data_7206 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7206 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for Human RNase 7 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-07-04 _Entry.Accession_date 2006-07-05 _Entry.Last_release_date . _Entry.Original_release_date . _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 Yu-Chie Huang . . . 7206 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7206 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 522 7206 '15N chemical shifts' 118 7206 '1H chemical shifts' 849 7206 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 2 . . 2008-07-16 2006-07-04 update BMRB 'complete entry citation' 7206 1 . . 2006-08-14 2006-07-04 original author 'original release' 7206 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 7206 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 17150966 _Citation.Full_citation . _Citation.Title ; The flexible and clustered lysine residues of human ribonuclease 7 are critical for membrane permeability and antimicrobial activity ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biol. Chem.' _Citation.Journal_name_full . _Citation.Journal_volume 282 _Citation.Journal_issue 7 _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 4626 _Citation.Page_last 4633 _Citation.Year 2007 _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 Yu-Chie Huang . . . 7206 1 2 Yu-Min Lin . . . 7206 1 3 Tin-Wei Chang . . . 7206 1 4 Shi-Jung Wu . . . 7206 1 5 Yan-Shin Lee . . . 7206 1 6 Hui-Ming Yu . . . 7206 1 7 Dah-Tsyr Chang . . . 7206 1 8 Chinpan Chen . . . 7206 1 9 Shih-Hsiung Wu . . . 7206 1 10 You-Di Liao . . . 7206 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7206 _Assembly.ID 1 _Assembly.Name 'human RNase 7' _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 yes _Assembly.Thiol_state 'all disulfide bound' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'human RNase 7' 1 $human_RNase_7 . . no native no no . . . 7206 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide SING . 1 . 1 CYS 56 56 SG . 1 . 1 CYS 107 107 SG . . . . . . . . . . 7206 1 2 disulfide SING . 1 . 1 CYS 38 38 SG . 1 . 1 CYS 92 92 SG . . . . . . . . . . 7206 1 3 disulfide SING . 1 . 1 CYS 63 63 SG . 1 . 1 CYS 70 70 SG . . . . . . . . . . 7206 1 4 disulfide SING . 1 . 1 CYS 24 24 SG . 1 . 1 CYS 82 82 SG . . . . . . . . . . 7206 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_human_RNase_7 _Entity.Sf_category entity _Entity.Sf_framecode human_RNase_7 _Entity.Entry_ID 7206 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'human RNase 7' _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 ; MKPKGMTSSQWFKIQHMQPS PQACNSAMKNINKHTKRCKD LNTFLHEPFSSVAATCQTPK IACKNGDKNCHQSHGPVSLT MCKLTSGKYPNCRYKEKRQN KSYVVACKPPQKKDSQQFHL VPVHLDRVL ; _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 yes _Entity.Nstd_chirality yes _Entity.Nstd_linkage yes _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 129 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic yes _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2HKY . "Nmr Solution Structure Of Human Rnase 7" . . . . . 100.00 129 100.00 100.00 1.11e-89 . . . . 7206 1 2 no DBJ BAF85386 . "unnamed protein product [Homo sapiens]" . . . . . 99.22 156 99.22 100.00 1.96e-88 . . . . 7206 1 3 no EMBL CAC20410 . "ribonuclease 7 [Homo sapiens]" . . . . . 99.22 156 100.00 100.00 8.63e-89 . . . . 7206 1 4 no EMBL CAC84457 . "ribonuclease 7 [Homo sapiens]" . . . . . 99.22 156 100.00 100.00 8.63e-89 . . . . 7206 1 5 no EMBL CAC84458 . "ribonuclease 7 [Homo sapiens]" . . . . . 99.22 156 100.00 100.00 8.63e-89 . . . . 7206 1 6 no EMBL CAC84462 . "ribonuclease 7 [Homo sapiens]" . . . . . 99.22 156 100.00 100.00 8.63e-89 . . . . 7206 1 7 no GB AAH74960 . "Ribonuclease, RNase A family, 7 [Homo sapiens]" . . . . . 99.22 156 100.00 100.00 8.63e-89 . . . . 7206 1 8 no GB AAI12335 . "Ribonuclease 7 [Homo sapiens]" . . . . . 99.22 156 100.00 100.00 8.63e-89 . . . . 7206 1 9 no GB AAO12510 . "ribonuclease 7 [Homo sapiens]" . . . . . 99.22 156 100.00 100.00 8.63e-89 . . . . 7206 1 10 no GB AAQ89455 . "RNASE7 [Homo sapiens]" . . . . . 99.22 156 100.00 100.00 8.63e-89 . . . . 7206 1 11 no GB AIC57364 . "RNASE7, partial [synthetic construct]" . . . . . 99.22 156 100.00 100.00 8.63e-89 . . . . 7206 1 12 no REF NP_115961 . "ribonuclease 7 precursor [Homo sapiens]" . . . . . 99.22 156 99.22 99.22 6.94e-88 . . . . 7206 1 13 no REF XP_003314288 . "PREDICTED: ribonuclease 7 [Pan troglodytes]" . . . . . 99.22 156 99.22 100.00 4.34e-88 . . . . 7206 1 14 no REF XP_003804787 . "PREDICTED: ribonuclease 7 [Pan paniscus]" . . . . . 99.22 156 99.22 100.00 4.34e-88 . . . . 7206 1 15 no REF XP_004054925 . "PREDICTED: ribonuclease 7 [Gorilla gorilla gorilla]" . . . . . 99.22 156 99.22 100.00 4.34e-88 . . . . 7206 1 16 no SP Q9H1E1 . "RecName: Full=Ribonuclease 7; Short=RNase 7; AltName: Full=Skin-derived antimicrobial protein 2; Short=SAP-2; Flags: Precursor " . . . . . 99.22 156 98.44 99.22 7.42e-87 . . . . 7206 1 17 no TPE CDG31915 . "TPA: ribonuclease A E1 [Homo sapiens]" . . . . . 99.22 156 100.00 100.00 8.63e-89 . . . . 7206 1 18 no TPE CDG31930 . "TPA: ribonuclease A E1 [Pan troglodytes]" . . . . . 99.22 156 99.22 100.00 4.34e-88 . . . . 7206 1 19 no TPE CDG31937 . "TPA: ribonuclease A E1 [Gorilla gorilla]" . . . . . 99.22 156 99.22 100.00 4.34e-88 . . . . 7206 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 . MET . 7206 1 2 . LYS . 7206 1 3 . PRO . 7206 1 4 . LYS . 7206 1 5 . GLY . 7206 1 6 . MET . 7206 1 7 . THR . 7206 1 8 . SER . 7206 1 9 . SER . 7206 1 10 . GLN . 7206 1 11 . TRP . 7206 1 12 . PHE . 7206 1 13 . LYS . 7206 1 14 . ILE . 7206 1 15 . GLN . 7206 1 16 . HIS . 7206 1 17 . MET . 7206 1 18 . GLN . 7206 1 19 . PRO . 7206 1 20 . SER . 7206 1 21 . PRO . 7206 1 22 . GLN . 7206 1 23 . ALA . 7206 1 24 . CYS . 7206 1 25 . ASN . 7206 1 26 . SER . 7206 1 27 . ALA . 7206 1 28 . MET . 7206 1 29 . LYS . 7206 1 30 . ASN . 7206 1 31 . ILE . 7206 1 32 . ASN . 7206 1 33 . LYS . 7206 1 34 . HIS . 7206 1 35 . THR . 7206 1 36 . LYS . 7206 1 37 . ARG . 7206 1 38 . CYS . 7206 1 39 . LYS . 7206 1 40 . ASP . 7206 1 41 . LEU . 7206 1 42 . ASN . 7206 1 43 . THR . 7206 1 44 . PHE . 7206 1 45 . LEU . 7206 1 46 . HIS . 7206 1 47 . GLU . 7206 1 48 . PRO . 7206 1 49 . PHE . 7206 1 50 . SER . 7206 1 51 . SER . 7206 1 52 . VAL . 7206 1 53 . ALA . 7206 1 54 . ALA . 7206 1 55 . THR . 7206 1 56 . CYS . 7206 1 57 . GLN . 7206 1 58 . THR . 7206 1 59 . PRO . 7206 1 60 . LYS . 7206 1 61 . ILE . 7206 1 62 . ALA . 7206 1 63 . CYS . 7206 1 64 . LYS . 7206 1 65 . ASN . 7206 1 66 . GLY . 7206 1 67 . ASP . 7206 1 68 . LYS . 7206 1 69 . ASN . 7206 1 70 . CYS . 7206 1 71 . HIS . 7206 1 72 . GLN . 7206 1 73 . SER . 7206 1 74 . HIS . 7206 1 75 . GLY . 7206 1 76 . PRO . 7206 1 77 . VAL . 7206 1 78 . SER . 7206 1 79 . LEU . 7206 1 80 . THR . 7206 1 81 . MET . 7206 1 82 . CYS . 7206 1 83 . LYS . 7206 1 84 . LEU . 7206 1 85 . THR . 7206 1 86 . SER . 7206 1 87 . GLY . 7206 1 88 . LYS . 7206 1 89 . TYR . 7206 1 90 . PRO . 7206 1 91 . ASN . 7206 1 92 . CYS . 7206 1 93 . ARG . 7206 1 94 . TYR . 7206 1 95 . LYS . 7206 1 96 . GLU . 7206 1 97 . LYS . 7206 1 98 . ARG . 7206 1 99 . GLN . 7206 1 100 . ASN . 7206 1 101 . LYS . 7206 1 102 . SER . 7206 1 103 . TYR . 7206 1 104 . VAL . 7206 1 105 . VAL . 7206 1 106 . ALA . 7206 1 107 . CYS . 7206 1 108 . LYS . 7206 1 109 . PRO . 7206 1 110 . PRO . 7206 1 111 . GLN . 7206 1 112 . LYS . 7206 1 113 . LYS . 7206 1 114 . ASP . 7206 1 115 . SER . 7206 1 116 . GLN . 7206 1 117 . GLN . 7206 1 118 . PHE . 7206 1 119 . HIS . 7206 1 120 . LEU . 7206 1 121 . VAL . 7206 1 122 . PRO . 7206 1 123 . VAL . 7206 1 124 . HIS . 7206 1 125 . LEU . 7206 1 126 . ASP . 7206 1 127 . ARG . 7206 1 128 . VAL . 7206 1 129 . LEU . 7206 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 7206 1 . LYS 2 2 7206 1 . PRO 3 3 7206 1 . LYS 4 4 7206 1 . GLY 5 5 7206 1 . MET 6 6 7206 1 . THR 7 7 7206 1 . SER 8 8 7206 1 . SER 9 9 7206 1 . GLN 10 10 7206 1 . TRP 11 11 7206 1 . PHE 12 12 7206 1 . LYS 13 13 7206 1 . ILE 14 14 7206 1 . GLN 15 15 7206 1 . HIS 16 16 7206 1 . MET 17 17 7206 1 . GLN 18 18 7206 1 . PRO 19 19 7206 1 . SER 20 20 7206 1 . PRO 21 21 7206 1 . GLN 22 22 7206 1 . ALA 23 23 7206 1 . CYS 24 24 7206 1 . ASN 25 25 7206 1 . SER 26 26 7206 1 . ALA 27 27 7206 1 . MET 28 28 7206 1 . LYS 29 29 7206 1 . ASN 30 30 7206 1 . ILE 31 31 7206 1 . ASN 32 32 7206 1 . LYS 33 33 7206 1 . HIS 34 34 7206 1 . THR 35 35 7206 1 . LYS 36 36 7206 1 . ARG 37 37 7206 1 . CYS 38 38 7206 1 . LYS 39 39 7206 1 . ASP 40 40 7206 1 . LEU 41 41 7206 1 . ASN 42 42 7206 1 . THR 43 43 7206 1 . PHE 44 44 7206 1 . LEU 45 45 7206 1 . HIS 46 46 7206 1 . GLU 47 47 7206 1 . PRO 48 48 7206 1 . PHE 49 49 7206 1 . SER 50 50 7206 1 . SER 51 51 7206 1 . VAL 52 52 7206 1 . ALA 53 53 7206 1 . ALA 54 54 7206 1 . THR 55 55 7206 1 . CYS 56 56 7206 1 . GLN 57 57 7206 1 . THR 58 58 7206 1 . PRO 59 59 7206 1 . LYS 60 60 7206 1 . ILE 61 61 7206 1 . ALA 62 62 7206 1 . CYS 63 63 7206 1 . LYS 64 64 7206 1 . ASN 65 65 7206 1 . GLY 66 66 7206 1 . ASP 67 67 7206 1 . LYS 68 68 7206 1 . ASN 69 69 7206 1 . CYS 70 70 7206 1 . HIS 71 71 7206 1 . GLN 72 72 7206 1 . SER 73 73 7206 1 . HIS 74 74 7206 1 . GLY 75 75 7206 1 . PRO 76 76 7206 1 . VAL 77 77 7206 1 . SER 78 78 7206 1 . LEU 79 79 7206 1 . THR 80 80 7206 1 . MET 81 81 7206 1 . CYS 82 82 7206 1 . LYS 83 83 7206 1 . LEU 84 84 7206 1 . THR 85 85 7206 1 . SER 86 86 7206 1 . GLY 87 87 7206 1 . LYS 88 88 7206 1 . TYR 89 89 7206 1 . PRO 90 90 7206 1 . ASN 91 91 7206 1 . CYS 92 92 7206 1 . ARG 93 93 7206 1 . TYR 94 94 7206 1 . LYS 95 95 7206 1 . GLU 96 96 7206 1 . LYS 97 97 7206 1 . ARG 98 98 7206 1 . GLN 99 99 7206 1 . ASN 100 100 7206 1 . LYS 101 101 7206 1 . SER 102 102 7206 1 . TYR 103 103 7206 1 . VAL 104 104 7206 1 . VAL 105 105 7206 1 . ALA 106 106 7206 1 . CYS 107 107 7206 1 . LYS 108 108 7206 1 . PRO 109 109 7206 1 . PRO 110 110 7206 1 . GLN 111 111 7206 1 . LYS 112 112 7206 1 . LYS 113 113 7206 1 . ASP 114 114 7206 1 . SER 115 115 7206 1 . GLN 116 116 7206 1 . GLN 117 117 7206 1 . PHE 118 118 7206 1 . HIS 119 119 7206 1 . LEU 120 120 7206 1 . VAL 121 121 7206 1 . PRO 122 122 7206 1 . VAL 123 123 7206 1 . HIS 124 124 7206 1 . LEU 125 125 7206 1 . ASP 126 126 7206 1 . ARG 127 127 7206 1 . VAL 128 128 7206 1 . LEU 129 129 7206 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 7206 _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 $human_RNase_7 . 9606 . no . Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 7206 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 7206 _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 $human_RNase_7 . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7206 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 7206 _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 'human RNase 7' '[U-95% 13C; U-90% 15N]' . . 1 $human_RNase_7 . . 0.6 . . mM . . . . 7206 1 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 7206 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 3.5 0.01 pH 7206 1 temperature 310 0.1 K 7206 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600 _NMR_spectrometer.Entry_ID 7206 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer BRUKER _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_800 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 800 _NMR_spectrometer.Entry_ID 7206 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer BRUKER _NMR_spectrometer.Model AVANCE _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 7206 _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 '2D TOCSY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 2 '2D NOESY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 3 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 4 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 5 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 6 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 7 '3D HNCO' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 8 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 9 '3D 15N NOESY-HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 10 '3D 15N TOCSY-HSQC' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 11 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 12 '3D HC(CO)NH' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 13 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7206 1 stop_ save_ save_2D_TOCSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 2D_TOCSY _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '2D TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_2D_NOESY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 2D_NOESY _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '2D 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 . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_2D_1H-13C_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 2D_1H-13C_HSQC _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name '2D 1H-13C HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_2D_1H-15N_HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 2D_1H-15N_HSQC _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name '2D 1H-15N HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_HNCACB _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_HNCACB _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name '3D HNCACB' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_CBCA(CO)NH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_CBCA(CO)NH _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name '3D CBCA(CO)NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_HNCO _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_HNCO _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name '3D HNCO' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_HN(CA)CO _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_HN(CA)CO _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name '3D HN(CA)CO' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_15N_NOESY-HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_15N_NOESY-HSQC _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name '3D 15N NOESY-HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_15N_TOCSY-HSQC _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_15N_TOCSY-HSQC _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name '3D 15N TOCSY-HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_C(CO)NH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_C(CO)NH _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name '3D C(CO)NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_HC(CO)NH _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_HC(CO)NH _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 12 _NMR_spec_expt.Name '3D HC(CO)NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_3D_HCCH-TOCSY _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode 3D_HCCH-TOCSY _NMR_spec_expt.Entry_ID 7206 _NMR_spec_expt.ID 13 _NMR_spec_expt.Name '3D HCCH-TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 7206 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 7206 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1.0 . . . . . . . . . 7206 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 7206 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7206 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err . _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 $sample_1 isotropic 7206 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 MET HA H 1 4.233 0.02 . 1 . . . . 1 MET HA . 7206 1 2 . 1 1 1 1 MET HB2 H 1 2.216 0.02 . 1 . . . . 1 MET HB2 . 7206 1 3 . 1 1 1 1 MET HB3 H 1 2.216 0.02 . 1 . . . . 1 MET HB3 . 7206 1 4 . 1 1 1 1 MET C C 13 171.381 0.2 . 1 . . . . 1 MET C . 7206 1 5 . 1 1 1 1 MET CA C 13 54.911 0.2 . 1 . . . . 1 MET CA . 7206 1 6 . 1 1 1 1 MET CB C 13 30.487 0.2 . 1 . . . . 1 MET CB . 7206 1 7 . 1 1 1 1 MET CG C 13 32.059 0.2 . 1 . . . . 1 MET CG . 7206 1 8 . 1 1 2 2 LYS H H 1 8.469 0.02 . 1 . . . . 2 LYS H . 7206 1 9 . 1 1 2 2 LYS HA H 1 3.797 0.02 . 1 . . . . 2 LYS HA . 7206 1 10 . 1 1 2 2 LYS HB2 H 1 1.828 0.02 . 1 . . . . 2 LYS HB2 . 7206 1 11 . 1 1 2 2 LYS HB3 H 1 1.828 0.02 . 1 . . . . 2 LYS HB3 . 7206 1 12 . 1 1 2 2 LYS HD2 H 1 1.509 0.02 . 1 . . . . 2 LYS HD2 . 7206 1 13 . 1 1 2 2 LYS HD3 H 1 1.658 0.02 . 1 . . . . 2 LYS HD3 . 7206 1 14 . 1 1 2 2 LYS C C 13 173.258 0.2 . 1 . . . . 2 LYS C . 7206 1 15 . 1 1 2 2 LYS CD C 13 31.835 0.2 . 1 . . . . 2 LYS CD . 7206 1 16 . 1 1 2 2 LYS N N 15 125.478 0.1 . 1 . . . . 2 LYS N . 7206 1 17 . 1 1 3 3 PRO HA H 1 4.202 0.02 . 1 . . . . 3 PRO HA . 7206 1 18 . 1 1 3 3 PRO HB2 H 1 2.168 0.02 . 1 . . . . 3 PRO HB2 . 7206 1 19 . 1 1 3 3 PRO HB3 H 1 1.523 0.02 . 1 . . . . 3 PRO HB3 . 7206 1 20 . 1 1 3 3 PRO HG2 H 1 1.026 0.02 . 1 . . . . 3 PRO HG2 . 7206 1 21 . 1 1 3 3 PRO HG3 H 1 1.026 0.02 . 1 . . . . 3 PRO HG3 . 7206 1 22 . 1 1 3 3 PRO C C 13 176.303 0.2 . 1 . . . . 3 PRO C . 7206 1 23 . 1 1 3 3 PRO CA C 13 62.62 0.2 . 1 . . . . 3 PRO CA . 7206 1 24 . 1 1 3 3 PRO CB C 13 31.727 0.2 . 1 . . . . 3 PRO CB . 7206 1 25 . 1 1 3 3 PRO CG C 13 27.329 0.2 . 1 . . . . 3 PRO CG . 7206 1 26 . 1 1 3 3 PRO CD C 13 50.071 0.2 . 1 . . . . 3 PRO CD . 7206 1 27 . 1 1 4 4 LYS H H 1 8.331 0.02 . 1 . . . . 4 LYS H . 7206 1 28 . 1 1 4 4 LYS HA H 1 4.118 0.02 . 1 . . . . 4 LYS HA . 7206 1 29 . 1 1 4 4 LYS HB2 H 1 1.811 0.02 . 1 . . . . 4 LYS HB2 . 7206 1 30 . 1 1 4 4 LYS HB3 H 1 1.811 0.02 . 1 . . . . 4 LYS HB3 . 7206 1 31 . 1 1 4 4 LYS HG2 H 1 1.528 0.02 . 1 . . . . 4 LYS HG2 . 7206 1 32 . 1 1 4 4 LYS HG3 H 1 1.528 0.02 . 1 . . . . 4 LYS HG3 . 7206 1 33 . 1 1 4 4 LYS HD2 H 1 1.74 0.02 . 1 . . . . 4 LYS HD2 . 7206 1 34 . 1 1 4 4 LYS HD3 H 1 1.74 0.02 . 1 . . . . 4 LYS HD3 . 7206 1 35 . 1 1 4 4 LYS HE2 H 1 3.064 0.02 . 1 . . . . 4 LYS HE2 . 7206 1 36 . 1 1 4 4 LYS HE3 H 1 3.064 0.02 . 1 . . . . 4 LYS HE3 . 7206 1 37 . 1 1 4 4 LYS C C 13 177.903 0.2 . 1 . . . . 4 LYS C . 7206 1 38 . 1 1 4 4 LYS CA C 13 57.626 0.2 . 1 . . . . 4 LYS CA . 7206 1 39 . 1 1 4 4 LYS CB C 13 32.375 0.2 . 1 . . . . 4 LYS CB . 7206 1 40 . 1 1 4 4 LYS CG C 13 24.743 0.2 . 1 . . . . 4 LYS CG . 7206 1 41 . 1 1 4 4 LYS CD C 13 29.062 0.2 . 1 . . . . 4 LYS CD . 7206 1 42 . 1 1 4 4 LYS CE C 13 42.039 0.2 . 1 . . . . 4 LYS CE . 7206 1 43 . 1 1 4 4 LYS N N 15 123.132 0.1 . 1 . . . . 4 LYS N . 7206 1 44 . 1 1 5 5 GLY H H 1 8.699 0.02 . 1 . . . . 5 GLY H . 7206 1 45 . 1 1 5 5 GLY HA2 H 1 4.121 0.02 . 1 . . . . 5 GLY HA2 . 7206 1 46 . 1 1 5 5 GLY HA3 H 1 3.823 0.02 . 1 . . . . 5 GLY HA3 . 7206 1 47 . 1 1 5 5 GLY C C 13 173.713 0.2 . 1 . . . . 5 GLY C . 7206 1 48 . 1 1 5 5 GLY CA C 13 45.314 0.2 . 1 . . . . 5 GLY CA . 7206 1 49 . 1 1 5 5 GLY N N 15 110.828 0.1 . 1 . . . . 5 GLY N . 7206 1 50 . 1 1 6 6 MET H H 1 7.428 0.02 . 1 . . . . 6 MET H . 7206 1 51 . 1 1 6 6 MET HA H 1 4.863 0.02 . 1 . . . . 6 MET HA . 7206 1 52 . 1 1 6 6 MET HB2 H 1 1.99 0.02 . 1 . . . . 6 MET HB2 . 7206 1 53 . 1 1 6 6 MET HB3 H 1 1.911 0.02 . 1 . . . . 6 MET HB3 . 7206 1 54 . 1 1 6 6 MET HG2 H 1 2.426 0.02 . 1 . . . . 6 MET HG2 . 7206 1 55 . 1 1 6 6 MET HG3 H 1 2.624 0.02 . 1 . . . . 6 MET HG3 . 7206 1 56 . 1 1 6 6 MET C C 13 176.274 0.2 . 1 . . . . 6 MET C . 7206 1 57 . 1 1 6 6 MET CA C 13 56.73 0.2 . 1 . . . . 6 MET CA . 7206 1 58 . 1 1 6 6 MET CB C 13 35.44 0.2 . 1 . . . . 6 MET CB . 7206 1 59 . 1 1 6 6 MET CG C 13 32.116 0.2 . 1 . . . . 6 MET CG . 7206 1 60 . 1 1 6 6 MET N N 15 118.383 0.1 . 1 . . . . 6 MET N . 7206 1 61 . 1 1 7 7 THR H H 1 8.604 0.02 . 1 . . . . 7 THR H . 7206 1 62 . 1 1 7 7 THR HA H 1 4.685 0.02 . 1 . . . . 7 THR HA . 7206 1 63 . 1 1 7 7 THR HB H 1 4.942 0.02 . 1 . . . . 7 THR HB . 7206 1 64 . 1 1 7 7 THR HG21 H 1 1.266 0.02 . 1 . . . . 7 THR HG2 . 7206 1 65 . 1 1 7 7 THR HG22 H 1 1.266 0.02 . 1 . . . . 7 THR HG2 . 7206 1 66 . 1 1 7 7 THR HG23 H 1 1.266 0.02 . 1 . . . . 7 THR HG2 . 7206 1 67 . 1 1 7 7 THR C C 13 176.164 0.2 . 1 . . . . 7 THR C . 7206 1 68 . 1 1 7 7 THR CA C 13 60.785 0.2 . 1 . . . . 7 THR CA . 7206 1 69 . 1 1 7 7 THR CB C 13 69.729 0.2 . 1 . . . . 7 THR CB . 7206 1 70 . 1 1 7 7 THR CG2 C 13 22.054 0.2 . 1 . . . . 7 THR CG2 . 7206 1 71 . 1 1 7 7 THR N N 15 113.851 0.1 . 1 . . . . 7 THR N . 7206 1 72 . 1 1 8 8 SER H H 1 9.03 0.02 . 1 . . . . 8 SER H . 7206 1 73 . 1 1 8 8 SER HB2 H 1 4.131 0.02 . 1 . . . . 8 SER HB2 . 7206 1 74 . 1 1 8 8 SER HB3 H 1 4.031 0.02 . 1 . . . . 8 SER HB3 . 7206 1 75 . 1 1 8 8 SER HG H 1 5.283 0.02 . 1 . . . . 8 SER HG . 7206 1 76 . 1 1 8 8 SER C C 13 177.6 0.2 . 1 . . . . 8 SER C . 7206 1 77 . 1 1 8 8 SER CA C 13 62.527 0.2 . 1 . . . . 8 SER CA . 7206 1 78 . 1 1 8 8 SER CB C 13 62.527 0.2 . 1 . . . . 8 SER CB . 7206 1 79 . 1 1 8 8 SER N N 15 117.946 0.1 . 1 . . . . 8 SER N . 7206 1 80 . 1 1 9 9 SER H H 1 9.782 0.02 . 1 . . . . 9 SER H . 7206 1 81 . 1 1 9 9 SER HA H 1 4.688 0.02 . 1 . . . . 9 SER HA . 7206 1 82 . 1 1 9 9 SER HB2 H 1 4.065 0.02 . 1 . . . . 9 SER HB2 . 7206 1 83 . 1 1 9 9 SER HB3 H 1 4.065 0.02 . 1 . . . . 9 SER HB3 . 7206 1 84 . 1 1 9 9 SER C C 13 177.422 0.2 . 1 . . . . 9 SER C . 7206 1 85 . 1 1 9 9 SER CA C 13 60.893 0.2 . 1 . . . . 9 SER CA . 7206 1 86 . 1 1 9 9 SER CB C 13 63.085 0.2 . 1 . . . . 9 SER CB . 7206 1 87 . 1 1 9 9 SER N N 15 119.339 0.1 . 1 . . . . 9 SER N . 7206 1 88 . 1 1 10 10 GLN H H 1 8.212 0.02 . 1 . . . . 10 GLN H . 7206 1 89 . 1 1 10 10 GLN HA H 1 4.148 0.02 . 1 . . . . 10 GLN HA . 7206 1 90 . 1 1 10 10 GLN HB2 H 1 2.455 0.02 . 1 . . . . 10 GLN HB2 . 7206 1 91 . 1 1 10 10 GLN HB3 H 1 2.215 0.02 . 1 . . . . 10 GLN HB3 . 7206 1 92 . 1 1 10 10 GLN HG2 H 1 2.632 0.02 . 1 . . . . 10 GLN HG2 . 7206 1 93 . 1 1 10 10 GLN HG3 H 1 2.686 0.02 . 1 . . . . 10 GLN HG3 . 7206 1 94 . 1 1 10 10 GLN HE21 H 1 6.735 0.02 . 1 . . . . 10 GLN HE21 . 7206 1 95 . 1 1 10 10 GLN HE22 H 1 7.393 0.02 . 1 . . . . 10 GLN HE22 . 7206 1 96 . 1 1 10 10 GLN C C 13 178.759 0.2 . 1 . . . . 10 GLN C . 7206 1 97 . 1 1 10 10 GLN CA C 13 59.252 0.2 . 1 . . . . 10 GLN CA . 7206 1 98 . 1 1 10 10 GLN CB C 13 28.445 0.2 . 1 . . . . 10 GLN CB . 7206 1 99 . 1 1 10 10 GLN CG C 13 33.837 0.2 . 1 . . . . 10 GLN CG . 7206 1 100 . 1 1 10 10 GLN N N 15 123.196 0.1 . 1 . . . . 10 GLN N . 7206 1 101 . 1 1 11 11 TRP H H 1 8.413 0.02 . 1 . . . . 11 TRP H . 7206 1 102 . 1 1 11 11 TRP HA H 1 5.16 0.02 . 1 . . . . 11 TRP HA . 7206 1 103 . 1 1 11 11 TRP HB2 H 1 3.481 0.02 . 1 . . . . 11 TRP HB2 . 7206 1 104 . 1 1 11 11 TRP HB3 H 1 3.314 0.02 . 1 . . . . 11 TRP HB3 . 7206 1 105 . 1 1 11 11 TRP HD1 H 1 7.512 0.02 . 1 . . . . 11 TRP HD1 . 7206 1 106 . 1 1 11 11 TRP HE3 H 1 7.579 0.02 . 1 . . . . 11 TRP HE3 . 7206 1 107 . 1 1 11 11 TRP HZ2 H 1 7.37 0.02 . 1 . . . . 11 TRP HZ2 . 7206 1 108 . 1 1 11 11 TRP HZ3 H 1 6.635 0.02 . 1 . . . . 11 TRP HZ3 . 7206 1 109 . 1 1 11 11 TRP HH2 H 1 7.211 0.02 . 1 . . . . 11 TRP HH2 . 7206 1 110 . 1 1 11 11 TRP C C 13 177.722 0.2 . 1 . . . . 11 TRP C . 7206 1 111 . 1 1 11 11 TRP CA C 13 58.055 0.2 . 1 . . . . 11 TRP CA . 7206 1 112 . 1 1 11 11 TRP CB C 13 31.486 0.2 . 1 . . . . 11 TRP CB . 7206 1 113 . 1 1 11 11 TRP N N 15 120.513 0.1 . 1 . . . . 11 TRP N . 7206 1 114 . 1 1 12 12 PHE H H 1 8.465 0.02 . 1 . . . . 12 PHE H . 7206 1 115 . 1 1 12 12 PHE HA H 1 4.17 0.02 . 1 . . . . 12 PHE HA . 7206 1 116 . 1 1 12 12 PHE HB2 H 1 3.587 0.02 . 1 . . . . 12 PHE HB2 . 7206 1 117 . 1 1 12 12 PHE HB3 H 1 3.138 0.02 . 1 . . . . 12 PHE HB3 . 7206 1 118 . 1 1 12 12 PHE HD1 H 1 7.103 0.02 . 1 . . . . 12 PHE HD1 . 7206 1 119 . 1 1 12 12 PHE HD2 H 1 7.103 0.02 . 1 . . . . 12 PHE HD2 . 7206 1 120 . 1 1 12 12 PHE HE1 H 1 7.036 0.02 . 1 . . . . 12 PHE HE1 . 7206 1 121 . 1 1 12 12 PHE HE2 H 1 7.036 0.02 . 1 . . . . 12 PHE HE2 . 7206 1 122 . 1 1 12 12 PHE C C 13 177.306 0.2 . 1 . . . . 12 PHE C . 7206 1 123 . 1 1 12 12 PHE CA C 13 61.846 0.2 . 1 . . . . 12 PHE CA . 7206 1 124 . 1 1 12 12 PHE CB C 13 38.85 0.2 . 1 . . . . 12 PHE CB . 7206 1 125 . 1 1 12 12 PHE N N 15 120.529 0.1 . 1 . . . . 12 PHE N . 7206 1 126 . 1 1 13 13 LYS H H 1 8.21 0.02 . 1 . . . . 13 LYS H . 7206 1 127 . 1 1 13 13 LYS HA H 1 3.821 0.02 . 1 . . . . 13 LYS HA . 7206 1 128 . 1 1 13 13 LYS HB2 H 1 2.113 0.02 . 1 . . . . 13 LYS HB2 . 7206 1 129 . 1 1 13 13 LYS HB3 H 1 2.047 0.02 . 1 . . . . 13 LYS HB3 . 7206 1 130 . 1 1 13 13 LYS HG2 H 1 1.284 0.02 . 1 . . . . 13 LYS HG2 . 7206 1 131 . 1 1 13 13 LYS HG3 H 1 1.784 0.02 . 1 . . . . 13 LYS HG3 . 7206 1 132 . 1 1 13 13 LYS HD2 H 1 1.392 0.02 . 1 . . . . 13 LYS HD2 . 7206 1 133 . 1 1 13 13 LYS HD3 H 1 1.392 0.02 . 1 . . . . 13 LYS HD3 . 7206 1 134 . 1 1 13 13 LYS C C 13 179.206 0.2 . 1 . . . . 13 LYS C . 7206 1 135 . 1 1 13 13 LYS CA C 13 60.585 0.2 . 1 . . . . 13 LYS CA . 7206 1 136 . 1 1 13 13 LYS CB C 13 32.337 0.2 . 1 . . . . 13 LYS CB . 7206 1 137 . 1 1 13 13 LYS CG C 13 26.298 0.2 . 1 . . . . 13 LYS CG . 7206 1 138 . 1 1 13 13 LYS CD C 13 29.525 0.2 . 1 . . . . 13 LYS CD . 7206 1 139 . 1 1 13 13 LYS CE C 13 41.287 0.2 . 1 . . . . 13 LYS CE . 7206 1 140 . 1 1 13 13 LYS N N 15 119.75 0.1 . 1 . . . . 13 LYS N . 7206 1 141 . 1 1 14 14 ILE H H 1 8.037 0.02 . 1 . . . . 14 ILE H . 7206 1 142 . 1 1 14 14 ILE HA H 1 3.724 0.02 . 1 . . . . 14 ILE HA . 7206 1 143 . 1 1 14 14 ILE HB H 1 1.917 0.02 . 1 . . . . 14 ILE HB . 7206 1 144 . 1 1 14 14 ILE HG12 H 1 1.883 0.02 . 1 . . . . 14 ILE HG12 . 7206 1 145 . 1 1 14 14 ILE HG13 H 1 1.39 0.02 . 1 . . . . 14 ILE HG13 . 7206 1 146 . 1 1 14 14 ILE HG21 H 1 0.898 0.02 . 1 . . . . 14 ILE HG2 . 7206 1 147 . 1 1 14 14 ILE HG22 H 1 0.898 0.02 . 1 . . . . 14 ILE HG2 . 7206 1 148 . 1 1 14 14 ILE HG23 H 1 0.898 0.02 . 1 . . . . 14 ILE HG2 . 7206 1 149 . 1 1 14 14 ILE HD11 H 1 1.113 0.02 . 1 . . . . 14 ILE HD1 . 7206 1 150 . 1 1 14 14 ILE HD12 H 1 1.113 0.02 . 1 . . . . 14 ILE HD1 . 7206 1 151 . 1 1 14 14 ILE HD13 H 1 1.113 0.02 . 1 . . . . 14 ILE HD1 . 7206 1 152 . 1 1 14 14 ILE C C 13 178.063 0.2 . 1 . . . . 14 ILE C . 7206 1 153 . 1 1 14 14 ILE CA C 13 64.363 0.2 . 1 . . . . 14 ILE CA . 7206 1 154 . 1 1 14 14 ILE CB C 13 38.184 0.2 . 1 . . . . 14 ILE CB . 7206 1 155 . 1 1 14 14 ILE CG1 C 13 29.446 0.2 . 1 . . . . 14 ILE CG1 . 7206 1 156 . 1 1 14 14 ILE CG2 C 13 17.391 0.2 . 1 . . . . 14 ILE CG2 . 7206 1 157 . 1 1 14 14 ILE CD1 C 13 13.484 0.2 . 1 . . . . 14 ILE CD1 . 7206 1 158 . 1 1 14 14 ILE N N 15 119.33 0.1 . 1 . . . . 14 ILE N . 7206 1 159 . 1 1 15 15 GLN H H 1 7.706 0.02 . 1 . . . . 15 GLN H . 7206 1 160 . 1 1 15 15 GLN HA H 1 3.52 0.02 . 1 . . . . 15 GLN HA . 7206 1 161 . 1 1 15 15 GLN HB2 H 1 0.744 0.02 . 1 . . . . 15 GLN HB2 . 7206 1 162 . 1 1 15 15 GLN HB3 H 1 0.58 0.02 . 1 . . . . 15 GLN HB3 . 7206 1 163 . 1 1 15 15 GLN HG2 H 1 0.957 0.02 . 1 . . . . 15 GLN HG2 . 7206 1 164 . 1 1 15 15 GLN HG3 H 1 0.582 0.02 . 1 . . . . 15 GLN HG3 . 7206 1 165 . 1 1 15 15 GLN HE21 H 1 5.708 0.02 . 1 . . . . 15 GLN HE21 . 7206 1 166 . 1 1 15 15 GLN HE22 H 1 7.452 0.02 . 1 . . . . 15 GLN HE22 . 7206 1 167 . 1 1 15 15 GLN C C 13 175.878 0.2 . 1 . . . . 15 GLN C . 7206 1 168 . 1 1 15 15 GLN CA C 13 58.289 0.2 . 1 . . . . 15 GLN CA . 7206 1 169 . 1 1 15 15 GLN CB C 13 30.939 0.2 . 1 . . . . 15 GLN CB . 7206 1 170 . 1 1 15 15 GLN CG C 13 34.943 0.2 . 1 . . . . 15 GLN CG . 7206 1 171 . 1 1 15 15 GLN N N 15 112.486 0.1 . 1 . . . . 15 GLN N . 7206 1 172 . 1 1 16 16 HIS H H 1 7.755 0.02 . 1 . . . . 16 HIS H . 7206 1 173 . 1 1 16 16 HIS HA H 1 5.268 0.02 . 1 . . . . 16 HIS HA . 7206 1 174 . 1 1 16 16 HIS HB2 H 1 2.624 0.02 . 1 . . . . 16 HIS HB2 . 7206 1 175 . 1 1 16 16 HIS HB3 H 1 1.814 0.02 . 1 . . . . 16 HIS HB3 . 7206 1 176 . 1 1 16 16 HIS HD2 H 1 6.444 0.02 . 1 . . . . 16 HIS HD2 . 7206 1 177 . 1 1 16 16 HIS HE1 H 1 8.74 0.02 . 1 . . . . 16 HIS HE1 . 7206 1 178 . 1 1 16 16 HIS C C 13 174.795 0.2 . 1 . . . . 16 HIS C . 7206 1 179 . 1 1 16 16 HIS CA C 13 54.449 0.2 . 1 . . . . 16 HIS CA . 7206 1 180 . 1 1 16 16 HIS CB C 13 30.291 0.2 . 1 . . . . 16 HIS CB . 7206 1 181 . 1 1 16 16 HIS N N 15 105.518 0.1 . 1 . . . . 16 HIS N . 7206 1 182 . 1 1 17 17 MET H H 1 8.374 0.02 . 1 . . . . 17 MET H . 7206 1 183 . 1 1 17 17 MET HA H 1 5.255 0.02 . 1 . . . . 17 MET HA . 7206 1 184 . 1 1 17 17 MET HB2 H 1 2.759 0.02 . 1 . . . . 17 MET HB2 . 7206 1 185 . 1 1 17 17 MET HB3 H 1 2.277 0.02 . 1 . . . . 17 MET HB3 . 7206 1 186 . 1 1 17 17 MET HG2 H 1 2.629 0.02 . 1 . . . . 17 MET HG2 . 7206 1 187 . 1 1 17 17 MET HG3 H 1 3.1 0.02 . 1 . . . . 17 MET HG3 . 7206 1 188 . 1 1 17 17 MET C C 13 175.916 0.2 . 1 . . . . 17 MET C . 7206 1 189 . 1 1 17 17 MET CA C 13 53.676 0.2 . 1 . . . . 17 MET CA . 7206 1 190 . 1 1 17 17 MET CB C 13 29.435 0.2 . 1 . . . . 17 MET CB . 7206 1 191 . 1 1 17 17 MET CG C 13 31.336 0.2 . 1 . . . . 17 MET CG . 7206 1 192 . 1 1 17 17 MET N N 15 118.203 0.1 . 1 . . . . 17 MET N . 7206 1 193 . 1 1 18 18 GLN H H 1 8.546 0.02 . 1 . . . . 18 GLN H . 7206 1 194 . 1 1 18 18 GLN HA H 1 4.85 0.02 . 1 . . . . 18 GLN HA . 7206 1 195 . 1 1 18 18 GLN HB2 H 1 1.666 0.02 . 1 . . . . 18 GLN HB2 . 7206 1 196 . 1 1 18 18 GLN HB3 H 1 1.949 0.02 . 1 . . . . 18 GLN HB3 . 7206 1 197 . 1 1 18 18 GLN HG2 H 1 2.193 0.02 . 1 . . . . 18 GLN HG2 . 7206 1 198 . 1 1 18 18 GLN HG3 H 1 2.193 0.02 . 1 . . . . 18 GLN HG3 . 7206 1 199 . 1 1 18 18 GLN HE21 H 1 5.094 0.02 . 1 . . . . 18 GLN HE21 . 7206 1 200 . 1 1 18 18 GLN HE22 H 1 7.009 0.02 . 1 . . . . 18 GLN HE22 . 7206 1 201 . 1 1 18 18 GLN C C 13 171.982 0.2 . 1 . . . . 18 GLN C . 7206 1 202 . 1 1 18 18 GLN CA C 13 53.438 0.2 . 1 . . . . 18 GLN CA . 7206 1 203 . 1 1 18 18 GLN CB C 13 32.977 0.2 . 1 . . . . 18 GLN CB . 7206 1 204 . 1 1 18 18 GLN CG C 13 35.222 0.2 . 1 . . . . 18 GLN CG . 7206 1 205 . 1 1 18 18 GLN N N 15 123.63 0.1 . 1 . . . . 18 GLN N . 7206 1 206 . 1 1 19 19 PRO HA H 1 4.141 0.02 . 1 . . . . 19 PRO HA . 7206 1 207 . 1 1 19 19 PRO HB2 H 1 2.26 0.02 . 1 . . . . 19 PRO HB2 . 7206 1 208 . 1 1 19 19 PRO HB3 H 1 2.061 0.02 . 1 . . . . 19 PRO HB3 . 7206 1 209 . 1 1 19 19 PRO HG2 H 1 2.216 0.02 . 1 . . . . 19 PRO HG2 . 7206 1 210 . 1 1 19 19 PRO HG3 H 1 2.216 0.02 . 1 . . . . 19 PRO HG3 . 7206 1 211 . 1 1 19 19 PRO HD2 H 1 3.924 0.02 . 1 . . . . 19 PRO HD2 . 7206 1 212 . 1 1 19 19 PRO HD3 H 1 3.64 0.02 . 1 . . . . 19 PRO HD3 . 7206 1 213 . 1 1 19 19 PRO C C 13 176.194 0.2 . 1 . . . . 19 PRO C . 7206 1 214 . 1 1 19 19 PRO CA C 13 66.439 0.2 . 1 . . . . 19 PRO CA . 7206 1 215 . 1 1 19 19 PRO CB C 13 31.758 0.2 . 1 . . . . 19 PRO CB . 7206 1 216 . 1 1 19 19 PRO CG C 13 27.267 0.2 . 1 . . . . 19 PRO CG . 7206 1 217 . 1 1 19 19 PRO CD C 13 50.33 0.2 . 1 . . . . 19 PRO CD . 7206 1 218 . 1 1 20 20 SER H H 1 7.628 0.02 . 1 . . . . 20 SER H . 7206 1 219 . 1 1 20 20 SER HA H 1 4.968 0.02 . 1 . . . . 20 SER HA . 7206 1 220 . 1 1 20 20 SER HB2 H 1 3.795 0.02 . 1 . . . . 20 SER HB2 . 7206 1 221 . 1 1 20 20 SER HB3 H 1 3.665 0.02 . 1 . . . . 20 SER HB3 . 7206 1 222 . 1 1 20 20 SER C C 13 172.224 0.2 . 1 . . . . 20 SER C . 7206 1 223 . 1 1 20 20 SER CA C 13 54.005 0.2 . 1 . . . . 20 SER CA . 7206 1 224 . 1 1 20 20 SER CB C 13 63.39 0.2 . 1 . . . . 20 SER CB . 7206 1 225 . 1 1 20 20 SER N N 15 110.997 0.1 . 1 . . . . 20 SER N . 7206 1 226 . 1 1 21 21 PRO HA H 1 3.972 0.02 . 1 . . . . 21 PRO HA . 7206 1 227 . 1 1 21 21 PRO HB2 H 1 1.612 0.02 . 1 . . . . 21 PRO HB2 . 7206 1 228 . 1 1 21 21 PRO HB3 H 1 1.672 0.02 . 1 . . . . 21 PRO HB3 . 7206 1 229 . 1 1 21 21 PRO HG2 H 1 1.874 0.02 . 1 . . . . 21 PRO HG2 . 7206 1 230 . 1 1 21 21 PRO HG3 H 1 0.855 0.02 . 1 . . . . 21 PRO HG3 . 7206 1 231 . 1 1 21 21 PRO HD2 H 1 3.586 0.02 . 1 . . . . 21 PRO HD2 . 7206 1 232 . 1 1 21 21 PRO HD3 H 1 3.586 0.02 . 1 . . . . 21 PRO HD3 . 7206 1 233 . 1 1 21 21 PRO C C 13 175.372 0.2 . 1 . . . . 21 PRO C . 7206 1 234 . 1 1 21 21 PRO CA C 13 63.829 0.2 . 1 . . . . 21 PRO CA . 7206 1 235 . 1 1 21 21 PRO CB C 13 31.828 0.2 . 1 . . . . 21 PRO CB . 7206 1 236 . 1 1 21 21 PRO CG C 13 27.01 0.2 . 1 . . . . 21 PRO CG . 7206 1 237 . 1 1 21 21 PRO CD C 13 50.785 0.2 . 1 . . . . 21 PRO CD . 7206 1 238 . 1 1 22 22 GLN H H 1 7.182 0.02 . 1 . . . . 22 GLN H . 7206 1 239 . 1 1 22 22 GLN HA H 1 4.45 0.02 . 1 . . . . 22 GLN HA . 7206 1 240 . 1 1 22 22 GLN HB2 H 1 1.905 0.02 . 1 . . . . 22 GLN HB2 . 7206 1 241 . 1 1 22 22 GLN HB3 H 1 1.552 0.02 . 1 . . . . 22 GLN HB3 . 7206 1 242 . 1 1 22 22 GLN HG2 H 1 2.291 0.02 . 1 . . . . 22 GLN HG2 . 7206 1 243 . 1 1 22 22 GLN HG3 H 1 2.291 0.02 . 1 . . . . 22 GLN HG3 . 7206 1 244 . 1 1 22 22 GLN HE21 H 1 6.735 0.02 . 1 . . . . 22 GLN HE21 . 7206 1 245 . 1 1 22 22 GLN HE22 H 1 7.205 0.02 . 1 . . . . 22 GLN HE22 . 7206 1 246 . 1 1 22 22 GLN C C 13 174.383 0.2 . 1 . . . . 22 GLN C . 7206 1 247 . 1 1 22 22 GLN CA C 13 53.306 0.2 . 1 . . . . 22 GLN CA . 7206 1 248 . 1 1 22 22 GLN CB C 13 32.787 0.2 . 1 . . . . 22 GLN CB . 7206 1 249 . 1 1 22 22 GLN CG C 13 33.166 0.2 . 1 . . . . 22 GLN CG . 7206 1 250 . 1 1 22 22 GLN N N 15 121.818 0.1 . 1 . . . . 22 GLN N . 7206 1 251 . 1 1 23 23 ALA H H 1 8.507 0.02 . 1 . . . . 23 ALA H . 7206 1 252 . 1 1 23 23 ALA HA H 1 4.614 0.02 . 1 . . . . 23 ALA HA . 7206 1 253 . 1 1 23 23 ALA HB1 H 1 1.574 0.02 . 1 . . . . 23 ALA HB . 7206 1 254 . 1 1 23 23 ALA HB2 H 1 1.574 0.02 . 1 . . . . 23 ALA HB . 7206 1 255 . 1 1 23 23 ALA HB3 H 1 1.574 0.02 . 1 . . . . 23 ALA HB . 7206 1 256 . 1 1 23 23 ALA C C 13 179.165 0.2 . 1 . . . . 23 ALA C . 7206 1 257 . 1 1 23 23 ALA CA C 13 52.087 0.2 . 1 . . . . 23 ALA CA . 7206 1 258 . 1 1 23 23 ALA CB C 13 18.958 0.2 . 1 . . . . 23 ALA CB . 7206 1 259 . 1 1 23 23 ALA N N 15 126.019 0.1 . 1 . . . . 23 ALA N . 7206 1 260 . 1 1 24 24 CYS H H 1 9.128 0.02 . 1 . . . . 24 CYS H . 7206 1 261 . 1 1 24 24 CYS HA H 1 4.177 0.02 . 1 . . . . 24 CYS HA . 7206 1 262 . 1 1 24 24 CYS HB2 H 1 3.246 0.02 . 1 . . . . 24 CYS HB2 . 7206 1 263 . 1 1 24 24 CYS HB3 H 1 2.416 0.02 . 1 . . . . 24 CYS HB3 . 7206 1 264 . 1 1 24 24 CYS C C 13 176.611 0.2 . 1 . . . . 24 CYS C . 7206 1 265 . 1 1 24 24 CYS CA C 13 60.787 0.2 . 1 . . . . 24 CYS CA . 7206 1 266 . 1 1 24 24 CYS CB C 13 41.271 0.2 . 1 . . . . 24 CYS CB . 7206 1 267 . 1 1 24 24 CYS N N 15 119.736 0.1 . 1 . . . . 24 CYS N . 7206 1 268 . 1 1 25 25 ASN H H 1 9.137 0.02 . 1 . . . . 25 ASN H . 7206 1 269 . 1 1 25 25 ASN HA H 1 4.654 0.02 . 1 . . . . 25 ASN HA . 7206 1 270 . 1 1 25 25 ASN HB2 H 1 2.988 0.02 . 1 . . . . 25 ASN HB2 . 7206 1 271 . 1 1 25 25 ASN HB3 H 1 2.988 0.02 . 1 . . . . 25 ASN HB3 . 7206 1 272 . 1 1 25 25 ASN HD21 H 1 7.253 0.02 . 1 . . . . 25 ASN HD21 . 7206 1 273 . 1 1 25 25 ASN HD22 H 1 7.627 0.02 . 1 . . . . 25 ASN HD22 . 7206 1 274 . 1 1 25 25 ASN C C 13 177.865 0.2 . 1 . . . . 25 ASN C . 7206 1 275 . 1 1 25 25 ASN CA C 13 56.811 0.2 . 1 . . . . 25 ASN CA . 7206 1 276 . 1 1 25 25 ASN CB C 13 37.147 0.2 . 1 . . . . 25 ASN CB . 7206 1 277 . 1 1 25 25 ASN N N 15 116.104 0.1 . 1 . . . . 25 ASN N . 7206 1 278 . 1 1 26 26 SER H H 1 7.192 0.02 . 1 . . . . 26 SER H . 7206 1 279 . 1 1 26 26 SER HA H 1 4.476 0.02 . 1 . . . . 26 SER HA . 7206 1 280 . 1 1 26 26 SER HB2 H 1 3.956 0.02 . 1 . . . . 26 SER HB2 . 7206 1 281 . 1 1 26 26 SER HB3 H 1 3.956 0.02 . 1 . . . . 26 SER HB3 . 7206 1 282 . 1 1 26 26 SER C C 13 176.524 0.2 . 1 . . . . 26 SER C . 7206 1 283 . 1 1 26 26 SER CA C 13 60.055 0.2 . 1 . . . . 26 SER CA . 7206 1 284 . 1 1 26 26 SER CB C 13 62.908 0.2 . 1 . . . . 26 SER CB . 7206 1 285 . 1 1 26 26 SER N N 15 111.99 0.1 . 1 . . . . 26 SER N . 7206 1 286 . 1 1 27 27 ALA H H 1 8.452 0.02 . 1 . . . . 27 ALA H . 7206 1 287 . 1 1 27 27 ALA HA H 1 4.067 0.02 . 1 . . . . 27 ALA HA . 7206 1 288 . 1 1 27 27 ALA HB1 H 1 0.964 0.02 . 1 . . . . 27 ALA HB . 7206 1 289 . 1 1 27 27 ALA HB2 H 1 0.964 0.02 . 1 . . . . 27 ALA HB . 7206 1 290 . 1 1 27 27 ALA HB3 H 1 0.964 0.02 . 1 . . . . 27 ALA HB . 7206 1 291 . 1 1 27 27 ALA C C 13 181.184 0.2 . 1 . . . . 27 ALA C . 7206 1 292 . 1 1 27 27 ALA CA C 13 54.713 0.2 . 1 . . . . 27 ALA CA . 7206 1 293 . 1 1 27 27 ALA CB C 13 19.845 0.2 . 1 . . . . 27 ALA CB . 7206 1 294 . 1 1 27 27 ALA N N 15 124.996 0.1 . 1 . . . . 27 ALA N . 7206 1 295 . 1 1 28 28 MET H H 1 8.699 0.02 . 1 . . . . 28 MET H . 7206 1 296 . 1 1 28 28 MET HA H 1 4.696 0.02 . 1 . . . . 28 MET HA . 7206 1 297 . 1 1 28 28 MET HB2 H 1 1.945 0.02 . 1 . . . . 28 MET HB2 . 7206 1 298 . 1 1 28 28 MET HB3 H 1 1.861 0.02 . 1 . . . . 28 MET HB3 . 7206 1 299 . 1 1 28 28 MET C C 13 178.861 0.2 . 1 . . . . 28 MET C . 7206 1 300 . 1 1 28 28 MET CA C 13 54.808 0.2 . 1 . . . . 28 MET CA . 7206 1 301 . 1 1 28 28 MET CB C 13 28.865 0.2 . 1 . . . . 28 MET CB . 7206 1 302 . 1 1 28 28 MET CE C 13 15.783 0.2 . 1 . . . . 28 MET CE . 7206 1 303 . 1 1 28 28 MET N N 15 112.275 0.1 . 1 . . . . 28 MET N . 7206 1 304 . 1 1 29 29 LYS H H 1 7.381 0.02 . 1 . . . . 29 LYS H . 7206 1 305 . 1 1 29 29 LYS HA H 1 4.424 0.02 . 1 . . . . 29 LYS HA . 7206 1 306 . 1 1 29 29 LYS HB2 H 1 2.06 0.02 . 1 . . . . 29 LYS HB2 . 7206 1 307 . 1 1 29 29 LYS HB3 H 1 2.06 0.02 . 1 . . . . 29 LYS HB3 . 7206 1 308 . 1 1 29 29 LYS HG2 H 1 1.926 0.02 . 1 . . . . 29 LYS HG2 . 7206 1 309 . 1 1 29 29 LYS HG3 H 1 1.705 0.02 . 1 . . . . 29 LYS HG3 . 7206 1 310 . 1 1 29 29 LYS HD2 H 1 1.865 0.02 . 1 . . . . 29 LYS HD2 . 7206 1 311 . 1 1 29 29 LYS HD3 H 1 1.865 0.02 . 1 . . . . 29 LYS HD3 . 7206 1 312 . 1 1 29 29 LYS HE2 H 1 3.159 0.02 . 1 . . . . 29 LYS HE2 . 7206 1 313 . 1 1 29 29 LYS HE3 H 1 3.159 0.02 . 1 . . . . 29 LYS HE3 . 7206 1 314 . 1 1 29 29 LYS C C 13 178.732 0.2 . 1 . . . . 29 LYS C . 7206 1 315 . 1 1 29 29 LYS CA C 13 60.382 0.2 . 1 . . . . 29 LYS CA . 7206 1 316 . 1 1 29 29 LYS CB C 13 32.227 0.2 . 1 . . . . 29 LYS CB . 7206 1 317 . 1 1 29 29 LYS CG C 13 25.189 0.2 . 1 . . . . 29 LYS CG . 7206 1 318 . 1 1 29 29 LYS CD C 13 29.589 0.2 . 1 . . . . 29 LYS CD . 7206 1 319 . 1 1 29 29 LYS CE C 13 42.096 0.2 . 1 . . . . 29 LYS CE . 7206 1 320 . 1 1 29 29 LYS N N 15 120.162 0.1 . 1 . . . . 29 LYS N . 7206 1 321 . 1 1 30 30 ASN H H 1 7.394 0.02 . 1 . . . . 30 ASN H . 7206 1 322 . 1 1 30 30 ASN HA H 1 4.622 0.02 . 1 . . . . 30 ASN HA . 7206 1 323 . 1 1 30 30 ASN HB2 H 1 3.01 0.02 . 1 . . . . 30 ASN HB2 . 7206 1 324 . 1 1 30 30 ASN HB3 H 1 3.01 0.02 . 1 . . . . 30 ASN HB3 . 7206 1 325 . 1 1 30 30 ASN HD21 H 1 7.19 0.02 . 1 . . . . 30 ASN HD21 . 7206 1 326 . 1 1 30 30 ASN HD22 H 1 7.94 0.02 . 1 . . . . 30 ASN HD22 . 7206 1 327 . 1 1 30 30 ASN C C 13 175.488 0.2 . 1 . . . . 30 ASN C . 7206 1 328 . 1 1 30 30 ASN CA C 13 55.369 0.2 . 1 . . . . 30 ASN CA . 7206 1 329 . 1 1 30 30 ASN CB C 13 38.666 0.2 . 1 . . . . 30 ASN CB . 7206 1 330 . 1 1 30 30 ASN N N 15 113.666 0.1 . 1 . . . . 30 ASN N . 7206 1 331 . 1 1 31 31 ILE H H 1 7.131 0.02 . 1 . . . . 31 ILE H . 7206 1 332 . 1 1 31 31 ILE HA H 1 4.066 0.02 . 1 . . . . 31 ILE HA . 7206 1 333 . 1 1 31 31 ILE HB H 1 1.936 0.02 . 1 . . . . 31 ILE HB . 7206 1 334 . 1 1 31 31 ILE HG12 H 1 1.648 0.02 . 1 . . . . 31 ILE HG12 . 7206 1 335 . 1 1 31 31 ILE HG13 H 1 0.828 0.02 . 1 . . . . 31 ILE HG13 . 7206 1 336 . 1 1 31 31 ILE HG21 H 1 0.964 0.02 . 1 . . . . 31 ILE HG2 . 7206 1 337 . 1 1 31 31 ILE HG22 H 1 0.964 0.02 . 1 . . . . 31 ILE HG2 . 7206 1 338 . 1 1 31 31 ILE HG23 H 1 0.964 0.02 . 1 . . . . 31 ILE HG2 . 7206 1 339 . 1 1 31 31 ILE HD11 H 1 1.033 0.02 . 1 . . . . 31 ILE HD1 . 7206 1 340 . 1 1 31 31 ILE HD12 H 1 1.033 0.02 . 1 . . . . 31 ILE HD1 . 7206 1 341 . 1 1 31 31 ILE HD13 H 1 1.033 0.02 . 1 . . . . 31 ILE HD1 . 7206 1 342 . 1 1 31 31 ILE C C 13 178.295 0.2 . 1 . . . . 31 ILE C . 7206 1 343 . 1 1 31 31 ILE CA C 13 64.467 0.2 . 1 . . . . 31 ILE CA . 7206 1 344 . 1 1 31 31 ILE CB C 13 40.069 0.2 . 1 . . . . 31 ILE CB . 7206 1 345 . 1 1 31 31 ILE CG1 C 13 30.025 0.2 . 1 . . . . 31 ILE CG1 . 7206 1 346 . 1 1 31 31 ILE CG2 C 13 17.874 0.2 . 1 . . . . 31 ILE CG2 . 7206 1 347 . 1 1 31 31 ILE CD1 C 13 15.711 0.2 . 1 . . . . 31 ILE CD1 . 7206 1 348 . 1 1 31 31 ILE N N 15 117.348 0.1 . 1 . . . . 31 ILE N . 7206 1 349 . 1 1 32 32 ASN H H 1 8.728 0.02 . 1 . . . . 32 ASN H . 7206 1 350 . 1 1 32 32 ASN HA H 1 5.018 0.02 . 1 . . . . 32 ASN HA . 7206 1 351 . 1 1 32 32 ASN HB2 H 1 3.301 0.02 . 1 . . . . 32 ASN HB2 . 7206 1 352 . 1 1 32 32 ASN HB3 H 1 3.002 0.02 . 1 . . . . 32 ASN HB3 . 7206 1 353 . 1 1 32 32 ASN HD21 H 1 7.531 0.02 . 1 . . . . 32 ASN HD21 . 7206 1 354 . 1 1 32 32 ASN HD22 H 1 8.753 0.02 . 1 . . . . 32 ASN HD22 . 7206 1 355 . 1 1 32 32 ASN C C 13 177.124 0.2 . 1 . . . . 32 ASN C . 7206 1 356 . 1 1 32 32 ASN CA C 13 54.864 0.2 . 1 . . . . 32 ASN CA . 7206 1 357 . 1 1 32 32 ASN CB C 13 37.957 0.2 . 1 . . . . 32 ASN CB . 7206 1 358 . 1 1 32 32 ASN N N 15 118.105 0.1 . 1 . . . . 32 ASN N . 7206 1 359 . 1 1 33 33 LYS H H 1 8.2 0.02 . 1 . . . . 33 LYS H . 7206 1 360 . 1 1 33 33 LYS HA H 1 4.582 0.02 . 1 . . . . 33 LYS HA . 7206 1 361 . 1 1 33 33 LYS HB2 H 1 2.063 0.02 . 1 . . . . 33 LYS HB2 . 7206 1 362 . 1 1 33 33 LYS HB3 H 1 1.948 0.02 . 1 . . . . 33 LYS HB3 . 7206 1 363 . 1 1 33 33 LYS HG2 H 1 1.443 0.02 . 1 . . . . 33 LYS HG2 . 7206 1 364 . 1 1 33 33 LYS HG3 H 1 0.875 0.02 . 1 . . . . 33 LYS HG3 . 7206 1 365 . 1 1 33 33 LYS HD2 H 1 1.742 0.02 . 1 . . . . 33 LYS HD2 . 7206 1 366 . 1 1 33 33 LYS HD3 H 1 1.742 0.02 . 1 . . . . 33 LYS HD3 . 7206 1 367 . 1 1 33 33 LYS HE2 H 1 3.086 0.02 . 1 . . . . 33 LYS HE2 . 7206 1 368 . 1 1 33 33 LYS HE3 H 1 3.086 0.02 . 1 . . . . 33 LYS HE3 . 7206 1 369 . 1 1 33 33 LYS C C 13 177.202 0.2 . 1 . . . . 33 LYS C . 7206 1 370 . 1 1 33 33 LYS CA C 13 58.32 0.2 . 1 . . . . 33 LYS CA . 7206 1 371 . 1 1 33 33 LYS CB C 13 31.29 0.2 . 1 . . . . 33 LYS CB . 7206 1 372 . 1 1 33 33 LYS CG C 13 23.879 0.2 . 1 . . . . 33 LYS CG . 7206 1 373 . 1 1 33 33 LYS CD C 13 29.771 0.2 . 1 . . . . 33 LYS CD . 7206 1 374 . 1 1 33 33 LYS CE C 13 41.949 0.2 . 1 . . . . 33 LYS CE . 7206 1 375 . 1 1 33 33 LYS N N 15 117.95 0.1 . 1 . . . . 33 LYS N . 7206 1 376 . 1 1 34 34 HIS H H 1 7.78 0.02 . 1 . . . . 34 HIS H . 7206 1 377 . 1 1 34 34 HIS HA H 1 4.545 0.02 . 1 . . . . 34 HIS HA . 7206 1 378 . 1 1 34 34 HIS HB2 H 1 3.55 0.02 . 1 . . . . 34 HIS HB2 . 7206 1 379 . 1 1 34 34 HIS HB3 H 1 3.248 0.02 . 1 . . . . 34 HIS HB3 . 7206 1 380 . 1 1 34 34 HIS HD2 H 1 7.373 0.02 . 1 . . . . 34 HIS HD2 . 7206 1 381 . 1 1 34 34 HIS HE1 H 1 8.646 0.02 . 1 . . . . 34 HIS HE1 . 7206 1 382 . 1 1 34 34 HIS C C 13 175.288 0.2 . 1 . . . . 34 HIS C . 7206 1 383 . 1 1 34 34 HIS CA C 13 57.838 0.2 . 1 . . . . 34 HIS CA . 7206 1 384 . 1 1 34 34 HIS CB C 13 29.102 0.2 . 1 . . . . 34 HIS CB . 7206 1 385 . 1 1 34 34 HIS N N 15 114.008 0.1 . 1 . . . . 34 HIS N . 7206 1 386 . 1 1 35 35 THR H H 1 7.54 0.02 . 1 . . . . 35 THR H . 7206 1 387 . 1 1 35 35 THR HA H 1 4.379 0.02 . 1 . . . . 35 THR HA . 7206 1 388 . 1 1 35 35 THR HB H 1 4.326 0.02 . 1 . . . . 35 THR HB . 7206 1 389 . 1 1 35 35 THR HG21 H 1 1.355 0.02 . 1 . . . . 35 THR HG2 . 7206 1 390 . 1 1 35 35 THR HG22 H 1 1.355 0.02 . 1 . . . . 35 THR HG2 . 7206 1 391 . 1 1 35 35 THR HG23 H 1 1.355 0.02 . 1 . . . . 35 THR HG2 . 7206 1 392 . 1 1 35 35 THR C C 13 174.871 0.2 . 1 . . . . 35 THR C . 7206 1 393 . 1 1 35 35 THR CA C 13 61.51 0.2 . 1 . . . . 35 THR CA . 7206 1 394 . 1 1 35 35 THR CB C 13 69.837 0.2 . 1 . . . . 35 THR CB . 7206 1 395 . 1 1 35 35 THR CG2 C 13 22.043 0.2 . 1 . . . . 35 THR CG2 . 7206 1 396 . 1 1 35 35 THR N N 15 108.167 0.1 . 1 . . . . 35 THR N . 7206 1 397 . 1 1 36 36 LYS H H 1 8.274 0.02 . 1 . . . . 36 LYS H . 7206 1 398 . 1 1 36 36 LYS HA H 1 2.071 0.02 . 1 . . . . 36 LYS HA . 7206 1 399 . 1 1 36 36 LYS HB2 H 1 1.899 0.02 . 1 . . . . 36 LYS HB2 . 7206 1 400 . 1 1 36 36 LYS HB3 H 1 1.56 0.02 . 1 . . . . 36 LYS HB3 . 7206 1 401 . 1 1 36 36 LYS HG2 H 1 1.226 0.02 . 1 . . . . 36 LYS HG2 . 7206 1 402 . 1 1 36 36 LYS HG3 H 1 1.226 0.02 . 1 . . . . 36 LYS HG3 . 7206 1 403 . 1 1 36 36 LYS HD2 H 1 1.623 0.02 . 1 . . . . 36 LYS HD2 . 7206 1 404 . 1 1 36 36 LYS HD3 H 1 1.623 0.02 . 1 . . . . 36 LYS HD3 . 7206 1 405 . 1 1 36 36 LYS HE2 H 1 3.16 0.02 . 1 . . . . 36 LYS HE2 . 7206 1 406 . 1 1 36 36 LYS HE3 H 1 3.16 0.02 . 1 . . . . 36 LYS HE3 . 7206 1 407 . 1 1 36 36 LYS C C 13 173.823 0.2 . 1 . . . . 36 LYS C . 7206 1 408 . 1 1 36 36 LYS CA C 13 56.354 0.2 . 1 . . . . 36 LYS CA . 7206 1 409 . 1 1 36 36 LYS CB C 13 28.568 0.2 . 1 . . . . 36 LYS CB . 7206 1 410 . 1 1 36 36 LYS CG C 13 24.925 0.2 . 1 . . . . 36 LYS CG . 7206 1 411 . 1 1 36 36 LYS CD C 13 27.792 0.2 . 1 . . . . 36 LYS CD . 7206 1 412 . 1 1 36 36 LYS CE C 13 42.359 0.2 . 1 . . . . 36 LYS CE . 7206 1 413 . 1 1 36 36 LYS N N 15 116.362 0.1 . 1 . . . . 36 LYS N . 7206 1 414 . 1 1 37 37 ARG H H 1 7.563 0.02 . 1 . . . . 37 ARG H . 7206 1 415 . 1 1 37 37 ARG HA H 1 4.514 0.02 . 1 . . . . 37 ARG HA . 7206 1 416 . 1 1 37 37 ARG HB2 H 1 1.712 0.02 . 1 . . . . 37 ARG HB2 . 7206 1 417 . 1 1 37 37 ARG HB3 H 1 1.61 0.02 . 1 . . . . 37 ARG HB3 . 7206 1 418 . 1 1 37 37 ARG HG2 H 1 1.521 0.02 . 1 . . . . 37 ARG HG2 . 7206 1 419 . 1 1 37 37 ARG HG3 H 1 1.521 0.02 . 1 . . . . 37 ARG HG3 . 7206 1 420 . 1 1 37 37 ARG HD2 H 1 3.195 0.02 . 1 . . . . 37 ARG HD2 . 7206 1 421 . 1 1 37 37 ARG HD3 H 1 3.263 0.02 . 1 . . . . 37 ARG HD3 . 7206 1 422 . 1 1 37 37 ARG C C 13 174.405 0.2 . 1 . . . . 37 ARG C . 7206 1 423 . 1 1 37 37 ARG CA C 13 54.228 0.2 . 1 . . . . 37 ARG CA . 7206 1 424 . 1 1 37 37 ARG CB C 13 33.723 0.2 . 1 . . . . 37 ARG CB . 7206 1 425 . 1 1 37 37 ARG CG C 13 26.517 0.2 . 1 . . . . 37 ARG CG . 7206 1 426 . 1 1 37 37 ARG CD C 13 43.331 0.2 . 1 . . . . 37 ARG CD . 7206 1 427 . 1 1 37 37 ARG N N 15 115.973 0.1 . 1 . . . . 37 ARG N . 7206 1 428 . 1 1 38 38 CYS H H 1 8.571 0.02 . 1 . . . . 38 CYS H . 7206 1 429 . 1 1 38 38 CYS HA H 1 4.786 0.02 . 1 . . . . 38 CYS HA . 7206 1 430 . 1 1 38 38 CYS HB2 H 1 3.083 0.02 . 1 . . . . 38 CYS HB2 . 7206 1 431 . 1 1 38 38 CYS HB3 H 1 2.917 0.02 . 1 . . . . 38 CYS HB3 . 7206 1 432 . 1 1 38 38 CYS C C 13 174.219 0.2 . 1 . . . . 38 CYS C . 7206 1 433 . 1 1 38 38 CYS CA C 13 52.71 0.2 . 1 . . . . 38 CYS CA . 7206 1 434 . 1 1 38 38 CYS CB C 13 39.017 0.2 . 1 . . . . 38 CYS CB . 7206 1 435 . 1 1 38 38 CYS N N 15 117.473 0.1 . 1 . . . . 38 CYS N . 7206 1 436 . 1 1 39 39 LYS H H 1 8.461 0.02 . 1 . . . . 39 LYS H . 7206 1 437 . 1 1 39 39 LYS HA H 1 4.295 0.02 . 1 . . . . 39 LYS HA . 7206 1 438 . 1 1 39 39 LYS HB2 H 1 2.097 0.02 . 1 . . . . 39 LYS HB2 . 7206 1 439 . 1 1 39 39 LYS HB3 H 1 1.675 0.02 . 1 . . . . 39 LYS HB3 . 7206 1 440 . 1 1 39 39 LYS HG2 H 1 1.522 0.02 . 1 . . . . 39 LYS HG2 . 7206 1 441 . 1 1 39 39 LYS HG3 H 1 1.522 0.02 . 1 . . . . 39 LYS HG3 . 7206 1 442 . 1 1 39 39 LYS HD2 H 1 1.974 0.02 . 1 . . . . 39 LYS HD2 . 7206 1 443 . 1 1 39 39 LYS HD3 H 1 1.974 0.02 . 1 . . . . 39 LYS HD3 . 7206 1 444 . 1 1 39 39 LYS C C 13 178.446 0.2 . 1 . . . . 39 LYS C . 7206 1 445 . 1 1 39 39 LYS CA C 13 57.757 0.2 . 1 . . . . 39 LYS CA . 7206 1 446 . 1 1 39 39 LYS CB C 13 32.807 0.2 . 1 . . . . 39 LYS CB . 7206 1 447 . 1 1 39 39 LYS CG C 13 25.709 0.2 . 1 . . . . 39 LYS CG . 7206 1 448 . 1 1 39 39 LYS CD C 13 30.775 0.2 . 1 . . . . 39 LYS CD . 7206 1 449 . 1 1 39 39 LYS CE C 13 41.94 0.2 . 1 . . . . 39 LYS CE . 7206 1 450 . 1 1 39 39 LYS N N 15 127.552 0.1 . 1 . . . . 39 LYS N . 7206 1 451 . 1 1 40 40 ASP H H 1 8.994 0.02 . 1 . . . . 40 ASP H . 7206 1 452 . 1 1 40 40 ASP HA H 1 4.52 0.02 . 1 . . . . 40 ASP HA . 7206 1 453 . 1 1 40 40 ASP HB2 H 1 2.869 0.02 . 1 . . . . 40 ASP HB2 . 7206 1 454 . 1 1 40 40 ASP HB3 H 1 2.869 0.02 . 1 . . . . 40 ASP HB3 . 7206 1 455 . 1 1 40 40 ASP C C 13 181.136 0.2 . 1 . . . . 40 ASP C . 7206 1 456 . 1 1 40 40 ASP CA C 13 57.398 0.2 . 1 . . . . 40 ASP CA . 7206 1 457 . 1 1 40 40 ASP CB C 13 40.723 0.2 . 1 . . . . 40 ASP CB . 7206 1 458 . 1 1 40 40 ASP N N 15 127.319 0.1 . 1 . . . . 40 ASP N . 7206 1 459 . 1 1 41 41 LEU H H 1 7.741 0.02 . 1 . . . . 41 LEU H . 7206 1 460 . 1 1 41 41 LEU HA H 1 5.475 0.02 . 1 . . . . 41 LEU HA . 7206 1 461 . 1 1 41 41 LEU HB2 H 1 1.726 0.02 . 1 . . . . 41 LEU HB2 . 7206 1 462 . 1 1 41 41 LEU HB3 H 1 1.649 0.02 . 1 . . . . 41 LEU HB3 . 7206 1 463 . 1 1 41 41 LEU HG H 1 1.573 0.02 . 1 . . . . 41 LEU HG . 7206 1 464 . 1 1 41 41 LEU HD11 H 1 1.562 0.02 . 1 . . . . 41 LEU HD1 . 7206 1 465 . 1 1 41 41 LEU HD12 H 1 1.562 0.02 . 1 . . . . 41 LEU HD1 . 7206 1 466 . 1 1 41 41 LEU HD13 H 1 1.562 0.02 . 1 . . . . 41 LEU HD1 . 7206 1 467 . 1 1 41 41 LEU HD21 H 1 0.96 0.02 . 1 . . . . 41 LEU HD2 . 7206 1 468 . 1 1 41 41 LEU HD22 H 1 0.96 0.02 . 1 . . . . 41 LEU HD2 . 7206 1 469 . 1 1 41 41 LEU HD23 H 1 0.96 0.02 . 1 . . . . 41 LEU HD2 . 7206 1 470 . 1 1 41 41 LEU C C 13 175.71 0.2 . 1 . . . . 41 LEU C . 7206 1 471 . 1 1 41 41 LEU CA C 13 53.989 0.2 . 1 . . . . 41 LEU CA . 7206 1 472 . 1 1 41 41 LEU CB C 13 45.336 0.2 . 1 . . . . 41 LEU CB . 7206 1 473 . 1 1 41 41 LEU CG C 13 27.399 0.2 . 1 . . . . 41 LEU CG . 7206 1 474 . 1 1 41 41 LEU CD1 C 13 25.431 0.2 . 1 . . . . 41 LEU CD1 . 7206 1 475 . 1 1 41 41 LEU CD2 C 13 24.004 0.2 . 1 . . . . 41 LEU CD2 . 7206 1 476 . 1 1 41 41 LEU N N 15 119.09 0.1 . 1 . . . . 41 LEU N . 7206 1 477 . 1 1 42 42 ASN H H 1 8.679 0.02 . 1 . . . . 42 ASN H . 7206 1 478 . 1 1 42 42 ASN HA H 1 5.134 0.02 . 1 . . . . 42 ASN HA . 7206 1 479 . 1 1 42 42 ASN HB2 H 1 2.268 0.02 . 1 . . . . 42 ASN HB2 . 7206 1 480 . 1 1 42 42 ASN HB3 H 1 2.153 0.02 . 1 . . . . 42 ASN HB3 . 7206 1 481 . 1 1 42 42 ASN HD21 H 1 7.143 0.02 . 1 . . . . 42 ASN HD21 . 7206 1 482 . 1 1 42 42 ASN HD22 H 1 4.14 0.02 . 1 . . . . 42 ASN HD22 . 7206 1 483 . 1 1 42 42 ASN C C 13 172.83 0.2 . 1 . . . . 42 ASN C . 7206 1 484 . 1 1 42 42 ASN CA C 13 53.544 0.2 . 1 . . . . 42 ASN CA . 7206 1 485 . 1 1 42 42 ASN CB C 13 44.71 0.2 . 1 . . . . 42 ASN CB . 7206 1 486 . 1 1 42 42 ASN N N 15 120.254 0.1 . 1 . . . . 42 ASN N . 7206 1 487 . 1 1 43 43 THR H H 1 7.705 0.02 . 1 . . . . 43 THR H . 7206 1 488 . 1 1 43 43 THR HA H 1 5.019 0.02 . 1 . . . . 43 THR HA . 7206 1 489 . 1 1 43 43 THR HB H 1 3.533 0.02 . 1 . . . . 43 THR HB . 7206 1 490 . 1 1 43 43 THR HG21 H 1 0.957 0.02 . 1 . . . . 43 THR HG2 . 7206 1 491 . 1 1 43 43 THR HG22 H 1 0.957 0.02 . 1 . . . . 43 THR HG2 . 7206 1 492 . 1 1 43 43 THR HG23 H 1 0.957 0.02 . 1 . . . . 43 THR HG2 . 7206 1 493 . 1 1 43 43 THR C C 13 173.042 0.2 . 1 . . . . 43 THR C . 7206 1 494 . 1 1 43 43 THR CA C 13 62.083 0.2 . 1 . . . . 43 THR CA . 7206 1 495 . 1 1 43 43 THR CB C 13 69.561 0.2 . 1 . . . . 43 THR CB . 7206 1 496 . 1 1 43 43 THR CG2 C 13 22.963 0.2 . 1 . . . . 43 THR CG2 . 7206 1 497 . 1 1 43 43 THR N N 15 122.531 0.1 . 1 . . . . 43 THR N . 7206 1 498 . 1 1 44 44 PHE H H 1 9.549 0.02 . 1 . . . . 44 PHE H . 7206 1 499 . 1 1 44 44 PHE HA H 1 4.938 0.02 . 1 . . . . 44 PHE HA . 7206 1 500 . 1 1 44 44 PHE HB2 H 1 2.583 0.02 . 1 . . . . 44 PHE HB2 . 7206 1 501 . 1 1 44 44 PHE HB3 H 1 2.583 0.02 . 1 . . . . 44 PHE HB3 . 7206 1 502 . 1 1 44 44 PHE HD1 H 1 6.861 0.02 . 1 . . . . 44 PHE HD1 . 7206 1 503 . 1 1 44 44 PHE HD2 H 1 6.861 0.02 . 1 . . . . 44 PHE HD2 . 7206 1 504 . 1 1 44 44 PHE HE1 H 1 7.168 0.02 . 1 . . . . 44 PHE HE1 . 7206 1 505 . 1 1 44 44 PHE HE2 H 1 7.168 0.02 . 1 . . . . 44 PHE HE2 . 7206 1 506 . 1 1 44 44 PHE C C 13 174.342 0.2 . 1 . . . . 44 PHE C . 7206 1 507 . 1 1 44 44 PHE CA C 13 56.363 0.2 . 1 . . . . 44 PHE CA . 7206 1 508 . 1 1 44 44 PHE CB C 13 42.252 0.2 . 1 . . . . 44 PHE CB . 7206 1 509 . 1 1 44 44 PHE N N 15 125.749 0.1 . 1 . . . . 44 PHE N . 7206 1 510 . 1 1 45 45 LEU H H 1 9.328 0.02 . 1 . . . . 45 LEU H . 7206 1 511 . 1 1 45 45 LEU HA H 1 4.173 0.02 . 1 . . . . 45 LEU HA . 7206 1 512 . 1 1 45 45 LEU HB2 H 1 1.999 0.02 . 1 . . . . 45 LEU HB2 . 7206 1 513 . 1 1 45 45 LEU HB3 H 1 1.038 0.02 . 1 . . . . 45 LEU HB3 . 7206 1 514 . 1 1 45 45 LEU HG H 1 1.357 0.02 . 1 . . . . 45 LEU HG . 7206 1 515 . 1 1 45 45 LEU HD11 H 1 0.233 0.02 . 1 . . . . 45 LEU HD1 . 7206 1 516 . 1 1 45 45 LEU HD12 H 1 0.233 0.02 . 1 . . . . 45 LEU HD1 . 7206 1 517 . 1 1 45 45 LEU HD13 H 1 0.233 0.02 . 1 . . . . 45 LEU HD1 . 7206 1 518 . 1 1 45 45 LEU HD21 H 1 0.323 0.02 . 1 . . . . 45 LEU HD2 . 7206 1 519 . 1 1 45 45 LEU HD22 H 1 0.323 0.02 . 1 . . . . 45 LEU HD2 . 7206 1 520 . 1 1 45 45 LEU HD23 H 1 0.323 0.02 . 1 . . . . 45 LEU HD2 . 7206 1 521 . 1 1 45 45 LEU C C 13 176.755 0.2 . 1 . . . . 45 LEU C . 7206 1 522 . 1 1 45 45 LEU CA C 13 54.263 0.2 . 1 . . . . 45 LEU CA . 7206 1 523 . 1 1 45 45 LEU CB C 13 42.791 0.2 . 1 . . . . 45 LEU CB . 7206 1 524 . 1 1 45 45 LEU CG C 13 27.21 0.2 . 1 . . . . 45 LEU CG . 7206 1 525 . 1 1 45 45 LEU CD1 C 13 23.201 0.2 . 1 . . . . 45 LEU CD1 . 7206 1 526 . 1 1 45 45 LEU CD2 C 13 24.521 0.2 . 1 . . . . 45 LEU CD2 . 7206 1 527 . 1 1 45 45 LEU N N 15 121.736 0.1 . 1 . . . . 45 LEU N . 7206 1 528 . 1 1 46 46 HIS H H 1 8.66 0.02 . 1 . . . . 46 HIS H . 7206 1 529 . 1 1 46 46 HIS HA H 1 5.427 0.02 . 1 . . . . 46 HIS HA . 7206 1 530 . 1 1 46 46 HIS HB2 H 1 3.424 0.02 . 1 . . . . 46 HIS HB2 . 7206 1 531 . 1 1 46 46 HIS HB3 H 1 3.112 0.02 . 1 . . . . 46 HIS HB3 . 7206 1 532 . 1 1 46 46 HIS HD2 H 1 7.283 0.02 . 1 . . . . 46 HIS HD2 . 7206 1 533 . 1 1 46 46 HIS HE1 H 1 9.313 0.02 . 1 . . . . 46 HIS HE1 . 7206 1 534 . 1 1 46 46 HIS C C 13 172.486 0.2 . 1 . . . . 46 HIS C . 7206 1 535 . 1 1 46 46 HIS CA C 13 52.304 0.2 . 1 . . . . 46 HIS CA . 7206 1 536 . 1 1 46 46 HIS CB C 13 25.979 0.2 . 1 . . . . 46 HIS CB . 7206 1 537 . 1 1 46 46 HIS N N 15 122.857 0.1 . 1 . . . . 46 HIS N . 7206 1 538 . 1 1 47 47 GLU H H 1 7.075 0.02 . 1 . . . . 47 GLU H . 7206 1 539 . 1 1 47 47 GLU HA H 1 5.059 0.02 . 1 . . . . 47 GLU HA . 7206 1 540 . 1 1 47 47 GLU HB2 H 1 2.252 0.02 . 1 . . . . 47 GLU HB2 . 7206 1 541 . 1 1 47 47 GLU HB3 H 1 1.735 0.02 . 1 . . . . 47 GLU HB3 . 7206 1 542 . 1 1 47 47 GLU HG2 H 1 2.25 0.02 . 1 . . . . 47 GLU HG2 . 7206 1 543 . 1 1 47 47 GLU HG3 H 1 2.441 0.02 . 1 . . . . 47 GLU HG3 . 7206 1 544 . 1 1 47 47 GLU C C 13 171.741 0.2 . 1 . . . . 47 GLU C . 7206 1 545 . 1 1 47 47 GLU CA C 13 52.866 0.2 . 1 . . . . 47 GLU CA . 7206 1 546 . 1 1 47 47 GLU CB C 13 31.875 0.2 . 1 . . . . 47 GLU CB . 7206 1 547 . 1 1 47 47 GLU CG C 13 33.153 0.2 . 1 . . . . 47 GLU CG . 7206 1 548 . 1 1 47 47 GLU N N 15 119.077 0.1 . 1 . . . . 47 GLU N . 7206 1 549 . 1 1 48 48 PRO HA H 1 4.723 0.02 . 1 . . . . 48 PRO HA . 7206 1 550 . 1 1 48 48 PRO HB2 H 1 2.605 0.02 . 1 . . . . 48 PRO HB2 . 7206 1 551 . 1 1 48 48 PRO HB3 H 1 2.136 0.02 . 1 . . . . 48 PRO HB3 . 7206 1 552 . 1 1 48 48 PRO HG2 H 1 2.165 0.02 . 1 . . . . 48 PRO HG2 . 7206 1 553 . 1 1 48 48 PRO HG3 H 1 2.165 0.02 . 1 . . . . 48 PRO HG3 . 7206 1 554 . 1 1 48 48 PRO HD2 H 1 3.777 0.02 . 1 . . . . 48 PRO HD2 . 7206 1 555 . 1 1 48 48 PRO HD3 H 1 3.925 0.02 . 1 . . . . 48 PRO HD3 . 7206 1 556 . 1 1 48 48 PRO C C 13 178.585 0.2 . 1 . . . . 48 PRO C . 7206 1 557 . 1 1 48 48 PRO CA C 13 62.245 0.2 . 1 . . . . 48 PRO CA . 7206 1 558 . 1 1 48 48 PRO CB C 13 32.122 0.2 . 1 . . . . 48 PRO CB . 7206 1 559 . 1 1 48 48 PRO CG C 13 27.707 0.2 . 1 . . . . 48 PRO CG . 7206 1 560 . 1 1 48 48 PRO CD C 13 50.109 0.2 . 1 . . . . 48 PRO CD . 7206 1 561 . 1 1 49 49 PHE H H 1 9.429 0.02 . 1 . . . . 49 PHE H . 7206 1 562 . 1 1 49 49 PHE HA H 1 4.197 0.02 . 1 . . . . 49 PHE HA . 7206 1 563 . 1 1 49 49 PHE HB2 H 1 3.502 0.02 . 1 . . . . 49 PHE HB2 . 7206 1 564 . 1 1 49 49 PHE HB3 H 1 3.185 0.02 . 1 . . . . 49 PHE HB3 . 7206 1 565 . 1 1 49 49 PHE HD1 H 1 7.396 0.02 . 1 . . . . 49 PHE HD1 . 7206 1 566 . 1 1 49 49 PHE HD2 H 1 7.396 0.02 . 1 . . . . 49 PHE HD2 . 7206 1 567 . 1 1 49 49 PHE HE1 H 1 7.337 0.02 . 1 . . . . 49 PHE HE1 . 7206 1 568 . 1 1 49 49 PHE HE2 H 1 7.337 0.02 . 1 . . . . 49 PHE HE2 . 7206 1 569 . 1 1 49 49 PHE C C 13 176.905 0.2 . 1 . . . . 49 PHE C . 7206 1 570 . 1 1 49 49 PHE CA C 13 62.452 0.2 . 1 . . . . 49 PHE CA . 7206 1 571 . 1 1 49 49 PHE CB C 13 38.841 0.2 . 1 . . . . 49 PHE CB . 7206 1 572 . 1 1 49 49 PHE N N 15 125.069 0.1 . 1 . . . . 49 PHE N . 7206 1 573 . 1 1 50 50 SER H H 1 9.006 0.02 . 1 . . . . 50 SER H . 7206 1 574 . 1 1 50 50 SER HA H 1 3.77 0.02 . 1 . . . . 50 SER HA . 7206 1 575 . 1 1 50 50 SER HB2 H 1 4.203 0.02 . 1 . . . . 50 SER HB2 . 7206 1 576 . 1 1 50 50 SER HB3 H 1 4.12 0.02 . 1 . . . . 50 SER HB3 . 7206 1 577 . 1 1 50 50 SER C C 13 176.925 0.2 . 1 . . . . 50 SER C . 7206 1 578 . 1 1 50 50 SER CA C 13 61.511 0.2 . 1 . . . . 50 SER CA . 7206 1 579 . 1 1 50 50 SER CB C 13 61.641 0.2 . 1 . . . . 50 SER CB . 7206 1 580 . 1 1 50 50 SER N N 15 111.936 0.1 . 1 . . . . 50 SER N . 7206 1 581 . 1 1 51 51 SER H H 1 7.303 0.02 . 1 . . . . 51 SER H . 7206 1 582 . 1 1 51 51 SER HA H 1 4.408 0.02 . 1 . . . . 51 SER HA . 7206 1 583 . 1 1 51 51 SER HB2 H 1 4.07 0.02 . 1 . . . . 51 SER HB2 . 7206 1 584 . 1 1 51 51 SER HB3 H 1 4.013 0.02 . 1 . . . . 51 SER HB3 . 7206 1 585 . 1 1 51 51 SER C C 13 175.718 0.2 . 1 . . . . 51 SER C . 7206 1 586 . 1 1 51 51 SER CA C 13 61.057 0.2 . 1 . . . . 51 SER CA . 7206 1 587 . 1 1 51 51 SER CB C 13 63.121 0.2 . 1 . . . . 51 SER CB . 7206 1 588 . 1 1 51 51 SER N N 15 117.941 0.1 . 1 . . . . 51 SER N . 7206 1 589 . 1 1 52 52 VAL H H 1 7.345 0.02 . 1 . . . . 52 VAL H . 7206 1 590 . 1 1 52 52 VAL HA H 1 4.103 0.02 . 1 . . . . 52 VAL HA . 7206 1 591 . 1 1 52 52 VAL HB H 1 1.893 0.02 . 1 . . . . 52 VAL HB . 7206 1 592 . 1 1 52 52 VAL HG11 H 1 0.948 0.02 . 1 . . . . 52 VAL HG1 . 7206 1 593 . 1 1 52 52 VAL HG12 H 1 0.948 0.02 . 1 . . . . 52 VAL HG1 . 7206 1 594 . 1 1 52 52 VAL HG13 H 1 0.948 0.02 . 1 . . . . 52 VAL HG1 . 7206 1 595 . 1 1 52 52 VAL HG21 H 1 0.905 0.02 . 1 . . . . 52 VAL HG2 . 7206 1 596 . 1 1 52 52 VAL HG22 H 1 0.905 0.02 . 1 . . . . 52 VAL HG2 . 7206 1 597 . 1 1 52 52 VAL HG23 H 1 0.905 0.02 . 1 . . . . 52 VAL HG2 . 7206 1 598 . 1 1 52 52 VAL C C 13 178.175 0.2 . 1 . . . . 52 VAL C . 7206 1 599 . 1 1 52 52 VAL CA C 13 64.553 0.2 . 1 . . . . 52 VAL CA . 7206 1 600 . 1 1 52 52 VAL CB C 13 31.049 0.2 . 1 . . . . 52 VAL CB . 7206 1 601 . 1 1 52 52 VAL CG1 C 13 21.869 0.2 . 1 . . . . 52 VAL CG1 . 7206 1 602 . 1 1 52 52 VAL CG2 C 13 21.869 0.2 . 1 . . . . 52 VAL CG2 . 7206 1 603 . 1 1 52 52 VAL N N 15 123.616 0.1 . 1 . . . . 52 VAL N . 7206 1 604 . 1 1 53 53 ALA H H 1 8.204 0.02 . 1 . . . . 53 ALA H . 7206 1 605 . 1 1 53 53 ALA HA H 1 3.473 0.02 . 1 . . . . 53 ALA HA . 7206 1 606 . 1 1 53 53 ALA HB1 H 1 0.403 0.02 . 1 . . . . 53 ALA HB . 7206 1 607 . 1 1 53 53 ALA HB2 H 1 0.403 0.02 . 1 . . . . 53 ALA HB . 7206 1 608 . 1 1 53 53 ALA HB3 H 1 0.403 0.02 . 1 . . . . 53 ALA HB . 7206 1 609 . 1 1 53 53 ALA C C 13 180.62 0.2 . 1 . . . . 53 ALA C . 7206 1 610 . 1 1 53 53 ALA CA C 13 54.827 0.2 . 1 . . . . 53 ALA CA . 7206 1 611 . 1 1 53 53 ALA CB C 13 15.836 0.2 . 1 . . . . 53 ALA CB . 7206 1 612 . 1 1 53 53 ALA N N 15 120.147 0.1 . 1 . . . . 53 ALA N . 7206 1 613 . 1 1 54 54 ALA H H 1 7.34 0.02 . 1 . . . . 54 ALA H . 7206 1 614 . 1 1 54 54 ALA HA H 1 4.111 0.02 . 1 . . . . 54 ALA HA . 7206 1 615 . 1 1 54 54 ALA HB1 H 1 1.55 0.02 . 1 . . . . 54 ALA HB . 7206 1 616 . 1 1 54 54 ALA HB2 H 1 1.55 0.02 . 1 . . . . 54 ALA HB . 7206 1 617 . 1 1 54 54 ALA HB3 H 1 1.55 0.02 . 1 . . . . 54 ALA HB . 7206 1 618 . 1 1 54 54 ALA C C 13 181.145 0.2 . 1 . . . . 54 ALA C . 7206 1 619 . 1 1 54 54 ALA CA C 13 54.601 0.2 . 1 . . . . 54 ALA CA . 7206 1 620 . 1 1 54 54 ALA CB C 13 17.306 0.2 . 1 . . . . 54 ALA CB . 7206 1 621 . 1 1 54 54 ALA N N 15 119.948 0.1 . 1 . . . . 54 ALA N . 7206 1 622 . 1 1 55 55 THR H H 1 7.724 0.02 . 1 . . . . 55 THR H . 7206 1 623 . 1 1 55 55 THR HA H 1 3.804 0.02 . 1 . . . . 55 THR HA . 7206 1 624 . 1 1 55 55 THR HB H 1 4.598 0.02 . 1 . . . . 55 THR HB . 7206 1 625 . 1 1 55 55 THR HG21 H 1 0.889 0.02 . 1 . . . . 55 THR HG2 . 7206 1 626 . 1 1 55 55 THR HG22 H 1 0.889 0.02 . 1 . . . . 55 THR HG2 . 7206 1 627 . 1 1 55 55 THR HG23 H 1 0.889 0.02 . 1 . . . . 55 THR HG2 . 7206 1 628 . 1 1 55 55 THR C C 13 174.683 0.2 . 1 . . . . 55 THR C . 7206 1 629 . 1 1 55 55 THR CA C 13 65.53 0.2 . 1 . . . . 55 THR CA . 7206 1 630 . 1 1 55 55 THR CB C 13 67.308 0.2 . 1 . . . . 55 THR CB . 7206 1 631 . 1 1 55 55 THR CG2 C 13 23.907 0.2 . 1 . . . . 55 THR CG2 . 7206 1 632 . 1 1 55 55 THR N N 15 119.304 0.1 . 1 . . . . 55 THR N . 7206 1 633 . 1 1 56 56 CYS H H 1 7.438 0.02 . 1 . . . . 56 CYS H . 7206 1 634 . 1 1 56 56 CYS HA H 1 3.366 0.02 . 1 . . . . 56 CYS HA . 7206 1 635 . 1 1 56 56 CYS HB2 H 1 3.003 0.02 . 1 . . . . 56 CYS HB2 . 7206 1 636 . 1 1 56 56 CYS HB3 H 1 2.543 0.02 . 1 . . . . 56 CYS HB3 . 7206 1 637 . 1 1 56 56 CYS C C 13 173.077 0.2 . 1 . . . . 56 CYS C . 7206 1 638 . 1 1 56 56 CYS CA C 13 55.053 0.2 . 1 . . . . 56 CYS CA . 7206 1 639 . 1 1 56 56 CYS CB C 13 39.608 0.2 . 1 . . . . 56 CYS CB . 7206 1 640 . 1 1 56 56 CYS N N 15 115.601 0.1 . 1 . . . . 56 CYS N . 7206 1 641 . 1 1 57 57 GLN H H 1 7.371 0.02 . 1 . . . . 57 GLN H . 7206 1 642 . 1 1 57 57 GLN HA H 1 4.252 0.02 . 1 . . . . 57 GLN HA . 7206 1 643 . 1 1 57 57 GLN HB2 H 1 2.426 0.02 . 1 . . . . 57 GLN HB2 . 7206 1 644 . 1 1 57 57 GLN HB3 H 1 2.057 0.02 . 1 . . . . 57 GLN HB3 . 7206 1 645 . 1 1 57 57 GLN HG2 H 1 2.367 0.02 . 1 . . . . 57 GLN HG2 . 7206 1 646 . 1 1 57 57 GLN HG3 H 1 2.367 0.02 . 1 . . . . 57 GLN HG3 . 7206 1 647 . 1 1 57 57 GLN HE21 H 1 6.886 0.02 . 1 . . . . 57 GLN HE21 . 7206 1 648 . 1 1 57 57 GLN HE22 H 1 7.073 0.02 . 1 . . . . 57 GLN HE22 . 7206 1 649 . 1 1 57 57 GLN C C 13 176.951 0.2 . 1 . . . . 57 GLN C . 7206 1 650 . 1 1 57 57 GLN CA C 13 53.444 0.2 . 1 . . . . 57 GLN CA . 7206 1 651 . 1 1 57 57 GLN CB C 13 28.706 0.2 . 1 . . . . 57 GLN CB . 7206 1 652 . 1 1 57 57 GLN CG C 13 34.126 0.2 . 1 . . . . 57 GLN CG . 7206 1 653 . 1 1 57 57 GLN N N 15 114.112 0.1 . 1 . . . . 57 GLN N . 7206 1 654 . 1 1 58 58 THR H H 1 7.592 0.02 . 1 . . . . 58 THR H . 7206 1 655 . 1 1 58 58 THR HA H 1 4.718 0.02 . 1 . . . . 58 THR HA . 7206 1 656 . 1 1 58 58 THR HB H 1 4.835 0.02 . 1 . . . . 58 THR HB . 7206 1 657 . 1 1 58 58 THR HG21 H 1 1.411 0.02 . 1 . . . . 58 THR HG2 . 7206 1 658 . 1 1 58 58 THR HG22 H 1 1.411 0.02 . 1 . . . . 58 THR HG2 . 7206 1 659 . 1 1 58 58 THR HG23 H 1 1.411 0.02 . 1 . . . . 58 THR HG2 . 7206 1 660 . 1 1 58 58 THR C C 13 173.213 0.2 . 1 . . . . 58 THR C . 7206 1 661 . 1 1 58 58 THR CA C 13 61.45 0.2 . 1 . . . . 58 THR CA . 7206 1 662 . 1 1 58 58 THR CB C 13 67.631 0.2 . 1 . . . . 58 THR CB . 7206 1 663 . 1 1 58 58 THR CG2 C 13 21.104 0.2 . 1 . . . . 58 THR CG2 . 7206 1 664 . 1 1 58 58 THR N N 15 112.076 0.1 . 1 . . . . 58 THR N . 7206 1 665 . 1 1 59 59 PRO HA H 1 4.437 0.02 . 1 . . . . 59 PRO HA . 7206 1 666 . 1 1 59 59 PRO HB2 H 1 2.446 0.02 . 1 . . . . 59 PRO HB2 . 7206 1 667 . 1 1 59 59 PRO HB3 H 1 1.824 0.02 . 1 . . . . 59 PRO HB3 . 7206 1 668 . 1 1 59 59 PRO HG2 H 1 2.223 0.02 . 1 . . . . 59 PRO HG2 . 7206 1 669 . 1 1 59 59 PRO HG3 H 1 2.075 0.02 . 1 . . . . 59 PRO HG3 . 7206 1 670 . 1 1 59 59 PRO C C 13 175.725 0.2 . 1 . . . . 59 PRO C . 7206 1 671 . 1 1 59 59 PRO CA C 13 64.703 0.2 . 1 . . . . 59 PRO CA . 7206 1 672 . 1 1 59 59 PRO CB C 13 31.935 0.2 . 1 . . . . 59 PRO CB . 7206 1 673 . 1 1 59 59 PRO CG C 13 28.096 0.2 . 1 . . . . 59 PRO CG . 7206 1 674 . 1 1 59 59 PRO CD C 13 50.884 0.2 . 1 . . . . 59 PRO CD . 7206 1 675 . 1 1 60 60 LYS H H 1 8.298 0.02 . 1 . . . . 60 LYS H . 7206 1 676 . 1 1 60 60 LYS HA H 1 4.079 0.02 . 1 . . . . 60 LYS HA . 7206 1 677 . 1 1 60 60 LYS HB2 H 1 1.729 0.02 . 1 . . . . 60 LYS HB2 . 7206 1 678 . 1 1 60 60 LYS HB3 H 1 1.729 0.02 . 1 . . . . 60 LYS HB3 . 7206 1 679 . 1 1 60 60 LYS HG2 H 1 1.301 0.02 . 1 . . . . 60 LYS HG2 . 7206 1 680 . 1 1 60 60 LYS HG3 H 1 1.301 0.02 . 1 . . . . 60 LYS HG3 . 7206 1 681 . 1 1 60 60 LYS HD2 H 1 1.91 0.02 . 1 . . . . 60 LYS HD2 . 7206 1 682 . 1 1 60 60 LYS HD3 H 1 1.91 0.02 . 1 . . . . 60 LYS HD3 . 7206 1 683 . 1 1 60 60 LYS C C 13 176.335 0.2 . 1 . . . . 60 LYS C . 7206 1 684 . 1 1 60 60 LYS CA C 13 56.844 0.2 . 1 . . . . 60 LYS CA . 7206 1 685 . 1 1 60 60 LYS CB C 13 32.839 0.2 . 1 . . . . 60 LYS CB . 7206 1 686 . 1 1 60 60 LYS CG C 13 25.645 0.2 . 1 . . . . 60 LYS CG . 7206 1 687 . 1 1 60 60 LYS CD C 13 29.321 0.2 . 1 . . . . 60 LYS CD . 7206 1 688 . 1 1 60 60 LYS CE C 13 41.934 0.2 . 1 . . . . 60 LYS CE . 7206 1 689 . 1 1 60 60 LYS N N 15 121.869 0.1 . 1 . . . . 60 LYS N . 7206 1 690 . 1 1 61 61 ILE H H 1 8.497 0.02 . 1 . . . . 61 ILE H . 7206 1 691 . 1 1 61 61 ILE HA H 1 4.477 0.02 . 1 . . . . 61 ILE HA . 7206 1 692 . 1 1 61 61 ILE HB H 1 1.892 0.02 . 1 . . . . 61 ILE HB . 7206 1 693 . 1 1 61 61 ILE HG12 H 1 0.815 0.02 . 1 . . . . 61 ILE HG12 . 7206 1 694 . 1 1 61 61 ILE HG13 H 1 0.595 0.02 . 1 . . . . 61 ILE HG13 . 7206 1 695 . 1 1 61 61 ILE HG21 H 1 0.83 0.02 . 1 . . . . 61 ILE HG2 . 7206 1 696 . 1 1 61 61 ILE HG22 H 1 0.83 0.02 . 1 . . . . 61 ILE HG2 . 7206 1 697 . 1 1 61 61 ILE HG23 H 1 0.83 0.02 . 1 . . . . 61 ILE HG2 . 7206 1 698 . 1 1 61 61 ILE HD11 H 1 0.776 0.02 . 1 . . . . 61 ILE HD1 . 7206 1 699 . 1 1 61 61 ILE HD12 H 1 0.776 0.02 . 1 . . . . 61 ILE HD1 . 7206 1 700 . 1 1 61 61 ILE HD13 H 1 0.776 0.02 . 1 . . . . 61 ILE HD1 . 7206 1 701 . 1 1 61 61 ILE C C 13 174.415 0.2 . 1 . . . . 61 ILE C . 7206 1 702 . 1 1 61 61 ILE CA C 13 58.938 0.2 . 1 . . . . 61 ILE CA . 7206 1 703 . 1 1 61 61 ILE CB C 13 42.815 0.2 . 1 . . . . 61 ILE CB . 7206 1 704 . 1 1 61 61 ILE CG1 C 13 25.357 0.2 . 1 . . . . 61 ILE CG1 . 7206 1 705 . 1 1 61 61 ILE CG2 C 13 17.954 0.2 . 1 . . . . 61 ILE CG2 . 7206 1 706 . 1 1 61 61 ILE CD1 C 13 14.709 0.2 . 1 . . . . 61 ILE CD1 . 7206 1 707 . 1 1 61 61 ILE N N 15 118.611 0.1 . 1 . . . . 61 ILE N . 7206 1 708 . 1 1 62 62 ALA H H 1 8.169 0.02 . 1 . . . . 62 ALA H . 7206 1 709 . 1 1 62 62 ALA HA H 1 4.469 0.02 . 1 . . . . 62 ALA HA . 7206 1 710 . 1 1 62 62 ALA HB1 H 1 1.358 0.02 . 1 . . . . 62 ALA HB . 7206 1 711 . 1 1 62 62 ALA HB2 H 1 1.358 0.02 . 1 . . . . 62 ALA HB . 7206 1 712 . 1 1 62 62 ALA HB3 H 1 1.358 0.02 . 1 . . . . 62 ALA HB . 7206 1 713 . 1 1 62 62 ALA C C 13 179.265 0.2 . 1 . . . . 62 ALA C . 7206 1 714 . 1 1 62 62 ALA CA C 13 52.474 0.2 . 1 . . . . 62 ALA CA . 7206 1 715 . 1 1 62 62 ALA CB C 13 18.689 0.2 . 1 . . . . 62 ALA CB . 7206 1 716 . 1 1 62 62 ALA N N 15 121.072 0.1 . 1 . . . . 62 ALA N . 7206 1 717 . 1 1 63 63 CYS H H 1 9.057 0.02 . 1 . . . . 63 CYS H . 7206 1 718 . 1 1 63 63 CYS HA H 1 4.686 0.02 . 1 . . . . 63 CYS HA . 7206 1 719 . 1 1 63 63 CYS HB2 H 1 3.549 0.02 . 1 . . . . 63 CYS HB2 . 7206 1 720 . 1 1 63 63 CYS HB3 H 1 2.973 0.02 . 1 . . . . 63 CYS HB3 . 7206 1 721 . 1 1 63 63 CYS C C 13 177.376 0.2 . 1 . . . . 63 CYS C . 7206 1 722 . 1 1 63 63 CYS CA C 13 52.159 0.2 . 1 . . . . 63 CYS CA . 7206 1 723 . 1 1 63 63 CYS CB C 13 40.435 0.2 . 1 . . . . 63 CYS CB . 7206 1 724 . 1 1 63 63 CYS N N 15 120.507 0.1 . 1 . . . . 63 CYS N . 7206 1 725 . 1 1 64 64 LYS H H 1 11.035 0.02 . 1 . . . . 64 LYS H . 7206 1 726 . 1 1 64 64 LYS HA H 1 4.044 0.02 . 1 . . . . 64 LYS HA . 7206 1 727 . 1 1 64 64 LYS HB2 H 1 1.959 0.02 . 1 . . . . 64 LYS HB2 . 7206 1 728 . 1 1 64 64 LYS HB3 H 1 1.841 0.02 . 1 . . . . 64 LYS HB3 . 7206 1 729 . 1 1 64 64 LYS HG2 H 1 1.585 0.02 . 1 . . . . 64 LYS HG2 . 7206 1 730 . 1 1 64 64 LYS HG3 H 1 1.585 0.02 . 1 . . . . 64 LYS HG3 . 7206 1 731 . 1 1 64 64 LYS C C 13 177.418 0.2 . 1 . . . . 64 LYS C . 7206 1 732 . 1 1 64 64 LYS CA C 13 60.081 0.2 . 1 . . . . 64 LYS CA . 7206 1 733 . 1 1 64 64 LYS CB C 13 31.794 0.2 . 1 . . . . 64 LYS CB . 7206 1 734 . 1 1 64 64 LYS CG C 13 24.793 0.2 . 1 . . . . 64 LYS CG . 7206 1 735 . 1 1 64 64 LYS CD C 13 29.256 0.2 . 1 . . . . 64 LYS CD . 7206 1 736 . 1 1 64 64 LYS CE C 13 41.82 0.2 . 1 . . . . 64 LYS CE . 7206 1 737 . 1 1 64 64 LYS N N 15 128.314 0.1 . 1 . . . . 64 LYS N . 7206 1 738 . 1 1 65 65 ASN H H 1 8.075 0.02 . 1 . . . . 65 ASN H . 7206 1 739 . 1 1 65 65 ASN HA H 1 4.588 0.02 . 1 . . . . 65 ASN HA . 7206 1 740 . 1 1 65 65 ASN HB2 H 1 3.232 0.02 . 1 . . . . 65 ASN HB2 . 7206 1 741 . 1 1 65 65 ASN HB3 H 1 2.794 0.02 . 1 . . . . 65 ASN HB3 . 7206 1 742 . 1 1 65 65 ASN HD21 H 1 6.543 0.02 . 1 . . . . 65 ASN HD21 . 7206 1 743 . 1 1 65 65 ASN HD22 H 1 7.308 0.02 . 1 . . . . 65 ASN HD22 . 7206 1 744 . 1 1 65 65 ASN C C 13 176.394 0.2 . 1 . . . . 65 ASN C . 7206 1 745 . 1 1 65 65 ASN CA C 13 52.548 0.2 . 1 . . . . 65 ASN CA . 7206 1 746 . 1 1 65 65 ASN CB C 13 37.473 0.2 . 1 . . . . 65 ASN CB . 7206 1 747 . 1 1 65 65 ASN N N 15 114.188 0.1 . 1 . . . . 65 ASN N . 7206 1 748 . 1 1 66 66 GLY H H 1 8.004 0.02 . 1 . . . . 66 GLY H . 7206 1 749 . 1 1 66 66 GLY HA2 H 1 4.438 0.02 . 1 . . . . 66 GLY HA2 . 7206 1 750 . 1 1 66 66 GLY HA3 H 1 3.584 0.02 . 1 . . . . 66 GLY HA3 . 7206 1 751 . 1 1 66 66 GLY C C 13 174.64 0.2 . 1 . . . . 66 GLY C . 7206 1 752 . 1 1 66 66 GLY CA C 13 44.848 0.2 . 1 . . . . 66 GLY CA . 7206 1 753 . 1 1 66 66 GLY N N 15 108.299 0.1 . 1 . . . . 66 GLY N . 7206 1 754 . 1 1 67 67 ASP H H 1 8.052 0.02 . 1 . . . . 67 ASP H . 7206 1 755 . 1 1 67 67 ASP HA H 1 4.556 0.02 . 1 . . . . 67 ASP HA . 7206 1 756 . 1 1 67 67 ASP HB2 H 1 2.755 0.02 . 1 . . . . 67 ASP HB2 . 7206 1 757 . 1 1 67 67 ASP HB3 H 1 2.755 0.02 . 1 . . . . 67 ASP HB3 . 7206 1 758 . 1 1 67 67 ASP C C 13 176.392 0.2 . 1 . . . . 67 ASP C . 7206 1 759 . 1 1 67 67 ASP CA C 13 54.367 0.2 . 1 . . . . 67 ASP CA . 7206 1 760 . 1 1 67 67 ASP CB C 13 40.327 0.2 . 1 . . . . 67 ASP CB . 7206 1 761 . 1 1 67 67 ASP N N 15 121.065 0.1 . 1 . . . . 67 ASP N . 7206 1 762 . 1 1 68 68 LYS H H 1 8.775 0.02 . 1 . . . . 68 LYS H . 7206 1 763 . 1 1 68 68 LYS HA H 1 4.681 0.02 . 1 . . . . 68 LYS HA . 7206 1 764 . 1 1 68 68 LYS HB2 H 1 1.984 0.02 . 1 . . . . 68 LYS HB2 . 7206 1 765 . 1 1 68 68 LYS HB3 H 1 1.698 0.02 . 1 . . . . 68 LYS HB3 . 7206 1 766 . 1 1 68 68 LYS HG2 H 1 1.289 0.02 . 1 . . . . 68 LYS HG2 . 7206 1 767 . 1 1 68 68 LYS HG3 H 1 1.469 0.02 . 1 . . . . 68 LYS HG3 . 7206 1 768 . 1 1 68 68 LYS C C 13 175.146 0.2 . 1 . . . . 68 LYS C . 7206 1 769 . 1 1 68 68 LYS CA C 13 55.066 0.2 . 1 . . . . 68 LYS CA . 7206 1 770 . 1 1 68 68 LYS CB C 13 31.067 0.2 . 1 . . . . 68 LYS CB . 7206 1 771 . 1 1 68 68 LYS CG C 13 25.184 0.2 . 1 . . . . 68 LYS CG . 7206 1 772 . 1 1 68 68 LYS CD C 13 28.865 0.2 . 1 . . . . 68 LYS CD . 7206 1 773 . 1 1 68 68 LYS CE C 13 42.112 0.2 . 1 . . . . 68 LYS CE . 7206 1 774 . 1 1 68 68 LYS N N 15 122.572 0.1 . 1 . . . . 68 LYS N . 7206 1 775 . 1 1 69 69 ASN H H 1 7.815 0.02 . 1 . . . . 69 ASN H . 7206 1 776 . 1 1 69 69 ASN HA H 1 5.012 0.02 . 1 . . . . 69 ASN HA . 7206 1 777 . 1 1 69 69 ASN HB2 H 1 3.285 0.02 . 1 . . . . 69 ASN HB2 . 7206 1 778 . 1 1 69 69 ASN HB3 H 1 2.966 0.02 . 1 . . . . 69 ASN HB3 . 7206 1 779 . 1 1 69 69 ASN HD21 H 1 7.453 0.02 . 1 . . . . 69 ASN HD21 . 7206 1 780 . 1 1 69 69 ASN HD22 H 1 6.881 0.02 . 1 . . . . 69 ASN HD22 . 7206 1 781 . 1 1 69 69 ASN C C 13 174.408 0.2 . 1 . . . . 69 ASN C . 7206 1 782 . 1 1 69 69 ASN CA C 13 52.047 0.2 . 1 . . . . 69 ASN CA . 7206 1 783 . 1 1 69 69 ASN CB C 13 38.402 0.2 . 1 . . . . 69 ASN CB . 7206 1 784 . 1 1 69 69 ASN N N 15 116.068 0.1 . 1 . . . . 69 ASN N . 7206 1 785 . 1 1 70 70 CYS H H 1 7.801 0.02 . 1 . . . . 70 CYS H . 7206 1 786 . 1 1 70 70 CYS HA H 1 5.735 0.02 . 1 . . . . 70 CYS HA . 7206 1 787 . 1 1 70 70 CYS HB2 H 1 2.821 0.02 . 1 . . . . 70 CYS HB2 . 7206 1 788 . 1 1 70 70 CYS HB3 H 1 2.617 0.02 . 1 . . . . 70 CYS HB3 . 7206 1 789 . 1 1 70 70 CYS C C 13 173.531 0.2 . 1 . . . . 70 CYS C . 7206 1 790 . 1 1 70 70 CYS CA C 13 60.81 0.2 . 1 . . . . 70 CYS CA . 7206 1 791 . 1 1 70 70 CYS CB C 13 44.101 0.2 . 1 . . . . 70 CYS CB . 7206 1 792 . 1 1 70 70 CYS N N 15 117.368 0.1 . 1 . . . . 70 CYS N . 7206 1 793 . 1 1 71 71 HIS H H 1 8.377 0.02 . 1 . . . . 71 HIS H . 7206 1 794 . 1 1 71 71 HIS HA H 1 4.508 0.02 . 1 . . . . 71 HIS HA . 7206 1 795 . 1 1 71 71 HIS HB2 H 1 3.446 0.02 . 1 . . . . 71 HIS HB2 . 7206 1 796 . 1 1 71 71 HIS HB3 H 1 2.42 0.02 . 1 . . . . 71 HIS HB3 . 7206 1 797 . 1 1 71 71 HIS HD2 H 1 7.107 0.02 . 1 . . . . 71 HIS HD2 . 7206 1 798 . 1 1 71 71 HIS HE1 H 1 8.49 0.02 . 1 . . . . 71 HIS HE1 . 7206 1 799 . 1 1 71 71 HIS C C 13 172.075 0.2 . 1 . . . . 71 HIS C . 7206 1 800 . 1 1 71 71 HIS CA C 13 55.42 0.2 . 1 . . . . 71 HIS CA . 7206 1 801 . 1 1 71 71 HIS CB C 13 32.898 0.2 . 1 . . . . 71 HIS CB . 7206 1 802 . 1 1 71 71 HIS N N 15 116.074 0.1 . 1 . . . . 71 HIS N . 7206 1 803 . 1 1 72 72 GLN H H 1 9.278 0.02 . 1 . . . . 72 GLN H . 7206 1 804 . 1 1 72 72 GLN HA H 1 4.923 0.02 . 1 . . . . 72 GLN HA . 7206 1 805 . 1 1 72 72 GLN HB2 H 1 2.01 0.02 . 1 . . . . 72 GLN HB2 . 7206 1 806 . 1 1 72 72 GLN HB3 H 1 1.797 0.02 . 1 . . . . 72 GLN HB3 . 7206 1 807 . 1 1 72 72 GLN HG2 H 1 2.848 0.02 . 1 . . . . 72 GLN HG2 . 7206 1 808 . 1 1 72 72 GLN HG3 H 1 1.91 0.02 . 1 . . . . 72 GLN HG3 . 7206 1 809 . 1 1 72 72 GLN HE21 H 1 6.608 0.02 . 1 . . . . 72 GLN HE21 . 7206 1 810 . 1 1 72 72 GLN HE22 H 1 7.452 0.02 . 1 . . . . 72 GLN HE22 . 7206 1 811 . 1 1 72 72 GLN C C 13 175.403 0.2 . 1 . . . . 72 GLN C . 7206 1 812 . 1 1 72 72 GLN CA C 13 54.308 0.2 . 1 . . . . 72 GLN CA . 7206 1 813 . 1 1 72 72 GLN CB C 13 30.056 0.2 . 1 . . . . 72 GLN CB . 7206 1 814 . 1 1 72 72 GLN CG C 13 33.199 0.2 . 1 . . . . 72 GLN CG . 7206 1 815 . 1 1 72 72 GLN N N 15 126.761 0.1 . 1 . . . . 72 GLN N . 7206 1 816 . 1 1 73 73 SER H H 1 8.6 0.02 . 1 . . . . 73 SER H . 7206 1 817 . 1 1 73 73 SER HA H 1 3.983 0.02 . 1 . . . . 73 SER HA . 7206 1 818 . 1 1 73 73 SER HB2 H 1 2.319 0.02 . 1 . . . . 73 SER HB2 . 7206 1 819 . 1 1 73 73 SER HB3 H 1 2.319 0.02 . 1 . . . . 73 SER HB3 . 7206 1 820 . 1 1 73 73 SER C C 13 174.412 0.2 . 1 . . . . 73 SER C . 7206 1 821 . 1 1 73 73 SER CA C 13 58.935 0.2 . 1 . . . . 73 SER CA . 7206 1 822 . 1 1 73 73 SER CB C 13 63.733 0.2 . 1 . . . . 73 SER CB . 7206 1 823 . 1 1 73 73 SER N N 15 120.799 0.1 . 1 . . . . 73 SER N . 7206 1 824 . 1 1 74 74 HIS H H 1 9.21 0.02 . 1 . . . . 74 HIS H . 7206 1 825 . 1 1 74 74 HIS HA H 1 4.46 0.02 . 1 . . . . 74 HIS HA . 7206 1 826 . 1 1 74 74 HIS HB2 H 1 3.269 0.02 . 1 . . . . 74 HIS HB2 . 7206 1 827 . 1 1 74 74 HIS HB3 H 1 3.269 0.02 . 1 . . . . 74 HIS HB3 . 7206 1 828 . 1 1 74 74 HIS HD2 H 1 7.403 0.02 . 1 . . . . 74 HIS HD2 . 7206 1 829 . 1 1 74 74 HIS C C 13 174.579 0.2 . 1 . . . . 74 HIS C . 7206 1 830 . 1 1 74 74 HIS CA C 13 57.415 0.2 . 1 . . . . 74 HIS CA . 7206 1 831 . 1 1 74 74 HIS CB C 13 27.839 0.2 . 1 . . . . 74 HIS CB . 7206 1 832 . 1 1 74 74 HIS N N 15 121.102 0.1 . 1 . . . . 74 HIS N . 7206 1 833 . 1 1 75 75 GLY H H 1 7.579 0.02 . 1 . . . . 75 GLY H . 7206 1 834 . 1 1 75 75 GLY HA2 H 1 4.005 0.02 . 1 . . . . 75 GLY HA2 . 7206 1 835 . 1 1 75 75 GLY HA3 H 1 4.106 0.02 . 1 . . . . 75 GLY HA3 . 7206 1 836 . 1 1 75 75 GLY C C 13 170.769 0.2 . 1 . . . . 75 GLY C . 7206 1 837 . 1 1 75 75 GLY CA C 13 44.106 0.2 . 1 . . . . 75 GLY CA . 7206 1 838 . 1 1 75 75 GLY N N 15 105.558 0.1 . 1 . . . . 75 GLY N . 7206 1 839 . 1 1 76 76 PRO HA H 1 4.208 0.02 . 1 . . . . 76 PRO HA . 7206 1 840 . 1 1 76 76 PRO HB2 H 1 1.951 0.02 . 1 . . . . 76 PRO HB2 . 7206 1 841 . 1 1 76 76 PRO HB3 H 1 1.649 0.02 . 1 . . . . 76 PRO HB3 . 7206 1 842 . 1 1 76 76 PRO HG2 H 1 2.007 0.02 . 1 . . . . 76 PRO HG2 . 7206 1 843 . 1 1 76 76 PRO HG3 H 1 2.007 0.02 . 1 . . . . 76 PRO HG3 . 7206 1 844 . 1 1 76 76 PRO C C 13 176.193 0.2 . 1 . . . . 76 PRO C . 7206 1 845 . 1 1 76 76 PRO CA C 13 62.316 0.2 . 1 . . . . 76 PRO CA . 7206 1 846 . 1 1 76 76 PRO CB C 13 32.059 0.2 . 1 . . . . 76 PRO CB . 7206 1 847 . 1 1 76 76 PRO CG C 13 26.592 0.2 . 1 . . . . 76 PRO CG . 7206 1 848 . 1 1 76 76 PRO CD C 13 49.251 0.2 . 1 . . . . 76 PRO CD . 7206 1 849 . 1 1 77 77 VAL H H 1 8.464 0.02 . 1 . . . . 77 VAL H . 7206 1 850 . 1 1 77 77 VAL HA H 1 4.722 0.02 . 1 . . . . 77 VAL HA . 7206 1 851 . 1 1 77 77 VAL HB H 1 2.355 0.02 . 1 . . . . 77 VAL HB . 7206 1 852 . 1 1 77 77 VAL HG11 H 1 1.123 0.02 . 1 . . . . 77 VAL HG1 . 7206 1 853 . 1 1 77 77 VAL HG12 H 1 1.123 0.02 . 1 . . . . 77 VAL HG1 . 7206 1 854 . 1 1 77 77 VAL HG13 H 1 1.123 0.02 . 1 . . . . 77 VAL HG1 . 7206 1 855 . 1 1 77 77 VAL HG21 H 1 1.044 0.02 . 1 . . . . 77 VAL HG2 . 7206 1 856 . 1 1 77 77 VAL HG22 H 1 1.044 0.02 . 1 . . . . 77 VAL HG2 . 7206 1 857 . 1 1 77 77 VAL HG23 H 1 1.044 0.02 . 1 . . . . 77 VAL HG2 . 7206 1 858 . 1 1 77 77 VAL C C 13 173.691 0.2 . 1 . . . . 77 VAL C . 7206 1 859 . 1 1 77 77 VAL CA C 13 58.81 0.2 . 1 . . . . 77 VAL CA . 7206 1 860 . 1 1 77 77 VAL CB C 13 35.483 0.2 . 1 . . . . 77 VAL CB . 7206 1 861 . 1 1 77 77 VAL CG1 C 13 21.691 0.2 . 1 . . . . 77 VAL CG1 . 7206 1 862 . 1 1 77 77 VAL CG2 C 13 19.221 0.2 . 1 . . . . 77 VAL CG2 . 7206 1 863 . 1 1 77 77 VAL N N 15 115.617 0.1 . 1 . . . . 77 VAL N . 7206 1 864 . 1 1 78 78 SER H H 1 8.269 0.02 . 1 . . . . 78 SER H . 7206 1 865 . 1 1 78 78 SER HA H 1 4.955 0.02 . 1 . . . . 78 SER HA . 7206 1 866 . 1 1 78 78 SER HB2 H 1 4.115 0.02 . 1 . . . . 78 SER HB2 . 7206 1 867 . 1 1 78 78 SER HB3 H 1 4.115 0.02 . 1 . . . . 78 SER HB3 . 7206 1 868 . 1 1 78 78 SER C C 13 174.021 0.2 . 1 . . . . 78 SER C . 7206 1 869 . 1 1 78 78 SER CA C 13 58.295 0.2 . 1 . . . . 78 SER CA . 7206 1 870 . 1 1 78 78 SER CB C 13 63.354 0.2 . 1 . . . . 78 SER CB . 7206 1 871 . 1 1 78 78 SER N N 15 114.458 0.1 . 1 . . . . 78 SER N . 7206 1 872 . 1 1 79 79 LEU H H 1 9.286 0.02 . 1 . . . . 79 LEU H . 7206 1 873 . 1 1 79 79 LEU HA H 1 4.977 0.02 . 1 . . . . 79 LEU HA . 7206 1 874 . 1 1 79 79 LEU HB2 H 1 1.751 0.02 . 1 . . . . 79 LEU HB2 . 7206 1 875 . 1 1 79 79 LEU HB3 H 1 1.527 0.02 . 1 . . . . 79 LEU HB3 . 7206 1 876 . 1 1 79 79 LEU HG H 1 0.752 0.02 . 1 . . . . 79 LEU HG . 7206 1 877 . 1 1 79 79 LEU HD11 H 1 0.837 0.02 . 1 . . . . 79 LEU HD1 . 7206 1 878 . 1 1 79 79 LEU HD12 H 1 0.837 0.02 . 1 . . . . 79 LEU HD1 . 7206 1 879 . 1 1 79 79 LEU HD13 H 1 0.837 0.02 . 1 . . . . 79 LEU HD1 . 7206 1 880 . 1 1 79 79 LEU HD21 H 1 2.1 0.02 . 1 . . . . 79 LEU HD2 . 7206 1 881 . 1 1 79 79 LEU HD22 H 1 2.1 0.02 . 1 . . . . 79 LEU HD2 . 7206 1 882 . 1 1 79 79 LEU HD23 H 1 2.1 0.02 . 1 . . . . 79 LEU HD2 . 7206 1 883 . 1 1 79 79 LEU C C 13 176.65 0.2 . 1 . . . . 79 LEU C . 7206 1 884 . 1 1 79 79 LEU CA C 13 54.059 0.2 . 1 . . . . 79 LEU CA . 7206 1 885 . 1 1 79 79 LEU CB C 13 45.711 0.2 . 1 . . . . 79 LEU CB . 7206 1 886 . 1 1 79 79 LEU CG C 13 27.444 0.2 . 1 . . . . 79 LEU CG . 7206 1 887 . 1 1 79 79 LEU CD1 C 13 25.388 0.2 . 1 . . . . 79 LEU CD1 . 7206 1 888 . 1 1 79 79 LEU CD2 C 13 25.388 0.2 . 1 . . . . 79 LEU CD2 . 7206 1 889 . 1 1 79 79 LEU N N 15 125.052 0.1 . 1 . . . . 79 LEU N . 7206 1 890 . 1 1 80 80 THR H H 1 9.016 0.02 . 1 . . . . 80 THR H . 7206 1 891 . 1 1 80 80 THR HA H 1 5.279 0.02 . 1 . . . . 80 THR HA . 7206 1 892 . 1 1 80 80 THR HB H 1 4.194 0.02 . 1 . . . . 80 THR HB . 7206 1 893 . 1 1 80 80 THR HG21 H 1 1.476 0.02 . 1 . . . . 80 THR HG2 . 7206 1 894 . 1 1 80 80 THR HG22 H 1 1.476 0.02 . 1 . . . . 80 THR HG2 . 7206 1 895 . 1 1 80 80 THR HG23 H 1 1.476 0.02 . 1 . . . . 80 THR HG2 . 7206 1 896 . 1 1 80 80 THR C C 13 172.789 0.2 . 1 . . . . 80 THR C . 7206 1 897 . 1 1 80 80 THR CA C 13 61.837 0.2 . 1 . . . . 80 THR CA . 7206 1 898 . 1 1 80 80 THR CB C 13 72.706 0.2 . 1 . . . . 80 THR CB . 7206 1 899 . 1 1 80 80 THR CG2 C 13 23.427 0.2 . 1 . . . . 80 THR CG2 . 7206 1 900 . 1 1 80 80 THR N N 15 117.343 0.1 . 1 . . . . 80 THR N . 7206 1 901 . 1 1 81 81 MET H H 1 9.447 0.02 . 1 . . . . 81 MET H . 7206 1 902 . 1 1 81 81 MET HA H 1 5.168 0.02 . 1 . . . . 81 MET HA . 7206 1 903 . 1 1 81 81 MET HB2 H 1 2.021 0.02 . 1 . . . . 81 MET HB2 . 7206 1 904 . 1 1 81 81 MET HB3 H 1 2.021 0.02 . 1 . . . . 81 MET HB3 . 7206 1 905 . 1 1 81 81 MET HG2 H 1 2.577 0.02 . 1 . . . . 81 MET HG2 . 7206 1 906 . 1 1 81 81 MET HG3 H 1 2.527 0.02 . 1 . . . . 81 MET HG3 . 7206 1 907 . 1 1 81 81 MET C C 13 175.128 0.2 . 1 . . . . 81 MET C . 7206 1 908 . 1 1 81 81 MET CA C 13 54.564 0.2 . 1 . . . . 81 MET CA . 7206 1 909 . 1 1 81 81 MET CB C 13 34.296 0.2 . 1 . . . . 81 MET CB . 7206 1 910 . 1 1 81 81 MET CG C 13 31.952 0.2 . 1 . . . . 81 MET CG . 7206 1 911 . 1 1 81 81 MET N N 15 126.656 0.1 . 1 . . . . 81 MET N . 7206 1 912 . 1 1 82 82 CYS H H 1 9.039 0.02 . 1 . . . . 82 CYS H . 7206 1 913 . 1 1 82 82 CYS HA H 1 5.68 0.02 . 1 . . . . 82 CYS HA . 7206 1 914 . 1 1 82 82 CYS HB2 H 1 2.74 0.02 . 1 . . . . 82 CYS HB2 . 7206 1 915 . 1 1 82 82 CYS HB3 H 1 2.74 0.02 . 1 . . . . 82 CYS HB3 . 7206 1 916 . 1 1 82 82 CYS C C 13 173.003 0.2 . 1 . . . . 82 CYS C . 7206 1 917 . 1 1 82 82 CYS CA C 13 52.436 0.2 . 1 . . . . 82 CYS CA . 7206 1 918 . 1 1 82 82 CYS CB C 13 39.685 0.2 . 1 . . . . 82 CYS CB . 7206 1 919 . 1 1 82 82 CYS N N 15 122.736 0.1 . 1 . . . . 82 CYS N . 7206 1 920 . 1 1 83 83 LYS H H 1 9.111 0.02 . 1 . . . . 83 LYS H . 7206 1 921 . 1 1 83 83 LYS HA H 1 5.326 0.02 . 1 . . . . 83 LYS HA . 7206 1 922 . 1 1 83 83 LYS HB2 H 1 1.947 0.02 . 1 . . . . 83 LYS HB2 . 7206 1 923 . 1 1 83 83 LYS HB3 H 1 1.756 0.02 . 1 . . . . 83 LYS HB3 . 7206 1 924 . 1 1 83 83 LYS HG2 H 1 1.486 0.02 . 1 . . . . 83 LYS HG2 . 7206 1 925 . 1 1 83 83 LYS HG3 H 1 1.486 0.02 . 1 . . . . 83 LYS HG3 . 7206 1 926 . 1 1 83 83 LYS HD2 H 1 1.923 0.02 . 1 . . . . 83 LYS HD2 . 7206 1 927 . 1 1 83 83 LYS HD3 H 1 1.923 0.02 . 1 . . . . 83 LYS HD3 . 7206 1 928 . 1 1 83 83 LYS HE2 H 1 3.27 0.02 . 1 . . . . 83 LYS HE2 . 7206 1 929 . 1 1 83 83 LYS HE3 H 1 3.27 0.02 . 1 . . . . 83 LYS HE3 . 7206 1 930 . 1 1 83 83 LYS C C 13 175.024 0.2 . 1 . . . . 83 LYS C . 7206 1 931 . 1 1 83 83 LYS CA C 13 54.302 0.2 . 1 . . . . 83 LYS CA . 7206 1 932 . 1 1 83 83 LYS CB C 13 35.74 0.2 . 1 . . . . 83 LYS CB . 7206 1 933 . 1 1 83 83 LYS CG C 13 25.036 0.2 . 1 . . . . 83 LYS CG . 7206 1 934 . 1 1 83 83 LYS CD C 13 28.938 0.2 . 1 . . . . 83 LYS CD . 7206 1 935 . 1 1 83 83 LYS CE C 13 42.404 0.2 . 1 . . . . 83 LYS CE . 7206 1 936 . 1 1 83 83 LYS N N 15 125.924 0.1 . 1 . . . . 83 LYS N . 7206 1 937 . 1 1 84 84 LEU H H 1 9.371 0.02 . 1 . . . . 84 LEU H . 7206 1 938 . 1 1 84 84 LEU HA H 1 3.648 0.02 . 1 . . . . 84 LEU HA . 7206 1 939 . 1 1 84 84 LEU HB2 H 1 1.975 0.02 . 1 . . . . 84 LEU HB2 . 7206 1 940 . 1 1 84 84 LEU HB3 H 1 1.679 0.02 . 1 . . . . 84 LEU HB3 . 7206 1 941 . 1 1 84 84 LEU HG H 1 1.247 0.02 . 1 . . . . 84 LEU HG . 7206 1 942 . 1 1 84 84 LEU HD11 H 1 0.485 0.02 . 1 . . . . 84 LEU HD1 . 7206 1 943 . 1 1 84 84 LEU HD12 H 1 0.485 0.02 . 1 . . . . 84 LEU HD1 . 7206 1 944 . 1 1 84 84 LEU HD13 H 1 0.485 0.02 . 1 . . . . 84 LEU HD1 . 7206 1 945 . 1 1 84 84 LEU HD21 H 1 0.781 0.02 . 1 . . . . 84 LEU HD2 . 7206 1 946 . 1 1 84 84 LEU HD22 H 1 0.781 0.02 . 1 . . . . 84 LEU HD2 . 7206 1 947 . 1 1 84 84 LEU HD23 H 1 0.781 0.02 . 1 . . . . 84 LEU HD2 . 7206 1 948 . 1 1 84 84 LEU C C 13 177.001 0.2 . 1 . . . . 84 LEU C . 7206 1 949 . 1 1 84 84 LEU CA C 13 56.308 0.2 . 1 . . . . 84 LEU CA . 7206 1 950 . 1 1 84 84 LEU CB C 13 43.267 0.2 . 1 . . . . 84 LEU CB . 7206 1 951 . 1 1 84 84 LEU CG C 13 26.543 0.2 . 1 . . . . 84 LEU CG . 7206 1 952 . 1 1 84 84 LEU CD1 C 13 23.096 0.2 . 1 . . . . 84 LEU CD1 . 7206 1 953 . 1 1 84 84 LEU CD2 C 13 26.174 0.2 . 1 . . . . 84 LEU CD2 . 7206 1 954 . 1 1 84 84 LEU N N 15 132.422 0.1 . 1 . . . . 84 LEU N . 7206 1 955 . 1 1 85 85 THR H H 1 9.466 0.02 . 1 . . . . 85 THR H . 7206 1 956 . 1 1 85 85 THR HA H 1 4.603 0.02 . 1 . . . . 85 THR HA . 7206 1 957 . 1 1 85 85 THR HB H 1 4.127 0.02 . 1 . . . . 85 THR HB . 7206 1 958 . 1 1 85 85 THR HG21 H 1 1.234 0.02 . 1 . . . . 85 THR HG2 . 7206 1 959 . 1 1 85 85 THR HG22 H 1 1.234 0.02 . 1 . . . . 85 THR HG2 . 7206 1 960 . 1 1 85 85 THR HG23 H 1 1.234 0.02 . 1 . . . . 85 THR HG2 . 7206 1 961 . 1 1 85 85 THR C C 13 174.633 0.2 . 1 . . . . 85 THR C . 7206 1 962 . 1 1 85 85 THR CA C 13 61.942 0.2 . 1 . . . . 85 THR CA . 7206 1 963 . 1 1 85 85 THR CB C 13 69.612 0.2 . 1 . . . . 85 THR CB . 7206 1 964 . 1 1 85 85 THR CG2 C 13 22.008 0.2 . 1 . . . . 85 THR CG2 . 7206 1 965 . 1 1 85 85 THR N N 15 120.316 0.1 . 1 . . . . 85 THR N . 7206 1 966 . 1 1 86 86 SER H H 1 7.641 0.02 . 1 . . . . 86 SER H . 7206 1 967 . 1 1 86 86 SER HA H 1 4.548 0.02 . 1 . . . . 86 SER HA . 7206 1 968 . 1 1 86 86 SER HB2 H 1 3.997 0.02 . 1 . . . . 86 SER HB2 . 7206 1 969 . 1 1 86 86 SER HB3 H 1 3.908 0.02 . 1 . . . . 86 SER HB3 . 7206 1 970 . 1 1 86 86 SER C C 13 172.29 0.2 . 1 . . . . 86 SER C . 7206 1 971 . 1 1 86 86 SER CA C 13 58.455 0.2 . 1 . . . . 86 SER CA . 7206 1 972 . 1 1 86 86 SER CB C 13 64.325 0.2 . 1 . . . . 86 SER CB . 7206 1 973 . 1 1 86 86 SER N N 15 114.356 0.1 . 1 . . . . 86 SER N . 7206 1 974 . 1 1 87 87 GLY H H 1 8.207 0.02 . 1 . . . . 87 GLY H . 7206 1 975 . 1 1 87 87 GLY HA2 H 1 4.831 0.02 . 1 . . . . 87 GLY HA2 . 7206 1 976 . 1 1 87 87 GLY HA3 H 1 3.877 0.02 . 1 . . . . 87 GLY HA3 . 7206 1 977 . 1 1 87 87 GLY C C 13 172.646 0.2 . 1 . . . . 87 GLY C . 7206 1 978 . 1 1 87 87 GLY CA C 13 44.704 0.2 . 1 . . . . 87 GLY CA . 7206 1 979 . 1 1 87 87 GLY N N 15 106.671 0.1 . 1 . . . . 87 GLY N . 7206 1 980 . 1 1 88 88 LYS H H 1 7.534 0.02 . 1 . . . . 88 LYS H . 7206 1 981 . 1 1 88 88 LYS HA H 1 4.582 0.02 . 1 . . . . 88 LYS HA . 7206 1 982 . 1 1 88 88 LYS HB2 H 1 1.839 0.02 . 1 . . . . 88 LYS HB2 . 7206 1 983 . 1 1 88 88 LYS HB3 H 1 1.755 0.02 . 1 . . . . 88 LYS HB3 . 7206 1 984 . 1 1 88 88 LYS HG2 H 1 1.494 0.02 . 1 . . . . 88 LYS HG2 . 7206 1 985 . 1 1 88 88 LYS HG3 H 1 1.494 0.02 . 1 . . . . 88 LYS HG3 . 7206 1 986 . 1 1 88 88 LYS HD2 H 1 1.759 0.02 . 1 . . . . 88 LYS HD2 . 7206 1 987 . 1 1 88 88 LYS HD3 H 1 1.759 0.02 . 1 . . . . 88 LYS HD3 . 7206 1 988 . 1 1 88 88 LYS C C 13 175.271 0.2 . 1 . . . . 88 LYS C . 7206 1 989 . 1 1 88 88 LYS CA C 13 54.432 0.2 . 1 . . . . 88 LYS CA . 7206 1 990 . 1 1 88 88 LYS CB C 13 34.678 0.2 . 1 . . . . 88 LYS CB . 7206 1 991 . 1 1 88 88 LYS CG C 13 24.44 0.2 . 1 . . . . 88 LYS CG . 7206 1 992 . 1 1 88 88 LYS CD C 13 29.145 0.2 . 1 . . . . 88 LYS CD . 7206 1 993 . 1 1 88 88 LYS CE C 13 42.12 0.2 . 1 . . . . 88 LYS CE . 7206 1 994 . 1 1 88 88 LYS N N 15 118.193 0.1 . 1 . . . . 88 LYS N . 7206 1 995 . 1 1 89 89 TYR H H 1 8.899 0.02 . 1 . . . . 89 TYR H . 7206 1 996 . 1 1 89 89 TYR HD1 H 1 6.886 0.02 . 1 . . . . 89 TYR HD1 . 7206 1 997 . 1 1 89 89 TYR HD2 H 1 6.886 0.02 . 1 . . . . 89 TYR HD2 . 7206 1 998 . 1 1 89 89 TYR HE1 H 1 6.753 0.02 . 1 . . . . 89 TYR HE1 . 7206 1 999 . 1 1 89 89 TYR HE2 H 1 6.753 0.02 . 1 . . . . 89 TYR HE2 . 7206 1 1000 . 1 1 89 89 TYR C C 13 174.497 0.2 . 1 . . . . 89 TYR C . 7206 1 1001 . 1 1 89 89 TYR CA C 13 58.467 0.2 . 1 . . . . 89 TYR CA . 7206 1 1002 . 1 1 89 89 TYR CB C 13 39.018 0.2 . 1 . . . . 89 TYR CB . 7206 1 1003 . 1 1 89 89 TYR N N 15 128.086 0.1 . 1 . . . . 89 TYR N . 7206 1 1004 . 1 1 90 90 PRO HA H 1 3.084 0.02 . 1 . . . . 90 PRO HA . 7206 1 1005 . 1 1 90 90 PRO HB2 H 1 1.949 0.02 . 1 . . . . 90 PRO HB2 . 7206 1 1006 . 1 1 90 90 PRO HB3 H 1 1.224 0.02 . 1 . . . . 90 PRO HB3 . 7206 1 1007 . 1 1 90 90 PRO HG2 H 1 1.814 0.02 . 1 . . . . 90 PRO HG2 . 7206 1 1008 . 1 1 90 90 PRO HG3 H 1 1.49 0.02 . 1 . . . . 90 PRO HG3 . 7206 1 1009 . 1 1 90 90 PRO HD2 H 1 3.408 0.02 . 1 . . . . 90 PRO HD2 . 7206 1 1010 . 1 1 90 90 PRO HD3 H 1 3.408 0.02 . 1 . . . . 90 PRO HD3 . 7206 1 1011 . 1 1 90 90 PRO C C 13 175.987 0.2 . 1 . . . . 90 PRO C . 7206 1 1012 . 1 1 90 90 PRO CA C 13 63.43 0.2 . 1 . . . . 90 PRO CA . 7206 1 1013 . 1 1 90 90 PRO CB C 13 33.788 0.2 . 1 . . . . 90 PRO CB . 7206 1 1014 . 1 1 90 90 PRO CG C 13 23.964 0.2 . 1 . . . . 90 PRO CG . 7206 1 1015 . 1 1 90 90 PRO CD C 13 49.617 0.2 . 1 . . . . 90 PRO CD . 7206 1 1016 . 1 1 91 91 ASN H H 1 8.777 0.02 . 1 . . . . 91 ASN H . 7206 1 1017 . 1 1 91 91 ASN HA H 1 4.905 0.02 . 1 . . . . 91 ASN HA . 7206 1 1018 . 1 1 91 91 ASN HB2 H 1 2.87 0.02 . 1 . . . . 91 ASN HB2 . 7206 1 1019 . 1 1 91 91 ASN HB3 H 1 2.784 0.02 . 1 . . . . 91 ASN HB3 . 7206 1 1020 . 1 1 91 91 ASN HD21 H 1 7.003 0.02 . 1 . . . . 91 ASN HD21 . 7206 1 1021 . 1 1 91 91 ASN HD22 H 1 7.737 0.02 . 1 . . . . 91 ASN HD22 . 7206 1 1022 . 1 1 91 91 ASN C C 13 173.165 0.2 . 1 . . . . 91 ASN C . 7206 1 1023 . 1 1 91 91 ASN CA C 13 52.785 0.2 . 1 . . . . 91 ASN CA . 7206 1 1024 . 1 1 91 91 ASN CB C 13 37.821 0.2 . 1 . . . . 91 ASN CB . 7206 1 1025 . 1 1 91 91 ASN N N 15 129.734 0.1 . 1 . . . . 91 ASN N . 7206 1 1026 . 1 1 92 92 CYS H H 1 7.271 0.02 . 1 . . . . 92 CYS H . 7206 1 1027 . 1 1 92 92 CYS HA H 1 4.381 0.02 . 1 . . . . 92 CYS HA . 7206 1 1028 . 1 1 92 92 CYS HB2 H 1 3.15 0.02 . 1 . . . . 92 CYS HB2 . 7206 1 1029 . 1 1 92 92 CYS HB3 H 1 2.979 0.02 . 1 . . . . 92 CYS HB3 . 7206 1 1030 . 1 1 92 92 CYS C C 13 173.93 0.2 . 1 . . . . 92 CYS C . 7206 1 1031 . 1 1 92 92 CYS CA C 13 53.287 0.2 . 1 . . . . 92 CYS CA . 7206 1 1032 . 1 1 92 92 CYS CB C 13 40.456 0.2 . 1 . . . . 92 CYS CB . 7206 1 1033 . 1 1 92 92 CYS N N 15 119.09 0.1 . 1 . . . . 92 CYS N . 7206 1 1034 . 1 1 93 93 ARG H H 1 8.497 0.02 . 1 . . . . 93 ARG H . 7206 1 1035 . 1 1 93 93 ARG HA H 1 4.805 0.02 . 1 . . . . 93 ARG HA . 7206 1 1036 . 1 1 93 93 ARG HB2 H 1 1.826 0.02 . 1 . . . . 93 ARG HB2 . 7206 1 1037 . 1 1 93 93 ARG HB3 H 1 1.826 0.02 . 1 . . . . 93 ARG HB3 . 7206 1 1038 . 1 1 93 93 ARG HG2 H 1 1.534 0.02 . 1 . . . . 93 ARG HG2 . 7206 1 1039 . 1 1 93 93 ARG HG3 H 1 1.534 0.02 . 1 . . . . 93 ARG HG3 . 7206 1 1040 . 1 1 93 93 ARG HD2 H 1 3.123 0.02 . 1 . . . . 93 ARG HD2 . 7206 1 1041 . 1 1 93 93 ARG HD3 H 1 3.123 0.02 . 1 . . . . 93 ARG HD3 . 7206 1 1042 . 1 1 93 93 ARG C C 13 174.216 0.2 . 1 . . . . 93 ARG C . 7206 1 1043 . 1 1 93 93 ARG CA C 13 55.267 0.2 . 1 . . . . 93 ARG CA . 7206 1 1044 . 1 1 93 93 ARG CB C 13 31.219 0.2 . 1 . . . . 93 ARG CB . 7206 1 1045 . 1 1 93 93 ARG CG C 13 26.928 0.2 . 1 . . . . 93 ARG CG . 7206 1 1046 . 1 1 93 93 ARG CD C 13 43.006 0.2 . 1 . . . . 93 ARG CD . 7206 1 1047 . 1 1 93 93 ARG N N 15 125.274 0.1 . 1 . . . . 93 ARG N . 7206 1 1048 . 1 1 94 94 TYR H H 1 9.522 0.02 . 1 . . . . 94 TYR H . 7206 1 1049 . 1 1 94 94 TYR HA H 1 5.106 0.02 . 1 . . . . 94 TYR HA . 7206 1 1050 . 1 1 94 94 TYR HB2 H 1 2.74 0.02 . 1 . . . . 94 TYR HB2 . 7206 1 1051 . 1 1 94 94 TYR HB3 H 1 2.74 0.02 . 1 . . . . 94 TYR HB3 . 7206 1 1052 . 1 1 94 94 TYR HD1 H 1 7.266 0.02 . 1 . . . . 94 TYR HD1 . 7206 1 1053 . 1 1 94 94 TYR HD2 H 1 7.266 0.02 . 1 . . . . 94 TYR HD2 . 7206 1 1054 . 1 1 94 94 TYR HE1 H 1 6.485 0.02 . 1 . . . . 94 TYR HE1 . 7206 1 1055 . 1 1 94 94 TYR HE2 H 1 6.485 0.02 . 1 . . . . 94 TYR HE2 . 7206 1 1056 . 1 1 94 94 TYR C C 13 176.104 0.2 . 1 . . . . 94 TYR C . 7206 1 1057 . 1 1 94 94 TYR CA C 13 58.283 0.2 . 1 . . . . 94 TYR CA . 7206 1 1058 . 1 1 94 94 TYR CB C 13 42.452 0.2 . 1 . . . . 94 TYR CB . 7206 1 1059 . 1 1 94 94 TYR N N 15 121.018 0.1 . 1 . . . . 94 TYR N . 7206 1 1060 . 1 1 95 95 LYS H H 1 9.522 0.02 . 1 . . . . 95 LYS H . 7206 1 1061 . 1 1 95 95 LYS HA H 1 4.8 0.02 . 1 . . . . 95 LYS HA . 7206 1 1062 . 1 1 95 95 LYS HB2 H 1 1.911 0.02 . 1 . . . . 95 LYS HB2 . 7206 1 1063 . 1 1 95 95 LYS HB3 H 1 1.911 0.02 . 1 . . . . 95 LYS HB3 . 7206 1 1064 . 1 1 95 95 LYS HG2 H 1 1.529 0.02 . 1 . . . . 95 LYS HG2 . 7206 1 1065 . 1 1 95 95 LYS HG3 H 1 1.529 0.02 . 1 . . . . 95 LYS HG3 . 7206 1 1066 . 1 1 95 95 LYS HD2 H 1 1.796 0.02 . 1 . . . . 95 LYS HD2 . 7206 1 1067 . 1 1 95 95 LYS HD3 H 1 1.796 0.02 . 1 . . . . 95 LYS HD3 . 7206 1 1068 . 1 1 95 95 LYS C C 13 174.936 0.2 . 1 . . . . 95 LYS C . 7206 1 1069 . 1 1 95 95 LYS CA C 13 55.022 0.2 . 1 . . . . 95 LYS CA . 7206 1 1070 . 1 1 95 95 LYS CB C 13 34.608 0.2 . 1 . . . . 95 LYS CB . 7206 1 1071 . 1 1 95 95 LYS CG C 13 24.805 0.2 . 1 . . . . 95 LYS CG . 7206 1 1072 . 1 1 95 95 LYS CD C 13 29.305 0.2 . 1 . . . . 95 LYS CD . 7206 1 1073 . 1 1 95 95 LYS CE C 13 42.023 0.2 . 1 . . . . 95 LYS CE . 7206 1 1074 . 1 1 95 95 LYS N N 15 122.629 0.1 . 1 . . . . 95 LYS N . 7206 1 1075 . 1 1 96 96 GLU H H 1 8.703 0.02 . 1 . . . . 96 GLU H . 7206 1 1076 . 1 1 96 96 GLU HA H 1 5.347 0.02 . 1 . . . . 96 GLU HA . 7206 1 1077 . 1 1 96 96 GLU HB2 H 1 2.105 0.02 . 1 . . . . 96 GLU HB2 . 7206 1 1078 . 1 1 96 96 GLU HB3 H 1 2.105 0.02 . 1 . . . . 96 GLU HB3 . 7206 1 1079 . 1 1 96 96 GLU HG2 H 1 2.42 0.02 . 1 . . . . 96 GLU HG2 . 7206 1 1080 . 1 1 96 96 GLU HG3 H 1 2.201 0.02 . 1 . . . . 96 GLU HG3 . 7206 1 1081 . 1 1 96 96 GLU C C 13 175.821 0.2 . 1 . . . . 96 GLU C . 7206 1 1082 . 1 1 96 96 GLU CA C 13 55.302 0.2 . 1 . . . . 96 GLU CA . 7206 1 1083 . 1 1 96 96 GLU CB C 13 33.526 0.2 . 1 . . . . 96 GLU CB . 7206 1 1084 . 1 1 96 96 GLU CG C 13 36.275 0.2 . 1 . . . . 96 GLU CG . 7206 1 1085 . 1 1 96 96 GLU N N 15 126.116 0.1 . 1 . . . . 96 GLU N . 7206 1 1086 . 1 1 97 97 LYS H H 1 8.84 0.02 . 1 . . . . 97 LYS H . 7206 1 1087 . 1 1 97 97 LYS HA H 1 4.807 0.02 . 1 . . . . 97 LYS HA . 7206 1 1088 . 1 1 97 97 LYS HB2 H 1 1.865 0.02 . 1 . . . . 97 LYS HB2 . 7206 1 1089 . 1 1 97 97 LYS HB3 H 1 1.865 0.02 . 1 . . . . 97 LYS HB3 . 7206 1 1090 . 1 1 97 97 LYS HG2 H 1 1.46 0.02 . 1 . . . . 97 LYS HG2 . 7206 1 1091 . 1 1 97 97 LYS HG3 H 1 1.46 0.02 . 1 . . . . 97 LYS HG3 . 7206 1 1092 . 1 1 97 97 LYS HD2 H 1 1.794 0.02 . 1 . . . . 97 LYS HD2 . 7206 1 1093 . 1 1 97 97 LYS HD3 H 1 1.794 0.02 . 1 . . . . 97 LYS HD3 . 7206 1 1094 . 1 1 97 97 LYS C C 13 174.813 0.2 . 1 . . . . 97 LYS C . 7206 1 1095 . 1 1 97 97 LYS CA C 13 55.392 0.2 . 1 . . . . 97 LYS CA . 7206 1 1096 . 1 1 97 97 LYS CB C 13 35.616 0.2 . 1 . . . . 97 LYS CB . 7206 1 1097 . 1 1 97 97 LYS CG C 13 24.751 0.2 . 1 . . . . 97 LYS CG . 7206 1 1098 . 1 1 97 97 LYS CD C 13 29.05 0.2 . 1 . . . . 97 LYS CD . 7206 1 1099 . 1 1 97 97 LYS CE C 13 41.976 0.2 . 1 . . . . 97 LYS CE . 7206 1 1100 . 1 1 97 97 LYS N N 15 125.044 0.1 . 1 . . . . 97 LYS N . 7206 1 1101 . 1 1 98 98 ARG H H 1 9.05 0.02 . 1 . . . . 98 ARG H . 7206 1 1102 . 1 1 98 98 ARG HA H 1 5.327 0.02 . 1 . . . . 98 ARG HA . 7206 1 1103 . 1 1 98 98 ARG HB2 H 1 2.036 0.02 . 1 . . . . 98 ARG HB2 . 7206 1 1104 . 1 1 98 98 ARG HB3 H 1 1.974 0.02 . 1 . . . . 98 ARG HB3 . 7206 1 1105 . 1 1 98 98 ARG HG2 H 1 1.832 0.02 . 1 . . . . 98 ARG HG2 . 7206 1 1106 . 1 1 98 98 ARG HG3 H 1 1.832 0.02 . 1 . . . . 98 ARG HG3 . 7206 1 1107 . 1 1 98 98 ARG HD2 H 1 3.273 0.02 . 1 . . . . 98 ARG HD2 . 7206 1 1108 . 1 1 98 98 ARG HD3 H 1 3.273 0.02 . 1 . . . . 98 ARG HD3 . 7206 1 1109 . 1 1 98 98 ARG C C 13 176.061 0.2 . 1 . . . . 98 ARG C . 7206 1 1110 . 1 1 98 98 ARG CA C 13 55.442 0.2 . 1 . . . . 98 ARG CA . 7206 1 1111 . 1 1 98 98 ARG CB C 13 30.658 0.2 . 1 . . . . 98 ARG CB . 7206 1 1112 . 1 1 98 98 ARG CG C 13 27.177 0.2 . 1 . . . . 98 ARG CG . 7206 1 1113 . 1 1 98 98 ARG CD C 13 43.182 0.2 . 1 . . . . 98 ARG CD . 7206 1 1114 . 1 1 98 98 ARG N N 15 127.954 0.1 . 1 . . . . 98 ARG N . 7206 1 1115 . 1 1 99 99 GLN H H 1 8.819 0.02 . 1 . . . . 99 GLN H . 7206 1 1116 . 1 1 99 99 GLN HA H 1 4.89 0.02 . 1 . . . . 99 GLN HA . 7206 1 1117 . 1 1 99 99 GLN HB2 H 1 2.361 0.02 . 1 . . . . 99 GLN HB2 . 7206 1 1118 . 1 1 99 99 GLN HB3 H 1 2.125 0.02 . 1 . . . . 99 GLN HB3 . 7206 1 1119 . 1 1 99 99 GLN HG2 H 1 1.85 0.02 . 1 . . . . 99 GLN HG2 . 7206 1 1120 . 1 1 99 99 GLN HG3 H 1 1.85 0.02 . 1 . . . . 99 GLN HG3 . 7206 1 1121 . 1 1 99 99 GLN HE21 H 1 7.452 0.02 . 1 . . . . 99 GLN HE21 . 7206 1 1122 . 1 1 99 99 GLN HE22 H 1 6.873 0.02 . 1 . . . . 99 GLN HE22 . 7206 1 1123 . 1 1 99 99 GLN C C 13 173.419 0.2 . 1 . . . . 99 GLN C . 7206 1 1124 . 1 1 99 99 GLN CA C 13 54.438 0.2 . 1 . . . . 99 GLN CA . 7206 1 1125 . 1 1 99 99 GLN CB C 13 34.044 0.2 . 1 . . . . 99 GLN CB . 7206 1 1126 . 1 1 99 99 GLN CG C 13 33.844 0.2 . 1 . . . . 99 GLN CG . 7206 1 1127 . 1 1 99 99 GLN N N 15 121.238 0.1 . 1 . . . . 99 GLN N . 7206 1 1128 . 1 1 100 100 ASN H H 1 8.693 0.02 . 1 . . . . 100 ASN H . 7206 1 1129 . 1 1 100 100 ASN HA H 1 5.803 0.02 . 1 . . . . 100 ASN HA . 7206 1 1130 . 1 1 100 100 ASN HB2 H 1 2.664 0.02 . 1 . . . . 100 ASN HB2 . 7206 1 1131 . 1 1 100 100 ASN HB3 H 1 2.519 0.02 . 1 . . . . 100 ASN HB3 . 7206 1 1132 . 1 1 100 100 ASN HD21 H 1 6.748 0.02 . 1 . . . . 100 ASN HD21 . 7206 1 1133 . 1 1 100 100 ASN HD22 H 1 7.419 0.02 . 1 . . . . 100 ASN HD22 . 7206 1 1134 . 1 1 100 100 ASN C C 13 174.784 0.2 . 1 . . . . 100 ASN C . 7206 1 1135 . 1 1 100 100 ASN CA C 13 52.537 0.2 . 1 . . . . 100 ASN CA . 7206 1 1136 . 1 1 100 100 ASN CB C 13 39.304 0.2 . 1 . . . . 100 ASN CB . 7206 1 1137 . 1 1 100 100 ASN N N 15 121.513 0.1 . 1 . . . . 100 ASN N . 7206 1 1138 . 1 1 101 101 LYS H H 1 8.616 0.02 . 1 . . . . 101 LYS H . 7206 1 1139 . 1 1 101 101 LYS HA H 1 4.904 0.02 . 1 . . . . 101 LYS HA . 7206 1 1140 . 1 1 101 101 LYS HB2 H 1 2.304 0.02 . 1 . . . . 101 LYS HB2 . 7206 1 1141 . 1 1 101 101 LYS HB3 H 1 1.61 0.02 . 1 . . . . 101 LYS HB3 . 7206 1 1142 . 1 1 101 101 LYS HG2 H 1 1.387 0.02 . 1 . . . . 101 LYS HG2 . 7206 1 1143 . 1 1 101 101 LYS HG3 H 1 1.387 0.02 . 1 . . . . 101 LYS HG3 . 7206 1 1144 . 1 1 101 101 LYS HD2 H 1 1.792 0.02 . 1 . . . . 101 LYS HD2 . 7206 1 1145 . 1 1 101 101 LYS HD3 H 1 1.792 0.02 . 1 . . . . 101 LYS HD3 . 7206 1 1146 . 1 1 101 101 LYS HE2 H 1 2.581 0.02 . 1 . . . . 101 LYS HE2 . 7206 1 1147 . 1 1 101 101 LYS HE3 H 1 2.581 0.02 . 1 . . . . 101 LYS HE3 . 7206 1 1148 . 1 1 101 101 LYS C C 13 176.598 0.2 . 1 . . . . 101 LYS C . 7206 1 1149 . 1 1 101 101 LYS CA C 13 54.306 0.2 . 1 . . . . 101 LYS CA . 7206 1 1150 . 1 1 101 101 LYS CB C 13 39.182 0.2 . 1 . . . . 101 LYS CB . 7206 1 1151 . 1 1 101 101 LYS CG C 13 25.573 0.2 . 1 . . . . 101 LYS CG . 7206 1 1152 . 1 1 101 101 LYS CD C 13 29.014 0.2 . 1 . . . . 101 LYS CD . 7206 1 1153 . 1 1 101 101 LYS CE C 13 42.213 0.2 . 1 . . . . 101 LYS CE . 7206 1 1154 . 1 1 101 101 LYS N N 15 121.968 0.1 . 1 . . . . 101 LYS N . 7206 1 1155 . 1 1 102 102 SER H H 1 8.774 0.02 . 1 . . . . 102 SER H . 7206 1 1156 . 1 1 102 102 SER HA H 1 4.549 0.02 . 1 . . . . 102 SER HA . 7206 1 1157 . 1 1 102 102 SER HB2 H 1 3.679 0.02 . 1 . . . . 102 SER HB2 . 7206 1 1158 . 1 1 102 102 SER HB3 H 1 3.621 0.02 . 1 . . . . 102 SER HB3 . 7206 1 1159 . 1 1 102 102 SER C C 13 171.681 0.2 . 1 . . . . 102 SER C . 7206 1 1160 . 1 1 102 102 SER CA C 13 59.311 0.2 . 1 . . . . 102 SER CA . 7206 1 1161 . 1 1 102 102 SER CB C 13 63.398 0.2 . 1 . . . . 102 SER CB . 7206 1 1162 . 1 1 102 102 SER N N 15 117.516 0.1 . 1 . . . . 102 SER N . 7206 1 1163 . 1 1 103 103 TYR H H 1 7.737 0.02 . 1 . . . . 103 TYR H . 7206 1 1164 . 1 1 103 103 TYR HA H 1 5.409 0.02 . 1 . . . . 103 TYR HA . 7206 1 1165 . 1 1 103 103 TYR HB2 H 1 3.027 0.02 . 1 . . . . 103 TYR HB2 . 7206 1 1166 . 1 1 103 103 TYR HB3 H 1 2.681 0.02 . 1 . . . . 103 TYR HB3 . 7206 1 1167 . 1 1 103 103 TYR HD1 H 1 6.927 0.02 . 1 . . . . 103 TYR HD1 . 7206 1 1168 . 1 1 103 103 TYR HD2 H 1 6.927 0.02 . 1 . . . . 103 TYR HD2 . 7206 1 1169 . 1 1 103 103 TYR HE1 H 1 6.752 0.02 . 1 . . . . 103 TYR HE1 . 7206 1 1170 . 1 1 103 103 TYR HE2 H 1 6.752 0.02 . 1 . . . . 103 TYR HE2 . 7206 1 1171 . 1 1 103 103 TYR C C 13 172.093 0.2 . 1 . . . . 103 TYR C . 7206 1 1172 . 1 1 103 103 TYR CA C 13 55.304 0.2 . 1 . . . . 103 TYR CA . 7206 1 1173 . 1 1 103 103 TYR CB C 13 41.488 0.2 . 1 . . . . 103 TYR CB . 7206 1 1174 . 1 1 103 103 TYR N N 15 114.24 0.1 . 1 . . . . 103 TYR N . 7206 1 1175 . 1 1 104 104 VAL H H 1 8.665 0.02 . 1 . . . . 104 VAL H . 7206 1 1176 . 1 1 104 104 VAL HA H 1 5.15 0.02 . 1 . . . . 104 VAL HA . 7206 1 1177 . 1 1 104 104 VAL HB H 1 1.968 0.02 . 1 . . . . 104 VAL HB . 7206 1 1178 . 1 1 104 104 VAL HG11 H 1 0.917 0.02 . 1 . . . . 104 VAL HG1 . 7206 1 1179 . 1 1 104 104 VAL HG12 H 1 0.917 0.02 . 1 . . . . 104 VAL HG1 . 7206 1 1180 . 1 1 104 104 VAL HG13 H 1 0.917 0.02 . 1 . . . . 104 VAL HG1 . 7206 1 1181 . 1 1 104 104 VAL HG21 H 1 0.758 0.02 . 1 . . . . 104 VAL HG2 . 7206 1 1182 . 1 1 104 104 VAL HG22 H 1 0.758 0.02 . 1 . . . . 104 VAL HG2 . 7206 1 1183 . 1 1 104 104 VAL HG23 H 1 0.758 0.02 . 1 . . . . 104 VAL HG2 . 7206 1 1184 . 1 1 104 104 VAL C C 13 176.659 0.2 . 1 . . . . 104 VAL C . 7206 1 1185 . 1 1 104 104 VAL CA C 13 60.252 0.2 . 1 . . . . 104 VAL CA . 7206 1 1186 . 1 1 104 104 VAL CB C 13 34.613 0.2 . 1 . . . . 104 VAL CB . 7206 1 1187 . 1 1 104 104 VAL CG1 C 13 22.935 0.2 . 1 . . . . 104 VAL CG1 . 7206 1 1188 . 1 1 104 104 VAL CG2 C 13 20.813 0.2 . 1 . . . . 104 VAL CG2 . 7206 1 1189 . 1 1 104 104 VAL N N 15 118.748 0.1 . 1 . . . . 104 VAL N . 7206 1 1190 . 1 1 105 105 VAL H H 1 8.899 0.02 . 1 . . . . 105 VAL H . 7206 1 1191 . 1 1 105 105 VAL HA H 1 5.422 0.02 . 1 . . . . 105 VAL HA . 7206 1 1192 . 1 1 105 105 VAL HB H 1 2.068 0.02 . 1 . . . . 105 VAL HB . 7206 1 1193 . 1 1 105 105 VAL HG11 H 1 1.089 0.02 . 1 . . . . 105 VAL HG1 . 7206 1 1194 . 1 1 105 105 VAL HG12 H 1 1.089 0.02 . 1 . . . . 105 VAL HG1 . 7206 1 1195 . 1 1 105 105 VAL HG13 H 1 1.089 0.02 . 1 . . . . 105 VAL HG1 . 7206 1 1196 . 1 1 105 105 VAL HG21 H 1 0.897 0.02 . 1 . . . . 105 VAL HG2 . 7206 1 1197 . 1 1 105 105 VAL HG22 H 1 0.897 0.02 . 1 . . . . 105 VAL HG2 . 7206 1 1198 . 1 1 105 105 VAL HG23 H 1 0.897 0.02 . 1 . . . . 105 VAL HG2 . 7206 1 1199 . 1 1 105 105 VAL C C 13 174.531 0.2 . 1 . . . . 105 VAL C . 7206 1 1200 . 1 1 105 105 VAL CA C 13 57.838 0.2 . 1 . . . . 105 VAL CA . 7206 1 1201 . 1 1 105 105 VAL CB C 13 34.694 0.2 . 1 . . . . 105 VAL CB . 7206 1 1202 . 1 1 105 105 VAL CG1 C 13 22.836 0.2 . 1 . . . . 105 VAL CG1 . 7206 1 1203 . 1 1 105 105 VAL CG2 C 13 18.474 0.2 . 1 . . . . 105 VAL CG2 . 7206 1 1204 . 1 1 105 105 VAL N N 15 118.16 0.1 . 1 . . . . 105 VAL N . 7206 1 1205 . 1 1 106 106 ALA H H 1 8.756 0.02 . 1 . . . . 106 ALA H . 7206 1 1206 . 1 1 106 106 ALA HA H 1 5.314 0.02 . 1 . . . . 106 ALA HA . 7206 1 1207 . 1 1 106 106 ALA HB1 H 1 1.574 0.02 . 1 . . . . 106 ALA HB . 7206 1 1208 . 1 1 106 106 ALA HB2 H 1 1.574 0.02 . 1 . . . . 106 ALA HB . 7206 1 1209 . 1 1 106 106 ALA HB3 H 1 1.574 0.02 . 1 . . . . 106 ALA HB . 7206 1 1210 . 1 1 106 106 ALA C C 13 178.123 0.2 . 1 . . . . 106 ALA C . 7206 1 1211 . 1 1 106 106 ALA CA C 13 51.242 0.2 . 1 . . . . 106 ALA CA . 7206 1 1212 . 1 1 106 106 ALA CB C 13 20.806 0.2 . 1 . . . . 106 ALA CB . 7206 1 1213 . 1 1 106 106 ALA N N 15 124.799 0.1 . 1 . . . . 106 ALA N . 7206 1 1214 . 1 1 107 107 CYS H H 1 8.676 0.02 . 1 . . . . 107 CYS H . 7206 1 1215 . 1 1 107 107 CYS HA H 1 6.011 0.02 . 1 . . . . 107 CYS HA . 7206 1 1216 . 1 1 107 107 CYS HB2 H 1 3.521 0.02 . 1 . . . . 107 CYS HB2 . 7206 1 1217 . 1 1 107 107 CYS HB3 H 1 2.62 0.02 . 1 . . . . 107 CYS HB3 . 7206 1 1218 . 1 1 107 107 CYS C C 13 172.734 0.2 . 1 . . . . 107 CYS C . 7206 1 1219 . 1 1 107 107 CYS CA C 13 55.265 0.2 . 1 . . . . 107 CYS CA . 7206 1 1220 . 1 1 107 107 CYS CB C 13 50.333 0.2 . 1 . . . . 107 CYS CB . 7206 1 1221 . 1 1 107 107 CYS N N 15 117.842 0.1 . 1 . . . . 107 CYS N . 7206 1 1222 . 1 1 108 108 LYS H H 1 8.947 0.02 . 1 . . . . 108 LYS H . 7206 1 1223 . 1 1 108 108 LYS HA H 1 4.924 0.02 . 1 . . . . 108 LYS HA . 7206 1 1224 . 1 1 108 108 LYS HB2 H 1 2.041 0.02 . 1 . . . . 108 LYS HB2 . 7206 1 1225 . 1 1 108 108 LYS HB3 H 1 1.692 0.02 . 1 . . . . 108 LYS HB3 . 7206 1 1226 . 1 1 108 108 LYS HG2 H 1 1.528 0.02 . 1 . . . . 108 LYS HG2 . 7206 1 1227 . 1 1 108 108 LYS HG3 H 1 1.528 0.02 . 1 . . . . 108 LYS HG3 . 7206 1 1228 . 1 1 108 108 LYS C C 13 172.529 0.2 . 1 . . . . 108 LYS C . 7206 1 1229 . 1 1 108 108 LYS CA C 13 54.362 0.2 . 1 . . . . 108 LYS CA . 7206 1 1230 . 1 1 108 108 LYS CB C 13 35.866 0.2 . 1 . . . . 108 LYS CB . 7206 1 1231 . 1 1 108 108 LYS CG C 13 25.17 0.2 . 1 . . . . 108 LYS CG . 7206 1 1232 . 1 1 108 108 LYS N N 15 122.692 0.1 . 1 . . . . 108 LYS N . 7206 1 1233 . 1 1 110 110 PRO HA H 1 4.45 0.02 . 1 . . . . 110 PRO HA . 7206 1 1234 . 1 1 110 110 PRO HB2 H 1 2.301 0.02 . 1 . . . . 110 PRO HB2 . 7206 1 1235 . 1 1 110 110 PRO HB3 H 1 2.301 0.02 . 1 . . . . 110 PRO HB3 . 7206 1 1236 . 1 1 110 110 PRO HG2 H 1 2.13 0.02 . 1 . . . . 110 PRO HG2 . 7206 1 1237 . 1 1 110 110 PRO HG3 H 1 2.13 0.02 . 1 . . . . 110 PRO HG3 . 7206 1 1238 . 1 1 110 110 PRO HD2 H 1 3.879 0.02 . 1 . . . . 110 PRO HD2 . 7206 1 1239 . 1 1 110 110 PRO HD3 H 1 3.879 0.02 . 1 . . . . 110 PRO HD3 . 7206 1 1240 . 1 1 110 110 PRO C C 13 177.075 0.2 . 1 . . . . 110 PRO C . 7206 1 1241 . 1 1 110 110 PRO CA C 13 62.689 0.2 . 1 . . . . 110 PRO CA . 7206 1 1242 . 1 1 110 110 PRO CB C 13 32.619 0.2 . 1 . . . . 110 PRO CB . 7206 1 1243 . 1 1 110 110 PRO CG C 13 27.326 0.2 . 1 . . . . 110 PRO CG . 7206 1 1244 . 1 1 110 110 PRO CD C 13 51.057 0.2 . 1 . . . . 110 PRO CD . 7206 1 1245 . 1 1 111 111 GLN H H 1 9.389 0.02 . 1 . . . . 111 GLN H . 7206 1 1246 . 1 1 111 111 GLN HA H 1 4.458 0.02 . 1 . . . . 111 GLN HA . 7206 1 1247 . 1 1 111 111 GLN HB2 H 1 2.525 0.02 . 1 . . . . 111 GLN HB2 . 7206 1 1248 . 1 1 111 111 GLN HB3 H 1 2.046 0.02 . 1 . . . . 111 GLN HB3 . 7206 1 1249 . 1 1 111 111 GLN HG2 H 1 2.676 0.02 . 1 . . . . 111 GLN HG2 . 7206 1 1250 . 1 1 111 111 GLN HG3 H 1 2.676 0.02 . 1 . . . . 111 GLN HG3 . 7206 1 1251 . 1 1 111 111 GLN HE21 H 1 7.086 0.02 . 1 . . . . 111 GLN HE21 . 7206 1 1252 . 1 1 111 111 GLN HE22 H 1 7.706 0.02 . 1 . . . . 111 GLN HE22 . 7206 1 1253 . 1 1 111 111 GLN C C 13 177.6 0.2 . 1 . . . . 111 GLN C . 7206 1 1254 . 1 1 111 111 GLN CA C 13 55.397 0.2 . 1 . . . . 111 GLN CA . 7206 1 1255 . 1 1 111 111 GLN CB C 13 30.137 0.2 . 1 . . . . 111 GLN CB . 7206 1 1256 . 1 1 111 111 GLN CG C 13 35.164 0.2 . 1 . . . . 111 GLN CG . 7206 1 1257 . 1 1 111 111 GLN N N 15 120.881 0.1 . 1 . . . . 111 GLN N . 7206 1 1258 . 1 1 112 112 LYS H H 1 8.506 0.02 . 1 . . . . 112 LYS H . 7206 1 1259 . 1 1 112 112 LYS HA H 1 4.118 0.02 . 1 . . . . 112 LYS HA . 7206 1 1260 . 1 1 112 112 LYS HB2 H 1 1.93 0.02 . 1 . . . . 112 LYS HB2 . 7206 1 1261 . 1 1 112 112 LYS HB3 H 1 1.93 0.02 . 1 . . . . 112 LYS HB3 . 7206 1 1262 . 1 1 112 112 LYS HG2 H 1 1.537 0.02 . 1 . . . . 112 LYS HG2 . 7206 1 1263 . 1 1 112 112 LYS HG3 H 1 1.537 0.02 . 1 . . . . 112 LYS HG3 . 7206 1 1264 . 1 1 112 112 LYS HD2 H 1 1.751 0.02 . 1 . . . . 112 LYS HD2 . 7206 1 1265 . 1 1 112 112 LYS HD3 H 1 1.751 0.02 . 1 . . . . 112 LYS HD3 . 7206 1 1266 . 1 1 112 112 LYS HE2 H 1 3.065 0.02 . 1 . . . . 112 LYS HE2 . 7206 1 1267 . 1 1 112 112 LYS HE3 H 1 3.065 0.02 . 1 . . . . 112 LYS HE3 . 7206 1 1268 . 1 1 112 112 LYS C C 13 177.796 0.2 . 1 . . . . 112 LYS C . 7206 1 1269 . 1 1 112 112 LYS CA C 13 59.257 0.2 . 1 . . . . 112 LYS CA . 7206 1 1270 . 1 1 112 112 LYS CB C 13 32.289 0.2 . 1 . . . . 112 LYS CB . 7206 1 1271 . 1 1 112 112 LYS CG C 13 24.922 0.2 . 1 . . . . 112 LYS CG . 7206 1 1272 . 1 1 112 112 LYS CD C 13 28.907 0.2 . 1 . . . . 112 LYS CD . 7206 1 1273 . 1 1 112 112 LYS CE C 13 42.08 0.2 . 1 . . . . 112 LYS CE . 7206 1 1274 . 1 1 112 112 LYS N N 15 121.598 0.1 . 1 . . . . 112 LYS N . 7206 1 1275 . 1 1 113 113 LYS H H 1 7.934 0.02 . 1 . . . . 113 LYS H . 7206 1 1276 . 1 1 113 113 LYS HA H 1 4.308 0.02 . 1 . . . . 113 LYS HA . 7206 1 1277 . 1 1 113 113 LYS HB2 H 1 1.978 0.02 . 1 . . . . 113 LYS HB2 . 7206 1 1278 . 1 1 113 113 LYS HB3 H 1 1.745 0.02 . 1 . . . . 113 LYS HB3 . 7206 1 1279 . 1 1 113 113 LYS HG2 H 1 1.498 0.02 . 1 . . . . 113 LYS HG2 . 7206 1 1280 . 1 1 113 113 LYS HG3 H 1 1.498 0.02 . 1 . . . . 113 LYS HG3 . 7206 1 1281 . 1 1 113 113 LYS HD2 H 1 1.732 0.02 . 1 . . . . 113 LYS HD2 . 7206 1 1282 . 1 1 113 113 LYS HD3 H 1 1.732 0.02 . 1 . . . . 113 LYS HD3 . 7206 1 1283 . 1 1 113 113 LYS HE2 H 1 3.054 0.02 . 1 . . . . 113 LYS HE2 . 7206 1 1284 . 1 1 113 113 LYS HE3 H 1 3.054 0.02 . 1 . . . . 113 LYS HE3 . 7206 1 1285 . 1 1 113 113 LYS C C 13 177.008 0.2 . 1 . . . . 113 LYS C . 7206 1 1286 . 1 1 113 113 LYS CA C 13 56.868 0.2 . 1 . . . . 113 LYS CA . 7206 1 1287 . 1 1 113 113 LYS CB C 13 32.121 0.2 . 1 . . . . 113 LYS CB . 7206 1 1288 . 1 1 113 113 LYS CG C 13 25.319 0.2 . 1 . . . . 113 LYS CG . 7206 1 1289 . 1 1 113 113 LYS CD C 13 28.899 0.2 . 1 . . . . 113 LYS CD . 7206 1 1290 . 1 1 113 113 LYS CE C 13 42.023 0.2 . 1 . . . . 113 LYS CE . 7206 1 1291 . 1 1 113 113 LYS N N 15 114.584 0.1 . 1 . . . . 113 LYS N . 7206 1 1292 . 1 1 114 114 ASP H H 1 7.694 0.02 . 1 . . . . 114 ASP H . 7206 1 1293 . 1 1 114 114 ASP HA H 1 4.83 0.02 . 1 . . . . 114 ASP HA . 7206 1 1294 . 1 1 114 114 ASP HB2 H 1 2.988 0.02 . 1 . . . . 114 ASP HB2 . 7206 1 1295 . 1 1 114 114 ASP HB3 H 1 2.988 0.02 . 1 . . . . 114 ASP HB3 . 7206 1 1296 . 1 1 114 114 ASP C C 13 176.712 0.2 . 1 . . . . 114 ASP C . 7206 1 1297 . 1 1 114 114 ASP CA C 13 54.624 0.2 . 1 . . . . 114 ASP CA . 7206 1 1298 . 1 1 114 114 ASP CB C 13 42.61 0.2 . 1 . . . . 114 ASP CB . 7206 1 1299 . 1 1 114 114 ASP N N 15 118.913 0.1 . 1 . . . . 114 ASP N . 7206 1 1300 . 1 1 115 115 SER H H 1 8.326 0.02 . 1 . . . . 115 SER H . 7206 1 1301 . 1 1 115 115 SER HA H 1 4.449 0.02 . 1 . . . . 115 SER HA . 7206 1 1302 . 1 1 115 115 SER HB2 H 1 4.149 0.02 . 1 . . . . 115 SER HB2 . 7206 1 1303 . 1 1 115 115 SER HB3 H 1 3.993 0.02 . 1 . . . . 115 SER HB3 . 7206 1 1304 . 1 1 115 115 SER C C 13 175.541 0.2 . 1 . . . . 115 SER C . 7206 1 1305 . 1 1 115 115 SER CA C 13 58.995 0.2 . 1 . . . . 115 SER CA . 7206 1 1306 . 1 1 115 115 SER CB C 13 63.457 0.2 . 1 . . . . 115 SER CB . 7206 1 1307 . 1 1 115 115 SER N N 15 114.08 0.1 . 1 . . . . 115 SER N . 7206 1 1308 . 1 1 116 116 GLN H H 1 8.53 0.02 . 1 . . . . 116 GLN H . 7206 1 1309 . 1 1 116 116 GLN HA H 1 4.33 0.02 . 1 . . . . 116 GLN HA . 7206 1 1310 . 1 1 116 116 GLN HB2 H 1 2.374 0.02 . 1 . . . . 116 GLN HB2 . 7206 1 1311 . 1 1 116 116 GLN HB3 H 1 1.883 0.02 . 1 . . . . 116 GLN HB3 . 7206 1 1312 . 1 1 116 116 GLN HG2 H 1 2.424 0.02 . 1 . . . . 116 GLN HG2 . 7206 1 1313 . 1 1 116 116 GLN HG3 H 1 2.424 0.02 . 1 . . . . 116 GLN HG3 . 7206 1 1314 . 1 1 116 116 GLN HE21 H 1 6.454 0.02 . 1 . . . . 116 GLN HE21 . 7206 1 1315 . 1 1 116 116 GLN HE22 H 1 7.331 0.02 . 1 . . . . 116 GLN HE22 . 7206 1 1316 . 1 1 116 116 GLN C C 13 176.071 0.2 . 1 . . . . 116 GLN C . 7206 1 1317 . 1 1 116 116 GLN CA C 13 54.785 0.2 . 1 . . . . 116 GLN CA . 7206 1 1318 . 1 1 116 116 GLN CB C 13 28.455 0.2 . 1 . . . . 116 GLN CB . 7206 1 1319 . 1 1 116 116 GLN CG C 13 33.702 0.2 . 1 . . . . 116 GLN CG . 7206 1 1320 . 1 1 116 116 GLN N N 15 121.439 0.1 . 1 . . . . 116 GLN N . 7206 1 1321 . 1 1 117 117 GLN H H 1 8.077 0.02 . 1 . . . . 117 GLN H . 7206 1 1322 . 1 1 117 117 GLN HA H 1 3.874 0.02 . 1 . . . . 117 GLN HA . 7206 1 1323 . 1 1 117 117 GLN HB2 H 1 1.716 0.02 . 1 . . . . 117 GLN HB2 . 7206 1 1324 . 1 1 117 117 GLN HB3 H 1 1.541 0.02 . 1 . . . . 117 GLN HB3 . 7206 1 1325 . 1 1 117 117 GLN HG2 H 1 1.943 0.02 . 1 . . . . 117 GLN HG2 . 7206 1 1326 . 1 1 117 117 GLN HG3 H 1 1.647 0.02 . 1 . . . . 117 GLN HG3 . 7206 1 1327 . 1 1 117 117 GLN HE21 H 1 6.788 0.02 . 1 . . . . 117 GLN HE21 . 7206 1 1328 . 1 1 117 117 GLN HE22 H 1 7.295 0.02 . 1 . . . . 117 GLN HE22 . 7206 1 1329 . 1 1 117 117 GLN C C 13 175.209 0.2 . 1 . . . . 117 GLN C . 7206 1 1330 . 1 1 117 117 GLN CA C 13 57.676 0.2 . 1 . . . . 117 GLN CA . 7206 1 1331 . 1 1 117 117 GLN CB C 13 28.618 0.2 . 1 . . . . 117 GLN CB . 7206 1 1332 . 1 1 117 117 GLN CG C 13 32.969 0.2 . 1 . . . . 117 GLN CG . 7206 1 1333 . 1 1 117 117 GLN N N 15 119.237 0.1 . 1 . . . . 117 GLN N . 7206 1 1334 . 1 1 118 118 PHE H H 1 7.707 0.02 . 1 . . . . 118 PHE H . 7206 1 1335 . 1 1 118 118 PHE HA H 1 4.78 0.02 . 1 . . . . 118 PHE HA . 7206 1 1336 . 1 1 118 118 PHE HB2 H 1 3.246 0.02 . 1 . . . . 118 PHE HB2 . 7206 1 1337 . 1 1 118 118 PHE HB3 H 1 2.655 0.02 . 1 . . . . 118 PHE HB3 . 7206 1 1338 . 1 1 118 118 PHE HD1 H 1 7.295 0.02 . 1 . . . . 118 PHE HD1 . 7206 1 1339 . 1 1 118 118 PHE HD2 H 1 7.295 0.02 . 1 . . . . 118 PHE HD2 . 7206 1 1340 . 1 1 118 118 PHE HE1 H 1 7.391 0.02 . 1 . . . . 118 PHE HE1 . 7206 1 1341 . 1 1 118 118 PHE HE2 H 1 7.391 0.02 . 1 . . . . 118 PHE HE2 . 7206 1 1342 . 1 1 118 118 PHE C C 13 175.927 0.2 . 1 . . . . 118 PHE C . 7206 1 1343 . 1 1 118 118 PHE CA C 13 55.794 0.2 . 1 . . . . 118 PHE CA . 7206 1 1344 . 1 1 118 118 PHE CB C 13 40.825 0.2 . 1 . . . . 118 PHE CB . 7206 1 1345 . 1 1 118 118 PHE N N 15 115.96 0.1 . 1 . . . . 118 PHE N . 7206 1 1346 . 1 1 119 119 HIS H H 1 9.014 0.02 . 1 . . . . 119 HIS H . 7206 1 1347 . 1 1 119 119 HIS HA H 1 4.547 0.02 . 1 . . . . 119 HIS HA . 7206 1 1348 . 1 1 119 119 HIS HB2 H 1 3.368 0.02 . 1 . . . . 119 HIS HB2 . 7206 1 1349 . 1 1 119 119 HIS HB3 H 1 3.243 0.02 . 1 . . . . 119 HIS HB3 . 7206 1 1350 . 1 1 119 119 HIS HD2 H 1 7.354 0.02 . 1 . . . . 119 HIS HD2 . 7206 1 1351 . 1 1 119 119 HIS C C 13 174.164 0.2 . 1 . . . . 119 HIS C . 7206 1 1352 . 1 1 119 119 HIS CA C 13 56.812 0.2 . 1 . . . . 119 HIS CA . 7206 1 1353 . 1 1 119 119 HIS CB C 13 28.438 0.2 . 1 . . . . 119 HIS CB . 7206 1 1354 . 1 1 119 119 HIS N N 15 119.415 0.1 . 1 . . . . 119 HIS N . 7206 1 1355 . 1 1 120 120 LEU H H 1 7.322 0.02 . 1 . . . . 120 LEU H . 7206 1 1356 . 1 1 120 120 LEU HA H 1 4.54 0.02 . 1 . . . . 120 LEU HA . 7206 1 1357 . 1 1 120 120 LEU HB2 H 1 1.439 0.02 . 1 . . . . 120 LEU HB2 . 7206 1 1358 . 1 1 120 120 LEU HB3 H 1 0.971 0.02 . 1 . . . . 120 LEU HB3 . 7206 1 1359 . 1 1 120 120 LEU HD11 H 1 0.774 0.02 . 1 . . . . 120 LEU HD1 . 7206 1 1360 . 1 1 120 120 LEU HD12 H 1 0.774 0.02 . 1 . . . . 120 LEU HD1 . 7206 1 1361 . 1 1 120 120 LEU HD13 H 1 0.774 0.02 . 1 . . . . 120 LEU HD1 . 7206 1 1362 . 1 1 120 120 LEU HD21 H 1 0.795 0.02 . 1 . . . . 120 LEU HD2 . 7206 1 1363 . 1 1 120 120 LEU HD22 H 1 0.795 0.02 . 1 . . . . 120 LEU HD2 . 7206 1 1364 . 1 1 120 120 LEU HD23 H 1 0.795 0.02 . 1 . . . . 120 LEU HD2 . 7206 1 1365 . 1 1 120 120 LEU C C 13 174.957 0.2 . 1 . . . . 120 LEU C . 7206 1 1366 . 1 1 120 120 LEU CA C 13 53.839 0.2 . 1 . . . . 120 LEU CA . 7206 1 1367 . 1 1 120 120 LEU CB C 13 47.917 0.2 . 1 . . . . 120 LEU CB . 7206 1 1368 . 1 1 120 120 LEU CG C 13 26.761 0.2 . 1 . . . . 120 LEU CG . 7206 1 1369 . 1 1 120 120 LEU CD1 C 13 26.288 0.2 . 1 . . . . 120 LEU CD1 . 7206 1 1370 . 1 1 120 120 LEU CD2 C 13 23.124 0.2 . 1 . . . . 120 LEU CD2 . 7206 1 1371 . 1 1 120 120 LEU N N 15 115.574 0.1 . 1 . . . . 120 LEU N . 7206 1 1372 . 1 1 121 121 VAL H H 1 9.067 0.02 . 1 . . . . 121 VAL H . 7206 1 1373 . 1 1 121 121 VAL HA H 1 4.838 0.02 . 1 . . . . 121 VAL HA . 7206 1 1374 . 1 1 121 121 VAL HB H 1 2.272 0.02 . 1 . . . . 121 VAL HB . 7206 1 1375 . 1 1 121 121 VAL HG11 H 1 1.122 0.02 . 1 . . . . 121 VAL HG1 . 7206 1 1376 . 1 1 121 121 VAL HG12 H 1 1.122 0.02 . 1 . . . . 121 VAL HG1 . 7206 1 1377 . 1 1 121 121 VAL HG13 H 1 1.122 0.02 . 1 . . . . 121 VAL HG1 . 7206 1 1378 . 1 1 121 121 VAL HG21 H 1 0.911 0.02 . 1 . . . . 121 VAL HG2 . 7206 1 1379 . 1 1 121 121 VAL HG22 H 1 0.911 0.02 . 1 . . . . 121 VAL HG2 . 7206 1 1380 . 1 1 121 121 VAL HG23 H 1 0.911 0.02 . 1 . . . . 121 VAL HG2 . 7206 1 1381 . 1 1 121 121 VAL C C 13 173.097 0.2 . 1 . . . . 121 VAL C . 7206 1 1382 . 1 1 121 121 VAL CA C 13 56.849 0.2 . 1 . . . . 121 VAL CA . 7206 1 1383 . 1 1 121 121 VAL CB C 13 33.693 0.2 . 1 . . . . 121 VAL CB . 7206 1 1384 . 1 1 121 121 VAL CG1 C 13 23.64 0.2 . 1 . . . . 121 VAL CG1 . 7206 1 1385 . 1 1 121 121 VAL CG2 C 13 17.872 0.2 . 1 . . . . 121 VAL CG2 . 7206 1 1386 . 1 1 121 121 VAL N N 15 112.005 0.1 . 1 . . . . 121 VAL N . 7206 1 1387 . 1 1 122 122 PRO HA H 1 4.762 0.02 . 1 . . . . 122 PRO HA . 7206 1 1388 . 1 1 122 122 PRO HB2 H 1 1.106 0.02 . 1 . . . . 122 PRO HB2 . 7206 1 1389 . 1 1 122 122 PRO HB3 H 1 0.211 0.02 . 1 . . . . 122 PRO HB3 . 7206 1 1390 . 1 1 122 122 PRO HG2 H 1 1.342 0.02 . 1 . . . . 122 PRO HG2 . 7206 1 1391 . 1 1 122 122 PRO HG3 H 1 1.699 0.02 . 1 . . . . 122 PRO HG3 . 7206 1 1392 . 1 1 122 122 PRO HD2 H 1 3.55 0.02 . 1 . . . . 122 PRO HD2 . 7206 1 1393 . 1 1 122 122 PRO HD3 H 1 3.55 0.02 . 1 . . . . 122 PRO HD3 . 7206 1 1394 . 1 1 122 122 PRO C C 13 176.312 0.2 . 1 . . . . 122 PRO C . 7206 1 1395 . 1 1 122 122 PRO CA C 13 61.483 0.2 . 1 . . . . 122 PRO CA . 7206 1 1396 . 1 1 122 122 PRO CB C 13 30.503 0.2 . 1 . . . . 122 PRO CB . 7206 1 1397 . 1 1 122 122 PRO CG C 13 28.052 0.2 . 1 . . . . 122 PRO CG . 7206 1 1398 . 1 1 122 122 PRO CD C 13 49.383 0.2 . 1 . . . . 122 PRO CD . 7206 1 1399 . 1 1 123 123 VAL H H 1 8.784 0.02 . 1 . . . . 123 VAL H . 7206 1 1400 . 1 1 123 123 VAL HA H 1 4.476 0.02 . 1 . . . . 123 VAL HA . 7206 1 1401 . 1 1 123 123 VAL HB H 1 2.252 0.02 . 1 . . . . 123 VAL HB . 7206 1 1402 . 1 1 123 123 VAL HG11 H 1 0.893 0.02 . 1 . . . . 123 VAL HG1 . 7206 1 1403 . 1 1 123 123 VAL HG12 H 1 0.893 0.02 . 1 . . . . 123 VAL HG1 . 7206 1 1404 . 1 1 123 123 VAL HG13 H 1 0.893 0.02 . 1 . . . . 123 VAL HG1 . 7206 1 1405 . 1 1 123 123 VAL HG21 H 1 0.724 0.02 . 1 . . . . 123 VAL HG2 . 7206 1 1406 . 1 1 123 123 VAL HG22 H 1 0.724 0.02 . 1 . . . . 123 VAL HG2 . 7206 1 1407 . 1 1 123 123 VAL HG23 H 1 0.724 0.02 . 1 . . . . 123 VAL HG2 . 7206 1 1408 . 1 1 123 123 VAL C C 13 175.575 0.2 . 1 . . . . 123 VAL C . 7206 1 1409 . 1 1 123 123 VAL CA C 13 60.786 0.2 . 1 . . . . 123 VAL CA . 7206 1 1410 . 1 1 123 123 VAL CB C 13 34.035 0.2 . 1 . . . . 123 VAL CB . 7206 1 1411 . 1 1 123 123 VAL CG1 C 13 23.059 0.2 . 1 . . . . 123 VAL CG1 . 7206 1 1412 . 1 1 123 123 VAL CG2 C 13 18.267 0.2 . 1 . . . . 123 VAL CG2 . 7206 1 1413 . 1 1 123 123 VAL N N 15 109.692 0.1 . 1 . . . . 123 VAL N . 7206 1 1414 . 1 1 124 124 HIS H H 1 7.386 0.02 . 1 . . . . 124 HIS H . 7206 1 1415 . 1 1 124 124 HIS HA H 1 5.598 0.02 . 1 . . . . 124 HIS HA . 7206 1 1416 . 1 1 124 124 HIS HB2 H 1 3.423 0.02 . 1 . . . . 124 HIS HB2 . 7206 1 1417 . 1 1 124 124 HIS HB3 H 1 3.229 0.02 . 1 . . . . 124 HIS HB3 . 7206 1 1418 . 1 1 124 124 HIS HD2 H 1 7.317 0.02 . 1 . . . . 124 HIS HD2 . 7206 1 1419 . 1 1 124 124 HIS HE1 H 1 8.673 0.02 . 1 . . . . 124 HIS HE1 . 7206 1 1420 . 1 1 124 124 HIS C C 13 173.622 0.2 . 1 . . . . 124 HIS C . 7206 1 1421 . 1 1 124 124 HIS CA C 13 55.543 0.2 . 1 . . . . 124 HIS CA . 7206 1 1422 . 1 1 124 124 HIS CB C 13 32.593 0.2 . 1 . . . . 124 HIS CB . 7206 1 1423 . 1 1 124 124 HIS N N 15 116.522 0.1 . 1 . . . . 124 HIS N . 7206 1 1424 . 1 1 125 125 LEU H H 1 9.374 0.02 . 1 . . . . 125 LEU H . 7206 1 1425 . 1 1 125 125 LEU HA H 1 4.714 0.02 . 1 . . . . 125 LEU HA . 7206 1 1426 . 1 1 125 125 LEU HB2 H 1 1.633 0.02 . 1 . . . . 125 LEU HB2 . 7206 1 1427 . 1 1 125 125 LEU HB3 H 1 0.369 0.02 . 1 . . . . 125 LEU HB3 . 7206 1 1428 . 1 1 125 125 LEU C C 13 173.568 0.2 . 1 . . . . 125 LEU C . 7206 1 1429 . 1 1 125 125 LEU CA C 13 54.422 0.2 . 1 . . . . 125 LEU CA . 7206 1 1430 . 1 1 125 125 LEU CB C 13 40.792 0.2 . 1 . . . . 125 LEU CB . 7206 1 1431 . 1 1 125 125 LEU CG C 13 27.2 0.2 . 1 . . . . 125 LEU CG . 7206 1 1432 . 1 1 125 125 LEU CD1 C 13 23.831 0.2 . 1 . . . . 125 LEU CD1 . 7206 1 1433 . 1 1 125 125 LEU CD2 C 13 25.687 0.2 . 1 . . . . 125 LEU CD2 . 7206 1 1434 . 1 1 125 125 LEU N N 15 129.968 0.1 . 1 . . . . 125 LEU N . 7206 1 1435 . 1 1 126 126 ASP H H 1 8.945 0.02 . 1 . . . . 126 ASP H . 7206 1 1436 . 1 1 126 126 ASP HA H 1 4.505 0.02 . 1 . . . . 126 ASP HA . 7206 1 1437 . 1 1 126 126 ASP HB2 H 1 2.492 0.02 . 1 . . . . 126 ASP HB2 . 7206 1 1438 . 1 1 126 126 ASP HB3 H 1 2.393 0.02 . 1 . . . . 126 ASP HB3 . 7206 1 1439 . 1 1 126 126 ASP C C 13 175.646 0.2 . 1 . . . . 126 ASP C . 7206 1 1440 . 1 1 126 126 ASP CA C 13 57.616 0.2 . 1 . . . . 126 ASP CA . 7206 1 1441 . 1 1 126 126 ASP CB C 13 46.308 0.2 . 1 . . . . 126 ASP CB . 7206 1 1442 . 1 1 126 126 ASP N N 15 130.523 0.1 . 1 . . . . 126 ASP N . 7206 1 1443 . 1 1 127 127 ARG H H 1 7.49 0.02 . 1 . . . . 127 ARG H . 7206 1 1444 . 1 1 127 127 ARG HA H 1 4.628 0.02 . 1 . . . . 127 ARG HA . 7206 1 1445 . 1 1 127 127 ARG HB2 H 1 1.988 0.02 . 1 . . . . 127 ARG HB2 . 7206 1 1446 . 1 1 127 127 ARG HB3 H 1 1.801 0.02 . 1 . . . . 127 ARG HB3 . 7206 1 1447 . 1 1 127 127 ARG HG2 H 1 1.352 0.02 . 1 . . . . 127 ARG HG2 . 7206 1 1448 . 1 1 127 127 ARG HG3 H 1 1.544 0.02 . 1 . . . . 127 ARG HG3 . 7206 1 1449 . 1 1 127 127 ARG HD2 H 1 3.046 0.02 . 1 . . . . 127 ARG HD2 . 7206 1 1450 . 1 1 127 127 ARG HD3 H 1 3.142 0.02 . 1 . . . . 127 ARG HD3 . 7206 1 1451 . 1 1 127 127 ARG C C 13 173.295 0.2 . 1 . . . . 127 ARG C . 7206 1 1452 . 1 1 127 127 ARG CA C 13 55.341 0.2 . 1 . . . . 127 ARG CA . 7206 1 1453 . 1 1 127 127 ARG CB C 13 32.592 0.2 . 1 . . . . 127 ARG CB . 7206 1 1454 . 1 1 127 127 ARG CG C 13 26.125 0.2 . 1 . . . . 127 ARG CG . 7206 1 1455 . 1 1 127 127 ARG CD C 13 44.202 0.2 . 1 . . . . 127 ARG CD . 7206 1 1456 . 1 1 127 127 ARG N N 15 108.893 0.1 . 1 . . . . 127 ARG N . 7206 1 1457 . 1 1 128 128 VAL H H 1 8.203 0.02 . 1 . . . . 128 VAL H . 7206 1 1458 . 1 1 128 128 VAL HA H 1 4.608 0.02 . 1 . . . . 128 VAL HA . 7206 1 1459 . 1 1 128 128 VAL HB H 1 1.993 0.02 . 1 . . . . 128 VAL HB . 7206 1 1460 . 1 1 128 128 VAL HG11 H 1 0.886 0.02 . 1 . . . . 128 VAL HG1 . 7206 1 1461 . 1 1 128 128 VAL HG12 H 1 0.886 0.02 . 1 . . . . 128 VAL HG1 . 7206 1 1462 . 1 1 128 128 VAL HG13 H 1 0.886 0.02 . 1 . . . . 128 VAL HG1 . 7206 1 1463 . 1 1 128 128 VAL HG21 H 1 0.992 0.02 . 1 . . . . 128 VAL HG2 . 7206 1 1464 . 1 1 128 128 VAL HG22 H 1 0.992 0.02 . 1 . . . . 128 VAL HG2 . 7206 1 1465 . 1 1 128 128 VAL HG23 H 1 0.992 0.02 . 1 . . . . 128 VAL HG2 . 7206 1 1466 . 1 1 128 128 VAL C C 13 174.849 0.2 . 1 . . . . 128 VAL C . 7206 1 1467 . 1 1 128 128 VAL CA C 13 61.536 0.2 . 1 . . . . 128 VAL CA . 7206 1 1468 . 1 1 128 128 VAL CB C 13 33.658 0.2 . 1 . . . . 128 VAL CB . 7206 1 1469 . 1 1 128 128 VAL CG1 C 13 22.138 0.2 . 1 . . . . 128 VAL CG1 . 7206 1 1470 . 1 1 128 128 VAL CG2 C 13 20.782 0.2 . 1 . . . . 128 VAL CG2 . 7206 1 1471 . 1 1 128 128 VAL N N 15 119.005 0.1 . 1 . . . . 128 VAL N . 7206 1 1472 . 1 1 129 129 LEU H H 1 8.213 0.02 . 1 . . . . 129 LEU H . 7206 1 1473 . 1 1 129 129 LEU HA H 1 4.304 0.02 . 1 . . . . 129 LEU HA . 7206 1 1474 . 1 1 129 129 LEU HB2 H 1 1.538 0.02 . 1 . . . . 129 LEU HB2 . 7206 1 1475 . 1 1 129 129 LEU HB3 H 1 1.538 0.02 . 1 . . . . 129 LEU HB3 . 7206 1 1476 . 1 1 129 129 LEU HG H 1 1.347 0.02 . 1 . . . . 129 LEU HG . 7206 1 1477 . 1 1 129 129 LEU HD11 H 1 1.5 0.02 . 1 . . . . 129 LEU HD1 . 7206 1 1478 . 1 1 129 129 LEU HD12 H 1 1.5 0.02 . 1 . . . . 129 LEU HD1 . 7206 1 1479 . 1 1 129 129 LEU HD13 H 1 1.5 0.02 . 1 . . . . 129 LEU HD1 . 7206 1 1480 . 1 1 129 129 LEU HD21 H 1 1.347 0.02 . 1 . . . . 129 LEU HD2 . 7206 1 1481 . 1 1 129 129 LEU HD22 H 1 1.347 0.02 . 1 . . . . 129 LEU HD2 . 7206 1 1482 . 1 1 129 129 LEU HD23 H 1 1.347 0.02 . 1 . . . . 129 LEU HD2 . 7206 1 1483 . 1 1 129 129 LEU C C 13 180.084 0.2 . 1 . . . . 129 LEU C . 7206 1 1484 . 1 1 129 129 LEU CA C 13 57.096 0.2 . 1 . . . . 129 LEU CA . 7206 1 1485 . 1 1 129 129 LEU CB C 13 42.65 0.2 . 1 . . . . 129 LEU CB . 7206 1 1486 . 1 1 129 129 LEU CG C 13 27.412 0.2 . 1 . . . . 129 LEU CG . 7206 1 1487 . 1 1 129 129 LEU CD1 C 13 24.45 0.2 . 1 . . . . 129 LEU CD1 . 7206 1 1488 . 1 1 129 129 LEU CD2 C 13 21.566 0.2 . 1 . . . . 129 LEU CD2 . 7206 1 1489 . 1 1 129 129 LEU N N 15 130.783 0.1 . 1 . . . . 129 LEU N . 7206 1 stop_ save_