data_19077 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19077 _Entry.Title ; 1H, 13C and 15N backbone and side-chain resonance assignments of the N-terminal ubiquitin-binding domain of the human deubiquitinase USP28 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-03-06 _Entry.Accession_date 2013-03-06 _Entry.Last_release_date 2014-02-13 _Entry.Original_release_date 2014-02-13 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Yi Wen . . . 19077 2 Rong Cui . . . 19077 3 Huaqun Zhang . . . 19077 4 Naixia Zhang . . . 19077 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Shanghai Institute of Materia Medica' . 19077 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19077 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 487 19077 '15N chemical shifts' 111 19077 '1H chemical shifts' 764 19077 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2014-02-13 2013-03-06 original author . 19077 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19077 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23754699 _Citation.Full_citation . _Citation.Title '(1)H, (13)C and (15)N backbone and side-chain resonance assignments of the N-terminal ubiquitin-binding domains of the human deubiquitinase Usp28.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Yi Wen . . . 19077 1 2 Rong Cui . . . 19077 1 3 Huaqun Zhang . . . 19077 1 4 Naixia Zhang . . . 19077 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19077 _Assembly.ID 1 _Assembly.Name 'USP28 monomer' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'USP28 monomer' 1 $USP28 A . yes native no no . . . 19077 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_USP28 _Entity.Sf_category entity _Entity.Sf_framecode USP28 _Entity.Entry_ID 19077 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name USP28 _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 ; GSMTAELQQDDAAGAADGHG SSCQMLLNQLREITGIQDPS FLHEALKASNGDITQAVSLL TDERVKEPSQDTVATEPSEV EGSAANKEVLAKVIDLTHDN KDDLQAAIALSLLESPKIQA DGVDKLAAALEHHHHHH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq ; -2,G -1,S 1,M 2,T 3,A ; _Entity.Polymer_author_seq_details 'The first two residues GS and the last fifteen residues VDKLAAALEHHHHHH are cloning artifacts.' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 137 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 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 BMRB 18560 . hs356_22_132 . . . . . 73.72 129 99.01 99.01 1.48e-61 . . . . 19077 1 2 no PDB 2LVA . "Nmr Solution Structure Of The N-Terminal Domain Of Human Usp28, Northeast Structural Genomics Consortium Target Ht8470a" . . . . . 73.72 129 99.01 99.01 1.48e-61 . . . . 19077 1 3 no DBJ BAG65214 . "unnamed protein product [Homo sapiens]" . . . . . 89.05 259 98.36 98.36 7.77e-77 . . . . 19077 1 4 no GB AAH65928 . "USP28 protein [Homo sapiens]" . . . . . 89.05 583 99.18 99.18 2.60e-69 . . . . 19077 1 5 no GB AAK58565 . "ubiquitin specific protease [Homo sapiens]" . . . . . 89.05 1077 99.18 99.18 2.85e-67 . . . . 19077 1 6 no GB ACA06098 . "ubiquitin carboxyl-terminal hydrolase 28 variant 2 [Homo sapiens]" . . . . . 89.05 1077 99.18 99.18 2.85e-67 . . . . 19077 1 7 no GB ACA06099 . "ubiquitin carboxyl-terminal hydrolase 28 variant 1 [Homo sapiens]" . . . . . 89.05 1045 99.18 99.18 2.11e-67 . . . . 19077 1 8 no GB AIC60511 . "USP28, partial [synthetic construct]" . . . . . 89.05 583 99.18 99.18 2.60e-69 . . . . 19077 1 9 no REF NP_065937 . "ubiquitin carboxyl-terminal hydrolase 28 isoform 1 [Homo sapiens]" . . . . . 89.05 1077 99.18 99.18 2.85e-67 . . . . 19077 1 10 no REF XP_001085291 . "PREDICTED: ubiquitin carboxyl-terminal hydrolase 28 isoform 1 [Macaca mulatta]" . . . . . 89.05 1077 98.36 98.36 1.99e-71 . . . . 19077 1 11 no REF XP_002799842 . "PREDICTED: ubiquitin carboxyl-terminal hydrolase 28 isoform 2 [Macaca mulatta]" . . . . . 89.05 1115 98.36 98.36 2.08e-71 . . . . 19077 1 12 no REF XP_003253212 . "PREDICTED: ubiquitin carboxyl-terminal hydrolase 28 isoform X1 [Nomascus leucogenys]" . . . . . 89.05 1078 99.18 99.18 2.10e-67 . . . . 19077 1 13 no REF XP_004052203 . "PREDICTED: ubiquitin carboxyl-terminal hydrolase 28 isoform 1 [Gorilla gorilla gorilla]" . . . . . 89.05 1077 99.18 99.18 2.88e-67 . . . . 19077 1 14 no SP Q96RU2 . "RecName: Full=Ubiquitin carboxyl-terminal hydrolase 28; AltName: Full=Deubiquitinating enzyme 28; AltName: Full=Ubiquitin thioe" . . . . . 89.05 1077 99.18 99.18 2.85e-67 . . . . 19077 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 -2 GLY . 19077 1 2 -1 SER . 19077 1 3 1 MET . 19077 1 4 2 THR . 19077 1 5 3 ALA . 19077 1 6 4 GLU . 19077 1 7 5 LEU . 19077 1 8 6 GLN . 19077 1 9 7 GLN . 19077 1 10 8 ASP . 19077 1 11 9 ASP . 19077 1 12 10 ALA . 19077 1 13 11 ALA . 19077 1 14 12 GLY . 19077 1 15 13 ALA . 19077 1 16 14 ALA . 19077 1 17 15 ASP . 19077 1 18 16 GLY . 19077 1 19 17 HIS . 19077 1 20 18 GLY . 19077 1 21 19 SER . 19077 1 22 20 SER . 19077 1 23 21 CYS . 19077 1 24 22 GLN . 19077 1 25 23 MET . 19077 1 26 24 LEU . 19077 1 27 25 LEU . 19077 1 28 26 ASN . 19077 1 29 27 GLN . 19077 1 30 28 LEU . 19077 1 31 29 ARG . 19077 1 32 30 GLU . 19077 1 33 31 ILE . 19077 1 34 32 THR . 19077 1 35 33 GLY . 19077 1 36 34 ILE . 19077 1 37 35 GLN . 19077 1 38 36 ASP . 19077 1 39 37 PRO . 19077 1 40 38 SER . 19077 1 41 39 PHE . 19077 1 42 40 LEU . 19077 1 43 41 HIS . 19077 1 44 42 GLU . 19077 1 45 43 ALA . 19077 1 46 44 LEU . 19077 1 47 45 LYS . 19077 1 48 46 ALA . 19077 1 49 47 SER . 19077 1 50 48 ASN . 19077 1 51 49 GLY . 19077 1 52 50 ASP . 19077 1 53 51 ILE . 19077 1 54 52 THR . 19077 1 55 53 GLN . 19077 1 56 54 ALA . 19077 1 57 55 VAL . 19077 1 58 56 SER . 19077 1 59 57 LEU . 19077 1 60 58 LEU . 19077 1 61 59 THR . 19077 1 62 60 ASP . 19077 1 63 61 GLU . 19077 1 64 62 ARG . 19077 1 65 63 VAL . 19077 1 66 64 LYS . 19077 1 67 65 GLU . 19077 1 68 66 PRO . 19077 1 69 67 SER . 19077 1 70 68 GLN . 19077 1 71 69 ASP . 19077 1 72 70 THR . 19077 1 73 71 VAL . 19077 1 74 72 ALA . 19077 1 75 73 THR . 19077 1 76 74 GLU . 19077 1 77 75 PRO . 19077 1 78 76 SER . 19077 1 79 77 GLU . 19077 1 80 78 VAL . 19077 1 81 79 GLU . 19077 1 82 80 GLY . 19077 1 83 81 SER . 19077 1 84 82 ALA . 19077 1 85 83 ALA . 19077 1 86 84 ASN . 19077 1 87 85 LYS . 19077 1 88 86 GLU . 19077 1 89 87 VAL . 19077 1 90 88 LEU . 19077 1 91 89 ALA . 19077 1 92 90 LYS . 19077 1 93 91 VAL . 19077 1 94 92 ILE . 19077 1 95 93 ASP . 19077 1 96 94 LEU . 19077 1 97 95 THR . 19077 1 98 96 HIS . 19077 1 99 97 ASP . 19077 1 100 98 ASN . 19077 1 101 99 LYS . 19077 1 102 100 ASP . 19077 1 103 101 ASP . 19077 1 104 102 LEU . 19077 1 105 103 GLN . 19077 1 106 104 ALA . 19077 1 107 105 ALA . 19077 1 108 106 ILE . 19077 1 109 107 ALA . 19077 1 110 108 LEU . 19077 1 111 109 SER . 19077 1 112 110 LEU . 19077 1 113 111 LEU . 19077 1 114 112 GLU . 19077 1 115 113 SER . 19077 1 116 114 PRO . 19077 1 117 115 LYS . 19077 1 118 116 ILE . 19077 1 119 117 GLN . 19077 1 120 118 ALA . 19077 1 121 119 ASP . 19077 1 122 120 GLY . 19077 1 123 121 VAL . 19077 1 124 122 ASP . 19077 1 125 123 LYS . 19077 1 126 124 LEU . 19077 1 127 125 ALA . 19077 1 128 126 ALA . 19077 1 129 127 ALA . 19077 1 130 128 LEU . 19077 1 131 129 GLU . 19077 1 132 130 HIS . 19077 1 133 131 HIS . 19077 1 134 132 HIS . 19077 1 135 133 HIS . 19077 1 136 134 HIS . 19077 1 137 135 HIS . 19077 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 19077 1 . SER 2 2 19077 1 . MET 3 3 19077 1 . THR 4 4 19077 1 . ALA 5 5 19077 1 . GLU 6 6 19077 1 . LEU 7 7 19077 1 . GLN 8 8 19077 1 . GLN 9 9 19077 1 . ASP 10 10 19077 1 . ASP 11 11 19077 1 . ALA 12 12 19077 1 . ALA 13 13 19077 1 . GLY 14 14 19077 1 . ALA 15 15 19077 1 . ALA 16 16 19077 1 . ASP 17 17 19077 1 . GLY 18 18 19077 1 . HIS 19 19 19077 1 . GLY 20 20 19077 1 . SER 21 21 19077 1 . SER 22 22 19077 1 . CYS 23 23 19077 1 . GLN 24 24 19077 1 . MET 25 25 19077 1 . LEU 26 26 19077 1 . LEU 27 27 19077 1 . ASN 28 28 19077 1 . GLN 29 29 19077 1 . LEU 30 30 19077 1 . ARG 31 31 19077 1 . GLU 32 32 19077 1 . ILE 33 33 19077 1 . THR 34 34 19077 1 . GLY 35 35 19077 1 . ILE 36 36 19077 1 . GLN 37 37 19077 1 . ASP 38 38 19077 1 . PRO 39 39 19077 1 . SER 40 40 19077 1 . PHE 41 41 19077 1 . LEU 42 42 19077 1 . HIS 43 43 19077 1 . GLU 44 44 19077 1 . ALA 45 45 19077 1 . LEU 46 46 19077 1 . LYS 47 47 19077 1 . ALA 48 48 19077 1 . SER 49 49 19077 1 . ASN 50 50 19077 1 . GLY 51 51 19077 1 . ASP 52 52 19077 1 . ILE 53 53 19077 1 . THR 54 54 19077 1 . GLN 55 55 19077 1 . ALA 56 56 19077 1 . VAL 57 57 19077 1 . SER 58 58 19077 1 . LEU 59 59 19077 1 . LEU 60 60 19077 1 . THR 61 61 19077 1 . ASP 62 62 19077 1 . GLU 63 63 19077 1 . ARG 64 64 19077 1 . VAL 65 65 19077 1 . LYS 66 66 19077 1 . GLU 67 67 19077 1 . PRO 68 68 19077 1 . SER 69 69 19077 1 . GLN 70 70 19077 1 . ASP 71 71 19077 1 . THR 72 72 19077 1 . VAL 73 73 19077 1 . ALA 74 74 19077 1 . THR 75 75 19077 1 . GLU 76 76 19077 1 . PRO 77 77 19077 1 . SER 78 78 19077 1 . GLU 79 79 19077 1 . VAL 80 80 19077 1 . GLU 81 81 19077 1 . GLY 82 82 19077 1 . SER 83 83 19077 1 . ALA 84 84 19077 1 . ALA 85 85 19077 1 . ASN 86 86 19077 1 . LYS 87 87 19077 1 . GLU 88 88 19077 1 . VAL 89 89 19077 1 . LEU 90 90 19077 1 . ALA 91 91 19077 1 . LYS 92 92 19077 1 . VAL 93 93 19077 1 . ILE 94 94 19077 1 . ASP 95 95 19077 1 . LEU 96 96 19077 1 . THR 97 97 19077 1 . HIS 98 98 19077 1 . ASP 99 99 19077 1 . ASN 100 100 19077 1 . LYS 101 101 19077 1 . ASP 102 102 19077 1 . ASP 103 103 19077 1 . LEU 104 104 19077 1 . GLN 105 105 19077 1 . ALA 106 106 19077 1 . ALA 107 107 19077 1 . ILE 108 108 19077 1 . ALA 109 109 19077 1 . LEU 110 110 19077 1 . SER 111 111 19077 1 . LEU 112 112 19077 1 . LEU 113 113 19077 1 . GLU 114 114 19077 1 . SER 115 115 19077 1 . PRO 116 116 19077 1 . LYS 117 117 19077 1 . ILE 118 118 19077 1 . GLN 119 119 19077 1 . ALA 120 120 19077 1 . ASP 121 121 19077 1 . GLY 122 122 19077 1 . VAL 123 123 19077 1 . ASP 124 124 19077 1 . LYS 125 125 19077 1 . LEU 126 126 19077 1 . ALA 127 127 19077 1 . ALA 128 128 19077 1 . ALA 129 129 19077 1 . LEU 130 130 19077 1 . GLU 131 131 19077 1 . HIS 132 132 19077 1 . HIS 133 133 19077 1 . HIS 134 134 19077 1 . HIS 135 135 19077 1 . HIS 136 136 19077 1 . HIS 137 137 19077 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 19077 _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 $USP28 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 19077 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 19077 _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 $USP28 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pGBTNH . . . . . . 19077 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19077 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 D20 'natural abundance' . . . . . . 10 . . % . . . . 19077 1 2 H20 'natural abundance' . . . . . . 90 . . % . . . . 19077 1 3 USP-28 [U-15N] . . 1 $USP28 . . . 0.8 1.0 mM . . . . 19077 1 4 Na2HPO4/NaH2PO4 'natural abundance' . . . . . . 20 . . mM . . . . 19077 1 5 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 19077 1 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 19077 1 7 NaNH3 'natural abundance' . . . . . . 0.02 . . % . . . . 19077 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 19077 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 D20 'natural abundance' . . . . . . 10 . . % . . . . 19077 2 2 H20 'natural abundance' . . . . . . 90 . . % . . . . 19077 2 3 USP-28 '[U-15N; U-13C]' . . 1 $USP28 . . . 0.8 1.0 mM . . . . 19077 2 4 Na2HPO4/NaH2PO4 'natural abundance' . . . . . . 20 . . mM . . . . 19077 2 5 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 19077 2 6 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 19077 2 7 NaNH3 'natural abundance' . . . . . . 0.02 . . % . . . . 19077 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 19077 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 D20 'natural abundance' . . . . . . 100 . . % . . . . 19077 3 2 USP-28 '[U-15N; U-13C]' . . 1 $USP28 . . . 0.8 1.0 mM . . . . 19077 3 3 Na2HPO4/NaH2PO4 'natural abundance' . . . . . . 20 . . mM . . . . 19077 3 4 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 19077 3 5 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 19077 3 6 NaNH3 'natural abundance' . . . . . . 0.02 . . % . . . . 19077 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 19077 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.15 . M 19077 1 pH 6.5 . pH 19077 1 pressure 1 . atm 19077 1 temperature 298.2 . K 19077 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 19077 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 19077 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 19077 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 600 . . . 19077 1 2 spectrometer_2 Bruker Avance . 600 . . . 19077 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 19077 _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 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 3 '3D C(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 4 '3D HNCO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 5 '3D HNCA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 6 '3D HNCACB' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 8 '3D HN(CO)CA' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 9 '3D H(CCO)NH' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 10 '3D HN(CA)CO' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 11 '3D HCCH-TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 12 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 13 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19077 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 19077 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . . 0.00 na indirect 0.251 . . . . . . . . . 19077 1 H 1 water protons . . . . . 4.77 internal direct 1.000 . . . . . . . . . 19077 1 N 15 water protons . . . . . 0.00 na indirect 0.101 . . . . . . . . . 19077 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 19077 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 19077 1 2 '2D 1H-13C HSQC' . . . 19077 1 3 '3D C(CO)NH' . . . 19077 1 4 '3D HNCO' . . . 19077 1 5 '3D HNCA' . . . 19077 1 6 '3D HNCACB' . . . 19077 1 7 '3D HBHA(CO)NH' . . . 19077 1 8 '3D HN(CO)CA' . . . 19077 1 9 '3D H(CCO)NH' . . . 19077 1 10 '3D HN(CA)CO' . . . 19077 1 11 '3D HCCH-TOCSY' . . . 19077 1 12 '3D 1H-15N NOESY' . . . 19077 1 13 '3D 1H-13C NOESY aliphatic' . . . 19077 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 SER CA C 13 58.354 0.3 . 1 . . . . -1 SER CA . 19077 1 2 . 1 1 3 3 MET H H 1 8.654 0.020 . 1 . . . . 1 MET H . 19077 1 3 . 1 1 3 3 MET HA H 1 4.587 0.020 . 1 . . . . 1 MET HA . 19077 1 4 . 1 1 3 3 MET HB2 H 1 2.135 0.020 . 2 . . . . 1 MET HB2 . 19077 1 5 . 1 1 3 3 MET HB3 H 1 2.028 0.020 . 2 . . . . 1 MET HB3 . 19077 1 6 . 1 1 3 3 MET HG2 H 1 2.631 0.020 . 2 . . . . 1 MET HG2 . 19077 1 7 . 1 1 3 3 MET HG3 H 1 2.569 0.020 . 2 . . . . 1 MET HG3 . 19077 1 8 . 1 1 3 3 MET C C 13 176.411 0.3 . 1 . . . . 1 MET C . 19077 1 9 . 1 1 3 3 MET CA C 13 55.800 0.3 . 1 . . . . 1 MET CA . 19077 1 10 . 1 1 3 3 MET CB C 13 32.846 0.3 . 1 . . . . 1 MET CB . 19077 1 11 . 1 1 3 3 MET CG C 13 31.892 0.3 . 1 . . . . 1 MET CG . 19077 1 12 . 1 1 3 3 MET N N 15 122.367 0.3 . 1 . . . . 1 MET N . 19077 1 13 . 1 1 4 4 THR H H 1 8.128 0.020 . 1 . . . . 2 THR H . 19077 1 14 . 1 1 4 4 THR HA H 1 4.310 0.020 . 1 . . . . 2 THR HA . 19077 1 15 . 1 1 4 4 THR HB H 1 4.225 0.020 . 1 . . . . 2 THR HB . 19077 1 16 . 1 1 4 4 THR HG21 H 1 1.217 0.020 . 1 . . . . 2 THR HG2 . 19077 1 17 . 1 1 4 4 THR HG22 H 1 1.217 0.020 . 1 . . . . 2 THR HG2 . 19077 1 18 . 1 1 4 4 THR HG23 H 1 1.217 0.020 . 1 . . . . 2 THR HG2 . 19077 1 19 . 1 1 4 4 THR C C 13 174.303 0.3 . 1 . . . . 2 THR C . 19077 1 20 . 1 1 4 4 THR CA C 13 61.906 0.3 . 1 . . . . 2 THR CA . 19077 1 21 . 1 1 4 4 THR CB C 13 69.780 0.3 . 1 . . . . 2 THR CB . 19077 1 22 . 1 1 4 4 THR CG2 C 13 21.440 0.3 . 1 . . . . 2 THR CG2 . 19077 1 23 . 1 1 4 4 THR N N 15 115.114 0.3 . 1 . . . . 2 THR N . 19077 1 24 . 1 1 5 5 ALA H H 1 8.316 0.020 . 1 . . . . 3 ALA H . 19077 1 25 . 1 1 5 5 ALA HA H 1 4.321 0.020 . 1 . . . . 3 ALA HA . 19077 1 26 . 1 1 5 5 ALA HB1 H 1 1.399 0.020 . 1 . . . . 3 ALA HB . 19077 1 27 . 1 1 5 5 ALA HB2 H 1 1.399 0.020 . 1 . . . . 3 ALA HB . 19077 1 28 . 1 1 5 5 ALA HB3 H 1 1.399 0.020 . 1 . . . . 3 ALA HB . 19077 1 29 . 1 1 5 5 ALA C C 13 177.700 0.3 . 1 . . . . 3 ALA C . 19077 1 30 . 1 1 5 5 ALA CA C 13 52.746 0.3 . 1 . . . . 3 ALA CA . 19077 1 31 . 1 1 5 5 ALA CB C 13 19.272 0.3 . 1 . . . . 3 ALA CB . 19077 1 32 . 1 1 5 5 ALA N N 15 126.150 0.3 . 1 . . . . 3 ALA N . 19077 1 33 . 1 1 6 6 GLU H H 1 8.352 0.020 . 1 . . . . 4 GLU H . 19077 1 34 . 1 1 6 6 GLU HA H 1 4.246 0.020 . 1 . . . . 4 GLU HA . 19077 1 35 . 1 1 6 6 GLU HB2 H 1 2.028 0.020 . 2 . . . . 4 GLU HB2 . 19077 1 36 . 1 1 6 6 GLU HB3 H 1 1.932 0.020 . 2 . . . . 4 GLU HB3 . 19077 1 37 . 1 1 6 6 GLU HG2 H 1 2.273 0.020 . 2 . . . . 4 GLU HG2 . 19077 1 38 . 1 1 6 6 GLU HG3 H 1 2.226 0.020 . 2 . . . . 4 GLU HG3 . 19077 1 39 . 1 1 6 6 GLU C C 13 176.505 0.3 . 1 . . . . 4 GLU C . 19077 1 40 . 1 1 6 6 GLU CA C 13 56.710 0.3 . 1 . . . . 4 GLU CA . 19077 1 41 . 1 1 6 6 GLU CB C 13 30.203 0.3 . 1 . . . . 4 GLU CB . 19077 1 42 . 1 1 6 6 GLU CG C 13 36.163 0.3 . 1 . . . . 4 GLU CG . 19077 1 43 . 1 1 6 6 GLU N N 15 119.754 0.3 . 1 . . . . 4 GLU N . 19077 1 44 . 1 1 7 7 LEU H H 1 8.182 0.020 . 1 . . . . 5 LEU H . 19077 1 45 . 1 1 7 7 LEU HA H 1 4.342 0.020 . 1 . . . . 5 LEU HA . 19077 1 46 . 1 1 7 7 LEU HB2 H 1 1.644 0.020 . 2 . . . . 5 LEU HB2 . 19077 1 47 . 1 1 7 7 LEU HB3 H 1 1.580 0.020 . 2 . . . . 5 LEU HB3 . 19077 1 48 . 1 1 7 7 LEU HG H 1 1.452 0.020 . 1 . . . . 5 LEU HG . 19077 1 49 . 1 1 7 7 LEU HD11 H 1 0.908 0.020 . 2 . . . . 5 LEU HD1 . 19077 1 50 . 1 1 7 7 LEU HD12 H 1 0.908 0.020 . 2 . . . . 5 LEU HD1 . 19077 1 51 . 1 1 7 7 LEU HD13 H 1 0.908 0.020 . 2 . . . . 5 LEU HD1 . 19077 1 52 . 1 1 7 7 LEU HD21 H 1 0.862 0.020 . 2 . . . . 5 LEU HD2 . 19077 1 53 . 1 1 7 7 LEU HD22 H 1 0.862 0.020 . 2 . . . . 5 LEU HD2 . 19077 1 54 . 1 1 7 7 LEU HD23 H 1 0.862 0.020 . 2 . . . . 5 LEU HD2 . 19077 1 55 . 1 1 7 7 LEU C C 13 177.166 0.3 . 1 . . . . 5 LEU C . 19077 1 56 . 1 1 7 7 LEU CA C 13 55.154 0.3 . 1 . . . . 5 LEU CA . 19077 1 57 . 1 1 7 7 LEU CB C 13 42.347 0.3 . 1 . . . . 5 LEU CB . 19077 1 58 . 1 1 7 7 LEU CG C 13 27.041 0.3 . 1 . . . . 5 LEU CG . 19077 1 59 . 1 1 7 7 LEU CD1 C 13 24.641 0.3 . 1 . . . . 5 LEU CD1 . 19077 1 60 . 1 1 7 7 LEU CD2 C 13 23.280 0.3 . 1 . . . . 5 LEU CD2 . 19077 1 61 . 1 1 7 7 LEU N N 15 122.654 0.3 . 1 . . . . 5 LEU N . 19077 1 62 . 1 1 8 8 GLN H H 1 8.375 0.020 . 1 . . . . 6 GLN H . 19077 1 63 . 1 1 8 8 GLN HA H 1 4.238 0.020 . 1 . . . . 6 GLN HA . 19077 1 64 . 1 1 8 8 GLN HB2 H 1 2.026 0.020 . 1 . . . . 6 GLN HB2 . 19077 1 65 . 1 1 8 8 GLN HB3 H 1 2.026 0.020 . 1 . . . . 6 GLN HB3 . 19077 1 66 . 1 1 8 8 GLN HG2 H 1 2.336 0.020 . 1 . . . . 6 GLN HG2 . 19077 1 67 . 1 1 8 8 GLN HG3 H 1 2.336 0.020 . 1 . . . . 6 GLN HG3 . 19077 1 68 . 1 1 8 8 GLN C C 13 175.786 0.3 . 1 . . . . 6 GLN C . 19077 1 69 . 1 1 8 8 GLN CA C 13 55.741 0.3 . 1 . . . . 6 GLN CA . 19077 1 70 . 1 1 8 8 GLN CB C 13 29.417 0.3 . 1 . . . . 6 GLN CB . 19077 1 71 . 1 1 8 8 GLN CG C 13 32.380 0.3 . 1 . . . . 6 GLN CG . 19077 1 72 . 1 1 8 8 GLN N N 15 121.491 0.3 . 1 . . . . 6 GLN N . 19077 1 73 . 1 1 9 9 GLN HA H 1 4.342 0.020 . 1 . . . . 7 GLN HA . 19077 1 74 . 1 1 9 9 GLN HB2 H 1 2.103 0.020 . 2 . . . . 7 GLN HB2 . 19077 1 75 . 1 1 9 9 GLN HB3 H 1 1.985 0.020 . 2 . . . . 7 GLN HB3 . 19077 1 76 . 1 1 9 9 GLN HG2 H 1 2.358 0.020 . 1 . . . . 7 GLN HG2 . 19077 1 77 . 1 1 9 9 GLN HG3 H 1 2.358 0.020 . 1 . . . . 7 GLN HG3 . 19077 1 78 . 1 1 9 9 GLN C C 13 175.624 0.3 . 1 . . . . 7 GLN C . 19077 1 79 . 1 1 9 9 GLN CA C 13 55.800 0.3 . 1 . . . . 7 GLN CA . 19077 1 80 . 1 1 9 9 GLN CB C 13 29.702 0.3 . 1 . . . . 7 GLN CB . 19077 1 81 . 1 1 9 9 GLN CG C 13 33.602 0.3 . 1 . . . . 7 GLN CG . 19077 1 82 . 1 1 10 10 ASP H H 1 8.437 0.020 . 1 . . . . 8 ASP H . 19077 1 83 . 1 1 10 10 ASP HA H 1 4.598 0.020 . 1 . . . . 8 ASP HA . 19077 1 84 . 1 1 10 10 ASP HB2 H 1 2.710 0.020 . 2 . . . . 8 ASP HB2 . 19077 1 85 . 1 1 10 10 ASP HB3 H 1 2.625 0.020 . 2 . . . . 8 ASP HB3 . 19077 1 86 . 1 1 10 10 ASP C C 13 176.143 0.3 . 1 . . . . 8 ASP C . 19077 1 87 . 1 1 10 10 ASP CA C 13 54.478 0.3 . 1 . . . . 8 ASP CA . 19077 1 88 . 1 1 10 10 ASP CB C 13 41.347 0.3 . 1 . . . . 8 ASP CB . 19077 1 89 . 1 1 10 10 ASP N N 15 121.927 0.3 . 1 . . . . 8 ASP N . 19077 1 90 . 1 1 11 11 ASP H H 1 8.354 0.020 . 1 . . . . 9 ASP H . 19077 1 91 . 1 1 11 11 ASP HA H 1 4.566 0.020 . 1 . . . . 9 ASP HA . 19077 1 92 . 1 1 11 11 ASP HB2 H 1 2.678 0.020 . 1 . . . . 9 ASP HB2 . 19077 1 93 . 1 1 11 11 ASP HB3 H 1 2.678 0.020 . 1 . . . . 9 ASP HB3 . 19077 1 94 . 1 1 11 11 ASP C C 13 176.442 0.3 . 1 . . . . 9 ASP C . 19077 1 95 . 1 1 11 11 ASP CA C 13 54.537 0.3 . 1 . . . . 9 ASP CA . 19077 1 96 . 1 1 11 11 ASP CB C 13 41.204 0.3 . 1 . . . . 9 ASP CB . 19077 1 97 . 1 1 11 11 ASP N N 15 121.296 0.3 . 1 . . . . 9 ASP N . 19077 1 98 . 1 1 12 12 ALA H H 1 8.257 0.020 . 1 . . . . 10 ALA H . 19077 1 99 . 1 1 12 12 ALA HA H 1 4.278 0.020 . 1 . . . . 10 ALA HA . 19077 1 100 . 1 1 12 12 ALA HB1 H 1 1.399 0.020 . 1 . . . . 10 ALA HB . 19077 1 101 . 1 1 12 12 ALA HB2 H 1 1.399 0.020 . 1 . . . . 10 ALA HB . 19077 1 102 . 1 1 12 12 ALA HB3 H 1 1.399 0.020 . 1 . . . . 10 ALA HB . 19077 1 103 . 1 1 12 12 ALA C C 13 178.015 0.3 . 1 . . . . 10 ALA C . 19077 1 104 . 1 1 12 12 ALA CA C 13 52.922 0.3 . 1 . . . . 10 ALA CA . 19077 1 105 . 1 1 12 12 ALA CB C 13 18.987 0.3 . 1 . . . . 10 ALA CB . 19077 1 106 . 1 1 12 12 ALA N N 15 124.241 0.3 . 1 . . . . 10 ALA N . 19077 1 107 . 1 1 13 13 ALA H H 1 8.168 0.020 . 1 . . . . 11 ALA H . 19077 1 108 . 1 1 13 13 ALA HA H 1 4.267 0.020 . 1 . . . . 11 ALA HA . 19077 1 109 . 1 1 13 13 ALA HB1 H 1 1.409 0.020 . 1 . . . . 11 ALA HB . 19077 1 110 . 1 1 13 13 ALA HB2 H 1 1.409 0.020 . 1 . . . . 11 ALA HB . 19077 1 111 . 1 1 13 13 ALA HB3 H 1 1.409 0.020 . 1 . . . . 11 ALA HB . 19077 1 112 . 1 1 13 13 ALA C C 13 178.581 0.3 . 1 . . . . 11 ALA C . 19077 1 113 . 1 1 13 13 ALA CA C 13 53.010 0.3 . 1 . . . . 11 ALA CA . 19077 1 114 . 1 1 13 13 ALA CB C 13 18.987 0.3 . 1 . . . . 11 ALA CB . 19077 1 115 . 1 1 13 13 ALA N N 15 122.341 0.3 . 1 . . . . 11 ALA N . 19077 1 116 . 1 1 14 14 GLY H H 1 8.244 0.020 . 1 . . . . 12 GLY H . 19077 1 117 . 1 1 14 14 GLY HA2 H 1 3.937 0.020 . 1 . . . . 12 GLY HA2 . 19077 1 118 . 1 1 14 14 GLY HA3 H 1 3.937 0.020 . 1 . . . . 12 GLY HA3 . 19077 1 119 . 1 1 14 14 GLY C C 13 174.177 0.3 . 1 . . . . 12 GLY C . 19077 1 120 . 1 1 14 14 GLY CA C 13 45.377 0.3 . 1 . . . . 12 GLY CA . 19077 1 121 . 1 1 14 14 GLY N N 15 107.618 0.3 . 1 . . . . 12 GLY N . 19077 1 122 . 1 1 15 15 ALA H H 1 8.050 0.020 . 1 . . . . 13 ALA H . 19077 1 123 . 1 1 15 15 ALA HA H 1 4.299 0.020 . 1 . . . . 13 ALA HA . 19077 1 124 . 1 1 15 15 ALA HB1 H 1 1.377 0.020 . 1 . . . . 13 ALA HB . 19077 1 125 . 1 1 15 15 ALA HB2 H 1 1.377 0.020 . 1 . . . . 13 ALA HB . 19077 1 126 . 1 1 15 15 ALA HB3 H 1 1.377 0.020 . 1 . . . . 13 ALA HB . 19077 1 127 . 1 1 15 15 ALA C C 13 177.905 0.3 . 1 . . . . 13 ALA C . 19077 1 128 . 1 1 15 15 ALA CA C 13 52.600 0.3 . 1 . . . . 13 ALA CA . 19077 1 129 . 1 1 15 15 ALA CB C 13 19.039 0.3 . 1 . . . . 13 ALA CB . 19077 1 130 . 1 1 15 15 ALA N N 15 123.567 0.3 . 1 . . . . 13 ALA N . 19077 1 131 . 1 1 16 16 ALA H H 1 8.321 0.020 . 1 . . . . 14 ALA H . 19077 1 132 . 1 1 16 16 ALA HA H 1 4.299 0.020 . 1 . . . . 14 ALA HA . 19077 1 133 . 1 1 16 16 ALA HB1 H 1 1.388 0.020 . 1 . . . . 14 ALA HB . 19077 1 134 . 1 1 16 16 ALA HB2 H 1 1.388 0.020 . 1 . . . . 14 ALA HB . 19077 1 135 . 1 1 16 16 ALA HB3 H 1 1.388 0.020 . 1 . . . . 14 ALA HB . 19077 1 136 . 1 1 16 16 ALA C C 13 177.622 0.3 . 1 . . . . 14 ALA C . 19077 1 137 . 1 1 16 16 ALA CA C 13 52.688 0.3 . 1 . . . . 14 ALA CA . 19077 1 138 . 1 1 16 16 ALA CB C 13 19.058 0.3 . 1 . . . . 14 ALA CB . 19077 1 139 . 1 1 16 16 ALA N N 15 123.081 0.3 . 1 . . . . 14 ALA N . 19077 1 140 . 1 1 17 17 ASP H H 1 8.179 0.020 . 1 . . . . 15 ASP H . 19077 1 141 . 1 1 17 17 ASP HA H 1 4.577 0.020 . 1 . . . . 15 ASP HA . 19077 1 142 . 1 1 17 17 ASP HB2 H 1 2.689 0.020 . 1 . . . . 15 ASP HB2 . 19077 1 143 . 1 1 17 17 ASP HB3 H 1 2.689 0.020 . 1 . . . . 15 ASP HB3 . 19077 1 144 . 1 1 17 17 ASP C C 13 176.914 0.3 . 1 . . . . 15 ASP C . 19077 1 145 . 1 1 17 17 ASP CA C 13 54.302 0.3 . 1 . . . . 15 ASP CA . 19077 1 146 . 1 1 17 17 ASP CB C 13 41.204 0.3 . 1 . . . . 15 ASP CB . 19077 1 147 . 1 1 17 17 ASP N N 15 118.660 0.3 . 1 . . . . 15 ASP N . 19077 1 148 . 1 1 18 18 GLY H H 1 8.258 0.020 . 1 . . . . 16 GLY H . 19077 1 149 . 1 1 18 18 GLY HA2 H 1 3.926 0.020 . 1 . . . . 16 GLY HA2 . 19077 1 150 . 1 1 18 18 GLY HA3 H 1 3.926 0.020 . 1 . . . . 16 GLY HA3 . 19077 1 151 . 1 1 18 18 GLY C C 13 174.539 0.3 . 1 . . . . 16 GLY C . 19077 1 152 . 1 1 18 18 GLY CA C 13 45.671 0.3 . 1 . . . . 16 GLY CA . 19077 1 153 . 1 1 18 18 GLY N N 15 108.713 0.3 . 1 . . . . 16 GLY N . 19077 1 154 . 1 1 19 19 HIS H H 1 8.295 0.020 . 1 . . . . 17 HIS H . 19077 1 155 . 1 1 19 19 HIS HA H 1 4.672 0.020 . 1 . . . . 17 HIS HA . 19077 1 156 . 1 1 19 19 HIS HB2 H 1 3.286 0.020 . 2 . . . . 17 HIS HB2 . 19077 1 157 . 1 1 19 19 HIS HB3 H 1 3.180 0.020 . 2 . . . . 17 HIS HB3 . 19077 1 158 . 1 1 19 19 HIS C C 13 175.876 0.3 . 1 . . . . 17 HIS C . 19077 1 159 . 1 1 19 19 HIS CA C 13 56.387 0.3 . 1 . . . . 17 HIS CA . 19077 1 160 . 1 1 19 19 HIS CB C 13 29.988 0.3 . 1 . . . . 17 HIS CB . 19077 1 161 . 1 1 19 19 HIS N N 15 118.865 0.3 . 1 . . . . 17 HIS N . 19077 1 162 . 1 1 20 20 GLY H H 1 8.486 0.020 . 1 . . . . 18 GLY H . 19077 1 163 . 1 1 20 20 GLY HA2 H 1 4.001 0.020 . 1 . . . . 18 GLY HA2 . 19077 1 164 . 1 1 20 20 GLY HA3 H 1 4.001 0.020 . 1 . . . . 18 GLY HA3 . 19077 1 165 . 1 1 20 20 GLY C C 13 174.476 0.3 . 1 . . . . 18 GLY C . 19077 1 166 . 1 1 20 20 GLY CA C 13 45.524 0.3 . 1 . . . . 18 GLY CA . 19077 1 167 . 1 1 20 20 GLY N N 15 109.792 0.3 . 1 . . . . 18 GLY N . 19077 1 168 . 1 1 21 21 SER H H 1 8.334 0.020 . 1 . . . . 19 SER H . 19077 1 169 . 1 1 21 21 SER HA H 1 4.511 0.020 . 1 . . . . 19 SER HA . 19077 1 170 . 1 1 21 21 SER HB2 H 1 3.888 0.020 . 1 . . . . 19 SER HB2 . 19077 1 171 . 1 1 21 21 SER HB3 H 1 3.888 0.020 . 1 . . . . 19 SER HB3 . 19077 1 172 . 1 1 21 21 SER C C 13 175.168 0.3 . 1 . . . . 19 SER C . 19077 1 173 . 1 1 21 21 SER CA C 13 58.765 0.3 . 1 . . . . 19 SER CA . 19077 1 174 . 1 1 21 21 SER CB C 13 63.850 0.3 . 1 . . . . 19 SER CB . 19077 1 175 . 1 1 21 21 SER N N 15 115.792 0.3 . 1 . . . . 19 SER N . 19077 1 176 . 1 1 22 22 SER HA H 1 4.438 0.020 . 1 . . . . 20 SER HA . 19077 1 177 . 1 1 22 22 SER HB2 H 1 3.894 0.020 . 1 . . . . 20 SER HB2 . 19077 1 178 . 1 1 22 22 SER HB3 H 1 3.894 0.020 . 1 . . . . 20 SER HB3 . 19077 1 179 . 1 1 22 22 SER C C 13 174.807 0.3 . 1 . . . . 20 SER C . 19077 1 180 . 1 1 22 22 SER CA C 13 58.324 0.3 . 1 . . . . 20 SER CA . 19077 1 181 . 1 1 22 22 SER CB C 13 63.779 0.3 . 1 . . . . 20 SER CB . 19077 1 182 . 1 1 23 23 CYS H H 1 8.507 0.020 . 1 . . . . 21 CYS H . 19077 1 183 . 1 1 23 23 CYS HA H 1 4.783 0.020 . 1 . . . . 21 CYS HA . 19077 1 184 . 1 1 23 23 CYS HB2 H 1 2.743 0.020 . 1 . . . . 21 CYS HB2 . 19077 1 185 . 1 1 23 23 CYS HB3 H 1 2.743 0.020 . 1 . . . . 21 CYS HB3 . 19077 1 186 . 1 1 23 23 CYS C C 13 175.687 0.3 . 1 . . . . 21 CYS C . 19077 1 187 . 1 1 23 23 CYS CA C 13 55.888 0.3 . 1 . . . . 21 CYS CA . 19077 1 188 . 1 1 23 23 CYS CB C 13 29.560 0.3 . 1 . . . . 21 CYS CB . 19077 1 189 . 1 1 23 23 CYS N N 15 122.337 0.3 . 1 . . . . 21 CYS N . 19077 1 190 . 1 1 24 24 GLN HA H 1 4.246 0.020 . 1 . . . . 22 GLN HA . 19077 1 191 . 1 1 24 24 GLN HB2 H 1 1.921 0.020 . 1 . . . . 22 GLN HB2 . 19077 1 192 . 1 1 24 24 GLN HB3 H 1 1.921 0.020 . 1 . . . . 22 GLN HB3 . 19077 1 193 . 1 1 24 24 GLN HG2 H 1 2.231 0.020 . 1 . . . . 22 GLN HG2 . 19077 1 194 . 1 1 24 24 GLN HG3 H 1 2.231 0.020 . 1 . . . . 22 GLN HG3 . 19077 1 195 . 1 1 24 24 GLN C C 13 177.575 0.3 . 1 . . . . 22 GLN C . 19077 1 196 . 1 1 24 24 GLN CA C 13 58.648 0.3 . 1 . . . . 22 GLN CA . 19077 1 197 . 1 1 24 24 GLN CB C 13 28.631 0.3 . 1 . . . . 22 GLN CB . 19077 1 198 . 1 1 24 24 GLN CG C 13 33.602 0.3 . 1 . . . . 22 GLN CG . 19077 1 199 . 1 1 25 25 MET H H 1 8.244 0.020 . 1 . . . . 23 MET H . 19077 1 200 . 1 1 25 25 MET HA H 1 4.257 0.020 . 1 . . . . 23 MET HA . 19077 1 201 . 1 1 25 25 MET HB2 H 1 2.177 0.020 . 1 . . . . 23 MET HB2 . 19077 1 202 . 1 1 25 25 MET HB3 H 1 2.177 0.020 . 1 . . . . 23 MET HB3 . 19077 1 203 . 1 1 25 25 MET HG2 H 1 2.710 0.020 . 2 . . . . 23 MET HG2 . 19077 1 204 . 1 1 25 25 MET HG3 H 1 2.593 0.020 . 2 . . . . 23 MET HG3 . 19077 1 205 . 1 1 25 25 MET C C 13 178.660 0.3 . 1 . . . . 23 MET C . 19077 1 206 . 1 1 25 25 MET CA C 13 58.501 0.3 . 1 . . . . 23 MET CA . 19077 1 207 . 1 1 25 25 MET CB C 13 32.131 0.3 . 1 . . . . 23 MET CB . 19077 1 208 . 1 1 25 25 MET CG C 13 32.131 0.3 . 1 . . . . 23 MET CG . 19077 1 209 . 1 1 25 25 MET N N 15 118.795 0.3 . 1 . . . . 23 MET N . 19077 1 210 . 1 1 26 26 LEU H H 1 7.819 0.020 . 1 . . . . 24 LEU H . 19077 1 211 . 1 1 26 26 LEU HA H 1 4.203 0.020 . 1 . . . . 24 LEU HA . 19077 1 212 . 1 1 26 26 LEU HB2 H 1 1.879 0.020 . 2 . . . . 24 LEU HB2 . 19077 1 213 . 1 1 26 26 LEU HB3 H 1 1.452 0.020 . 2 . . . . 24 LEU HB3 . 19077 1 214 . 1 1 26 26 LEU HD11 H 1 0.972 0.020 . 1 . . . . 24 LEU HD1 . 19077 1 215 . 1 1 26 26 LEU HD12 H 1 0.972 0.020 . 1 . . . . 24 LEU HD1 . 19077 1 216 . 1 1 26 26 LEU HD13 H 1 0.972 0.020 . 1 . . . . 24 LEU HD1 . 19077 1 217 . 1 1 26 26 LEU HD21 H 1 0.972 0.020 . 1 . . . . 24 LEU HD2 . 19077 1 218 . 1 1 26 26 LEU HD22 H 1 0.972 0.020 . 1 . . . . 24 LEU HD2 . 19077 1 219 . 1 1 26 26 LEU HD23 H 1 0.972 0.020 . 1 . . . . 24 LEU HD2 . 19077 1 220 . 1 1 26 26 LEU C C 13 178.691 0.3 . 1 . . . . 24 LEU C . 19077 1 221 . 1 1 26 26 LEU CA C 13 57.561 0.3 . 1 . . . . 24 LEU CA . 19077 1 222 . 1 1 26 26 LEU CB C 13 42.276 0.3 . 1 . . . . 24 LEU CB . 19077 1 223 . 1 1 26 26 LEU CG C 13 25.361 0.3 . 1 . . . . 24 LEU CG . 19077 1 224 . 1 1 26 26 LEU CD1 C 13 18.719 0.3 . 1 . . . . 24 LEU CD1 . 19077 1 225 . 1 1 26 26 LEU CD2 C 13 18.719 0.3 . 1 . . . . 24 LEU CD2 . 19077 1 226 . 1 1 26 26 LEU N N 15 120.878 0.3 . 1 . . . . 24 LEU N . 19077 1 227 . 1 1 27 27 LEU H H 1 8.086 0.020 . 1 . . . . 25 LEU H . 19077 1 228 . 1 1 27 27 LEU HA H 1 4.246 0.020 . 1 . . . . 25 LEU HA . 19077 1 229 . 1 1 27 27 LEU HB2 H 1 1.377 0.020 . 1 . . . . 25 LEU HB2 . 19077 1 230 . 1 1 27 27 LEU HB3 H 1 1.377 0.020 . 1 . . . . 25 LEU HB3 . 19077 1 231 . 1 1 27 27 LEU HG H 1 1.090 0.020 . 1 . . . . 25 LEU HG . 19077 1 232 . 1 1 27 27 LEU HD11 H 1 0.738 0.020 . 1 . . . . 25 LEU HD1 . 19077 1 233 . 1 1 27 27 LEU HD12 H 1 0.738 0.020 . 1 . . . . 25 LEU HD1 . 19077 1 234 . 1 1 27 27 LEU HD13 H 1 0.738 0.020 . 1 . . . . 25 LEU HD1 . 19077 1 235 . 1 1 27 27 LEU HD21 H 1 0.738 0.020 . 1 . . . . 25 LEU HD2 . 19077 1 236 . 1 1 27 27 LEU HD22 H 1 0.738 0.020 . 1 . . . . 25 LEU HD2 . 19077 1 237 . 1 1 27 27 LEU HD23 H 1 0.738 0.020 . 1 . . . . 25 LEU HD2 . 19077 1 238 . 1 1 27 27 LEU C C 13 179.100 0.3 . 1 . . . . 25 LEU C . 19077 1 239 . 1 1 27 27 LEU CA C 13 58.442 0.3 . 1 . . . . 25 LEU CA . 19077 1 240 . 1 1 27 27 LEU CB C 13 41.418 0.3 . 1 . . . . 25 LEU CB . 19077 1 241 . 1 1 27 27 LEU CG C 13 27.201 0.3 . 1 . . . . 25 LEU CG . 19077 1 242 . 1 1 27 27 LEU CD1 C 13 18.639 0.3 . 1 . . . . 25 LEU CD1 . 19077 1 243 . 1 1 27 27 LEU CD2 C 13 18.639 0.3 . 1 . . . . 25 LEU CD2 . 19077 1 244 . 1 1 27 27 LEU N N 15 119.530 0.3 . 1 . . . . 25 LEU N . 19077 1 245 . 1 1 28 28 ASN H H 1 8.237 0.020 . 1 . . . . 26 ASN H . 19077 1 246 . 1 1 28 28 ASN HA H 1 4.299 0.020 . 1 . . . . 26 ASN HA . 19077 1 247 . 1 1 28 28 ASN HB2 H 1 2.955 0.020 . 2 . . . . 26 ASN HB2 . 19077 1 248 . 1 1 28 28 ASN HB3 H 1 2.894 0.020 . 2 . . . . 26 ASN HB3 . 19077 1 249 . 1 1 28 28 ASN C C 13 177.748 0.3 . 1 . . . . 26 ASN C . 19077 1 250 . 1 1 28 28 ASN CA C 13 55.946 0.3 . 1 . . . . 26 ASN CA . 19077 1 251 . 1 1 28 28 ASN CB C 13 37.847 0.3 . 1 . . . . 26 ASN CB . 19077 1 252 . 1 1 28 28 ASN N N 15 117.286 0.3 . 1 . . . . 26 ASN N . 19077 1 253 . 1 1 29 29 GLN H H 1 8.049 0.020 . 1 . . . . 27 GLN H . 19077 1 254 . 1 1 29 29 GLN HA H 1 4.150 0.020 . 1 . . . . 27 GLN HA . 19077 1 255 . 1 1 29 29 GLN HB2 H 1 2.230 0.020 . 1 . . . . 27 GLN HB2 . 19077 1 256 . 1 1 29 29 GLN HB3 H 1 2.230 0.020 . 1 . . . . 27 GLN HB3 . 19077 1 257 . 1 1 29 29 GLN HG2 H 1 2.311 0.020 . 1 . . . . 27 GLN HG2 . 19077 1 258 . 1 1 29 29 GLN HG3 H 1 2.311 0.020 . 1 . . . . 27 GLN HG3 . 19077 1 259 . 1 1 29 29 GLN C C 13 178.141 0.3 . 1 . . . . 27 GLN C . 19077 1 260 . 1 1 29 29 GLN CA C 13 58.912 0.3 . 1 . . . . 27 GLN CA . 19077 1 261 . 1 1 29 29 GLN CB C 13 28.702 0.3 . 1 . . . . 27 GLN CB . 19077 1 262 . 1 1 29 29 GLN CG C 13 34.003 0.3 . 1 . . . . 27 GLN CG . 19077 1 263 . 1 1 29 29 GLN N N 15 120.695 0.3 . 1 . . . . 27 GLN N . 19077 1 264 . 1 1 30 30 LEU H H 1 8.349 0.020 . 1 . . . . 28 LEU H . 19077 1 265 . 1 1 30 30 LEU HA H 1 4.075 0.020 . 1 . . . . 28 LEU HA . 19077 1 266 . 1 1 30 30 LEU HB2 H 1 1.783 0.020 . 1 . . . . 28 LEU HB2 . 19077 1 267 . 1 1 30 30 LEU HB3 H 1 1.783 0.020 . 1 . . . . 28 LEU HB3 . 19077 1 268 . 1 1 30 30 LEU HG H 1 1.655 0.020 . 1 . . . . 28 LEU HG . 19077 1 269 . 1 1 30 30 LEU HD11 H 1 0.866 0.020 . 1 . . . . 28 LEU HD1 . 19077 1 270 . 1 1 30 30 LEU HD12 H 1 0.866 0.020 . 1 . . . . 28 LEU HD1 . 19077 1 271 . 1 1 30 30 LEU HD13 H 1 0.866 0.020 . 1 . . . . 28 LEU HD1 . 19077 1 272 . 1 1 30 30 LEU HD21 H 1 0.866 0.020 . 1 . . . . 28 LEU HD2 . 19077 1 273 . 1 1 30 30 LEU HD22 H 1 0.866 0.020 . 1 . . . . 28 LEU HD2 . 19077 1 274 . 1 1 30 30 LEU HD23 H 1 0.866 0.020 . 1 . . . . 28 LEU HD2 . 19077 1 275 . 1 1 30 30 LEU C C 13 179.981 0.3 . 1 . . . . 28 LEU C . 19077 1 276 . 1 1 30 30 LEU CA C 13 57.590 0.3 . 1 . . . . 28 LEU CA . 19077 1 277 . 1 1 30 30 LEU CB C 13 42.419 0.3 . 1 . . . . 28 LEU CB . 19077 1 278 . 1 1 30 30 LEU CG C 13 25.441 0.3 . 1 . . . . 28 LEU CG . 19077 1 279 . 1 1 30 30 LEU CD1 C 13 20.640 0.3 . 1 . . . . 28 LEU CD1 . 19077 1 280 . 1 1 30 30 LEU CD2 C 13 20.640 0.3 . 1 . . . . 28 LEU CD2 . 19077 1 281 . 1 1 30 30 LEU N N 15 119.338 0.3 . 1 . . . . 28 LEU N . 19077 1 282 . 1 1 31 31 ARG H H 1 8.496 0.020 . 1 . . . . 29 ARG H . 19077 1 283 . 1 1 31 31 ARG HA H 1 4.107 0.020 . 1 . . . . 29 ARG HA . 19077 1 284 . 1 1 31 31 ARG HB2 H 1 2.039 0.020 . 1 . . . . 29 ARG HB2 . 19077 1 285 . 1 1 31 31 ARG HB3 H 1 2.039 0.020 . 1 . . . . 29 ARG HB3 . 19077 1 286 . 1 1 31 31 ARG HG2 H 1 1.783 0.020 . 1 . . . . 29 ARG HG2 . 19077 1 287 . 1 1 31 31 ARG HG3 H 1 1.783 0.020 . 1 . . . . 29 ARG HG3 . 19077 1 288 . 1 1 31 31 ARG HD2 H 1 3.270 0.020 . 2 . . . . 29 ARG HD2 . 19077 1 289 . 1 1 31 31 ARG HD3 H 1 3.148 0.020 . 2 . . . . 29 ARG HD3 . 19077 1 290 . 1 1 31 31 ARG C C 13 178.424 0.3 . 1 . . . . 29 ARG C . 19077 1 291 . 1 1 31 31 ARG CA C 13 59.264 0.3 . 1 . . . . 29 ARG CA . 19077 1 292 . 1 1 31 31 ARG CB C 13 30.560 0.3 . 1 . . . . 29 ARG CB . 19077 1 293 . 1 1 31 31 ARG CG C 13 26.321 0.3 . 1 . . . . 29 ARG CG . 19077 1 294 . 1 1 31 31 ARG CD C 13 43.605 0.3 . 1 . . . . 29 ARG CD . 19077 1 295 . 1 1 31 31 ARG N N 15 123.838 0.3 . 1 . . . . 29 ARG N . 19077 1 296 . 1 1 32 32 GLU H H 1 8.008 0.020 . 1 . . . . 30 GLU H . 19077 1 297 . 1 1 32 32 GLU HA H 1 4.011 0.020 . 1 . . . . 30 GLU HA . 19077 1 298 . 1 1 32 32 GLU HB2 H 1 2.145 0.020 . 1 . . . . 30 GLU HB2 . 19077 1 299 . 1 1 32 32 GLU HB3 H 1 2.145 0.020 . 1 . . . . 30 GLU HB3 . 19077 1 300 . 1 1 32 32 GLU HG2 H 1 2.369 0.020 . 2 . . . . 30 GLU HG2 . 19077 1 301 . 1 1 32 32 GLU HG3 H 1 2.294 0.020 . 2 . . . . 30 GLU HG3 . 19077 1 302 . 1 1 32 32 GLU C C 13 178.723 0.3 . 1 . . . . 30 GLU C . 19077 1 303 . 1 1 32 32 GLU CA C 13 59.146 0.3 . 1 . . . . 30 GLU CA . 19077 1 304 . 1 1 32 32 GLU CB C 13 29.631 0.3 . 1 . . . . 30 GLU CB . 19077 1 305 . 1 1 32 32 GLU CG C 13 36.083 0.3 . 1 . . . . 30 GLU CG . 19077 1 306 . 1 1 32 32 GLU N N 15 120.029 0.3 . 1 . . . . 30 GLU N . 19077 1 307 . 1 1 33 33 ILE H H 1 8.150 0.020 . 1 . . . . 31 ILE H . 19077 1 308 . 1 1 33 33 ILE HA H 1 3.905 0.020 . 1 . . . . 31 ILE HA . 19077 1 309 . 1 1 33 33 ILE HB H 1 1.708 0.020 . 1 . . . . 31 ILE HB . 19077 1 310 . 1 1 33 33 ILE HG12 H 1 1.112 0.020 . 1 . . . . 31 ILE HG12 . 19077 1 311 . 1 1 33 33 ILE HG13 H 1 1.112 0.020 . 1 . . . . 31 ILE HG13 . 19077 1 312 . 1 1 33 33 ILE HG21 H 1 0.939 0.020 . 1 . . . . 31 ILE HG2 . 19077 1 313 . 1 1 33 33 ILE HG22 H 1 0.939 0.020 . 1 . . . . 31 ILE HG2 . 19077 1 314 . 1 1 33 33 ILE HG23 H 1 0.939 0.020 . 1 . . . . 31 ILE HG2 . 19077 1 315 . 1 1 33 33 ILE HD11 H 1 0.809 0.020 . 1 . . . . 31 ILE HD1 . 19077 1 316 . 1 1 33 33 ILE HD12 H 1 0.809 0.020 . 1 . . . . 31 ILE HD1 . 19077 1 317 . 1 1 33 33 ILE HD13 H 1 0.809 0.020 . 1 . . . . 31 ILE HD1 . 19077 1 318 . 1 1 33 33 ILE C C 13 177.921 0.3 . 1 . . . . 31 ILE C . 19077 1 319 . 1 1 33 33 ILE CA C 13 64.372 0.3 . 1 . . . . 31 ILE CA . 19077 1 320 . 1 1 33 33 ILE CB C 13 39.847 0.3 . 1 . . . . 31 ILE CB . 19077 1 321 . 1 1 33 33 ILE CG1 C 13 28.081 0.3 . 1 . . . . 31 ILE CG1 . 19077 1 322 . 1 1 33 33 ILE CG2 C 13 17.759 0.3 . 1 . . . . 31 ILE CG2 . 19077 1 323 . 1 1 33 33 ILE CD1 C 13 14.478 0.3 . 1 . . . . 31 ILE CD1 . 19077 1 324 . 1 1 33 33 ILE N N 15 116.888 0.3 . 1 . . . . 31 ILE N . 19077 1 325 . 1 1 34 34 THR H H 1 7.917 0.020 . 1 . . . . 32 THR H . 19077 1 326 . 1 1 34 34 THR HA H 1 4.331 0.020 . 1 . . . . 32 THR HA . 19077 1 327 . 1 1 34 34 THR HB H 1 4.171 0.020 . 1 . . . . 32 THR HB . 19077 1 328 . 1 1 34 34 THR HG21 H 1 1.335 0.020 . 1 . . . . 32 THR HG2 . 19077 1 329 . 1 1 34 34 THR HG22 H 1 1.335 0.020 . 1 . . . . 32 THR HG2 . 19077 1 330 . 1 1 34 34 THR HG23 H 1 1.335 0.020 . 1 . . . . 32 THR HG2 . 19077 1 331 . 1 1 34 34 THR C C 13 176.206 0.3 . 1 . . . . 32 THR C . 19077 1 332 . 1 1 34 34 THR CA C 13 63.110 0.3 . 1 . . . . 32 THR CA . 19077 1 333 . 1 1 34 34 THR CB C 13 71.637 0.3 . 1 . . . . 32 THR CB . 19077 1 334 . 1 1 34 34 THR CG2 C 13 22.160 0.3 . 1 . . . . 32 THR CG2 . 19077 1 335 . 1 1 34 34 THR N N 15 106.661 0.3 . 1 . . . . 32 THR N . 19077 1 336 . 1 1 35 35 GLY H H 1 8.327 0.020 . 1 . . . . 33 GLY H . 19077 1 337 . 1 1 35 35 GLY HA2 H 1 4.161 0.020 . 2 . . . . 33 GLY HA2 . 19077 1 338 . 1 1 35 35 GLY HA3 H 1 3.819 0.020 . 2 . . . . 33 GLY HA3 . 19077 1 339 . 1 1 35 35 GLY C C 13 174.083 0.3 . 1 . . . . 33 GLY C . 19077 1 340 . 1 1 35 35 GLY CA C 13 45.788 0.3 . 1 . . . . 33 GLY CA . 19077 1 341 . 1 1 35 35 GLY N N 15 111.646 0.3 . 1 . . . . 33 GLY N . 19077 1 342 . 1 1 36 36 ILE H H 1 7.858 0.020 . 1 . . . . 34 ILE H . 19077 1 343 . 1 1 36 36 ILE HA H 1 3.947 0.020 . 1 . . . . 34 ILE HA . 19077 1 344 . 1 1 36 36 ILE HB H 1 1.932 0.020 . 1 . . . . 34 ILE HB . 19077 1 345 . 1 1 36 36 ILE HG12 H 1 1.164 0.020 . 2 . . . . 34 ILE HG12 . 19077 1 346 . 1 1 36 36 ILE HG13 H 1 1.111 0.020 . 2 . . . . 34 ILE HG13 . 19077 1 347 . 1 1 36 36 ILE HG21 H 1 1.004 0.020 . 1 . . . . 34 ILE HG2 . 19077 1 348 . 1 1 36 36 ILE HG22 H 1 1.004 0.020 . 1 . . . . 34 ILE HG2 . 19077 1 349 . 1 1 36 36 ILE HG23 H 1 1.004 0.020 . 1 . . . . 34 ILE HG2 . 19077 1 350 . 1 1 36 36 ILE HD11 H 1 0.888 0.020 . 1 . . . . 34 ILE HD1 . 19077 1 351 . 1 1 36 36 ILE HD12 H 1 0.888 0.020 . 1 . . . . 34 ILE HD1 . 19077 1 352 . 1 1 36 36 ILE HD13 H 1 0.888 0.020 . 1 . . . . 34 ILE HD1 . 19077 1 353 . 1 1 36 36 ILE C C 13 174.885 0.3 . 1 . . . . 34 ILE C . 19077 1 354 . 1 1 36 36 ILE CA C 13 61.407 0.3 . 1 . . . . 34 ILE CA . 19077 1 355 . 1 1 36 36 ILE CB C 13 37.775 0.3 . 1 . . . . 34 ILE CB . 19077 1 356 . 1 1 36 36 ILE CG1 C 13 27.841 0.3 . 1 . . . . 34 ILE CG1 . 19077 1 357 . 1 1 36 36 ILE CG2 C 13 17.279 0.3 . 1 . . . . 34 ILE CG2 . 19077 1 358 . 1 1 36 36 ILE CD1 C 13 13.118 0.3 . 1 . . . . 34 ILE CD1 . 19077 1 359 . 1 1 36 36 ILE N N 15 123.499 0.3 . 1 . . . . 34 ILE N . 19077 1 360 . 1 1 37 37 GLN H H 1 8.309 0.020 . 1 . . . . 35 GLN H . 19077 1 361 . 1 1 37 37 GLN HA H 1 4.214 0.020 . 1 . . . . 35 GLN HA . 19077 1 362 . 1 1 37 37 GLN HB2 H 1 2.231 0.020 . 2 . . . . 35 GLN HB2 . 19077 1 363 . 1 1 37 37 GLN HB3 H 1 1.879 0.020 . 2 . . . . 35 GLN HB3 . 19077 1 364 . 1 1 37 37 GLN HG2 H 1 2.412 0.020 . 2 . . . . 35 GLN HG2 . 19077 1 365 . 1 1 37 37 GLN HG3 H 1 2.337 0.020 . 2 . . . . 35 GLN HG3 . 19077 1 366 . 1 1 37 37 GLN C C 13 176.285 0.3 . 1 . . . . 35 GLN C . 19077 1 367 . 1 1 37 37 GLN CA C 13 55.447 0.3 . 1 . . . . 35 GLN CA . 19077 1 368 . 1 1 37 37 GLN CB C 13 29.845 0.3 . 1 . . . . 35 GLN CB . 19077 1 369 . 1 1 37 37 GLN CG C 13 33.282 0.3 . 1 . . . . 35 GLN CG . 19077 1 370 . 1 1 37 37 GLN N N 15 121.515 0.3 . 1 . . . . 35 GLN N . 19077 1 371 . 1 1 38 38 ASP H H 1 7.303 0.020 . 1 . . . . 36 ASP H . 19077 1 372 . 1 1 38 38 ASP HA H 1 4.583 0.020 . 1 . . . . 36 ASP HA . 19077 1 373 . 1 1 38 38 ASP HB2 H 1 2.724 0.020 . 2 . . . . 36 ASP HB2 . 19077 1 374 . 1 1 38 38 ASP HB3 H 1 2.567 0.020 . 2 . . . . 36 ASP HB3 . 19077 1 375 . 1 1 38 38 ASP C C 13 174.633 0.3 . 1 . . . . 36 ASP C . 19077 1 376 . 1 1 38 38 ASP CA C 13 51.748 0.3 . 1 . . . . 36 ASP CA . 19077 1 377 . 1 1 38 38 ASP CB C 13 41.990 0.3 . 1 . . . . 36 ASP CB . 19077 1 378 . 1 1 38 38 ASP N N 15 120.566 0.3 . 1 . . . . 36 ASP N . 19077 1 379 . 1 1 39 39 PRO HA H 1 4.246 0.020 . 1 . . . . 37 PRO HA . 19077 1 380 . 1 1 39 39 PRO HB2 H 1 2.348 0.020 . 2 . . . . 37 PRO HB2 . 19077 1 381 . 1 1 39 39 PRO HB3 H 1 2.081 0.020 . 2 . . . . 37 PRO HB3 . 19077 1 382 . 1 1 39 39 PRO HG2 H 1 1.837 0.020 . 1 . . . . 37 PRO HG2 . 19077 1 383 . 1 1 39 39 PRO HG3 H 1 1.837 0.020 . 1 . . . . 37 PRO HG3 . 19077 1 384 . 1 1 39 39 PRO HD2 H 1 3.939 0.020 . 1 . . . . 37 PRO HD2 . 19077 1 385 . 1 1 39 39 PRO HD3 H 1 3.939 0.020 . 1 . . . . 37 PRO HD3 . 19077 1 386 . 1 1 39 39 PRO C C 13 178.597 0.3 . 1 . . . . 37 PRO C . 19077 1 387 . 1 1 39 39 PRO CA C 13 64.724 0.3 . 1 . . . . 37 PRO CA . 19077 1 388 . 1 1 39 39 PRO CB C 13 32.131 0.3 . 1 . . . . 37 PRO CB . 19077 1 389 . 1 1 39 39 PRO CG C 13 27.121 0.3 . 1 . . . . 37 PRO CG . 19077 1 390 . 1 1 39 39 PRO CD C 13 51.046 0.3 . 1 . . . . 37 PRO CD . 19077 1 391 . 1 1 40 40 SER H H 1 8.375 0.020 . 1 . . . . 38 SER H . 19077 1 392 . 1 1 40 40 SER HA H 1 4.321 0.020 . 1 . . . . 38 SER HA . 19077 1 393 . 1 1 40 40 SER HB2 H 1 3.926 0.020 . 1 . . . . 38 SER HB2 . 19077 1 394 . 1 1 40 40 SER HB3 H 1 3.926 0.020 . 1 . . . . 38 SER HB3 . 19077 1 395 . 1 1 40 40 SER C C 13 176.772 0.3 . 1 . . . . 38 SER C . 19077 1 396 . 1 1 40 40 SER CA C 13 61.642 0.3 . 1 . . . . 38 SER CA . 19077 1 397 . 1 1 40 40 SER CB C 13 62.649 0.3 . 1 . . . . 38 SER CB . 19077 1 398 . 1 1 40 40 SER N N 15 115.184 0.3 . 1 . . . . 38 SER N . 19077 1 399 . 1 1 41 41 PHE H H 1 7.549 0.020 . 1 . . . . 39 PHE H . 19077 1 400 . 1 1 41 41 PHE HA H 1 4.491 0.020 . 1 . . . . 39 PHE HA . 19077 1 401 . 1 1 41 41 PHE HB2 H 1 3.126 0.020 . 1 . . . . 39 PHE HB2 . 19077 1 402 . 1 1 41 41 PHE HB3 H 1 3.126 0.020 . 1 . . . . 39 PHE HB3 . 19077 1 403 . 1 1 41 41 PHE C C 13 178.440 0.3 . 1 . . . . 39 PHE C . 19077 1 404 . 1 1 41 41 PHE CA C 13 59.176 0.3 . 1 . . . . 39 PHE CA . 19077 1 405 . 1 1 41 41 PHE CB C 13 38.990 0.3 . 1 . . . . 39 PHE CB . 19077 1 406 . 1 1 41 41 PHE N N 15 122.201 0.3 . 1 . . . . 39 PHE N . 19077 1 407 . 1 1 42 42 LEU H H 1 7.671 0.020 . 1 . . . . 40 LEU H . 19077 1 408 . 1 1 42 42 LEU HA H 1 3.958 0.020 . 1 . . . . 40 LEU HA . 19077 1 409 . 1 1 42 42 LEU HB2 H 1 1.879 0.020 . 2 . . . . 40 LEU HB2 . 19077 1 410 . 1 1 42 42 LEU HB3 H 1 1.303 0.020 . 2 . . . . 40 LEU HB3 . 19077 1 411 . 1 1 42 42 LEU HD11 H 1 0.866 0.020 . 2 . . . . 40 LEU HD1 . 19077 1 412 . 1 1 42 42 LEU HD12 H 1 0.866 0.020 . 2 . . . . 40 LEU HD1 . 19077 1 413 . 1 1 42 42 LEU HD13 H 1 0.866 0.020 . 2 . . . . 40 LEU HD1 . 19077 1 414 . 1 1 42 42 LEU HD21 H 1 0.759 0.020 . 2 . . . . 40 LEU HD2 . 19077 1 415 . 1 1 42 42 LEU HD22 H 1 0.759 0.020 . 2 . . . . 40 LEU HD2 . 19077 1 416 . 1 1 42 42 LEU HD23 H 1 0.759 0.020 . 2 . . . . 40 LEU HD2 . 19077 1 417 . 1 1 42 42 LEU C C 13 177.873 0.3 . 1 . . . . 40 LEU C . 19077 1 418 . 1 1 42 42 LEU CA C 13 57.737 0.3 . 1 . . . . 40 LEU CA . 19077 1 419 . 1 1 42 42 LEU CB C 13 42.562 0.3 . 1 . . . . 40 LEU CB . 19077 1 420 . 1 1 42 42 LEU CG C 13 27.041 0.3 . 1 . . . . 40 LEU CG . 19077 1 421 . 1 1 42 42 LEU CD1 C 13 25.201 0.3 . 1 . . . . 40 LEU CD1 . 19077 1 422 . 1 1 42 42 LEU CD2 C 13 22.560 0.3 . 1 . . . . 40 LEU CD2 . 19077 1 423 . 1 1 42 42 LEU N N 15 117.975 0.3 . 1 . . . . 40 LEU N . 19077 1 424 . 1 1 43 43 HIS H H 1 8.441 0.020 . 1 . . . . 41 HIS H . 19077 1 425 . 1 1 43 43 HIS HA H 1 4.182 0.020 . 1 . . . . 41 HIS HA . 19077 1 426 . 1 1 43 43 HIS HB2 H 1 3.233 0.020 . 1 . . . . 41 HIS HB2 . 19077 1 427 . 1 1 43 43 HIS HB3 H 1 3.233 0.020 . 1 . . . . 41 HIS HB3 . 19077 1 428 . 1 1 43 43 HIS C C 13 178.015 0.3 . 1 . . . . 41 HIS C . 19077 1 429 . 1 1 43 43 HIS CA C 13 59.645 0.3 . 1 . . . . 41 HIS CA . 19077 1 430 . 1 1 43 43 HIS CB C 13 30.560 0.3 . 1 . . . . 41 HIS CB . 19077 1 431 . 1 1 43 43 HIS N N 15 117.284 0.3 . 1 . . . . 41 HIS N . 19077 1 432 . 1 1 44 44 GLU H H 1 8.063 0.020 . 1 . . . . 42 GLU H . 19077 1 433 . 1 1 44 44 GLU HA H 1 3.979 0.020 . 1 . . . . 42 GLU HA . 19077 1 434 . 1 1 44 44 GLU HB2 H 1 2.103 0.020 . 1 . . . . 42 GLU HB2 . 19077 1 435 . 1 1 44 44 GLU HB3 H 1 2.103 0.020 . 1 . . . . 42 GLU HB3 . 19077 1 436 . 1 1 44 44 GLU HG2 H 1 2.422 0.020 . 1 . . . . 42 GLU HG2 . 19077 1 437 . 1 1 44 44 GLU HG3 H 1 2.422 0.020 . 1 . . . . 42 GLU HG3 . 19077 1 438 . 1 1 44 44 GLU C C 13 178.959 0.3 . 1 . . . . 42 GLU C . 19077 1 439 . 1 1 44 44 GLU CA C 13 59.117 0.3 . 1 . . . . 42 GLU CA . 19077 1 440 . 1 1 44 44 GLU CB C 13 29.274 0.3 . 1 . . . . 42 GLU CB . 19077 1 441 . 1 1 44 44 GLU CG C 13 35.763 0.3 . 1 . . . . 42 GLU CG . 19077 1 442 . 1 1 44 44 GLU N N 15 118.334 0.3 . 1 . . . . 42 GLU N . 19077 1 443 . 1 1 45 45 ALA H H 1 7.827 0.020 . 1 . . . . 43 ALA H . 19077 1 444 . 1 1 45 45 ALA HA H 1 3.969 0.020 . 1 . . . . 43 ALA HA . 19077 1 445 . 1 1 45 45 ALA HB1 H 1 1.441 0.020 . 1 . . . . 43 ALA HB . 19077 1 446 . 1 1 45 45 ALA HB2 H 1 1.441 0.020 . 1 . . . . 43 ALA HB . 19077 1 447 . 1 1 45 45 ALA HB3 H 1 1.441 0.020 . 1 . . . . 43 ALA HB . 19077 1 448 . 1 1 45 45 ALA C C 13 179.635 0.3 . 1 . . . . 43 ALA C . 19077 1 449 . 1 1 45 45 ALA CA C 13 54.743 0.3 . 1 . . . . 43 ALA CA . 19077 1 450 . 1 1 45 45 ALA CB C 13 18.344 0.3 . 1 . . . . 43 ALA CB . 19077 1 451 . 1 1 45 45 ALA N N 15 122.209 0.3 . 1 . . . . 43 ALA N . 19077 1 452 . 1 1 46 46 LEU H H 1 8.024 0.020 . 1 . . . . 44 LEU H . 19077 1 453 . 1 1 46 46 LEU HA H 1 4.267 0.020 . 1 . . . . 44 LEU HA . 19077 1 454 . 1 1 46 46 LEU HB2 H 1 1.847 0.020 . 2 . . . . 44 LEU HB2 . 19077 1 455 . 1 1 46 46 LEU HB3 H 1 1.623 0.020 . 2 . . . . 44 LEU HB3 . 19077 1 456 . 1 1 46 46 LEU HG H 1 1.441 0.020 . 1 . . . . 44 LEU HG . 19077 1 457 . 1 1 46 46 LEU HD11 H 1 0.760 0.020 . 1 . . . . 44 LEU HD1 . 19077 1 458 . 1 1 46 46 LEU HD12 H 1 0.760 0.020 . 1 . . . . 44 LEU HD1 . 19077 1 459 . 1 1 46 46 LEU HD13 H 1 0.760 0.020 . 1 . . . . 44 LEU HD1 . 19077 1 460 . 1 1 46 46 LEU HD21 H 1 0.760 0.020 . 1 . . . . 44 LEU HD2 . 19077 1 461 . 1 1 46 46 LEU HD22 H 1 0.760 0.020 . 1 . . . . 44 LEU HD2 . 19077 1 462 . 1 1 46 46 LEU HD23 H 1 0.760 0.020 . 1 . . . . 44 LEU HD2 . 19077 1 463 . 1 1 46 46 LEU C C 13 179.352 0.3 . 1 . . . . 44 LEU C . 19077 1 464 . 1 1 46 46 LEU CA C 13 57.532 0.3 . 1 . . . . 44 LEU CA . 19077 1 465 . 1 1 46 46 LEU CB C 13 41.919 0.3 . 1 . . . . 44 LEU CB . 19077 1 466 . 1 1 46 46 LEU CG C 13 26.863 0.3 . 1 . . . . 44 LEU CG . 19077 1 467 . 1 1 46 46 LEU CD1 C 13 24.401 0.3 . 1 . . . . 44 LEU CD1 . 19077 1 468 . 1 1 46 46 LEU CD2 C 13 24.401 0.3 . 1 . . . . 44 LEU CD2 . 19077 1 469 . 1 1 46 46 LEU N N 15 119.338 0.3 . 1 . . . . 44 LEU N . 19077 1 470 . 1 1 47 47 LYS H H 1 8.332 0.020 . 1 . . . . 45 LYS H . 19077 1 471 . 1 1 47 47 LYS HA H 1 4.310 0.020 . 1 . . . . 45 LYS HA . 19077 1 472 . 1 1 47 47 LYS HB2 H 1 1.772 0.020 . 1 . . . . 45 LYS HB2 . 19077 1 473 . 1 1 47 47 LYS HB3 H 1 1.772 0.020 . 1 . . . . 45 LYS HB3 . 19077 1 474 . 1 1 47 47 LYS HG2 H 1 1.178 0.020 . 1 . . . . 45 LYS HG2 . 19077 1 475 . 1 1 47 47 LYS HG3 H 1 1.178 0.020 . 1 . . . . 45 LYS HG3 . 19077 1 476 . 1 1 47 47 LYS HD2 H 1 1.420 0.020 . 1 . . . . 45 LYS HD2 . 19077 1 477 . 1 1 47 47 LYS HD3 H 1 1.420 0.020 . 1 . . . . 45 LYS HD3 . 19077 1 478 . 1 1 47 47 LYS HE2 H 1 2.998 0.020 . 1 . . . . 45 LYS HE2 . 19077 1 479 . 1 1 47 47 LYS HE3 H 1 2.998 0.020 . 1 . . . . 45 LYS HE3 . 19077 1 480 . 1 1 47 47 LYS C C 13 179.949 0.3 . 1 . . . . 45 LYS C . 19077 1 481 . 1 1 47 47 LYS CA C 13 59.117 0.3 . 1 . . . . 45 LYS CA . 19077 1 482 . 1 1 47 47 LYS CB C 13 32.417 0.3 . 1 . . . . 45 LYS CB . 19077 1 483 . 1 1 47 47 LYS CG C 13 24.481 0.3 . 1 . . . . 45 LYS CG . 19077 1 484 . 1 1 47 47 LYS CD C 13 28.721 0.3 . 1 . . . . 45 LYS CD . 19077 1 485 . 1 1 47 47 LYS CE C 13 40.724 0.3 . 1 . . . . 45 LYS CE . 19077 1 486 . 1 1 47 47 LYS N N 15 120.904 0.3 . 1 . . . . 45 LYS N . 19077 1 487 . 1 1 48 48 ALA H H 1 8.145 0.020 . 1 . . . . 46 ALA H . 19077 1 488 . 1 1 48 48 ALA HA H 1 4.193 0.020 . 1 . . . . 46 ALA HA . 19077 1 489 . 1 1 48 48 ALA HB1 H 1 1.484 0.020 . 1 . . . . 46 ALA HB . 19077 1 490 . 1 1 48 48 ALA HB2 H 1 1.484 0.020 . 1 . . . . 46 ALA HB . 19077 1 491 . 1 1 48 48 ALA HB3 H 1 1.484 0.020 . 1 . . . . 46 ALA HB . 19077 1 492 . 1 1 48 48 ALA C C 13 178.628 0.3 . 1 . . . . 46 ALA C . 19077 1 493 . 1 1 48 48 ALA CA C 13 54.214 0.3 . 1 . . . . 46 ALA CA . 19077 1 494 . 1 1 48 48 ALA CB C 13 18.487 0.3 . 1 . . . . 46 ALA CB . 19077 1 495 . 1 1 48 48 ALA N N 15 122.326 0.3 . 1 . . . . 46 ALA N . 19077 1 496 . 1 1 49 49 SER H H 1 7.635 0.020 . 1 . . . . 47 SER H . 19077 1 497 . 1 1 49 49 SER HA H 1 4.502 0.020 . 1 . . . . 47 SER HA . 19077 1 498 . 1 1 49 49 SER HB2 H 1 3.969 0.020 . 2 . . . . 47 SER HB2 . 19077 1 499 . 1 1 49 49 SER HB3 H 1 3.915 0.020 . 2 . . . . 47 SER HB3 . 19077 1 500 . 1 1 49 49 SER C C 13 174.995 0.3 . 1 . . . . 47 SER C . 19077 1 501 . 1 1 49 49 SER CA C 13 57.972 0.3 . 1 . . . . 47 SER CA . 19077 1 502 . 1 1 49 49 SER CB C 13 64.208 0.3 . 1 . . . . 47 SER CB . 19077 1 503 . 1 1 49 49 SER N N 15 111.021 0.3 . 1 . . . . 47 SER N . 19077 1 504 . 1 1 50 50 ASN H H 1 8.099 0.020 . 1 . . . . 48 ASN H . 19077 1 505 . 1 1 50 50 ASN HA H 1 4.470 0.020 . 1 . . . . 48 ASN HA . 19077 1 506 . 1 1 50 50 ASN HB2 H 1 3.094 0.020 . 2 . . . . 48 ASN HB2 . 19077 1 507 . 1 1 50 50 ASN HB3 H 1 2.774 0.020 . 2 . . . . 48 ASN HB3 . 19077 1 508 . 1 1 50 50 ASN C C 13 175.514 0.3 . 1 . . . . 48 ASN C . 19077 1 509 . 1 1 50 50 ASN CA C 13 54.126 0.3 . 1 . . . . 48 ASN CA . 19077 1 510 . 1 1 50 50 ASN CB C 13 37.704 0.3 . 1 . . . . 48 ASN CB . 19077 1 511 . 1 1 50 50 ASN N N 15 119.684 0.3 . 1 . . . . 48 ASN N . 19077 1 512 . 1 1 51 51 GLY H H 1 8.487 0.020 . 1 . . . . 49 GLY H . 19077 1 513 . 1 1 51 51 GLY HA2 H 1 4.086 0.020 . 2 . . . . 49 GLY HA2 . 19077 1 514 . 1 1 51 51 GLY HA3 H 1 3.372 0.020 . 2 . . . . 49 GLY HA3 . 19077 1 515 . 1 1 51 51 GLY C C 13 172.620 0.3 . 1 . . . . 49 GLY C . 19077 1 516 . 1 1 51 51 GLY CA C 13 45.612 0.3 . 1 . . . . 49 GLY CA . 19077 1 517 . 1 1 51 51 GLY N N 15 103.971 0.3 . 1 . . . . 49 GLY N . 19077 1 518 . 1 1 52 52 ASP H H 1 7.400 0.020 . 1 . . . . 50 ASP H . 19077 1 519 . 1 1 52 52 ASP HA H 1 4.704 0.020 . 1 . . . . 50 ASP HA . 19077 1 520 . 1 1 52 52 ASP HB2 H 1 2.977 0.020 . 2 . . . . 50 ASP HB2 . 19077 1 521 . 1 1 52 52 ASP HB3 H 1 2.614 0.020 . 2 . . . . 50 ASP HB3 . 19077 1 522 . 1 1 52 52 ASP C C 13 176.552 0.3 . 1 . . . . 50 ASP C . 19077 1 523 . 1 1 52 52 ASP CA C 13 53.480 0.3 . 1 . . . . 50 ASP CA . 19077 1 524 . 1 1 52 52 ASP CB C 13 42.133 0.3 . 1 . . . . 50 ASP CB . 19077 1 525 . 1 1 52 52 ASP N N 15 120.151 0.3 . 1 . . . . 50 ASP N . 19077 1 526 . 1 1 53 53 ILE H H 1 8.650 0.020 . 1 . . . . 51 ILE H . 19077 1 527 . 1 1 53 53 ILE HA H 1 3.787 0.020 . 1 . . . . 51 ILE HA . 19077 1 528 . 1 1 53 53 ILE HB H 1 1.932 0.020 . 1 . . . . 51 ILE HB . 19077 1 529 . 1 1 53 53 ILE HG12 H 1 1.516 0.020 . 2 . . . . 51 ILE HG12 . 19077 1 530 . 1 1 53 53 ILE HG13 H 1 1.356 0.020 . 2 . . . . 51 ILE HG13 . 19077 1 531 . 1 1 53 53 ILE HG21 H 1 0.908 0.020 . 1 . . . . 51 ILE HG2 . 19077 1 532 . 1 1 53 53 ILE HG22 H 1 0.908 0.020 . 1 . . . . 51 ILE HG2 . 19077 1 533 . 1 1 53 53 ILE HG23 H 1 0.908 0.020 . 1 . . . . 51 ILE HG2 . 19077 1 534 . 1 1 53 53 ILE HD11 H 1 0.834 0.020 . 1 . . . . 51 ILE HD1 . 19077 1 535 . 1 1 53 53 ILE HD12 H 1 0.834 0.020 . 1 . . . . 51 ILE HD1 . 19077 1 536 . 1 1 53 53 ILE HD13 H 1 0.834 0.020 . 1 . . . . 51 ILE HD1 . 19077 1 537 . 1 1 53 53 ILE C C 13 176.065 0.3 . 1 . . . . 51 ILE C . 19077 1 538 . 1 1 53 53 ILE CA C 13 63.462 0.3 . 1 . . . . 51 ILE CA . 19077 1 539 . 1 1 53 53 ILE CB C 13 37.561 0.3 . 1 . . . . 51 ILE CB . 19077 1 540 . 1 1 53 53 ILE CG1 C 13 28.161 0.3 . 1 . . . . 51 ILE CG1 . 19077 1 541 . 1 1 53 53 ILE CG2 C 13 17.039 0.3 . 1 . . . . 51 ILE CG2 . 19077 1 542 . 1 1 53 53 ILE CD1 C 13 12.718 0.3 . 1 . . . . 51 ILE CD1 . 19077 1 543 . 1 1 53 53 ILE N N 15 127.515 0.3 . 1 . . . . 51 ILE N . 19077 1 544 . 1 1 54 54 THR H H 1 7.935 0.020 . 1 . . . . 52 THR H . 19077 1 545 . 1 1 54 54 THR HA H 1 4.299 0.020 . 1 . . . . 52 THR HA . 19077 1 546 . 1 1 54 54 THR HB H 1 4.214 0.020 . 1 . . . . 52 THR HB . 19077 1 547 . 1 1 54 54 THR HG21 H 1 1.198 0.020 . 1 . . . . 52 THR HG2 . 19077 1 548 . 1 1 54 54 THR HG22 H 1 1.198 0.020 . 1 . . . . 52 THR HG2 . 19077 1 549 . 1 1 54 54 THR HG23 H 1 1.198 0.020 . 1 . . . . 52 THR HG2 . 19077 1 550 . 1 1 54 54 THR C C 13 177.181 0.3 . 1 . . . . 52 THR C . 19077 1 551 . 1 1 54 54 THR CA C 13 66.280 0.3 . 1 . . . . 52 THR CA . 19077 1 552 . 1 1 54 54 THR CB C 13 68.065 0.3 . 1 . . . . 52 THR CB . 19077 1 553 . 1 1 54 54 THR CG2 C 13 21.920 0.3 . 1 . . . . 52 THR CG2 . 19077 1 554 . 1 1 54 54 THR N N 15 117.016 0.3 . 1 . . . . 52 THR N . 19077 1 555 . 1 1 55 55 GLN H H 1 8.149 0.020 . 1 . . . . 53 GLN H . 19077 1 556 . 1 1 55 55 GLN HA H 1 4.193 0.020 . 1 . . . . 53 GLN HA . 19077 1 557 . 1 1 55 55 GLN HB2 H 1 2.113 0.020 . 1 . . . . 53 GLN HB2 . 19077 1 558 . 1 1 55 55 GLN HB3 H 1 2.113 0.020 . 1 . . . . 53 GLN HB3 . 19077 1 559 . 1 1 55 55 GLN HG2 H 1 2.433 0.020 . 1 . . . . 53 GLN HG2 . 19077 1 560 . 1 1 55 55 GLN HG3 H 1 2.433 0.020 . 1 . . . . 53 GLN HG3 . 19077 1 561 . 1 1 55 55 GLN C C 13 177.858 0.3 . 1 . . . . 53 GLN C . 19077 1 562 . 1 1 55 55 GLN CA C 13 57.825 0.3 . 1 . . . . 53 GLN CA . 19077 1 563 . 1 1 55 55 GLN CB C 13 28.702 0.3 . 1 . . . . 53 GLN CB . 19077 1 564 . 1 1 55 55 GLN CG C 13 33.522 0.3 . 1 . . . . 53 GLN CG . 19077 1 565 . 1 1 55 55 GLN N N 15 121.979 0.3 . 1 . . . . 53 GLN N . 19077 1 566 . 1 1 56 56 ALA H H 1 8.274 0.020 . 1 . . . . 54 ALA H . 19077 1 567 . 1 1 56 56 ALA HA H 1 4.001 0.020 . 1 . . . . 54 ALA HA . 19077 1 568 . 1 1 56 56 ALA HB1 H 1 1.356 0.020 . 1 . . . . 54 ALA HB . 19077 1 569 . 1 1 56 56 ALA HB2 H 1 1.356 0.020 . 1 . . . . 54 ALA HB . 19077 1 570 . 1 1 56 56 ALA HB3 H 1 1.356 0.020 . 1 . . . . 54 ALA HB . 19077 1 571 . 1 1 56 56 ALA C C 13 178.927 0.3 . 1 . . . . 54 ALA C . 19077 1 572 . 1 1 56 56 ALA CA C 13 55.418 0.3 . 1 . . . . 54 ALA CA . 19077 1 573 . 1 1 56 56 ALA CB C 13 18.272 0.3 . 1 . . . . 54 ALA CB . 19077 1 574 . 1 1 56 56 ALA N N 15 123.634 0.3 . 1 . . . . 54 ALA N . 19077 1 575 . 1 1 57 57 VAL H H 1 8.383 0.020 . 1 . . . . 55 VAL H . 19077 1 576 . 1 1 57 57 VAL HA H 1 3.414 0.020 . 1 . . . . 55 VAL HA . 19077 1 577 . 1 1 57 57 VAL HB H 1 2.177 0.020 . 1 . . . . 55 VAL HB . 19077 1 578 . 1 1 57 57 VAL HG11 H 1 1.004 0.020 . 2 . . . . 55 VAL HG1 . 19077 1 579 . 1 1 57 57 VAL HG12 H 1 1.004 0.020 . 2 . . . . 55 VAL HG1 . 19077 1 580 . 1 1 57 57 VAL HG13 H 1 1.004 0.020 . 2 . . . . 55 VAL HG1 . 19077 1 581 . 1 1 57 57 VAL HG21 H 1 0.855 0.020 . 2 . . . . 55 VAL HG2 . 19077 1 582 . 1 1 57 57 VAL HG22 H 1 0.855 0.020 . 2 . . . . 55 VAL HG2 . 19077 1 583 . 1 1 57 57 VAL HG23 H 1 0.855 0.020 . 2 . . . . 55 VAL HG2 . 19077 1 584 . 1 1 57 57 VAL C C 13 179.021 0.3 . 1 . . . . 55 VAL C . 19077 1 585 . 1 1 57 57 VAL CA C 13 66.721 0.3 . 1 . . . . 55 VAL CA . 19077 1 586 . 1 1 57 57 VAL CB C 13 31.774 0.3 . 1 . . . . 55 VAL CB . 19077 1 587 . 1 1 57 57 VAL CG1 C 13 23.760 0.3 . 1 . . . . 55 VAL CG1 . 19077 1 588 . 1 1 57 57 VAL CG2 C 13 21.200 0.3 . 1 . . . . 55 VAL CG2 . 19077 1 589 . 1 1 57 57 VAL N N 15 117.028 0.3 . 1 . . . . 55 VAL N . 19077 1 590 . 1 1 58 58 SER H H 1 7.642 0.020 . 1 . . . . 56 SER H . 19077 1 591 . 1 1 58 58 SER HA H 1 4.203 0.020 . 1 . . . . 56 SER HA . 19077 1 592 . 1 1 58 58 SER HB2 H 1 3.979 0.020 . 1 . . . . 56 SER HB2 . 19077 1 593 . 1 1 58 58 SER HB3 H 1 3.979 0.020 . 1 . . . . 56 SER HB3 . 19077 1 594 . 1 1 58 58 SER C C 13 176.143 0.3 . 1 . . . . 56 SER C . 19077 1 595 . 1 1 58 58 SER CA C 13 61.466 0.3 . 1 . . . . 56 SER CA . 19077 1 596 . 1 1 58 58 SER CB C 13 62.850 0.3 . 1 . . . . 56 SER CB . 19077 1 597 . 1 1 58 58 SER N N 15 116.824 0.3 . 1 . . . . 56 SER N . 19077 1 598 . 1 1 59 59 LEU H H 1 8.001 0.020 . 1 . . . . 57 LEU H . 19077 1 599 . 1 1 59 59 LEU HA H 1 4.182 0.020 . 1 . . . . 57 LEU HA . 19077 1 600 . 1 1 59 59 LEU HB2 H 1 1.879 0.020 . 2 . . . . 57 LEU HB2 . 19077 1 601 . 1 1 59 59 LEU HB3 H 1 1.580 0.020 . 2 . . . . 57 LEU HB3 . 19077 1 602 . 1 1 59 59 LEU HG H 1 1.783 0.020 . 1 . . . . 57 LEU HG . 19077 1 603 . 1 1 59 59 LEU HD11 H 1 0.887 0.020 . 1 . . . . 57 LEU HD1 . 19077 1 604 . 1 1 59 59 LEU HD12 H 1 0.887 0.020 . 1 . . . . 57 LEU HD1 . 19077 1 605 . 1 1 59 59 LEU HD13 H 1 0.887 0.020 . 1 . . . . 57 LEU HD1 . 19077 1 606 . 1 1 59 59 LEU HD21 H 1 0.887 0.020 . 1 . . . . 57 LEU HD2 . 19077 1 607 . 1 1 59 59 LEU HD22 H 1 0.887 0.020 . 1 . . . . 57 LEU HD2 . 19077 1 608 . 1 1 59 59 LEU HD23 H 1 0.887 0.020 . 1 . . . . 57 LEU HD2 . 19077 1 609 . 1 1 59 59 LEU C C 13 179.100 0.3 . 1 . . . . 57 LEU C . 19077 1 610 . 1 1 59 59 LEU CA C 13 57.238 0.3 . 1 . . . . 57 LEU CA . 19077 1 611 . 1 1 59 59 LEU CB C 13 42.204 0.3 . 1 . . . . 57 LEU CB . 19077 1 612 . 1 1 59 59 LEU CG C 13 26.401 0.3 . 1 . . . . 57 LEU CG . 19077 1 613 . 1 1 59 59 LEU CD1 C 13 25.361 0.3 . 1 . . . . 57 LEU CD1 . 19077 1 614 . 1 1 59 59 LEU CD2 C 13 23.120 0.3 . 1 . . . . 57 LEU CD2 . 19077 1 615 . 1 1 59 59 LEU N N 15 121.308 0.3 . 1 . . . . 57 LEU N . 19077 1 616 . 1 1 60 60 LEU H H 1 7.784 0.020 . 1 . . . . 58 LEU H . 19077 1 617 . 1 1 60 60 LEU HA H 1 4.257 0.020 . 1 . . . . 58 LEU HA . 19077 1 618 . 1 1 60 60 LEU HB2 H 1 1.847 0.020 . 2 . . . . 58 LEU HB2 . 19077 1 619 . 1 1 60 60 LEU HB3 H 1 1.537 0.020 . 2 . . . . 58 LEU HB3 . 19077 1 620 . 1 1 60 60 LEU HG H 1 1.719 0.020 . 1 . . . . 58 LEU HG . 19077 1 621 . 1 1 60 60 LEU HD11 H 1 0.812 0.020 . 1 . . . . 58 LEU HD1 . 19077 1 622 . 1 1 60 60 LEU HD12 H 1 0.812 0.020 . 1 . . . . 58 LEU HD1 . 19077 1 623 . 1 1 60 60 LEU HD13 H 1 0.812 0.020 . 1 . . . . 58 LEU HD1 . 19077 1 624 . 1 1 60 60 LEU HD21 H 1 0.812 0.020 . 1 . . . . 58 LEU HD2 . 19077 1 625 . 1 1 60 60 LEU HD22 H 1 0.812 0.020 . 1 . . . . 58 LEU HD2 . 19077 1 626 . 1 1 60 60 LEU HD23 H 1 0.812 0.020 . 1 . . . . 58 LEU HD2 . 19077 1 627 . 1 1 60 60 LEU C C 13 177.810 0.3 . 1 . . . . 58 LEU C . 19077 1 628 . 1 1 60 60 LEU CA C 13 55.976 0.3 . 1 . . . . 58 LEU CA . 19077 1 629 . 1 1 60 60 LEU CB C 13 42.990 0.3 . 1 . . . . 58 LEU CB . 19077 1 630 . 1 1 60 60 LEU CG C 13 26.721 0.3 . 1 . . . . 58 LEU CG . 19077 1 631 . 1 1 60 60 LEU CD1 C 13 22.800 0.3 . 1 . . . . 58 LEU CD1 . 19077 1 632 . 1 1 60 60 LEU CD2 C 13 22.161 0.3 . 1 . . . . 58 LEU CD2 . 19077 1 633 . 1 1 60 60 LEU N N 15 117.700 0.3 . 1 . . . . 58 LEU N . 19077 1 634 . 1 1 61 61 THR H H 1 7.820 0.020 . 1 . . . . 59 THR H . 19077 1 635 . 1 1 61 61 THR HA H 1 4.342 0.020 . 1 . . . . 59 THR HA . 19077 1 636 . 1 1 61 61 THR HB H 1 4.203 0.020 . 1 . . . . 59 THR HB . 19077 1 637 . 1 1 61 61 THR HG21 H 1 1.207 0.020 . 1 . . . . 59 THR HG2 . 19077 1 638 . 1 1 61 61 THR HG22 H 1 1.207 0.020 . 1 . . . . 59 THR HG2 . 19077 1 639 . 1 1 61 61 THR HG23 H 1 1.207 0.020 . 1 . . . . 59 THR HG2 . 19077 1 640 . 1 1 61 61 THR C C 13 174.429 0.3 . 1 . . . . 59 THR C . 19077 1 641 . 1 1 61 61 THR CA C 13 62.435 0.3 . 1 . . . . 59 THR CA . 19077 1 642 . 1 1 61 61 THR CB C 13 70.351 0.3 . 1 . . . . 59 THR CB . 19077 1 643 . 1 1 61 61 THR CG2 C 13 21.280 0.3 . 1 . . . . 59 THR CG2 . 19077 1 644 . 1 1 61 61 THR N N 15 110.625 0.3 . 1 . . . . 59 THR N . 19077 1 645 . 1 1 62 62 ASP H H 1 8.148 0.020 . 1 . . . . 60 ASP H . 19077 1 646 . 1 1 62 62 ASP HA H 1 4.395 0.020 . 1 . . . . 60 ASP HA . 19077 1 647 . 1 1 62 62 ASP HB2 H 1 2.838 0.020 . 2 . . . . 60 ASP HB2 . 19077 1 648 . 1 1 62 62 ASP HB3 H 1 2.753 0.020 . 2 . . . . 60 ASP HB3 . 19077 1 649 . 1 1 62 62 ASP C C 13 176.537 0.3 . 1 . . . . 60 ASP C . 19077 1 650 . 1 1 62 62 ASP CA C 13 54.978 0.3 . 1 . . . . 60 ASP CA . 19077 1 651 . 1 1 62 62 ASP CB C 13 41.204 0.3 . 1 . . . . 60 ASP CB . 19077 1 652 . 1 1 62 62 ASP N N 15 123.010 0.3 . 1 . . . . 60 ASP N . 19077 1 653 . 1 1 63 63 GLU H H 1 8.392 0.020 . 1 . . . . 61 GLU H . 19077 1 654 . 1 1 63 63 GLU HA H 1 4.235 0.020 . 1 . . . . 61 GLU HA . 19077 1 655 . 1 1 63 63 GLU HB2 H 1 2.081 0.020 . 2 . . . . 61 GLU HB2 . 19077 1 656 . 1 1 63 63 GLU HB3 H 1 1.964 0.020 . 2 . . . . 61 GLU HB3 . 19077 1 657 . 1 1 63 63 GLU HG2 H 1 2.273 0.020 . 1 . . . . 61 GLU HG2 . 19077 1 658 . 1 1 63 63 GLU HG3 H 1 2.273 0.020 . 1 . . . . 61 GLU HG3 . 19077 1 659 . 1 1 63 63 GLU C C 13 176.615 0.3 . 1 . . . . 61 GLU C . 19077 1 660 . 1 1 63 63 GLU CA C 13 56.945 0.3 . 1 . . . . 61 GLU CA . 19077 1 661 . 1 1 63 63 GLU CB C 13 29.917 0.3 . 1 . . . . 61 GLU CB . 19077 1 662 . 1 1 63 63 GLU CG C 13 36.003 0.3 . 1 . . . . 61 GLU CG . 19077 1 663 . 1 1 63 63 GLU N N 15 121.252 0.3 . 1 . . . . 61 GLU N . 19077 1 664 . 1 1 64 64 ARG H H 1 8.235 0.020 . 1 . . . . 62 ARG H . 19077 1 665 . 1 1 64 64 ARG HA H 1 4.289 0.020 . 1 . . . . 62 ARG HA . 19077 1 666 . 1 1 64 64 ARG HB2 H 1 1.825 0.020 . 1 . . . . 62 ARG HB2 . 19077 1 667 . 1 1 64 64 ARG HB3 H 1 1.825 0.020 . 1 . . . . 62 ARG HB3 . 19077 1 668 . 1 1 64 64 ARG HG2 H 1 1.655 0.020 . 1 . . . . 62 ARG HG2 . 19077 1 669 . 1 1 64 64 ARG HG3 H 1 1.655 0.020 . 1 . . . . 62 ARG HG3 . 19077 1 670 . 1 1 64 64 ARG HD2 H 1 3.201 0.020 . 1 . . . . 62 ARG HD2 . 19077 1 671 . 1 1 64 64 ARG HD3 H 1 3.201 0.020 . 1 . . . . 62 ARG HD3 . 19077 1 672 . 1 1 64 64 ARG C C 13 176.584 0.3 . 1 . . . . 62 ARG C . 19077 1 673 . 1 1 64 64 ARG CA C 13 56.445 0.3 . 1 . . . . 62 ARG CA . 19077 1 674 . 1 1 64 64 ARG CB C 13 30.703 0.3 . 1 . . . . 62 ARG CB . 19077 1 675 . 1 1 64 64 ARG CG C 13 26.801 0.3 . 1 . . . . 62 ARG CG . 19077 1 676 . 1 1 64 64 ARG CD C 13 43.284 0.3 . 1 . . . . 62 ARG CD . 19077 1 677 . 1 1 64 64 ARG N N 15 120.975 0.3 . 1 . . . . 62 ARG N . 19077 1 678 . 1 1 65 65 VAL H H 1 8.049 0.020 . 1 . . . . 63 VAL H . 19077 1 679 . 1 1 65 65 VAL HA H 1 4.065 0.020 . 1 . . . . 63 VAL HA . 19077 1 680 . 1 1 65 65 VAL HB H 1 2.049 0.020 . 1 . . . . 63 VAL HB . 19077 1 681 . 1 1 65 65 VAL HG11 H 1 0.940 0.020 . 1 . . . . 63 VAL HG1 . 19077 1 682 . 1 1 65 65 VAL HG12 H 1 0.940 0.020 . 1 . . . . 63 VAL HG1 . 19077 1 683 . 1 1 65 65 VAL HG13 H 1 0.940 0.020 . 1 . . . . 63 VAL HG1 . 19077 1 684 . 1 1 65 65 VAL HG21 H 1 0.940 0.020 . 1 . . . . 63 VAL HG2 . 19077 1 685 . 1 1 65 65 VAL HG22 H 1 0.940 0.020 . 1 . . . . 63 VAL HG2 . 19077 1 686 . 1 1 65 65 VAL HG23 H 1 0.940 0.020 . 1 . . . . 63 VAL HG2 . 19077 1 687 . 1 1 65 65 VAL C C 13 175.986 0.3 . 1 . . . . 63 VAL C . 19077 1 688 . 1 1 65 65 VAL CA C 13 62.523 0.3 . 1 . . . . 63 VAL CA . 19077 1 689 . 1 1 65 65 VAL CB C 13 32.417 0.3 . 1 . . . . 63 VAL CB . 19077 1 690 . 1 1 65 65 VAL CG1 C 13 20.800 0.3 . 1 . . . . 63 VAL CG1 . 19077 1 691 . 1 1 65 65 VAL CG2 C 13 20.800 0.3 . 1 . . . . 63 VAL CG2 . 19077 1 692 . 1 1 65 65 VAL N N 15 120.433 0.3 . 1 . . . . 63 VAL N . 19077 1 693 . 1 1 66 66 LYS H H 1 8.234 0.020 . 1 . . . . 64 LYS H . 19077 1 694 . 1 1 66 66 LYS HA H 1 4.321 0.020 . 1 . . . . 64 LYS HA . 19077 1 695 . 1 1 66 66 LYS HB2 H 1 1.783 0.020 . 2 . . . . 64 LYS HB2 . 19077 1 696 . 1 1 66 66 LYS HB3 H 1 1.729 0.020 . 2 . . . . 64 LYS HB3 . 19077 1 697 . 1 1 66 66 LYS HG2 H 1 1.399 0.020 . 1 . . . . 64 LYS HG2 . 19077 1 698 . 1 1 66 66 LYS HG3 H 1 1.399 0.020 . 1 . . . . 64 LYS HG3 . 19077 1 699 . 1 1 66 66 LYS HD2 H 1 1.651 0.020 . 1 . . . . 64 LYS HD2 . 19077 1 700 . 1 1 66 66 LYS HD3 H 1 1.651 0.020 . 1 . . . . 64 LYS HD3 . 19077 1 701 . 1 1 66 66 LYS HE2 H 1 2.849 0.020 . 1 . . . . 64 LYS HE2 . 19077 1 702 . 1 1 66 66 LYS HE3 H 1 2.849 0.020 . 1 . . . . 64 LYS HE3 . 19077 1 703 . 1 1 66 66 LYS C C 13 176.112 0.3 . 1 . . . . 64 LYS C . 19077 1 704 . 1 1 66 66 LYS CA C 13 55.976 0.3 . 1 . . . . 64 LYS CA . 19077 1 705 . 1 1 66 66 LYS CB C 13 33.274 0.3 . 1 . . . . 64 LYS CB . 19077 1 706 . 1 1 66 66 LYS CG C 13 24.401 0.3 . 1 . . . . 64 LYS CG . 19077 1 707 . 1 1 66 66 LYS CD C 13 28.801 0.3 . 1 . . . . 64 LYS CD . 19077 1 708 . 1 1 66 66 LYS CE C 13 41.044 0.3 . 1 . . . . 64 LYS CE . 19077 1 709 . 1 1 66 66 LYS N N 15 124.986 0.3 . 1 . . . . 64 LYS N . 19077 1 710 . 1 1 67 67 GLU H H 1 8.394 0.020 . 1 . . . . 65 GLU H . 19077 1 711 . 1 1 67 67 GLU HA H 1 4.321 0.020 . 1 . . . . 65 GLU HA . 19077 1 712 . 1 1 67 67 GLU HB2 H 1 2.035 0.020 . 2 . . . . 65 GLU HB2 . 19077 1 713 . 1 1 67 67 GLU HB3 H 1 1.899 0.020 . 2 . . . . 65 GLU HB3 . 19077 1 714 . 1 1 67 67 GLU HG2 H 1 2.306 0.020 . 1 . . . . 65 GLU HG2 . 19077 1 715 . 1 1 67 67 GLU HG3 H 1 2.306 0.020 . 1 . . . . 65 GLU HG3 . 19077 1 716 . 1 1 67 67 GLU C C 13 174.571 0.3 . 1 . . . . 65 GLU C . 19077 1 717 . 1 1 67 67 GLU CA C 13 54.390 0.3 . 1 . . . . 65 GLU CA . 19077 1 718 . 1 1 67 67 GLU CB C 13 29.631 0.3 . 1 . . . . 65 GLU CB . 19077 1 719 . 1 1 67 67 GLU CG C 13 35.967 0.3 . 1 . . . . 65 GLU CG . 19077 1 720 . 1 1 67 67 GLU N N 15 123.697 0.3 . 1 . . . . 65 GLU N . 19077 1 721 . 1 1 68 68 PRO HA H 1 4.790 0.020 . 1 . . . . 66 PRO HA . 19077 1 722 . 1 1 68 68 PRO HB2 H 1 2.412 0.020 . 2 . . . . 66 PRO HB2 . 19077 1 723 . 1 1 68 68 PRO HB3 H 1 2.156 0.020 . 2 . . . . 66 PRO HB3 . 19077 1 724 . 1 1 68 68 PRO HG2 H 1 1.964 0.020 . 2 . . . . 66 PRO HG2 . 19077 1 725 . 1 1 68 68 PRO HG3 H 1 1.889 0.020 . 2 . . . . 66 PRO HG3 . 19077 1 726 . 1 1 68 68 PRO HD2 H 1 3.585 0.020 . 2 . . . . 66 PRO HD2 . 19077 1 727 . 1 1 68 68 PRO HD3 H 1 3.489 0.020 . 2 . . . . 66 PRO HD3 . 19077 1 728 . 1 1 68 68 PRO C C 13 176.301 0.3 . 1 . . . . 66 PRO C . 19077 1 729 . 1 1 68 68 PRO CA C 13 62.552 0.3 . 1 . . . . 66 PRO CA . 19077 1 730 . 1 1 68 68 PRO CB C 13 34.346 0.3 . 1 . . . . 66 PRO CB . 19077 1 731 . 1 1 68 68 PRO CG C 13 24.641 0.3 . 1 . . . . 66 PRO CG . 19077 1 732 . 1 1 68 68 PRO CD C 13 50.006 0.3 . 1 . . . . 66 PRO CD . 19077 1 733 . 1 1 69 69 SER H H 1 8.616 0.020 . 1 . . . . 67 SER H . 19077 1 734 . 1 1 69 69 SER HA H 1 4.438 0.020 . 1 . . . . 67 SER HA . 19077 1 735 . 1 1 69 69 SER HB2 H 1 3.905 0.020 . 1 . . . . 67 SER HB2 . 19077 1 736 . 1 1 69 69 SER HB3 H 1 3.905 0.020 . 1 . . . . 67 SER HB3 . 19077 1 737 . 1 1 69 69 SER C C 13 174.744 0.3 . 1 . . . . 67 SER C . 19077 1 738 . 1 1 69 69 SER CA C 13 58.471 0.3 . 1 . . . . 67 SER CA . 19077 1 739 . 1 1 69 69 SER CB C 13 63.922 0.3 . 1 . . . . 67 SER CB . 19077 1 740 . 1 1 69 69 SER N N 15 116.888 0.3 . 1 . . . . 67 SER N . 19077 1 741 . 1 1 70 70 GLN H H 1 8.514 0.020 . 1 . . . . 68 GLN H . 19077 1 742 . 1 1 70 70 GLN HA H 1 4.227 0.020 . 1 . . . . 68 GLN HA . 19077 1 743 . 1 1 70 70 GLN HB2 H 1 2.029 0.020 . 1 . . . . 68 GLN HB2 . 19077 1 744 . 1 1 70 70 GLN HB3 H 1 2.029 0.020 . 1 . . . . 68 GLN HB3 . 19077 1 745 . 1 1 70 70 GLN HG2 H 1 2.396 0.020 . 1 . . . . 68 GLN HG2 . 19077 1 746 . 1 1 70 70 GLN HG3 H 1 2.396 0.020 . 1 . . . . 68 GLN HG3 . 19077 1 747 . 1 1 70 70 GLN C C 13 176.413 0.3 . 1 . . . . 68 GLN C . 19077 1 748 . 1 1 70 70 GLN CA C 13 56.475 0.3 . 1 . . . . 68 GLN CA . 19077 1 749 . 1 1 70 70 GLN CB C 13 30.471 0.3 . 1 . . . . 68 GLN CB . 19077 1 750 . 1 1 70 70 GLN CG C 13 33.929 0.3 . 1 . . . . 68 GLN CG . 19077 1 751 . 1 1 70 70 GLN N N 15 122.930 0.3 . 1 . . . . 68 GLN N . 19077 1 752 . 1 1 71 71 ASP HA H 1 4.640 0.020 . 1 . . . . 69 ASP HA . 19077 1 753 . 1 1 71 71 ASP HB2 H 1 2.700 0.020 . 2 . . . . 69 ASP HB2 . 19077 1 754 . 1 1 71 71 ASP HB3 H 1 2.593 0.020 . 2 . . . . 69 ASP HB3 . 19077 1 755 . 1 1 71 71 ASP C C 13 176.316 0.3 . 1 . . . . 69 ASP C . 19077 1 756 . 1 1 71 71 ASP CA C 13 54.537 0.3 . 1 . . . . 69 ASP CA . 19077 1 757 . 1 1 71 71 ASP CB C 13 41.133 0.3 . 1 . . . . 69 ASP CB . 19077 1 758 . 1 1 72 72 THR H H 1 8.107 0.020 . 1 . . . . 70 THR H . 19077 1 759 . 1 1 72 72 THR HA H 1 4.321 0.020 . 1 . . . . 70 THR HA . 19077 1 760 . 1 1 72 72 THR HB H 1 4.203 0.020 . 1 . . . . 70 THR HB . 19077 1 761 . 1 1 72 72 THR HG21 H 1 1.196 0.020 . 1 . . . . 70 THR HG2 . 19077 1 762 . 1 1 72 72 THR HG22 H 1 1.196 0.020 . 1 . . . . 70 THR HG2 . 19077 1 763 . 1 1 72 72 THR HG23 H 1 1.196 0.020 . 1 . . . . 70 THR HG2 . 19077 1 764 . 1 1 72 72 THR C C 13 174.445 0.3 . 1 . . . . 70 THR C . 19077 1 765 . 1 1 72 72 THR CA C 13 61.906 0.3 . 1 . . . . 70 THR CA . 19077 1 766 . 1 1 72 72 THR CB C 13 69.923 0.3 . 1 . . . . 70 THR CB . 19077 1 767 . 1 1 72 72 THR CG2 C 13 21.360 0.3 . 1 . . . . 70 THR CG2 . 19077 1 768 . 1 1 72 72 THR N N 15 114.576 0.3 . 1 . . . . 70 THR N . 19077 1 769 . 1 1 73 73 VAL H H 1 8.141 0.020 . 1 . . . . 71 VAL H . 19077 1 770 . 1 1 73 73 VAL HA H 1 4.118 0.020 . 1 . . . . 71 VAL HA . 19077 1 771 . 1 1 73 73 VAL HB H 1 2.071 0.020 . 1 . . . . 71 VAL HB . 19077 1 772 . 1 1 73 73 VAL HG11 H 1 0.951 0.020 . 1 . . . . 71 VAL HG1 . 19077 1 773 . 1 1 73 73 VAL HG12 H 1 0.951 0.020 . 1 . . . . 71 VAL HG1 . 19077 1 774 . 1 1 73 73 VAL HG13 H 1 0.951 0.020 . 1 . . . . 71 VAL HG1 . 19077 1 775 . 1 1 73 73 VAL HG21 H 1 0.951 0.020 . 1 . . . . 71 VAL HG2 . 19077 1 776 . 1 1 73 73 VAL HG22 H 1 0.951 0.020 . 1 . . . . 71 VAL HG2 . 19077 1 777 . 1 1 73 73 VAL HG23 H 1 0.951 0.020 . 1 . . . . 71 VAL HG2 . 19077 1 778 . 1 1 73 73 VAL C C 13 175.703 0.3 . 1 . . . . 71 VAL C . 19077 1 779 . 1 1 73 73 VAL CA C 13 62.141 0.3 . 1 . . . . 71 VAL CA . 19077 1 780 . 1 1 73 73 VAL CB C 13 32.774 0.3 . 1 . . . . 71 VAL CB . 19077 1 781 . 1 1 73 73 VAL CG1 C 13 20.880 0.3 . 1 . . . . 71 VAL CG1 . 19077 1 782 . 1 1 73 73 VAL CG2 C 13 20.480 0.3 . 1 . . . . 71 VAL CG2 . 19077 1 783 . 1 1 73 73 VAL N N 15 122.898 0.3 . 1 . . . . 71 VAL N . 19077 1 784 . 1 1 74 74 ALA H H 1 8.425 0.020 . 1 . . . . 72 ALA H . 19077 1 785 . 1 1 74 74 ALA HA H 1 4.406 0.020 . 1 . . . . 72 ALA HA . 19077 1 786 . 1 1 74 74 ALA HB1 H 1 1.388 0.020 . 1 . . . . 72 ALA HB . 19077 1 787 . 1 1 74 74 ALA HB2 H 1 1.388 0.020 . 1 . . . . 72 ALA HB . 19077 1 788 . 1 1 74 74 ALA HB3 H 1 1.388 0.020 . 1 . . . . 72 ALA HB . 19077 1 789 . 1 1 74 74 ALA C C 13 177.637 0.3 . 1 . . . . 72 ALA C . 19077 1 790 . 1 1 74 74 ALA CA C 13 52.365 0.3 . 1 . . . . 72 ALA CA . 19077 1 791 . 1 1 74 74 ALA CB C 13 19.344 0.3 . 1 . . . . 72 ALA CB . 19077 1 792 . 1 1 74 74 ALA N N 15 128.268 0.3 . 1 . . . . 72 ALA N . 19077 1 793 . 1 1 75 75 THR H H 1 8.142 0.020 . 1 . . . . 73 THR H . 19077 1 794 . 1 1 75 75 THR HA H 1 4.308 0.020 . 1 . . . . 73 THR HA . 19077 1 795 . 1 1 75 75 THR HB H 1 4.161 0.020 . 1 . . . . 73 THR HB . 19077 1 796 . 1 1 75 75 THR HG21 H 1 1.207 0.020 . 1 . . . . 73 THR HG2 . 19077 1 797 . 1 1 75 75 THR HG22 H 1 1.207 0.020 . 1 . . . . 73 THR HG2 . 19077 1 798 . 1 1 75 75 THR HG23 H 1 1.207 0.020 . 1 . . . . 73 THR HG2 . 19077 1 799 . 1 1 75 75 THR C C 13 174.350 0.3 . 1 . . . . 73 THR C . 19077 1 800 . 1 1 75 75 THR CA C 13 61.642 0.3 . 1 . . . . 73 THR CA . 19077 1 801 . 1 1 75 75 THR CB C 13 69.923 0.3 . 1 . . . . 73 THR CB . 19077 1 802 . 1 1 75 75 THR CG2 C 13 21.520 0.3 . 1 . . . . 73 THR CG2 . 19077 1 803 . 1 1 75 75 THR N N 15 114.083 0.3 . 1 . . . . 73 THR N . 19077 1 804 . 1 1 76 76 GLU H H 1 8.409 0.020 . 1 . . . . 74 GLU H . 19077 1 805 . 1 1 76 76 GLU HA H 1 4.258 0.020 . 1 . . . . 74 GLU HA . 19077 1 806 . 1 1 76 76 GLU HB2 H 1 2.081 0.020 . 1 . . . . 74 GLU HB2 . 19077 1 807 . 1 1 76 76 GLU HB3 H 1 2.081 0.020 . 1 . . . . 74 GLU HB3 . 19077 1 808 . 1 1 76 76 GLU HG2 H 1 2.375 0.020 . 1 . . . . 74 GLU HG2 . 19077 1 809 . 1 1 76 76 GLU HG3 H 1 2.375 0.020 . 1 . . . . 74 GLU HG3 . 19077 1 810 . 1 1 76 76 GLU C C 13 174.602 0.3 . 1 . . . . 74 GLU C . 19077 1 811 . 1 1 76 76 GLU CA C 13 54.361 0.3 . 1 . . . . 74 GLU CA . 19077 1 812 . 1 1 76 76 GLU CB C 13 29.774 0.3 . 1 . . . . 74 GLU CB . 19077 1 813 . 1 1 76 76 GLU CG C 13 36.093 0.3 . 1 . . . . 74 GLU CG . 19077 1 814 . 1 1 76 76 GLU N N 15 124.795 0.3 . 1 . . . . 74 GLU N . 19077 1 815 . 1 1 77 77 PRO HA H 1 4.438 0.020 . 1 . . . . 75 PRO HA . 19077 1 816 . 1 1 77 77 PRO HB2 H 1 2.305 0.020 . 2 . . . . 75 PRO HB2 . 19077 1 817 . 1 1 77 77 PRO HB3 H 1 1.943 0.020 . 2 . . . . 75 PRO HB3 . 19077 1 818 . 1 1 77 77 PRO HG2 H 1 2.039 0.020 . 1 . . . . 75 PRO HG2 . 19077 1 819 . 1 1 77 77 PRO HG3 H 1 2.039 0.020 . 1 . . . . 75 PRO HG3 . 19077 1 820 . 1 1 77 77 PRO HD2 H 1 3.841 0.020 . 2 . . . . 75 PRO HD2 . 19077 1 821 . 1 1 77 77 PRO HD3 H 1 3.723 0.020 . 2 . . . . 75 PRO HD3 . 19077 1 822 . 1 1 77 77 PRO C C 13 176.993 0.3 . 1 . . . . 75 PRO C . 19077 1 823 . 1 1 77 77 PRO CA C 13 63.315 0.3 . 1 . . . . 75 PRO CA . 19077 1 824 . 1 1 77 77 PRO CB C 13 32.131 0.3 . 1 . . . . 75 PRO CB . 19077 1 825 . 1 1 77 77 PRO CG C 13 27.281 0.3 . 1 . . . . 75 PRO CG . 19077 1 826 . 1 1 77 77 PRO CD C 13 50.566 0.3 . 1 . . . . 75 PRO CD . 19077 1 827 . 1 1 78 78 SER H H 1 8.436 0.020 . 1 . . . . 76 SER H . 19077 1 828 . 1 1 78 78 SER HA H 1 4.438 0.020 . 1 . . . . 76 SER HA . 19077 1 829 . 1 1 78 78 SER HB2 H 1 3.873 0.020 . 1 . . . . 76 SER HB2 . 19077 1 830 . 1 1 78 78 SER HB3 H 1 3.873 0.020 . 1 . . . . 76 SER HB3 . 19077 1 831 . 1 1 78 78 SER C C 13 174.744 0.3 . 1 . . . . 76 SER C . 19077 1 832 . 1 1 78 78 SER CA C 13 58.412 0.3 . 1 . . . . 76 SER CA . 19077 1 833 . 1 1 78 78 SER CB C 13 63.850 0.3 . 1 . . . . 76 SER CB . 19077 1 834 . 1 1 78 78 SER N N 15 115.933 0.3 . 1 . . . . 76 SER N . 19077 1 835 . 1 1 79 79 GLU H H 1 8.440 0.020 . 1 . . . . 77 GLU H . 19077 1 836 . 1 1 79 79 GLU HA H 1 4.353 0.020 . 1 . . . . 77 GLU HA . 19077 1 837 . 1 1 79 79 GLU HB2 H 1 2.060 0.020 . 2 . . . . 77 GLU HB2 . 19077 1 838 . 1 1 79 79 GLU HB3 H 1 1.953 0.020 . 2 . . . . 77 GLU HB3 . 19077 1 839 . 1 1 79 79 GLU HG2 H 1 2.273 0.020 . 1 . . . . 77 GLU HG2 . 19077 1 840 . 1 1 79 79 GLU HG3 H 1 2.273 0.020 . 1 . . . . 77 GLU HG3 . 19077 1 841 . 1 1 79 79 GLU C C 13 176.521 0.3 . 1 . . . . 77 GLU C . 19077 1 842 . 1 1 79 79 GLU CA C 13 56.622 0.3 . 1 . . . . 77 GLU CA . 19077 1 843 . 1 1 79 79 GLU CB C 13 30.345 0.3 . 1 . . . . 77 GLU CB . 19077 1 844 . 1 1 79 79 GLU CG C 13 36.003 0.3 . 1 . . . . 77 GLU CG . 19077 1 845 . 1 1 79 79 GLU N N 15 122.743 0.3 . 1 . . . . 77 GLU N . 19077 1 846 . 1 1 80 80 VAL H H 1 8.117 0.020 . 1 . . . . 78 VAL H . 19077 1 847 . 1 1 80 80 VAL HA H 1 4.097 0.020 . 1 . . . . 78 VAL HA . 19077 1 848 . 1 1 80 80 VAL HB H 1 2.060 0.020 . 1 . . . . 78 VAL HB . 19077 1 849 . 1 1 80 80 VAL HG11 H 1 0.930 0.020 . 1 . . . . 78 VAL HG1 . 19077 1 850 . 1 1 80 80 VAL HG12 H 1 0.930 0.020 . 1 . . . . 78 VAL HG1 . 19077 1 851 . 1 1 80 80 VAL HG13 H 1 0.930 0.020 . 1 . . . . 78 VAL HG1 . 19077 1 852 . 1 1 80 80 VAL HG21 H 1 0.930 0.020 . 1 . . . . 78 VAL HG2 . 19077 1 853 . 1 1 80 80 VAL HG22 H 1 0.930 0.020 . 1 . . . . 78 VAL HG2 . 19077 1 854 . 1 1 80 80 VAL HG23 H 1 0.930 0.020 . 1 . . . . 78 VAL HG2 . 19077 1 855 . 1 1 80 80 VAL C C 13 176.332 0.3 . 1 . . . . 78 VAL C . 19077 1 856 . 1 1 80 80 VAL CA C 13 62.464 0.3 . 1 . . . . 78 VAL CA . 19077 1 857 . 1 1 80 80 VAL CB C 13 32.774 0.3 . 1 . . . . 78 VAL CB . 19077 1 858 . 1 1 80 80 VAL CG1 C 13 20.960 0.3 . 1 . . . . 78 VAL CG1 . 19077 1 859 . 1 1 80 80 VAL CG2 C 13 20.400 0.3 . 1 . . . . 78 VAL CG2 . 19077 1 860 . 1 1 80 80 VAL N N 15 120.479 0.3 . 1 . . . . 78 VAL N . 19077 1 861 . 1 1 81 81 GLU H H 1 8.485 0.020 . 1 . . . . 79 GLU H . 19077 1 862 . 1 1 81 81 GLU HA H 1 4.257 0.020 . 1 . . . . 79 GLU HA . 19077 1 863 . 1 1 81 81 GLU HB2 H 1 2.017 0.020 . 1 . . . . 79 GLU HB2 . 19077 1 864 . 1 1 81 81 GLU HB3 H 1 2.017 0.020 . 1 . . . . 79 GLU HB3 . 19077 1 865 . 1 1 81 81 GLU HG2 H 1 2.284 0.020 . 1 . . . . 79 GLU HG2 . 19077 1 866 . 1 1 81 81 GLU HG3 H 1 2.284 0.020 . 1 . . . . 79 GLU HG3 . 19077 1 867 . 1 1 81 81 GLU C C 13 177.166 0.3 . 1 . . . . 79 GLU C . 19077 1 868 . 1 1 81 81 GLU CA C 13 57.033 0.3 . 1 . . . . 79 GLU CA . 19077 1 869 . 1 1 81 81 GLU CB C 13 30.131 0.3 . 1 . . . . 79 GLU CB . 19077 1 870 . 1 1 81 81 GLU CG C 13 36.083 0.3 . 1 . . . . 79 GLU CG . 19077 1 871 . 1 1 81 81 GLU N N 15 124.855 0.3 . 1 . . . . 79 GLU N . 19077 1 872 . 1 1 82 82 GLY H H 1 8.494 0.020 . 1 . . . . 80 GLY H . 19077 1 873 . 1 1 82 82 GLY HA2 H 1 3.990 0.020 . 1 . . . . 80 GLY HA2 . 19077 1 874 . 1 1 82 82 GLY HA3 H 1 3.990 0.020 . 1 . . . . 80 GLY HA3 . 19077 1 875 . 1 1 82 82 GLY C C 13 174.508 0.3 . 1 . . . . 80 GLY C . 19077 1 876 . 1 1 82 82 GLY CA C 13 45.495 0.3 . 1 . . . . 80 GLY CA . 19077 1 877 . 1 1 82 82 GLY N N 15 110.479 0.3 . 1 . . . . 80 GLY N . 19077 1 878 . 1 1 83 83 SER H H 1 8.205 0.020 . 1 . . . . 81 SER H . 19077 1 879 . 1 1 83 83 SER HA H 1 4.427 0.020 . 1 . . . . 81 SER HA . 19077 1 880 . 1 1 83 83 SER HB2 H 1 3.894 0.020 . 1 . . . . 81 SER HB2 . 19077 1 881 . 1 1 83 83 SER HB3 H 1 3.894 0.020 . 1 . . . . 81 SER HB3 . 19077 1 882 . 1 1 83 83 SER C C 13 174.681 0.3 . 1 . . . . 81 SER C . 19077 1 883 . 1 1 83 83 SER CA C 13 58.559 0.3 . 1 . . . . 81 SER CA . 19077 1 884 . 1 1 83 83 SER CB C 13 63.850 0.3 . 1 . . . . 81 SER CB . 19077 1 885 . 1 1 83 83 SER N N 15 115.658 0.3 . 1 . . . . 81 SER N . 19077 1 886 . 1 1 84 84 ALA H H 1 8.381 0.020 . 1 . . . . 82 ALA H . 19077 1 887 . 1 1 84 84 ALA HA H 1 4.321 0.020 . 1 . . . . 82 ALA HA . 19077 1 888 . 1 1 84 84 ALA HB1 H 1 1.388 0.020 . 1 . . . . 82 ALA HB . 19077 1 889 . 1 1 84 84 ALA HB2 H 1 1.388 0.020 . 1 . . . . 82 ALA HB . 19077 1 890 . 1 1 84 84 ALA HB3 H 1 1.388 0.020 . 1 . . . . 82 ALA HB . 19077 1 891 . 1 1 84 84 ALA C C 13 177.748 0.3 . 1 . . . . 82 ALA C . 19077 1 892 . 1 1 84 84 ALA CA C 13 52.805 0.3 . 1 . . . . 82 ALA CA . 19077 1 893 . 1 1 84 84 ALA CB C 13 19.058 0.3 . 1 . . . . 82 ALA CB . 19077 1 894 . 1 1 84 84 ALA N N 15 125.878 0.3 . 1 . . . . 82 ALA N . 19077 1 895 . 1 1 85 85 ALA HA H 1 4.257 0.020 . 1 . . . . 83 ALA HA . 19077 1 896 . 1 1 85 85 ALA HB1 H 1 1.367 0.020 . 1 . . . . 83 ALA HB . 19077 1 897 . 1 1 85 85 ALA HB2 H 1 1.367 0.020 . 1 . . . . 83 ALA HB . 19077 1 898 . 1 1 85 85 ALA HB3 H 1 1.367 0.020 . 1 . . . . 83 ALA HB . 19077 1 899 . 1 1 85 85 ALA C C 13 177.700 0.3 . 1 . . . . 83 ALA C . 19077 1 900 . 1 1 85 85 ALA CA C 13 52.834 0.3 . 1 . . . . 83 ALA CA . 19077 1 901 . 1 1 85 85 ALA CB C 13 19.058 0.3 . 1 . . . . 83 ALA CB . 19077 1 902 . 1 1 86 86 ASN H H 1 8.242 0.020 . 1 . . . . 84 ASN H . 19077 1 903 . 1 1 86 86 ASN HA H 1 4.662 0.020 . 1 . . . . 84 ASN HA . 19077 1 904 . 1 1 86 86 ASN HB2 H 1 2.849 0.020 . 2 . . . . 84 ASN HB2 . 19077 1 905 . 1 1 86 86 ASN HB3 H 1 2.796 0.020 . 2 . . . . 84 ASN HB3 . 19077 1 906 . 1 1 86 86 ASN C C 13 175.388 0.3 . 1 . . . . 84 ASN C . 19077 1 907 . 1 1 86 86 ASN CA C 13 53.333 0.3 . 1 . . . . 84 ASN CA . 19077 1 908 . 1 1 86 86 ASN CB C 13 38.775 0.3 . 1 . . . . 84 ASN CB . 19077 1 909 . 1 1 86 86 ASN N N 15 117.303 0.3 . 1 . . . . 84 ASN N . 19077 1 910 . 1 1 87 87 LYS H H 1 8.206 0.020 . 1 . . . . 85 LYS H . 19077 1 911 . 1 1 87 87 LYS HA H 1 4.257 0.020 . 1 . . . . 85 LYS HA . 19077 1 912 . 1 1 87 87 LYS HB2 H 1 1.857 0.020 . 2 . . . . 85 LYS HB2 . 19077 1 913 . 1 1 87 87 LYS HB3 H 1 1.783 0.020 . 2 . . . . 85 LYS HB3 . 19077 1 914 . 1 1 87 87 LYS HG2 H 1 1.441 0.020 . 1 . . . . 85 LYS HG2 . 19077 1 915 . 1 1 87 87 LYS HG3 H 1 1.441 0.020 . 1 . . . . 85 LYS HG3 . 19077 1 916 . 1 1 87 87 LYS HD2 H 1 1.687 0.020 . 1 . . . . 85 LYS HD2 . 19077 1 917 . 1 1 87 87 LYS HD3 H 1 1.687 0.020 . 1 . . . . 85 LYS HD3 . 19077 1 918 . 1 1 87 87 LYS HE2 H 1 2.998 0.020 . 1 . . . . 85 LYS HE2 . 19077 1 919 . 1 1 87 87 LYS HE3 H 1 2.998 0.020 . 1 . . . . 85 LYS HE3 . 19077 1 920 . 1 1 87 87 LYS C C 13 176.757 0.3 . 1 . . . . 85 LYS C . 19077 1 921 . 1 1 87 87 LYS CA C 13 56.768 0.3 . 1 . . . . 85 LYS CA . 19077 1 922 . 1 1 87 87 LYS CB C 13 32.989 0.3 . 1 . . . . 85 LYS CB . 19077 1 923 . 1 1 87 87 LYS CG C 13 24.641 0.3 . 1 . . . . 85 LYS CG . 19077 1 924 . 1 1 87 87 LYS CD C 13 29.362 0.3 . 1 . . . . 85 LYS CD . 19077 1 925 . 1 1 87 87 LYS CE C 13 41.124 0.3 . 1 . . . . 85 LYS CE . 19077 1 926 . 1 1 87 87 LYS N N 15 121.385 0.3 . 1 . . . . 85 LYS N . 19077 1 927 . 1 1 88 88 GLU H H 1 8.363 0.020 . 1 . . . . 86 GLU H . 19077 1 928 . 1 1 88 88 GLU HA H 1 4.257 0.020 . 1 . . . . 86 GLU HA . 19077 1 929 . 1 1 88 88 GLU HB2 H 1 1.996 0.020 . 1 . . . . 86 GLU HB2 . 19077 1 930 . 1 1 88 88 GLU HB3 H 1 1.996 0.020 . 1 . . . . 86 GLU HB3 . 19077 1 931 . 1 1 88 88 GLU HG2 H 1 2.263 0.020 . 1 . . . . 86 GLU HG2 . 19077 1 932 . 1 1 88 88 GLU HG3 H 1 2.263 0.020 . 1 . . . . 86 GLU HG3 . 19077 1 933 . 1 1 88 88 GLU C C 13 176.677 0.3 . 1 . . . . 86 GLU C . 19077 1 934 . 1 1 88 88 GLU CA C 13 56.827 0.3 . 1 . . . . 86 GLU CA . 19077 1 935 . 1 1 88 88 GLU CB C 13 30.131 0.3 . 1 . . . . 86 GLU CB . 19077 1 936 . 1 1 88 88 GLU CG C 13 36.163 0.3 . 1 . . . . 86 GLU CG . 19077 1 937 . 1 1 88 88 GLU N N 15 121.587 0.3 . 1 . . . . 86 GLU N . 19077 1 938 . 1 1 89 89 VAL H H 1 8.098 0.020 . 1 . . . . 87 VAL H . 19077 1 939 . 1 1 89 89 VAL HA H 1 4.033 0.020 . 1 . . . . 87 VAL HA . 19077 1 940 . 1 1 89 89 VAL HB H 1 2.060 0.020 . 1 . . . . 87 VAL HB . 19077 1 941 . 1 1 89 89 VAL HG11 H 1 0.951 0.020 . 1 . . . . 87 VAL HG1 . 19077 1 942 . 1 1 89 89 VAL HG12 H 1 0.951 0.020 . 1 . . . . 87 VAL HG1 . 19077 1 943 . 1 1 89 89 VAL HG13 H 1 0.951 0.020 . 1 . . . . 87 VAL HG1 . 19077 1 944 . 1 1 89 89 VAL HG21 H 1 0.951 0.020 . 1 . . . . 87 VAL HG2 . 19077 1 945 . 1 1 89 89 VAL HG22 H 1 0.951 0.020 . 1 . . . . 87 VAL HG2 . 19077 1 946 . 1 1 89 89 VAL HG23 H 1 0.951 0.020 . 1 . . . . 87 VAL HG2 . 19077 1 947 . 1 1 89 89 VAL C C 13 176.284 0.3 . 1 . . . . 87 VAL C . 19077 1 948 . 1 1 89 89 VAL CA C 13 62.728 0.3 . 1 . . . . 87 VAL CA . 19077 1 949 . 1 1 89 89 VAL CB C 13 32.560 0.3 . 1 . . . . 87 VAL CB . 19077 1 950 . 1 1 89 89 VAL CG1 C 13 20.800 0.3 . 1 . . . . 87 VAL CG1 . 19077 1 951 . 1 1 89 89 VAL CG2 C 13 20.800 0.3 . 1 . . . . 87 VAL CG2 . 19077 1 952 . 1 1 89 89 VAL N N 15 121.380 0.3 . 1 . . . . 87 VAL N . 19077 1 953 . 1 1 90 90 LEU H H 1 8.194 0.020 . 1 . . . . 88 LEU H . 19077 1 954 . 1 1 90 90 LEU HA H 1 4.321 0.020 . 1 . . . . 88 LEU HA . 19077 1 955 . 1 1 90 90 LEU HB2 H 1 1.633 0.020 . 2 . . . . 88 LEU HB2 . 19077 1 956 . 1 1 90 90 LEU HB3 H 1 1.559 0.020 . 2 . . . . 88 LEU HB3 . 19077 1 957 . 1 1 90 90 LEU HG H 1 1.431 0.020 . 1 . . . . 88 LEU HG . 19077 1 958 . 1 1 90 90 LEU HD11 H 1 0.908 0.020 . 1 . . . . 88 LEU HD1 . 19077 1 959 . 1 1 90 90 LEU HD12 H 1 0.908 0.020 . 1 . . . . 88 LEU HD1 . 19077 1 960 . 1 1 90 90 LEU HD13 H 1 0.908 0.020 . 1 . . . . 88 LEU HD1 . 19077 1 961 . 1 1 90 90 LEU HD21 H 1 0.908 0.020 . 1 . . . . 88 LEU HD2 . 19077 1 962 . 1 1 90 90 LEU HD22 H 1 0.908 0.020 . 1 . . . . 88 LEU HD2 . 19077 1 963 . 1 1 90 90 LEU HD23 H 1 0.908 0.020 . 1 . . . . 88 LEU HD2 . 19077 1 964 . 1 1 90 90 LEU C C 13 177.055 0.3 . 1 . . . . 88 LEU C . 19077 1 965 . 1 1 90 90 LEU CA C 13 55.124 0.3 . 1 . . . . 88 LEU CA . 19077 1 966 . 1 1 90 90 LEU CB C 13 42.276 0.3 . 1 . . . . 88 LEU CB . 19077 1 967 . 1 1 90 90 LEU CG C 13 26.801 0.3 . 1 . . . . 88 LEU CG . 19077 1 968 . 1 1 90 90 LEU CD1 C 13 24.641 0.3 . 1 . . . . 88 LEU CD1 . 19077 1 969 . 1 1 90 90 LEU CD2 C 13 23.280 0.3 . 1 . . . . 88 LEU CD2 . 19077 1 970 . 1 1 90 90 LEU N N 15 125.394 0.3 . 1 . . . . 88 LEU N . 19077 1 971 . 1 1 91 91 ALA H H 1 8.151 0.020 . 1 . . . . 89 ALA H . 19077 1 972 . 1 1 91 91 ALA HA H 1 4.289 0.020 . 1 . . . . 89 ALA HA . 19077 1 973 . 1 1 91 91 ALA HB1 H 1 1.388 0.020 . 1 . . . . 89 ALA HB . 19077 1 974 . 1 1 91 91 ALA HB2 H 1 1.388 0.020 . 1 . . . . 89 ALA HB . 19077 1 975 . 1 1 91 91 ALA HB3 H 1 1.388 0.020 . 1 . . . . 89 ALA HB . 19077 1 976 . 1 1 91 91 ALA C C 13 177.495 0.3 . 1 . . . . 89 ALA C . 19077 1 977 . 1 1 91 91 ALA CA C 13 52.511 0.3 . 1 . . . . 89 ALA CA . 19077 1 978 . 1 1 91 91 ALA CB C 13 19.129 0.3 . 1 . . . . 89 ALA CB . 19077 1 979 . 1 1 91 91 ALA N N 15 124.518 0.3 . 1 . . . . 89 ALA N . 19077 1 980 . 1 1 92 92 LYS H H 1 8.126 0.020 . 1 . . . . 90 LYS H . 19077 1 981 . 1 1 92 92 LYS HA H 1 4.299 0.020 . 1 . . . . 90 LYS HA . 19077 1 982 . 1 1 92 92 LYS HB2 H 1 1.783 0.020 . 1 . . . . 90 LYS HB2 . 19077 1 983 . 1 1 92 92 LYS HB3 H 1 1.783 0.020 . 1 . . . . 90 LYS HB3 . 19077 1 984 . 1 1 92 92 LYS HG2 H 1 1.407 0.020 . 1 . . . . 90 LYS HG2 . 19077 1 985 . 1 1 92 92 LYS HG3 H 1 1.407 0.020 . 1 . . . . 90 LYS HG3 . 19077 1 986 . 1 1 92 92 LYS HD2 H 1 1.611 0.020 . 1 . . . . 90 LYS HD2 . 19077 1 987 . 1 1 92 92 LYS HD3 H 1 1.611 0.020 . 1 . . . . 90 LYS HD3 . 19077 1 988 . 1 1 92 92 LYS HE2 H 1 3.020 0.020 . 1 . . . . 90 LYS HE2 . 19077 1 989 . 1 1 92 92 LYS HE3 H 1 3.020 0.020 . 1 . . . . 90 LYS HE3 . 19077 1 990 . 1 1 92 92 LYS C C 13 176.442 0.3 . 1 . . . . 90 LYS C . 19077 1 991 . 1 1 92 92 LYS CA C 13 56.269 0.3 . 1 . . . . 90 LYS CA . 19077 1 992 . 1 1 92 92 LYS CB C 13 33.060 0.3 . 1 . . . . 90 LYS CB . 19077 1 993 . 1 1 92 92 LYS CG C 13 24.561 0.3 . 1 . . . . 90 LYS CG . 19077 1 994 . 1 1 92 92 LYS CD C 13 28.801 0.3 . 1 . . . . 90 LYS CD . 19077 1 995 . 1 1 92 92 LYS CE C 13 40.724 0.3 . 1 . . . . 90 LYS CE . 19077 1 996 . 1 1 92 92 LYS N N 15 120.429 0.3 . 1 . . . . 90 LYS N . 19077 1 997 . 1 1 93 93 VAL H H 1 8.156 0.020 . 1 . . . . 91 VAL H . 19077 1 998 . 1 1 93 93 VAL HA H 1 4.065 0.020 . 1 . . . . 91 VAL HA . 19077 1 999 . 1 1 93 93 VAL HB H 1 2.039 0.020 . 1 . . . . 91 VAL HB . 19077 1 1000 . 1 1 93 93 VAL HG11 H 1 0.940 0.020 . 1 . . . . 91 VAL HG1 . 19077 1 1001 . 1 1 93 93 VAL HG12 H 1 0.940 0.020 . 1 . . . . 91 VAL HG1 . 19077 1 1002 . 1 1 93 93 VAL HG13 H 1 0.940 0.020 . 1 . . . . 91 VAL HG1 . 19077 1 1003 . 1 1 93 93 VAL HG21 H 1 0.940 0.020 . 1 . . . . 91 VAL HG2 . 19077 1 1004 . 1 1 93 93 VAL HG22 H 1 0.940 0.020 . 1 . . . . 91 VAL HG2 . 19077 1 1005 . 1 1 93 93 VAL HG23 H 1 0.940 0.020 . 1 . . . . 91 VAL HG2 . 19077 1 1006 . 1 1 93 93 VAL C C 13 176.080 0.3 . 1 . . . . 91 VAL C . 19077 1 1007 . 1 1 93 93 VAL CA C 13 62.523 0.3 . 1 . . . . 91 VAL CA . 19077 1 1008 . 1 1 93 93 VAL CB C 13 32.703 0.3 . 1 . . . . 91 VAL CB . 19077 1 1009 . 1 1 93 93 VAL CG1 C 13 20.800 0.3 . 1 . . . . 91 VAL CG1 . 19077 1 1010 . 1 1 93 93 VAL CG2 C 13 20.800 0.3 . 1 . . . . 91 VAL CG2 . 19077 1 1011 . 1 1 93 93 VAL N N 15 122.338 0.3 . 1 . . . . 91 VAL N . 19077 1 1012 . 1 1 94 94 ILE H H 1 8.212 0.020 . 1 . . . . 92 ILE H . 19077 1 1013 . 1 1 94 94 ILE HA H 1 4.150 0.020 . 1 . . . . 92 ILE HA . 19077 1 1014 . 1 1 94 94 ILE HB H 1 1.836 0.020 . 1 . . . . 92 ILE HB . 19077 1 1015 . 1 1 94 94 ILE HG12 H 1 1.463 0.020 . 2 . . . . 92 ILE HG12 . 19077 1 1016 . 1 1 94 94 ILE HG13 H 1 1.184 0.020 . 2 . . . . 92 ILE HG13 . 19077 1 1017 . 1 1 94 94 ILE HG21 H 1 0.878 0.020 . 1 . . . . 92 ILE HG2 . 19077 1 1018 . 1 1 94 94 ILE HG22 H 1 0.878 0.020 . 1 . . . . 92 ILE HG2 . 19077 1 1019 . 1 1 94 94 ILE HG23 H 1 0.878 0.020 . 1 . . . . 92 ILE HG2 . 19077 1 1020 . 1 1 94 94 ILE HD11 H 1 0.842 0.020 . 1 . . . . 92 ILE HD1 . 19077 1 1021 . 1 1 94 94 ILE HD12 H 1 0.842 0.020 . 1 . . . . 92 ILE HD1 . 19077 1 1022 . 1 1 94 94 ILE HD13 H 1 0.842 0.020 . 1 . . . . 92 ILE HD1 . 19077 1 1023 . 1 1 94 94 ILE C C 13 175.436 0.3 . 1 . . . . 92 ILE C . 19077 1 1024 . 1 1 94 94 ILE CA C 13 60.967 0.3 . 1 . . . . 92 ILE CA . 19077 1 1025 . 1 1 94 94 ILE CB C 13 38.847 0.3 . 1 . . . . 92 ILE CB . 19077 1 1026 . 1 1 94 94 ILE CG1 C 13 27.121 0.3 . 1 . . . . 92 ILE CG1 . 19077 1 1027 . 1 1 94 94 ILE CG2 C 13 17.199 0.3 . 1 . . . . 92 ILE CG2 . 19077 1 1028 . 1 1 94 94 ILE CD1 C 13 12.638 0.3 . 1 . . . . 92 ILE CD1 . 19077 1 1029 . 1 1 94 94 ILE N N 15 124.834 0.3 . 1 . . . . 92 ILE N . 19077 1 1030 . 1 1 95 95 ASP H H 1 8.382 0.020 . 1 . . . . 93 ASP H . 19077 1 1031 . 1 1 95 95 ASP HA H 1 4.640 0.020 . 1 . . . . 93 ASP HA . 19077 1 1032 . 1 1 95 95 ASP HB2 H 1 2.753 0.020 . 2 . . . . 93 ASP HB2 . 19077 1 1033 . 1 1 95 95 ASP HB3 H 1 2.582 0.020 . 2 . . . . 93 ASP HB3 . 19077 1 1034 . 1 1 95 95 ASP C C 13 176.175 0.3 . 1 . . . . 93 ASP C . 19077 1 1035 . 1 1 95 95 ASP CA C 13 53.921 0.3 . 1 . . . . 93 ASP CA . 19077 1 1036 . 1 1 95 95 ASP CB C 13 41.347 0.3 . 1 . . . . 93 ASP CB . 19077 1 1037 . 1 1 95 95 ASP N N 15 124.790 0.3 . 1 . . . . 93 ASP N . 19077 1 1038 . 1 1 96 96 LEU H H 1 8.406 0.020 . 1 . . . . 94 LEU H . 19077 1 1039 . 1 1 96 96 LEU HA H 1 4.374 0.020 . 1 . . . . 94 LEU HA . 19077 1 1040 . 1 1 96 96 LEU HB2 H 1 1.644 0.020 . 1 . . . . 94 LEU HB2 . 19077 1 1041 . 1 1 96 96 LEU HB3 H 1 1.644 0.020 . 1 . . . . 94 LEU HB3 . 19077 1 1042 . 1 1 96 96 LEU HG H 1 1.557 0.020 . 1 . . . . 94 LEU HG . 19077 1 1043 . 1 1 96 96 LEU HD11 H 1 0.940 0.020 . 2 . . . . 94 LEU HD1 . 19077 1 1044 . 1 1 96 96 LEU HD12 H 1 0.940 0.020 . 2 . . . . 94 LEU HD1 . 19077 1 1045 . 1 1 96 96 LEU HD13 H 1 0.940 0.020 . 2 . . . . 94 LEU HD1 . 19077 1 1046 . 1 1 96 96 LEU HD21 H 1 0.876 0.020 . 2 . . . . 94 LEU HD2 . 19077 1 1047 . 1 1 96 96 LEU HD22 H 1 0.876 0.020 . 2 . . . . 94 LEU HD2 . 19077 1 1048 . 1 1 96 96 LEU HD23 H 1 0.876 0.020 . 2 . . . . 94 LEU HD2 . 19077 1 1049 . 1 1 96 96 LEU C C 13 177.810 0.3 . 1 . . . . 94 LEU C . 19077 1 1050 . 1 1 96 96 LEU CA C 13 55.359 0.3 . 1 . . . . 94 LEU CA . 19077 1 1051 . 1 1 96 96 LEU CB C 13 42.133 0.3 . 1 . . . . 94 LEU CB . 19077 1 1052 . 1 1 96 96 LEU CG C 13 26.641 0.3 . 1 . . . . 94 LEU CG . 19077 1 1053 . 1 1 96 96 LEU CD1 C 13 24.881 0.3 . 1 . . . . 94 LEU CD1 . 19077 1 1054 . 1 1 96 96 LEU CD2 C 13 22.960 0.3 . 1 . . . . 94 LEU CD2 . 19077 1 1055 . 1 1 96 96 LEU N N 15 123.975 0.3 . 1 . . . . 94 LEU N . 19077 1 1056 . 1 1 97 97 THR H H 1 8.228 0.020 . 1 . . . . 95 THR H . 19077 1 1057 . 1 1 97 97 THR HA H 1 4.566 0.020 . 1 . . . . 95 THR HA . 19077 1 1058 . 1 1 97 97 THR HB H 1 4.267 0.020 . 1 . . . . 95 THR HB . 19077 1 1059 . 1 1 97 97 THR HG21 H 1 1.143 0.020 . 1 . . . . 95 THR HG2 . 19077 1 1060 . 1 1 97 97 THR HG22 H 1 1.143 0.020 . 1 . . . . 95 THR HG2 . 19077 1 1061 . 1 1 97 97 THR HG23 H 1 1.143 0.020 . 1 . . . . 95 THR HG2 . 19077 1 1062 . 1 1 97 97 THR C C 13 174.571 0.3 . 1 . . . . 95 THR C . 19077 1 1063 . 1 1 97 97 THR CA C 13 62.523 0.3 . 1 . . . . 95 THR CA . 19077 1 1064 . 1 1 97 97 THR CB C 13 69.708 0.3 . 1 . . . . 95 THR CB . 19077 1 1065 . 1 1 97 97 THR CG2 C 13 21.360 0.3 . 1 . . . . 95 THR CG2 . 19077 1 1066 . 1 1 97 97 THR N N 15 113.412 0.3 . 1 . . . . 95 THR N . 19077 1 1067 . 1 1 98 98 HIS H H 1 8.192 0.020 . 1 . . . . 96 HIS H . 19077 1 1068 . 1 1 98 98 HIS HA H 1 4.662 0.020 . 1 . . . . 96 HIS HA . 19077 1 1069 . 1 1 98 98 HIS HB2 H 1 3.222 0.020 . 2 . . . . 96 HIS HB2 . 19077 1 1070 . 1 1 98 98 HIS HB3 H 1 3.126 0.020 . 2 . . . . 96 HIS HB3 . 19077 1 1071 . 1 1 98 98 HIS C C 13 174.476 0.3 . 1 . . . . 96 HIS C . 19077 1 1072 . 1 1 98 98 HIS CA C 13 55.976 0.3 . 1 . . . . 96 HIS CA . 19077 1 1073 . 1 1 98 98 HIS CB C 13 29.842 0.3 . 1 . . . . 96 HIS CB . 19077 1 1074 . 1 1 98 98 HIS N N 15 120.604 0.3 . 1 . . . . 96 HIS N . 19077 1 1075 . 1 1 99 99 ASP H H 1 8.309 0.020 . 1 . . . . 97 ASP H . 19077 1 1076 . 1 1 99 99 ASP HA H 1 4.587 0.020 . 1 . . . . 97 ASP HA . 19077 1 1077 . 1 1 99 99 ASP HB2 H 1 2.689 0.020 . 2 . . . . 97 ASP HB2 . 19077 1 1078 . 1 1 99 99 ASP HB3 H 1 2.593 0.020 . 2 . . . . 97 ASP HB3 . 19077 1 1079 . 1 1 99 99 ASP C C 13 175.829 0.3 . 1 . . . . 97 ASP C . 19077 1 1080 . 1 1 99 99 ASP CA C 13 54.361 0.3 . 1 . . . . 97 ASP CA . 19077 1 1081 . 1 1 99 99 ASP CB C 13 41.276 0.3 . 1 . . . . 97 ASP CB . 19077 1 1082 . 1 1 99 99 ASP N N 15 121.564 0.3 . 1 . . . . 97 ASP N . 19077 1 1083 . 1 1 100 100 ASN H H 1 8.436 0.020 . 1 . . . . 98 ASN H . 19077 1 1084 . 1 1 100 100 ASN HA H 1 4.608 0.020 . 1 . . . . 98 ASN HA . 19077 1 1085 . 1 1 100 100 ASN HB2 H 1 2.710 0.020 . 2 . . . . 98 ASN HB2 . 19077 1 1086 . 1 1 100 100 ASN HB3 H 1 2.625 0.020 . 2 . . . . 98 ASN HB3 . 19077 1 1087 . 1 1 100 100 ASN C C 13 175.577 0.3 . 1 . . . . 98 ASN C . 19077 1 1088 . 1 1 100 100 ASN CA C 13 53.392 0.3 . 1 . . . . 98 ASN CA . 19077 1 1089 . 1 1 100 100 ASN CB C 13 38.847 0.3 . 1 . . . . 98 ASN CB . 19077 1 1090 . 1 1 100 100 ASN N N 15 119.607 0.3 . 1 . . . . 98 ASN N . 19077 1 1091 . 1 1 101 101 LYS H H 1 8.364 0.020 . 1 . . . . 99 LYS H . 19077 1 1092 . 1 1 101 101 LYS HA H 1 4.235 0.020 . 1 . . . . 99 LYS HA . 19077 1 1093 . 1 1 101 101 LYS HB2 H 1 1.825 0.020 . 1 . . . . 99 LYS HB2 . 19077 1 1094 . 1 1 101 101 LYS HB3 H 1 1.825 0.020 . 1 . . . . 99 LYS HB3 . 19077 1 1095 . 1 1 101 101 LYS HG2 H 1 1.420 0.020 . 1 . . . . 99 LYS HG2 . 19077 1 1096 . 1 1 101 101 LYS HG3 H 1 1.420 0.020 . 1 . . . . 99 LYS HG3 . 19077 1 1097 . 1 1 101 101 LYS HD2 H 1 1.665 0.020 . 1 . . . . 99 LYS HD2 . 19077 1 1098 . 1 1 101 101 LYS HD3 H 1 1.665 0.020 . 1 . . . . 99 LYS HD3 . 19077 1 1099 . 1 1 101 101 LYS HE2 H 1 3.009 0.020 . 1 . . . . 99 LYS HE2 . 19077 1 1100 . 1 1 101 101 LYS HE3 H 1 3.009 0.020 . 1 . . . . 99 LYS HE3 . 19077 1 1101 . 1 1 101 101 LYS C C 13 176.710 0.3 . 1 . . . . 99 LYS C . 19077 1 1102 . 1 1 101 101 LYS CA C 13 57.091 0.3 . 1 . . . . 99 LYS CA . 19077 1 1103 . 1 1 101 101 LYS CB C 13 32.560 0.3 . 1 . . . . 99 LYS CB . 19077 1 1104 . 1 1 101 101 LYS CG C 13 24.321 0.3 . 1 . . . . 99 LYS CG . 19077 1 1105 . 1 1 101 101 LYS CD C 13 28.801 0.3 . 1 . . . . 99 LYS CD . 19077 1 1106 . 1 1 101 101 LYS CE C 13 41.844 0.3 . 1 . . . . 99 LYS CE . 19077 1 1107 . 1 1 101 101 LYS N N 15 121.458 0.3 . 1 . . . . 99 LYS N . 19077 1 1108 . 1 1 102 102 ASP H H 1 8.309 0.020 . 1 . . . . 100 ASP H . 19077 1 1109 . 1 1 102 102 ASP HA H 1 4.577 0.020 . 1 . . . . 100 ASP HA . 19077 1 1110 . 1 1 102 102 ASP HB2 H 1 2.710 0.020 . 2 . . . . 100 ASP HB2 . 19077 1 1111 . 1 1 102 102 ASP HB3 H 1 2.636 0.020 . 2 . . . . 100 ASP HB3 . 19077 1 1112 . 1 1 102 102 ASP C C 13 176.458 0.3 . 1 . . . . 100 ASP C . 19077 1 1113 . 1 1 102 102 ASP CA C 13 55.007 0.3 . 1 . . . . 100 ASP CA . 19077 1 1114 . 1 1 102 102 ASP CB C 13 41.061 0.3 . 1 . . . . 100 ASP CB . 19077 1 1115 . 1 1 102 102 ASP N N 15 120.566 0.3 . 1 . . . . 100 ASP N . 19077 1 1116 . 1 1 103 103 ASP H H 1 8.204 0.020 . 1 . . . . 101 ASP H . 19077 1 1117 . 1 1 103 103 ASP HA H 1 4.577 0.020 . 1 . . . . 101 ASP HA . 19077 1 1118 . 1 1 103 103 ASP HB2 H 1 2.717 0.020 . 1 . . . . 101 ASP HB2 . 19077 1 1119 . 1 1 103 103 ASP HB3 H 1 2.717 0.020 . 1 . . . . 101 ASP HB3 . 19077 1 1120 . 1 1 103 103 ASP C C 13 177.087 0.3 . 1 . . . . 101 ASP C . 19077 1 1121 . 1 1 103 103 ASP CA C 13 54.919 0.3 . 1 . . . . 101 ASP CA . 19077 1 1122 . 1 1 103 103 ASP CB C 13 40.918 0.3 . 1 . . . . 101 ASP CB . 19077 1 1123 . 1 1 103 103 ASP N N 15 120.703 0.3 . 1 . . . . 101 ASP N . 19077 1 1124 . 1 1 104 104 LEU HA H 1 4.235 0.020 . 1 . . . . 102 LEU HA . 19077 1 1125 . 1 1 104 104 LEU HB2 H 1 1.719 0.020 . 2 . . . . 102 LEU HB2 . 19077 1 1126 . 1 1 104 104 LEU HB3 H 1 1.633 0.020 . 2 . . . . 102 LEU HB3 . 19077 1 1127 . 1 1 104 104 LEU HG H 1 1.365 0.020 . 1 . . . . 102 LEU HG . 19077 1 1128 . 1 1 104 104 LEU HD11 H 1 0.898 0.020 . 1 . . . . 102 LEU HD1 . 19077 1 1129 . 1 1 104 104 LEU HD12 H 1 0.898 0.020 . 1 . . . . 102 LEU HD1 . 19077 1 1130 . 1 1 104 104 LEU HD13 H 1 0.898 0.020 . 1 . . . . 102 LEU HD1 . 19077 1 1131 . 1 1 104 104 LEU HD21 H 1 0.898 0.020 . 1 . . . . 102 LEU HD2 . 19077 1 1132 . 1 1 104 104 LEU HD22 H 1 0.898 0.020 . 1 . . . . 102 LEU HD2 . 19077 1 1133 . 1 1 104 104 LEU HD23 H 1 0.898 0.020 . 1 . . . . 102 LEU HD2 . 19077 1 1134 . 1 1 104 104 LEU C C 13 178.219 0.3 . 1 . . . . 102 LEU C . 19077 1 1135 . 1 1 104 104 LEU CA C 13 56.445 0.3 . 1 . . . . 102 LEU CA . 19077 1 1136 . 1 1 104 104 LEU CB C 13 41.990 0.3 . 1 . . . . 102 LEU CB . 19077 1 1137 . 1 1 104 104 LEU CG C 13 26.721 0.3 . 1 . . . . 102 LEU CG . 19077 1 1138 . 1 1 104 104 LEU CD1 C 13 24.481 0.3 . 1 . . . . 102 LEU CD1 . 19077 1 1139 . 1 1 104 104 LEU CD2 C 13 23.440 0.3 . 1 . . . . 102 LEU CD2 . 19077 1 1140 . 1 1 105 105 GLN H H 1 8.230 0.020 . 1 . . . . 103 GLN H . 19077 1 1141 . 1 1 105 105 GLN HA H 1 4.161 0.020 . 1 . . . . 103 GLN HA . 19077 1 1142 . 1 1 105 105 GLN HB2 H 1 2.103 0.020 . 1 . . . . 103 GLN HB2 . 19077 1 1143 . 1 1 105 105 GLN HB3 H 1 2.103 0.020 . 1 . . . . 103 GLN HB3 . 19077 1 1144 . 1 1 105 105 GLN HG2 H 1 2.422 0.020 . 1 . . . . 103 GLN HG2 . 19077 1 1145 . 1 1 105 105 GLN HG3 H 1 2.422 0.020 . 1 . . . . 103 GLN HG3 . 19077 1 1146 . 1 1 105 105 GLN C C 13 177.087 0.3 . 1 . . . . 103 GLN C . 19077 1 1147 . 1 1 105 105 GLN CA C 13 57.091 0.3 . 1 . . . . 103 GLN CA . 19077 1 1148 . 1 1 105 105 GLN CB C 13 28.702 0.3 . 1 . . . . 103 GLN CB . 19077 1 1149 . 1 1 105 105 GLN CG C 13 33.762 0.3 . 1 . . . . 103 GLN CG . 19077 1 1150 . 1 1 105 105 GLN N N 15 119.063 0.3 . 1 . . . . 103 GLN N . 19077 1 1151 . 1 1 106 106 ALA H H 1 8.107 0.020 . 1 . . . . 104 ALA H . 19077 1 1152 . 1 1 106 106 ALA HA H 1 4.214 0.020 . 1 . . . . 104 ALA HA . 19077 1 1153 . 1 1 106 106 ALA HB1 H 1 1.420 0.020 . 1 . . . . 104 ALA HB . 19077 1 1154 . 1 1 106 106 ALA HB2 H 1 1.420 0.020 . 1 . . . . 104 ALA HB . 19077 1 1155 . 1 1 106 106 ALA HB3 H 1 1.420 0.020 . 1 . . . . 104 ALA HB . 19077 1 1156 . 1 1 106 106 ALA C C 13 178.392 0.3 . 1 . . . . 104 ALA C . 19077 1 1157 . 1 1 106 106 ALA CA C 13 53.539 0.3 . 1 . . . . 104 ALA CA . 19077 1 1158 . 1 1 106 106 ALA CB C 13 18.844 0.3 . 1 . . . . 104 ALA CB . 19077 1 1159 . 1 1 106 106 ALA N N 15 123.604 0.3 . 1 . . . . 104 ALA N . 19077 1 1160 . 1 1 107 107 ALA H H 1 8.010 0.020 . 1 . . . . 105 ALA H . 19077 1 1161 . 1 1 107 107 ALA HA H 1 4.235 0.020 . 1 . . . . 105 ALA HA . 19077 1 1162 . 1 1 107 107 ALA HB1 H 1 1.441 0.020 . 1 . . . . 105 ALA HB . 19077 1 1163 . 1 1 107 107 ALA HB2 H 1 1.441 0.020 . 1 . . . . 105 ALA HB . 19077 1 1164 . 1 1 107 107 ALA HB3 H 1 1.441 0.020 . 1 . . . . 105 ALA HB . 19077 1 1165 . 1 1 107 107 ALA C C 13 179.132 0.3 . 1 . . . . 105 ALA C . 19077 1 1166 . 1 1 107 107 ALA CA C 13 53.480 0.3 . 1 . . . . 105 ALA CA . 19077 1 1167 . 1 1 107 107 ALA CB C 13 18.844 0.3 . 1 . . . . 105 ALA CB . 19077 1 1168 . 1 1 107 107 ALA N N 15 121.789 0.3 . 1 . . . . 105 ALA N . 19077 1 1169 . 1 1 108 108 ILE H H 1 7.997 0.020 . 1 . . . . 106 ILE H . 19077 1 1170 . 1 1 108 108 ILE HA H 1 3.958 0.020 . 1 . . . . 106 ILE HA . 19077 1 1171 . 1 1 108 108 ILE HB H 1 1.868 0.020 . 1 . . . . 106 ILE HB . 19077 1 1172 . 1 1 108 108 ILE HG12 H 1 1.591 0.020 . 1 . . . . 106 ILE HG12 . 19077 1 1173 . 1 1 108 108 ILE HG13 H 1 1.591 0.020 . 1 . . . . 106 ILE HG13 . 19077 1 1174 . 1 1 108 108 ILE HG21 H 1 1.175 0.020 . 1 . . . . 106 ILE HG2 . 19077 1 1175 . 1 1 108 108 ILE HG22 H 1 1.175 0.020 . 1 . . . . 106 ILE HG2 . 19077 1 1176 . 1 1 108 108 ILE HG23 H 1 1.175 0.020 . 1 . . . . 106 ILE HG2 . 19077 1 1177 . 1 1 108 108 ILE HD11 H 1 0.919 0.020 . 1 . . . . 106 ILE HD1 . 19077 1 1178 . 1 1 108 108 ILE HD12 H 1 0.919 0.020 . 1 . . . . 106 ILE HD1 . 19077 1 1179 . 1 1 108 108 ILE HD13 H 1 0.919 0.020 . 1 . . . . 106 ILE HD1 . 19077 1 1180 . 1 1 108 108 ILE C C 13 177.118 0.3 . 1 . . . . 106 ILE C . 19077 1 1181 . 1 1 108 108 ILE CA C 13 62.464 0.3 . 1 . . . . 106 ILE CA . 19077 1 1182 . 1 1 108 108 ILE CB C 13 38.489 0.3 . 1 . . . . 106 ILE CB . 19077 1 1183 . 1 1 108 108 ILE CG1 C 13 27.841 0.3 . 1 . . . . 106 ILE CG1 . 19077 1 1184 . 1 1 108 108 ILE CG2 C 13 17.119 0.3 . 1 . . . . 106 ILE CG2 . 19077 1 1185 . 1 1 108 108 ILE CD1 C 13 12.878 0.3 . 1 . . . . 106 ILE CD1 . 19077 1 1186 . 1 1 108 108 ILE N N 15 119.754 0.3 . 1 . . . . 106 ILE N . 19077 1 1187 . 1 1 109 109 ALA H H 1 8.132 0.020 . 1 . . . . 107 ALA H . 19077 1 1188 . 1 1 109 109 ALA HA H 1 4.225 0.020 . 1 . . . . 107 ALA HA . 19077 1 1189 . 1 1 109 109 ALA HB1 H 1 1.431 0.020 . 1 . . . . 107 ALA HB . 19077 1 1190 . 1 1 109 109 ALA HB2 H 1 1.431 0.020 . 1 . . . . 107 ALA HB . 19077 1 1191 . 1 1 109 109 ALA HB3 H 1 1.431 0.020 . 1 . . . . 107 ALA HB . 19077 1 1192 . 1 1 109 109 ALA C C 13 178.738 0.3 . 1 . . . . 107 ALA C . 19077 1 1193 . 1 1 109 109 ALA CA C 13 53.510 0.3 . 1 . . . . 107 ALA CA . 19077 1 1194 . 1 1 109 109 ALA CB C 13 18.701 0.3 . 1 . . . . 107 ALA CB . 19077 1 1195 . 1 1 109 109 ALA N N 15 125.606 0.3 . 1 . . . . 107 ALA N . 19077 1 1196 . 1 1 110 110 LEU H H 1 8.022 0.020 . 1 . . . . 108 LEU H . 19077 1 1197 . 1 1 110 110 LEU HA H 1 4.257 0.020 . 1 . . . . 108 LEU HA . 19077 1 1198 . 1 1 110 110 LEU HB2 H 1 1.697 0.020 . 2 . . . . 108 LEU HB2 . 19077 1 1199 . 1 1 110 110 LEU HB3 H 1 1.623 0.020 . 2 . . . . 108 LEU HB3 . 19077 1 1200 . 1 1 110 110 LEU HG H 1 1.505 0.020 . 1 . . . . 108 LEU HG . 19077 1 1201 . 1 1 110 110 LEU HD11 H 1 0.919 0.020 . 1 . . . . 108 LEU HD1 . 19077 1 1202 . 1 1 110 110 LEU HD12 H 1 0.919 0.020 . 1 . . . . 108 LEU HD1 . 19077 1 1203 . 1 1 110 110 LEU HD13 H 1 0.919 0.020 . 1 . . . . 108 LEU HD1 . 19077 1 1204 . 1 1 110 110 LEU HD21 H 1 0.919 0.020 . 1 . . . . 108 LEU HD2 . 19077 1 1205 . 1 1 110 110 LEU HD22 H 1 0.919 0.020 . 1 . . . . 108 LEU HD2 . 19077 1 1206 . 1 1 110 110 LEU HD23 H 1 0.919 0.020 . 1 . . . . 108 LEU HD2 . 19077 1 1207 . 1 1 110 110 LEU C C 13 178.282 0.3 . 1 . . . . 108 LEU C . 19077 1 1208 . 1 1 110 110 LEU CA C 13 56.181 0.3 . 1 . . . . 108 LEU CA . 19077 1 1209 . 1 1 110 110 LEU CB C 13 42.204 0.3 . 1 . . . . 108 LEU CB . 19077 1 1210 . 1 1 110 110 LEU CG C 13 26.721 0.3 . 1 . . . . 108 LEU CG . 19077 1 1211 . 1 1 110 110 LEU CD1 C 13 24.561 0.3 . 1 . . . . 108 LEU CD1 . 19077 1 1212 . 1 1 110 110 LEU CD2 C 13 23.440 0.3 . 1 . . . . 108 LEU CD2 . 19077 1 1213 . 1 1 110 110 LEU N N 15 119.892 0.3 . 1 . . . . 108 LEU N . 19077 1 1214 . 1 1 111 111 SER H H 1 8.097 0.020 . 1 . . . . 109 SER H . 19077 1 1215 . 1 1 111 111 SER HA H 1 4.374 0.020 . 1 . . . . 109 SER HA . 19077 1 1216 . 1 1 111 111 SER HB2 H 1 3.926 0.020 . 1 . . . . 109 SER HB2 . 19077 1 1217 . 1 1 111 111 SER HB3 H 1 3.926 0.020 . 1 . . . . 109 SER HB3 . 19077 1 1218 . 1 1 111 111 SER C C 13 175.090 0.3 . 1 . . . . 109 SER C . 19077 1 1219 . 1 1 111 111 SER CA C 13 59.293 0.3 . 1 . . . . 109 SER CA . 19077 1 1220 . 1 1 111 111 SER CB C 13 63.493 0.3 . 1 . . . . 109 SER CB . 19077 1 1221 . 1 1 111 111 SER N N 15 115.523 0.3 . 1 . . . . 109 SER N . 19077 1 1222 . 1 1 112 112 LEU H H 1 7.971 0.020 . 1 . . . . 110 LEU H . 19077 1 1223 . 1 1 112 112 LEU HA H 1 4.331 0.020 . 1 . . . . 110 LEU HA . 19077 1 1224 . 1 1 112 112 LEU HB2 H 1 1.708 0.020 . 2 . . . . 110 LEU HB2 . 19077 1 1225 . 1 1 112 112 LEU HB3 H 1 1.612 0.020 . 2 . . . . 110 LEU HB3 . 19077 1 1226 . 1 1 112 112 LEU HG H 1 1.484 0.020 . 1 . . . . 110 LEU HG . 19077 1 1227 . 1 1 112 112 LEU HD11 H 1 0.908 0.020 . 1 . . . . 110 LEU HD1 . 19077 1 1228 . 1 1 112 112 LEU HD12 H 1 0.908 0.020 . 1 . . . . 110 LEU HD1 . 19077 1 1229 . 1 1 112 112 LEU HD13 H 1 0.908 0.020 . 1 . . . . 110 LEU HD1 . 19077 1 1230 . 1 1 112 112 LEU HD21 H 1 0.908 0.020 . 1 . . . . 110 LEU HD2 . 19077 1 1231 . 1 1 112 112 LEU HD22 H 1 0.908 0.020 . 1 . . . . 110 LEU HD2 . 19077 1 1232 . 1 1 112 112 LEU HD23 H 1 0.908 0.020 . 1 . . . . 110 LEU HD2 . 19077 1 1233 . 1 1 112 112 LEU C C 13 177.622 0.3 . 1 . . . . 110 LEU C . 19077 1 1234 . 1 1 112 112 LEU CA C 13 55.623 0.3 . 1 . . . . 110 LEU CA . 19077 1 1235 . 1 1 112 112 LEU CB C 13 42.133 0.3 . 1 . . . . 110 LEU CB . 19077 1 1236 . 1 1 112 112 LEU CG C 13 26.481 0.3 . 1 . . . . 110 LEU CG . 19077 1 1237 . 1 1 112 112 LEU CD1 C 13 24.801 0.3 . 1 . . . . 110 LEU CD1 . 19077 1 1238 . 1 1 112 112 LEU CD2 C 13 22.960 0.3 . 1 . . . . 110 LEU CD2 . 19077 1 1239 . 1 1 112 112 LEU N N 15 122.877 0.3 . 1 . . . . 110 LEU N . 19077 1 1240 . 1 1 113 113 LEU H H 1 7.861 0.020 . 1 . . . . 111 LEU H . 19077 1 1241 . 1 1 113 113 LEU HA H 1 4.235 0.020 . 1 . . . . 111 LEU HA . 19077 1 1242 . 1 1 113 113 LEU HB2 H 1 1.633 0.020 . 1 . . . . 111 LEU HB2 . 19077 1 1243 . 1 1 113 113 LEU HB3 H 1 1.633 0.020 . 1 . . . . 111 LEU HB3 . 19077 1 1244 . 1 1 113 113 LEU HG H 1 1.521 0.020 . 1 . . . . 111 LEU HG . 19077 1 1245 . 1 1 113 113 LEU HD11 H 1 0.898 0.020 . 1 . . . . 111 LEU HD1 . 19077 1 1246 . 1 1 113 113 LEU HD12 H 1 0.898 0.020 . 1 . . . . 111 LEU HD1 . 19077 1 1247 . 1 1 113 113 LEU HD13 H 1 0.898 0.020 . 1 . . . . 111 LEU HD1 . 19077 1 1248 . 1 1 113 113 LEU HD21 H 1 0.898 0.020 . 1 . . . . 111 LEU HD2 . 19077 1 1249 . 1 1 113 113 LEU HD22 H 1 0.898 0.020 . 1 . . . . 111 LEU HD2 . 19077 1 1250 . 1 1 113 113 LEU HD23 H 1 0.898 0.020 . 1 . . . . 111 LEU HD2 . 19077 1 1251 . 1 1 113 113 LEU C C 13 177.386 0.3 . 1 . . . . 111 LEU C . 19077 1 1252 . 1 1 113 113 LEU CA C 13 55.447 0.3 . 1 . . . . 111 LEU CA . 19077 1 1253 . 1 1 113 113 LEU CB C 13 42.133 0.3 . 1 . . . . 111 LEU CB . 19077 1 1254 . 1 1 113 113 LEU CG C 13 26.561 0.3 . 1 . . . . 111 LEU CG . 19077 1 1255 . 1 1 113 113 LEU CD1 C 13 24.721 0.3 . 1 . . . . 111 LEU CD1 . 19077 1 1256 . 1 1 113 113 LEU CD2 C 13 23.120 0.3 . 1 . . . . 111 LEU CD2 . 19077 1 1257 . 1 1 113 113 LEU N N 15 120.975 0.3 . 1 . . . . 111 LEU N . 19077 1 1258 . 1 1 114 114 GLU H H 1 8.098 0.020 . 1 . . . . 112 GLU H . 19077 1 1259 . 1 1 114 114 GLU HA H 1 4.321 0.020 . 1 . . . . 112 GLU HA . 19077 1 1260 . 1 1 114 114 GLU HB2 H 1 2.049 0.020 . 2 . . . . 112 GLU HB2 . 19077 1 1261 . 1 1 114 114 GLU HB3 H 1 1.943 0.020 . 2 . . . . 112 GLU HB3 . 19077 1 1262 . 1 1 114 114 GLU HG2 H 1 2.273 0.020 . 1 . . . . 112 GLU HG2 . 19077 1 1263 . 1 1 114 114 GLU HG3 H 1 2.273 0.020 . 1 . . . . 112 GLU HG3 . 19077 1 1264 . 1 1 114 114 GLU C C 13 176.222 0.3 . 1 . . . . 112 GLU C . 19077 1 1265 . 1 1 114 114 GLU CA C 13 56.269 0.3 . 1 . . . . 112 GLU CA . 19077 1 1266 . 1 1 114 114 GLU CB C 13 30.631 0.3 . 1 . . . . 112 GLU CB . 19077 1 1267 . 1 1 114 114 GLU CG C 13 36.003 0.3 . 1 . . . . 112 GLU CG . 19077 1 1268 . 1 1 114 114 GLU N N 15 120.429 0.3 . 1 . . . . 112 GLU N . 19077 1 1269 . 1 1 115 115 SER H H 1 8.257 0.020 . 1 . . . . 113 SER H . 19077 1 1270 . 1 1 115 115 SER HA H 1 4.498 0.020 . 1 . . . . 113 SER HA . 19077 1 1271 . 1 1 115 115 SER HB2 H 1 3.895 0.020 . 1 . . . . 113 SER HB2 . 19077 1 1272 . 1 1 115 115 SER HB3 H 1 3.895 0.020 . 1 . . . . 113 SER HB3 . 19077 1 1273 . 1 1 115 115 SER C C 13 172.589 0.3 . 1 . . . . 113 SER C . 19077 1 1274 . 1 1 115 115 SER CA C 13 56.592 0.3 . 1 . . . . 113 SER CA . 19077 1 1275 . 1 1 115 115 SER CB C 13 63.207 0.3 . 1 . . . . 113 SER CB . 19077 1 1276 . 1 1 115 115 SER N N 15 118.110 0.3 . 1 . . . . 113 SER N . 19077 1 1277 . 1 1 116 116 PRO HA H 1 4.342 0.020 . 1 . . . . 114 PRO HA . 19077 1 1278 . 1 1 116 116 PRO HB2 H 1 2.156 0.020 . 2 . . . . 114 PRO HB2 . 19077 1 1279 . 1 1 116 116 PRO HB3 H 1 1.985 0.020 . 2 . . . . 114 PRO HB3 . 19077 1 1280 . 1 1 116 116 PRO HG2 H 1 1.918 0.020 . 1 . . . . 114 PRO HG2 . 19077 1 1281 . 1 1 116 116 PRO HG3 H 1 1.918 0.020 . 1 . . . . 114 PRO HG3 . 19077 1 1282 . 1 1 116 116 PRO HD2 H 1 3.696 0.020 . 1 . . . . 114 PRO HD2 . 19077 1 1283 . 1 1 116 116 PRO HD3 H 1 3.696 0.020 . 1 . . . . 114 PRO HD3 . 19077 1 1284 . 1 1 116 116 PRO C C 13 176.820 0.3 . 1 . . . . 114 PRO C . 19077 1 1285 . 1 1 116 116 PRO CA C 13 63.286 0.3 . 1 . . . . 114 PRO CA . 19077 1 1286 . 1 1 116 116 PRO CB C 13 29.442 0.3 . 1 . . . . 114 PRO CB . 19077 1 1287 . 1 1 116 116 PRO CG C 13 27.121 0.3 . 1 . . . . 114 PRO CG . 19077 1 1288 . 1 1 116 116 PRO CD C 13 50.566 0.3 . 1 . . . . 114 PRO CD . 19077 1 1289 . 1 1 117 117 LYS H H 1 8.379 0.020 . 1 . . . . 115 LYS H . 19077 1 1290 . 1 1 117 117 LYS HA H 1 4.309 0.020 . 1 . . . . 115 LYS HA . 19077 1 1291 . 1 1 117 117 LYS HB2 H 1 1.783 0.020 . 1 . . . . 115 LYS HB2 . 19077 1 1292 . 1 1 117 117 LYS HB3 H 1 1.783 0.020 . 1 . . . . 115 LYS HB3 . 19077 1 1293 . 1 1 117 117 LYS HG2 H 1 1.473 0.020 . 1 . . . . 115 LYS HG2 . 19077 1 1294 . 1 1 117 117 LYS HG3 H 1 1.473 0.020 . 1 . . . . 115 LYS HG3 . 19077 1 1295 . 1 1 117 117 LYS HD2 H 1 1.687 0.020 . 1 . . . . 115 LYS HD2 . 19077 1 1296 . 1 1 117 117 LYS HD3 H 1 1.687 0.020 . 1 . . . . 115 LYS HD3 . 19077 1 1297 . 1 1 117 117 LYS HE2 H 1 3.009 0.020 . 1 . . . . 115 LYS HE2 . 19077 1 1298 . 1 1 117 117 LYS HE3 H 1 3.009 0.020 . 1 . . . . 115 LYS HE3 . 19077 1 1299 . 1 1 117 117 LYS C C 13 176.552 0.3 . 1 . . . . 115 LYS C . 19077 1 1300 . 1 1 117 117 LYS CA C 13 56.211 0.3 . 1 . . . . 115 LYS CA . 19077 1 1301 . 1 1 117 117 LYS CB C 13 32.802 0.3 . 1 . . . . 115 LYS CB . 19077 1 1302 . 1 1 117 117 LYS CG C 13 24.561 0.3 . 1 . . . . 115 LYS CG . 19077 1 1303 . 1 1 117 117 LYS CD C 13 28.641 0.3 . 1 . . . . 115 LYS CD . 19077 1 1304 . 1 1 117 117 LYS CE C 13 41.924 0.3 . 1 . . . . 115 LYS CE . 19077 1 1305 . 1 1 117 117 LYS N N 15 121.664 0.3 . 1 . . . . 115 LYS N . 19077 1 1306 . 1 1 118 118 ILE H H 1 8.126 0.020 . 1 . . . . 116 ILE H . 19077 1 1307 . 1 1 118 118 ILE HA H 1 4.150 0.020 . 1 . . . . 116 ILE HA . 19077 1 1308 . 1 1 118 118 ILE HB H 1 1.847 0.020 . 1 . . . . 116 ILE HB . 19077 1 1309 . 1 1 118 118 ILE HG12 H 1 1.463 0.020 . 2 . . . . 116 ILE HG12 . 19077 1 1310 . 1 1 118 118 ILE HG13 H 1 1.184 0.020 . 2 . . . . 116 ILE HG13 . 19077 1 1311 . 1 1 118 118 ILE HG21 H 1 0.872 0.020 . 1 . . . . 116 ILE HG2 . 19077 1 1312 . 1 1 118 118 ILE HG22 H 1 0.872 0.020 . 1 . . . . 116 ILE HG2 . 19077 1 1313 . 1 1 118 118 ILE HG23 H 1 0.872 0.020 . 1 . . . . 116 ILE HG2 . 19077 1 1314 . 1 1 118 118 ILE HD11 H 1 0.836 0.020 . 1 . . . . 116 ILE HD1 . 19077 1 1315 . 1 1 118 118 ILE HD12 H 1 0.836 0.020 . 1 . . . . 116 ILE HD1 . 19077 1 1316 . 1 1 118 118 ILE HD13 H 1 0.836 0.020 . 1 . . . . 116 ILE HD1 . 19077 1 1317 . 1 1 118 118 ILE C C 13 176.143 0.3 . 1 . . . . 116 ILE C . 19077 1 1318 . 1 1 118 118 ILE CA C 13 60.937 0.3 . 1 . . . . 116 ILE CA . 19077 1 1319 . 1 1 118 118 ILE CB C 13 38.704 0.3 . 1 . . . . 116 ILE CB . 19077 1 1320 . 1 1 118 118 ILE CG1 C 13 27.041 0.3 . 1 . . . . 116 ILE CG1 . 19077 1 1321 . 1 1 118 118 ILE CG2 C 13 17.279 0.3 . 1 . . . . 116 ILE CG2 . 19077 1 1322 . 1 1 118 118 ILE CD1 C 13 12.558 0.3 . 1 . . . . 116 ILE CD1 . 19077 1 1323 . 1 1 118 118 ILE N N 15 122.238 0.3 . 1 . . . . 116 ILE N . 19077 1 1324 . 1 1 119 119 GLN H H 1 8.462 0.020 . 1 . . . . 117 GLN H . 19077 1 1325 . 1 1 119 119 GLN HA H 1 4.342 0.020 . 1 . . . . 117 GLN HA . 19077 1 1326 . 1 1 119 119 GLN HB2 H 1 2.092 0.020 . 2 . . . . 117 GLN HB2 . 19077 1 1327 . 1 1 119 119 GLN HB3 H 1 1.985 0.020 . 2 . . . . 117 GLN HB3 . 19077 1 1328 . 1 1 119 119 GLN HG2 H 1 2.369 0.020 . 1 . . . . 117 GLN HG2 . 19077 1 1329 . 1 1 119 119 GLN HG3 H 1 2.369 0.020 . 1 . . . . 117 GLN HG3 . 19077 1 1330 . 1 1 119 119 GLN C C 13 175.530 0.3 . 1 . . . . 117 GLN C . 19077 1 1331 . 1 1 119 119 GLN CA C 13 55.623 0.3 . 1 . . . . 117 GLN CA . 19077 1 1332 . 1 1 119 119 GLN CB C 13 29.488 0.3 . 1 . . . . 117 GLN CB . 19077 1 1333 . 1 1 119 119 GLN CG C 13 33.602 0.3 . 1 . . . . 117 GLN CG . 19077 1 1334 . 1 1 119 119 GLN N N 15 124.790 0.3 . 1 . . . . 117 GLN N . 19077 1 1335 . 1 1 120 120 ALA H H 1 8.418 0.020 . 1 . . . . 118 ALA H . 19077 1 1336 . 1 1 120 120 ALA HA H 1 4.310 0.020 . 1 . . . . 118 ALA HA . 19077 1 1337 . 1 1 120 120 ALA HB1 H 1 1.388 0.020 . 1 . . . . 118 ALA HB . 19077 1 1338 . 1 1 120 120 ALA HB2 H 1 1.388 0.020 . 1 . . . . 118 ALA HB . 19077 1 1339 . 1 1 120 120 ALA HB3 H 1 1.388 0.020 . 1 . . . . 118 ALA HB . 19077 1 1340 . 1 1 120 120 ALA C C 13 177.307 0.3 . 1 . . . . 118 ALA C . 19077 1 1341 . 1 1 120 120 ALA CA C 13 52.600 0.3 . 1 . . . . 118 ALA CA . 19077 1 1342 . 1 1 120 120 ALA CB C 13 19.272 0.3 . 1 . . . . 118 ALA CB . 19077 1 1343 . 1 1 120 120 ALA N N 15 126.150 0.3 . 1 . . . . 118 ALA N . 19077 1 1344 . 1 1 121 121 ASP H H 1 8.355 0.020 . 1 . . . . 119 ASP H . 19077 1 1345 . 1 1 121 121 ASP HA H 1 4.577 0.020 . 1 . . . . 119 ASP HA . 19077 1 1346 . 1 1 121 121 ASP HB2 H 1 2.678 0.020 . 1 . . . . 119 ASP HB2 . 19077 1 1347 . 1 1 121 121 ASP HB3 H 1 2.678 0.020 . 1 . . . . 119 ASP HB3 . 19077 1 1348 . 1 1 121 121 ASP C C 13 176.851 0.3 . 1 . . . . 119 ASP C . 19077 1 1349 . 1 1 121 121 ASP CA C 13 54.508 0.3 . 1 . . . . 119 ASP CA . 19077 1 1350 . 1 1 121 121 ASP CB C 13 41.276 0.3 . 1 . . . . 119 ASP CB . 19077 1 1351 . 1 1 121 121 ASP N N 15 119.415 0.3 . 1 . . . . 119 ASP N . 19077 1 1352 . 1 1 122 122 GLY H H 1 8.318 0.020 . 1 . . . . 120 GLY H . 19077 1 1353 . 1 1 122 122 GLY HA2 H 1 3.979 0.020 . 1 . . . . 120 GLY HA2 . 19077 1 1354 . 1 1 122 122 GLY HA3 H 1 3.979 0.020 . 1 . . . . 120 GLY HA3 . 19077 1 1355 . 1 1 122 122 GLY C C 13 174.508 0.3 . 1 . . . . 120 GLY C . 19077 1 1356 . 1 1 122 122 GLY CA C 13 45.612 0.3 . 1 . . . . 120 GLY CA . 19077 1 1357 . 1 1 122 122 GLY N N 15 108.852 0.3 . 1 . . . . 120 GLY N . 19077 1 1358 . 1 1 123 123 VAL H H 1 7.948 0.020 . 1 . . . . 121 VAL H . 19077 1 1359 . 1 1 123 123 VAL C C 13 176.143 0.3 . 1 . . . . 121 VAL C . 19077 1 1360 . 1 1 123 123 VAL CA C 13 62.846 0.3 . 1 . . . . 121 VAL CA . 19077 1 1361 . 1 1 123 123 VAL CB C 13 32.631 0.3 . 1 . . . . 121 VAL CB . 19077 1 1362 . 1 1 123 123 VAL N N 15 119.146 0.3 . 1 . . . . 121 VAL N . 19077 1 stop_ save_