data_19758 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19758 _Entry.Title ; 1H, 15N and 13C resonance assignments of the two TPR domains of the human RPAP3 protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2014-01-30 _Entry.Accession_date 2014-01-30 _Entry.Last_release_date 2014-01-30 _Entry.Original_release_date 2014-01-30 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.1.32 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _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.ORCID _Entry_author.Entry_ID 1 Marie-Eve Chagot . . . . 19758 2 'Cl mence' Jacquemin . . . . 19758 3 Bruno Charpentier . . . . 19758 4 Xavier Manival . . . . 19758 5 Marc Quinternet . . . . 19758 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19758 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 537 19758 '15N chemical shifts' 132 19758 '1H chemical shifts' 880 19758 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 . . 2019-08-13 . original BMRB . 19758 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19758 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 24668569 _Citation.Full_citation . _Citation.Title ; (1)H, (15)N and (13)C resonance assignments of the two TPR domains from the human RPAP3 protein. ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 9 _Citation.Journal_issue 1 _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 99 _Citation.Page_last 102 _Citation.Year 2014 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Marie-Eve Chagot . . . . 19758 1 2 Clemence Jacquemin . . . . 19758 1 3 Christiane Branlant . . . . 19758 1 4 Bruno Charpentier . . . . 19758 1 5 Xavier Manival . . . . 19758 1 6 Marc Quinternet . . . . 19758 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID HSP90 19758 1 r2tp 19758 1 snoRNP 19758 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19758 _Assembly.ID 1 _Assembly.Name RPAP3 _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 TPR1 1 $rpap3(133-255) A . yes native no no . . . 19758 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_rpap3(133-255) _Entity.Sf_category entity _Entity.Sf_framecode rpap3(133-255) _Entity.Entry_ID 19758 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name rpap3(133-255) _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 ; GPHMALVLKEKGNKYFKQGK YDEAIDCYTKGMDADPYNPV LPTNRASAYFRLKKFAVAES DCNLAVALNRSYTKAYSRRG AARFALQKLEEAKKDYERVL ELEPNNFEATNELRKISQAL ASKENSY ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 127 _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 . 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 1 GLY . 19758 1 2 2 PRO . 19758 1 3 3 HIS . 19758 1 4 4 MET . 19758 1 5 5 ALA . 19758 1 6 6 LEU . 19758 1 7 7 VAL . 19758 1 8 8 LEU . 19758 1 9 9 LYS . 19758 1 10 10 GLU . 19758 1 11 11 LYS . 19758 1 12 12 GLY . 19758 1 13 13 ASN . 19758 1 14 14 LYS . 19758 1 15 15 TYR . 19758 1 16 16 PHE . 19758 1 17 17 LYS . 19758 1 18 18 GLN . 19758 1 19 19 GLY . 19758 1 20 20 LYS . 19758 1 21 21 TYR . 19758 1 22 22 ASP . 19758 1 23 23 GLU . 19758 1 24 24 ALA . 19758 1 25 25 ILE . 19758 1 26 26 ASP . 19758 1 27 27 CYS . 19758 1 28 28 TYR . 19758 1 29 29 THR . 19758 1 30 30 LYS . 19758 1 31 31 GLY . 19758 1 32 32 MET . 19758 1 33 33 ASP . 19758 1 34 34 ALA . 19758 1 35 35 ASP . 19758 1 36 36 PRO . 19758 1 37 37 TYR . 19758 1 38 38 ASN . 19758 1 39 39 PRO . 19758 1 40 40 VAL . 19758 1 41 41 LEU . 19758 1 42 42 PRO . 19758 1 43 43 THR . 19758 1 44 44 ASN . 19758 1 45 45 ARG . 19758 1 46 46 ALA . 19758 1 47 47 SER . 19758 1 48 48 ALA . 19758 1 49 49 TYR . 19758 1 50 50 PHE . 19758 1 51 51 ARG . 19758 1 52 52 LEU . 19758 1 53 53 LYS . 19758 1 54 54 LYS . 19758 1 55 55 PHE . 19758 1 56 56 ALA . 19758 1 57 57 VAL . 19758 1 58 58 ALA . 19758 1 59 59 GLU . 19758 1 60 60 SER . 19758 1 61 61 ASP . 19758 1 62 62 CYS . 19758 1 63 63 ASN . 19758 1 64 64 LEU . 19758 1 65 65 ALA . 19758 1 66 66 VAL . 19758 1 67 67 ALA . 19758 1 68 68 LEU . 19758 1 69 69 ASN . 19758 1 70 70 ARG . 19758 1 71 71 SER . 19758 1 72 72 TYR . 19758 1 73 73 THR . 19758 1 74 74 LYS . 19758 1 75 75 ALA . 19758 1 76 76 TYR . 19758 1 77 77 SER . 19758 1 78 78 ARG . 19758 1 79 79 ARG . 19758 1 80 80 GLY . 19758 1 81 81 ALA . 19758 1 82 82 ALA . 19758 1 83 83 ARG . 19758 1 84 84 PHE . 19758 1 85 85 ALA . 19758 1 86 86 LEU . 19758 1 87 87 GLN . 19758 1 88 88 LYS . 19758 1 89 89 LEU . 19758 1 90 90 GLU . 19758 1 91 91 GLU . 19758 1 92 92 ALA . 19758 1 93 93 LYS . 19758 1 94 94 LYS . 19758 1 95 95 ASP . 19758 1 96 96 TYR . 19758 1 97 97 GLU . 19758 1 98 98 ARG . 19758 1 99 99 VAL . 19758 1 100 100 LEU . 19758 1 101 101 GLU . 19758 1 102 102 LEU . 19758 1 103 103 GLU . 19758 1 104 104 PRO . 19758 1 105 105 ASN . 19758 1 106 106 ASN . 19758 1 107 107 PHE . 19758 1 108 108 GLU . 19758 1 109 109 ALA . 19758 1 110 110 THR . 19758 1 111 111 ASN . 19758 1 112 112 GLU . 19758 1 113 113 LEU . 19758 1 114 114 ARG . 19758 1 115 115 LYS . 19758 1 116 116 ILE . 19758 1 117 117 SER . 19758 1 118 118 GLN . 19758 1 119 119 ALA . 19758 1 120 120 LEU . 19758 1 121 121 ALA . 19758 1 122 122 SER . 19758 1 123 123 LYS . 19758 1 124 124 GLU . 19758 1 125 125 ASN . 19758 1 126 126 SER . 19758 1 127 127 TYR . 19758 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 19758 1 . PRO 2 2 19758 1 . HIS 3 3 19758 1 . MET 4 4 19758 1 . ALA 5 5 19758 1 . LEU 6 6 19758 1 . VAL 7 7 19758 1 . LEU 8 8 19758 1 . LYS 9 9 19758 1 . GLU 10 10 19758 1 . LYS 11 11 19758 1 . GLY 12 12 19758 1 . ASN 13 13 19758 1 . LYS 14 14 19758 1 . TYR 15 15 19758 1 . PHE 16 16 19758 1 . LYS 17 17 19758 1 . GLN 18 18 19758 1 . GLY 19 19 19758 1 . LYS 20 20 19758 1 . TYR 21 21 19758 1 . ASP 22 22 19758 1 . GLU 23 23 19758 1 . ALA 24 24 19758 1 . ILE 25 25 19758 1 . ASP 26 26 19758 1 . CYS 27 27 19758 1 . TYR 28 28 19758 1 . THR 29 29 19758 1 . LYS 30 30 19758 1 . GLY 31 31 19758 1 . MET 32 32 19758 1 . ASP 33 33 19758 1 . ALA 34 34 19758 1 . ASP 35 35 19758 1 . PRO 36 36 19758 1 . TYR 37 37 19758 1 . ASN 38 38 19758 1 . PRO 39 39 19758 1 . VAL 40 40 19758 1 . LEU 41 41 19758 1 . PRO 42 42 19758 1 . THR 43 43 19758 1 . ASN 44 44 19758 1 . ARG 45 45 19758 1 . ALA 46 46 19758 1 . SER 47 47 19758 1 . ALA 48 48 19758 1 . TYR 49 49 19758 1 . PHE 50 50 19758 1 . ARG 51 51 19758 1 . LEU 52 52 19758 1 . LYS 53 53 19758 1 . LYS 54 54 19758 1 . PHE 55 55 19758 1 . ALA 56 56 19758 1 . VAL 57 57 19758 1 . ALA 58 58 19758 1 . GLU 59 59 19758 1 . SER 60 60 19758 1 . ASP 61 61 19758 1 . CYS 62 62 19758 1 . ASN 63 63 19758 1 . LEU 64 64 19758 1 . ALA 65 65 19758 1 . VAL 66 66 19758 1 . ALA 67 67 19758 1 . LEU 68 68 19758 1 . ASN 69 69 19758 1 . ARG 70 70 19758 1 . SER 71 71 19758 1 . TYR 72 72 19758 1 . THR 73 73 19758 1 . LYS 74 74 19758 1 . ALA 75 75 19758 1 . TYR 76 76 19758 1 . SER 77 77 19758 1 . ARG 78 78 19758 1 . ARG 79 79 19758 1 . GLY 80 80 19758 1 . ALA 81 81 19758 1 . ALA 82 82 19758 1 . ARG 83 83 19758 1 . PHE 84 84 19758 1 . ALA 85 85 19758 1 . LEU 86 86 19758 1 . GLN 87 87 19758 1 . LYS 88 88 19758 1 . LEU 89 89 19758 1 . GLU 90 90 19758 1 . GLU 91 91 19758 1 . ALA 92 92 19758 1 . LYS 93 93 19758 1 . LYS 94 94 19758 1 . ASP 95 95 19758 1 . TYR 96 96 19758 1 . GLU 97 97 19758 1 . ARG 98 98 19758 1 . VAL 99 99 19758 1 . LEU 100 100 19758 1 . GLU 101 101 19758 1 . LEU 102 102 19758 1 . GLU 103 103 19758 1 . PRO 104 104 19758 1 . ASN 105 105 19758 1 . ASN 106 106 19758 1 . PHE 107 107 19758 1 . GLU 108 108 19758 1 . ALA 109 109 19758 1 . THR 110 110 19758 1 . ASN 111 111 19758 1 . GLU 112 112 19758 1 . LEU 113 113 19758 1 . ARG 114 114 19758 1 . LYS 115 115 19758 1 . ILE 116 116 19758 1 . SER 117 117 19758 1 . GLN 118 118 19758 1 . ALA 119 119 19758 1 . LEU 120 120 19758 1 . ALA 121 121 19758 1 . SER 122 122 19758 1 . LYS 123 123 19758 1 . GLU 124 124 19758 1 . ASN 125 125 19758 1 . SER 126 126 19758 1 . TYR 127 127 19758 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 19758 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $rpap3(133-255) . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 19758 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 19758 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $rpap3(133-255) . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pnEA-3CH . . . 19758 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19758 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% 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 rpap3(133-255) '[U-99% 13C; U-99% 15N]' . . 1 $rpap3(133-255) . . 1.0 . . mM . . . . 19758 1 2 'sodium chloride' 'natural abundance' . . . . . . 150 . . mM . . . . 19758 1 3 DTT '[U-99% 2H]' . . . . . . 10 . . mM . . . . 19758 1 4 H2O 'natural abundance' . . . . . . 95 . . % . . . . 19758 1 5 D2O '[U-100% 2H]' . . . . . . 5 . . % . . . . 19758 1 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 19758 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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' 150 . mM 19758 1 pH 6.4 . pH 19758 1 pressure 1 . atm 19758 1 temperature 303 . K 19758 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 19758 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 19758 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . collection 19758 1 . processing 19758 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 19758 _Software.ID 2 _Software.Type . _Software.Name CARA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 19758 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 19758 2 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 19758 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _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 19758 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 19758 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 19758 _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 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19758 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19758 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19758 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19758 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19758 1 6 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19758 1 7 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19758 1 8 '3D HNHA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19758 1 9 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19758 1 10 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19758 1 11 '3D HCCH-COSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19758 1 12 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19758 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 19758 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 'separate tube (no insert) not similar to the experimental sample tube' . . . . 19758 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 'separate tube (no insert) not similar to the experimental sample tube' . . . . 19758 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 'separate tube (no insert) not similar to the experimental sample tube' . . . . 19758 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 19758 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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' . . . 19758 1 2 '2D 1H-13C HSQC' . . . 19758 1 3 '3D CBCA(CO)NH' . . . 19758 1 4 '3D HNCO' . . . 19758 1 5 '3D HNCA' . . . 19758 1 6 '3D HNCACB' . . . 19758 1 7 '3D HCCH-TOCSY' . . . 19758 1 8 '3D HNHA' . . . 19758 1 9 '3D 1H-15N NOESY' . . . 19758 1 10 '3D 1H-13C NOESY aliphatic' . . . 19758 1 11 '3D HCCH-COSY' . . . 19758 1 12 '3D 1H-13C NOESY aromatic' . . . 19758 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $TOPSPIN . . 19758 1 2 $CARA . . 19758 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.Ambiguity_set_ID _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 PRO HA H 1 4.455 0.020 . 1 . . . . . 2 PRO HA . 19758 1 2 . 1 1 2 2 PRO HB2 H 1 1.974 0.020 . 1 . . . . . 2 PRO HB2 . 19758 1 3 . 1 1 2 2 PRO HB3 H 1 2.431 0.020 . 1 . . . . . 2 PRO HB3 . 19758 1 4 . 1 1 2 2 PRO HG2 H 1 2.098 0.020 . 2 . . . . . 2 PRO QG . 19758 1 5 . 1 1 2 2 PRO HG3 H 1 2.098 0.020 . 2 . . . . . 2 PRO QG . 19758 1 6 . 1 1 2 2 PRO HD2 H 1 3.709 0.020 . 2 . . . . . 2 PRO QD . 19758 1 7 . 1 1 2 2 PRO HD3 H 1 3.709 0.020 . 2 . . . . . 2 PRO QD . 19758 1 8 . 1 1 2 2 PRO CA C 13 64.095 0.300 . 1 . . . . . 2 PRO CA . 19758 1 9 . 1 1 2 2 PRO CB C 13 32.480 0.300 . 1 . . . . . 2 PRO CB . 19758 1 10 . 1 1 2 2 PRO CG C 13 27.277 0.300 . 1 . . . . . 2 PRO CG . 19758 1 11 . 1 1 2 2 PRO CD C 13 49.980 0.300 . 1 . . . . . 2 PRO CD . 19758 1 12 . 1 1 3 3 HIS HA H 1 4.465 0.020 . 1 . . . . . 3 HIS HA . 19758 1 13 . 1 1 3 3 HIS HB2 H 1 3.229 0.020 . 1 . . . . . 3 HIS HB2 . 19758 1 14 . 1 1 3 3 HIS HB3 H 1 3.315 0.020 . 1 . . . . . 3 HIS HB3 . 19758 1 15 . 1 1 3 3 HIS HD2 H 1 7.170 0.020 . 1 . . . . . 3 HIS HD2 . 19758 1 16 . 1 1 3 3 HIS HE1 H 1 8.031 0.020 . 1 . . . . . 3 HIS HE1 . 19758 1 17 . 1 1 3 3 HIS C C 13 177.229 0.300 . 1 . . . . . 3 HIS C . 19758 1 18 . 1 1 3 3 HIS CA C 13 59.068 0.300 . 1 . . . . . 3 HIS CA . 19758 1 19 . 1 1 3 3 HIS CB C 13 29.867 0.300 . 1 . . . . . 3 HIS CB . 19758 1 20 . 1 1 3 3 HIS CD2 C 13 119.404 0.300 . 1 . . . . . 3 HIS CD2 . 19758 1 21 . 1 1 3 3 HIS CE1 C 13 137.957 0.300 . 1 . . . . . 3 HIS CE1 . 19758 1 22 . 1 1 4 4 MET H H 1 8.454 0.020 . 1 . . . . . 4 MET H . 19758 1 23 . 1 1 4 4 MET HA H 1 4.322 0.020 . 1 . . . . . 4 MET HA . 19758 1 24 . 1 1 4 4 MET HB2 H 1 2.033 0.020 . 1 . . . . . 4 MET HB2 . 19758 1 25 . 1 1 4 4 MET HB3 H 1 2.205 0.020 . 1 . . . . . 4 MET HB3 . 19758 1 26 . 1 1 4 4 MET HG2 H 1 2.638 0.020 . 2 . . . . . 4 MET QG . 19758 1 27 . 1 1 4 4 MET HG3 H 1 2.638 0.020 . 2 . . . . . 4 MET QG . 19758 1 28 . 1 1 4 4 MET HE1 H 1 2.123 0.020 . 1 . . . . . 4 MET HE . 19758 1 29 . 1 1 4 4 MET HE2 H 1 2.123 0.020 . 1 . . . . . 4 MET HE . 19758 1 30 . 1 1 4 4 MET HE3 H 1 2.123 0.020 . 1 . . . . . 4 MET HE . 19758 1 31 . 1 1 4 4 MET C C 13 178.216 0.300 . 1 . . . . . 4 MET C . 19758 1 32 . 1 1 4 4 MET CA C 13 57.309 0.300 . 1 . . . . . 4 MET CA . 19758 1 33 . 1 1 4 4 MET CB C 13 31.975 0.300 . 1 . . . . . 4 MET CB . 19758 1 34 . 1 1 4 4 MET CG C 13 31.975 0.300 . 1 . . . . . 4 MET CG . 19758 1 35 . 1 1 4 4 MET CE C 13 16.631 0.300 . 1 . . . . . 4 MET CE . 19758 1 36 . 1 1 4 4 MET N N 15 120.001 0.300 . 1 . . . . . 4 MET N . 19758 1 37 . 1 1 5 5 ALA H H 1 8.272 0.020 . 1 . . . . . 5 ALA H . 19758 1 38 . 1 1 5 5 ALA HA H 1 4.055 0.020 . 1 . . . . . 5 ALA HA . 19758 1 39 . 1 1 5 5 ALA HB1 H 1 1.615 0.020 . 1 . . . . . 5 ALA HB . 19758 1 40 . 1 1 5 5 ALA HB2 H 1 1.615 0.020 . 1 . . . . . 5 ALA HB . 19758 1 41 . 1 1 5 5 ALA HB3 H 1 1.615 0.020 . 1 . . . . . 5 ALA HB . 19758 1 42 . 1 1 5 5 ALA C C 13 179.196 0.300 . 1 . . . . . 5 ALA C . 19758 1 43 . 1 1 5 5 ALA CA C 13 55.656 0.300 . 1 . . . . . 5 ALA CA . 19758 1 44 . 1 1 5 5 ALA CB C 13 20.121 0.300 . 1 . . . . . 5 ALA CB . 19758 1 45 . 1 1 5 5 ALA N N 15 120.119 0.300 . 1 . . . . . 5 ALA N . 19758 1 46 . 1 1 6 6 LEU H H 1 7.614 0.020 . 1 . . . . . 6 LEU H . 19758 1 47 . 1 1 6 6 LEU HA H 1 4.144 0.020 . 1 . . . . . 6 LEU HA . 19758 1 48 . 1 1 6 6 LEU HB2 H 1 1.776 0.020 . 1 . . . . . 6 LEU HB2 . 19758 1 49 . 1 1 6 6 LEU HB3 H 1 1.886 0.020 . 1 . . . . . 6 LEU HB3 . 19758 1 50 . 1 1 6 6 LEU HG H 1 1.771 0.020 . 1 . . . . . 6 LEU HG . 19758 1 51 . 1 1 6 6 LEU HD11 H 1 0.903 0.020 . 2 . . . . . 6 LEU QD1 . 19758 1 52 . 1 1 6 6 LEU HD12 H 1 0.903 0.020 . 2 . . . . . 6 LEU QD1 . 19758 1 53 . 1 1 6 6 LEU HD13 H 1 0.903 0.020 . 2 . . . . . 6 LEU QD1 . 19758 1 54 . 1 1 6 6 LEU HD21 H 1 0.997 0.020 . 2 . . . . . 6 LEU QD2 . 19758 1 55 . 1 1 6 6 LEU HD22 H 1 0.997 0.020 . 2 . . . . . 6 LEU QD2 . 19758 1 56 . 1 1 6 6 LEU HD23 H 1 0.997 0.020 . 2 . . . . . 6 LEU QD2 . 19758 1 57 . 1 1 6 6 LEU C C 13 179.340 0.300 . 1 . . . . . 6 LEU C . 19758 1 58 . 1 1 6 6 LEU CA C 13 57.993 0.300 . 1 . . . . . 6 LEU CA . 19758 1 59 . 1 1 6 6 LEU CB C 13 41.246 0.300 . 1 . . . . . 6 LEU CB . 19758 1 60 . 1 1 6 6 LEU CG C 13 26.950 0.300 . 1 . . . . . 6 LEU CG . 19758 1 61 . 1 1 6 6 LEU CD1 C 13 23.807 0.300 . 1 . . . . . 6 LEU CD1 . 19758 1 62 . 1 1 6 6 LEU CD2 C 13 24.656 0.300 . 1 . . . . . 6 LEU CD2 . 19758 1 63 . 1 1 6 6 LEU N N 15 118.447 0.300 . 1 . . . . . 6 LEU N . 19758 1 64 . 1 1 7 7 VAL H H 1 7.657 0.020 . 1 . . . . . 7 VAL H . 19758 1 65 . 1 1 7 7 VAL HA H 1 3.682 0.020 . 1 . . . . . 7 VAL HA . 19758 1 66 . 1 1 7 7 VAL HB H 1 2.242 0.020 . 1 . . . . . 7 VAL HB . 19758 1 67 . 1 1 7 7 VAL HG11 H 1 0.942 0.020 . 2 . . . . . 7 VAL QG1 . 19758 1 68 . 1 1 7 7 VAL HG12 H 1 0.942 0.020 . 2 . . . . . 7 VAL QG1 . 19758 1 69 . 1 1 7 7 VAL HG13 H 1 0.942 0.020 . 2 . . . . . 7 VAL QG1 . 19758 1 70 . 1 1 7 7 VAL HG21 H 1 0.970 0.020 . 2 . . . . . 7 VAL QG2 . 19758 1 71 . 1 1 7 7 VAL HG22 H 1 0.970 0.020 . 2 . . . . . 7 VAL QG2 . 19758 1 72 . 1 1 7 7 VAL HG23 H 1 0.970 0.020 . 2 . . . . . 7 VAL QG2 . 19758 1 73 . 1 1 7 7 VAL C C 13 179.705 0.300 . 1 . . . . . 7 VAL C . 19758 1 74 . 1 1 7 7 VAL CA C 13 66.200 0.300 . 1 . . . . . 7 VAL CA . 19758 1 75 . 1 1 7 7 VAL CB C 13 31.875 0.300 . 1 . . . . . 7 VAL CB . 19758 1 76 . 1 1 7 7 VAL CG1 C 13 20.945 0.300 . 1 . . . . . 7 VAL CG1 . 19758 1 77 . 1 1 7 7 VAL CG2 C 13 22.133 0.300 . 1 . . . . . 7 VAL CG2 . 19758 1 78 . 1 1 7 7 VAL N N 15 120.789 0.300 . 1 . . . . . 7 VAL N . 19758 1 79 . 1 1 8 8 LEU H H 1 8.139 0.020 . 1 . . . . . 8 LEU H . 19758 1 80 . 1 1 8 8 LEU HA H 1 4.013 0.020 . 1 . . . . . 8 LEU HA . 19758 1 81 . 1 1 8 8 LEU HB2 H 1 1.637 0.020 . 1 . . . . . 8 LEU HB2 . 19758 1 82 . 1 1 8 8 LEU HB3 H 1 1.765 0.020 . 1 . . . . . 8 LEU HB3 . 19758 1 83 . 1 1 8 8 LEU HG H 1 1.595 0.020 . 1 . . . . . 8 LEU HG . 19758 1 84 . 1 1 8 8 LEU HD11 H 1 0.972 0.020 . 2 . . . . . 8 LEU QD1 . 19758 1 85 . 1 1 8 8 LEU HD12 H 1 0.972 0.020 . 2 . . . . . 8 LEU QD1 . 19758 1 86 . 1 1 8 8 LEU HD13 H 1 0.972 0.020 . 2 . . . . . 8 LEU QD1 . 19758 1 87 . 1 1 8 8 LEU HD21 H 1 0.788 0.020 . 2 . . . . . 8 LEU QD2 . 19758 1 88 . 1 1 8 8 LEU HD22 H 1 0.788 0.020 . 2 . . . . . 8 LEU QD2 . 19758 1 89 . 1 1 8 8 LEU HD23 H 1 0.788 0.020 . 2 . . . . . 8 LEU QD2 . 19758 1 90 . 1 1 8 8 LEU C C 13 179.135 0.300 . 1 . . . . . 8 LEU C . 19758 1 91 . 1 1 8 8 LEU CA C 13 58.184 0.300 . 1 . . . . . 8 LEU CA . 19758 1 92 . 1 1 8 8 LEU CB C 13 40.901 0.300 . 1 . . . . . 8 LEU CB . 19758 1 93 . 1 1 8 8 LEU CG C 13 27.760 0.300 . 1 . . . . . 8 LEU CG . 19758 1 94 . 1 1 8 8 LEU CD1 C 13 22.738 0.300 . 1 . . . . . 8 LEU CD1 . 19758 1 95 . 1 1 8 8 LEU CD2 C 13 25.087 0.300 . 1 . . . . . 8 LEU CD2 . 19758 1 96 . 1 1 8 8 LEU N N 15 120.886 0.300 . 1 . . . . . 8 LEU N . 19758 1 97 . 1 1 9 9 LYS H H 1 8.410 0.020 . 1 . . . . . 9 LYS H . 19758 1 98 . 1 1 9 9 LYS HA H 1 3.877 0.020 . 1 . . . . . 9 LYS HA . 19758 1 99 . 1 1 9 9 LYS HB2 H 1 1.591 0.020 . 2 . . . . . 9 LYS QB . 19758 1 100 . 1 1 9 9 LYS HB3 H 1 1.591 0.020 . 2 . . . . . 9 LYS QB . 19758 1 101 . 1 1 9 9 LYS HG2 H 1 1.418 0.020 . 2 . . . . . 9 LYS QG . 19758 1 102 . 1 1 9 9 LYS HG3 H 1 1.418 0.020 . 2 . . . . . 9 LYS QG . 19758 1 103 . 1 1 9 9 LYS HD2 H 1 2.016 0.020 . 2 . . . . . 9 LYS QD . 19758 1 104 . 1 1 9 9 LYS HD3 H 1 2.016 0.020 . 2 . . . . . 9 LYS QD . 19758 1 105 . 1 1 9 9 LYS HE2 H 1 2.855 0.020 . 1 . . . . . 9 LYS HE2 . 19758 1 106 . 1 1 9 9 LYS HE3 H 1 3.040 0.020 . 1 . . . . . 9 LYS HE3 . 19758 1 107 . 1 1 9 9 LYS C C 13 177.910 0.300 . 1 . . . . . 9 LYS C . 19758 1 108 . 1 1 9 9 LYS CA C 13 60.610 0.300 . 1 . . . . . 9 LYS CA . 19758 1 109 . 1 1 9 9 LYS CB C 13 29.273 0.300 . 1 . . . . . 9 LYS CB . 19758 1 110 . 1 1 9 9 LYS CG C 13 24.373 0.300 . 1 . . . . . 9 LYS CG . 19758 1 111 . 1 1 9 9 LYS CD C 13 31.125 0.300 . 1 . . . . . 9 LYS CD . 19758 1 112 . 1 1 9 9 LYS CE C 13 41.742 0.300 . 1 . . . . . 9 LYS CE . 19758 1 113 . 1 1 9 9 LYS N N 15 120.934 0.300 . 1 . . . . . 9 LYS N . 19758 1 114 . 1 1 10 10 GLU H H 1 8.179 0.020 . 1 . . . . . 10 GLU H . 19758 1 115 . 1 1 10 10 GLU HA H 1 4.099 0.020 . 1 . . . . . 10 GLU HA . 19758 1 116 . 1 1 10 10 GLU HB2 H 1 2.127 0.020 . 2 . . . . . 10 GLU QB . 19758 1 117 . 1 1 10 10 GLU HB3 H 1 2.127 0.020 . 2 . . . . . 10 GLU QB . 19758 1 118 . 1 1 10 10 GLU HG2 H 1 2.336 0.020 . 1 . . . . . 10 GLU HG2 . 19758 1 119 . 1 1 10 10 GLU HG3 H 1 2.467 0.020 . 1 . . . . . 10 GLU HG3 . 19758 1 120 . 1 1 10 10 GLU C C 13 179.595 0.300 . 1 . . . . . 10 GLU C . 19758 1 121 . 1 1 10 10 GLU CA C 13 59.556 0.300 . 1 . . . . . 10 GLU CA . 19758 1 122 . 1 1 10 10 GLU CB C 13 29.067 0.300 . 1 . . . . . 10 GLU CB . 19758 1 123 . 1 1 10 10 GLU CG C 13 36.431 0.300 . 1 . . . . . 10 GLU CG . 19758 1 124 . 1 1 10 10 GLU N N 15 118.181 0.300 . 1 . . . . . 10 GLU N . 19758 1 125 . 1 1 11 11 LYS H H 1 8.298 0.020 . 1 . . . . . 11 LYS H . 19758 1 126 . 1 1 11 11 LYS HA H 1 3.889 0.020 . 1 . . . . . 11 LYS HA . 19758 1 127 . 1 1 11 11 LYS HB2 H 1 1.900 0.020 . 2 . . . . . 11 LYS QB . 19758 1 128 . 1 1 11 11 LYS HB3 H 1 1.900 0.020 . 2 . . . . . 11 LYS QB . 19758 1 129 . 1 1 11 11 LYS HG2 H 1 1.470 0.020 . 2 . . . . . 11 LYS QG . 19758 1 130 . 1 1 11 11 LYS HG3 H 1 1.470 0.020 . 2 . . . . . 11 LYS QG . 19758 1 131 . 1 1 11 11 LYS HD2 H 1 1.627 0.020 . 1 . . . . . 11 LYS HD2 . 19758 1 132 . 1 1 11 11 LYS HD3 H 1 1.678 0.020 . 1 . . . . . 11 LYS HD3 . 19758 1 133 . 1 1 11 11 LYS HE2 H 1 2.928 0.020 . 2 . . . . . 11 LYS QE . 19758 1 134 . 1 1 11 11 LYS HE3 H 1 2.928 0.020 . 2 . . . . . 11 LYS QE . 19758 1 135 . 1 1 11 11 LYS C C 13 179.127 0.300 . 1 . . . . . 11 LYS C . 19758 1 136 . 1 1 11 11 LYS CA C 13 59.735 0.300 . 1 . . . . . 11 LYS CA . 19758 1 137 . 1 1 11 11 LYS CB C 13 33.271 0.300 . 1 . . . . . 11 LYS CB . 19758 1 138 . 1 1 11 11 LYS CG C 13 25.610 0.300 . 1 . . . . . 11 LYS CG . 19758 1 139 . 1 1 11 11 LYS CD C 13 29.682 0.300 . 1 . . . . . 11 LYS CD . 19758 1 140 . 1 1 11 11 LYS CE C 13 42.013 0.300 . 1 . . . . . 11 LYS CE . 19758 1 141 . 1 1 11 11 LYS N N 15 121.573 0.300 . 1 . . . . . 11 LYS N . 19758 1 142 . 1 1 12 12 GLY H H 1 8.712 0.020 . 1 . . . . . 12 GLY H . 19758 1 143 . 1 1 12 12 GLY HA2 H 1 3.268 0.020 . 1 . . . . . 12 GLY HA2 . 19758 1 144 . 1 1 12 12 GLY HA3 H 1 3.653 0.020 . 1 . . . . . 12 GLY HA3 . 19758 1 145 . 1 1 12 12 GLY C C 13 174.834 0.300 . 1 . . . . . 12 GLY C . 19758 1 146 . 1 1 12 12 GLY CA C 13 47.990 0.300 . 1 . . . . . 12 GLY CA . 19758 1 147 . 1 1 12 12 GLY N N 15 106.756 0.300 . 1 . . . . . 12 GLY N . 19758 1 148 . 1 1 13 13 ASN H H 1 8.959 0.020 . 1 . . . . . 13 ASN H . 19758 1 149 . 1 1 13 13 ASN HA H 1 4.551 0.020 . 1 . . . . . 13 ASN HA . 19758 1 150 . 1 1 13 13 ASN HB2 H 1 2.976 0.020 . 1 . . . . . 13 ASN HB2 . 19758 1 151 . 1 1 13 13 ASN HB3 H 1 3.197 0.020 . 1 . . . . . 13 ASN HB3 . 19758 1 152 . 1 1 13 13 ASN HD21 H 1 6.986 0.020 . 1 . . . . . 13 ASN HD21 . 19758 1 153 . 1 1 13 13 ASN HD22 H 1 7.824 0.020 . 1 . . . . . 13 ASN HD22 . 19758 1 154 . 1 1 13 13 ASN C C 13 177.835 0.300 . 1 . . . . . 13 ASN C . 19758 1 155 . 1 1 13 13 ASN CA C 13 55.421 0.300 . 1 . . . . . 13 ASN CA . 19758 1 156 . 1 1 13 13 ASN CB C 13 37.158 0.300 . 1 . . . . . 13 ASN CB . 19758 1 157 . 1 1 13 13 ASN N N 15 121.028 0.300 . 1 . . . . . 13 ASN N . 19758 1 158 . 1 1 13 13 ASN ND2 N 15 110.661 0.300 . 1 . . . . . 13 ASN ND2 . 19758 1 159 . 1 1 14 14 LYS H H 1 7.984 0.020 . 1 . . . . . 14 LYS H . 19758 1 160 . 1 1 14 14 LYS HA H 1 4.062 0.020 . 1 . . . . . 14 LYS HA . 19758 1 161 . 1 1 14 14 LYS HB2 H 1 1.816 0.020 . 2 . . . . . 14 LYS QB . 19758 1 162 . 1 1 14 14 LYS HB3 H 1 1.816 0.020 . 2 . . . . . 14 LYS QB . 19758 1 163 . 1 1 14 14 LYS HG2 H 1 1.242 0.020 . 1 . . . . . 14 LYS HG2 . 19758 1 164 . 1 1 14 14 LYS HG3 H 1 1.499 0.020 . 1 . . . . . 14 LYS HG3 . 19758 1 165 . 1 1 14 14 LYS HD2 H 1 1.566 0.020 . 1 . . . . . 14 LYS HD2 . 19758 1 166 . 1 1 14 14 LYS HD3 H 1 1.850 0.020 . 1 . . . . . 14 LYS HD3 . 19758 1 167 . 1 1 14 14 LYS HE2 H 1 2.851 0.020 . 2 . . . . . 14 LYS QE . 19758 1 168 . 1 1 14 14 LYS HE3 H 1 2.851 0.020 . 2 . . . . . 14 LYS QE . 19758 1 169 . 1 1 14 14 LYS C C 13 179.663 0.300 . 1 . . . . . 14 LYS C . 19758 1 170 . 1 1 14 14 LYS CA C 13 60.096 0.300 . 1 . . . . . 14 LYS CA . 19758 1 171 . 1 1 14 14 LYS CB C 13 31.496 0.300 . 1 . . . . . 14 LYS CB . 19758 1 172 . 1 1 14 14 LYS CG C 13 25.173 0.300 . 1 . . . . . 14 LYS CG . 19758 1 173 . 1 1 14 14 LYS CD C 13 29.162 0.300 . 1 . . . . . 14 LYS CD . 19758 1 174 . 1 1 14 14 LYS CE C 13 42.134 0.300 . 1 . . . . . 14 LYS CE . 19758 1 175 . 1 1 14 14 LYS N N 15 123.022 0.300 . 1 . . . . . 14 LYS N . 19758 1 176 . 1 1 15 15 TYR H H 1 7.797 0.020 . 1 . . . . . 15 TYR H . 19758 1 177 . 1 1 15 15 TYR HA H 1 4.409 0.020 . 1 . . . . . 15 TYR HA . 19758 1 178 . 1 1 15 15 TYR HB2 H 1 2.801 0.020 . 1 . . . . . 15 TYR HB2 . 19758 1 179 . 1 1 15 15 TYR HB3 H 1 3.604 0.020 . 1 . . . . . 15 TYR HB3 . 19758 1 180 . 1 1 15 15 TYR HD1 H 1 6.997 0.020 . 1 . . . . . 15 TYR QD . 19758 1 181 . 1 1 15 15 TYR HD2 H 1 6.997 0.020 . 1 . . . . . 15 TYR QD . 19758 1 182 . 1 1 15 15 TYR HE1 H 1 6.694 0.020 . 1 . . . . . 15 TYR QE . 19758 1 183 . 1 1 15 15 TYR HE2 H 1 6.694 0.020 . 1 . . . . . 15 TYR QE . 19758 1 184 . 1 1 15 15 TYR C C 13 178.788 0.300 . 1 . . . . . 15 TYR C . 19758 1 185 . 1 1 15 15 TYR CA C 13 60.904 0.300 . 1 . . . . . 15 TYR CA . 19758 1 186 . 1 1 15 15 TYR CB C 13 36.966 0.300 . 1 . . . . . 15 TYR CB . 19758 1 187 . 1 1 15 15 TYR CD1 C 13 132.699 0.300 . 1 . . . . . 15 TYR CD1 . 19758 1 188 . 1 1 15 15 TYR CE1 C 13 118.400 0.300 . 1 . . . . . 15 TYR CE1 . 19758 1 189 . 1 1 15 15 TYR N N 15 118.514 0.300 . 1 . . . . . 15 TYR N . 19758 1 190 . 1 1 16 16 PHE H H 1 9.325 0.020 . 1 . . . . . 16 PHE H . 19758 1 191 . 1 1 16 16 PHE HA H 1 3.664 0.020 . 1 . . . . . 16 PHE HA . 19758 1 192 . 1 1 16 16 PHE HB2 H 1 3.316 0.020 . 2 . . . . . 16 PHE QB . 19758 1 193 . 1 1 16 16 PHE HB3 H 1 3.316 0.020 . 2 . . . . . 16 PHE QB . 19758 1 194 . 1 1 16 16 PHE C C 13 179.285 0.300 . 1 . . . . . 16 PHE C . 19758 1 195 . 1 1 16 16 PHE CA C 13 62.369 0.300 . 1 . . . . . 16 PHE CA . 19758 1 196 . 1 1 16 16 PHE CB C 13 40.133 0.300 . 1 . . . . . 16 PHE CB . 19758 1 197 . 1 1 16 16 PHE N N 15 122.316 0.300 . 1 . . . . . 16 PHE N . 19758 1 198 . 1 1 17 17 LYS H H 1 8.375 0.020 . 1 . . . . . 17 LYS H . 19758 1 199 . 1 1 17 17 LYS HA H 1 4.141 0.020 . 1 . . . . . 17 LYS HA . 19758 1 200 . 1 1 17 17 LYS HB2 H 1 2.098 0.020 . 2 . . . . . 17 LYS QB . 19758 1 201 . 1 1 17 17 LYS HB3 H 1 2.098 0.020 . 2 . . . . . 17 LYS QB . 19758 1 202 . 1 1 17 17 LYS HG2 H 1 1.682 0.020 . 1 . . . . . 17 LYS HG2 . 19758 1 203 . 1 1 17 17 LYS HG3 H 1 1.796 0.020 . 1 . . . . . 17 LYS HG3 . 19758 1 204 . 1 1 17 17 LYS HD2 H 1 1.675 0.020 . 1 . . . . . 17 LYS HD2 . 19758 1 205 . 1 1 17 17 LYS HD3 H 1 1.807 0.020 . 1 . . . . . 17 LYS HD3 . 19758 1 206 . 1 1 17 17 LYS HE2 H 1 2.978 0.020 . 1 . . . . . 17 LYS HE2 . 19758 1 207 . 1 1 17 17 LYS HE3 H 1 3.054 0.020 . 1 . . . . . 17 LYS HE3 . 19758 1 208 . 1 1 17 17 LYS C C 13 177.639 0.300 . 1 . . . . . 17 LYS C . 19758 1 209 . 1 1 17 17 LYS CA C 13 59.304 0.300 . 1 . . . . . 17 LYS CA . 19758 1 210 . 1 1 17 17 LYS CB C 13 32.532 0.300 . 1 . . . . . 17 LYS CB . 19758 1 211 . 1 1 17 17 LYS CG C 13 25.629 0.300 . 1 . . . . . 17 LYS CG . 19758 1 212 . 1 1 17 17 LYS CD C 13 29.298 0.300 . 1 . . . . . 17 LYS CD . 19758 1 213 . 1 1 17 17 LYS CE C 13 42.309 0.300 . 1 . . . . . 17 LYS CE . 19758 1 214 . 1 1 17 17 LYS N N 15 120.497 0.300 . 1 . . . . . 17 LYS N . 19758 1 215 . 1 1 18 18 GLN H H 1 7.369 0.020 . 1 . . . . . 18 GLN H . 19758 1 216 . 1 1 18 18 GLN HA H 1 4.350 0.020 . 1 . . . . . 18 GLN HA . 19758 1 217 . 1 1 18 18 GLN HB2 H 1 2.168 0.020 . 1 . . . . . 18 GLN HB2 . 19758 1 218 . 1 1 18 18 GLN HB3 H 1 2.252 0.020 . 1 . . . . . 18 GLN HB3 . 19758 1 219 . 1 1 18 18 GLN HG2 H 1 2.450 0.020 . 1 . . . . . 18 GLN HG2 . 19758 1 220 . 1 1 18 18 GLN HG3 H 1 2.617 0.020 . 1 . . . . . 18 GLN HG3 . 19758 1 221 . 1 1 18 18 GLN HE21 H 1 6.693 0.020 . 1 . . . . . 18 GLN HE21 . 19758 1 222 . 1 1 18 18 GLN HE22 H 1 7.208 0.020 . 1 . . . . . 18 GLN HE22 . 19758 1 223 . 1 1 18 18 GLN C C 13 176.026 0.300 . 1 . . . . . 18 GLN C . 19758 1 224 . 1 1 18 18 GLN CA C 13 55.608 0.300 . 1 . . . . . 18 GLN CA . 19758 1 225 . 1 1 18 18 GLN CB C 13 29.768 0.300 . 1 . . . . . 18 GLN CB . 19758 1 226 . 1 1 18 18 GLN CG C 13 34.137 0.300 . 1 . . . . . 18 GLN CG . 19758 1 227 . 1 1 18 18 GLN N N 15 115.173 0.300 . 1 . . . . . 18 GLN N . 19758 1 228 . 1 1 18 18 GLN NE2 N 15 109.960 0.300 . 1 . . . . . 18 GLN NE2 . 19758 1 229 . 1 1 19 19 GLY H H 1 7.729 0.020 . 1 . . . . . 19 GLY H . 19758 1 230 . 1 1 19 19 GLY HA2 H 1 2.783 0.020 . 1 . . . . . 19 GLY HA2 . 19758 1 231 . 1 1 19 19 GLY HA3 H 1 3.822 0.020 . 1 . . . . . 19 GLY HA3 . 19758 1 232 . 1 1 19 19 GLY C C 13 173.612 0.300 . 1 . . . . . 19 GLY C . 19758 1 233 . 1 1 19 19 GLY CA C 13 44.668 0.300 . 1 . . . . . 19 GLY CA . 19758 1 234 . 1 1 19 19 GLY N N 15 107.940 0.300 . 1 . . . . . 19 GLY N . 19758 1 235 . 1 1 20 20 LYS H H 1 7.729 0.020 . 1 . . . . . 20 LYS H . 19758 1 236 . 1 1 20 20 LYS HA H 1 4.338 0.020 . 1 . . . . . 20 LYS HA . 19758 1 237 . 1 1 20 20 LYS HB2 H 1 1.652 0.020 . 1 . . . . . 20 LYS HB2 . 19758 1 238 . 1 1 20 20 LYS HB3 H 1 1.859 0.020 . 1 . . . . . 20 LYS HB3 . 19758 1 239 . 1 1 20 20 LYS HG2 H 1 1.221 0.020 . 1 . . . . . 20 LYS HG2 . 19758 1 240 . 1 1 20 20 LYS HG3 H 1 1.301 0.020 . 1 . . . . . 20 LYS HG3 . 19758 1 241 . 1 1 20 20 LYS HD2 H 1 1.616 0.020 . 2 . . . . . 20 LYS QD . 19758 1 242 . 1 1 20 20 LYS HD3 H 1 1.616 0.020 . 2 . . . . . 20 LYS QD . 19758 1 243 . 1 1 20 20 LYS HE2 H 1 2.940 0.020 . 2 . . . . . 20 LYS QE . 19758 1 244 . 1 1 20 20 LYS HE3 H 1 2.940 0.020 . 2 . . . . . 20 LYS QE . 19758 1 245 . 1 1 20 20 LYS C C 13 176.320 0.300 . 1 . . . . . 20 LYS C . 19758 1 246 . 1 1 20 20 LYS CA C 13 53.664 0.300 . 1 . . . . . 20 LYS CA . 19758 1 247 . 1 1 20 20 LYS CB C 13 30.008 0.300 . 1 . . . . . 20 LYS CB . 19758 1 248 . 1 1 20 20 LYS CG C 13 24.610 0.300 . 1 . . . . . 20 LYS CG . 19758 1 249 . 1 1 20 20 LYS CD C 13 29.527 0.300 . 1 . . . . . 20 LYS CD . 19758 1 250 . 1 1 20 20 LYS CE C 13 42.403 0.300 . 1 . . . . . 20 LYS CE . 19758 1 251 . 1 1 20 20 LYS N N 15 122.431 0.300 . 1 . . . . . 20 LYS N . 19758 1 252 . 1 1 21 21 TYR H H 1 6.851 0.020 . 1 . . . . . 21 TYR H . 19758 1 253 . 1 1 21 21 TYR HA H 1 4.010 0.020 . 1 . . . . . 21 TYR HA . 19758 1 254 . 1 1 21 21 TYR HB2 H 1 2.744 0.020 . 1 . . . . . 21 TYR HB2 . 19758 1 255 . 1 1 21 21 TYR HB3 H 1 2.973 0.020 . 1 . . . . . 21 TYR HB3 . 19758 1 256 . 1 1 21 21 TYR HD1 H 1 6.876 0.020 . 1 . . . . . 21 TYR QD . 19758 1 257 . 1 1 21 21 TYR HD2 H 1 6.876 0.020 . 1 . . . . . 21 TYR QD . 19758 1 258 . 1 1 21 21 TYR HE1 H 1 6.278 0.020 . 1 . . . . . 21 TYR QE . 19758 1 259 . 1 1 21 21 TYR HE2 H 1 6.278 0.020 . 1 . . . . . 21 TYR QE . 19758 1 260 . 1 1 21 21 TYR C C 13 177.395 0.300 . 1 . . . . . 21 TYR C . 19758 1 261 . 1 1 21 21 TYR CA C 13 61.944 0.300 . 1 . . . . . 21 TYR CA . 19758 1 262 . 1 1 21 21 TYR CB C 13 37.494 0.300 . 1 . . . . . 21 TYR CB . 19758 1 263 . 1 1 21 21 TYR CD1 C 13 131.720 0.300 . 1 . . . . . 21 TYR CD1 . 19758 1 264 . 1 1 21 21 TYR CE1 C 13 119.280 0.300 . 1 . . . . . 21 TYR CE1 . 19758 1 265 . 1 1 21 21 TYR N N 15 119.614 0.300 . 1 . . . . . 21 TYR N . 19758 1 266 . 1 1 22 22 ASP H H 1 8.580 0.020 . 1 . . . . . 22 ASP H . 19758 1 267 . 1 1 22 22 ASP HA H 1 4.200 0.020 . 1 . . . . . 22 ASP HA . 19758 1 268 . 1 1 22 22 ASP HB2 H 1 2.428 0.020 . 1 . . . . . 22 ASP HB2 . 19758 1 269 . 1 1 22 22 ASP HB3 H 1 2.514 0.020 . 1 . . . . . 22 ASP HB3 . 19758 1 270 . 1 1 22 22 ASP C C 13 178.861 0.300 . 1 . . . . . 22 ASP C . 19758 1 271 . 1 1 22 22 ASP CA C 13 58.140 0.300 . 1 . . . . . 22 ASP CA . 19758 1 272 . 1 1 22 22 ASP CB C 13 40.005 0.300 . 1 . . . . . 22 ASP CB . 19758 1 273 . 1 1 22 22 ASP N N 15 119.659 0.300 . 1 . . . . . 22 ASP N . 19758 1 274 . 1 1 23 23 GLU H H 1 9.137 0.020 . 1 . . . . . 23 GLU H . 19758 1 275 . 1 1 23 23 GLU HA H 1 3.691 0.020 . 1 . . . . . 23 GLU HA . 19758 1 276 . 1 1 23 23 GLU HB2 H 1 0.381 0.020 . 1 . . . . . 23 GLU HB2 . 19758 1 277 . 1 1 23 23 GLU HB3 H 1 1.165 0.020 . 1 . . . . . 23 GLU HB3 . 19758 1 278 . 1 1 23 23 GLU HG2 H 1 1.899 0.020 . 2 . . . . . 23 GLU QG . 19758 1 279 . 1 1 23 23 GLU HG3 H 1 1.899 0.020 . 2 . . . . . 23 GLU QG . 19758 1 280 . 1 1 23 23 GLU C C 13 179.458 0.300 . 1 . . . . . 23 GLU C . 19758 1 281 . 1 1 23 23 GLU CA C 13 60.133 0.300 . 1 . . . . . 23 GLU CA . 19758 1 282 . 1 1 23 23 GLU CB C 13 26.562 0.300 . 1 . . . . . 23 GLU CB . 19758 1 283 . 1 1 23 23 GLU CG C 13 37.421 0.300 . 1 . . . . . 23 GLU CG . 19758 1 284 . 1 1 23 23 GLU N N 15 122.996 0.300 . 1 . . . . . 23 GLU N . 19758 1 285 . 1 1 24 24 ALA H H 1 8.013 0.020 . 1 . . . . . 24 ALA H . 19758 1 286 . 1 1 24 24 ALA HA H 1 3.829 0.020 . 1 . . . . . 24 ALA HA . 19758 1 287 . 1 1 24 24 ALA HB1 H 1 1.589 0.020 . 1 . . . . . 24 ALA HB . 19758 1 288 . 1 1 24 24 ALA HB2 H 1 1.589 0.020 . 1 . . . . . 24 ALA HB . 19758 1 289 . 1 1 24 24 ALA HB3 H 1 1.589 0.020 . 1 . . . . . 24 ALA HB . 19758 1 290 . 1 1 24 24 ALA C C 13 177.796 0.300 . 1 . . . . . 24 ALA C . 19758 1 291 . 1 1 24 24 ALA CA C 13 55.974 0.300 . 1 . . . . . 24 ALA CA . 19758 1 292 . 1 1 24 24 ALA CB C 13 17.774 0.300 . 1 . . . . . 24 ALA CB . 19758 1 293 . 1 1 24 24 ALA N N 15 121.913 0.300 . 1 . . . . . 24 ALA N . 19758 1 294 . 1 1 25 25 ILE H H 1 8.508 0.020 . 1 . . . . . 25 ILE H . 19758 1 295 . 1 1 25 25 ILE HA H 1 3.384 0.020 . 1 . . . . . 25 ILE HA . 19758 1 296 . 1 1 25 25 ILE HB H 1 1.926 0.020 . 1 . . . . . 25 ILE HB . 19758 1 297 . 1 1 25 25 ILE HG12 H 1 0.516 0.020 . 1 . . . . . 25 ILE HG12 . 19758 1 298 . 1 1 25 25 ILE HG13 H 1 1.706 0.020 . 1 . . . . . 25 ILE HG13 . 19758 1 299 . 1 1 25 25 ILE HG21 H 1 0.792 0.020 . 1 . . . . . 25 ILE QG2 . 19758 1 300 . 1 1 25 25 ILE HG22 H 1 0.792 0.020 . 1 . . . . . 25 ILE QG2 . 19758 1 301 . 1 1 25 25 ILE HG23 H 1 0.792 0.020 . 1 . . . . . 25 ILE QG2 . 19758 1 302 . 1 1 25 25 ILE HD11 H 1 0.165 0.020 . 1 . . . . . 25 ILE QD1 . 19758 1 303 . 1 1 25 25 ILE HD12 H 1 0.165 0.020 . 1 . . . . . 25 ILE QD1 . 19758 1 304 . 1 1 25 25 ILE HD13 H 1 0.165 0.020 . 1 . . . . . 25 ILE QD1 . 19758 1 305 . 1 1 25 25 ILE C C 13 178.842 0.300 . 1 . . . . . 25 ILE C . 19758 1 306 . 1 1 25 25 ILE CA C 13 67.069 0.300 . 1 . . . . . 25 ILE CA . 19758 1 307 . 1 1 25 25 ILE CB C 13 37.935 0.300 . 1 . . . . . 25 ILE CB . 19758 1 308 . 1 1 25 25 ILE CG1 C 13 32.372 0.300 . 1 . . . . . 25 ILE CG1 . 19758 1 309 . 1 1 25 25 ILE CG2 C 13 17.421 0.300 . 1 . . . . . 25 ILE CG2 . 19758 1 310 . 1 1 25 25 ILE CD1 C 13 13.691 0.300 . 1 . . . . . 25 ILE CD1 . 19758 1 311 . 1 1 25 25 ILE N N 15 117.748 0.300 . 1 . . . . . 25 ILE N . 19758 1 312 . 1 1 26 26 ASP H H 1 7.814 0.020 . 1 . . . . . 26 ASP H . 19758 1 313 . 1 1 26 26 ASP HA H 1 4.418 0.020 . 1 . . . . . 26 ASP HA . 19758 1 314 . 1 1 26 26 ASP HB2 H 1 2.704 0.020 . 1 . . . . . 26 ASP HB2 . 19758 1 315 . 1 1 26 26 ASP HB3 H 1 2.793 0.020 . 1 . . . . . 26 ASP HB3 . 19758 1 316 . 1 1 26 26 ASP C C 13 178.060 0.300 . 1 . . . . . 26 ASP C . 19758 1 317 . 1 1 26 26 ASP CA C 13 58.046 0.300 . 1 . . . . . 26 ASP CA . 19758 1 318 . 1 1 26 26 ASP CB C 13 41.477 0.300 . 1 . . . . . 26 ASP CB . 19758 1 319 . 1 1 26 26 ASP N N 15 122.986 0.300 . 1 . . . . . 26 ASP N . 19758 1 320 . 1 1 27 27 CYS H H 1 7.579 0.020 . 1 . . . . . 27 CYS H . 19758 1 321 . 1 1 27 27 CYS HA H 1 4.086 0.020 . 1 . . . . . 27 CYS HA . 19758 1 322 . 1 1 27 27 CYS HB2 H 1 2.812 0.020 . 1 . . . . . 27 CYS HB2 . 19758 1 323 . 1 1 27 27 CYS HB3 H 1 3.032 0.020 . 1 . . . . . 27 CYS HB3 . 19758 1 324 . 1 1 27 27 CYS C C 13 177.688 0.300 . 1 . . . . . 27 CYS C . 19758 1 325 . 1 1 27 27 CYS CA C 13 64.582 0.300 . 1 . . . . . 27 CYS CA . 19758 1 326 . 1 1 27 27 CYS CB C 13 26.505 0.300 . 1 . . . . . 27 CYS CB . 19758 1 327 . 1 1 27 27 CYS N N 15 116.448 0.300 . 1 . . . . . 27 CYS N . 19758 1 328 . 1 1 28 28 TYR H H 1 8.863 0.020 . 1 . . . . . 28 TYR H . 19758 1 329 . 1 1 28 28 TYR HA H 1 4.414 0.020 . 1 . . . . . 28 TYR HA . 19758 1 330 . 1 1 28 28 TYR HB2 H 1 2.740 0.020 . 1 . . . . . 28 TYR HB2 . 19758 1 331 . 1 1 28 28 TYR HB3 H 1 3.137 0.020 . 1 . . . . . 28 TYR HB3 . 19758 1 332 . 1 1 28 28 TYR C C 13 177.933 0.300 . 1 . . . . . 28 TYR C . 19758 1 333 . 1 1 28 28 TYR CA C 13 58.751 0.300 . 1 . . . . . 28 TYR CA . 19758 1 334 . 1 1 28 28 TYR CB C 13 37.254 0.300 . 1 . . . . . 28 TYR CB . 19758 1 335 . 1 1 28 28 TYR N N 15 117.939 0.300 . 1 . . . . . 28 TYR N . 19758 1 336 . 1 1 29 29 THR H H 1 8.709 0.020 . 1 . . . . . 29 THR H . 19758 1 337 . 1 1 29 29 THR HA H 1 4.078 0.020 . 1 . . . . . 29 THR HA . 19758 1 338 . 1 1 29 29 THR HB H 1 4.553 0.020 . 1 . . . . . 29 THR HB . 19758 1 339 . 1 1 29 29 THR HG21 H 1 1.246 0.020 . 1 . . . . . 29 THR QG2 . 19758 1 340 . 1 1 29 29 THR HG22 H 1 1.246 0.020 . 1 . . . . . 29 THR QG2 . 19758 1 341 . 1 1 29 29 THR HG23 H 1 1.246 0.020 . 1 . . . . . 29 THR QG2 . 19758 1 342 . 1 1 29 29 THR C C 13 176.444 0.300 . 1 . . . . . 29 THR C . 19758 1 343 . 1 1 29 29 THR CA C 13 67.344 0.300 . 1 . . . . . 29 THR CA . 19758 1 344 . 1 1 29 29 THR CB C 13 68.935 0.300 . 1 . . . . . 29 THR CB . 19758 1 345 . 1 1 29 29 THR CG2 C 13 21.014 0.300 . 1 . . . . . 29 THR CG2 . 19758 1 346 . 1 1 29 29 THR N N 15 117.323 0.300 . 1 . . . . . 29 THR N . 19758 1 347 . 1 1 30 30 LYS H H 1 7.992 0.020 . 1 . . . . . 30 LYS H . 19758 1 348 . 1 1 30 30 LYS HA H 1 4.186 0.020 . 1 . . . . . 30 LYS HA . 19758 1 349 . 1 1 30 30 LYS HB2 H 1 1.902 0.020 . 2 . . . . . 30 LYS QB . 19758 1 350 . 1 1 30 30 LYS HB3 H 1 1.902 0.020 . 2 . . . . . 30 LYS QB . 19758 1 351 . 1 1 30 30 LYS HG2 H 1 1.683 0.020 . 2 . . . . . 30 LYS QG . 19758 1 352 . 1 1 30 30 LYS HG3 H 1 1.683 0.020 . 2 . . . . . 30 LYS QG . 19758 1 353 . 1 1 30 30 LYS HD2 H 1 1.481 0.020 . 2 . . . . . 30 LYS QD . 19758 1 354 . 1 1 30 30 LYS HD3 H 1 1.481 0.020 . 2 . . . . . 30 LYS QD . 19758 1 355 . 1 1 30 30 LYS HE2 H 1 2.981 0.020 . 2 . . . . . 30 LYS QE . 19758 1 356 . 1 1 30 30 LYS HE3 H 1 2.981 0.020 . 2 . . . . . 30 LYS QE . 19758 1 357 . 1 1 30 30 LYS C C 13 180.914 0.300 . 1 . . . . . 30 LYS C . 19758 1 358 . 1 1 30 30 LYS CA C 13 59.562 0.300 . 1 . . . . . 30 LYS CA . 19758 1 359 . 1 1 30 30 LYS CB C 13 33.031 0.300 . 1 . . . . . 30 LYS CB . 19758 1 360 . 1 1 30 30 LYS CG C 13 26.384 0.300 . 1 . . . . . 30 LYS CG . 19758 1 361 . 1 1 30 30 LYS CD C 13 29.115 0.300 . 1 . . . . . 30 LYS CD . 19758 1 362 . 1 1 30 30 LYS CE C 13 42.298 0.300 . 1 . . . . . 30 LYS CE . 19758 1 363 . 1 1 30 30 LYS N N 15 122.161 0.300 . 1 . . . . . 30 LYS N . 19758 1 364 . 1 1 31 31 GLY H H 1 8.850 0.020 . 1 . . . . . 31 GLY H . 19758 1 365 . 1 1 31 31 GLY HA2 H 1 3.585 0.020 . 1 . . . . . 31 GLY HA2 . 19758 1 366 . 1 1 31 31 GLY HA3 H 1 3.679 0.020 . 1 . . . . . 31 GLY HA3 . 19758 1 367 . 1 1 31 31 GLY C C 13 174.267 0.300 . 1 . . . . . 31 GLY C . 19758 1 368 . 1 1 31 31 GLY CA C 13 48.245 0.300 . 1 . . . . . 31 GLY CA . 19758 1 369 . 1 1 31 31 GLY N N 15 110.213 0.300 . 1 . . . . . 31 GLY N . 19758 1 370 . 1 1 32 32 MET H H 1 8.421 0.020 . 1 . . . . . 32 MET H . 19758 1 371 . 1 1 32 32 MET HA H 1 3.872 0.020 . 1 . . . . . 32 MET HA . 19758 1 372 . 1 1 32 32 MET HB2 H 1 2.206 0.020 . 2 . . . . . 32 MET QB . 19758 1 373 . 1 1 32 32 MET HB3 H 1 2.206 0.020 . 2 . . . . . 32 MET QB . 19758 1 374 . 1 1 32 32 MET HG2 H 1 1.294 0.020 . 1 . . . . . 32 MET HG2 . 19758 1 375 . 1 1 32 32 MET HG3 H 1 1.489 0.020 . 1 . . . . . 32 MET HG3 . 19758 1 376 . 1 1 32 32 MET HE1 H 1 1.976 0.020 . 1 . . . . . 32 MET HE . 19758 1 377 . 1 1 32 32 MET HE2 H 1 1.976 0.020 . 1 . . . . . 32 MET HE . 19758 1 378 . 1 1 32 32 MET HE3 H 1 1.976 0.020 . 1 . . . . . 32 MET HE . 19758 1 379 . 1 1 32 32 MET C C 13 177.746 0.300 . 1 . . . . . 32 MET C . 19758 1 380 . 1 1 32 32 MET CA C 13 58.906 0.300 . 1 . . . . . 32 MET CA . 19758 1 381 . 1 1 32 32 MET CB C 13 33.730 0.300 . 1 . . . . . 32 MET CB . 19758 1 382 . 1 1 32 32 MET CG C 13 32.381 0.300 . 1 . . . . . 32 MET CG . 19758 1 383 . 1 1 32 32 MET CE C 13 15.920 0.300 . 1 . . . . . 32 MET CE . 19758 1 384 . 1 1 32 32 MET N N 15 123.127 0.300 . 1 . . . . . 32 MET N . 19758 1 385 . 1 1 33 33 ASP H H 1 7.320 0.020 . 1 . . . . . 33 ASP H . 19758 1 386 . 1 1 33 33 ASP HA H 1 4.380 0.020 . 1 . . . . . 33 ASP HA . 19758 1 387 . 1 1 33 33 ASP HB2 H 1 2.666 0.020 . 1 . . . . . 33 ASP HB2 . 19758 1 388 . 1 1 33 33 ASP HB3 H 1 2.738 0.020 . 1 . . . . . 33 ASP HB3 . 19758 1 389 . 1 1 33 33 ASP C C 13 177.630 0.300 . 1 . . . . . 33 ASP C . 19758 1 390 . 1 1 33 33 ASP CA C 13 56.541 0.300 . 1 . . . . . 33 ASP CA . 19758 1 391 . 1 1 33 33 ASP CB C 13 40.997 0.300 . 1 . . . . . 33 ASP CB . 19758 1 392 . 1 1 33 33 ASP N N 15 116.786 0.300 . 1 . . . . . 33 ASP N . 19758 1 393 . 1 1 34 34 ALA H H 1 7.208 0.020 . 1 . . . . . 34 ALA H . 19758 1 394 . 1 1 34 34 ALA HA H 1 4.309 0.020 . 1 . . . . . 34 ALA HA . 19758 1 395 . 1 1 34 34 ALA HB1 H 1 1.502 0.020 . 1 . . . . . 34 ALA HB . 19758 1 396 . 1 1 34 34 ALA HB2 H 1 1.502 0.020 . 1 . . . . . 34 ALA HB . 19758 1 397 . 1 1 34 34 ALA HB3 H 1 1.502 0.020 . 1 . . . . . 34 ALA HB . 19758 1 398 . 1 1 34 34 ALA C C 13 177.806 0.300 . 1 . . . . . 34 ALA C . 19758 1 399 . 1 1 34 34 ALA CA C 13 53.604 0.300 . 1 . . . . . 34 ALA CA . 19758 1 400 . 1 1 34 34 ALA CB C 13 18.478 0.300 . 1 . . . . . 34 ALA CB . 19758 1 401 . 1 1 34 34 ALA N N 15 119.880 0.300 . 1 . . . . . 34 ALA N . 19758 1 402 . 1 1 35 35 ASP H H 1 7.933 0.020 . 1 . . . . . 35 ASP H . 19758 1 403 . 1 1 35 35 ASP HA H 1 4.954 0.020 . 1 . . . . . 35 ASP HA . 19758 1 404 . 1 1 35 35 ASP HB2 H 1 2.236 0.020 . 1 . . . . . 35 ASP HB2 . 19758 1 405 . 1 1 35 35 ASP HB3 H 1 2.821 0.020 . 1 . . . . . 35 ASP HB3 . 19758 1 406 . 1 1 35 35 ASP CA C 13 51.638 0.300 . 1 . . . . . 35 ASP CA . 19758 1 407 . 1 1 35 35 ASP CB C 13 41.626 0.300 . 1 . . . . . 35 ASP CB . 19758 1 408 . 1 1 35 35 ASP N N 15 114.768 0.300 . 1 . . . . . 35 ASP N . 19758 1 409 . 1 1 36 36 PRO HA H 1 4.635 0.020 . 1 . . . . . 36 PRO HA . 19758 1 410 . 1 1 36 36 PRO HB2 H 1 1.323 0.020 . 1 . . . . . 36 PRO HB2 . 19758 1 411 . 1 1 36 36 PRO HB3 H 1 2.221 0.020 . 1 . . . . . 36 PRO HB3 . 19758 1 412 . 1 1 36 36 PRO HG2 H 1 1.315 0.020 . 1 . . . . . 36 PRO HG2 . 19758 1 413 . 1 1 36 36 PRO HG3 H 1 1.876 0.020 . 1 . . . . . 36 PRO HG3 . 19758 1 414 . 1 1 36 36 PRO HD2 H 1 3.394 0.020 . 1 . . . . . 36 PRO HD2 . 19758 1 415 . 1 1 36 36 PRO HD3 H 1 3.612 0.020 . 1 . . . . . 36 PRO HD3 . 19758 1 416 . 1 1 36 36 PRO C C 13 176.447 0.300 . 1 . . . . . 36 PRO C . 19758 1 417 . 1 1 36 36 PRO CA C 13 63.743 0.300 . 1 . . . . . 36 PRO CA . 19758 1 418 . 1 1 36 36 PRO CB C 13 32.238 0.300 . 1 . . . . . 36 PRO CB . 19758 1 419 . 1 1 36 36 PRO CG C 13 26.141 0.300 . 1 . . . . . 36 PRO CG . 19758 1 420 . 1 1 36 36 PRO CD C 13 50.602 0.300 . 1 . . . . . 36 PRO CD . 19758 1 421 . 1 1 37 37 TYR H H 1 7.905 0.020 . 1 . . . . . 37 TYR H . 19758 1 422 . 1 1 37 37 TYR HA H 1 4.798 0.020 . 1 . . . . . 37 TYR HA . 19758 1 423 . 1 1 37 37 TYR HB2 H 1 2.831 0.020 . 1 . . . . . 37 TYR HB2 . 19758 1 424 . 1 1 37 37 TYR HB3 H 1 3.379 0.020 . 1 . . . . . 37 TYR HB3 . 19758 1 425 . 1 1 37 37 TYR HD1 H 1 7.138 0.020 . 1 . . . . . 37 TYR QD . 19758 1 426 . 1 1 37 37 TYR HD2 H 1 7.138 0.020 . 1 . . . . . 37 TYR QD . 19758 1 427 . 1 1 37 37 TYR HE1 H 1 6.868 0.020 . 1 . . . . . 37 TYR QE . 19758 1 428 . 1 1 37 37 TYR HE2 H 1 6.868 0.020 . 1 . . . . . 37 TYR QE . 19758 1 429 . 1 1 37 37 TYR C C 13 174.971 0.300 . 1 . . . . . 37 TYR C . 19758 1 430 . 1 1 37 37 TYR CA C 13 57.083 0.300 . 1 . . . . . 37 TYR CA . 19758 1 431 . 1 1 37 37 TYR CB C 13 37.638 0.300 . 1 . . . . . 37 TYR CB . 19758 1 432 . 1 1 37 37 TYR CD1 C 13 133.065 0.300 . 1 . . . . . 37 TYR CD1 . 19758 1 433 . 1 1 37 37 TYR CE1 C 13 118.369 0.300 . 1 . . . . . 37 TYR CE1 . 19758 1 434 . 1 1 37 37 TYR N N 15 116.190 0.300 . 1 . . . . . 37 TYR N . 19758 1 435 . 1 1 38 38 ASN H H 1 6.778 0.020 . 1 . . . . . 38 ASN H . 19758 1 436 . 1 1 38 38 ASN HA H 1 4.982 0.020 . 1 . . . . . 38 ASN HA . 19758 1 437 . 1 1 38 38 ASN HB2 H 1 2.849 0.020 . 1 . . . . . 38 ASN HB2 . 19758 1 438 . 1 1 38 38 ASN HB3 H 1 2.897 0.020 . 1 . . . . . 38 ASN HB3 . 19758 1 439 . 1 1 38 38 ASN HD21 H 1 6.921 0.020 . 1 . . . . . 38 ASN HD21 . 19758 1 440 . 1 1 38 38 ASN HD22 H 1 8.075 0.020 . 1 . . . . . 38 ASN HD22 . 19758 1 441 . 1 1 38 38 ASN C C 13 175.811 0.300 . 1 . . . . . 38 ASN C . 19758 1 442 . 1 1 38 38 ASN CA C 13 50.157 0.300 . 1 . . . . . 38 ASN CA . 19758 1 443 . 1 1 38 38 ASN CB C 13 39.657 0.300 . 1 . . . . . 38 ASN CB . 19758 1 444 . 1 1 38 38 ASN N N 15 118.789 0.300 . 1 . . . . . 38 ASN N . 19758 1 445 . 1 1 38 38 ASN ND2 N 15 111.845 0.300 . 1 . . . . . 38 ASN ND2 . 19758 1 446 . 1 1 39 39 PRO HA H 1 4.650 0.020 . 1 . . . . . 39 PRO HA . 19758 1 447 . 1 1 39 39 PRO HB2 H 1 1.319 0.020 . 1 . . . . . 39 PRO HB2 . 19758 1 448 . 1 1 39 39 PRO HB3 H 1 2.182 0.020 . 1 . . . . . 39 PRO HB3 . 19758 1 449 . 1 1 39 39 PRO HG2 H 1 1.319 0.020 . 1 . . . . . 39 PRO HG2 . 19758 1 450 . 1 1 39 39 PRO HG3 H 1 1.788 0.020 . 1 . . . . . 39 PRO HG3 . 19758 1 451 . 1 1 39 39 PRO HD2 H 1 4.002 0.020 . 2 . . . . . 39 PRO QD . 19758 1 452 . 1 1 39 39 PRO HD3 H 1 4.002 0.020 . 2 . . . . . 39 PRO QD . 19758 1 453 . 1 1 39 39 PRO C C 13 176.812 0.300 . 1 . . . . . 39 PRO C . 19758 1 454 . 1 1 39 39 PRO CA C 13 64.485 0.300 . 1 . . . . . 39 PRO CA . 19758 1 455 . 1 1 39 39 PRO CB C 13 32.119 0.300 . 1 . . . . . 39 PRO CB . 19758 1 456 . 1 1 39 39 PRO CG C 13 26.634 0.300 . 1 . . . . . 39 PRO CG . 19758 1 457 . 1 1 39 39 PRO CD C 13 50.768 0.300 . 1 . . . . . 39 PRO CD . 19758 1 458 . 1 1 40 40 VAL H H 1 7.924 0.020 . 1 . . . . . 40 VAL H . 19758 1 459 . 1 1 40 40 VAL HA H 1 3.451 0.020 . 1 . . . . . 40 VAL HA . 19758 1 460 . 1 1 40 40 VAL HB H 1 1.874 0.020 . 1 . . . . . 40 VAL HB . 19758 1 461 . 1 1 40 40 VAL HG11 H 1 0.850 0.020 . 2 . . . . . 40 VAL QG1 . 19758 1 462 . 1 1 40 40 VAL HG12 H 1 0.850 0.020 . 2 . . . . . 40 VAL QG1 . 19758 1 463 . 1 1 40 40 VAL HG13 H 1 0.850 0.020 . 2 . . . . . 40 VAL QG1 . 19758 1 464 . 1 1 40 40 VAL HG21 H 1 0.980 0.020 . 2 . . . . . 40 VAL QG2 . 19758 1 465 . 1 1 40 40 VAL HG22 H 1 0.980 0.020 . 2 . . . . . 40 VAL QG2 . 19758 1 466 . 1 1 40 40 VAL HG23 H 1 0.980 0.020 . 2 . . . . . 40 VAL QG2 . 19758 1 467 . 1 1 40 40 VAL C C 13 177.131 0.300 . 1 . . . . . 40 VAL C . 19758 1 468 . 1 1 40 40 VAL CA C 13 65.245 0.300 . 1 . . . . . 40 VAL CA . 19758 1 469 . 1 1 40 40 VAL CB C 13 31.897 0.300 . 1 . . . . . 40 VAL CB . 19758 1 470 . 1 1 40 40 VAL CG1 C 13 21.152 0.300 . 1 . . . . . 40 VAL CG1 . 19758 1 471 . 1 1 40 40 VAL CG2 C 13 21.837 0.300 . 1 . . . . . 40 VAL CG2 . 19758 1 472 . 1 1 40 40 VAL N N 15 122.272 0.300 . 1 . . . . . 40 VAL N . 19758 1 473 . 1 1 41 41 LEU H H 1 6.468 0.020 . 1 . . . . . 41 LEU H . 19758 1 474 . 1 1 41 41 LEU HA H 1 3.828 0.020 . 1 . . . . . 41 LEU HA . 19758 1 475 . 1 1 41 41 LEU HB2 H 1 1.384 0.020 . 1 . . . . . 41 LEU HB2 . 19758 1 476 . 1 1 41 41 LEU HB3 H 1 2.149 0.020 . 1 . . . . . 41 LEU HB3 . 19758 1 477 . 1 1 41 41 LEU HG H 1 1.487 0.020 . 1 . . . . . 41 LEU HG . 19758 1 478 . 1 1 41 41 LEU HD11 H 1 0.979 0.020 . 2 . . . . . 41 LEU QD1 . 19758 1 479 . 1 1 41 41 LEU HD12 H 1 0.979 0.020 . 2 . . . . . 41 LEU QD1 . 19758 1 480 . 1 1 41 41 LEU HD13 H 1 0.979 0.020 . 2 . . . . . 41 LEU QD1 . 19758 1 481 . 1 1 41 41 LEU HD21 H 1 1.020 0.020 . 2 . . . . . 41 LEU QD2 . 19758 1 482 . 1 1 41 41 LEU HD22 H 1 1.020 0.020 . 2 . . . . . 41 LEU QD2 . 19758 1 483 . 1 1 41 41 LEU HD23 H 1 1.020 0.020 . 2 . . . . . 41 LEU QD2 . 19758 1 484 . 1 1 41 41 LEU C C 13 175.166 0.300 . 1 . . . . . 41 LEU C . 19758 1 485 . 1 1 41 41 LEU CA C 13 59.642 0.300 . 1 . . . . . 41 LEU CA . 19758 1 486 . 1 1 41 41 LEU CB C 13 39.812 0.300 . 1 . . . . . 41 LEU CB . 19758 1 487 . 1 1 41 41 LEU CG C 13 28.417 0.300 . 1 . . . . . 41 LEU CG . 19758 1 488 . 1 1 41 41 LEU CD1 C 13 23.527 0.300 . 1 . . . . . 41 LEU CD1 . 19758 1 489 . 1 1 41 41 LEU CD2 C 13 25.541 0.300 . 1 . . . . . 41 LEU CD2 . 19758 1 490 . 1 1 41 41 LEU N N 15 116.534 0.300 . 1 . . . . . 41 LEU N . 19758 1 491 . 1 1 42 42 PRO HA H 1 4.372 0.020 . 1 . . . . . 42 PRO HA . 19758 1 492 . 1 1 42 42 PRO HB2 H 1 2.136 0.020 . 1 . . . . . 42 PRO HB2 . 19758 1 493 . 1 1 42 42 PRO HB3 H 1 2.191 0.020 . 1 . . . . . 42 PRO HB3 . 19758 1 494 . 1 1 42 42 PRO HG2 H 1 1.850 0.020 . 1 . . . . . 42 PRO HG2 . 19758 1 495 . 1 1 42 42 PRO HG3 H 1 1.965 0.020 . 1 . . . . . 42 PRO HG3 . 19758 1 496 . 1 1 42 42 PRO HD2 H 1 3.351 0.020 . 1 . . . . . 42 PRO HD2 . 19758 1 497 . 1 1 42 42 PRO HD3 H 1 4.171 0.020 . 1 . . . . . 42 PRO HD3 . 19758 1 498 . 1 1 42 42 PRO C C 13 178.040 0.300 . 1 . . . . . 42 PRO C . 19758 1 499 . 1 1 42 42 PRO CA C 13 65.254 0.300 . 1 . . . . . 42 PRO CA . 19758 1 500 . 1 1 42 42 PRO CB C 13 29.624 0.300 . 1 . . . . . 42 PRO CB . 19758 1 501 . 1 1 42 42 PRO CG C 13 27.058 0.300 . 1 . . . . . 42 PRO CG . 19758 1 502 . 1 1 42 42 PRO CD C 13 49.643 0.300 . 1 . . . . . 42 PRO CD . 19758 1 503 . 1 1 43 43 THR H H 1 6.797 0.020 . 1 . . . . . 43 THR H . 19758 1 504 . 1 1 43 43 THR HA H 1 3.757 0.020 . 1 . . . . . 43 THR HA . 19758 1 505 . 1 1 43 43 THR HB H 1 4.227 0.020 . 1 . . . . . 43 THR HB . 19758 1 506 . 1 1 43 43 THR HG21 H 1 1.032 0.020 . 1 . . . . . 43 THR QG2 . 19758 1 507 . 1 1 43 43 THR HG22 H 1 1.032 0.020 . 1 . . . . . 43 THR QG2 . 19758 1 508 . 1 1 43 43 THR HG23 H 1 1.032 0.020 . 1 . . . . . 43 THR QG2 . 19758 1 509 . 1 1 43 43 THR C C 13 176.015 0.300 . 1 . . . . . 43 THR C . 19758 1 510 . 1 1 43 43 THR CA C 13 68.022 0.300 . 1 . . . . . 43 THR CA . 19758 1 511 . 1 1 43 43 THR CB C 13 66.922 0.300 . 1 . . . . . 43 THR CB . 19758 1 512 . 1 1 43 43 THR CG2 C 13 21.844 0.300 . 1 . . . . . 43 THR CG2 . 19758 1 513 . 1 1 43 43 THR N N 15 115.606 0.300 . 1 . . . . . 43 THR N . 19758 1 514 . 1 1 44 44 ASN H H 1 8.273 0.020 . 1 . . . . . 44 ASN H . 19758 1 515 . 1 1 44 44 ASN HA H 1 4.037 0.020 . 1 . . . . . 44 ASN HA . 19758 1 516 . 1 1 44 44 ASN HB2 H 1 1.653 0.020 . 1 . . . . . 44 ASN HB2 . 19758 1 517 . 1 1 44 44 ASN HB3 H 1 1.907 0.020 . 1 . . . . . 44 ASN HB3 . 19758 1 518 . 1 1 44 44 ASN HD21 H 1 5.630 0.020 . 1 . . . . . 44 ASN HD21 . 19758 1 519 . 1 1 44 44 ASN HD22 H 1 6.993 0.020 . 1 . . . . . 44 ASN HD22 . 19758 1 520 . 1 1 44 44 ASN C C 13 177.725 0.300 . 1 . . . . . 44 ASN C . 19758 1 521 . 1 1 44 44 ASN CA C 13 55.328 0.300 . 1 . . . . . 44 ASN CA . 19758 1 522 . 1 1 44 44 ASN CB C 13 34.850 0.300 . 1 . . . . . 44 ASN CB . 19758 1 523 . 1 1 44 44 ASN N N 15 123.582 0.300 . 1 . . . . . 44 ASN N . 19758 1 524 . 1 1 44 44 ASN ND2 N 15 106.024 0.300 . 1 . . . . . 44 ASN ND2 . 19758 1 525 . 1 1 45 45 ARG H H 1 8.354 0.020 . 1 . . . . . 45 ARG H . 19758 1 526 . 1 1 45 45 ARG HA H 1 3.782 0.020 . 1 . . . . . 45 ARG HA . 19758 1 527 . 1 1 45 45 ARG HB2 H 1 1.456 0.020 . 1 . . . . . 45 ARG HB2 . 19758 1 528 . 1 1 45 45 ARG HB3 H 1 2.673 0.020 . 1 . . . . . 45 ARG HB3 . 19758 1 529 . 1 1 45 45 ARG HG2 H 1 2.220 0.020 . 2 . . . . . 45 ARG QG . 19758 1 530 . 1 1 45 45 ARG HG3 H 1 2.220 0.020 . 2 . . . . . 45 ARG QG . 19758 1 531 . 1 1 45 45 ARG HD2 H 1 3.408 0.020 . 2 . . . . . 45 ARG QD . 19758 1 532 . 1 1 45 45 ARG HD3 H 1 3.408 0.020 . 2 . . . . . 45 ARG QD . 19758 1 533 . 1 1 45 45 ARG C C 13 177.923 0.300 . 1 . . . . . 45 ARG C . 19758 1 534 . 1 1 45 45 ARG CA C 13 61.918 0.300 . 1 . . . . . 45 ARG CA . 19758 1 535 . 1 1 45 45 ARG CB C 13 31.112 0.300 . 1 . . . . . 45 ARG CB . 19758 1 536 . 1 1 45 45 ARG CG C 13 28.810 0.300 . 1 . . . . . 45 ARG CG . 19758 1 537 . 1 1 45 45 ARG CD C 13 44.540 0.300 . 1 . . . . . 45 ARG CD . 19758 1 538 . 1 1 45 45 ARG N N 15 124.032 0.300 . 1 . . . . . 45 ARG N . 19758 1 539 . 1 1 46 46 ALA H H 1 8.852 0.020 . 1 . . . . . 46 ALA H . 19758 1 540 . 1 1 46 46 ALA HA H 1 4.327 0.020 . 1 . . . . . 46 ALA HA . 19758 1 541 . 1 1 46 46 ALA HB1 H 1 1.881 0.020 . 1 . . . . . 46 ALA HB . 19758 1 542 . 1 1 46 46 ALA HB2 H 1 1.881 0.020 . 1 . . . . . 46 ALA HB . 19758 1 543 . 1 1 46 46 ALA HB3 H 1 1.881 0.020 . 1 . . . . . 46 ALA HB . 19758 1 544 . 1 1 46 46 ALA C C 13 180.748 0.300 . 1 . . . . . 46 ALA C . 19758 1 545 . 1 1 46 46 ALA CA C 13 55.800 0.300 . 1 . . . . . 46 ALA CA . 19758 1 546 . 1 1 46 46 ALA CB C 13 20.998 0.300 . 1 . . . . . 46 ALA CB . 19758 1 547 . 1 1 46 46 ALA N N 15 122.023 0.300 . 1 . . . . . 46 ALA N . 19758 1 548 . 1 1 47 47 SER H H 1 8.186 0.020 . 1 . . . . . 47 SER H . 19758 1 549 . 1 1 47 47 SER HA H 1 4.095 0.020 . 1 . . . . . 47 SER HA . 19758 1 550 . 1 1 47 47 SER HB2 H 1 3.932 0.020 . 2 . . . . . 47 SER QB . 19758 1 551 . 1 1 47 47 SER HB3 H 1 3.932 0.020 . 2 . . . . . 47 SER QB . 19758 1 552 . 1 1 47 47 SER C C 13 176.202 0.300 . 1 . . . . . 47 SER C . 19758 1 553 . 1 1 47 47 SER CA C 13 62.254 0.300 . 1 . . . . . 47 SER CA . 19758 1 554 . 1 1 47 47 SER CB C 13 62.507 0.300 . 1 . . . . . 47 SER CB . 19758 1 555 . 1 1 47 47 SER N N 15 114.285 0.300 . 1 . . . . . 47 SER N . 19758 1 556 . 1 1 48 48 ALA H H 1 7.964 0.020 . 1 . . . . . 48 ALA H . 19758 1 557 . 1 1 48 48 ALA HA H 1 4.191 0.020 . 1 . . . . . 48 ALA HA . 19758 1 558 . 1 1 48 48 ALA HB1 H 1 1.744 0.020 . 1 . . . . . 48 ALA HB . 19758 1 559 . 1 1 48 48 ALA HB2 H 1 1.744 0.020 . 1 . . . . . 48 ALA HB . 19758 1 560 . 1 1 48 48 ALA HB3 H 1 1.744 0.020 . 1 . . . . . 48 ALA HB . 19758 1 561 . 1 1 48 48 ALA C C 13 178.441 0.300 . 1 . . . . . 48 ALA C . 19758 1 562 . 1 1 48 48 ALA CA C 13 55.944 0.300 . 1 . . . . . 48 ALA CA . 19758 1 563 . 1 1 48 48 ALA CB C 13 18.744 0.300 . 1 . . . . . 48 ALA CB . 19758 1 564 . 1 1 48 48 ALA N N 15 125.342 0.300 . 1 . . . . . 48 ALA N . 19758 1 565 . 1 1 49 49 TYR H H 1 8.801 0.020 . 1 . . . . . 49 TYR H . 19758 1 566 . 1 1 49 49 TYR HA H 1 4.192 0.020 . 1 . . . . . 49 TYR HA . 19758 1 567 . 1 1 49 49 TYR HB2 H 1 2.858 0.020 . 1 . . . . . 49 TYR HB2 . 19758 1 568 . 1 1 49 49 TYR HB3 H 1 3.302 0.020 . 1 . . . . . 49 TYR HB3 . 19758 1 569 . 1 1 49 49 TYR HD1 H 1 7.013 0.020 . 1 . . . . . 49 TYR QD . 19758 1 570 . 1 1 49 49 TYR HD2 H 1 7.013 0.020 . 1 . . . . . 49 TYR QD . 19758 1 571 . 1 1 49 49 TYR HE1 H 1 6.799 0.020 . 1 . . . . . 49 TYR QE . 19758 1 572 . 1 1 49 49 TYR HE2 H 1 6.799 0.020 . 1 . . . . . 49 TYR QE . 19758 1 573 . 1 1 49 49 TYR C C 13 179.067 0.300 . 1 . . . . . 49 TYR C . 19758 1 574 . 1 1 49 49 TYR CA C 13 62.881 0.300 . 1 . . . . . 49 TYR CA . 19758 1 575 . 1 1 49 49 TYR CB C 13 37.014 0.300 . 1 . . . . . 49 TYR CB . 19758 1 576 . 1 1 49 49 TYR CD1 C 13 133.070 0.300 . 1 . . . . . 49 TYR CD1 . 19758 1 577 . 1 1 49 49 TYR CE1 C 13 118.842 0.300 . 1 . . . . . 49 TYR CE1 . 19758 1 578 . 1 1 49 49 TYR N N 15 117.564 0.300 . 1 . . . . . 49 TYR N . 19758 1 579 . 1 1 50 50 PHE H H 1 9.255 0.020 . 1 . . . . . 50 PHE H . 19758 1 580 . 1 1 50 50 PHE HA H 1 3.701 0.020 . 1 . . . . . 50 PHE HA . 19758 1 581 . 1 1 50 50 PHE HB2 H 1 3.099 0.020 . 1 . . . . . 50 PHE HB2 . 19758 1 582 . 1 1 50 50 PHE HB3 H 1 3.310 0.020 . 1 . . . . . 50 PHE HB3 . 19758 1 583 . 1 1 50 50 PHE HD1 H 1 7.136 0.020 . 1 . . . . . 50 PHE QD . 19758 1 584 . 1 1 50 50 PHE HD2 H 1 7.136 0.020 . 1 . . . . . 50 PHE QD . 19758 1 585 . 1 1 50 50 PHE HE1 H 1 7.385 0.020 . 1 . . . . . 50 PHE QE . 19758 1 586 . 1 1 50 50 PHE HE2 H 1 7.385 0.020 . 1 . . . . . 50 PHE QE . 19758 1 587 . 1 1 50 50 PHE HZ H 1 7.513 0.020 . 1 . . . . . 50 PHE HZ . 19758 1 588 . 1 1 50 50 PHE C C 13 179.319 0.300 . 1 . . . . . 50 PHE C . 19758 1 589 . 1 1 50 50 PHE CA C 13 62.350 0.300 . 1 . . . . . 50 PHE CA . 19758 1 590 . 1 1 50 50 PHE CB C 13 39.989 0.300 . 1 . . . . . 50 PHE CB . 19758 1 591 . 1 1 50 50 PHE CD1 C 13 131.196 0.300 . 1 . . . . . 50 PHE CD1 . 19758 1 592 . 1 1 50 50 PHE CE1 C 13 132.775 0.300 . 1 . . . . . 50 PHE CE1 . 19758 1 593 . 1 1 50 50 PHE CZ C 13 131.358 0.300 . 1 . . . . . 50 PHE CZ . 19758 1 594 . 1 1 50 50 PHE N N 15 120.898 0.300 . 1 . . . . . 50 PHE N . 19758 1 595 . 1 1 51 51 ARG H H 1 7.772 0.020 . 1 . . . . . 51 ARG H . 19758 1 596 . 1 1 51 51 ARG HA H 1 3.976 0.020 . 1 . . . . . 51 ARG HA . 19758 1 597 . 1 1 51 51 ARG HB2 H 1 1.566 0.020 . 1 . . . . . 51 ARG HB2 . 19758 1 598 . 1 1 51 51 ARG HB3 H 1 1.837 0.020 . 1 . . . . . 51 ARG HB3 . 19758 1 599 . 1 1 51 51 ARG HG2 H 1 1.102 0.020 . 1 . . . . . 51 ARG HG2 . 19758 1 600 . 1 1 51 51 ARG HG3 H 1 1.271 0.020 . 1 . . . . . 51 ARG HG3 . 19758 1 601 . 1 1 51 51 ARG HD2 H 1 3.059 0.020 . 1 . . . . . 51 ARG HD2 . 19758 1 602 . 1 1 51 51 ARG HD3 H 1 3.290 0.020 . 1 . . . . . 51 ARG HD3 . 19758 1 603 . 1 1 51 51 ARG C C 13 177.598 0.300 . 1 . . . . . 51 ARG C . 19758 1 604 . 1 1 51 51 ARG CA C 13 57.840 0.300 . 1 . . . . . 51 ARG CA . 19758 1 605 . 1 1 51 51 ARG CB C 13 27.547 0.300 . 1 . . . . . 51 ARG CB . 19758 1 606 . 1 1 51 51 ARG CG C 13 28.089 0.300 . 1 . . . . . 51 ARG CG . 19758 1 607 . 1 1 51 51 ARG CD C 13 42.558 0.300 . 1 . . . . . 51 ARG CD . 19758 1 608 . 1 1 51 51 ARG N N 15 120.669 0.300 . 1 . . . . . 51 ARG N . 19758 1 609 . 1 1 52 52 LEU H H 1 7.100 0.020 . 1 . . . . . 52 LEU H . 19758 1 610 . 1 1 52 52 LEU HA H 1 4.211 0.020 . 1 . . . . . 52 LEU HA . 19758 1 611 . 1 1 52 52 LEU HB2 H 1 1.659 0.020 . 1 . . . . . 52 LEU HB2 . 19758 1 612 . 1 1 52 52 LEU HB3 H 1 1.799 0.020 . 1 . . . . . 52 LEU HB3 . 19758 1 613 . 1 1 52 52 LEU HG H 1 1.544 0.020 . 1 . . . . . 52 LEU HG . 19758 1 614 . 1 1 52 52 LEU HD11 H 1 0.758 0.020 . 2 . . . . . 52 LEU QD1 . 19758 1 615 . 1 1 52 52 LEU HD12 H 1 0.758 0.020 . 2 . . . . . 52 LEU QD1 . 19758 1 616 . 1 1 52 52 LEU HD13 H 1 0.758 0.020 . 2 . . . . . 52 LEU QD1 . 19758 1 617 . 1 1 52 52 LEU HD21 H 1 0.982 0.020 . 2 . . . . . 52 LEU QD2 . 19758 1 618 . 1 1 52 52 LEU HD22 H 1 0.982 0.020 . 2 . . . . . 52 LEU QD2 . 19758 1 619 . 1 1 52 52 LEU HD23 H 1 0.982 0.020 . 2 . . . . . 52 LEU QD2 . 19758 1 620 . 1 1 52 52 LEU C C 13 175.322 0.300 . 1 . . . . . 52 LEU C . 19758 1 621 . 1 1 52 52 LEU CA C 13 54.573 0.300 . 1 . . . . . 52 LEU CA . 19758 1 622 . 1 1 52 52 LEU CB C 13 42.772 0.300 . 1 . . . . . 52 LEU CB . 19758 1 623 . 1 1 52 52 LEU CG C 13 25.700 0.300 . 1 . . . . . 52 LEU CG . 19758 1 624 . 1 1 52 52 LEU CD1 C 13 26.302 0.300 . 1 . . . . . 52 LEU CD1 . 19758 1 625 . 1 1 52 52 LEU CD2 C 13 22.700 0.300 . 1 . . . . . 52 LEU CD2 . 19758 1 626 . 1 1 52 52 LEU N N 15 118.021 0.300 . 1 . . . . . 52 LEU N . 19758 1 627 . 1 1 53 53 LYS H H 1 7.474 0.020 . 1 . . . . . 53 LYS H . 19758 1 628 . 1 1 53 53 LYS HA H 1 2.451 0.020 . 1 . . . . . 53 LYS HA . 19758 1 629 . 1 1 53 53 LYS HB2 H 1 1.583 0.020 . 1 . . . . . 53 LYS HB2 . 19758 1 630 . 1 1 53 53 LYS HB3 H 1 1.979 0.020 . 1 . . . . . 53 LYS HB3 . 19758 1 631 . 1 1 53 53 LYS HG2 H 1 1.143 0.020 . 1 . . . . . 53 LYS HG2 . 19758 1 632 . 1 1 53 53 LYS HG3 H 1 1.168 0.020 . 1 . . . . . 53 LYS HG3 . 19758 1 633 . 1 1 53 53 LYS HD2 H 1 1.653 0.020 . 2 . . . . . 53 LYS QD . 19758 1 634 . 1 1 53 53 LYS HD3 H 1 1.653 0.020 . 2 . . . . . 53 LYS QD . 19758 1 635 . 1 1 53 53 LYS HE2 H 1 3.025 0.020 . 2 . . . . . 53 LYS QE . 19758 1 636 . 1 1 53 53 LYS HE3 H 1 3.025 0.020 . 2 . . . . . 53 LYS QE . 19758 1 637 . 1 1 53 53 LYS C C 13 175.295 0.300 . 1 . . . . . 53 LYS C . 19758 1 638 . 1 1 53 53 LYS CA C 13 56.664 0.300 . 1 . . . . . 53 LYS CA . 19758 1 639 . 1 1 53 53 LYS CB C 13 28.041 0.300 . 1 . . . . . 53 LYS CB . 19758 1 640 . 1 1 53 53 LYS CG C 13 24.970 0.300 . 1 . . . . . 53 LYS CG . 19758 1 641 . 1 1 53 53 LYS CD C 13 29.284 0.300 . 1 . . . . . 53 LYS CD . 19758 1 642 . 1 1 53 53 LYS CE C 13 42.551 0.300 . 1 . . . . . 53 LYS CE . 19758 1 643 . 1 1 53 53 LYS N N 15 112.408 0.300 . 1 . . . . . 53 LYS N . 19758 1 644 . 1 1 54 54 LYS H H 1 7.809 0.020 . 1 . . . . . 54 LYS H . 19758 1 645 . 1 1 54 54 LYS HA H 1 4.495 0.020 . 1 . . . . . 54 LYS HA . 19758 1 646 . 1 1 54 54 LYS HB2 H 1 1.694 0.020 . 2 . . . . . 54 LYS QB . 19758 1 647 . 1 1 54 54 LYS HB3 H 1 1.694 0.020 . 2 . . . . . 54 LYS QB . 19758 1 648 . 1 1 54 54 LYS HG2 H 1 1.265 0.020 . 1 . . . . . 54 LYS HG2 . 19758 1 649 . 1 1 54 54 LYS HG3 H 1 1.400 0.020 . 1 . . . . . 54 LYS HG3 . 19758 1 650 . 1 1 54 54 LYS HD2 H 1 1.673 0.020 . 2 . . . . . 54 LYS QD . 19758 1 651 . 1 1 54 54 LYS HD3 H 1 1.673 0.020 . 2 . . . . . 54 LYS QD . 19758 1 652 . 1 1 54 54 LYS HE2 H 1 2.956 0.020 . 2 . . . . . 54 LYS QE . 19758 1 653 . 1 1 54 54 LYS HE3 H 1 2.956 0.020 . 2 . . . . . 54 LYS QE . 19758 1 654 . 1 1 54 54 LYS C C 13 177.415 0.300 . 1 . . . . . 54 LYS C . 19758 1 655 . 1 1 54 54 LYS CA C 13 53.636 0.300 . 1 . . . . . 54 LYS CA . 19758 1 656 . 1 1 54 54 LYS CB C 13 29.768 0.300 . 1 . . . . . 54 LYS CB . 19758 1 657 . 1 1 54 54 LYS CG C 13 24.576 0.300 . 1 . . . . . 54 LYS CG . 19758 1 658 . 1 1 54 54 LYS CD C 13 29.527 0.300 . 1 . . . . . 54 LYS CD . 19758 1 659 . 1 1 54 54 LYS CE C 13 42.377 0.300 . 1 . . . . . 54 LYS CE . 19758 1 660 . 1 1 54 54 LYS N N 15 120.966 0.300 . 1 . . . . . 54 LYS N . 19758 1 661 . 1 1 55 55 PHE H H 1 6.646 0.020 . 1 . . . . . 55 PHE H . 19758 1 662 . 1 1 55 55 PHE HA H 1 4.060 0.020 . 1 . . . . . 55 PHE HA . 19758 1 663 . 1 1 55 55 PHE HB2 H 1 2.816 0.020 . 1 . . . . . 55 PHE HB2 . 19758 1 664 . 1 1 55 55 PHE HB3 H 1 3.352 0.020 . 1 . . . . . 55 PHE HB3 . 19758 1 665 . 1 1 55 55 PHE HD1 H 1 7.005 0.020 . 1 . . . . . 55 PHE QD . 19758 1 666 . 1 1 55 55 PHE HD2 H 1 7.005 0.020 . 1 . . . . . 55 PHE QD . 19758 1 667 . 1 1 55 55 PHE HE1 H 1 6.693 0.020 . 1 . . . . . 55 PHE QE . 19758 1 668 . 1 1 55 55 PHE HE2 H 1 6.693 0.020 . 1 . . . . . 55 PHE QE . 19758 1 669 . 1 1 55 55 PHE HZ H 1 7.079 0.020 . 1 . . . . . 55 PHE HZ . 19758 1 670 . 1 1 55 55 PHE C C 13 177.327 0.300 . 1 . . . . . 55 PHE C . 19758 1 671 . 1 1 55 55 PHE CA C 13 61.378 0.300 . 1 . . . . . 55 PHE CA . 19758 1 672 . 1 1 55 55 PHE CB C 13 38.741 0.300 . 1 . . . . . 55 PHE CB . 19758 1 673 . 1 1 55 55 PHE CD1 C 13 130.793 0.300 . 1 . . . . . 55 PHE CD1 . 19758 1 674 . 1 1 55 55 PHE CE1 C 13 132.530 0.300 . 1 . . . . . 55 PHE CE1 . 19758 1 675 . 1 1 55 55 PHE CZ C 13 130.102 0.300 . 1 . . . . . 55 PHE CZ . 19758 1 676 . 1 1 55 55 PHE N N 15 118.103 0.300 . 1 . . . . . 55 PHE N . 19758 1 677 . 1 1 56 56 ALA H H 1 8.963 0.020 . 1 . . . . . 56 ALA H . 19758 1 678 . 1 1 56 56 ALA HA H 1 4.276 0.020 . 1 . . . . . 56 ALA HA . 19758 1 679 . 1 1 56 56 ALA HB1 H 1 1.513 0.020 . 1 . . . . . 56 ALA HB . 19758 1 680 . 1 1 56 56 ALA HB2 H 1 1.513 0.020 . 1 . . . . . 56 ALA HB . 19758 1 681 . 1 1 56 56 ALA HB3 H 1 1.513 0.020 . 1 . . . . . 56 ALA HB . 19758 1 682 . 1 1 56 56 ALA C C 13 180.694 0.300 . 1 . . . . . 56 ALA C . 19758 1 683 . 1 1 56 56 ALA CA C 13 55.249 0.300 . 1 . . . . . 56 ALA CA . 19758 1 684 . 1 1 56 56 ALA CB C 13 17.667 0.300 . 1 . . . . . 56 ALA CB . 19758 1 685 . 1 1 56 56 ALA N N 15 121.294 0.300 . 1 . . . . . 56 ALA N . 19758 1 686 . 1 1 57 57 VAL H H 1 7.288 0.020 . 1 . . . . . 57 VAL H . 19758 1 687 . 1 1 57 57 VAL HA H 1 3.680 0.020 . 1 . . . . . 57 VAL HA . 19758 1 688 . 1 1 57 57 VAL HB H 1 1.375 0.020 . 1 . . . . . 57 VAL HB . 19758 1 689 . 1 1 57 57 VAL HG11 H 1 0.049 0.020 . 2 . . . . . 57 VAL QG1 . 19758 1 690 . 1 1 57 57 VAL HG12 H 1 0.049 0.020 . 2 . . . . . 57 VAL QG1 . 19758 1 691 . 1 1 57 57 VAL HG13 H 1 0.049 0.020 . 2 . . . . . 57 VAL QG1 . 19758 1 692 . 1 1 57 57 VAL HG21 H 1 0.615 0.020 . 2 . . . . . 57 VAL QG2 . 19758 1 693 . 1 1 57 57 VAL HG22 H 1 0.615 0.020 . 2 . . . . . 57 VAL QG2 . 19758 1 694 . 1 1 57 57 VAL HG23 H 1 0.615 0.020 . 2 . . . . . 57 VAL QG2 . 19758 1 695 . 1 1 57 57 VAL C C 13 178.095 0.300 . 1 . . . . . 57 VAL C . 19758 1 696 . 1 1 57 57 VAL CA C 13 65.133 0.300 . 1 . . . . . 57 VAL CA . 19758 1 697 . 1 1 57 57 VAL CB C 13 31.359 0.300 . 1 . . . . . 57 VAL CB . 19758 1 698 . 1 1 57 57 VAL CG1 C 13 20.938 0.300 . 1 . . . . . 57 VAL CG1 . 19758 1 699 . 1 1 57 57 VAL CG2 C 13 21.353 0.300 . 1 . . . . . 57 VAL CG2 . 19758 1 700 . 1 1 57 57 VAL N N 15 119.210 0.300 . 1 . . . . . 57 VAL N . 19758 1 701 . 1 1 58 58 ALA H H 1 7.797 0.020 . 1 . . . . . 58 ALA H . 19758 1 702 . 1 1 58 58 ALA HA H 1 4.215 0.020 . 1 . . . . . 58 ALA HA . 19758 1 703 . 1 1 58 58 ALA HB1 H 1 1.734 0.020 . 1 . . . . . 58 ALA HB . 19758 1 704 . 1 1 58 58 ALA HB2 H 1 1.734 0.020 . 1 . . . . . 58 ALA HB . 19758 1 705 . 1 1 58 58 ALA HB3 H 1 1.734 0.020 . 1 . . . . . 58 ALA HB . 19758 1 706 . 1 1 58 58 ALA C C 13 179.380 0.300 . 1 . . . . . 58 ALA C . 19758 1 707 . 1 1 58 58 ALA CA C 13 55.702 0.300 . 1 . . . . . 58 ALA CA . 19758 1 708 . 1 1 58 58 ALA CB C 13 18.217 0.300 . 1 . . . . . 58 ALA CB . 19758 1 709 . 1 1 58 58 ALA N N 15 121.119 0.300 . 1 . . . . . 58 ALA N . 19758 1 710 . 1 1 59 59 GLU H H 1 8.443 0.020 . 1 . . . . . 59 GLU H . 19758 1 711 . 1 1 59 59 GLU HA H 1 3.652 0.020 . 1 . . . . . 59 GLU HA . 19758 1 712 . 1 1 59 59 GLU HB2 H 1 1.913 0.020 . 1 . . . . . 59 GLU HB2 . 19758 1 713 . 1 1 59 59 GLU HB3 H 1 2.353 0.020 . 1 . . . . . 59 GLU HB3 . 19758 1 714 . 1 1 59 59 GLU HG2 H 1 2.014 0.020 . 1 . . . . . 59 GLU HG2 . 19758 1 715 . 1 1 59 59 GLU HG3 H 1 2.161 0.020 . 1 . . . . . 59 GLU HG3 . 19758 1 716 . 1 1 59 59 GLU C C 13 177.258 0.300 . 1 . . . . . 59 GLU C . 19758 1 717 . 1 1 59 59 GLU CA C 13 60.718 0.300 . 1 . . . . . 59 GLU CA . 19758 1 718 . 1 1 59 59 GLU CB C 13 29.461 0.300 . 1 . . . . . 59 GLU CB . 19758 1 719 . 1 1 59 59 GLU CG C 13 36.035 0.300 . 1 . . . . . 59 GLU CG . 19758 1 720 . 1 1 59 59 GLU N N 15 118.197 0.300 . 1 . . . . . 59 GLU N . 19758 1 721 . 1 1 60 60 SER H H 1 7.753 0.020 . 1 . . . . . 60 SER H . 19758 1 722 . 1 1 60 60 SER HA H 1 4.211 0.020 . 1 . . . . . 60 SER HA . 19758 1 723 . 1 1 60 60 SER HB2 H 1 4.000 0.020 . 1 . . . . . 60 SER HB2 . 19758 1 724 . 1 1 60 60 SER HB3 H 1 4.039 0.020 . 1 . . . . . 60 SER HB3 . 19758 1 725 . 1 1 60 60 SER C C 13 177.776 0.300 . 1 . . . . . 60 SER C . 19758 1 726 . 1 1 60 60 SER CA C 13 61.994 0.300 . 1 . . . . . 60 SER CA . 19758 1 727 . 1 1 60 60 SER CB C 13 62.494 0.300 . 1 . . . . . 60 SER CB . 19758 1 728 . 1 1 60 60 SER N N 15 113.750 0.300 . 1 . . . . . 60 SER N . 19758 1 729 . 1 1 61 61 ASP H H 1 8.313 0.020 . 1 . . . . . 61 ASP H . 19758 1 730 . 1 1 61 61 ASP HA H 1 4.635 0.020 . 1 . . . . . 61 ASP HA . 19758 1 731 . 1 1 61 61 ASP HB2 H 1 2.766 0.020 . 1 . . . . . 61 ASP HB2 . 19758 1 732 . 1 1 61 61 ASP HB3 H 1 3.136 0.020 . 1 . . . . . 61 ASP HB3 . 19758 1 733 . 1 1 61 61 ASP C C 13 179.624 0.300 . 1 . . . . . 61 ASP C . 19758 1 734 . 1 1 61 61 ASP CA C 13 57.839 0.300 . 1 . . . . . 61 ASP CA . 19758 1 735 . 1 1 61 61 ASP CB C 13 40.181 0.300 . 1 . . . . . 61 ASP CB . 19758 1 736 . 1 1 61 61 ASP N N 15 125.111 0.300 . 1 . . . . . 61 ASP N . 19758 1 737 . 1 1 62 62 CYS H H 1 7.887 0.020 . 1 . . . . . 62 CYS H . 19758 1 738 . 1 1 62 62 CYS HA H 1 4.072 0.020 . 1 . . . . . 62 CYS HA . 19758 1 739 . 1 1 62 62 CYS HB2 H 1 2.598 0.020 . 1 . . . . . 62 CYS HB2 . 19758 1 740 . 1 1 62 62 CYS HB3 H 1 3.019 0.020 . 1 . . . . . 62 CYS HB3 . 19758 1 741 . 1 1 62 62 CYS C C 13 176.544 0.300 . 1 . . . . . 62 CYS C . 19758 1 742 . 1 1 62 62 CYS CA C 13 64.437 0.300 . 1 . . . . . 62 CYS CA . 19758 1 743 . 1 1 62 62 CYS CB C 13 27.324 0.300 . 1 . . . . . 62 CYS CB . 19758 1 744 . 1 1 62 62 CYS N N 15 117.517 0.300 . 1 . . . . . 62 CYS N . 19758 1 745 . 1 1 63 63 ASN H H 1 8.327 0.020 . 1 . . . . . 63 ASN H . 19758 1 746 . 1 1 63 63 ASN HA H 1 4.229 0.020 . 1 . . . . . 63 ASN HA . 19758 1 747 . 1 1 63 63 ASN HB2 H 1 2.709 0.020 . 1 . . . . . 63 ASN HB2 . 19758 1 748 . 1 1 63 63 ASN HB3 H 1 3.290 0.020 . 1 . . . . . 63 ASN HB3 . 19758 1 749 . 1 1 63 63 ASN HD21 H 1 6.770 0.020 . 1 . . . . . 63 ASN HD21 . 19758 1 750 . 1 1 63 63 ASN HD22 H 1 7.546 0.020 . 1 . . . . . 63 ASN HD22 . 19758 1 751 . 1 1 63 63 ASN C C 13 178.488 0.300 . 1 . . . . . 63 ASN C . 19758 1 752 . 1 1 63 63 ASN CA C 13 55.776 0.300 . 1 . . . . . 63 ASN CA . 19758 1 753 . 1 1 63 63 ASN CB C 13 36.822 0.300 . 1 . . . . . 63 ASN CB . 19758 1 754 . 1 1 63 63 ASN N N 15 119.308 0.300 . 1 . . . . . 63 ASN N . 19758 1 755 . 1 1 63 63 ASN ND2 N 15 109.463 0.300 . 1 . . . . . 63 ASN ND2 . 19758 1 756 . 1 1 64 64 LEU H H 1 7.429 0.020 . 1 . . . . . 64 LEU H . 19758 1 757 . 1 1 64 64 LEU HA H 1 4.115 0.020 . 1 . . . . . 64 LEU HA . 19758 1 758 . 1 1 64 64 LEU HB2 H 1 1.892 0.020 . 2 . . . . . 64 LEU QB . 19758 1 759 . 1 1 64 64 LEU HB3 H 1 1.892 0.020 . 2 . . . . . 64 LEU QB . 19758 1 760 . 1 1 64 64 LEU HG H 1 1.772 0.020 . 1 . . . . . 64 LEU HG . 19758 1 761 . 1 1 64 64 LEU HD11 H 1 0.902 0.020 . 2 . . . . . 64 LEU QD1 . 19758 1 762 . 1 1 64 64 LEU HD12 H 1 0.902 0.020 . 2 . . . . . 64 LEU QD1 . 19758 1 763 . 1 1 64 64 LEU HD13 H 1 0.902 0.020 . 2 . . . . . 64 LEU QD1 . 19758 1 764 . 1 1 64 64 LEU HD21 H 1 0.997 0.020 . 2 . . . . . 64 LEU QD2 . 19758 1 765 . 1 1 64 64 LEU HD22 H 1 0.997 0.020 . 2 . . . . . 64 LEU QD2 . 19758 1 766 . 1 1 64 64 LEU HD23 H 1 0.997 0.020 . 2 . . . . . 64 LEU QD2 . 19758 1 767 . 1 1 64 64 LEU C C 13 178.095 0.300 . 1 . . . . . 64 LEU C . 19758 1 768 . 1 1 64 64 LEU CA C 13 57.911 0.300 . 1 . . . . . 64 LEU CA . 19758 1 769 . 1 1 64 64 LEU CB C 13 41.093 0.300 . 1 . . . . . 64 LEU CB . 19758 1 770 . 1 1 64 64 LEU CG C 13 27.029 0.300 . 1 . . . . . 64 LEU CG . 19758 1 771 . 1 1 64 64 LEU CD1 C 13 23.781 0.300 . 1 . . . . . 64 LEU CD1 . 19758 1 772 . 1 1 64 64 LEU CD2 C 13 24.781 0.300 . 1 . . . . . 64 LEU CD2 . 19758 1 773 . 1 1 64 64 LEU N N 15 121.509 0.300 . 1 . . . . . 64 LEU N . 19758 1 774 . 1 1 65 65 ALA H H 1 7.613 0.020 . 1 . . . . . 65 ALA H . 19758 1 775 . 1 1 65 65 ALA HA H 1 3.765 0.020 . 1 . . . . . 65 ALA HA . 19758 1 776 . 1 1 65 65 ALA HB1 H 1 1.483 0.020 . 1 . . . . . 65 ALA HB . 19758 1 777 . 1 1 65 65 ALA HB2 H 1 1.483 0.020 . 1 . . . . . 65 ALA HB . 19758 1 778 . 1 1 65 65 ALA HB3 H 1 1.483 0.020 . 1 . . . . . 65 ALA HB . 19758 1 779 . 1 1 65 65 ALA C C 13 178.803 0.300 . 1 . . . . . 65 ALA C . 19758 1 780 . 1 1 65 65 ALA CA C 13 56.256 0.300 . 1 . . . . . 65 ALA CA . 19758 1 781 . 1 1 65 65 ALA CB C 13 20.590 0.300 . 1 . . . . . 65 ALA CB . 19758 1 782 . 1 1 65 65 ALA N N 15 120.683 0.300 . 1 . . . . . 65 ALA N . 19758 1 783 . 1 1 66 66 VAL H H 1 8.134 0.020 . 1 . . . . . 66 VAL H . 19758 1 784 . 1 1 66 66 VAL HA H 1 3.695 0.020 . 1 . . . . . 66 VAL HA . 19758 1 785 . 1 1 66 66 VAL HB H 1 1.895 0.020 . 1 . . . . . 66 VAL HB . 19758 1 786 . 1 1 66 66 VAL HG11 H 1 0.417 0.020 . 2 . . . . . 66 VAL QG1 . 19758 1 787 . 1 1 66 66 VAL HG12 H 1 0.417 0.020 . 2 . . . . . 66 VAL QG1 . 19758 1 788 . 1 1 66 66 VAL HG13 H 1 0.417 0.020 . 2 . . . . . 66 VAL QG1 . 19758 1 789 . 1 1 66 66 VAL HG21 H 1 0.606 0.020 . 2 . . . . . 66 VAL QG2 . 19758 1 790 . 1 1 66 66 VAL HG22 H 1 0.606 0.020 . 2 . . . . . 66 VAL QG2 . 19758 1 791 . 1 1 66 66 VAL HG23 H 1 0.606 0.020 . 2 . . . . . 66 VAL QG2 . 19758 1 792 . 1 1 66 66 VAL C C 13 177.542 0.300 . 1 . . . . . 66 VAL C . 19758 1 793 . 1 1 66 66 VAL CA C 13 64.542 0.300 . 1 . . . . . 66 VAL CA . 19758 1 794 . 1 1 66 66 VAL CB C 13 31.674 0.300 . 1 . . . . . 66 VAL CB . 19758 1 795 . 1 1 66 66 VAL CG1 C 13 21.364 0.300 . 1 . . . . . 66 VAL CG1 . 19758 1 796 . 1 1 66 66 VAL CG2 C 13 21.919 0.300 . 1 . . . . . 66 VAL CG2 . 19758 1 797 . 1 1 66 66 VAL N N 15 113.315 0.300 . 1 . . . . . 66 VAL N . 19758 1 798 . 1 1 67 67 ALA H H 1 7.309 0.020 . 1 . . . . . 67 ALA H . 19758 1 799 . 1 1 67 67 ALA HA H 1 4.106 0.020 . 1 . . . . . 67 ALA HA . 19758 1 800 . 1 1 67 67 ALA HB1 H 1 1.492 0.020 . 1 . . . . . 67 ALA HB . 19758 1 801 . 1 1 67 67 ALA HB2 H 1 1.492 0.020 . 1 . . . . . 67 ALA HB . 19758 1 802 . 1 1 67 67 ALA HB3 H 1 1.492 0.020 . 1 . . . . . 67 ALA HB . 19758 1 803 . 1 1 67 67 ALA C C 13 180.649 0.300 . 1 . . . . . 67 ALA C . 19758 1 804 . 1 1 67 67 ALA CA C 13 54.181 0.300 . 1 . . . . . 67 ALA CA . 19758 1 805 . 1 1 67 67 ALA CB C 13 18.012 0.300 . 1 . . . . . 67 ALA CB . 19758 1 806 . 1 1 67 67 ALA N N 15 120.041 0.300 . 1 . . . . . 67 ALA N . 19758 1 807 . 1 1 68 68 LEU H H 1 7.652 0.020 . 1 . . . . . 68 LEU H . 19758 1 808 . 1 1 68 68 LEU HA H 1 4.205 0.020 . 1 . . . . . 68 LEU HA . 19758 1 809 . 1 1 68 68 LEU HB2 H 1 1.277 0.020 . 1 . . . . . 68 LEU HB2 . 19758 1 810 . 1 1 68 68 LEU HB3 H 1 2.030 0.020 . 1 . . . . . 68 LEU HB3 . 19758 1 811 . 1 1 68 68 LEU HG H 1 1.977 0.020 . 1 . . . . . 68 LEU HG . 19758 1 812 . 1 1 68 68 LEU HD11 H 1 0.585 0.020 . 2 . . . . . 68 LEU QD1 . 19758 1 813 . 1 1 68 68 LEU HD12 H 1 0.585 0.020 . 2 . . . . . 68 LEU QD1 . 19758 1 814 . 1 1 68 68 LEU HD13 H 1 0.585 0.020 . 2 . . . . . 68 LEU QD1 . 19758 1 815 . 1 1 68 68 LEU HD21 H 1 1.009 0.020 . 2 . . . . . 68 LEU QD2 . 19758 1 816 . 1 1 68 68 LEU HD22 H 1 1.009 0.020 . 2 . . . . . 68 LEU QD2 . 19758 1 817 . 1 1 68 68 LEU HD23 H 1 1.009 0.020 . 2 . . . . . 68 LEU QD2 . 19758 1 818 . 1 1 68 68 LEU C C 13 178.568 0.300 . 1 . . . . . 68 LEU C . 19758 1 819 . 1 1 68 68 LEU CA C 13 56.592 0.300 . 1 . . . . . 68 LEU CA . 19758 1 820 . 1 1 68 68 LEU CB C 13 42.868 0.300 . 1 . . . . . 68 LEU CB . 19758 1 821 . 1 1 68 68 LEU CG C 13 25.916 0.300 . 1 . . . . . 68 LEU CG . 19758 1 822 . 1 1 68 68 LEU CD1 C 13 25.285 0.300 . 1 . . . . . 68 LEU CD1 . 19758 1 823 . 1 1 68 68 LEU CD2 C 13 22.509 0.300 . 1 . . . . . 68 LEU CD2 . 19758 1 824 . 1 1 68 68 LEU N N 15 118.064 0.300 . 1 . . . . . 68 LEU N . 19758 1 825 . 1 1 69 69 ASN H H 1 7.977 0.020 . 1 . . . . . 69 ASN H . 19758 1 826 . 1 1 69 69 ASN HA H 1 4.678 0.020 . 1 . . . . . 69 ASN HA . 19758 1 827 . 1 1 69 69 ASN HB2 H 1 2.786 0.020 . 2 . . . . . 69 ASN QB . 19758 1 828 . 1 1 69 69 ASN HB3 H 1 2.786 0.020 . 2 . . . . . 69 ASN QB . 19758 1 829 . 1 1 69 69 ASN HD21 H 1 7.152 0.020 . 1 . . . . . 69 ASN HD21 . 19758 1 830 . 1 1 69 69 ASN HD22 H 1 7.479 0.020 . 1 . . . . . 69 ASN HD22 . 19758 1 831 . 1 1 69 69 ASN C C 13 174.237 0.300 . 1 . . . . . 69 ASN C . 19758 1 832 . 1 1 69 69 ASN CA C 13 53.317 0.300 . 1 . . . . . 69 ASN CA . 19758 1 833 . 1 1 69 69 ASN CB C 13 39.125 0.300 . 1 . . . . . 69 ASN CB . 19758 1 834 . 1 1 69 69 ASN N N 15 115.947 0.300 . 1 . . . . . 69 ASN N . 19758 1 835 . 1 1 69 69 ASN ND2 N 15 111.158 0.300 . 1 . . . . . 69 ASN ND2 . 19758 1 836 . 1 1 70 70 ARG H H 1 8.733 0.020 . 1 . . . . . 70 ARG H . 19758 1 837 . 1 1 70 70 ARG HA H 1 4.603 0.020 . 1 . . . . . 70 ARG HA . 19758 1 838 . 1 1 70 70 ARG HB2 H 1 2.055 0.020 . 2 . . . . . 70 ARG QB . 19758 1 839 . 1 1 70 70 ARG HB3 H 1 2.055 0.020 . 2 . . . . . 70 ARG QB . 19758 1 840 . 1 1 70 70 ARG HG2 H 1 1.761 0.020 . 1 . . . . . 70 ARG HG2 . 19758 1 841 . 1 1 70 70 ARG HG3 H 1 1.892 0.020 . 1 . . . . . 70 ARG HG3 . 19758 1 842 . 1 1 70 70 ARG HD2 H 1 3.291 0.020 . 2 . . . . . 70 ARG QD . 19758 1 843 . 1 1 70 70 ARG HD3 H 1 3.291 0.020 . 2 . . . . . 70 ARG QD . 19758 1 844 . 1 1 70 70 ARG C C 13 178.580 0.300 . 1 . . . . . 70 ARG C . 19758 1 845 . 1 1 70 70 ARG CA C 13 57.575 0.300 . 1 . . . . . 70 ARG CA . 19758 1 846 . 1 1 70 70 ARG CB C 13 29.960 0.300 . 1 . . . . . 70 ARG CB . 19758 1 847 . 1 1 70 70 ARG CG C 13 27.072 0.300 . 1 . . . . . 70 ARG CG . 19758 1 848 . 1 1 70 70 ARG CD C 13 43.468 0.300 . 1 . . . . . 70 ARG CD . 19758 1 849 . 1 1 70 70 ARG N N 15 123.307 0.300 . 1 . . . . . 70 ARG N . 19758 1 850 . 1 1 71 71 SER H H 1 8.785 0.020 . 1 . . . . . 71 SER H . 19758 1 851 . 1 1 71 71 SER HA H 1 4.869 0.020 . 1 . . . . . 71 SER HA . 19758 1 852 . 1 1 71 71 SER HB2 H 1 4.022 0.020 . 1 . . . . . 71 SER HB2 . 19758 1 853 . 1 1 71 71 SER HB3 H 1 4.168 0.020 . 1 . . . . . 71 SER HB3 . 19758 1 854 . 1 1 71 71 SER C C 13 172.830 0.300 . 1 . . . . . 71 SER C . 19758 1 855 . 1 1 71 71 SER CA C 13 57.479 0.300 . 1 . . . . . 71 SER CA . 19758 1 856 . 1 1 71 71 SER CB C 13 63.148 0.300 . 1 . . . . . 71 SER CB . 19758 1 857 . 1 1 71 71 SER N N 15 117.214 0.300 . 1 . . . . . 71 SER N . 19758 1 858 . 1 1 72 72 TYR H H 1 7.532 0.020 . 1 . . . . . 72 TYR H . 19758 1 859 . 1 1 72 72 TYR HA H 1 4.769 0.020 . 1 . . . . . 72 TYR HA . 19758 1 860 . 1 1 72 72 TYR HB2 H 1 2.789 0.020 . 1 . . . . . 72 TYR HB2 . 19758 1 861 . 1 1 72 72 TYR HB3 H 1 3.200 0.020 . 1 . . . . . 72 TYR HB3 . 19758 1 862 . 1 1 72 72 TYR C C 13 174.271 0.300 . 1 . . . . . 72 TYR C . 19758 1 863 . 1 1 72 72 TYR CA C 13 57.505 0.300 . 1 . . . . . 72 TYR CA . 19758 1 864 . 1 1 72 72 TYR CB C 13 36.630 0.300 . 1 . . . . . 72 TYR CB . 19758 1 865 . 1 1 72 72 TYR N N 15 122.787 0.300 . 1 . . . . . 72 TYR N . 19758 1 866 . 1 1 73 73 THR H H 1 8.125 0.020 . 1 . . . . . 73 THR H . 19758 1 867 . 1 1 73 73 THR HA H 1 3.629 0.020 . 1 . . . . . 73 THR HA . 19758 1 868 . 1 1 73 73 THR HB H 1 3.922 0.020 . 1 . . . . . 73 THR HB . 19758 1 869 . 1 1 73 73 THR HG21 H 1 1.245 0.020 . 1 . . . . . 73 THR QG2 . 19758 1 870 . 1 1 73 73 THR HG22 H 1 1.245 0.020 . 1 . . . . . 73 THR QG2 . 19758 1 871 . 1 1 73 73 THR HG23 H 1 1.245 0.020 . 1 . . . . . 73 THR QG2 . 19758 1 872 . 1 1 73 73 THR C C 13 176.065 0.300 . 1 . . . . . 73 THR C . 19758 1 873 . 1 1 73 73 THR CA C 13 67.010 0.300 . 1 . . . . . 73 THR CA . 19758 1 874 . 1 1 73 73 THR CB C 13 68.577 0.300 . 1 . . . . . 73 THR CB . 19758 1 875 . 1 1 73 73 THR CG2 C 13 24.865 0.300 . 1 . . . . . 73 THR CG2 . 19758 1 876 . 1 1 73 73 THR N N 15 124.992 0.300 . 1 . . . . . 73 THR N . 19758 1 877 . 1 1 74 74 LYS H H 1 7.559 0.020 . 1 . . . . . 74 LYS H . 19758 1 878 . 1 1 74 74 LYS HA H 1 3.863 0.020 . 1 . . . . . 74 LYS HA . 19758 1 879 . 1 1 74 74 LYS HB2 H 1 1.279 0.020 . 1 . . . . . 74 LYS HB2 . 19758 1 880 . 1 1 74 74 LYS HB3 H 1 1.489 0.020 . 1 . . . . . 74 LYS HB3 . 19758 1 881 . 1 1 74 74 LYS HG2 H 1 1.400 0.020 . 1 . . . . . 74 LYS HG2 . 19758 1 882 . 1 1 74 74 LYS HG3 H 1 1.542 0.020 . 1 . . . . . 74 LYS HG3 . 19758 1 883 . 1 1 74 74 LYS HD2 H 1 1.689 0.020 . 2 . . . . . 74 LYS QD . 19758 1 884 . 1 1 74 74 LYS HD3 H 1 1.689 0.020 . 2 . . . . . 74 LYS QD . 19758 1 885 . 1 1 74 74 LYS HE2 H 1 2.961 0.020 . 2 . . . . . 74 LYS QE . 19758 1 886 . 1 1 74 74 LYS HE3 H 1 2.961 0.020 . 2 . . . . . 74 LYS QE . 19758 1 887 . 1 1 74 74 LYS C C 13 178.199 0.300 . 1 . . . . . 74 LYS C . 19758 1 888 . 1 1 74 74 LYS CA C 13 59.087 0.300 . 1 . . . . . 74 LYS CA . 19758 1 889 . 1 1 74 74 LYS CB C 13 32.359 0.300 . 1 . . . . . 74 LYS CB . 19758 1 890 . 1 1 74 74 LYS CG C 13 25.795 0.300 . 1 . . . . . 74 LYS CG . 19758 1 891 . 1 1 74 74 LYS CD C 13 29.139 0.300 . 1 . . . . . 74 LYS CD . 19758 1 892 . 1 1 74 74 LYS CE C 13 42.036 0.300 . 1 . . . . . 74 LYS CE . 19758 1 893 . 1 1 74 74 LYS N N 15 116.565 0.300 . 1 . . . . . 74 LYS N . 19758 1 894 . 1 1 75 75 ALA H H 1 7.304 0.020 . 1 . . . . . 75 ALA H . 19758 1 895 . 1 1 75 75 ALA HA H 1 4.078 0.020 . 1 . . . . . 75 ALA HA . 19758 1 896 . 1 1 75 75 ALA HB1 H 1 1.456 0.020 . 1 . . . . . 75 ALA HB . 19758 1 897 . 1 1 75 75 ALA HB2 H 1 1.456 0.020 . 1 . . . . . 75 ALA HB . 19758 1 898 . 1 1 75 75 ALA HB3 H 1 1.456 0.020 . 1 . . . . . 75 ALA HB . 19758 1 899 . 1 1 75 75 ALA C C 13 179.399 0.300 . 1 . . . . . 75 ALA C . 19758 1 900 . 1 1 75 75 ALA CA C 13 55.126 0.300 . 1 . . . . . 75 ALA CA . 19758 1 901 . 1 1 75 75 ALA CB C 13 19.265 0.300 . 1 . . . . . 75 ALA CB . 19758 1 902 . 1 1 75 75 ALA N N 15 118.831 0.300 . 1 . . . . . 75 ALA N . 19758 1 903 . 1 1 76 76 TYR H H 1 7.023 0.020 . 1 . . . . . 76 TYR H . 19758 1 904 . 1 1 76 76 TYR HA H 1 3.835 0.020 . 1 . . . . . 76 TYR HA . 19758 1 905 . 1 1 76 76 TYR HB2 H 1 2.801 0.020 . 1 . . . . . 76 TYR HB2 . 19758 1 906 . 1 1 76 76 TYR HB3 H 1 2.984 0.020 . 1 . . . . . 76 TYR HB3 . 19758 1 907 . 1 1 76 76 TYR C C 13 178.148 0.300 . 1 . . . . . 76 TYR C . 19758 1 908 . 1 1 76 76 TYR CA C 13 62.452 0.300 . 1 . . . . . 76 TYR CA . 19758 1 909 . 1 1 76 76 TYR CB C 13 38.357 0.300 . 1 . . . . . 76 TYR CB . 19758 1 910 . 1 1 76 76 TYR N N 15 116.073 0.300 . 1 . . . . . 76 TYR N . 19758 1 911 . 1 1 77 77 SER H H 1 7.784 0.020 . 1 . . . . . 77 SER H . 19758 1 912 . 1 1 77 77 SER HA H 1 3.765 0.020 . 1 . . . . . 77 SER HA . 19758 1 913 . 1 1 77 77 SER HB2 H 1 3.922 0.020 . 2 . . . . . 77 SER QB . 19758 1 914 . 1 1 77 77 SER HB3 H 1 3.922 0.020 . 2 . . . . . 77 SER QB . 19758 1 915 . 1 1 77 77 SER C C 13 176.258 0.300 . 1 . . . . . 77 SER C . 19758 1 916 . 1 1 77 77 SER CA C 13 61.775 0.300 . 1 . . . . . 77 SER CA . 19758 1 917 . 1 1 77 77 SER CB C 13 62.254 0.300 . 1 . . . . . 77 SER CB . 19758 1 918 . 1 1 77 77 SER N N 15 114.439 0.300 . 1 . . . . . 77 SER N . 19758 1 919 . 1 1 78 78 ARG H H 1 7.714 0.020 . 1 . . . . . 78 ARG H . 19758 1 920 . 1 1 78 78 ARG HA H 1 3.877 0.020 . 1 . . . . . 78 ARG HA . 19758 1 921 . 1 1 78 78 ARG HB2 H 1 1.855 0.020 . 1 . . . . . 78 ARG HB2 . 19758 1 922 . 1 1 78 78 ARG HB3 H 1 1.966 0.020 . 1 . . . . . 78 ARG HB3 . 19758 1 923 . 1 1 78 78 ARG HG2 H 1 1.429 0.020 . 1 . . . . . 78 ARG HG2 . 19758 1 924 . 1 1 78 78 ARG HG3 H 1 1.695 0.020 . 1 . . . . . 78 ARG HG3 . 19758 1 925 . 1 1 78 78 ARG HD2 H 1 2.815 0.020 . 1 . . . . . 78 ARG HD2 . 19758 1 926 . 1 1 78 78 ARG HD3 H 1 3.125 0.020 . 1 . . . . . 78 ARG HD3 . 19758 1 927 . 1 1 78 78 ARG C C 13 177.317 0.300 . 1 . . . . . 78 ARG C . 19758 1 928 . 1 1 78 78 ARG CA C 13 56.615 0.300 . 1 . . . . . 78 ARG CA . 19758 1 929 . 1 1 78 78 ARG CB C 13 27.236 0.300 . 1 . . . . . 78 ARG CB . 19758 1 930 . 1 1 78 78 ARG CG C 13 26.729 0.300 . 1 . . . . . 78 ARG CG . 19758 1 931 . 1 1 78 78 ARG CD C 13 40.827 0.300 . 1 . . . . . 78 ARG CD . 19758 1 932 . 1 1 78 78 ARG N N 15 119.592 0.300 . 1 . . . . . 78 ARG N . 19758 1 933 . 1 1 79 79 ARG H H 1 8.399 0.020 . 1 . . . . . 79 ARG H . 19758 1 934 . 1 1 79 79 ARG HA H 1 3.721 0.020 . 1 . . . . . 79 ARG HA . 19758 1 935 . 1 1 79 79 ARG HB2 H 1 1.642 0.020 . 1 . . . . . 79 ARG HB2 . 19758 1 936 . 1 1 79 79 ARG HB3 H 1 2.152 0.020 . 1 . . . . . 79 ARG HB3 . 19758 1 937 . 1 1 79 79 ARG HG2 H 1 1.445 0.020 . 2 . . . . . 79 ARG QG . 19758 1 938 . 1 1 79 79 ARG HG3 H 1 1.445 0.020 . 2 . . . . . 79 ARG QG . 19758 1 939 . 1 1 79 79 ARG HD2 H 1 2.585 0.020 . 2 . . . . . 79 ARG QD . 19758 1 940 . 1 1 79 79 ARG HD3 H 1 2.585 0.020 . 2 . . . . . 79 ARG QD . 19758 1 941 . 1 1 79 79 ARG C C 13 179.057 0.300 . 1 . . . . . 79 ARG C . 19758 1 942 . 1 1 79 79 ARG CA C 13 61.368 0.300 . 1 . . . . . 79 ARG CA . 19758 1 943 . 1 1 79 79 ARG CB C 13 30.019 0.300 . 1 . . . . . 79 ARG CB . 19758 1 944 . 1 1 79 79 ARG CG C 13 28.754 0.300 . 1 . . . . . 79 ARG CG . 19758 1 945 . 1 1 79 79 ARG CD C 13 43.959 0.300 . 1 . . . . . 79 ARG CD . 19758 1 946 . 1 1 79 79 ARG N N 15 124.153 0.300 . 1 . . . . . 79 ARG N . 19758 1 947 . 1 1 80 80 GLY H H 1 8.735 0.020 . 1 . . . . . 80 GLY H . 19758 1 948 . 1 1 80 80 GLY HA2 H 1 2.943 0.020 . 1 . . . . . 80 GLY HA2 . 19758 1 949 . 1 1 80 80 GLY HA3 H 1 3.568 0.020 . 1 . . . . . 80 GLY HA3 . 19758 1 950 . 1 1 80 80 GLY C C 13 175.655 0.300 . 1 . . . . . 80 GLY C . 19758 1 951 . 1 1 80 80 GLY CA C 13 48.099 0.300 . 1 . . . . . 80 GLY CA . 19758 1 952 . 1 1 80 80 GLY N N 15 109.322 0.300 . 1 . . . . . 80 GLY N . 19758 1 953 . 1 1 81 81 ALA H H 1 7.721 0.020 . 1 . . . . . 81 ALA H . 19758 1 954 . 1 1 81 81 ALA HA H 1 4.425 0.020 . 1 . . . . . 81 ALA HA . 19758 1 955 . 1 1 81 81 ALA HB1 H 1 1.356 0.020 . 1 . . . . . 81 ALA HB . 19758 1 956 . 1 1 81 81 ALA HB2 H 1 1.356 0.020 . 1 . . . . . 81 ALA HB . 19758 1 957 . 1 1 81 81 ALA HB3 H 1 1.356 0.020 . 1 . . . . . 81 ALA HB . 19758 1 958 . 1 1 81 81 ALA C C 13 181.838 0.300 . 1 . . . . . 81 ALA C . 19758 1 959 . 1 1 81 81 ALA CA C 13 55.296 0.300 . 1 . . . . . 81 ALA CA . 19758 1 960 . 1 1 81 81 ALA CB C 13 18.415 0.300 . 1 . . . . . 81 ALA CB . 19758 1 961 . 1 1 81 81 ALA N N 15 124.760 0.300 . 1 . . . . . 81 ALA N . 19758 1 962 . 1 1 82 82 ALA H H 1 8.505 0.020 . 1 . . . . . 82 ALA H . 19758 1 963 . 1 1 82 82 ALA HA H 1 4.226 0.020 . 1 . . . . . 82 ALA HA . 19758 1 964 . 1 1 82 82 ALA HB1 H 1 1.783 0.020 . 1 . . . . . 82 ALA HB . 19758 1 965 . 1 1 82 82 ALA HB2 H 1 1.783 0.020 . 1 . . . . . 82 ALA HB . 19758 1 966 . 1 1 82 82 ALA HB3 H 1 1.783 0.020 . 1 . . . . . 82 ALA HB . 19758 1 967 . 1 1 82 82 ALA C C 13 178.470 0.300 . 1 . . . . . 82 ALA C . 19758 1 968 . 1 1 82 82 ALA CA C 13 56.064 0.300 . 1 . . . . . 82 ALA CA . 19758 1 969 . 1 1 82 82 ALA CB C 13 17.721 0.300 . 1 . . . . . 82 ALA CB . 19758 1 970 . 1 1 82 82 ALA N N 15 123.334 0.300 . 1 . . . . . 82 ALA N . 19758 1 971 . 1 1 83 83 ARG H H 1 9.124 0.020 . 1 . . . . . 83 ARG H . 19758 1 972 . 1 1 83 83 ARG HA H 1 3.827 0.020 . 1 . . . . . 83 ARG HA . 19758 1 973 . 1 1 83 83 ARG HB2 H 1 1.578 0.020 . 2 . . . . . 83 ARG QB . 19758 1 974 . 1 1 83 83 ARG HB3 H 1 1.578 0.020 . 2 . . . . . 83 ARG QB . 19758 1 975 . 1 1 83 83 ARG HG2 H 1 1.904 0.020 . 2 . . . . . 83 ARG QG . 19758 1 976 . 1 1 83 83 ARG HG3 H 1 1.904 0.020 . 2 . . . . . 83 ARG QG . 19758 1 977 . 1 1 83 83 ARG C C 13 178.324 0.300 . 1 . . . . . 83 ARG C . 19758 1 978 . 1 1 83 83 ARG CA C 13 60.574 0.300 . 1 . . . . . 83 ARG CA . 19758 1 979 . 1 1 83 83 ARG CB C 13 29.555 0.300 . 1 . . . . . 83 ARG CB . 19758 1 980 . 1 1 83 83 ARG CD C 13 43.430 0.300 . 1 . . . . . 83 ARG CD . 19758 1 981 . 1 1 83 83 ARG N N 15 115.976 0.300 . 1 . . . . . 83 ARG N . 19758 1 982 . 1 1 84 84 PHE H H 1 9.072 0.020 . 1 . . . . . 84 PHE H . 19758 1 983 . 1 1 84 84 PHE HA H 1 4.175 0.020 . 1 . . . . . 84 PHE HA . 19758 1 984 . 1 1 84 84 PHE HB2 H 1 3.319 0.020 . 1 . . . . . 84 PHE HB2 . 19758 1 985 . 1 1 84 84 PHE HB3 H 1 3.574 0.020 . 1 . . . . . 84 PHE HB3 . 19758 1 986 . 1 1 84 84 PHE HD1 H 1 7.385 0.020 . 1 . . . . . 84 PHE QD . 19758 1 987 . 1 1 84 84 PHE HD2 H 1 7.385 0.020 . 1 . . . . . 84 PHE QD . 19758 1 988 . 1 1 84 84 PHE HE1 H 1 7.223 0.020 . 1 . . . . . 84 PHE QE . 19758 1 989 . 1 1 84 84 PHE HE2 H 1 7.223 0.020 . 1 . . . . . 84 PHE QE . 19758 1 990 . 1 1 84 84 PHE HZ H 1 7.092 0.020 . 1 . . . . . 84 PHE HZ . 19758 1 991 . 1 1 84 84 PHE C C 13 179.458 0.300 . 1 . . . . . 84 PHE C . 19758 1 992 . 1 1 84 84 PHE CA C 13 59.329 0.300 . 1 . . . . . 84 PHE CA . 19758 1 993 . 1 1 84 84 PHE CB C 13 38.284 0.300 . 1 . . . . . 84 PHE CB . 19758 1 994 . 1 1 84 84 PHE CD1 C 13 131.129 0.300 . 1 . . . . . 84 PHE CD1 . 19758 1 995 . 1 1 84 84 PHE CE1 C 13 131.121 0.300 . 1 . . . . . 84 PHE CE1 . 19758 1 996 . 1 1 84 84 PHE CZ C 13 129.214 0.300 . 1 . . . . . 84 PHE CZ . 19758 1 997 . 1 1 84 84 PHE N N 15 122.541 0.300 . 1 . . . . . 84 PHE N . 19758 1 998 . 1 1 85 85 ALA H H 1 7.773 0.020 . 1 . . . . . 85 ALA H . 19758 1 999 . 1 1 85 85 ALA HA H 1 3.699 0.020 . 1 . . . . . 85 ALA HA . 19758 1 1000 . 1 1 85 85 ALA HB1 H 1 0.392 0.020 . 1 . . . . . 85 ALA HB . 19758 1 1001 . 1 1 85 85 ALA HB2 H 1 0.392 0.020 . 1 . . . . . 85 ALA HB . 19758 1 1002 . 1 1 85 85 ALA HB3 H 1 0.392 0.020 . 1 . . . . . 85 ALA HB . 19758 1 1003 . 1 1 85 85 ALA C C 13 179.139 0.300 . 1 . . . . . 85 ALA C . 19758 1 1004 . 1 1 85 85 ALA CA C 13 54.828 0.300 . 1 . . . . . 85 ALA CA . 19758 1 1005 . 1 1 85 85 ALA CB C 13 15.760 0.300 . 1 . . . . . 85 ALA CB . 19758 1 1006 . 1 1 85 85 ALA N N 15 123.340 0.300 . 1 . . . . . 85 ALA N . 19758 1 1007 . 1 1 86 86 LEU H H 1 7.354 0.020 . 1 . . . . . 86 LEU H . 19758 1 1008 . 1 1 86 86 LEU HA H 1 4.240 0.020 . 1 . . . . . 86 LEU HA . 19758 1 1009 . 1 1 86 86 LEU HB2 H 1 1.780 0.020 . 2 . . . . . 86 LEU QB . 19758 1 1010 . 1 1 86 86 LEU HB3 H 1 1.780 0.020 . 2 . . . . . 86 LEU QB . 19758 1 1011 . 1 1 86 86 LEU HG H 1 1.719 0.020 . 1 . . . . . 86 LEU HG . 19758 1 1012 . 1 1 86 86 LEU HD11 H 1 1.073 0.020 . 2 . . . . . 86 LEU QD1 . 19758 1 1013 . 1 1 86 86 LEU HD12 H 1 1.073 0.020 . 2 . . . . . 86 LEU QD1 . 19758 1 1014 . 1 1 86 86 LEU HD13 H 1 1.073 0.020 . 2 . . . . . 86 LEU QD1 . 19758 1 1015 . 1 1 86 86 LEU HD21 H 1 0.757 0.020 . 2 . . . . . 86 LEU QD2 . 19758 1 1016 . 1 1 86 86 LEU HD22 H 1 0.757 0.020 . 2 . . . . . 86 LEU QD2 . 19758 1 1017 . 1 1 86 86 LEU HD23 H 1 0.757 0.020 . 2 . . . . . 86 LEU QD2 . 19758 1 1018 . 1 1 86 86 LEU C C 13 175.645 0.300 . 1 . . . . . 86 LEU C . 19758 1 1019 . 1 1 86 86 LEU CA C 13 54.792 0.300 . 1 . . . . . 86 LEU CA . 19758 1 1020 . 1 1 86 86 LEU CB C 13 43.300 0.300 . 1 . . . . . 86 LEU CB . 19758 1 1021 . 1 1 86 86 LEU CG C 13 26.120 0.300 . 1 . . . . . 86 LEU CG . 19758 1 1022 . 1 1 86 86 LEU CD1 C 13 22.873 0.300 . 1 . . . . . 86 LEU CD1 . 19758 1 1023 . 1 1 86 86 LEU CD2 C 13 25.490 0.300 . 1 . . . . . 86 LEU CD2 . 19758 1 1024 . 1 1 86 86 LEU N N 15 116.988 0.300 . 1 . . . . . 86 LEU N . 19758 1 1025 . 1 1 87 87 GLN H H 1 8.043 0.020 . 1 . . . . . 87 GLN H . 19758 1 1026 . 1 1 87 87 GLN HA H 1 3.582 0.020 . 1 . . . . . 87 GLN HA . 19758 1 1027 . 1 1 87 87 GLN HB2 H 1 2.428 0.020 . 2 . . . . . 87 GLN QB . 19758 1 1028 . 1 1 87 87 GLN HB3 H 1 2.428 0.020 . 2 . . . . . 87 GLN QB . 19758 1 1029 . 1 1 87 87 GLN HG2 H 1 2.236 0.020 . 1 . . . . . 87 GLN HG2 . 19758 1 1030 . 1 1 87 87 GLN HG3 H 1 2.304 0.020 . 1 . . . . . 87 GLN HG3 . 19758 1 1031 . 1 1 87 87 GLN HE21 H 1 6.666 0.020 . 1 . . . . . 87 GLN HE21 . 19758 1 1032 . 1 1 87 87 GLN HE22 H 1 7.384 0.020 . 1 . . . . . 87 GLN HE22 . 19758 1 1033 . 1 1 87 87 GLN C C 13 175.440 0.300 . 1 . . . . . 87 GLN C . 19758 1 1034 . 1 1 87 87 GLN CA C 13 57.607 0.300 . 1 . . . . . 87 GLN CA . 19758 1 1035 . 1 1 87 87 GLN CB C 13 25.642 0.300 . 1 . . . . . 87 GLN CB . 19758 1 1036 . 1 1 87 87 GLN CG C 13 34.359 0.300 . 1 . . . . . 87 GLN CG . 19758 1 1037 . 1 1 87 87 GLN N N 15 113.309 0.300 . 1 . . . . . 87 GLN N . 19758 1 1038 . 1 1 87 87 GLN NE2 N 15 112.230 0.300 . 1 . . . . . 87 GLN NE2 . 19758 1 1039 . 1 1 88 88 LYS H H 1 8.474 0.020 . 1 . . . . . 88 LYS H . 19758 1 1040 . 1 1 88 88 LYS HA H 1 4.659 0.020 . 1 . . . . . 88 LYS HA . 19758 1 1041 . 1 1 88 88 LYS HB2 H 1 1.647 0.020 . 1 . . . . . 88 LYS HB2 . 19758 1 1042 . 1 1 88 88 LYS HB3 H 1 1.696 0.020 . 1 . . . . . 88 LYS HB3 . 19758 1 1043 . 1 1 88 88 LYS HG2 H 1 1.371 0.020 . 1 . . . . . 88 LYS HG2 . 19758 1 1044 . 1 1 88 88 LYS HG3 H 1 1.425 0.020 . 1 . . . . . 88 LYS HG3 . 19758 1 1045 . 1 1 88 88 LYS HD2 H 1 1.873 0.020 . 2 . . . . . 88 LYS QD . 19758 1 1046 . 1 1 88 88 LYS HD3 H 1 1.873 0.020 . 2 . . . . . 88 LYS QD . 19758 1 1047 . 1 1 88 88 LYS HE2 H 1 2.724 0.020 . 2 . . . . . 88 LYS QE . 19758 1 1048 . 1 1 88 88 LYS HE3 H 1 2.724 0.020 . 2 . . . . . 88 LYS QE . 19758 1 1049 . 1 1 88 88 LYS C C 13 177.141 0.300 . 1 . . . . . 88 LYS C . 19758 1 1050 . 1 1 88 88 LYS CA C 13 54.817 0.300 . 1 . . . . . 88 LYS CA . 19758 1 1051 . 1 1 88 88 LYS CB C 13 30.174 0.300 . 1 . . . . . 88 LYS CB . 19758 1 1052 . 1 1 88 88 LYS CG C 13 24.524 0.300 . 1 . . . . . 88 LYS CG . 19758 1 1053 . 1 1 88 88 LYS CD C 13 30.696 0.300 . 1 . . . . . 88 LYS CD . 19758 1 1054 . 1 1 88 88 LYS CE C 13 41.948 0.300 . 1 . . . . . 88 LYS CE . 19758 1 1055 . 1 1 88 88 LYS N N 15 122.833 0.300 . 1 . . . . . 88 LYS N . 19758 1 1056 . 1 1 89 89 LEU H H 1 7.379 0.020 . 1 . . . . . 89 LEU H . 19758 1 1057 . 1 1 89 89 LEU HA H 1 3.735 0.020 . 1 . . . . . 89 LEU HA . 19758 1 1058 . 1 1 89 89 LEU HB2 H 1 1.273 0.020 . 1 . . . . . 89 LEU HB2 . 19758 1 1059 . 1 1 89 89 LEU HB3 H 1 1.955 0.020 . 1 . . . . . 89 LEU HB3 . 19758 1 1060 . 1 1 89 89 LEU HG H 1 1.691 0.020 . 1 . . . . . 89 LEU HG . 19758 1 1061 . 1 1 89 89 LEU HD11 H 1 0.948 0.020 . 2 . . . . . 89 LEU QD1 . 19758 1 1062 . 1 1 89 89 LEU HD12 H 1 0.948 0.020 . 2 . . . . . 89 LEU QD1 . 19758 1 1063 . 1 1 89 89 LEU HD13 H 1 0.948 0.020 . 2 . . . . . 89 LEU QD1 . 19758 1 1064 . 1 1 89 89 LEU HD21 H 1 0.954 0.020 . 2 . . . . . 89 LEU QD2 . 19758 1 1065 . 1 1 89 89 LEU HD22 H 1 0.954 0.020 . 2 . . . . . 89 LEU QD2 . 19758 1 1066 . 1 1 89 89 LEU HD23 H 1 0.954 0.020 . 2 . . . . . 89 LEU QD2 . 19758 1 1067 . 1 1 89 89 LEU C C 13 178.578 0.300 . 1 . . . . . 89 LEU C . 19758 1 1068 . 1 1 89 89 LEU CA C 13 59.387 0.300 . 1 . . . . . 89 LEU CA . 19758 1 1069 . 1 1 89 89 LEU CB C 13 41.908 0.300 . 1 . . . . . 89 LEU CB . 19758 1 1070 . 1 1 89 89 LEU CG C 13 27.997 0.300 . 1 . . . . . 89 LEU CG . 19758 1 1071 . 1 1 89 89 LEU CD1 C 13 23.698 0.300 . 1 . . . . . 89 LEU CD1 . 19758 1 1072 . 1 1 89 89 LEU CD2 C 13 25.389 0.300 . 1 . . . . . 89 LEU CD2 . 19758 1 1073 . 1 1 89 89 LEU N N 15 118.256 0.300 . 1 . . . . . 89 LEU N . 19758 1 1074 . 1 1 90 90 GLU H H 1 8.886 0.020 . 1 . . . . . 90 GLU H . 19758 1 1075 . 1 1 90 90 GLU HA H 1 3.901 0.020 . 1 . . . . . 90 GLU HA . 19758 1 1076 . 1 1 90 90 GLU HB2 H 1 1.972 0.020 . 1 . . . . . 90 GLU HB2 . 19758 1 1077 . 1 1 90 90 GLU HB3 H 1 2.009 0.020 . 1 . . . . . 90 GLU HB3 . 19758 1 1078 . 1 1 90 90 GLU HG2 H 1 2.318 0.020 . 2 . . . . . 90 GLU QG . 19758 1 1079 . 1 1 90 90 GLU HG3 H 1 2.318 0.020 . 2 . . . . . 90 GLU QG . 19758 1 1080 . 1 1 90 90 GLU C C 13 179.747 0.300 . 1 . . . . . 90 GLU C . 19758 1 1081 . 1 1 90 90 GLU CA C 13 60.246 0.300 . 1 . . . . . 90 GLU CA . 19758 1 1082 . 1 1 90 90 GLU CB C 13 28.812 0.300 . 1 . . . . . 90 GLU CB . 19758 1 1083 . 1 1 90 90 GLU CG C 13 36.716 0.300 . 1 . . . . . 90 GLU CG . 19758 1 1084 . 1 1 90 90 GLU N N 15 118.572 0.300 . 1 . . . . . 90 GLU N . 19758 1 1085 . 1 1 91 91 GLU H H 1 8.747 0.020 . 1 . . . . . 91 GLU H . 19758 1 1086 . 1 1 91 91 GLU HA H 1 4.008 0.020 . 1 . . . . . 91 GLU HA . 19758 1 1087 . 1 1 91 91 GLU HB2 H 1 1.829 0.020 . 1 . . . . . 91 GLU HB2 . 19758 1 1088 . 1 1 91 91 GLU HB3 H 1 2.086 0.020 . 1 . . . . . 91 GLU HB3 . 19758 1 1089 . 1 1 91 91 GLU HG2 H 1 2.315 0.020 . 2 . . . . . 91 GLU QG . 19758 1 1090 . 1 1 91 91 GLU HG3 H 1 2.315 0.020 . 2 . . . . . 91 GLU QG . 19758 1 1091 . 1 1 91 91 GLU C C 13 178.702 0.300 . 1 . . . . . 91 GLU C . 19758 1 1092 . 1 1 91 91 GLU CA C 13 59.975 0.300 . 1 . . . . . 91 GLU CA . 19758 1 1093 . 1 1 91 91 GLU CB C 13 29.048 0.300 . 1 . . . . . 91 GLU CB . 19758 1 1094 . 1 1 91 91 GLU CG C 13 37.190 0.300 . 1 . . . . . 91 GLU CG . 19758 1 1095 . 1 1 91 91 GLU N N 15 119.572 0.300 . 1 . . . . . 91 GLU N . 19758 1 1096 . 1 1 92 92 ALA H H 1 8.521 0.020 . 1 . . . . . 92 ALA H . 19758 1 1097 . 1 1 92 92 ALA HA H 1 4.032 0.020 . 1 . . . . . 92 ALA HA . 19758 1 1098 . 1 1 92 92 ALA HB1 H 1 1.580 0.020 . 1 . . . . . 92 ALA HB . 19758 1 1099 . 1 1 92 92 ALA HB2 H 1 1.580 0.020 . 1 . . . . . 92 ALA HB . 19758 1 1100 . 1 1 92 92 ALA HB3 H 1 1.580 0.020 . 1 . . . . . 92 ALA HB . 19758 1 1101 . 1 1 92 92 ALA C C 13 178.719 0.300 . 1 . . . . . 92 ALA C . 19758 1 1102 . 1 1 92 92 ALA CA C 13 55.464 0.300 . 1 . . . . . 92 ALA CA . 19758 1 1103 . 1 1 92 92 ALA CB C 13 18.578 0.300 . 1 . . . . . 92 ALA CB . 19758 1 1104 . 1 1 92 92 ALA N N 15 122.532 0.300 . 1 . . . . . 92 ALA N . 19758 1 1105 . 1 1 93 93 LYS H H 1 8.344 0.020 . 1 . . . . . 93 LYS H . 19758 1 1106 . 1 1 93 93 LYS HA H 1 3.822 0.020 . 1 . . . . . 93 LYS HA . 19758 1 1107 . 1 1 93 93 LYS HB2 H 1 1.809 0.020 . 1 . . . . . 93 LYS HB2 . 19758 1 1108 . 1 1 93 93 LYS HB3 H 1 2.131 0.020 . 1 . . . . . 93 LYS HB3 . 19758 1 1109 . 1 1 93 93 LYS HG2 H 1 1.249 0.020 . 2 . . . . . 93 LYS QG . 19758 1 1110 . 1 1 93 93 LYS HG3 H 1 1.249 0.020 . 2 . . . . . 93 LYS QG . 19758 1 1111 . 1 1 93 93 LYS HD2 H 1 1.489 0.020 . 2 . . . . . 93 LYS QD . 19758 1 1112 . 1 1 93 93 LYS HD3 H 1 1.489 0.020 . 2 . . . . . 93 LYS QD . 19758 1 1113 . 1 1 93 93 LYS C C 13 177.512 0.300 . 1 . . . . . 93 LYS C . 19758 1 1114 . 1 1 93 93 LYS CA C 13 59.807 0.300 . 1 . . . . . 93 LYS CA . 19758 1 1115 . 1 1 93 93 LYS CB C 13 32.854 0.300 . 1 . . . . . 93 LYS CB . 19758 1 1116 . 1 1 93 93 LYS CG C 13 24.502 0.300 . 1 . . . . . 93 LYS CG . 19758 1 1117 . 1 1 93 93 LYS CD C 13 30.455 0.300 . 1 . . . . . 93 LYS CD . 19758 1 1118 . 1 1 93 93 LYS N N 15 117.698 0.300 . 1 . . . . . 93 LYS N . 19758 1 1119 . 1 1 94 94 LYS H H 1 7.374 0.020 . 1 . . . . . 94 LYS H . 19758 1 1120 . 1 1 94 94 LYS HA H 1 4.136 0.020 . 1 . . . . . 94 LYS HA . 19758 1 1121 . 1 1 94 94 LYS HB2 H 1 1.923 0.020 . 2 . . . . . 94 LYS QB . 19758 1 1122 . 1 1 94 94 LYS HB3 H 1 1.923 0.020 . 2 . . . . . 94 LYS QB . 19758 1 1123 . 1 1 94 94 LYS HG2 H 1 1.566 0.020 . 1 . . . . . 94 LYS HG2 . 19758 1 1124 . 1 1 94 94 LYS HG3 H 1 1.647 0.020 . 1 . . . . . 94 LYS HG3 . 19758 1 1125 . 1 1 94 94 LYS HD2 H 1 1.671 0.020 . 2 . . . . . 94 LYS QD . 19758 1 1126 . 1 1 94 94 LYS HD3 H 1 1.671 0.020 . 2 . . . . . 94 LYS QD . 19758 1 1127 . 1 1 94 94 LYS HE2 H 1 2.979 0.020 . 2 . . . . . 94 LYS QE . 19758 1 1128 . 1 1 94 94 LYS HE3 H 1 2.979 0.020 . 2 . . . . . 94 LYS QE . 19758 1 1129 . 1 1 94 94 LYS C C 13 179.866 0.300 . 1 . . . . . 94 LYS C . 19758 1 1130 . 1 1 94 94 LYS CA C 13 59.059 0.300 . 1 . . . . . 94 LYS CA . 19758 1 1131 . 1 1 94 94 LYS CB C 13 32.071 0.300 . 1 . . . . . 94 LYS CB . 19758 1 1132 . 1 1 94 94 LYS CG C 13 25.292 0.300 . 1 . . . . . 94 LYS CG . 19758 1 1133 . 1 1 94 94 LYS CD C 13 29.064 0.300 . 1 . . . . . 94 LYS CD . 19758 1 1134 . 1 1 94 94 LYS CE C 13 42.052 0.300 . 1 . . . . . 94 LYS CE . 19758 1 1135 . 1 1 94 94 LYS N N 15 116.276 0.300 . 1 . . . . . 94 LYS N . 19758 1 1136 . 1 1 95 95 ASP H H 1 7.535 0.020 . 1 . . . . . 95 ASP H . 19758 1 1137 . 1 1 95 95 ASP HA H 1 4.646 0.020 . 1 . . . . . 95 ASP HA . 19758 1 1138 . 1 1 95 95 ASP HB2 H 1 2.492 0.020 . 1 . . . . . 95 ASP HB2 . 19758 1 1139 . 1 1 95 95 ASP HB3 H 1 2.782 0.020 . 1 . . . . . 95 ASP HB3 . 19758 1 1140 . 1 1 95 95 ASP C C 13 178.773 0.300 . 1 . . . . . 95 ASP C . 19758 1 1141 . 1 1 95 95 ASP CA C 13 58.234 0.300 . 1 . . . . . 95 ASP CA . 19758 1 1142 . 1 1 95 95 ASP CB C 13 39.606 0.300 . 1 . . . . . 95 ASP CB . 19758 1 1143 . 1 1 95 95 ASP N N 15 121.853 0.300 . 1 . . . . . 95 ASP N . 19758 1 1144 . 1 1 96 96 TYR H H 1 8.111 0.020 . 1 . . . . . 96 TYR H . 19758 1 1145 . 1 1 96 96 TYR HA H 1 4.290 0.020 . 1 . . . . . 96 TYR HA . 19758 1 1146 . 1 1 96 96 TYR HB2 H 1 2.655 0.020 . 1 . . . . . 96 TYR HB2 . 19758 1 1147 . 1 1 96 96 TYR HB3 H 1 2.958 0.020 . 1 . . . . . 96 TYR HB3 . 19758 1 1148 . 1 1 96 96 TYR HD1 H 1 7.385 0.020 . 1 . . . . . 96 TYR QD . 19758 1 1149 . 1 1 96 96 TYR HD2 H 1 7.385 0.020 . 1 . . . . . 96 TYR QD . 19758 1 1150 . 1 1 96 96 TYR HE1 H 1 6.610 0.020 . 1 . . . . . 96 TYR QE . 19758 1 1151 . 1 1 96 96 TYR HE2 H 1 6.610 0.020 . 1 . . . . . 96 TYR QE . 19758 1 1152 . 1 1 96 96 TYR C C 13 178.743 0.300 . 1 . . . . . 96 TYR C . 19758 1 1153 . 1 1 96 96 TYR CA C 13 63.468 0.300 . 1 . . . . . 96 TYR CA . 19758 1 1154 . 1 1 96 96 TYR CB C 13 37.734 0.300 . 1 . . . . . 96 TYR CB . 19758 1 1155 . 1 1 96 96 TYR CD1 C 13 131.959 0.300 . 1 . . . . . 96 TYR CD1 . 19758 1 1156 . 1 1 96 96 TYR CE1 C 13 118.025 0.300 . 1 . . . . . 96 TYR CE1 . 19758 1 1157 . 1 1 96 96 TYR N N 15 118.122 0.300 . 1 . . . . . 96 TYR N . 19758 1 1158 . 1 1 97 97 GLU H H 1 8.740 0.020 . 1 . . . . . 97 GLU H . 19758 1 1159 . 1 1 97 97 GLU HA H 1 3.883 0.020 . 1 . . . . . 97 GLU HA . 19758 1 1160 . 1 1 97 97 GLU HB2 H 1 1.975 0.020 . 1 . . . . . 97 GLU HB2 . 19758 1 1161 . 1 1 97 97 GLU HB3 H 1 2.015 0.020 . 1 . . . . . 97 GLU HB3 . 19758 1 1162 . 1 1 97 97 GLU HG2 H 1 2.319 0.020 . 2 . . . . . 97 GLU QG . 19758 1 1163 . 1 1 97 97 GLU HG3 H 1 2.319 0.020 . 2 . . . . . 97 GLU QG . 19758 1 1164 . 1 1 97 97 GLU C C 13 179.937 0.300 . 1 . . . . . 97 GLU C . 19758 1 1165 . 1 1 97 97 GLU CA C 13 60.023 0.300 . 1 . . . . . 97 GLU CA . 19758 1 1166 . 1 1 97 97 GLU CB C 13 28.708 0.300 . 1 . . . . . 97 GLU CB . 19758 1 1167 . 1 1 97 97 GLU CG C 13 36.697 0.300 . 1 . . . . . 97 GLU CG . 19758 1 1168 . 1 1 97 97 GLU N N 15 119.614 0.300 . 1 . . . . . 97 GLU N . 19758 1 1169 . 1 1 98 98 ARG H H 1 7.879 0.020 . 1 . . . . . 98 ARG H . 19758 1 1170 . 1 1 98 98 ARG HA H 1 3.926 0.020 . 1 . . . . . 98 ARG HA . 19758 1 1171 . 1 1 98 98 ARG HB2 H 1 1.656 0.020 . 1 . . . . . 98 ARG HB2 . 19758 1 1172 . 1 1 98 98 ARG HB3 H 1 1.786 0.020 . 1 . . . . . 98 ARG HB3 . 19758 1 1173 . 1 1 98 98 ARG HG2 H 1 0.477 0.020 . 1 . . . . . 98 ARG HG2 . 19758 1 1174 . 1 1 98 98 ARG HG3 H 1 0.728 0.020 . 1 . . . . . 98 ARG HG3 . 19758 1 1175 . 1 1 98 98 ARG HD2 H 1 2.777 0.020 . 1 . . . . . 98 ARG HD2 . 19758 1 1176 . 1 1 98 98 ARG HD3 H 1 3.137 0.020 . 1 . . . . . 98 ARG HD3 . 19758 1 1177 . 1 1 98 98 ARG C C 13 178.500 0.300 . 1 . . . . . 98 ARG C . 19758 1 1178 . 1 1 98 98 ARG CA C 13 58.038 0.300 . 1 . . . . . 98 ARG CA . 19758 1 1179 . 1 1 98 98 ARG CB C 13 28.185 0.300 . 1 . . . . . 98 ARG CB . 19758 1 1180 . 1 1 98 98 ARG CG C 13 24.902 0.300 . 1 . . . . . 98 ARG CG . 19758 1 1181 . 1 1 98 98 ARG CD C 13 42.945 0.300 . 1 . . . . . 98 ARG CD . 19758 1 1182 . 1 1 98 98 ARG N N 15 122.465 0.300 . 1 . . . . . 98 ARG N . 19758 1 1183 . 1 1 99 99 VAL H H 1 7.880 0.020 . 1 . . . . . 99 VAL H . 19758 1 1184 . 1 1 99 99 VAL HA H 1 3.340 0.020 . 1 . . . . . 99 VAL HA . 19758 1 1185 . 1 1 99 99 VAL HB H 1 2.521 0.020 . 1 . . . . . 99 VAL HB . 19758 1 1186 . 1 1 99 99 VAL HG11 H 1 0.815 0.020 . 2 . . . . . 99 VAL QG1 . 19758 1 1187 . 1 1 99 99 VAL HG12 H 1 0.815 0.020 . 2 . . . . . 99 VAL QG1 . 19758 1 1188 . 1 1 99 99 VAL HG13 H 1 0.815 0.020 . 2 . . . . . 99 VAL QG1 . 19758 1 1189 . 1 1 99 99 VAL HG21 H 1 1.088 0.020 . 2 . . . . . 99 VAL QG2 . 19758 1 1190 . 1 1 99 99 VAL HG22 H 1 1.088 0.020 . 2 . . . . . 99 VAL QG2 . 19758 1 1191 . 1 1 99 99 VAL HG23 H 1 1.088 0.020 . 2 . . . . . 99 VAL QG2 . 19758 1 1192 . 1 1 99 99 VAL C C 13 177.063 0.300 . 1 . . . . . 99 VAL C . 19758 1 1193 . 1 1 99 99 VAL CA C 13 67.549 0.300 . 1 . . . . . 99 VAL CA . 19758 1 1194 . 1 1 99 99 VAL CB C 13 30.535 0.300 . 1 . . . . . 99 VAL CB . 19758 1 1195 . 1 1 99 99 VAL CG1 C 13 21.410 0.300 . 1 . . . . . 99 VAL CG1 . 19758 1 1196 . 1 1 99 99 VAL CG2 C 13 23.868 0.300 . 1 . . . . . 99 VAL CG2 . 19758 1 1197 . 1 1 99 99 VAL N N 15 119.361 0.300 . 1 . . . . . 99 VAL N . 19758 1 1198 . 1 1 100 100 LEU H H 1 7.343 0.020 . 1 . . . . . 100 LEU H . 19758 1 1199 . 1 1 100 100 LEU HA H 1 4.165 0.020 . 1 . . . . . 100 LEU HA . 19758 1 1200 . 1 1 100 100 LEU HB2 H 1 1.424 0.020 . 1 . . . . . 100 LEU HB2 . 19758 1 1201 . 1 1 100 100 LEU HB3 H 1 1.756 0.020 . 1 . . . . . 100 LEU HB3 . 19758 1 1202 . 1 1 100 100 LEU HG H 1 0.968 0.020 . 1 . . . . . 100 LEU HG . 19758 1 1203 . 1 1 100 100 LEU HD11 H 1 0.790 0.020 . 2 . . . . . 100 LEU QD1 . 19758 1 1204 . 1 1 100 100 LEU HD12 H 1 0.790 0.020 . 2 . . . . . 100 LEU QD1 . 19758 1 1205 . 1 1 100 100 LEU HD13 H 1 0.790 0.020 . 2 . . . . . 100 LEU QD1 . 19758 1 1206 . 1 1 100 100 LEU HD21 H 1 0.997 0.020 . 2 . . . . . 100 LEU QD2 . 19758 1 1207 . 1 1 100 100 LEU HD22 H 1 0.997 0.020 . 2 . . . . . 100 LEU QD2 . 19758 1 1208 . 1 1 100 100 LEU HD23 H 1 0.997 0.020 . 2 . . . . . 100 LEU QD2 . 19758 1 1209 . 1 1 100 100 LEU C C 13 179.204 0.300 . 1 . . . . . 100 LEU C . 19758 1 1210 . 1 1 100 100 LEU CA C 13 56.546 0.300 . 1 . . . . . 100 LEU CA . 19758 1 1211 . 1 1 100 100 LEU CB C 13 41.963 0.300 . 1 . . . . . 100 LEU CB . 19758 1 1212 . 1 1 100 100 LEU CG C 13 23.705 0.300 . 1 . . . . . 100 LEU CG . 19758 1 1213 . 1 1 100 100 LEU CD1 C 13 26.258 0.300 . 1 . . . . . 100 LEU CD1 . 19758 1 1214 . 1 1 100 100 LEU CD2 C 13 23.806 0.300 . 1 . . . . . 100 LEU CD2 . 19758 1 1215 . 1 1 100 100 LEU N N 15 116.283 0.300 . 1 . . . . . 100 LEU N . 19758 1 1216 . 1 1 101 101 GLU H H 1 7.610 0.020 . 1 . . . . . 101 GLU H . 19758 1 1217 . 1 1 101 101 GLU HA H 1 3.952 0.020 . 1 . . . . . 101 GLU HA . 19758 1 1218 . 1 1 101 101 GLU HB2 H 1 2.086 0.020 . 1 . . . . . 101 GLU HB2 . 19758 1 1219 . 1 1 101 101 GLU HB3 H 1 2.181 0.020 . 1 . . . . . 101 GLU HB3 . 19758 1 1220 . 1 1 101 101 GLU HG2 H 1 2.135 0.020 . 1 . . . . . 101 GLU HG2 . 19758 1 1221 . 1 1 101 101 GLU HG3 H 1 2.435 0.020 . 1 . . . . . 101 GLU HG3 . 19758 1 1222 . 1 1 101 101 GLU C C 13 178.649 0.300 . 1 . . . . . 101 GLU C . 19758 1 1223 . 1 1 101 101 GLU CA C 13 58.777 0.300 . 1 . . . . . 101 GLU CA . 19758 1 1224 . 1 1 101 101 GLU CB C 13 29.916 0.300 . 1 . . . . . 101 GLU CB . 19758 1 1225 . 1 1 101 101 GLU CG C 13 36.313 0.300 . 1 . . . . . 101 GLU CG . 19758 1 1226 . 1 1 101 101 GLU N N 15 119.283 0.300 . 1 . . . . . 101 GLU N . 19758 1 1227 . 1 1 102 102 LEU H H 1 7.462 0.020 . 1 . . . . . 102 LEU H . 19758 1 1228 . 1 1 102 102 LEU HA H 1 4.163 0.020 . 1 . . . . . 102 LEU HA . 19758 1 1229 . 1 1 102 102 LEU HB2 H 1 1.613 0.020 . 1 . . . . . 102 LEU HB2 . 19758 1 1230 . 1 1 102 102 LEU HB3 H 1 1.915 0.020 . 1 . . . . . 102 LEU HB3 . 19758 1 1231 . 1 1 102 102 LEU HG H 1 1.632 0.020 . 1 . . . . . 102 LEU HG . 19758 1 1232 . 1 1 102 102 LEU HD11 H 1 0.793 0.020 . 2 . . . . . 102 LEU QD1 . 19758 1 1233 . 1 1 102 102 LEU HD12 H 1 0.793 0.020 . 2 . . . . . 102 LEU QD1 . 19758 1 1234 . 1 1 102 102 LEU HD13 H 1 0.793 0.020 . 2 . . . . . 102 LEU QD1 . 19758 1 1235 . 1 1 102 102 LEU HD21 H 1 0.966 0.020 . 2 . . . . . 102 LEU QD2 . 19758 1 1236 . 1 1 102 102 LEU HD22 H 1 0.966 0.020 . 2 . . . . . 102 LEU QD2 . 19758 1 1237 . 1 1 102 102 LEU HD23 H 1 0.966 0.020 . 2 . . . . . 102 LEU QD2 . 19758 1 1238 . 1 1 102 102 LEU C C 13 178.164 0.300 . 1 . . . . . 102 LEU C . 19758 1 1239 . 1 1 102 102 LEU CA C 13 56.616 0.300 . 1 . . . . . 102 LEU CA . 19758 1 1240 . 1 1 102 102 LEU CB C 13 43.588 0.300 . 1 . . . . . 102 LEU CB . 19758 1 1241 . 1 1 102 102 LEU CG C 13 27.466 0.300 . 1 . . . . . 102 LEU CG . 19758 1 1242 . 1 1 102 102 LEU CD1 C 13 26.023 0.300 . 1 . . . . . 102 LEU CD1 . 19758 1 1243 . 1 1 102 102 LEU CD2 C 13 22.621 0.300 . 1 . . . . . 102 LEU CD2 . 19758 1 1244 . 1 1 102 102 LEU N N 15 119.168 0.300 . 1 . . . . . 102 LEU N . 19758 1 1245 . 1 1 103 103 GLU H H 1 9.188 0.020 . 1 . . . . . 103 GLU H . 19758 1 1246 . 1 1 103 103 GLU HA H 1 4.624 0.020 . 1 . . . . . 103 GLU HA . 19758 1 1247 . 1 1 103 103 GLU HB2 H 1 1.868 0.020 . 1 . . . . . 103 GLU HB2 . 19758 1 1248 . 1 1 103 103 GLU HB3 H 1 2.092 0.020 . 1 . . . . . 103 GLU HB3 . 19758 1 1249 . 1 1 103 103 GLU HG2 H 1 2.220 0.020 . 2 . . . . . 103 GLU QG . 19758 1 1250 . 1 1 103 103 GLU HG3 H 1 2.220 0.020 . 2 . . . . . 103 GLU QG . 19758 1 1251 . 1 1 103 103 GLU C C 13 182.830 0.300 . 1 . . . . . 103 GLU C . 19758 1 1252 . 1 1 103 103 GLU CA C 13 53.926 0.300 . 1 . . . . . 103 GLU CA . 19758 1 1253 . 1 1 103 103 GLU CB C 13 31.462 0.300 . 1 . . . . . 103 GLU CB . 19758 1 1254 . 1 1 103 103 GLU CG C 13 37.069 0.300 . 1 . . . . . 103 GLU CG . 19758 1 1255 . 1 1 103 103 GLU N N 15 121.618 0.300 . 1 . . . . . 103 GLU N . 19758 1 1256 . 1 1 104 104 PRO HA H 1 4.651 0.020 . 1 . . . . . 104 PRO HA . 19758 1 1257 . 1 1 104 104 PRO HB2 H 1 1.817 0.020 . 1 . . . . . 104 PRO HB2 . 19758 1 1258 . 1 1 104 104 PRO HB3 H 1 2.368 0.020 . 1 . . . . . 104 PRO HB3 . 19758 1 1259 . 1 1 104 104 PRO HG2 H 1 1.998 0.020 . 2 . . . . . 104 PRO QG . 19758 1 1260 . 1 1 104 104 PRO HG3 H 1 1.998 0.020 . 2 . . . . . 104 PRO QG . 19758 1 1261 . 1 1 104 104 PRO HD2 H 1 3.572 0.020 . 2 . . . . . 104 PRO QD . 19758 1 1262 . 1 1 104 104 PRO HD3 H 1 3.572 0.020 . 2 . . . . . 104 PRO QD . 19758 1 1263 . 1 1 104 104 PRO C C 13 177.378 0.300 . 1 . . . . . 104 PRO C . 19758 1 1264 . 1 1 104 104 PRO CA C 13 64.510 0.300 . 1 . . . . . 104 PRO CA . 19758 1 1265 . 1 1 104 104 PRO CB C 13 32.279 0.300 . 1 . . . . . 104 PRO CB . 19758 1 1266 . 1 1 104 104 PRO CG C 13 27.156 0.300 . 1 . . . . . 104 PRO CG . 19758 1 1267 . 1 1 104 104 PRO CD C 13 49.809 0.300 . 1 . . . . . 104 PRO CD . 19758 1 1268 . 1 1 105 105 ASN H H 1 8.448 0.020 . 1 . . . . . 105 ASN H . 19758 1 1269 . 1 1 105 105 ASN HA H 1 4.611 0.020 . 1 . . . . . 105 ASN HA . 19758 1 1270 . 1 1 105 105 ASN HB2 H 1 2.857 0.020 . 1 . . . . . 105 ASN HB2 . 19758 1 1271 . 1 1 105 105 ASN HB3 H 1 2.930 0.020 . 1 . . . . . 105 ASN HB3 . 19758 1 1272 . 1 1 105 105 ASN HD21 H 1 7.568 0.020 . 1 . . . . . 105 ASN HD21 . 19758 1 1273 . 1 1 105 105 ASN HD22 H 1 6.948 0.020 . 1 . . . . . 105 ASN HD22 . 19758 1 1274 . 1 1 105 105 ASN C C 13 174.736 0.300 . 1 . . . . . 105 ASN C . 19758 1 1275 . 1 1 105 105 ASN CA C 13 52.658 0.300 . 1 . . . . . 105 ASN CA . 19758 1 1276 . 1 1 105 105 ASN CB C 13 37.859 0.300 . 1 . . . . . 105 ASN CB . 19758 1 1277 . 1 1 105 105 ASN N N 15 113.675 0.300 . 1 . . . . . 105 ASN N . 19758 1 1278 . 1 1 105 105 ASN ND2 N 15 113.206 0.300 . 1 . . . . . 105 ASN ND2 . 19758 1 1279 . 1 1 106 106 ASN H H 1 7.663 0.020 . 1 . . . . . 106 ASN H . 19758 1 1280 . 1 1 106 106 ASN HA H 1 4.469 0.020 . 1 . . . . . 106 ASN HA . 19758 1 1281 . 1 1 106 106 ASN HB2 H 1 2.789 0.020 . 1 . . . . . 106 ASN HB2 . 19758 1 1282 . 1 1 106 106 ASN HB3 H 1 2.967 0.020 . 1 . . . . . 106 ASN HB3 . 19758 1 1283 . 1 1 106 106 ASN HD21 H 1 6.930 0.020 . 1 . . . . . 106 ASN HD21 . 19758 1 1284 . 1 1 106 106 ASN HD22 H 1 7.939 0.020 . 1 . . . . . 106 ASN HD22 . 19758 1 1285 . 1 1 106 106 ASN C C 13 174.906 0.300 . 1 . . . . . 106 ASN C . 19758 1 1286 . 1 1 106 106 ASN CA C 13 55.415 0.300 . 1 . . . . . 106 ASN CA . 19758 1 1287 . 1 1 106 106 ASN CB C 13 39.317 0.300 . 1 . . . . . 106 ASN CB . 19758 1 1288 . 1 1 106 106 ASN N N 15 119.799 0.300 . 1 . . . . . 106 ASN N . 19758 1 1289 . 1 1 106 106 ASN ND2 N 15 114.287 0.300 . 1 . . . . . 106 ASN ND2 . 19758 1 1290 . 1 1 107 107 PHE H H 1 8.538 0.020 . 1 . . . . . 107 PHE H . 19758 1 1291 . 1 1 107 107 PHE HA H 1 4.250 0.020 . 1 . . . . . 107 PHE HA . 19758 1 1292 . 1 1 107 107 PHE HB2 H 1 3.058 0.020 . 1 . . . . . 107 PHE HB2 . 19758 1 1293 . 1 1 107 107 PHE HB3 H 1 3.285 0.020 . 1 . . . . . 107 PHE HB3 . 19758 1 1294 . 1 1 107 107 PHE HD1 H 1 7.299 0.020 . 1 . . . . . 107 PHE QD . 19758 1 1295 . 1 1 107 107 PHE HD2 H 1 7.299 0.020 . 1 . . . . . 107 PHE QD . 19758 1 1296 . 1 1 107 107 PHE HE1 H 1 7.301 0.020 . 1 . . . . . 107 PHE QE . 19758 1 1297 . 1 1 107 107 PHE HE2 H 1 7.301 0.020 . 1 . . . . . 107 PHE QE . 19758 1 1298 . 1 1 107 107 PHE C C 13 177.131 0.300 . 1 . . . . . 107 PHE C . 19758 1 1299 . 1 1 107 107 PHE CA C 13 60.947 0.300 . 1 . . . . . 107 PHE CA . 19758 1 1300 . 1 1 107 107 PHE CB C 13 39.292 0.300 . 1 . . . . . 107 PHE CB . 19758 1 1301 . 1 1 107 107 PHE CD1 C 13 131.699 0.300 . 1 . . . . . 107 PHE CD1 . 19758 1 1302 . 1 1 107 107 PHE CE1 C 13 132.740 0.300 . 1 . . . . . 107 PHE CE1 . 19758 1 1303 . 1 1 107 107 PHE N N 15 131.624 0.300 . 1 . . . . . 107 PHE N . 19758 1 1304 . 1 1 108 108 GLU H H 1 8.401 0.020 . 1 . . . . . 108 GLU H . 19758 1 1305 . 1 1 108 108 GLU HA H 1 3.973 0.020 . 1 . . . . . 108 GLU HA . 19758 1 1306 . 1 1 108 108 GLU HB2 H 1 2.120 0.020 . 2 . . . . . 108 GLU QB . 19758 1 1307 . 1 1 108 108 GLU HB3 H 1 2.120 0.020 . 2 . . . . . 108 GLU QB . 19758 1 1308 . 1 1 108 108 GLU HG2 H 1 2.127 0.020 . 2 . . . . . 108 GLU QG . 19758 1 1309 . 1 1 108 108 GLU HG3 H 1 2.127 0.020 . 2 . . . . . 108 GLU QG . 19758 1 1310 . 1 1 108 108 GLU C C 13 178.210 0.300 . 1 . . . . . 108 GLU C . 19758 1 1311 . 1 1 108 108 GLU CA C 13 59.694 0.300 . 1 . . . . . 108 GLU CA . 19758 1 1312 . 1 1 108 108 GLU CB C 13 29.528 0.300 . 1 . . . . . 108 GLU CB . 19758 1 1313 . 1 1 108 108 GLU CG C 13 36.832 0.300 . 1 . . . . . 108 GLU CG . 19758 1 1314 . 1 1 108 108 GLU N N 15 121.425 0.300 . 1 . . . . . 108 GLU N . 19758 1 1315 . 1 1 109 109 ALA H H 1 8.760 0.020 . 1 . . . . . 109 ALA H . 19758 1 1316 . 1 1 109 109 ALA HA H 1 3.777 0.020 . 1 . . . . . 109 ALA HA . 19758 1 1317 . 1 1 109 109 ALA HB1 H 1 1.555 0.020 . 1 . . . . . 109 ALA HB . 19758 1 1318 . 1 1 109 109 ALA HB2 H 1 1.555 0.020 . 1 . . . . . 109 ALA HB . 19758 1 1319 . 1 1 109 109 ALA HB3 H 1 1.555 0.020 . 1 . . . . . 109 ALA HB . 19758 1 1320 . 1 1 109 109 ALA C C 13 179.028 0.300 . 1 . . . . . 109 ALA C . 19758 1 1321 . 1 1 109 109 ALA CA C 13 55.213 0.300 . 1 . . . . . 109 ALA CA . 19758 1 1322 . 1 1 109 109 ALA CB C 13 18.479 0.300 . 1 . . . . . 109 ALA CB . 19758 1 1323 . 1 1 109 109 ALA N N 15 120.470 0.300 . 1 . . . . . 109 ALA N . 19758 1 1324 . 1 1 110 110 THR H H 1 7.560 0.020 . 1 . . . . . 110 THR H . 19758 1 1325 . 1 1 110 110 THR HA H 1 3.695 0.020 . 1 . . . . . 110 THR HA . 19758 1 1326 . 1 1 110 110 THR HB H 1 4.176 0.020 . 1 . . . . . 110 THR HB . 19758 1 1327 . 1 1 110 110 THR HG21 H 1 1.184 0.020 . 1 . . . . . 110 THR QG2 . 19758 1 1328 . 1 1 110 110 THR HG22 H 1 1.184 0.020 . 1 . . . . . 110 THR QG2 . 19758 1 1329 . 1 1 110 110 THR HG23 H 1 1.184 0.020 . 1 . . . . . 110 THR QG2 . 19758 1 1330 . 1 1 110 110 THR C C 13 176.651 0.300 . 1 . . . . . 110 THR C . 19758 1 1331 . 1 1 110 110 THR CA C 13 67.121 0.300 . 1 . . . . . 110 THR CA . 19758 1 1332 . 1 1 110 110 THR CB C 13 68.674 0.300 . 1 . . . . . 110 THR CB . 19758 1 1333 . 1 1 110 110 THR CG2 C 13 21.547 0.300 . 1 . . . . . 110 THR CG2 . 19758 1 1334 . 1 1 110 110 THR N N 15 112.979 0.300 . 1 . . . . . 110 THR N . 19758 1 1335 . 1 1 111 111 ASN H H 1 7.862 0.020 . 1 . . . . . 111 ASN H . 19758 1 1336 . 1 1 111 111 ASN HA H 1 4.281 0.020 . 1 . . . . . 111 ASN HA . 19758 1 1337 . 1 1 111 111 ASN HB2 H 1 2.542 0.020 . 1 . . . . . 111 ASN HB2 . 19758 1 1338 . 1 1 111 111 ASN HB3 H 1 2.652 0.020 . 1 . . . . . 111 ASN HB3 . 19758 1 1339 . 1 1 111 111 ASN HD21 H 1 6.302 0.020 . 1 . . . . . 111 ASN HD21 . 19758 1 1340 . 1 1 111 111 ASN HD22 H 1 7.531 0.020 . 1 . . . . . 111 ASN HD22 . 19758 1 1341 . 1 1 111 111 ASN C C 13 178.206 0.300 . 1 . . . . . 111 ASN C . 19758 1 1342 . 1 1 111 111 ASN CA C 13 56.255 0.300 . 1 . . . . . 111 ASN CA . 19758 1 1343 . 1 1 111 111 ASN CB C 13 38.576 0.300 . 1 . . . . . 111 ASN CB . 19758 1 1344 . 1 1 111 111 ASN N N 15 120.559 0.300 . 1 . . . . . 111 ASN N . 19758 1 1345 . 1 1 111 111 ASN ND2 N 15 113.775 0.300 . 1 . . . . . 111 ASN ND2 . 19758 1 1346 . 1 1 112 112 GLU H H 1 8.561 0.020 . 1 . . . . . 112 GLU H . 19758 1 1347 . 1 1 112 112 GLU HA H 1 3.829 0.020 . 1 . . . . . 112 GLU HA . 19758 1 1348 . 1 1 112 112 GLU HB2 H 1 0.609 0.020 . 1 . . . . . 112 GLU HB2 . 19758 1 1349 . 1 1 112 112 GLU HB3 H 1 1.321 0.020 . 1 . . . . . 112 GLU HB3 . 19758 1 1350 . 1 1 112 112 GLU HG2 H 1 1.985 0.020 . 1 . . . . . 112 GLU HG2 . 19758 1 1351 . 1 1 112 112 GLU HG3 H 1 2.275 0.020 . 1 . . . . . 112 GLU HG3 . 19758 1 1352 . 1 1 112 112 GLU C C 13 179.057 0.300 . 1 . . . . . 112 GLU C . 19758 1 1353 . 1 1 112 112 GLU CA C 13 58.533 0.300 . 1 . . . . . 112 GLU CA . 19758 1 1354 . 1 1 112 112 GLU CB C 13 28.107 0.300 . 1 . . . . . 112 GLU CB . 19758 1 1355 . 1 1 112 112 GLU CG C 13 36.029 0.300 . 1 . . . . . 112 GLU CG . 19758 1 1356 . 1 1 112 112 GLU N N 15 119.830 0.300 . 1 . . . . . 112 GLU N . 19758 1 1357 . 1 1 113 113 LEU H H 1 8.210 0.020 . 1 . . . . . 113 LEU H . 19758 1 1358 . 1 1 113 113 LEU HA H 1 3.809 0.020 . 1 . . . . . 113 LEU HA . 19758 1 1359 . 1 1 113 113 LEU HB2 H 1 1.539 0.020 . 1 . . . . . 113 LEU HB2 . 19758 1 1360 . 1 1 113 113 LEU HB3 H 1 1.735 0.020 . 1 . . . . . 113 LEU HB3 . 19758 1 1361 . 1 1 113 113 LEU HG H 1 1.539 0.020 . 1 . . . . . 113 LEU HG . 19758 1 1362 . 1 1 113 113 LEU HD11 H 1 0.817 0.020 . 2 . . . . . 113 LEU QD1 . 19758 1 1363 . 1 1 113 113 LEU HD12 H 1 0.817 0.020 . 2 . . . . . 113 LEU QD1 . 19758 1 1364 . 1 1 113 113 LEU HD13 H 1 0.817 0.020 . 2 . . . . . 113 LEU QD1 . 19758 1 1365 . 1 1 113 113 LEU HD21 H 1 1.015 0.020 . 2 . . . . . 113 LEU QD2 . 19758 1 1366 . 1 1 113 113 LEU HD22 H 1 1.015 0.020 . 2 . . . . . 113 LEU QD2 . 19758 1 1367 . 1 1 113 113 LEU HD23 H 1 1.015 0.020 . 2 . . . . . 113 LEU QD2 . 19758 1 1368 . 1 1 113 113 LEU C C 13 179.722 0.300 . 1 . . . . . 113 LEU C . 19758 1 1369 . 1 1 113 113 LEU CA C 13 58.319 0.300 . 1 . . . . . 113 LEU CA . 19758 1 1370 . 1 1 113 113 LEU CB C 13 41.333 0.300 . 1 . . . . . 113 LEU CB . 19758 1 1371 . 1 1 113 113 LEU CG C 13 27.535 0.300 . 1 . . . . . 113 LEU CG . 19758 1 1372 . 1 1 113 113 LEU CD1 C 13 25.629 0.300 . 1 . . . . . 113 LEU CD1 . 19758 1 1373 . 1 1 113 113 LEU CD2 C 13 25.654 0.300 . 1 . . . . . 113 LEU CD2 . 19758 1 1374 . 1 1 113 113 LEU N N 15 119.096 0.300 . 1 . . . . . 113 LEU N . 19758 1 1375 . 1 1 114 114 ARG H H 1 7.364 0.020 . 1 . . . . . 114 ARG H . 19758 1 1376 . 1 1 114 114 ARG HA H 1 4.044 0.020 . 1 . . . . . 114 ARG HA . 19758 1 1377 . 1 1 114 114 ARG HB2 H 1 1.942 0.020 . 2 . . . . . 114 ARG QB . 19758 1 1378 . 1 1 114 114 ARG HB3 H 1 1.942 0.020 . 2 . . . . . 114 ARG QB . 19758 1 1379 . 1 1 114 114 ARG HG2 H 1 1.551 0.020 . 1 . . . . . 114 ARG HG2 . 19758 1 1380 . 1 1 114 114 ARG HG3 H 1 1.777 0.020 . 1 . . . . . 114 ARG HG3 . 19758 1 1381 . 1 1 114 114 ARG HD2 H 1 3.209 0.020 . 2 . . . . . 114 ARG QD . 19758 1 1382 . 1 1 114 114 ARG HD3 H 1 3.209 0.020 . 2 . . . . . 114 ARG QD . 19758 1 1383 . 1 1 114 114 ARG C C 13 178.915 0.300 . 1 . . . . . 114 ARG C . 19758 1 1384 . 1 1 114 114 ARG CA C 13 59.754 0.300 . 1 . . . . . 114 ARG CA . 19758 1 1385 . 1 1 114 114 ARG CB C 13 29.452 0.300 . 1 . . . . . 114 ARG CB . 19758 1 1386 . 1 1 114 114 ARG CG C 13 27.466 0.300 . 1 . . . . . 114 ARG CG . 19758 1 1387 . 1 1 114 114 ARG CD C 13 43.392 0.300 . 1 . . . . . 114 ARG CD . 19758 1 1388 . 1 1 114 114 ARG N N 15 120.327 0.300 . 1 . . . . . 114 ARG N . 19758 1 1389 . 1 1 115 115 LYS H H 1 7.320 0.020 . 1 . . . . . 115 LYS H . 19758 1 1390 . 1 1 115 115 LYS HA H 1 4.033 0.020 . 1 . . . . . 115 LYS HA . 19758 1 1391 . 1 1 115 115 LYS HB2 H 1 1.982 0.020 . 2 . . . . . 115 LYS QB . 19758 1 1392 . 1 1 115 115 LYS HB3 H 1 1.982 0.020 . 2 . . . . . 115 LYS QB . 19758 1 1393 . 1 1 115 115 LYS HG2 H 1 1.389 0.020 . 2 . . . . . 115 LYS QG . 19758 1 1394 . 1 1 115 115 LYS HG3 H 1 1.389 0.020 . 2 . . . . . 115 LYS QG . 19758 1 1395 . 1 1 115 115 LYS HD2 H 1 1.628 0.020 . 1 . . . . . 115 LYS HD2 . 19758 1 1396 . 1 1 115 115 LYS HD3 H 1 1.681 0.020 . 1 . . . . . 115 LYS HD3 . 19758 1 1397 . 1 1 115 115 LYS HE2 H 1 2.677 0.020 . 2 . . . . . 115 LYS QE . 19758 1 1398 . 1 1 115 115 LYS HE3 H 1 2.677 0.020 . 2 . . . . . 115 LYS QE . 19758 1 1399 . 1 1 115 115 LYS C C 13 180.290 0.300 . 1 . . . . . 115 LYS C . 19758 1 1400 . 1 1 115 115 LYS CA C 13 59.714 0.300 . 1 . . . . . 115 LYS CA . 19758 1 1401 . 1 1 115 115 LYS CB C 13 32.493 0.300 . 1 . . . . . 115 LYS CB . 19758 1 1402 . 1 1 115 115 LYS CG C 13 24.992 0.300 . 1 . . . . . 115 LYS CG . 19758 1 1403 . 1 1 115 115 LYS CD C 13 29.700 0.300 . 1 . . . . . 115 LYS CD . 19758 1 1404 . 1 1 115 115 LYS CE C 13 42.077 0.300 . 1 . . . . . 115 LYS CE . 19758 1 1405 . 1 1 115 115 LYS N N 15 119.986 0.300 . 1 . . . . . 115 LYS N . 19758 1 1406 . 1 1 116 116 ILE H H 1 8.618 0.020 . 1 . . . . . 116 ILE H . 19758 1 1407 . 1 1 116 116 ILE HA H 1 3.322 0.020 . 1 . . . . . 116 ILE HA . 19758 1 1408 . 1 1 116 116 ILE HB H 1 1.576 0.020 . 1 . . . . . 116 ILE HB . 19758 1 1409 . 1 1 116 116 ILE HG12 H 1 -0.029 0.020 . 1 . . . . . 116 ILE HG12 . 19758 1 1410 . 1 1 116 116 ILE HG13 H 1 1.196 0.020 . 1 . . . . . 116 ILE HG13 . 19758 1 1411 . 1 1 116 116 ILE HG21 H 1 0.805 0.020 . 1 . . . . . 116 ILE QG2 . 19758 1 1412 . 1 1 116 116 ILE HG22 H 1 0.805 0.020 . 1 . . . . . 116 ILE QG2 . 19758 1 1413 . 1 1 116 116 ILE HG23 H 1 0.805 0.020 . 1 . . . . . 116 ILE QG2 . 19758 1 1414 . 1 1 116 116 ILE HD11 H 1 0.619 0.020 . 1 . . . . . 116 ILE QD1 . 19758 1 1415 . 1 1 116 116 ILE HD12 H 1 0.619 0.020 . 1 . . . . . 116 ILE QD1 . 19758 1 1416 . 1 1 116 116 ILE HD13 H 1 0.619 0.020 . 1 . . . . . 116 ILE QD1 . 19758 1 1417 . 1 1 116 116 ILE C C 13 177.494 0.300 . 1 . . . . . 116 ILE C . 19758 1 1418 . 1 1 116 116 ILE CA C 13 65.748 0.300 . 1 . . . . . 116 ILE CA . 19758 1 1419 . 1 1 116 116 ILE CB C 13 38.420 0.300 . 1 . . . . . 116 ILE CB . 19758 1 1420 . 1 1 116 116 ILE CG1 C 13 29.470 0.300 . 1 . . . . . 116 ILE CG1 . 19758 1 1421 . 1 1 116 116 ILE CG2 C 13 18.267 0.300 . 1 . . . . . 116 ILE CG2 . 19758 1 1422 . 1 1 116 116 ILE CD1 C 13 15.215 0.300 . 1 . . . . . 116 ILE CD1 . 19758 1 1423 . 1 1 116 116 ILE N N 15 122.492 0.300 . 1 . . . . . 116 ILE N . 19758 1 1424 . 1 1 117 117 SER H H 1 8.508 0.020 . 1 . . . . . 117 SER H . 19758 1 1425 . 1 1 117 117 SER HA H 1 4.113 0.020 . 1 . . . . . 117 SER HA . 19758 1 1426 . 1 1 117 117 SER HB2 H 1 4.031 0.020 . 2 . . . . . 117 SER QB . 19758 1 1427 . 1 1 117 117 SER HB3 H 1 4.031 0.020 . 2 . . . . . 117 SER QB . 19758 1 1428 . 1 1 117 117 SER C C 13 177.332 0.300 . 1 . . . . . 117 SER C . 19758 1 1429 . 1 1 117 117 SER CA C 13 62.579 0.300 . 1 . . . . . 117 SER CA . 19758 1 1430 . 1 1 117 117 SER CB C 13 62.738 0.300 . 1 . . . . . 117 SER CB . 19758 1 1431 . 1 1 117 117 SER N N 15 115.616 0.300 . 1 . . . . . 117 SER N . 19758 1 1432 . 1 1 118 118 GLN H H 1 7.819 0.020 . 1 . . . . . 118 GLN H . 19758 1 1433 . 1 1 118 118 GLN HA H 1 4.131 0.020 . 1 . . . . . 118 GLN HA . 19758 1 1434 . 1 1 118 118 GLN HB2 H 1 2.152 0.020 . 1 . . . . . 118 GLN HB2 . 19758 1 1435 . 1 1 118 118 GLN HB3 H 1 2.224 0.020 . 1 . . . . . 118 GLN HB3 . 19758 1 1436 . 1 1 118 118 GLN HG2 H 1 2.406 0.020 . 1 . . . . . 118 GLN HG2 . 19758 1 1437 . 1 1 118 118 GLN HG3 H 1 2.542 0.020 . 1 . . . . . 118 GLN HG3 . 19758 1 1438 . 1 1 118 118 GLN HE21 H 1 6.809 0.020 . 1 . . . . . 118 GLN HE21 . 19758 1 1439 . 1 1 118 118 GLN HE22 H 1 7.417 0.020 . 1 . . . . . 118 GLN HE22 . 19758 1 1440 . 1 1 118 118 GLN C C 13 178.285 0.300 . 1 . . . . . 118 GLN C . 19758 1 1441 . 1 1 118 118 GLN CA C 13 58.799 0.300 . 1 . . . . . 118 GLN CA . 19758 1 1442 . 1 1 118 118 GLN CB C 13 28.346 0.300 . 1 . . . . . 118 GLN CB . 19758 1 1443 . 1 1 118 118 GLN CG C 13 34.114 0.300 . 1 . . . . . 118 GLN CG . 19758 1 1444 . 1 1 118 118 GLN N N 15 121.099 0.300 . 1 . . . . . 118 GLN N . 19758 1 1445 . 1 1 118 118 GLN NE2 N 15 111.377 0.300 . 1 . . . . . 118 GLN NE2 . 19758 1 1446 . 1 1 119 119 ALA H H 1 7.946 0.020 . 1 . . . . . 119 ALA H . 19758 1 1447 . 1 1 119 119 ALA HA H 1 4.261 0.020 . 1 . . . . . 119 ALA HA . 19758 1 1448 . 1 1 119 119 ALA HB1 H 1 1.670 0.020 . 1 . . . . . 119 ALA HB . 19758 1 1449 . 1 1 119 119 ALA HB2 H 1 1.670 0.020 . 1 . . . . . 119 ALA HB . 19758 1 1450 . 1 1 119 119 ALA HB3 H 1 1.670 0.020 . 1 . . . . . 119 ALA HB . 19758 1 1451 . 1 1 119 119 ALA C C 13 180.775 0.300 . 1 . . . . . 119 ALA C . 19758 1 1452 . 1 1 119 119 ALA CA C 13 54.881 0.300 . 1 . . . . . 119 ALA CA . 19758 1 1453 . 1 1 119 119 ALA CB C 13 18.492 0.300 . 1 . . . . . 119 ALA CB . 19758 1 1454 . 1 1 119 119 ALA N N 15 123.658 0.300 . 1 . . . . . 119 ALA N . 19758 1 1455 . 1 1 120 120 LEU H H 1 8.494 0.020 . 1 . . . . . 120 LEU H . 19758 1 1456 . 1 1 120 120 LEU HA H 1 4.047 0.020 . 1 . . . . . 120 LEU HA . 19758 1 1457 . 1 1 120 120 LEU HB2 H 1 1.556 0.020 . 1 . . . . . 120 LEU HB2 . 19758 1 1458 . 1 1 120 120 LEU HB3 H 1 1.865 0.020 . 1 . . . . . 120 LEU HB3 . 19758 1 1459 . 1 1 120 120 LEU HD11 H 1 0.797 0.020 . 2 . . . . . 120 LEU QD1 . 19758 1 1460 . 1 1 120 120 LEU HD12 H 1 0.797 0.020 . 2 . . . . . 120 LEU QD1 . 19758 1 1461 . 1 1 120 120 LEU HD13 H 1 0.797 0.020 . 2 . . . . . 120 LEU QD1 . 19758 1 1462 . 1 1 120 120 LEU HD21 H 1 0.893 0.020 . 2 . . . . . 120 LEU QD2 . 19758 1 1463 . 1 1 120 120 LEU HD22 H 1 0.893 0.020 . 2 . . . . . 120 LEU QD2 . 19758 1 1464 . 1 1 120 120 LEU HD23 H 1 0.893 0.020 . 2 . . . . . 120 LEU QD2 . 19758 1 1465 . 1 1 120 120 LEU C C 13 178.696 0.300 . 1 . . . . . 120 LEU C . 19758 1 1466 . 1 1 120 120 LEU CA C 13 57.250 0.300 . 1 . . . . . 120 LEU CA . 19758 1 1467 . 1 1 120 120 LEU CB C 13 42.436 0.300 . 1 . . . . . 120 LEU CB . 19758 1 1468 . 1 1 120 120 LEU CG C 13 27.002 0.300 . 1 . . . . . 120 LEU CG . 19758 1 1469 . 1 1 120 120 LEU CD1 C 13 25.860 0.300 . 1 . . . . . 120 LEU CD1 . 19758 1 1470 . 1 1 120 120 LEU CD2 C 13 24.430 0.300 . 1 . . . . . 120 LEU CD2 . 19758 1 1471 . 1 1 120 120 LEU N N 15 119.511 0.300 . 1 . . . . . 120 LEU N . 19758 1 1472 . 1 1 121 121 ALA H H 1 7.742 0.020 . 1 . . . . . 121 ALA H . 19758 1 1473 . 1 1 121 121 ALA HA H 1 4.269 0.020 . 1 . . . . . 121 ALA HA . 19758 1 1474 . 1 1 121 121 ALA HB1 H 1 1.504 0.020 . 1 . . . . . 121 ALA HB . 19758 1 1475 . 1 1 121 121 ALA HB2 H 1 1.504 0.020 . 1 . . . . . 121 ALA HB . 19758 1 1476 . 1 1 121 121 ALA HB3 H 1 1.504 0.020 . 1 . . . . . 121 ALA HB . 19758 1 1477 . 1 1 121 121 ALA C C 13 179.065 0.300 . 1 . . . . . 121 ALA C . 19758 1 1478 . 1 1 121 121 ALA CA C 13 53.925 0.300 . 1 . . . . . 121 ALA CA . 19758 1 1479 . 1 1 121 121 ALA CB C 13 18.438 0.300 . 1 . . . . . 121 ALA CB . 19758 1 1480 . 1 1 121 121 ALA N N 15 121.540 0.300 . 1 . . . . . 121 ALA N . 19758 1 1481 . 1 1 122 122 SER H H 1 7.805 0.020 . 1 . . . . . 122 SER H . 19758 1 1482 . 1 1 122 122 SER HA H 1 4.409 0.020 . 1 . . . . . 122 SER HA . 19758 1 1483 . 1 1 122 122 SER HB2 H 1 4.008 0.020 . 2 . . . . . 122 SER QB . 19758 1 1484 . 1 1 122 122 SER HB3 H 1 4.008 0.020 . 2 . . . . . 122 SER QB . 19758 1 1485 . 1 1 122 122 SER C C 13 175.195 0.300 . 1 . . . . . 122 SER C . 19758 1 1486 . 1 1 122 122 SER CA C 13 59.558 0.300 . 1 . . . . . 122 SER CA . 19758 1 1487 . 1 1 122 122 SER CB C 13 63.564 0.300 . 1 . . . . . 122 SER CB . 19758 1 1488 . 1 1 122 122 SER N N 15 113.006 0.300 . 1 . . . . . 122 SER N . 19758 1 1489 . 1 1 123 123 LYS H H 1 7.827 0.020 . 1 . . . . . 123 LYS H . 19758 1 1490 . 1 1 123 123 LYS HA H 1 4.306 0.020 . 1 . . . . . 123 LYS HA . 19758 1 1491 . 1 1 123 123 LYS HB2 H 1 1.886 0.020 . 1 . . . . . 123 LYS HB2 . 19758 1 1492 . 1 1 123 123 LYS HB3 H 1 1.957 0.020 . 1 . . . . . 123 LYS HB3 . 19758 1 1493 . 1 1 123 123 LYS HG2 H 1 1.514 0.020 . 1 . . . . . 123 LYS HG2 . 19758 1 1494 . 1 1 123 123 LYS HG3 H 1 1.541 0.020 . 1 . . . . . 123 LYS HG3 . 19758 1 1495 . 1 1 123 123 LYS HD2 H 1 1.723 0.020 . 2 . . . . . 123 LYS QD . 19758 1 1496 . 1 1 123 123 LYS HD3 H 1 1.723 0.020 . 2 . . . . . 123 LYS QD . 19758 1 1497 . 1 1 123 123 LYS HE2 H 1 3.048 0.020 . 2 . . . . . 123 LYS QE . 19758 1 1498 . 1 1 123 123 LYS HE3 H 1 3.048 0.020 . 2 . . . . . 123 LYS QE . 19758 1 1499 . 1 1 123 123 LYS C C 13 177.078 0.300 . 1 . . . . . 123 LYS C . 19758 1 1500 . 1 1 123 123 LYS CA C 13 57.039 0.300 . 1 . . . . . 123 LYS CA . 19758 1 1501 . 1 1 123 123 LYS CB C 13 32.743 0.300 . 1 . . . . . 123 LYS CB . 19758 1 1502 . 1 1 123 123 LYS CG C 13 24.683 0.300 . 1 . . . . . 123 LYS CG . 19758 1 1503 . 1 1 123 123 LYS CD C 13 29.252 0.300 . 1 . . . . . 123 LYS CD . 19758 1 1504 . 1 1 123 123 LYS CE C 13 42.197 0.300 . 1 . . . . . 123 LYS CE . 19758 1 1505 . 1 1 123 123 LYS N N 15 122.021 0.300 . 1 . . . . . 123 LYS N . 19758 1 1506 . 1 1 124 124 GLU H H 1 8.147 0.020 . 1 . . . . . 124 GLU H . 19758 1 1507 . 1 1 124 124 GLU HA H 1 4.248 0.020 . 1 . . . . . 124 GLU HA . 19758 1 1508 . 1 1 124 124 GLU HB2 H 1 1.986 0.020 . 1 . . . . . 124 GLU HB2 . 19758 1 1509 . 1 1 124 124 GLU HB3 H 1 2.081 0.020 . 1 . . . . . 124 GLU HB3 . 19758 1 1510 . 1 1 124 124 GLU HG2 H 1 2.283 0.020 . 1 . . . . . 124 GLU HG2 . 19758 1 1511 . 1 1 124 124 GLU HG3 H 1 2.332 0.020 . 1 . . . . . 124 GLU HG3 . 19758 1 1512 . 1 1 124 124 GLU C C 13 176.396 0.300 . 1 . . . . . 124 GLU C . 19758 1 1513 . 1 1 124 124 GLU CA C 13 56.969 0.300 . 1 . . . . . 124 GLU CA . 19758 1 1514 . 1 1 124 124 GLU CB C 13 30.104 0.300 . 1 . . . . . 124 GLU CB . 19758 1 1515 . 1 1 124 124 GLU CG C 13 36.214 0.300 . 1 . . . . . 124 GLU CG . 19758 1 1516 . 1 1 124 124 GLU N N 15 120.249 0.300 . 1 . . . . . 124 GLU N . 19758 1 1517 . 1 1 125 125 ASN H H 1 8.248 0.020 . 1 . . . . . 125 ASN H . 19758 1 1518 . 1 1 125 125 ASN HA H 1 4.743 0.020 . 1 . . . . . 125 ASN HA . 19758 1 1519 . 1 1 125 125 ASN HB2 H 1 2.730 0.020 . 1 . . . . . 125 ASN HB2 . 19758 1 1520 . 1 1 125 125 ASN HB3 H 1 2.783 0.020 . 1 . . . . . 125 ASN HB3 . 19758 1 1521 . 1 1 125 125 ASN HD21 H 1 6.903 0.020 . 1 . . . . . 125 ASN HD21 . 19758 1 1522 . 1 1 125 125 ASN HD22 H 1 7.560 0.020 . 1 . . . . . 125 ASN HD22 . 19758 1 1523 . 1 1 125 125 ASN C C 13 174.951 0.300 . 1 . . . . . 125 ASN C . 19758 1 1524 . 1 1 125 125 ASN CA C 13 53.320 0.300 . 1 . . . . . 125 ASN CA . 19758 1 1525 . 1 1 125 125 ASN CB C 13 39.157 0.300 . 1 . . . . . 125 ASN CB . 19758 1 1526 . 1 1 125 125 ASN N N 15 118.628 0.300 . 1 . . . . . 125 ASN N . 19758 1 1527 . 1 1 125 125 ASN ND2 N 15 112.979 0.300 . 1 . . . . . 125 ASN ND2 . 19758 1 1528 . 1 1 126 126 SER H H 1 8.060 0.020 . 1 . . . . . 126 SER H . 19758 1 1529 . 1 1 126 126 SER HA H 1 4.447 0.020 . 1 . . . . . 126 SER HA . 19758 1 1530 . 1 1 126 126 SER HB2 H 1 3.820 0.020 . 2 . . . . . 126 SER QB . 19758 1 1531 . 1 1 126 126 SER HB3 H 1 3.820 0.020 . 2 . . . . . 126 SER QB . 19758 1 1532 . 1 1 126 126 SER C C 13 173.152 0.300 . 1 . . . . . 126 SER C . 19758 1 1533 . 1 1 126 126 SER CA C 13 58.277 0.300 . 1 . . . . . 126 SER CA . 19758 1 1534 . 1 1 126 126 SER CB C 13 64.030 0.300 . 1 . . . . . 126 SER CB . 19758 1 1535 . 1 1 126 126 SER N N 15 115.940 0.300 . 1 . . . . . 126 SER N . 19758 1 1536 . 1 1 127 127 TYR H H 1 7.700 0.020 . 1 . . . . . 127 TYR H . 19758 1 1537 . 1 1 127 127 TYR HA H 1 4.420 0.020 . 1 . . . . . 127 TYR HA . 19758 1 1538 . 1 1 127 127 TYR HB2 H 1 2.918 0.020 . 1 . . . . . 127 TYR HB2 . 19758 1 1539 . 1 1 127 127 TYR HB3 H 1 3.095 0.020 . 1 . . . . . 127 TYR HB3 . 19758 1 1540 . 1 1 127 127 TYR HD1 H 1 7.122 0.020 . 1 . . . . . 127 TYR QD . 19758 1 1541 . 1 1 127 127 TYR HD2 H 1 7.122 0.020 . 1 . . . . . 127 TYR QD . 19758 1 1542 . 1 1 127 127 TYR HE1 H 1 6.835 0.020 . 1 . . . . . 127 TYR QE . 19758 1 1543 . 1 1 127 127 TYR HE2 H 1 6.835 0.020 . 1 . . . . . 127 TYR QE . 19758 1 1544 . 1 1 127 127 TYR C C 13 180.514 0.300 . 1 . . . . . 127 TYR C . 19758 1 1545 . 1 1 127 127 TYR CA C 13 59.169 0.300 . 1 . . . . . 127 TYR CA . 19758 1 1546 . 1 1 127 127 TYR CB C 13 39.273 0.300 . 1 . . . . . 127 TYR CB . 19758 1 1547 . 1 1 127 127 TYR CD1 C 13 133.406 0.300 . 1 . . . . . 127 TYR CD1 . 19758 1 1548 . 1 1 127 127 TYR CE1 C 13 118.202 0.300 . 1 . . . . . 127 TYR CE1 . 19758 1 1549 . 1 1 127 127 TYR N N 15 126.614 0.300 . 1 . . . . . 127 TYR N . 19758 1 stop_ save_