data_27353 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 27353 _Entry.Title ; Chemical Shift Assignments of RHE-RS02845,a NTF2 domain-containing protein ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2018-01-08 _Entry.Accession_date 2018-01-08 _Entry.Last_release_date 2018-01-09 _Entry.Original_release_date 2018-01-09 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.0.16 _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 Tao Li . . . . 27353 2 Shuangli Li . . . . 27353 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 27353 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 301 27353 '15N chemical shifts' 85 27353 '1H chemical shifts' 466 27353 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2018-09-27 2018-01-08 update BMRB 'update entry citation' 27353 1 . . 2018-03-29 2018-01-08 original author 'original release' 27353 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 27353 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 29572784 _Citation.Full_citation . _Citation.Title ; Chemical shift assignments of RHE_RS02845, a NTF2-like domain-containing protein from Rhizobium etli ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assign.' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 12 _Citation.Journal_issue 2 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1874-270X _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 249 _Citation.Page_last 252 _Citation.Year 2018 _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 Tao Li T. . . . 27353 1 2 Shuangli Li S. . . . 27353 1 3 Chunjie Liang C. . . . 27353 1 4 Jiang Zhu J. . . . 27353 1 5 Maili Liu M. . . . 27353 1 6 Yunhuang Yang Y. . . . 27353 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 27353 _Assembly.ID 1 _Assembly.Name 'Protein RHE_CH00563' _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 RHE_CH00563 1 $NTF2_containing-domain A . yes native no no . . . 27353 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_NTF2_containing-domain _Entity.Sf_category entity _Entity.Sf_framecode NTF2_containing-domain _Entity.Entry_ID 27353 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name NTF2_containing-domain _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MHHHHHHSSGLVPRGSVKDE AIARHEEEAVIAMLMMRAKA LGEKNAEEALSYEAEDSVEF SLAPPLVINGKDKAGLQAWF DTWEGPIGGEVRDAKLTVGE GVAFWCGLTRMTGTKTDGTK VDLWFRQTLGLVKQDGRWLV THQHASVPFAMDGSGRALLD LQP ; _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 163 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state unknown _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 . MET . 27353 1 2 . HIS . 27353 1 3 . HIS . 27353 1 4 . HIS . 27353 1 5 . HIS . 27353 1 6 . HIS . 27353 1 7 . HIS . 27353 1 8 . SER . 27353 1 9 . SER . 27353 1 10 . GLY . 27353 1 11 . LEU . 27353 1 12 . VAL . 27353 1 13 . PRO . 27353 1 14 . ARG . 27353 1 15 . GLY . 27353 1 16 . SER . 27353 1 17 . VAL . 27353 1 18 . LYS . 27353 1 19 . ASP . 27353 1 20 . GLU . 27353 1 21 . ALA . 27353 1 22 . ILE . 27353 1 23 . ALA . 27353 1 24 . ARG . 27353 1 25 . HIS . 27353 1 26 . GLU . 27353 1 27 . GLU . 27353 1 28 . GLU . 27353 1 29 . ALA . 27353 1 30 . VAL . 27353 1 31 . ILE . 27353 1 32 . ALA . 27353 1 33 . MET . 27353 1 34 . LEU . 27353 1 35 . MET . 27353 1 36 . MET . 27353 1 37 . ARG . 27353 1 38 . ALA . 27353 1 39 . LYS . 27353 1 40 . ALA . 27353 1 41 . LEU . 27353 1 42 . GLY . 27353 1 43 . GLU . 27353 1 44 . LYS . 27353 1 45 . ASN . 27353 1 46 . ALA . 27353 1 47 . GLU . 27353 1 48 . GLU . 27353 1 49 . ALA . 27353 1 50 . LEU . 27353 1 51 . SER . 27353 1 52 . TYR . 27353 1 53 . GLU . 27353 1 54 . ALA . 27353 1 55 . GLU . 27353 1 56 . ASP . 27353 1 57 . SER . 27353 1 58 . VAL . 27353 1 59 . GLU . 27353 1 60 . PHE . 27353 1 61 . SER . 27353 1 62 . LEU . 27353 1 63 . ALA . 27353 1 64 . PRO . 27353 1 65 . PRO . 27353 1 66 . LEU . 27353 1 67 . VAL . 27353 1 68 . ILE . 27353 1 69 . ASN . 27353 1 70 . GLY . 27353 1 71 . LYS . 27353 1 72 . ASP . 27353 1 73 . LYS . 27353 1 74 . ALA . 27353 1 75 . GLY . 27353 1 76 . LEU . 27353 1 77 . GLN . 27353 1 78 . ALA . 27353 1 79 . TRP . 27353 1 80 . PHE . 27353 1 81 . ASP . 27353 1 82 . THR . 27353 1 83 . TRP . 27353 1 84 . GLU . 27353 1 85 . GLY . 27353 1 86 . PRO . 27353 1 87 . ILE . 27353 1 88 . GLY . 27353 1 89 . GLY . 27353 1 90 . GLU . 27353 1 91 . VAL . 27353 1 92 . ARG . 27353 1 93 . ASP . 27353 1 94 . ALA . 27353 1 95 . LYS . 27353 1 96 . LEU . 27353 1 97 . THR . 27353 1 98 . VAL . 27353 1 99 . GLY . 27353 1 100 . GLU . 27353 1 101 . GLY . 27353 1 102 . VAL . 27353 1 103 . ALA . 27353 1 104 . PHE . 27353 1 105 . TRP . 27353 1 106 . CYS . 27353 1 107 . GLY . 27353 1 108 . LEU . 27353 1 109 . THR . 27353 1 110 . ARG . 27353 1 111 . MET . 27353 1 112 . THR . 27353 1 113 . GLY . 27353 1 114 . THR . 27353 1 115 . LYS . 27353 1 116 . THR . 27353 1 117 . ASP . 27353 1 118 . GLY . 27353 1 119 . THR . 27353 1 120 . LYS . 27353 1 121 . VAL . 27353 1 122 . ASP . 27353 1 123 . LEU . 27353 1 124 . TRP . 27353 1 125 . PHE . 27353 1 126 . ARG . 27353 1 127 . GLN . 27353 1 128 . THR . 27353 1 129 . LEU . 27353 1 130 . GLY . 27353 1 131 . LEU . 27353 1 132 . VAL . 27353 1 133 . LYS . 27353 1 134 . GLN . 27353 1 135 . ASP . 27353 1 136 . GLY . 27353 1 137 . ARG . 27353 1 138 . TRP . 27353 1 139 . LEU . 27353 1 140 . VAL . 27353 1 141 . THR . 27353 1 142 . HIS . 27353 1 143 . GLN . 27353 1 144 . HIS . 27353 1 145 . ALA . 27353 1 146 . SER . 27353 1 147 . VAL . 27353 1 148 . PRO . 27353 1 149 . PHE . 27353 1 150 . ALA . 27353 1 151 . MET . 27353 1 152 . ASP . 27353 1 153 . GLY . 27353 1 154 . SER . 27353 1 155 . GLY . 27353 1 156 . ARG . 27353 1 157 . ALA . 27353 1 158 . LEU . 27353 1 159 . LEU . 27353 1 160 . ASP . 27353 1 161 . LEU . 27353 1 162 . GLN . 27353 1 163 . PRO . 27353 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 27353 1 . HIS 2 2 27353 1 . HIS 3 3 27353 1 . HIS 4 4 27353 1 . HIS 5 5 27353 1 . HIS 6 6 27353 1 . HIS 7 7 27353 1 . SER 8 8 27353 1 . SER 9 9 27353 1 . GLY 10 10 27353 1 . LEU 11 11 27353 1 . VAL 12 12 27353 1 . PRO 13 13 27353 1 . ARG 14 14 27353 1 . GLY 15 15 27353 1 . SER 16 16 27353 1 . VAL 17 17 27353 1 . LYS 18 18 27353 1 . ASP 19 19 27353 1 . GLU 20 20 27353 1 . ALA 21 21 27353 1 . ILE 22 22 27353 1 . ALA 23 23 27353 1 . ARG 24 24 27353 1 . HIS 25 25 27353 1 . GLU 26 26 27353 1 . GLU 27 27 27353 1 . GLU 28 28 27353 1 . ALA 29 29 27353 1 . VAL 30 30 27353 1 . ILE 31 31 27353 1 . ALA 32 32 27353 1 . MET 33 33 27353 1 . LEU 34 34 27353 1 . MET 35 35 27353 1 . MET 36 36 27353 1 . ARG 37 37 27353 1 . ALA 38 38 27353 1 . LYS 39 39 27353 1 . ALA 40 40 27353 1 . LEU 41 41 27353 1 . GLY 42 42 27353 1 . GLU 43 43 27353 1 . LYS 44 44 27353 1 . ASN 45 45 27353 1 . ALA 46 46 27353 1 . GLU 47 47 27353 1 . GLU 48 48 27353 1 . ALA 49 49 27353 1 . LEU 50 50 27353 1 . SER 51 51 27353 1 . TYR 52 52 27353 1 . GLU 53 53 27353 1 . ALA 54 54 27353 1 . GLU 55 55 27353 1 . ASP 56 56 27353 1 . SER 57 57 27353 1 . VAL 58 58 27353 1 . GLU 59 59 27353 1 . PHE 60 60 27353 1 . SER 61 61 27353 1 . LEU 62 62 27353 1 . ALA 63 63 27353 1 . PRO 64 64 27353 1 . PRO 65 65 27353 1 . LEU 66 66 27353 1 . VAL 67 67 27353 1 . ILE 68 68 27353 1 . ASN 69 69 27353 1 . GLY 70 70 27353 1 . LYS 71 71 27353 1 . ASP 72 72 27353 1 . LYS 73 73 27353 1 . ALA 74 74 27353 1 . GLY 75 75 27353 1 . LEU 76 76 27353 1 . GLN 77 77 27353 1 . ALA 78 78 27353 1 . TRP 79 79 27353 1 . PHE 80 80 27353 1 . ASP 81 81 27353 1 . THR 82 82 27353 1 . TRP 83 83 27353 1 . GLU 84 84 27353 1 . GLY 85 85 27353 1 . PRO 86 86 27353 1 . ILE 87 87 27353 1 . GLY 88 88 27353 1 . GLY 89 89 27353 1 . GLU 90 90 27353 1 . VAL 91 91 27353 1 . ARG 92 92 27353 1 . ASP 93 93 27353 1 . ALA 94 94 27353 1 . LYS 95 95 27353 1 . LEU 96 96 27353 1 . THR 97 97 27353 1 . VAL 98 98 27353 1 . GLY 99 99 27353 1 . GLU 100 100 27353 1 . GLY 101 101 27353 1 . VAL 102 102 27353 1 . ALA 103 103 27353 1 . PHE 104 104 27353 1 . TRP 105 105 27353 1 . CYS 106 106 27353 1 . GLY 107 107 27353 1 . LEU 108 108 27353 1 . THR 109 109 27353 1 . ARG 110 110 27353 1 . MET 111 111 27353 1 . THR 112 112 27353 1 . GLY 113 113 27353 1 . THR 114 114 27353 1 . LYS 115 115 27353 1 . THR 116 116 27353 1 . ASP 117 117 27353 1 . GLY 118 118 27353 1 . THR 119 119 27353 1 . LYS 120 120 27353 1 . VAL 121 121 27353 1 . ASP 122 122 27353 1 . LEU 123 123 27353 1 . TRP 124 124 27353 1 . PHE 125 125 27353 1 . ARG 126 126 27353 1 . GLN 127 127 27353 1 . THR 128 128 27353 1 . LEU 129 129 27353 1 . GLY 130 130 27353 1 . LEU 131 131 27353 1 . VAL 132 132 27353 1 . LYS 133 133 27353 1 . GLN 134 134 27353 1 . ASP 135 135 27353 1 . GLY 136 136 27353 1 . ARG 137 137 27353 1 . TRP 138 138 27353 1 . LEU 139 139 27353 1 . VAL 140 140 27353 1 . THR 141 141 27353 1 . HIS 142 142 27353 1 . GLN 143 143 27353 1 . HIS 144 144 27353 1 . ALA 145 145 27353 1 . SER 146 146 27353 1 . VAL 147 147 27353 1 . PRO 148 148 27353 1 . PHE 149 149 27353 1 . ALA 150 150 27353 1 . MET 151 151 27353 1 . ASP 152 152 27353 1 . GLY 153 153 27353 1 . SER 154 154 27353 1 . GLY 155 155 27353 1 . ARG 156 156 27353 1 . ALA 157 157 27353 1 . LEU 158 158 27353 1 . LEU 159 159 27353 1 . ASP 160 160 27353 1 . LEU 161 161 27353 1 . GLN 162 162 27353 1 . PRO 163 163 27353 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 27353 _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 $NTF2_containing-domain . 29449 organism . 'Rhizobium etli' 'Rhizobium etli' . . Bacteria . Rhizobium etli . . . . . . . . . . . . . 27353 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 27353 _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 $NTF2_containing-domain . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . pET32M . . . 27353 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 27353 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 RHE_RS02845 '[U-100% 13C; U-100% 15N]' . . 1 $NTF2_containing-domain . . 0.5 . . mM . . . . 27353 1 2 Tris-HCl 'natural abundance' . . . . . . 10 . . mM . . . . 27353 1 3 DTT 'natural abundance' . . . . . . 5 . . mM . . . . 27353 1 4 NaCl 'natural abundance' . . . . . . 100 . . mM . . . . 27353 1 5 NaN3 'natural abundance' . . . . . . 0.02 . . % . . . . 27353 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 27353 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.2 . M 27353 1 pH 7.5 . pH 27353 1 pressure 1 . atm 27353 1 temperature 298 . K 27353 1 stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Software.Sf_category software _Software.Sf_framecode TOPSPIN _Software.Entry_ID 27353 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.1 _Software.DOI . _Software.Details 'NMR data collection' loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 27353 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 27353 1 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 27353 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 27353 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 27353 2 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 27353 _Software.ID 3 _Software.Type . _Software.Name SPARKY _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 27353 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 27353 3 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 27353 _Software.ID 4 _Software.Type . _Software.Name TALOS _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 27353 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift calculation' 27353 4 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 27353 _Software.ID 5 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 27353 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 27353 5 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 27353 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 27353 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 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 27353 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 27353 1 2 spectrometer_2 Bruker Avance . 850 . . . 27353 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 27353 _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 . . . . . . . . . . . . . . . . . . . . . 27353 1 2 '2D 1H-13C HSQC aliphatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27353 1 3 '2D 1H-13C HSQC aromatic' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27353 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27353 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27353 1 6 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27353 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27353 1 8 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27353 1 9 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 27353 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 27353 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 TMS 'methyl carbon' . . . . ppm 0 . indirect 1 . . . . . 27353 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1 . . . . . 27353 1 N 15 water protons . . . . ppm 0 . indirect 1 . . . . . 27353 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 27353 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 8 '3D 1H-15N NOESY' . . . 27353 1 9 '3D 1H-13C NOESY' . . . 27353 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 37 37 ARG CA C 13 58.6 0.2 . 1 . . . . . 37 ARG CA . 27353 1 2 . 1 1 38 38 ALA H H 1 8.1 0.02 . 1 . . . . . 38 ALA H . 27353 1 3 . 1 1 38 38 ALA HA H 1 3.96 0.02 . 1 . . . . . 38 ALA HA . 27353 1 4 . 1 1 38 38 ALA HB1 H 1 1.36 0.02 . 1 . . . . . 38 ALA HB . 27353 1 5 . 1 1 38 38 ALA HB2 H 1 1.36 0.02 . 1 . . . . . 38 ALA HB . 27353 1 6 . 1 1 38 38 ALA HB3 H 1 1.36 0.02 . 1 . . . . . 38 ALA HB . 27353 1 7 . 1 1 38 38 ALA C C 13 181.2 0.2 . 1 . . . . . 38 ALA C . 27353 1 8 . 1 1 38 38 ALA CA C 13 55 0.2 . 1 . . . . . 38 ALA CA . 27353 1 9 . 1 1 38 38 ALA CB C 13 17.6 0.2 . 1 . . . . . 38 ALA CB . 27353 1 10 . 1 1 38 38 ALA N N 15 119.7 0.2 . 1 . . . . . 38 ALA N . 27353 1 11 . 1 1 39 39 LYS H H 1 7.93 0.02 . 1 . . . . . 39 LYS H . 27353 1 12 . 1 1 39 39 LYS HA H 1 4.09 0.02 . 1 . . . . . 39 LYS HA . 27353 1 13 . 1 1 39 39 LYS HB2 H 1 1.92 0.02 . 1 . . . . . 39 LYS HB2 . 27353 1 14 . 1 1 39 39 LYS HB3 H 1 1.87 0.02 . 1 . . . . . 39 LYS HB3 . 27353 1 15 . 1 1 39 39 LYS HG2 H 1 1.44 0.02 . 1 . . . . . 39 LYS HG2 . 27353 1 16 . 1 1 39 39 LYS HG3 H 1 1.3 0.02 . 1 . . . . . 39 LYS HG3 . 27353 1 17 . 1 1 39 39 LYS HD2 H 1 1.67 0.02 . 1 . . . . . 39 LYS HD2 . 27353 1 18 . 1 1 39 39 LYS HD3 H 1 1.67 0.02 . 1 . . . . . 39 LYS HD3 . 27353 1 19 . 1 1 39 39 LYS HE2 H 1 2.97 0.02 . 1 . . . . . 39 LYS HE2 . 27353 1 20 . 1 1 39 39 LYS HE3 H 1 2.97 0.02 . 1 . . . . . 39 LYS HE3 . 27353 1 21 . 1 1 39 39 LYS C C 13 178.2 0.2 . 1 . . . . . 39 LYS C . 27353 1 22 . 1 1 39 39 LYS CA C 13 59.1 0.2 . 1 . . . . . 39 LYS CA . 27353 1 23 . 1 1 39 39 LYS CB C 13 32.5 0.2 . 1 . . . . . 39 LYS CB . 27353 1 24 . 1 1 39 39 LYS CG C 13 24.3 0.2 . 1 . . . . . 39 LYS CG . 27353 1 25 . 1 1 39 39 LYS CD C 13 29 0.2 . 1 . . . . . 39 LYS CD . 27353 1 26 . 1 1 39 39 LYS CE C 13 41.9 0.2 . 1 . . . . . 39 LYS CE . 27353 1 27 . 1 1 39 39 LYS N N 15 120.7 0.2 . 1 . . . . . 39 LYS N . 27353 1 28 . 1 1 40 40 ALA H H 1 7.67 0.02 . 1 . . . . . 40 ALA H . 27353 1 29 . 1 1 40 40 ALA HA H 1 4.24 0.02 . 1 . . . . . 40 ALA HA . 27353 1 30 . 1 1 40 40 ALA HB1 H 1 1.63 0.02 . 1 . . . . . 40 ALA HB . 27353 1 31 . 1 1 40 40 ALA HB2 H 1 1.63 0.02 . 1 . . . . . 40 ALA HB . 27353 1 32 . 1 1 40 40 ALA HB3 H 1 1.63 0.02 . 1 . . . . . 40 ALA HB . 27353 1 33 . 1 1 40 40 ALA C C 13 179.6 0.2 . 1 . . . . . 40 ALA C . 27353 1 34 . 1 1 40 40 ALA CA C 13 55.1 0.2 . 1 . . . . . 40 ALA CA . 27353 1 35 . 1 1 40 40 ALA CB C 13 17.6 0.2 . 1 . . . . . 40 ALA CB . 27353 1 36 . 1 1 40 40 ALA N N 15 121.7 0.2 . 1 . . . . . 40 ALA N . 27353 1 37 . 1 1 41 41 LEU H H 1 8.18 0.02 . 1 . . . . . 41 LEU H . 27353 1 38 . 1 1 41 41 LEU HA H 1 4.12 0.02 . 1 . . . . . 41 LEU HA . 27353 1 39 . 1 1 41 41 LEU C C 13 179.7 0.2 . 1 . . . . . 41 LEU C . 27353 1 40 . 1 1 41 41 LEU CA C 13 58.1 0.2 . 1 . . . . . 41 LEU CA . 27353 1 41 . 1 1 41 41 LEU CB C 13 42.2 0.2 . 1 . . . . . 41 LEU CB . 27353 1 42 . 1 1 41 41 LEU N N 15 117.3 0.2 . 1 . . . . . 41 LEU N . 27353 1 43 . 1 1 42 42 GLY H H 1 7.98 0.02 . 1 . . . . . 42 GLY H . 27353 1 44 . 1 1 42 42 GLY HA2 H 1 3.73 0.02 . 1 . . . . . 42 GLY HA2 . 27353 1 45 . 1 1 42 42 GLY HA3 H 1 4.02 0.02 . 1 . . . . . 42 GLY HA3 . 27353 1 46 . 1 1 42 42 GLY C C 13 175 0.2 . 1 . . . . . 42 GLY C . 27353 1 47 . 1 1 42 42 GLY CA C 13 47.2 0.2 . 1 . . . . . 42 GLY CA . 27353 1 48 . 1 1 42 42 GLY N N 15 105.8 0.2 . 1 . . . . . 42 GLY N . 27353 1 49 . 1 1 43 43 GLU H H 1 7.65 0.02 . 1 . . . . . 43 GLU H . 27353 1 50 . 1 1 43 43 GLU HA H 1 4.03 0.02 . 1 . . . . . 43 GLU HA . 27353 1 51 . 1 1 43 43 GLU HB2 H 1 2.01 0.02 . 1 . . . . . 43 GLU HB2 . 27353 1 52 . 1 1 43 43 GLU HB3 H 1 1.92 0.02 . 1 . . . . . 43 GLU HB3 . 27353 1 53 . 1 1 43 43 GLU HG2 H 1 2.3 0.02 . 1 . . . . . 43 GLU HG2 . 27353 1 54 . 1 1 43 43 GLU HG3 H 1 2.3 0.02 . 1 . . . . . 43 GLU HG3 . 27353 1 55 . 1 1 43 43 GLU C C 13 176.2 0.2 . 1 . . . . . 43 GLU C . 27353 1 56 . 1 1 43 43 GLU CA C 13 55.6 0.2 . 1 . . . . . 43 GLU CA . 27353 1 57 . 1 1 43 43 GLU CB C 13 29 0.2 . 1 . . . . . 43 GLU CB . 27353 1 58 . 1 1 43 43 GLU CG C 13 36.3 0.2 . 1 . . . . . 43 GLU CG . 27353 1 59 . 1 1 43 43 GLU N N 15 115.3 0.2 . 1 . . . . . 43 GLU N . 27353 1 60 . 1 1 44 44 LYS H H 1 7.36 0.02 . 1 . . . . . 44 LYS H . 27353 1 61 . 1 1 44 44 LYS HA H 1 4.03 0.02 . 1 . . . . . 44 LYS HA . 27353 1 62 . 1 1 44 44 LYS HB2 H 1 1.65 0.02 . 1 . . . . . 44 LYS HB2 . 27353 1 63 . 1 1 44 44 LYS HB3 H 1 1.61 0.02 . 1 . . . . . 44 LYS HB3 . 27353 1 64 . 1 1 44 44 LYS C C 13 174.7 0.2 . 1 . . . . . 44 LYS C . 27353 1 65 . 1 1 44 44 LYS CA C 13 55.6 0.2 . 1 . . . . . 44 LYS CA . 27353 1 66 . 1 1 44 44 LYS CB C 13 26.7 0.2 . 1 . . . . . 44 LYS CB . 27353 1 67 . 1 1 44 44 LYS N N 15 115.8 0.2 . 1 . . . . . 44 LYS N . 27353 1 68 . 1 1 45 45 ASN H H 1 8.15 0.02 . 1 . . . . . 45 ASN H . 27353 1 69 . 1 1 45 45 ASN HA H 1 4.75 0.02 . 1 . . . . . 45 ASN HA . 27353 1 70 . 1 1 45 45 ASN HB2 H 1 2.54 0.02 . 1 . . . . . 45 ASN HB2 . 27353 1 71 . 1 1 45 45 ASN HB3 H 1 2.54 0.02 . 1 . . . . . 45 ASN HB3 . 27353 1 72 . 1 1 45 45 ASN HD21 H 1 7.75 0.02 . 1 . . . . . 45 ASN HD21 . 27353 1 73 . 1 1 45 45 ASN HD22 H 1 6.88 0.02 . 1 . . . . . 45 ASN HD22 . 27353 1 74 . 1 1 45 45 ASN C C 13 174.8 0.2 . 1 . . . . . 45 ASN C . 27353 1 75 . 1 1 45 45 ASN CA C 13 51 0.2 . 1 . . . . . 45 ASN CA . 27353 1 76 . 1 1 45 45 ASN CB C 13 38 0.2 . 1 . . . . . 45 ASN CB . 27353 1 77 . 1 1 45 45 ASN N N 15 118.5 0.2 . 1 . . . . . 45 ASN N . 27353 1 78 . 1 1 45 45 ASN ND2 N 15 113.1 0.2 . 1 . . . . . 45 ASN ND2 . 27353 1 79 . 1 1 46 46 ALA H H 1 9.29 0.02 . 1 . . . . . 46 ALA H . 27353 1 80 . 1 1 46 46 ALA HA H 1 4.13 0.02 . 1 . . . . . 46 ALA HA . 27353 1 81 . 1 1 46 46 ALA HB1 H 1 1.57 0.02 . 1 . . . . . 46 ALA HB . 27353 1 82 . 1 1 46 46 ALA HB2 H 1 1.57 0.02 . 1 . . . . . 46 ALA HB . 27353 1 83 . 1 1 46 46 ALA HB3 H 1 1.57 0.02 . 1 . . . . . 46 ALA HB . 27353 1 84 . 1 1 46 46 ALA C C 13 178.2 0.2 . 1 . . . . . 46 ALA C . 27353 1 85 . 1 1 46 46 ALA CA C 13 56.3 0.2 . 1 . . . . . 46 ALA CA . 27353 1 86 . 1 1 46 46 ALA CB C 13 18.4 0.2 . 1 . . . . . 46 ALA CB . 27353 1 87 . 1 1 46 46 ALA N N 15 126.1 0.2 . 1 . . . . . 46 ALA N . 27353 1 88 . 1 1 47 47 GLU H H 1 8.77 0.02 . 1 . . . . . 47 GLU H . 27353 1 89 . 1 1 47 47 GLU HA H 1 3.91 0.02 . 1 . . . . . 47 GLU HA . 27353 1 90 . 1 1 47 47 GLU HB2 H 1 2.11 0.02 . 1 . . . . . 47 GLU HB2 . 27353 1 91 . 1 1 47 47 GLU HB3 H 1 2.06 0.02 . 1 . . . . . 47 GLU HB3 . 27353 1 92 . 1 1 47 47 GLU C C 13 179.6 0.2 . 1 . . . . . 47 GLU C . 27353 1 93 . 1 1 47 47 GLU CA C 13 59.8 0.2 . 1 . . . . . 47 GLU CA . 27353 1 94 . 1 1 47 47 GLU CB C 13 29.4 0.2 . 1 . . . . . 47 GLU CB . 27353 1 95 . 1 1 47 47 GLU N N 15 116.5 0.2 . 1 . . . . . 47 GLU N . 27353 1 96 . 1 1 48 48 GLU H H 1 7.75 0.02 . 1 . . . . . 48 GLU H . 27353 1 97 . 1 1 48 48 GLU HA H 1 3.98 0.02 . 1 . . . . . 48 GLU HA . 27353 1 98 . 1 1 48 48 GLU HB2 H 1 1.89 0.02 . 1 . . . . . 48 GLU HB2 . 27353 1 99 . 1 1 48 48 GLU HB3 H 1 1.79 0.02 . 1 . . . . . 48 GLU HB3 . 27353 1 100 . 1 1 48 48 GLU HG2 H 1 2.29 0.02 . 1 . . . . . 48 GLU HG2 . 27353 1 101 . 1 1 48 48 GLU HG3 H 1 2.29 0.02 . 1 . . . . . 48 GLU HG3 . 27353 1 102 . 1 1 48 48 GLU C C 13 179.7 0.2 . 1 . . . . . 48 GLU C . 27353 1 103 . 1 1 48 48 GLU CA C 13 58.8 0.2 . 1 . . . . . 48 GLU CA . 27353 1 104 . 1 1 48 48 GLU CB C 13 29.6 0.2 . 1 . . . . . 48 GLU CB . 27353 1 105 . 1 1 48 48 GLU CG C 13 36.3 0.2 . 1 . . . . . 48 GLU CG . 27353 1 106 . 1 1 48 48 GLU N N 15 117.7 0.2 . 1 . . . . . 48 GLU N . 27353 1 107 . 1 1 49 49 ALA H H 1 8.62 0.02 . 1 . . . . . 49 ALA H . 27353 1 108 . 1 1 49 49 ALA HA H 1 3.99 0.02 . 1 . . . . . 49 ALA HA . 27353 1 109 . 1 1 49 49 ALA HB1 H 1 1.5 0.02 . 1 . . . . . 49 ALA HB . 27353 1 110 . 1 1 49 49 ALA HB2 H 1 1.5 0.02 . 1 . . . . . 49 ALA HB . 27353 1 111 . 1 1 49 49 ALA HB3 H 1 1.5 0.02 . 1 . . . . . 49 ALA HB . 27353 1 112 . 1 1 49 49 ALA C C 13 180.3 0.2 . 1 . . . . . 49 ALA C . 27353 1 113 . 1 1 49 49 ALA CA C 13 56.8 0.2 . 1 . . . . . 49 ALA CA . 27353 1 114 . 1 1 49 49 ALA CB C 13 18.2 0.2 . 1 . . . . . 49 ALA CB . 27353 1 115 . 1 1 49 49 ALA N N 15 121.9 0.2 . 1 . . . . . 49 ALA N . 27353 1 116 . 1 1 50 50 LEU H H 1 8.27 0.02 . 1 . . . . . 50 LEU H . 27353 1 117 . 1 1 50 50 LEU HA H 1 4 0.02 . 1 . . . . . 50 LEU HA . 27353 1 118 . 1 1 50 50 LEU HB2 H 1 1.84 0.02 . 1 . . . . . 50 LEU HB2 . 27353 1 119 . 1 1 50 50 LEU HB3 H 1 1.43 0.02 . 1 . . . . . 50 LEU HB3 . 27353 1 120 . 1 1 50 50 LEU HD11 H 1 0.78 0.02 . 1 . . . . . 50 LEU HD1 . 27353 1 121 . 1 1 50 50 LEU HD12 H 1 0.78 0.02 . 1 . . . . . 50 LEU HD1 . 27353 1 122 . 1 1 50 50 LEU HD13 H 1 0.78 0.02 . 1 . . . . . 50 LEU HD1 . 27353 1 123 . 1 1 50 50 LEU HD21 H 1 0.78 0.02 . 1 . . . . . 50 LEU HD2 . 27353 1 124 . 1 1 50 50 LEU HD22 H 1 0.78 0.02 . 1 . . . . . 50 LEU HD2 . 27353 1 125 . 1 1 50 50 LEU HD23 H 1 0.78 0.02 . 1 . . . . . 50 LEU HD2 . 27353 1 126 . 1 1 50 50 LEU C C 13 179 0.2 . 1 . . . . . 50 LEU C . 27353 1 127 . 1 1 50 50 LEU CA C 13 56.7 0.2 . 1 . . . . . 50 LEU CA . 27353 1 128 . 1 1 50 50 LEU CB C 13 41 0.2 . 1 . . . . . 50 LEU CB . 27353 1 129 . 1 1 50 50 LEU CG C 13 23.2 0.2 . 1 . . . . . 50 LEU CG . 27353 1 130 . 1 1 50 50 LEU CD1 C 13 25.6 0.2 . 1 . . . . . 50 LEU CD1 . 27353 1 131 . 1 1 50 50 LEU CD2 C 13 25.6 0.2 . 1 . . . . . 50 LEU CD2 . 27353 1 132 . 1 1 50 50 LEU N N 15 114.7 0.2 . 1 . . . . . 50 LEU N . 27353 1 133 . 1 1 51 51 SER H H 1 7.49 0.02 . 1 . . . . . 51 SER H . 27353 1 134 . 1 1 51 51 SER HA H 1 4.18 0.02 . 1 . . . . . 51 SER HA . 27353 1 135 . 1 1 51 51 SER HB2 H 1 3.69 0.02 . 1 . . . . . 51 SER HB2 . 27353 1 136 . 1 1 51 51 SER HB3 H 1 3.69 0.02 . 1 . . . . . 51 SER HB3 . 27353 1 137 . 1 1 51 51 SER C C 13 175 0.2 . 1 . . . . . 51 SER C . 27353 1 138 . 1 1 51 51 SER CA C 13 60.9 0.2 . 1 . . . . . 51 SER CA . 27353 1 139 . 1 1 51 51 SER CB C 13 62.7 0.2 . 1 . . . . . 51 SER CB . 27353 1 140 . 1 1 51 51 SER N N 15 116.1 0.2 . 1 . . . . . 51 SER N . 27353 1 141 . 1 1 52 52 TYR H H 1 7.04 0.02 . 1 . . . . . 52 TYR H . 27353 1 142 . 1 1 52 52 TYR HA H 1 4.59 0.02 . 1 . . . . . 52 TYR HA . 27353 1 143 . 1 1 52 52 TYR HB2 H 1 3.97 0.02 . 1 . . . . . 52 TYR HB2 . 27353 1 144 . 1 1 52 52 TYR HB3 H 1 3.97 0.02 . 1 . . . . . 52 TYR HB3 . 27353 1 145 . 1 1 52 52 TYR C C 13 173.3 0.2 . 1 . . . . . 52 TYR C . 27353 1 146 . 1 1 52 52 TYR CA C 13 58.6 0.2 . 1 . . . . . 52 TYR CA . 27353 1 147 . 1 1 52 52 TYR CB C 13 38.9 0.2 . 1 . . . . . 52 TYR CB . 27353 1 148 . 1 1 52 52 TYR N N 15 119.4 0.2 . 1 . . . . . 52 TYR N . 27353 1 149 . 1 1 53 53 GLU H H 1 7.55 0.02 . 1 . . . . . 53 GLU H . 27353 1 150 . 1 1 53 53 GLU HA H 1 4.11 0.02 . 1 . . . . . 53 GLU HA . 27353 1 151 . 1 1 53 53 GLU HB2 H 1 2.06 0.02 . 1 . . . . . 53 GLU HB2 . 27353 1 152 . 1 1 53 53 GLU HB3 H 1 2.06 0.02 . 1 . . . . . 53 GLU HB3 . 27353 1 153 . 1 1 53 53 GLU HG2 H 1 2.39 0.02 . 1 . . . . . 53 GLU HG2 . 27353 1 154 . 1 1 53 53 GLU HG3 H 1 2.22 0.02 . 1 . . . . . 53 GLU HG3 . 27353 1 155 . 1 1 53 53 GLU C C 13 176 0.2 . 1 . . . . . 53 GLU C . 27353 1 156 . 1 1 53 53 GLU CA C 13 54.2 0.2 . 1 . . . . . 53 GLU CA . 27353 1 157 . 1 1 53 53 GLU CB C 13 32.6 0.2 . 1 . . . . . 53 GLU CB . 27353 1 158 . 1 1 53 53 GLU CG C 13 36 0.2 . 1 . . . . . 53 GLU CG . 27353 1 159 . 1 1 53 53 GLU N N 15 118.5 0.2 . 1 . . . . . 53 GLU N . 27353 1 160 . 1 1 54 54 ALA H H 1 8.38 0.02 . 1 . . . . . 54 ALA H . 27353 1 161 . 1 1 54 54 ALA HA H 1 4.35 0.02 . 1 . . . . . 54 ALA HA . 27353 1 162 . 1 1 54 54 ALA HB1 H 1 1.42 0.02 . 1 . . . . . 54 ALA HB . 27353 1 163 . 1 1 54 54 ALA HB2 H 1 1.42 0.02 . 1 . . . . . 54 ALA HB . 27353 1 164 . 1 1 54 54 ALA HB3 H 1 1.42 0.02 . 1 . . . . . 54 ALA HB . 27353 1 165 . 1 1 54 54 ALA C C 13 178.1 0.2 . 1 . . . . . 54 ALA C . 27353 1 166 . 1 1 54 54 ALA CA C 13 51.3 0.2 . 1 . . . . . 54 ALA CA . 27353 1 167 . 1 1 54 54 ALA CB C 13 20.6 0.2 . 1 . . . . . 54 ALA CB . 27353 1 168 . 1 1 54 54 ALA N N 15 125.5 0.2 . 1 . . . . . 54 ALA N . 27353 1 169 . 1 1 55 55 GLU H H 1 8.82 0.02 . 1 . . . . . 55 GLU H . 27353 1 170 . 1 1 55 55 GLU HA H 1 4.02 0.02 . 1 . . . . . 55 GLU HA . 27353 1 171 . 1 1 55 55 GLU HB2 H 1 2.02 0.02 . 1 . . . . . 55 GLU HB2 . 27353 1 172 . 1 1 55 55 GLU HB3 H 1 2.02 0.02 . 1 . . . . . 55 GLU HB3 . 27353 1 173 . 1 1 55 55 GLU HG2 H 1 2.29 0.02 . 1 . . . . . 55 GLU HG2 . 27353 1 174 . 1 1 55 55 GLU HG3 H 1 2.29 0.02 . 1 . . . . . 55 GLU HG3 . 27353 1 175 . 1 1 55 55 GLU C C 13 177.2 0.2 . 1 . . . . . 55 GLU C . 27353 1 176 . 1 1 55 55 GLU CA C 13 58.5 0.2 . 1 . . . . . 55 GLU CA . 27353 1 177 . 1 1 55 55 GLU CB C 13 29.5 0.2 . 1 . . . . . 55 GLU CB . 27353 1 178 . 1 1 55 55 GLU CG C 13 36.3 0.2 . 1 . . . . . 55 GLU CG . 27353 1 179 . 1 1 55 55 GLU N N 15 119.3 0.2 . 1 . . . . . 55 GLU N . 27353 1 180 . 1 1 56 56 ASP H H 1 8.57 0.02 . 1 . . . . . 56 ASP H . 27353 1 181 . 1 1 56 56 ASP HA H 1 4.68 0.02 . 1 . . . . . 56 ASP HA . 27353 1 182 . 1 1 56 56 ASP HB2 H 1 2.73 0.02 . 1 . . . . . 56 ASP HB2 . 27353 1 183 . 1 1 56 56 ASP HB3 H 1 2.53 0.02 . 1 . . . . . 56 ASP HB3 . 27353 1 184 . 1 1 56 56 ASP C C 13 175.1 0.2 . 1 . . . . . 56 ASP C . 27353 1 185 . 1 1 56 56 ASP CA C 13 52.4 0.2 . 1 . . . . . 56 ASP CA . 27353 1 186 . 1 1 56 56 ASP CB C 13 38.7 0.2 . 1 . . . . . 56 ASP CB . 27353 1 187 . 1 1 56 56 ASP N N 15 116.7 0.2 . 1 . . . . . 56 ASP N . 27353 1 188 . 1 1 57 57 SER H H 1 6.92 0.02 . 1 . . . . . 57 SER H . 27353 1 189 . 1 1 57 57 SER HA H 1 4 0.02 . 1 . . . . . 57 SER HA . 27353 1 190 . 1 1 57 57 SER HB2 H 1 3.77 0.02 . 1 . . . . . 57 SER HB2 . 27353 1 191 . 1 1 57 57 SER HB3 H 1 3.71 0.02 . 1 . . . . . 57 SER HB3 . 27353 1 192 . 1 1 57 57 SER C C 13 174.7 0.2 . 1 . . . . . 57 SER C . 27353 1 193 . 1 1 57 57 SER CA C 13 58.6 0.2 . 1 . . . . . 57 SER CA . 27353 1 194 . 1 1 57 57 SER CB C 13 64.5 0.2 . 1 . . . . . 57 SER CB . 27353 1 195 . 1 1 57 57 SER N N 15 112.8 0.2 . 1 . . . . . 57 SER N . 27353 1 196 . 1 1 58 58 VAL H H 1 7.88 0.02 . 1 . . . . . 58 VAL H . 27353 1 197 . 1 1 58 58 VAL HA H 1 4.02 0.02 . 1 . . . . . 58 VAL HA . 27353 1 198 . 1 1 58 58 VAL HB H 1 1.75 0.02 . 1 . . . . . 58 VAL HB . 27353 1 199 . 1 1 58 58 VAL HG11 H 1 0.88 0.02 . 1 . . . . . 58 VAL HG1 . 27353 1 200 . 1 1 58 58 VAL HG12 H 1 0.88 0.02 . 1 . . . . . 58 VAL HG1 . 27353 1 201 . 1 1 58 58 VAL HG13 H 1 0.88 0.02 . 1 . . . . . 58 VAL HG1 . 27353 1 202 . 1 1 58 58 VAL HG21 H 1 0.88 0.02 . 1 . . . . . 58 VAL HG2 . 27353 1 203 . 1 1 58 58 VAL HG22 H 1 0.88 0.02 . 1 . . . . . 58 VAL HG2 . 27353 1 204 . 1 1 58 58 VAL HG23 H 1 0.88 0.02 . 1 . . . . . 58 VAL HG2 . 27353 1 205 . 1 1 58 58 VAL C C 13 175.3 0.2 . 1 . . . . . 58 VAL C . 27353 1 206 . 1 1 58 58 VAL CA C 13 62.3 0.2 . 1 . . . . . 58 VAL CA . 27353 1 207 . 1 1 58 58 VAL CB C 13 34.3 0.2 . 1 . . . . . 58 VAL CB . 27353 1 208 . 1 1 58 58 VAL CG1 C 13 21.2 0.2 . 1 . . . . . 58 VAL CG1 . 27353 1 209 . 1 1 58 58 VAL CG2 C 13 21.2 0.2 . 1 . . . . . 58 VAL CG2 . 27353 1 210 . 1 1 58 58 VAL N N 15 123.2 0.2 . 1 . . . . . 58 VAL N . 27353 1 211 . 1 1 59 59 GLU H H 1 9.23 0.02 . 1 . . . . . 59 GLU H . 27353 1 212 . 1 1 59 59 GLU HA H 1 4.95 0.02 . 1 . . . . . 59 GLU HA . 27353 1 213 . 1 1 59 59 GLU HG2 H 1 2.18 0.02 . 1 . . . . . 59 GLU HG2 . 27353 1 214 . 1 1 59 59 GLU HG3 H 1 2.18 0.02 . 1 . . . . . 59 GLU HG3 . 27353 1 215 . 1 1 59 59 GLU C C 13 173.3 0.2 . 1 . . . . . 59 GLU C . 27353 1 216 . 1 1 59 59 GLU CA C 13 54.2 0.2 . 1 . . . . . 59 GLU CA . 27353 1 217 . 1 1 59 59 GLU CB C 13 31.8 0.2 . 1 . . . . . 59 GLU CB . 27353 1 218 . 1 1 59 59 GLU CG C 13 33.7 0.2 . 1 . . . . . 59 GLU CG . 27353 1 219 . 1 1 59 59 GLU N N 15 133 0.2 . 1 . . . . . 59 GLU N . 27353 1 220 . 1 1 60 60 PHE H H 1 8.82 0.02 . 1 . . . . . 60 PHE H . 27353 1 221 . 1 1 60 60 PHE HA H 1 5.29 0.02 . 1 . . . . . 60 PHE HA . 27353 1 222 . 1 1 60 60 PHE HB2 H 1 2.96 0.02 . 1 . . . . . 60 PHE HB2 . 27353 1 223 . 1 1 60 60 PHE HB3 H 1 2.96 0.02 . 1 . . . . . 60 PHE HB3 . 27353 1 224 . 1 1 60 60 PHE C C 13 174.3 0.2 . 1 . . . . . 60 PHE C . 27353 1 225 . 1 1 60 60 PHE CA C 13 52.1 0.2 . 1 . . . . . 60 PHE CA . 27353 1 226 . 1 1 60 60 PHE CB C 13 37.8 0.2 . 1 . . . . . 60 PHE CB . 27353 1 227 . 1 1 60 60 PHE N N 15 127.4 0.2 . 1 . . . . . 60 PHE N . 27353 1 228 . 1 1 61 61 SER H H 1 9.25 0.02 . 1 . . . . . 61 SER H . 27353 1 229 . 1 1 61 61 SER HA H 1 4.72 0.02 . 1 . . . . . 61 SER HA . 27353 1 230 . 1 1 61 61 SER HB2 H 1 3.95 0.02 . 1 . . . . . 61 SER HB2 . 27353 1 231 . 1 1 61 61 SER HB3 H 1 3.82 0.02 . 1 . . . . . 61 SER HB3 . 27353 1 232 . 1 1 61 61 SER C C 13 174 0.2 . 1 . . . . . 61 SER C . 27353 1 233 . 1 1 61 61 SER CA C 13 56.7 0.2 . 1 . . . . . 61 SER CA . 27353 1 234 . 1 1 61 61 SER CB C 13 64.4 0.2 . 1 . . . . . 61 SER CB . 27353 1 235 . 1 1 61 61 SER N N 15 119.4 0.2 . 1 . . . . . 61 SER N . 27353 1 236 . 1 1 62 62 LEU H H 1 8.09 0.02 . 1 . . . . . 62 LEU H . 27353 1 237 . 1 1 62 62 LEU HA H 1 3.95 0.02 . 1 . . . . . 62 LEU HA . 27353 1 238 . 1 1 62 62 LEU HB2 H 1 1.32 0.02 . 1 . . . . . 62 LEU HB2 . 27353 1 239 . 1 1 62 62 LEU HB3 H 1 1.23 0.02 . 1 . . . . . 62 LEU HB3 . 27353 1 240 . 1 1 62 62 LEU HD11 H 1 0.72 0.02 . 1 . . . . . 62 LEU HD1 . 27353 1 241 . 1 1 62 62 LEU HD12 H 1 0.72 0.02 . 1 . . . . . 62 LEU HD1 . 27353 1 242 . 1 1 62 62 LEU HD13 H 1 0.72 0.02 . 1 . . . . . 62 LEU HD1 . 27353 1 243 . 1 1 62 62 LEU HD21 H 1 0.72 0.02 . 1 . . . . . 62 LEU HD2 . 27353 1 244 . 1 1 62 62 LEU HD22 H 1 0.72 0.02 . 1 . . . . . 62 LEU HD2 . 27353 1 245 . 1 1 62 62 LEU HD23 H 1 0.72 0.02 . 1 . . . . . 62 LEU HD2 . 27353 1 246 . 1 1 62 62 LEU C C 13 174 0.2 . 1 . . . . . 62 LEU C . 27353 1 247 . 1 1 62 62 LEU CA C 13 58.6 0.2 . 1 . . . . . 62 LEU CA . 27353 1 248 . 1 1 62 62 LEU CB C 13 43.1 0.2 . 1 . . . . . 62 LEU CB . 27353 1 249 . 1 1 62 62 LEU CD1 C 13 24.8 0.2 . 1 . . . . . 62 LEU CD1 . 27353 1 250 . 1 1 62 62 LEU CD2 C 13 24.8 0.2 . 1 . . . . . 62 LEU CD2 . 27353 1 251 . 1 1 62 62 LEU N N 15 121.7 0.2 . 1 . . . . . 62 LEU N . 27353 1 252 . 1 1 63 63 ALA H H 1 7.03 0.02 . 1 . . . . . 63 ALA H . 27353 1 253 . 1 1 63 63 ALA HA H 1 4.77 0.02 . 1 . . . . . 63 ALA HA . 27353 1 254 . 1 1 63 63 ALA HB1 H 1 1.22 0.02 . 1 . . . . . 63 ALA HB . 27353 1 255 . 1 1 63 63 ALA HB2 H 1 1.22 0.02 . 1 . . . . . 63 ALA HB . 27353 1 256 . 1 1 63 63 ALA HB3 H 1 1.22 0.02 . 1 . . . . . 63 ALA HB . 27353 1 257 . 1 1 63 63 ALA CA C 13 48.7 0.2 . 1 . . . . . 63 ALA CA . 27353 1 258 . 1 1 63 63 ALA CB C 13 19.8 0.2 . 1 . . . . . 63 ALA CB . 27353 1 259 . 1 1 63 63 ALA N N 15 116.1 0.2 . 1 . . . . . 63 ALA N . 27353 1 260 . 1 1 65 65 PRO HA H 1 4.37 0.02 . 1 . . . . . 65 PRO HA . 27353 1 261 . 1 1 65 65 PRO C C 13 174.2 0.2 . 1 . . . . . 65 PRO C . 27353 1 262 . 1 1 65 65 PRO CA C 13 61.7 0.2 . 1 . . . . . 65 PRO CA . 27353 1 263 . 1 1 65 65 PRO CB C 13 33.7 0.2 . 1 . . . . . 65 PRO CB . 27353 1 264 . 1 1 66 66 LEU H H 1 8.29 0.02 . 1 . . . . . 66 LEU H . 27353 1 265 . 1 1 66 66 LEU HA H 1 3.64 0.02 . 1 . . . . . 66 LEU HA . 27353 1 266 . 1 1 66 66 LEU HD11 H 1 0.92 0.02 . 1 . . . . . 66 LEU HD1 . 27353 1 267 . 1 1 66 66 LEU HD12 H 1 0.92 0.02 . 1 . . . . . 66 LEU HD1 . 27353 1 268 . 1 1 66 66 LEU HD13 H 1 0.92 0.02 . 1 . . . . . 66 LEU HD1 . 27353 1 269 . 1 1 66 66 LEU HD21 H 1 0.84 0.02 . 1 . . . . . 66 LEU HD2 . 27353 1 270 . 1 1 66 66 LEU HD22 H 1 0.84 0.02 . 1 . . . . . 66 LEU HD2 . 27353 1 271 . 1 1 66 66 LEU HD23 H 1 0.84 0.02 . 1 . . . . . 66 LEU HD2 . 27353 1 272 . 1 1 66 66 LEU C C 13 175.7 0.2 . 1 . . . . . 66 LEU C . 27353 1 273 . 1 1 66 66 LEU CA C 13 60.2 0.2 . 1 . . . . . 66 LEU CA . 27353 1 274 . 1 1 66 66 LEU CB C 13 42.6 0.2 . 1 . . . . . 66 LEU CB . 27353 1 275 . 1 1 66 66 LEU CD1 C 13 25.3 0.2 . 1 . . . . . 66 LEU CD1 . 27353 1 276 . 1 1 66 66 LEU CD2 C 13 25.3 0.2 . 1 . . . . . 66 LEU CD2 . 27353 1 277 . 1 1 66 66 LEU N N 15 116.5 0.2 . 1 . . . . . 66 LEU N . 27353 1 278 . 1 1 67 67 VAL H H 1 7.36 0.02 . 1 . . . . . 67 VAL H . 27353 1 279 . 1 1 67 67 VAL HA H 1 5.09 0.02 . 1 . . . . . 67 VAL HA . 27353 1 280 . 1 1 67 67 VAL HB H 1 2.05 0.02 . 1 . . . . . 67 VAL HB . 27353 1 281 . 1 1 67 67 VAL HG11 H 1 1.11 0.02 . 1 . . . . . 67 VAL HG1 . 27353 1 282 . 1 1 67 67 VAL HG12 H 1 1.11 0.02 . 1 . . . . . 67 VAL HG1 . 27353 1 283 . 1 1 67 67 VAL HG13 H 1 1.11 0.02 . 1 . . . . . 67 VAL HG1 . 27353 1 284 . 1 1 67 67 VAL HG21 H 1 1.05 0.02 . 1 . . . . . 67 VAL HG2 . 27353 1 285 . 1 1 67 67 VAL HG22 H 1 1.05 0.02 . 1 . . . . . 67 VAL HG2 . 27353 1 286 . 1 1 67 67 VAL HG23 H 1 1.05 0.02 . 1 . . . . . 67 VAL HG2 . 27353 1 287 . 1 1 67 67 VAL C C 13 171.9 0.2 . 1 . . . . . 67 VAL C . 27353 1 288 . 1 1 67 67 VAL CA C 13 59 0.2 . 1 . . . . . 67 VAL CA . 27353 1 289 . 1 1 67 67 VAL CB C 13 35.1 0.2 . 1 . . . . . 67 VAL CB . 27353 1 290 . 1 1 67 67 VAL CG1 C 13 22 0.2 . 1 . . . . . 67 VAL CG1 . 27353 1 291 . 1 1 67 67 VAL CG2 C 13 20.8 0.2 . 1 . . . . . 67 VAL CG2 . 27353 1 292 . 1 1 67 67 VAL N N 15 110.1 0.2 . 1 . . . . . 67 VAL N . 27353 1 293 . 1 1 68 68 ILE H H 1 9.1 0.02 . 1 . . . . . 68 ILE H . 27353 1 294 . 1 1 68 68 ILE HA H 1 4.18 0.02 . 1 . . . . . 68 ILE HA . 27353 1 295 . 1 1 68 68 ILE HB H 1 1.76 0.02 . 1 . . . . . 68 ILE HB . 27353 1 296 . 1 1 68 68 ILE HG12 H 1 1.35 0.02 . 1 . . . . . 68 ILE HG12 . 27353 1 297 . 1 1 68 68 ILE HG13 H 1 1.35 0.02 . 1 . . . . . 68 ILE HG13 . 27353 1 298 . 1 1 68 68 ILE HG21 H 1 0.81 0.02 . 1 . . . . . 68 ILE HG2 . 27353 1 299 . 1 1 68 68 ILE HG22 H 1 0.81 0.02 . 1 . . . . . 68 ILE HG2 . 27353 1 300 . 1 1 68 68 ILE HG23 H 1 0.81 0.02 . 1 . . . . . 68 ILE HG2 . 27353 1 301 . 1 1 68 68 ILE HD11 H 1 0.7 0.02 . 1 . . . . . 68 ILE HD1 . 27353 1 302 . 1 1 68 68 ILE HD12 H 1 0.7 0.02 . 1 . . . . . 68 ILE HD1 . 27353 1 303 . 1 1 68 68 ILE HD13 H 1 0.7 0.02 . 1 . . . . . 68 ILE HD1 . 27353 1 304 . 1 1 68 68 ILE C C 13 174.9 0.2 . 1 . . . . . 68 ILE C . 27353 1 305 . 1 1 68 68 ILE CA C 13 60.6 0.2 . 1 . . . . . 68 ILE CA . 27353 1 306 . 1 1 68 68 ILE CB C 13 40.5 0.2 . 1 . . . . . 68 ILE CB . 27353 1 307 . 1 1 68 68 ILE CG1 C 13 26.5 0.2 . 1 . . . . . 68 ILE CG1 . 27353 1 308 . 1 1 68 68 ILE CG2 C 13 17.6 0.2 . 1 . . . . . 68 ILE CG2 . 27353 1 309 . 1 1 68 68 ILE CD1 C 13 13.7 0.2 . 1 . . . . . 68 ILE CD1 . 27353 1 310 . 1 1 68 68 ILE N N 15 126.6 0.2 . 1 . . . . . 68 ILE N . 27353 1 311 . 1 1 69 69 ASN H H 1 8.75 0.02 . 1 . . . . . 69 ASN H . 27353 1 312 . 1 1 69 69 ASN HA H 1 5.2 0.02 . 1 . . . . . 69 ASN HA . 27353 1 313 . 1 1 69 69 ASN HB2 H 1 2.65 0.02 . 1 . . . . . 69 ASN HB2 . 27353 1 314 . 1 1 69 69 ASN HB3 H 1 2.56 0.02 . 1 . . . . . 69 ASN HB3 . 27353 1 315 . 1 1 69 69 ASN HD21 H 1 7.53 0.02 . 1 . . . . . 69 ASN HD21 . 27353 1 316 . 1 1 69 69 ASN HD22 H 1 6.86 0.02 . 1 . . . . . 69 ASN HD22 . 27353 1 317 . 1 1 69 69 ASN C C 13 175.5 0.2 . 1 . . . . . 69 ASN C . 27353 1 318 . 1 1 69 69 ASN CA C 13 52.9 0.2 . 1 . . . . . 69 ASN CA . 27353 1 319 . 1 1 69 69 ASN CB C 13 40.6 0.2 . 1 . . . . . 69 ASN CB . 27353 1 320 . 1 1 69 69 ASN N N 15 126 0.2 . 1 . . . . . 69 ASN N . 27353 1 321 . 1 1 69 69 ASN ND2 N 15 112.5 0.2 . 1 . . . . . 69 ASN ND2 . 27353 1 322 . 1 1 70 70 GLY H H 1 8.6 0.02 . 1 . . . . . 70 GLY H . 27353 1 323 . 1 1 70 70 GLY HA2 H 1 4.15 0.02 . 1 . . . . . 70 GLY HA2 . 27353 1 324 . 1 1 70 70 GLY HA3 H 1 3.83 0.02 . 1 . . . . . 70 GLY HA3 . 27353 1 325 . 1 1 70 70 GLY C C 13 172.8 0.2 . 1 . . . . . 70 GLY C . 27353 1 326 . 1 1 70 70 GLY CA C 13 44.6 0.2 . 1 . . . . . 70 GLY CA . 27353 1 327 . 1 1 70 70 GLY N N 15 111.8 0.2 . 1 . . . . . 70 GLY N . 27353 1 328 . 1 1 71 71 LYS H H 1 8.19 0.02 . 1 . . . . . 71 LYS H . 27353 1 329 . 1 1 71 71 LYS HA H 1 4.17 0.02 . 1 . . . . . 71 LYS HA . 27353 1 330 . 1 1 71 71 LYS HB2 H 1 1.72 0.02 . 1 . . . . . 71 LYS HB2 . 27353 1 331 . 1 1 71 71 LYS HB3 H 1 1.64 0.02 . 1 . . . . . 71 LYS HB3 . 27353 1 332 . 1 1 71 71 LYS HG2 H 1 1.41 0.02 . 1 . . . . . 71 LYS HG2 . 27353 1 333 . 1 1 71 71 LYS HG3 H 1 1.41 0.02 . 1 . . . . . 71 LYS HG3 . 27353 1 334 . 1 1 71 71 LYS HD2 H 1 1.67 0.02 . 1 . . . . . 71 LYS HD2 . 27353 1 335 . 1 1 71 71 LYS HD3 H 1 1.67 0.02 . 1 . . . . . 71 LYS HD3 . 27353 1 336 . 1 1 71 71 LYS HE2 H 1 2.78 0.02 . 1 . . . . . 71 LYS HE2 . 27353 1 337 . 1 1 71 71 LYS HE3 H 1 2.78 0.02 . 1 . . . . . 71 LYS HE3 . 27353 1 338 . 1 1 71 71 LYS C C 13 176.4 0.2 . 1 . . . . . 71 LYS C . 27353 1 339 . 1 1 71 71 LYS CA C 13 56.3 0.2 . 1 . . . . . 71 LYS CA . 27353 1 340 . 1 1 71 71 LYS CB C 13 33.6 0.2 . 1 . . . . . 71 LYS CB . 27353 1 341 . 1 1 71 71 LYS CG C 13 24.8 0.2 . 1 . . . . . 71 LYS CG . 27353 1 342 . 1 1 71 71 LYS CD C 13 29.2 0.2 . 1 . . . . . 71 LYS CD . 27353 1 343 . 1 1 71 71 LYS CE C 13 42.2 0.2 . 1 . . . . . 71 LYS CE . 27353 1 344 . 1 1 71 71 LYS N N 15 119.6 0.2 . 1 . . . . . 71 LYS N . 27353 1 345 . 1 1 72 72 ASP H H 1 8.67 0.02 . 1 . . . . . 72 ASP H . 27353 1 346 . 1 1 72 72 ASP HA H 1 4.73 0.02 . 1 . . . . . 72 ASP HA . 27353 1 347 . 1 1 72 72 ASP HB2 H 1 2.76 0.02 . 1 . . . . . 72 ASP HB2 . 27353 1 348 . 1 1 72 72 ASP HB3 H 1 2.76 0.02 . 1 . . . . . 72 ASP HB3 . 27353 1 349 . 1 1 72 72 ASP C C 13 175.4 0.2 . 1 . . . . . 72 ASP C . 27353 1 350 . 1 1 72 72 ASP CA C 13 52.1 0.2 . 1 . . . . . 72 ASP CA . 27353 1 351 . 1 1 72 72 ASP CB C 13 41.3 0.2 . 1 . . . . . 72 ASP CB . 27353 1 352 . 1 1 72 72 ASP N N 15 124.3 0.2 . 1 . . . . . 72 ASP N . 27353 1 353 . 1 1 73 73 LYS H H 1 8.67 0.02 . 1 . . . . . 73 LYS H . 27353 1 354 . 1 1 73 73 LYS HA H 1 3.75 0.02 . 1 . . . . . 73 LYS HA . 27353 1 355 . 1 1 73 73 LYS HB2 H 1 1.78 0.02 . 1 . . . . . 73 LYS HB2 . 27353 1 356 . 1 1 73 73 LYS HB3 H 1 1.78 0.02 . 1 . . . . . 73 LYS HB3 . 27353 1 357 . 1 1 73 73 LYS HG2 H 1 1.44 0.02 . 1 . . . . . 73 LYS HG2 . 27353 1 358 . 1 1 73 73 LYS HG3 H 1 1.44 0.02 . 1 . . . . . 73 LYS HG3 . 27353 1 359 . 1 1 73 73 LYS HD2 H 1 1.74 0.02 . 1 . . . . . 73 LYS HD2 . 27353 1 360 . 1 1 73 73 LYS HD3 H 1 1.74 0.02 . 1 . . . . . 73 LYS HD3 . 27353 1 361 . 1 1 73 73 LYS HE2 H 1 2.76 0.02 . 1 . . . . . 73 LYS HE2 . 27353 1 362 . 1 1 73 73 LYS HE3 H 1 2.76 0.02 . 1 . . . . . 73 LYS HE3 . 27353 1 363 . 1 1 73 73 LYS C C 13 177.5 0.2 . 1 . . . . . 73 LYS C . 27353 1 364 . 1 1 73 73 LYS CA C 13 60.4 0.2 . 1 . . . . . 73 LYS CA . 27353 1 365 . 1 1 73 73 LYS CB C 13 32.1 0.2 . 1 . . . . . 73 LYS CB . 27353 1 366 . 1 1 73 73 LYS CG C 13 25 0.2 . 1 . . . . . 73 LYS CG . 27353 1 367 . 1 1 73 73 LYS CD C 13 29.4 0.2 . 1 . . . . . 73 LYS CD . 27353 1 368 . 1 1 73 73 LYS CE C 13 42 0.2 . 1 . . . . . 73 LYS CE . 27353 1 369 . 1 1 73 73 LYS N N 15 125.2 0.2 . 1 . . . . . 73 LYS N . 27353 1 370 . 1 1 74 74 ALA H H 1 8.23 0.02 . 1 . . . . . 74 ALA H . 27353 1 371 . 1 1 74 74 ALA HA H 1 4.11 0.02 . 1 . . . . . 74 ALA HA . 27353 1 372 . 1 1 74 74 ALA HB1 H 1 1.44 0.02 . 1 . . . . . 74 ALA HB . 27353 1 373 . 1 1 74 74 ALA HB2 H 1 1.44 0.02 . 1 . . . . . 74 ALA HB . 27353 1 374 . 1 1 74 74 ALA HB3 H 1 1.44 0.02 . 1 . . . . . 74 ALA HB . 27353 1 375 . 1 1 74 74 ALA C C 13 181.5 0.2 . 1 . . . . . 74 ALA C . 27353 1 376 . 1 1 74 74 ALA CA C 13 54.9 0.2 . 1 . . . . . 74 ALA CA . 27353 1 377 . 1 1 74 74 ALA CB C 13 17.6 0.2 . 1 . . . . . 74 ALA CB . 27353 1 378 . 1 1 74 74 ALA N N 15 120.2 0.2 . 1 . . . . . 74 ALA N . 27353 1 379 . 1 1 75 75 GLY H H 1 8.34 0.02 . 1 . . . . . 75 GLY H . 27353 1 380 . 1 1 75 75 GLY HA2 H 1 3.88 0.02 . 1 . . . . . 75 GLY HA2 . 27353 1 381 . 1 1 75 75 GLY HA3 H 1 3.81 0.02 . 1 . . . . . 75 GLY HA3 . 27353 1 382 . 1 1 75 75 GLY C C 13 176.9 0.2 . 1 . . . . . 75 GLY C . 27353 1 383 . 1 1 75 75 GLY CA C 13 46.9 0.2 . 1 . . . . . 75 GLY CA . 27353 1 384 . 1 1 75 75 GLY N N 15 108.9 0.2 . 1 . . . . . 75 GLY N . 27353 1 385 . 1 1 76 76 LEU H H 1 7.95 0.02 . 1 . . . . . 76 LEU H . 27353 1 386 . 1 1 76 76 LEU HA H 1 4.57 0.02 . 1 . . . . . 76 LEU HA . 27353 1 387 . 1 1 76 76 LEU HG H 1 1.67 0.02 . 1 . . . . . 76 LEU HG . 27353 1 388 . 1 1 76 76 LEU HD11 H 1 0.76 0.02 . 1 . . . . . 76 LEU HD1 . 27353 1 389 . 1 1 76 76 LEU HD12 H 1 0.76 0.02 . 1 . . . . . 76 LEU HD1 . 27353 1 390 . 1 1 76 76 LEU HD13 H 1 0.76 0.02 . 1 . . . . . 76 LEU HD1 . 27353 1 391 . 1 1 76 76 LEU HD21 H 1 0.76 0.02 . 1 . . . . . 76 LEU HD2 . 27353 1 392 . 1 1 76 76 LEU HD22 H 1 0.76 0.02 . 1 . . . . . 76 LEU HD2 . 27353 1 393 . 1 1 76 76 LEU HD23 H 1 0.76 0.02 . 1 . . . . . 76 LEU HD2 . 27353 1 394 . 1 1 76 76 LEU C C 13 179.4 0.2 . 1 . . . . . 76 LEU C . 27353 1 395 . 1 1 76 76 LEU CA C 13 57.5 0.2 . 1 . . . . . 76 LEU CA . 27353 1 396 . 1 1 76 76 LEU CB C 13 41.1 0.2 . 1 . . . . . 76 LEU CB . 27353 1 397 . 1 1 76 76 LEU CG C 13 26.3 0.2 . 1 . . . . . 76 LEU CG . 27353 1 398 . 1 1 76 76 LEU CD1 C 13 23.4 0.2 . 1 . . . . . 76 LEU CD1 . 27353 1 399 . 1 1 76 76 LEU CD2 C 13 23.4 0.2 . 1 . . . . . 76 LEU CD2 . 27353 1 400 . 1 1 76 76 LEU N N 15 125.4 0.2 . 1 . . . . . 76 LEU N . 27353 1 401 . 1 1 77 77 GLN H H 1 8.51 0.02 . 1 . . . . . 77 GLN H . 27353 1 402 . 1 1 77 77 GLN HA H 1 4.19 0.02 . 1 . . . . . 77 GLN HA . 27353 1 403 . 1 1 77 77 GLN HB2 H 1 2.09 0.02 . 1 . . . . . 77 GLN HB2 . 27353 1 404 . 1 1 77 77 GLN HB3 H 1 2.02 0.02 . 1 . . . . . 77 GLN HB3 . 27353 1 405 . 1 1 77 77 GLN HG2 H 1 2.32 0.02 . 1 . . . . . 77 GLN HG2 . 27353 1 406 . 1 1 77 77 GLN HG3 H 1 2.32 0.02 . 1 . . . . . 77 GLN HG3 . 27353 1 407 . 1 1 77 77 GLN HE21 H 1 7.41 0.02 . 1 . . . . . 77 GLN HE21 . 27353 1 408 . 1 1 77 77 GLN HE22 H 1 6.99 0.02 . 1 . . . . . 77 GLN HE22 . 27353 1 409 . 1 1 77 77 GLN C C 13 177 0.2 . 1 . . . . . 77 GLN C . 27353 1 410 . 1 1 77 77 GLN CA C 13 57.7 0.2 . 1 . . . . . 77 GLN CA . 27353 1 411 . 1 1 77 77 GLN CB C 13 29.9 0.2 . 1 . . . . . 77 GLN CB . 27353 1 412 . 1 1 77 77 GLN CG C 13 33.4 0.2 . 1 . . . . . 77 GLN CG . 27353 1 413 . 1 1 77 77 GLN N N 15 123 0.2 . 1 . . . . . 77 GLN N . 27353 1 414 . 1 1 77 77 GLN NE2 N 15 113.6 0.2 . 1 . . . . . 77 GLN NE2 . 27353 1 415 . 1 1 78 78 ALA H H 1 8.31 0.02 . 1 . . . . . 78 ALA H . 27353 1 416 . 1 1 78 78 ALA HA H 1 4.23 0.02 . 1 . . . . . 78 ALA HA . 27353 1 417 . 1 1 78 78 ALA HB1 H 1 1.43 0.02 . 1 . . . . . 78 ALA HB . 27353 1 418 . 1 1 78 78 ALA HB2 H 1 1.43 0.02 . 1 . . . . . 78 ALA HB . 27353 1 419 . 1 1 78 78 ALA HB3 H 1 1.43 0.02 . 1 . . . . . 78 ALA HB . 27353 1 420 . 1 1 78 78 ALA CA C 13 53.7 0.2 . 1 . . . . . 78 ALA CA . 27353 1 421 . 1 1 78 78 ALA CB C 13 18.7 0.2 . 1 . . . . . 78 ALA CB . 27353 1 422 . 1 1 78 78 ALA N N 15 123.5 0.2 . 1 . . . . . 78 ALA N . 27353 1 423 . 1 1 79 79 TRP H H 1 7.85 0.02 . 1 . . . . . 79 TRP H . 27353 1 424 . 1 1 79 79 TRP CA C 13 62.4 0.2 . 1 . . . . . 79 TRP CA . 27353 1 425 . 1 1 79 79 TRP CB C 13 38 0.2 . 1 . . . . . 79 TRP CB . 27353 1 426 . 1 1 79 79 TRP N N 15 119.5 0.2 . 1 . . . . . 79 TRP N . 27353 1 427 . 1 1 80 80 PHE C C 13 170.4 0.2 . 1 . . . . . 80 PHE C . 27353 1 428 . 1 1 81 81 ASP H H 1 8.05 0.02 . 1 . . . . . 81 ASP H . 27353 1 429 . 1 1 81 81 ASP HA H 1 4.98 0.02 . 1 . . . . . 81 ASP HA . 27353 1 430 . 1 1 81 81 ASP HB2 H 1 1.5 0.02 . 1 . . . . . 81 ASP HB2 . 27353 1 431 . 1 1 81 81 ASP HB3 H 1 1.55 0.02 . 1 . . . . . 81 ASP HB3 . 27353 1 432 . 1 1 81 81 ASP C C 13 176.3 0.2 . 1 . . . . . 81 ASP C . 27353 1 433 . 1 1 81 81 ASP CA C 13 53.3 0.2 . 1 . . . . . 81 ASP CA . 27353 1 434 . 1 1 81 81 ASP N N 15 118.7 0.2 . 1 . . . . . 81 ASP N . 27353 1 435 . 1 1 82 82 THR H H 1 8.9 0.02 . 1 . . . . . 82 THR H . 27353 1 436 . 1 1 82 82 THR HB H 1 2.71 0.02 . 1 . . . . . 82 THR HB . 27353 1 437 . 1 1 82 82 THR C C 13 169.7 0.2 . 1 . . . . . 82 THR C . 27353 1 438 . 1 1 82 82 THR CA C 13 60.4 0.2 . 1 . . . . . 82 THR CA . 27353 1 439 . 1 1 82 82 THR CB C 13 71.1 0.2 . 1 . . . . . 82 THR CB . 27353 1 440 . 1 1 82 82 THR N N 15 117.7 0.2 . 1 . . . . . 82 THR N . 27353 1 441 . 1 1 83 83 TRP H H 1 8.47 0.02 . 1 . . . . . 83 TRP H . 27353 1 442 . 1 1 83 83 TRP CA C 13 52.4 0.2 . 1 . . . . . 83 TRP CA . 27353 1 443 . 1 1 83 83 TRP CB C 13 33.1 0.2 . 1 . . . . . 83 TRP CB . 27353 1 444 . 1 1 83 83 TRP N N 15 127.8 0.2 . 1 . . . . . 83 TRP N . 27353 1 445 . 1 1 86 86 PRO HA H 1 4.21 0.02 . 1 . . . . . 86 PRO HA . 27353 1 446 . 1 1 86 86 PRO HB2 H 1 2.19 0.02 . 1 . . . . . 86 PRO HB2 . 27353 1 447 . 1 1 86 86 PRO HB3 H 1 2.19 0.02 . 1 . . . . . 86 PRO HB3 . 27353 1 448 . 1 1 86 86 PRO C C 13 176 0.2 . 1 . . . . . 86 PRO C . 27353 1 449 . 1 1 86 86 PRO CA C 13 62.6 0.2 . 1 . . . . . 86 PRO CA . 27353 1 450 . 1 1 86 86 PRO CB C 13 33 0.2 . 1 . . . . . 86 PRO CB . 27353 1 451 . 1 1 87 87 ILE H H 1 8.57 0.02 . 1 . . . . . 87 ILE H . 27353 1 452 . 1 1 87 87 ILE HA H 1 4.27 0.02 . 1 . . . . . 87 ILE HA . 27353 1 453 . 1 1 87 87 ILE HB H 1 1.89 0.02 . 1 . . . . . 87 ILE HB . 27353 1 454 . 1 1 87 87 ILE HG12 H 1 1.27 0.02 . 1 . . . . . 87 ILE HG12 . 27353 1 455 . 1 1 87 87 ILE HG13 H 1 1.5 0.02 . 1 . . . . . 87 ILE HG13 . 27353 1 456 . 1 1 87 87 ILE HG21 H 1 0.81 0.02 . 1 . . . . . 87 ILE HG2 . 27353 1 457 . 1 1 87 87 ILE HG22 H 1 0.81 0.02 . 1 . . . . . 87 ILE HG2 . 27353 1 458 . 1 1 87 87 ILE HG23 H 1 0.81 0.02 . 1 . . . . . 87 ILE HG2 . 27353 1 459 . 1 1 87 87 ILE HD11 H 1 0.87 0.02 . 1 . . . . . 87 ILE HD1 . 27353 1 460 . 1 1 87 87 ILE HD12 H 1 0.87 0.02 . 1 . . . . . 87 ILE HD1 . 27353 1 461 . 1 1 87 87 ILE HD13 H 1 0.87 0.02 . 1 . . . . . 87 ILE HD1 . 27353 1 462 . 1 1 87 87 ILE C C 13 177.8 0.2 . 1 . . . . . 87 ILE C . 27353 1 463 . 1 1 87 87 ILE CA C 13 61 0.2 . 1 . . . . . 87 ILE CA . 27353 1 464 . 1 1 87 87 ILE CB C 13 38.8 0.2 . 1 . . . . . 87 ILE CB . 27353 1 465 . 1 1 87 87 ILE CG1 C 13 27.3 0.2 . 1 . . . . . 87 ILE CG1 . 27353 1 466 . 1 1 87 87 ILE CG2 C 13 17.6 0.2 . 1 . . . . . 87 ILE CG2 . 27353 1 467 . 1 1 87 87 ILE CD1 C 13 12.8 0.2 . 1 . . . . . 87 ILE CD1 . 27353 1 468 . 1 1 87 87 ILE N N 15 122.2 0.2 . 1 . . . . . 87 ILE N . 27353 1 469 . 1 1 88 88 GLY H H 1 8.97 0.02 . 1 . . . . . 88 GLY H . 27353 1 470 . 1 1 88 88 GLY HA2 H 1 3.53 0.02 . 1 . . . . . 88 GLY HA2 . 27353 1 471 . 1 1 88 88 GLY HA3 H 1 3.53 0.02 . 1 . . . . . 88 GLY HA3 . 27353 1 472 . 1 1 88 88 GLY C C 13 173.6 0.2 . 1 . . . . . 88 GLY C . 27353 1 473 . 1 1 88 88 GLY CA C 13 44.6 0.2 . 1 . . . . . 88 GLY CA . 27353 1 474 . 1 1 88 88 GLY N N 15 118.2 0.2 . 1 . . . . . 88 GLY N . 27353 1 475 . 1 1 89 89 GLY H H 1 8 0.02 . 1 . . . . . 89 GLY H . 27353 1 476 . 1 1 89 89 GLY HA2 H 1 3.54 0.02 . 1 . . . . . 89 GLY HA2 . 27353 1 477 . 1 1 89 89 GLY HA3 H 1 3.54 0.02 . 1 . . . . . 89 GLY HA3 . 27353 1 478 . 1 1 89 89 GLY C C 13 172.7 0.2 . 1 . . . . . 89 GLY C . 27353 1 479 . 1 1 89 89 GLY CA C 13 45.1 0.2 . 1 . . . . . 89 GLY CA . 27353 1 480 . 1 1 89 89 GLY N N 15 106.9 0.2 . 1 . . . . . 89 GLY N . 27353 1 481 . 1 1 90 90 GLU H H 1 7.46 0.02 . 1 . . . . . 90 GLU H . 27353 1 482 . 1 1 90 90 GLU HA H 1 4.04 0.02 . 1 . . . . . 90 GLU HA . 27353 1 483 . 1 1 90 90 GLU HB2 H 1 2.02 0.02 . 1 . . . . . 90 GLU HB2 . 27353 1 484 . 1 1 90 90 GLU HB3 H 1 2.02 0.02 . 1 . . . . . 90 GLU HB3 . 27353 1 485 . 1 1 90 90 GLU HG2 H 1 2.03 0.02 . 1 . . . . . 90 GLU HG2 . 27353 1 486 . 1 1 90 90 GLU HG3 H 1 2.03 0.02 . 1 . . . . . 90 GLU HG3 . 27353 1 487 . 1 1 90 90 GLU C C 13 173.6 0.2 . 1 . . . . . 90 GLU C . 27353 1 488 . 1 1 90 90 GLU CA C 13 55.2 0.2 . 1 . . . . . 90 GLU CA . 27353 1 489 . 1 1 90 90 GLU CB C 13 32.8 0.2 . 1 . . . . . 90 GLU CB . 27353 1 490 . 1 1 90 90 GLU CG C 13 36.4 0.2 . 1 . . . . . 90 GLU CG . 27353 1 491 . 1 1 90 90 GLU N N 15 116.7 0.2 . 1 . . . . . 90 GLU N . 27353 1 492 . 1 1 91 91 VAL H H 1 8.51 0.02 . 1 . . . . . 91 VAL H . 27353 1 493 . 1 1 91 91 VAL HA H 1 3.84 0.02 . 1 . . . . . 91 VAL HA . 27353 1 494 . 1 1 91 91 VAL HB H 1 2.08 0.02 . 1 . . . . . 91 VAL HB . 27353 1 495 . 1 1 91 91 VAL HG11 H 1 1.12 0.02 . 1 . . . . . 91 VAL HG1 . 27353 1 496 . 1 1 91 91 VAL HG12 H 1 1.12 0.02 . 1 . . . . . 91 VAL HG1 . 27353 1 497 . 1 1 91 91 VAL HG13 H 1 1.12 0.02 . 1 . . . . . 91 VAL HG1 . 27353 1 498 . 1 1 91 91 VAL HG21 H 1 0.94 0.02 . 1 . . . . . 91 VAL HG2 . 27353 1 499 . 1 1 91 91 VAL HG22 H 1 0.94 0.02 . 1 . . . . . 91 VAL HG2 . 27353 1 500 . 1 1 91 91 VAL HG23 H 1 0.94 0.02 . 1 . . . . . 91 VAL HG2 . 27353 1 501 . 1 1 91 91 VAL C C 13 175.9 0.2 . 1 . . . . . 91 VAL C . 27353 1 502 . 1 1 91 91 VAL CA C 13 60.5 0.2 . 1 . . . . . 91 VAL CA . 27353 1 503 . 1 1 91 91 VAL CB C 13 35.2 0.2 . 1 . . . . . 91 VAL CB . 27353 1 504 . 1 1 91 91 VAL CG1 C 13 22.1 0.2 . 1 . . . . . 91 VAL CG1 . 27353 1 505 . 1 1 91 91 VAL CG2 C 13 20.8 0.2 . 1 . . . . . 91 VAL CG2 . 27353 1 506 . 1 1 91 91 VAL N N 15 119.1 0.2 . 1 . . . . . 91 VAL N . 27353 1 507 . 1 1 92 92 ARG H H 1 9.62 0.02 . 1 . . . . . 92 ARG H . 27353 1 508 . 1 1 92 92 ARG HA H 1 4.21 0.02 . 1 . . . . . 92 ARG HA . 27353 1 509 . 1 1 92 92 ARG HB2 H 1 1.75 0.02 . 1 . . . . . 92 ARG HB2 . 27353 1 510 . 1 1 92 92 ARG HB3 H 1 1.66 0.02 . 1 . . . . . 92 ARG HB3 . 27353 1 511 . 1 1 92 92 ARG HG2 H 1 1.63 0.02 . 1 . . . . . 92 ARG HG2 . 27353 1 512 . 1 1 92 92 ARG HG3 H 1 1.54 0.02 . 1 . . . . . 92 ARG HG3 . 27353 1 513 . 1 1 92 92 ARG HD2 H 1 3.24 0.02 . 1 . . . . . 92 ARG HD2 . 27353 1 514 . 1 1 92 92 ARG HD3 H 1 3.24 0.02 . 1 . . . . . 92 ARG HD3 . 27353 1 515 . 1 1 92 92 ARG HE H 1 7.27 0.02 . 1 . . . . . 92 ARG HE . 27353 1 516 . 1 1 92 92 ARG C C 13 173.5 0.2 . 1 . . . . . 92 ARG C . 27353 1 517 . 1 1 92 92 ARG CA C 13 54.4 0.2 . 1 . . . . . 92 ARG CA . 27353 1 518 . 1 1 92 92 ARG CB C 13 34.2 0.2 . 1 . . . . . 92 ARG CB . 27353 1 519 . 1 1 92 92 ARG CG C 13 27.2 0.2 . 1 . . . . . 92 ARG CG . 27353 1 520 . 1 1 92 92 ARG CD C 13 43.3 0.2 . 1 . . . . . 92 ARG CD . 27353 1 521 . 1 1 92 92 ARG N N 15 126.5 0.2 . 1 . . . . . 92 ARG N . 27353 1 522 . 1 1 93 93 ASP H H 1 8.74 0.02 . 1 . . . . . 93 ASP H . 27353 1 523 . 1 1 93 93 ASP HA H 1 4.16 0.02 . 1 . . . . . 93 ASP HA . 27353 1 524 . 1 1 93 93 ASP HB2 H 1 2.77 0.02 . 1 . . . . . 93 ASP HB2 . 27353 1 525 . 1 1 93 93 ASP HB3 H 1 2.55 0.02 . 1 . . . . . 93 ASP HB3 . 27353 1 526 . 1 1 93 93 ASP C C 13 174.3 0.2 . 1 . . . . . 93 ASP C . 27353 1 527 . 1 1 93 93 ASP CA C 13 55.2 0.2 . 1 . . . . . 93 ASP CA . 27353 1 528 . 1 1 93 93 ASP CB C 13 39.1 0.2 . 1 . . . . . 93 ASP CB . 27353 1 529 . 1 1 93 93 ASP N N 15 120.4 0.2 . 1 . . . . . 93 ASP N . 27353 1 530 . 1 1 94 94 ALA H H 1 8 0.02 . 1 . . . . . 94 ALA H . 27353 1 531 . 1 1 94 94 ALA HA H 1 4.51 0.02 . 1 . . . . . 94 ALA HA . 27353 1 532 . 1 1 94 94 ALA HB1 H 1 1.16 0.02 . 1 . . . . . 94 ALA HB . 27353 1 533 . 1 1 94 94 ALA HB2 H 1 1.16 0.02 . 1 . . . . . 94 ALA HB . 27353 1 534 . 1 1 94 94 ALA HB3 H 1 1.16 0.02 . 1 . . . . . 94 ALA HB . 27353 1 535 . 1 1 94 94 ALA C C 13 178.5 0.2 . 1 . . . . . 94 ALA C . 27353 1 536 . 1 1 94 94 ALA CA C 13 51.6 0.2 . 1 . . . . . 94 ALA CA . 27353 1 537 . 1 1 94 94 ALA CB C 13 20.1 0.2 . 1 . . . . . 94 ALA CB . 27353 1 538 . 1 1 94 94 ALA N N 15 119.1 0.2 . 1 . . . . . 94 ALA N . 27353 1 539 . 1 1 95 95 LYS H H 1 8.42 0.02 . 1 . . . . . 95 LYS H . 27353 1 540 . 1 1 95 95 LYS HA H 1 4.32 0.02 . 1 . . . . . 95 LYS HA . 27353 1 541 . 1 1 95 95 LYS HB2 H 1 1.51 0.02 . 1 . . . . . 95 LYS HB2 . 27353 1 542 . 1 1 95 95 LYS HB3 H 1 1.42 0.02 . 1 . . . . . 95 LYS HB3 . 27353 1 543 . 1 1 95 95 LYS HG2 H 1 1.3 0.02 . 1 . . . . . 95 LYS HG2 . 27353 1 544 . 1 1 95 95 LYS HG3 H 1 1.02 0.02 . 1 . . . . . 95 LYS HG3 . 27353 1 545 . 1 1 95 95 LYS HD2 H 1 1.45 0.02 . 1 . . . . . 95 LYS HD2 . 27353 1 546 . 1 1 95 95 LYS HD3 H 1 1.45 0.02 . 1 . . . . . 95 LYS HD3 . 27353 1 547 . 1 1 95 95 LYS HE2 H 1 3.01 0.02 . 1 . . . . . 95 LYS HE2 . 27353 1 548 . 1 1 95 95 LYS HE3 H 1 3.01 0.02 . 1 . . . . . 95 LYS HE3 . 27353 1 549 . 1 1 95 95 LYS HZ1 H 1 7.92 0.02 . 1 . . . . . 95 LYS HZ . 27353 1 550 . 1 1 95 95 LYS HZ2 H 1 7.92 0.02 . 1 . . . . . 95 LYS HZ . 27353 1 551 . 1 1 95 95 LYS HZ3 H 1 7.92 0.02 . 1 . . . . . 95 LYS HZ . 27353 1 552 . 1 1 95 95 LYS C C 13 173.8 0.2 . 1 . . . . . 95 LYS C . 27353 1 553 . 1 1 95 95 LYS CA C 13 55.9 0.2 . 1 . . . . . 95 LYS CA . 27353 1 554 . 1 1 95 95 LYS CB C 13 36.1 0.2 . 1 . . . . . 95 LYS CB . 27353 1 555 . 1 1 95 95 LYS CG C 13 24.7 0.2 . 1 . . . . . 95 LYS CG . 27353 1 556 . 1 1 95 95 LYS CD C 13 29.7 0.2 . 1 . . . . . 95 LYS CD . 27353 1 557 . 1 1 95 95 LYS CE C 13 42 0.2 . 1 . . . . . 95 LYS CE . 27353 1 558 . 1 1 95 95 LYS N N 15 122.5 0.2 . 1 . . . . . 95 LYS N . 27353 1 559 . 1 1 96 96 LEU H H 1 8.74 0.02 . 1 . . . . . 96 LEU H . 27353 1 560 . 1 1 96 96 LEU HA H 1 4.14 0.02 . 1 . . . . . 96 LEU HA . 27353 1 561 . 1 1 96 96 LEU HB2 H 1 1.32 0.02 . 1 . . . . . 96 LEU HB2 . 27353 1 562 . 1 1 96 96 LEU HB3 H 1 1.32 0.02 . 1 . . . . . 96 LEU HB3 . 27353 1 563 . 1 1 96 96 LEU HD11 H 1 0.77 0.02 . 1 . . . . . 96 LEU HD1 . 27353 1 564 . 1 1 96 96 LEU HD12 H 1 0.77 0.02 . 1 . . . . . 96 LEU HD1 . 27353 1 565 . 1 1 96 96 LEU HD13 H 1 0.77 0.02 . 1 . . . . . 96 LEU HD1 . 27353 1 566 . 1 1 96 96 LEU HD21 H 1 0.77 0.02 . 1 . . . . . 96 LEU HD2 . 27353 1 567 . 1 1 96 96 LEU HD22 H 1 0.77 0.02 . 1 . . . . . 96 LEU HD2 . 27353 1 568 . 1 1 96 96 LEU HD23 H 1 0.77 0.02 . 1 . . . . . 96 LEU HD2 . 27353 1 569 . 1 1 96 96 LEU C C 13 174.7 0.2 . 1 . . . . . 96 LEU C . 27353 1 570 . 1 1 96 96 LEU CA C 13 53.7 0.2 . 1 . . . . . 96 LEU CA . 27353 1 571 . 1 1 96 96 LEU CB C 13 44.8 0.2 . 1 . . . . . 96 LEU CB . 27353 1 572 . 1 1 96 96 LEU CD1 C 13 26.5 0.2 . 1 . . . . . 96 LEU CD1 . 27353 1 573 . 1 1 96 96 LEU CD2 C 13 26.5 0.2 . 1 . . . . . 96 LEU CD2 . 27353 1 574 . 1 1 96 96 LEU N N 15 129.3 0.2 . 1 . . . . . 96 LEU N . 27353 1 575 . 1 1 97 97 THR H H 1 8.61 0.02 . 1 . . . . . 97 THR H . 27353 1 576 . 1 1 97 97 THR HA H 1 4.24 0.02 . 1 . . . . . 97 THR HA . 27353 1 577 . 1 1 97 97 THR HB H 1 2.41 0.02 . 1 . . . . . 97 THR HB . 27353 1 578 . 1 1 97 97 THR HG21 H 1 1.16 0.02 . 1 . . . . . 97 THR HG2 . 27353 1 579 . 1 1 97 97 THR HG22 H 1 1.16 0.02 . 1 . . . . . 97 THR HG2 . 27353 1 580 . 1 1 97 97 THR HG23 H 1 1.16 0.02 . 1 . . . . . 97 THR HG2 . 27353 1 581 . 1 1 97 97 THR C C 13 172.5 0.2 . 1 . . . . . 97 THR C . 27353 1 582 . 1 1 97 97 THR CA C 13 62.1 0.2 . 1 . . . . . 97 THR CA . 27353 1 583 . 1 1 97 97 THR CB C 13 69.5 0.2 . 1 . . . . . 97 THR CB . 27353 1 584 . 1 1 97 97 THR CG2 C 13 21.5 0.2 . 1 . . . . . 97 THR CG2 . 27353 1 585 . 1 1 97 97 THR N N 15 125.1 0.2 . 1 . . . . . 97 THR N . 27353 1 586 . 1 1 98 98 VAL H H 1 8.88 0.02 . 1 . . . . . 98 VAL H . 27353 1 587 . 1 1 98 98 VAL HA H 1 4.25 0.02 . 1 . . . . . 98 VAL HA . 27353 1 588 . 1 1 98 98 VAL HB H 1 1.96 0.02 . 1 . . . . . 98 VAL HB . 27353 1 589 . 1 1 98 98 VAL HG11 H 1 1.15 0.02 . 1 . . . . . 98 VAL HG1 . 27353 1 590 . 1 1 98 98 VAL HG12 H 1 1.15 0.02 . 1 . . . . . 98 VAL HG1 . 27353 1 591 . 1 1 98 98 VAL HG13 H 1 1.15 0.02 . 1 . . . . . 98 VAL HG1 . 27353 1 592 . 1 1 98 98 VAL HG21 H 1 0.75 0.02 . 1 . . . . . 98 VAL HG2 . 27353 1 593 . 1 1 98 98 VAL HG22 H 1 0.75 0.02 . 1 . . . . . 98 VAL HG2 . 27353 1 594 . 1 1 98 98 VAL HG23 H 1 0.75 0.02 . 1 . . . . . 98 VAL HG2 . 27353 1 595 . 1 1 98 98 VAL C C 13 175 0.2 . 1 . . . . . 98 VAL C . 27353 1 596 . 1 1 98 98 VAL CA C 13 61.8 0.2 . 1 . . . . . 98 VAL CA . 27353 1 597 . 1 1 98 98 VAL CB C 13 34.2 0.2 . 1 . . . . . 98 VAL CB . 27353 1 598 . 1 1 98 98 VAL CG1 C 13 21.5 0.2 . 1 . . . . . 98 VAL CG1 . 27353 1 599 . 1 1 98 98 VAL CG2 C 13 21.5 0.2 . 1 . . . . . 98 VAL CG2 . 27353 1 600 . 1 1 98 98 VAL N N 15 126 0.2 . 1 . . . . . 98 VAL N . 27353 1 601 . 1 1 99 99 GLY H H 1 8.82 0.02 . 1 . . . . . 99 GLY H . 27353 1 602 . 1 1 99 99 GLY HA2 H 1 3.69 0.02 . 1 . . . . . 99 GLY HA2 . 27353 1 603 . 1 1 99 99 GLY HA3 H 1 3.44 0.02 . 1 . . . . . 99 GLY HA3 . 27353 1 604 . 1 1 99 99 GLY C C 13 173.2 0.2 . 1 . . . . . 99 GLY C . 27353 1 605 . 1 1 99 99 GLY CA C 13 45.3 0.2 . 1 . . . . . 99 GLY CA . 27353 1 606 . 1 1 99 99 GLY N N 15 117.7 0.2 . 1 . . . . . 99 GLY N . 27353 1 607 . 1 1 100 100 GLU H H 1 8.5 0.02 . 1 . . . . . 100 GLU H . 27353 1 608 . 1 1 100 100 GLU HA H 1 4.49 0.02 . 1 . . . . . 100 GLU HA . 27353 1 609 . 1 1 100 100 GLU HB2 H 1 2.22 0.02 . 1 . . . . . 100 GLU HB2 . 27353 1 610 . 1 1 100 100 GLU HB3 H 1 2.13 0.02 . 1 . . . . . 100 GLU HB3 . 27353 1 611 . 1 1 100 100 GLU HG2 H 1 2.36 0.02 . 1 . . . . . 100 GLU HG2 . 27353 1 612 . 1 1 100 100 GLU HG3 H 1 2.36 0.02 . 1 . . . . . 100 GLU HG3 . 27353 1 613 . 1 1 100 100 GLU C C 13 177 0.2 . 1 . . . . . 100 GLU C . 27353 1 614 . 1 1 100 100 GLU CA C 13 57.5 0.2 . 1 . . . . . 100 GLU CA . 27353 1 615 . 1 1 100 100 GLU CB C 13 28.8 0.2 . 1 . . . . . 100 GLU CB . 27353 1 616 . 1 1 100 100 GLU CG C 13 36.1 0.2 . 1 . . . . . 100 GLU CG . 27353 1 617 . 1 1 100 100 GLU N N 15 121.9 0.2 . 1 . . . . . 100 GLU N . 27353 1 618 . 1 1 101 101 GLY H H 1 8.92 0.02 . 1 . . . . . 101 GLY H . 27353 1 619 . 1 1 101 101 GLY HA2 H 1 4.1 0.02 . 1 . . . . . 101 GLY HA2 . 27353 1 620 . 1 1 101 101 GLY HA3 H 1 3.6 0.02 . 1 . . . . . 101 GLY HA3 . 27353 1 621 . 1 1 101 101 GLY C C 13 172.9 0.2 . 1 . . . . . 101 GLY C . 27353 1 622 . 1 1 101 101 GLY CA C 13 46.1 0.2 . 1 . . . . . 101 GLY CA . 27353 1 623 . 1 1 101 101 GLY N N 15 111.5 0.2 . 1 . . . . . 101 GLY N . 27353 1 624 . 1 1 102 102 VAL H H 1 7.39 0.02 . 1 . . . . . 102 VAL H . 27353 1 625 . 1 1 102 102 VAL HA H 1 4.37 0.02 . 1 . . . . . 102 VAL HA . 27353 1 626 . 1 1 102 102 VAL HB H 1 1.87 0.02 . 1 . . . . . 102 VAL HB . 27353 1 627 . 1 1 102 102 VAL HG11 H 1 1.25 0.02 . 1 . . . . . 102 VAL HG1 . 27353 1 628 . 1 1 102 102 VAL HG12 H 1 1.25 0.02 . 1 . . . . . 102 VAL HG1 . 27353 1 629 . 1 1 102 102 VAL HG13 H 1 1.25 0.02 . 1 . . . . . 102 VAL HG1 . 27353 1 630 . 1 1 102 102 VAL HG21 H 1 1.03 0.02 . 1 . . . . . 102 VAL HG2 . 27353 1 631 . 1 1 102 102 VAL HG22 H 1 1.03 0.02 . 1 . . . . . 102 VAL HG2 . 27353 1 632 . 1 1 102 102 VAL HG23 H 1 1.03 0.02 . 1 . . . . . 102 VAL HG2 . 27353 1 633 . 1 1 102 102 VAL C C 13 172.8 0.2 . 1 . . . . . 102 VAL C . 27353 1 634 . 1 1 102 102 VAL CA C 13 61.5 0.2 . 1 . . . . . 102 VAL CA . 27353 1 635 . 1 1 102 102 VAL CB C 13 37.2 0.2 . 1 . . . . . 102 VAL CB . 27353 1 636 . 1 1 102 102 VAL CG1 C 13 22.7 0.2 . 1 . . . . . 102 VAL CG1 . 27353 1 637 . 1 1 102 102 VAL CG2 C 13 22.7 0.2 . 1 . . . . . 102 VAL CG2 . 27353 1 638 . 1 1 102 102 VAL N N 15 119.8 0.2 . 1 . . . . . 102 VAL N . 27353 1 639 . 1 1 103 103 ALA H H 1 9.43 0.02 . 1 . . . . . 103 ALA H . 27353 1 640 . 1 1 103 103 ALA HA H 1 4.89 0.02 . 1 . . . . . 103 ALA HA . 27353 1 641 . 1 1 103 103 ALA HB1 H 1 1.28 0.02 . 1 . . . . . 103 ALA HB . 27353 1 642 . 1 1 103 103 ALA HB2 H 1 1.28 0.02 . 1 . . . . . 103 ALA HB . 27353 1 643 . 1 1 103 103 ALA HB3 H 1 1.28 0.02 . 1 . . . . . 103 ALA HB . 27353 1 644 . 1 1 103 103 ALA C C 13 175.3 0.2 . 1 . . . . . 103 ALA C . 27353 1 645 . 1 1 103 103 ALA CA C 13 50.7 0.2 . 1 . . . . . 103 ALA CA . 27353 1 646 . 1 1 103 103 ALA CB C 13 24.9 0.2 . 1 . . . . . 103 ALA CB . 27353 1 647 . 1 1 103 103 ALA N N 15 126.4 0.2 . 1 . . . . . 103 ALA N . 27353 1 648 . 1 1 104 104 PHE H H 1 8.81 0.02 . 1 . . . . . 104 PHE H . 27353 1 649 . 1 1 104 104 PHE HA H 1 4.49 0.02 . 1 . . . . . 104 PHE HA . 27353 1 650 . 1 1 104 104 PHE HB2 H 1 2.77 0.02 . 1 . . . . . 104 PHE HB2 . 27353 1 651 . 1 1 104 104 PHE HB3 H 1 2.63 0.02 . 1 . . . . . 104 PHE HB3 . 27353 1 652 . 1 1 104 104 PHE C C 13 171.6 0.2 . 1 . . . . . 104 PHE C . 27353 1 653 . 1 1 104 104 PHE CA C 13 57.3 0.2 . 1 . . . . . 104 PHE CA . 27353 1 654 . 1 1 104 104 PHE CB C 13 41.5 0.2 . 1 . . . . . 104 PHE CB . 27353 1 655 . 1 1 104 104 PHE N N 15 111.6 0.2 . 1 . . . . . 104 PHE N . 27353 1 656 . 1 1 105 105 TRP H H 1 9.59 0.02 . 1 . . . . . 105 TRP H . 27353 1 657 . 1 1 105 105 TRP CA C 13 55.4 0.2 . 1 . . . . . 105 TRP CA . 27353 1 658 . 1 1 105 105 TRP CB C 13 34.8 0.2 . 1 . . . . . 105 TRP CB . 27353 1 659 . 1 1 105 105 TRP N N 15 124.5 0.2 . 1 . . . . . 105 TRP N . 27353 1 660 . 1 1 106 106 CYS H H 1 8.54 0.02 . 1 . . . . . 106 CYS H . 27353 1 661 . 1 1 106 106 CYS CA C 13 57.5 0.2 . 1 . . . . . 106 CYS CA . 27353 1 662 . 1 1 106 106 CYS N N 15 101.50 0.2 . 1 . . . . . 106 CYS N . 27353 1 663 . 1 1 107 107 GLY H H 1 7.7 0.02 . 1 . . . . . 107 GLY H . 27353 1 664 . 1 1 107 107 GLY CA C 13 45.4 0.2 . 1 . . . . . 107 GLY CA . 27353 1 665 . 1 1 107 107 GLY N N 15 119.9 0.2 . 1 . . . . . 107 GLY N . 27353 1 666 . 1 1 108 108 LEU H H 1 8.82 0.02 . 1 . . . . . 108 LEU H . 27353 1 667 . 1 1 108 108 LEU CA C 13 52 0.2 . 1 . . . . . 108 LEU CA . 27353 1 668 . 1 1 108 108 LEU N N 15 127.3 0.2 . 1 . . . . . 108 LEU N . 27353 1 669 . 1 1 109 109 THR H H 1 8 0.02 . 1 . . . . . 109 THR H . 27353 1 670 . 1 1 109 109 THR CB C 13 71.1 0.2 . 1 . . . . . 109 THR CB . 27353 1 671 . 1 1 109 109 THR N N 15 120.1 0.2 . 1 . . . . . 109 THR N . 27353 1 672 . 1 1 110 110 ARG H H 1 8.47 0.02 . 1 . . . . . 110 ARG H . 27353 1 673 . 1 1 110 110 ARG CA C 13 52.4 0.2 . 1 . . . . . 110 ARG CA . 27353 1 674 . 1 1 110 110 ARG CB C 13 33.1 0.2 . 1 . . . . . 110 ARG CB . 27353 1 675 . 1 1 110 110 ARG N N 15 127.9 0.2 . 1 . . . . . 110 ARG N . 27353 1 676 . 1 1 111 111 MET C C 13 174.4 0.2 . 1 . . . . . 111 MET C . 27353 1 677 . 1 1 112 112 THR H H 1 7.98 0.02 . 1 . . . . . 112 THR H . 27353 1 678 . 1 1 112 112 THR HA H 1 5.42 0.02 . 1 . . . . . 112 THR HA . 27353 1 679 . 1 1 112 112 THR HB H 1 3.94 0.02 . 1 . . . . . 112 THR HB . 27353 1 680 . 1 1 112 112 THR HG21 H 1 0.98 0.02 . 1 . . . . . 112 THR HG2 . 27353 1 681 . 1 1 112 112 THR HG22 H 1 0.98 0.02 . 1 . . . . . 112 THR HG2 . 27353 1 682 . 1 1 112 112 THR HG23 H 1 0.98 0.02 . 1 . . . . . 112 THR HG2 . 27353 1 683 . 1 1 112 112 THR C C 13 173 0.2 . 1 . . . . . 112 THR C . 27353 1 684 . 1 1 112 112 THR CA C 13 58.6 0.2 . 1 . . . . . 112 THR CA . 27353 1 685 . 1 1 112 112 THR CB C 13 71.7 0.2 . 1 . . . . . 112 THR CB . 27353 1 686 . 1 1 112 112 THR CG2 C 13 21.4 0.2 . 1 . . . . . 112 THR CG2 . 27353 1 687 . 1 1 112 112 THR N N 15 115.8 0.2 . 1 . . . . . 112 THR N . 27353 1 688 . 1 1 113 113 GLY H H 1 8.51 0.02 . 1 . . . . . 113 GLY H . 27353 1 689 . 1 1 113 113 GLY HA2 H 1 3.43 0.02 . 1 . . . . . 113 GLY HA2 . 27353 1 690 . 1 1 113 113 GLY HA3 H 1 3.11 0.02 . 1 . . . . . 113 GLY HA3 . 27353 1 691 . 1 1 113 113 GLY C C 13 171.8 0.2 . 1 . . . . . 113 GLY C . 27353 1 692 . 1 1 113 113 GLY CA C 13 45.4 0.2 . 1 . . . . . 113 GLY CA . 27353 1 693 . 1 1 113 113 GLY N N 15 108.1 0.2 . 1 . . . . . 113 GLY N . 27353 1 694 . 1 1 114 114 THR H H 1 9.54 0.02 . 1 . . . . . 114 THR H . 27353 1 695 . 1 1 114 114 THR HA H 1 5.12 0.02 . 1 . . . . . 114 THR HA . 27353 1 696 . 1 1 114 114 THR HB H 1 4 0.02 . 1 . . . . . 114 THR HB . 27353 1 697 . 1 1 114 114 THR HG21 H 1 1.28 0.02 . 1 . . . . . 114 THR HG2 . 27353 1 698 . 1 1 114 114 THR HG22 H 1 1.28 0.02 . 1 . . . . . 114 THR HG2 . 27353 1 699 . 1 1 114 114 THR HG23 H 1 1.28 0.02 . 1 . . . . . 114 THR HG2 . 27353 1 700 . 1 1 114 114 THR C C 13 173.8 0.2 . 1 . . . . . 114 THR C . 27353 1 701 . 1 1 114 114 THR CA C 13 61.5 0.2 . 1 . . . . . 114 THR CA . 27353 1 702 . 1 1 114 114 THR CB C 13 71.3 0.2 . 1 . . . . . 114 THR CB . 27353 1 703 . 1 1 114 114 THR CG2 C 13 21.2 0.2 . 1 . . . . . 114 THR CG2 . 27353 1 704 . 1 1 114 114 THR N N 15 118.7 0.2 . 1 . . . . . 114 THR N . 27353 1 705 . 1 1 115 115 LYS H H 1 9.15 0.02 . 1 . . . . . 115 LYS H . 27353 1 706 . 1 1 115 115 LYS HA H 1 4.7 0.02 . 1 . . . . . 115 LYS HA . 27353 1 707 . 1 1 115 115 LYS HB2 H 1 2.07 0.02 . 1 . . . . . 115 LYS HB2 . 27353 1 708 . 1 1 115 115 LYS HB3 H 1 2.07 0.02 . 1 . . . . . 115 LYS HB3 . 27353 1 709 . 1 1 115 115 LYS HG2 H 1 1.65 0.02 . 1 . . . . . 115 LYS HG2 . 27353 1 710 . 1 1 115 115 LYS HG3 H 1 1.21 0.02 . 1 . . . . . 115 LYS HG3 . 27353 1 711 . 1 1 115 115 LYS HD2 H 1 1.59 0.02 . 1 . . . . . 115 LYS HD2 . 27353 1 712 . 1 1 115 115 LYS HD3 H 1 0.74 0.02 . 1 . . . . . 115 LYS HD3 . 27353 1 713 . 1 1 115 115 LYS HE2 H 1 2.9 0.02 . 1 . . . . . 115 LYS HE2 . 27353 1 714 . 1 1 115 115 LYS HE3 H 1 2.9 0.02 . 1 . . . . . 115 LYS HE3 . 27353 1 715 . 1 1 115 115 LYS HZ1 H 1 7.25 0.02 . 1 . . . . . 115 LYS HZ . 27353 1 716 . 1 1 115 115 LYS HZ2 H 1 7.25 0.02 . 1 . . . . . 115 LYS HZ . 27353 1 717 . 1 1 115 115 LYS HZ3 H 1 7.25 0.02 . 1 . . . . . 115 LYS HZ . 27353 1 718 . 1 1 115 115 LYS C C 13 180.1 0.2 . 1 . . . . . 115 LYS C . 27353 1 719 . 1 1 115 115 LYS CA C 13 54.4 0.2 . 1 . . . . . 115 LYS CA . 27353 1 720 . 1 1 115 115 LYS CB C 13 32.3 0.2 . 1 . . . . . 115 LYS CB . 27353 1 721 . 1 1 115 115 LYS CG C 13 25.8 0.2 . 1 . . . . . 115 LYS CG . 27353 1 722 . 1 1 115 115 LYS CD C 13 28.6 0.2 . 1 . . . . . 115 LYS CD . 27353 1 723 . 1 1 115 115 LYS CE C 13 41.9 0.2 . 1 . . . . . 115 LYS CE . 27353 1 724 . 1 1 115 115 LYS N N 15 125.3 0.2 . 1 . . . . . 115 LYS N . 27353 1 725 . 1 1 116 116 THR H H 1 8.52 0.02 . 1 . . . . . 116 THR H . 27353 1 726 . 1 1 116 116 THR HA H 1 4.37 0.02 . 1 . . . . . 116 THR HA . 27353 1 727 . 1 1 116 116 THR HB H 1 3.98 0.02 . 1 . . . . . 116 THR HB . 27353 1 728 . 1 1 116 116 THR HG21 H 1 1.16 0.02 . 1 . . . . . 116 THR HG2 . 27353 1 729 . 1 1 116 116 THR HG22 H 1 1.16 0.02 . 1 . . . . . 116 THR HG2 . 27353 1 730 . 1 1 116 116 THR HG23 H 1 1.16 0.02 . 1 . . . . . 116 THR HG2 . 27353 1 731 . 1 1 116 116 THR C C 13 175.3 0.2 . 1 . . . . . 116 THR C . 27353 1 732 . 1 1 116 116 THR CA C 13 64.7 0.2 . 1 . . . . . 116 THR CA . 27353 1 733 . 1 1 116 116 THR CB C 13 68.4 0.2 . 1 . . . . . 116 THR CB . 27353 1 734 . 1 1 116 116 THR CG2 C 13 21.5 0.2 . 1 . . . . . 116 THR CG2 . 27353 1 735 . 1 1 116 116 THR N N 15 112.7 0.2 . 1 . . . . . 116 THR N . 27353 1 736 . 1 1 117 117 ASP H H 1 7.35 0.02 . 1 . . . . . 117 ASP H . 27353 1 737 . 1 1 117 117 ASP HA H 1 4.56 0.02 . 1 . . . . . 117 ASP HA . 27353 1 738 . 1 1 117 117 ASP HB2 H 1 2.92 0.02 . 1 . . . . . 117 ASP HB2 . 27353 1 739 . 1 1 117 117 ASP HB3 H 1 2.55 0.02 . 1 . . . . . 117 ASP HB3 . 27353 1 740 . 1 1 117 117 ASP C C 13 177.1 0.2 . 1 . . . . . 117 ASP C . 27353 1 741 . 1 1 117 117 ASP CA C 13 53.2 0.2 . 1 . . . . . 117 ASP CA . 27353 1 742 . 1 1 117 117 ASP CB C 13 39.7 0.2 . 1 . . . . . 117 ASP CB . 27353 1 743 . 1 1 117 117 ASP N N 15 118 0.2 . 1 . . . . . 117 ASP N . 27353 1 744 . 1 1 118 118 GLY H H 1 8.13 0.02 . 1 . . . . . 118 GLY H . 27353 1 745 . 1 1 118 118 GLY HA2 H 1 4.19 0.02 . 1 . . . . . 118 GLY HA2 . 27353 1 746 . 1 1 118 118 GLY HA3 H 1 3.53 0.02 . 1 . . . . . 118 GLY HA3 . 27353 1 747 . 1 1 118 118 GLY C C 13 175 0.2 . 1 . . . . . 118 GLY C . 27353 1 748 . 1 1 118 118 GLY CA C 13 44.6 0.2 . 1 . . . . . 118 GLY CA . 27353 1 749 . 1 1 118 118 GLY N N 15 108.5 0.2 . 1 . . . . . 118 GLY N . 27353 1 750 . 1 1 119 119 THR H H 1 8.03 0.02 . 1 . . . . . 119 THR H . 27353 1 751 . 1 1 119 119 THR HA H 1 3.96 0.02 . 1 . . . . . 119 THR HA . 27353 1 752 . 1 1 119 119 THR HB H 1 3.93 0.02 . 1 . . . . . 119 THR HB . 27353 1 753 . 1 1 119 119 THR HG21 H 1 1.13 0.02 . 1 . . . . . 119 THR HG2 . 27353 1 754 . 1 1 119 119 THR HG22 H 1 1.13 0.02 . 1 . . . . . 119 THR HG2 . 27353 1 755 . 1 1 119 119 THR HG23 H 1 1.13 0.02 . 1 . . . . . 119 THR HG2 . 27353 1 756 . 1 1 119 119 THR C C 13 173.4 0.2 . 1 . . . . . 119 THR C . 27353 1 757 . 1 1 119 119 THR CA C 13 64.3 0.2 . 1 . . . . . 119 THR CA . 27353 1 758 . 1 1 119 119 THR CB C 13 69.2 0.2 . 1 . . . . . 119 THR CB . 27353 1 759 . 1 1 119 119 THR CG2 C 13 21.4 0.2 . 1 . . . . . 119 THR CG2 . 27353 1 760 . 1 1 119 119 THR N N 15 117.3 0.2 . 1 . . . . . 119 THR N . 27353 1 761 . 1 1 120 120 LYS H H 1 8.69 0.02 . 1 . . . . . 120 LYS H . 27353 1 762 . 1 1 120 120 LYS HA H 1 4.85 0.02 . 1 . . . . . 120 LYS HA . 27353 1 763 . 1 1 120 120 LYS HB2 H 1 1.87 0.02 . 1 . . . . . 120 LYS HB2 . 27353 1 764 . 1 1 120 120 LYS HB3 H 1 1.87 0.02 . 1 . . . . . 120 LYS HB3 . 27353 1 765 . 1 1 120 120 LYS HG2 H 1 1.66 0.02 . 1 . . . . . 120 LYS HG2 . 27353 1 766 . 1 1 120 120 LYS HG3 H 1 1.6 0.02 . 1 . . . . . 120 LYS HG3 . 27353 1 767 . 1 1 120 120 LYS HD2 H 1 1.75 0.02 . 1 . . . . . 120 LYS HD2 . 27353 1 768 . 1 1 120 120 LYS HD3 H 1 1.75 0.02 . 1 . . . . . 120 LYS HD3 . 27353 1 769 . 1 1 120 120 LYS HE2 H 1 3.24 0.02 . 1 . . . . . 120 LYS HE2 . 27353 1 770 . 1 1 120 120 LYS HE3 H 1 3.24 0.02 . 1 . . . . . 120 LYS HE3 . 27353 1 771 . 1 1 120 120 LYS HZ1 H 1 8.08 0.02 . 1 . . . . . 120 LYS HZ . 27353 1 772 . 1 1 120 120 LYS HZ2 H 1 8.08 0.02 . 1 . . . . . 120 LYS HZ . 27353 1 773 . 1 1 120 120 LYS HZ3 H 1 8.08 0.02 . 1 . . . . . 120 LYS HZ . 27353 1 774 . 1 1 120 120 LYS C C 13 176.4 0.2 . 1 . . . . . 120 LYS C . 27353 1 775 . 1 1 120 120 LYS CA C 13 55.8 0.2 . 1 . . . . . 120 LYS CA . 27353 1 776 . 1 1 120 120 LYS CB C 13 32.9 0.2 . 1 . . . . . 120 LYS CB . 27353 1 777 . 1 1 120 120 LYS CG C 13 26.4 0.2 . 1 . . . . . 120 LYS CG . 27353 1 778 . 1 1 120 120 LYS CD C 13 29 0.2 . 1 . . . . . 120 LYS CD . 27353 1 779 . 1 1 120 120 LYS CE C 13 43.6 0.2 . 1 . . . . . 120 LYS CE . 27353 1 780 . 1 1 120 120 LYS N N 15 125.9 0.2 . 1 . . . . . 120 LYS N . 27353 1 781 . 1 1 121 121 VAL H H 1 9.01 0.02 . 1 . . . . . 121 VAL H . 27353 1 782 . 1 1 121 121 VAL HA H 1 4.22 0.02 . 1 . . . . . 121 VAL HA . 27353 1 783 . 1 1 121 121 VAL HB H 1 1.97 0.02 . 1 . . . . . 121 VAL HB . 27353 1 784 . 1 1 121 121 VAL HG11 H 1 1.07 0.02 . 1 . . . . . 121 VAL HG1 . 27353 1 785 . 1 1 121 121 VAL HG12 H 1 1.07 0.02 . 1 . . . . . 121 VAL HG1 . 27353 1 786 . 1 1 121 121 VAL HG13 H 1 1.07 0.02 . 1 . . . . . 121 VAL HG1 . 27353 1 787 . 1 1 121 121 VAL HG21 H 1 0.75 0.02 . 1 . . . . . 121 VAL HG2 . 27353 1 788 . 1 1 121 121 VAL HG22 H 1 0.75 0.02 . 1 . . . . . 121 VAL HG2 . 27353 1 789 . 1 1 121 121 VAL HG23 H 1 0.75 0.02 . 1 . . . . . 121 VAL HG2 . 27353 1 790 . 1 1 121 121 VAL C C 13 175.5 0.2 . 1 . . . . . 121 VAL C . 27353 1 791 . 1 1 121 121 VAL CA C 13 61.8 0.2 . 1 . . . . . 121 VAL CA . 27353 1 792 . 1 1 121 121 VAL CB C 13 34.6 0.2 . 1 . . . . . 121 VAL CB . 27353 1 793 . 1 1 121 121 VAL CG1 C 13 21.6 0.2 . 1 . . . . . 121 VAL CG1 . 27353 1 794 . 1 1 121 121 VAL CG2 C 13 21.6 0.2 . 1 . . . . . 121 VAL CG2 . 27353 1 795 . 1 1 121 121 VAL N N 15 125.4 0.2 . 1 . . . . . 121 VAL N . 27353 1 796 . 1 1 122 122 ASP H H 1 8.7 0.02 . 1 . . . . . 122 ASP H . 27353 1 797 . 1 1 122 122 ASP HA H 1 4.6 0.02 . 1 . . . . . 122 ASP HA . 27353 1 798 . 1 1 122 122 ASP HB2 H 1 2.9 0.02 . 1 . . . . . 122 ASP HB2 . 27353 1 799 . 1 1 122 122 ASP HB3 H 1 2.9 0.02 . 1 . . . . . 122 ASP HB3 . 27353 1 800 . 1 1 122 122 ASP C C 13 174 0.2 . 1 . . . . . 122 ASP C . 27353 1 801 . 1 1 122 122 ASP CA C 13 54.5 0.2 . 1 . . . . . 122 ASP CA . 27353 1 802 . 1 1 122 122 ASP CB C 13 41 0.2 . 1 . . . . . 122 ASP CB . 27353 1 803 . 1 1 122 122 ASP N N 15 128.3 0.2 . 1 . . . . . 122 ASP N . 27353 1 804 . 1 1 123 123 LEU H H 1 8.77 0.02 . 1 . . . . . 123 LEU H . 27353 1 805 . 1 1 123 123 LEU HA H 1 4.23 0.02 . 1 . . . . . 123 LEU HA . 27353 1 806 . 1 1 123 123 LEU HB2 H 1 1.92 0.02 . 1 . . . . . 123 LEU HB2 . 27353 1 807 . 1 1 123 123 LEU HB3 H 1 1.66 0.02 . 1 . . . . . 123 LEU HB3 . 27353 1 808 . 1 1 123 123 LEU HG H 1 1.59 0.02 . 1 . . . . . 123 LEU HG . 27353 1 809 . 1 1 123 123 LEU HD11 H 1 1.21 0.02 . 1 . . . . . 123 LEU HD1 . 27353 1 810 . 1 1 123 123 LEU HD12 H 1 1.21 0.02 . 1 . . . . . 123 LEU HD1 . 27353 1 811 . 1 1 123 123 LEU HD13 H 1 1.21 0.02 . 1 . . . . . 123 LEU HD1 . 27353 1 812 . 1 1 123 123 LEU HD21 H 1 0.98 0.02 . 1 . . . . . 123 LEU HD2 . 27353 1 813 . 1 1 123 123 LEU HD22 H 1 0.98 0.02 . 1 . . . . . 123 LEU HD2 . 27353 1 814 . 1 1 123 123 LEU HD23 H 1 0.98 0.02 . 1 . . . . . 123 LEU HD2 . 27353 1 815 . 1 1 123 123 LEU C C 13 174.8 0.2 . 1 . . . . . 123 LEU C . 27353 1 816 . 1 1 123 123 LEU CA C 13 54.4 0.2 . 1 . . . . . 123 LEU CA . 27353 1 817 . 1 1 123 123 LEU CB C 13 46.9 0.2 . 1 . . . . . 123 LEU CB . 27353 1 818 . 1 1 123 123 LEU CG C 13 28.5 0.2 . 1 . . . . . 123 LEU CG . 27353 1 819 . 1 1 123 123 LEU CD1 C 13 26 0.2 . 1 . . . . . 123 LEU CD1 . 27353 1 820 . 1 1 123 123 LEU CD2 C 13 26 0.2 . 1 . . . . . 123 LEU CD2 . 27353 1 821 . 1 1 123 123 LEU N N 15 127.4 0.2 . 1 . . . . . 123 LEU N . 27353 1 822 . 1 1 124 124 TRP H H 1 8.68 0.02 . 1 . . . . . 124 TRP H . 27353 1 823 . 1 1 124 124 TRP HA H 1 4.75 0.02 . 1 . . . . . 124 TRP HA . 27353 1 824 . 1 1 124 124 TRP HB2 H 1 2.93 0.02 . 1 . . . . . 124 TRP HB2 . 27353 1 825 . 1 1 124 124 TRP HB3 H 1 2.93 0.02 . 1 . . . . . 124 TRP HB3 . 27353 1 826 . 1 1 124 124 TRP C C 13 175.1 0.2 . 1 . . . . . 124 TRP C . 27353 1 827 . 1 1 124 124 TRP CA C 13 58.3 0.2 . 1 . . . . . 124 TRP CA . 27353 1 828 . 1 1 124 124 TRP CB C 13 30.3 0.2 . 1 . . . . . 124 TRP CB . 27353 1 829 . 1 1 124 124 TRP N N 15 123.5 0.2 . 1 . . . . . 124 TRP N . 27353 1 830 . 1 1 125 125 PHE H H 1 7.85 0.02 . 1 . . . . . 125 PHE H . 27353 1 831 . 1 1 125 125 PHE C C 13 175 0.2 . 1 . . . . . 125 PHE C . 27353 1 832 . 1 1 125 125 PHE CA C 13 62.4 0.2 . 1 . . . . . 125 PHE CA . 27353 1 833 . 1 1 125 125 PHE CB C 13 38 0.2 . 1 . . . . . 125 PHE CB . 27353 1 834 . 1 1 126 126 ARG H H 1 7.47 0.02 . 1 . . . . . 126 ARG H . 27353 1 835 . 1 1 126 126 ARG HA H 1 4.46 0.02 . 1 . . . . . 126 ARG HA . 27353 1 836 . 1 1 126 126 ARG HB2 H 1 1.88 0.02 . 1 . . . . . 126 ARG HB2 . 27353 1 837 . 1 1 126 126 ARG HB3 H 1 1.79 0.02 . 1 . . . . . 126 ARG HB3 . 27353 1 838 . 1 1 126 126 ARG HG2 H 1 1.71 0.02 . 1 . . . . . 126 ARG HG2 . 27353 1 839 . 1 1 126 126 ARG HG3 H 1 1.64 0.02 . 1 . . . . . 126 ARG HG3 . 27353 1 840 . 1 1 126 126 ARG HD2 H 1 3.27 0.02 . 1 . . . . . 126 ARG HD2 . 27353 1 841 . 1 1 126 126 ARG HD3 H 1 3.27 0.02 . 1 . . . . . 126 ARG HD3 . 27353 1 842 . 1 1 126 126 ARG HE H 1 7.48 0.02 . 1 . . . . . 126 ARG HE . 27353 1 843 . 1 1 126 126 ARG C C 13 175.7 0.2 . 1 . . . . . 126 ARG C . 27353 1 844 . 1 1 126 126 ARG CA C 13 56.6 0.2 . 1 . . . . . 126 ARG CA . 27353 1 845 . 1 1 126 126 ARG CB C 13 31.3 0.2 . 1 . . . . . 126 ARG CB . 27353 1 846 . 1 1 126 126 ARG CG C 13 27.2 0.2 . 1 . . . . . 126 ARG CG . 27353 1 847 . 1 1 126 126 ARG CD C 13 43.3 0.2 . 1 . . . . . 126 ARG CD . 27353 1 848 . 1 1 126 126 ARG N N 15 118.9 0.2 . 1 . . . . . 126 ARG N . 27353 1 849 . 1 1 127 127 GLN H H 1 7.79 0.02 . 1 . . . . . 127 GLN H . 27353 1 850 . 1 1 127 127 GLN CA C 13 61.7 0.2 . 1 . . . . . 127 GLN CA . 27353 1 851 . 1 1 127 127 GLN CB C 13 28.7 0.2 . 1 . . . . . 127 GLN CB . 27353 1 852 . 1 1 127 127 GLN N N 15 119.1 0.2 . 1 . . . . . 127 GLN N . 27353 1 stop_ save_