data_19303 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19303 _Entry.Title ; Solution Structure of (HhH)2 domain of human FAAP24 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-06-18 _Entry.Accession_date 2013-06-18 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Fangming Wu . . . 19303 2 Xiao Han . . . 19303 3 Chaowei Shi . . . 19303 4 Weimin Gong . . . 19303 5 Changlin Tian . . . 19303 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 19303 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID FAAP24 . 19303 'Fanconi anemia' . 19303 '(HhH)2 domain' . 19303 'Solution NMR' . 19303 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19303 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 196 19303 '15N chemical shifts' 56 19303 '1H chemical shifts' 415 19303 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 . . 2013-10-09 2013-06-18 update BMRB 'update entry citation' 19303 1 . . 2013-09-16 2013-06-18 original author 'original release' 19303 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 19302 'ERCC4 domain of human FAAP24' 19303 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19303 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23999858 _Citation.Full_citation . _Citation.Title 'Structure analysis of FAAP24 reveals single-stranded DNA-binding activity and domain functions in DNA damage response.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Cell Res.' _Citation.Journal_name_full 'Cell research' _Citation.Journal_volume 23 _Citation.Journal_issue 10 _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 1215 _Citation.Page_last 1228 _Citation.Year 2013 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Yucai Wang . . . 19303 1 2 Xiao Han . . . 19303 1 3 Fangming Wu . . . 19303 1 4 Justin Leung . W. . 19303 1 5 Megan Lowery . G. . 19303 1 6 Huong Do . . . 19303 1 7 Junjie Chen . . . 19303 1 8 Chaowei Shi . . . 19303 1 9 Changlin Tian . . . 19303 1 10 Lei Li . . . 19303 1 11 Weimin Gong . . . 19303 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19303 _Assembly.ID 1 _Assembly.Name '(HhH)2 domain of human FAAP24' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _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 '(HhH)2 domain of human FAAP24' 1 $entity A . yes native no no . . . 19303 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 19303 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name FAAP24_HhH2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSSEPSLLRTVQQIPGVGKV KAPLLLQKFPSIQQLSNASI GELEQVVGQAVAQQIHAFFT QPR ; _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 63 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 6628.704 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 18725 . Faap24 . . . . . 96.83 95 100.00 100.00 8.83e-33 . . . . 19303 1 2 no PDB 2LYH . "Structure Of Faap24 Residues 141-215" . . . . . 96.83 98 100.00 100.00 1.19e-32 . . . . 19303 1 3 no PDB 2M9N . "Solution Structure Of (hhh)2 Domain Of Human Faap24" . . . . . 100.00 63 100.00 100.00 4.78e-34 . . . . 19303 1 4 no PDB 4BXO . "Architecture And Dna Recognition Elements Of The Fanconi Anemia Fancm-faap24 Complex" . . . . . 95.24 217 100.00 100.00 1.20e-30 . . . . 19303 1 5 no PDB 4M6W . "Crystal Structure Of The C-terminal Segment Of Fancm In Complex With Faap24" . . . . . 96.83 208 100.00 100.00 8.19e-32 . . . . 19303 1 6 no DBJ BAG54708 . "unnamed protein product [Homo sapiens]" . . . . . 96.83 215 100.00 100.00 1.23e-31 . . . . 19303 1 7 no GB AAH03535 . "Chromosome 19 open reading frame 40 [Homo sapiens]" . . . . . 96.83 215 100.00 100.00 1.23e-31 . . . . 19303 1 8 no GB AAH10170 . "Chromosome 19 open reading frame 40 [Homo sapiens]" . . . . . 96.83 215 100.00 100.00 1.23e-31 . . . . 19303 1 9 no GB AAH20247 . "Chromosome 19 open reading frame 40 [Homo sapiens]" . . . . . 96.83 215 100.00 100.00 1.23e-31 . . . . 19303 1 10 no GB ADQ32151 . "chromosome 19 open reading frame 40 [synthetic construct]" . . . . . 96.83 215 100.00 100.00 1.23e-31 . . . . 19303 1 11 no GB AIC52732 . "C19orf40, partial [synthetic construct]" . . . . . 96.83 215 100.00 100.00 1.23e-31 . . . . 19303 1 12 no REF NP_001287907 . "Fanconi anemia core complex-associated protein 24 isoform 2 [Homo sapiens]" . . . . . 96.83 120 100.00 100.00 1.79e-32 . . . . 19303 1 13 no REF NP_689479 . "Fanconi anemia core complex-associated protein 24 isoform 1 [Homo sapiens]" . . . . . 96.83 215 100.00 100.00 1.23e-31 . . . . 19303 1 14 no REF XP_003780763 . "PREDICTED: LOW QUALITY PROTEIN: Fanconi anemia-associated protein of 24 kDa [Pongo abelii]" . . . . . 96.83 215 100.00 100.00 1.45e-31 . . . . 19303 1 15 no REF XP_003816251 . "PREDICTED: Fanconi anemia core complex-associated protein 24 isoform X2 [Pan paniscus]" . . . . . 96.83 215 100.00 100.00 1.36e-31 . . . . 19303 1 16 no REF XP_004060528 . "PREDICTED: Fanconi anemia-associated protein of 24 kDa [Gorilla gorilla gorilla]" . . . . . 96.83 89 100.00 100.00 1.33e-32 . . . . 19303 1 17 no SP Q9BTP7 . "RecName: Full=Fanconi anemia core complex-associated protein 24; AltName: Full=Fanconi anemia-associated protein of 24 kDa" . . . . . 96.83 215 100.00 100.00 1.23e-31 . . . . 19303 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 153 GLY . 19303 1 2 154 SER . 19303 1 3 155 SER . 19303 1 4 156 GLU . 19303 1 5 157 PRO . 19303 1 6 158 SER . 19303 1 7 159 LEU . 19303 1 8 160 LEU . 19303 1 9 161 ARG . 19303 1 10 162 THR . 19303 1 11 163 VAL . 19303 1 12 164 GLN . 19303 1 13 165 GLN . 19303 1 14 166 ILE . 19303 1 15 167 PRO . 19303 1 16 168 GLY . 19303 1 17 169 VAL . 19303 1 18 170 GLY . 19303 1 19 171 LYS . 19303 1 20 172 VAL . 19303 1 21 173 LYS . 19303 1 22 174 ALA . 19303 1 23 175 PRO . 19303 1 24 176 LEU . 19303 1 25 177 LEU . 19303 1 26 178 LEU . 19303 1 27 179 GLN . 19303 1 28 180 LYS . 19303 1 29 181 PHE . 19303 1 30 182 PRO . 19303 1 31 183 SER . 19303 1 32 184 ILE . 19303 1 33 185 GLN . 19303 1 34 186 GLN . 19303 1 35 187 LEU . 19303 1 36 188 SER . 19303 1 37 189 ASN . 19303 1 38 190 ALA . 19303 1 39 191 SER . 19303 1 40 192 ILE . 19303 1 41 193 GLY . 19303 1 42 194 GLU . 19303 1 43 195 LEU . 19303 1 44 196 GLU . 19303 1 45 197 GLN . 19303 1 46 198 VAL . 19303 1 47 199 VAL . 19303 1 48 200 GLY . 19303 1 49 201 GLN . 19303 1 50 202 ALA . 19303 1 51 203 VAL . 19303 1 52 204 ALA . 19303 1 53 205 GLN . 19303 1 54 206 GLN . 19303 1 55 207 ILE . 19303 1 56 208 HIS . 19303 1 57 209 ALA . 19303 1 58 210 PHE . 19303 1 59 211 PHE . 19303 1 60 212 THR . 19303 1 61 213 GLN . 19303 1 62 214 PRO . 19303 1 63 215 ARG . 19303 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 19303 1 . SER 2 2 19303 1 . SER 3 3 19303 1 . GLU 4 4 19303 1 . PRO 5 5 19303 1 . SER 6 6 19303 1 . LEU 7 7 19303 1 . LEU 8 8 19303 1 . ARG 9 9 19303 1 . THR 10 10 19303 1 . VAL 11 11 19303 1 . GLN 12 12 19303 1 . GLN 13 13 19303 1 . ILE 14 14 19303 1 . PRO 15 15 19303 1 . GLY 16 16 19303 1 . VAL 17 17 19303 1 . GLY 18 18 19303 1 . LYS 19 19 19303 1 . VAL 20 20 19303 1 . LYS 21 21 19303 1 . ALA 22 22 19303 1 . PRO 23 23 19303 1 . LEU 24 24 19303 1 . LEU 25 25 19303 1 . LEU 26 26 19303 1 . GLN 27 27 19303 1 . LYS 28 28 19303 1 . PHE 29 29 19303 1 . PRO 30 30 19303 1 . SER 31 31 19303 1 . ILE 32 32 19303 1 . GLN 33 33 19303 1 . GLN 34 34 19303 1 . LEU 35 35 19303 1 . SER 36 36 19303 1 . ASN 37 37 19303 1 . ALA 38 38 19303 1 . SER 39 39 19303 1 . ILE 40 40 19303 1 . GLY 41 41 19303 1 . GLU 42 42 19303 1 . LEU 43 43 19303 1 . GLU 44 44 19303 1 . GLN 45 45 19303 1 . VAL 46 46 19303 1 . VAL 47 47 19303 1 . GLY 48 48 19303 1 . GLN 49 49 19303 1 . ALA 50 50 19303 1 . VAL 51 51 19303 1 . ALA 52 52 19303 1 . GLN 53 53 19303 1 . GLN 54 54 19303 1 . ILE 55 55 19303 1 . HIS 56 56 19303 1 . ALA 57 57 19303 1 . PHE 58 58 19303 1 . PHE 59 59 19303 1 . THR 60 60 19303 1 . GLN 61 61 19303 1 . PRO 62 62 19303 1 . ARG 63 63 19303 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 19303 _Entity_natural_src_list.ID 1 loop_ _Entity_natural_src.ID _Entity_natural_src.Entity_ID _Entity_natural_src.Entity_label _Entity_natural_src.Entity_chimera_segment_ID _Entity_natural_src.NCBI_taxonomy_ID _Entity_natural_src.Type _Entity_natural_src.Common _Entity_natural_src.Organism_name_scientific _Entity_natural_src.Organism_name_common _Entity_natural_src.Organism_acronym _Entity_natural_src.ICTVdb_decimal_code _Entity_natural_src.Superkingdom _Entity_natural_src.Kingdom _Entity_natural_src.Genus _Entity_natural_src.Species _Entity_natural_src.Strain _Entity_natural_src.Variant _Entity_natural_src.Subvariant _Entity_natural_src.Organ _Entity_natural_src.Tissue _Entity_natural_src.Tissue_fraction _Entity_natural_src.Cell_line _Entity_natural_src.Cell_type _Entity_natural_src.ATCC_number _Entity_natural_src.Organelle _Entity_natural_src.Cellular_location _Entity_natural_src.Fragment _Entity_natural_src.Fraction _Entity_natural_src.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Plasmid_details _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Dev_stage _Entity_natural_src.Details _Entity_natural_src.Citation_ID _Entity_natural_src.Citation_label _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 19303 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 19303 _Entity_experimental_src_list.ID 1 loop_ _Entity_experimental_src.ID _Entity_experimental_src.Entity_ID _Entity_experimental_src.Entity_label _Entity_experimental_src.Entity_chimera_segment_ID _Entity_experimental_src.Production_method _Entity_experimental_src.Host_org_scientific_name _Entity_experimental_src.Host_org_name_common _Entity_experimental_src.Host_org_details _Entity_experimental_src.Host_org_NCBI_taxonomy_ID _Entity_experimental_src.Host_org_genus _Entity_experimental_src.Host_org_species _Entity_experimental_src.Host_org_strain _Entity_experimental_src.Host_org_variant _Entity_experimental_src.Host_org_subvariant _Entity_experimental_src.Host_org_organ _Entity_experimental_src.Host_org_tissue _Entity_experimental_src.Host_org_tissue_fraction _Entity_experimental_src.Host_org_cell_line _Entity_experimental_src.Host_org_cell_type _Entity_experimental_src.Host_org_cellular_location _Entity_experimental_src.Host_org_organelle _Entity_experimental_src.Host_org_gene _Entity_experimental_src.Host_org_culture_collection _Entity_experimental_src.Host_org_ATCC_number _Entity_experimental_src.Vector_type _Entity_experimental_src.PDBview_host_org_vector_name _Entity_experimental_src.PDBview_plasmid_name _Entity_experimental_src.Vector_name _Entity_experimental_src.Vector_details _Entity_experimental_src.Vendor_name _Entity_experimental_src.Host_org_dev_stage _Entity_experimental_src.Details _Entity_experimental_src.Citation_ID _Entity_experimental_src.Citation_label _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET-28 . . . . . . 19303 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19303 _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 FAAP24_HhH2 '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 0.5-0.8 . . mM . . . . 19303 1 2 'potassium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 19303 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 19303 1 4 beta-mercaptoethanol 'natural abundance' . . . . . . 1 . . mM . . . . 19303 1 5 EDTA 'natural abundance' . . . . . . 0.5 . . mM . . . . 19303 1 6 H2O 'natural abundance' . . . . . . 90 . . % . . . . 19303 1 7 D2O 'natural abundance' . . . . . . 10 . . % . . . . 19303 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 19303 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 FAAP24_HhH2 '[U-100% 13C; U-100% 15N]' . . 1 $entity . . 0.5-0.8 . . mM . . . . 19303 2 2 'potassium phosphate' 'natural abundance' . . . . . . 50 . . mM . . . . 19303 2 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 19303 2 4 beta-mercaptoethanol 'natural abundance' . . . . . . 1 . . mM . . . . 19303 2 5 EDTA 'natural abundance' . . . . . . 0.5 . . mM . . . . 19303 2 6 D2O 'natural abundance' . . . . . . 100 . . % . . . . 19303 2 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 19303 _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' 0.35 . M 19303 1 pH 6.0 . pH 19303 1 pressure 1 . atm 19303 1 temperature 298 . K 19303 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 19303 _Software.ID 1 _Software.Name NMRView _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 19303 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19303 1 stop_ save_ save_SPARKY _Software.Sf_category software _Software.Sf_framecode SPARKY _Software.Entry_ID 19303 _Software.ID 2 _Software.Name SPARKY _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 19303 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19303 2 stop_ save_ save_TALOS _Software.Sf_category software _Software.Sf_framecode TALOS _Software.Entry_ID 19303 _Software.ID 3 _Software.Name TALOS _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 19303 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 19303 3 stop_ save_ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 19303 _Software.ID 4 _Software.Name NMRPipe _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 19303 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 19303 4 stop_ save_ save_X-PLOR_NIH _Software.Sf_category software _Software.Sf_framecode X-PLOR_NIH _Software.Entry_ID 19303 _Software.ID 5 _Software.Name 'X-PLOR NIH' _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Schwieters, Kuszewski, Tjandra and Clore' . . 19303 5 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 19303 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 19303 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DMX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 19303 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 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 19303 _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 DMX . 850 . . . 19303 1 2 spectrometer_2 Varian INOVA . 700 . . . 19303 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 19303 _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 . . . . . . . . . . . . . . . . . . . . . 19303 1 2 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19303 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19303 1 4 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19303 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19303 1 6 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19303 1 7 '3D HBHA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19303 1 8 '3D H(CCO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19303 1 9 '3D C(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19303 1 10 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19303 1 11 '3D HCCH-COSY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19303 1 12 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19303 1 13 '3D 1H-13C NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 19303 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 19303 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . . . . . 19303 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 19303 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 19303 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 19303 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 19303 1 2 '3D CBCA(CO)NH' . . . 19303 1 3 '3D HNCACB' . . . 19303 1 5 '3D HNCA' . . . 19303 1 7 '3D HBHA(CO)NH' . . . 19303 1 8 '3D H(CCO)NH' . . . 19303 1 9 '3D C(CO)NH' . . . 19303 1 10 '3D HCCH-TOCSY' . . . 19303 1 11 '3D HCCH-COSY' . . . 19303 1 12 '3D 1H-15N NOESY' . . . 19303 1 13 '3D 1H-13C NOESY' . . . 19303 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 SER H H 1 7.973 0.000 . . . . . A 155 SER H . 19303 1 2 . 1 1 3 3 SER CA C 13 58.382 0.000 . . . . . A 155 SER CA . 19303 1 3 . 1 1 3 3 SER CB C 13 63.982 0.000 . . . . . A 155 SER CB . 19303 1 4 . 1 1 3 3 SER N N 15 115.669 0.000 . . . . . A 155 SER N . 19303 1 5 . 1 1 4 4 GLU H H 1 8.256 0.000 . . . . . A 156 GLU H . 19303 1 6 . 1 1 4 4 GLU CA C 13 54.943 0.000 . . . . . A 156 GLU CA . 19303 1 7 . 1 1 4 4 GLU CB C 13 29.595 0.000 . . . . . A 156 GLU CB . 19303 1 8 . 1 1 4 4 GLU N N 15 125.261 0.000 . . . . . A 156 GLU N . 19303 1 9 . 1 1 5 5 PRO HA H 1 4.218 0.014 . . . . . A 157 PRO HA . 19303 1 10 . 1 1 5 5 PRO HB2 H 1 1.762 0.012 . . . . . A 157 PRO HB2 . 19303 1 11 . 1 1 5 5 PRO HB3 H 1 2.119 0.015 . . . . . A 157 PRO HB3 . 19303 1 12 . 1 1 5 5 PRO HG2 H 1 1.828 0.004 . . . . . A 157 PRO HG2 . 19303 1 13 . 1 1 5 5 PRO HG3 H 1 1.828 0.004 . . . . . A 157 PRO HG3 . 19303 1 14 . 1 1 5 5 PRO HD2 H 1 3.615 0.018 . . . . . A 157 PRO HD2 . 19303 1 15 . 1 1 5 5 PRO HD3 H 1 3.615 0.018 . . . . . A 157 PRO HD3 . 19303 1 16 . 1 1 5 5 PRO CA C 13 63.554 0.069 . . . . . A 157 PRO CA . 19303 1 17 . 1 1 5 5 PRO CB C 13 32.001 0.137 . . . . . A 157 PRO CB . 19303 1 18 . 1 1 5 5 PRO CG C 13 27.380 0.000 . . . . . A 157 PRO CG . 19303 1 19 . 1 1 5 5 PRO CD C 13 50.690 0.000 . . . . . A 157 PRO CD . 19303 1 20 . 1 1 6 6 SER H H 1 8.260 0.012 . . . . . A 158 SER H . 19303 1 21 . 1 1 6 6 SER HA H 1 4.147 0.022 . . . . . A 158 SER HA . 19303 1 22 . 1 1 6 6 SER HB2 H 1 3.760 0.004 . . . . . A 158 SER HB2 . 19303 1 23 . 1 1 6 6 SER HB3 H 1 3.865 0.010 . . . . . A 158 SER HB3 . 19303 1 24 . 1 1 6 6 SER CA C 13 58.796 0.151 . . . . . A 158 SER CA . 19303 1 25 . 1 1 6 6 SER CB C 13 63.301 0.000 . . . . . A 158 SER CB . 19303 1 26 . 1 1 6 6 SER N N 15 115.564 0.056 . . . . . A 158 SER N . 19303 1 27 . 1 1 7 7 LEU H H 1 8.196 0.030 . . . . . A 159 LEU H . 19303 1 28 . 1 1 7 7 LEU HA H 1 4.016 0.015 . . . . . A 159 LEU HA . 19303 1 29 . 1 1 7 7 LEU HB2 H 1 1.644 0.014 . . . . . A 159 LEU HB2 . 19303 1 30 . 1 1 7 7 LEU HB3 H 1 1.464 0.025 . . . . . A 159 LEU HB3 . 19303 1 31 . 1 1 7 7 LEU HG H 1 1.414 0.009 . . . . . A 159 LEU HG . 19303 1 32 . 1 1 7 7 LEU HD11 H 1 0.709 0.013 . . . . . A 159 LEU HD11 . 19303 1 33 . 1 1 7 7 LEU HD12 H 1 0.709 0.013 . . . . . A 159 LEU HD12 . 19303 1 34 . 1 1 7 7 LEU HD13 H 1 0.709 0.013 . . . . . A 159 LEU HD13 . 19303 1 35 . 1 1 7 7 LEU HD21 H 1 0.781 0.011 . . . . . A 159 LEU HD21 . 19303 1 36 . 1 1 7 7 LEU HD22 H 1 0.781 0.011 . . . . . A 159 LEU HD22 . 19303 1 37 . 1 1 7 7 LEU HD23 H 1 0.781 0.011 . . . . . A 159 LEU HD23 . 19303 1 38 . 1 1 7 7 LEU CA C 13 57.781 0.062 . . . . . A 159 LEU CA . 19303 1 39 . 1 1 7 7 LEU CB C 13 41.496 0.065 . . . . . A 159 LEU CB . 19303 1 40 . 1 1 7 7 LEU CG C 13 26.789 0.007 . . . . . A 159 LEU CG . 19303 1 41 . 1 1 7 7 LEU CD1 C 13 23.501 0.170 . . . . . A 159 LEU CD1 . 19303 1 42 . 1 1 7 7 LEU CD2 C 13 25.727 0.093 . . . . . A 159 LEU CD2 . 19303 1 43 . 1 1 7 7 LEU N N 15 127.034 0.189 . . . . . A 159 LEU N . 19303 1 44 . 1 1 8 8 LEU H H 1 7.838 0.006 . . . . . A 160 LEU H . 19303 1 45 . 1 1 8 8 LEU HA H 1 3.692 0.006 . . . . . A 160 LEU HA . 19303 1 46 . 1 1 8 8 LEU HB2 H 1 1.312 0.012 . . . . . A 160 LEU HB2 . 19303 1 47 . 1 1 8 8 LEU HB3 H 1 1.494 0.016 . . . . . A 160 LEU HB3 . 19303 1 48 . 1 1 8 8 LEU HG H 1 1.208 0.007 . . . . . A 160 LEU HG . 19303 1 49 . 1 1 8 8 LEU HD11 H 1 0.670 0.000 . . . . . A 160 LEU HD11 . 19303 1 50 . 1 1 8 8 LEU HD12 H 1 0.670 0.000 . . . . . A 160 LEU HD12 . 19303 1 51 . 1 1 8 8 LEU HD13 H 1 0.670 0.000 . . . . . A 160 LEU HD13 . 19303 1 52 . 1 1 8 8 LEU HD21 H 1 0.653 0.000 . . . . . A 160 LEU HD21 . 19303 1 53 . 1 1 8 8 LEU HD22 H 1 0.653 0.000 . . . . . A 160 LEU HD22 . 19303 1 54 . 1 1 8 8 LEU HD23 H 1 0.653 0.000 . . . . . A 160 LEU HD23 . 19303 1 55 . 1 1 8 8 LEU CA C 13 58.756 0.249 . . . . . A 160 LEU CA . 19303 1 56 . 1 1 8 8 LEU CB C 13 41.428 0.000 . . . . . A 160 LEU CB . 19303 1 57 . 1 1 8 8 LEU CG C 13 26.959 0.021 . . . . . A 160 LEU CG . 19303 1 58 . 1 1 8 8 LEU CD1 C 13 25.254 0.016 . . . . . A 160 LEU CD1 . 19303 1 59 . 1 1 8 8 LEU CD2 C 13 23.419 0.044 . . . . . A 160 LEU CD2 . 19303 1 60 . 1 1 8 8 LEU N N 15 119.250 0.049 . . . . . A 160 LEU N . 19303 1 61 . 1 1 9 9 ARG H H 1 7.550 0.019 . . . . . A 161 ARG H . 19303 1 62 . 1 1 9 9 ARG HA H 1 3.763 0.014 . . . . . A 161 ARG HA . 19303 1 63 . 1 1 9 9 ARG HB2 H 1 1.669 0.008 . . . . . A 161 ARG HB2 . 19303 1 64 . 1 1 9 9 ARG HB3 H 1 1.669 0.008 . . . . . A 161 ARG HB3 . 19303 1 65 . 1 1 9 9 ARG CA C 13 59.026 0.174 . . . . . A 161 ARG CA . 19303 1 66 . 1 1 9 9 ARG CB C 13 29.801 0.000 . . . . . A 161 ARG CB . 19303 1 67 . 1 1 9 9 ARG CG C 13 27.515 0.000 . . . . . A 161 ARG CG . 19303 1 68 . 1 1 9 9 ARG CD C 13 43.199 0.000 . . . . . A 161 ARG CD . 19303 1 69 . 1 1 9 9 ARG N N 15 117.503 0.052 . . . . . A 161 ARG N . 19303 1 70 . 1 1 10 10 THR H H 1 7.743 0.012 . . . . . A 162 THR H . 19303 1 71 . 1 1 10 10 THR HA H 1 4.252 0.015 . . . . . A 162 THR HA . 19303 1 72 . 1 1 10 10 THR HB H 1 3.677 0.009 . . . . . A 162 THR HB . 19303 1 73 . 1 1 10 10 THR HG21 H 1 1.073 0.015 . . . . . A 162 THR HG21 . 19303 1 74 . 1 1 10 10 THR HG22 H 1 1.073 0.015 . . . . . A 162 THR HG22 . 19303 1 75 . 1 1 10 10 THR HG23 H 1 1.073 0.015 . . . . . A 162 THR HG23 . 19303 1 76 . 1 1 10 10 THR CA C 13 63.719 0.000 . . . . . A 162 THR CA . 19303 1 77 . 1 1 10 10 THR CB C 13 66.712 0.051 . . . . . A 162 THR CB . 19303 1 78 . 1 1 10 10 THR CG2 C 13 21.258 0.089 . . . . . A 162 THR CG2 . 19303 1 79 . 1 1 10 10 THR N N 15 116.102 0.023 . . . . . A 162 THR N . 19303 1 80 . 1 1 11 11 VAL H H 1 8.029 0.011 . . . . . A 163 VAL H . 19303 1 81 . 1 1 11 11 VAL HA H 1 3.374 0.039 . . . . . A 163 VAL HA . 19303 1 82 . 1 1 11 11 VAL HB H 1 1.890 0.008 . . . . . A 163 VAL HB . 19303 1 83 . 1 1 11 11 VAL HG11 H 1 0.829 0.013 . . . . . A 163 VAL HG11 . 19303 1 84 . 1 1 11 11 VAL HG12 H 1 0.829 0.013 . . . . . A 163 VAL HG12 . 19303 1 85 . 1 1 11 11 VAL HG13 H 1 0.829 0.013 . . . . . A 163 VAL HG13 . 19303 1 86 . 1 1 11 11 VAL HG21 H 1 0.829 0.013 . . . . . A 163 VAL HG21 . 19303 1 87 . 1 1 11 11 VAL HG22 H 1 0.829 0.013 . . . . . A 163 VAL HG22 . 19303 1 88 . 1 1 11 11 VAL HG23 H 1 0.829 0.013 . . . . . A 163 VAL HG23 . 19303 1 89 . 1 1 11 11 VAL CA C 13 65.770 0.000 . . . . . A 163 VAL CA . 19303 1 90 . 1 1 11 11 VAL CB C 13 31.670 0.000 . . . . . A 163 VAL CB . 19303 1 91 . 1 1 11 11 VAL CG1 C 13 22.758 0.000 . . . . . A 163 VAL CG1 . 19303 1 92 . 1 1 11 11 VAL CG2 C 13 23.506 0.000 . . . . . A 163 VAL CG2 . 19303 1 93 . 1 1 11 11 VAL N N 15 119.306 0.039 . . . . . A 163 VAL N . 19303 1 94 . 1 1 12 12 GLN H H 1 8.055 0.007 . . . . . A 164 GLN H . 19303 1 95 . 1 1 12 12 GLN HA H 1 3.639 0.012 . . . . . A 164 GLN HA . 19303 1 96 . 1 1 12 12 GLN HB2 H 1 1.654 0.017 . . . . . A 164 GLN HB2 . 19303 1 97 . 1 1 12 12 GLN HB3 H 1 1.981 0.018 . . . . . A 164 GLN HB3 . 19303 1 98 . 1 1 12 12 GLN HG2 H 1 2.316 0.000 . . . . . A 164 GLN HG2 . 19303 1 99 . 1 1 12 12 GLN HG3 H 1 2.316 0.000 . . . . . A 164 GLN HG3 . 19303 1 100 . 1 1 12 12 GLN CA C 13 58.337 0.180 . . . . . A 164 GLN CA . 19303 1 101 . 1 1 12 12 GLN CB C 13 28.678 0.000 . . . . . A 164 GLN CB . 19303 1 102 . 1 1 12 12 GLN CG C 13 34.302 0.000 . . . . . A 164 GLN CG . 19303 1 103 . 1 1 12 12 GLN N N 15 116.563 0.067 . . . . . A 164 GLN N . 19303 1 104 . 1 1 13 13 GLN H H 1 7.028 0.005 . . . . . A 165 GLN H . 19303 1 105 . 1 1 13 13 GLN HA H 1 3.940 0.008 . . . . . A 165 GLN HA . 19303 1 106 . 1 1 13 13 GLN HB2 H 1 1.894 0.008 . . . . . A 165 GLN HB2 . 19303 1 107 . 1 1 13 13 GLN HB3 H 1 2.054 0.025 . . . . . A 165 GLN HB3 . 19303 1 108 . 1 1 13 13 GLN HG2 H 1 2.242 0.007 . . . . . A 165 GLN HG2 . 19303 1 109 . 1 1 13 13 GLN HG3 H 1 2.393 0.000 . . . . . A 165 GLN HG3 . 19303 1 110 . 1 1 13 13 GLN CA C 13 55.530 0.158 . . . . . A 165 GLN CA . 19303 1 111 . 1 1 13 13 GLN CB C 13 29.250 0.000 . . . . . A 165 GLN CB . 19303 1 112 . 1 1 13 13 GLN CG C 13 34.392 0.000 . . . . . A 165 GLN CG . 19303 1 113 . 1 1 13 13 GLN N N 15 114.540 0.060 . . . . . A 165 GLN N . 19303 1 114 . 1 1 14 14 ILE H H 1 7.141 0.006 . . . . . A 166 ILE H . 19303 1 115 . 1 1 14 14 ILE HA H 1 3.359 0.011 . . . . . A 166 ILE HA . 19303 1 116 . 1 1 14 14 ILE HB H 1 1.479 0.019 . . . . . A 166 ILE HB . 19303 1 117 . 1 1 14 14 ILE HG12 H 1 -0.522 0.018 . . . . . A 166 ILE HG12 . 19303 1 118 . 1 1 14 14 ILE HG13 H 1 1.390 0.013 . . . . . A 166 ILE HG13 . 19303 1 119 . 1 1 14 14 ILE HG21 H 1 0.404 0.010 . . . . . A 166 ILE HG21 . 19303 1 120 . 1 1 14 14 ILE HG22 H 1 0.404 0.010 . . . . . A 166 ILE HG22 . 19303 1 121 . 1 1 14 14 ILE HG23 H 1 0.404 0.010 . . . . . A 166 ILE HG23 . 19303 1 122 . 1 1 14 14 ILE HD11 H 1 0.377 0.010 . . . . . A 166 ILE HD11 . 19303 1 123 . 1 1 14 14 ILE HD12 H 1 0.377 0.010 . . . . . A 166 ILE HD12 . 19303 1 124 . 1 1 14 14 ILE HD13 H 1 0.377 0.010 . . . . . A 166 ILE HD13 . 19303 1 125 . 1 1 14 14 ILE CA C 13 60.282 0.043 . . . . . A 166 ILE CA . 19303 1 126 . 1 1 14 14 ILE CB C 13 37.612 0.000 . . . . . A 166 ILE CB . 19303 1 127 . 1 1 14 14 ILE CG1 C 13 26.876 0.038 . . . . . A 166 ILE CG1 . 19303 1 128 . 1 1 14 14 ILE CG2 C 13 15.609 0.092 . . . . . A 166 ILE CG2 . 19303 1 129 . 1 1 14 14 ILE CD1 C 13 14.873 0.072 . . . . . A 166 ILE CD1 . 19303 1 130 . 1 1 14 14 ILE N N 15 125.636 0.022 . . . . . A 166 ILE N . 19303 1 131 . 1 1 15 15 PRO HA H 1 3.928 0.008 . . . . . A 167 PRO HA . 19303 1 132 . 1 1 15 15 PRO HB2 H 1 1.679 0.008 . . . . . A 167 PRO HB2 . 19303 1 133 . 1 1 15 15 PRO HB3 H 1 2.049 0.006 . . . . . A 167 PRO HB3 . 19303 1 134 . 1 1 15 15 PRO CA C 13 64.385 0.065 . . . . . A 167 PRO CA . 19303 1 135 . 1 1 15 15 PRO CB C 13 31.718 0.000 . . . . . A 167 PRO CB . 19303 1 136 . 1 1 15 15 PRO CG C 13 27.799 0.000 . . . . . A 167 PRO CG . 19303 1 137 . 1 1 15 15 PRO CD C 13 51.338 0.000 . . . . . A 167 PRO CD . 19303 1 138 . 1 1 16 16 GLY H H 1 8.026 0.007 . . . . . A 168 GLY H . 19303 1 139 . 1 1 16 16 GLY HA2 H 1 3.353 0.008 . . . . . A 168 GLY HA2 . 19303 1 140 . 1 1 16 16 GLY HA3 H 1 4.040 0.021 . . . . . A 168 GLY HA3 . 19303 1 141 . 1 1 16 16 GLY CA C 13 44.989 0.078 . . . . . A 168 GLY CA . 19303 1 142 . 1 1 16 16 GLY N N 15 108.788 0.036 . . . . . A 168 GLY N . 19303 1 143 . 1 1 17 17 VAL H H 1 7.603 0.005 . . . . . A 169 VAL H . 19303 1 144 . 1 1 17 17 VAL HA H 1 3.670 0.010 . . . . . A 169 VAL HA . 19303 1 145 . 1 1 17 17 VAL HB H 1 2.144 0.011 . . . . . A 169 VAL HB . 19303 1 146 . 1 1 17 17 VAL HG11 H 1 0.444 0.021 . . . . . A 169 VAL HG11 . 19303 1 147 . 1 1 17 17 VAL HG12 H 1 0.444 0.021 . . . . . A 169 VAL HG12 . 19303 1 148 . 1 1 17 17 VAL HG13 H 1 0.444 0.021 . . . . . A 169 VAL HG13 . 19303 1 149 . 1 1 17 17 VAL HG21 H 1 0.701 0.011 . . . . . A 169 VAL HG21 . 19303 1 150 . 1 1 17 17 VAL HG22 H 1 0.701 0.011 . . . . . A 169 VAL HG22 . 19303 1 151 . 1 1 17 17 VAL HG23 H 1 0.701 0.011 . . . . . A 169 VAL HG23 . 19303 1 152 . 1 1 17 17 VAL CA C 13 64.709 0.120 . . . . . A 169 VAL CA . 19303 1 153 . 1 1 17 17 VAL CB C 13 30.920 0.078 . . . . . A 169 VAL CB . 19303 1 154 . 1 1 17 17 VAL CG1 C 13 23.261 0.069 . . . . . A 169 VAL CG1 . 19303 1 155 . 1 1 17 17 VAL CG2 C 13 22.338 0.000 . . . . . A 169 VAL CG2 . 19303 1 156 . 1 1 17 17 VAL N N 15 121.103 0.030 . . . . . A 169 VAL N . 19303 1 157 . 1 1 18 18 GLY H H 1 7.481 0.007 . . . . . A 170 GLY H . 19303 1 158 . 1 1 18 18 GLY HA2 H 1 3.920 0.005 . . . . . A 170 GLY HA2 . 19303 1 159 . 1 1 18 18 GLY HA3 H 1 4.010 0.015 . . . . . A 170 GLY HA3 . 19303 1 160 . 1 1 18 18 GLY CA C 13 44.872 0.000 . . . . . A 170 GLY CA . 19303 1 161 . 1 1 18 18 GLY N N 15 106.137 0.076 . . . . . A 170 GLY N . 19303 1 162 . 1 1 19 19 LYS H H 1 8.273 0.009 . . . . . A 171 LYS H . 19303 1 163 . 1 1 19 19 LYS HA H 1 3.793 0.008 . . . . . A 171 LYS HA . 19303 1 164 . 1 1 19 19 LYS HB2 H 1 1.638 0.018 . . . . . A 171 LYS HB2 . 19303 1 165 . 1 1 19 19 LYS HB3 H 1 1.638 0.018 . . . . . A 171 LYS HB3 . 19303 1 166 . 1 1 19 19 LYS HG2 H 1 1.174 0.011 . . . . . A 171 LYS HG2 . 19303 1 167 . 1 1 19 19 LYS HG3 H 1 1.274 0.020 . . . . . A 171 LYS HG3 . 19303 1 168 . 1 1 19 19 LYS HE2 H 1 2.802 0.000 . . . . . A 171 LYS HE2 . 19303 1 169 . 1 1 19 19 LYS HE3 H 1 2.802 0.000 . . . . . A 171 LYS HE3 . 19303 1 170 . 1 1 19 19 LYS CA C 13 59.141 0.000 . . . . . A 171 LYS CA . 19303 1 171 . 1 1 19 19 LYS CB C 13 33.067 0.176 . . . . . A 171 LYS CB . 19303 1 172 . 1 1 19 19 LYS CG C 13 25.347 0.059 . . . . . A 171 LYS CG . 19303 1 173 . 1 1 19 19 LYS CD C 13 29.387 0.000 . . . . . A 171 LYS CD . 19303 1 174 . 1 1 19 19 LYS CE C 13 41.896 0.059 . . . . . A 171 LYS CE . 19303 1 175 . 1 1 19 19 LYS N N 15 116.989 0.044 . . . . . A 171 LYS N . 19303 1 176 . 1 1 20 20 VAL H H 1 8.165 0.007 . . . . . A 172 VAL H . 19303 1 177 . 1 1 20 20 VAL HA H 1 3.701 0.009 . . . . . A 172 VAL HA . 19303 1 178 . 1 1 20 20 VAL HB H 1 1.930 0.012 . . . . . A 172 VAL HB . 19303 1 179 . 1 1 20 20 VAL HG11 H 1 0.770 0.008 . . . . . A 172 VAL HG11 . 19303 1 180 . 1 1 20 20 VAL HG12 H 1 0.770 0.008 . . . . . A 172 VAL HG12 . 19303 1 181 . 1 1 20 20 VAL HG13 H 1 0.770 0.008 . . . . . A 172 VAL HG13 . 19303 1 182 . 1 1 20 20 VAL HG21 H 1 0.833 0.009 . . . . . A 172 VAL HG21 . 19303 1 183 . 1 1 20 20 VAL HG22 H 1 0.833 0.009 . . . . . A 172 VAL HG22 . 19303 1 184 . 1 1 20 20 VAL HG23 H 1 0.833 0.009 . . . . . A 172 VAL HG23 . 19303 1 185 . 1 1 20 20 VAL CA C 13 64.800 0.156 . . . . . A 172 VAL CA . 19303 1 186 . 1 1 20 20 VAL CB C 13 31.979 0.145 . . . . . A 172 VAL CB . 19303 1 187 . 1 1 20 20 VAL CG1 C 13 20.887 0.183 . . . . . A 172 VAL CG1 . 19303 1 188 . 1 1 20 20 VAL CG2 C 13 21.879 0.161 . . . . . A 172 VAL CG2 . 19303 1 189 . 1 1 20 20 VAL N N 15 118.550 0.079 . . . . . A 172 VAL N . 19303 1 190 . 1 1 21 21 LYS H H 1 7.432 0.019 . . . . . A 173 LYS H . 19303 1 191 . 1 1 21 21 LYS HA H 1 4.108 0.020 . . . . . A 173 LYS HA . 19303 1 192 . 1 1 21 21 LYS HB2 H 1 1.527 0.017 . . . . . A 173 LYS HB2 . 19303 1 193 . 1 1 21 21 LYS HB3 H 1 1.828 0.012 . . . . . A 173 LYS HB3 . 19303 1 194 . 1 1 21 21 LYS HG2 H 1 1.349 0.010 . . . . . A 173 LYS HG2 . 19303 1 195 . 1 1 21 21 LYS HG3 H 1 1.349 0.010 . . . . . A 173 LYS HG3 . 19303 1 196 . 1 1 21 21 LYS HD2 H 1 1.659 0.000 . . . . . A 173 LYS HD2 . 19303 1 197 . 1 1 21 21 LYS HD3 H 1 1.659 0.000 . . . . . A 173 LYS HD3 . 19303 1 198 . 1 1 21 21 LYS HE2 H 1 2.938 0.013 . . . . . A 173 LYS HE2 . 19303 1 199 . 1 1 21 21 LYS HE3 H 1 2.938 0.013 . . . . . A 173 LYS HE3 . 19303 1 200 . 1 1 21 21 LYS CA C 13 57.063 0.000 . . . . . A 173 LYS CA . 19303 1 201 . 1 1 21 21 LYS CB C 13 33.061 0.026 . . . . . A 173 LYS CB . 19303 1 202 . 1 1 21 21 LYS CG C 13 26.192 0.081 . . . . . A 173 LYS CG . 19303 1 203 . 1 1 21 21 LYS CD C 13 29.137 0.000 . . . . . A 173 LYS CD . 19303 1 204 . 1 1 21 21 LYS CE C 13 42.242 0.150 . . . . . A 173 LYS CE . 19303 1 205 . 1 1 21 21 LYS N N 15 115.404 0.027 . . . . . A 173 LYS N . 19303 1 206 . 1 1 22 22 ALA H H 1 7.164 0.015 . . . . . A 174 ALA H . 19303 1 207 . 1 1 22 22 ALA HA H 1 3.728 0.013 . . . . . A 174 ALA HA . 19303 1 208 . 1 1 22 22 ALA HB1 H 1 1.241 0.009 . . . . . A 174 ALA HB1 . 19303 1 209 . 1 1 22 22 ALA HB2 H 1 1.241 0.009 . . . . . A 174 ALA HB2 . 19303 1 210 . 1 1 22 22 ALA HB3 H 1 1.241 0.009 . . . . . A 174 ALA HB3 . 19303 1 211 . 1 1 22 22 ALA CA C 13 57.049 0.030 . . . . . A 174 ALA CA . 19303 1 212 . 1 1 22 22 ALA CB C 13 16.633 0.080 . . . . . A 174 ALA CB . 19303 1 213 . 1 1 22 22 ALA N N 15 120.967 0.088 . . . . . A 174 ALA N . 19303 1 214 . 1 1 23 23 PRO HA H 1 3.989 0.010 . . . . . A 175 PRO HA . 19303 1 215 . 1 1 23 23 PRO HB2 H 1 1.617 0.013 . . . . . A 175 PRO HB2 . 19303 1 216 . 1 1 23 23 PRO HB3 H 1 2.135 0.014 . . . . . A 175 PRO HB3 . 19303 1 217 . 1 1 23 23 PRO CA C 13 65.795 0.065 . . . . . A 175 PRO CA . 19303 1 218 . 1 1 23 23 PRO CB C 13 30.763 0.123 . . . . . A 175 PRO CB . 19303 1 219 . 1 1 23 23 PRO CG C 13 28.397 0.000 . . . . . A 175 PRO CG . 19303 1 220 . 1 1 23 23 PRO CD C 13 50.437 0.000 . . . . . A 175 PRO CD . 19303 1 221 . 1 1 24 24 LEU H H 1 6.565 0.017 . . . . . A 176 LEU H . 19303 1 222 . 1 1 24 24 LEU HA H 1 3.885 0.003 . . . . . A 176 LEU HA . 19303 1 223 . 1 1 24 24 LEU HB2 H 1 1.360 0.017 . . . . . A 176 LEU HB2 . 19303 1 224 . 1 1 24 24 LEU HB3 H 1 1.662 0.009 . . . . . A 176 LEU HB3 . 19303 1 225 . 1 1 24 24 LEU HG H 1 1.556 0.012 . . . . . A 176 LEU HG . 19303 1 226 . 1 1 24 24 LEU HD11 H 1 0.698 0.011 . . . . . A 176 LEU HD11 . 19303 1 227 . 1 1 24 24 LEU HD12 H 1 0.698 0.011 . . . . . A 176 LEU HD12 . 19303 1 228 . 1 1 24 24 LEU HD13 H 1 0.698 0.011 . . . . . A 176 LEU HD13 . 19303 1 229 . 1 1 24 24 LEU HD21 H 1 0.796 0.007 . . . . . A 176 LEU HD21 . 19303 1 230 . 1 1 24 24 LEU HD22 H 1 0.796 0.007 . . . . . A 176 LEU HD22 . 19303 1 231 . 1 1 24 24 LEU HD23 H 1 0.796 0.007 . . . . . A 176 LEU HD23 . 19303 1 232 . 1 1 24 24 LEU CA C 13 57.190 0.071 . . . . . A 176 LEU CA . 19303 1 233 . 1 1 24 24 LEU CB C 13 41.483 0.097 . . . . . A 176 LEU CB . 19303 1 234 . 1 1 24 24 LEU CG C 13 27.022 0.108 . . . . . A 176 LEU CG . 19303 1 235 . 1 1 24 24 LEU CD1 C 13 23.026 0.051 . . . . . A 176 LEU CD1 . 19303 1 236 . 1 1 24 24 LEU CD2 C 13 24.917 0.083 . . . . . A 176 LEU CD2 . 19303 1 237 . 1 1 24 24 LEU N N 15 116.715 0.045 . . . . . A 176 LEU N . 19303 1 238 . 1 1 25 25 LEU H H 1 7.520 0.009 . . . . . A 177 LEU H . 19303 1 239 . 1 1 25 25 LEU HA H 1 3.916 0.008 . . . . . A 177 LEU HA . 19303 1 240 . 1 1 25 25 LEU HB2 H 1 1.462 0.015 . . . . . A 177 LEU HB2 . 19303 1 241 . 1 1 25 25 LEU HB3 H 1 1.703 0.014 . . . . . A 177 LEU HB3 . 19303 1 242 . 1 1 25 25 LEU HD11 H 1 0.697 0.001 . . . . . A 177 LEU HD11 . 19303 1 243 . 1 1 25 25 LEU HD12 H 1 0.697 0.001 . . . . . A 177 LEU HD12 . 19303 1 244 . 1 1 25 25 LEU HD13 H 1 0.697 0.001 . . . . . A 177 LEU HD13 . 19303 1 245 . 1 1 25 25 LEU HD21 H 1 0.736 0.007 . . . . . A 177 LEU HD21 . 19303 1 246 . 1 1 25 25 LEU HD22 H 1 0.736 0.007 . . . . . A 177 LEU HD22 . 19303 1 247 . 1 1 25 25 LEU HD23 H 1 0.736 0.007 . . . . . A 177 LEU HD23 . 19303 1 248 . 1 1 25 25 LEU CA C 13 57.823 0.024 . . . . . A 177 LEU CA . 19303 1 249 . 1 1 25 25 LEU CB C 13 42.464 0.099 . . . . . A 177 LEU CB . 19303 1 250 . 1 1 25 25 LEU CG C 13 26.311 0.000 . . . . . A 177 LEU CG . 19303 1 251 . 1 1 25 25 LEU CD1 C 13 23.462 0.084 . . . . . A 177 LEU CD1 . 19303 1 252 . 1 1 25 25 LEU CD2 C 13 24.847 0.167 . . . . . A 177 LEU CD2 . 19303 1 253 . 1 1 25 25 LEU N N 15 119.180 0.027 . . . . . A 177 LEU N . 19303 1 254 . 1 1 26 26 LEU H H 1 7.599 0.005 . . . . . A 178 LEU H . 19303 1 255 . 1 1 26 26 LEU HA H 1 3.977 0.010 . . . . . A 178 LEU HA . 19303 1 256 . 1 1 26 26 LEU HB2 H 1 1.431 0.020 . . . . . A 178 LEU HB2 . 19303 1 257 . 1 1 26 26 LEU HB3 H 1 1.431 0.020 . . . . . A 178 LEU HB3 . 19303 1 258 . 1 1 26 26 LEU HG H 1 1.514 0.010 . . . . . A 178 LEU HG . 19303 1 259 . 1 1 26 26 LEU HD11 H 1 0.647 0.006 . . . . . A 178 LEU HD11 . 19303 1 260 . 1 1 26 26 LEU HD12 H 1 0.647 0.006 . . . . . A 178 LEU HD12 . 19303 1 261 . 1 1 26 26 LEU HD13 H 1 0.647 0.006 . . . . . A 178 LEU HD13 . 19303 1 262 . 1 1 26 26 LEU HD21 H 1 0.699 0.004 . . . . . A 178 LEU HD21 . 19303 1 263 . 1 1 26 26 LEU HD22 H 1 0.699 0.004 . . . . . A 178 LEU HD22 . 19303 1 264 . 1 1 26 26 LEU HD23 H 1 0.699 0.004 . . . . . A 178 LEU HD23 . 19303 1 265 . 1 1 26 26 LEU CA C 13 56.707 0.184 . . . . . A 178 LEU CA . 19303 1 266 . 1 1 26 26 LEU CB C 13 41.464 0.000 . . . . . A 178 LEU CB . 19303 1 267 . 1 1 26 26 LEU CG C 13 28.211 0.057 . . . . . A 178 LEU CG . 19303 1 268 . 1 1 26 26 LEU CD1 C 13 25.219 0.099 . . . . . A 178 LEU CD1 . 19303 1 269 . 1 1 26 26 LEU CD2 C 13 23.445 0.158 . . . . . A 178 LEU CD2 . 19303 1 270 . 1 1 26 26 LEU N N 15 118.057 0.047 . . . . . A 178 LEU N . 19303 1 271 . 1 1 27 27 GLN H H 1 7.251 0.014 . . . . . A 179 GLN H . 19303 1 272 . 1 1 27 27 GLN HA H 1 3.789 0.013 . . . . . A 179 GLN HA . 19303 1 273 . 1 1 27 27 GLN HB2 H 1 1.883 0.014 . . . . . A 179 GLN HB2 . 19303 1 274 . 1 1 27 27 GLN HB3 H 1 1.883 0.014 . . . . . A 179 GLN HB3 . 19303 1 275 . 1 1 27 27 GLN HG2 H 1 2.171 0.007 . . . . . A 179 GLN HG2 . 19303 1 276 . 1 1 27 27 GLN HG3 H 1 2.319 0.006 . . . . . A 179 GLN HG3 . 19303 1 277 . 1 1 27 27 GLN CA C 13 58.106 0.000 . . . . . A 179 GLN CA . 19303 1 278 . 1 1 27 27 GLN CB C 13 28.524 0.073 . . . . . A 179 GLN CB . 19303 1 279 . 1 1 27 27 GLN CG C 13 33.834 0.211 . . . . . A 179 GLN CG . 19303 1 280 . 1 1 27 27 GLN N N 15 116.676 0.030 . . . . . A 179 GLN N . 19303 1 281 . 1 1 28 28 LYS H H 1 6.685 0.094 . . . . . A 180 LYS H . 19303 1 282 . 1 1 28 28 LYS HA H 1 3.770 0.007 . . . . . A 180 LYS HA . 19303 1 283 . 1 1 28 28 LYS HB2 H 1 0.852 0.012 . . . . . A 180 LYS HB2 . 19303 1 284 . 1 1 28 28 LYS HB3 H 1 1.227 0.007 . . . . . A 180 LYS HB3 . 19303 1 285 . 1 1 28 28 LYS HG2 H 1 0.707 0.014 . . . . . A 180 LYS HG2 . 19303 1 286 . 1 1 28 28 LYS HG3 H 1 0.707 0.014 . . . . . A 180 LYS HG3 . 19303 1 287 . 1 1 28 28 LYS HD2 H 1 1.230 0.005 . . . . . A 180 LYS HD2 . 19303 1 288 . 1 1 28 28 LYS HD3 H 1 1.230 0.005 . . . . . A 180 LYS HD3 . 19303 1 289 . 1 1 28 28 LYS HE2 H 1 2.601 0.004 . . . . . A 180 LYS HE2 . 19303 1 290 . 1 1 28 28 LYS HE3 H 1 2.659 0.004 . . . . . A 180 LYS HE3 . 19303 1 291 . 1 1 28 28 LYS CA C 13 56.408 0.023 . . . . . A 180 LYS CA . 19303 1 292 . 1 1 28 28 LYS CB C 13 33.350 0.098 . . . . . A 180 LYS CB . 19303 1 293 . 1 1 28 28 LYS CG C 13 24.572 0.073 . . . . . A 180 LYS CG . 19303 1 294 . 1 1 28 28 LYS CD C 13 28.143 0.073 . . . . . A 180 LYS CD . 19303 1 295 . 1 1 28 28 LYS CE C 13 41.843 0.136 . . . . . A 180 LYS CE . 19303 1 296 . 1 1 28 28 LYS N N 15 116.819 0.041 . . . . . A 180 LYS N . 19303 1 297 . 1 1 29 29 PHE H H 1 8.018 0.004 . . . . . A 181 PHE H . 19303 1 298 . 1 1 29 29 PHE HA H 1 4.730 0.013 . . . . . A 181 PHE HA . 19303 1 299 . 1 1 29 29 PHE HB2 H 1 2.289 0.011 . . . . . A 181 PHE HB2 . 19303 1 300 . 1 1 29 29 PHE HB3 H 1 2.970 0.013 . . . . . A 181 PHE HB3 . 19303 1 301 . 1 1 29 29 PHE HD1 H 1 7.015 0.012 . . . . . A 181 PHE HD1 . 19303 1 302 . 1 1 29 29 PHE HD2 H 1 7.015 0.012 . . . . . A 181 PHE HD2 . 19303 1 303 . 1 1 29 29 PHE HE1 H 1 6.821 0.027 . . . . . A 181 PHE HE1 . 19303 1 304 . 1 1 29 29 PHE HE2 H 1 6.821 0.027 . . . . . A 181 PHE HE2 . 19303 1 305 . 1 1 29 29 PHE HZ H 1 6.985 0.000 . . . . . A 181 PHE HZ . 19303 1 306 . 1 1 29 29 PHE CA C 13 53.829 0.197 . . . . . A 181 PHE CA . 19303 1 307 . 1 1 29 29 PHE CB C 13 39.551 0.105 . . . . . A 181 PHE CB . 19303 1 308 . 1 1 29 29 PHE N N 15 117.515 0.041 . . . . . A 181 PHE N . 19303 1 309 . 1 1 30 30 PRO HA H 1 4.562 0.015 . . . . . A 182 PRO HA . 19303 1 310 . 1 1 30 30 PRO HB2 H 1 1.981 0.013 . . . . . A 182 PRO HB2 . 19303 1 311 . 1 1 30 30 PRO HB3 H 1 2.117 0.012 . . . . . A 182 PRO HB3 . 19303 1 312 . 1 1 30 30 PRO HG2 H 1 1.692 0.014 . . . . . A 182 PRO HG2 . 19303 1 313 . 1 1 30 30 PRO HG3 H 1 1.692 0.014 . . . . . A 182 PRO HG3 . 19303 1 314 . 1 1 30 30 PRO HD2 H 1 3.043 0.024 . . . . . A 182 PRO HD2 . 19303 1 315 . 1 1 30 30 PRO HD3 H 1 3.317 0.014 . . . . . A 182 PRO HD3 . 19303 1 316 . 1 1 30 30 PRO CA C 13 64.890 0.244 . . . . . A 182 PRO CA . 19303 1 317 . 1 1 30 30 PRO CB C 13 31.440 0.045 . . . . . A 182 PRO CB . 19303 1 318 . 1 1 30 30 PRO CG C 13 26.734 0.037 . . . . . A 182 PRO CG . 19303 1 319 . 1 1 30 30 PRO CD C 13 50.107 0.125 . . . . . A 182 PRO CD . 19303 1 320 . 1 1 31 31 SER H H 1 7.441 0.012 . . . . . A 183 SER H . 19303 1 321 . 1 1 31 31 SER HA H 1 4.559 0.003 . . . . . A 183 SER HA . 19303 1 322 . 1 1 31 31 SER HB2 H 1 3.826 0.025 . . . . . A 183 SER HB2 . 19303 1 323 . 1 1 31 31 SER HB3 H 1 4.060 0.019 . . . . . A 183 SER HB3 . 19303 1 324 . 1 1 31 31 SER CA C 13 56.630 0.000 . . . . . A 183 SER CA . 19303 1 325 . 1 1 31 31 SER CB C 13 66.761 0.055 . . . . . A 183 SER CB . 19303 1 326 . 1 1 31 31 SER N N 15 112.252 0.039 . . . . . A 183 SER N . 19303 1 327 . 1 1 32 32 ILE H H 1 9.023 0.007 . . . . . A 184 ILE H . 19303 1 328 . 1 1 32 32 ILE HA H 1 3.536 0.013 . . . . . A 184 ILE HA . 19303 1 329 . 1 1 32 32 ILE HB H 1 1.735 0.007 . . . . . A 184 ILE HB . 19303 1 330 . 1 1 32 32 ILE HG12 H 1 1.196 0.016 . . . . . A 184 ILE HG12 . 19303 1 331 . 1 1 32 32 ILE HG13 H 1 1.422 0.015 . . . . . A 184 ILE HG13 . 19303 1 332 . 1 1 32 32 ILE HG21 H 1 0.785 0.003 . . . . . A 184 ILE HG21 . 19303 1 333 . 1 1 32 32 ILE HG22 H 1 0.785 0.003 . . . . . A 184 ILE HG22 . 19303 1 334 . 1 1 32 32 ILE HG23 H 1 0.785 0.003 . . . . . A 184 ILE HG23 . 19303 1 335 . 1 1 32 32 ILE HD11 H 1 0.785 0.007 . . . . . A 184 ILE HD11 . 19303 1 336 . 1 1 32 32 ILE HD12 H 1 0.785 0.007 . . . . . A 184 ILE HD12 . 19303 1 337 . 1 1 32 32 ILE HD13 H 1 0.785 0.007 . . . . . A 184 ILE HD13 . 19303 1 338 . 1 1 32 32 ILE CA C 13 63.476 0.035 . . . . . A 184 ILE CA . 19303 1 339 . 1 1 32 32 ILE CB C 13 37.076 0.060 . . . . . A 184 ILE CB . 19303 1 340 . 1 1 32 32 ILE CG1 C 13 29.001 0.156 . . . . . A 184 ILE CG1 . 19303 1 341 . 1 1 32 32 ILE CG2 C 13 17.484 0.035 . . . . . A 184 ILE CG2 . 19303 1 342 . 1 1 32 32 ILE CD1 C 13 12.322 0.078 . . . . . A 184 ILE CD1 . 19303 1 343 . 1 1 32 32 ILE N N 15 122.959 0.045 . . . . . A 184 ILE N . 19303 1 344 . 1 1 33 33 GLN H H 1 8.497 0.008 . . . . . A 185 GLN H . 19303 1 345 . 1 1 33 33 GLN HA H 1 3.699 0.008 . . . . . A 185 GLN HA . 19303 1 346 . 1 1 33 33 GLN HB2 H 1 1.758 0.010 . . . . . A 185 GLN HB2 . 19303 1 347 . 1 1 33 33 GLN HB3 H 1 1.886 0.007 . . . . . A 185 GLN HB3 . 19303 1 348 . 1 1 33 33 GLN HG2 H 1 2.166 0.001 . . . . . A 185 GLN HG2 . 19303 1 349 . 1 1 33 33 GLN HG3 H 1 2.202 0.000 . . . . . A 185 GLN HG3 . 19303 1 350 . 1 1 33 33 GLN CA C 13 59.718 0.154 . . . . . A 185 GLN CA . 19303 1 351 . 1 1 33 33 GLN CB C 13 27.302 0.000 . . . . . A 185 GLN CB . 19303 1 352 . 1 1 33 33 GLN CG C 13 33.808 0.000 . . . . . A 185 GLN CG . 19303 1 353 . 1 1 33 33 GLN N N 15 122.211 0.043 . . . . . A 185 GLN N . 19303 1 354 . 1 1 34 34 GLN H H 1 7.534 0.012 . . . . . A 186 GLN H . 19303 1 355 . 1 1 34 34 GLN HA H 1 3.887 0.015 . . . . . A 186 GLN HA . 19303 1 356 . 1 1 34 34 GLN HB2 H 1 1.789 0.015 . . . . . A 186 GLN HB2 . 19303 1 357 . 1 1 34 34 GLN HB3 H 1 2.127 0.011 . . . . . A 186 GLN HB3 . 19303 1 358 . 1 1 34 34 GLN HG2 H 1 2.354 0.010 . . . . . A 186 GLN HG2 . 19303 1 359 . 1 1 34 34 GLN HG3 H 1 2.354 0.010 . . . . . A 186 GLN HG3 . 19303 1 360 . 1 1 34 34 GLN CA C 13 58.793 0.079 . . . . . A 186 GLN CA . 19303 1 361 . 1 1 34 34 GLN CB C 13 29.662 0.000 . . . . . A 186 GLN CB . 19303 1 362 . 1 1 34 34 GLN CG C 13 35.557 0.043 . . . . . A 186 GLN CG . 19303 1 363 . 1 1 34 34 GLN N N 15 117.236 0.073 . . . . . A 186 GLN N . 19303 1 364 . 1 1 35 35 LEU H H 1 7.865 0.010 . . . . . A 187 LEU H . 19303 1 365 . 1 1 35 35 LEU HA H 1 3.351 0.011 . . . . . A 187 LEU HA . 19303 1 366 . 1 1 35 35 LEU HB2 H 1 1.056 0.009 . . . . . A 187 LEU HB2 . 19303 1 367 . 1 1 35 35 LEU HB3 H 1 1.304 0.013 . . . . . A 187 LEU HB3 . 19303 1 368 . 1 1 35 35 LEU HG H 1 1.400 0.010 . . . . . A 187 LEU HG . 19303 1 369 . 1 1 35 35 LEU HD11 H 1 0.500 0.010 . . . . . A 187 LEU HD11 . 19303 1 370 . 1 1 35 35 LEU HD12 H 1 0.500 0.010 . . . . . A 187 LEU HD12 . 19303 1 371 . 1 1 35 35 LEU HD13 H 1 0.500 0.010 . . . . . A 187 LEU HD13 . 19303 1 372 . 1 1 35 35 LEU HD21 H 1 0.611 0.016 . . . . . A 187 LEU HD21 . 19303 1 373 . 1 1 35 35 LEU HD22 H 1 0.611 0.016 . . . . . A 187 LEU HD22 . 19303 1 374 . 1 1 35 35 LEU HD23 H 1 0.611 0.016 . . . . . A 187 LEU HD23 . 19303 1 375 . 1 1 35 35 LEU CA C 13 57.638 0.147 . . . . . A 187 LEU CA . 19303 1 376 . 1 1 35 35 LEU CB C 13 41.889 0.070 . . . . . A 187 LEU CB . 19303 1 377 . 1 1 35 35 LEU CG C 13 26.763 0.040 . . . . . A 187 LEU CG . 19303 1 378 . 1 1 35 35 LEU CD1 C 13 25.313 0.084 . . . . . A 187 LEU CD1 . 19303 1 379 . 1 1 35 35 LEU CD2 C 13 25.974 0.077 . . . . . A 187 LEU CD2 . 19303 1 380 . 1 1 35 35 LEU N N 15 121.185 0.025 . . . . . A 187 LEU N . 19303 1 381 . 1 1 36 36 SER H H 1 7.942 0.007 . . . . . A 188 SER H . 19303 1 382 . 1 1 36 36 SER HA H 1 3.348 0.012 . . . . . A 188 SER HA . 19303 1 383 . 1 1 36 36 SER HB2 H 1 3.090 0.017 . . . . . A 188 SER HB2 . 19303 1 384 . 1 1 36 36 SER HB3 H 1 3.090 0.017 . . . . . A 188 SER HB3 . 19303 1 385 . 1 1 36 36 SER CA C 13 60.666 0.000 . . . . . A 188 SER CA . 19303 1 386 . 1 1 36 36 SER CB C 13 64.028 0.320 . . . . . A 188 SER CB . 19303 1 387 . 1 1 36 36 SER N N 15 111.786 0.033 . . . . . A 188 SER N . 19303 1 388 . 1 1 37 37 ASN H H 1 6.890 0.022 . . . . . A 189 ASN H . 19303 1 389 . 1 1 37 37 ASN HA H 1 4.564 0.012 . . . . . A 189 ASN HA . 19303 1 390 . 1 1 37 37 ASN HB2 H 1 2.425 0.009 . . . . . A 189 ASN HB2 . 19303 1 391 . 1 1 37 37 ASN HB3 H 1 2.681 0.018 . . . . . A 189 ASN HB3 . 19303 1 392 . 1 1 37 37 ASN CA C 13 52.798 0.000 . . . . . A 189 ASN CA . 19303 1 393 . 1 1 37 37 ASN CB C 13 39.994 0.128 . . . . . A 189 ASN CB . 19303 1 394 . 1 1 37 37 ASN N N 15 116.719 0.036 . . . . . A 189 ASN N . 19303 1 395 . 1 1 38 38 ALA H H 1 6.753 0.004 . . . . . A 190 ALA H . 19303 1 396 . 1 1 38 38 ALA HA H 1 4.006 0.004 . . . . . A 190 ALA HA . 19303 1 397 . 1 1 38 38 ALA HB1 H 1 0.700 0.008 . . . . . A 190 ALA HB1 . 19303 1 398 . 1 1 38 38 ALA HB2 H 1 0.700 0.008 . . . . . A 190 ALA HB2 . 19303 1 399 . 1 1 38 38 ALA HB3 H 1 0.700 0.008 . . . . . A 190 ALA HB3 . 19303 1 400 . 1 1 38 38 ALA CA C 13 52.394 0.105 . . . . . A 190 ALA CA . 19303 1 401 . 1 1 38 38 ALA CB C 13 18.955 0.057 . . . . . A 190 ALA CB . 19303 1 402 . 1 1 38 38 ALA N N 15 124.825 0.024 . . . . . A 190 ALA N . 19303 1 403 . 1 1 39 39 SER H H 1 8.693 0.018 . . . . . A 191 SER H . 19303 1 404 . 1 1 39 39 SER HA H 1 4.220 0.014 . . . . . A 191 SER HA . 19303 1 405 . 1 1 39 39 SER HB2 H 1 3.892 0.006 . . . . . A 191 SER HB2 . 19303 1 406 . 1 1 39 39 SER HB3 H 1 4.069 0.012 . . . . . A 191 SER HB3 . 19303 1 407 . 1 1 39 39 SER CA C 13 57.078 0.000 . . . . . A 191 SER CA . 19303 1 408 . 1 1 39 39 SER CB C 13 64.365 0.000 . . . . . A 191 SER CB . 19303 1 409 . 1 1 39 39 SER N N 15 119.395 0.035 . . . . . A 191 SER N . 19303 1 410 . 1 1 40 40 ILE H H 1 8.560 0.006 . . . . . A 192 ILE H . 19303 1 411 . 1 1 40 40 ILE HA H 1 3.419 0.018 . . . . . A 192 ILE HA . 19303 1 412 . 1 1 40 40 ILE HB H 1 1.536 0.008 . . . . . A 192 ILE HB . 19303 1 413 . 1 1 40 40 ILE HG12 H 1 1.159 0.023 . . . . . A 192 ILE HG12 . 19303 1 414 . 1 1 40 40 ILE HG13 H 1 0.853 0.007 . . . . . A 192 ILE HG13 . 19303 1 415 . 1 1 40 40 ILE HG21 H 1 0.644 0.011 . . . . . A 192 ILE HG21 . 19303 1 416 . 1 1 40 40 ILE HG22 H 1 0.644 0.011 . . . . . A 192 ILE HG22 . 19303 1 417 . 1 1 40 40 ILE HG23 H 1 0.644 0.011 . . . . . A 192 ILE HG23 . 19303 1 418 . 1 1 40 40 ILE HD11 H 1 0.415 0.026 . . . . . A 192 ILE HD11 . 19303 1 419 . 1 1 40 40 ILE HD12 H 1 0.415 0.026 . . . . . A 192 ILE HD12 . 19303 1 420 . 1 1 40 40 ILE HD13 H 1 0.415 0.026 . . . . . A 192 ILE HD13 . 19303 1 421 . 1 1 40 40 ILE CA C 13 64.403 0.244 . . . . . A 192 ILE CA . 19303 1 422 . 1 1 40 40 ILE CB C 13 36.752 0.089 . . . . . A 192 ILE CB . 19303 1 423 . 1 1 40 40 ILE CG1 C 13 28.588 0.010 . . . . . A 192 ILE CG1 . 19303 1 424 . 1 1 40 40 ILE CG2 C 13 17.323 0.056 . . . . . A 192 ILE CG2 . 19303 1 425 . 1 1 40 40 ILE CD1 C 13 11.833 0.260 . . . . . A 192 ILE CD1 . 19303 1 426 . 1 1 40 40 ILE N N 15 121.860 0.041 . . . . . A 192 ILE N . 19303 1 427 . 1 1 41 41 GLY H H 1 8.328 0.008 . . . . . A 193 GLY H . 19303 1 428 . 1 1 41 41 GLY HA2 H 1 3.659 0.007 . . . . . A 193 GLY HA2 . 19303 1 429 . 1 1 41 41 GLY HA3 H 1 3.659 0.007 . . . . . A 193 GLY HA3 . 19303 1 430 . 1 1 41 41 GLY CA C 13 46.856 0.000 . . . . . A 193 GLY CA . 19303 1 431 . 1 1 41 41 GLY N N 15 106.916 0.037 . . . . . A 193 GLY N . 19303 1 432 . 1 1 42 42 GLU H H 1 7.551 0.011 . . . . . A 194 GLU H . 19303 1 433 . 1 1 42 42 GLU HA H 1 3.987 0.006 . . . . . A 194 GLU HA . 19303 1 434 . 1 1 42 42 GLU HB2 H 1 1.886 0.017 . . . . . A 194 GLU HB2 . 19303 1 435 . 1 1 42 42 GLU HB3 H 1 2.201 0.011 . . . . . A 194 GLU HB3 . 19303 1 436 . 1 1 42 42 GLU HG2 H 1 2.233 0.002 . . . . . A 194 GLU HG2 . 19303 1 437 . 1 1 42 42 GLU HG3 H 1 2.233 0.002 . . . . . A 194 GLU HG3 . 19303 1 438 . 1 1 42 42 GLU CA C 13 59.029 0.020 . . . . . A 194 GLU CA . 19303 1 439 . 1 1 42 42 GLU CB C 13 30.277 0.000 . . . . . A 194 GLU CB . 19303 1 440 . 1 1 42 42 GLU CG C 13 37.326 0.156 . . . . . A 194 GLU CG . 19303 1 441 . 1 1 42 42 GLU N N 15 121.395 0.056 . . . . . A 194 GLU N . 19303 1 442 . 1 1 43 43 LEU H H 1 7.927 0.004 . . . . . A 195 LEU H . 19303 1 443 . 1 1 43 43 LEU HA H 1 3.855 0.005 . . . . . A 195 LEU HA . 19303 1 444 . 1 1 43 43 LEU HB2 H 1 0.848 0.011 . . . . . A 195 LEU HB2 . 19303 1 445 . 1 1 43 43 LEU HB3 H 1 1.943 0.011 . . . . . A 195 LEU HB3 . 19303 1 446 . 1 1 43 43 LEU HG H 1 1.394 0.011 . . . . . A 195 LEU HG . 19303 1 447 . 1 1 43 43 LEU HD11 H 1 0.303 0.015 . . . . . A 195 LEU HD11 . 19303 1 448 . 1 1 43 43 LEU HD12 H 1 0.303 0.015 . . . . . A 195 LEU HD12 . 19303 1 449 . 1 1 43 43 LEU HD13 H 1 0.303 0.015 . . . . . A 195 LEU HD13 . 19303 1 450 . 1 1 43 43 LEU HD21 H 1 0.713 0.017 . . . . . A 195 LEU HD21 . 19303 1 451 . 1 1 43 43 LEU HD22 H 1 0.713 0.017 . . . . . A 195 LEU HD22 . 19303 1 452 . 1 1 43 43 LEU HD23 H 1 0.713 0.017 . . . . . A 195 LEU HD23 . 19303 1 453 . 1 1 43 43 LEU CA C 13 57.809 0.025 . . . . . A 195 LEU CA . 19303 1 454 . 1 1 43 43 LEU CB C 13 43.543 0.124 . . . . . A 195 LEU CB . 19303 1 455 . 1 1 43 43 LEU CD1 C 13 23.125 0.053 . . . . . A 195 LEU CD1 . 19303 1 456 . 1 1 43 43 LEU CD2 C 13 25.985 0.040 . . . . . A 195 LEU CD2 . 19303 1 457 . 1 1 43 43 LEU N N 15 119.753 0.047 . . . . . A 195 LEU N . 19303 1 458 . 1 1 44 44 GLU H H 1 9.059 0.005 . . . . . A 196 GLU H . 19303 1 459 . 1 1 44 44 GLU HA H 1 3.591 0.011 . . . . . A 196 GLU HA . 19303 1 460 . 1 1 44 44 GLU HB2 H 1 1.914 0.012 . . . . . A 196 GLU HB2 . 19303 1 461 . 1 1 44 44 GLU HB3 H 1 1.914 0.012 . . . . . A 196 GLU HB3 . 19303 1 462 . 1 1 44 44 GLU HG2 H 1 2.048 0.011 . . . . . A 196 GLU HG2 . 19303 1 463 . 1 1 44 44 GLU HG3 H 1 2.048 0.011 . . . . . A 196 GLU HG3 . 19303 1 464 . 1 1 44 44 GLU CA C 13 58.906 0.099 . . . . . A 196 GLU CA . 19303 1 465 . 1 1 44 44 GLU CB C 13 28.937 0.044 . . . . . A 196 GLU CB . 19303 1 466 . 1 1 44 44 GLU CG C 13 35.940 0.000 . . . . . A 196 GLU CG . 19303 1 467 . 1 1 44 44 GLU N N 15 121.200 0.056 . . . . . A 196 GLU N . 19303 1 468 . 1 1 45 45 GLN H H 1 7.060 0.012 . . . . . A 197 GLN H . 19303 1 469 . 1 1 45 45 GLN HA H 1 3.917 0.012 . . . . . A 197 GLN HA . 19303 1 470 . 1 1 45 45 GLN HB2 H 1 1.941 0.004 . . . . . A 197 GLN HB2 . 19303 1 471 . 1 1 45 45 GLN HB3 H 1 2.057 0.007 . . . . . A 197 GLN HB3 . 19303 1 472 . 1 1 45 45 GLN HG2 H 1 2.349 0.017 . . . . . A 197 GLN HG2 . 19303 1 473 . 1 1 45 45 GLN HG3 H 1 2.471 0.010 . . . . . A 197 GLN HG3 . 19303 1 474 . 1 1 45 45 GLN CA C 13 58.000 0.068 . . . . . A 197 GLN CA . 19303 1 475 . 1 1 45 45 GLN CB C 13 28.858 0.080 . . . . . A 197 GLN CB . 19303 1 476 . 1 1 45 45 GLN CG C 13 33.932 0.078 . . . . . A 197 GLN CG . 19303 1 477 . 1 1 45 45 GLN N N 15 116.723 0.030 . . . . . A 197 GLN N . 19303 1 478 . 1 1 46 46 VAL H H 1 7.451 0.002 . . . . . A 198 VAL H . 19303 1 479 . 1 1 46 46 VAL HA H 1 4.030 0.009 . . . . . A 198 VAL HA . 19303 1 480 . 1 1 46 46 VAL HB H 1 1.984 0.011 . . . . . A 198 VAL HB . 19303 1 481 . 1 1 46 46 VAL HG11 H 1 0.766 0.029 . . . . . A 198 VAL HG11 . 19303 1 482 . 1 1 46 46 VAL HG12 H 1 0.766 0.029 . . . . . A 198 VAL HG12 . 19303 1 483 . 1 1 46 46 VAL HG13 H 1 0.766 0.029 . . . . . A 198 VAL HG13 . 19303 1 484 . 1 1 46 46 VAL HG21 H 1 0.929 0.019 . . . . . A 198 VAL HG21 . 19303 1 485 . 1 1 46 46 VAL HG22 H 1 0.929 0.019 . . . . . A 198 VAL HG22 . 19303 1 486 . 1 1 46 46 VAL HG23 H 1 0.929 0.019 . . . . . A 198 VAL HG23 . 19303 1 487 . 1 1 46 46 VAL CA C 13 63.803 0.030 . . . . . A 198 VAL CA . 19303 1 488 . 1 1 46 46 VAL CB C 13 33.803 0.045 . . . . . A 198 VAL CB . 19303 1 489 . 1 1 46 46 VAL CG1 C 13 22.320 0.162 . . . . . A 198 VAL CG1 . 19303 1 490 . 1 1 46 46 VAL CG2 C 13 21.970 0.156 . . . . . A 198 VAL CG2 . 19303 1 491 . 1 1 46 46 VAL N N 15 115.154 0.040 . . . . . A 198 VAL N . 19303 1 492 . 1 1 47 47 VAL H H 1 7.576 0.006 . . . . . A 199 VAL H . 19303 1 493 . 1 1 47 47 VAL HA H 1 4.539 0.008 . . . . . A 199 VAL HA . 19303 1 494 . 1 1 47 47 VAL HB H 1 2.290 0.009 . . . . . A 199 VAL HB . 19303 1 495 . 1 1 47 47 VAL HG11 H 1 0.680 0.002 . . . . . A 199 VAL HG11 . 19303 1 496 . 1 1 47 47 VAL HG12 H 1 0.680 0.002 . . . . . A 199 VAL HG12 . 19303 1 497 . 1 1 47 47 VAL HG13 H 1 0.680 0.002 . . . . . A 199 VAL HG13 . 19303 1 498 . 1 1 47 47 VAL HG21 H 1 0.724 0.012 . . . . . A 199 VAL HG21 . 19303 1 499 . 1 1 47 47 VAL HG22 H 1 0.724 0.012 . . . . . A 199 VAL HG22 . 19303 1 500 . 1 1 47 47 VAL HG23 H 1 0.724 0.012 . . . . . A 199 VAL HG23 . 19303 1 501 . 1 1 47 47 VAL CA C 13 60.613 0.000 . . . . . A 199 VAL CA . 19303 1 502 . 1 1 47 47 VAL CB C 13 34.014 0.051 . . . . . A 199 VAL CB . 19303 1 503 . 1 1 47 47 VAL CG1 C 13 17.536 0.140 . . . . . A 199 VAL CG1 . 19303 1 504 . 1 1 47 47 VAL CG2 C 13 22.597 0.045 . . . . . A 199 VAL CG2 . 19303 1 505 . 1 1 47 47 VAL N N 15 106.495 0.025 . . . . . A 199 VAL N . 19303 1 506 . 1 1 48 48 GLY H H 1 7.981 0.009 . . . . . A 200 GLY H . 19303 1 507 . 1 1 48 48 GLY HA2 H 1 3.853 0.009 . . . . . A 200 GLY HA2 . 19303 1 508 . 1 1 48 48 GLY HA3 H 1 4.329 0.010 . . . . . A 200 GLY HA3 . 19303 1 509 . 1 1 48 48 GLY CA C 13 44.769 0.064 . . . . . A 200 GLY CA . 19303 1 510 . 1 1 48 48 GLY N N 15 111.200 0.042 . . . . . A 200 GLY N . 19303 1 511 . 1 1 49 49 GLN H H 1 8.498 0.007 . . . . . A 201 GLN H . 19303 1 512 . 1 1 49 49 GLN HA H 1 3.610 0.007 . . . . . A 201 GLN HA . 19303 1 513 . 1 1 49 49 GLN HB2 H 1 1.848 0.016 . . . . . A 201 GLN HB2 . 19303 1 514 . 1 1 49 49 GLN HB3 H 1 1.959 0.008 . . . . . A 201 GLN HB3 . 19303 1 515 . 1 1 49 49 GLN HG2 H 1 2.070 0.015 . . . . . A 201 GLN HG2 . 19303 1 516 . 1 1 49 49 GLN HG3 H 1 2.070 0.015 . . . . . A 201 GLN HG3 . 19303 1 517 . 1 1 49 49 GLN CA C 13 60.571 0.036 . . . . . A 201 GLN CA . 19303 1 518 . 1 1 49 49 GLN CB C 13 27.228 0.105 . . . . . A 201 GLN CB . 19303 1 519 . 1 1 49 49 GLN CG C 13 33.958 0.000 . . . . . A 201 GLN CG . 19303 1 520 . 1 1 49 49 GLN N N 15 119.688 0.023 . . . . . A 201 GLN N . 19303 1 521 . 1 1 50 50 ALA H H 1 8.291 0.010 . . . . . A 202 ALA H . 19303 1 522 . 1 1 50 50 ALA HA H 1 3.935 0.012 . . . . . A 202 ALA HA . 19303 1 523 . 1 1 50 50 ALA HB1 H 1 1.282 0.003 . . . . . A 202 ALA HB1 . 19303 1 524 . 1 1 50 50 ALA HB2 H 1 1.282 0.003 . . . . . A 202 ALA HB2 . 19303 1 525 . 1 1 50 50 ALA HB3 H 1 1.282 0.003 . . . . . A 202 ALA HB3 . 19303 1 526 . 1 1 50 50 ALA CA C 13 55.606 0.000 . . . . . A 202 ALA CA . 19303 1 527 . 1 1 50 50 ALA CB C 13 17.746 0.194 . . . . . A 202 ALA CB . 19303 1 528 . 1 1 50 50 ALA N N 15 122.373 0.028 . . . . . A 202 ALA N . 19303 1 529 . 1 1 51 51 VAL H H 1 8.358 0.011 . . . . . A 203 VAL H . 19303 1 530 . 1 1 51 51 VAL HA H 1 3.618 0.006 . . . . . A 203 VAL HA . 19303 1 531 . 1 1 51 51 VAL HB H 1 1.641 0.014 . . . . . A 203 VAL HB . 19303 1 532 . 1 1 51 51 VAL HG11 H 1 0.679 0.009 . . . . . A 203 VAL HG11 . 19303 1 533 . 1 1 51 51 VAL HG12 H 1 0.679 0.009 . . . . . A 203 VAL HG12 . 19303 1 534 . 1 1 51 51 VAL HG13 H 1 0.679 0.009 . . . . . A 203 VAL HG13 . 19303 1 535 . 1 1 51 51 VAL HG21 H 1 0.948 0.018 . . . . . A 203 VAL HG21 . 19303 1 536 . 1 1 51 51 VAL HG22 H 1 0.948 0.018 . . . . . A 203 VAL HG22 . 19303 1 537 . 1 1 51 51 VAL HG23 H 1 0.948 0.018 . . . . . A 203 VAL HG23 . 19303 1 538 . 1 1 51 51 VAL CA C 13 65.113 0.087 . . . . . A 203 VAL CA . 19303 1 539 . 1 1 51 51 VAL CB C 13 31.085 0.192 . . . . . A 203 VAL CB . 19303 1 540 . 1 1 51 51 VAL CG1 C 13 22.061 0.000 . . . . . A 203 VAL CG1 . 19303 1 541 . 1 1 51 51 VAL CG2 C 13 23.334 0.075 . . . . . A 203 VAL CG2 . 19303 1 542 . 1 1 51 51 VAL N N 15 119.328 0.024 . . . . . A 203 VAL N . 19303 1 543 . 1 1 52 52 ALA H H 1 7.885 0.002 . . . . . A 204 ALA H . 19303 1 544 . 1 1 52 52 ALA HA H 1 3.599 0.008 . . . . . A 204 ALA HA . 19303 1 545 . 1 1 52 52 ALA HB1 H 1 1.285 0.013 . . . . . A 204 ALA HB1 . 19303 1 546 . 1 1 52 52 ALA HB2 H 1 1.285 0.013 . . . . . A 204 ALA HB2 . 19303 1 547 . 1 1 52 52 ALA HB3 H 1 1.285 0.013 . . . . . A 204 ALA HB3 . 19303 1 548 . 1 1 52 52 ALA CA C 13 55.888 0.085 . . . . . A 204 ALA CA . 19303 1 549 . 1 1 52 52 ALA CB C 13 19.929 0.158 . . . . . A 204 ALA CB . 19303 1 550 . 1 1 52 52 ALA N N 15 123.342 0.037 . . . . . A 204 ALA N . 19303 1 551 . 1 1 53 53 GLN H H 1 7.683 0.014 . . . . . A 205 GLN H . 19303 1 552 . 1 1 53 53 GLN HA H 1 3.762 0.014 . . . . . A 205 GLN HA . 19303 1 553 . 1 1 53 53 GLN HB2 H 1 2.029 0.013 . . . . . A 205 GLN HB2 . 19303 1 554 . 1 1 53 53 GLN HB3 H 1 2.029 0.013 . . . . . A 205 GLN HB3 . 19303 1 555 . 1 1 53 53 GLN HG2 H 1 2.297 0.008 . . . . . A 205 GLN HG2 . 19303 1 556 . 1 1 53 53 GLN HG3 H 1 2.415 0.002 . . . . . A 205 GLN HG3 . 19303 1 557 . 1 1 53 53 GLN CA C 13 59.079 0.090 . . . . . A 205 GLN CA . 19303 1 558 . 1 1 53 53 GLN CB C 13 28.052 0.212 . . . . . A 205 GLN CB . 19303 1 559 . 1 1 53 53 GLN CG C 13 33.740 0.130 . . . . . A 205 GLN CG . 19303 1 560 . 1 1 53 53 GLN N N 15 114.955 0.033 . . . . . A 205 GLN N . 19303 1 561 . 1 1 54 54 GLN H H 1 7.339 0.005 . . . . . A 206 GLN H . 19303 1 562 . 1 1 54 54 GLN HA H 1 3.950 0.007 . . . . . A 206 GLN HA . 19303 1 563 . 1 1 54 54 GLN HB2 H 1 2.076 0.026 . . . . . A 206 GLN HB2 . 19303 1 564 . 1 1 54 54 GLN HB3 H 1 2.172 0.020 . . . . . A 206 GLN HB3 . 19303 1 565 . 1 1 54 54 GLN HG2 H 1 2.295 0.008 . . . . . A 206 GLN HG2 . 19303 1 566 . 1 1 54 54 GLN HG3 H 1 2.295 0.008 . . . . . A 206 GLN HG3 . 19303 1 567 . 1 1 54 54 GLN CA C 13 59.072 0.218 . . . . . A 206 GLN CA . 19303 1 568 . 1 1 54 54 GLN CB C 13 28.886 0.000 . . . . . A 206 GLN CB . 19303 1 569 . 1 1 54 54 GLN CG C 13 34.077 0.115 . . . . . A 206 GLN CG . 19303 1 570 . 1 1 54 54 GLN N N 15 120.118 0.043 . . . . . A 206 GLN N . 19303 1 571 . 1 1 55 55 ILE H H 1 8.464 0.011 . . . . . A 207 ILE H . 19303 1 572 . 1 1 55 55 ILE HA H 1 3.440 0.014 . . . . . A 207 ILE HA . 19303 1 573 . 1 1 55 55 ILE HB H 1 1.797 0.010 . . . . . A 207 ILE HB . 19303 1 574 . 1 1 55 55 ILE HG12 H 1 1.728 0.014 . . . . . A 207 ILE HG12 . 19303 1 575 . 1 1 55 55 ILE HG13 H 1 1.728 0.014 . . . . . A 207 ILE HG13 . 19303 1 576 . 1 1 55 55 ILE HG21 H 1 0.870 0.007 . . . . . A 207 ILE HG21 . 19303 1 577 . 1 1 55 55 ILE HG22 H 1 0.870 0.007 . . . . . A 207 ILE HG22 . 19303 1 578 . 1 1 55 55 ILE HG23 H 1 0.870 0.007 . . . . . A 207 ILE HG23 . 19303 1 579 . 1 1 55 55 ILE HD11 H 1 0.680 0.009 . . . . . A 207 ILE HD11 . 19303 1 580 . 1 1 55 55 ILE HD12 H 1 0.680 0.009 . . . . . A 207 ILE HD12 . 19303 1 581 . 1 1 55 55 ILE HD13 H 1 0.680 0.009 . . . . . A 207 ILE HD13 . 19303 1 582 . 1 1 55 55 ILE CA C 13 65.448 0.082 . . . . . A 207 ILE CA . 19303 1 583 . 1 1 55 55 ILE CB C 13 38.070 0.105 . . . . . A 207 ILE CB . 19303 1 584 . 1 1 55 55 ILE CG1 C 13 28.892 0.069 . . . . . A 207 ILE CG1 . 19303 1 585 . 1 1 55 55 ILE CG2 C 13 17.897 0.151 . . . . . A 207 ILE CG2 . 19303 1 586 . 1 1 55 55 ILE CD1 C 13 17.040 0.071 . . . . . A 207 ILE CD1 . 19303 1 587 . 1 1 55 55 ILE N N 15 121.817 0.025 . . . . . A 207 ILE N . 19303 1 588 . 1 1 56 56 HIS H H 1 8.171 0.008 . . . . . A 208 HIS H . 19303 1 589 . 1 1 56 56 HIS HA H 1 4.375 0.066 . . . . . A 208 HIS HA . 19303 1 590 . 1 1 56 56 HIS HB2 H 1 2.933 0.023 . . . . . A 208 HIS HB2 . 19303 1 591 . 1 1 56 56 HIS HB3 H 1 3.060 0.016 . . . . . A 208 HIS HB3 . 19303 1 592 . 1 1 56 56 HIS CA C 13 59.657 0.025 . . . . . A 208 HIS CA . 19303 1 593 . 1 1 56 56 HIS CB C 13 28.715 0.075 . . . . . A 208 HIS CB . 19303 1 594 . 1 1 56 56 HIS N N 15 117.120 0.092 . . . . . A 208 HIS N . 19303 1 595 . 1 1 57 57 ALA H H 1 8.131 0.012 . . . . . A 209 ALA H . 19303 1 596 . 1 1 57 57 ALA HA H 1 3.832 0.003 . . . . . A 209 ALA HA . 19303 1 597 . 1 1 57 57 ALA HB1 H 1 1.347 0.007 . . . . . A 209 ALA HB1 . 19303 1 598 . 1 1 57 57 ALA HB2 H 1 1.347 0.007 . . . . . A 209 ALA HB2 . 19303 1 599 . 1 1 57 57 ALA HB3 H 1 1.347 0.007 . . . . . A 209 ALA HB3 . 19303 1 600 . 1 1 57 57 ALA CA C 13 54.755 0.038 . . . . . A 209 ALA CA . 19303 1 601 . 1 1 57 57 ALA CB C 13 18.039 0.092 . . . . . A 209 ALA CB . 19303 1 602 . 1 1 57 57 ALA N N 15 121.488 0.179 . . . . . A 209 ALA N . 19303 1 603 . 1 1 58 58 PHE H H 1 7.771 0.007 . . . . . A 210 PHE H . 19303 1 604 . 1 1 58 58 PHE HA H 1 3.849 0.005 . . . . . A 210 PHE HA . 19303 1 605 . 1 1 58 58 PHE HB2 H 1 2.799 0.017 . . . . . A 210 PHE HB2 . 19303 1 606 . 1 1 58 58 PHE HB3 H 1 2.901 0.027 . . . . . A 210 PHE HB3 . 19303 1 607 . 1 1 58 58 PHE HD1 H 1 6.034 0.012 . . . . . A 210 PHE HD1 . 19303 1 608 . 1 1 58 58 PHE HD2 H 1 6.034 0.012 . . . . . A 210 PHE HD2 . 19303 1 609 . 1 1 58 58 PHE HE1 H 1 6.787 0.012 . . . . . A 210 PHE HE1 . 19303 1 610 . 1 1 58 58 PHE HE2 H 1 6.787 0.012 . . . . . A 210 PHE HE2 . 19303 1 611 . 1 1 58 58 PHE HZ H 1 6.984 0.014 . . . . . A 210 PHE HZ . 19303 1 612 . 1 1 58 58 PHE CA C 13 61.382 0.089 . . . . . A 210 PHE CA . 19303 1 613 . 1 1 58 58 PHE CB C 13 39.206 0.159 . . . . . A 210 PHE CB . 19303 1 614 . 1 1 58 58 PHE N N 15 119.874 0.033 . . . . . A 210 PHE N . 19303 1 615 . 1 1 59 59 PHE H H 1 7.296 0.010 . . . . . A 211 PHE H . 19303 1 616 . 1 1 59 59 PHE HA H 1 4.218 0.013 . . . . . A 211 PHE HA . 19303 1 617 . 1 1 59 59 PHE HB2 H 1 2.631 0.017 . . . . . A 211 PHE HB2 . 19303 1 618 . 1 1 59 59 PHE HB3 H 1 3.290 0.007 . . . . . A 211 PHE HB3 . 19303 1 619 . 1 1 59 59 PHE HD1 H 1 7.285 0.023 . . . . . A 211 PHE HD1 . 19303 1 620 . 1 1 59 59 PHE HD2 H 1 7.285 0.023 . . . . . A 211 PHE HD2 . 19303 1 621 . 1 1 59 59 PHE HE1 H 1 7.024 0.014 . . . . . A 211 PHE HE1 . 19303 1 622 . 1 1 59 59 PHE HE2 H 1 7.024 0.014 . . . . . A 211 PHE HE2 . 19303 1 623 . 1 1 59 59 PHE HZ H 1 6.684 0.007 . . . . . A 211 PHE HZ . 19303 1 624 . 1 1 59 59 PHE CA C 13 60.337 0.046 . . . . . A 211 PHE CA . 19303 1 625 . 1 1 59 59 PHE CB C 13 39.664 0.147 . . . . . A 211 PHE CB . 19303 1 626 . 1 1 59 59 PHE N N 15 113.116 0.100 . . . . . A 211 PHE N . 19303 1 627 . 1 1 60 60 THR H H 1 7.328 0.011 . . . . . A 212 THR H . 19303 1 628 . 1 1 60 60 THR HA H 1 4.182 0.008 . . . . . A 212 THR HA . 19303 1 629 . 1 1 60 60 THR HB H 1 3.944 0.035 . . . . . A 212 THR HB . 19303 1 630 . 1 1 60 60 THR HG21 H 1 0.854 0.008 . . . . . A 212 THR HG21 . 19303 1 631 . 1 1 60 60 THR HG22 H 1 0.854 0.008 . . . . . A 212 THR HG22 . 19303 1 632 . 1 1 60 60 THR HG23 H 1 0.854 0.008 . . . . . A 212 THR HG23 . 19303 1 633 . 1 1 60 60 THR CA C 13 62.434 0.049 . . . . . A 212 THR CA . 19303 1 634 . 1 1 60 60 THR CB C 13 69.944 0.054 . . . . . A 212 THR CB . 19303 1 635 . 1 1 60 60 THR CG2 C 13 21.168 0.069 . . . . . A 212 THR CG2 . 19303 1 636 . 1 1 60 60 THR N N 15 111.426 0.065 . . . . . A 212 THR N . 19303 1 637 . 1 1 61 61 GLN H H 1 7.557 0.005 . . . . . A 213 GLN H . 19303 1 638 . 1 1 61 61 GLN HA H 1 4.410 0.016 . . . . . A 213 GLN HA . 19303 1 639 . 1 1 61 61 GLN HB2 H 1 1.767 0.011 . . . . . A 213 GLN HB2 . 19303 1 640 . 1 1 61 61 GLN HB3 H 1 1.767 0.011 . . . . . A 213 GLN HB3 . 19303 1 641 . 1 1 61 61 GLN HG2 H 1 2.156 0.000 . . . . . A 213 GLN HG2 . 19303 1 642 . 1 1 61 61 GLN HG3 H 1 2.156 0.000 . . . . . A 213 GLN HG3 . 19303 1 643 . 1 1 61 61 GLN CA C 13 54.441 0.075 . . . . . A 213 GLN CA . 19303 1 644 . 1 1 61 61 GLN CB C 13 29.136 0.000 . . . . . A 213 GLN CB . 19303 1 645 . 1 1 61 61 GLN N N 15 123.682 0.046 . . . . . A 213 GLN N . 19303 1 646 . 1 1 62 62 PRO HA H 1 4.176 0.012 . . . . . A 214 PRO HA . 19303 1 647 . 1 1 62 62 PRO HB2 H 1 1.709 0.009 . . . . . A 214 PRO HB2 . 19303 1 648 . 1 1 62 62 PRO HB3 H 1 2.076 0.009 . . . . . A 214 PRO HB3 . 19303 1 649 . 1 1 62 62 PRO HG2 H 1 1.835 0.015 . . . . . A 214 PRO HG2 . 19303 1 650 . 1 1 62 62 PRO HG3 H 1 1.835 0.015 . . . . . A 214 PRO HG3 . 19303 1 651 . 1 1 62 62 PRO HD2 H 1 3.274 0.020 . . . . . A 214 PRO HD2 . 19303 1 652 . 1 1 62 62 PRO HD3 H 1 3.582 0.009 . . . . . A 214 PRO HD3 . 19303 1 653 . 1 1 62 62 PRO CA C 13 63.466 0.030 . . . . . A 214 PRO CA . 19303 1 654 . 1 1 62 62 PRO CB C 13 31.987 0.069 . . . . . A 214 PRO CB . 19303 1 655 . 1 1 62 62 PRO CG C 13 27.220 0.129 . . . . . A 214 PRO CG . 19303 1 656 . 1 1 62 62 PRO CD C 13 50.563 0.000 . . . . . A 214 PRO CD . 19303 1 657 . 1 1 63 63 ARG H H 1 7.785 0.007 . . . . . A 215 ARG H . 19303 1 658 . 1 1 63 63 ARG HA H 1 3.930 0.034 . . . . . A 215 ARG HA . 19303 1 659 . 1 1 63 63 ARG HB2 H 1 1.467 0.032 . . . . . A 215 ARG HB2 . 19303 1 660 . 1 1 63 63 ARG HB3 H 1 1.618 0.006 . . . . . A 215 ARG HB3 . 19303 1 661 . 1 1 63 63 ARG HG2 H 1 1.368 0.003 . . . . . A 215 ARG HG2 . 19303 1 662 . 1 1 63 63 ARG HG3 H 1 1.368 0.003 . . . . . A 215 ARG HG3 . 19303 1 663 . 1 1 63 63 ARG HD2 H 1 2.899 0.009 . . . . . A 215 ARG HD2 . 19303 1 664 . 1 1 63 63 ARG HD3 H 1 2.899 0.009 . . . . . A 215 ARG HD3 . 19303 1 665 . 1 1 63 63 ARG CA C 13 57.094 0.019 . . . . . A 215 ARG CA . 19303 1 666 . 1 1 63 63 ARG CB C 13 31.629 0.014 . . . . . A 215 ARG CB . 19303 1 667 . 1 1 63 63 ARG N N 15 127.166 0.028 . . . . . A 215 ARG N . 19303 1 stop_ save_