data_6367 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6367 _Entry.Title ; 1H, 13C, and 15N Chemical Shift Assignments of E.Coli Protein yhgG: The Northeast Structural Genomics Consortium Target ET95 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2004-10-27 _Entry.Accession_date 2004-10-28 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Yang Shen . . . 6367 2 Thomas Acton . . . 6367 3 Hanudatta Atreya . S. . 6367 4 LiChung Ma . . . 6367 5 Gaohua Liu . . . 6367 6 Rong Xiao . . . 6367 7 Gaetano Montelione . T. . 6367 8 Thomas Szyperski . . . 6367 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6367 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 533 6367 '13C chemical shifts' 321 6367 '15N chemical shifts' 80 6367 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2008-08-28 . update BMRB 'update entry citation' 6367 2 . . 2005-10-31 . original author 'original release' 6367 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6367 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16027363 _Citation.Full_citation . _Citation.Title 'NMR data collection and analysis protocol for high-throughput protein structure determination' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Proc. Natl. Acad. Sci. U.S.A.' _Citation.Journal_name_full . _Citation.Journal_volume 102 _Citation.Journal_issue 30 _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 10487 _Citation.Page_last 10492 _Citation.Year 2005 _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 Gaohua Liu . . . 6367 1 2 Yang Shen . . . 6367 1 3 Hanudatta Atreya . S. . 6367 1 4 David Parish . . . 6367 1 5 Ying Shao . . . 6367 1 6 Dinesh Sukumaran . K. . 6367 1 7 Rong Xiao . . . 6367 1 8 Adelinda Yee . . . 6367 1 9 Alexander Lemak . . . 6367 1 10 Aneerban Bhattacharya . . . 6367 1 11 Thomas Acton . A. . 6367 1 12 Cheryl Arrowsmith . H. . 6367 1 13 Gaetano Montelione . T. . 6367 1 14 Thomas Szyperski . . . 6367 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_molecular_system_yhgG _Assembly.Sf_category assembly _Assembly.Sf_framecode molecular_system_yhgG _Assembly.Entry_ID 6367 _Assembly.ID 1 _Assembly.Name 'Hypothetical protein yhgG' _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 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 6367 1 stop_ 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 'Hypothetical protein yhgG' 1 $Hypothetical_protein_yhgG . . . native . . . . . 6367 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'Hypothetical protein yhgG' system 6367 1 'Hypothetical protein yhgG' abbreviation 6367 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Hypothetical_protein_yhgG _Entity.Sf_category entity _Entity.Sf_framecode Hypothetical_protein_yhgG _Entity.Entry_ID 6367 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Hypothetical protein yhgG' _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 ; MASLIQVRDLLALRGRMEAA QISQTLNTPQPMINAMLQQL ESMGKAVRIQEEPDGCLSGS CKSCPEGKACLREWWALR ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 78 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1XN7 . "Solution Structure Of E.Coli Protein Yhgg: The Northeast Structural Genomics Consortium Target Et95" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 2 no DBJ BAB37675 . "hypothetical protein [Escherichia coli O157:H7 str. Sakai]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 3 no DBJ BAE77881 . "predicted DNA-binding transcriptional regulator [Escherichia coli str. K-12 substr. W3110]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 4 no DBJ BAG79200 . "conserved hypothetical protein [Escherichia coli SE11]" . . . . . 100.00 78 98.72 98.72 3.39e-47 . . . . 6367 1 5 no DBJ BAI27668 . "predicted DNA-binding transcriptional regulator [Escherichia coli O26:H11 str. 11368]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 6 no DBJ BAI32838 . "predicted DNA-binding transcriptional regulator [Escherichia coli O103:H2 str. 12009]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 7 no EMBL CAP77856 . "Protein yhgG [Escherichia coli LF82]" . . . . . 100.00 78 97.44 98.72 1.17e-46 . . . . 6367 1 8 no EMBL CAQ33731 . "predicted DNA-binding transcriptional regulator [Escherichia coli BL21(DE3)]" . . . . . 100.00 78 98.72 98.72 3.39e-47 . . . . 6367 1 9 no EMBL CAQ90856 . "putative DNA-binding transcriptional regulator [Escherichia fergusonii ATCC 35469]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 10 no EMBL CAR00353 . "putative DNA-binding transcriptional regulator [Escherichia coli IAI1]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 11 no EMBL CAR05011 . "putative DNA-binding transcriptional regulator [Escherichia coli S88]" . . . . . 100.00 78 97.44 98.72 1.17e-46 . . . . 6367 1 12 no GB AAA58208 . "ORF_o78 [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 13 no GB AAC76435 . "putative DNA-binding transcriptional regulator [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 14 no GB AAG58511 . "orf, hypothetical protein [Escherichia coli O157:H7 str. EDL933]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 15 no GB AAN44890 . "conserved hypothetical protein [Shigella flexneri 2a str. 301]" . . . . . 100.00 78 98.72 98.72 3.39e-47 . . . . 6367 1 16 no GB AAN82625 . "Hypothetical protein yhgG [Escherichia coli CFT073]" . . . . . 100.00 81 97.44 98.72 1.47e-46 . . . . 6367 1 17 no REF NP_289950 . "hypothetical protein Z4765 [Escherichia coli O157:H7 str. EDL933]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 18 no REF NP_312279 . "hypothetical protein ECs4252 [Escherichia coli O157:H7 str. Sakai]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 19 no REF NP_417869 . "putative DNA-binding transcriptional regulator [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 20 no REF NP_709183 . "ferrous iron transport protein FeoC [Shigella flexneri 2a str. 301]" . . . . . 100.00 78 98.72 98.72 3.39e-47 . . . . 6367 1 21 no REF NP_756051 . "hypothetical protein c4187 [Escherichia coli CFT073]" . . . . . 100.00 81 97.44 98.72 1.47e-46 . . . . 6367 1 22 no SP A7ZST9 . "RecName: Full=Ferrous iron transport protein C [Escherichia coli E24377A]" . . . . . 100.00 78 98.72 100.00 3.29e-47 . . . . 6367 1 23 no SP A8A5L8 . "RecName: Full=Ferrous iron transport protein C [Escherichia coli HS]" . . . . . 100.00 78 98.72 98.72 3.39e-47 . . . . 6367 1 24 no SP B1IP55 . "RecName: Full=Ferrous iron transport protein C [Escherichia coli ATCC 8739]" . . . . . 100.00 78 98.72 98.72 3.39e-47 . . . . 6367 1 25 no SP B1LHL0 . "RecName: Full=Ferrous iron transport protein C [Escherichia coli SMS-3-5]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 26 no SP B1X757 . "RecName: Full=Ferrous iron transport protein C [Escherichia coli str. K-12 substr. DH10B]" . . . . . 100.00 78 100.00 100.00 1.04e-47 . . . . 6367 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Hypothetical protein yhgG' common 6367 1 'Hypothetical protein yhgG' abbreviation 6367 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 6367 1 2 . ALA . 6367 1 3 . SER . 6367 1 4 . LEU . 6367 1 5 . ILE . 6367 1 6 . GLN . 6367 1 7 . VAL . 6367 1 8 . ARG . 6367 1 9 . ASP . 6367 1 10 . LEU . 6367 1 11 . LEU . 6367 1 12 . ALA . 6367 1 13 . LEU . 6367 1 14 . ARG . 6367 1 15 . GLY . 6367 1 16 . ARG . 6367 1 17 . MET . 6367 1 18 . GLU . 6367 1 19 . ALA . 6367 1 20 . ALA . 6367 1 21 . GLN . 6367 1 22 . ILE . 6367 1 23 . SER . 6367 1 24 . GLN . 6367 1 25 . THR . 6367 1 26 . LEU . 6367 1 27 . ASN . 6367 1 28 . THR . 6367 1 29 . PRO . 6367 1 30 . GLN . 6367 1 31 . PRO . 6367 1 32 . MET . 6367 1 33 . ILE . 6367 1 34 . ASN . 6367 1 35 . ALA . 6367 1 36 . MET . 6367 1 37 . LEU . 6367 1 38 . GLN . 6367 1 39 . GLN . 6367 1 40 . LEU . 6367 1 41 . GLU . 6367 1 42 . SER . 6367 1 43 . MET . 6367 1 44 . GLY . 6367 1 45 . LYS . 6367 1 46 . ALA . 6367 1 47 . VAL . 6367 1 48 . ARG . 6367 1 49 . ILE . 6367 1 50 . GLN . 6367 1 51 . GLU . 6367 1 52 . GLU . 6367 1 53 . PRO . 6367 1 54 . ASP . 6367 1 55 . GLY . 6367 1 56 . CYS . 6367 1 57 . LEU . 6367 1 58 . SER . 6367 1 59 . GLY . 6367 1 60 . SER . 6367 1 61 . CYS . 6367 1 62 . LYS . 6367 1 63 . SER . 6367 1 64 . CYS . 6367 1 65 . PRO . 6367 1 66 . GLU . 6367 1 67 . GLY . 6367 1 68 . LYS . 6367 1 69 . ALA . 6367 1 70 . CYS . 6367 1 71 . LEU . 6367 1 72 . ARG . 6367 1 73 . GLU . 6367 1 74 . TRP . 6367 1 75 . TRP . 6367 1 76 . ALA . 6367 1 77 . LEU . 6367 1 78 . ARG . 6367 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 6367 1 . ALA 2 2 6367 1 . SER 3 3 6367 1 . LEU 4 4 6367 1 . ILE 5 5 6367 1 . GLN 6 6 6367 1 . VAL 7 7 6367 1 . ARG 8 8 6367 1 . ASP 9 9 6367 1 . LEU 10 10 6367 1 . LEU 11 11 6367 1 . ALA 12 12 6367 1 . LEU 13 13 6367 1 . ARG 14 14 6367 1 . GLY 15 15 6367 1 . ARG 16 16 6367 1 . MET 17 17 6367 1 . GLU 18 18 6367 1 . ALA 19 19 6367 1 . ALA 20 20 6367 1 . GLN 21 21 6367 1 . ILE 22 22 6367 1 . SER 23 23 6367 1 . GLN 24 24 6367 1 . THR 25 25 6367 1 . LEU 26 26 6367 1 . ASN 27 27 6367 1 . THR 28 28 6367 1 . PRO 29 29 6367 1 . GLN 30 30 6367 1 . PRO 31 31 6367 1 . MET 32 32 6367 1 . ILE 33 33 6367 1 . ASN 34 34 6367 1 . ALA 35 35 6367 1 . MET 36 36 6367 1 . LEU 37 37 6367 1 . GLN 38 38 6367 1 . GLN 39 39 6367 1 . LEU 40 40 6367 1 . GLU 41 41 6367 1 . SER 42 42 6367 1 . MET 43 43 6367 1 . GLY 44 44 6367 1 . LYS 45 45 6367 1 . ALA 46 46 6367 1 . VAL 47 47 6367 1 . ARG 48 48 6367 1 . ILE 49 49 6367 1 . GLN 50 50 6367 1 . GLU 51 51 6367 1 . GLU 52 52 6367 1 . PRO 53 53 6367 1 . ASP 54 54 6367 1 . GLY 55 55 6367 1 . CYS 56 56 6367 1 . LEU 57 57 6367 1 . SER 58 58 6367 1 . GLY 59 59 6367 1 . SER 60 60 6367 1 . CYS 61 61 6367 1 . LYS 62 62 6367 1 . SER 63 63 6367 1 . CYS 64 64 6367 1 . PRO 65 65 6367 1 . GLU 66 66 6367 1 . GLY 67 67 6367 1 . LYS 68 68 6367 1 . ALA 69 69 6367 1 . CYS 70 70 6367 1 . LEU 71 71 6367 1 . ARG 72 72 6367 1 . GLU 73 73 6367 1 . TRP 74 74 6367 1 . TRP 75 75 6367 1 . ALA 76 76 6367 1 . LEU 77 77 6367 1 . ARG 78 78 6367 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 6367 _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 $Hypothetical_protein_yhgG . 562 organism . 'Escherichia coli' 'E. Coli' . . Bacteria 'Not applicable' Escherichia coli . . . . . . . . . . . . . . . . . . . . . 6367 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 6367 _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 $Hypothetical_protein_yhgG . 'recombinant technology' 'Escherichia coli' 'Escherichia coli' . . Escherichia coli . . . . . . . . . . . . . . . . . . . . . . . 6367 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6367 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Hypothetical protein yhgG' '[U-13C; U-15N]' . . 1 $Hypothetical_protein_yhgG . . 1.13 . . mM . . . . 6367 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions _Sample_condition_list.Entry_ID 6367 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.5 0.2 pH 6367 1 temperature 298 0.1 K 6367 1 pressure 1 0.001 atm 6367 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 6367 _Software.ID 1 _Software.Name PROSA _Software.Version 6.0 _Software.Details 'Spectrum Processing' save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 6367 _Software.ID 2 _Software.Name XEASY _Software.Version 1.3.1.3 _Software.Details 'Spectrum Analysis' save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 6367 _Software.ID 3 _Software.Name AUTOASSIGN _Software.Version 1.13.2 _Software.Details 'Backbon resonance assignments' save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 6367 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer VARIAN _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 6367 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer VARIAN _NMR_spectrometer.Model Inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 6367 _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 NMR_spectrometer_1 VARIAN Inova . 750 . . . 6367 1 2 NMR_spectrometer_2 VARIAN Inova . 600 . . . 6367 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 6367 _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 'GFT (4,3)D HNNCABCA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6367 1 2 'GFT (4,3)D CABCA(CO)NHN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6367 1 3 'GFT (5,2)D HACACONHN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6367 1 4 'GFT (4,3)D HCCH' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6367 1 5 'SIMULTANEOUS HETERONUCLEAR RESOLVED [1H,1H]-NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6367 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 6367 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name 'GFT (4,3)D HNNCABCA' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 6367 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name 'GFT (4,3)D CABCA(CO)NHN' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 6367 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name 'GFT (5,2)D HACACONHN' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 6367 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name 'GFT (4,3)D HCCH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 6367 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name 'SIMULTANEOUS HETERONUCLEAR RESOLVED [1H,1H]-NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 6367 _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 H 1 DSS 'methyl protons' . . . . ppm 0.0 external direct 1.0 . . . . . . . . . 6367 1 C 13 DSS 'methyl protons' . . . . ppm 0.0 external indirect 0.251449530 . . . . . . . . . 6367 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 external indirect 0.101329118 . . . . . . . . . 6367 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_chemical_shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts _Assigned_chem_shift_list.Entry_ID 6367 _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 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 6367 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 ALA CA C 13 51.5 0.03 . 1 . . . . . . . . 6367 1 2 . 1 1 2 2 ALA HA H 1 4.28 0.01 . 1 . . . . . . . . 6367 1 3 . 1 1 2 2 ALA HB1 H 1 1.36 0.01 . 1 . . . . . . . . 6367 1 4 . 1 1 2 2 ALA HB2 H 1 1.36 0.01 . 1 . . . . . . . . 6367 1 5 . 1 1 2 2 ALA HB3 H 1 1.36 0.01 . 1 . . . . . . . . 6367 1 6 . 1 1 2 2 ALA CB C 13 21.0 0.03 . 1 . . . . . . . . 6367 1 7 . 1 1 2 2 ALA C C 13 173.4 0.03 . 1 . . . . . . . . 6367 1 8 . 1 1 3 3 SER N N 15 114.9 0.03 . 1 . . . . . . . . 6367 1 9 . 1 1 3 3 SER H H 1 8.40 0.01 . 1 . . . . . . . . 6367 1 10 . 1 1 3 3 SER CA C 13 56.2 0.03 . 1 . . . . . . . . 6367 1 11 . 1 1 3 3 SER HA H 1 4.76 0.01 . 1 . . . . . . . . 6367 1 12 . 1 1 3 3 SER CB C 13 66.3 0.03 . 1 . . . . . . . . 6367 1 13 . 1 1 3 3 SER HB2 H 1 3.91 0.01 . 1 . . . . . . . . 6367 1 14 . 1 1 3 3 SER HB3 H 1 4.25 0.01 . 1 . . . . . . . . 6367 1 15 . 1 1 3 3 SER C C 13 174.5 0.03 . 1 . . . . . . . . 6367 1 16 . 1 1 4 4 LEU N N 15 121.6 0.03 . 1 . . . . . . . . 6367 1 17 . 1 1 4 4 LEU H H 1 8.71 0.01 . 1 . . . . . . . . 6367 1 18 . 1 1 4 4 LEU CA C 13 58.7 0.03 . 1 . . . . . . . . 6367 1 19 . 1 1 4 4 LEU HA H 1 3.89 0.01 . 1 . . . . . . . . 6367 1 20 . 1 1 4 4 LEU CB C 13 42.2 0.03 . 1 . . . . . . . . 6367 1 21 . 1 1 4 4 LEU HB2 H 1 1.56 0.01 . 2 . . . . . . . . 6367 1 22 . 1 1 4 4 LEU HB3 H 1 1.72 0.01 . 2 . . . . . . . . 6367 1 23 . 1 1 4 4 LEU CG C 13 27.0 0.03 . 1 . . . . . . . . 6367 1 24 . 1 1 4 4 LEU HG H 1 1.84 0.01 . 1 . . . . . . . . 6367 1 25 . 1 1 4 4 LEU HD11 H 1 0.89 0.01 . 2 . . . . . . . . 6367 1 26 . 1 1 4 4 LEU HD12 H 1 0.89 0.01 . 2 . . . . . . . . 6367 1 27 . 1 1 4 4 LEU HD13 H 1 0.89 0.01 . 2 . . . . . . . . 6367 1 28 . 1 1 4 4 LEU HD21 H 1 0.84 0.01 . 2 . . . . . . . . 6367 1 29 . 1 1 4 4 LEU HD22 H 1 0.84 0.01 . 2 . . . . . . . . 6367 1 30 . 1 1 4 4 LEU HD23 H 1 0.84 0.01 . 2 . . . . . . . . 6367 1 31 . 1 1 4 4 LEU CD1 C 13 25.4 0.03 . 2 . . . . . . . . 6367 1 32 . 1 1 4 4 LEU CD2 C 13 24.7 0.03 . 2 . . . . . . . . 6367 1 33 . 1 1 4 4 LEU C C 13 179.1 0.03 . 1 . . . . . . . . 6367 1 34 . 1 1 5 5 ILE N N 15 116.8 0.03 . 1 . . . . . . . . 6367 1 35 . 1 1 5 5 ILE H H 1 7.78 0.01 . 1 . . . . . . . . 6367 1 36 . 1 1 5 5 ILE CA C 13 63.2 0.03 . 1 . . . . . . . . 6367 1 37 . 1 1 5 5 ILE HA H 1 3.71 0.01 . 1 . . . . . . . . 6367 1 38 . 1 1 5 5 ILE CB C 13 37.7 0.03 . 1 . . . . . . . . 6367 1 39 . 1 1 5 5 ILE HB H 1 1.74 0.01 . 1 . . . . . . . . 6367 1 40 . 1 1 5 5 ILE HG21 H 1 0.87 0.01 . 1 . . . . . . . . 6367 1 41 . 1 1 5 5 ILE HG22 H 1 0.87 0.01 . 1 . . . . . . . . 6367 1 42 . 1 1 5 5 ILE HG23 H 1 0.87 0.01 . 1 . . . . . . . . 6367 1 43 . 1 1 5 5 ILE CG2 C 13 17.6 0.03 . 1 . . . . . . . . 6367 1 44 . 1 1 5 5 ILE CG1 C 13 28.8 0.03 . 1 . . . . . . . . 6367 1 45 . 1 1 5 5 ILE HG12 H 1 1.52 0.01 . 2 . . . . . . . . 6367 1 46 . 1 1 5 5 ILE HG13 H 1 1.27 0.01 . 2 . . . . . . . . 6367 1 47 . 1 1 5 5 ILE HD11 H 1 0.84 0.01 . 1 . . . . . . . . 6367 1 48 . 1 1 5 5 ILE HD12 H 1 0.84 0.01 . 1 . . . . . . . . 6367 1 49 . 1 1 5 5 ILE HD13 H 1 0.84 0.01 . 1 . . . . . . . . 6367 1 50 . 1 1 5 5 ILE CD1 C 13 12.5 0.03 . 1 . . . . . . . . 6367 1 51 . 1 1 5 5 ILE C C 13 177.0 0.03 . 1 . . . . . . . . 6367 1 52 . 1 1 6 6 GLN N N 15 119.0 0.03 . 1 . . . . . . . . 6367 1 53 . 1 1 6 6 GLN H H 1 7.47 0.01 . 1 . . . . . . . . 6367 1 54 . 1 1 6 6 GLN CA C 13 58.7 0.03 . 1 . . . . . . . . 6367 1 55 . 1 1 6 6 GLN HA H 1 4.11 0.01 . 1 . . . . . . . . 6367 1 56 . 1 1 6 6 GLN CB C 13 29.3 0.03 . 1 . . . . . . . . 6367 1 57 . 1 1 6 6 GLN HB2 H 1 1.95 0.01 . 2 . . . . . . . . 6367 1 58 . 1 1 6 6 GLN HB3 H 1 2.30 0.01 . 2 . . . . . . . . 6367 1 59 . 1 1 6 6 GLN CG C 13 35.1 0.03 . 1 . . . . . . . . 6367 1 60 . 1 1 6 6 GLN HG2 H 1 2.40 0.01 . 1 . . . . . . . . 6367 1 61 . 1 1 6 6 GLN HG3 H 1 2.41 0.01 . 1 . . . . . . . . 6367 1 62 . 1 1 6 6 GLN NE2 N 15 111.7 0.03 . 1 . . . . . . . . 6367 1 63 . 1 1 6 6 GLN HE21 H 1 7.64 0.01 . 2 . . . . . . . . 6367 1 64 . 1 1 6 6 GLN HE22 H 1 6.90 0.01 . 2 . . . . . . . . 6367 1 65 . 1 1 6 6 GLN C C 13 179.9 0.03 . 1 . . . . . . . . 6367 1 66 . 1 1 7 7 VAL N N 15 119.3 0.03 . 1 . . . . . . . . 6367 1 67 . 1 1 7 7 VAL H H 1 7.61 0.01 . 1 . . . . . . . . 6367 1 68 . 1 1 7 7 VAL CA C 13 66.7 0.03 . 1 . . . . . . . . 6367 1 69 . 1 1 7 7 VAL HA H 1 3.33 0.01 . 1 . . . . . . . . 6367 1 70 . 1 1 7 7 VAL CB C 13 31.1 0.03 . 1 . . . . . . . . 6367 1 71 . 1 1 7 7 VAL HB H 1 2.10 0.01 . 1 . . . . . . . . 6367 1 72 . 1 1 7 7 VAL HG11 H 1 0.61 0.01 . 2 . . . . . . . . 6367 1 73 . 1 1 7 7 VAL HG12 H 1 0.61 0.01 . 2 . . . . . . . . 6367 1 74 . 1 1 7 7 VAL HG13 H 1 0.61 0.01 . 2 . . . . . . . . 6367 1 75 . 1 1 7 7 VAL HG21 H 1 0.79 0.01 . 2 . . . . . . . . 6367 1 76 . 1 1 7 7 VAL HG22 H 1 0.79 0.01 . 2 . . . . . . . . 6367 1 77 . 1 1 7 7 VAL HG23 H 1 0.79 0.01 . 2 . . . . . . . . 6367 1 78 . 1 1 7 7 VAL CG1 C 13 22.1 0.03 . 2 . . . . . . . . 6367 1 79 . 1 1 7 7 VAL CG2 C 13 23.4 0.03 . 2 . . . . . . . . 6367 1 80 . 1 1 7 7 VAL C C 13 176.5 0.03 . 1 . . . . . . . . 6367 1 81 . 1 1 8 8 ARG N N 15 119.5 0.03 . 1 . . . . . . . . 6367 1 82 . 1 1 8 8 ARG H H 1 8.11 0.01 . 1 . . . . . . . . 6367 1 83 . 1 1 8 8 ARG CA C 13 60.1 0.03 . 1 . . . . . . . . 6367 1 84 . 1 1 8 8 ARG HA H 1 3.67 0.01 . 1 . . . . . . . . 6367 1 85 . 1 1 8 8 ARG CB C 13 29.6 0.03 . 1 . . . . . . . . 6367 1 86 . 1 1 8 8 ARG HB2 H 1 1.84 0.01 . 1 . . . . . . . . 6367 1 87 . 1 1 8 8 ARG HB3 H 1 2.11 0.01 . 1 . . . . . . . . 6367 1 88 . 1 1 8 8 ARG CG C 13 26.6 0.03 . 1 . . . . . . . . 6367 1 89 . 1 1 8 8 ARG HG2 H 1 1.84 0.01 . 1 . . . . . . . . 6367 1 90 . 1 1 8 8 ARG HG3 H 1 1.56 0.01 . 1 . . . . . . . . 6367 1 91 . 1 1 8 8 ARG CD C 13 42.6 0.03 . 1 . . . . . . . . 6367 1 92 . 1 1 8 8 ARG HD2 H 1 3.24 0.01 . 2 . . . . . . . . 6367 1 93 . 1 1 8 8 ARG HD3 H 1 3.13 0.01 . 2 . . . . . . . . 6367 1 94 . 1 1 8 8 ARG C C 13 178.3 0.03 . 1 . . . . . . . . 6367 1 95 . 1 1 9 9 ASP N N 15 118.0 0.03 . 1 . . . . . . . . 6367 1 96 . 1 1 9 9 ASP H H 1 8.98 0.01 . 1 . . . . . . . . 6367 1 97 . 1 1 9 9 ASP CA C 13 56.9 0.03 . 1 . . . . . . . . 6367 1 98 . 1 1 9 9 ASP HA H 1 4.34 0.01 . 1 . . . . . . . . 6367 1 99 . 1 1 9 9 ASP CB C 13 39.5 0.03 . 1 . . . . . . . . 6367 1 100 . 1 1 9 9 ASP HB2 H 1 2.58 0.01 . 1 . . . . . . . . 6367 1 101 . 1 1 9 9 ASP HB3 H 1 2.70 0.01 . 1 . . . . . . . . 6367 1 102 . 1 1 9 9 ASP C C 13 178.9 0.03 . 1 . . . . . . . . 6367 1 103 . 1 1 10 10 LEU N N 15 122.6 0.03 . 1 . . . . . . . . 6367 1 104 . 1 1 10 10 LEU H H 1 7.68 0.01 . 1 . . . . . . . . 6367 1 105 . 1 1 10 10 LEU CA C 13 57.8 0.03 . 1 . . . . . . . . 6367 1 106 . 1 1 10 10 LEU HA H 1 4.27 0.01 . 1 . . . . . . . . 6367 1 107 . 1 1 10 10 LEU CB C 13 41.7 0.03 . 1 . . . . . . . . 6367 1 108 . 1 1 10 10 LEU HB2 H 1 1.65 0.01 . 1 . . . . . . . . 6367 1 109 . 1 1 10 10 LEU HB3 H 1 1.99 0.01 . 1 . . . . . . . . 6367 1 110 . 1 1 10 10 LEU CG C 13 26.5 0.03 . 1 . . . . . . . . 6367 1 111 . 1 1 10 10 LEU HG H 1 1.76 0.01 . 1 . . . . . . . . 6367 1 112 . 1 1 10 10 LEU HD11 H 1 0.87 0.01 . 1 . . . . . . . . 6367 1 113 . 1 1 10 10 LEU HD12 H 1 0.87 0.01 . 1 . . . . . . . . 6367 1 114 . 1 1 10 10 LEU HD13 H 1 0.87 0.01 . 1 . . . . . . . . 6367 1 115 . 1 1 10 10 LEU HD21 H 1 0.97 0.01 . 1 . . . . . . . . 6367 1 116 . 1 1 10 10 LEU HD22 H 1 0.97 0.01 . 1 . . . . . . . . 6367 1 117 . 1 1 10 10 LEU HD23 H 1 0.97 0.01 . 1 . . . . . . . . 6367 1 118 . 1 1 10 10 LEU CD1 C 13 27.4 0.03 . 1 . . . . . . . . 6367 1 119 . 1 1 10 10 LEU CD2 C 13 23.8 0.03 . 1 . . . . . . . . 6367 1 120 . 1 1 10 10 LEU C C 13 178.5 0.03 . 1 . . . . . . . . 6367 1 121 . 1 1 11 11 LEU N N 15 117.4 0.03 . 1 . . . . . . . . 6367 1 122 . 1 1 11 11 LEU H H 1 7.82 0.01 . 1 . . . . . . . . 6367 1 123 . 1 1 11 11 LEU CA C 13 57.3 0.03 . 1 . . . . . . . . 6367 1 124 . 1 1 11 11 LEU HA H 1 4.11 0.01 . 1 . . . . . . . . 6367 1 125 . 1 1 11 11 LEU CB C 13 41.7 0.03 . 1 . . . . . . . . 6367 1 126 . 1 1 11 11 LEU HB2 H 1 1.31 0.01 . 1 . . . . . . . . 6367 1 127 . 1 1 11 11 LEU HB3 H 1 2.00 0.01 . 1 . . . . . . . . 6367 1 128 . 1 1 11 11 LEU CG C 13 26.5 0.03 . 1 . . . . . . . . 6367 1 129 . 1 1 11 11 LEU HG H 1 1.78 0.01 . 1 . . . . . . . . 6367 1 130 . 1 1 11 11 LEU HD11 H 1 0.85 0.01 . 2 . . . . . . . . 6367 1 131 . 1 1 11 11 LEU HD12 H 1 0.85 0.01 . 2 . . . . . . . . 6367 1 132 . 1 1 11 11 LEU HD13 H 1 0.85 0.01 . 2 . . . . . . . . 6367 1 133 . 1 1 11 11 LEU HD21 H 1 0.62 0.01 . 2 . . . . . . . . 6367 1 134 . 1 1 11 11 LEU HD22 H 1 0.62 0.01 . 2 . . . . . . . . 6367 1 135 . 1 1 11 11 LEU HD23 H 1 0.62 0.01 . 2 . . . . . . . . 6367 1 136 . 1 1 11 11 LEU CD1 C 13 22.9 0.03 . 2 . . . . . . . . 6367 1 137 . 1 1 11 11 LEU CD2 C 13 25.3 0.03 . 2 . . . . . . . . 6367 1 138 . 1 1 11 11 LEU C C 13 180.7 0.03 . 1 . . . . . . . . 6367 1 139 . 1 1 12 12 ALA N N 15 121.8 0.03 . 1 . . . . . . . . 6367 1 140 . 1 1 12 12 ALA H H 1 8.44 0.01 . 1 . . . . . . . . 6367 1 141 . 1 1 12 12 ALA CA C 13 54.7 0.03 . 1 . . . . . . . . 6367 1 142 . 1 1 12 12 ALA HA H 1 4.04 0.01 . 1 . . . . . . . . 6367 1 143 . 1 1 12 12 ALA HB1 H 1 1.51 0.01 . 1 . . . . . . . . 6367 1 144 . 1 1 12 12 ALA HB2 H 1 1.51 0.01 . 1 . . . . . . . . 6367 1 145 . 1 1 12 12 ALA HB3 H 1 1.51 0.01 . 1 . . . . . . . . 6367 1 146 . 1 1 12 12 ALA CB C 13 18.1 0.03 . 1 . . . . . . . . 6367 1 147 . 1 1 12 12 ALA C C 13 179.5 0.03 . 1 . . . . . . . . 6367 1 148 . 1 1 13 13 LEU N N 15 117.4 0.03 . 1 . . . . . . . . 6367 1 149 . 1 1 13 13 LEU H H 1 7.66 0.01 . 1 . . . . . . . . 6367 1 150 . 1 1 13 13 LEU CA C 13 56.9 0.03 . 1 . . . . . . . . 6367 1 151 . 1 1 13 13 LEU HA H 1 4.25 0.01 . 1 . . . . . . . . 6367 1 152 . 1 1 13 13 LEU CB C 13 43.1 0.03 . 1 . . . . . . . . 6367 1 153 . 1 1 13 13 LEU HB2 H 1 1.84 0.01 . 1 . . . . . . . . 6367 1 154 . 1 1 13 13 LEU HB3 H 1 1.82 0.01 . 1 . . . . . . . . 6367 1 155 . 1 1 13 13 LEU CG C 13 27.0 0.03 . 1 . . . . . . . . 6367 1 156 . 1 1 13 13 LEU HG H 1 1.61 0.01 . 1 . . . . . . . . 6367 1 157 . 1 1 13 13 LEU HD11 H 1 0.93 0.01 . 2 . . . . . . . . 6367 1 158 . 1 1 13 13 LEU HD12 H 1 0.93 0.01 . 2 . . . . . . . . 6367 1 159 . 1 1 13 13 LEU HD13 H 1 0.93 0.01 . 2 . . . . . . . . 6367 1 160 . 1 1 13 13 LEU HD21 H 1 0.91 0.01 . 2 . . . . . . . . 6367 1 161 . 1 1 13 13 LEU HD22 H 1 0.91 0.01 . 2 . . . . . . . . 6367 1 162 . 1 1 13 13 LEU HD23 H 1 0.91 0.01 . 2 . . . . . . . . 6367 1 163 . 1 1 13 13 LEU CD1 C 13 23.9 0.03 . 2 . . . . . . . . 6367 1 164 . 1 1 13 13 LEU CD2 C 13 24.7 0.03 . 2 . . . . . . . . 6367 1 165 . 1 1 13 13 LEU C C 13 179.2 0.03 . 1 . . . . . . . . 6367 1 166 . 1 1 14 14 ARG N N 15 114.7 0.03 . 1 . . . . . . . . 6367 1 167 . 1 1 14 14 ARG H H 1 8.45 0.01 . 1 . . . . . . . . 6367 1 168 . 1 1 14 14 ARG CA C 13 55.5 0.03 . 1 . . . . . . . . 6367 1 169 . 1 1 14 14 ARG HA H 1 4.36 0.01 . 1 . . . . . . . . 6367 1 170 . 1 1 14 14 ARG CB C 13 31.0 0.03 . 1 . . . . . . . . 6367 1 171 . 1 1 14 14 ARG HB2 H 1 1.90 0.01 . 1 . . . . . . . . 6367 1 172 . 1 1 14 14 ARG HB3 H 1 1.94 0.01 . 1 . . . . . . . . 6367 1 173 . 1 1 14 14 ARG CG C 13 27.3 0.03 . 1 . . . . . . . . 6367 1 174 . 1 1 14 14 ARG HG2 H 1 1.87 0.01 . 2 . . . . . . . . 6367 1 175 . 1 1 14 14 ARG HG3 H 1 1.63 0.01 . 2 . . . . . . . . 6367 1 176 . 1 1 14 14 ARG CD C 13 42.2 0.03 . 1 . . . . . . . . 6367 1 177 . 1 1 14 14 ARG HD2 H 1 3.27 0.01 . 1 . . . . . . . . 6367 1 178 . 1 1 14 14 ARG HD3 H 1 3.23 0.01 . 1 . . . . . . . . 6367 1 179 . 1 1 14 14 ARG C C 13 178.1 0.03 . 1 . . . . . . . . 6367 1 180 . 1 1 15 15 GLY N N 15 111.3 0.03 . 1 . . . . . . . . 6367 1 181 . 1 1 15 15 GLY H H 1 8.25 0.01 . 1 . . . . . . . . 6367 1 182 . 1 1 15 15 GLY CA C 13 45.3 0.03 . 1 . . . . . . . . 6367 1 183 . 1 1 15 15 GLY HA2 H 1 4.32 0.01 . 2 . . . . . . . . 6367 1 184 . 1 1 15 15 GLY HA3 H 1 3.65 0.01 . 2 . . . . . . . . 6367 1 185 . 1 1 15 15 GLY C C 13 172.8 0.03 . 1 . . . . . . . . 6367 1 186 . 1 1 16 16 ARG N N 15 117.9 0.03 . 1 . . . . . . . . 6367 1 187 . 1 1 16 16 ARG H H 1 7.80 0.01 . 1 . . . . . . . . 6367 1 188 . 1 1 16 16 ARG CA C 13 55.2 0.03 . 1 . . . . . . . . 6367 1 189 . 1 1 16 16 ARG HA H 1 5.27 0.01 . 1 . . . . . . . . 6367 1 190 . 1 1 16 16 ARG CB C 13 31.9 0.03 . 1 . . . . . . . . 6367 1 191 . 1 1 16 16 ARG HB2 H 1 1.68 0.01 . 2 . . . . . . . . 6367 1 192 . 1 1 16 16 ARG HB3 H 1 1.59 0.01 . 2 . . . . . . . . 6367 1 193 . 1 1 16 16 ARG CG C 13 26.1 0.03 . 1 . . . . . . . . 6367 1 194 . 1 1 16 16 ARG HG2 H 1 1.49 0.01 . 2 . . . . . . . . 6367 1 195 . 1 1 16 16 ARG HG3 H 1 1.37 0.01 . 2 . . . . . . . . 6367 1 196 . 1 1 16 16 ARG CD C 13 43.5 0.03 . 1 . . . . . . . . 6367 1 197 . 1 1 16 16 ARG HD2 H 1 2.38 0.01 . 2 . . . . . . . . 6367 1 198 . 1 1 16 16 ARG HD3 H 1 2.53 0.01 . 2 . . . . . . . . 6367 1 199 . 1 1 16 16 ARG C C 13 176.9 0.03 . 1 . . . . . . . . 6367 1 200 . 1 1 17 17 MET N N 15 119.5 0.03 . 1 . . . . . . . . 6367 1 201 . 1 1 17 17 MET H H 1 9.15 0.01 . 1 . . . . . . . . 6367 1 202 . 1 1 17 17 MET CA C 13 55.6 0.03 . 1 . . . . . . . . 6367 1 203 . 1 1 17 17 MET HA H 1 5.13 0.01 . 1 . . . . . . . . 6367 1 204 . 1 1 17 17 MET CB C 13 39.5 0.03 . 1 . . . . . . . . 6367 1 205 . 1 1 17 17 MET HB2 H 1 1.72 0.01 . 2 . . . . . . . . 6367 1 206 . 1 1 17 17 MET HB3 H 1 2.26 0.01 . 2 . . . . . . . . 6367 1 207 . 1 1 17 17 MET CG C 13 32.8 0.03 . 1 . . . . . . . . 6367 1 208 . 1 1 17 17 MET HG2 H 1 2.53 0.01 . 2 . . . . . . . . 6367 1 209 . 1 1 17 17 MET HG3 H 1 2.66 0.01 . 2 . . . . . . . . 6367 1 210 . 1 1 17 17 MET C C 13 175.5 0.03 . 1 . . . . . . . . 6367 1 211 . 1 1 18 18 GLU N N 15 121.6 0.03 . 1 . . . . . . . . 6367 1 212 . 1 1 18 18 GLU H H 1 9.02 0.01 . 1 . . . . . . . . 6367 1 213 . 1 1 18 18 GLU CA C 13 56.0 0.03 . 1 . . . . . . . . 6367 1 214 . 1 1 18 18 GLU HA H 1 4.79 0.01 . 1 . . . . . . . . 6367 1 215 . 1 1 18 18 GLU CB C 13 31.5 0.03 . 1 . . . . . . . . 6367 1 216 . 1 1 18 18 GLU HB2 H 1 1.71 0.01 . 2 . . . . . . . . 6367 1 217 . 1 1 18 18 GLU HB3 H 1 2.25 0.01 . 2 . . . . . . . . 6367 1 218 . 1 1 18 18 GLU CG C 13 36.9 0.03 . 1 . . . . . . . . 6367 1 219 . 1 1 18 18 GLU HG2 H 1 1.71 0.01 . 2 . . . . . . . . 6367 1 220 . 1 1 18 18 GLU HG3 H 1 1.64 0.01 . 2 . . . . . . . . 6367 1 221 . 1 1 18 18 GLU C C 13 178.4 0.03 . 1 . . . . . . . . 6367 1 222 . 1 1 19 19 ALA N N 15 127.3 0.03 . 1 . . . . . . . . 6367 1 223 . 1 1 19 19 ALA H H 1 10.00 0.01 . 1 . . . . . . . . 6367 1 224 . 1 1 19 19 ALA CA C 13 56.0 0.03 . 1 . . . . . . . . 6367 1 225 . 1 1 19 19 ALA HA H 1 3.78 0.01 . 1 . . . . . . . . 6367 1 226 . 1 1 19 19 ALA HB1 H 1 1.43 0.01 . 1 . . . . . . . . 6367 1 227 . 1 1 19 19 ALA HB2 H 1 1.43 0.01 . 1 . . . . . . . . 6367 1 228 . 1 1 19 19 ALA HB3 H 1 1.43 0.01 . 1 . . . . . . . . 6367 1 229 . 1 1 19 19 ALA CB C 13 18.0 0.03 . 1 . . . . . . . . 6367 1 230 . 1 1 19 19 ALA C C 13 180.5 0.03 . 1 . . . . . . . . 6367 1 231 . 1 1 20 20 ALA N N 15 119.9 0.03 . 1 . . . . . . . . 6367 1 232 . 1 1 20 20 ALA H H 1 9.19 0.01 . 1 . . . . . . . . 6367 1 233 . 1 1 20 20 ALA CA C 13 54.7 0.03 . 1 . . . . . . . . 6367 1 234 . 1 1 20 20 ALA HA H 1 4.37 0.01 . 1 . . . . . . . . 6367 1 235 . 1 1 20 20 ALA HB1 H 1 1.43 0.01 . 1 . . . . . . . . 6367 1 236 . 1 1 20 20 ALA HB2 H 1 1.43 0.01 . 1 . . . . . . . . 6367 1 237 . 1 1 20 20 ALA HB3 H 1 1.43 0.01 . 1 . . . . . . . . 6367 1 238 . 1 1 20 20 ALA CB C 13 18.0 0.03 . 1 . . . . . . . . 6367 1 239 . 1 1 20 20 ALA C C 13 180.5 0.03 . 1 . . . . . . . . 6367 1 240 . 1 1 21 21 GLN N N 15 115.9 0.03 . 1 . . . . . . . . 6367 1 241 . 1 1 21 21 GLN H H 1 7.08 0.01 . 1 . . . . . . . . 6367 1 242 . 1 1 21 21 GLN CA C 13 57.8 0.03 . 1 . . . . . . . . 6367 1 243 . 1 1 21 21 GLN HA H 1 4.25 0.01 . 1 . . . . . . . . 6367 1 244 . 1 1 21 21 GLN CB C 13 29.2 0.03 . 1 . . . . . . . . 6367 1 245 . 1 1 21 21 GLN HB2 H 1 2.24 0.01 . 1 . . . . . . . . 6367 1 246 . 1 1 21 21 GLN HB3 H 1 2.43 0.01 . 1 . . . . . . . . 6367 1 247 . 1 1 21 21 GLN CG C 13 34.1 0.03 . 1 . . . . . . . . 6367 1 248 . 1 1 21 21 GLN HG2 H 1 2.47 0.01 . 2 . . . . . . . . 6367 1 249 . 1 1 21 21 GLN HG3 H 1 2.49 0.01 . 2 . . . . . . . . 6367 1 250 . 1 1 21 21 GLN NE2 N 15 112.8 0.03 . 1 . . . . . . . . 6367 1 251 . 1 1 21 21 GLN HE21 H 1 7.68 0.01 . 2 . . . . . . . . 6367 1 252 . 1 1 21 21 GLN HE22 H 1 7.00 0.01 . 2 . . . . . . . . 6367 1 253 . 1 1 21 21 GLN C C 13 179.5 0.03 . 1 . . . . . . . . 6367 1 254 . 1 1 22 22 ILE N N 15 122.5 0.03 . 1 . . . . . . . . 6367 1 255 . 1 1 22 22 ILE H H 1 7.94 0.01 . 1 . . . . . . . . 6367 1 256 . 1 1 22 22 ILE CA C 13 65.9 0.03 . 1 . . . . . . . . 6367 1 257 . 1 1 22 22 ILE HA H 1 3.40 0.01 . 1 . . . . . . . . 6367 1 258 . 1 1 22 22 ILE CB C 13 37.7 0.03 . 1 . . . . . . . . 6367 1 259 . 1 1 22 22 ILE HB H 1 1.92 0.01 . 1 . . . . . . . . 6367 1 260 . 1 1 22 22 ILE HG21 H 1 0.78 0.01 . 1 . . . . . . . . 6367 1 261 . 1 1 22 22 ILE HG22 H 1 0.78 0.01 . 1 . . . . . . . . 6367 1 262 . 1 1 22 22 ILE HG23 H 1 0.78 0.01 . 1 . . . . . . . . 6367 1 263 . 1 1 22 22 ILE CG2 C 13 18.5 0.03 . 1 . . . . . . . . 6367 1 264 . 1 1 22 22 ILE CG1 C 13 28.8 0.03 . 1 . . . . . . . . 6367 1 265 . 1 1 22 22 ILE HG12 H 1 1.02 0.01 . 2 . . . . . . . . 6367 1 266 . 1 1 22 22 ILE HG13 H 1 1.00 0.01 . 2 . . . . . . . . 6367 1 267 . 1 1 22 22 ILE HD11 H 1 0.71 0.01 . 1 . . . . . . . . 6367 1 268 . 1 1 22 22 ILE HD12 H 1 0.71 0.01 . 1 . . . . . . . . 6367 1 269 . 1 1 22 22 ILE HD13 H 1 0.71 0.01 . 1 . . . . . . . . 6367 1 270 . 1 1 22 22 ILE CD1 C 13 14.4 0.03 . 1 . . . . . . . . 6367 1 271 . 1 1 22 22 ILE C C 13 177.0 0.03 . 1 . . . . . . . . 6367 1 272 . 1 1 23 23 SER N N 15 112.3 0.03 . 1 . . . . . . . . 6367 1 273 . 1 1 23 23 SER H H 1 7.85 0.01 . 1 . . . . . . . . 6367 1 274 . 1 1 23 23 SER CA C 13 61.4 0.03 . 1 . . . . . . . . 6367 1 275 . 1 1 23 23 SER HA H 1 4.04 0.01 . 1 . . . . . . . . 6367 1 276 . 1 1 23 23 SER CB C 13 63.2 0.03 . 1 . . . . . . . . 6367 1 277 . 1 1 23 23 SER HB2 H 1 4.00 0.01 . 1 . . . . . . . . 6367 1 278 . 1 1 23 23 SER HB3 H 1 3.83 0.01 . 1 . . . . . . . . 6367 1 279 . 1 1 23 23 SER C C 13 176.6 0.03 . 1 . . . . . . . . 6367 1 280 . 1 1 24 24 GLN N N 15 117.9 0.03 . 1 . . . . . . . . 6367 1 281 . 1 1 24 24 GLN H H 1 7.76 0.01 . 1 . . . . . . . . 6367 1 282 . 1 1 24 24 GLN CA C 13 58.9 0.03 . 1 . . . . . . . . 6367 1 283 . 1 1 24 24 GLN HA H 1 4.13 0.01 . 1 . . . . . . . . 6367 1 284 . 1 1 24 24 GLN CB C 13 28.7 0.03 . 1 . . . . . . . . 6367 1 285 . 1 1 24 24 GLN HB2 H 1 2.19 0.01 . 1 . . . . . . . . 6367 1 286 . 1 1 24 24 GLN HB3 H 1 2.18 0.01 . 1 . . . . . . . . 6367 1 287 . 1 1 24 24 GLN CG C 13 33.7 0.03 . 1 . . . . . . . . 6367 1 288 . 1 1 24 24 GLN HG2 H 1 2.42 0.01 . 2 . . . . . . . . 6367 1 289 . 1 1 24 24 GLN HG3 H 1 2.54 0.01 . 2 . . . . . . . . 6367 1 290 . 1 1 24 24 GLN C C 13 179.4 0.03 . 1 . . . . . . . . 6367 1 291 . 1 1 25 25 THR N N 15 116.3 0.03 . 1 . . . . . . . . 6367 1 292 . 1 1 25 25 THR H H 1 8.29 0.01 . 1 . . . . . . . . 6367 1 293 . 1 1 25 25 THR CA C 13 66.8 0.03 . 1 . . . . . . . . 6367 1 294 . 1 1 25 25 THR HA H 1 3.95 0.01 . 1 . . . . . . . . 6367 1 295 . 1 1 25 25 THR CB C 13 68.6 0.03 . 1 . . . . . . . . 6367 1 296 . 1 1 25 25 THR HB H 1 4.08 0.01 . 1 . . . . . . . . 6367 1 297 . 1 1 25 25 THR HG21 H 1 1.26 0.01 . 1 . . . . . . . . 6367 1 298 . 1 1 25 25 THR HG22 H 1 1.26 0.01 . 1 . . . . . . . . 6367 1 299 . 1 1 25 25 THR HG23 H 1 1.26 0.01 . 1 . . . . . . . . 6367 1 300 . 1 1 25 25 THR CG2 C 13 22.0 0.03 . 1 . . . . . . . . 6367 1 301 . 1 1 25 25 THR C C 13 175.6 0.03 . 1 . . . . . . . . 6367 1 302 . 1 1 26 26 LEU N N 15 114.9 0.03 . 1 . . . . . . . . 6367 1 303 . 1 1 26 26 LEU H H 1 7.88 0.01 . 1 . . . . . . . . 6367 1 304 . 1 1 26 26 LEU CA C 13 53.6 0.03 . 1 . . . . . . . . 6367 1 305 . 1 1 26 26 LEU HA H 1 4.47 0.01 . 1 . . . . . . . . 6367 1 306 . 1 1 26 26 LEU CB C 13 40.3 0.03 . 1 . . . . . . . . 6367 1 307 . 1 1 26 26 LEU HB2 H 1 1.49 0.01 . 2 . . . . . . . . 6367 1 308 . 1 1 26 26 LEU HB3 H 1 1.62 0.01 . 2 . . . . . . . . 6367 1 309 . 1 1 26 26 LEU CG C 13 26.1 0.03 . 1 . . . . . . . . 6367 1 310 . 1 1 26 26 LEU HG H 1 1.64 0.01 . 1 . . . . . . . . 6367 1 311 . 1 1 26 26 LEU HD11 H 1 0.61 0.01 . 1 . . . . . . . . 6367 1 312 . 1 1 26 26 LEU HD12 H 1 0.61 0.01 . 1 . . . . . . . . 6367 1 313 . 1 1 26 26 LEU HD13 H 1 0.61 0.01 . 1 . . . . . . . . 6367 1 314 . 1 1 26 26 LEU HD21 H 1 0.78 0.01 . 1 . . . . . . . . 6367 1 315 . 1 1 26 26 LEU HD22 H 1 0.78 0.01 . 1 . . . . . . . . 6367 1 316 . 1 1 26 26 LEU HD23 H 1 0.78 0.01 . 1 . . . . . . . . 6367 1 317 . 1 1 26 26 LEU CD1 C 13 26.5 0.03 . 1 . . . . . . . . 6367 1 318 . 1 1 26 26 LEU CD2 C 13 21.6 0.03 . 1 . . . . . . . . 6367 1 319 . 1 1 26 26 LEU C C 13 176.8 0.03 . 1 . . . . . . . . 6367 1 320 . 1 1 27 27 ASN N N 15 122.4 0.03 . 1 . . . . . . . . 6367 1 321 . 1 1 27 27 ASN H H 1 7.87 0.01 . 1 . . . . . . . . 6367 1 322 . 1 1 27 27 ASN CA C 13 53.8 0.03 . 1 . . . . . . . . 6367 1 323 . 1 1 27 27 ASN HA H 1 4.42 0.01 . 1 . . . . . . . . 6367 1 324 . 1 1 27 27 ASN CB C 13 37.3 0.03 . 1 . . . . . . . . 6367 1 325 . 1 1 27 27 ASN HB2 H 1 3.07 0.01 . 1 . . . . . . . . 6367 1 326 . 1 1 27 27 ASN HB3 H 1 2.60 0.01 . 1 . . . . . . . . 6367 1 327 . 1 1 27 27 ASN ND2 N 15 111.7 0.03 . 1 . . . . . . . . 6367 1 328 . 1 1 27 27 ASN HD21 H 1 7.53 0.01 . 2 . . . . . . . . 6367 1 329 . 1 1 27 27 ASN HD22 H 1 6.77 0.01 . 2 . . . . . . . . 6367 1 330 . 1 1 27 27 ASN C C 13 173.9 0.03 . 1 . . . . . . . . 6367 1 331 . 1 1 28 28 THR N N 15 113.6 0.03 . 1 . . . . . . . . 6367 1 332 . 1 1 28 28 THR H H 1 8.02 0.01 . 1 . . . . . . . . 6367 1 333 . 1 1 28 28 THR CA C 13 59.9 0.03 . 1 . . . . . . . . 6367 1 334 . 1 1 28 28 THR HA H 1 4.77 0.01 . 1 . . . . . . . . 6367 1 335 . 1 1 28 28 THR CB C 13 73.9 0.03 . 1 . . . . . . . . 6367 1 336 . 1 1 28 28 THR HB H 1 3.37 0.01 . 1 . . . . . . . . 6367 1 337 . 1 1 28 28 THR HG21 H 1 1.24 0.01 . 1 . . . . . . . . 6367 1 338 . 1 1 28 28 THR HG22 H 1 1.24 0.01 . 1 . . . . . . . . 6367 1 339 . 1 1 28 28 THR HG23 H 1 1.24 0.01 . 1 . . . . . . . . 6367 1 340 . 1 1 28 28 THR CG2 C 13 19.8 0.03 . 1 . . . . . . . . 6367 1 341 . 1 1 29 29 PRO CD C 13 50.2 0.03 . 1 . . . . . . . . 6367 1 342 . 1 1 29 29 PRO CA C 13 63.2 0.03 . 1 . . . . . . . . 6367 1 343 . 1 1 29 29 PRO HA H 1 4.27 0.01 . 1 . . . . . . . . 6367 1 344 . 1 1 29 29 PRO CB C 13 33.6 0.03 . 1 . . . . . . . . 6367 1 345 . 1 1 29 29 PRO HB2 H 1 1.92 0.01 . 2 . . . . . . . . 6367 1 346 . 1 1 29 29 PRO HB3 H 1 2.50 0.01 . 2 . . . . . . . . 6367 1 347 . 1 1 29 29 PRO CG C 13 29.1 0.03 . 1 . . . . . . . . 6367 1 348 . 1 1 29 29 PRO HG2 H 1 2.17 0.01 . 1 . . . . . . . . 6367 1 349 . 1 1 29 29 PRO HG3 H 1 2.17 0.01 . 1 . . . . . . . . 6367 1 350 . 1 1 29 29 PRO HD2 H 1 3.49 0.01 . 2 . . . . . . . . 6367 1 351 . 1 1 29 29 PRO HD3 H 1 3.50 0.01 . 2 . . . . . . . . 6367 1 352 . 1 1 29 29 PRO C C 13 177.1 0.03 . 1 . . . . . . . . 6367 1 353 . 1 1 30 30 GLN N N 15 125.1 0.03 . 1 . . . . . . . . 6367 1 354 . 1 1 30 30 GLN H H 1 9.24 0.01 . 1 . . . . . . . . 6367 1 355 . 1 1 30 30 GLN CA C 13 60.5 0.03 . 1 . . . . . . . . 6367 1 356 . 1 1 30 30 GLN HA H 1 3.87 0.01 . 1 . . . . . . . . 6367 1 357 . 1 1 30 30 GLN CB C 13 26.5 0.03 . 1 . . . . . . . . 6367 1 358 . 1 1 30 30 GLN HB2 H 1 2.19 0.01 . 2 . . . . . . . . 6367 1 359 . 1 1 30 30 GLN HB3 H 1 2.15 0.01 . 2 . . . . . . . . 6367 1 360 . 1 1 30 30 GLN CG C 13 33.7 0.03 . 1 . . . . . . . . 6367 1 361 . 1 1 30 30 GLN HG2 H 1 2.22 0.01 . 1 . . . . . . . . 6367 1 362 . 1 1 30 30 GLN HG3 H 1 2.38 0.01 . 1 . . . . . . . . 6367 1 363 . 1 1 30 30 GLN NE2 N 15 110.7 0.03 . 1 . . . . . . . . 6367 1 364 . 1 1 30 30 GLN HE21 H 1 7.38 0.01 . 2 . . . . . . . . 6367 1 365 . 1 1 30 30 GLN HE22 H 1 6.43 0.01 . 2 . . . . . . . . 6367 1 366 . 1 1 31 31 PRO CD C 13 50.2 0.03 . 1 . . . . . . . . 6367 1 367 . 1 1 31 31 PRO CA C 13 66.3 0.03 . 1 . . . . . . . . 6367 1 368 . 1 1 31 31 PRO HA H 1 4.33 0.01 . 1 . . . . . . . . 6367 1 369 . 1 1 31 31 PRO CB C 13 30.6 0.03 . 1 . . . . . . . . 6367 1 370 . 1 1 31 31 PRO HB2 H 1 1.82 0.01 . 2 . . . . . . . . 6367 1 371 . 1 1 31 31 PRO HB3 H 1 2.38 0.01 . 2 . . . . . . . . 6367 1 372 . 1 1 31 31 PRO CG C 13 28.8 0.03 . 1 . . . . . . . . 6367 1 373 . 1 1 31 31 PRO HG2 H 1 2.12 0.01 . 2 . . . . . . . . 6367 1 374 . 1 1 31 31 PRO HG3 H 1 1.98 0.01 . 2 . . . . . . . . 6367 1 375 . 1 1 31 31 PRO HD2 H 1 3.50 0.01 . 1 . . . . . . . . 6367 1 376 . 1 1 31 31 PRO HD3 H 1 3.81 0.01 . 1 . . . . . . . . 6367 1 377 . 1 1 31 31 PRO C C 13 179.9 0.03 . 1 . . . . . . . . 6367 1 378 . 1 1 32 32 MET N N 15 115.4 0.03 . 1 . . . . . . . . 6367 1 379 . 1 1 32 32 MET H H 1 6.96 0.01 . 1 . . . . . . . . 6367 1 380 . 1 1 32 32 MET CA C 13 57.8 0.03 . 1 . . . . . . . . 6367 1 381 . 1 1 32 32 MET HA H 1 4.28 0.01 . 1 . . . . . . . . 6367 1 382 . 1 1 32 32 MET CB C 13 32.4 0.03 . 1 . . . . . . . . 6367 1 383 . 1 1 32 32 MET HB2 H 1 2.02 0.01 . 2 . . . . . . . . 6367 1 384 . 1 1 32 32 MET HB3 H 1 2.10 0.01 . 2 . . . . . . . . 6367 1 385 . 1 1 32 32 MET CG C 13 32.4 0.03 . 1 . . . . . . . . 6367 1 386 . 1 1 32 32 MET HG2 H 1 2.57 0.01 . 2 . . . . . . . . 6367 1 387 . 1 1 32 32 MET HG3 H 1 2.59 0.01 . 2 . . . . . . . . 6367 1 388 . 1 1 32 32 MET C C 13 178.5 0.03 . 1 . . . . . . . . 6367 1 389 . 1 1 33 33 ILE N N 15 119.8 0.03 . 1 . . . . . . . . 6367 1 390 . 1 1 33 33 ILE H H 1 7.41 0.01 . 1 . . . . . . . . 6367 1 391 . 1 1 33 33 ILE CA C 13 60.9 0.03 . 1 . . . . . . . . 6367 1 392 . 1 1 33 33 ILE HA H 1 3.61 0.01 . 1 . . . . . . . . 6367 1 393 . 1 1 33 33 ILE CB C 13 34.7 0.03 . 1 . . . . . . . . 6367 1 394 . 1 1 33 33 ILE HB H 1 2.16 0.01 . 1 . . . . . . . . 6367 1 395 . 1 1 33 33 ILE HG21 H 1 0.69 0.01 . 1 . . . . . . . . 6367 1 396 . 1 1 33 33 ILE HG22 H 1 0.69 0.01 . 1 . . . . . . . . 6367 1 397 . 1 1 33 33 ILE HG23 H 1 0.69 0.01 . 1 . . . . . . . . 6367 1 398 . 1 1 33 33 ILE CG2 C 13 17.6 0.03 . 1 . . . . . . . . 6367 1 399 . 1 1 33 33 ILE CG1 C 13 26.2 0.03 . 1 . . . . . . . . 6367 1 400 . 1 1 33 33 ILE HG12 H 1 1.50 0.01 . 1 . . . . . . . . 6367 1 401 . 1 1 33 33 ILE HG13 H 1 0.88 0.01 . 1 . . . . . . . . 6367 1 402 . 1 1 33 33 ILE HD11 H 1 0.48 0.01 . 1 . . . . . . . . 6367 1 403 . 1 1 33 33 ILE HD12 H 1 0.48 0.01 . 1 . . . . . . . . 6367 1 404 . 1 1 33 33 ILE HD13 H 1 0.48 0.01 . 1 . . . . . . . . 6367 1 405 . 1 1 33 33 ILE CD1 C 13 8.6 0.03 . 1 . . . . . . . . 6367 1 406 . 1 1 33 33 ILE C C 13 177.6 0.03 . 1 . . . . . . . . 6367 1 407 . 1 1 34 34 ASN N N 15 118.8 0.03 . 1 . . . . . . . . 6367 1 408 . 1 1 34 34 ASN H H 1 8.98 0.01 . 1 . . . . . . . . 6367 1 409 . 1 1 34 34 ASN CA C 13 56.1 0.03 . 1 . . . . . . . . 6367 1 410 . 1 1 34 34 ASN HA H 1 4.12 0.01 . 1 . . . . . . . . 6367 1 411 . 1 1 34 34 ASN CB C 13 37.3 0.03 . 1 . . . . . . . . 6367 1 412 . 1 1 34 34 ASN HB2 H 1 2.79 0.01 . 2 . . . . . . . . 6367 1 413 . 1 1 34 34 ASN HB3 H 1 2.78 0.01 . 2 . . . . . . . . 6367 1 414 . 1 1 34 34 ASN ND2 N 15 110.2 0.03 . 1 . . . . . . . . 6367 1 415 . 1 1 34 34 ASN HD21 H 1 7.59 0.01 . 1 . . . . . . . . 6367 1 416 . 1 1 34 34 ASN HD22 H 1 6.87 0.01 . 1 . . . . . . . . 6367 1 417 . 1 1 34 34 ASN C C 13 177.6 0.03 . 1 . . . . . . . . 6367 1 418 . 1 1 35 35 ALA N N 15 121.1 0.03 . 1 . . . . . . . . 6367 1 419 . 1 1 35 35 ALA H H 1 7.43 0.01 . 1 . . . . . . . . 6367 1 420 . 1 1 35 35 ALA CA C 13 55.1 0.03 . 1 . . . . . . . . 6367 1 421 . 1 1 35 35 ALA HA H 1 4.13 0.01 . 1 . . . . . . . . 6367 1 422 . 1 1 35 35 ALA HB1 H 1 1.51 0.01 . 1 . . . . . . . . 6367 1 423 . 1 1 35 35 ALA HB2 H 1 1.51 0.01 . 1 . . . . . . . . 6367 1 424 . 1 1 35 35 ALA HB3 H 1 1.51 0.01 . 1 . . . . . . . . 6367 1 425 . 1 1 35 35 ALA CB C 13 17.6 0.03 . 1 . . . . . . . . 6367 1 426 . 1 1 35 35 ALA C C 13 180.6 0.03 . 1 . . . . . . . . 6367 1 427 . 1 1 36 36 MET N N 15 119.0 0.03 . 1 . . . . . . . . 6367 1 428 . 1 1 36 36 MET H H 1 7.79 0.01 . 1 . . . . . . . . 6367 1 429 . 1 1 36 36 MET CA C 13 59.5 0.03 . 1 . . . . . . . . 6367 1 430 . 1 1 36 36 MET HA H 1 4.04 0.01 . 1 . . . . . . . . 6367 1 431 . 1 1 36 36 MET CB C 13 33.3 0.03 . 1 . . . . . . . . 6367 1 432 . 1 1 36 36 MET HB2 H 1 2.43 0.01 . 1 . . . . . . . . 6367 1 433 . 1 1 36 36 MET HB3 H 1 2.80 0.01 . 1 . . . . . . . . 6367 1 434 . 1 1 36 36 MET CG C 13 33.7 0.03 . 1 . . . . . . . . 6367 1 435 . 1 1 36 36 MET HG2 H 1 1.67 0.01 . 1 . . . . . . . . 6367 1 436 . 1 1 36 36 MET HG3 H 1 2.15 0.01 . 1 . . . . . . . . 6367 1 437 . 1 1 36 36 MET C C 13 178.1 0.03 . 1 . . . . . . . . 6367 1 438 . 1 1 37 37 LEU N N 15 120.5 0.03 . 1 . . . . . . . . 6367 1 439 . 1 1 37 37 LEU H H 1 8.40 0.01 . 1 . . . . . . . . 6367 1 440 . 1 1 37 37 LEU CA C 13 57.8 0.03 . 1 . . . . . . . . 6367 1 441 . 1 1 37 37 LEU HA H 1 3.34 0.01 . 1 . . . . . . . . 6367 1 442 . 1 1 37 37 LEU CB C 13 38.6 0.03 . 1 . . . . . . . . 6367 1 443 . 1 1 37 37 LEU HB2 H 1 0.89 0.01 . 1 . . . . . . . . 6367 1 444 . 1 1 37 37 LEU HB3 H 1 -1.02 0.01 . 1 . . . . . . . . 6367 1 445 . 1 1 37 37 LEU CG C 13 25.6 0.03 . 1 . . . . . . . . 6367 1 446 . 1 1 37 37 LEU HG H 1 1.11 0.01 . 1 . . . . . . . . 6367 1 447 . 1 1 37 37 LEU HD11 H 1 -0.04 0.01 . 1 . . . . . . . . 6367 1 448 . 1 1 37 37 LEU HD12 H 1 -0.04 0.01 . 1 . . . . . . . . 6367 1 449 . 1 1 37 37 LEU HD13 H 1 -0.04 0.01 . 1 . . . . . . . . 6367 1 450 . 1 1 37 37 LEU HD21 H 1 -0.37 0.01 . 1 . . . . . . . . 6367 1 451 . 1 1 37 37 LEU HD22 H 1 -0.37 0.01 . 1 . . . . . . . . 6367 1 452 . 1 1 37 37 LEU HD23 H 1 -0.37 0.01 . 1 . . . . . . . . 6367 1 453 . 1 1 37 37 LEU CD1 C 13 20.5 0.03 . 1 . . . . . . . . 6367 1 454 . 1 1 37 37 LEU CD2 C 13 24.3 0.03 . 1 . . . . . . . . 6367 1 455 . 1 1 37 37 LEU C C 13 178.2 0.03 . 1 . . . . . . . . 6367 1 456 . 1 1 38 38 GLN N N 15 116.9 0.03 . 1 . . . . . . . . 6367 1 457 . 1 1 38 38 GLN H H 1 7.81 0.01 . 1 . . . . . . . . 6367 1 458 . 1 1 38 38 GLN CA C 13 59.1 0.03 . 1 . . . . . . . . 6367 1 459 . 1 1 38 38 GLN HA H 1 4.13 0.01 . 1 . . . . . . . . 6367 1 460 . 1 1 38 38 GLN CB C 13 27.9 0.03 . 1 . . . . . . . . 6367 1 461 . 1 1 38 38 GLN HB2 H 1 2.19 0.01 . 2 . . . . . . . . 6367 1 462 . 1 1 38 38 GLN HB3 H 1 2.21 0.01 . 2 . . . . . . . . 6367 1 463 . 1 1 38 38 GLN CG C 13 34.6 0.03 . 1 . . . . . . . . 6367 1 464 . 1 1 38 38 GLN HG2 H 1 2.60 0.01 . 2 . . . . . . . . 6367 1 465 . 1 1 38 38 GLN HG3 H 1 2.49 0.01 . 2 . . . . . . . . 6367 1 466 . 1 1 38 38 GLN NE2 N 15 111.2 0.03 . 1 . . . . . . . . 6367 1 467 . 1 1 38 38 GLN HE21 H 1 7.47 0.01 . 2 . . . . . . . . 6367 1 468 . 1 1 38 38 GLN HE22 H 1 6.82 0.01 . 2 . . . . . . . . 6367 1 469 . 1 1 38 38 GLN C C 13 179.5 0.03 . 1 . . . . . . . . 6367 1 470 . 1 1 39 39 GLN N N 15 121.0 0.03 . 1 . . . . . . . . 6367 1 471 . 1 1 39 39 GLN H H 1 7.90 0.01 . 1 . . . . . . . . 6367 1 472 . 1 1 39 39 GLN CA C 13 59.1 0.03 . 1 . . . . . . . . 6367 1 473 . 1 1 39 39 GLN HA H 1 4.15 0.01 . 1 . . . . . . . . 6367 1 474 . 1 1 39 39 GLN CB C 13 27.9 0.03 . 1 . . . . . . . . 6367 1 475 . 1 1 39 39 GLN HB2 H 1 2.15 0.01 . 1 . . . . . . . . 6367 1 476 . 1 1 39 39 GLN HB3 H 1 2.31 0.01 . 1 . . . . . . . . 6367 1 477 . 1 1 39 39 GLN CG C 13 33.7 0.03 . 1 . . . . . . . . 6367 1 478 . 1 1 39 39 GLN HG2 H 1 2.51 0.01 . 2 . . . . . . . . 6367 1 479 . 1 1 39 39 GLN HG3 H 1 2.39 0.01 . 2 . . . . . . . . 6367 1 480 . 1 1 39 39 GLN NE2 N 15 110.2 0.03 . 1 . . . . . . . . 6367 1 481 . 1 1 39 39 GLN HE21 H 1 7.19 0.01 . 2 . . . . . . . . 6367 1 482 . 1 1 39 39 GLN HE22 H 1 6.72 0.01 . 2 . . . . . . . . 6367 1 483 . 1 1 39 39 GLN C C 13 179.2 0.03 . 1 . . . . . . . . 6367 1 484 . 1 1 40 40 LEU N N 15 119.9 0.03 . 1 . . . . . . . . 6367 1 485 . 1 1 40 40 LEU H H 1 8.37 0.01 . 1 . . . . . . . . 6367 1 486 . 1 1 40 40 LEU CA C 13 57.9 0.03 . 1 . . . . . . . . 6367 1 487 . 1 1 40 40 LEU HA H 1 4.07 0.01 . 1 . . . . . . . . 6367 1 488 . 1 1 40 40 LEU CB C 13 42.7 0.03 . 1 . . . . . . . . 6367 1 489 . 1 1 40 40 LEU HB2 H 1 2.02 0.01 . 1 . . . . . . . . 6367 1 490 . 1 1 40 40 LEU HB3 H 1 1.17 0.01 . 1 . . . . . . . . 6367 1 491 . 1 1 40 40 LEU CG C 13 26.6 0.03 . 1 . . . . . . . . 6367 1 492 . 1 1 40 40 LEU HG H 1 1.85 0.01 . 1 . . . . . . . . 6367 1 493 . 1 1 40 40 LEU HD11 H 1 0.78 0.01 . 1 . . . . . . . . 6367 1 494 . 1 1 40 40 LEU HD12 H 1 0.78 0.01 . 1 . . . . . . . . 6367 1 495 . 1 1 40 40 LEU HD13 H 1 0.78 0.01 . 1 . . . . . . . . 6367 1 496 . 1 1 40 40 LEU HD21 H 1 0.66 0.01 . 1 . . . . . . . . 6367 1 497 . 1 1 40 40 LEU HD22 H 1 0.66 0.01 . 1 . . . . . . . . 6367 1 498 . 1 1 40 40 LEU HD23 H 1 0.66 0.01 . 1 . . . . . . . . 6367 1 499 . 1 1 40 40 LEU CD1 C 13 23.3 0.03 . 1 . . . . . . . . 6367 1 500 . 1 1 40 40 LEU CD2 C 13 25.2 0.03 . 1 . . . . . . . . 6367 1 501 . 1 1 40 40 LEU C C 13 179.8 0.03 . 1 . . . . . . . . 6367 1 502 . 1 1 41 41 GLU N N 15 123.1 0.03 . 1 . . . . . . . . 6367 1 503 . 1 1 41 41 GLU H H 1 9.07 0.01 . 1 . . . . . . . . 6367 1 504 . 1 1 41 41 GLU CA C 13 59.2 0.03 . 1 . . . . . . . . 6367 1 505 . 1 1 41 41 GLU HA H 1 4.62 0.01 . 1 . . . . . . . . 6367 1 506 . 1 1 41 41 GLU CB C 13 30.6 0.03 . 1 . . . . . . . . 6367 1 507 . 1 1 41 41 GLU HB2 H 1 2.40 0.01 . 1 . . . . . . . . 6367 1 508 . 1 1 41 41 GLU HB3 H 1 2.70 0.01 . 1 . . . . . . . . 6367 1 509 . 1 1 41 41 GLU CG C 13 35.9 0.03 . 1 . . . . . . . . 6367 1 510 . 1 1 41 41 GLU HG2 H 1 2.34 0.01 . 1 . . . . . . . . 6367 1 511 . 1 1 41 41 GLU HG3 H 1 2.52 0.01 . 1 . . . . . . . . 6367 1 512 . 1 1 41 41 GLU C C 13 181.3 0.03 . 1 . . . . . . . . 6367 1 513 . 1 1 42 42 SER N N 15 118.9 0.03 . 1 . . . . . . . . 6367 1 514 . 1 1 42 42 SER H H 1 8.73 0.01 . 1 . . . . . . . . 6367 1 515 . 1 1 42 42 SER CA C 13 61.7 0.03 . 1 . . . . . . . . 6367 1 516 . 1 1 42 42 SER HA H 1 4.37 0.01 . 1 . . . . . . . . 6367 1 517 . 1 1 42 42 SER CB C 13 62.8 0.03 . 1 . . . . . . . . 6367 1 518 . 1 1 42 42 SER HB2 H 1 4.13 0.01 . 2 . . . . . . . . 6367 1 519 . 1 1 42 42 SER HB3 H 1 4.12 0.01 . 2 . . . . . . . . 6367 1 520 . 1 1 42 42 SER C C 13 176.1 0.03 . 1 . . . . . . . . 6367 1 521 . 1 1 43 43 MET N N 15 117.3 0.03 . 1 . . . . . . . . 6367 1 522 . 1 1 43 43 MET H H 1 7.87 0.01 . 1 . . . . . . . . 6367 1 523 . 1 1 43 43 MET CA C 13 56.0 0.03 . 1 . . . . . . . . 6367 1 524 . 1 1 43 43 MET HA H 1 4.47 0.01 . 1 . . . . . . . . 6367 1 525 . 1 1 43 43 MET CB C 13 35.1 0.03 . 1 . . . . . . . . 6367 1 526 . 1 1 43 43 MET HB2 H 1 2.09 0.01 . 1 . . . . . . . . 6367 1 527 . 1 1 43 43 MET HB3 H 1 2.41 0.01 . 1 . . . . . . . . 6367 1 528 . 1 1 43 43 MET CG C 13 31.9 0.03 . 1 . . . . . . . . 6367 1 529 . 1 1 43 43 MET HG2 H 1 2.69 0.01 . 1 . . . . . . . . 6367 1 530 . 1 1 43 43 MET HG3 H 1 2.82 0.01 . 1 . . . . . . . . 6367 1 531 . 1 1 43 43 MET C C 13 176.3 0.03 . 1 . . . . . . . . 6367 1 532 . 1 1 44 44 GLY N N 15 107.7 0.03 . 1 . . . . . . . . 6367 1 533 . 1 1 44 44 GLY H H 1 8.14 0.01 . 1 . . . . . . . . 6367 1 534 . 1 1 44 44 GLY CA C 13 45.8 0.03 . 1 . . . . . . . . 6367 1 535 . 1 1 44 44 GLY HA2 H 1 4.06 0.01 . 2 . . . . . . . . 6367 1 536 . 1 1 44 44 GLY HA3 H 1 4.22 0.01 . 2 . . . . . . . . 6367 1 537 . 1 1 44 44 GLY C C 13 174.6 0.03 . 1 . . . . . . . . 6367 1 538 . 1 1 45 45 LYS N N 15 114.9 0.03 . 1 . . . . . . . . 6367 1 539 . 1 1 45 45 LYS H H 1 8.20 0.01 . 1 . . . . . . . . 6367 1 540 . 1 1 45 45 LYS CA C 13 55.6 0.03 . 1 . . . . . . . . 6367 1 541 . 1 1 45 45 LYS HA H 1 4.61 0.01 . 1 . . . . . . . . 6367 1 542 . 1 1 45 45 LYS CB C 13 34.2 0.03 . 1 . . . . . . . . 6367 1 543 . 1 1 45 45 LYS HB2 H 1 1.91 0.01 . 2 . . . . . . . . 6367 1 544 . 1 1 45 45 LYS HB3 H 1 1.73 0.01 . 2 . . . . . . . . 6367 1 545 . 1 1 45 45 LYS CG C 13 25.2 0.03 . 1 . . . . . . . . 6367 1 546 . 1 1 45 45 LYS HG2 H 1 1.45 0.01 . 2 . . . . . . . . 6367 1 547 . 1 1 45 45 LYS HG3 H 1 1.38 0.01 . 2 . . . . . . . . 6367 1 548 . 1 1 45 45 LYS CD C 13 28.4 0.03 . 1 . . . . . . . . 6367 1 549 . 1 1 45 45 LYS HD2 H 1 1.64 0.01 . 2 . . . . . . . . 6367 1 550 . 1 1 45 45 LYS HD3 H 1 1.62 0.01 . 2 . . . . . . . . 6367 1 551 . 1 1 45 45 LYS CE C 13 42.2 0.03 . 1 . . . . . . . . 6367 1 552 . 1 1 45 45 LYS HE2 H 1 2.96 0.01 . 2 . . . . . . . . 6367 1 553 . 1 1 45 45 LYS HE3 H 1 3.05 0.01 . 2 . . . . . . . . 6367 1 554 . 1 1 45 45 LYS C C 13 176.1 0.03 . 1 . . . . . . . . 6367 1 555 . 1 1 46 46 ALA N N 15 119.0 0.03 . 1 . . . . . . . . 6367 1 556 . 1 1 46 46 ALA H H 1 7.24 0.01 . 1 . . . . . . . . 6367 1 557 . 1 1 46 46 ALA CA C 13 50.2 0.03 . 1 . . . . . . . . 6367 1 558 . 1 1 46 46 ALA HA H 1 5.38 0.01 . 1 . . . . . . . . 6367 1 559 . 1 1 46 46 ALA HB1 H 1 1.36 0.01 . 1 . . . . . . . . 6367 1 560 . 1 1 46 46 ALA HB2 H 1 1.36 0.01 . 1 . . . . . . . . 6367 1 561 . 1 1 46 46 ALA HB3 H 1 1.36 0.01 . 1 . . . . . . . . 6367 1 562 . 1 1 46 46 ALA CB C 13 23.4 0.03 . 1 . . . . . . . . 6367 1 563 . 1 1 46 46 ALA C C 13 174.6 0.03 . 1 . . . . . . . . 6367 1 564 . 1 1 47 47 VAL N N 15 116.7 0.03 . 1 . . . . . . . . 6367 1 565 . 1 1 47 47 VAL H H 1 9.35 0.01 . 1 . . . . . . . . 6367 1 566 . 1 1 47 47 VAL CA C 13 59.3 0.03 . 1 . . . . . . . . 6367 1 567 . 1 1 47 47 VAL HA H 1 4.74 0.01 . 1 . . . . . . . . 6367 1 568 . 1 1 47 47 VAL CB C 13 35.9 0.03 . 1 . . . . . . . . 6367 1 569 . 1 1 47 47 VAL HB H 1 1.88 0.01 . 1 . . . . . . . . 6367 1 570 . 1 1 47 47 VAL HG11 H 1 0.74 0.01 . 2 . . . . . . . . 6367 1 571 . 1 1 47 47 VAL HG12 H 1 0.74 0.01 . 2 . . . . . . . . 6367 1 572 . 1 1 47 47 VAL HG13 H 1 0.74 0.01 . 2 . . . . . . . . 6367 1 573 . 1 1 47 47 VAL HG21 H 1 0.77 0.01 . 2 . . . . . . . . 6367 1 574 . 1 1 47 47 VAL HG22 H 1 0.77 0.01 . 2 . . . . . . . . 6367 1 575 . 1 1 47 47 VAL HG23 H 1 0.77 0.01 . 2 . . . . . . . . 6367 1 576 . 1 1 47 47 VAL CG1 C 13 19.3 0.03 . 2 . . . . . . . . 6367 1 577 . 1 1 47 47 VAL CG2 C 13 20.5 0.03 . 2 . . . . . . . . 6367 1 578 . 1 1 47 47 VAL C C 13 172.1 0.03 . 1 . . . . . . . . 6367 1 579 . 1 1 48 48 ARG N N 15 123.0 0.03 . 1 . . . . . . . . 6367 1 580 . 1 1 48 48 ARG H H 1 8.06 0.01 . 1 . . . . . . . . 6367 1 581 . 1 1 48 48 ARG CA C 13 53.6 0.03 . 1 . . . . . . . . 6367 1 582 . 1 1 48 48 ARG HA H 1 4.18 0.01 . 1 . . . . . . . . 6367 1 583 . 1 1 48 48 ARG CB C 13 31.4 0.03 . 1 . . . . . . . . 6367 1 584 . 1 1 48 48 ARG HB2 H 1 0.77 0.01 . 2 . . . . . . . . 6367 1 585 . 1 1 48 48 ARG HB3 H 1 0.61 0.01 . 2 . . . . . . . . 6367 1 586 . 1 1 48 48 ARG CG C 13 26.1 0.03 . 1 . . . . . . . . 6367 1 587 . 1 1 48 48 ARG HG2 H 1 0.23 0.01 . 2 . . . . . . . . 6367 1 588 . 1 1 48 48 ARG HG3 H 1 0.34 0.01 . 2 . . . . . . . . 6367 1 589 . 1 1 48 48 ARG CD C 13 43.1 0.03 . 1 . . . . . . . . 6367 1 590 . 1 1 48 48 ARG HD2 H 1 2.79 0.01 . 1 . . . . . . . . 6367 1 591 . 1 1 48 48 ARG HD3 H 1 2.79 0.01 . 1 . . . . . . . . 6367 1 592 . 1 1 48 48 ARG C C 13 176.3 0.03 . 1 . . . . . . . . 6367 1 593 . 1 1 49 49 ILE N N 15 125.6 0.03 . 1 . . . . . . . . 6367 1 594 . 1 1 49 49 ILE H H 1 9.06 0.01 . 1 . . . . . . . . 6367 1 595 . 1 1 49 49 ILE CA C 13 60.1 0.03 . 1 . . . . . . . . 6367 1 596 . 1 1 49 49 ILE HA H 1 4.15 0.01 . 1 . . . . . . . . 6367 1 597 . 1 1 49 49 ILE CB C 13 40.8 0.03 . 1 . . . . . . . . 6367 1 598 . 1 1 49 49 ILE HB H 1 1.63 0.01 . 1 . . . . . . . . 6367 1 599 . 1 1 49 49 ILE HG21 H 1 0.80 0.01 . 1 . . . . . . . . 6367 1 600 . 1 1 49 49 ILE HG22 H 1 0.80 0.01 . 1 . . . . . . . . 6367 1 601 . 1 1 49 49 ILE HG23 H 1 0.80 0.01 . 1 . . . . . . . . 6367 1 602 . 1 1 49 49 ILE CG2 C 13 17.6 0.03 . 1 . . . . . . . . 6367 1 603 . 1 1 49 49 ILE CG1 C 13 27.0 0.03 . 1 . . . . . . . . 6367 1 604 . 1 1 49 49 ILE HG12 H 1 1.26 0.01 . 2 . . . . . . . . 6367 1 605 . 1 1 49 49 ILE HG13 H 1 0.94 0.01 . 2 . . . . . . . . 6367 1 606 . 1 1 49 49 ILE HD11 H 1 0.65 0.01 . 1 . . . . . . . . 6367 1 607 . 1 1 49 49 ILE HD12 H 1 0.65 0.01 . 1 . . . . . . . . 6367 1 608 . 1 1 49 49 ILE HD13 H 1 0.65 0.01 . 1 . . . . . . . . 6367 1 609 . 1 1 49 49 ILE CD1 C 13 14.0 0.03 . 1 . . . . . . . . 6367 1 610 . 1 1 49 49 ILE C C 13 175.1 0.03 . 1 . . . . . . . . 6367 1 611 . 1 1 50 50 GLN N N 15 124.6 0.03 . 1 . . . . . . . . 6367 1 612 . 1 1 50 50 GLN H H 1 8.56 0.01 . 1 . . . . . . . . 6367 1 613 . 1 1 50 50 GLN CA C 13 54.7 0.03 . 1 . . . . . . . . 6367 1 614 . 1 1 50 50 GLN HA H 1 4.85 0.01 . 1 . . . . . . . . 6367 1 615 . 1 1 50 50 GLN CB C 13 30.2 0.03 . 1 . . . . . . . . 6367 1 616 . 1 1 50 50 GLN HB2 H 1 1.94 0.01 . 2 . . . . . . . . 6367 1 617 . 1 1 50 50 GLN HB3 H 1 1.99 0.01 . 2 . . . . . . . . 6367 1 618 . 1 1 50 50 GLN CG C 13 34.1 0.03 . 1 . . . . . . . . 6367 1 619 . 1 1 50 50 GLN HG2 H 1 2.28 0.01 . 2 . . . . . . . . 6367 1 620 . 1 1 50 50 GLN HG3 H 1 2.21 0.01 . 2 . . . . . . . . 6367 1 621 . 1 1 50 50 GLN NE2 N 15 112.3 0.03 . 1 . . . . . . . . 6367 1 622 . 1 1 50 50 GLN HE21 H 1 7.66 0.01 . 2 . . . . . . . . 6367 1 623 . 1 1 50 50 GLN HE22 H 1 6.86 0.01 . 2 . . . . . . . . 6367 1 624 . 1 1 50 50 GLN C C 13 175.8 0.03 . 1 . . . . . . . . 6367 1 625 . 1 1 51 51 GLU N N 15 124.0 0.03 . 1 . . . . . . . . 6367 1 626 . 1 1 51 51 GLU H H 1 8.57 0.01 . 1 . . . . . . . . 6367 1 627 . 1 1 51 51 GLU CA C 13 56.0 0.03 . 1 . . . . . . . . 6367 1 628 . 1 1 51 51 GLU HA H 1 4.39 0.01 . 1 . . . . . . . . 6367 1 629 . 1 1 51 51 GLU CB C 13 31.9 0.03 . 1 . . . . . . . . 6367 1 630 . 1 1 51 51 GLU HB2 H 1 1.91 0.01 . 2 . . . . . . . . 6367 1 631 . 1 1 51 51 GLU HB3 H 1 2.05 0.01 . 2 . . . . . . . . 6367 1 632 . 1 1 51 51 GLU CG C 13 35.9 0.03 . 1 . . . . . . . . 6367 1 633 . 1 1 51 51 GLU HG2 H 1 2.30 0.01 . 2 . . . . . . . . 6367 1 634 . 1 1 51 51 GLU HG3 H 1 2.28 0.01 . 2 . . . . . . . . 6367 1 635 . 1 1 51 51 GLU C C 13 175.3 0.03 . 1 . . . . . . . . 6367 1 636 . 1 1 52 52 GLU N N 15 124.6 0.03 . 1 . . . . . . . . 6367 1 637 . 1 1 52 52 GLU H H 1 8.61 0.01 . 1 . . . . . . . . 6367 1 638 . 1 1 52 52 GLU CA C 13 54.4 0.03 . 1 . . . . . . . . 6367 1 639 . 1 1 52 52 GLU HA H 1 4.60 0.01 . 1 . . . . . . . . 6367 1 640 . 1 1 52 52 GLU CB C 13 29.7 0.03 . 1 . . . . . . . . 6367 1 641 . 1 1 52 52 GLU HB2 H 1 1.89 0.01 . 2 . . . . . . . . 6367 1 642 . 1 1 52 52 GLU HB3 H 1 2.07 0.01 . 2 . . . . . . . . 6367 1 643 . 1 1 52 52 GLU CG C 13 36.0 0.03 . 1 . . . . . . . . 6367 1 644 . 1 1 52 52 GLU HG2 H 1 2.29 0.01 . 2 . . . . . . . . 6367 1 645 . 1 1 52 52 GLU HG3 H 1 2.27 0.01 . 2 . . . . . . . . 6367 1 646 . 1 1 53 53 PRO CD C 13 50.4 0.03 . 1 . . . . . . . . 6367 1 647 . 1 1 53 53 PRO CA C 13 63.2 0.03 . 1 . . . . . . . . 6367 1 648 . 1 1 53 53 PRO HA H 1 4.40 0.01 . 1 . . . . . . . . 6367 1 649 . 1 1 53 53 PRO CB C 13 31.9 0.03 . 1 . . . . . . . . 6367 1 650 . 1 1 53 53 PRO HB2 H 1 2.25 0.01 . 2 . . . . . . . . 6367 1 651 . 1 1 53 53 PRO HB3 H 1 1.94 0.01 . 2 . . . . . . . . 6367 1 652 . 1 1 53 53 PRO CG C 13 27.4 0.03 . 1 . . . . . . . . 6367 1 653 . 1 1 53 53 PRO HG2 H 1 2.01 0.01 . 1 . . . . . . . . 6367 1 654 . 1 1 53 53 PRO HG3 H 1 2.01 0.01 . 1 . . . . . . . . 6367 1 655 . 1 1 53 53 PRO HD2 H 1 3.73 0.01 . 2 . . . . . . . . 6367 1 656 . 1 1 53 53 PRO HD3 H 1 3.75 0.01 . 2 . . . . . . . . 6367 1 657 . 1 1 53 53 PRO C C 13 176.6 0.03 . 1 . . . . . . . . 6367 1 658 . 1 1 54 54 ASP N N 15 119.9 0.03 . 1 . . . . . . . . 6367 1 659 . 1 1 54 54 ASP H H 1 8.39 0.01 . 1 . . . . . . . . 6367 1 660 . 1 1 54 54 ASP CA C 13 54.3 0.03 . 1 . . . . . . . . 6367 1 661 . 1 1 54 54 ASP HA H 1 4.57 0.01 . 1 . . . . . . . . 6367 1 662 . 1 1 54 54 ASP CB C 13 41.2 0.03 . 1 . . . . . . . . 6367 1 663 . 1 1 54 54 ASP HB2 H 1 2.69 0.01 . 2 . . . . . . . . 6367 1 664 . 1 1 54 54 ASP HB3 H 1 2.70 0.01 . 2 . . . . . . . . 6367 1 665 . 1 1 54 54 ASP C C 13 177.1 0.03 . 1 . . . . . . . . 6367 1 666 . 1 1 55 55 GLY N N 15 109.7 0.03 . 1 . . . . . . . . 6367 1 667 . 1 1 55 55 GLY H H 1 8.37 0.01 . 1 . . . . . . . . 6367 1 668 . 1 1 55 55 GLY CA C 13 45.3 0.03 . 1 . . . . . . . . 6367 1 669 . 1 1 55 55 GLY HA2 H 1 3.96 0.01 . 2 . . . . . . . . 6367 1 670 . 1 1 55 55 GLY HA3 H 1 3.97 0.01 . 2 . . . . . . . . 6367 1 671 . 1 1 55 55 GLY C C 13 174.6 0.03 . 1 . . . . . . . . 6367 1 672 . 1 1 56 56 CYS N N 15 118.4 0.03 . 1 . . . . . . . . 6367 1 673 . 1 1 56 56 CYS H H 1 8.27 0.01 . 1 . . . . . . . . 6367 1 674 . 1 1 56 56 CYS CA C 13 58.7 0.03 . 1 . . . . . . . . 6367 1 675 . 1 1 56 56 CYS HA H 1 4.47 0.01 . 1 . . . . . . . . 6367 1 676 . 1 1 56 56 CYS CB C 13 27.8 0.03 . 1 . . . . . . . . 6367 1 677 . 1 1 56 56 CYS HB2 H 1 2.94 0.01 . 2 . . . . . . . . 6367 1 678 . 1 1 56 56 CYS HB3 H 1 2.93 0.01 . 2 . . . . . . . . 6367 1 679 . 1 1 56 56 CYS C C 13 175.1 0.03 . 1 . . . . . . . . 6367 1 680 . 1 1 57 57 LEU N N 15 124.1 0.03 . 1 . . . . . . . . 6367 1 681 . 1 1 57 57 LEU H H 1 8.37 0.01 . 1 . . . . . . . . 6367 1 682 . 1 1 57 57 LEU CA C 13 55.2 0.03 . 1 . . . . . . . . 6367 1 683 . 1 1 57 57 LEU HA H 1 4.40 0.01 . 1 . . . . . . . . 6367 1 684 . 1 1 57 57 LEU CB C 13 42.2 0.03 . 1 . . . . . . . . 6367 1 685 . 1 1 57 57 LEU HB2 H 1 1.68 0.01 . 2 . . . . . . . . 6367 1 686 . 1 1 57 57 LEU HB3 H 1 1.61 0.01 . 2 . . . . . . . . 6367 1 687 . 1 1 57 57 LEU CG C 13 27.0 0.03 . 1 . . . . . . . . 6367 1 688 . 1 1 57 57 LEU HG H 1 1.69 0.01 . 1 . . . . . . . . 6367 1 689 . 1 1 57 57 LEU HD11 H 1 0.85 0.01 . 2 . . . . . . . . 6367 1 690 . 1 1 57 57 LEU HD12 H 1 0.85 0.01 . 2 . . . . . . . . 6367 1 691 . 1 1 57 57 LEU HD13 H 1 0.85 0.01 . 2 . . . . . . . . 6367 1 692 . 1 1 57 57 LEU HD21 H 1 0.84 0.01 . 2 . . . . . . . . 6367 1 693 . 1 1 57 57 LEU HD22 H 1 0.84 0.01 . 2 . . . . . . . . 6367 1 694 . 1 1 57 57 LEU HD23 H 1 0.84 0.01 . 2 . . . . . . . . 6367 1 695 . 1 1 57 57 LEU CD1 C 13 23.4 0.03 . 1 . . . . . . . . 6367 1 696 . 1 1 57 57 LEU CD2 C 13 23.4 0.03 . 1 . . . . . . . . 6367 1 697 . 1 1 57 57 LEU C C 13 177.7 0.03 . 1 . . . . . . . . 6367 1 698 . 1 1 58 58 SER N N 15 115.9 0.03 . 1 . . . . . . . . 6367 1 699 . 1 1 58 58 SER H H 1 8.28 0.01 . 1 . . . . . . . . 6367 1 700 . 1 1 58 58 SER CA C 13 58.2 0.03 . 1 . . . . . . . . 6367 1 701 . 1 1 58 58 SER HA H 1 4.43 0.01 . 1 . . . . . . . . 6367 1 702 . 1 1 58 58 SER CB C 13 63.6 0.03 . 1 . . . . . . . . 6367 1 703 . 1 1 58 58 SER HB2 H 1 3.88 0.01 . 2 . . . . . . . . 6367 1 704 . 1 1 58 58 SER HB3 H 1 3.87 0.01 . 2 . . . . . . . . 6367 1 705 . 1 1 58 58 SER C C 13 175.3 0.03 . 1 . . . . . . . . 6367 1 706 . 1 1 59 59 GLY N N 15 110.8 0.03 . 1 . . . . . . . . 6367 1 707 . 1 1 59 59 GLY H H 1 8.44 0.01 . 1 . . . . . . . . 6367 1 708 . 1 1 59 59 GLY CA C 13 45.3 0.03 . 1 . . . . . . . . 6367 1 709 . 1 1 59 59 GLY HA2 H 1 3.99 0.01 . 2 . . . . . . . . 6367 1 710 . 1 1 59 59 GLY HA3 H 1 4.00 0.01 . 2 . . . . . . . . 6367 1 711 . 1 1 59 59 GLY C C 13 174.4 0.03 . 1 . . . . . . . . 6367 1 712 . 1 1 60 60 SER N N 15 115.3 0.03 . 1 . . . . . . . . 6367 1 713 . 1 1 60 60 SER H H 1 8.21 0.01 . 1 . . . . . . . . 6367 1 714 . 1 1 60 60 SER CA C 13 58.5 0.03 . 1 . . . . . . . . 6367 1 715 . 1 1 60 60 SER HA H 1 4.77 0.01 . 1 . . . . . . . . 6367 1 716 . 1 1 60 60 SER CB C 13 63.6 0.03 . 1 . . . . . . . . 6367 1 717 . 1 1 60 60 SER HB2 H 1 3.87 0.01 . 2 . . . . . . . . 6367 1 718 . 1 1 60 60 SER HB3 H 1 3.91 0.01 . 2 . . . . . . . . 6367 1 719 . 1 1 60 60 SER C C 13 174.0 0.03 . 1 . . . . . . . . 6367 1 720 . 1 1 61 61 CYS N N 15 121.5 0.03 . 1 . . . . . . . . 6367 1 721 . 1 1 61 61 CYS H H 1 8.25 0.01 . 1 . . . . . . . . 6367 1 722 . 1 1 61 61 CYS CA C 13 56.5 0.03 . 1 . . . . . . . . 6367 1 723 . 1 1 61 61 CYS HA H 1 4.47 0.01 . 1 . . . . . . . . 6367 1 724 . 1 1 61 61 CYS CB C 13 27.9 0.03 . 1 . . . . . . . . 6367 1 725 . 1 1 61 61 CYS HB2 H 1 2.93 0.01 . 2 . . . . . . . . 6367 1 726 . 1 1 61 61 CYS HB3 H 1 2.90 0.01 . 2 . . . . . . . . 6367 1 727 . 1 1 62 62 LYS CA C 13 57.4 0.03 . 1 . . . . . . . . 6367 1 728 . 1 1 62 62 LYS HA H 1 4.09 0.01 . 1 . . . . . . . . 6367 1 729 . 1 1 62 62 LYS CB C 13 33.0 0.03 . 1 . . . . . . . . 6367 1 730 . 1 1 62 62 LYS HB2 H 1 2.01 0.01 . 2 . . . . . . . . 6367 1 731 . 1 1 62 62 LYS HB3 H 1 2.00 0.01 . 2 . . . . . . . . 6367 1 732 . 1 1 62 62 LYS CG C 13 25.0 0.03 . 1 . . . . . . . . 6367 1 733 . 1 1 62 62 LYS HG2 H 1 1.30 0.01 . 2 . . . . . . . . 6367 1 734 . 1 1 62 62 LYS HG3 H 1 1.31 0.01 . 2 . . . . . . . . 6367 1 735 . 1 1 62 62 LYS CD C 13 28.9 0.03 . 1 . . . . . . . . 6367 1 736 . 1 1 62 62 LYS HD2 H 1 1.74 0.01 . 2 . . . . . . . . 6367 1 737 . 1 1 62 62 LYS HD3 H 1 1.77 0.01 . 2 . . . . . . . . 6367 1 738 . 1 1 62 62 LYS CE C 13 41.8 0.03 . 1 . . . . . . . . 6367 1 739 . 1 1 62 62 LYS HE2 H 1 3.00 0.01 . 2 . . . . . . . . 6367 1 740 . 1 1 62 62 LYS HE3 H 1 3.10 0.01 . 2 . . . . . . . . 6367 1 741 . 1 1 62 62 LYS C C 13 176.6 0.03 . 1 . . . . . . . . 6367 1 742 . 1 1 63 63 SER N N 15 115.9 0.03 . 1 . . . . . . . . 6367 1 743 . 1 1 63 63 SER H H 1 8.25 0.01 . 1 . . . . . . . . 6367 1 744 . 1 1 63 63 SER CA C 13 58.2 0.03 . 1 . . . . . . . . 6367 1 745 . 1 1 63 63 SER HA H 1 4.47 0.01 . 1 . . . . . . . . 6367 1 746 . 1 1 63 63 SER CB C 13 63.8 0.03 . 1 . . . . . . . . 6367 1 747 . 1 1 63 63 SER HB2 H 1 3.88 0.01 . 2 . . . . . . . . 6367 1 748 . 1 1 63 63 SER HB3 H 1 3.87 0.01 . 2 . . . . . . . . 6367 1 749 . 1 1 65 65 PRO CD C 13 50.6 0.03 . 1 . . . . . . . . 6367 1 750 . 1 1 65 65 PRO CA C 13 63.6 0.03 . 1 . . . . . . . . 6367 1 751 . 1 1 65 65 PRO HA H 1 4.39 0.01 . 1 . . . . . . . . 6367 1 752 . 1 1 65 65 PRO CB C 13 31.9 0.03 . 1 . . . . . . . . 6367 1 753 . 1 1 65 65 PRO HB2 H 1 2.31 0.01 . 2 . . . . . . . . 6367 1 754 . 1 1 65 65 PRO HB3 H 1 1.93 0.01 . 2 . . . . . . . . 6367 1 755 . 1 1 65 65 PRO CG C 13 27.4 0.03 . 1 . . . . . . . . 6367 1 756 . 1 1 65 65 PRO HG2 H 1 2.01 0.01 . 2 . . . . . . . . 6367 1 757 . 1 1 65 65 PRO HG3 H 1 2.03 0.01 . 2 . . . . . . . . 6367 1 758 . 1 1 65 65 PRO HD2 H 1 3.77 0.01 . 2 . . . . . . . . 6367 1 759 . 1 1 65 65 PRO HD3 H 1 3.76 0.01 . 2 . . . . . . . . 6367 1 760 . 1 1 65 65 PRO C C 13 177.2 0.03 . 1 . . . . . . . . 6367 1 761 . 1 1 66 66 GLU N N 15 119.5 0.03 . 1 . . . . . . . . 6367 1 762 . 1 1 66 66 GLU H H 1 8.61 0.01 . 1 . . . . . . . . 6367 1 763 . 1 1 66 66 GLU CA C 13 56.9 0.03 . 1 . . . . . . . . 6367 1 764 . 1 1 66 66 GLU HA H 1 4.24 0.01 . 1 . . . . . . . . 6367 1 765 . 1 1 66 66 GLU CB C 13 29.7 0.03 . 1 . . . . . . . . 6367 1 766 . 1 1 66 66 GLU HB2 H 1 1.98 0.01 . 2 . . . . . . . . 6367 1 767 . 1 1 66 66 GLU HB3 H 1 2.06 0.01 . 2 . . . . . . . . 6367 1 768 . 1 1 66 66 GLU CG C 13 36.2 0.03 . 1 . . . . . . . . 6367 1 769 . 1 1 66 66 GLU HG2 H 1 2.28 0.01 . 2 . . . . . . . . 6367 1 770 . 1 1 66 66 GLU HG3 H 1 2.27 0.01 . 2 . . . . . . . . 6367 1 771 . 1 1 66 66 GLU C C 13 177.1 0.03 . 1 . . . . . . . . 6367 1 772 . 1 1 67 67 GLY N N 15 109.7 0.03 . 1 . . . . . . . . 6367 1 773 . 1 1 67 67 GLY H H 1 8.29 0.01 . 1 . . . . . . . . 6367 1 774 . 1 1 67 67 GLY CA C 13 45.3 0.03 . 1 . . . . . . . . 6367 1 775 . 1 1 67 67 GLY HA2 H 1 3.99 0.01 . 2 . . . . . . . . 6367 1 776 . 1 1 67 67 GLY HA3 H 1 3.91 0.01 . 2 . . . . . . . . 6367 1 777 . 1 1 67 67 GLY C C 13 174.1 0.03 . 1 . . . . . . . . 6367 1 778 . 1 1 68 68 LYS N N 15 120.5 0.03 . 1 . . . . . . . . 6367 1 779 . 1 1 68 68 LYS H H 1 8.02 0.01 . 1 . . . . . . . . 6367 1 780 . 1 1 68 68 LYS CA C 13 55.6 0.03 . 1 . . . . . . . . 6367 1 781 . 1 1 68 68 LYS HA H 1 4.34 0.01 . 1 . . . . . . . . 6367 1 782 . 1 1 68 68 LYS CB C 13 33.2 0.03 . 1 . . . . . . . . 6367 1 783 . 1 1 68 68 LYS HB2 H 1 1.84 0.01 . 2 . . . . . . . . 6367 1 784 . 1 1 68 68 LYS HB3 H 1 1.72 0.01 . 2 . . . . . . . . 6367 1 785 . 1 1 68 68 LYS CG C 13 24.7 0.03 . 1 . . . . . . . . 6367 1 786 . 1 1 68 68 LYS HG2 H 1 1.43 0.01 . 2 . . . . . . . . 6367 1 787 . 1 1 68 68 LYS HG3 H 1 1.39 0.01 . 2 . . . . . . . . 6367 1 788 . 1 1 68 68 LYS CD C 13 28.8 0.03 . 1 . . . . . . . . 6367 1 789 . 1 1 68 68 LYS HD2 H 1 1.66 0.01 . 2 . . . . . . . . 6367 1 790 . 1 1 68 68 LYS HD3 H 1 1.67 0.01 . 2 . . . . . . . . 6367 1 791 . 1 1 68 68 LYS CE C 13 42.2 0.03 . 1 . . . . . . . . 6367 1 792 . 1 1 68 68 LYS HE2 H 1 2.99 0.01 . 1 . . . . . . . . 6367 1 793 . 1 1 68 68 LYS HE3 H 1 2.99 0.01 . 1 . . . . . . . . 6367 1 794 . 1 1 68 68 LYS C C 13 176.2 0.03 . 1 . . . . . . . . 6367 1 795 . 1 1 69 69 ALA N N 15 124.6 0.03 . 1 . . . . . . . . 6367 1 796 . 1 1 69 69 ALA H H 1 8.30 0.01 . 1 . . . . . . . . 6367 1 797 . 1 1 69 69 ALA CA C 13 52.4 0.03 . 1 . . . . . . . . 6367 1 798 . 1 1 69 69 ALA HA H 1 4.33 0.01 . 1 . . . . . . . . 6367 1 799 . 1 1 69 69 ALA HB1 H 1 1.38 0.01 . 1 . . . . . . . . 6367 1 800 . 1 1 69 69 ALA HB2 H 1 1.38 0.01 . 1 . . . . . . . . 6367 1 801 . 1 1 69 69 ALA HB3 H 1 1.38 0.01 . 1 . . . . . . . . 6367 1 802 . 1 1 69 69 ALA CB C 13 19.3 0.03 . 1 . . . . . . . . 6367 1 803 . 1 1 69 69 ALA C C 13 177.4 0.03 . 1 . . . . . . . . 6367 1 804 . 1 1 70 70 CYS N N 15 117.9 0.03 . 1 . . . . . . . . 6367 1 805 . 1 1 70 70 CYS H H 1 8.24 0.01 . 1 . . . . . . . . 6367 1 806 . 1 1 70 70 CYS CA C 13 57.8 0.03 . 1 . . . . . . . . 6367 1 807 . 1 1 70 70 CYS HA H 1 4.48 0.01 . 1 . . . . . . . . 6367 1 808 . 1 1 70 70 CYS CB C 13 27.9 0.03 . 1 . . . . . . . . 6367 1 809 . 1 1 70 70 CYS HB2 H 1 2.90 0.01 . 2 . . . . . . . . 6367 1 810 . 1 1 70 70 CYS HB3 H 1 2.88 0.01 . 2 . . . . . . . . 6367 1 811 . 1 1 70 70 CYS C C 13 174.0 0.03 . 1 . . . . . . . . 6367 1 812 . 1 1 71 71 LEU N N 15 124.0 0.03 . 1 . . . . . . . . 6367 1 813 . 1 1 71 71 LEU H H 1 8.19 0.01 . 1 . . . . . . . . 6367 1 814 . 1 1 71 71 LEU CA C 13 54.7 0.03 . 1 . . . . . . . . 6367 1 815 . 1 1 71 71 LEU HA H 1 4.34 0.01 . 1 . . . . . . . . 6367 1 816 . 1 1 71 71 LEU CB C 13 42.2 0.03 . 1 . . . . . . . . 6367 1 817 . 1 1 71 71 LEU HB2 H 1 1.48 0.01 . 1 . . . . . . . . 6367 1 818 . 1 1 71 71 LEU HB3 H 1 1.61 0.01 . 1 . . . . . . . . 6367 1 819 . 1 1 71 71 LEU CG C 13 26.5 0.03 . 1 . . . . . . . . 6367 1 820 . 1 1 71 71 LEU HG H 1 1.53 0.01 . 1 . . . . . . . . 6367 1 821 . 1 1 71 71 LEU HD11 H 1 0.88 0.01 . 1 . . . . . . . . 6367 1 822 . 1 1 71 71 LEU HD12 H 1 0.88 0.01 . 1 . . . . . . . . 6367 1 823 . 1 1 71 71 LEU HD13 H 1 0.88 0.01 . 1 . . . . . . . . 6367 1 824 . 1 1 71 71 LEU HD21 H 1 0.78 0.01 . 1 . . . . . . . . 6367 1 825 . 1 1 71 71 LEU HD22 H 1 0.78 0.01 . 1 . . . . . . . . 6367 1 826 . 1 1 71 71 LEU HD23 H 1 0.78 0.01 . 1 . . . . . . . . 6367 1 827 . 1 1 71 71 LEU CD1 C 13 24.7 0.03 . 1 . . . . . . . . 6367 1 828 . 1 1 71 71 LEU CD2 C 13 23.4 0.03 . 1 . . . . . . . . 6367 1 829 . 1 1 71 71 LEU C C 13 176.9 0.03 . 1 . . . . . . . . 6367 1 830 . 1 1 72 72 ARG N N 15 123.1 0.03 . 1 . . . . . . . . 6367 1 831 . 1 1 72 72 ARG H H 1 8.54 0.01 . 1 . . . . . . . . 6367 1 832 . 1 1 72 72 ARG CA C 13 55.5 0.03 . 1 . . . . . . . . 6367 1 833 . 1 1 72 72 ARG HA H 1 4.22 0.01 . 1 . . . . . . . . 6367 1 834 . 1 1 72 72 ARG CB C 13 31.5 0.03 . 1 . . . . . . . . 6367 1 835 . 1 1 72 72 ARG HB2 H 1 1.13 0.01 . 1 . . . . . . . . 6367 1 836 . 1 1 72 72 ARG HB3 H 1 1.42 0.01 . 1 . . . . . . . . 6367 1 837 . 1 1 72 72 ARG CG C 13 27.0 0.03 . 1 . . . . . . . . 6367 1 838 . 1 1 72 72 ARG HG2 H 1 1.33 0.01 . 2 . . . . . . . . 6367 1 839 . 1 1 72 72 ARG HG3 H 1 1.49 0.01 . 2 . . . . . . . . 6367 1 840 . 1 1 72 72 ARG CD C 13 43.4 0.03 . 1 . . . . . . . . 6367 1 841 . 1 1 72 72 ARG HD2 H 1 3.08 0.01 . 2 . . . . . . . . 6367 1 842 . 1 1 72 72 ARG HD3 H 1 2.98 0.01 . 2 . . . . . . . . 6367 1 843 . 1 1 72 72 ARG C C 13 174.3 0.03 . 1 . . . . . . . . 6367 1 844 . 1 1 73 73 GLU N N 15 121.6 0.03 . 1 . . . . . . . . 6367 1 845 . 1 1 73 73 GLU H H 1 8.34 0.01 . 1 . . . . . . . . 6367 1 846 . 1 1 73 73 GLU CA C 13 55.0 0.03 . 1 . . . . . . . . 6367 1 847 . 1 1 73 73 GLU HA H 1 4.77 0.01 . 1 . . . . . . . . 6367 1 848 . 1 1 73 73 GLU CB C 13 32.7 0.03 . 1 . . . . . . . . 6367 1 849 . 1 1 73 73 GLU HB2 H 1 1.78 0.01 . 2 . . . . . . . . 6367 1 850 . 1 1 73 73 GLU HB3 H 1 1.80 0.01 . 2 . . . . . . . . 6367 1 851 . 1 1 73 73 GLU CG C 13 36.0 0.03 . 1 . . . . . . . . 6367 1 852 . 1 1 73 73 GLU HG2 H 1 1.88 0.01 . 2 . . . . . . . . 6367 1 853 . 1 1 73 73 GLU HG3 H 1 1.89 0.01 . 2 . . . . . . . . 6367 1 854 . 1 1 73 73 GLU C C 13 174.5 0.03 . 1 . . . . . . . . 6367 1 855 . 1 1 74 74 TRP N N 15 125.1 0.03 . 1 . . . . . . . . 6367 1 856 . 1 1 74 74 TRP H H 1 9.05 0.01 . 1 . . . . . . . . 6367 1 857 . 1 1 74 74 TRP CA C 13 56.6 0.03 . 1 . . . . . . . . 6367 1 858 . 1 1 74 74 TRP HA H 1 4.80 0.01 . 1 . . . . . . . . 6367 1 859 . 1 1 74 74 TRP CB C 13 32.7 0.03 . 1 . . . . . . . . 6367 1 860 . 1 1 74 74 TRP HB2 H 1 2.97 0.01 . 2 . . . . . . . . 6367 1 861 . 1 1 74 74 TRP HB3 H 1 2.94 0.01 . 2 . . . . . . . . 6367 1 862 . 1 1 74 74 TRP CD1 C 13 126.3 0.03 . 1 . . . . . . . . 6367 1 863 . 1 1 74 74 TRP CE3 C 13 119.8 0.03 . 1 . . . . . . . . 6367 1 864 . 1 1 74 74 TRP NE1 N 15 129.7 0.03 . 1 . . . . . . . . 6367 1 865 . 1 1 74 74 TRP HD1 H 1 6.89 0.01 . 1 . . . . . . . . 6367 1 866 . 1 1 74 74 TRP HE3 H 1 7.24 0.01 . 1 . . . . . . . . 6367 1 867 . 1 1 74 74 TRP CZ3 C 13 121.8 0.03 . 1 . . . . . . . . 6367 1 868 . 1 1 74 74 TRP CZ2 C 13 114.3 0.03 . 1 . . . . . . . . 6367 1 869 . 1 1 74 74 TRP HE1 H 1 10.30 0.01 . 1 . . . . . . . . 6367 1 870 . 1 1 74 74 TRP HZ3 H 1 7.01 0.01 . 1 . . . . . . . . 6367 1 871 . 1 1 74 74 TRP CH2 C 13 124.3 0.03 . 1 . . . . . . . . 6367 1 872 . 1 1 74 74 TRP HZ2 H 1 7.32 0.01 . 1 . . . . . . . . 6367 1 873 . 1 1 74 74 TRP HH2 H 1 7.14 0.01 . 1 . . . . . . . . 6367 1 874 . 1 1 74 74 TRP C C 13 174.1 0.03 . 1 . . . . . . . . 6367 1 875 . 1 1 75 75 TRP N N 15 121.3 0.03 . 1 . . . . . . . . 6367 1 876 . 1 1 75 75 TRP H H 1 9.17 0.01 . 1 . . . . . . . . 6367 1 877 . 1 1 75 75 TRP CA C 13 56.0 0.03 . 1 . . . . . . . . 6367 1 878 . 1 1 75 75 TRP HA H 1 5.30 0.01 . 1 . . . . . . . . 6367 1 879 . 1 1 75 75 TRP CB C 13 32.0 0.03 . 1 . . . . . . . . 6367 1 880 . 1 1 75 75 TRP HB2 H 1 2.92 0.01 . 2 . . . . . . . . 6367 1 881 . 1 1 75 75 TRP HB3 H 1 2.94 0.01 . 2 . . . . . . . . 6367 1 882 . 1 1 75 75 TRP CD1 C 13 125.1 0.03 . 1 . . . . . . . . 6367 1 883 . 1 1 75 75 TRP CE3 C 13 119.5 0.03 . 1 . . . . . . . . 6367 1 884 . 1 1 75 75 TRP NE1 N 15 128.7 0.03 . 1 . . . . . . . . 6367 1 885 . 1 1 75 75 TRP HD1 H 1 7.06 0.01 . 1 . . . . . . . . 6367 1 886 . 1 1 75 75 TRP HE3 H 1 7.16 0.01 . 1 . . . . . . . . 6367 1 887 . 1 1 75 75 TRP CZ3 C 13 121.4 0.03 . 1 . . . . . . . . 6367 1 888 . 1 1 75 75 TRP CZ2 C 13 114.4 0.03 . 1 . . . . . . . . 6367 1 889 . 1 1 75 75 TRP HE1 H 1 10.23 0.01 . 1 . . . . . . . . 6367 1 890 . 1 1 75 75 TRP HZ3 H 1 6.61 0.01 . 1 . . . . . . . . 6367 1 891 . 1 1 75 75 TRP CH2 C 13 123.6 0.03 . 1 . . . . . . . . 6367 1 892 . 1 1 75 75 TRP HZ2 H 1 7.28 0.01 . 1 . . . . . . . . 6367 1 893 . 1 1 75 75 TRP HH2 H 1 6.84 0.01 . 1 . . . . . . . . 6367 1 894 . 1 1 75 75 TRP C C 13 174.6 0.03 . 1 . . . . . . . . 6367 1 895 . 1 1 76 76 ALA N N 15 119.9 0.03 . 1 . . . . . . . . 6367 1 896 . 1 1 76 76 ALA H H 1 8.83 0.01 . 1 . . . . . . . . 6367 1 897 . 1 1 76 76 ALA CA C 13 50.2 0.03 . 1 . . . . . . . . 6367 1 898 . 1 1 76 76 ALA HA H 1 4.87 0.01 . 1 . . . . . . . . 6367 1 899 . 1 1 76 76 ALA HB1 H 1 1.33 0.01 . 1 . . . . . . . . 6367 1 900 . 1 1 76 76 ALA HB2 H 1 1.33 0.01 . 1 . . . . . . . . 6367 1 901 . 1 1 76 76 ALA HB3 H 1 1.33 0.01 . 1 . . . . . . . . 6367 1 902 . 1 1 76 76 ALA CB C 13 23.8 0.03 . 1 . . . . . . . . 6367 1 903 . 1 1 76 76 ALA C C 13 176.6 0.03 . 1 . . . . . . . . 6367 1 904 . 1 1 77 77 LEU N N 15 117.9 0.03 . 1 . . . . . . . . 6367 1 905 . 1 1 77 77 LEU H H 1 8.86 0.01 . 1 . . . . . . . . 6367 1 906 . 1 1 77 77 LEU CA C 13 55.0 0.03 . 1 . . . . . . . . 6367 1 907 . 1 1 77 77 LEU HA H 1 4.74 0.01 . 1 . . . . . . . . 6367 1 908 . 1 1 77 77 LEU CB C 13 41.8 0.03 . 1 . . . . . . . . 6367 1 909 . 1 1 77 77 LEU HB2 H 1 1.65 0.01 . 2 . . . . . . . . 6367 1 910 . 1 1 77 77 LEU HB3 H 1 1.56 0.01 . 2 . . . . . . . . 6367 1 911 . 1 1 77 77 LEU CG C 13 27.0 0.03 . 1 . . . . . . . . 6367 1 912 . 1 1 77 77 LEU HG H 1 1.68 0.01 . 1 . . . . . . . . 6367 1 913 . 1 1 77 77 LEU HD11 H 1 0.95 0.01 . 1 . . . . . . . . 6367 1 914 . 1 1 77 77 LEU HD12 H 1 0.95 0.01 . 1 . . . . . . . . 6367 1 915 . 1 1 77 77 LEU HD13 H 1 0.95 0.01 . 1 . . . . . . . . 6367 1 916 . 1 1 77 77 LEU HD21 H 1 0.97 0.01 . 1 . . . . . . . . 6367 1 917 . 1 1 77 77 LEU HD22 H 1 0.97 0.01 . 1 . . . . . . . . 6367 1 918 . 1 1 77 77 LEU HD23 H 1 0.97 0.01 . 1 . . . . . . . . 6367 1 919 . 1 1 77 77 LEU CD1 C 13 23.0 0.03 . 1 . . . . . . . . 6367 1 920 . 1 1 77 77 LEU CD2 C 13 22.9 0.03 . 1 . . . . . . . . 6367 1 921 . 1 1 77 77 LEU C C 13 177.4 0.03 . 1 . . . . . . . . 6367 1 922 . 1 1 78 78 ARG N N 15 121.3 0.03 . 1 . . . . . . . . 6367 1 923 . 1 1 78 78 ARG H H 1 7.66 0.01 . 1 . . . . . . . . 6367 1 924 . 1 1 78 78 ARG CA C 13 55.6 0.03 . 1 . . . . . . . . 6367 1 925 . 1 1 78 78 ARG HA H 1 4.23 0.01 . 1 . . . . . . . . 6367 1 926 . 1 1 78 78 ARG CB C 13 31.0 0.03 . 1 . . . . . . . . 6367 1 927 . 1 1 78 78 ARG HB2 H 1 1.76 0.01 . 2 . . . . . . . . 6367 1 928 . 1 1 78 78 ARG HB3 H 1 1.31 0.01 . 2 . . . . . . . . 6367 1 929 . 1 1 78 78 ARG CG C 13 27.5 0.03 . 1 . . . . . . . . 6367 1 930 . 1 1 78 78 ARG HG2 H 1 1.45 0.01 . 2 . . . . . . . . 6367 1 931 . 1 1 78 78 ARG HG3 H 1 1.43 0.01 . 2 . . . . . . . . 6367 1 932 . 1 1 78 78 ARG CD C 13 43.1 0.03 . 1 . . . . . . . . 6367 1 933 . 1 1 78 78 ARG HD2 H 1 3.07 0.01 . 2 . . . . . . . . 6367 1 934 . 1 1 78 78 ARG HD3 H 1 3.08 0.01 . 2 . . . . . . . . 6367 1 stop_ save_