data_7084 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7084 _Entry.Title ; Dr13312 chemical shift data ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-04-24 _Entry.Accession_date 2006-04-24 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _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 Robert Tyler . C. . 7084 2 Jikui Song . . . 7084 3 John Markley . L. . 7084 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID . . CESG . 7084 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7084 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 347 7084 '15N chemical shifts' 77 7084 '1H chemical shifts' 540 7084 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2009-06-23 2006-04-24 update BMRB 'added time domain data' 7084 1 . . 2006-06-28 2006-04-24 original author 'original release' 7084 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 7084 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'NMR Structural Investigation of Dr13312' _Citation.Status 'in preparation' _Citation.Type journal _Citation.Journal_abbrev 'Protein Sci.' _Citation.Journal_name_full . _Citation.Journal_volume . _Citation.Journal_issue . _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first . _Citation.Page_last . _Citation.Year . _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 Robert Tyler . C. . 7084 1 2 Jikui Song . . . 7084 1 3 John Markley . L. . 7084 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7084 _Assembly.ID 1 _Assembly.Name Dr13312 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites yes _Assembly.Molecules_in_chemical_exchange no _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_ _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 Dr13312 1 $Protein . . yes native no no . . . 7084 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Protein _Entity.Sf_category entity _Entity.Sf_framecode Protein _Entity.Entry_ID 7084 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Dr13312 _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 ; GHHHHHHLEDPSGGTPYIGS KISLISKAEIRYEGILYTID TENSTVALAKVRSFGTEDRP TDRPIAPRDETFEYIIFRGS DIKDLTVCEPPKPIM ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites yes _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 95 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 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 BMRB 15971 . DANIO_RERIO_RAP55 . . . . . 100.00 95 100.00 100.00 1.77e-61 . . . . 7084 1 2 no PDB 2FB7 . "Nmr Solution Structure Of Protein From Zebra Fish Dr.13312" . . . . . 100.00 95 100.00 100.00 1.77e-61 . . . . 7084 1 3 no PDB 2VXF . "Solution Structure Of The Lsm-Domain Of Zebrafish Rap55" . . . . . 100.00 95 100.00 100.00 1.77e-61 . . . . 7084 1 4 no DBJ BAB55259 . "unnamed protein product [Homo sapiens]" . . . . . 86.32 463 97.56 97.56 2.17e-44 . . . . 7084 1 5 no DBJ BAC99045 . "alphaSNBP(A) [Homo sapiens]" . . . . . 86.32 463 97.56 97.56 5.15e-46 . . . . 7084 1 6 no DBJ BAC99046 . "alphaSNBP(B) [Homo sapiens]" . . . . . 86.32 463 97.56 97.56 4.23e-46 . . . . 7084 1 7 no DBJ BAF36055 . "RAP55 protein [Xenopus laevis]" . . . . . 86.32 471 97.56 97.56 7.13e-46 . . . . 7084 1 8 no DBJ BAG10232 . "LSM14 protein homolog A [synthetic construct]" . . . . . 86.32 463 97.56 97.56 5.15e-46 . . . . 7084 1 9 no EMBL CAG31566 . "hypothetical protein RCJMB04_8b16 [Gallus gallus]" . . . . . 86.32 461 97.56 97.56 5.16e-46 . . . . 7084 1 10 no EMBL CAH93252 . "hypothetical protein [Pongo abelii]" . . . . . 86.32 463 97.56 97.56 4.89e-46 . . . . 7084 1 11 no EMBL CDQ65324 . "unnamed protein product [Oncorhynchus mykiss]" . . . . . 86.32 166 97.56 97.56 1.38e-48 . . . . 7084 1 12 no EMBL CDQ79842 . "unnamed protein product [Oncorhynchus mykiss]" . . . . . 85.26 444 97.53 97.53 4.39e-45 . . . . 7084 1 13 no EMBL CDQ84551 . "unnamed protein product [Oncorhynchus mykiss]" . . . . . 85.26 447 97.53 97.53 4.79e-45 . . . . 7084 1 14 no GB AAH16842 . "LSM14A protein [Homo sapiens]" . . . . . 86.32 463 97.56 97.56 4.23e-46 . . . . 7084 1 15 no GB AAH31521 . "LSM14 homolog A (SCD6, S. cerevisiae) [Mus musculus]" . . . . . 86.32 462 97.56 97.56 7.15e-46 . . . . 7084 1 16 no GB AAH42251 . "MGC53350 protein [Xenopus laevis]" . . . . . 86.32 471 97.56 97.56 4.03e-46 . . . . 7084 1 17 no GB AAH54659 . "Lsm14a protein [Danio rerio]" . . . . . 86.32 243 100.00 100.00 2.04e-49 . . . . 7084 1 18 no GB AAH55387 . "Lsm14a protein [Danio rerio]" . . . . . 88.42 85 100.00 100.00 3.23e-52 . . . . 7084 1 19 no REF NP_001012796 . "protein LSM14 homolog A [Gallus gallus]" . . . . . 86.32 461 97.56 97.56 5.16e-46 . . . . 7084 1 20 no REF NP_001029826 . "protein LSM14 homolog A [Bos taurus]" . . . . . 86.32 463 97.56 97.56 5.78e-46 . . . . 7084 1 21 no REF NP_001079434 . "protein LSM14 homolog A-B [Xenopus laevis]" . . . . . 86.32 471 97.56 97.56 4.03e-46 . . . . 7084 1 22 no REF NP_001087507 . "protein LSM14 homolog A-A [Xenopus laevis]" . . . . . 86.32 471 97.56 97.56 7.13e-46 . . . . 7084 1 23 no REF NP_001107565 . "protein LSM14 homolog A isoform a [Homo sapiens]" . . . . . 86.32 463 97.56 97.56 5.15e-46 . . . . 7084 1 24 no SP A0A8M2 . "RecName: Full=Protein LSM14 homolog A-A; AltName: Full=RNA-associated protein 55A-A; Short=RAP55A-A; Short=xRAP55; Short=xRAP55" . . . . . 86.32 471 97.56 97.56 7.13e-46 . . . . 7084 1 25 no SP Q3MHF8 . "RecName: Full=Protein LSM14 homolog A; AltName: Full=Protein FAM61A; AltName: Full=RNA-associated protein 55A [Bos taurus]" . . . . . 86.32 463 97.56 97.56 5.78e-46 . . . . 7084 1 26 no SP Q5R4R4 . "RecName: Full=Protein LSM14 homolog A; AltName: Full=Protein FAM61A; AltName: Full=RNA-associated protein 55A [Pongo abelii]" . . . . . 86.32 463 97.56 97.56 4.89e-46 . . . . 7084 1 27 no SP Q6NVR8 . "RecName: Full=Protein LSM14 homolog A; AltName: Full=RNA-associated protein 55A; Short=RAP55A [Xenopus (Silurana) tropicalis]" . . . . . 86.32 469 97.56 97.56 3.76e-46 . . . . 7084 1 28 no SP Q8AVJ2 . "RecName: Full=Protein LSM14 homolog A-B; AltName: Full=RNA-associated protein 55A-B; Short=RAP55A-B [Xenopus laevis]" . . . . . 86.32 471 97.56 97.56 4.03e-46 . . . . 7084 1 29 no TPG DAA19959 . "TPA: protein LSM14 homolog A [Bos taurus]" . . . . . 86.32 463 97.56 97.56 5.31e-46 . . . . 7084 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 . GLY . 7084 1 2 . HIS . 7084 1 3 . HIS . 7084 1 4 . HIS . 7084 1 5 . HIS . 7084 1 6 . HIS . 7084 1 7 . HIS . 7084 1 8 . LEU . 7084 1 9 . GLU . 7084 1 10 . ASP . 7084 1 11 . PRO . 7084 1 12 . SER . 7084 1 13 . GLY . 7084 1 14 . GLY . 7084 1 15 . THR . 7084 1 16 . PRO . 7084 1 17 . TYR . 7084 1 18 . ILE . 7084 1 19 . GLY . 7084 1 20 . SER . 7084 1 21 . LYS . 7084 1 22 . ILE . 7084 1 23 . SER . 7084 1 24 . LEU . 7084 1 25 . ILE . 7084 1 26 . SER . 7084 1 27 . LYS . 7084 1 28 . ALA . 7084 1 29 . GLU . 7084 1 30 . ILE . 7084 1 31 . ARG . 7084 1 32 . TYR . 7084 1 33 . GLU . 7084 1 34 . GLY . 7084 1 35 . ILE . 7084 1 36 . LEU . 7084 1 37 . TYR . 7084 1 38 . THR . 7084 1 39 . ILE . 7084 1 40 . ASP . 7084 1 41 . THR . 7084 1 42 . GLU . 7084 1 43 . ASN . 7084 1 44 . SER . 7084 1 45 . THR . 7084 1 46 . VAL . 7084 1 47 . ALA . 7084 1 48 . LEU . 7084 1 49 . ALA . 7084 1 50 . LYS . 7084 1 51 . VAL . 7084 1 52 . ARG . 7084 1 53 . SER . 7084 1 54 . PHE . 7084 1 55 . GLY . 7084 1 56 . THR . 7084 1 57 . GLU . 7084 1 58 . ASP . 7084 1 59 . ARG . 7084 1 60 . PRO . 7084 1 61 . THR . 7084 1 62 . ASP . 7084 1 63 . ARG . 7084 1 64 . PRO . 7084 1 65 . ILE . 7084 1 66 . ALA . 7084 1 67 . PRO . 7084 1 68 . ARG . 7084 1 69 . ASP . 7084 1 70 . GLU . 7084 1 71 . THR . 7084 1 72 . PHE . 7084 1 73 . GLU . 7084 1 74 . TYR . 7084 1 75 . ILE . 7084 1 76 . ILE . 7084 1 77 . PHE . 7084 1 78 . ARG . 7084 1 79 . GLY . 7084 1 80 . SER . 7084 1 81 . ASP . 7084 1 82 . ILE . 7084 1 83 . LYS . 7084 1 84 . ASP . 7084 1 85 . LEU . 7084 1 86 . THR . 7084 1 87 . VAL . 7084 1 88 . CYS . 7084 1 89 . GLU . 7084 1 90 . PRO . 7084 1 91 . PRO . 7084 1 92 . LYS . 7084 1 93 . PRO . 7084 1 94 . ILE . 7084 1 95 . MET . 7084 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 7084 1 . HIS 2 2 7084 1 . HIS 3 3 7084 1 . HIS 4 4 7084 1 . HIS 5 5 7084 1 . HIS 6 6 7084 1 . HIS 7 7 7084 1 . LEU 8 8 7084 1 . GLU 9 9 7084 1 . ASP 10 10 7084 1 . PRO 11 11 7084 1 . SER 12 12 7084 1 . GLY 13 13 7084 1 . GLY 14 14 7084 1 . THR 15 15 7084 1 . PRO 16 16 7084 1 . TYR 17 17 7084 1 . ILE 18 18 7084 1 . GLY 19 19 7084 1 . SER 20 20 7084 1 . LYS 21 21 7084 1 . ILE 22 22 7084 1 . SER 23 23 7084 1 . LEU 24 24 7084 1 . ILE 25 25 7084 1 . SER 26 26 7084 1 . LYS 27 27 7084 1 . ALA 28 28 7084 1 . GLU 29 29 7084 1 . ILE 30 30 7084 1 . ARG 31 31 7084 1 . TYR 32 32 7084 1 . GLU 33 33 7084 1 . GLY 34 34 7084 1 . ILE 35 35 7084 1 . LEU 36 36 7084 1 . TYR 37 37 7084 1 . THR 38 38 7084 1 . ILE 39 39 7084 1 . ASP 40 40 7084 1 . THR 41 41 7084 1 . GLU 42 42 7084 1 . ASN 43 43 7084 1 . SER 44 44 7084 1 . THR 45 45 7084 1 . VAL 46 46 7084 1 . ALA 47 47 7084 1 . LEU 48 48 7084 1 . ALA 49 49 7084 1 . LYS 50 50 7084 1 . VAL 51 51 7084 1 . ARG 52 52 7084 1 . SER 53 53 7084 1 . PHE 54 54 7084 1 . GLY 55 55 7084 1 . THR 56 56 7084 1 . GLU 57 57 7084 1 . ASP 58 58 7084 1 . ARG 59 59 7084 1 . PRO 60 60 7084 1 . THR 61 61 7084 1 . ASP 62 62 7084 1 . ARG 63 63 7084 1 . PRO 64 64 7084 1 . ILE 65 65 7084 1 . ALA 66 66 7084 1 . PRO 67 67 7084 1 . ARG 68 68 7084 1 . ASP 69 69 7084 1 . GLU 70 70 7084 1 . THR 71 71 7084 1 . PHE 72 72 7084 1 . GLU 73 73 7084 1 . TYR 74 74 7084 1 . ILE 75 75 7084 1 . ILE 76 76 7084 1 . PHE 77 77 7084 1 . ARG 78 78 7084 1 . GLY 79 79 7084 1 . SER 80 80 7084 1 . ASP 81 81 7084 1 . ILE 82 82 7084 1 . LYS 83 83 7084 1 . ASP 84 84 7084 1 . LEU 85 85 7084 1 . THR 86 86 7084 1 . VAL 87 87 7084 1 . CYS 88 88 7084 1 . GLU 89 89 7084 1 . PRO 90 90 7084 1 . PRO 91 91 7084 1 . LYS 92 92 7084 1 . PRO 93 93 7084 1 . ILE 94 94 7084 1 . MET 95 95 7084 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 7084 _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 $Protein . 7955 . no . 'Zebra Fish' . . Eukaryota Metazoa Danio rerio . . . . . . . . . . . . . . . . . . . . . 7084 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 7084 _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 $Protein . 'cell free synthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7084 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 7084 _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 Dr13312 . . . 1 $Protein . . . . . . . . . . 7084 1 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 7084 _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 0.1 pH 7084 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz_spectrometer _NMR_spectrometer.Entry_ID 7084 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model inova _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 7084 _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 1H15N_HSQC yes 1 . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $600MHz_spectrometer . . . . . . . . . . . . . . . . 7084 1 stop_ save_ save_NMR_spectrometer_expt_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spectrometer_expt_1 _NMR_spec_expt.Entry_ID 7084 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name 1H15N_HSQC _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 1 _NMR_spec_expt.NMR_spectrometer_label $600MHz_spectrometer _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 . loop_ _NMR_experiment_file.Name _NMR_experiment_file.Type _NMR_experiment_file.Directory_path _NMR_experiment_file.Byte_order _NMR_experiment_file.Bytes_per_data_point _NMR_experiment_file.File_header_size _NMR_experiment_file.Record_header_size _NMR_experiment_file.Record_trailer_size _NMR_experiment_file.Compression_algorithm _NMR_experiment_file.Details _NMR_experiment_file.Entry_ID _NMR_experiment_file.NMR_spec_expt_ID fid 'raw spectral data' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7084/timedomain_data/td_data_7084/JN11674_hsqc3.fid/' . . . . . . . 7084 1 . 'NMR Experiment Directory' 'http://www.bmrb.wisc.edu/data_library/timedomain/1/bmr7084/timedomain_data/td_data_7084/JN11674_hsqc3.fid/' . . . . . . . 7084 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 7084 _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 Water protons . . . . ppm 4.7 internal direct . . . . . . . . . . 7084 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7084 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _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 isotropic 7084 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 7 7 HIS HA H 1 4.612 0.0 . . . . . . 7 HIS HA . 7084 1 2 . 1 1 7 7 HIS HB2 H 1 3.08 0.0 . . . . . . 7 HIS HB1 . 7084 1 3 . 1 1 7 7 HIS HB3 H 1 3.08 0.0 . . . . . . 7 HIS HB2 . 7084 1 4 . 1 1 7 7 HIS CA C 13 56.47 0.0 . . . . . . 7 HIS CA . 7084 1 5 . 1 1 7 7 HIS CB C 13 30.011 0.0 . . . . . . 7 HIS CB . 7084 1 6 . 1 1 8 8 LEU H H 1 8.312 0.0 . . . . . . 8 LEU H . 7084 1 7 . 1 1 8 8 LEU HA H 1 4.265 0.0 . . . . . . 8 LEU HA . 7084 1 8 . 1 1 8 8 LEU HB2 H 1 1.49 0.0 . . . . . . 8 LEU HB1 . 7084 1 9 . 1 1 8 8 LEU HB3 H 1 1.49 0.0 . . . . . . 8 LEU HB2 . 7084 1 10 . 1 1 8 8 LEU HG H 1 1.381 0.0 . . . . . . 8 LEU HG . 7084 1 11 . 1 1 8 8 LEU HD11 H 1 0.718 0.0 . . . . . . 8 LEU HD1 . 7084 1 12 . 1 1 8 8 LEU HD12 H 1 0.718 0.0 . . . . . . 8 LEU HD1 . 7084 1 13 . 1 1 8 8 LEU HD13 H 1 0.718 0.0 . . . . . . 8 LEU HD1 . 7084 1 14 . 1 1 8 8 LEU HD21 H 1 0.684 0.0 . . . . . . 8 LEU HD2 . 7084 1 15 . 1 1 8 8 LEU HD22 H 1 0.684 0.0 . . . . . . 8 LEU HD2 . 7084 1 16 . 1 1 8 8 LEU HD23 H 1 0.684 0.0 . . . . . . 8 LEU HD2 . 7084 1 17 . 1 1 8 8 LEU CA C 13 54.977 0.0 . . . . . . 8 LEU CA . 7084 1 18 . 1 1 8 8 LEU CB C 13 42.09 0.0 . . . . . . 8 LEU CB . 7084 1 19 . 1 1 8 8 LEU CG C 13 26.93 0.0 . . . . . . 8 LEU CG . 7084 1 20 . 1 1 8 8 LEU CD1 C 13 25.186 0.0 . . . . . . 8 LEU CD1 . 7084 1 21 . 1 1 8 8 LEU CD2 C 13 23.561 0.0 . . . . . . 8 LEU CD2 . 7084 1 22 . 1 1 8 8 LEU N N 15 122.503 0.0 . . . . . . 8 LEU N . 7084 1 23 . 1 1 9 9 GLU H H 1 8.301 0.0 . . . . . . 9 GLU H . 7084 1 24 . 1 1 9 9 GLU HA H 1 4.226 0.0 . . . . . . 9 GLU HA . 7084 1 25 . 1 1 9 9 GLU HB2 H 1 1.956 0.0 . . . . . . 9 GLU HB1 . 7084 1 26 . 1 1 9 9 GLU HB3 H 1 1.956 0.0 . . . . . . 9 GLU HB2 . 7084 1 27 . 1 1 9 9 GLU HG2 H 1 2.212 0.0 . . . . . . 9 GLU HG1 . 7084 1 28 . 1 1 9 9 GLU HG3 H 1 2.212 0.0 . . . . . . 9 GLU HG2 . 7084 1 29 . 1 1 9 9 GLU CA C 13 56.803 0.0 . . . . . . 9 GLU CA . 7084 1 30 . 1 1 9 9 GLU CB C 13 30.476 0.0 . . . . . . 9 GLU CB . 7084 1 31 . 1 1 9 9 GLU CG C 13 36.256 0.0 . . . . . . 9 GLU CG . 7084 1 32 . 1 1 9 9 GLU N N 15 120.077 0.0 . . . . . . 9 GLU N . 7084 1 33 . 1 1 10 10 ASP H H 1 8.044 0.0 . . . . . . 10 ASP H . 7084 1 34 . 1 1 10 10 ASP HA H 1 4.908 0.0 . . . . . . 10 ASP HA . 7084 1 35 . 1 1 10 10 ASP HB2 H 1 2.867 0.0 . . . . . . 10 ASP HB1 . 7084 1 36 . 1 1 10 10 ASP CA C 13 52.03 0.0 . . . . . . 10 ASP CA . 7084 1 37 . 1 1 10 10 ASP CB C 13 42.3 0.0 . . . . . . 10 ASP CB . 7084 1 38 . 1 1 10 10 ASP N N 15 120.239 0.0 . . . . . . 10 ASP N . 7084 1 39 . 1 1 11 11 PRO HA H 1 4.309 0.0 . . . . . . 11 PRO HA . 7084 1 40 . 1 1 11 11 PRO HB2 H 1 2.25 0.0 . . . . . . 11 PRO HB1 . 7084 1 41 . 1 1 11 11 PRO HB3 H 1 1.875 0.0 . . . . . . 11 PRO HB2 . 7084 1 42 . 1 1 11 11 PRO HG2 H 1 2.036 0.0 . . . . . . 11 PRO HG1 . 7084 1 43 . 1 1 11 11 PRO HD2 H 1 3.812 0.0 . . . . . . 11 PRO HD1 . 7084 1 44 . 1 1 11 11 PRO HD3 H 1 3.812 0.0 . . . . . . 11 PRO HD2 . 7084 1 45 . 1 1 11 11 PRO C C 13 177.426 0.0 . . . . . . 11 PRO C . 7084 1 46 . 1 1 11 11 PRO CA C 13 64.53 0.0 . . . . . . 11 PRO CA . 7084 1 47 . 1 1 11 11 PRO CB C 13 32.028 0.0 . . . . . . 11 PRO CB . 7084 1 48 . 1 1 11 11 PRO CG C 13 27.344 0.0 . . . . . . 11 PRO CG . 7084 1 49 . 1 1 11 11 PRO CD C 13 50.801 0.0 . . . . . . 11 PRO CD . 7084 1 50 . 1 1 12 12 SER H H 1 8.455 0.0 . . . . . . 12 SER H . 7084 1 51 . 1 1 12 12 SER HA H 1 4.316 0.0 . . . . . . 12 SER HA . 7084 1 52 . 1 1 12 12 SER HB2 H 1 3.935 0.0 . . . . . . 12 SER HB1 . 7084 1 53 . 1 1 12 12 SER HB3 H 1 3.935 0.0 . . . . . . 12 SER HB2 . 7084 1 54 . 1 1 12 12 SER C C 13 175.613 0.0 . . . . . . 12 SER C . 7084 1 55 . 1 1 12 12 SER CA C 13 59.796 0.0 . . . . . . 12 SER CA . 7084 1 56 . 1 1 12 12 SER CB C 13 63.554 0.0 . . . . . . 12 SER CB . 7084 1 57 . 1 1 12 12 SER N N 15 114.106 0.0 . . . . . . 12 SER N . 7084 1 58 . 1 1 13 13 GLY H H 1 8.207 0.0 . . . . . . 13 GLY H . 7084 1 59 . 1 1 13 13 GLY HA2 H 1 4.035 0.0 . . . . . . 13 GLY HA1 . 7084 1 60 . 1 1 13 13 GLY HA3 H 1 4.035 0.0 . . . . . . 13 GLY HA2 . 7084 1 61 . 1 1 13 13 GLY C C 13 174.752 0.0 . . . . . . 13 GLY C . 7084 1 62 . 1 1 13 13 GLY CA C 13 45.583 0.0 . . . . . . 13 GLY CA . 7084 1 63 . 1 1 13 13 GLY N N 15 110.168 0.0 . . . . . . 13 GLY N . 7084 1 64 . 1 1 14 14 GLY H H 1 8.214 0.0 . . . . . . 14 GLY H . 7084 1 65 . 1 1 14 14 GLY HA2 H 1 4.208 0.0 . . . . . . 14 GLY HA1 . 7084 1 66 . 1 1 14 14 GLY HA3 H 1 3.31 0.0 . . . . . . 14 GLY HA2 . 7084 1 67 . 1 1 14 14 GLY C C 13 173.955 0.0 . . . . . . 14 GLY C . 7084 1 68 . 1 1 14 14 GLY CA C 13 45.394 0.0 . . . . . . 14 GLY CA . 7084 1 69 . 1 1 14 14 GLY N N 15 107.52 0.0 . . . . . . 14 GLY N . 7084 1 70 . 1 1 15 15 THR H H 1 8.687 0.0 . . . . . . 15 THR H . 7084 1 71 . 1 1 15 15 THR HA H 1 4.3 0.0 . . . . . . 15 THR HA . 7084 1 72 . 1 1 15 15 THR HB H 1 4.1 0.0 . . . . . . 15 THR HB . 7084 1 73 . 1 1 15 15 THR HG21 H 1 1.17 0.0 . . . . . . 15 THR HG2 . 7084 1 74 . 1 1 15 15 THR HG22 H 1 1.17 0.0 . . . . . . 15 THR HG2 . 7084 1 75 . 1 1 15 15 THR HG23 H 1 1.17 0.0 . . . . . . 15 THR HG2 . 7084 1 76 . 1 1 15 15 THR CA C 13 63.099 0.0 . . . . . . 15 THR CA . 7084 1 77 . 1 1 15 15 THR CB C 13 69.165 0.0 . . . . . . 15 THR CB . 7084 1 78 . 1 1 15 15 THR CG2 C 13 21.5 0.0 . . . . . . 15 THR CG2 . 7084 1 79 . 1 1 15 15 THR N N 15 111.467 0.0 . . . . . . 15 THR N . 7084 1 80 . 1 1 16 16 PRO HA H 1 4.425 0.0 . . . . . . 16 PRO HA . 7084 1 81 . 1 1 16 16 PRO HB2 H 1 2.271 0.0 . . . . . . 16 PRO HB1 . 7084 1 82 . 1 1 16 16 PRO HB3 H 1 1.937 0.0 . . . . . . 16 PRO HB2 . 7084 1 83 . 1 1 16 16 PRO HG2 H 1 2.0 0.0 . . . . . . 16 PRO HG1 . 7084 1 84 . 1 1 16 16 PRO HD2 H 1 3.815 0.0 . . . . . . 16 PRO HD1 . 7084 1 85 . 1 1 16 16 PRO HD3 H 1 3.633 0.0 . . . . . . 16 PRO HD2 . 7084 1 86 . 1 1 16 16 PRO C C 13 176.03 0.0 . . . . . . 16 PRO C . 7084 1 87 . 1 1 16 16 PRO CA C 13 63.336 0.0 . . . . . . 16 PRO CA . 7084 1 88 . 1 1 16 16 PRO CB C 13 31.836 0.0 . . . . . . 16 PRO CB . 7084 1 89 . 1 1 16 16 PRO CG C 13 27.353 0.0 . . . . . . 16 PRO CG . 7084 1 90 . 1 1 16 16 PRO CD C 13 50.463 0.0 . . . . . . 16 PRO CD . 7084 1 91 . 1 1 17 17 TYR H H 1 7.706 0.0 . . . . . . 17 TYR H . 7084 1 92 . 1 1 17 17 TYR CB C 13 39.83 0.0 . . . . . . 17 TYR CB . 7084 1 93 . 1 1 17 17 TYR N N 15 125.271 0.0 . . . . . . 17 TYR N . 7084 1 94 . 1 1 18 18 ILE HA H 1 3.561 0.0 . . . . . . 18 ILE HA . 7084 1 95 . 1 1 18 18 ILE HB H 1 1.861 0.0 . . . . . . 18 ILE HB . 7084 1 96 . 1 1 18 18 ILE HG12 H 1 1.27 0.0 . . . . . . 18 ILE HG11 . 7084 1 97 . 1 1 18 18 ILE HG13 H 1 1.6 0.0 . . . . . . 18 ILE HG12 . 7084 1 98 . 1 1 18 18 ILE HG21 H 1 0.928 0.0 . . . . . . 18 ILE HG2 . 7084 1 99 . 1 1 18 18 ILE HG22 H 1 0.928 0.0 . . . . . . 18 ILE HG2 . 7084 1 100 . 1 1 18 18 ILE HG23 H 1 0.928 0.0 . . . . . . 18 ILE HG2 . 7084 1 101 . 1 1 18 18 ILE HD11 H 1 0.782 0.0 . . . . . . 18 ILE HD1 . 7084 1 102 . 1 1 18 18 ILE HD12 H 1 0.782 0.0 . . . . . . 18 ILE HD1 . 7084 1 103 . 1 1 18 18 ILE HD13 H 1 0.782 0.0 . . . . . . 18 ILE HD1 . 7084 1 104 . 1 1 18 18 ILE C C 13 177.306 0.0 . . . . . . 18 ILE C . 7084 1 105 . 1 1 18 18 ILE CA C 13 63.358 0.0 . . . . . . 18 ILE CA . 7084 1 106 . 1 1 18 18 ILE CB C 13 36.402 0.0 . . . . . . 18 ILE CB . 7084 1 107 . 1 1 18 18 ILE CG1 C 13 28.02 0.0 . . . . . . 18 ILE CG1 . 7084 1 108 . 1 1 18 18 ILE CG2 C 13 17.36 0.0 . . . . . . 18 ILE CG2 . 7084 1 109 . 1 1 18 18 ILE CD1 C 13 11.476 0.0 . . . . . . 18 ILE CD1 . 7084 1 110 . 1 1 19 19 GLY H H 1 9.31 0.0 . . . . . . 19 GLY H . 7084 1 111 . 1 1 19 19 GLY HA2 H 1 3.583 0.0 . . . . . . 19 GLY HA1 . 7084 1 112 . 1 1 19 19 GLY HA3 H 1 4.559 0.0 . . . . . . 19 GLY HA2 . 7084 1 113 . 1 1 19 19 GLY C C 13 174.774 0.0 . . . . . . 19 GLY C . 7084 1 114 . 1 1 19 19 GLY CA C 13 44.846 0.0 . . . . . . 19 GLY CA . 7084 1 115 . 1 1 19 19 GLY N N 15 115.888 0.0 . . . . . . 19 GLY N . 7084 1 116 . 1 1 20 20 SER H H 1 8.307 0.0 . . . . . . 20 SER H . 7084 1 117 . 1 1 20 20 SER HA H 1 4.439 0.0 . . . . . . 20 SER HA . 7084 1 118 . 1 1 20 20 SER HB2 H 1 3.841 0.0 . . . . . . 20 SER HB1 . 7084 1 119 . 1 1 20 20 SER HB3 H 1 3.841 0.0 . . . . . . 20 SER HB2 . 7084 1 120 . 1 1 20 20 SER C C 13 172.525 0.0 . . . . . . 20 SER C . 7084 1 121 . 1 1 20 20 SER CA C 13 59.651 0.0 . . . . . . 20 SER CA . 7084 1 122 . 1 1 20 20 SER CB C 13 64.527 0.0 . . . . . . 20 SER CB . 7084 1 123 . 1 1 20 20 SER N N 15 117.263 0.0 . . . . . . 20 SER N . 7084 1 124 . 1 1 21 21 LYS H H 1 8.703 0.0 . . . . . . 21 LYS H . 7084 1 125 . 1 1 21 21 LYS HA H 1 4.691 0.0 . . . . . . 21 LYS HA . 7084 1 126 . 1 1 21 21 LYS HB2 H 1 1.768 0.0 . . . . . . 21 LYS HB1 . 7084 1 127 . 1 1 21 21 LYS HB3 H 1 1.768 0.0 . . . . . . 21 LYS HB2 . 7084 1 128 . 1 1 21 21 LYS HG2 H 1 1.374 0.0 . . . . . . 21 LYS HG1 . 7084 1 129 . 1 1 21 21 LYS HG3 H 1 1.374 0.0 . . . . . . 21 LYS HG2 . 7084 1 130 . 1 1 21 21 LYS HD2 H 1 1.67 0.0 . . . . . . 21 LYS HD1 . 7084 1 131 . 1 1 21 21 LYS HE2 H 1 2.98 0.0 . . . . . . 21 LYS HE1 . 7084 1 132 . 1 1 21 21 LYS C C 13 175.321 0.0 . . . . . . 21 LYS C . 7084 1 133 . 1 1 21 21 LYS CA C 13 56.778 0.0 . . . . . . 21 LYS CA . 7084 1 134 . 1 1 21 21 LYS CB C 13 32.843 0.0 . . . . . . 21 LYS CB . 7084 1 135 . 1 1 21 21 LYS CG C 13 25.411 0.0 . . . . . . 21 LYS CG . 7084 1 136 . 1 1 21 21 LYS CD C 13 29.311 0.0 . . . . . . 21 LYS CD . 7084 1 137 . 1 1 21 21 LYS CE C 13 42.33 0.0 . . . . . . 21 LYS CE . 7084 1 138 . 1 1 21 21 LYS N N 15 124.119 0.0 . . . . . . 21 LYS N . 7084 1 139 . 1 1 22 22 ILE H H 1 9.249 0.0 . . . . . . 22 ILE H . 7084 1 140 . 1 1 22 22 ILE HA H 1 4.99 0.0 . . . . . . 22 ILE HA . 7084 1 141 . 1 1 22 22 ILE HB H 1 1.887 0.0 . . . . . . 22 ILE HB . 7084 1 142 . 1 1 22 22 ILE HG12 H 1 1.2 0.0 . . . . . . 22 ILE HG11 . 7084 1 143 . 1 1 22 22 ILE HG13 H 1 1.43 0.0 . . . . . . 22 ILE HG12 . 7084 1 144 . 1 1 22 22 ILE HG21 H 1 0.798 0.0 . . . . . . 22 ILE HG2 . 7084 1 145 . 1 1 22 22 ILE HG22 H 1 0.798 0.0 . . . . . . 22 ILE HG2 . 7084 1 146 . 1 1 22 22 ILE HG23 H 1 0.798 0.0 . . . . . . 22 ILE HG2 . 7084 1 147 . 1 1 22 22 ILE HD11 H 1 0.85 0.0 . . . . . . 22 ILE HD1 . 7084 1 148 . 1 1 22 22 ILE HD12 H 1 0.85 0.0 . . . . . . 22 ILE HD1 . 7084 1 149 . 1 1 22 22 ILE HD13 H 1 0.85 0.0 . . . . . . 22 ILE HD1 . 7084 1 150 . 1 1 22 22 ILE C C 13 174.369 0.0 . . . . . . 22 ILE C . 7084 1 151 . 1 1 22 22 ILE CA C 13 57.877 0.0 . . . . . . 22 ILE CA . 7084 1 152 . 1 1 22 22 ILE CB C 13 41.091 0.0 . . . . . . 22 ILE CB . 7084 1 153 . 1 1 22 22 ILE CG1 C 13 27.393 0.0 . . . . . . 22 ILE CG1 . 7084 1 154 . 1 1 22 22 ILE CG2 C 13 19.183 0.0 . . . . . . 22 ILE CG2 . 7084 1 155 . 1 1 22 22 ILE CD1 C 13 13.089 0.0 . . . . . . 22 ILE CD1 . 7084 1 156 . 1 1 22 22 ILE N N 15 125.573 0.0 . . . . . . 22 ILE N . 7084 1 157 . 1 1 23 23 SER H H 1 8.641 0.0 . . . . . . 23 SER H . 7084 1 158 . 1 1 23 23 SER HA H 1 5.521 0.0 . . . . . . 23 SER HA . 7084 1 159 . 1 1 23 23 SER HB2 H 1 3.63 0.0 . . . . . . 23 SER HB1 . 7084 1 160 . 1 1 23 23 SER HB3 H 1 3.482 0.0 . . . . . . 23 SER HB2 . 7084 1 161 . 1 1 23 23 SER C C 13 173.444 0.0 . . . . . . 23 SER C . 7084 1 162 . 1 1 23 23 SER CA C 13 56.028 0.0 . . . . . . 23 SER CA . 7084 1 163 . 1 1 23 23 SER CB C 13 64.089 0.0 . . . . . . 23 SER CB . 7084 1 164 . 1 1 23 23 SER N N 15 117.426 0.0 . . . . . . 23 SER N . 7084 1 165 . 1 1 24 24 LEU H H 1 9.435 0.0 . . . . . . 24 LEU H . 7084 1 166 . 1 1 24 24 LEU HA H 1 5.14 0.0 . . . . . . 24 LEU HA . 7084 1 167 . 1 1 24 24 LEU HB2 H 1 1.326 0.0 . . . . . . 24 LEU HB1 . 7084 1 168 . 1 1 24 24 LEU HB3 H 1 1.326 0.0 . . . . . . 24 LEU HB2 . 7084 1 169 . 1 1 24 24 LEU HG H 1 1.74 0.0 . . . . . . 24 LEU HG . 7084 1 170 . 1 1 24 24 LEU HD11 H 1 0.052 0.0 . . . . . . 24 LEU HD1 . 7084 1 171 . 1 1 24 24 LEU HD12 H 1 0.052 0.0 . . . . . . 24 LEU HD1 . 7084 1 172 . 1 1 24 24 LEU HD13 H 1 0.052 0.0 . . . . . . 24 LEU HD1 . 7084 1 173 . 1 1 24 24 LEU HD21 H 1 0.02 0.0 . . . . . . 24 LEU HD2 . 7084 1 174 . 1 1 24 24 LEU HD22 H 1 0.02 0.0 . . . . . . 24 LEU HD2 . 7084 1 175 . 1 1 24 24 LEU HD23 H 1 0.02 0.0 . . . . . . 24 LEU HD2 . 7084 1 176 . 1 1 24 24 LEU C C 13 174.592 0.0 . . . . . . 24 LEU C . 7084 1 177 . 1 1 24 24 LEU CA C 13 54.164 0.0 . . . . . . 24 LEU CA . 7084 1 178 . 1 1 24 24 LEU CB C 13 46.791 0.0 . . . . . . 24 LEU CB . 7084 1 179 . 1 1 24 24 LEU CG C 13 32.77 0.0 . . . . . . 24 LEU CG . 7084 1 180 . 1 1 24 24 LEU CD1 C 13 26.21 0.0 . . . . . . 24 LEU CD1 . 7084 1 181 . 1 1 24 24 LEU CD2 C 13 24.084 0.0 . . . . . . 24 LEU CD2 . 7084 1 182 . 1 1 24 24 LEU N N 15 131.51 0.0 . . . . . . 24 LEU N . 7084 1 183 . 1 1 25 25 ILE H H 1 8.897 0.0 . . . . . . 25 ILE H . 7084 1 184 . 1 1 25 25 ILE HA H 1 5.147 0.0 . . . . . . 25 ILE HA . 7084 1 185 . 1 1 25 25 ILE HB H 1 1.568 0.0 . . . . . . 25 ILE HB . 7084 1 186 . 1 1 25 25 ILE HG12 H 1 0.63 0.0 . . . . . . 25 ILE HG11 . 7084 1 187 . 1 1 25 25 ILE HG21 H 1 0.889 0.0 . . . . . . 25 ILE HG2 . 7084 1 188 . 1 1 25 25 ILE HG22 H 1 0.889 0.0 . . . . . . 25 ILE HG2 . 7084 1 189 . 1 1 25 25 ILE HG23 H 1 0.889 0.0 . . . . . . 25 ILE HG2 . 7084 1 190 . 1 1 25 25 ILE HD11 H 1 0.77 0.0 . . . . . . 25 ILE HD1 . 7084 1 191 . 1 1 25 25 ILE HD12 H 1 0.77 0.0 . . . . . . 25 ILE HD1 . 7084 1 192 . 1 1 25 25 ILE HD13 H 1 0.77 0.0 . . . . . . 25 ILE HD1 . 7084 1 193 . 1 1 25 25 ILE C C 13 176.399 0.0 . . . . . . 25 ILE C . 7084 1 194 . 1 1 25 25 ILE CA C 13 59.688 0.0 . . . . . . 25 ILE CA . 7084 1 195 . 1 1 25 25 ILE CB C 13 39.5 0.0 . . . . . . 25 ILE CB . 7084 1 196 . 1 1 25 25 ILE CG1 C 13 28.281 0.0 . . . . . . 25 ILE CG1 . 7084 1 197 . 1 1 25 25 ILE CG2 C 13 17.052 0.0 . . . . . . 25 ILE CG2 . 7084 1 198 . 1 1 25 25 ILE CD1 C 13 12.784 0.0 . . . . . . 25 ILE CD1 . 7084 1 199 . 1 1 25 25 ILE N N 15 124.686 0.0 . . . . . . 25 ILE N . 7084 1 200 . 1 1 26 26 SER H H 1 9.503 0.0 . . . . . . 26 SER H . 7084 1 201 . 1 1 26 26 SER HA H 1 5.229 0.0 . . . . . . 26 SER HA . 7084 1 202 . 1 1 26 26 SER HB2 H 1 4.02 0.0 . . . . . . 26 SER HB1 . 7084 1 203 . 1 1 26 26 SER HB3 H 1 4.886 0.0 . . . . . . 26 SER HB2 . 7084 1 204 . 1 1 26 26 SER C C 13 176.228 0.0 . . . . . . 26 SER C . 7084 1 205 . 1 1 26 26 SER CA C 13 56.869 0.0 . . . . . . 26 SER CA . 7084 1 206 . 1 1 26 26 SER CB C 13 66.993 0.0 . . . . . . 26 SER CB . 7084 1 207 . 1 1 26 26 SER N N 15 125.514 0.0 . . . . . . 26 SER N . 7084 1 208 . 1 1 27 27 LYS H H 1 8.518 0.0 . . . . . . 27 LYS H . 7084 1 209 . 1 1 27 27 LYS HA H 1 4.038 0.0 . . . . . . 27 LYS HA . 7084 1 210 . 1 1 27 27 LYS HB2 H 1 1.984 0.0 . . . . . . 27 LYS HB1 . 7084 1 211 . 1 1 27 27 LYS HB3 H 1 1.984 0.0 . . . . . . 27 LYS HB2 . 7084 1 212 . 1 1 27 27 LYS HG2 H 1 1.301 0.0 . . . . . . 27 LYS HG1 . 7084 1 213 . 1 1 27 27 LYS HG3 H 1 1.5 0.0 . . . . . . 27 LYS HG2 . 7084 1 214 . 1 1 27 27 LYS HD2 H 1 1.5 0.0 . . . . . . 27 LYS HD1 . 7084 1 215 . 1 1 27 27 LYS HE2 H 1 2.949 0.0 . . . . . . 27 LYS HE1 . 7084 1 216 . 1 1 27 27 LYS C C 13 176.839 0.0 . . . . . . 27 LYS C . 7084 1 217 . 1 1 27 27 LYS CA C 13 58.833 0.0 . . . . . . 27 LYS CA . 7084 1 218 . 1 1 27 27 LYS CB C 13 31.838 0.0 . . . . . . 27 LYS CB . 7084 1 219 . 1 1 27 27 LYS CG C 13 26.46 0.0 . . . . . . 27 LYS CG . 7084 1 220 . 1 1 27 27 LYS CD C 13 29.088 0.0 . . . . . . 27 LYS CD . 7084 1 221 . 1 1 27 27 LYS CE C 13 42.451 0.0 . . . . . . 27 LYS CE . 7084 1 222 . 1 1 27 27 LYS N N 15 119.323 0.0 . . . . . . 27 LYS N . 7084 1 223 . 1 1 28 28 ALA H H 1 7.753 0.0 . . . . . . 28 ALA H . 7084 1 224 . 1 1 28 28 ALA HA H 1 4.485 0.0 . . . . . . 28 ALA HA . 7084 1 225 . 1 1 28 28 ALA HB1 H 1 1.41 0.0 . . . . . . 28 ALA HB . 7084 1 226 . 1 1 28 28 ALA HB2 H 1 1.41 0.0 . . . . . . 28 ALA HB . 7084 1 227 . 1 1 28 28 ALA HB3 H 1 1.41 0.0 . . . . . . 28 ALA HB . 7084 1 228 . 1 1 28 28 ALA C C 13 175.648 0.0 . . . . . . 28 ALA C . 7084 1 229 . 1 1 28 28 ALA CA C 13 52.129 0.0 . . . . . . 28 ALA CA . 7084 1 230 . 1 1 28 28 ALA CB C 13 18.73 0.0 . . . . . . 28 ALA CB . 7084 1 231 . 1 1 28 28 ALA N N 15 121.419 0.0 . . . . . . 28 ALA N . 7084 1 232 . 1 1 29 29 GLU H H 1 8.189 0.0 . . . . . . 29 GLU H . 7084 1 233 . 1 1 29 29 GLU HA H 1 4.194 0.0 . . . . . . 29 GLU HA . 7084 1 234 . 1 1 29 29 GLU HB2 H 1 2.255 0.0 . . . . . . 29 GLU HB1 . 7084 1 235 . 1 1 29 29 GLU HB3 H 1 2.255 0.0 . . . . . . 29 GLU HB2 . 7084 1 236 . 1 1 29 29 GLU HG2 H 1 2.012 0.0 . . . . . . 29 GLU HG1 . 7084 1 237 . 1 1 29 29 GLU HG3 H 1 2.012 0.0 . . . . . . 29 GLU HG2 . 7084 1 238 . 1 1 29 29 GLU C C 13 176.196 0.0 . . . . . . 29 GLU C . 7084 1 239 . 1 1 29 29 GLU CA C 13 56.598 0.0 . . . . . . 29 GLU CA . 7084 1 240 . 1 1 29 29 GLU CB C 13 24.811 0.0 . . . . . . 29 GLU CB . 7084 1 241 . 1 1 29 29 GLU CG C 13 33.088 0.0 . . . . . . 29 GLU CG . 7084 1 242 . 1 1 29 29 GLU N N 15 108.952 0.0 . . . . . . 29 GLU N . 7084 1 243 . 1 1 30 30 ILE H H 1 6.909 0.0 . . . . . . 30 ILE H . 7084 1 244 . 1 1 30 30 ILE HA H 1 3.703 0.0 . . . . . . 30 ILE HA . 7084 1 245 . 1 1 30 30 ILE HB H 1 1.617 0.0 . . . . . . 30 ILE HB . 7084 1 246 . 1 1 30 30 ILE HG12 H 1 0.474 0.0 . . . . . . 30 ILE HG12 . 7084 1 247 . 1 1 30 30 ILE HG21 H 1 0.227 0.0 . . . . . . 30 ILE HG2 . 7084 1 248 . 1 1 30 30 ILE HG22 H 1 0.227 0.0 . . . . . . 30 ILE HG2 . 7084 1 249 . 1 1 30 30 ILE HG23 H 1 0.227 0.0 . . . . . . 30 ILE HG2 . 7084 1 250 . 1 1 30 30 ILE C C 13 173.875 0.0 . . . . . . 30 ILE C . 7084 1 251 . 1 1 30 30 ILE CA C 13 60.604 0.0 . . . . . . 30 ILE CA . 7084 1 252 . 1 1 30 30 ILE CB C 13 38.357 0.0 . . . . . . 30 ILE CB . 7084 1 253 . 1 1 30 30 ILE CG1 C 13 28.99 0.0 . . . . . . 30 ILE CG1 . 7084 1 254 . 1 1 30 30 ILE CG2 C 13 18.33 0.0 . . . . . . 30 ILE CG2 . 7084 1 255 . 1 1 30 30 ILE CD1 C 13 13.3 0.0 . . . . . . 30 ILE CD1 . 7084 1 256 . 1 1 30 30 ILE N N 15 121.093 0.0 . . . . . . 30 ILE N . 7084 1 257 . 1 1 31 31 ARG H H 1 7.569 0.0 . . . . . . 31 ARG H . 7084 1 258 . 1 1 31 31 ARG HA H 1 5.552 0.0 . . . . . . 31 ARG HA . 7084 1 259 . 1 1 31 31 ARG HB2 H 1 1.825 0.0 . . . . . . 31 ARG HB1 . 7084 1 260 . 1 1 31 31 ARG HB3 H 1 1.436 0.0 . . . . . . 31 ARG HB2 . 7084 1 261 . 1 1 31 31 ARG HG2 H 1 1.364 0.0 . . . . . . 31 ARG HG1 . 7084 1 262 . 1 1 31 31 ARG HG3 H 1 1.364 0.0 . . . . . . 31 ARG HG2 . 7084 1 263 . 1 1 31 31 ARG HD2 H 1 3.196 0.0 . . . . . . 31 ARG HD1 . 7084 1 264 . 1 1 31 31 ARG HD3 H 1 2.646 0.0 . . . . . . 31 ARG HD2 . 7084 1 265 . 1 1 31 31 ARG C C 13 173.407 0.0 . . . . . . 31 ARG C . 7084 1 266 . 1 1 31 31 ARG CA C 13 54.204 0.0 . . . . . . 31 ARG CA . 7084 1 267 . 1 1 31 31 ARG CB C 13 35.335 0.0 . . . . . . 31 ARG CB . 7084 1 268 . 1 1 31 31 ARG CG C 13 28.654 0.0 . . . . . . 31 ARG CG . 7084 1 269 . 1 1 31 31 ARG CD C 13 43.309 0.0 . . . . . . 31 ARG CD . 7084 1 270 . 1 1 31 31 ARG N N 15 126.822 0.0 . . . . . . 31 ARG N . 7084 1 271 . 1 1 32 32 TYR H H 1 9.687 0.0 . . . . . . 32 TYR H . 7084 1 272 . 1 1 32 32 TYR HA H 1 5.825 0.0 . . . . . . 32 TYR HA . 7084 1 273 . 1 1 32 32 TYR HB2 H 1 2.789 0.0 . . . . . . 32 TYR HB1 . 7084 1 274 . 1 1 32 32 TYR HB3 H 1 2.566 0.0 . . . . . . 32 TYR HB2 . 7084 1 275 . 1 1 32 32 TYR HD1 H 1 6.951 0.0 . . . . . . 32 TYR HD1 . 7084 1 276 . 1 1 32 32 TYR HD2 H 1 6.951 0.0 . . . . . . 32 TYR HD2 . 7084 1 277 . 1 1 32 32 TYR C C 13 175.904 0.0 . . . . . . 32 TYR C . 7084 1 278 . 1 1 32 32 TYR CA C 13 55.891 0.0 . . . . . . 32 TYR CA . 7084 1 279 . 1 1 32 32 TYR CB C 13 41.644 0.0 . . . . . . 32 TYR CB . 7084 1 280 . 1 1 32 32 TYR N N 15 125.201 0.0 . . . . . . 32 TYR N . 7084 1 281 . 1 1 33 33 GLU H H 1 9.035 0.0 . . . . . . 33 GLU H . 7084 1 282 . 1 1 33 33 GLU HA H 1 5.917 0.0 . . . . . . 33 GLU HA . 7084 1 283 . 1 1 33 33 GLU HB2 H 1 2.139 0.0 . . . . . . 33 GLU HB1 . 7084 1 284 . 1 1 33 33 GLU HB3 H 1 2.139 0.0 . . . . . . 33 GLU HB2 . 7084 1 285 . 1 1 33 33 GLU HG2 H 1 2.315 0.0 . . . . . . 33 GLU HG1 . 7084 1 286 . 1 1 33 33 GLU HG3 H 1 2.315 0.0 . . . . . . 33 GLU HG2 . 7084 1 287 . 1 1 33 33 GLU C C 13 176.651 0.0 . . . . . . 33 GLU C . 7084 1 288 . 1 1 33 33 GLU CA C 13 54.316 0.0 . . . . . . 33 GLU CA . 7084 1 289 . 1 1 33 33 GLU CB C 13 34.549 0.0 . . . . . . 33 GLU CB . 7084 1 290 . 1 1 33 33 GLU CG C 13 36.737 0.0 . . . . . . 33 GLU CG . 7084 1 291 . 1 1 33 33 GLU N N 15 118.131 0.0 . . . . . . 33 GLU N . 7084 1 292 . 1 1 34 34 GLY H H 1 8.598 0.0 . . . . . . 34 GLY H . 7084 1 293 . 1 1 34 34 GLY HA2 H 1 4.644 0.0 . . . . . . 34 GLY HA1 . 7084 1 294 . 1 1 34 34 GLY HA3 H 1 3.796 0.0 . . . . . . 34 GLY HA2 . 7084 1 295 . 1 1 34 34 GLY C C 13 170.195 0.0 . . . . . . 34 GLY C . 7084 1 296 . 1 1 34 34 GLY CA C 13 45.874 0.0 . . . . . . 34 GLY CA . 7084 1 297 . 1 1 34 34 GLY N N 15 108.533 0.0 . . . . . . 34 GLY N . 7084 1 298 . 1 1 35 35 ILE H H 1 9.303 0.0 . . . . . . 35 ILE H . 7084 1 299 . 1 1 35 35 ILE HA H 1 4.689 0.0 . . . . . . 35 ILE HA . 7084 1 300 . 1 1 35 35 ILE HB H 1 1.888 0.0 . . . . . . 35 ILE HB . 7084 1 301 . 1 1 35 35 ILE HG12 H 1 1.474 0.0 . . . . . . 35 ILE HG12 . 7084 1 302 . 1 1 35 35 ILE HG21 H 1 0.84 0.0 . . . . . . 35 ILE HG2 . 7084 1 303 . 1 1 35 35 ILE HG22 H 1 0.84 0.0 . . . . . . 35 ILE HG2 . 7084 1 304 . 1 1 35 35 ILE HG23 H 1 0.84 0.0 . . . . . . 35 ILE HG2 . 7084 1 305 . 1 1 35 35 ILE HD11 H 1 0.78 0.0 . . . . . . 35 ILE HD1 . 7084 1 306 . 1 1 35 35 ILE HD12 H 1 0.78 0.0 . . . . . . 35 ILE HD1 . 7084 1 307 . 1 1 35 35 ILE HD13 H 1 0.78 0.0 . . . . . . 35 ILE HD1 . 7084 1 308 . 1 1 35 35 ILE C C 13 177.387 0.0 . . . . . . 35 ILE C . 7084 1 309 . 1 1 35 35 ILE CA C 13 58.755 0.0 . . . . . . 35 ILE CA . 7084 1 310 . 1 1 35 35 ILE CB C 13 38.886 0.0 . . . . . . 35 ILE CB . 7084 1 311 . 1 1 35 35 ILE CG1 C 13 26.72 0.0 . . . . . . 35 ILE CG1 . 7084 1 312 . 1 1 35 35 ILE CG2 C 13 17.03 0.0 . . . . . . 35 ILE CG2 . 7084 1 313 . 1 1 35 35 ILE CD1 C 13 11.07 0.0 . . . . . . 35 ILE CD1 . 7084 1 314 . 1 1 35 35 ILE N N 15 120.874 0.0 . . . . . . 35 ILE N . 7084 1 315 . 1 1 36 36 LEU H H 1 9.064 0.0 . . . . . . 36 LEU H . 7084 1 316 . 1 1 36 36 LEU HA H 1 4.366 0.0 . . . . . . 36 LEU HA . 7084 1 317 . 1 1 36 36 LEU HB2 H 1 2.234 0.0 . . . . . . 36 LEU HB1 . 7084 1 318 . 1 1 36 36 LEU HB3 H 1 1.355 0.0 . . . . . . 36 LEU HB2 . 7084 1 319 . 1 1 36 36 LEU HD11 H 1 0.783 0.0 . . . . . . 36 LEU HD1 . 7084 1 320 . 1 1 36 36 LEU HD12 H 1 0.783 0.0 . . . . . . 36 LEU HD1 . 7084 1 321 . 1 1 36 36 LEU HD13 H 1 0.783 0.0 . . . . . . 36 LEU HD1 . 7084 1 322 . 1 1 36 36 LEU HD21 H 1 0.73 0.0 . . . . . . 36 LEU HD2 . 7084 1 323 . 1 1 36 36 LEU HD22 H 1 0.73 0.0 . . . . . . 36 LEU HD2 . 7084 1 324 . 1 1 36 36 LEU HD23 H 1 0.73 0.0 . . . . . . 36 LEU HD2 . 7084 1 325 . 1 1 36 36 LEU C C 13 174.976 0.0 . . . . . . 36 LEU C . 7084 1 326 . 1 1 36 36 LEU CA C 13 56.742 0.0 . . . . . . 36 LEU CA . 7084 1 327 . 1 1 36 36 LEU CB C 13 40.951 0.0 . . . . . . 36 LEU CB . 7084 1 328 . 1 1 36 36 LEU CD1 C 13 23.875 0.0 . . . . . . 36 LEU CD1 . 7084 1 329 . 1 1 36 36 LEU CD2 C 13 26.239 0.0 . . . . . . 36 LEU CD2 . 7084 1 330 . 1 1 36 36 LEU N N 15 128.032 0.0 . . . . . . 36 LEU N . 7084 1 331 . 1 1 37 37 TYR H H 1 9.245 0.0 . . . . . . 37 TYR H . 7084 1 332 . 1 1 37 37 TYR HA H 1 4.825 0.0 . . . . . . 37 TYR HA . 7084 1 333 . 1 1 37 37 TYR HB2 H 1 3.02 0.0 . . . . . . 37 TYR HB1 . 7084 1 334 . 1 1 37 37 TYR HB3 H 1 2.894 0.0 . . . . . . 37 TYR HB2 . 7084 1 335 . 1 1 37 37 TYR HD1 H 1 7.082 0.0 . . . . . . 37 TYR HD1 . 7084 1 336 . 1 1 37 37 TYR HD2 H 1 7.082 0.0 . . . . . . 37 TYR HD2 . 7084 1 337 . 1 1 37 37 TYR C C 13 174.957 0.0 . . . . . . 37 TYR C . 7084 1 338 . 1 1 37 37 TYR CA C 13 60.029 0.0 . . . . . . 37 TYR CA . 7084 1 339 . 1 1 37 37 TYR CB C 13 41.133 0.0 . . . . . . 37 TYR CB . 7084 1 340 . 1 1 37 37 TYR N N 15 133.05 0.0 . . . . . . 37 TYR N . 7084 1 341 . 1 1 38 38 THR H H 1 7.657 0.0 . . . . . . 38 THR H . 7084 1 342 . 1 1 38 38 THR HA H 1 4.409 0.0 . . . . . . 38 THR HA . 7084 1 343 . 1 1 38 38 THR HB H 1 3.983 0.0 . . . . . . 38 THR HB . 7084 1 344 . 1 1 38 38 THR HG21 H 1 1.24 0.0 . . . . . . 38 THR HG2 . 7084 1 345 . 1 1 38 38 THR HG22 H 1 1.24 0.0 . . . . . . 38 THR HG2 . 7084 1 346 . 1 1 38 38 THR HG23 H 1 1.24 0.0 . . . . . . 38 THR HG2 . 7084 1 347 . 1 1 38 38 THR C C 13 172.233 0.0 . . . . . . 38 THR C . 7084 1 348 . 1 1 38 38 THR CA C 13 61.655 0.0 . . . . . . 38 THR CA . 7084 1 349 . 1 1 38 38 THR CB C 13 71.778 0.0 . . . . . . 38 THR CB . 7084 1 350 . 1 1 38 38 THR CG2 C 13 21.429 0.0 . . . . . . 38 THR CG2 . 7084 1 351 . 1 1 38 38 THR N N 15 109.074 0.0 . . . . . . 38 THR N . 7084 1 352 . 1 1 39 39 ILE H H 1 8.394 0.0 . . . . . . 39 ILE H . 7084 1 353 . 1 1 39 39 ILE HA H 1 4.516 0.0 . . . . . . 39 ILE HA . 7084 1 354 . 1 1 39 39 ILE HB H 1 1.727 0.0 . . . . . . 39 ILE HB . 7084 1 355 . 1 1 39 39 ILE HG12 H 1 0.98 0.0 . . . . . . 39 ILE HG12 . 7084 1 356 . 1 1 39 39 ILE HG21 H 1 0.92 0.0 . . . . . . 39 ILE HG2 . 7084 1 357 . 1 1 39 39 ILE HG22 H 1 0.92 0.0 . . . . . . 39 ILE HG2 . 7084 1 358 . 1 1 39 39 ILE HG23 H 1 0.92 0.0 . . . . . . 39 ILE HG2 . 7084 1 359 . 1 1 39 39 ILE HD11 H 1 0.854 0.0 . . . . . . 39 ILE HD1 . 7084 1 360 . 1 1 39 39 ILE HD12 H 1 0.854 0.0 . . . . . . 39 ILE HD1 . 7084 1 361 . 1 1 39 39 ILE HD13 H 1 0.854 0.0 . . . . . . 39 ILE HD1 . 7084 1 362 . 1 1 39 39 ILE C C 13 173.745 0.0 . . . . . . 39 ILE C . 7084 1 363 . 1 1 39 39 ILE CA C 13 60.924 0.0 . . . . . . 39 ILE CA . 7084 1 364 . 1 1 39 39 ILE CB C 13 41.174 0.0 . . . . . . 39 ILE CB . 7084 1 365 . 1 1 39 39 ILE CG1 C 13 28.086 0.0 . . . . . . 39 ILE CG1 . 7084 1 366 . 1 1 39 39 ILE CG2 C 13 16.736 0.0 . . . . . . 39 ILE CG2 . 7084 1 367 . 1 1 39 39 ILE CD1 C 13 13.853 0.0 . . . . . . 39 ILE CD1 . 7084 1 368 . 1 1 39 39 ILE N N 15 123.003 0.0 . . . . . . 39 ILE N . 7084 1 369 . 1 1 40 40 ASP H H 1 8.489 0.0 . . . . . . 40 ASP H . 7084 1 370 . 1 1 40 40 ASP HA H 1 4.982 0.0 . . . . . . 40 ASP HA . 7084 1 371 . 1 1 40 40 ASP HB2 H 1 3.307 0.0 . . . . . . 40 ASP HB1 . 7084 1 372 . 1 1 40 40 ASP HB3 H 1 2.373 0.0 . . . . . . 40 ASP HB2 . 7084 1 373 . 1 1 40 40 ASP C C 13 177.418 0.0 . . . . . . 40 ASP C . 7084 1 374 . 1 1 40 40 ASP CA C 13 52.07 0.0 . . . . . . 40 ASP CA . 7084 1 375 . 1 1 40 40 ASP CB C 13 41.494 0.0 . . . . . . 40 ASP CB . 7084 1 376 . 1 1 40 40 ASP N N 15 127.383 0.0 . . . . . . 40 ASP N . 7084 1 377 . 1 1 41 41 THR H H 1 8.734 0.0 . . . . . . 41 THR H . 7084 1 378 . 1 1 41 41 THR HA H 1 4.309 0.0 . . . . . . 41 THR HA . 7084 1 379 . 1 1 41 41 THR HB H 1 4.131 0.0 . . . . . . 41 THR HB . 7084 1 380 . 1 1 41 41 THR HG21 H 1 1.24 0.0 . . . . . . 41 THR HG2 . 7084 1 381 . 1 1 41 41 THR HG22 H 1 1.24 0.0 . . . . . . 41 THR HG2 . 7084 1 382 . 1 1 41 41 THR HG23 H 1 1.24 0.0 . . . . . . 41 THR HG2 . 7084 1 383 . 1 1 41 41 THR C C 13 176.525 0.0 . . . . . . 41 THR C . 7084 1 384 . 1 1 41 41 THR CA C 13 64.287 0.0 . . . . . . 41 THR CA . 7084 1 385 . 1 1 41 41 THR CB C 13 68.425 0.0 . . . . . . 41 THR CB . 7084 1 386 . 1 1 41 41 THR CG2 C 13 22.194 0.0 . . . . . . 41 THR CG2 . 7084 1 387 . 1 1 41 41 THR N N 15 117.378 0.0 . . . . . . 41 THR N . 7084 1 388 . 1 1 42 42 GLU H H 1 8.415 0.0 . . . . . . 42 GLU H . 7084 1 389 . 1 1 42 42 GLU HA H 1 4.18 0.0 . . . . . . 42 GLU HA . 7084 1 390 . 1 1 42 42 GLU HB2 H 1 2.077 0.0 . . . . . . 42 GLU HB1 . 7084 1 391 . 1 1 42 42 GLU HB3 H 1 2.077 0.0 . . . . . . 42 GLU HB2 . 7084 1 392 . 1 1 42 42 GLU HG2 H 1 2.235 0.0 . . . . . . 42 GLU HG1 . 7084 1 393 . 1 1 42 42 GLU HG3 H 1 2.235 0.0 . . . . . . 42 GLU HG2 . 7084 1 394 . 1 1 42 42 GLU C C 13 177.84 0.0 . . . . . . 42 GLU C . 7084 1 395 . 1 1 42 42 GLU CA C 13 58.957 0.0 . . . . . . 42 GLU CA . 7084 1 396 . 1 1 42 42 GLU CB C 13 29.586 0.0 . . . . . . 42 GLU CB . 7084 1 397 . 1 1 42 42 GLU CG C 13 36.301 0.0 . . . . . . 42 GLU CG . 7084 1 398 . 1 1 42 42 GLU N N 15 123.375 0.0 . . . . . . 42 GLU N . 7084 1 399 . 1 1 43 43 ASN H H 1 7.894 0.0 . . . . . . 43 ASN H . 7084 1 400 . 1 1 43 43 ASN HA H 1 4.787 0.0 . . . . . . 43 ASN HA . 7084 1 401 . 1 1 43 43 ASN HB2 H 1 2.731 0.0 . . . . . . 43 ASN HB1 . 7084 1 402 . 1 1 43 43 ASN HB3 H 1 2.493 0.0 . . . . . . 43 ASN HB2 . 7084 1 403 . 1 1 43 43 ASN C C 13 174.364 0.0 . . . . . . 43 ASN C . 7084 1 404 . 1 1 43 43 ASN CA C 13 52.768 0.0 . . . . . . 43 ASN CA . 7084 1 405 . 1 1 43 43 ASN CB C 13 39.276 0.0 . . . . . . 43 ASN CB . 7084 1 406 . 1 1 43 43 ASN N N 15 114.577 0.0 . . . . . . 43 ASN N . 7084 1 407 . 1 1 44 44 SER H H 1 7.734 0.0 . . . . . . 44 SER H . 7084 1 408 . 1 1 44 44 SER HA H 1 3.88 0.0 . . . . . . 44 SER HA . 7084 1 409 . 1 1 44 44 SER HB2 H 1 3.88 0.0 . . . . . . 44 SER HB1 . 7084 1 410 . 1 1 44 44 SER C C 13 173.859 0.0 . . . . . . 44 SER C . 7084 1 411 . 1 1 44 44 SER CA C 13 58.747 0.0 . . . . . . 44 SER CA . 7084 1 412 . 1 1 44 44 SER CB C 13 61.581 0.0 . . . . . . 44 SER CB . 7084 1 413 . 1 1 44 44 SER N N 15 115.064 0.0 . . . . . . 44 SER N . 7084 1 414 . 1 1 45 45 THR H H 1 8.194 0.0 . . . . . . 45 THR H . 7084 1 415 . 1 1 45 45 THR HA H 1 5.204 0.0 . . . . . . 45 THR HA . 7084 1 416 . 1 1 45 45 THR HB H 1 4.015 0.0 . . . . . . 45 THR HB . 7084 1 417 . 1 1 45 45 THR HG21 H 1 1.01 0.0 . . . . . . 45 THR HG2 . 7084 1 418 . 1 1 45 45 THR HG22 H 1 1.01 0.0 . . . . . . 45 THR HG2 . 7084 1 419 . 1 1 45 45 THR HG23 H 1 1.01 0.0 . . . . . . 45 THR HG2 . 7084 1 420 . 1 1 45 45 THR C C 13 173.962 0.0 . . . . . . 45 THR C . 7084 1 421 . 1 1 45 45 THR CA C 13 60.025 0.0 . . . . . . 45 THR CA . 7084 1 422 . 1 1 45 45 THR CB C 13 72.375 0.0 . . . . . . 45 THR CB . 7084 1 423 . 1 1 45 45 THR CG2 C 13 21.46 0.0 . . . . . . 45 THR CG2 . 7084 1 424 . 1 1 45 45 THR N N 15 110.944 0.0 . . . . . . 45 THR N . 7084 1 425 . 1 1 46 46 VAL H H 1 8.933 0.0 . . . . . . 46 VAL H . 7084 1 426 . 1 1 46 46 VAL HA H 1 4.514 0.0 . . . . . . 46 VAL HA . 7084 1 427 . 1 1 46 46 VAL HB H 1 1.818 0.0 . . . . . . 46 VAL HB . 7084 1 428 . 1 1 46 46 VAL HG11 H 1 0.73 0.0 . . . . . . 46 VAL HG1 . 7084 1 429 . 1 1 46 46 VAL HG12 H 1 0.73 0.0 . . . . . . 46 VAL HG1 . 7084 1 430 . 1 1 46 46 VAL HG13 H 1 0.73 0.0 . . . . . . 46 VAL HG1 . 7084 1 431 . 1 1 46 46 VAL HG21 H 1 0.73 0.0 . . . . . . 46 VAL HG2 . 7084 1 432 . 1 1 46 46 VAL HG22 H 1 0.73 0.0 . . . . . . 46 VAL HG2 . 7084 1 433 . 1 1 46 46 VAL HG23 H 1 0.73 0.0 . . . . . . 46 VAL HG2 . 7084 1 434 . 1 1 46 46 VAL C C 13 173.199 0.0 . . . . . . 46 VAL C . 7084 1 435 . 1 1 46 46 VAL CA C 13 61.052 0.0 . . . . . . 46 VAL CA . 7084 1 436 . 1 1 46 46 VAL CB C 13 35.639 0.0 . . . . . . 46 VAL CB . 7084 1 437 . 1 1 46 46 VAL CG1 C 13 20.993 0.0 . . . . . . 46 VAL CG1 . 7084 1 438 . 1 1 46 46 VAL CG2 C 13 20.993 0.0 . . . . . . 46 VAL CG2 . 7084 1 439 . 1 1 46 46 VAL N N 15 120.73 0.0 . . . . . . 46 VAL N . 7084 1 440 . 1 1 47 47 ALA H H 1 8.86 0.0 . . . . . . 47 ALA H . 7084 1 441 . 1 1 47 47 ALA HA H 1 5.488 0.0 . . . . . . 47 ALA HA . 7084 1 442 . 1 1 47 47 ALA HB1 H 1 1.375 0.0 . . . . . . 47 ALA HB . 7084 1 443 . 1 1 47 47 ALA HB2 H 1 1.375 0.0 . . . . . . 47 ALA HB . 7084 1 444 . 1 1 47 47 ALA HB3 H 1 1.375 0.0 . . . . . . 47 ALA HB . 7084 1 445 . 1 1 47 47 ALA C C 13 176.179 0.0 . . . . . . 47 ALA C . 7084 1 446 . 1 1 47 47 ALA CA C 13 50.462 0.0 . . . . . . 47 ALA CA . 7084 1 447 . 1 1 47 47 ALA CB C 13 21.911 0.0 . . . . . . 47 ALA CB . 7084 1 448 . 1 1 47 47 ALA N N 15 127.532 0.0 . . . . . . 47 ALA N . 7084 1 449 . 1 1 48 48 LEU H H 1 8.887 0.0 . . . . . . 48 LEU H . 7084 1 450 . 1 1 48 48 LEU HA H 1 5.434 0.0 . . . . . . 48 LEU HA . 7084 1 451 . 1 1 48 48 LEU HB2 H 1 1.696 0.0 . . . . . . 48 LEU HB1 . 7084 1 452 . 1 1 48 48 LEU HB3 H 1 1.223 0.0 . . . . . . 48 LEU HB2 . 7084 1 453 . 1 1 48 48 LEU HG H 1 1.62 0.0 . . . . . . 48 LEU HG . 7084 1 454 . 1 1 48 48 LEU HD11 H 1 0.68 0.0 . . . . . . 48 LEU HD1 . 7084 1 455 . 1 1 48 48 LEU HD12 H 1 0.68 0.0 . . . . . . 48 LEU HD1 . 7084 1 456 . 1 1 48 48 LEU HD13 H 1 0.68 0.0 . . . . . . 48 LEU HD1 . 7084 1 457 . 1 1 48 48 LEU HD21 H 1 0.68 0.0 . . . . . . 48 LEU HD2 . 7084 1 458 . 1 1 48 48 LEU HD22 H 1 0.68 0.0 . . . . . . 48 LEU HD2 . 7084 1 459 . 1 1 48 48 LEU HD23 H 1 0.68 0.0 . . . . . . 48 LEU HD2 . 7084 1 460 . 1 1 48 48 LEU C C 13 174.08 0.0 . . . . . . 48 LEU C . 7084 1 461 . 1 1 48 48 LEU CA C 13 52.667 0.0 . . . . . . 48 LEU CA . 7084 1 462 . 1 1 48 48 LEU CB C 13 46.404 0.0 . . . . . . 48 LEU CB . 7084 1 463 . 1 1 48 48 LEU CG C 13 28.162 0.0 . . . . . . 48 LEU CG . 7084 1 464 . 1 1 48 48 LEU CD1 C 13 24.794 0.0 . . . . . . 48 LEU CD1 . 7084 1 465 . 1 1 48 48 LEU CD2 C 13 24.794 0.0 . . . . . . 48 LEU CD2 . 7084 1 466 . 1 1 48 48 LEU N N 15 122.53 0.0 . . . . . . 48 LEU N . 7084 1 467 . 1 1 49 49 ALA H H 1 9.512 0.0 . . . . . . 49 ALA H . 7084 1 468 . 1 1 49 49 ALA HA H 1 5.22 0.0 . . . . . . 49 ALA HA . 7084 1 469 . 1 1 49 49 ALA HB1 H 1 1.266 0.0 . . . . . . 49 ALA HB . 7084 1 470 . 1 1 49 49 ALA HB2 H 1 1.266 0.0 . . . . . . 49 ALA HB . 7084 1 471 . 1 1 49 49 ALA HB3 H 1 1.266 0.0 . . . . . . 49 ALA HB . 7084 1 472 . 1 1 49 49 ALA C C 13 177.126 0.0 . . . . . . 49 ALA C . 7084 1 473 . 1 1 49 49 ALA CA C 13 49.426 0.0 . . . . . . 49 ALA CA . 7084 1 474 . 1 1 49 49 ALA CB C 13 23.284 0.0 . . . . . . 49 ALA CB . 7084 1 475 . 1 1 49 49 ALA N N 15 122.596 0.0 . . . . . . 49 ALA N . 7084 1 476 . 1 1 50 50 LYS H H 1 8.065 0.0 . . . . . . 50 LYS H . 7084 1 477 . 1 1 50 50 LYS HA H 1 3.632 0.0 . . . . . . 50 LYS HA . 7084 1 478 . 1 1 50 50 LYS HB2 H 1 2.095 0.0 . . . . . . 50 LYS HB1 . 7084 1 479 . 1 1 50 50 LYS HB3 H 1 1.662 0.0 . . . . . . 50 LYS HB2 . 7084 1 480 . 1 1 50 50 LYS HG2 H 1 1.413 0.0 . . . . . . 50 LYS HG1 . 7084 1 481 . 1 1 50 50 LYS HE2 H 1 2.994 0.0 . . . . . . 50 LYS HE1 . 7084 1 482 . 1 1 50 50 LYS C C 13 175.225 0.0 . . . . . . 50 LYS C . 7084 1 483 . 1 1 50 50 LYS CA C 13 56.597 0.0 . . . . . . 50 LYS CA . 7084 1 484 . 1 1 50 50 LYS CB C 13 29.076 0.0 . . . . . . 50 LYS CB . 7084 1 485 . 1 1 50 50 LYS CG C 13 24.84 0.0 . . . . . . 50 LYS CG . 7084 1 486 . 1 1 50 50 LYS CE C 13 42.48 0.0 . . . . . . 50 LYS CE . 7084 1 487 . 1 1 50 50 LYS N N 15 117.839 0.0 . . . . . . 50 LYS N . 7084 1 488 . 1 1 51 51 VAL H H 1 8.716 0.0 . . . . . . 51 VAL H . 7084 1 489 . 1 1 51 51 VAL HA H 1 4.922 0.0 . . . . . . 51 VAL HA . 7084 1 490 . 1 1 51 51 VAL HB H 1 2.049 0.0 . . . . . . 51 VAL HB . 7084 1 491 . 1 1 51 51 VAL HG11 H 1 0.837 0.0 . . . . . . 51 VAL HG1 . 7084 1 492 . 1 1 51 51 VAL HG12 H 1 0.837 0.0 . . . . . . 51 VAL HG1 . 7084 1 493 . 1 1 51 51 VAL HG13 H 1 0.837 0.0 . . . . . . 51 VAL HG1 . 7084 1 494 . 1 1 51 51 VAL HG21 H 1 1.14 0.0 . . . . . . 51 VAL HG2 . 7084 1 495 . 1 1 51 51 VAL HG22 H 1 1.14 0.0 . . . . . . 51 VAL HG2 . 7084 1 496 . 1 1 51 51 VAL HG23 H 1 1.14 0.0 . . . . . . 51 VAL HG2 . 7084 1 497 . 1 1 51 51 VAL C C 13 175.935 0.0 . . . . . . 51 VAL C . 7084 1 498 . 1 1 51 51 VAL CA C 13 61.056 0.0 . . . . . . 51 VAL CA . 7084 1 499 . 1 1 51 51 VAL CB C 13 34.924 0.0 . . . . . . 51 VAL CB . 7084 1 500 . 1 1 51 51 VAL CG2 C 13 24.431 0.0 . . . . . . 51 VAL CG2 . 7084 1 501 . 1 1 51 51 VAL N N 15 119.308 0.0 . . . . . . 51 VAL N . 7084 1 502 . 1 1 52 52 ARG H H 1 9.109 0.0 . . . . . . 52 ARG H . 7084 1 503 . 1 1 52 52 ARG HA H 1 5.037 0.0 . . . . . . 52 ARG HA . 7084 1 504 . 1 1 52 52 ARG HB2 H 1 1.586 0.0 . . . . . . 52 ARG HB1 . 7084 1 505 . 1 1 52 52 ARG HB3 H 1 1.667 0.0 . . . . . . 52 ARG HB2 . 7084 1 506 . 1 1 52 52 ARG HG2 H 1 1.592 0.0 . . . . . . 52 ARG HG1 . 7084 1 507 . 1 1 52 52 ARG HG3 H 1 1.311 0.0 . . . . . . 52 ARG HG2 . 7084 1 508 . 1 1 52 52 ARG HD2 H 1 3.067 0.0 . . . . . . 52 ARG HD1 . 7084 1 509 . 1 1 52 52 ARG HD3 H 1 3.067 0.0 . . . . . . 52 ARG HD2 . 7084 1 510 . 1 1 52 52 ARG C C 13 175.398 0.0 . . . . . . 52 ARG C . 7084 1 511 . 1 1 52 52 ARG CA C 13 54.039 0.0 . . . . . . 52 ARG CA . 7084 1 512 . 1 1 52 52 ARG CB C 13 33.615 0.0 . . . . . . 52 ARG CB . 7084 1 513 . 1 1 52 52 ARG CG C 13 26.873 0.0 . . . . . . 52 ARG CG . 7084 1 514 . 1 1 52 52 ARG CD C 13 42.899 0.0 . . . . . . 52 ARG CD . 7084 1 515 . 1 1 52 52 ARG N N 15 125.32 0.0 . . . . . . 52 ARG N . 7084 1 516 . 1 1 53 53 SER H H 1 9.8 0.0 . . . . . . 53 SER H . 7084 1 517 . 1 1 53 53 SER HA H 1 4.935 0.0 . . . . . . 53 SER HA . 7084 1 518 . 1 1 53 53 SER HB2 H 1 3.822 0.0 . . . . . . 53 SER HB1 . 7084 1 519 . 1 1 53 53 SER HB3 H 1 3.615 0.0 . . . . . . 53 SER HB2 . 7084 1 520 . 1 1 53 53 SER C C 13 175.918 0.0 . . . . . . 53 SER C . 7084 1 521 . 1 1 53 53 SER CA C 13 55.955 0.0 . . . . . . 53 SER CA . 7084 1 522 . 1 1 53 53 SER CB C 13 64.972 0.0 . . . . . . 53 SER CB . 7084 1 523 . 1 1 53 53 SER N N 15 116.967 0.0 . . . . . . 53 SER N . 7084 1 524 . 1 1 54 54 PHE H H 1 9.408 0.0 . . . . . . 54 PHE H . 7084 1 525 . 1 1 54 54 PHE HA H 1 4.362 0.0 . . . . . . 54 PHE HA . 7084 1 526 . 1 1 54 54 PHE HB2 H 1 3.365 0.0 . . . . . . 54 PHE HB1 . 7084 1 527 . 1 1 54 54 PHE HB3 H 1 2.506 0.0 . . . . . . 54 PHE HB2 . 7084 1 528 . 1 1 54 54 PHE HD1 H 1 7.107 0.0 . . . . . . 54 PHE HD1 . 7084 1 529 . 1 1 54 54 PHE HD2 H 1 7.107 0.0 . . . . . . 54 PHE HD2 . 7084 1 530 . 1 1 54 54 PHE C C 13 175.254 0.0 . . . . . . 54 PHE C . 7084 1 531 . 1 1 54 54 PHE CA C 13 58.653 0.0 . . . . . . 54 PHE CA . 7084 1 532 . 1 1 54 54 PHE CB C 13 39.589 0.0 . . . . . . 54 PHE CB . 7084 1 533 . 1 1 54 54 PHE N N 15 124.937 0.0 . . . . . . 54 PHE N . 7084 1 534 . 1 1 55 55 GLY H H 1 7.52 0.0 . . . . . . 55 GLY H . 7084 1 535 . 1 1 55 55 GLY HA2 H 1 4.036 0.0 . . . . . . 55 GLY HA1 . 7084 1 536 . 1 1 55 55 GLY HA3 H 1 3.816 0.0 . . . . . . 55 GLY HA2 . 7084 1 537 . 1 1 55 55 GLY C C 13 173.595 0.0 . . . . . . 55 GLY C . 7084 1 538 . 1 1 55 55 GLY CA C 13 45.269 0.0 . . . . . . 55 GLY CA . 7084 1 539 . 1 1 55 55 GLY N N 15 106.144 0.0 . . . . . . 55 GLY N . 7084 1 540 . 1 1 56 56 THR H H 1 7.892 0.0 . . . . . . 56 THR H . 7084 1 541 . 1 1 56 56 THR HA H 1 4.805 0.0 . . . . . . 56 THR HA . 7084 1 542 . 1 1 56 56 THR HB H 1 4.381 0.0 . . . . . . 56 THR HB . 7084 1 543 . 1 1 56 56 THR HG21 H 1 1.209 0.0 . . . . . . 56 THR HG2 . 7084 1 544 . 1 1 56 56 THR HG22 H 1 1.209 0.0 . . . . . . 56 THR HG2 . 7084 1 545 . 1 1 56 56 THR HG23 H 1 1.209 0.0 . . . . . . 56 THR HG2 . 7084 1 546 . 1 1 56 56 THR C C 13 174.118 0.0 . . . . . . 56 THR C . 7084 1 547 . 1 1 56 56 THR CA C 13 63.118 0.0 . . . . . . 56 THR CA . 7084 1 548 . 1 1 56 56 THR CB C 13 69.138 0.0 . . . . . . 56 THR CB . 7084 1 549 . 1 1 56 56 THR CG2 C 13 22.84 0.0 . . . . . . 56 THR CG2 . 7084 1 550 . 1 1 56 56 THR N N 15 115.908 0.0 . . . . . . 56 THR N . 7084 1 551 . 1 1 57 57 GLU H H 1 9.089 0.0 . . . . . . 57 GLU H . 7084 1 552 . 1 1 57 57 GLU HA H 1 3.757 0.0 . . . . . . 57 GLU HA . 7084 1 553 . 1 1 57 57 GLU HB2 H 1 2.138 0.0 . . . . . . 57 GLU HB1 . 7084 1 554 . 1 1 57 57 GLU HB3 H 1 2.138 0.0 . . . . . . 57 GLU HB2 . 7084 1 555 . 1 1 57 57 GLU HG2 H 1 2.278 0.0 . . . . . . 57 GLU HG1 . 7084 1 556 . 1 1 57 57 GLU HG3 H 1 2.168 0.0 . . . . . . 57 GLU HG2 . 7084 1 557 . 1 1 57 57 GLU C C 13 175.907 0.0 . . . . . . 57 GLU C . 7084 1 558 . 1 1 57 57 GLU CA C 13 57.645 0.0 . . . . . . 57 GLU CA . 7084 1 559 . 1 1 57 57 GLU CB C 13 28.231 0.0 . . . . . . 57 GLU CB . 7084 1 560 . 1 1 57 57 GLU CG C 13 38.545 0.0 . . . . . . 57 GLU CG . 7084 1 561 . 1 1 57 57 GLU N N 15 118.238 0.0 . . . . . . 57 GLU N . 7084 1 562 . 1 1 58 58 ASP H H 1 8.646 0.0 . . . . . . 58 ASP H . 7084 1 563 . 1 1 58 58 ASP HA H 1 4.756 0.0 . . . . . . 58 ASP HA . 7084 1 564 . 1 1 58 58 ASP HB2 H 1 2.871 0.0 . . . . . . 58 ASP HB1 . 7084 1 565 . 1 1 58 58 ASP HB3 H 1 2.603 0.0 . . . . . . 58 ASP HB2 . 7084 1 566 . 1 1 58 58 ASP C C 13 176.885 0.0 . . . . . . 58 ASP C . 7084 1 567 . 1 1 58 58 ASP CA C 13 52.927 0.0 . . . . . . 58 ASP CA . 7084 1 568 . 1 1 58 58 ASP CB C 13 39.743 0.0 . . . . . . 58 ASP CB . 7084 1 569 . 1 1 58 58 ASP N N 15 122.559 0.0 . . . . . . 58 ASP N . 7084 1 570 . 1 1 59 59 ARG H H 1 8.441 0.0 . . . . . . 59 ARG H . 7084 1 571 . 1 1 59 59 ARG HA H 1 4.36 0.0 . . . . . . 59 ARG HA . 7084 1 572 . 1 1 59 59 ARG HB2 H 1 1.62 0.0 . . . . . . 59 ARG HB1 . 7084 1 573 . 1 1 59 59 ARG HB3 H 1 2.314 0.0 . . . . . . 59 ARG HB2 . 7084 1 574 . 1 1 59 59 ARG HG2 H 1 1.8 0.0 . . . . . . 59 ARG HG1 . 7084 1 575 . 1 1 59 59 ARG CA C 13 55.516 0.0 . . . . . . 59 ARG CA . 7084 1 576 . 1 1 59 59 ARG CB C 13 28.901 0.0 . . . . . . 59 ARG CB . 7084 1 577 . 1 1 59 59 ARG CD C 13 41.24 0.0 . . . . . . 59 ARG CD . 7084 1 578 . 1 1 59 59 ARG N N 15 124.073 0.0 . . . . . . 59 ARG N . 7084 1 579 . 1 1 60 60 PRO HA H 1 4.353 0.0 . . . . . . 60 PRO HA . 7084 1 580 . 1 1 60 60 PRO HB2 H 1 2.126 0.0 . . . . . . 60 PRO HB1 . 7084 1 581 . 1 1 60 60 PRO HB3 H 1 1.88 0.0 . . . . . . 60 PRO HB2 . 7084 1 582 . 1 1 60 60 PRO HG2 H 1 1.997 0.0 . . . . . . 60 PRO HG1 . 7084 1 583 . 1 1 60 60 PRO HD2 H 1 3.863 0.0 . . . . . . 60 PRO HD1 . 7084 1 584 . 1 1 60 60 PRO HD3 H 1 3.565 0.0 . . . . . . 60 PRO HD2 . 7084 1 585 . 1 1 60 60 PRO C C 13 176.367 0.0 . . . . . . 60 PRO C . 7084 1 586 . 1 1 60 60 PRO CA C 13 63.306 0.0 . . . . . . 60 PRO CA . 7084 1 587 . 1 1 60 60 PRO CB C 13 31.52 0.0 . . . . . . 60 PRO CB . 7084 1 588 . 1 1 60 60 PRO CG C 13 27.678 0.0 . . . . . . 60 PRO CG . 7084 1 589 . 1 1 60 60 PRO CD C 13 50.527 0.0 . . . . . . 60 PRO CD . 7084 1 590 . 1 1 61 61 THR H H 1 7.739 0.0 . . . . . . 61 THR H . 7084 1 591 . 1 1 61 61 THR HA H 1 4.52 0.0 . . . . . . 61 THR HA . 7084 1 592 . 1 1 61 61 THR HB H 1 4.29 0.0 . . . . . . 61 THR HB . 7084 1 593 . 1 1 61 61 THR HG21 H 1 0.988 0.0 . . . . . . 61 THR HG2 . 7084 1 594 . 1 1 61 61 THR HG22 H 1 0.988 0.0 . . . . . . 61 THR HG2 . 7084 1 595 . 1 1 61 61 THR HG23 H 1 0.988 0.0 . . . . . . 61 THR HG2 . 7084 1 596 . 1 1 61 61 THR C C 13 172.184 0.0 . . . . . . 61 THR C . 7084 1 597 . 1 1 61 61 THR CA C 13 60.171 0.0 . . . . . . 61 THR CA . 7084 1 598 . 1 1 61 61 THR CB C 13 68.013 0.0 . . . . . . 61 THR CB . 7084 1 599 . 1 1 61 61 THR CG2 C 13 18.466 0.0 . . . . . . 61 THR CG2 . 7084 1 600 . 1 1 61 61 THR N N 15 116.422 0.0 . . . . . . 61 THR N . 7084 1 601 . 1 1 62 62 ASP H H 1 8.485 0.0 . . . . . . 62 ASP H . 7084 1 602 . 1 1 62 62 ASP HA H 1 4.485 0.0 . . . . . . 62 ASP HA . 7084 1 603 . 1 1 62 62 ASP HB2 H 1 2.59 0.0 . . . . . . 62 ASP HB1 . 7084 1 604 . 1 1 62 62 ASP HB3 H 1 2.59 0.0 . . . . . . 62 ASP HB2 . 7084 1 605 . 1 1 62 62 ASP C C 13 176.032 0.0 . . . . . . 62 ASP C . 7084 1 606 . 1 1 62 62 ASP CA C 13 55.258 0.0 . . . . . . 62 ASP CA . 7084 1 607 . 1 1 62 62 ASP CB C 13 40.834 0.0 . . . . . . 62 ASP CB . 7084 1 608 . 1 1 62 62 ASP N N 15 124.61 0.0 . . . . . . 62 ASP N . 7084 1 609 . 1 1 63 63 ARG H H 1 8.315 0.0 . . . . . . 63 ARG H . 7084 1 610 . 1 1 63 63 ARG HA H 1 5.435 0.0 . . . . . . 63 ARG HA . 7084 1 611 . 1 1 63 63 ARG HB2 H 1 1.578 0.0 . . . . . . 63 ARG HB1 . 7084 1 612 . 1 1 63 63 ARG HB3 H 1 1.755 0.0 . . . . . . 63 ARG HB2 . 7084 1 613 . 1 1 63 63 ARG HG2 H 1 1.506 0.0 . . . . . . 63 ARG HG1 . 7084 1 614 . 1 1 63 63 ARG HG3 H 1 1.506 0.0 . . . . . . 63 ARG HG2 . 7084 1 615 . 1 1 63 63 ARG HD2 H 1 3.19 0.0 . . . . . . 63 ARG HD1 . 7084 1 616 . 1 1 63 63 ARG HD3 H 1 3.19 0.0 . . . . . . 63 ARG HD2 . 7084 1 617 . 1 1 63 63 ARG CA C 13 53.065 0.0 . . . . . . 63 ARG CA . 7084 1 618 . 1 1 63 63 ARG CB C 13 31.25 0.0 . . . . . . 63 ARG CB . 7084 1 619 . 1 1 63 63 ARG CG C 13 26.807 0.0 . . . . . . 63 ARG CG . 7084 1 620 . 1 1 63 63 ARG CD C 13 43.566 0.0 . . . . . . 63 ARG CD . 7084 1 621 . 1 1 63 63 ARG N N 15 121.354 0.0 . . . . . . 63 ARG N . 7084 1 622 . 1 1 64 64 PRO HA H 1 4.364 0.0 . . . . . . 64 PRO HA . 7084 1 623 . 1 1 64 64 PRO HB2 H 1 2.169 0.0 . . . . . . 64 PRO HB1 . 7084 1 624 . 1 1 64 64 PRO HB3 H 1 1.773 0.0 . . . . . . 64 PRO HB2 . 7084 1 625 . 1 1 64 64 PRO HG2 H 1 2.0 0.0 . . . . . . 64 PRO HG1 . 7084 1 626 . 1 1 64 64 PRO HG3 H 1 1.93 0.0 . . . . . . 64 PRO HG2 . 7084 1 627 . 1 1 64 64 PRO HD2 H 1 3.79 0.0 . . . . . . 64 PRO HD1 . 7084 1 628 . 1 1 64 64 PRO HD3 H 1 3.601 0.0 . . . . . . 64 PRO HD2 . 7084 1 629 . 1 1 64 64 PRO C C 13 176.759 0.0 . . . . . . 64 PRO C . 7084 1 630 . 1 1 64 64 PRO CA C 13 63.026 0.0 . . . . . . 64 PRO CA . 7084 1 631 . 1 1 64 64 PRO CB C 13 31.964 0.0 . . . . . . 64 PRO CB . 7084 1 632 . 1 1 64 64 PRO CG C 13 27.57 0.0 . . . . . . 64 PRO CG . 7084 1 633 . 1 1 64 64 PRO CD C 13 50.4 0.0 . . . . . . 64 PRO CD . 7084 1 634 . 1 1 65 65 ILE H H 1 8.467 0.0 . . . . . . 65 ILE H . 7084 1 635 . 1 1 65 65 ILE HA H 1 4.383 0.0 . . . . . . 65 ILE HA . 7084 1 636 . 1 1 65 65 ILE HB H 1 1.72 0.0 . . . . . . 65 ILE HB . 7084 1 637 . 1 1 65 65 ILE HG12 H 1 1.483 0.0 . . . . . . 65 ILE HG11 . 7084 1 638 . 1 1 65 65 ILE HG13 H 1 1.483 0.0 . . . . . . 65 ILE HG12 . 7084 1 639 . 1 1 65 65 ILE HG21 H 1 1.049 0.0 . . . . . . 65 ILE HG2 . 7084 1 640 . 1 1 65 65 ILE HG22 H 1 1.049 0.0 . . . . . . 65 ILE HG2 . 7084 1 641 . 1 1 65 65 ILE HG23 H 1 1.049 0.0 . . . . . . 65 ILE HG2 . 7084 1 642 . 1 1 65 65 ILE HD11 H 1 0.793 0.0 . . . . . . 65 ILE HD1 . 7084 1 643 . 1 1 65 65 ILE HD12 H 1 0.793 0.0 . . . . . . 65 ILE HD1 . 7084 1 644 . 1 1 65 65 ILE HD13 H 1 0.793 0.0 . . . . . . 65 ILE HD1 . 7084 1 645 . 1 1 65 65 ILE C C 13 175.783 0.0 . . . . . . 65 ILE C . 7084 1 646 . 1 1 65 65 ILE CA C 13 59.092 0.0 . . . . . . 65 ILE CA . 7084 1 647 . 1 1 65 65 ILE CB C 13 40.812 0.0 . . . . . . 65 ILE CB . 7084 1 648 . 1 1 65 65 ILE CG1 C 13 26.19 0.0 . . . . . . 65 ILE CG1 . 7084 1 649 . 1 1 65 65 ILE CG2 C 13 17.025 0.0 . . . . . . 65 ILE CG2 . 7084 1 650 . 1 1 65 65 ILE CD1 C 13 11.373 0.0 . . . . . . 65 ILE CD1 . 7084 1 651 . 1 1 65 65 ILE N N 15 123.079 0.0 . . . . . . 65 ILE N . 7084 1 652 . 1 1 66 66 ALA H H 1 8.633 0.0 . . . . . . 66 ALA H . 7084 1 653 . 1 1 66 66 ALA HA H 1 4.68 0.0 . . . . . . 66 ALA HA . 7084 1 654 . 1 1 66 66 ALA HB1 H 1 1.442 0.0 . . . . . . 66 ALA HB . 7084 1 655 . 1 1 66 66 ALA HB2 H 1 1.442 0.0 . . . . . . 66 ALA HB . 7084 1 656 . 1 1 66 66 ALA HB3 H 1 1.442 0.0 . . . . . . 66 ALA HB . 7084 1 657 . 1 1 66 66 ALA CA C 13 51.35 0.0 . . . . . . 66 ALA CA . 7084 1 658 . 1 1 66 66 ALA CB C 13 18.2 0.0 . . . . . . 66 ALA CB . 7084 1 659 . 1 1 66 66 ALA N N 15 132.184 0.0 . . . . . . 66 ALA N . 7084 1 660 . 1 1 67 67 PRO HA H 1 4.029 0.0 . . . . . . 67 PRO HA . 7084 1 661 . 1 1 67 67 PRO HB2 H 1 2.125 0.0 . . . . . . 67 PRO HB1 . 7084 1 662 . 1 1 67 67 PRO HG2 H 1 1.907 0.0 . . . . . . 67 PRO HG1 . 7084 1 663 . 1 1 67 67 PRO CA C 13 62.984 0.0 . . . . . . 67 PRO CA . 7084 1 664 . 1 1 67 67 PRO CB C 13 32.458 0.0 . . . . . . 67 PRO CB . 7084 1 665 . 1 1 67 67 PRO CG C 13 27.25 0.0 . . . . . . 67 PRO CG . 7084 1 666 . 1 1 67 67 PRO CD C 13 50.504 0.0 . . . . . . 67 PRO CD . 7084 1 667 . 1 1 68 68 ARG H H 1 7.537 0.0 . . . . . . 68 ARG H . 7084 1 668 . 1 1 68 68 ARG HA H 1 4.685 0.0 . . . . . . 68 ARG HA . 7084 1 669 . 1 1 68 68 ARG CA C 13 54.34 0.0 . . . . . . 68 ARG CA . 7084 1 670 . 1 1 68 68 ARG CB C 13 32.8 0.0 . . . . . . 68 ARG CB . 7084 1 671 . 1 1 68 68 ARG CG C 13 27.3 0.0 . . . . . . 68 ARG CG . 7084 1 672 . 1 1 68 68 ARG CD C 13 43.121 0.0 . . . . . . 68 ARG CD . 7084 1 673 . 1 1 68 68 ARG N N 15 119.11 0.0 . . . . . . 68 ARG N . 7084 1 674 . 1 1 69 69 ASP HA H 1 4.497 0.0 . . . . . . 69 ASP HA . 7084 1 675 . 1 1 69 69 ASP HB2 H 1 2.687 0.0 . . . . . . 69 ASP HB1 . 7084 1 676 . 1 1 69 69 ASP HB3 H 1 2.503 0.0 . . . . . . 69 ASP HB2 . 7084 1 677 . 1 1 69 69 ASP C C 13 176.032 0.0 . . . . . . 69 ASP C . 7084 1 678 . 1 1 69 69 ASP CA C 13 55.258 0.0 . . . . . . 69 ASP CA . 7084 1 679 . 1 1 69 69 ASP CB C 13 40.834 0.0 . . . . . . 69 ASP CB . 7084 1 680 . 1 1 70 70 GLU H H 1 8.076 0.0 . . . . . . 70 GLU H . 7084 1 681 . 1 1 70 70 GLU HA H 1 4.121 0.0 . . . . . . 70 GLU HA . 7084 1 682 . 1 1 70 70 GLU HB2 H 1 1.594 0.0 . . . . . . 70 GLU HB1 . 7084 1 683 . 1 1 70 70 GLU HB3 H 1 1.594 0.0 . . . . . . 70 GLU HB2 . 7084 1 684 . 1 1 70 70 GLU HG2 H 1 1.901 0.0 . . . . . . 70 GLU HG1 . 7084 1 685 . 1 1 70 70 GLU HG3 H 1 1.901 0.0 . . . . . . 70 GLU HG2 . 7084 1 686 . 1 1 70 70 GLU C C 13 175.158 0.0 . . . . . . 70 GLU C . 7084 1 687 . 1 1 70 70 GLU CA C 13 56.818 0.0 . . . . . . 70 GLU CA . 7084 1 688 . 1 1 70 70 GLU CB C 13 30.543 0.0 . . . . . . 70 GLU CB . 7084 1 689 . 1 1 70 70 GLU CG C 13 35.766 0.0 . . . . . . 70 GLU CG . 7084 1 690 . 1 1 70 70 GLU N N 15 120.008 0.0 . . . . . . 70 GLU N . 7084 1 691 . 1 1 71 71 THR H H 1 8.224 0.0 . . . . . . 71 THR H . 7084 1 692 . 1 1 71 71 THR HA H 1 4.594 0.0 . . . . . . 71 THR HA . 7084 1 693 . 1 1 71 71 THR HB H 1 3.845 0.0 . . . . . . 71 THR HB . 7084 1 694 . 1 1 71 71 THR HG21 H 1 0.92 0.0 . . . . . . 71 THR HG2 . 7084 1 695 . 1 1 71 71 THR HG22 H 1 0.92 0.0 . . . . . . 71 THR HG2 . 7084 1 696 . 1 1 71 71 THR HG23 H 1 0.92 0.0 . . . . . . 71 THR HG2 . 7084 1 697 . 1 1 71 71 THR CA C 13 61.29 0.0 . . . . . . 71 THR CA . 7084 1 698 . 1 1 71 71 THR CB C 13 69.99 0.0 . . . . . . 71 THR CB . 7084 1 699 . 1 1 71 71 THR CG2 C 13 21.35 0.0 . . . . . . 71 THR CG2 . 7084 1 700 . 1 1 71 71 THR N N 15 117.549 0.0 . . . . . . 71 THR N . 7084 1 701 . 1 1 72 72 PHE HA H 1 4.683 0.0 . . . . . . 72 PHE HA . 7084 1 702 . 1 1 72 72 PHE HB2 H 1 2.994 0.0 . . . . . . 72 PHE HB1 . 7084 1 703 . 1 1 72 72 PHE HB3 H 1 2.747 0.0 . . . . . . 72 PHE HB2 . 7084 1 704 . 1 1 72 72 PHE C C 13 176.523 0.0 . . . . . . 72 PHE C . 7084 1 705 . 1 1 72 72 PHE CA C 13 56.729 0.0 . . . . . . 72 PHE CA . 7084 1 706 . 1 1 72 72 PHE CB C 13 40.261 0.0 . . . . . . 72 PHE CB . 7084 1 707 . 1 1 73 73 GLU H H 1 9.135 0.0 . . . . . . 73 GLU H . 7084 1 708 . 1 1 73 73 GLU HA H 1 3.834 0.0 . . . . . . 73 GLU HA . 7084 1 709 . 1 1 73 73 GLU HB2 H 1 2.0 0.0 . . . . . . 73 GLU HB1 . 7084 1 710 . 1 1 73 73 GLU HB3 H 1 2.0 0.0 . . . . . . 73 GLU HB2 . 7084 1 711 . 1 1 73 73 GLU HG2 H 1 2.256 0.0 . . . . . . 73 GLU HG1 . 7084 1 712 . 1 1 73 73 GLU HG3 H 1 2.256 0.0 . . . . . . 73 GLU HG2 . 7084 1 713 . 1 1 73 73 GLU C C 13 177.946 0.0 . . . . . . 73 GLU C . 7084 1 714 . 1 1 73 73 GLU CA C 13 60.858 0.0 . . . . . . 73 GLU CA . 7084 1 715 . 1 1 73 73 GLU CB C 13 29.531 0.0 . . . . . . 73 GLU CB . 7084 1 716 . 1 1 73 73 GLU CG C 13 36.099 0.0 . . . . . . 73 GLU CG . 7084 1 717 . 1 1 73 73 GLU N N 15 125.155 0.0 . . . . . . 73 GLU N . 7084 1 718 . 1 1 74 74 TYR H H 1 7.545 0.0 . . . . . . 74 TYR H . 7084 1 719 . 1 1 74 74 TYR HA H 1 5.492 0.0 . . . . . . 74 TYR HA . 7084 1 720 . 1 1 74 74 TYR HB2 H 1 2.784 0.0 . . . . . . 74 TYR HB1 . 7084 1 721 . 1 1 74 74 TYR HB3 H 1 2.685 0.0 . . . . . . 74 TYR HB2 . 7084 1 722 . 1 1 74 74 TYR HD1 H 1 6.741 0.0 . . . . . . 74 TYR HD1 . 7084 1 723 . 1 1 74 74 TYR HD2 H 1 6.741 0.0 . . . . . . 74 TYR HD2 . 7084 1 724 . 1 1 74 74 TYR C C 13 174.974 0.0 . . . . . . 74 TYR C . 7084 1 725 . 1 1 74 74 TYR CA C 13 57.361 0.0 . . . . . . 74 TYR CA . 7084 1 726 . 1 1 74 74 TYR CB C 13 42.688 0.0 . . . . . . 74 TYR CB . 7084 1 727 . 1 1 74 74 TYR N N 15 113.368 0.0 . . . . . . 74 TYR N . 7084 1 728 . 1 1 75 75 ILE H H 1 8.667 0.0 . . . . . . 75 ILE H . 7084 1 729 . 1 1 75 75 ILE HA H 1 3.939 0.0 . . . . . . 75 ILE HA . 7084 1 730 . 1 1 75 75 ILE HB H 1 1.151 0.0 . . . . . . 75 ILE HB . 7084 1 731 . 1 1 75 75 ILE HG12 H 1 1.094 0.0 . . . . . . 75 ILE HG11 . 7084 1 732 . 1 1 75 75 ILE HG13 H 1 1.094 0.0 . . . . . . 75 ILE HG12 . 7084 1 733 . 1 1 75 75 ILE HG21 H 1 -0.168 0.0 . . . . . . 75 ILE HG2 . 7084 1 734 . 1 1 75 75 ILE HG22 H 1 -0.168 0.0 . . . . . . 75 ILE HG2 . 7084 1 735 . 1 1 75 75 ILE HG23 H 1 -0.168 0.0 . . . . . . 75 ILE HG2 . 7084 1 736 . 1 1 75 75 ILE HD11 H 1 0.233 0.0 . . . . . . 75 ILE HD1 . 7084 1 737 . 1 1 75 75 ILE HD12 H 1 0.233 0.0 . . . . . . 75 ILE HD1 . 7084 1 738 . 1 1 75 75 ILE HD13 H 1 0.233 0.0 . . . . . . 75 ILE HD1 . 7084 1 739 . 1 1 75 75 ILE C C 13 172.978 0.0 . . . . . . 75 ILE C . 7084 1 740 . 1 1 75 75 ILE CA C 13 61.888 0.0 . . . . . . 75 ILE CA . 7084 1 741 . 1 1 75 75 ILE CB C 13 41.906 0.0 . . . . . . 75 ILE CB . 7084 1 742 . 1 1 75 75 ILE CG1 C 13 27.256 0.0 . . . . . . 75 ILE CG1 . 7084 1 743 . 1 1 75 75 ILE CG2 C 13 17.035 0.0 . . . . . . 75 ILE CG2 . 7084 1 744 . 1 1 75 75 ILE CD1 C 13 13.212 0.0 . . . . . . 75 ILE CD1 . 7084 1 745 . 1 1 75 75 ILE N N 15 121.873 0.0 . . . . . . 75 ILE N . 7084 1 746 . 1 1 76 76 ILE H H 1 8.019 0.0 . . . . . . 76 ILE H . 7084 1 747 . 1 1 76 76 ILE HA H 1 4.507 0.0 . . . . . . 76 ILE HA . 7084 1 748 . 1 1 76 76 ILE HB H 1 1.557 0.0 . . . . . . 76 ILE HB . 7084 1 749 . 1 1 76 76 ILE HG12 H 1 1.402 0.0 . . . . . . 76 ILE HG11 . 7084 1 750 . 1 1 76 76 ILE HG13 H 1 1.402 0.0 . . . . . . 76 ILE HG12 . 7084 1 751 . 1 1 76 76 ILE HG21 H 1 0.729 0.0 . . . . . . 76 ILE HG2 . 7084 1 752 . 1 1 76 76 ILE HG22 H 1 0.729 0.0 . . . . . . 76 ILE HG2 . 7084 1 753 . 1 1 76 76 ILE HG23 H 1 0.729 0.0 . . . . . . 76 ILE HG2 . 7084 1 754 . 1 1 76 76 ILE HD11 H 1 0.761 0.0 . . . . . . 76 ILE HD1 . 7084 1 755 . 1 1 76 76 ILE HD12 H 1 0.761 0.0 . . . . . . 76 ILE HD1 . 7084 1 756 . 1 1 76 76 ILE HD13 H 1 0.761 0.0 . . . . . . 76 ILE HD1 . 7084 1 757 . 1 1 76 76 ILE C C 13 174.911 0.0 . . . . . . 76 ILE C . 7084 1 758 . 1 1 76 76 ILE CA C 13 60.23 0.0 . . . . . . 76 ILE CA . 7084 1 759 . 1 1 76 76 ILE CB C 13 38.891 0.0 . . . . . . 76 ILE CB . 7084 1 760 . 1 1 76 76 ILE CG1 C 13 28.26 0.0 . . . . . . 76 ILE CG1 . 7084 1 761 . 1 1 76 76 ILE CG2 C 13 17.348 0.0 . . . . . . 76 ILE CG2 . 7084 1 762 . 1 1 76 76 ILE CD1 C 13 13.241 0.0 . . . . . . 76 ILE CD1 . 7084 1 763 . 1 1 76 76 ILE N N 15 125.606 0.0 . . . . . . 76 ILE N . 7084 1 764 . 1 1 77 77 PHE H H 1 9.326 0.0 . . . . . . 77 PHE H . 7084 1 765 . 1 1 77 77 PHE HA H 1 4.622 0.0 . . . . . . 77 PHE HA . 7084 1 766 . 1 1 77 77 PHE HB2 H 1 2.696 0.0 . . . . . . 77 PHE HB1 . 7084 1 767 . 1 1 77 77 PHE HB3 H 1 2.696 0.0 . . . . . . 77 PHE HB2 . 7084 1 768 . 1 1 77 77 PHE HD1 H 1 6.937 0.0 . . . . . . 77 PHE HD1 . 7084 1 769 . 1 1 77 77 PHE HD2 H 1 6.937 0.0 . . . . . . 77 PHE HD2 . 7084 1 770 . 1 1 77 77 PHE C C 13 175.73 0.0 . . . . . . 77 PHE C . 7084 1 771 . 1 1 77 77 PHE CA C 13 56.808 0.0 . . . . . . 77 PHE CA . 7084 1 772 . 1 1 77 77 PHE CB C 13 41.548 0.0 . . . . . . 77 PHE CB . 7084 1 773 . 1 1 77 77 PHE N N 15 126.24 0.0 . . . . . . 77 PHE N . 7084 1 774 . 1 1 78 78 ARG H H 1 9.047 0.0 . . . . . . 78 ARG H . 7084 1 775 . 1 1 78 78 ARG HA H 1 4.642 0.0 . . . . . . 78 ARG HA . 7084 1 776 . 1 1 78 78 ARG HB2 H 1 1.96 0.0 . . . . . . 78 ARG HB1 . 7084 1 777 . 1 1 78 78 ARG HB3 H 1 1.74 0.0 . . . . . . 78 ARG HB2 . 7084 1 778 . 1 1 78 78 ARG HD2 H 1 3.176 0.0 . . . . . . 78 ARG HD1 . 7084 1 779 . 1 1 78 78 ARG HD3 H 1 3.176 0.0 . . . . . . 78 ARG HD2 . 7084 1 780 . 1 1 78 78 ARG C C 13 178.867 0.0 . . . . . . 78 ARG C . 7084 1 781 . 1 1 78 78 ARG CA C 13 55.657 0.0 . . . . . . 78 ARG CA . 7084 1 782 . 1 1 78 78 ARG CB C 13 30.62 0.0 . . . . . . 78 ARG CB . 7084 1 783 . 1 1 78 78 ARG CG C 13 27.418 0.0 . . . . . . 78 ARG CG . 7084 1 784 . 1 1 78 78 ARG CD C 13 43.279 0.0 . . . . . . 78 ARG CD . 7084 1 785 . 1 1 78 78 ARG N N 15 121.785 0.0 . . . . . . 78 ARG N . 7084 1 786 . 1 1 79 79 GLY H H 1 8.871 0.0 . . . . . . 79 GLY H . 7084 1 787 . 1 1 79 79 GLY HA2 H 1 3.584 0.0 . . . . . . 79 GLY HA1 . 7084 1 788 . 1 1 79 79 GLY HA3 H 1 3.956 0.0 . . . . . . 79 GLY HA2 . 7084 1 789 . 1 1 79 79 GLY C C 13 176.538 0.0 . . . . . . 79 GLY C . 7084 1 790 . 1 1 79 79 GLY CA C 13 48.048 0.0 . . . . . . 79 GLY CA . 7084 1 791 . 1 1 79 79 GLY N N 15 112.043 0.0 . . . . . . 79 GLY N . 7084 1 792 . 1 1 80 80 SER H H 1 8.289 0.0 . . . . . . 80 SER H . 7084 1 793 . 1 1 80 80 SER HA H 1 4.239 0.0 . . . . . . 80 SER HA . 7084 1 794 . 1 1 80 80 SER HB2 H 1 3.915 0.0 . . . . . . 80 SER HB1 . 7084 1 795 . 1 1 80 80 SER HB3 H 1 3.915 0.0 . . . . . . 80 SER HB2 . 7084 1 796 . 1 1 80 80 SER C C 13 174.787 0.0 . . . . . . 80 SER C . 7084 1 797 . 1 1 80 80 SER CA C 13 59.863 0.0 . . . . . . 80 SER CA . 7084 1 798 . 1 1 80 80 SER CB C 13 62.793 0.0 . . . . . . 80 SER CB . 7084 1 799 . 1 1 80 80 SER N N 15 113.127 0.0 . . . . . . 80 SER N . 7084 1 800 . 1 1 81 81 ASP H H 1 8.031 0.0 . . . . . . 81 ASP H . 7084 1 801 . 1 1 81 81 ASP HA H 1 4.937 0.0 . . . . . . 81 ASP HA . 7084 1 802 . 1 1 81 81 ASP HB2 H 1 3.198 0.0 . . . . . . 81 ASP HB1 . 7084 1 803 . 1 1 81 81 ASP HB3 H 1 2.924 0.0 . . . . . . 81 ASP HB2 . 7084 1 804 . 1 1 81 81 ASP C C 13 175.642 0.0 . . . . . . 81 ASP C . 7084 1 805 . 1 1 81 81 ASP CA C 13 54.852 0.0 . . . . . . 81 ASP CA . 7084 1 806 . 1 1 81 81 ASP CB C 13 42.762 0.0 . . . . . . 81 ASP CB . 7084 1 807 . 1 1 81 81 ASP N N 15 120.273 0.0 . . . . . . 81 ASP N . 7084 1 808 . 1 1 82 82 ILE H H 1 7.403 0.0 . . . . . . 82 ILE H . 7084 1 809 . 1 1 82 82 ILE HA H 1 3.77 0.0 . . . . . . 82 ILE HA . 7084 1 810 . 1 1 82 82 ILE HB H 1 1.868 0.0 . . . . . . 82 ILE HB . 7084 1 811 . 1 1 82 82 ILE HG12 H 1 1.868 0.0 . . . . . . 82 ILE HG11 . 7084 1 812 . 1 1 82 82 ILE HG21 H 1 0.578 0.0 . . . . . . 82 ILE HG2 . 7084 1 813 . 1 1 82 82 ILE HG22 H 1 0.578 0.0 . . . . . . 82 ILE HG2 . 7084 1 814 . 1 1 82 82 ILE HG23 H 1 0.578 0.0 . . . . . . 82 ILE HG2 . 7084 1 815 . 1 1 82 82 ILE HD11 H 1 0.593 0.0 . . . . . . 82 ILE HD1 . 7084 1 816 . 1 1 82 82 ILE HD12 H 1 0.593 0.0 . . . . . . 82 ILE HD1 . 7084 1 817 . 1 1 82 82 ILE HD13 H 1 0.593 0.0 . . . . . . 82 ILE HD1 . 7084 1 818 . 1 1 82 82 ILE C C 13 174.769 0.0 . . . . . . 82 ILE C . 7084 1 819 . 1 1 82 82 ILE CA C 13 62.839 0.0 . . . . . . 82 ILE CA . 7084 1 820 . 1 1 82 82 ILE CB C 13 39.459 0.0 . . . . . . 82 ILE CB . 7084 1 821 . 1 1 82 82 ILE CG1 C 13 26.657 0.0 . . . . . . 82 ILE CG1 . 7084 1 822 . 1 1 82 82 ILE CG2 C 13 17.55 0.0 . . . . . . 82 ILE CG2 . 7084 1 823 . 1 1 82 82 ILE CD1 C 13 13.798 0.0 . . . . . . 82 ILE CD1 . 7084 1 824 . 1 1 82 82 ILE N N 15 119.888 0.0 . . . . . . 82 ILE N . 7084 1 825 . 1 1 83 83 LYS H H 1 9.165 0.0 . . . . . . 83 LYS H . 7084 1 826 . 1 1 83 83 LYS HA H 1 4.324 0.0 . . . . . . 83 LYS HA . 7084 1 827 . 1 1 83 83 LYS HB2 H 1 1.305 0.0 . . . . . . 83 LYS HB1 . 7084 1 828 . 1 1 83 83 LYS HB3 H 1 1.521 0.0 . . . . . . 83 LYS HB2 . 7084 1 829 . 1 1 83 83 LYS HG2 H 1 1.284 0.0 . . . . . . 83 LYS HG1 . 7084 1 830 . 1 1 83 83 LYS HG3 H 1 1.191 0.0 . . . . . . 83 LYS HG2 . 7084 1 831 . 1 1 83 83 LYS HD2 H 1 1.631 0.0 . . . . . . 83 LYS HD1 . 7084 1 832 . 1 1 83 83 LYS HD3 H 1 1.519 0.0 . . . . . . 83 LYS HD2 . 7084 1 833 . 1 1 83 83 LYS HE2 H 1 2.899 0.0 . . . . . . 83 LYS HE1 . 7084 1 834 . 1 1 83 83 LYS HE3 H 1 2.899 0.0 . . . . . . 83 LYS HE2 . 7084 1 835 . 1 1 83 83 LYS C C 13 175.618 0.0 . . . . . . 83 LYS C . 7084 1 836 . 1 1 83 83 LYS CA C 13 57.504 0.0 . . . . . . 83 LYS CA . 7084 1 837 . 1 1 83 83 LYS CB C 13 34.58 0.0 . . . . . . 83 LYS CB . 7084 1 838 . 1 1 83 83 LYS CG C 13 25.238 0.0 . . . . . . 83 LYS CG . 7084 1 839 . 1 1 83 83 LYS CD C 13 29.751 0.0 . . . . . . 83 LYS CD . 7084 1 840 . 1 1 83 83 LYS CE C 13 41.478 0.0 . . . . . . 83 LYS CE . 7084 1 841 . 1 1 83 83 LYS N N 15 128.514 0.0 . . . . . . 83 LYS N . 7084 1 842 . 1 1 84 84 ASP H H 1 7.922 0.0 . . . . . . 84 ASP H . 7084 1 843 . 1 1 84 84 ASP HA H 1 4.761 0.0 . . . . . . 84 ASP HA . 7084 1 844 . 1 1 84 84 ASP HB2 H 1 2.452 0.0 . . . . . . 84 ASP HB1 . 7084 1 845 . 1 1 84 84 ASP HB3 H 1 2.452 0.0 . . . . . . 84 ASP HB2 . 7084 1 846 . 1 1 84 84 ASP C C 13 173.32 0.0 . . . . . . 84 ASP C . 7084 1 847 . 1 1 84 84 ASP CA C 13 54.114 0.0 . . . . . . 84 ASP CA . 7084 1 848 . 1 1 84 84 ASP CB C 13 45.371 0.0 . . . . . . 84 ASP CB . 7084 1 849 . 1 1 84 84 ASP N N 15 116.943 0.0 . . . . . . 84 ASP N . 7084 1 850 . 1 1 85 85 LEU H H 1 8.378 0.0 . . . . . . 85 LEU H . 7084 1 851 . 1 1 85 85 LEU HA H 1 4.919 0.0 . . . . . . 85 LEU HA . 7084 1 852 . 1 1 85 85 LEU HB2 H 1 1.486 0.0 . . . . . . 85 LEU HB1 . 7084 1 853 . 1 1 85 85 LEU HB3 H 1 1.486 0.0 . . . . . . 85 LEU HB2 . 7084 1 854 . 1 1 85 85 LEU HD11 H 1 0.702 0.0 . . . . . . 85 LEU HD1 . 7084 1 855 . 1 1 85 85 LEU HD12 H 1 0.702 0.0 . . . . . . 85 LEU HD1 . 7084 1 856 . 1 1 85 85 LEU HD13 H 1 0.702 0.0 . . . . . . 85 LEU HD1 . 7084 1 857 . 1 1 85 85 LEU HD21 H 1 0.702 0.0 . . . . . . 85 LEU HD2 . 7084 1 858 . 1 1 85 85 LEU HD22 H 1 0.702 0.0 . . . . . . 85 LEU HD2 . 7084 1 859 . 1 1 85 85 LEU HD23 H 1 0.702 0.0 . . . . . . 85 LEU HD2 . 7084 1 860 . 1 1 85 85 LEU C C 13 174.815 0.0 . . . . . . 85 LEU C . 7084 1 861 . 1 1 85 85 LEU CA C 13 55.705 0.0 . . . . . . 85 LEU CA . 7084 1 862 . 1 1 85 85 LEU CB C 13 44.902 0.0 . . . . . . 85 LEU CB . 7084 1 863 . 1 1 85 85 LEU CG C 13 26.465 0.0 . . . . . . 85 LEU CG . 7084 1 864 . 1 1 85 85 LEU CD1 C 13 25.013 0.0 . . . . . . 85 LEU CD1 . 7084 1 865 . 1 1 85 85 LEU CD2 C 13 25.013 0.0 . . . . . . 85 LEU CD2 . 7084 1 866 . 1 1 85 85 LEU N N 15 125.7 0.0 . . . . . . 85 LEU N . 7084 1 867 . 1 1 86 86 THR H H 1 9.102 0.0 . . . . . . 86 THR H . 7084 1 868 . 1 1 86 86 THR HA H 1 4.662 0.0 . . . . . . 86 THR HA . 7084 1 869 . 1 1 86 86 THR HB H 1 3.935 0.0 . . . . . . 86 THR HB . 7084 1 870 . 1 1 86 86 THR C C 13 172.81 0.0 . . . . . . 86 THR C . 7084 1 871 . 1 1 86 86 THR CA C 13 61.13 0.0 . . . . . . 86 THR CA . 7084 1 872 . 1 1 86 86 THR CB C 13 71.889 0.0 . . . . . . 86 THR CB . 7084 1 873 . 1 1 86 86 THR CG2 C 13 21.506 0.0 . . . . . . 86 THR CG2 . 7084 1 874 . 1 1 86 86 THR N N 15 120.448 0.0 . . . . . . 86 THR N . 7084 1 875 . 1 1 87 87 VAL H H 1 8.73 0.0 . . . . . . 87 VAL H . 7084 1 876 . 1 1 87 87 VAL HA H 1 4.178 0.0 . . . . . . 87 VAL HA . 7084 1 877 . 1 1 87 87 VAL HB H 1 1.849 0.0 . . . . . . 87 VAL HB . 7084 1 878 . 1 1 87 87 VAL HG11 H 1 0.603 0.0 . . . . . . 87 VAL HG1 . 7084 1 879 . 1 1 87 87 VAL HG12 H 1 0.603 0.0 . . . . . . 87 VAL HG1 . 7084 1 880 . 1 1 87 87 VAL HG13 H 1 0.603 0.0 . . . . . . 87 VAL HG1 . 7084 1 881 . 1 1 87 87 VAL HG21 H 1 0.843 0.0 . . . . . . 87 VAL HG2 . 7084 1 882 . 1 1 87 87 VAL HG22 H 1 0.843 0.0 . . . . . . 87 VAL HG2 . 7084 1 883 . 1 1 87 87 VAL HG23 H 1 0.843 0.0 . . . . . . 87 VAL HG2 . 7084 1 884 . 1 1 87 87 VAL C C 13 176.083 0.0 . . . . . . 87 VAL C . 7084 1 885 . 1 1 87 87 VAL CA C 13 62.527 0.0 . . . . . . 87 VAL CA . 7084 1 886 . 1 1 87 87 VAL CB C 13 32.037 0.0 . . . . . . 87 VAL CB . 7084 1 887 . 1 1 87 87 VAL CG2 C 13 20.945 0.0 . . . . . . 87 VAL CG2 . 7084 1 888 . 1 1 87 87 VAL N N 15 125.429 0.0 . . . . . . 87 VAL N . 7084 1 889 . 1 1 88 88 CYS H H 1 8.758 0.0 . . . . . . 88 CYS H . 7084 1 890 . 1 1 88 88 CYS HA H 1 4.402 0.0 . . . . . . 88 CYS HA . 7084 1 891 . 1 1 88 88 CYS HB2 H 1 2.913 0.0 . . . . . . 88 CYS HB1 . 7084 1 892 . 1 1 88 88 CYS HB3 H 1 2.536 0.0 . . . . . . 88 CYS HB2 . 7084 1 893 . 1 1 88 88 CYS C C 13 174.425 0.0 . . . . . . 88 CYS C . 7084 1 894 . 1 1 88 88 CYS CA C 13 59.486 0.0 . . . . . . 88 CYS CA . 7084 1 895 . 1 1 88 88 CYS CB C 13 28.152 0.0 . . . . . . 88 CYS CB . 7084 1 896 . 1 1 88 88 CYS N N 15 126.307 0.0 . . . . . . 88 CYS N . 7084 1 897 . 1 1 89 89 GLU H H 1 8.114 0.0 . . . . . . 89 GLU H . 7084 1 898 . 1 1 89 89 GLU HA H 1 4.689 0.0 . . . . . . 89 GLU HA . 7084 1 899 . 1 1 89 89 GLU HB2 H 1 1.893 0.0 . . . . . . 89 GLU HB1 . 7084 1 900 . 1 1 89 89 GLU HB3 H 1 2.078 0.0 . . . . . . 89 GLU HB2 . 7084 1 901 . 1 1 89 89 GLU HG2 H 1 2.296 0.0 . . . . . . 89 GLU HG1 . 7084 1 902 . 1 1 89 89 GLU HG3 H 1 2.296 0.0 . . . . . . 89 GLU HG2 . 7084 1 903 . 1 1 89 89 GLU CA C 13 54.22 0.0 . . . . . . 89 GLU CA . 7084 1 904 . 1 1 89 89 GLU CB C 13 31.29 0.0 . . . . . . 89 GLU CB . 7084 1 905 . 1 1 89 89 GLU CG C 13 36.024 0.0 . . . . . . 89 GLU CG . 7084 1 906 . 1 1 89 89 GLU N N 15 121.427 0.0 . . . . . . 89 GLU N . 7084 1 907 . 1 1 91 91 PRO HA H 1 4.35 0.0 . . . . . . 91 PRO HA . 7084 1 908 . 1 1 91 91 PRO HB2 H 1 1.834 0.0 . . . . . . 91 PRO HB1 . 7084 1 909 . 1 1 91 91 PRO HB3 H 1 2.231 0.0 . . . . . . 91 PRO HB2 . 7084 1 910 . 1 1 91 91 PRO HG2 H 1 1.921 0.0 . . . . . . 91 PRO HG1 . 7084 1 911 . 1 1 91 91 PRO HD2 H 1 3.595 0.0 . . . . . . 91 PRO HD1 . 7084 1 912 . 1 1 91 91 PRO HD3 H 1 3.755 0.0 . . . . . . 91 PRO HD2 . 7084 1 913 . 1 1 91 91 PRO CA C 13 62.854 0.0 . . . . . . 91 PRO CA . 7084 1 914 . 1 1 91 91 PRO CB C 13 31.974 0.0 . . . . . . 91 PRO CB . 7084 1 915 . 1 1 91 91 PRO CG C 13 27.542 0.0 . . . . . . 91 PRO CG . 7084 1 916 . 1 1 91 91 PRO CD C 13 50.221 0.0 . . . . . . 91 PRO CD . 7084 1 917 . 1 1 92 92 LYS H H 1 8.292 0.0 . . . . . . 92 LYS H . 7084 1 918 . 1 1 92 92 LYS HA H 1 4.571 0.0 . . . . . . 92 LYS HA . 7084 1 919 . 1 1 92 92 LYS HB2 H 1 1.702 0.0 . . . . . . 92 LYS HB1 . 7084 1 920 . 1 1 92 92 LYS HB3 H 1 1.805 0.0 . . . . . . 92 LYS HB2 . 7084 1 921 . 1 1 92 92 LYS HG2 H 1 1.482 0.0 . . . . . . 92 LYS HG1 . 7084 1 922 . 1 1 92 92 LYS HD2 H 1 1.684 0.0 . . . . . . 92 LYS HD1 . 7084 1 923 . 1 1 92 92 LYS HE2 H 1 3.003 0.0 . . . . . . 92 LYS HE1 . 7084 1 924 . 1 1 92 92 LYS CA C 13 54.29 0.0 . . . . . . 92 LYS CA . 7084 1 925 . 1 1 92 92 LYS CB C 13 32.62 0.0 . . . . . . 92 LYS CB . 7084 1 926 . 1 1 92 92 LYS CG C 13 24.657 0.0 . . . . . . 92 LYS CG . 7084 1 927 . 1 1 92 92 LYS CD C 13 29.099 0.0 . . . . . . 92 LYS CD . 7084 1 928 . 1 1 92 92 LYS CE C 13 42.291 0.0 . . . . . . 92 LYS CE . 7084 1 929 . 1 1 92 92 LYS N N 15 122.899 0.0 . . . . . . 92 LYS N . 7084 1 930 . 1 1 93 93 PRO HA H 1 4.419 0.0 . . . . . . 93 PRO HA . 7084 1 931 . 1 1 93 93 PRO HB2 H 1 2.279 0.0 . . . . . . 93 PRO HB1 . 7084 1 932 . 1 1 93 93 PRO HB3 H 1 1.866 0.0 . . . . . . 93 PRO HB2 . 7084 1 933 . 1 1 93 93 PRO HG2 H 1 1.976 0.0 . . . . . . 93 PRO HG1 . 7084 1 934 . 1 1 93 93 PRO HD2 H 1 3.805 0.0 . . . . . . 93 PRO HD1 . 7084 1 935 . 1 1 93 93 PRO HD3 H 1 3.618 0.0 . . . . . . 93 PRO HD2 . 7084 1 936 . 1 1 93 93 PRO C C 13 176.67 0.0 . . . . . . 93 PRO C . 7084 1 937 . 1 1 93 93 PRO CA C 13 63.029 0.0 . . . . . . 93 PRO CA . 7084 1 938 . 1 1 93 93 PRO CB C 13 32.165 0.0 . . . . . . 93 PRO CB . 7084 1 939 . 1 1 93 93 PRO CG C 13 27.42 0.0 . . . . . . 93 PRO CG . 7084 1 940 . 1 1 93 93 PRO CD C 13 50.541 0.0 . . . . . . 93 PRO CD . 7084 1 941 . 1 1 94 94 ILE H H 1 8.236 0.0 . . . . . . 94 ILE H . 7084 1 942 . 1 1 94 94 ILE HA H 1 4.11 0.0 . . . . . . 94 ILE HA . 7084 1 943 . 1 1 94 94 ILE HB H 1 1.852 0.0 . . . . . . 94 ILE HB . 7084 1 944 . 1 1 94 94 ILE HG12 H 1 1.507 0.0 . . . . . . 94 ILE HG11 . 7084 1 945 . 1 1 94 94 ILE HG21 H 1 1.193 0.0 . . . . . . 94 ILE HG2 . 7084 1 946 . 1 1 94 94 ILE HG22 H 1 1.193 0.0 . . . . . . 94 ILE HG2 . 7084 1 947 . 1 1 94 94 ILE HG23 H 1 1.193 0.0 . . . . . . 94 ILE HG2 . 7084 1 948 . 1 1 94 94 ILE HD11 H 1 0.902 0.0 . . . . . . 94 ILE HD1 . 7084 1 949 . 1 1 94 94 ILE HD12 H 1 0.902 0.0 . . . . . . 94 ILE HD1 . 7084 1 950 . 1 1 94 94 ILE HD13 H 1 0.902 0.0 . . . . . . 94 ILE HD1 . 7084 1 951 . 1 1 94 94 ILE C C 13 175.475 0.0 . . . . . . 94 ILE C . 7084 1 952 . 1 1 94 94 ILE CA C 13 61.43 0.0 . . . . . . 94 ILE CA . 7084 1 953 . 1 1 94 94 ILE CB C 13 38.642 0.0 . . . . . . 94 ILE CB . 7084 1 954 . 1 1 94 94 ILE CG1 C 13 27.297 0.0 . . . . . . 94 ILE CG1 . 7084 1 955 . 1 1 94 94 ILE CG2 C 13 17.444 0.0 . . . . . . 94 ILE CG2 . 7084 1 956 . 1 1 94 94 ILE CD1 C 13 12.945 0.0 . . . . . . 94 ILE CD1 . 7084 1 957 . 1 1 94 94 ILE N N 15 121.402 0.0 . . . . . . 94 ILE N . 7084 1 958 . 1 1 95 95 MET H H 1 7.896 0.0 . . . . . . 95 MET H . 7084 1 959 . 1 1 95 95 MET HA H 1 4.285 0.0 . . . . . . 95 MET HA . 7084 1 960 . 1 1 95 95 MET HB2 H 1 1.927 0.0 . . . . . . 95 MET HB1 . 7084 1 961 . 1 1 95 95 MET HB3 H 1 2.057 0.0 . . . . . . 95 MET HB2 . 7084 1 962 . 1 1 95 95 MET CA C 13 56.98 0.0 . . . . . . 95 MET CA . 7084 1 963 . 1 1 95 95 MET CB C 13 34.35 0.0 . . . . . . 95 MET CB . 7084 1 964 . 1 1 95 95 MET N N 15 129.247 0.0 . . . . . . 95 MET N . 7084 1 stop_ save_