data_5177 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 5177 _Entry.Title ; Backbone and side-chain 1H, 13C, and 15N chemical shift assignments for chick cofilin ; _Entry.Type . _Entry.Version_type original _Entry.Submission_date 2001-10-12 _Entry.Accession_date 2001-10-16 _Entry.Last_release_date 2002-05-06 _Entry.Original_release_date 2002-05-06 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Naresh Bains . P.S. . 5177 2 Vitaliy Gorbatyuk . Ya. . 5177 3 Neil Nosworthy . J. . 5177 4 Scott Robson . A. . 5177 5 Mark Maciejewski . W. . 5177 6 Cristobal 'dos Remedios' . G. . 5177 7 Glenn King . F. . 5177 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 5177 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 1233 5177 '13C chemical shifts' 713 5177 '15N chemical shifts' 172 5177 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2002-05-06 2001-10-12 original author . 5177 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 5177 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 21880669 _Citation.DOI . _Citation.PubMed_ID 11885570 _Citation.Full_citation . _Citation.Title 'Letter to the Editor: Backbone and Side-chain 1H, 15N, and 13C Assignments for Chick Cofilin' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 22 _Citation.Journal_issue 2 _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 193 _Citation.Page_last 194 _Citation.Year 2002 _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 Naresh Bains . P.S. . 5177 1 2 Vitaliy Gorbatyuk . Ya. . 5177 1 3 Neil Nosworthy . J. . 5177 1 4 Scott Robson . A. . 5177 1 5 Mark Maciejewski . W. . 5177 1 6 Cristobal 'dos Remedios' . G. . 5177 1 7 Glenn King . F. . 5177 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID cofilin 5177 1 actin 5177 1 stop_ save_ save_Reference_1 _Citation.Sf_category citations _Citation.Sf_framecode Reference_1 _Citation.Entry_ID 5177 _Citation.ID 2 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 1699599 _Citation.Full_citation ; Abe H, Endo T, Yamamoto K, Obinata T. Sequence of cDNAs encoding actin depolymerizing factor and cofilin of embryonic chicken skeletal muscle: two functionally distinct actin-regulatory proteins exhibit high structural homology. Biochemistry. 1990 Aug 14;29(32):7420-5. ; _Citation.Title 'Sequence of cDNAs encoding actin depolymerizing factor and cofilin of embryonic chicken skeletal muscle: two functionally distinct actin-regulatory proteins exhibit high structural homology.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full Biochemistry _Citation.Journal_volume 29 _Citation.Journal_issue 32 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0006-2960 _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 7420 _Citation.Page_last 7425 _Citation.Year 1990 _Citation.Details ; Two actin-regulatory proteins of 19 and 20 kDa are involved in the regulation of actin assembly in developing chicken skeletal muscle. They are homologous with actin depolymerizing factor (ADF) and cofilin, a pH-dependent actin-modulating protein, which were originally discovered in chicken and mammalian brain, respectively. In this study, full-length cDNA clones were isolated by screening a lambda gt11 cDNA library constructed from poly(A+) RNA of embryonic chicken skeletal muscle with the antibodies specific for each protein, and their complete sequences were determined. The chicken cofilin cDNA encoded a protein of 166 amino acids, the sequence of which had over 80% identity with that of porcine brain cofilin. The amino acid sequence of the ADF was 165 amino acids and showed about 70% identity with either chicken or mammalian cofilin, in spite of the fact that ADF and cofilin are functionally distinct. Like chicken and mammalian cofilin, ADF contained a sequence similar to the nuclear transport signal sequence of SV40 large T antigen. ADF and cofilin shared a hexapeptide identical with the amino-terminal sequence of tropomyosin as well as the regions homologous to other actin-regulatory proteins, including depactin, gelsolin, and profilin. The overall nucleotide sequences and Southern blot analysis of genomic DNA, however, indicated that the two proteins were derived from different genes. ; 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 H. Abe H. . . 5177 2 2 T. Endo T. . . 5177 2 3 K. Yamamoto K. . . 5177 2 4 T. Obinata T. . . 5177 2 stop_ save_ save_Reference_2 _Citation.Sf_category citations _Citation.Sf_framecode Reference_2 _Citation.Entry_ID 5177 _Citation.ID 3 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 8520220 _Citation.Full_citation ; Delaglio F, Grzesiek S, Vuister GW, Zhu G, Pfeifer J, Bax A. NMRPipe: a multidimensional spectral processing system based on UNIX pipes. J Biomol NMR. 1995 Nov;6(3):277-93. ; _Citation.Title 'NMRPipe: a multidimensional spectral processing system based on UNIX pipes.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full 'Journal of biomolecular NMR' _Citation.Journal_volume 6 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN 0925-2738 _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 277 _Citation.Page_last 293 _Citation.Year 1995 _Citation.Details ; The NMRPipe system is a UNIX software environment of processing, graphics, and analysis tools designed to meet current routine and research-oriented multidimensional processing requirements, and to anticipate and accommodate future demands and developments. The system is based on UNIX pipes, which allow programs running simultaneously to exchange streams of data under user control. In an NMRPipe processing scheme, a stream of spectral data flows through a pipeline of processing programs, each of which performs one component of the overall scheme, such as Fourier transformation or linear prediction. Complete multidimensional processing schemes are constructed as simple UNIX shell scripts. The processing modules themselves maintain and exploit accurate records of data sizes, detection modes, and calibration information in all dimensions, so that schemes can be constructed without the need to explicitly define or anticipate data sizes or storage details of real and imaginary channels during processing. The asynchronous pipeline scheme provides other substantial advantages, including high flexibility, favorable processing speeds, choice of both all-in-memory and disk-bound processing, easy adaptation to different data formats, simpler software development and maintenance, and the ability to distribute processing tasks on multi-CPU computers and computer networks. ; 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 F. Delaglio F. . . 5177 3 2 S. Grzesiek S. . . 5177 3 3 'G. W.' Vuister G. W. . 5177 3 4 G. Zhu G. . . 5177 3 5 J. Pfeifer J. . . 5177 3 6 A. Bax A. . . 5177 3 stop_ save_ save_Reference_3 _Citation.Sf_category citations _Citation.Sf_framecode Reference_3 _Citation.Entry_ID 5177 _Citation.ID 4 _Citation.Class 'reference citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation ; Bartels, C., Xia, T.-H., Billeter, M., Guntert, P., and Wuthrich, K. (1995) J. Biomol. NMR 5, 1-10. ; _Citation.Title . _Citation.Status . _Citation.Type . _Citation.Journal_abbrev . _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 . save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_cofilin _Assembly.Sf_category assembly _Assembly.Sf_framecode system_cofilin _Assembly.Entry_ID 5177 _Assembly.ID 1 _Assembly.Name 'chick cofilin' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details ; The deposited protein sequence (SWISS-PROT accession number P21566) is incorrect. The NMR chemical shift assignments revealed that residues 53-54 are Lys-Gln and NOT Thr-Arg as reported in the sequence database. ; _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 5177 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'chick cofilin' 1 $cofilin . . . native . . . . . 5177 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . SWISS-PROT P21566 . . . . . . 5177 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'chick cofilin' system 5177 1 cofilin abbreviation 5177 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'modulates actin polymerization' 5177 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_cofilin _Entity.Sf_category entity _Entity.Sf_framecode cofilin _Entity.Entry_ID 5177 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'chick cofilin' _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 ; MASGVTVNDEVIKVFNDMKV RKSSTPEEIKKRKKAVLFCL SDDKKQIIVEEAKQILVGDI GDTVEDPYTAFVKLLPLNDC RYALYDATYETKESKKEDLV FIFWAPESAPLKSKMIYASS KDAIKKKFTGIKHEWQVNGL DDIKDRSTLGEKLGGNVVVS LEGKPL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 166 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 18662 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1TVJ . "Solution Structure Of Chick Cofilin" . . . . . 100.00 166 100.00 100.00 5.71e-115 . . . . 5177 1 2 no DBJ BAE27737 . "unnamed protein product [Mus musculus]" . . . . . 100.00 166 97.59 99.40 2.96e-112 . . . . 5177 1 3 no DBJ BAE87142 . "unnamed protein product [Macaca fascicularis]" . . . . . 100.00 166 98.19 99.40 5.04e-113 . . . . 5177 1 4 no DBJ BAG36842 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 166 98.19 99.40 5.04e-113 . . . . 5177 1 5 no GB AAA37433 . "cofilin [Mus musculus]" . . . . . 100.00 166 97.59 99.40 2.96e-112 . . . . 5177 1 6 no GB AAA62732 . "cofilin [Gallus gallus]" . . . . . 100.00 166 98.80 99.40 2.01e-113 . . . . 5177 1 7 no GB AAD31280 . "cofilin isoform 1 [Homo sapiens]" . . . . . 100.00 166 98.19 99.40 5.04e-113 . . . . 5177 1 8 no GB AAD31281 . "cofilin isoform 2 [Homo sapiens]" . . . . . 100.00 166 98.19 99.40 5.04e-113 . . . . 5177 1 9 no GB AAF64498 . "cofilin 2b [Homo sapiens]" . . . . . 100.00 166 98.19 99.40 5.04e-113 . . . . 5177 1 10 no REF NP_001004406 . "cofilin-2 [Gallus gallus]" . . . . . 100.00 166 98.80 99.40 2.01e-113 . . . . 5177 1 11 no REF NP_001020386 . "cofilin-2 [Sus scrofa]" . . . . . 100.00 166 98.19 99.40 5.04e-113 . . . . 5177 1 12 no REF NP_001069622 . "cofilin-2 [Bos taurus]" . . . . . 100.00 166 98.19 99.40 5.04e-113 . . . . 5177 1 13 no REF NP_001102452 . "cofilin-2 [Rattus norvegicus]" . . . . . 100.00 166 97.59 99.40 2.96e-112 . . . . 5177 1 14 no REF NP_001162212 . "cofilin 2 homolog [Papio anubis]" . . . . . 100.00 166 97.59 98.80 1.37e-111 . . . . 5177 1 15 no SP P21566 . "RecName: Full=Cofilin-2; AltName: Full=Cofilin, muscle isoform [Gallus gallus]" . . . . . 100.00 166 100.00 100.00 5.71e-115 . . . . 5177 1 16 no SP P45591 . "RecName: Full=Cofilin-2; AltName: Full=Cofilin, muscle isoform [Mus musculus]" . . . . . 100.00 166 97.59 99.40 2.96e-112 . . . . 5177 1 17 no SP Q148F1 . "RecName: Full=Cofilin-2; AltName: Full=Cofilin, muscle isoform [Bos taurus]" . . . . . 100.00 166 98.19 99.40 5.04e-113 . . . . 5177 1 18 no SP Q5G6V9 . "RecName: Full=Cofilin-2; AltName: Full=Cofilin, muscle isoform [Sus scrofa]" . . . . . 100.00 166 98.19 99.40 5.04e-113 . . . . 5177 1 19 no SP Q9Y281 . "RecName: Full=Cofilin-2; AltName: Full=Cofilin, muscle isoform [Homo sapiens]" . . . . . 100.00 166 98.19 99.40 5.04e-113 . . . . 5177 1 20 no TPG DAA17465 . "TPA: cofilin-2 [Bos taurus]" . . . . . 100.00 166 98.19 99.40 5.04e-113 . . . . 5177 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'chick cofilin' common 5177 1 cofilin abbreviation 5177 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 5177 1 2 . ALA . 5177 1 3 . SER . 5177 1 4 . GLY . 5177 1 5 . VAL . 5177 1 6 . THR . 5177 1 7 . VAL . 5177 1 8 . ASN . 5177 1 9 . ASP . 5177 1 10 . GLU . 5177 1 11 . VAL . 5177 1 12 . ILE . 5177 1 13 . LYS . 5177 1 14 . VAL . 5177 1 15 . PHE . 5177 1 16 . ASN . 5177 1 17 . ASP . 5177 1 18 . MET . 5177 1 19 . LYS . 5177 1 20 . VAL . 5177 1 21 . ARG . 5177 1 22 . LYS . 5177 1 23 . SER . 5177 1 24 . SER . 5177 1 25 . THR . 5177 1 26 . PRO . 5177 1 27 . GLU . 5177 1 28 . GLU . 5177 1 29 . ILE . 5177 1 30 . LYS . 5177 1 31 . LYS . 5177 1 32 . ARG . 5177 1 33 . LYS . 5177 1 34 . LYS . 5177 1 35 . ALA . 5177 1 36 . VAL . 5177 1 37 . LEU . 5177 1 38 . PHE . 5177 1 39 . CYS . 5177 1 40 . LEU . 5177 1 41 . SER . 5177 1 42 . ASP . 5177 1 43 . ASP . 5177 1 44 . LYS . 5177 1 45 . LYS . 5177 1 46 . GLN . 5177 1 47 . ILE . 5177 1 48 . ILE . 5177 1 49 . VAL . 5177 1 50 . GLU . 5177 1 51 . GLU . 5177 1 52 . ALA . 5177 1 53 . LYS . 5177 1 54 . GLN . 5177 1 55 . ILE . 5177 1 56 . LEU . 5177 1 57 . VAL . 5177 1 58 . GLY . 5177 1 59 . ASP . 5177 1 60 . ILE . 5177 1 61 . GLY . 5177 1 62 . ASP . 5177 1 63 . THR . 5177 1 64 . VAL . 5177 1 65 . GLU . 5177 1 66 . ASP . 5177 1 67 . PRO . 5177 1 68 . TYR . 5177 1 69 . THR . 5177 1 70 . ALA . 5177 1 71 . PHE . 5177 1 72 . VAL . 5177 1 73 . LYS . 5177 1 74 . LEU . 5177 1 75 . LEU . 5177 1 76 . PRO . 5177 1 77 . LEU . 5177 1 78 . ASN . 5177 1 79 . ASP . 5177 1 80 . CYS . 5177 1 81 . ARG . 5177 1 82 . TYR . 5177 1 83 . ALA . 5177 1 84 . LEU . 5177 1 85 . TYR . 5177 1 86 . ASP . 5177 1 87 . ALA . 5177 1 88 . THR . 5177 1 89 . TYR . 5177 1 90 . GLU . 5177 1 91 . THR . 5177 1 92 . LYS . 5177 1 93 . GLU . 5177 1 94 . SER . 5177 1 95 . LYS . 5177 1 96 . LYS . 5177 1 97 . GLU . 5177 1 98 . ASP . 5177 1 99 . LEU . 5177 1 100 . VAL . 5177 1 101 . PHE . 5177 1 102 . ILE . 5177 1 103 . PHE . 5177 1 104 . TRP . 5177 1 105 . ALA . 5177 1 106 . PRO . 5177 1 107 . GLU . 5177 1 108 . SER . 5177 1 109 . ALA . 5177 1 110 . PRO . 5177 1 111 . LEU . 5177 1 112 . LYS . 5177 1 113 . SER . 5177 1 114 . LYS . 5177 1 115 . MET . 5177 1 116 . ILE . 5177 1 117 . TYR . 5177 1 118 . ALA . 5177 1 119 . SER . 5177 1 120 . SER . 5177 1 121 . LYS . 5177 1 122 . ASP . 5177 1 123 . ALA . 5177 1 124 . ILE . 5177 1 125 . LYS . 5177 1 126 . LYS . 5177 1 127 . LYS . 5177 1 128 . PHE . 5177 1 129 . THR . 5177 1 130 . GLY . 5177 1 131 . ILE . 5177 1 132 . LYS . 5177 1 133 . HIS . 5177 1 134 . GLU . 5177 1 135 . TRP . 5177 1 136 . GLN . 5177 1 137 . VAL . 5177 1 138 . ASN . 5177 1 139 . GLY . 5177 1 140 . LEU . 5177 1 141 . ASP . 5177 1 142 . ASP . 5177 1 143 . ILE . 5177 1 144 . LYS . 5177 1 145 . ASP . 5177 1 146 . ARG . 5177 1 147 . SER . 5177 1 148 . THR . 5177 1 149 . LEU . 5177 1 150 . GLY . 5177 1 151 . GLU . 5177 1 152 . LYS . 5177 1 153 . LEU . 5177 1 154 . GLY . 5177 1 155 . GLY . 5177 1 156 . ASN . 5177 1 157 . VAL . 5177 1 158 . VAL . 5177 1 159 . VAL . 5177 1 160 . SER . 5177 1 161 . LEU . 5177 1 162 . GLU . 5177 1 163 . GLY . 5177 1 164 . LYS . 5177 1 165 . PRO . 5177 1 166 . LEU . 5177 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 5177 1 . ALA 2 2 5177 1 . SER 3 3 5177 1 . GLY 4 4 5177 1 . VAL 5 5 5177 1 . THR 6 6 5177 1 . VAL 7 7 5177 1 . ASN 8 8 5177 1 . ASP 9 9 5177 1 . GLU 10 10 5177 1 . VAL 11 11 5177 1 . ILE 12 12 5177 1 . LYS 13 13 5177 1 . VAL 14 14 5177 1 . PHE 15 15 5177 1 . ASN 16 16 5177 1 . ASP 17 17 5177 1 . MET 18 18 5177 1 . LYS 19 19 5177 1 . VAL 20 20 5177 1 . ARG 21 21 5177 1 . LYS 22 22 5177 1 . SER 23 23 5177 1 . SER 24 24 5177 1 . THR 25 25 5177 1 . PRO 26 26 5177 1 . GLU 27 27 5177 1 . GLU 28 28 5177 1 . ILE 29 29 5177 1 . LYS 30 30 5177 1 . LYS 31 31 5177 1 . ARG 32 32 5177 1 . LYS 33 33 5177 1 . LYS 34 34 5177 1 . ALA 35 35 5177 1 . VAL 36 36 5177 1 . LEU 37 37 5177 1 . PHE 38 38 5177 1 . CYS 39 39 5177 1 . LEU 40 40 5177 1 . SER 41 41 5177 1 . ASP 42 42 5177 1 . ASP 43 43 5177 1 . LYS 44 44 5177 1 . LYS 45 45 5177 1 . GLN 46 46 5177 1 . ILE 47 47 5177 1 . ILE 48 48 5177 1 . VAL 49 49 5177 1 . GLU 50 50 5177 1 . GLU 51 51 5177 1 . ALA 52 52 5177 1 . LYS 53 53 5177 1 . GLN 54 54 5177 1 . ILE 55 55 5177 1 . LEU 56 56 5177 1 . VAL 57 57 5177 1 . GLY 58 58 5177 1 . ASP 59 59 5177 1 . ILE 60 60 5177 1 . GLY 61 61 5177 1 . ASP 62 62 5177 1 . THR 63 63 5177 1 . VAL 64 64 5177 1 . GLU 65 65 5177 1 . ASP 66 66 5177 1 . PRO 67 67 5177 1 . TYR 68 68 5177 1 . THR 69 69 5177 1 . ALA 70 70 5177 1 . PHE 71 71 5177 1 . VAL 72 72 5177 1 . LYS 73 73 5177 1 . LEU 74 74 5177 1 . LEU 75 75 5177 1 . PRO 76 76 5177 1 . LEU 77 77 5177 1 . ASN 78 78 5177 1 . ASP 79 79 5177 1 . CYS 80 80 5177 1 . ARG 81 81 5177 1 . TYR 82 82 5177 1 . ALA 83 83 5177 1 . LEU 84 84 5177 1 . TYR 85 85 5177 1 . ASP 86 86 5177 1 . ALA 87 87 5177 1 . THR 88 88 5177 1 . TYR 89 89 5177 1 . GLU 90 90 5177 1 . THR 91 91 5177 1 . LYS 92 92 5177 1 . GLU 93 93 5177 1 . SER 94 94 5177 1 . LYS 95 95 5177 1 . LYS 96 96 5177 1 . GLU 97 97 5177 1 . ASP 98 98 5177 1 . LEU 99 99 5177 1 . VAL 100 100 5177 1 . PHE 101 101 5177 1 . ILE 102 102 5177 1 . PHE 103 103 5177 1 . TRP 104 104 5177 1 . ALA 105 105 5177 1 . PRO 106 106 5177 1 . GLU 107 107 5177 1 . SER 108 108 5177 1 . ALA 109 109 5177 1 . PRO 110 110 5177 1 . LEU 111 111 5177 1 . LYS 112 112 5177 1 . SER 113 113 5177 1 . LYS 114 114 5177 1 . MET 115 115 5177 1 . ILE 116 116 5177 1 . TYR 117 117 5177 1 . ALA 118 118 5177 1 . SER 119 119 5177 1 . SER 120 120 5177 1 . LYS 121 121 5177 1 . ASP 122 122 5177 1 . ALA 123 123 5177 1 . ILE 124 124 5177 1 . LYS 125 125 5177 1 . LYS 126 126 5177 1 . LYS 127 127 5177 1 . PHE 128 128 5177 1 . THR 129 129 5177 1 . GLY 130 130 5177 1 . ILE 131 131 5177 1 . LYS 132 132 5177 1 . HIS 133 133 5177 1 . GLU 134 134 5177 1 . TRP 135 135 5177 1 . GLN 136 136 5177 1 . VAL 137 137 5177 1 . ASN 138 138 5177 1 . GLY 139 139 5177 1 . LEU 140 140 5177 1 . ASP 141 141 5177 1 . ASP 142 142 5177 1 . ILE 143 143 5177 1 . LYS 144 144 5177 1 . ASP 145 145 5177 1 . ARG 146 146 5177 1 . SER 147 147 5177 1 . THR 148 148 5177 1 . LEU 149 149 5177 1 . GLY 150 150 5177 1 . GLU 151 151 5177 1 . LYS 152 152 5177 1 . LEU 153 153 5177 1 . GLY 154 154 5177 1 . GLY 155 155 5177 1 . ASN 156 156 5177 1 . VAL 157 157 5177 1 . VAL 158 158 5177 1 . VAL 159 159 5177 1 . SER 160 160 5177 1 . LEU 161 161 5177 1 . GLU 162 162 5177 1 . GLY 163 163 5177 1 . LYS 164 164 5177 1 . PRO 165 165 5177 1 . LEU 166 166 5177 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 5177 _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 $cofilin . 9031 organism . 'Gallus gallus' Chicken . . Eukaryota Metazoa Gallus gallus . . . . 'skeletal muscle' . . . . . . . . . . . . . . . . 5177 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 5177 _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 $cofilin . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli XL1-Blue . . . . . . . . . . . . . . . . . . . ; The protein was expressed as a GST-fusion protein in E. coli, then purified using glutathione affinity chromatography. ; . . 5177 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_Sample_1 _Sample.Sf_category sample _Sample.Sf_framecode Sample_1 _Sample.Entry_ID 5177 _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 'chick cofilin' '[U-99% 15N]' . . 1 $cofilin . . 1.0 . . mM . . . . 5177 1 2 NaCl . . . . . . . 50 . . mM . . . . 5177 1 3 PIPES . . . . . . . 10 . . mM . . . . 5177 1 4 H2O . . . . . . . 92.5 . . % . . . . 5177 1 5 D2O . . . . . . . 7.5 . . % . . . . 5177 1 stop_ save_ save_Sample_2 _Sample.Sf_category sample _Sample.Sf_framecode Sample_2 _Sample.Entry_ID 5177 _Sample.ID 2 _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 'chick cofilin' '[U-99% 13C; U-99% 15N]' . . 1 $cofilin . . 1.0 . . mM . . . . 5177 2 2 NaCl . . . . . . . 50 . . mM . . . . 5177 2 3 PIPES . . . . . . . 10 . . mM . . . . 5177 2 4 H2O . . . . . . . 92.5 . . % . . . . 5177 2 5 D2O . . . . . . . 7.5 . . % . . . . 5177 2 stop_ save_ save_Sample_3 _Sample.Sf_category sample _Sample.Sf_framecode Sample_3 _Sample.Entry_ID 5177 _Sample.ID 3 _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 'chick cofilin' '[U-99% 13C; U-99% 15N]' . . 1 $cofilin . . 1.0 . . mM . . . . 5177 3 2 NaCl . . . . . . . 50 . . mM . . . . 5177 3 3 PIPES . . . . . . . 10 . . mM . . . . 5177 3 4 D2O . . . . . . . 100 . . % . . . . 5177 3 stop_ save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Ex-cond_1 _Sample_condition_list.Entry_ID 5177 _Sample_condition_list.ID 1 _Sample_condition_list.Details 'The sample was equilibrated for at least 30 min prior to data acquisition.' 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 6.8 0.05 n/a 5177 1 temperature 298 0.5 K 5177 1 'ionic strength' 0.06 0.01 M 5177 1 stop_ save_ ############################ # Computer software used # ############################ save_nmrPipe _Software.Sf_category software _Software.Sf_framecode nmrPipe _Software.Entry_ID 5177 _Software.ID 1 _Software.Name nmrPipe _Software.Version . _Software.Details ; nmrPipe was run using scripts generated on our website at http://sbtools.uchc.edu/nmr/. ; loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'NMR data processing' 5177 1 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 3 $Reference_2 5177 1 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 5177 _Software.ID 2 _Software.Name XEASY _Software.Version . _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Spectral analysis' 5177 2 'resonance assignment' 5177 2 stop_ loop_ _Software_citation.Citation_ID _Software_citation.Citation_label _Software_citation.Entry_ID _Software_citation.Software_ID 4 $Reference_3 5177 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 5177 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 5177 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 5177 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Varian INOVA . 500 . . . 5177 1 2 NMR_spectrometer_2 Varian INOVA . 600 . . . 5177 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 5177 _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 '3D HNCACB' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 2 '3D CBCA(CO)NH' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 3 '3D HNCO' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 4 '3D HCCH-COSY' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 5 '3D HCCH-TOCSY' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 6 '3D HC(CO)NH-TOCSY' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 7 '3D C(CO)NH-TOCSY' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 8 '3D 15N-edited NOESY-HSQC' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 9 '3D 13C-edited NOESY-HSQC' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 10 '2D (HB)CB(CGCD)HD' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 11 '2D 1H-1H NOESY' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 12 '2D 1H-1H DQF-COSY' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 13 '2D TOCSY' . . . . . . . . . . . . . . . . 1 $Ex-cond_1 . . . . . . . . . . . . . . . . . . . . . 5177 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '3D HNCACB' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '3D CBCA(CO)NH' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name '3D HNCO' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name '3D HCCH-COSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name '3D HCCH-TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_6 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name '3D HC(CO)NH-TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_7 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_7 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 7 _NMR_spec_expt.Name '3D C(CO)NH-TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_8 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_8 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 8 _NMR_spec_expt.Name '3D 15N-edited NOESY-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 . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_9 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_9 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 9 _NMR_spec_expt.Name '3D 13C-edited NOESY-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 . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_10 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_10 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 10 _NMR_spec_expt.Name '2D (HB)CB(CGCD)HD' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_11 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_11 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 11 _NMR_spec_expt.Name '2D 1H-1H NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_12 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_12 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 12 _NMR_spec_expt.Name '2D 1H-1H DQF-COSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_13 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_13 _NMR_spec_expt.Entry_ID 5177 _NMR_spec_expt.ID 13 _NMR_spec_expt.Name '2D TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 5177 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 5177 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 5177 1 C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 5177 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_Cofilin_chemical_shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode Cofilin_chemical_shifts _Assigned_chem_shift_list.Entry_ID 5177 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Ex-cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $Sample_1 . 5177 1 . . 2 $Sample_2 . 5177 1 . . 3 $Sample_3 . 5177 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 1 1 MET CA C 13 55.5 0.3 . 1 . . . . . . . . 5177 1 2 . 1 1 1 1 MET HA H 1 4.57 0.02 . 1 . . . . . . . . 5177 1 3 . 1 1 1 1 MET CB C 13 33.0 0.3 . 1 . . . . . . . . 5177 1 4 . 1 1 1 1 MET HB2 H 1 2.06 0.02 . 2 . . . . . . . . 5177 1 5 . 1 1 1 1 MET HB3 H 1 2.16 0.02 . 2 . . . . . . . . 5177 1 6 . 1 1 1 1 MET CG C 13 32.0 0.3 . 1 . . . . . . . . 5177 1 7 . 1 1 1 1 MET HG2 H 1 2.61 0.02 . 2 . . . . . . . . 5177 1 8 . 1 1 1 1 MET HG3 H 1 2.67 0.02 . 2 . . . . . . . . 5177 1 9 . 1 1 1 1 MET C C 13 176.0 0.3 . 1 . . . . . . . . 5177 1 10 . 1 1 2 2 ALA N N 15 126.0 0.2 . 1 . . . . . . . . 5177 1 11 . 1 1 2 2 ALA H H 1 8.39 0.02 . 1 . . . . . . . . 5177 1 12 . 1 1 2 2 ALA CA C 13 52.7 0.3 . 1 . . . . . . . . 5177 1 13 . 1 1 2 2 ALA HA H 1 4.39 0.02 . 1 . . . . . . . . 5177 1 14 . 1 1 2 2 ALA HB1 H 1 1.42 0.02 . 1 . . . . . . . . 5177 1 15 . 1 1 2 2 ALA HB2 H 1 1.42 0.02 . 1 . . . . . . . . 5177 1 16 . 1 1 2 2 ALA HB3 H 1 1.42 0.02 . 1 . . . . . . . . 5177 1 17 . 1 1 2 2 ALA CB C 13 19.4 0.3 . 1 . . . . . . . . 5177 1 18 . 1 1 2 2 ALA C C 13 177.7 0.3 . 1 . . . . . . . . 5177 1 19 . 1 1 3 3 SER N N 15 115.4 0.2 . 1 . . . . . . . . 5177 1 20 . 1 1 3 3 SER H H 1 8.29 0.02 . 1 . . . . . . . . 5177 1 21 . 1 1 3 3 SER CA C 13 58.5 0.3 . 1 . . . . . . . . 5177 1 22 . 1 1 3 3 SER HA H 1 4.55 0.02 . 1 . . . . . . . . 5177 1 23 . 1 1 3 3 SER CB C 13 64.1 0.3 . 1 . . . . . . . . 5177 1 24 . 1 1 3 3 SER HB2 H 1 3.93 0.02 . 1 . . . . . . . . 5177 1 25 . 1 1 3 3 SER HB3 H 1 3.93 0.02 . 1 . . . . . . . . 5177 1 26 . 1 1 3 3 SER C C 13 175.0 0.3 . 1 . . . . . . . . 5177 1 27 . 1 1 4 4 GLY N N 15 111.3 0.2 . 1 . . . . . . . . 5177 1 28 . 1 1 4 4 GLY H H 1 8.35 0.02 . 1 . . . . . . . . 5177 1 29 . 1 1 4 4 GLY CA C 13 45.3 0.3 . 1 . . . . . . . . 5177 1 30 . 1 1 4 4 GLY HA2 H 1 3.94 0.02 . 2 . . . . . . . . 5177 1 31 . 1 1 4 4 GLY HA3 H 1 4.04 0.02 . 2 . . . . . . . . 5177 1 32 . 1 1 4 4 GLY C C 13 173.6 0.3 . 1 . . . . . . . . 5177 1 33 . 1 1 5 5 VAL N N 15 120.6 0.2 . 1 . . . . . . . . 5177 1 34 . 1 1 5 5 VAL H H 1 7.83 0.02 . 1 . . . . . . . . 5177 1 35 . 1 1 5 5 VAL CA C 13 62.0 0.3 . 1 . . . . . . . . 5177 1 36 . 1 1 5 5 VAL HA H 1 4.29 0.02 . 1 . . . . . . . . 5177 1 37 . 1 1 5 5 VAL CB C 13 33.5 0.3 . 1 . . . . . . . . 5177 1 38 . 1 1 5 5 VAL HB H 1 1.82 0.02 . 1 . . . . . . . . 5177 1 39 . 1 1 5 5 VAL HG11 H 1 0.84 0.02 . 2 . . . . . . . . 5177 1 40 . 1 1 5 5 VAL HG12 H 1 0.84 0.02 . 2 . . . . . . . . 5177 1 41 . 1 1 5 5 VAL HG13 H 1 0.84 0.02 . 2 . . . . . . . . 5177 1 42 . 1 1 5 5 VAL HG21 H 1 0.70 0.02 . 2 . . . . . . . . 5177 1 43 . 1 1 5 5 VAL HG22 H 1 0.70 0.02 . 2 . . . . . . . . 5177 1 44 . 1 1 5 5 VAL HG23 H 1 0.70 0.02 . 2 . . . . . . . . 5177 1 45 . 1 1 5 5 VAL CG1 C 13 20.9 0.3 . 1 . . . . . . . . 5177 1 46 . 1 1 5 5 VAL CG2 C 13 21.5 0.3 . 1 . . . . . . . . 5177 1 47 . 1 1 5 5 VAL C C 13 176.2 0.3 . 1 . . . . . . . . 5177 1 48 . 1 1 6 6 THR N N 15 117.5 0.2 . 1 . . . . . . . . 5177 1 49 . 1 1 6 6 THR H H 1 8.09 0.02 . 1 . . . . . . . . 5177 1 50 . 1 1 6 6 THR CA C 13 60.4 0.3 . 1 . . . . . . . . 5177 1 51 . 1 1 6 6 THR HA H 1 4.61 0.02 . 1 . . . . . . . . 5177 1 52 . 1 1 6 6 THR CB C 13 71.4 0.3 . 1 . . . . . . . . 5177 1 53 . 1 1 6 6 THR HB H 1 4.26 0.02 . 1 . . . . . . . . 5177 1 54 . 1 1 6 6 THR HG21 H 1 1.24 0.02 . 1 . . . . . . . . 5177 1 55 . 1 1 6 6 THR HG22 H 1 1.24 0.02 . 1 . . . . . . . . 5177 1 56 . 1 1 6 6 THR HG23 H 1 1.24 0.02 . 1 . . . . . . . . 5177 1 57 . 1 1 6 6 THR CG2 C 13 21.7 0.3 . 1 . . . . . . . . 5177 1 58 . 1 1 6 6 THR C C 13 173.4 0.3 . 1 . . . . . . . . 5177 1 59 . 1 1 7 7 VAL N N 15 122.1 0.2 . 1 . . . . . . . . 5177 1 60 . 1 1 7 7 VAL H H 1 8.79 0.02 . 1 . . . . . . . . 5177 1 61 . 1 1 7 7 VAL CA C 13 62.1 0.3 . 1 . . . . . . . . 5177 1 62 . 1 1 7 7 VAL HA H 1 4.11 0.02 . 1 . . . . . . . . 5177 1 63 . 1 1 7 7 VAL CB C 13 32.6 0.3 . 1 . . . . . . . . 5177 1 64 . 1 1 7 7 VAL HB H 1 1.88 0.02 . 1 . . . . . . . . 5177 1 65 . 1 1 7 7 VAL HG11 H 1 0.64 0.02 . 2 . . . . . . . . 5177 1 66 . 1 1 7 7 VAL HG12 H 1 0.64 0.02 . 2 . . . . . . . . 5177 1 67 . 1 1 7 7 VAL HG13 H 1 0.64 0.02 . 2 . . . . . . . . 5177 1 68 . 1 1 7 7 VAL HG21 H 1 0.76 0.02 . 2 . . . . . . . . 5177 1 69 . 1 1 7 7 VAL HG22 H 1 0.76 0.02 . 2 . . . . . . . . 5177 1 70 . 1 1 7 7 VAL HG23 H 1 0.76 0.02 . 2 . . . . . . . . 5177 1 71 . 1 1 7 7 VAL CG1 C 13 21.2 0.3 . 1 . . . . . . . . 5177 1 72 . 1 1 7 7 VAL CG2 C 13 22.0 0.3 . 1 . . . . . . . . 5177 1 73 . 1 1 7 7 VAL C C 13 175.0 0.3 . 1 . . . . . . . . 5177 1 74 . 1 1 8 8 ASN N N 15 128.3 0.2 . 1 . . . . . . . . 5177 1 75 . 1 1 8 8 ASN H H 1 8.71 0.02 . 1 . . . . . . . . 5177 1 76 . 1 1 8 8 ASN CA C 13 55.3 0.3 . 1 . . . . . . . . 5177 1 77 . 1 1 8 8 ASN HA H 1 4.58 0.02 . 1 . . . . . . . . 5177 1 78 . 1 1 8 8 ASN CB C 13 42.1 0.3 . 1 . . . . . . . . 5177 1 79 . 1 1 8 8 ASN HB2 H 1 2.89 0.02 . 2 . . . . . . . . 5177 1 80 . 1 1 8 8 ASN HB3 H 1 3.12 0.02 . 2 . . . . . . . . 5177 1 81 . 1 1 8 8 ASN CG C 13 176.1 0.3 . 1 . . . . . . . . 5177 1 82 . 1 1 8 8 ASN ND2 N 15 115.4 0.2 . 1 . . . . . . . . 5177 1 83 . 1 1 8 8 ASN HD21 H 1 7.38 0.02 . 2 . . . . . . . . 5177 1 84 . 1 1 8 8 ASN HD22 H 1 8.22 0.02 . 2 . . . . . . . . 5177 1 85 . 1 1 8 8 ASN C C 13 176.3 0.3 . 1 . . . . . . . . 5177 1 86 . 1 1 9 9 ASP N N 15 125.8 0.2 . 1 . . . . . . . . 5177 1 87 . 1 1 9 9 ASP H H 1 9.08 0.02 . 1 . . . . . . . . 5177 1 88 . 1 1 9 9 ASP CA C 13 58.3 0.3 . 1 . . . . . . . . 5177 1 89 . 1 1 9 9 ASP HA H 1 4.46 0.02 . 1 . . . . . . . . 5177 1 90 . 1 1 9 9 ASP CB C 13 41.2 0.3 . 1 . . . . . . . . 5177 1 91 . 1 1 9 9 ASP HB2 H 1 2.75 0.02 . 1 . . . . . . . . 5177 1 92 . 1 1 9 9 ASP HB3 H 1 2.75 0.02 . 1 . . . . . . . . 5177 1 93 . 1 1 9 9 ASP C C 13 178.4 0.3 . 1 . . . . . . . . 5177 1 94 . 1 1 10 10 GLU N N 15 120.5 0.2 . 1 . . . . . . . . 5177 1 95 . 1 1 10 10 GLU H H 1 9.23 0.02 . 1 . . . . . . . . 5177 1 96 . 1 1 10 10 GLU CA C 13 59.3 0.3 . 1 . . . . . . . . 5177 1 97 . 1 1 10 10 GLU HA H 1 4.22 0.02 . 1 . . . . . . . . 5177 1 98 . 1 1 10 10 GLU CB C 13 29.6 0.3 . 1 . . . . . . . . 5177 1 99 . 1 1 10 10 GLU HB2 H 1 2.28 0.02 . 1 . . . . . . . . 5177 1 100 . 1 1 10 10 GLU HB3 H 1 2.28 0.02 . 1 . . . . . . . . 5177 1 101 . 1 1 10 10 GLU CG C 13 36.2 0.3 . 1 . . . . . . . . 5177 1 102 . 1 1 10 10 GLU HG2 H 1 2.57 0.02 . 1 . . . . . . . . 5177 1 103 . 1 1 10 10 GLU HG3 H 1 2.57 0.02 . 1 . . . . . . . . 5177 1 104 . 1 1 10 10 GLU C C 13 178.8 0.3 . 1 . . . . . . . . 5177 1 105 . 1 1 11 11 VAL N N 15 119.1 0.2 . 1 . . . . . . . . 5177 1 106 . 1 1 11 11 VAL H H 1 7.95 0.02 . 1 . . . . . . . . 5177 1 107 . 1 1 11 11 VAL CA C 13 66.1 0.3 . 1 . . . . . . . . 5177 1 108 . 1 1 11 11 VAL HA H 1 3.59 0.02 . 1 . . . . . . . . 5177 1 109 . 1 1 11 11 VAL CB C 13 31.7 0.3 . 1 . . . . . . . . 5177 1 110 . 1 1 11 11 VAL HB H 1 2.39 0.02 . 1 . . . . . . . . 5177 1 111 . 1 1 11 11 VAL HG11 H 1 1.13 0.02 . 2 . . . . . . . . 5177 1 112 . 1 1 11 11 VAL HG12 H 1 1.13 0.02 . 2 . . . . . . . . 5177 1 113 . 1 1 11 11 VAL HG13 H 1 1.13 0.02 . 2 . . . . . . . . 5177 1 114 . 1 1 11 11 VAL HG21 H 1 0.39 0.02 . 2 . . . . . . . . 5177 1 115 . 1 1 11 11 VAL HG22 H 1 0.39 0.02 . 2 . . . . . . . . 5177 1 116 . 1 1 11 11 VAL HG23 H 1 0.39 0.02 . 2 . . . . . . . . 5177 1 117 . 1 1 11 11 VAL CG1 C 13 23.7 0.3 . 1 . . . . . . . . 5177 1 118 . 1 1 11 11 VAL CG2 C 13 20.4 0.3 . 1 . . . . . . . . 5177 1 119 . 1 1 11 11 VAL C C 13 177.0 0.3 . 1 . . . . . . . . 5177 1 120 . 1 1 12 12 ILE N N 15 118.0 0.2 . 1 . . . . . . . . 5177 1 121 . 1 1 12 12 ILE H H 1 6.89 0.02 . 1 . . . . . . . . 5177 1 122 . 1 1 12 12 ILE CA C 13 64.3 0.3 . 1 . . . . . . . . 5177 1 123 . 1 1 12 12 ILE HA H 1 3.83 0.02 . 1 . . . . . . . . 5177 1 124 . 1 1 12 12 ILE CB C 13 37.9 0.3 . 1 . . . . . . . . 5177 1 125 . 1 1 12 12 ILE HB H 1 2.21 0.02 . 1 . . . . . . . . 5177 1 126 . 1 1 12 12 ILE HG21 H 1 1.19 0.02 . 1 . . . . . . . . 5177 1 127 . 1 1 12 12 ILE HG22 H 1 1.19 0.02 . 1 . . . . . . . . 5177 1 128 . 1 1 12 12 ILE HG23 H 1 1.19 0.02 . 1 . . . . . . . . 5177 1 129 . 1 1 12 12 ILE CG2 C 13 18.4 0.3 . 1 . . . . . . . . 5177 1 130 . 1 1 12 12 ILE CG1 C 13 29.5 0.3 . 1 . . . . . . . . 5177 1 131 . 1 1 12 12 ILE HG12 H 1 1.32 0.02 . 2 . . . . . . . . 5177 1 132 . 1 1 12 12 ILE HG13 H 1 1.68 0.02 . 2 . . . . . . . . 5177 1 133 . 1 1 12 12 ILE HD11 H 1 0.97 0.02 . 1 . . . . . . . . 5177 1 134 . 1 1 12 12 ILE HD12 H 1 0.97 0.02 . 1 . . . . . . . . 5177 1 135 . 1 1 12 12 ILE HD13 H 1 0.97 0.02 . 1 . . . . . . . . 5177 1 136 . 1 1 12 12 ILE CD1 C 13 13.1 0.3 . 1 . . . . . . . . 5177 1 137 . 1 1 12 12 ILE C C 13 177.7 0.3 . 1 . . . . . . . . 5177 1 138 . 1 1 13 13 LYS N N 15 121.1 0.2 . 1 . . . . . . . . 5177 1 139 . 1 1 13 13 LYS H H 1 7.80 0.02 . 1 . . . . . . . . 5177 1 140 . 1 1 13 13 LYS CA C 13 60.1 0.3 . 1 . . . . . . . . 5177 1 141 . 1 1 13 13 LYS HA H 1 4.16 0.02 . 1 . . . . . . . . 5177 1 142 . 1 1 13 13 LYS CB C 13 32.7 0.3 . 1 . . . . . . . . 5177 1 143 . 1 1 13 13 LYS HB2 H 1 2.08 0.02 . 1 . . . . . . . . 5177 1 144 . 1 1 13 13 LYS HB3 H 1 2.08 0.02 . 1 . . . . . . . . 5177 1 145 . 1 1 13 13 LYS CG C 13 25.4 0.3 . 1 . . . . . . . . 5177 1 146 . 1 1 13 13 LYS HG2 H 1 1.55 0.02 . 1 . . . . . . . . 5177 1 147 . 1 1 13 13 LYS HG3 H 1 1.55 0.02 . 1 . . . . . . . . 5177 1 148 . 1 1 13 13 LYS CD C 13 29.3 0.3 . 1 . . . . . . . . 5177 1 149 . 1 1 13 13 LYS HD2 H 1 1.79 0.02 . 1 . . . . . . . . 5177 1 150 . 1 1 13 13 LYS HD3 H 1 1.79 0.02 . 1 . . . . . . . . 5177 1 151 . 1 1 13 13 LYS CE C 13 42.4 0.3 . 1 . . . . . . . . 5177 1 152 . 1 1 13 13 LYS HE2 H 1 3.11 0.02 . 1 . . . . . . . . 5177 1 153 . 1 1 13 13 LYS HE3 H 1 3.11 0.02 . 1 . . . . . . . . 5177 1 154 . 1 1 13 13 LYS C C 13 178.8 0.3 . 1 . . . . . . . . 5177 1 155 . 1 1 14 14 VAL N N 15 119.0 0.2 . 1 . . . . . . . . 5177 1 156 . 1 1 14 14 VAL H H 1 8.13 0.02 . 1 . . . . . . . . 5177 1 157 . 1 1 14 14 VAL CA C 13 66.5 0.3 . 1 . . . . . . . . 5177 1 158 . 1 1 14 14 VAL HA H 1 3.93 0.02 . 1 . . . . . . . . 5177 1 159 . 1 1 14 14 VAL CB C 13 31.8 0.3 . 1 . . . . . . . . 5177 1 160 . 1 1 14 14 VAL HB H 1 2.52 0.02 . 1 . . . . . . . . 5177 1 161 . 1 1 14 14 VAL HG11 H 1 1.39 0.02 . 2 . . . . . . . . 5177 1 162 . 1 1 14 14 VAL HG12 H 1 1.39 0.02 . 2 . . . . . . . . 5177 1 163 . 1 1 14 14 VAL HG13 H 1 1.39 0.02 . 2 . . . . . . . . 5177 1 164 . 1 1 14 14 VAL HG21 H 1 1.23 0.02 . 2 . . . . . . . . 5177 1 165 . 1 1 14 14 VAL HG22 H 1 1.23 0.02 . 2 . . . . . . . . 5177 1 166 . 1 1 14 14 VAL HG23 H 1 1.23 0.02 . 2 . . . . . . . . 5177 1 167 . 1 1 14 14 VAL CG1 C 13 24.5 0.3 . 1 . . . . . . . . 5177 1 168 . 1 1 14 14 VAL CG2 C 13 23.2 0.3 . 1 . . . . . . . . 5177 1 169 . 1 1 14 14 VAL C C 13 178.4 0.3 . 1 . . . . . . . . 5177 1 170 . 1 1 15 15 PHE N N 15 120.5 0.2 . 1 . . . . . . . . 5177 1 171 . 1 1 15 15 PHE H H 1 7.94 0.02 . 1 . . . . . . . . 5177 1 172 . 1 1 15 15 PHE CA C 13 61.4 0.3 . 1 . . . . . . . . 5177 1 173 . 1 1 15 15 PHE HA H 1 3.92 0.02 . 1 . . . . . . . . 5177 1 174 . 1 1 15 15 PHE CB C 13 39.3 0.3 . 1 . . . . . . . . 5177 1 175 . 1 1 15 15 PHE HB2 H 1 2.78 0.02 . 2 . . . . . . . . 5177 1 176 . 1 1 15 15 PHE HB3 H 1 3.08 0.02 . 2 . . . . . . . . 5177 1 177 . 1 1 15 15 PHE HD1 H 1 6.91 0.02 . 1 . . . . . . . . 5177 1 178 . 1 1 15 15 PHE HD2 H 1 6.91 0.02 . 1 . . . . . . . . 5177 1 179 . 1 1 15 15 PHE HE1 H 1 7.19 0.02 . 1 . . . . . . . . 5177 1 180 . 1 1 15 15 PHE HE2 H 1 7.19 0.02 . 1 . . . . . . . . 5177 1 181 . 1 1 15 15 PHE HZ H 1 7.18 0.02 . 1 . . . . . . . . 5177 1 182 . 1 1 15 15 PHE C C 13 176.2 0.3 . 1 . . . . . . . . 5177 1 183 . 1 1 16 16 ASN N N 15 118.0 0.2 . 1 . . . . . . . . 5177 1 184 . 1 1 16 16 ASN H H 1 8.72 0.02 . 1 . . . . . . . . 5177 1 185 . 1 1 16 16 ASN CA C 13 56.5 0.3 . 1 . . . . . . . . 5177 1 186 . 1 1 16 16 ASN HA H 1 3.99 0.02 . 1 . . . . . . . . 5177 1 187 . 1 1 16 16 ASN CB C 13 38.2 0.3 . 1 . . . . . . . . 5177 1 188 . 1 1 16 16 ASN HB2 H 1 2.78 0.02 . 2 . . . . . . . . 5177 1 189 . 1 1 16 16 ASN HB3 H 1 2.98 0.02 . 2 . . . . . . . . 5177 1 190 . 1 1 16 16 ASN CG C 13 176.2 0.3 . 1 . . . . . . . . 5177 1 191 . 1 1 16 16 ASN ND2 N 15 111.8 0.2 . 1 . . . . . . . . 5177 1 192 . 1 1 16 16 ASN HD21 H 1 7.04 0.02 . 2 . . . . . . . . 5177 1 193 . 1 1 16 16 ASN HD22 H 1 7.61 0.02 . 2 . . . . . . . . 5177 1 194 . 1 1 16 16 ASN C C 13 178.0 0.3 . 1 . . . . . . . . 5177 1 195 . 1 1 17 17 ASP N N 15 119.6 0.2 . 1 . . . . . . . . 5177 1 196 . 1 1 17 17 ASP H H 1 8.23 0.02 . 1 . . . . . . . . 5177 1 197 . 1 1 17 17 ASP CA C 13 56.8 0.3 . 1 . . . . . . . . 5177 1 198 . 1 1 17 17 ASP HA H 1 4.53 0.02 . 1 . . . . . . . . 5177 1 199 . 1 1 17 17 ASP CB C 13 40.9 0.3 . 1 . . . . . . . . 5177 1 200 . 1 1 17 17 ASP HB2 H 1 2.73 0.02 . 2 . . . . . . . . 5177 1 201 . 1 1 17 17 ASP HB3 H 1 2.96 0.02 . 2 . . . . . . . . 5177 1 202 . 1 1 17 17 ASP C C 13 178.7 0.3 . 1 . . . . . . . . 5177 1 203 . 1 1 18 18 MET N N 15 119.0 0.2 . 1 . . . . . . . . 5177 1 204 . 1 1 18 18 MET H H 1 8.02 0.02 . 1 . . . . . . . . 5177 1 205 . 1 1 18 18 MET CA C 13 58.6 0.3 . 1 . . . . . . . . 5177 1 206 . 1 1 18 18 MET HA H 1 4.15 0.02 . 1 . . . . . . . . 5177 1 207 . 1 1 18 18 MET CB C 13 34.9 0.3 . 1 . . . . . . . . 5177 1 208 . 1 1 18 18 MET HB2 H 1 2.11 0.02 . 2 . . . . . . . . 5177 1 209 . 1 1 18 18 MET HB3 H 1 1.91 0.02 . 2 . . . . . . . . 5177 1 210 . 1 1 18 18 MET CG C 13 33.1 0.3 . 1 . . . . . . . . 5177 1 211 . 1 1 18 18 MET HG2 H 1 2.48 0.02 . 2 . . . . . . . . 5177 1 212 . 1 1 18 18 MET HG3 H 1 2.93 0.02 . 2 . . . . . . . . 5177 1 213 . 1 1 18 18 MET HE1 H 1 1.66 0.02 . 1 . . . . . . . . 5177 1 214 . 1 1 18 18 MET HE2 H 1 1.66 0.02 . 1 . . . . . . . . 5177 1 215 . 1 1 18 18 MET HE3 H 1 1.66 0.02 . 1 . . . . . . . . 5177 1 216 . 1 1 18 18 MET CE C 13 16.7 0.3 . 1 . . . . . . . . 5177 1 217 . 1 1 18 18 MET C C 13 177.6 0.3 . 1 . . . . . . . . 5177 1 218 . 1 1 19 19 LYS N N 15 118.0 0.2 . 1 . . . . . . . . 5177 1 219 . 1 1 19 19 LYS H H 1 8.03 0.02 . 1 . . . . . . . . 5177 1 220 . 1 1 19 19 LYS CA C 13 57.8 0.3 . 1 . . . . . . . . 5177 1 221 . 1 1 19 19 LYS HA H 1 3.85 0.02 . 1 . . . . . . . . 5177 1 222 . 1 1 19 19 LYS CB C 13 32.2 0.3 . 1 . . . . . . . . 5177 1 223 . 1 1 19 19 LYS HB2 H 1 1.34 0.02 . 1 . . . . . . . . 5177 1 224 . 1 1 19 19 LYS HB3 H 1 1.34 0.02 . 1 . . . . . . . . 5177 1 225 . 1 1 19 19 LYS CG C 13 24.6 0.3 . 1 . . . . . . . . 5177 1 226 . 1 1 19 19 LYS HG2 H 1 1.17 0.02 . 1 . . . . . . . . 5177 1 227 . 1 1 19 19 LYS HG3 H 1 1.17 0.02 . 1 . . . . . . . . 5177 1 228 . 1 1 19 19 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 5177 1 229 . 1 1 19 19 LYS HD2 H 1 1.63 0.02 . 1 . . . . . . . . 5177 1 230 . 1 1 19 19 LYS HD3 H 1 1.63 0.02 . 1 . . . . . . . . 5177 1 231 . 1 1 19 19 LYS CE C 13 41.7 0.3 . 1 . . . . . . . . 5177 1 232 . 1 1 19 19 LYS HE2 H 1 2.95 0.02 . 1 . . . . . . . . 5177 1 233 . 1 1 19 19 LYS HE3 H 1 2.95 0.02 . 1 . . . . . . . . 5177 1 234 . 1 1 19 19 LYS C C 13 177.2 0.3 . 1 . . . . . . . . 5177 1 235 . 1 1 20 20 VAL N N 15 117.5 0.2 . 1 . . . . . . . . 5177 1 236 . 1 1 20 20 VAL H H 1 7.25 0.02 . 1 . . . . . . . . 5177 1 237 . 1 1 20 20 VAL CA C 13 62.8 0.3 . 1 . . . . . . . . 5177 1 238 . 1 1 20 20 VAL HA H 1 4.00 0.02 . 1 . . . . . . . . 5177 1 239 . 1 1 20 20 VAL CB C 13 32.7 0.3 . 1 . . . . . . . . 5177 1 240 . 1 1 20 20 VAL HB H 1 2.13 0.02 . 1 . . . . . . . . 5177 1 241 . 1 1 20 20 VAL HG11 H 1 0.95 0.02 . 2 . . . . . . . . 5177 1 242 . 1 1 20 20 VAL HG12 H 1 0.95 0.02 . 2 . . . . . . . . 5177 1 243 . 1 1 20 20 VAL HG13 H 1 0.95 0.02 . 2 . . . . . . . . 5177 1 244 . 1 1 20 20 VAL HG21 H 1 1.03 0.02 . 2 . . . . . . . . 5177 1 245 . 1 1 20 20 VAL HG22 H 1 1.03 0.02 . 2 . . . . . . . . 5177 1 246 . 1 1 20 20 VAL HG23 H 1 1.03 0.02 . 2 . . . . . . . . 5177 1 247 . 1 1 20 20 VAL CG1 C 13 21.1 0.3 . 1 . . . . . . . . 5177 1 248 . 1 1 20 20 VAL CG2 C 13 21.4 0.3 . 1 . . . . . . . . 5177 1 249 . 1 1 20 20 VAL C C 13 175.6 0.3 . 1 . . . . . . . . 5177 1 250 . 1 1 21 21 ARG N N 15 123.2 0.2 . 1 . . . . . . . . 5177 1 251 . 1 1 21 21 ARG H H 1 8.06 0.02 . 1 . . . . . . . . 5177 1 252 . 1 1 21 21 ARG CA C 13 56.0 0.3 . 1 . . . . . . . . 5177 1 253 . 1 1 21 21 ARG HA H 1 4.15 0.02 . 1 . . . . . . . . 5177 1 254 . 1 1 21 21 ARG CB C 13 29.7 0.3 . 1 . . . . . . . . 5177 1 255 . 1 1 21 21 ARG HB2 H 1 1.74 0.02 . 1 . . . . . . . . 5177 1 256 . 1 1 21 21 ARG HB3 H 1 1.74 0.02 . 1 . . . . . . . . 5177 1 257 . 1 1 21 21 ARG CG C 13 27.5 0.3 . 1 . . . . . . . . 5177 1 258 . 1 1 21 21 ARG HG2 H 1 1.58 0.02 . 1 . . . . . . . . 5177 1 259 . 1 1 21 21 ARG HG3 H 1 1.58 0.02 . 1 . . . . . . . . 5177 1 260 . 1 1 21 21 ARG CD C 13 43.6 0.3 . 1 . . . . . . . . 5177 1 261 . 1 1 21 21 ARG HD2 H 1 3.08 0.02 . 2 . . . . . . . . 5177 1 262 . 1 1 21 21 ARG HD3 H 1 3.16 0.02 . 2 . . . . . . . . 5177 1 263 . 1 1 21 21 ARG NE N 15 86.1 0.2 . 1 . . . . . . . . 5177 1 264 . 1 1 21 21 ARG HE H 1 7.78 0.02 . 1 . . . . . . . . 5177 1 265 . 1 1 21 21 ARG C C 13 176.0 0.3 . 1 . . . . . . . . 5177 1 266 . 1 1 22 22 LYS N N 15 123.3 0.2 . 1 . . . . . . . . 5177 1 267 . 1 1 22 22 LYS H H 1 8.50 0.02 . 1 . . . . . . . . 5177 1 268 . 1 1 22 22 LYS CA C 13 57.2 0.3 . 1 . . . . . . . . 5177 1 269 . 1 1 22 22 LYS HA H 1 4.30 0.02 . 1 . . . . . . . . 5177 1 270 . 1 1 22 22 LYS CB C 13 33.4 0.3 . 1 . . . . . . . . 5177 1 271 . 1 1 22 22 LYS HB2 H 1 1.82 0.02 . 1 . . . . . . . . 5177 1 272 . 1 1 22 22 LYS HB3 H 1 1.82 0.02 . 1 . . . . . . . . 5177 1 273 . 1 1 22 22 LYS CG C 13 25.0 0.3 . 1 . . . . . . . . 5177 1 274 . 1 1 22 22 LYS HG2 H 1 1.42 0.02 . 1 . . . . . . . . 5177 1 275 . 1 1 22 22 LYS HG3 H 1 1.42 0.02 . 1 . . . . . . . . 5177 1 276 . 1 1 22 22 LYS CD C 13 29.3 0.3 . 1 . . . . . . . . 5177 1 277 . 1 1 22 22 LYS HD2 H 1 1.76 0.02 . 1 . . . . . . . . 5177 1 278 . 1 1 22 22 LYS HD3 H 1 1.76 0.02 . 1 . . . . . . . . 5177 1 279 . 1 1 22 22 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 280 . 1 1 22 22 LYS HE2 H 1 3.03 0.02 . 1 . . . . . . . . 5177 1 281 . 1 1 22 22 LYS HE3 H 1 3.03 0.02 . 1 . . . . . . . . 5177 1 282 . 1 1 22 22 LYS C C 13 176.9 0.3 . 1 . . . . . . . . 5177 1 283 . 1 1 23 23 SER N N 15 117.5 0.2 . 1 . . . . . . . . 5177 1 284 . 1 1 23 23 SER H H 1 8.49 0.02 . 1 . . . . . . . . 5177 1 285 . 1 1 23 23 SER CA C 13 58.1 0.3 . 1 . . . . . . . . 5177 1 286 . 1 1 23 23 SER HA H 1 4.60 0.02 . 1 . . . . . . . . 5177 1 287 . 1 1 23 23 SER CB C 13 64.1 0.3 . 1 . . . . . . . . 5177 1 288 . 1 1 23 23 SER HB2 H 1 3.88 0.02 . 1 . . . . . . . . 5177 1 289 . 1 1 23 23 SER HB3 H 1 3.88 0.02 . 1 . . . . . . . . 5177 1 290 . 1 1 23 23 SER C C 13 174.8 0.3 . 1 . . . . . . . . 5177 1 291 . 1 1 24 24 SER N N 15 119.0 0.2 . 1 . . . . . . . . 5177 1 292 . 1 1 24 24 SER H H 1 8.68 0.02 . 1 . . . . . . . . 5177 1 293 . 1 1 24 24 SER CA C 13 59.6 0.3 . 1 . . . . . . . . 5177 1 294 . 1 1 24 24 SER HA H 1 4.62 0.02 . 1 . . . . . . . . 5177 1 295 . 1 1 24 24 SER CB C 13 64.8 0.3 . 1 . . . . . . . . 5177 1 296 . 1 1 24 24 SER HB2 H 1 3.97 0.02 . 1 . . . . . . . . 5177 1 297 . 1 1 24 24 SER HB3 H 1 3.97 0.02 . 1 . . . . . . . . 5177 1 298 . 1 1 24 24 SER C C 13 174.2 0.3 . 1 . . . . . . . . 5177 1 299 . 1 1 25 25 THR N N 15 113.4 0.2 . 1 . . . . . . . . 5177 1 300 . 1 1 25 25 THR H H 1 7.92 0.02 . 1 . . . . . . . . 5177 1 301 . 1 1 25 25 THR CA C 13 59.3 0.3 . 1 . . . . . . . . 5177 1 302 . 1 1 25 25 THR HA H 1 4.90 0.02 . 1 . . . . . . . . 5177 1 303 . 1 1 25 25 THR CB C 13 69.6 0.3 . 1 . . . . . . . . 5177 1 304 . 1 1 25 25 THR HB H 1 4.68 0.02 . 1 . . . . . . . . 5177 1 305 . 1 1 25 25 THR HG21 H 1 1.34 0.02 . 1 . . . . . . . . 5177 1 306 . 1 1 25 25 THR HG22 H 1 1.34 0.02 . 1 . . . . . . . . 5177 1 307 . 1 1 25 25 THR HG23 H 1 1.34 0.02 . 1 . . . . . . . . 5177 1 308 . 1 1 25 25 THR CG2 C 13 22.4 0.3 . 1 . . . . . . . . 5177 1 309 . 1 1 26 26 PRO CD C 13 50.6 0.3 . 1 . . . . . . . . 5177 1 310 . 1 1 26 26 PRO CA C 13 65.7 0.3 . 1 . . . . . . . . 5177 1 311 . 1 1 26 26 PRO HA H 1 4.26 0.02 . 1 . . . . . . . . 5177 1 312 . 1 1 26 26 PRO CB C 13 32.1 0.3 . 1 . . . . . . . . 5177 1 313 . 1 1 26 26 PRO HB2 H 1 2.01 0.02 . 2 . . . . . . . . 5177 1 314 . 1 1 26 26 PRO HB3 H 1 2.46 0.02 . 2 . . . . . . . . 5177 1 315 . 1 1 26 26 PRO CG C 13 28.1 0.3 . 1 . . . . . . . . 5177 1 316 . 1 1 26 26 PRO HG2 H 1 2.09 0.02 . 2 . . . . . . . . 5177 1 317 . 1 1 26 26 PRO HG3 H 1 2.29 0.02 . 2 . . . . . . . . 5177 1 318 . 1 1 26 26 PRO HD2 H 1 3.99 0.02 . 1 . . . . . . . . 5177 1 319 . 1 1 26 26 PRO HD3 H 1 3.99 0.02 . 1 . . . . . . . . 5177 1 320 . 1 1 26 26 PRO C C 13 179.1 0.3 . 1 . . . . . . . . 5177 1 321 . 1 1 27 27 GLU N N 15 116.5 0.2 . 1 . . . . . . . . 5177 1 322 . 1 1 27 27 GLU H H 1 8.50 0.02 . 1 . . . . . . . . 5177 1 323 . 1 1 27 27 GLU CA C 13 59.8 0.3 . 1 . . . . . . . . 5177 1 324 . 1 1 27 27 GLU HA H 1 4.04 0.02 . 1 . . . . . . . . 5177 1 325 . 1 1 27 27 GLU CB C 13 29.2 0.3 . 1 . . . . . . . . 5177 1 326 . 1 1 27 27 GLU HB2 H 1 1.98 0.02 . 2 . . . . . . . . 5177 1 327 . 1 1 27 27 GLU HB3 H 1 2.09 0.02 . 2 . . . . . . . . 5177 1 328 . 1 1 27 27 GLU CG C 13 36.7 0.3 . 1 . . . . . . . . 5177 1 329 . 1 1 27 27 GLU HG2 H 1 2.31 0.02 . 2 . . . . . . . . 5177 1 330 . 1 1 27 27 GLU HG3 H 1 2.42 0.02 . 2 . . . . . . . . 5177 1 331 . 1 1 27 27 GLU C C 13 178.7 0.3 . 1 . . . . . . . . 5177 1 332 . 1 1 28 28 GLU N N 15 119.0 0.2 . 1 . . . . . . . . 5177 1 333 . 1 1 28 28 GLU H H 1 7.68 0.02 . 1 . . . . . . . . 5177 1 334 . 1 1 28 28 GLU CA C 13 58.9 0.3 . 1 . . . . . . . . 5177 1 335 . 1 1 28 28 GLU HA H 1 4.01 0.02 . 1 . . . . . . . . 5177 1 336 . 1 1 28 28 GLU CB C 13 30.2 0.3 . 1 . . . . . . . . 5177 1 337 . 1 1 28 28 GLU HB2 H 1 2.05 0.02 . 1 . . . . . . . . 5177 1 338 . 1 1 28 28 GLU HB3 H 1 2.05 0.02 . 1 . . . . . . . . 5177 1 339 . 1 1 28 28 GLU CG C 13 37.1 0.3 . 1 . . . . . . . . 5177 1 340 . 1 1 28 28 GLU HG2 H 1 2.26 0.02 . 2 . . . . . . . . 5177 1 341 . 1 1 28 28 GLU HG3 H 1 2.39 0.02 . 2 . . . . . . . . 5177 1 342 . 1 1 28 28 GLU C C 13 179.8 0.3 . 1 . . . . . . . . 5177 1 343 . 1 1 29 29 ILE N N 15 120.6 0.2 . 1 . . . . . . . . 5177 1 344 . 1 1 29 29 ILE H H 1 7.98 0.02 . 1 . . . . . . . . 5177 1 345 . 1 1 29 29 ILE CA C 13 65.4 0.3 . 1 . . . . . . . . 5177 1 346 . 1 1 29 29 ILE HA H 1 3.63 0.02 . 1 . . . . . . . . 5177 1 347 . 1 1 29 29 ILE CB C 13 38.2 0.3 . 1 . . . . . . . . 5177 1 348 . 1 1 29 29 ILE HB H 1 1.91 0.02 . 1 . . . . . . . . 5177 1 349 . 1 1 29 29 ILE HG21 H 1 0.92 0.02 . 1 . . . . . . . . 5177 1 350 . 1 1 29 29 ILE HG22 H 1 0.92 0.02 . 1 . . . . . . . . 5177 1 351 . 1 1 29 29 ILE HG23 H 1 0.92 0.02 . 1 . . . . . . . . 5177 1 352 . 1 1 29 29 ILE CG2 C 13 17.2 0.3 . 1 . . . . . . . . 5177 1 353 . 1 1 29 29 ILE CG1 C 13 29.7 0.3 . 1 . . . . . . . . 5177 1 354 . 1 1 29 29 ILE HG12 H 1 1.08 0.02 . 2 . . . . . . . . 5177 1 355 . 1 1 29 29 ILE HG13 H 1 1.70 0.02 . 2 . . . . . . . . 5177 1 356 . 1 1 29 29 ILE HD11 H 1 0.86 0.02 . 1 . . . . . . . . 5177 1 357 . 1 1 29 29 ILE HD12 H 1 0.86 0.02 . 1 . . . . . . . . 5177 1 358 . 1 1 29 29 ILE HD13 H 1 0.86 0.02 . 1 . . . . . . . . 5177 1 359 . 1 1 29 29 ILE CD1 C 13 13.1 0.3 . 1 . . . . . . . . 5177 1 360 . 1 1 29 29 ILE C C 13 177.6 0.3 . 1 . . . . . . . . 5177 1 361 . 1 1 30 30 LYS N N 15 115.4 0.2 . 1 . . . . . . . . 5177 1 362 . 1 1 30 30 LYS H H 1 7.50 0.02 . 1 . . . . . . . . 5177 1 363 . 1 1 30 30 LYS CA C 13 59.1 0.3 . 1 . . . . . . . . 5177 1 364 . 1 1 30 30 LYS HA H 1 3.79 0.02 . 1 . . . . . . . . 5177 1 365 . 1 1 30 30 LYS CB C 13 33.1 0.3 . 1 . . . . . . . . 5177 1 366 . 1 1 30 30 LYS HB2 H 1 1.89 0.02 . 1 . . . . . . . . 5177 1 367 . 1 1 30 30 LYS HB3 H 1 1.89 0.02 . 1 . . . . . . . . 5177 1 368 . 1 1 30 30 LYS CG C 13 26.2 0.3 . 1 . . . . . . . . 5177 1 369 . 1 1 30 30 LYS HG2 H 1 1.48 0.02 . 1 . . . . . . . . 5177 1 370 . 1 1 30 30 LYS HG3 H 1 1.48 0.02 . 1 . . . . . . . . 5177 1 371 . 1 1 30 30 LYS CD C 13 29.7 0.3 . 1 . . . . . . . . 5177 1 372 . 1 1 30 30 LYS HD2 H 1 1.74 0.02 . 1 . . . . . . . . 5177 1 373 . 1 1 30 30 LYS HD3 H 1 1.74 0.02 . 1 . . . . . . . . 5177 1 374 . 1 1 30 30 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 375 . 1 1 30 30 LYS HE2 H 1 2.98 0.02 . 1 . . . . . . . . 5177 1 376 . 1 1 30 30 LYS HE3 H 1 2.98 0.02 . 1 . . . . . . . . 5177 1 377 . 1 1 30 30 LYS C C 13 178.4 0.3 . 1 . . . . . . . . 5177 1 378 . 1 1 31 31 LYS N N 15 115.9 0.2 . 1 . . . . . . . . 5177 1 379 . 1 1 31 31 LYS H H 1 7.30 0.02 . 1 . . . . . . . . 5177 1 380 . 1 1 31 31 LYS CA C 13 56.0 0.3 . 1 . . . . . . . . 5177 1 381 . 1 1 31 31 LYS HA H 1 4.33 0.02 . 1 . . . . . . . . 5177 1 382 . 1 1 31 31 LYS CB C 13 33.4 0.3 . 1 . . . . . . . . 5177 1 383 . 1 1 31 31 LYS HB2 H 1 1.86 0.02 . 2 . . . . . . . . 5177 1 384 . 1 1 31 31 LYS HB3 H 1 2.04 0.02 . 2 . . . . . . . . 5177 1 385 . 1 1 31 31 LYS CG C 13 25.6 0.3 . 1 . . . . . . . . 5177 1 386 . 1 1 31 31 LYS HG2 H 1 1.52 0.02 . 2 . . . . . . . . 5177 1 387 . 1 1 31 31 LYS HG3 H 1 1.61 0.02 . 2 . . . . . . . . 5177 1 388 . 1 1 31 31 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 5177 1 389 . 1 1 31 31 LYS HD2 H 1 1.72 0.02 . 1 . . . . . . . . 5177 1 390 . 1 1 31 31 LYS HD3 H 1 1.72 0.02 . 1 . . . . . . . . 5177 1 391 . 1 1 31 31 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 392 . 1 1 31 31 LYS HE2 H 1 3.00 0.02 . 1 . . . . . . . . 5177 1 393 . 1 1 31 31 LYS HE3 H 1 3.00 0.02 . 1 . . . . . . . . 5177 1 394 . 1 1 31 31 LYS C C 13 176.0 0.3 . 1 . . . . . . . . 5177 1 395 . 1 1 32 32 ARG N N 15 121.6 0.2 . 1 . . . . . . . . 5177 1 396 . 1 1 32 32 ARG H H 1 7.55 0.02 . 1 . . . . . . . . 5177 1 397 . 1 1 32 32 ARG CA C 13 57.0 0.3 . 1 . . . . . . . . 5177 1 398 . 1 1 32 32 ARG HA H 1 4.18 0.02 . 1 . . . . . . . . 5177 1 399 . 1 1 32 32 ARG CB C 13 30.9 0.3 . 1 . . . . . . . . 5177 1 400 . 1 1 32 32 ARG HB2 H 1 1.96 0.02 . 1 . . . . . . . . 5177 1 401 . 1 1 32 32 ARG HB3 H 1 1.96 0.02 . 1 . . . . . . . . 5177 1 402 . 1 1 32 32 ARG CG C 13 27.8 0.3 . 1 . . . . . . . . 5177 1 403 . 1 1 32 32 ARG HG2 H 1 1.77 0.02 . 2 . . . . . . . . 5177 1 404 . 1 1 32 32 ARG HG3 H 1 2.01 0.02 . 2 . . . . . . . . 5177 1 405 . 1 1 32 32 ARG CD C 13 44.2 0.3 . 1 . . . . . . . . 5177 1 406 . 1 1 32 32 ARG HD2 H 1 3.21 0.02 . 2 . . . . . . . . 5177 1 407 . 1 1 32 32 ARG HD3 H 1 3.35 0.02 . 2 . . . . . . . . 5177 1 408 . 1 1 32 32 ARG NE N 15 87.4 0.2 . 1 . . . . . . . . 5177 1 409 . 1 1 32 32 ARG HE H 1 7.63 0.02 . 1 . . . . . . . . 5177 1 410 . 1 1 32 32 ARG C C 13 176.3 0.3 . 1 . . . . . . . . 5177 1 411 . 1 1 33 33 LYS N N 15 121.7 0.2 . 1 . . . . . . . . 5177 1 412 . 1 1 33 33 LYS H H 1 8.86 0.02 . 1 . . . . . . . . 5177 1 413 . 1 1 33 33 LYS CA C 13 57.5 0.3 . 1 . . . . . . . . 5177 1 414 . 1 1 33 33 LYS HA H 1 4.39 0.02 . 1 . . . . . . . . 5177 1 415 . 1 1 33 33 LYS CB C 13 32.9 0.3 . 1 . . . . . . . . 5177 1 416 . 1 1 33 33 LYS HB2 H 1 1.58 0.02 . 2 . . . . . . . . 5177 1 417 . 1 1 33 33 LYS HB3 H 1 1.89 0.02 . 2 . . . . . . . . 5177 1 418 . 1 1 33 33 LYS CG C 13 26.2 0.3 . 1 . . . . . . . . 5177 1 419 . 1 1 33 33 LYS HG2 H 1 1.58 0.02 . 1 . . . . . . . . 5177 1 420 . 1 1 33 33 LYS HG3 H 1 1.58 0.02 . 1 . . . . . . . . 5177 1 421 . 1 1 33 33 LYS CD C 13 28.7 0.3 . 1 . . . . . . . . 5177 1 422 . 1 1 33 33 LYS HD2 H 1 1.65 0.02 . 1 . . . . . . . . 5177 1 423 . 1 1 33 33 LYS HD3 H 1 1.65 0.02 . 1 . . . . . . . . 5177 1 424 . 1 1 33 33 LYS CE C 13 43.0 0.3 . 1 . . . . . . . . 5177 1 425 . 1 1 33 33 LYS HE2 H 1 3.02 0.02 . 1 . . . . . . . . 5177 1 426 . 1 1 33 33 LYS HE3 H 1 3.02 0.02 . 1 . . . . . . . . 5177 1 427 . 1 1 33 33 LYS C C 13 176.3 0.3 . 1 . . . . . . . . 5177 1 428 . 1 1 34 34 LYS N N 15 124.7 0.2 . 1 . . . . . . . . 5177 1 429 . 1 1 34 34 LYS H H 1 9.53 0.02 . 1 . . . . . . . . 5177 1 430 . 1 1 34 34 LYS CA C 13 55.4 0.3 . 1 . . . . . . . . 5177 1 431 . 1 1 34 34 LYS HA H 1 4.41 0.02 . 1 . . . . . . . . 5177 1 432 . 1 1 34 34 LYS CB C 13 35.1 0.3 . 1 . . . . . . . . 5177 1 433 . 1 1 34 34 LYS HB2 H 1 1.39 0.02 . 2 . . . . . . . . 5177 1 434 . 1 1 34 34 LYS HB3 H 1 1.66 0.02 . 2 . . . . . . . . 5177 1 435 . 1 1 34 34 LYS CG C 13 24.7 0.3 . 1 . . . . . . . . 5177 1 436 . 1 1 34 34 LYS HG2 H 1 1.12 0.02 . 1 . . . . . . . . 5177 1 437 . 1 1 34 34 LYS HG3 H 1 1.12 0.02 . 1 . . . . . . . . 5177 1 438 . 1 1 34 34 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 5177 1 439 . 1 1 34 34 LYS HD2 H 1 1.42 0.02 . 1 . . . . . . . . 5177 1 440 . 1 1 34 34 LYS HD3 H 1 1.42 0.02 . 1 . . . . . . . . 5177 1 441 . 1 1 34 34 LYS C C 13 173.4 0.3 . 1 . . . . . . . . 5177 1 442 . 1 1 35 35 ALA N N 15 117.0 0.2 . 1 . . . . . . . . 5177 1 443 . 1 1 35 35 ALA H H 1 7.81 0.02 . 1 . . . . . . . . 5177 1 444 . 1 1 35 35 ALA CA C 13 51.2 0.3 . 1 . . . . . . . . 5177 1 445 . 1 1 35 35 ALA HA H 1 5.25 0.02 . 1 . . . . . . . . 5177 1 446 . 1 1 35 35 ALA HB1 H 1 1.39 0.02 . 1 . . . . . . . . 5177 1 447 . 1 1 35 35 ALA HB2 H 1 1.39 0.02 . 1 . . . . . . . . 5177 1 448 . 1 1 35 35 ALA HB3 H 1 1.39 0.02 . 1 . . . . . . . . 5177 1 449 . 1 1 35 35 ALA CB C 13 23.9 0.3 . 1 . . . . . . . . 5177 1 450 . 1 1 35 35 ALA C C 13 175.7 0.3 . 1 . . . . . . . . 5177 1 451 . 1 1 36 36 VAL N N 15 117.5 0.2 . 1 . . . . . . . . 5177 1 452 . 1 1 36 36 VAL H H 1 8.58 0.02 . 1 . . . . . . . . 5177 1 453 . 1 1 36 36 VAL CA C 13 61.0 0.3 . 1 . . . . . . . . 5177 1 454 . 1 1 36 36 VAL HA H 1 4.70 0.02 . 1 . . . . . . . . 5177 1 455 . 1 1 36 36 VAL CB C 13 35.8 0.3 . 1 . . . . . . . . 5177 1 456 . 1 1 36 36 VAL HB H 1 1.99 0.02 . 1 . . . . . . . . 5177 1 457 . 1 1 36 36 VAL HG11 H 1 0.86 0.02 . 2 . . . . . . . . 5177 1 458 . 1 1 36 36 VAL HG12 H 1 0.86 0.02 . 2 . . . . . . . . 5177 1 459 . 1 1 36 36 VAL HG13 H 1 0.86 0.02 . 2 . . . . . . . . 5177 1 460 . 1 1 36 36 VAL HG21 H 1 0.92 0.02 . 2 . . . . . . . . 5177 1 461 . 1 1 36 36 VAL HG22 H 1 0.92 0.02 . 2 . . . . . . . . 5177 1 462 . 1 1 36 36 VAL HG23 H 1 0.92 0.02 . 2 . . . . . . . . 5177 1 463 . 1 1 36 36 VAL CG1 C 13 21.9 0.3 . 1 . . . . . . . . 5177 1 464 . 1 1 36 36 VAL CG2 C 13 21.9 0.3 . 1 . . . . . . . . 5177 1 465 . 1 1 36 36 VAL C C 13 172.2 0.3 . 1 . . . . . . . . 5177 1 466 . 1 1 37 37 LEU N N 15 124.9 0.2 . 1 . . . . . . . . 5177 1 467 . 1 1 37 37 LEU H H 1 7.69 0.02 . 1 . . . . . . . . 5177 1 468 . 1 1 37 37 LEU CA C 13 54.6 0.3 . 1 . . . . . . . . 5177 1 469 . 1 1 37 37 LEU HA H 1 5.18 0.02 . 1 . . . . . . . . 5177 1 470 . 1 1 37 37 LEU CB C 13 45.2 0.3 . 1 . . . . . . . . 5177 1 471 . 1 1 37 37 LEU HB2 H 1 1.89 0.02 . 2 . . . . . . . . 5177 1 472 . 1 1 37 37 LEU HB3 H 1 2.20 0.02 . 2 . . . . . . . . 5177 1 473 . 1 1 37 37 LEU CG C 13 30.5 0.3 . 1 . . . . . . . . 5177 1 474 . 1 1 37 37 LEU HG H 1 1.85 0.02 . 1 . . . . . . . . 5177 1 475 . 1 1 37 37 LEU CD1 C 13 25.2 0.3 . 1 . . . . . . . . 5177 1 476 . 1 1 37 37 LEU CD2 C 13 26.4 0.3 . 1 . . . . . . . . 5177 1 477 . 1 1 37 37 LEU HD11 H 1 0.87 0.02 . 1 . . . . . . . . 5177 1 478 . 1 1 37 37 LEU HD12 H 1 0.87 0.02 . 1 . . . . . . . . 5177 1 479 . 1 1 37 37 LEU HD13 H 1 0.87 0.02 . 1 . . . . . . . . 5177 1 480 . 1 1 37 37 LEU HD21 H 1 0.87 0.02 . 1 . . . . . . . . 5177 1 481 . 1 1 37 37 LEU HD22 H 1 0.87 0.02 . 1 . . . . . . . . 5177 1 482 . 1 1 37 37 LEU HD23 H 1 0.87 0.02 . 1 . . . . . . . . 5177 1 483 . 1 1 37 37 LEU C C 13 175.6 0.3 . 1 . . . . . . . . 5177 1 484 . 1 1 38 38 PHE N N 15 117.1 0.2 . 1 . . . . . . . . 5177 1 485 . 1 1 38 38 PHE H H 1 9.21 0.02 . 1 . . . . . . . . 5177 1 486 . 1 1 38 38 PHE CA C 13 55.4 0.3 . 1 . . . . . . . . 5177 1 487 . 1 1 38 38 PHE HA H 1 5.84 0.02 . 1 . . . . . . . . 5177 1 488 . 1 1 38 38 PHE CB C 13 42.0 0.3 . 1 . . . . . . . . 5177 1 489 . 1 1 38 38 PHE HB2 H 1 3.07 0.02 . 2 . . . . . . . . 5177 1 490 . 1 1 38 38 PHE HB3 H 1 3.53 0.02 . 2 . . . . . . . . 5177 1 491 . 1 1 38 38 PHE HD1 H 1 7.31 0.02 . 1 . . . . . . . . 5177 1 492 . 1 1 38 38 PHE HD2 H 1 7.31 0.02 . 1 . . . . . . . . 5177 1 493 . 1 1 38 38 PHE HE1 H 1 7.22 0.02 . 1 . . . . . . . . 5177 1 494 . 1 1 38 38 PHE HE2 H 1 7.22 0.02 . 1 . . . . . . . . 5177 1 495 . 1 1 38 38 PHE HZ H 1 7.38 0.02 . 1 . . . . . . . . 5177 1 496 . 1 1 38 38 PHE C C 13 174.8 0.3 . 1 . . . . . . . . 5177 1 497 . 1 1 39 39 CYS N N 15 117.1 0.2 . 1 . . . . . . . . 5177 1 498 . 1 1 39 39 CYS H H 1 9.26 0.02 . 1 . . . . . . . . 5177 1 499 . 1 1 39 39 CYS CA C 13 54.3 0.3 . 1 . . . . . . . . 5177 1 500 . 1 1 39 39 CYS HA H 1 5.86 0.02 . 1 . . . . . . . . 5177 1 501 . 1 1 39 39 CYS CB C 13 33.2 0.3 . 1 . . . . . . . . 5177 1 502 . 1 1 39 39 CYS HB2 H 1 2.54 0.02 . 2 . . . . . . . . 5177 1 503 . 1 1 39 39 CYS HB3 H 1 3.54 0.02 . 2 . . . . . . . . 5177 1 504 . 1 1 39 39 CYS C C 13 172.4 0.3 . 1 . . . . . . . . 5177 1 505 . 1 1 40 40 LEU N N 15 118.6 0.2 . 1 . . . . . . . . 5177 1 506 . 1 1 40 40 LEU H H 1 7.91 0.02 . 1 . . . . . . . . 5177 1 507 . 1 1 40 40 LEU CA C 13 54.3 0.3 . 1 . . . . . . . . 5177 1 508 . 1 1 40 40 LEU HA H 1 5.11 0.02 . 1 . . . . . . . . 5177 1 509 . 1 1 40 40 LEU CB C 13 44.2 0.3 . 1 . . . . . . . . 5177 1 510 . 1 1 40 40 LEU HB2 H 1 1.63 0.02 . 1 . . . . . . . . 5177 1 511 . 1 1 40 40 LEU HB3 H 1 1.63 0.02 . 1 . . . . . . . . 5177 1 512 . 1 1 40 40 LEU CG C 13 27.7 0.3 . 1 . . . . . . . . 5177 1 513 . 1 1 40 40 LEU HG H 1 1.38 0.02 . 1 . . . . . . . . 5177 1 514 . 1 1 40 40 LEU HD11 H 1 0.56 0.02 . 2 . . . . . . . . 5177 1 515 . 1 1 40 40 LEU HD12 H 1 0.56 0.02 . 2 . . . . . . . . 5177 1 516 . 1 1 40 40 LEU HD13 H 1 0.56 0.02 . 2 . . . . . . . . 5177 1 517 . 1 1 40 40 LEU HD21 H 1 0.64 0.02 . 2 . . . . . . . . 5177 1 518 . 1 1 40 40 LEU HD22 H 1 0.64 0.02 . 2 . . . . . . . . 5177 1 519 . 1 1 40 40 LEU HD23 H 1 0.64 0.02 . 2 . . . . . . . . 5177 1 520 . 1 1 40 40 LEU CD1 C 13 23.9 0.3 . 1 . . . . . . . . 5177 1 521 . 1 1 40 40 LEU CD2 C 13 26.4 0.3 . 1 . . . . . . . . 5177 1 522 . 1 1 40 40 LEU C C 13 178.7 0.3 . 1 . . . . . . . . 5177 1 523 . 1 1 41 41 SER N N 15 118.0 0.2 . 1 . . . . . . . . 5177 1 524 . 1 1 41 41 SER H H 1 9.31 0.02 . 1 . . . . . . . . 5177 1 525 . 1 1 41 41 SER CA C 13 58.5 0.3 . 1 . . . . . . . . 5177 1 526 . 1 1 41 41 SER HA H 1 4.38 0.02 . 1 . . . . . . . . 5177 1 527 . 1 1 41 41 SER CB C 13 64.2 0.3 . 1 . . . . . . . . 5177 1 528 . 1 1 41 41 SER HB2 H 1 4.01 0.02 . 2 . . . . . . . . 5177 1 529 . 1 1 41 41 SER HB3 H 1 4.56 0.02 . 2 . . . . . . . . 5177 1 530 . 1 1 41 41 SER C C 13 176.7 0.3 . 1 . . . . . . . . 5177 1 531 . 1 1 42 42 ASP N N 15 124.7 0.2 . 1 . . . . . . . . 5177 1 532 . 1 1 42 42 ASP H H 1 9.30 0.02 . 1 . . . . . . . . 5177 1 533 . 1 1 42 42 ASP CA C 13 58.3 0.3 . 1 . . . . . . . . 5177 1 534 . 1 1 42 42 ASP HA H 1 4.49 0.02 . 1 . . . . . . . . 5177 1 535 . 1 1 42 42 ASP CB C 13 40.7 0.3 . 1 . . . . . . . . 5177 1 536 . 1 1 42 42 ASP HB2 H 1 2.78 0.02 . 1 . . . . . . . . 5177 1 537 . 1 1 42 42 ASP HB3 H 1 2.78 0.02 . 1 . . . . . . . . 5177 1 538 . 1 1 42 42 ASP C C 13 177.6 0.3 . 1 . . . . . . . . 5177 1 539 . 1 1 43 43 ASP N N 15 115.9 0.2 . 1 . . . . . . . . 5177 1 540 . 1 1 43 43 ASP H H 1 8.17 0.02 . 1 . . . . . . . . 5177 1 541 . 1 1 43 43 ASP CA C 13 53.3 0.3 . 1 . . . . . . . . 5177 1 542 . 1 1 43 43 ASP HA H 1 4.53 0.02 . 1 . . . . . . . . 5177 1 543 . 1 1 43 43 ASP CB C 13 40.0 0.3 . 1 . . . . . . . . 5177 1 544 . 1 1 43 43 ASP HB2 H 1 2.72 0.02 . 2 . . . . . . . . 5177 1 545 . 1 1 43 43 ASP HB3 H 1 3.11 0.02 . 2 . . . . . . . . 5177 1 546 . 1 1 43 43 ASP C C 13 175.9 0.3 . 1 . . . . . . . . 5177 1 547 . 1 1 44 44 LYS N N 15 113.4 0.2 . 1 . . . . . . . . 5177 1 548 . 1 1 44 44 LYS H H 1 8.17 0.02 . 1 . . . . . . . . 5177 1 549 . 1 1 44 44 LYS CA C 13 57.6 0.3 . 1 . . . . . . . . 5177 1 550 . 1 1 44 44 LYS HA H 1 3.73 0.02 . 1 . . . . . . . . 5177 1 551 . 1 1 44 44 LYS CB C 13 29.4 0.3 . 1 . . . . . . . . 5177 1 552 . 1 1 44 44 LYS HB2 H 1 2.05 0.02 . 2 . . . . . . . . 5177 1 553 . 1 1 44 44 LYS HB3 H 1 2.22 0.02 . 2 . . . . . . . . 5177 1 554 . 1 1 44 44 LYS CG C 13 25.6 0.3 . 1 . . . . . . . . 5177 1 555 . 1 1 44 44 LYS HG2 H 1 1.39 0.02 . 2 . . . . . . . . 5177 1 556 . 1 1 44 44 LYS HG3 H 1 1.54 0.02 . 2 . . . . . . . . 5177 1 557 . 1 1 44 44 LYS CD C 13 29.1 0.3 . 1 . . . . . . . . 5177 1 558 . 1 1 44 44 LYS HD2 H 1 1.77 0.02 . 1 . . . . . . . . 5177 1 559 . 1 1 44 44 LYS HD3 H 1 1.77 0.02 . 1 . . . . . . . . 5177 1 560 . 1 1 44 44 LYS CE C 13 42.5 0.3 . 1 . . . . . . . . 5177 1 561 . 1 1 44 44 LYS HE2 H 1 3.13 0.02 . 1 . . . . . . . . 5177 1 562 . 1 1 44 44 LYS HE3 H 1 3.13 0.02 . 1 . . . . . . . . 5177 1 563 . 1 1 44 44 LYS C C 13 174.9 0.3 . 1 . . . . . . . . 5177 1 564 . 1 1 45 45 LYS N N 15 114.0 0.2 . 1 . . . . . . . . 5177 1 565 . 1 1 45 45 LYS H H 1 7.65 0.02 . 1 . . . . . . . . 5177 1 566 . 1 1 45 45 LYS CA C 13 57.1 0.3 . 1 . . . . . . . . 5177 1 567 . 1 1 45 45 LYS HA H 1 4.40 0.02 . 1 . . . . . . . . 5177 1 568 . 1 1 45 45 LYS CB C 13 33.8 0.3 . 1 . . . . . . . . 5177 1 569 . 1 1 45 45 LYS HB2 H 1 1.91 0.02 . 1 . . . . . . . . 5177 1 570 . 1 1 45 45 LYS HB3 H 1 1.91 0.02 . 1 . . . . . . . . 5177 1 571 . 1 1 45 45 LYS CG C 13 25.3 0.3 . 1 . . . . . . . . 5177 1 572 . 1 1 45 45 LYS HG2 H 1 1.33 0.02 . 1 . . . . . . . . 5177 1 573 . 1 1 45 45 LYS HG3 H 1 1.33 0.02 . 1 . . . . . . . . 5177 1 574 . 1 1 45 45 LYS CD C 13 28.9 0.3 . 1 . . . . . . . . 5177 1 575 . 1 1 45 45 LYS HD2 H 1 1.63 0.02 . 1 . . . . . . . . 5177 1 576 . 1 1 45 45 LYS HD3 H 1 1.63 0.02 . 1 . . . . . . . . 5177 1 577 . 1 1 45 45 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 578 . 1 1 45 45 LYS HE2 H 1 3.02 0.02 . 1 . . . . . . . . 5177 1 579 . 1 1 45 45 LYS HE3 H 1 3.02 0.02 . 1 . . . . . . . . 5177 1 580 . 1 1 45 45 LYS C C 13 177.0 0.3 . 1 . . . . . . . . 5177 1 581 . 1 1 46 46 GLN N N 15 116.5 0.2 . 1 . . . . . . . . 5177 1 582 . 1 1 46 46 GLN H H 1 8.06 0.02 . 1 . . . . . . . . 5177 1 583 . 1 1 46 46 GLN CA C 13 54.2 0.3 . 1 . . . . . . . . 5177 1 584 . 1 1 46 46 GLN HA H 1 5.63 0.02 . 1 . . . . . . . . 5177 1 585 . 1 1 46 46 GLN CB C 13 34.1 0.3 . 1 . . . . . . . . 5177 1 586 . 1 1 46 46 GLN HB2 H 1 1.85 0.02 . 2 . . . . . . . . 5177 1 587 . 1 1 46 46 GLN HB3 H 1 2.02 0.02 . 2 . . . . . . . . 5177 1 588 . 1 1 46 46 GLN CG C 13 34.2 0.3 . 1 . . . . . . . . 5177 1 589 . 1 1 46 46 GLN HG2 H 1 2.32 0.02 . 1 . . . . . . . . 5177 1 590 . 1 1 46 46 GLN HG3 H 1 2.32 0.02 . 1 . . . . . . . . 5177 1 591 . 1 1 46 46 GLN CD C 13 180.8 0.3 . 1 . . . . . . . . 5177 1 592 . 1 1 46 46 GLN NE2 N 15 111.8 0.2 . 1 . . . . . . . . 5177 1 593 . 1 1 46 46 GLN HE21 H 1 7.00 0.02 . 2 . . . . . . . . 5177 1 594 . 1 1 46 46 GLN HE22 H 1 7.48 0.02 . 2 . . . . . . . . 5177 1 595 . 1 1 46 46 GLN C C 13 174.5 0.3 . 1 . . . . . . . . 5177 1 596 . 1 1 47 47 ILE N N 15 122.2 0.2 . 1 . . . . . . . . 5177 1 597 . 1 1 47 47 ILE H H 1 8.52 0.02 . 1 . . . . . . . . 5177 1 598 . 1 1 47 47 ILE CA C 13 60.4 0.3 . 1 . . . . . . . . 5177 1 599 . 1 1 47 47 ILE HA H 1 4.73 0.02 . 1 . . . . . . . . 5177 1 600 . 1 1 47 47 ILE CB C 13 39.1 0.3 . 1 . . . . . . . . 5177 1 601 . 1 1 47 47 ILE HB H 1 1.67 0.02 . 1 . . . . . . . . 5177 1 602 . 1 1 47 47 ILE HG21 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 603 . 1 1 47 47 ILE HG22 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 604 . 1 1 47 47 ILE HG23 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 605 . 1 1 47 47 ILE CG2 C 13 18.8 0.3 . 1 . . . . . . . . 5177 1 606 . 1 1 47 47 ILE CG1 C 13 27.9 0.3 . 1 . . . . . . . . 5177 1 607 . 1 1 47 47 ILE HG12 H 1 1.54 0.02 . 2 . . . . . . . . 5177 1 608 . 1 1 47 47 ILE HG13 H 1 1.07 0.02 . 2 . . . . . . . . 5177 1 609 . 1 1 47 47 ILE HD11 H 1 0.69 0.02 . 1 . . . . . . . . 5177 1 610 . 1 1 47 47 ILE HD12 H 1 0.69 0.02 . 1 . . . . . . . . 5177 1 611 . 1 1 47 47 ILE HD13 H 1 0.69 0.02 . 1 . . . . . . . . 5177 1 612 . 1 1 47 47 ILE CD1 C 13 13.2 0.3 . 1 . . . . . . . . 5177 1 613 . 1 1 47 47 ILE C C 13 174.5 0.3 . 1 . . . . . . . . 5177 1 614 . 1 1 48 48 ILE N N 15 120.1 0.2 . 1 . . . . . . . . 5177 1 615 . 1 1 48 48 ILE H H 1 9.28 0.02 . 1 . . . . . . . . 5177 1 616 . 1 1 48 48 ILE CA C 13 59.8 0.3 . 1 . . . . . . . . 5177 1 617 . 1 1 48 48 ILE HA H 1 4.86 0.02 . 1 . . . . . . . . 5177 1 618 . 1 1 48 48 ILE CB C 13 42.9 0.3 . 1 . . . . . . . . 5177 1 619 . 1 1 48 48 ILE HB H 1 2.20 0.02 . 1 . . . . . . . . 5177 1 620 . 1 1 48 48 ILE HG21 H 1 0.98 0.02 . 1 . . . . . . . . 5177 1 621 . 1 1 48 48 ILE HG22 H 1 0.98 0.02 . 1 . . . . . . . . 5177 1 622 . 1 1 48 48 ILE HG23 H 1 0.98 0.02 . 1 . . . . . . . . 5177 1 623 . 1 1 48 48 ILE CG2 C 13 19.1 0.3 . 1 . . . . . . . . 5177 1 624 . 1 1 48 48 ILE CG1 C 13 26.6 0.3 . 1 . . . . . . . . 5177 1 625 . 1 1 48 48 ILE HG12 H 1 1.01 0.02 . 2 . . . . . . . . 5177 1 626 . 1 1 48 48 ILE HG13 H 1 1.41 0.02 . 2 . . . . . . . . 5177 1 627 . 1 1 48 48 ILE HD11 H 1 0.86 0.02 . 1 . . . . . . . . 5177 1 628 . 1 1 48 48 ILE HD12 H 1 0.86 0.02 . 1 . . . . . . . . 5177 1 629 . 1 1 48 48 ILE HD13 H 1 0.86 0.02 . 1 . . . . . . . . 5177 1 630 . 1 1 48 48 ILE CD1 C 13 14.2 0.3 . 1 . . . . . . . . 5177 1 631 . 1 1 48 48 ILE C C 13 175.7 0.3 . 1 . . . . . . . . 5177 1 632 . 1 1 49 49 VAL N N 15 120.6 0.2 . 1 . . . . . . . . 5177 1 633 . 1 1 49 49 VAL H H 1 8.69 0.02 . 1 . . . . . . . . 5177 1 634 . 1 1 49 49 VAL CA C 13 63.9 0.3 . 1 . . . . . . . . 5177 1 635 . 1 1 49 49 VAL HA H 1 4.26 0.02 . 1 . . . . . . . . 5177 1 636 . 1 1 49 49 VAL CB C 13 32.9 0.3 . 1 . . . . . . . . 5177 1 637 . 1 1 49 49 VAL HB H 1 2.20 0.02 . 1 . . . . . . . . 5177 1 638 . 1 1 49 49 VAL HG11 H 1 1.26 0.02 . 2 . . . . . . . . 5177 1 639 . 1 1 49 49 VAL HG12 H 1 1.26 0.02 . 2 . . . . . . . . 5177 1 640 . 1 1 49 49 VAL HG13 H 1 1.26 0.02 . 2 . . . . . . . . 5177 1 641 . 1 1 49 49 VAL HG21 H 1 0.94 0.02 . 2 . . . . . . . . 5177 1 642 . 1 1 49 49 VAL HG22 H 1 0.94 0.02 . 2 . . . . . . . . 5177 1 643 . 1 1 49 49 VAL HG23 H 1 0.94 0.02 . 2 . . . . . . . . 5177 1 644 . 1 1 49 49 VAL CG1 C 13 23.1 0.3 . 1 . . . . . . . . 5177 1 645 . 1 1 49 49 VAL CG2 C 13 21.5 0.3 . 1 . . . . . . . . 5177 1 646 . 1 1 49 49 VAL C C 13 176.0 0.3 . 1 . . . . . . . . 5177 1 647 . 1 1 50 50 GLU N N 15 132.1 0.2 . 1 . . . . . . . . 5177 1 648 . 1 1 50 50 GLU H H 1 8.72 0.02 . 1 . . . . . . . . 5177 1 649 . 1 1 50 50 GLU CA C 13 55.4 0.3 . 1 . . . . . . . . 5177 1 650 . 1 1 50 50 GLU HA H 1 4.52 0.02 . 1 . . . . . . . . 5177 1 651 . 1 1 50 50 GLU CB C 13 29.1 0.3 . 1 . . . . . . . . 5177 1 652 . 1 1 50 50 GLU HB2 H 1 1.54 0.02 . 2 . . . . . . . . 5177 1 653 . 1 1 50 50 GLU HB3 H 1 2.37 0.02 . 2 . . . . . . . . 5177 1 654 . 1 1 50 50 GLU CG C 13 37.2 0.3 . 1 . . . . . . . . 5177 1 655 . 1 1 50 50 GLU HG2 H 1 2.17 0.02 . 2 . . . . . . . . 5177 1 656 . 1 1 50 50 GLU HG3 H 1 2.29 0.02 . 2 . . . . . . . . 5177 1 657 . 1 1 50 50 GLU C C 13 175.9 0.3 . 1 . . . . . . . . 5177 1 658 . 1 1 51 51 GLU N N 15 127.8 0.2 . 1 . . . . . . . . 5177 1 659 . 1 1 51 51 GLU H H 1 7.96 0.02 . 1 . . . . . . . . 5177 1 660 . 1 1 51 51 GLU CA C 13 59.5 0.3 . 1 . . . . . . . . 5177 1 661 . 1 1 51 51 GLU HA H 1 3.87 0.02 . 1 . . . . . . . . 5177 1 662 . 1 1 51 51 GLU CB C 13 30.3 0.3 . 1 . . . . . . . . 5177 1 663 . 1 1 51 51 GLU HB2 H 1 2.08 0.02 . 1 . . . . . . . . 5177 1 664 . 1 1 51 51 GLU HB3 H 1 2.08 0.02 . 1 . . . . . . . . 5177 1 665 . 1 1 51 51 GLU CG C 13 36.3 0.3 . 1 . . . . . . . . 5177 1 666 . 1 1 51 51 GLU HG2 H 1 2.33 0.02 . 1 . . . . . . . . 5177 1 667 . 1 1 51 51 GLU HG3 H 1 2.33 0.02 . 1 . . . . . . . . 5177 1 668 . 1 1 51 51 GLU C C 13 176.7 0.3 . 1 . . . . . . . . 5177 1 669 . 1 1 52 52 ALA N N 15 118.6 0.2 . 1 . . . . . . . . 5177 1 670 . 1 1 52 52 ALA H H 1 8.71 0.02 . 1 . . . . . . . . 5177 1 671 . 1 1 52 52 ALA CA C 13 53.7 0.3 . 1 . . . . . . . . 5177 1 672 . 1 1 52 52 ALA HA H 1 4.28 0.02 . 1 . . . . . . . . 5177 1 673 . 1 1 52 52 ALA HB1 H 1 1.57 0.02 . 1 . . . . . . . . 5177 1 674 . 1 1 52 52 ALA HB2 H 1 1.57 0.02 . 1 . . . . . . . . 5177 1 675 . 1 1 52 52 ALA HB3 H 1 1.57 0.02 . 1 . . . . . . . . 5177 1 676 . 1 1 52 52 ALA CB C 13 18.9 0.3 . 1 . . . . . . . . 5177 1 677 . 1 1 52 52 ALA C C 13 177.9 0.3 . 1 . . . . . . . . 5177 1 678 . 1 1 53 53 LYS N N 15 120.6 0.2 . 1 . . . . . . . . 5177 1 679 . 1 1 53 53 LYS H H 1 7.82 0.02 . 1 . . . . . . . . 5177 1 680 . 1 1 53 53 LYS CA C 13 53.1 0.3 . 1 . . . . . . . . 5177 1 681 . 1 1 53 53 LYS HA H 1 4.69 0.02 . 1 . . . . . . . . 5177 1 682 . 1 1 53 53 LYS CB C 13 32.9 0.3 . 1 . . . . . . . . 5177 1 683 . 1 1 53 53 LYS HB2 H 1 1.62 0.02 . 2 . . . . . . . . 5177 1 684 . 1 1 53 53 LYS HB3 H 1 2.04 0.02 . 2 . . . . . . . . 5177 1 685 . 1 1 53 53 LYS CG C 13 23.8 0.3 . 1 . . . . . . . . 5177 1 686 . 1 1 53 53 LYS HG2 H 1 1.24 0.02 . 2 . . . . . . . . 5177 1 687 . 1 1 53 53 LYS HG3 H 1 1.52 0.02 . 2 . . . . . . . . 5177 1 688 . 1 1 53 53 LYS CD C 13 29.1 0.3 . 1 . . . . . . . . 5177 1 689 . 1 1 53 53 LYS HD2 H 1 1.79 0.02 . 1 . . . . . . . . 5177 1 690 . 1 1 53 53 LYS HD3 H 1 1.79 0.02 . 1 . . . . . . . . 5177 1 691 . 1 1 53 53 LYS CE C 13 42.5 0.3 . 1 . . . . . . . . 5177 1 692 . 1 1 53 53 LYS HE2 H 1 2.98 0.02 . 1 . . . . . . . . 5177 1 693 . 1 1 53 53 LYS HE3 H 1 2.98 0.02 . 1 . . . . . . . . 5177 1 694 . 1 1 53 53 LYS C C 13 172.4 0.3 . 1 . . . . . . . . 5177 1 695 . 1 1 54 54 GLN N N 15 115.4 0.2 . 1 . . . . . . . . 5177 1 696 . 1 1 54 54 GLN H H 1 7.51 0.02 . 1 . . . . . . . . 5177 1 697 . 1 1 54 54 GLN CA C 13 53.9 0.3 . 1 . . . . . . . . 5177 1 698 . 1 1 54 54 GLN HA H 1 5.07 0.02 . 1 . . . . . . . . 5177 1 699 . 1 1 54 54 GLN CB C 13 32.2 0.3 . 1 . . . . . . . . 5177 1 700 . 1 1 54 54 GLN HB2 H 1 2.06 0.02 . 2 . . . . . . . . 5177 1 701 . 1 1 54 54 GLN HB3 H 1 2.19 0.02 . 2 . . . . . . . . 5177 1 702 . 1 1 54 54 GLN CG C 13 32.6 0.3 . 1 . . . . . . . . 5177 1 703 . 1 1 54 54 GLN HG2 H 1 2.23 0.02 . 2 . . . . . . . . 5177 1 704 . 1 1 54 54 GLN HG3 H 1 2.43 0.02 . 2 . . . . . . . . 5177 1 705 . 1 1 54 54 GLN CD C 13 180.1 0.3 . 1 . . . . . . . . 5177 1 706 . 1 1 54 54 GLN NE2 N 15 110.1 0.2 . 1 . . . . . . . . 5177 1 707 . 1 1 54 54 GLN HE21 H 1 7.03 0.02 . 2 . . . . . . . . 5177 1 708 . 1 1 54 54 GLN HE22 H 1 7.64 0.02 . 2 . . . . . . . . 5177 1 709 . 1 1 54 54 GLN C C 13 174.6 0.3 . 1 . . . . . . . . 5177 1 710 . 1 1 55 55 ILE N N 15 119.6 0.2 . 1 . . . . . . . . 5177 1 711 . 1 1 55 55 ILE H H 1 8.68 0.02 . 1 . . . . . . . . 5177 1 712 . 1 1 55 55 ILE CA C 13 59.5 0.3 . 1 . . . . . . . . 5177 1 713 . 1 1 55 55 ILE HA H 1 4.51 0.02 . 1 . . . . . . . . 5177 1 714 . 1 1 55 55 ILE CB C 13 41.1 0.3 . 1 . . . . . . . . 5177 1 715 . 1 1 55 55 ILE HB H 1 1.71 0.02 . 1 . . . . . . . . 5177 1 716 . 1 1 55 55 ILE HG21 H 1 1.04 0.02 . 1 . . . . . . . . 5177 1 717 . 1 1 55 55 ILE HG22 H 1 1.04 0.02 . 1 . . . . . . . . 5177 1 718 . 1 1 55 55 ILE HG23 H 1 1.04 0.02 . 1 . . . . . . . . 5177 1 719 . 1 1 55 55 ILE CG2 C 13 17.2 0.3 . 1 . . . . . . . . 5177 1 720 . 1 1 55 55 ILE CG1 C 13 27.2 0.3 . 1 . . . . . . . . 5177 1 721 . 1 1 55 55 ILE HG12 H 1 1.38 0.02 . 2 . . . . . . . . 5177 1 722 . 1 1 55 55 ILE HG13 H 1 1.57 0.02 . 2 . . . . . . . . 5177 1 723 . 1 1 55 55 ILE HD11 H 1 0.91 0.02 . 1 . . . . . . . . 5177 1 724 . 1 1 55 55 ILE HD12 H 1 0.91 0.02 . 1 . . . . . . . . 5177 1 725 . 1 1 55 55 ILE HD13 H 1 0.91 0.02 . 1 . . . . . . . . 5177 1 726 . 1 1 55 55 ILE CD1 C 13 13.2 0.3 . 1 . . . . . . . . 5177 1 727 . 1 1 55 55 ILE C C 13 175.2 0.3 . 1 . . . . . . . . 5177 1 728 . 1 1 56 56 LEU N N 15 129.9 0.2 . 1 . . . . . . . . 5177 1 729 . 1 1 56 56 LEU H H 1 9.42 0.02 . 1 . . . . . . . . 5177 1 730 . 1 1 56 56 LEU CA C 13 53.5 0.3 . 1 . . . . . . . . 5177 1 731 . 1 1 56 56 LEU HA H 1 5.09 0.02 . 1 . . . . . . . . 5177 1 732 . 1 1 56 56 LEU CB C 13 42.3 0.3 . 1 . . . . . . . . 5177 1 733 . 1 1 56 56 LEU HB2 H 1 1.76 0.02 . 1 . . . . . . . . 5177 1 734 . 1 1 56 56 LEU HB3 H 1 1.76 0.02 . 1 . . . . . . . . 5177 1 735 . 1 1 56 56 LEU CG C 13 27.5 0.3 . 1 . . . . . . . . 5177 1 736 . 1 1 56 56 LEU HG H 1 1.82 0.02 . 1 . . . . . . . . 5177 1 737 . 1 1 56 56 LEU HD11 H 1 0.99 0.02 . 2 . . . . . . . . 5177 1 738 . 1 1 56 56 LEU HD12 H 1 0.99 0.02 . 2 . . . . . . . . 5177 1 739 . 1 1 56 56 LEU HD13 H 1 0.99 0.02 . 2 . . . . . . . . 5177 1 740 . 1 1 56 56 LEU HD21 H 1 0.86 0.02 . 2 . . . . . . . . 5177 1 741 . 1 1 56 56 LEU HD22 H 1 0.86 0.02 . 2 . . . . . . . . 5177 1 742 . 1 1 56 56 LEU HD23 H 1 0.86 0.02 . 2 . . . . . . . . 5177 1 743 . 1 1 56 56 LEU CD1 C 13 25.6 0.3 . 1 . . . . . . . . 5177 1 744 . 1 1 56 56 LEU CD2 C 13 23.3 0.3 . 1 . . . . . . . . 5177 1 745 . 1 1 56 56 LEU C C 13 178.4 0.3 . 1 . . . . . . . . 5177 1 746 . 1 1 57 57 VAL N N 15 124.2 0.2 . 1 . . . . . . . . 5177 1 747 . 1 1 57 57 VAL H H 1 9.27 0.02 . 1 . . . . . . . . 5177 1 748 . 1 1 57 57 VAL CA C 13 67.3 0.3 . 1 . . . . . . . . 5177 1 749 . 1 1 57 57 VAL HA H 1 3.55 0.02 . 1 . . . . . . . . 5177 1 750 . 1 1 57 57 VAL CB C 13 31.1 0.3 . 1 . . . . . . . . 5177 1 751 . 1 1 57 57 VAL HB H 1 2.37 0.02 . 1 . . . . . . . . 5177 1 752 . 1 1 57 57 VAL CG1 C 13 21.5 0.3 . 1 . . . . . . . . 5177 1 753 . 1 1 57 57 VAL CG2 C 13 24.7 0.3 . 1 . . . . . . . . 5177 1 754 . 1 1 57 57 VAL HG11 H 1 0.92 0.02 . 1 . . . . . . . . 5177 1 755 . 1 1 57 57 VAL HG12 H 1 0.92 0.02 . 1 . . . . . . . . 5177 1 756 . 1 1 57 57 VAL HG13 H 1 0.92 0.02 . 1 . . . . . . . . 5177 1 757 . 1 1 57 57 VAL HG21 H 1 0.92 0.02 . 1 . . . . . . . . 5177 1 758 . 1 1 57 57 VAL HG22 H 1 0.92 0.02 . 1 . . . . . . . . 5177 1 759 . 1 1 57 57 VAL HG23 H 1 0.92 0.02 . 1 . . . . . . . . 5177 1 760 . 1 1 57 57 VAL C C 13 179.8 0.3 . 1 . . . . . . . . 5177 1 761 . 1 1 58 58 GLY N N 15 105.1 0.2 . 1 . . . . . . . . 5177 1 762 . 1 1 58 58 GLY H H 1 8.68 0.02 . 1 . . . . . . . . 5177 1 763 . 1 1 58 58 GLY CA C 13 46.3 0.3 . 1 . . . . . . . . 5177 1 764 . 1 1 58 58 GLY HA2 H 1 4.08 0.02 . 2 . . . . . . . . 5177 1 765 . 1 1 58 58 GLY HA3 H 1 3.96 0.02 . 2 . . . . . . . . 5177 1 766 . 1 1 58 58 GLY C C 13 174.1 0.3 . 1 . . . . . . . . 5177 1 767 . 1 1 59 59 ASP N N 15 118.5 0.2 . 1 . . . . . . . . 5177 1 768 . 1 1 59 59 ASP H H 1 7.79 0.02 . 1 . . . . . . . . 5177 1 769 . 1 1 59 59 ASP CA C 13 56.5 0.3 . 1 . . . . . . . . 5177 1 770 . 1 1 59 59 ASP HA H 1 4.73 0.02 . 1 . . . . . . . . 5177 1 771 . 1 1 59 59 ASP CB C 13 41.6 0.3 . 1 . . . . . . . . 5177 1 772 . 1 1 59 59 ASP HB2 H 1 2.92 0.02 . 1 . . . . . . . . 5177 1 773 . 1 1 59 59 ASP HB3 H 1 2.92 0.02 . 1 . . . . . . . . 5177 1 774 . 1 1 59 59 ASP C C 13 178.7 0.3 . 1 . . . . . . . . 5177 1 775 . 1 1 60 60 ILE N N 15 122.6 0.2 . 1 . . . . . . . . 5177 1 776 . 1 1 60 60 ILE H H 1 7.77 0.02 . 1 . . . . . . . . 5177 1 777 . 1 1 60 60 ILE CA C 13 63.2 0.3 . 1 . . . . . . . . 5177 1 778 . 1 1 60 60 ILE HA H 1 4.13 0.02 . 1 . . . . . . . . 5177 1 779 . 1 1 60 60 ILE CB C 13 37.2 0.3 . 1 . . . . . . . . 5177 1 780 . 1 1 60 60 ILE HB H 1 2.14 0.02 . 1 . . . . . . . . 5177 1 781 . 1 1 60 60 ILE HG21 H 1 1.03 0.02 . 1 . . . . . . . . 5177 1 782 . 1 1 60 60 ILE HG22 H 1 1.03 0.02 . 1 . . . . . . . . 5177 1 783 . 1 1 60 60 ILE HG23 H 1 1.03 0.02 . 1 . . . . . . . . 5177 1 784 . 1 1 60 60 ILE CG2 C 13 17.4 0.3 . 1 . . . . . . . . 5177 1 785 . 1 1 60 60 ILE CG1 C 13 28.1 0.3 . 1 . . . . . . . . 5177 1 786 . 1 1 60 60 ILE HG12 H 1 0.83 0.02 . 2 . . . . . . . . 5177 1 787 . 1 1 60 60 ILE HG13 H 1 1.94 0.02 . 2 . . . . . . . . 5177 1 788 . 1 1 60 60 ILE HD11 H 1 1.05 0.02 . 1 . . . . . . . . 5177 1 789 . 1 1 60 60 ILE HD12 H 1 1.05 0.02 . 1 . . . . . . . . 5177 1 790 . 1 1 60 60 ILE HD13 H 1 1.05 0.02 . 1 . . . . . . . . 5177 1 791 . 1 1 60 60 ILE CD1 C 13 14.4 0.3 . 1 . . . . . . . . 5177 1 792 . 1 1 60 60 ILE C C 13 177.3 0.3 . 1 . . . . . . . . 5177 1 793 . 1 1 61 61 GLY N N 15 117.5 0.2 . 1 . . . . . . . . 5177 1 794 . 1 1 61 61 GLY H H 1 9.01 0.02 . 1 . . . . . . . . 5177 1 795 . 1 1 61 61 GLY CA C 13 45.4 0.3 . 1 . . . . . . . . 5177 1 796 . 1 1 61 61 GLY HA2 H 1 4.43 0.02 . 2 . . . . . . . . 5177 1 797 . 1 1 61 61 GLY HA3 H 1 3.87 0.02 . 2 . . . . . . . . 5177 1 798 . 1 1 61 61 GLY C C 13 173.2 0.3 . 1 . . . . . . . . 5177 1 799 . 1 1 62 62 ASP N N 15 120.6 0.2 . 1 . . . . . . . . 5177 1 800 . 1 1 62 62 ASP H H 1 8.02 0.02 . 1 . . . . . . . . 5177 1 801 . 1 1 62 62 ASP CA C 13 54.8 0.3 . 1 . . . . . . . . 5177 1 802 . 1 1 62 62 ASP HA H 1 4.96 0.02 . 1 . . . . . . . . 5177 1 803 . 1 1 62 62 ASP CB C 13 42.0 0.3 . 1 . . . . . . . . 5177 1 804 . 1 1 62 62 ASP HB2 H 1 2.76 0.02 . 2 . . . . . . . . 5177 1 805 . 1 1 62 62 ASP HB3 H 1 2.86 0.02 . 2 . . . . . . . . 5177 1 806 . 1 1 62 62 ASP C C 13 175.6 0.3 . 1 . . . . . . . . 5177 1 807 . 1 1 63 63 THR N N 15 108.2 0.2 . 1 . . . . . . . . 5177 1 808 . 1 1 63 63 THR H H 1 7.79 0.02 . 1 . . . . . . . . 5177 1 809 . 1 1 63 63 THR CA C 13 62.2 0.3 . 1 . . . . . . . . 5177 1 810 . 1 1 63 63 THR HA H 1 4.43 0.02 . 1 . . . . . . . . 5177 1 811 . 1 1 63 63 THR CB C 13 70.2 0.3 . 1 . . . . . . . . 5177 1 812 . 1 1 63 63 THR HB H 1 4.40 0.02 . 1 . . . . . . . . 5177 1 813 . 1 1 63 63 THR HG21 H 1 1.30 0.02 . 1 . . . . . . . . 5177 1 814 . 1 1 63 63 THR HG22 H 1 1.30 0.02 . 1 . . . . . . . . 5177 1 815 . 1 1 63 63 THR HG23 H 1 1.30 0.02 . 1 . . . . . . . . 5177 1 816 . 1 1 63 63 THR CG2 C 13 22.1 0.3 . 1 . . . . . . . . 5177 1 817 . 1 1 63 63 THR C C 13 175.0 0.3 . 1 . . . . . . . . 5177 1 818 . 1 1 64 64 VAL N N 15 121.6 0.2 . 1 . . . . . . . . 5177 1 819 . 1 1 64 64 VAL H H 1 7.82 0.02 . 1 . . . . . . . . 5177 1 820 . 1 1 64 64 VAL CA C 13 61.0 0.3 . 1 . . . . . . . . 5177 1 821 . 1 1 64 64 VAL HA H 1 4.32 0.02 . 1 . . . . . . . . 5177 1 822 . 1 1 64 64 VAL CB C 13 34.2 0.3 . 1 . . . . . . . . 5177 1 823 . 1 1 64 64 VAL HB H 1 1.82 0.02 . 1 . . . . . . . . 5177 1 824 . 1 1 64 64 VAL HG11 H 1 0.95 0.02 . 2 . . . . . . . . 5177 1 825 . 1 1 64 64 VAL HG12 H 1 0.95 0.02 . 2 . . . . . . . . 5177 1 826 . 1 1 64 64 VAL HG13 H 1 0.95 0.02 . 2 . . . . . . . . 5177 1 827 . 1 1 64 64 VAL HG21 H 1 0.81 0.02 . 2 . . . . . . . . 5177 1 828 . 1 1 64 64 VAL HG22 H 1 0.81 0.02 . 2 . . . . . . . . 5177 1 829 . 1 1 64 64 VAL HG23 H 1 0.81 0.02 . 2 . . . . . . . . 5177 1 830 . 1 1 64 64 VAL CG1 C 13 21.2 0.3 . 1 . . . . . . . . 5177 1 831 . 1 1 64 64 VAL CG2 C 13 21.5 0.3 . 1 . . . . . . . . 5177 1 832 . 1 1 64 64 VAL C C 13 174.8 0.3 . 1 . . . . . . . . 5177 1 833 . 1 1 65 65 GLU N N 15 127.8 0.2 . 1 . . . . . . . . 5177 1 834 . 1 1 65 65 GLU H H 1 8.64 0.02 . 1 . . . . . . . . 5177 1 835 . 1 1 65 65 GLU CA C 13 57.7 0.3 . 1 . . . . . . . . 5177 1 836 . 1 1 65 65 GLU HA H 1 4.42 0.02 . 1 . . . . . . . . 5177 1 837 . 1 1 65 65 GLU CB C 13 30.2 0.3 . 1 . . . . . . . . 5177 1 838 . 1 1 65 65 GLU HB2 H 1 2.07 0.02 . 1 . . . . . . . . 5177 1 839 . 1 1 65 65 GLU HB3 H 1 2.07 0.02 . 1 . . . . . . . . 5177 1 840 . 1 1 65 65 GLU CG C 13 36.3 0.3 . 1 . . . . . . . . 5177 1 841 . 1 1 65 65 GLU HG2 H 1 2.35 0.02 . 1 . . . . . . . . 5177 1 842 . 1 1 65 65 GLU HG3 H 1 2.35 0.02 . 1 . . . . . . . . 5177 1 843 . 1 1 65 65 GLU C C 13 175.7 0.3 . 1 . . . . . . . . 5177 1 844 . 1 1 66 66 ASP N N 15 118.1 0.2 . 1 . . . . . . . . 5177 1 845 . 1 1 66 66 ASP H H 1 7.92 0.02 . 1 . . . . . . . . 5177 1 846 . 1 1 66 66 ASP CA C 13 50.4 0.3 . 1 . . . . . . . . 5177 1 847 . 1 1 66 66 ASP HA H 1 5.31 0.02 . 1 . . . . . . . . 5177 1 848 . 1 1 66 66 ASP CB C 13 43.2 0.3 . 1 . . . . . . . . 5177 1 849 . 1 1 66 66 ASP HB2 H 1 2.81 0.02 . 2 . . . . . . . . 5177 1 850 . 1 1 66 66 ASP HB3 H 1 3.06 0.02 . 2 . . . . . . . . 5177 1 851 . 1 1 67 67 PRO CD C 13 51.0 0.3 . 1 . . . . . . . . 5177 1 852 . 1 1 67 67 PRO CA C 13 64.7 0.3 . 1 . . . . . . . . 5177 1 853 . 1 1 67 67 PRO HA H 1 4.27 0.02 . 1 . . . . . . . . 5177 1 854 . 1 1 67 67 PRO CB C 13 32.4 0.3 . 1 . . . . . . . . 5177 1 855 . 1 1 67 67 PRO HB2 H 1 2.12 0.02 . 2 . . . . . . . . 5177 1 856 . 1 1 67 67 PRO HB3 H 1 2.21 0.02 . 2 . . . . . . . . 5177 1 857 . 1 1 67 67 PRO CG C 13 27.1 0.3 . 1 . . . . . . . . 5177 1 858 . 1 1 67 67 PRO HG2 H 1 2.25 0.02 . 2 . . . . . . . . 5177 1 859 . 1 1 67 67 PRO HG3 H 1 2.36 0.02 . 2 . . . . . . . . 5177 1 860 . 1 1 67 67 PRO HD2 H 1 3.90 0.02 . 2 . . . . . . . . 5177 1 861 . 1 1 67 67 PRO HD3 H 1 4.37 0.02 . 2 . . . . . . . . 5177 1 862 . 1 1 67 67 PRO C C 13 176.2 0.3 . 1 . . . . . . . . 5177 1 863 . 1 1 68 68 TYR N N 15 120.7 0.2 . 1 . . . . . . . . 5177 1 864 . 1 1 68 68 TYR H H 1 8.11 0.02 . 1 . . . . . . . . 5177 1 865 . 1 1 68 68 TYR CA C 13 63.1 0.3 . 1 . . . . . . . . 5177 1 866 . 1 1 68 68 TYR HA H 1 4.32 0.02 . 1 . . . . . . . . 5177 1 867 . 1 1 68 68 TYR CB C 13 38.9 0.3 . 1 . . . . . . . . 5177 1 868 . 1 1 68 68 TYR HB2 H 1 3.10 0.02 . 2 . . . . . . . . 5177 1 869 . 1 1 68 68 TYR HB3 H 1 3.24 0.02 . 2 . . . . . . . . 5177 1 870 . 1 1 68 68 TYR HD1 H 1 6.70 0.02 . 1 . . . . . . . . 5177 1 871 . 1 1 68 68 TYR HD2 H 1 6.70 0.02 . 1 . . . . . . . . 5177 1 872 . 1 1 68 68 TYR HE1 H 1 6.56 0.02 . 1 . . . . . . . . 5177 1 873 . 1 1 68 68 TYR HE2 H 1 6.56 0.02 . 1 . . . . . . . . 5177 1 874 . 1 1 68 68 TYR C C 13 177.3 0.3 . 1 . . . . . . . . 5177 1 875 . 1 1 69 69 THR N N 15 114.4 0.2 . 1 . . . . . . . . 5177 1 876 . 1 1 69 69 THR H H 1 7.76 0.02 . 1 . . . . . . . . 5177 1 877 . 1 1 69 69 THR CA C 13 66.2 0.3 . 1 . . . . . . . . 5177 1 878 . 1 1 69 69 THR HA H 1 3.77 0.02 . 1 . . . . . . . . 5177 1 879 . 1 1 69 69 THR CB C 13 68.9 0.3 . 1 . . . . . . . . 5177 1 880 . 1 1 69 69 THR HB H 1 4.24 0.02 . 1 . . . . . . . . 5177 1 881 . 1 1 69 69 THR HG21 H 1 1.38 0.02 . 1 . . . . . . . . 5177 1 882 . 1 1 69 69 THR HG22 H 1 1.38 0.02 . 1 . . . . . . . . 5177 1 883 . 1 1 69 69 THR HG23 H 1 1.38 0.02 . 1 . . . . . . . . 5177 1 884 . 1 1 69 69 THR CG2 C 13 22.5 0.3 . 1 . . . . . . . . 5177 1 885 . 1 1 69 69 THR C C 13 176.9 0.3 . 1 . . . . . . . . 5177 1 886 . 1 1 70 70 ALA N N 15 122.1 0.2 . 1 . . . . . . . . 5177 1 887 . 1 1 70 70 ALA H H 1 7.91 0.02 . 1 . . . . . . . . 5177 1 888 . 1 1 70 70 ALA CA C 13 55.1 0.3 . 1 . . . . . . . . 5177 1 889 . 1 1 70 70 ALA HA H 1 4.03 0.02 . 1 . . . . . . . . 5177 1 890 . 1 1 70 70 ALA HB1 H 1 1.54 0.02 . 1 . . . . . . . . 5177 1 891 . 1 1 70 70 ALA HB2 H 1 1.54 0.02 . 1 . . . . . . . . 5177 1 892 . 1 1 70 70 ALA HB3 H 1 1.54 0.02 . 1 . . . . . . . . 5177 1 893 . 1 1 70 70 ALA CB C 13 19.5 0.3 . 1 . . . . . . . . 5177 1 894 . 1 1 70 70 ALA C C 13 179.3 0.3 . 1 . . . . . . . . 5177 1 895 . 1 1 71 71 PHE N N 15 120.2 0.2 . 1 . . . . . . . . 5177 1 896 . 1 1 71 71 PHE H H 1 7.91 0.02 . 1 . . . . . . . . 5177 1 897 . 1 1 71 71 PHE CA C 13 59.8 0.3 . 1 . . . . . . . . 5177 1 898 . 1 1 71 71 PHE HA H 1 4.05 0.02 . 1 . . . . . . . . 5177 1 899 . 1 1 71 71 PHE CB C 13 38.5 0.3 . 1 . . . . . . . . 5177 1 900 . 1 1 71 71 PHE HB2 H 1 3.16 0.02 . 2 . . . . . . . . 5177 1 901 . 1 1 71 71 PHE HB3 H 1 3.29 0.02 . 2 . . . . . . . . 5177 1 902 . 1 1 71 71 PHE HD1 H 1 6.63 0.02 . 1 . . . . . . . . 5177 1 903 . 1 1 71 71 PHE HD2 H 1 6.63 0.02 . 1 . . . . . . . . 5177 1 904 . 1 1 71 71 PHE HE1 H 1 7.13 0.02 . 1 . . . . . . . . 5177 1 905 . 1 1 71 71 PHE HE2 H 1 7.13 0.02 . 1 . . . . . . . . 5177 1 906 . 1 1 71 71 PHE HZ H 1 6.42 0.02 . 1 . . . . . . . . 5177 1 907 . 1 1 71 71 PHE C C 13 176.0 0.3 . 1 . . . . . . . . 5177 1 908 . 1 1 72 72 VAL N N 15 119.0 0.2 . 1 . . . . . . . . 5177 1 909 . 1 1 72 72 VAL H H 1 7.64 0.02 . 1 . . . . . . . . 5177 1 910 . 1 1 72 72 VAL CA C 13 66.2 0.3 . 1 . . . . . . . . 5177 1 911 . 1 1 72 72 VAL HA H 1 2.48 0.02 . 1 . . . . . . . . 5177 1 912 . 1 1 72 72 VAL CB C 13 31.2 0.3 . 1 . . . . . . . . 5177 1 913 . 1 1 72 72 VAL HB H 1 1.85 0.02 . 1 . . . . . . . . 5177 1 914 . 1 1 72 72 VAL CG1 C 13 21.9 0.3 . 1 . . . . . . . . 5177 1 915 . 1 1 72 72 VAL CG2 C 13 23.2 0.3 . 1 . . . . . . . . 5177 1 916 . 1 1 72 72 VAL HG11 H 1 0.52 0.02 . 1 . . . . . . . . 5177 1 917 . 1 1 72 72 VAL HG12 H 1 0.52 0.02 . 1 . . . . . . . . 5177 1 918 . 1 1 72 72 VAL HG13 H 1 0.52 0.02 . 1 . . . . . . . . 5177 1 919 . 1 1 72 72 VAL HG21 H 1 0.52 0.02 . 1 . . . . . . . . 5177 1 920 . 1 1 72 72 VAL HG22 H 1 0.52 0.02 . 1 . . . . . . . . 5177 1 921 . 1 1 72 72 VAL HG23 H 1 0.52 0.02 . 1 . . . . . . . . 5177 1 922 . 1 1 72 72 VAL C C 13 178.6 0.3 . 1 . . . . . . . . 5177 1 923 . 1 1 73 73 LYS N N 15 116.0 0.2 . 1 . . . . . . . . 5177 1 924 . 1 1 73 73 LYS H H 1 7.21 0.02 . 1 . . . . . . . . 5177 1 925 . 1 1 73 73 LYS CA C 13 57.9 0.3 . 1 . . . . . . . . 5177 1 926 . 1 1 73 73 LYS HA H 1 3.87 0.02 . 1 . . . . . . . . 5177 1 927 . 1 1 73 73 LYS CB C 13 32.8 0.3 . 1 . . . . . . . . 5177 1 928 . 1 1 73 73 LYS HB2 H 1 1.85 0.02 . 1 . . . . . . . . 5177 1 929 . 1 1 73 73 LYS HB3 H 1 1.85 0.02 . 1 . . . . . . . . 5177 1 930 . 1 1 73 73 LYS CG C 13 25.6 0.3 . 1 . . . . . . . . 5177 1 931 . 1 1 73 73 LYS HG2 H 1 1.47 0.02 . 1 . . . . . . . . 5177 1 932 . 1 1 73 73 LYS HG3 H 1 1.47 0.02 . 1 . . . . . . . . 5177 1 933 . 1 1 73 73 LYS CD C 13 29.3 0.3 . 1 . . . . . . . . 5177 1 934 . 1 1 73 73 LYS HD2 H 1 1.61 0.02 . 1 . . . . . . . . 5177 1 935 . 1 1 73 73 LYS HD3 H 1 1.61 0.02 . 1 . . . . . . . . 5177 1 936 . 1 1 73 73 LYS CE C 13 42.1 0.3 . 1 . . . . . . . . 5177 1 937 . 1 1 73 73 LYS HE2 H 1 2.98 0.02 . 1 . . . . . . . . 5177 1 938 . 1 1 73 73 LYS HE3 H 1 2.98 0.02 . 1 . . . . . . . . 5177 1 939 . 1 1 73 73 LYS C C 13 177.6 0.3 . 1 . . . . . . . . 5177 1 940 . 1 1 74 74 LEU N N 15 118.2 0.2 . 1 . . . . . . . . 5177 1 941 . 1 1 74 74 LEU H H 1 7.53 0.02 . 1 . . . . . . . . 5177 1 942 . 1 1 74 74 LEU CA C 13 55.7 0.3 . 1 . . . . . . . . 5177 1 943 . 1 1 74 74 LEU HA H 1 4.00 0.02 . 1 . . . . . . . . 5177 1 944 . 1 1 74 74 LEU CB C 13 43.2 0.3 . 1 . . . . . . . . 5177 1 945 . 1 1 74 74 LEU HB2 H 1 1.24 0.02 . 2 . . . . . . . . 5177 1 946 . 1 1 74 74 LEU HB3 H 1 1.89 0.02 . 2 . . . . . . . . 5177 1 947 . 1 1 74 74 LEU CG C 13 25.3 0.3 . 1 . . . . . . . . 5177 1 948 . 1 1 74 74 LEU HG H 1 2.12 0.02 . 1 . . . . . . . . 5177 1 949 . 1 1 74 74 LEU HD11 H 1 0.79 0.02 . 2 . . . . . . . . 5177 1 950 . 1 1 74 74 LEU HD12 H 1 0.79 0.02 . 2 . . . . . . . . 5177 1 951 . 1 1 74 74 LEU HD13 H 1 0.79 0.02 . 2 . . . . . . . . 5177 1 952 . 1 1 74 74 LEU HD21 H 1 0.75 0.02 . 2 . . . . . . . . 5177 1 953 . 1 1 74 74 LEU HD22 H 1 0.75 0.02 . 2 . . . . . . . . 5177 1 954 . 1 1 74 74 LEU HD23 H 1 0.75 0.02 . 2 . . . . . . . . 5177 1 955 . 1 1 74 74 LEU CD1 C 13 22.6 0.3 . 1 . . . . . . . . 5177 1 956 . 1 1 74 74 LEU CD2 C 13 25.3 0.3 . 1 . . . . . . . . 5177 1 957 . 1 1 74 74 LEU C C 13 177.6 0.3 . 1 . . . . . . . . 5177 1 958 . 1 1 75 75 LEU N N 15 118.5 0.2 . 1 . . . . . . . . 5177 1 959 . 1 1 75 75 LEU H H 1 6.65 0.02 . 1 . . . . . . . . 5177 1 960 . 1 1 75 75 LEU CA C 13 52.6 0.3 . 1 . . . . . . . . 5177 1 961 . 1 1 75 75 LEU HA H 1 3.64 0.02 . 1 . . . . . . . . 5177 1 962 . 1 1 75 75 LEU CB C 13 38.5 0.3 . 1 . . . . . . . . 5177 1 963 . 1 1 75 75 LEU HB2 H 1 -0.89 0.02 . 2 . . . . . . . . 5177 1 964 . 1 1 75 75 LEU HB3 H 1 0.64 0.02 . 2 . . . . . . . . 5177 1 965 . 1 1 75 75 LEU CG C 13 24.3 0.3 . 1 . . . . . . . . 5177 1 966 . 1 1 75 75 LEU HG H 1 0.75 0.02 . 1 . . . . . . . . 5177 1 967 . 1 1 75 75 LEU HD11 H 1 -0.14 0.02 . 2 . . . . . . . . 5177 1 968 . 1 1 75 75 LEU HD12 H 1 -0.14 0.02 . 2 . . . . . . . . 5177 1 969 . 1 1 75 75 LEU HD13 H 1 -0.14 0.02 . 2 . . . . . . . . 5177 1 970 . 1 1 75 75 LEU HD21 H 1 -0.59 0.02 . 2 . . . . . . . . 5177 1 971 . 1 1 75 75 LEU HD22 H 1 -0.59 0.02 . 2 . . . . . . . . 5177 1 972 . 1 1 75 75 LEU HD23 H 1 -0.59 0.02 . 2 . . . . . . . . 5177 1 973 . 1 1 75 75 LEU CD1 C 13 21.3 0.3 . 1 . . . . . . . . 5177 1 974 . 1 1 75 75 LEU CD2 C 13 24.1 0.3 . 1 . . . . . . . . 5177 1 975 . 1 1 76 76 PRO CD C 13 50.3 0.3 . 1 . . . . . . . . 5177 1 976 . 1 1 76 76 PRO CA C 13 61.9 0.3 . 1 . . . . . . . . 5177 1 977 . 1 1 76 76 PRO HA H 1 4.59 0.02 . 1 . . . . . . . . 5177 1 978 . 1 1 76 76 PRO CB C 13 31.6 0.3 . 1 . . . . . . . . 5177 1 979 . 1 1 76 76 PRO HB2 H 1 2.09 0.02 . 2 . . . . . . . . 5177 1 980 . 1 1 76 76 PRO HB3 H 1 2.27 0.02 . 2 . . . . . . . . 5177 1 981 . 1 1 76 76 PRO CG C 13 26.9 0.3 . 1 . . . . . . . . 5177 1 982 . 1 1 76 76 PRO HG2 H 1 1.92 0.02 . 2 . . . . . . . . 5177 1 983 . 1 1 76 76 PRO HG3 H 1 2.48 0.02 . 2 . . . . . . . . 5177 1 984 . 1 1 76 76 PRO HD2 H 1 3.31 0.02 . 2 . . . . . . . . 5177 1 985 . 1 1 76 76 PRO HD3 H 1 3.85 0.02 . 2 . . . . . . . . 5177 1 986 . 1 1 76 76 PRO C C 13 177.7 0.3 . 1 . . . . . . . . 5177 1 987 . 1 1 77 77 LEU N N 15 122.1 0.2 . 1 . . . . . . . . 5177 1 988 . 1 1 77 77 LEU H H 1 8.73 0.02 . 1 . . . . . . . . 5177 1 989 . 1 1 77 77 LEU CA C 13 57.1 0.3 . 1 . . . . . . . . 5177 1 990 . 1 1 77 77 LEU HA H 1 4.33 0.02 . 1 . . . . . . . . 5177 1 991 . 1 1 77 77 LEU CB C 13 41.3 0.3 . 1 . . . . . . . . 5177 1 992 . 1 1 77 77 LEU HB2 H 1 1.59 0.02 . 2 . . . . . . . . 5177 1 993 . 1 1 77 77 LEU HB3 H 1 1.72 0.02 . 2 . . . . . . . . 5177 1 994 . 1 1 77 77 LEU CG C 13 27.8 0.3 . 1 . . . . . . . . 5177 1 995 . 1 1 77 77 LEU HG H 1 1.88 0.02 . 1 . . . . . . . . 5177 1 996 . 1 1 77 77 LEU CD1 C 13 25.4 0.3 . 1 . . . . . . . . 5177 1 997 . 1 1 77 77 LEU CD2 C 13 23.2 0.3 . 1 . . . . . . . . 5177 1 998 . 1 1 77 77 LEU HD11 H 1 1.04 0.02 . 1 . . . . . . . . 5177 1 999 . 1 1 77 77 LEU HD12 H 1 1.04 0.02 . 1 . . . . . . . . 5177 1 1000 . 1 1 77 77 LEU HD13 H 1 1.04 0.02 . 1 . . . . . . . . 5177 1 1001 . 1 1 77 77 LEU HD21 H 1 1.04 0.02 . 1 . . . . . . . . 5177 1 1002 . 1 1 77 77 LEU HD22 H 1 1.04 0.02 . 1 . . . . . . . . 5177 1 1003 . 1 1 77 77 LEU HD23 H 1 1.04 0.02 . 1 . . . . . . . . 5177 1 1004 . 1 1 77 77 LEU C C 13 177.0 0.3 . 1 . . . . . . . . 5177 1 1005 . 1 1 78 78 ASN N N 15 111.4 0.2 . 1 . . . . . . . . 5177 1 1006 . 1 1 78 78 ASN H H 1 7.98 0.02 . 1 . . . . . . . . 5177 1 1007 . 1 1 78 78 ASN CA C 13 51.2 0.3 . 1 . . . . . . . . 5177 1 1008 . 1 1 78 78 ASN HA H 1 4.73 0.02 . 1 . . . . . . . . 5177 1 1009 . 1 1 78 78 ASN CB C 13 39.1 0.3 . 1 . . . . . . . . 5177 1 1010 . 1 1 78 78 ASN HB2 H 1 2.81 0.02 . 2 . . . . . . . . 5177 1 1011 . 1 1 78 78 ASN HB3 H 1 2.98 0.02 . 2 . . . . . . . . 5177 1 1012 . 1 1 78 78 ASN CG C 13 178.1 0.3 . 1 . . . . . . . . 5177 1 1013 . 1 1 78 78 ASN ND2 N 15 111.8 0.2 . 1 . . . . . . . . 5177 1 1014 . 1 1 78 78 ASN HD21 H 1 6.85 0.02 . 2 . . . . . . . . 5177 1 1015 . 1 1 78 78 ASN HD22 H 1 7.57 0.02 . 2 . . . . . . . . 5177 1 1016 . 1 1 78 78 ASN C C 13 174.1 0.3 . 1 . . . . . . . . 5177 1 1017 . 1 1 79 79 ASP N N 15 114.9 0.2 . 1 . . . . . . . . 5177 1 1018 . 1 1 79 79 ASP H H 1 7.39 0.02 . 1 . . . . . . . . 5177 1 1019 . 1 1 79 79 ASP CA C 13 52.9 0.3 . 1 . . . . . . . . 5177 1 1020 . 1 1 79 79 ASP HA H 1 5.00 0.02 . 1 . . . . . . . . 5177 1 1021 . 1 1 79 79 ASP CB C 13 43.9 0.3 . 1 . . . . . . . . 5177 1 1022 . 1 1 79 79 ASP HB2 H 1 2.70 0.02 . 2 . . . . . . . . 5177 1 1023 . 1 1 79 79 ASP HB3 H 1 2.41 0.02 . 2 . . . . . . . . 5177 1 1024 . 1 1 79 79 ASP C C 13 173.2 0.3 . 1 . . . . . . . . 5177 1 1025 . 1 1 80 80 CYS N N 15 115.4 0.2 . 1 . . . . . . . . 5177 1 1026 . 1 1 80 80 CYS H H 1 7.63 0.02 . 1 . . . . . . . . 5177 1 1027 . 1 1 80 80 CYS CA C 13 57.6 0.3 . 1 . . . . . . . . 5177 1 1028 . 1 1 80 80 CYS HA H 1 4.63 0.02 . 1 . . . . . . . . 5177 1 1029 . 1 1 80 80 CYS CB C 13 29.2 0.3 . 1 . . . . . . . . 5177 1 1030 . 1 1 80 80 CYS HB2 H 1 1.53 0.02 . 2 . . . . . . . . 5177 1 1031 . 1 1 80 80 CYS HB3 H 1 2.38 0.02 . 2 . . . . . . . . 5177 1 1032 . 1 1 80 80 CYS C C 13 174.1 0.3 . 1 . . . . . . . . 5177 1 1033 . 1 1 81 81 ARG N N 15 116.5 0.2 . 1 . . . . . . . . 5177 1 1034 . 1 1 81 81 ARG H H 1 9.06 0.02 . 1 . . . . . . . . 5177 1 1035 . 1 1 81 81 ARG CA C 13 54.2 0.3 . 1 . . . . . . . . 5177 1 1036 . 1 1 81 81 ARG HA H 1 4.74 0.02 . 1 . . . . . . . . 5177 1 1037 . 1 1 81 81 ARG CB C 13 38.4 0.3 . 1 . . . . . . . . 5177 1 1038 . 1 1 81 81 ARG HB2 H 1 1.78 0.02 . 2 . . . . . . . . 5177 1 1039 . 1 1 81 81 ARG HB3 H 1 2.33 0.02 . 2 . . . . . . . . 5177 1 1040 . 1 1 81 81 ARG CG C 13 29.5 0.3 . 1 . . . . . . . . 5177 1 1041 . 1 1 81 81 ARG HG2 H 1 1.48 0.02 . 1 . . . . . . . . 5177 1 1042 . 1 1 81 81 ARG HG3 H 1 1.48 0.02 . 1 . . . . . . . . 5177 1 1043 . 1 1 81 81 ARG CD C 13 43.5 0.3 . 1 . . . . . . . . 5177 1 1044 . 1 1 81 81 ARG HD2 H 1 3.16 0.02 . 1 . . . . . . . . 5177 1 1045 . 1 1 81 81 ARG HD3 H 1 3.16 0.02 . 1 . . . . . . . . 5177 1 1046 . 1 1 81 81 ARG NE N 15 84.1 0.2 . 1 . . . . . . . . 5177 1 1047 . 1 1 81 81 ARG HE H 1 9.93 0.02 . 1 . . . . . . . . 5177 1 1048 . 1 1 81 81 ARG C C 13 175.9 0.3 . 1 . . . . . . . . 5177 1 1049 . 1 1 82 82 TYR N N 15 116.4 0.2 . 1 . . . . . . . . 5177 1 1050 . 1 1 82 82 TYR H H 1 8.23 0.02 . 1 . . . . . . . . 5177 1 1051 . 1 1 82 82 TYR CA C 13 55.4 0.3 . 1 . . . . . . . . 5177 1 1052 . 1 1 82 82 TYR HA H 1 6.16 0.02 . 1 . . . . . . . . 5177 1 1053 . 1 1 82 82 TYR CB C 13 41.6 0.3 . 1 . . . . . . . . 5177 1 1054 . 1 1 82 82 TYR HB2 H 1 3.26 0.02 . 2 . . . . . . . . 5177 1 1055 . 1 1 82 82 TYR HB3 H 1 3.70 0.02 . 2 . . . . . . . . 5177 1 1056 . 1 1 82 82 TYR HD1 H 1 7.09 0.02 . 1 . . . . . . . . 5177 1 1057 . 1 1 82 82 TYR HD2 H 1 7.09 0.02 . 1 . . . . . . . . 5177 1 1058 . 1 1 82 82 TYR HE1 H 1 6.20 0.02 . 1 . . . . . . . . 5177 1 1059 . 1 1 82 82 TYR HE2 H 1 6.20 0.02 . 1 . . . . . . . . 5177 1 1060 . 1 1 82 82 TYR C C 13 175.0 0.3 . 1 . . . . . . . . 5177 1 1061 . 1 1 83 83 ALA N N 15 122.1 0.2 . 1 . . . . . . . . 5177 1 1062 . 1 1 83 83 ALA H H 1 9.57 0.02 . 1 . . . . . . . . 5177 1 1063 . 1 1 83 83 ALA CA C 13 51.7 0.3 . 1 . . . . . . . . 5177 1 1064 . 1 1 83 83 ALA HA H 1 5.69 0.02 . 1 . . . . . . . . 5177 1 1065 . 1 1 83 83 ALA HB1 H 1 1.65 0.02 . 1 . . . . . . . . 5177 1 1066 . 1 1 83 83 ALA HB2 H 1 1.65 0.02 . 1 . . . . . . . . 5177 1 1067 . 1 1 83 83 ALA HB3 H 1 1.65 0.02 . 1 . . . . . . . . 5177 1 1068 . 1 1 83 83 ALA CB C 13 23.9 0.3 . 1 . . . . . . . . 5177 1 1069 . 1 1 83 83 ALA C C 13 176.3 0.3 . 1 . . . . . . . . 5177 1 1070 . 1 1 84 84 LEU N N 15 118.6 0.2 . 1 . . . . . . . . 5177 1 1071 . 1 1 84 84 LEU H H 1 8.51 0.02 . 1 . . . . . . . . 5177 1 1072 . 1 1 84 84 LEU CA C 13 53.9 0.3 . 1 . . . . . . . . 5177 1 1073 . 1 1 84 84 LEU HA H 1 5.63 0.02 . 1 . . . . . . . . 5177 1 1074 . 1 1 84 84 LEU CB C 13 46.6 0.3 . 1 . . . . . . . . 5177 1 1075 . 1 1 84 84 LEU HB2 H 1 1.43 0.02 . 2 . . . . . . . . 5177 1 1076 . 1 1 84 84 LEU HB3 H 1 1.84 0.02 . 2 . . . . . . . . 5177 1 1077 . 1 1 84 84 LEU CG C 13 27.8 0.3 . 1 . . . . . . . . 5177 1 1078 . 1 1 84 84 LEU HG H 1 1.96 0.02 . 1 . . . . . . . . 5177 1 1079 . 1 1 84 84 LEU HD11 H 1 1.15 0.02 . 2 . . . . . . . . 5177 1 1080 . 1 1 84 84 LEU HD12 H 1 1.15 0.02 . 2 . . . . . . . . 5177 1 1081 . 1 1 84 84 LEU HD13 H 1 1.15 0.02 . 2 . . . . . . . . 5177 1 1082 . 1 1 84 84 LEU HD21 H 1 1.02 0.02 . 2 . . . . . . . . 5177 1 1083 . 1 1 84 84 LEU HD22 H 1 1.02 0.02 . 2 . . . . . . . . 5177 1 1084 . 1 1 84 84 LEU HD23 H 1 1.02 0.02 . 2 . . . . . . . . 5177 1 1085 . 1 1 84 84 LEU CD1 C 13 24.5 0.3 . 1 . . . . . . . . 5177 1 1086 . 1 1 84 84 LEU CD2 C 13 27.2 0.3 . 1 . . . . . . . . 5177 1 1087 . 1 1 84 84 LEU C C 13 174.6 0.3 . 1 . . . . . . . . 5177 1 1088 . 1 1 85 85 TYR N N 15 123.2 0.2 . 1 . . . . . . . . 5177 1 1089 . 1 1 85 85 TYR H H 1 8.78 0.02 . 1 . . . . . . . . 5177 1 1090 . 1 1 85 85 TYR CA C 13 57.1 0.3 . 1 . . . . . . . . 5177 1 1091 . 1 1 85 85 TYR HA H 1 4.59 0.02 . 1 . . . . . . . . 5177 1 1092 . 1 1 85 85 TYR CB C 13 42.8 0.3 . 1 . . . . . . . . 5177 1 1093 . 1 1 85 85 TYR HB2 H 1 1.96 0.02 . 2 . . . . . . . . 5177 1 1094 . 1 1 85 85 TYR HB3 H 1 2.68 0.02 . 2 . . . . . . . . 5177 1 1095 . 1 1 85 85 TYR HD1 H 1 6.32 0.02 . 1 . . . . . . . . 5177 1 1096 . 1 1 85 85 TYR HD2 H 1 6.32 0.02 . 1 . . . . . . . . 5177 1 1097 . 1 1 85 85 TYR HE1 H 1 6.58 0.02 . 1 . . . . . . . . 5177 1 1098 . 1 1 85 85 TYR HE2 H 1 6.58 0.02 . 1 . . . . . . . . 5177 1 1099 . 1 1 85 85 TYR C C 13 173.2 0.3 . 1 . . . . . . . . 5177 1 1100 . 1 1 86 86 ASP N N 15 128.9 0.2 . 1 . . . . . . . . 5177 1 1101 . 1 1 86 86 ASP H H 1 8.02 0.02 . 1 . . . . . . . . 5177 1 1102 . 1 1 86 86 ASP CA C 13 52.6 0.3 . 1 . . . . . . . . 5177 1 1103 . 1 1 86 86 ASP HA H 1 4.93 0.02 . 1 . . . . . . . . 5177 1 1104 . 1 1 86 86 ASP CB C 13 40.4 0.3 . 1 . . . . . . . . 5177 1 1105 . 1 1 86 86 ASP HB2 H 1 2.97 0.02 . 2 . . . . . . . . 5177 1 1106 . 1 1 86 86 ASP HB3 H 1 2.02 0.02 . 2 . . . . . . . . 5177 1 1107 . 1 1 86 86 ASP C C 13 173.5 0.3 . 1 . . . . . . . . 5177 1 1108 . 1 1 87 87 ALA N N 15 128.3 0.2 . 1 . . . . . . . . 5177 1 1109 . 1 1 87 87 ALA H H 1 8.83 0.02 . 1 . . . . . . . . 5177 1 1110 . 1 1 87 87 ALA CA C 13 51.8 0.3 . 1 . . . . . . . . 5177 1 1111 . 1 1 87 87 ALA HA H 1 4.76 0.02 . 1 . . . . . . . . 5177 1 1112 . 1 1 87 87 ALA HB1 H 1 1.51 0.02 . 1 . . . . . . . . 5177 1 1113 . 1 1 87 87 ALA HB2 H 1 1.51 0.02 . 1 . . . . . . . . 5177 1 1114 . 1 1 87 87 ALA HB3 H 1 1.51 0.02 . 1 . . . . . . . . 5177 1 1115 . 1 1 87 87 ALA CB C 13 20.6 0.3 . 1 . . . . . . . . 5177 1 1116 . 1 1 87 87 ALA C C 13 177.3 0.3 . 1 . . . . . . . . 5177 1 1117 . 1 1 88 88 THR N N 15 120.1 0.2 . 1 . . . . . . . . 5177 1 1118 . 1 1 88 88 THR H H 1 8.40 0.02 . 1 . . . . . . . . 5177 1 1119 . 1 1 88 88 THR CA C 13 62.3 0.3 . 1 . . . . . . . . 5177 1 1120 . 1 1 88 88 THR HA H 1 5.09 0.02 . 1 . . . . . . . . 5177 1 1121 . 1 1 88 88 THR CB C 13 69.8 0.3 . 1 . . . . . . . . 5177 1 1122 . 1 1 88 88 THR HB H 1 4.24 0.02 . 1 . . . . . . . . 5177 1 1123 . 1 1 88 88 THR HG21 H 1 1.25 0.02 . 1 . . . . . . . . 5177 1 1124 . 1 1 88 88 THR HG22 H 1 1.25 0.02 . 1 . . . . . . . . 5177 1 1125 . 1 1 88 88 THR HG23 H 1 1.25 0.02 . 1 . . . . . . . . 5177 1 1126 . 1 1 88 88 THR CG2 C 13 22.6 0.3 . 1 . . . . . . . . 5177 1 1127 . 1 1 88 88 THR C C 13 173.4 0.3 . 1 . . . . . . . . 5177 1 1128 . 1 1 89 89 TYR N N 15 124.7 0.2 . 1 . . . . . . . . 5177 1 1129 . 1 1 89 89 TYR H H 1 9.08 0.02 . 1 . . . . . . . . 5177 1 1130 . 1 1 89 89 TYR CA C 13 55.9 0.3 . 1 . . . . . . . . 5177 1 1131 . 1 1 89 89 TYR HA H 1 5.52 0.02 . 1 . . . . . . . . 5177 1 1132 . 1 1 89 89 TYR CB C 13 39.4 0.3 . 1 . . . . . . . . 5177 1 1133 . 1 1 89 89 TYR HB2 H 1 3.08 0.02 . 2 . . . . . . . . 5177 1 1134 . 1 1 89 89 TYR HB3 H 1 3.41 0.02 . 2 . . . . . . . . 5177 1 1135 . 1 1 89 89 TYR HD1 H 1 6.76 0.02 . 1 . . . . . . . . 5177 1 1136 . 1 1 89 89 TYR HD2 H 1 6.76 0.02 . 1 . . . . . . . . 5177 1 1137 . 1 1 89 89 TYR HE1 H 1 6.54 0.02 . 1 . . . . . . . . 5177 1 1138 . 1 1 89 89 TYR HE2 H 1 6.54 0.02 . 1 . . . . . . . . 5177 1 1139 . 1 1 89 89 TYR C C 13 172.5 0.3 . 1 . . . . . . . . 5177 1 1140 . 1 1 90 90 GLU N N 15 117.5 0.2 . 1 . . . . . . . . 5177 1 1141 . 1 1 90 90 GLU H H 1 8.24 0.02 . 1 . . . . . . . . 5177 1 1142 . 1 1 90 90 GLU CA C 13 55.1 0.3 . 1 . . . . . . . . 5177 1 1143 . 1 1 90 90 GLU HA H 1 5.18 0.02 . 1 . . . . . . . . 5177 1 1144 . 1 1 90 90 GLU CB C 13 33.5 0.3 . 1 . . . . . . . . 5177 1 1145 . 1 1 90 90 GLU HB2 H 1 1.90 0.02 . 2 . . . . . . . . 5177 1 1146 . 1 1 90 90 GLU HB3 H 1 2.16 0.02 . 2 . . . . . . . . 5177 1 1147 . 1 1 90 90 GLU CG C 13 36.6 0.3 . 1 . . . . . . . . 5177 1 1148 . 1 1 90 90 GLU HG2 H 1 2.19 0.02 . 1 . . . . . . . . 5177 1 1149 . 1 1 90 90 GLU HG3 H 1 2.19 0.02 . 1 . . . . . . . . 5177 1 1150 . 1 1 90 90 GLU C C 13 176.9 0.3 . 1 . . . . . . . . 5177 1 1151 . 1 1 91 91 THR N N 15 114.4 0.2 . 1 . . . . . . . . 5177 1 1152 . 1 1 91 91 THR H H 1 8.76 0.02 . 1 . . . . . . . . 5177 1 1153 . 1 1 91 91 THR CA C 13 59.5 0.3 . 1 . . . . . . . . 5177 1 1154 . 1 1 91 91 THR HA H 1 5.44 0.02 . 1 . . . . . . . . 5177 1 1155 . 1 1 91 91 THR CB C 13 71.6 0.3 . 1 . . . . . . . . 5177 1 1156 . 1 1 91 91 THR HB H 1 4.79 0.02 . 1 . . . . . . . . 5177 1 1157 . 1 1 91 91 THR HG21 H 1 1.35 0.02 . 1 . . . . . . . . 5177 1 1158 . 1 1 91 91 THR HG22 H 1 1.35 0.02 . 1 . . . . . . . . 5177 1 1159 . 1 1 91 91 THR HG23 H 1 1.35 0.02 . 1 . . . . . . . . 5177 1 1160 . 1 1 91 91 THR CG2 C 13 22.1 0.3 . 1 . . . . . . . . 5177 1 1161 . 1 1 91 91 THR C C 13 174.8 0.3 . 1 . . . . . . . . 5177 1 1162 . 1 1 92 92 LYS N N 15 118.0 0.2 . 1 . . . . . . . . 5177 1 1163 . 1 1 92 92 LYS H H 1 8.82 0.02 . 1 . . . . . . . . 5177 1 1164 . 1 1 92 92 LYS CA C 13 59.3 0.3 . 1 . . . . . . . . 5177 1 1165 . 1 1 92 92 LYS HA H 1 4.12 0.02 . 1 . . . . . . . . 5177 1 1166 . 1 1 92 92 LYS CB C 13 32.7 0.3 . 1 . . . . . . . . 5177 1 1167 . 1 1 92 92 LYS HB2 H 1 1.95 0.02 . 1 . . . . . . . . 5177 1 1168 . 1 1 92 92 LYS HB3 H 1 1.95 0.02 . 1 . . . . . . . . 5177 1 1169 . 1 1 92 92 LYS CG C 13 25.6 0.3 . 1 . . . . . . . . 5177 1 1170 . 1 1 92 92 LYS HG2 H 1 1.56 0.02 . 1 . . . . . . . . 5177 1 1171 . 1 1 92 92 LYS HG3 H 1 1.56 0.02 . 1 . . . . . . . . 5177 1 1172 . 1 1 92 92 LYS CD C 13 29.5 0.3 . 1 . . . . . . . . 5177 1 1173 . 1 1 92 92 LYS HD2 H 1 1.78 0.02 . 1 . . . . . . . . 5177 1 1174 . 1 1 92 92 LYS HD3 H 1 1.78 0.02 . 1 . . . . . . . . 5177 1 1175 . 1 1 92 92 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 1176 . 1 1 92 92 LYS HE2 H 1 3.11 0.02 . 1 . . . . . . . . 5177 1 1177 . 1 1 92 92 LYS HE3 H 1 3.11 0.02 . 1 . . . . . . . . 5177 1 1178 . 1 1 92 92 LYS C C 13 177.0 0.3 . 1 . . . . . . . . 5177 1 1179 . 1 1 93 93 GLU N N 15 114.4 0.2 . 1 . . . . . . . . 5177 1 1180 . 1 1 93 93 GLU H H 1 8.03 0.02 . 1 . . . . . . . . 5177 1 1181 . 1 1 93 93 GLU CA C 13 57.4 0.3 . 1 . . . . . . . . 5177 1 1182 . 1 1 93 93 GLU HA H 1 4.45 0.02 . 1 . . . . . . . . 5177 1 1183 . 1 1 93 93 GLU CB C 13 32.0 0.3 . 1 . . . . . . . . 5177 1 1184 . 1 1 93 93 GLU HB2 H 1 1.98 0.02 . 2 . . . . . . . . 5177 1 1185 . 1 1 93 93 GLU HB3 H 1 2.07 0.02 . 2 . . . . . . . . 5177 1 1186 . 1 1 93 93 GLU CG C 13 36.6 0.3 . 1 . . . . . . . . 5177 1 1187 . 1 1 93 93 GLU HG2 H 1 2.28 0.02 . 1 . . . . . . . . 5177 1 1188 . 1 1 93 93 GLU HG3 H 1 2.28 0.02 . 1 . . . . . . . . 5177 1 1189 . 1 1 93 93 GLU C C 13 176.6 0.3 . 1 . . . . . . . . 5177 1 1190 . 1 1 94 94 SER N N 15 112.4 0.2 . 1 . . . . . . . . 5177 1 1191 . 1 1 94 94 SER H H 1 7.55 0.02 . 1 . . . . . . . . 5177 1 1192 . 1 1 94 94 SER CA C 13 58.3 0.3 . 1 . . . . . . . . 5177 1 1193 . 1 1 94 94 SER HA H 1 4.72 0.02 . 1 . . . . . . . . 5177 1 1194 . 1 1 94 94 SER CB C 13 66.1 0.3 . 1 . . . . . . . . 5177 1 1195 . 1 1 94 94 SER HB2 H 1 3.76 0.02 . 1 . . . . . . . . 5177 1 1196 . 1 1 94 94 SER HB3 H 1 3.76 0.02 . 1 . . . . . . . . 5177 1 1197 . 1 1 94 94 SER C C 13 172.5 0.3 . 1 . . . . . . . . 5177 1 1198 . 1 1 95 95 LYS N N 15 123.2 0.2 . 1 . . . . . . . . 5177 1 1199 . 1 1 95 95 LYS H H 1 8.36 0.02 . 1 . . . . . . . . 5177 1 1200 . 1 1 95 95 LYS CA C 13 57.0 0.3 . 1 . . . . . . . . 5177 1 1201 . 1 1 95 95 LYS HA H 1 4.63 0.02 . 1 . . . . . . . . 5177 1 1202 . 1 1 95 95 LYS CB C 13 33.3 0.3 . 1 . . . . . . . . 5177 1 1203 . 1 1 95 95 LYS HB2 H 1 1.74 0.02 . 2 . . . . . . . . 5177 1 1204 . 1 1 95 95 LYS HB3 H 1 1.88 0.02 . 2 . . . . . . . . 5177 1 1205 . 1 1 95 95 LYS CG C 13 25.3 0.3 . 1 . . . . . . . . 5177 1 1206 . 1 1 95 95 LYS HG2 H 1 1.30 0.02 . 2 . . . . . . . . 5177 1 1207 . 1 1 95 95 LYS HG3 H 1 1.47 0.02 . 2 . . . . . . . . 5177 1 1208 . 1 1 95 95 LYS CD C 13 29.5 0.3 . 1 . . . . . . . . 5177 1 1209 . 1 1 95 95 LYS HD2 H 1 1.65 0.02 . 1 . . . . . . . . 5177 1 1210 . 1 1 95 95 LYS HD3 H 1 1.65 0.02 . 1 . . . . . . . . 5177 1 1211 . 1 1 95 95 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 1212 . 1 1 95 95 LYS HE2 H 1 3.01 0.02 . 1 . . . . . . . . 5177 1 1213 . 1 1 95 95 LYS HE3 H 1 3.01 0.02 . 1 . . . . . . . . 5177 1 1214 . 1 1 95 95 LYS C C 13 176.0 0.3 . 1 . . . . . . . . 5177 1 1215 . 1 1 96 96 LYS N N 15 126.8 0.2 . 1 . . . . . . . . 5177 1 1216 . 1 1 96 96 LYS H H 1 8.91 0.02 . 1 . . . . . . . . 5177 1 1217 . 1 1 96 96 LYS CA C 13 54.8 0.3 . 1 . . . . . . . . 5177 1 1218 . 1 1 96 96 LYS HA H 1 4.55 0.02 . 1 . . . . . . . . 5177 1 1219 . 1 1 96 96 LYS CB C 13 36.3 0.3 . 1 . . . . . . . . 5177 1 1220 . 1 1 96 96 LYS HB2 H 1 0.16 0.02 . 2 . . . . . . . . 5177 1 1221 . 1 1 96 96 LYS HB3 H 1 1.36 0.02 . 2 . . . . . . . . 5177 1 1222 . 1 1 96 96 LYS CG C 13 25.0 0.3 . 1 . . . . . . . . 5177 1 1223 . 1 1 96 96 LYS HG2 H 1 1.13 0.02 . 1 . . . . . . . . 5177 1 1224 . 1 1 96 96 LYS HG3 H 1 1.13 0.02 . 1 . . . . . . . . 5177 1 1225 . 1 1 96 96 LYS CD C 13 29.0 0.3 . 1 . . . . . . . . 5177 1 1226 . 1 1 96 96 LYS HD2 H 1 1.65 0.02 . 1 . . . . . . . . 5177 1 1227 . 1 1 96 96 LYS HD3 H 1 1.65 0.02 . 1 . . . . . . . . 5177 1 1228 . 1 1 96 96 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 1229 . 1 1 96 96 LYS HE2 H 1 2.97 0.02 . 2 . . . . . . . . 5177 1 1230 . 1 1 96 96 LYS HE3 H 1 3.05 0.02 . 2 . . . . . . . . 5177 1 1231 . 1 1 96 96 LYS C C 13 177.3 0.3 . 1 . . . . . . . . 5177 1 1232 . 1 1 97 97 GLU N N 15 117.5 0.2 . 1 . . . . . . . . 5177 1 1233 . 1 1 97 97 GLU H H 1 7.62 0.02 . 1 . . . . . . . . 5177 1 1234 . 1 1 97 97 GLU CA C 13 54.8 0.3 . 1 . . . . . . . . 5177 1 1235 . 1 1 97 97 GLU HA H 1 5.69 0.02 . 1 . . . . . . . . 5177 1 1236 . 1 1 97 97 GLU CB C 13 33.3 0.3 . 1 . . . . . . . . 5177 1 1237 . 1 1 97 97 GLU HB2 H 1 1.78 0.02 . 2 . . . . . . . . 5177 1 1238 . 1 1 97 97 GLU HB3 H 1 2.02 0.02 . 2 . . . . . . . . 5177 1 1239 . 1 1 97 97 GLU CG C 13 36.8 0.3 . 1 . . . . . . . . 5177 1 1240 . 1 1 97 97 GLU HG2 H 1 2.12 0.02 . 2 . . . . . . . . 5177 1 1241 . 1 1 97 97 GLU HG3 H 1 2.30 0.02 . 2 . . . . . . . . 5177 1 1242 . 1 1 97 97 GLU C C 13 176.2 0.3 . 1 . . . . . . . . 5177 1 1243 . 1 1 98 98 ASP N N 15 121.2 0.2 . 1 . . . . . . . . 5177 1 1244 . 1 1 98 98 ASP H H 1 9.09 0.02 . 1 . . . . . . . . 5177 1 1245 . 1 1 98 98 ASP CA C 13 54.5 0.3 . 1 . . . . . . . . 5177 1 1246 . 1 1 98 98 ASP HA H 1 5.21 0.02 . 1 . . . . . . . . 5177 1 1247 . 1 1 98 98 ASP CB C 13 47.9 0.3 . 1 . . . . . . . . 5177 1 1248 . 1 1 98 98 ASP HB2 H 1 2.60 0.02 . 2 . . . . . . . . 5177 1 1249 . 1 1 98 98 ASP HB3 H 1 2.75 0.02 . 2 . . . . . . . . 5177 1 1250 . 1 1 98 98 ASP C C 13 173.8 0.3 . 1 . . . . . . . . 5177 1 1251 . 1 1 99 99 LEU N N 15 120.1 0.2 . 1 . . . . . . . . 5177 1 1252 . 1 1 99 99 LEU H H 1 8.33 0.02 . 1 . . . . . . . . 5177 1 1253 . 1 1 99 99 LEU CA C 13 54.9 0.3 . 1 . . . . . . . . 5177 1 1254 . 1 1 99 99 LEU HA H 1 4.95 0.02 . 1 . . . . . . . . 5177 1 1255 . 1 1 99 99 LEU CB C 13 44.2 0.3 . 1 . . . . . . . . 5177 1 1256 . 1 1 99 99 LEU HB2 H 1 1.56 0.02 . 2 . . . . . . . . 5177 1 1257 . 1 1 99 99 LEU HB3 H 1 1.90 0.02 . 2 . . . . . . . . 5177 1 1258 . 1 1 99 99 LEU CG C 13 27.3 0.3 . 1 . . . . . . . . 5177 1 1259 . 1 1 99 99 LEU HG H 1 1.77 0.02 . 1 . . . . . . . . 5177 1 1260 . 1 1 99 99 LEU HD11 H 1 0.84 0.02 . 1 . . . . . . . . 5177 1 1261 . 1 1 99 99 LEU HD12 H 1 0.84 0.02 . 1 . . . . . . . . 5177 1 1262 . 1 1 99 99 LEU HD13 H 1 0.84 0.02 . 1 . . . . . . . . 5177 1 1263 . 1 1 99 99 LEU HD21 H 1 0.84 0.02 . 1 . . . . . . . . 5177 1 1264 . 1 1 99 99 LEU HD22 H 1 0.84 0.02 . 1 . . . . . . . . 5177 1 1265 . 1 1 99 99 LEU HD23 H 1 0.84 0.02 . 1 . . . . . . . . 5177 1 1266 . 1 1 99 99 LEU CD1 C 13 25.3 0.3 . 1 . . . . . . . . 5177 1 1267 . 1 1 99 99 LEU CD2 C 13 24.4 0.3 . 1 . . . . . . . . 5177 1 1268 . 1 1 99 99 LEU C C 13 176.6 0.3 . 1 . . . . . . . . 5177 1 1269 . 1 1 100 100 VAL N N 15 123.2 0.2 . 1 . . . . . . . . 5177 1 1270 . 1 1 100 100 VAL H H 1 9.35 0.02 . 1 . . . . . . . . 5177 1 1271 . 1 1 100 100 VAL CA C 13 61.4 0.3 . 1 . . . . . . . . 5177 1 1272 . 1 1 100 100 VAL HA H 1 4.72 0.02 . 1 . . . . . . . . 5177 1 1273 . 1 1 100 100 VAL CB C 13 35.1 0.3 . 1 . . . . . . . . 5177 1 1274 . 1 1 100 100 VAL HB H 1 2.43 0.02 . 1 . . . . . . . . 5177 1 1275 . 1 1 100 100 VAL CG1 C 13 21.3 0.3 . 1 . . . . . . . . 5177 1 1276 . 1 1 100 100 VAL CG2 C 13 21.3 0.3 . 1 . . . . . . . . 5177 1 1277 . 1 1 100 100 VAL HG11 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1278 . 1 1 100 100 VAL HG12 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1279 . 1 1 100 100 VAL HG13 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1280 . 1 1 100 100 VAL HG21 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1281 . 1 1 100 100 VAL HG22 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1282 . 1 1 100 100 VAL HG23 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1283 . 1 1 100 100 VAL C C 13 174.9 0.3 . 1 . . . . . . . . 5177 1 1284 . 1 1 101 101 PHE N N 15 127.4 0.2 . 1 . . . . . . . . 5177 1 1285 . 1 1 101 101 PHE H H 1 8.73 0.02 . 1 . . . . . . . . 5177 1 1286 . 1 1 101 101 PHE CA C 13 56.5 0.3 . 1 . . . . . . . . 5177 1 1287 . 1 1 101 101 PHE HA H 1 5.76 0.02 . 1 . . . . . . . . 5177 1 1288 . 1 1 101 101 PHE CB C 13 41.1 0.3 . 1 . . . . . . . . 5177 1 1289 . 1 1 101 101 PHE HB2 H 1 3.30 0.02 . 2 . . . . . . . . 5177 1 1290 . 1 1 101 101 PHE HB3 H 1 3.46 0.02 . 2 . . . . . . . . 5177 1 1291 . 1 1 101 101 PHE HD1 H 1 7.47 0.02 . 1 . . . . . . . . 5177 1 1292 . 1 1 101 101 PHE HD2 H 1 7.47 0.02 . 1 . . . . . . . . 5177 1 1293 . 1 1 101 101 PHE HE1 H 1 7.13 0.02 . 1 . . . . . . . . 5177 1 1294 . 1 1 101 101 PHE HE2 H 1 7.13 0.02 . 1 . . . . . . . . 5177 1 1295 . 1 1 101 101 PHE HZ H 1 6.74 0.02 . 1 . . . . . . . . 5177 1 1296 . 1 1 101 101 PHE C C 13 173.5 0.3 . 1 . . . . . . . . 5177 1 1297 . 1 1 102 102 ILE N N 15 130.0 0.2 . 1 . . . . . . . . 5177 1 1298 . 1 1 102 102 ILE H H 1 9.17 0.02 . 1 . . . . . . . . 5177 1 1299 . 1 1 102 102 ILE CA C 13 59.5 0.3 . 1 . . . . . . . . 5177 1 1300 . 1 1 102 102 ILE HA H 1 5.25 0.02 . 1 . . . . . . . . 5177 1 1301 . 1 1 102 102 ILE CB C 13 42.5 0.3 . 1 . . . . . . . . 5177 1 1302 . 1 1 102 102 ILE HB H 1 1.78 0.02 . 1 . . . . . . . . 5177 1 1303 . 1 1 102 102 ILE HG21 H 1 0.85 0.02 . 1 . . . . . . . . 5177 1 1304 . 1 1 102 102 ILE HG22 H 1 0.85 0.02 . 1 . . . . . . . . 5177 1 1305 . 1 1 102 102 ILE HG23 H 1 0.85 0.02 . 1 . . . . . . . . 5177 1 1306 . 1 1 102 102 ILE CG2 C 13 16.1 0.3 . 1 . . . . . . . . 5177 1 1307 . 1 1 102 102 ILE CG1 C 13 29.7 0.3 . 1 . . . . . . . . 5177 1 1308 . 1 1 102 102 ILE HG12 H 1 1.46 0.02 . 2 . . . . . . . . 5177 1 1309 . 1 1 102 102 ILE HG13 H 1 1.91 0.02 . 2 . . . . . . . . 5177 1 1310 . 1 1 102 102 ILE HD11 H 1 1.05 0.02 . 1 . . . . . . . . 5177 1 1311 . 1 1 102 102 ILE HD12 H 1 1.05 0.02 . 1 . . . . . . . . 5177 1 1312 . 1 1 102 102 ILE HD13 H 1 1.05 0.02 . 1 . . . . . . . . 5177 1 1313 . 1 1 102 102 ILE CD1 C 13 14.6 0.3 . 1 . . . . . . . . 5177 1 1314 . 1 1 102 102 ILE C C 13 174.2 0.3 . 1 . . . . . . . . 5177 1 1315 . 1 1 103 103 PHE N N 15 126.3 0.2 . 1 . . . . . . . . 5177 1 1316 . 1 1 103 103 PHE H H 1 8.83 0.02 . 1 . . . . . . . . 5177 1 1317 . 1 1 103 103 PHE CA C 13 53.6 0.3 . 1 . . . . . . . . 5177 1 1318 . 1 1 103 103 PHE HA H 1 5.65 0.02 . 1 . . . . . . . . 5177 1 1319 . 1 1 103 103 PHE CB C 13 39.5 0.3 . 1 . . . . . . . . 5177 1 1320 . 1 1 103 103 PHE HB2 H 1 3.18 0.02 . 1 . . . . . . . . 5177 1 1321 . 1 1 103 103 PHE HB3 H 1 3.18 0.02 . 1 . . . . . . . . 5177 1 1322 . 1 1 103 103 PHE HD1 H 1 7.36 0.02 . 1 . . . . . . . . 5177 1 1323 . 1 1 103 103 PHE HD2 H 1 7.36 0.02 . 1 . . . . . . . . 5177 1 1324 . 1 1 103 103 PHE HE1 H 1 7.13 0.02 . 1 . . . . . . . . 5177 1 1325 . 1 1 103 103 PHE HE2 H 1 7.13 0.02 . 1 . . . . . . . . 5177 1 1326 . 1 1 103 103 PHE HZ H 1 6.91 0.02 . 1 . . . . . . . . 5177 1 1327 . 1 1 103 103 PHE C C 13 172.7 0.3 . 1 . . . . . . . . 5177 1 1328 . 1 1 104 104 TRP N N 15 131.4 0.2 . 1 . . . . . . . . 5177 1 1329 . 1 1 104 104 TRP H H 1 8.91 0.02 . 1 . . . . . . . . 5177 1 1330 . 1 1 104 104 TRP CA C 13 55.4 0.3 . 1 . . . . . . . . 5177 1 1331 . 1 1 104 104 TRP HA H 1 4.76 0.02 . 1 . . . . . . . . 5177 1 1332 . 1 1 104 104 TRP CB C 13 31.0 0.3 . 1 . . . . . . . . 5177 1 1333 . 1 1 104 104 TRP HB2 H 1 2.65 0.02 . 2 . . . . . . . . 5177 1 1334 . 1 1 104 104 TRP HB3 H 1 3.07 0.02 . 2 . . . . . . . . 5177 1 1335 . 1 1 104 104 TRP NE1 N 15 133.7 0.2 . 1 . . . . . . . . 5177 1 1336 . 1 1 104 104 TRP HD1 H 1 6.92 0.02 . 1 . . . . . . . . 5177 1 1337 . 1 1 104 104 TRP HE3 H 1 6.94 0.02 . 1 . . . . . . . . 5177 1 1338 . 1 1 104 104 TRP HE1 H 1 11.07 0.02 . 1 . . . . . . . . 5177 1 1339 . 1 1 104 104 TRP HZ3 H 1 6.43 0.02 . 1 . . . . . . . . 5177 1 1340 . 1 1 104 104 TRP HZ2 H 1 7.13 0.02 . 1 . . . . . . . . 5177 1 1341 . 1 1 104 104 TRP HH2 H 1 6.66 0.02 . 1 . . . . . . . . 5177 1 1342 . 1 1 104 104 TRP C C 13 171.9 0.3 . 1 . . . . . . . . 5177 1 1343 . 1 1 105 105 ALA N N 15 129.4 0.2 . 1 . . . . . . . . 5177 1 1344 . 1 1 105 105 ALA H H 1 7.63 0.02 . 1 . . . . . . . . 5177 1 1345 . 1 1 105 105 ALA CA C 13 48.6 0.3 . 1 . . . . . . . . 5177 1 1346 . 1 1 105 105 ALA HA H 1 4.55 0.02 . 1 . . . . . . . . 5177 1 1347 . 1 1 105 105 ALA HB1 H 1 0.26 0.02 . 1 . . . . . . . . 5177 1 1348 . 1 1 105 105 ALA HB2 H 1 0.26 0.02 . 1 . . . . . . . . 5177 1 1349 . 1 1 105 105 ALA HB3 H 1 0.26 0.02 . 1 . . . . . . . . 5177 1 1350 . 1 1 105 105 ALA CB C 13 18.3 0.3 . 1 . . . . . . . . 5177 1 1351 . 1 1 106 106 PRO CD C 13 48.5 0.3 . 1 . . . . . . . . 5177 1 1352 . 1 1 106 106 PRO CA C 13 62.0 0.3 . 1 . . . . . . . . 5177 1 1353 . 1 1 106 106 PRO HA H 1 3.58 0.02 . 1 . . . . . . . . 5177 1 1354 . 1 1 106 106 PRO CB C 13 31.6 0.3 . 1 . . . . . . . . 5177 1 1355 . 1 1 106 106 PRO HB2 H 1 0.93 0.02 . 2 . . . . . . . . 5177 1 1356 . 1 1 106 106 PRO HB3 H 1 1.75 0.02 . 2 . . . . . . . . 5177 1 1357 . 1 1 106 106 PRO CG C 13 27.5 0.3 . 1 . . . . . . . . 5177 1 1358 . 1 1 106 106 PRO HG2 H 1 1.27 0.02 . 2 . . . . . . . . 5177 1 1359 . 1 1 106 106 PRO HG3 H 1 1.54 0.02 . 2 . . . . . . . . 5177 1 1360 . 1 1 106 106 PRO HD2 H 1 0.84 0.02 . 2 . . . . . . . . 5177 1 1361 . 1 1 106 106 PRO HD3 H 1 2.71 0.02 . 2 . . . . . . . . 5177 1 1362 . 1 1 106 106 PRO C C 13 178.0 0.3 . 1 . . . . . . . . 5177 1 1363 . 1 1 107 107 GLU N N 15 120.7 0.2 . 1 . . . . . . . . 5177 1 1364 . 1 1 107 107 GLU H H 1 7.90 0.02 . 1 . . . . . . . . 5177 1 1365 . 1 1 107 107 GLU CA C 13 58.9 0.3 . 1 . . . . . . . . 5177 1 1366 . 1 1 107 107 GLU HA H 1 3.86 0.02 . 1 . . . . . . . . 5177 1 1367 . 1 1 107 107 GLU CB C 13 29.8 0.3 . 1 . . . . . . . . 5177 1 1368 . 1 1 107 107 GLU HB2 H 1 2.07 0.02 . 1 . . . . . . . . 5177 1 1369 . 1 1 107 107 GLU HB3 H 1 2.07 0.02 . 1 . . . . . . . . 5177 1 1370 . 1 1 107 107 GLU CG C 13 36.0 0.3 . 1 . . . . . . . . 5177 1 1371 . 1 1 107 107 GLU HG2 H 1 2.36 0.02 . 1 . . . . . . . . 5177 1 1372 . 1 1 107 107 GLU HG3 H 1 2.36 0.02 . 1 . . . . . . . . 5177 1 1373 . 1 1 107 107 GLU C C 13 177.4 0.3 . 1 . . . . . . . . 5177 1 1374 . 1 1 108 108 SER N N 15 108.8 0.2 . 1 . . . . . . . . 5177 1 1375 . 1 1 108 108 SER H H 1 7.72 0.02 . 1 . . . . . . . . 5177 1 1376 . 1 1 108 108 SER CA C 13 58.2 0.3 . 1 . . . . . . . . 5177 1 1377 . 1 1 108 108 SER HA H 1 4.30 0.02 . 1 . . . . . . . . 5177 1 1378 . 1 1 108 108 SER CB C 13 63.2 0.3 . 1 . . . . . . . . 5177 1 1379 . 1 1 108 108 SER HB2 H 1 3.85 0.02 . 2 . . . . . . . . 5177 1 1380 . 1 1 108 108 SER HB3 H 1 4.10 0.02 . 2 . . . . . . . . 5177 1 1381 . 1 1 108 108 SER C C 13 174.8 0.3 . 1 . . . . . . . . 5177 1 1382 . 1 1 109 109 ALA N N 15 125.4 0.2 . 1 . . . . . . . . 5177 1 1383 . 1 1 109 109 ALA H H 1 7.37 0.02 . 1 . . . . . . . . 5177 1 1384 . 1 1 109 109 ALA CA C 13 50.5 0.3 . 1 . . . . . . . . 5177 1 1385 . 1 1 109 109 ALA HA H 1 4.43 0.02 . 1 . . . . . . . . 5177 1 1386 . 1 1 109 109 ALA HB1 H 1 1.11 0.02 . 1 . . . . . . . . 5177 1 1387 . 1 1 109 109 ALA HB2 H 1 1.11 0.02 . 1 . . . . . . . . 5177 1 1388 . 1 1 109 109 ALA HB3 H 1 1.11 0.02 . 1 . . . . . . . . 5177 1 1389 . 1 1 109 109 ALA CB C 13 18.3 0.3 . 1 . . . . . . . . 5177 1 1390 . 1 1 110 110 PRO CD C 13 51.0 0.3 . 1 . . . . . . . . 5177 1 1391 . 1 1 110 110 PRO CA C 13 62.8 0.3 . 1 . . . . . . . . 5177 1 1392 . 1 1 110 110 PRO HA H 1 4.51 0.02 . 1 . . . . . . . . 5177 1 1393 . 1 1 110 110 PRO CB C 13 32.5 0.3 . 1 . . . . . . . . 5177 1 1394 . 1 1 110 110 PRO HB2 H 1 2.02 0.02 . 2 . . . . . . . . 5177 1 1395 . 1 1 110 110 PRO HB3 H 1 2.60 0.02 . 2 . . . . . . . . 5177 1 1396 . 1 1 110 110 PRO CG C 13 28.1 0.3 . 1 . . . . . . . . 5177 1 1397 . 1 1 110 110 PRO HG2 H 1 2.25 0.02 . 2 . . . . . . . . 5177 1 1398 . 1 1 110 110 PRO HG3 H 1 2.31 0.02 . 2 . . . . . . . . 5177 1 1399 . 1 1 110 110 PRO HD2 H 1 3.66 0.02 . 2 . . . . . . . . 5177 1 1400 . 1 1 110 110 PRO HD3 H 1 4.18 0.02 . 2 . . . . . . . . 5177 1 1401 . 1 1 110 110 PRO C C 13 178.0 0.3 . 1 . . . . . . . . 5177 1 1402 . 1 1 111 111 LEU N N 15 127.2 0.2 . 1 . . . . . . . . 5177 1 1403 . 1 1 111 111 LEU H H 1 8.79 0.02 . 1 . . . . . . . . 5177 1 1404 . 1 1 111 111 LEU CA C 13 58.9 0.3 . 1 . . . . . . . . 5177 1 1405 . 1 1 111 111 LEU HA H 1 4.02 0.02 . 1 . . . . . . . . 5177 1 1406 . 1 1 111 111 LEU CB C 13 41.7 0.3 . 1 . . . . . . . . 5177 1 1407 . 1 1 111 111 LEU HB2 H 1 1.80 0.02 . 1 . . . . . . . . 5177 1 1408 . 1 1 111 111 LEU HB3 H 1 1.80 0.02 . 1 . . . . . . . . 5177 1 1409 . 1 1 111 111 LEU CG C 13 27.2 0.3 . 1 . . . . . . . . 5177 1 1410 . 1 1 111 111 LEU HG H 1 1.74 0.02 . 1 . . . . . . . . 5177 1 1411 . 1 1 111 111 LEU CD1 C 13 24.9 0.3 . 1 . . . . . . . . 5177 1 1412 . 1 1 111 111 LEU CD2 C 13 23.7 0.3 . 1 . . . . . . . . 5177 1 1413 . 1 1 111 111 LEU HD11 H 1 1.01 0.02 . 1 . . . . . . . . 5177 1 1414 . 1 1 111 111 LEU HD12 H 1 1.01 0.02 . 1 . . . . . . . . 5177 1 1415 . 1 1 111 111 LEU HD13 H 1 1.01 0.02 . 1 . . . . . . . . 5177 1 1416 . 1 1 111 111 LEU HD21 H 1 1.01 0.02 . 1 . . . . . . . . 5177 1 1417 . 1 1 111 111 LEU HD22 H 1 1.01 0.02 . 1 . . . . . . . . 5177 1 1418 . 1 1 111 111 LEU HD23 H 1 1.01 0.02 . 1 . . . . . . . . 5177 1 1419 . 1 1 111 111 LEU C C 13 178.8 0.3 . 1 . . . . . . . . 5177 1 1420 . 1 1 112 112 LYS N N 15 115.9 0.2 . 1 . . . . . . . . 5177 1 1421 . 1 1 112 112 LYS H H 1 8.86 0.02 . 1 . . . . . . . . 5177 1 1422 . 1 1 112 112 LYS CA C 13 59.8 0.3 . 1 . . . . . . . . 5177 1 1423 . 1 1 112 112 LYS HA H 1 4.16 0.02 . 1 . . . . . . . . 5177 1 1424 . 1 1 112 112 LYS CB C 13 32.4 0.3 . 1 . . . . . . . . 5177 1 1425 . 1 1 112 112 LYS HB2 H 1 1.95 0.02 . 1 . . . . . . . . 5177 1 1426 . 1 1 112 112 LYS HB3 H 1 1.95 0.02 . 1 . . . . . . . . 5177 1 1427 . 1 1 112 112 LYS CG C 13 25.3 0.3 . 1 . . . . . . . . 5177 1 1428 . 1 1 112 112 LYS HG2 H 1 1.54 0.02 . 1 . . . . . . . . 5177 1 1429 . 1 1 112 112 LYS HG3 H 1 1.54 0.02 . 1 . . . . . . . . 5177 1 1430 . 1 1 112 112 LYS CD C 13 29.7 0.3 . 1 . . . . . . . . 5177 1 1431 . 1 1 112 112 LYS HD2 H 1 1.78 0.02 . 1 . . . . . . . . 5177 1 1432 . 1 1 112 112 LYS HD3 H 1 1.78 0.02 . 1 . . . . . . . . 5177 1 1433 . 1 1 112 112 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 1434 . 1 1 112 112 LYS HE2 H 1 3.12 0.02 . 1 . . . . . . . . 5177 1 1435 . 1 1 112 112 LYS HE3 H 1 3.12 0.02 . 1 . . . . . . . . 5177 1 1436 . 1 1 112 112 LYS C C 13 179.3 0.3 . 1 . . . . . . . . 5177 1 1437 . 1 1 113 113 SER N N 15 112.9 0.2 . 1 . . . . . . . . 5177 1 1438 . 1 1 113 113 SER H H 1 7.09 0.02 . 1 . . . . . . . . 5177 1 1439 . 1 1 113 113 SER CA C 13 61.4 0.3 . 1 . . . . . . . . 5177 1 1440 . 1 1 113 113 SER HA H 1 4.58 0.02 . 1 . . . . . . . . 5177 1 1441 . 1 1 113 113 SER CB C 13 63.3 0.3 . 1 . . . . . . . . 5177 1 1442 . 1 1 113 113 SER HB2 H 1 4.23 0.02 . 1 . . . . . . . . 5177 1 1443 . 1 1 113 113 SER HB3 H 1 4.23 0.02 . 1 . . . . . . . . 5177 1 1444 . 1 1 113 113 SER C C 13 176.2 0.3 . 1 . . . . . . . . 5177 1 1445 . 1 1 114 114 LYS N N 15 121.6 0.2 . 1 . . . . . . . . 5177 1 1446 . 1 1 114 114 LYS H H 1 8.16 0.02 . 1 . . . . . . . . 5177 1 1447 . 1 1 114 114 LYS CA C 13 61.0 0.3 . 1 . . . . . . . . 5177 1 1448 . 1 1 114 114 LYS HA H 1 4.28 0.02 . 1 . . . . . . . . 5177 1 1449 . 1 1 114 114 LYS CB C 13 32.3 0.3 . 1 . . . . . . . . 5177 1 1450 . 1 1 114 114 LYS HB2 H 1 1.89 0.02 . 1 . . . . . . . . 5177 1 1451 . 1 1 114 114 LYS HB3 H 1 1.89 0.02 . 1 . . . . . . . . 5177 1 1452 . 1 1 114 114 LYS CG C 13 26.4 0.3 . 1 . . . . . . . . 5177 1 1453 . 1 1 114 114 LYS HG2 H 1 1.11 0.02 . 2 . . . . . . . . 5177 1 1454 . 1 1 114 114 LYS HG3 H 1 1.34 0.02 . 2 . . . . . . . . 5177 1 1455 . 1 1 114 114 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 5177 1 1456 . 1 1 114 114 LYS HD2 H 1 1.51 0.02 . 2 . . . . . . . . 5177 1 1457 . 1 1 114 114 LYS HD3 H 1 1.63 0.02 . 2 . . . . . . . . 5177 1 1458 . 1 1 114 114 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 1459 . 1 1 114 114 LYS HE2 H 1 2.77 0.02 . 2 . . . . . . . . 5177 1 1460 . 1 1 114 114 LYS HE3 H 1 2.91 0.02 . 2 . . . . . . . . 5177 1 1461 . 1 1 114 114 LYS C C 13 179.3 0.3 . 1 . . . . . . . . 5177 1 1462 . 1 1 115 115 MET N N 15 116.0 0.2 . 1 . . . . . . . . 5177 1 1463 . 1 1 115 115 MET H H 1 8.56 0.02 . 1 . . . . . . . . 5177 1 1464 . 1 1 115 115 MET CA C 13 58.9 0.3 . 1 . . . . . . . . 5177 1 1465 . 1 1 115 115 MET HA H 1 4.35 0.02 . 1 . . . . . . . . 5177 1 1466 . 1 1 115 115 MET CB C 13 32.9 0.3 . 1 . . . . . . . . 5177 1 1467 . 1 1 115 115 MET HB2 H 1 2.26 0.02 . 1 . . . . . . . . 5177 1 1468 . 1 1 115 115 MET HB3 H 1 2.26 0.02 . 1 . . . . . . . . 5177 1 1469 . 1 1 115 115 MET CG C 13 32.3 0.3 . 1 . . . . . . . . 5177 1 1470 . 1 1 115 115 MET HG2 H 1 2.69 0.02 . 2 . . . . . . . . 5177 1 1471 . 1 1 115 115 MET HG3 H 1 2.86 0.02 . 2 . . . . . . . . 5177 1 1472 . 1 1 115 115 MET HE1 H 1 1.76 0.02 . 1 . . . . . . . . 5177 1 1473 . 1 1 115 115 MET HE2 H 1 1.76 0.02 . 1 . . . . . . . . 5177 1 1474 . 1 1 115 115 MET HE3 H 1 1.76 0.02 . 1 . . . . . . . . 5177 1 1475 . 1 1 115 115 MET CE C 13 18.1 0.3 . 1 . . . . . . . . 5177 1 1476 . 1 1 115 115 MET C C 13 179.5 0.3 . 1 . . . . . . . . 5177 1 1477 . 1 1 116 116 ILE N N 15 121.1 0.2 . 1 . . . . . . . . 5177 1 1478 . 1 1 116 116 ILE H H 1 7.99 0.02 . 1 . . . . . . . . 5177 1 1479 . 1 1 116 116 ILE CA C 13 64.8 0.3 . 1 . . . . . . . . 5177 1 1480 . 1 1 116 116 ILE HA H 1 4.11 0.02 . 1 . . . . . . . . 5177 1 1481 . 1 1 116 116 ILE CB C 13 38.4 0.3 . 1 . . . . . . . . 5177 1 1482 . 1 1 116 116 ILE HB H 1 2.00 0.02 . 1 . . . . . . . . 5177 1 1483 . 1 1 116 116 ILE HG21 H 1 1.00 0.02 . 1 . . . . . . . . 5177 1 1484 . 1 1 116 116 ILE HG22 H 1 1.00 0.02 . 1 . . . . . . . . 5177 1 1485 . 1 1 116 116 ILE HG23 H 1 1.00 0.02 . 1 . . . . . . . . 5177 1 1486 . 1 1 116 116 ILE CG2 C 13 18.3 0.3 . 1 . . . . . . . . 5177 1 1487 . 1 1 116 116 ILE CG1 C 13 29.2 0.3 . 1 . . . . . . . . 5177 1 1488 . 1 1 116 116 ILE HG12 H 1 1.21 0.02 . 2 . . . . . . . . 5177 1 1489 . 1 1 116 116 ILE HG13 H 1 1.82 0.02 . 2 . . . . . . . . 5177 1 1490 . 1 1 116 116 ILE HD11 H 1 0.96 0.02 . 1 . . . . . . . . 5177 1 1491 . 1 1 116 116 ILE HD12 H 1 0.96 0.02 . 1 . . . . . . . . 5177 1 1492 . 1 1 116 116 ILE HD13 H 1 0.96 0.02 . 1 . . . . . . . . 5177 1 1493 . 1 1 116 116 ILE CD1 C 13 14.0 0.3 . 1 . . . . . . . . 5177 1 1494 . 1 1 116 116 ILE C C 13 179.5 0.3 . 1 . . . . . . . . 5177 1 1495 . 1 1 117 117 TYR N N 15 121.1 0.2 . 1 . . . . . . . . 5177 1 1496 . 1 1 117 117 TYR H H 1 8.98 0.02 . 1 . . . . . . . . 5177 1 1497 . 1 1 117 117 TYR CA C 13 62.3 0.3 . 1 . . . . . . . . 5177 1 1498 . 1 1 117 117 TYR HA H 1 4.28 0.02 . 1 . . . . . . . . 5177 1 1499 . 1 1 117 117 TYR CB C 13 37.9 0.3 . 1 . . . . . . . . 5177 1 1500 . 1 1 117 117 TYR HB2 H 1 2.83 0.02 . 2 . . . . . . . . 5177 1 1501 . 1 1 117 117 TYR HB3 H 1 3.29 0.02 . 2 . . . . . . . . 5177 1 1502 . 1 1 117 117 TYR HD1 H 1 6.89 0.02 . 1 . . . . . . . . 5177 1 1503 . 1 1 117 117 TYR HD2 H 1 6.89 0.02 . 1 . . . . . . . . 5177 1 1504 . 1 1 117 117 TYR HE1 H 1 7.13 0.02 . 1 . . . . . . . . 5177 1 1505 . 1 1 117 117 TYR HE2 H 1 7.13 0.02 . 1 . . . . . . . . 5177 1 1506 . 1 1 117 117 TYR C C 13 181.1 0.3 . 1 . . . . . . . . 5177 1 1507 . 1 1 118 118 ALA N N 15 123.7 0.2 . 1 . . . . . . . . 5177 1 1508 . 1 1 118 118 ALA H H 1 9.03 0.02 . 1 . . . . . . . . 5177 1 1509 . 1 1 118 118 ALA CA C 13 56.1 0.3 . 1 . . . . . . . . 5177 1 1510 . 1 1 118 118 ALA HA H 1 4.20 0.02 . 1 . . . . . . . . 5177 1 1511 . 1 1 118 118 ALA HB1 H 1 1.81 0.02 . 1 . . . . . . . . 5177 1 1512 . 1 1 118 118 ALA HB2 H 1 1.81 0.02 . 1 . . . . . . . . 5177 1 1513 . 1 1 118 118 ALA HB3 H 1 1.81 0.02 . 1 . . . . . . . . 5177 1 1514 . 1 1 118 118 ALA CB C 13 18.3 0.3 . 1 . . . . . . . . 5177 1 1515 . 1 1 118 118 ALA C C 13 180.7 0.3 . 1 . . . . . . . . 5177 1 1516 . 1 1 119 119 SER N N 15 113.9 0.2 . 1 . . . . . . . . 5177 1 1517 . 1 1 119 119 SER H H 1 8.25 0.02 . 1 . . . . . . . . 5177 1 1518 . 1 1 119 119 SER CA C 13 61.4 0.3 . 1 . . . . . . . . 5177 1 1519 . 1 1 119 119 SER HA H 1 4.45 0.02 . 1 . . . . . . . . 5177 1 1520 . 1 1 119 119 SER CB C 13 63.3 0.3 . 1 . . . . . . . . 5177 1 1521 . 1 1 119 119 SER HB2 H 1 4.11 0.02 . 2 . . . . . . . . 5177 1 1522 . 1 1 119 119 SER HB3 H 1 4.16 0.02 . 2 . . . . . . . . 5177 1 1523 . 1 1 119 119 SER C C 13 176.2 0.3 . 1 . . . . . . . . 5177 1 1524 . 1 1 120 120 SER N N 15 115.0 0.2 . 1 . . . . . . . . 5177 1 1525 . 1 1 120 120 SER H H 1 7.49 0.02 . 1 . . . . . . . . 5177 1 1526 . 1 1 120 120 SER CA C 13 59.4 0.3 . 1 . . . . . . . . 5177 1 1527 . 1 1 120 120 SER HA H 1 4.67 0.02 . 1 . . . . . . . . 5177 1 1528 . 1 1 120 120 SER CB C 13 63.6 0.3 . 1 . . . . . . . . 5177 1 1529 . 1 1 120 120 SER HB2 H 1 3.85 0.02 . 2 . . . . . . . . 5177 1 1530 . 1 1 120 120 SER HB3 H 1 4.00 0.02 . 2 . . . . . . . . 5177 1 1531 . 1 1 120 120 SER C C 13 172.9 0.3 . 1 . . . . . . . . 5177 1 1532 . 1 1 121 121 LYS N N 15 122.1 0.2 . 1 . . . . . . . . 5177 1 1533 . 1 1 121 121 LYS H H 1 7.04 0.02 . 1 . . . . . . . . 5177 1 1534 . 1 1 121 121 LYS CA C 13 59.6 0.3 . 1 . . . . . . . . 5177 1 1535 . 1 1 121 121 LYS HA H 1 3.57 0.02 . 1 . . . . . . . . 5177 1 1536 . 1 1 121 121 LYS CB C 13 31.3 0.3 . 1 . . . . . . . . 5177 1 1537 . 1 1 121 121 LYS HB2 H 1 1.84 0.02 . 1 . . . . . . . . 5177 1 1538 . 1 1 121 121 LYS HB3 H 1 1.84 0.02 . 1 . . . . . . . . 5177 1 1539 . 1 1 121 121 LYS CG C 13 23.8 0.3 . 1 . . . . . . . . 5177 1 1540 . 1 1 121 121 LYS HG2 H 1 1.46 0.02 . 1 . . . . . . . . 5177 1 1541 . 1 1 121 121 LYS HG3 H 1 1.46 0.02 . 1 . . . . . . . . 5177 1 1542 . 1 1 121 121 LYS HD2 H 1 1.65 0.02 . 1 . . . . . . . . 5177 1 1543 . 1 1 121 121 LYS HD3 H 1 1.65 0.02 . 1 . . . . . . . . 5177 1 1544 . 1 1 121 121 LYS CE C 13 41.3 0.3 . 1 . . . . . . . . 5177 1 1545 . 1 1 121 121 LYS HE2 H 1 3.08 0.02 . 1 . . . . . . . . 5177 1 1546 . 1 1 121 121 LYS HE3 H 1 3.08 0.02 . 1 . . . . . . . . 5177 1 1547 . 1 1 121 121 LYS C C 13 177.3 0.3 . 1 . . . . . . . . 5177 1 1548 . 1 1 122 122 ASP N N 15 117.5 0.2 . 1 . . . . . . . . 5177 1 1549 . 1 1 122 122 ASP H H 1 8.47 0.02 . 1 . . . . . . . . 5177 1 1550 . 1 1 122 122 ASP CA C 13 57.3 0.3 . 1 . . . . . . . . 5177 1 1551 . 1 1 122 122 ASP HA H 1 4.28 0.02 . 1 . . . . . . . . 5177 1 1552 . 1 1 122 122 ASP CB C 13 40.4 0.3 . 1 . . . . . . . . 5177 1 1553 . 1 1 122 122 ASP HB2 H 1 2.52 0.02 . 2 . . . . . . . . 5177 1 1554 . 1 1 122 122 ASP HB3 H 1 2.62 0.02 . 2 . . . . . . . . 5177 1 1555 . 1 1 122 122 ASP C C 13 177.7 0.3 . 1 . . . . . . . . 5177 1 1556 . 1 1 123 123 ALA N N 15 121.6 0.2 . 1 . . . . . . . . 5177 1 1557 . 1 1 123 123 ALA H H 1 7.59 0.02 . 1 . . . . . . . . 5177 1 1558 . 1 1 123 123 ALA CA C 13 54.9 0.3 . 1 . . . . . . . . 5177 1 1559 . 1 1 123 123 ALA HA H 1 3.92 0.02 . 1 . . . . . . . . 5177 1 1560 . 1 1 123 123 ALA HB1 H 1 1.33 0.02 . 1 . . . . . . . . 5177 1 1561 . 1 1 123 123 ALA HB2 H 1 1.33 0.02 . 1 . . . . . . . . 5177 1 1562 . 1 1 123 123 ALA HB3 H 1 1.33 0.02 . 1 . . . . . . . . 5177 1 1563 . 1 1 123 123 ALA CB C 13 17.9 0.3 . 1 . . . . . . . . 5177 1 1564 . 1 1 123 123 ALA C C 13 179.8 0.3 . 1 . . . . . . . . 5177 1 1565 . 1 1 124 124 ILE N N 15 114.4 0.2 . 1 . . . . . . . . 5177 1 1566 . 1 1 124 124 ILE H H 1 6.95 0.02 . 1 . . . . . . . . 5177 1 1567 . 1 1 124 124 ILE CA C 13 63.1 0.3 . 1 . . . . . . . . 5177 1 1568 . 1 1 124 124 ILE HA H 1 3.48 0.02 . 1 . . . . . . . . 5177 1 1569 . 1 1 124 124 ILE CB C 13 37.4 0.3 . 1 . . . . . . . . 5177 1 1570 . 1 1 124 124 ILE HB H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1571 . 1 1 124 124 ILE HG21 H 1 0.10 0.02 . 1 . . . . . . . . 5177 1 1572 . 1 1 124 124 ILE HG22 H 1 0.10 0.02 . 1 . . . . . . . . 5177 1 1573 . 1 1 124 124 ILE HG23 H 1 0.10 0.02 . 1 . . . . . . . . 5177 1 1574 . 1 1 124 124 ILE CG2 C 13 15.2 0.3 . 1 . . . . . . . . 5177 1 1575 . 1 1 124 124 ILE CG1 C 13 28.9 0.3 . 1 . . . . . . . . 5177 1 1576 . 1 1 124 124 ILE HG12 H 1 -0.10 0.02 . 2 . . . . . . . . 5177 1 1577 . 1 1 124 124 ILE HG13 H 1 0.45 0.02 . 2 . . . . . . . . 5177 1 1578 . 1 1 124 124 ILE HD11 H 1 0.24 0.02 . 1 . . . . . . . . 5177 1 1579 . 1 1 124 124 ILE HD12 H 1 0.24 0.02 . 1 . . . . . . . . 5177 1 1580 . 1 1 124 124 ILE HD13 H 1 0.24 0.02 . 1 . . . . . . . . 5177 1 1581 . 1 1 124 124 ILE CD1 C 13 14.1 0.3 . 1 . . . . . . . . 5177 1 1582 . 1 1 124 124 ILE C C 13 175.3 0.3 . 1 . . . . . . . . 5177 1 1583 . 1 1 125 125 LYS N N 15 122.1 0.2 . 1 . . . . . . . . 5177 1 1584 . 1 1 125 125 LYS H H 1 7.73 0.02 . 1 . . . . . . . . 5177 1 1585 . 1 1 125 125 LYS CA C 13 59.5 0.3 . 1 . . . . . . . . 5177 1 1586 . 1 1 125 125 LYS HA H 1 3.00 0.02 . 1 . . . . . . . . 5177 1 1587 . 1 1 125 125 LYS CB C 13 31.9 0.3 . 1 . . . . . . . . 5177 1 1588 . 1 1 125 125 LYS HB2 H 1 1.38 0.02 . 2 . . . . . . . . 5177 1 1589 . 1 1 125 125 LYS HB3 H 1 1.65 0.02 . 2 . . . . . . . . 5177 1 1590 . 1 1 125 125 LYS CG C 13 25.0 0.3 . 1 . . . . . . . . 5177 1 1591 . 1 1 125 125 LYS HG2 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1592 . 1 1 125 125 LYS HG3 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1593 . 1 1 125 125 LYS CD C 13 28.8 0.3 . 1 . . . . . . . . 5177 1 1594 . 1 1 125 125 LYS HD2 H 1 1.43 0.02 . 2 . . . . . . . . 5177 1 1595 . 1 1 125 125 LYS HD3 H 1 1.57 0.02 . 2 . . . . . . . . 5177 1 1596 . 1 1 125 125 LYS CE C 13 41.8 0.3 . 1 . . . . . . . . 5177 1 1597 . 1 1 125 125 LYS HE2 H 1 2.80 0.02 . 2 . . . . . . . . 5177 1 1598 . 1 1 125 125 LYS HE3 H 1 2.92 0.02 . 2 . . . . . . . . 5177 1 1599 . 1 1 125 125 LYS C C 13 179.3 0.3 . 1 . . . . . . . . 5177 1 1600 . 1 1 126 126 LYS N N 15 115.9 0.2 . 1 . . . . . . . . 5177 1 1601 . 1 1 126 126 LYS H H 1 7.66 0.02 . 1 . . . . . . . . 5177 1 1602 . 1 1 126 126 LYS CA C 13 58.5 0.3 . 1 . . . . . . . . 5177 1 1603 . 1 1 126 126 LYS HA H 1 3.86 0.02 . 1 . . . . . . . . 5177 1 1604 . 1 1 126 126 LYS CB C 13 32.6 0.3 . 1 . . . . . . . . 5177 1 1605 . 1 1 126 126 LYS HB2 H 1 1.75 0.02 . 1 . . . . . . . . 5177 1 1606 . 1 1 126 126 LYS HB3 H 1 1.75 0.02 . 1 . . . . . . . . 5177 1 1607 . 1 1 126 126 LYS CG C 13 26.0 0.3 . 1 . . . . . . . . 5177 1 1608 . 1 1 126 126 LYS HG2 H 1 1.45 0.02 . 1 . . . . . . . . 5177 1 1609 . 1 1 126 126 LYS HG3 H 1 1.45 0.02 . 1 . . . . . . . . 5177 1 1610 . 1 1 126 126 LYS CD C 13 29.4 0.3 . 1 . . . . . . . . 5177 1 1611 . 1 1 126 126 LYS HD2 H 1 1.82 0.02 . 1 . . . . . . . . 5177 1 1612 . 1 1 126 126 LYS HD3 H 1 1.82 0.02 . 1 . . . . . . . . 5177 1 1613 . 1 1 126 126 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 1614 . 1 1 126 126 LYS HE2 H 1 3.00 0.02 . 1 . . . . . . . . 5177 1 1615 . 1 1 126 126 LYS HE3 H 1 3.00 0.02 . 1 . . . . . . . . 5177 1 1616 . 1 1 126 126 LYS C C 13 178.4 0.3 . 1 . . . . . . . . 5177 1 1617 . 1 1 127 127 LYS N N 15 115.4 0.2 . 1 . . . . . . . . 5177 1 1618 . 1 1 127 127 LYS H H 1 6.93 0.02 . 1 . . . . . . . . 5177 1 1619 . 1 1 127 127 LYS CA C 13 55.3 0.3 . 1 . . . . . . . . 5177 1 1620 . 1 1 127 127 LYS HA H 1 4.17 0.02 . 1 . . . . . . . . 5177 1 1621 . 1 1 127 127 LYS CB C 13 31.4 0.3 . 1 . . . . . . . . 5177 1 1622 . 1 1 127 127 LYS HB2 H 1 1.66 0.02 . 1 . . . . . . . . 5177 1 1623 . 1 1 127 127 LYS HB3 H 1 1.66 0.02 . 1 . . . . . . . . 5177 1 1624 . 1 1 127 127 LYS CG C 13 24.5 0.3 . 1 . . . . . . . . 5177 1 1625 . 1 1 127 127 LYS HG2 H 1 1.20 0.02 . 1 . . . . . . . . 5177 1 1626 . 1 1 127 127 LYS HG3 H 1 1.20 0.02 . 1 . . . . . . . . 5177 1 1627 . 1 1 127 127 LYS CD C 13 28.1 0.3 . 1 . . . . . . . . 5177 1 1628 . 1 1 127 127 LYS HD2 H 1 1.49 0.02 . 1 . . . . . . . . 5177 1 1629 . 1 1 127 127 LYS HD3 H 1 1.49 0.02 . 1 . . . . . . . . 5177 1 1630 . 1 1 127 127 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 1631 . 1 1 127 127 LYS HE2 H 1 3.01 0.02 . 1 . . . . . . . . 5177 1 1632 . 1 1 127 127 LYS HE3 H 1 3.01 0.02 . 1 . . . . . . . . 5177 1 1633 . 1 1 127 127 LYS C C 13 176.7 0.3 . 1 . . . . . . . . 5177 1 1634 . 1 1 128 128 PHE N N 15 123.2 0.2 . 1 . . . . . . . . 5177 1 1635 . 1 1 128 128 PHE H H 1 7.14 0.02 . 1 . . . . . . . . 5177 1 1636 . 1 1 128 128 PHE CA C 13 51.4 0.3 . 1 . . . . . . . . 5177 1 1637 . 1 1 128 128 PHE HA H 1 3.80 0.02 . 1 . . . . . . . . 5177 1 1638 . 1 1 128 128 PHE CB C 13 34.8 0.3 . 1 . . . . . . . . 5177 1 1639 . 1 1 128 128 PHE HB2 H 1 2.35 0.02 . 2 . . . . . . . . 5177 1 1640 . 1 1 128 128 PHE HB3 H 1 2.66 0.02 . 2 . . . . . . . . 5177 1 1641 . 1 1 128 128 PHE HD1 H 1 6.15 0.02 . 1 . . . . . . . . 5177 1 1642 . 1 1 128 128 PHE HD2 H 1 6.15 0.02 . 1 . . . . . . . . 5177 1 1643 . 1 1 128 128 PHE HE1 H 1 6.75 0.02 . 1 . . . . . . . . 5177 1 1644 . 1 1 128 128 PHE HE2 H 1 6.75 0.02 . 1 . . . . . . . . 5177 1 1645 . 1 1 128 128 PHE HZ H 1 6.25 0.02 . 1 . . . . . . . . 5177 1 1646 . 1 1 128 128 PHE C C 13 175.0 0.3 . 1 . . . . . . . . 5177 1 1647 . 1 1 129 129 THR N N 15 115.4 0.2 . 1 . . . . . . . . 5177 1 1648 . 1 1 129 129 THR H H 1 7.21 0.02 . 1 . . . . . . . . 5177 1 1649 . 1 1 129 129 THR CA C 13 63.8 0.3 . 1 . . . . . . . . 5177 1 1650 . 1 1 129 129 THR HA H 1 3.98 0.02 . 1 . . . . . . . . 5177 1 1651 . 1 1 129 129 THR CB C 13 69.3 0.3 . 1 . . . . . . . . 5177 1 1652 . 1 1 129 129 THR HB H 1 4.17 0.02 . 1 . . . . . . . . 5177 1 1653 . 1 1 129 129 THR HG21 H 1 1.33 0.02 . 1 . . . . . . . . 5177 1 1654 . 1 1 129 129 THR HG22 H 1 1.33 0.02 . 1 . . . . . . . . 5177 1 1655 . 1 1 129 129 THR HG23 H 1 1.33 0.02 . 1 . . . . . . . . 5177 1 1656 . 1 1 129 129 THR CG2 C 13 21.9 0.3 . 1 . . . . . . . . 5177 1 1657 . 1 1 129 129 THR C C 13 175.6 0.3 . 1 . . . . . . . . 5177 1 1658 . 1 1 130 130 GLY N N 15 113.9 0.2 . 1 . . . . . . . . 5177 1 1659 . 1 1 130 130 GLY H H 1 8.95 0.02 . 1 . . . . . . . . 5177 1 1660 . 1 1 130 130 GLY CA C 13 45.2 0.3 . 1 . . . . . . . . 5177 1 1661 . 1 1 130 130 GLY HA2 H 1 4.40 0.02 . 2 . . . . . . . . 5177 1 1662 . 1 1 130 130 GLY HA3 H 1 3.80 0.02 . 2 . . . . . . . . 5177 1 1663 . 1 1 130 130 GLY C C 13 175.5 0.3 . 1 . . . . . . . . 5177 1 1664 . 1 1 131 131 ILE N N 15 120.9 0.2 . 1 . . . . . . . . 5177 1 1665 . 1 1 131 131 ILE H H 1 7.87 0.02 . 1 . . . . . . . . 5177 1 1666 . 1 1 131 131 ILE CA C 13 61.3 0.3 . 1 . . . . . . . . 5177 1 1667 . 1 1 131 131 ILE HA H 1 4.45 0.02 . 1 . . . . . . . . 5177 1 1668 . 1 1 131 131 ILE CB C 13 38.5 0.3 . 1 . . . . . . . . 5177 1 1669 . 1 1 131 131 ILE HB H 1 2.11 0.02 . 1 . . . . . . . . 5177 1 1670 . 1 1 131 131 ILE HG21 H 1 1.16 0.02 . 1 . . . . . . . . 5177 1 1671 . 1 1 131 131 ILE HG22 H 1 1.16 0.02 . 1 . . . . . . . . 5177 1 1672 . 1 1 131 131 ILE HG23 H 1 1.16 0.02 . 1 . . . . . . . . 5177 1 1673 . 1 1 131 131 ILE CG2 C 13 18.8 0.3 . 1 . . . . . . . . 5177 1 1674 . 1 1 131 131 ILE CG1 C 13 29.0 0.3 . 1 . . . . . . . . 5177 1 1675 . 1 1 131 131 ILE HG12 H 1 1.58 0.02 . 2 . . . . . . . . 5177 1 1676 . 1 1 131 131 ILE HG13 H 1 1.76 0.02 . 2 . . . . . . . . 5177 1 1677 . 1 1 131 131 ILE HD11 H 1 1.13 0.02 . 1 . . . . . . . . 5177 1 1678 . 1 1 131 131 ILE HD12 H 1 1.13 0.02 . 1 . . . . . . . . 5177 1 1679 . 1 1 131 131 ILE HD13 H 1 1.13 0.02 . 1 . . . . . . . . 5177 1 1680 . 1 1 131 131 ILE CD1 C 13 15.3 0.3 . 1 . . . . . . . . 5177 1 1681 . 1 1 131 131 ILE C C 13 176.3 0.3 . 1 . . . . . . . . 5177 1 1682 . 1 1 132 132 LYS N N 15 126.8 0.2 . 1 . . . . . . . . 5177 1 1683 . 1 1 132 132 LYS H H 1 9.39 0.02 . 1 . . . . . . . . 5177 1 1684 . 1 1 132 132 LYS CA C 13 57.3 0.3 . 1 . . . . . . . . 5177 1 1685 . 1 1 132 132 LYS HA H 1 4.36 0.02 . 1 . . . . . . . . 5177 1 1686 . 1 1 132 132 LYS CB C 13 34.2 0.3 . 1 . . . . . . . . 5177 1 1687 . 1 1 132 132 LYS HB2 H 1 1.56 0.02 . 1 . . . . . . . . 5177 1 1688 . 1 1 132 132 LYS HB3 H 1 1.56 0.02 . 1 . . . . . . . . 5177 1 1689 . 1 1 132 132 LYS CG C 13 25.3 0.3 . 1 . . . . . . . . 5177 1 1690 . 1 1 132 132 LYS HG2 H 1 1.29 0.02 . 2 . . . . . . . . 5177 1 1691 . 1 1 132 132 LYS HG3 H 1 1.45 0.02 . 2 . . . . . . . . 5177 1 1692 . 1 1 132 132 LYS CD C 13 29.2 0.3 . 1 . . . . . . . . 5177 1 1693 . 1 1 132 132 LYS HD2 H 1 1.72 0.02 . 1 . . . . . . . . 5177 1 1694 . 1 1 132 132 LYS HD3 H 1 1.72 0.02 . 1 . . . . . . . . 5177 1 1695 . 1 1 132 132 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 1696 . 1 1 132 132 LYS HE2 H 1 3.07 0.02 . 1 . . . . . . . . 5177 1 1697 . 1 1 132 132 LYS HE3 H 1 3.07 0.02 . 1 . . . . . . . . 5177 1 1698 . 1 1 132 132 LYS C C 13 176.0 0.3 . 1 . . . . . . . . 5177 1 1699 . 1 1 133 133 HIS N N 15 116.5 0.2 . 1 . . . . . . . . 5177 1 1700 . 1 1 133 133 HIS H H 1 7.13 0.02 . 1 . . . . . . . . 5177 1 1701 . 1 1 133 133 HIS CA C 13 55.4 0.3 . 1 . . . . . . . . 5177 1 1702 . 1 1 133 133 HIS HA H 1 5.11 0.02 . 1 . . . . . . . . 5177 1 1703 . 1 1 133 133 HIS CB C 13 34.7 0.3 . 1 . . . . . . . . 5177 1 1704 . 1 1 133 133 HIS HB2 H 1 3.33 0.02 . 2 . . . . . . . . 5177 1 1705 . 1 1 133 133 HIS HB3 H 1 2.82 0.02 . 2 . . . . . . . . 5177 1 1706 . 1 1 133 133 HIS HD2 H 1 6.96 0.02 . 1 . . . . . . . . 5177 1 1707 . 1 1 133 133 HIS HE1 H 1 7.79 0.02 . 1 . . . . . . . . 5177 1 1708 . 1 1 133 133 HIS C C 13 173.5 0.3 . 1 . . . . . . . . 5177 1 1709 . 1 1 134 134 GLU N N 15 123.7 0.2 . 1 . . . . . . . . 5177 1 1710 . 1 1 134 134 GLU H H 1 8.94 0.02 . 1 . . . . . . . . 5177 1 1711 . 1 1 134 134 GLU CA C 13 54.3 0.3 . 1 . . . . . . . . 5177 1 1712 . 1 1 134 134 GLU HA H 1 5.92 0.02 . 1 . . . . . . . . 5177 1 1713 . 1 1 134 134 GLU CB C 13 33.3 0.3 . 1 . . . . . . . . 5177 1 1714 . 1 1 134 134 GLU HB2 H 1 2.21 0.02 . 1 . . . . . . . . 5177 1 1715 . 1 1 134 134 GLU HB3 H 1 2.21 0.02 . 1 . . . . . . . . 5177 1 1716 . 1 1 134 134 GLU CG C 13 36.4 0.3 . 1 . . . . . . . . 5177 1 1717 . 1 1 134 134 GLU HG2 H 1 2.40 0.02 . 1 . . . . . . . . 5177 1 1718 . 1 1 134 134 GLU HG3 H 1 2.40 0.02 . 1 . . . . . . . . 5177 1 1719 . 1 1 134 134 GLU C C 13 174.9 0.3 . 1 . . . . . . . . 5177 1 1720 . 1 1 135 135 TRP N N 15 127.8 0.2 . 1 . . . . . . . . 5177 1 1721 . 1 1 135 135 TRP H H 1 9.42 0.02 . 1 . . . . . . . . 5177 1 1722 . 1 1 135 135 TRP CA C 13 53.7 0.3 . 1 . . . . . . . . 5177 1 1723 . 1 1 135 135 TRP HA H 1 5.48 0.02 . 1 . . . . . . . . 5177 1 1724 . 1 1 135 135 TRP CB C 13 33.6 0.3 . 1 . . . . . . . . 5177 1 1725 . 1 1 135 135 TRP HB2 H 1 2.69 0.02 . 2 . . . . . . . . 5177 1 1726 . 1 1 135 135 TRP HB3 H 1 3.58 0.02 . 2 . . . . . . . . 5177 1 1727 . 1 1 135 135 TRP NE1 N 15 128.3 0.2 . 1 . . . . . . . . 5177 1 1728 . 1 1 135 135 TRP HD1 H 1 7.28 0.02 . 1 . . . . . . . . 5177 1 1729 . 1 1 135 135 TRP HE3 H 1 7.19 0.02 . 1 . . . . . . . . 5177 1 1730 . 1 1 135 135 TRP HE1 H 1 10.20 0.02 . 1 . . . . . . . . 5177 1 1731 . 1 1 135 135 TRP HZ3 H 1 6.53 0.02 . 1 . . . . . . . . 5177 1 1732 . 1 1 135 135 TRP HZ2 H 1 7.51 0.02 . 1 . . . . . . . . 5177 1 1733 . 1 1 135 135 TRP HH2 H 1 7.13 0.02 . 1 . . . . . . . . 5177 1 1734 . 1 1 135 135 TRP C C 13 173.9 0.3 . 1 . . . . . . . . 5177 1 1735 . 1 1 136 136 GLN N N 15 129.8 0.2 . 1 . . . . . . . . 5177 1 1736 . 1 1 136 136 GLN H H 1 9.29 0.02 . 1 . . . . . . . . 5177 1 1737 . 1 1 136 136 GLN CA C 13 55.4 0.3 . 1 . . . . . . . . 5177 1 1738 . 1 1 136 136 GLN HA H 1 5.28 0.02 . 1 . . . . . . . . 5177 1 1739 . 1 1 136 136 GLN CB C 13 29.0 0.3 . 1 . . . . . . . . 5177 1 1740 . 1 1 136 136 GLN HB2 H 1 2.18 0.02 . 2 . . . . . . . . 5177 1 1741 . 1 1 136 136 GLN HB3 H 1 2.34 0.02 . 2 . . . . . . . . 5177 1 1742 . 1 1 136 136 GLN CG C 13 34.1 0.3 . 1 . . . . . . . . 5177 1 1743 . 1 1 136 136 GLN HG2 H 1 2.16 0.02 . 1 . . . . . . . . 5177 1 1744 . 1 1 136 136 GLN HG3 H 1 2.16 0.02 . 1 . . . . . . . . 5177 1 1745 . 1 1 136 136 GLN CD C 13 179.5 0.3 . 1 . . . . . . . . 5177 1 1746 . 1 1 136 136 GLN NE2 N 15 111.3 0.2 . 1 . . . . . . . . 5177 1 1747 . 1 1 136 136 GLN HE21 H 1 6.82 0.02 . 2 . . . . . . . . 5177 1 1748 . 1 1 136 136 GLN HE22 H 1 7.67 0.02 . 2 . . . . . . . . 5177 1 1749 . 1 1 136 136 GLN C C 13 173.6 0.3 . 1 . . . . . . . . 5177 1 1750 . 1 1 137 137 VAL N N 15 125.4 0.2 . 1 . . . . . . . . 5177 1 1751 . 1 1 137 137 VAL H H 1 8.53 0.02 . 1 . . . . . . . . 5177 1 1752 . 1 1 137 137 VAL CA C 13 60.5 0.3 . 1 . . . . . . . . 5177 1 1753 . 1 1 137 137 VAL HA H 1 4.15 0.02 . 1 . . . . . . . . 5177 1 1754 . 1 1 137 137 VAL CB C 13 34.6 0.3 . 1 . . . . . . . . 5177 1 1755 . 1 1 137 137 VAL HB H 1 1.68 0.02 . 1 . . . . . . . . 5177 1 1756 . 1 1 137 137 VAL HG11 H 1 0.52 0.02 . 2 . . . . . . . . 5177 1 1757 . 1 1 137 137 VAL HG12 H 1 0.52 0.02 . 2 . . . . . . . . 5177 1 1758 . 1 1 137 137 VAL HG13 H 1 0.52 0.02 . 2 . . . . . . . . 5177 1 1759 . 1 1 137 137 VAL HG21 H 1 0.03 0.02 . 2 . . . . . . . . 5177 1 1760 . 1 1 137 137 VAL HG22 H 1 0.03 0.02 . 2 . . . . . . . . 5177 1 1761 . 1 1 137 137 VAL HG23 H 1 0.03 0.02 . 2 . . . . . . . . 5177 1 1762 . 1 1 137 137 VAL CG1 C 13 23.2 0.3 . 1 . . . . . . . . 5177 1 1763 . 1 1 137 137 VAL CG2 C 13 19.8 0.3 . 1 . . . . . . . . 5177 1 1764 . 1 1 137 137 VAL C C 13 174.6 0.3 . 1 . . . . . . . . 5177 1 1765 . 1 1 138 138 ASN N N 15 123.2 0.2 . 1 . . . . . . . . 5177 1 1766 . 1 1 138 138 ASN H H 1 9.01 0.02 . 1 . . . . . . . . 5177 1 1767 . 1 1 138 138 ASN CA C 13 53.1 0.3 . 1 . . . . . . . . 5177 1 1768 . 1 1 138 138 ASN HA H 1 4.68 0.02 . 1 . . . . . . . . 5177 1 1769 . 1 1 138 138 ASN CB C 13 39.6 0.3 . 1 . . . . . . . . 5177 1 1770 . 1 1 138 138 ASN HB2 H 1 2.65 0.02 . 2 . . . . . . . . 5177 1 1771 . 1 1 138 138 ASN HB3 H 1 2.90 0.02 . 2 . . . . . . . . 5177 1 1772 . 1 1 138 138 ASN CG C 13 177.4 0.3 . 1 . . . . . . . . 5177 1 1773 . 1 1 138 138 ASN ND2 N 15 112.3 0.2 . 1 . . . . . . . . 5177 1 1774 . 1 1 138 138 ASN HD21 H 1 6.82 0.02 . 2 . . . . . . . . 5177 1 1775 . 1 1 138 138 ASN HD22 H 1 7.61 0.02 . 2 . . . . . . . . 5177 1 1776 . 1 1 138 138 ASN C C 13 174.8 0.3 . 1 . . . . . . . . 5177 1 1777 . 1 1 139 139 GLY N N 15 104.6 0.2 . 1 . . . . . . . . 5177 1 1778 . 1 1 139 139 GLY H H 1 6.93 0.02 . 1 . . . . . . . . 5177 1 1779 . 1 1 139 139 GLY CA C 13 45.2 0.3 . 1 . . . . . . . . 5177 1 1780 . 1 1 139 139 GLY HA2 H 1 4.34 0.02 . 2 . . . . . . . . 5177 1 1781 . 1 1 139 139 GLY HA3 H 1 3.55 0.02 . 2 . . . . . . . . 5177 1 1782 . 1 1 139 139 GLY C C 13 173.6 0.3 . 1 . . . . . . . . 5177 1 1783 . 1 1 140 140 LEU N N 15 122.6 0.2 . 1 . . . . . . . . 5177 1 1784 . 1 1 140 140 LEU H H 1 9.06 0.02 . 1 . . . . . . . . 5177 1 1785 . 1 1 140 140 LEU CA C 13 57.6 0.3 . 1 . . . . . . . . 5177 1 1786 . 1 1 140 140 LEU HA H 1 4.27 0.02 . 1 . . . . . . . . 5177 1 1787 . 1 1 140 140 LEU CB C 13 42.9 0.3 . 1 . . . . . . . . 5177 1 1788 . 1 1 140 140 LEU HB2 H 1 1.75 0.02 . 1 . . . . . . . . 5177 1 1789 . 1 1 140 140 LEU HB3 H 1 1.75 0.02 . 1 . . . . . . . . 5177 1 1790 . 1 1 140 140 LEU CG C 13 27.3 0.3 . 1 . . . . . . . . 5177 1 1791 . 1 1 140 140 LEU HG H 1 1.75 0.02 . 1 . . . . . . . . 5177 1 1792 . 1 1 140 140 LEU CD1 C 13 24.3 0.3 . 1 . . . . . . . . 5177 1 1793 . 1 1 140 140 LEU CD2 C 13 24.4 0.3 . 1 . . . . . . . . 5177 1 1794 . 1 1 140 140 LEU HD11 H 1 0.91 0.02 . 1 . . . . . . . . 5177 1 1795 . 1 1 140 140 LEU HD12 H 1 0.91 0.02 . 1 . . . . . . . . 5177 1 1796 . 1 1 140 140 LEU HD13 H 1 0.91 0.02 . 1 . . . . . . . . 5177 1 1797 . 1 1 140 140 LEU HD21 H 1 0.91 0.02 . 1 . . . . . . . . 5177 1 1798 . 1 1 140 140 LEU HD22 H 1 0.91 0.02 . 1 . . . . . . . . 5177 1 1799 . 1 1 140 140 LEU HD23 H 1 0.91 0.02 . 1 . . . . . . . . 5177 1 1800 . 1 1 140 140 LEU C C 13 178.7 0.3 . 1 . . . . . . . . 5177 1 1801 . 1 1 141 141 ASP N N 15 117.5 0.2 . 1 . . . . . . . . 5177 1 1802 . 1 1 141 141 ASP H H 1 8.75 0.02 . 1 . . . . . . . . 5177 1 1803 . 1 1 141 141 ASP CA C 13 57.6 0.3 . 1 . . . . . . . . 5177 1 1804 . 1 1 141 141 ASP HA H 1 4.41 0.02 . 1 . . . . . . . . 5177 1 1805 . 1 1 141 141 ASP CB C 13 40.1 0.3 . 1 . . . . . . . . 5177 1 1806 . 1 1 141 141 ASP HB2 H 1 2.67 0.02 . 2 . . . . . . . . 5177 1 1807 . 1 1 141 141 ASP HB3 H 1 2.77 0.02 . 2 . . . . . . . . 5177 1 1808 . 1 1 141 141 ASP C C 13 178.0 0.3 . 1 . . . . . . . . 5177 1 1809 . 1 1 142 142 ASP N N 15 117.5 0.2 . 1 . . . . . . . . 5177 1 1810 . 1 1 142 142 ASP H H 1 7.53 0.02 . 1 . . . . . . . . 5177 1 1811 . 1 1 142 142 ASP CA C 13 56.3 0.3 . 1 . . . . . . . . 5177 1 1812 . 1 1 142 142 ASP HA H 1 4.74 0.02 . 1 . . . . . . . . 5177 1 1813 . 1 1 142 142 ASP CB C 13 42.0 0.3 . 1 . . . . . . . . 5177 1 1814 . 1 1 142 142 ASP HB2 H 1 2.90 0.02 . 1 . . . . . . . . 5177 1 1815 . 1 1 142 142 ASP HB3 H 1 2.90 0.02 . 1 . . . . . . . . 5177 1 1816 . 1 1 142 142 ASP C C 13 176.9 0.3 . 1 . . . . . . . . 5177 1 1817 . 1 1 143 143 ILE N N 15 114.9 0.2 . 1 . . . . . . . . 5177 1 1818 . 1 1 143 143 ILE H H 1 7.40 0.02 . 1 . . . . . . . . 5177 1 1819 . 1 1 143 143 ILE CA C 13 61.4 0.3 . 1 . . . . . . . . 5177 1 1820 . 1 1 143 143 ILE HA H 1 4.91 0.02 . 1 . . . . . . . . 5177 1 1821 . 1 1 143 143 ILE CB C 13 41.1 0.3 . 1 . . . . . . . . 5177 1 1822 . 1 1 143 143 ILE HB H 1 1.54 0.02 . 1 . . . . . . . . 5177 1 1823 . 1 1 143 143 ILE HG21 H 1 0.89 0.02 . 1 . . . . . . . . 5177 1 1824 . 1 1 143 143 ILE HG22 H 1 0.89 0.02 . 1 . . . . . . . . 5177 1 1825 . 1 1 143 143 ILE HG23 H 1 0.89 0.02 . 1 . . . . . . . . 5177 1 1826 . 1 1 143 143 ILE CG2 C 13 16.8 0.3 . 1 . . . . . . . . 5177 1 1827 . 1 1 143 143 ILE CG1 C 13 29.0 0.3 . 1 . . . . . . . . 5177 1 1828 . 1 1 143 143 ILE HG12 H 1 1.17 0.02 . 2 . . . . . . . . 5177 1 1829 . 1 1 143 143 ILE HG13 H 1 1.59 0.02 . 2 . . . . . . . . 5177 1 1830 . 1 1 143 143 ILE HD11 H 1 0.43 0.02 . 1 . . . . . . . . 5177 1 1831 . 1 1 143 143 ILE HD12 H 1 0.43 0.02 . 1 . . . . . . . . 5177 1 1832 . 1 1 143 143 ILE HD13 H 1 0.43 0.02 . 1 . . . . . . . . 5177 1 1833 . 1 1 143 143 ILE CD1 C 13 14.4 0.3 . 1 . . . . . . . . 5177 1 1834 . 1 1 143 143 ILE C C 13 176.0 0.3 . 1 . . . . . . . . 5177 1 1835 . 1 1 144 144 LYS N N 15 120.7 0.2 . 1 . . . . . . . . 5177 1 1836 . 1 1 144 144 LYS H H 1 7.94 0.02 . 1 . . . . . . . . 5177 1 1837 . 1 1 144 144 LYS CA C 13 59.5 0.3 . 1 . . . . . . . . 5177 1 1838 . 1 1 144 144 LYS HA H 1 4.16 0.02 . 1 . . . . . . . . 5177 1 1839 . 1 1 144 144 LYS CB C 13 32.7 0.3 . 1 . . . . . . . . 5177 1 1840 . 1 1 144 144 LYS HB2 H 1 1.99 0.02 . 1 . . . . . . . . 5177 1 1841 . 1 1 144 144 LYS HB3 H 1 1.99 0.02 . 1 . . . . . . . . 5177 1 1842 . 1 1 144 144 LYS CG C 13 25.2 0.3 . 1 . . . . . . . . 5177 1 1843 . 1 1 144 144 LYS HG2 H 1 1.64 0.02 . 1 . . . . . . . . 5177 1 1844 . 1 1 144 144 LYS HG3 H 1 1.64 0.02 . 1 . . . . . . . . 5177 1 1845 . 1 1 144 144 LYS CD C 13 29.8 0.3 . 1 . . . . . . . . 5177 1 1846 . 1 1 144 144 LYS HD2 H 1 1.79 0.02 . 1 . . . . . . . . 5177 1 1847 . 1 1 144 144 LYS HD3 H 1 1.79 0.02 . 1 . . . . . . . . 5177 1 1848 . 1 1 144 144 LYS CE C 13 42.1 0.3 . 1 . . . . . . . . 5177 1 1849 . 1 1 144 144 LYS HE2 H 1 3.12 0.02 . 1 . . . . . . . . 5177 1 1850 . 1 1 144 144 LYS HE3 H 1 3.12 0.02 . 1 . . . . . . . . 5177 1 1851 . 1 1 144 144 LYS C C 13 176.2 0.3 . 1 . . . . . . . . 5177 1 1852 . 1 1 145 145 ASP N N 15 118.2 0.2 . 1 . . . . . . . . 5177 1 1853 . 1 1 145 145 ASP H H 1 7.77 0.02 . 1 . . . . . . . . 5177 1 1854 . 1 1 145 145 ASP CA C 13 53.2 0.3 . 1 . . . . . . . . 5177 1 1855 . 1 1 145 145 ASP HA H 1 4.95 0.02 . 1 . . . . . . . . 5177 1 1856 . 1 1 145 145 ASP CB C 13 41.6 0.3 . 1 . . . . . . . . 5177 1 1857 . 1 1 145 145 ASP HB2 H 1 3.19 0.02 . 2 . . . . . . . . 5177 1 1858 . 1 1 145 145 ASP HB3 H 1 2.71 0.02 . 2 . . . . . . . . 5177 1 1859 . 1 1 145 145 ASP C C 13 176.5 0.3 . 1 . . . . . . . . 5177 1 1860 . 1 1 146 146 ARG N N 15 126.3 0.2 . 1 . . . . . . . . 5177 1 1861 . 1 1 146 146 ARG H H 1 8.64 0.02 . 1 . . . . . . . . 5177 1 1862 . 1 1 146 146 ARG CA C 13 58.6 0.3 . 1 . . . . . . . . 5177 1 1863 . 1 1 146 146 ARG HA H 1 3.80 0.02 . 1 . . . . . . . . 5177 1 1864 . 1 1 146 146 ARG CB C 13 30.1 0.3 . 1 . . . . . . . . 5177 1 1865 . 1 1 146 146 ARG HB2 H 1 1.62 0.02 . 1 . . . . . . . . 5177 1 1866 . 1 1 146 146 ARG HB3 H 1 1.62 0.02 . 1 . . . . . . . . 5177 1 1867 . 1 1 146 146 ARG CG C 13 27.8 0.3 . 1 . . . . . . . . 5177 1 1868 . 1 1 146 146 ARG HG2 H 1 1.43 0.02 . 2 . . . . . . . . 5177 1 1869 . 1 1 146 146 ARG HG3 H 1 1.62 0.02 . 2 . . . . . . . . 5177 1 1870 . 1 1 146 146 ARG CD C 13 43.5 0.3 . 1 . . . . . . . . 5177 1 1871 . 1 1 146 146 ARG HD2 H 1 3.14 0.02 . 2 . . . . . . . . 5177 1 1872 . 1 1 146 146 ARG HD3 H 1 3.32 0.02 . 2 . . . . . . . . 5177 1 1873 . 1 1 146 146 ARG C C 13 176.7 0.3 . 1 . . . . . . . . 5177 1 1874 . 1 1 147 147 SER N N 15 114.4 0.2 . 1 . . . . . . . . 5177 1 1875 . 1 1 147 147 SER H H 1 8.54 0.02 . 1 . . . . . . . . 5177 1 1876 . 1 1 147 147 SER CA C 13 61.6 0.3 . 1 . . . . . . . . 5177 1 1877 . 1 1 147 147 SER HA H 1 3.99 0.02 . 1 . . . . . . . . 5177 1 1878 . 1 1 147 147 SER CB C 13 62.2 0.3 . 1 . . . . . . . . 5177 1 1879 . 1 1 147 147 SER HB2 H 1 4.00 0.02 . 1 . . . . . . . . 5177 1 1880 . 1 1 147 147 SER HB3 H 1 4.00 0.02 . 1 . . . . . . . . 5177 1 1881 . 1 1 147 147 SER C C 13 176.9 0.3 . 1 . . . . . . . . 5177 1 1882 . 1 1 148 148 THR N N 15 120.2 0.2 . 1 . . . . . . . . 5177 1 1883 . 1 1 148 148 THR H H 1 7.92 0.02 . 1 . . . . . . . . 5177 1 1884 . 1 1 148 148 THR CA C 13 65.9 0.3 . 1 . . . . . . . . 5177 1 1885 . 1 1 148 148 THR HA H 1 4.04 0.02 . 1 . . . . . . . . 5177 1 1886 . 1 1 148 148 THR CB C 13 68.2 0.3 . 1 . . . . . . . . 5177 1 1887 . 1 1 148 148 THR HB H 1 4.47 0.02 . 1 . . . . . . . . 5177 1 1888 . 1 1 148 148 THR HG21 H 1 1.35 0.02 . 1 . . . . . . . . 5177 1 1889 . 1 1 148 148 THR HG22 H 1 1.35 0.02 . 1 . . . . . . . . 5177 1 1890 . 1 1 148 148 THR HG23 H 1 1.35 0.02 . 1 . . . . . . . . 5177 1 1891 . 1 1 148 148 THR CG2 C 13 23.4 0.3 . 1 . . . . . . . . 5177 1 1892 . 1 1 148 148 THR C C 13 176.7 0.3 . 1 . . . . . . . . 5177 1 1893 . 1 1 149 149 LEU N N 15 123.7 0.2 . 1 . . . . . . . . 5177 1 1894 . 1 1 149 149 LEU H H 1 7.07 0.02 . 1 . . . . . . . . 5177 1 1895 . 1 1 149 149 LEU CA C 13 57.1 0.3 . 1 . . . . . . . . 5177 1 1896 . 1 1 149 149 LEU HA H 1 3.42 0.02 . 1 . . . . . . . . 5177 1 1897 . 1 1 149 149 LEU CB C 13 39.5 0.3 . 1 . . . . . . . . 5177 1 1898 . 1 1 149 149 LEU HB2 H 1 1.43 0.02 . 2 . . . . . . . . 5177 1 1899 . 1 1 149 149 LEU HB3 H 1 1.49 0.02 . 2 . . . . . . . . 5177 1 1900 . 1 1 149 149 LEU CG C 13 26.9 0.3 . 1 . . . . . . . . 5177 1 1901 . 1 1 149 149 LEU HG H 1 1.25 0.02 . 1 . . . . . . . . 5177 1 1902 . 1 1 149 149 LEU HD11 H 1 0.87 0.02 . 2 . . . . . . . . 5177 1 1903 . 1 1 149 149 LEU HD12 H 1 0.87 0.02 . 2 . . . . . . . . 5177 1 1904 . 1 1 149 149 LEU HD13 H 1 0.87 0.02 . 2 . . . . . . . . 5177 1 1905 . 1 1 149 149 LEU HD21 H 1 0.68 0.02 . 2 . . . . . . . . 5177 1 1906 . 1 1 149 149 LEU HD22 H 1 0.68 0.02 . 2 . . . . . . . . 5177 1 1907 . 1 1 149 149 LEU HD23 H 1 0.68 0.02 . 2 . . . . . . . . 5177 1 1908 . 1 1 149 149 LEU CD1 C 13 26.6 0.3 . 1 . . . . . . . . 5177 1 1909 . 1 1 149 149 LEU CD2 C 13 22.6 0.3 . 1 . . . . . . . . 5177 1 1910 . 1 1 149 149 LEU C C 13 178.3 0.3 . 1 . . . . . . . . 5177 1 1911 . 1 1 150 150 GLY N N 15 104.6 0.2 . 1 . . . . . . . . 5177 1 1912 . 1 1 150 150 GLY H H 1 8.09 0.02 . 1 . . . . . . . . 5177 1 1913 . 1 1 150 150 GLY CA C 13 48.0 0.3 . 1 . . . . . . . . 5177 1 1914 . 1 1 150 150 GLY HA2 H 1 3.55 0.02 . 2 . . . . . . . . 5177 1 1915 . 1 1 150 150 GLY HA3 H 1 3.25 0.02 . 2 . . . . . . . . 5177 1 1916 . 1 1 151 151 GLU N N 15 120.1 0.2 . 1 . . . . . . . . 5177 1 1917 . 1 1 151 151 GLU H H 1 7.91 0.02 . 1 . . . . . . . . 5177 1 1918 . 1 1 151 151 GLU CA C 13 59.4 0.3 . 1 . . . . . . . . 5177 1 1919 . 1 1 151 151 GLU HA H 1 3.97 0.02 . 1 . . . . . . . . 5177 1 1920 . 1 1 151 151 GLU CB C 13 29.2 0.3 . 1 . . . . . . . . 5177 1 1921 . 1 1 151 151 GLU HB2 H 1 2.07 0.02 . 1 . . . . . . . . 5177 1 1922 . 1 1 151 151 GLU HB3 H 1 2.07 0.02 . 1 . . . . . . . . 5177 1 1923 . 1 1 151 151 GLU CG C 13 36.3 0.3 . 1 . . . . . . . . 5177 1 1924 . 1 1 151 151 GLU HG2 H 1 2.32 0.02 . 1 . . . . . . . . 5177 1 1925 . 1 1 151 151 GLU HG3 H 1 2.32 0.02 . 1 . . . . . . . . 5177 1 1926 . 1 1 151 151 GLU C C 13 179.7 0.3 . 1 . . . . . . . . 5177 1 1927 . 1 1 152 152 LYS N N 15 120.6 0.2 . 1 . . . . . . . . 5177 1 1928 . 1 1 152 152 LYS H H 1 7.40 0.02 . 1 . . . . . . . . 5177 1 1929 . 1 1 152 152 LYS CA C 13 57.9 0.3 . 1 . . . . . . . . 5177 1 1930 . 1 1 152 152 LYS HA H 1 3.98 0.02 . 1 . . . . . . . . 5177 1 1931 . 1 1 152 152 LYS CB C 13 31.0 0.3 . 1 . . . . . . . . 5177 1 1932 . 1 1 152 152 LYS HB2 H 1 1.57 0.02 . 1 . . . . . . . . 5177 1 1933 . 1 1 152 152 LYS HB3 H 1 1.57 0.02 . 1 . . . . . . . . 5177 1 1934 . 1 1 152 152 LYS CG C 13 23.8 0.3 . 1 . . . . . . . . 5177 1 1935 . 1 1 152 152 LYS HG2 H 1 0.97 0.02 . 2 . . . . . . . . 5177 1 1936 . 1 1 152 152 LYS HG3 H 1 1.08 0.02 . 2 . . . . . . . . 5177 1 1937 . 1 1 152 152 LYS CD C 13 27.8 0.3 . 1 . . . . . . . . 5177 1 1938 . 1 1 152 152 LYS HD2 H 1 1.29 0.02 . 2 . . . . . . . . 5177 1 1939 . 1 1 152 152 LYS HD3 H 1 1.39 0.02 . 2 . . . . . . . . 5177 1 1940 . 1 1 152 152 LYS CE C 13 41.3 0.3 . 1 . . . . . . . . 5177 1 1941 . 1 1 152 152 LYS HE2 H 1 2.66 0.02 . 2 . . . . . . . . 5177 1 1942 . 1 1 152 152 LYS HE3 H 1 2.71 0.02 . 2 . . . . . . . . 5177 1 1943 . 1 1 152 152 LYS C C 13 177.9 0.3 . 1 . . . . . . . . 5177 1 1944 . 1 1 153 153 LEU N N 15 116.1 0.2 . 1 . . . . . . . . 5177 1 1945 . 1 1 153 153 LEU H H 1 7.51 0.02 . 1 . . . . . . . . 5177 1 1946 . 1 1 153 153 LEU CA C 13 55.8 0.3 . 1 . . . . . . . . 5177 1 1947 . 1 1 153 153 LEU HA H 1 3.72 0.02 . 1 . . . . . . . . 5177 1 1948 . 1 1 153 153 LEU CB C 13 41.7 0.3 . 1 . . . . . . . . 5177 1 1949 . 1 1 153 153 LEU HB2 H 1 0.57 0.02 . 2 . . . . . . . . 5177 1 1950 . 1 1 153 153 LEU HB3 H 1 1.15 0.02 . 2 . . . . . . . . 5177 1 1951 . 1 1 153 153 LEU CG C 13 25.6 0.3 . 1 . . . . . . . . 5177 1 1952 . 1 1 153 153 LEU HG H 1 1.24 0.02 . 1 . . . . . . . . 5177 1 1953 . 1 1 153 153 LEU CD1 C 13 20.4 0.3 . 1 . . . . . . . . 5177 1 1954 . 1 1 153 153 LEU CD2 C 13 25.3 0.3 . 1 . . . . . . . . 5177 1 1955 . 1 1 153 153 LEU HD11 H 1 -0.02 0.02 . 1 . . . . . . . . 5177 1 1956 . 1 1 153 153 LEU HD12 H 1 -0.02 0.02 . 1 . . . . . . . . 5177 1 1957 . 1 1 153 153 LEU HD13 H 1 -0.02 0.02 . 1 . . . . . . . . 5177 1 1958 . 1 1 153 153 LEU HD21 H 1 -0.02 0.02 . 1 . . . . . . . . 5177 1 1959 . 1 1 153 153 LEU HD22 H 1 -0.02 0.02 . 1 . . . . . . . . 5177 1 1960 . 1 1 153 153 LEU HD23 H 1 -0.02 0.02 . 1 . . . . . . . . 5177 1 1961 . 1 1 153 153 LEU C C 13 177.3 0.3 . 1 . . . . . . . . 5177 1 1962 . 1 1 154 154 GLY N N 15 103.2 0.2 . 1 . . . . . . . . 5177 1 1963 . 1 1 154 154 GLY H H 1 7.51 0.02 . 1 . . . . . . . . 5177 1 1964 . 1 1 154 154 GLY CA C 13 46.2 0.3 . 1 . . . . . . . . 5177 1 1965 . 1 1 154 154 GLY HA2 H 1 4.19 0.02 . 2 . . . . . . . . 5177 1 1966 . 1 1 154 154 GLY HA3 H 1 3.83 0.02 . 2 . . . . . . . . 5177 1 1967 . 1 1 154 154 GLY C C 13 174.3 0.3 . 1 . . . . . . . . 5177 1 1968 . 1 1 155 155 GLY N N 15 112.9 0.2 . 1 . . . . . . . . 5177 1 1969 . 1 1 155 155 GLY H H 1 8.71 0.02 . 1 . . . . . . . . 5177 1 1970 . 1 1 155 155 GLY CA C 13 46.6 0.3 . 1 . . . . . . . . 5177 1 1971 . 1 1 155 155 GLY HA2 H 1 4.21 0.02 . 2 . . . . . . . . 5177 1 1972 . 1 1 155 155 GLY HA3 H 1 3.84 0.02 . 2 . . . . . . . . 5177 1 1973 . 1 1 155 155 GLY C C 13 175.1 0.3 . 1 . . . . . . . . 5177 1 1974 . 1 1 156 156 ASN N N 15 122.2 0.2 . 1 . . . . . . . . 5177 1 1975 . 1 1 156 156 ASN H H 1 8.81 0.02 . 1 . . . . . . . . 5177 1 1976 . 1 1 156 156 ASN CA C 13 54.6 0.3 . 1 . . . . . . . . 5177 1 1977 . 1 1 156 156 ASN HA H 1 4.63 0.02 . 1 . . . . . . . . 5177 1 1978 . 1 1 156 156 ASN CB C 13 38.0 0.3 . 1 . . . . . . . . 5177 1 1979 . 1 1 156 156 ASN HB2 H 1 2.91 0.02 . 2 . . . . . . . . 5177 1 1980 . 1 1 156 156 ASN HB3 H 1 3.06 0.02 . 2 . . . . . . . . 5177 1 1981 . 1 1 156 156 ASN CG C 13 177.0 0.3 . 1 . . . . . . . . 5177 1 1982 . 1 1 156 156 ASN ND2 N 15 111.2 0.2 . 1 . . . . . . . . 5177 1 1983 . 1 1 156 156 ASN HD21 H 1 6.90 0.02 . 2 . . . . . . . . 5177 1 1984 . 1 1 156 156 ASN HD22 H 1 7.65 0.02 . 2 . . . . . . . . 5177 1 1985 . 1 1 156 156 ASN C C 13 176.0 0.3 . 1 . . . . . . . . 5177 1 1986 . 1 1 157 157 VAL N N 15 110.8 0.2 . 1 . . . . . . . . 5177 1 1987 . 1 1 157 157 VAL H H 1 7.20 0.02 . 1 . . . . . . . . 5177 1 1988 . 1 1 157 157 VAL CA C 13 61.6 0.3 . 1 . . . . . . . . 5177 1 1989 . 1 1 157 157 VAL HA H 1 4.36 0.02 . 1 . . . . . . . . 5177 1 1990 . 1 1 157 157 VAL CB C 13 32.2 0.3 . 1 . . . . . . . . 5177 1 1991 . 1 1 157 157 VAL HB H 1 2.53 0.02 . 1 . . . . . . . . 5177 1 1992 . 1 1 157 157 VAL CG1 C 13 19.1 0.3 . 1 . . . . . . . . 5177 1 1993 . 1 1 157 157 VAL CG2 C 13 21.5 0.3 . 1 . . . . . . . . 5177 1 1994 . 1 1 157 157 VAL HG11 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1995 . 1 1 157 157 VAL HG12 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1996 . 1 1 157 157 VAL HG13 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1997 . 1 1 157 157 VAL HG21 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1998 . 1 1 157 157 VAL HG22 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 1999 . 1 1 157 157 VAL HG23 H 1 1.08 0.02 . 1 . . . . . . . . 5177 1 2000 . 1 1 157 157 VAL C C 13 175.7 0.3 . 1 . . . . . . . . 5177 1 2001 . 1 1 158 158 VAL N N 15 123.1 0.2 . 1 . . . . . . . . 5177 1 2002 . 1 1 158 158 VAL H H 1 7.59 0.02 . 1 . . . . . . . . 5177 1 2003 . 1 1 158 158 VAL CA C 13 63.8 0.3 . 1 . . . . . . . . 5177 1 2004 . 1 1 158 158 VAL HA H 1 4.10 0.02 . 1 . . . . . . . . 5177 1 2005 . 1 1 158 158 VAL CB C 13 31.7 0.3 . 1 . . . . . . . . 5177 1 2006 . 1 1 158 158 VAL HB H 1 2.06 0.02 . 1 . . . . . . . . 5177 1 2007 . 1 1 158 158 VAL HG11 H 1 0.96 0.02 . 2 . . . . . . . . 5177 1 2008 . 1 1 158 158 VAL HG12 H 1 0.96 0.02 . 2 . . . . . . . . 5177 1 2009 . 1 1 158 158 VAL HG13 H 1 0.96 0.02 . 2 . . . . . . . . 5177 1 2010 . 1 1 158 158 VAL HG21 H 1 0.91 0.02 . 2 . . . . . . . . 5177 1 2011 . 1 1 158 158 VAL HG22 H 1 0.91 0.02 . 2 . . . . . . . . 5177 1 2012 . 1 1 158 158 VAL HG23 H 1 0.91 0.02 . 2 . . . . . . . . 5177 1 2013 . 1 1 158 158 VAL CG1 C 13 22.6 0.3 . 1 . . . . . . . . 5177 1 2014 . 1 1 158 158 VAL CG2 C 13 22.5 0.3 . 1 . . . . . . . . 5177 1 2015 . 1 1 158 158 VAL C C 13 175.3 0.3 . 1 . . . . . . . . 5177 1 2016 . 1 1 159 159 VAL N N 15 122.3 0.2 . 1 . . . . . . . . 5177 1 2017 . 1 1 159 159 VAL H H 1 8.99 0.02 . 1 . . . . . . . . 5177 1 2018 . 1 1 159 159 VAL CA C 13 62.4 0.3 . 1 . . . . . . . . 5177 1 2019 . 1 1 159 159 VAL HA H 1 4.41 0.02 . 1 . . . . . . . . 5177 1 2020 . 1 1 159 159 VAL CB C 13 33.6 0.3 . 1 . . . . . . . . 5177 1 2021 . 1 1 159 159 VAL HB H 1 2.07 0.02 . 1 . . . . . . . . 5177 1 2022 . 1 1 159 159 VAL HG11 H 1 0.93 0.02 . 2 . . . . . . . . 5177 1 2023 . 1 1 159 159 VAL HG12 H 1 0.93 0.02 . 2 . . . . . . . . 5177 1 2024 . 1 1 159 159 VAL HG13 H 1 0.93 0.02 . 2 . . . . . . . . 5177 1 2025 . 1 1 159 159 VAL HG21 H 1 0.77 0.02 . 2 . . . . . . . . 5177 1 2026 . 1 1 159 159 VAL HG22 H 1 0.77 0.02 . 2 . . . . . . . . 5177 1 2027 . 1 1 159 159 VAL HG23 H 1 0.77 0.02 . 2 . . . . . . . . 5177 1 2028 . 1 1 159 159 VAL CG1 C 13 21.5 0.3 . 1 . . . . . . . . 5177 1 2029 . 1 1 159 159 VAL CG2 C 13 19.7 0.3 . 1 . . . . . . . . 5177 1 2030 . 1 1 159 159 VAL C C 13 176.7 0.3 . 1 . . . . . . . . 5177 1 2031 . 1 1 160 160 SER N N 15 115.4 0.2 . 1 . . . . . . . . 5177 1 2032 . 1 1 160 160 SER H H 1 7.91 0.02 . 1 . . . . . . . . 5177 1 2033 . 1 1 160 160 SER CA C 13 57.3 0.3 . 1 . . . . . . . . 5177 1 2034 . 1 1 160 160 SER HA H 1 4.84 0.02 . 1 . . . . . . . . 5177 1 2035 . 1 1 160 160 SER CB C 13 65.1 0.3 . 1 . . . . . . . . 5177 1 2036 . 1 1 160 160 SER HB2 H 1 3.44 0.02 . 2 . . . . . . . . 5177 1 2037 . 1 1 160 160 SER HB3 H 1 3.68 0.02 . 2 . . . . . . . . 5177 1 2038 . 1 1 160 160 SER C C 13 171.2 0.3 . 1 . . . . . . . . 5177 1 2039 . 1 1 161 161 LEU N N 15 121.6 0.2 . 1 . . . . . . . . 5177 1 2040 . 1 1 161 161 LEU H H 1 8.46 0.02 . 1 . . . . . . . . 5177 1 2041 . 1 1 161 161 LEU CA C 13 55.1 0.3 . 1 . . . . . . . . 5177 1 2042 . 1 1 161 161 LEU HA H 1 4.94 0.02 . 1 . . . . . . . . 5177 1 2043 . 1 1 161 161 LEU CB C 13 46.0 0.3 . 1 . . . . . . . . 5177 1 2044 . 1 1 161 161 LEU HB2 H 1 1.25 0.02 . 2 . . . . . . . . 5177 1 2045 . 1 1 161 161 LEU HB3 H 1 1.70 0.02 . 2 . . . . . . . . 5177 1 2046 . 1 1 161 161 LEU CG C 13 28.1 0.3 . 1 . . . . . . . . 5177 1 2047 . 1 1 161 161 LEU HG H 1 1.64 0.02 . 1 . . . . . . . . 5177 1 2048 . 1 1 161 161 LEU HD11 H 1 0.70 0.02 . 2 . . . . . . . . 5177 1 2049 . 1 1 161 161 LEU HD12 H 1 0.70 0.02 . 2 . . . . . . . . 5177 1 2050 . 1 1 161 161 LEU HD13 H 1 0.70 0.02 . 2 . . . . . . . . 5177 1 2051 . 1 1 161 161 LEU HD21 H 1 0.96 0.02 . 2 . . . . . . . . 5177 1 2052 . 1 1 161 161 LEU HD22 H 1 0.96 0.02 . 2 . . . . . . . . 5177 1 2053 . 1 1 161 161 LEU HD23 H 1 0.96 0.02 . 2 . . . . . . . . 5177 1 2054 . 1 1 161 161 LEU CD1 C 13 26.6 0.3 . 1 . . . . . . . . 5177 1 2055 . 1 1 161 161 LEU CD2 C 13 24.1 0.3 . 1 . . . . . . . . 5177 1 2056 . 1 1 161 161 LEU C C 13 176.3 0.3 . 1 . . . . . . . . 5177 1 2057 . 1 1 162 162 GLU N N 15 126.8 0.2 . 1 . . . . . . . . 5177 1 2058 . 1 1 162 162 GLU H H 1 9.97 0.02 . 1 . . . . . . . . 5177 1 2059 . 1 1 162 162 GLU CA C 13 56.1 0.3 . 1 . . . . . . . . 5177 1 2060 . 1 1 162 162 GLU HA H 1 4.20 0.02 . 1 . . . . . . . . 5177 1 2061 . 1 1 162 162 GLU CB C 13 26.3 0.3 . 1 . . . . . . . . 5177 1 2062 . 1 1 162 162 GLU HB2 H 1 2.17 0.02 . 2 . . . . . . . . 5177 1 2063 . 1 1 162 162 GLU HB3 H 1 2.37 0.02 . 2 . . . . . . . . 5177 1 2064 . 1 1 162 162 GLU CG C 13 35.0 0.3 . 1 . . . . . . . . 5177 1 2065 . 1 1 162 162 GLU HG2 H 1 2.62 0.02 . 1 . . . . . . . . 5177 1 2066 . 1 1 162 162 GLU HG3 H 1 2.62 0.02 . 1 . . . . . . . . 5177 1 2067 . 1 1 162 162 GLU C C 13 176.9 0.3 . 1 . . . . . . . . 5177 1 2068 . 1 1 163 163 GLY N N 15 106.2 0.2 . 1 . . . . . . . . 5177 1 2069 . 1 1 163 163 GLY H H 1 9.61 0.02 . 1 . . . . . . . . 5177 1 2070 . 1 1 163 163 GLY CA C 13 45.3 0.3 . 1 . . . . . . . . 5177 1 2071 . 1 1 163 163 GLY HA2 H 1 4.22 0.02 . 2 . . . . . . . . 5177 1 2072 . 1 1 163 163 GLY HA3 H 1 3.64 0.02 . 2 . . . . . . . . 5177 1 2073 . 1 1 163 163 GLY C C 13 174.1 0.3 . 1 . . . . . . . . 5177 1 2074 . 1 1 164 164 LYS N N 15 121.6 0.2 . 1 . . . . . . . . 5177 1 2075 . 1 1 164 164 LYS H H 1 7.65 0.02 . 1 . . . . . . . . 5177 1 2076 . 1 1 164 164 LYS CA C 13 52.6 0.3 . 1 . . . . . . . . 5177 1 2077 . 1 1 164 164 LYS HA H 1 5.03 0.02 . 1 . . . . . . . . 5177 1 2078 . 1 1 164 164 LYS CB C 13 33.8 0.3 . 1 . . . . . . . . 5177 1 2079 . 1 1 164 164 LYS HB2 H 1 1.79 0.02 . 2 . . . . . . . . 5177 1 2080 . 1 1 164 164 LYS HB3 H 1 1.93 0.02 . 2 . . . . . . . . 5177 1 2081 . 1 1 164 164 LYS CG C 13 24.8 0.3 . 1 . . . . . . . . 5177 1 2082 . 1 1 164 164 LYS HG2 H 1 1.52 0.02 . 2 . . . . . . . . 5177 1 2083 . 1 1 164 164 LYS HG3 H 1 1.59 0.02 . 2 . . . . . . . . 5177 1 2084 . 1 1 164 164 LYS CD C 13 28.8 0.3 . 1 . . . . . . . . 5177 1 2085 . 1 1 164 164 LYS HD2 H 1 1.79 0.02 . 1 . . . . . . . . 5177 1 2086 . 1 1 164 164 LYS HD3 H 1 1.79 0.02 . 1 . . . . . . . . 5177 1 2087 . 1 1 164 164 LYS CE C 13 42.2 0.3 . 1 . . . . . . . . 5177 1 2088 . 1 1 164 164 LYS HE2 H 1 3.15 0.02 . 1 . . . . . . . . 5177 1 2089 . 1 1 164 164 LYS HE3 H 1 3.15 0.02 . 1 . . . . . . . . 5177 1 2090 . 1 1 165 165 PRO CD C 13 51.3 0.3 . 1 . . . . . . . . 5177 1 2091 . 1 1 165 165 PRO CA C 13 63.1 0.3 . 1 . . . . . . . . 5177 1 2092 . 1 1 165 165 PRO HA H 1 4.56 0.02 . 1 . . . . . . . . 5177 1 2093 . 1 1 165 165 PRO CB C 13 32.2 0.3 . 1 . . . . . . . . 5177 1 2094 . 1 1 165 165 PRO HB2 H 1 2.03 0.02 . 2 . . . . . . . . 5177 1 2095 . 1 1 165 165 PRO HB3 H 1 2.46 0.02 . 2 . . . . . . . . 5177 1 2096 . 1 1 165 165 PRO CG C 13 27.5 0.3 . 1 . . . . . . . . 5177 1 2097 . 1 1 165 165 PRO HG2 H 1 2.06 0.02 . 2 . . . . . . . . 5177 1 2098 . 1 1 165 165 PRO HG3 H 1 2.17 0.02 . 2 . . . . . . . . 5177 1 2099 . 1 1 165 165 PRO HD2 H 1 3.75 0.02 . 2 . . . . . . . . 5177 1 2100 . 1 1 165 165 PRO HD3 H 1 4.00 0.02 . 2 . . . . . . . . 5177 1 2101 . 1 1 165 165 PRO C C 13 176.3 0.3 . 1 . . . . . . . . 5177 1 2102 . 1 1 166 166 LEU N N 15 128.9 0.2 . 1 . . . . . . . . 5177 1 2103 . 1 1 166 166 LEU H H 1 7.67 0.02 . 1 . . . . . . . . 5177 1 2104 . 1 1 166 166 LEU CA C 13 56.6 0.3 . 1 . . . . . . . . 5177 1 2105 . 1 1 166 166 LEU HA H 1 4.15 0.02 . 1 . . . . . . . . 5177 1 2106 . 1 1 166 166 LEU CB C 13 42.9 0.3 . 1 . . . . . . . . 5177 1 2107 . 1 1 166 166 LEU HB2 H 1 1.46 0.02 . 2 . . . . . . . . 5177 1 2108 . 1 1 166 166 LEU HB3 H 1 1.55 0.02 . 2 . . . . . . . . 5177 1 2109 . 1 1 166 166 LEU CG C 13 28.0 0.3 . 1 . . . . . . . . 5177 1 2110 . 1 1 166 166 LEU HG H 1 1.47 0.02 . 1 . . . . . . . . 5177 1 2111 . 1 1 166 166 LEU HD11 H 1 0.75 0.02 . 1 . . . . . . . . 5177 1 2112 . 1 1 166 166 LEU HD12 H 1 0.75 0.02 . 1 . . . . . . . . 5177 1 2113 . 1 1 166 166 LEU HD13 H 1 0.75 0.02 . 1 . . . . . . . . 5177 1 2114 . 1 1 166 166 LEU HD21 H 1 0.75 0.02 . 1 . . . . . . . . 5177 1 2115 . 1 1 166 166 LEU HD22 H 1 0.75 0.02 . 1 . . . . . . . . 5177 1 2116 . 1 1 166 166 LEU HD23 H 1 0.75 0.02 . 1 . . . . . . . . 5177 1 2117 . 1 1 166 166 LEU CD1 C 13 24.5 0.3 . 1 . . . . . . . . 5177 1 2118 . 1 1 166 166 LEU CD2 C 13 26.3 0.3 . 1 . . . . . . . . 5177 1 stop_ save_