data_4345 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4345 _Entry.Title ; 1H, 13C, and 15N Chemical Shift Assignments for Yeast Ribosomal Protein L30 in Complex with Its mRNA in Solution ; _Entry.Type . _Entry.Version_type original _Entry.Submission_date 1999-05-07 _Entry.Accession_date 1999-05-10 _Entry.Last_release_date 2000-03-08 _Entry.Original_release_date 2000-03-08 _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 'both the protein and RNA chemical shifts are provided here.' _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 Hongyuan Mao . . . 4345 2 Susan White . A. . 4345 3 james Williamson . R. . 4345 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 4345 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 648 4345 '15N chemical shifts' 138 4345 '1H chemical shifts' 1009 4345 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 . . 2000-03-08 1999-05-07 original author . 4345 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 4346 . 4345 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4345 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code 20051011 _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation ; Mao, H. N., White, S. A., and Williamson, J. R., "A Novel Loop-loop Recognition Motif in the Yeast Ribosomal Protein L30 Autoregulatory RNA Complex," Nat. Struct. Biol. 6, 1139-1147 (1999). ; _Citation.Title ; A Novel Loop-loop Recognition Motif in the Yeast Ribosomal Protein L30 Autoregulatory RNA Complex ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Struct. Biol.' _Citation.Journal_name_full 'Nature Structural Biology' _Citation.Journal_volume 6 _Citation.Journal_issue 12 _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 1139 _Citation.Page_last 1147 _Citation.Year 1999 _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 Hongyuan Mao . . . 4345 1 2 Susan White . A. . 4345 1 3 james Williamson . R. . 4345 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'AUTO-REGULATION OF PRE-MRNA SPLICING AND MRNA TRANSLATION' 4345 1 'PROTEIN-RNA COMPLEX' 4345 1 'RIBOSOMAL PROTEIN' 4345 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_L30-MRNA _Assembly.Sf_category assembly _Assembly.Sf_framecode L30-MRNA _Assembly.Entry_ID 4345 _Assembly.ID 1 _Assembly.Name 'L30-MRNA COMPLEX' _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 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details ; THE PROTEIN STUDIED IS IN COMPLEX WITH ITS REGULATORY MRNA HAIRPIN. THE RNA USED IN THE NMR STUDIES IS ONLY A SMALL FRACTION OF THE PRE-MRNA. DETAILED DESCRIPTION CAN BE FOUND IN THE REFERENCE PAPER. ; _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 4345 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 'L30 PROTEIN' 1 $RPL30 . . . native . . . . . 4345 1 2 'L30 MRNA' 2 $L30N . . . native . . . . . 4345 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID L30-MRNA abbreviation 4345 1 'L30-MRNA COMPLEX' system 4345 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'eukaryotic ribosomal protein, autoregulation of its synthesis.' 4345 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_RPL30 _Entity.Sf_category entity _Entity.Sf_framecode RPL30 _Entity.Entry_ID 4345 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'YEAST (SACCHAROMYCES CEREVISIAE) RIBOSOMAL PROTEIN L30' _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 ; APVKSQESINQKLALVIKSG KYTLGYKSTVKSLRQGKSKL IIIAANTPVLRKSELEYYAM LSKTKVYYFQGGNNELGTAV GKLFRVGVVSILEAGDSDIL TTLA ; _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 104 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 11284 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-24 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 4339 . "RIBOSOMAL PROTEIN L30" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 2 no PDB 1CK2 . "Yeast (Saccharomyces Cerevisiae) Ribosomal Protein L30" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 3 no PDB 1CN7 . "Yeast Ribosomal Protein L30" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 4 no PDB 1NMU . Mbp-L30 . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 5 no PDB 1T0K . "Joint X-ray And Nmr Refinement Of Yeast L30e-mrna Complex" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 6 no PDB 1VW8 . "S. Cerevisiae 80s Ribosome Bound With Taura Syndrome Virus (tsv) Ires, 5 Degree Rotation (class Ii). This Entry Contains The La" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 7 no PDB 1VWU . "S. Cerevisiae 80s Ribosome Bound With Taura Syndrome Virus (tsv) Ires, 2 Degree Rotation (class I). This Entry Contains The Lar" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 8 no PDB 1VXV . "Structures Of Yeast 80s Ribosome-trna Complexes In The Rotated And Non-rotated Conformations (class Ii - Rotated Ribosome With " . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 9 no PDB 1VXY . "Structures Of Yeast 80s Ribosome-trna Complexes In The Rotated And Non-rotated Conformations (class I - Non-rotated Ribosome Wi" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 10 no PDB 3IZS . "Localization Of The Large Subunit Ribosomal Proteins Into A 6.1 A Cryo-Em Map Of Saccharomyces Cerevisiae Translating 80s Ribos" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 11 no PDB 3J65 . "Arx1 Pre-60s Particle. This Entry Contains The R-proteins And Biogenesis Factors." . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 12 no PDB 3JYW . "Structure Of The 60s Proteins For Eukaryotic Ribosome Based On Cryo-Em Map Of Thermomyces Lanuginosus Ribosome At 8.9a Resoluti" . . . . . 94.23 98 100.00 100.00 1.45e-60 . . . . 4345 1 13 no PDB 3O58 . "Yeast 80s Ribosome. This Entry Consists Of The 60s Subunit Of The First 80s In The Asymmetric Unit." . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 14 no PDB 3O5H . "Yeast 80s Ribosome. This Entry Consists Of The 60s Subunit Of The Second 80s In The Asymmetric Unit." . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 15 no PDB 3U5E . "The Structure Of The Eukaryotic Ribosome At 3.0 A Resolution. This Entry Contains Proteins Of The 60s Subunit, Ribosome A" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 16 no PDB 3U5I . "The Structure Of The Eukaryotic Ribosome At 3.0 A Resolution. This Entry Contains Proteins Of The 60s Subunit, Ribosome B" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 17 no PDB 4B6A . "Cryo-Em Structure Of The 60s Ribosomal Subunit In Complex With Arx1 And Rei1" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 18 no PDB 4BYN . "Cryo-em Reconstruction Of The 80s-eif5b-met-itrnamet Eukaryotic Translation Initiation Complex" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 19 no PDB 4BYU . "Cryo-em Reconstruction Of The 80s-eif5b-met-itrnamet Eukaryotic Translation Initiation Complex" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 20 no PDB 4CUW . "Kluyveromyces Lactis 80s Ribosome In Complex With Crpv-ires" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 21 no PDB 4UJH . "Crystal Structure Of Narciclasine Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 22 no PDB 4UJJ . "Crystal Structure Of Narciclasine Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 23 no PDB 4UJM . "Crystal Structure Of Lycorine Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 24 no PDB 4UJO . "Crystal Structure Of Lycorine Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 25 no PDB 4UJR . "Crystal Structure Of Lactimidomycin Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 26 no PDB 4UJT . "Crystal Structure Of Lactimidomycin Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 27 no PDB 4UJW . "Crystal Structure Of T-2 Toxin Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 28 no PDB 4UJY . "Crystal Structure Of T-2 Toxin Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 29 no PDB 4UK1 . "Crystal Structure Of Anisomycin Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 30 no PDB 4UK3 . "Crystal Structure Of Anisomycin Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 31 no PDB 4UK6 . "Crystal Structure Of Cca Trinucleotide Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 32 no PDB 4UK8 . "Crystal Structure Of Cca Trinucleotide Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 33 no PDB 4UKB . "Crystal Structure Of Cycloheximide Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 34 no PDB 4UKE . "Crystal Structure Of Cycloheximide Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 35 no PDB 4UKH . "Crystal Structure Of Blasticidin S Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 36 no PDB 4UKJ . "Crystal Structure Of Blasticidin S Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 37 no PDB 4UKM . "Crystal Structure Of Cryptopleurine Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 38 no PDB 4UKO . "Crystal Structure Of Cryptopleurine Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 39 no PDB 4UKR . "Crystal Structure Of Deoxynivalenol Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 40 no PDB 4UKT . "Crystal Structure Of Deoxynivalenol Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 41 no PDB 4UKW . "Crystal Structure Of Edeine Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 42 no PDB 4UKY . "Crystal Structure Of Edeine Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 43 no PDB 4UL1 . "Crystal Structure Of Geneticin Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 44 no PDB 4UL3 . "Crystal Structure Of Geneticin Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 45 no PDB 4UL6 . "Crystal Structure Of Homoharringtonine Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 46 no PDB 4UL8 . "Crystal Structure Of Homoharringtonine Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 47 no PDB 4ULB . "Crystal Structure Of Nagilactone C Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 48 no PDB 4ULD . "Crystal Structure Of Nagilactone C Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 49 no PDB 4ULG . "Crystal Structure Of Pactamycin Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 50 no PDB 4ULI . "Crystal Structure Of Pactamycin Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 51 no PDB 4ULM . "Crystal Structure Of Phyllanthoside Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 52 no PDB 4ULO . "Crystal Structure Of Phyllanthoside Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 53 no PDB 4ULR . "Crystal Structure Of Verrucarin Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 54 no PDB 4ULT . "Crystal Structure Of Verrucarin Bound To The Yeast 80s Ribosome" . . . . . 100.00 104 100.00 100.00 2.87e-65 . . . . 4345 1 55 no DBJ GAA23357 . "K7_Rpl30p [Saccharomyces cerevisiae Kyokai no. 7]" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 56 no EMBL CAA96731 . "RPL32 [Saccharomyces cerevisiae]" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 57 no EMBL CAY79728 . "Rpl30p [Saccharomyces cerevisiae EC1118]" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 58 no EMBL CCD24685 . "hypothetical protein NDAI_0D03710 [Naumovozyma dairenensis CBS 421]" . . . . . 100.00 105 99.04 100.00 6.20e-65 . . . . 4345 1 59 no EMBL CEP64155 . "LALA0S10e03686g1_1 [Lachancea lanzarotensis]" . . . . . 100.00 105 97.12 100.00 4.82e-64 . . . . 4345 1 60 no GB AAA35005 . "ribosomal protein L32 [Saccharomyces cerevisiae]" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 61 no GB AHY79340 . "Rpl30p [Saccharomyces cerevisiae YJM993]" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 62 no GB AJP38758 . "Rpl30p [Saccharomyces cerevisiae YJM1078]" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 63 no GB AJR76078 . "Rpl30p [Saccharomyces cerevisiae YJM189]" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 64 no GB AJR76578 . "Rpl30p [Saccharomyces cerevisiae YJM193]" . . . . . 100.00 105 99.04 99.04 3.22e-64 . . . . 4345 1 65 no REF NP_011485 . "ribosomal 60S subunit protein L30 [Saccharomyces cerevisiae S288c]" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 66 no REF XP_003669928 . "ribosomal protein L30 [Naumovozyma dairenensis CBS 421]" . . . . . 100.00 105 99.04 100.00 6.20e-65 . . . . 4345 1 67 no SP P14120 . "RecName: Full=60S ribosomal protein L30; AltName: Full=L32; AltName: Full=RP73; AltName: Full=YL38" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 68 no TPG DAA08069 . "TPA: ribosomal 60S subunit protein L30 [Saccharomyces cerevisiae S288c]" . . . . . 100.00 105 100.00 100.00 2.77e-65 . . . . 4345 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID RPL30 abbreviation 4345 1 'YEAST (SACCHAROMYCES CEREVISIAE) RIBOSOMAL PROTEIN L30' common 4345 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 2 ALA . 4345 1 2 3 PRO . 4345 1 3 4 VAL . 4345 1 4 5 LYS . 4345 1 5 6 SER . 4345 1 6 7 GLN . 4345 1 7 8 GLU . 4345 1 8 9 SER . 4345 1 9 10 ILE . 4345 1 10 11 ASN . 4345 1 11 12 GLN . 4345 1 12 13 LYS . 4345 1 13 14 LEU . 4345 1 14 15 ALA . 4345 1 15 16 LEU . 4345 1 16 17 VAL . 4345 1 17 18 ILE . 4345 1 18 19 LYS . 4345 1 19 20 SER . 4345 1 20 21 GLY . 4345 1 21 22 LYS . 4345 1 22 23 TYR . 4345 1 23 24 THR . 4345 1 24 25 LEU . 4345 1 25 26 GLY . 4345 1 26 27 TYR . 4345 1 27 28 LYS . 4345 1 28 29 SER . 4345 1 29 30 THR . 4345 1 30 31 VAL . 4345 1 31 32 LYS . 4345 1 32 33 SER . 4345 1 33 34 LEU . 4345 1 34 35 ARG . 4345 1 35 36 GLN . 4345 1 36 37 GLY . 4345 1 37 38 LYS . 4345 1 38 39 SER . 4345 1 39 40 LYS . 4345 1 40 41 LEU . 4345 1 41 42 ILE . 4345 1 42 43 ILE . 4345 1 43 44 ILE . 4345 1 44 45 ALA . 4345 1 45 46 ALA . 4345 1 46 47 ASN . 4345 1 47 48 THR . 4345 1 48 49 PRO . 4345 1 49 50 VAL . 4345 1 50 51 LEU . 4345 1 51 52 ARG . 4345 1 52 53 LYS . 4345 1 53 54 SER . 4345 1 54 55 GLU . 4345 1 55 56 LEU . 4345 1 56 57 GLU . 4345 1 57 58 TYR . 4345 1 58 59 TYR . 4345 1 59 60 ALA . 4345 1 60 61 MET . 4345 1 61 62 LEU . 4345 1 62 63 SER . 4345 1 63 64 LYS . 4345 1 64 65 THR . 4345 1 65 66 LYS . 4345 1 66 67 VAL . 4345 1 67 68 TYR . 4345 1 68 69 TYR . 4345 1 69 70 PHE . 4345 1 70 71 GLN . 4345 1 71 72 GLY . 4345 1 72 73 GLY . 4345 1 73 74 ASN . 4345 1 74 75 ASN . 4345 1 75 76 GLU . 4345 1 76 77 LEU . 4345 1 77 78 GLY . 4345 1 78 79 THR . 4345 1 79 80 ALA . 4345 1 80 81 VAL . 4345 1 81 82 GLY . 4345 1 82 83 LYS . 4345 1 83 84 LEU . 4345 1 84 85 PHE . 4345 1 85 86 ARG . 4345 1 86 87 VAL . 4345 1 87 88 GLY . 4345 1 88 89 VAL . 4345 1 89 90 VAL . 4345 1 90 91 SER . 4345 1 91 92 ILE . 4345 1 92 93 LEU . 4345 1 93 94 GLU . 4345 1 94 95 ALA . 4345 1 95 96 GLY . 4345 1 96 97 ASP . 4345 1 97 98 SER . 4345 1 98 99 ASP . 4345 1 99 100 ILE . 4345 1 100 101 LEU . 4345 1 101 102 THR . 4345 1 102 103 THR . 4345 1 103 104 LEU . 4345 1 104 105 ALA . 4345 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 . ALA 1 1 4345 1 . PRO 2 2 4345 1 . VAL 3 3 4345 1 . LYS 4 4 4345 1 . SER 5 5 4345 1 . GLN 6 6 4345 1 . GLU 7 7 4345 1 . SER 8 8 4345 1 . ILE 9 9 4345 1 . ASN 10 10 4345 1 . GLN 11 11 4345 1 . LYS 12 12 4345 1 . LEU 13 13 4345 1 . ALA 14 14 4345 1 . LEU 15 15 4345 1 . VAL 16 16 4345 1 . ILE 17 17 4345 1 . LYS 18 18 4345 1 . SER 19 19 4345 1 . GLY 20 20 4345 1 . LYS 21 21 4345 1 . TYR 22 22 4345 1 . THR 23 23 4345 1 . LEU 24 24 4345 1 . GLY 25 25 4345 1 . TYR 26 26 4345 1 . LYS 27 27 4345 1 . SER 28 28 4345 1 . THR 29 29 4345 1 . VAL 30 30 4345 1 . LYS 31 31 4345 1 . SER 32 32 4345 1 . LEU 33 33 4345 1 . ARG 34 34 4345 1 . GLN 35 35 4345 1 . GLY 36 36 4345 1 . LYS 37 37 4345 1 . SER 38 38 4345 1 . LYS 39 39 4345 1 . LEU 40 40 4345 1 . ILE 41 41 4345 1 . ILE 42 42 4345 1 . ILE 43 43 4345 1 . ALA 44 44 4345 1 . ALA 45 45 4345 1 . ASN 46 46 4345 1 . THR 47 47 4345 1 . PRO 48 48 4345 1 . VAL 49 49 4345 1 . LEU 50 50 4345 1 . ARG 51 51 4345 1 . LYS 52 52 4345 1 . SER 53 53 4345 1 . GLU 54 54 4345 1 . LEU 55 55 4345 1 . GLU 56 56 4345 1 . TYR 57 57 4345 1 . TYR 58 58 4345 1 . ALA 59 59 4345 1 . MET 60 60 4345 1 . LEU 61 61 4345 1 . SER 62 62 4345 1 . LYS 63 63 4345 1 . THR 64 64 4345 1 . LYS 65 65 4345 1 . VAL 66 66 4345 1 . TYR 67 67 4345 1 . TYR 68 68 4345 1 . PHE 69 69 4345 1 . GLN 70 70 4345 1 . GLY 71 71 4345 1 . GLY 72 72 4345 1 . ASN 73 73 4345 1 . ASN 74 74 4345 1 . GLU 75 75 4345 1 . LEU 76 76 4345 1 . GLY 77 77 4345 1 . THR 78 78 4345 1 . ALA 79 79 4345 1 . VAL 80 80 4345 1 . GLY 81 81 4345 1 . LYS 82 82 4345 1 . LEU 83 83 4345 1 . PHE 84 84 4345 1 . ARG 85 85 4345 1 . VAL 86 86 4345 1 . GLY 87 87 4345 1 . VAL 88 88 4345 1 . VAL 89 89 4345 1 . SER 90 90 4345 1 . ILE 91 91 4345 1 . LEU 92 92 4345 1 . GLU 93 93 4345 1 . ALA 94 94 4345 1 . GLY 95 95 4345 1 . ASP 96 96 4345 1 . SER 97 97 4345 1 . ASP 98 98 4345 1 . ILE 99 99 4345 1 . LEU 100 100 4345 1 . THR 101 101 4345 1 . THR 102 102 4345 1 . LEU 103 103 4345 1 . ALA 104 104 4345 1 stop_ save_ save_L30N _Entity.Sf_category entity _Entity.Sf_framecode L30N _Entity.Entry_ID 4345 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name L30N _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GGACCGGAGUGUCGCAAGAC GCAGAGAUGGUCC ; _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 33 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 10814 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID L30N abbreviation 4345 2 L30N common 4345 2 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 5 G . 4345 2 2 6 G . 4345 2 3 7 A . 4345 2 4 8 C . 4345 2 5 9 C . 4345 2 6 10 G . 4345 2 7 11 G . 4345 2 8 12 A . 4345 2 9 13 G . 4345 2 10 14 U . 4345 2 11 15 G . 4345 2 12 16 U . 4345 2 13 17 C . 4345 2 14 18 G . 4345 2 15 19 C . 4345 2 16 20 A . 4345 2 17 21 A . 4345 2 18 50 G . 4345 2 19 51 A . 4345 2 20 52 C . 4345 2 21 53 G . 4345 2 22 54 C . 4345 2 23 55 A . 4345 2 24 56 G . 4345 2 25 57 A . 4345 2 26 58 G . 4345 2 27 59 A . 4345 2 28 60 U . 4345 2 29 61 G . 4345 2 30 62 G . 4345 2 31 63 U . 4345 2 32 64 C . 4345 2 33 65 C . 4345 2 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 . G 1 1 4345 2 . G 2 2 4345 2 . A 3 3 4345 2 . C 4 4 4345 2 . C 5 5 4345 2 . G 6 6 4345 2 . G 7 7 4345 2 . A 8 8 4345 2 . G 9 9 4345 2 . U 10 10 4345 2 . G 11 11 4345 2 . U 12 12 4345 2 . C 13 13 4345 2 . G 14 14 4345 2 . C 15 15 4345 2 . A 16 16 4345 2 . A 17 17 4345 2 . G 18 18 4345 2 . A 19 19 4345 2 . C 20 20 4345 2 . G 21 21 4345 2 . C 22 22 4345 2 . A 23 23 4345 2 . G 24 24 4345 2 . A 25 25 4345 2 . G 26 26 4345 2 . A 27 27 4345 2 . U 28 28 4345 2 . G 29 29 4345 2 . G 30 30 4345 2 . U 31 31 4345 2 . C 32 32 4345 2 . C 33 33 4345 2 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 4345 _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 $RPL30 . 4932 . . 'SACCHAROMYCES CEREVISIAE' 'BAKER'S YEAST' . . Eukaryota Fungi SACCHAROMYCES CEREVISIAE . . . . . . . . . 'RIBOSOME,60S SUBUNIT' . . CYTOPLASM . . . RPL30 . 'recombinant expression as a c-terminal maltose-binding protein fusion in Escherichia coli strain JM109 hosting plasmid pMALC-30' . . 4345 1 2 2 $L30N . 4932 . . 'SACCHAROMYCES CEREVISIAE' 'BAKER'S YEAST' . . Eukaryota Fungi SACCHAROMYCES CEREVISIAE . . . . . . . . . . . . NUCLEUS . . . 'L30 PRE-MRNA' . 'IN VITRO T7 RNA POLYMERASE TRANSCRIPTION' . . 4345 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 4345 _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 $RPL30 . 'recombinant technology' 'ESCHERICHIA COLI' 'E. COLI' . . ESCHERICHIA COLI JM109 . . . . . . . . . . . . PLASMID . . PMALC-L30 . . . 'RECOMBINANT EXPRESSION AS A C-TERMINAL MALTOSE-BINDING PROTEIN FUSION IN ESCHERICHIA COLI STRAIN JM109 HOSTING PLASMID PMALC-30' . . 4345 1 2 2 $L30N . 'enzymatic semisynthesis' . . . . . . . . . . . . . . . . . . . . . . . . . . 'IN VITRO T7 RNA POLYMERASE TRANSCRIPTION' . . 4345 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_SAMPLE_1 _Sample.Sf_category sample _Sample.Sf_framecode SAMPLE_1 _Sample.Entry_ID 4345 _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 'YEAST (SACCHAROMYCES CEREVISIAE) RIBOSOMAL PROTEIN L30' [U-15N] . . 1 $RPL30 . . 1.3 0.5 1.8 mM . . . . 4345 1 2 L30N . . . 2 $L30N . . 1.3 0.5 1.8 mM . . . . 4345 1 stop_ save_ save_SAMPLE_2 _Sample.Sf_category sample _Sample.Sf_framecode SAMPLE_2 _Sample.Entry_ID 4345 _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 'YEAST (SACCHAROMYCES CEREVISIAE) RIBOSOMAL PROTEIN L30' '[U-99% 13C; U-99% 15N]' . . 1 $RPL30 . . 1.7 . . mM . . . . 4345 2 2 L30N . . . 2 $L30N . . 1.3 0.5 1.8 mM . . . . 4345 2 stop_ save_ save_SAMPLE_3 _Sample.Sf_category sample _Sample.Sf_framecode SAMPLE_3 _Sample.Entry_ID 4345 _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 'YEAST (SACCHAROMYCES CEREVISIAE) RIBOSOMAL PROTEIN L30' '[U-99% 13C; U-99% 15N]' . . 1 $RPL30 . . 0.9 . . mM . . . . 4345 3 2 L30N . . . 2 $L30N . . 1.3 0.5 1.8 mM . . . . 4345 3 stop_ save_ save_SAMPLE_4 _Sample.Sf_category sample _Sample.Sf_framecode SAMPLE_4 _Sample.Entry_ID 4345 _Sample.ID 4 _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 'YEAST (SACCHAROMYCES CEREVISIAE) RIBOSOMAL PROTEIN L30' . . . 1 $RPL30 . . 0.5 . . mM . . . . 4345 4 2 L30N '[U-99% 13C; U-99% 15N]-G' . . 2 $L30N . . 1.3 0.5 1.8 mM . . . . 4345 4 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 4345 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.10 0.02 M 4345 1 pH 6.5 0.2 n/a 4345 1 temperature 303 1 K 4345 1 stop_ save_ save_Ex-cond_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Ex-cond_2 _Sample_condition_list.Entry_ID 4345 _Sample_condition_list.ID 2 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID ionic_strength 0.10 0.02 M 4345 2 pH 6.0 0.2 na 4345 2 temperature 303 1 K 4345 2 stop_ save_ ############################ # Computer software used # ############################ save_NMRPIPE _Software.Sf_category software _Software.Sf_framecode NMRPIPE _Software.Entry_ID 4345 _Software.ID 1 _Software.Name NMRPIPE _Software.Version . _Software.Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 4345 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer VARIAN _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 4345 _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 4345 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 VARIAN INOVA . 750 . . . 4345 1 2 spectrometer_2 VARIAN INOVA . 600 . . . 4345 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 4345 _Experiment_list.ID 1 _Experiment_list.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 4345 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 TSP 'methyl protons' . . . . ppm 0.00 internal direct . internal spherical parallel_to_Bo 1 $entry_citation . . 1 $entry_citation 4345 1 H 1 TSP 'methyl protons' . . . . ppm 0.00 internal direct . internal spherical parallel_to_Bo 1 $entry_citation . . 1 $entry_citation 4345 1 N 15 'ammonium chloride NH4Cl' 'ammonium nitrogen' . . . . ppm 0.00 internal direct . internal spherical parallel_to_Bo 1 $entry_citation . . 1 $entry_citation 4345 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_SHIFT_SET_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode SHIFT_SET_1 _Assigned_chem_shift_list.Entry_ID 4345 _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 . 4345 1 . . 2 $SAMPLE_2 . 4345 1 . . 3 $SAMPLE_3 . 4345 1 . . 4 $SAMPLE_4 . 4345 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 . 2 2 1 1 G H8 H 1 8.16 0.02 . 1 . . . . . . . . 4345 1 2 . 2 2 1 1 G C8 C 13 139.4 0.2 . 1 . . . . . . . . 4345 1 3 . 2 2 1 1 G H1' H 1 5.83 0.02 . 1 . . . . . . . . 4345 1 4 . 2 2 1 1 G H2' H 1 4.97 0.02 . 1 . . . . . . . . 4345 1 5 . 2 2 1 1 G H3' H 1 4.81 0.02 . 1 . . . . . . . . 4345 1 6 . 2 2 1 1 G H4' H 1 4.60 0.02 . 1 . . . . . . . . 4345 1 7 . 2 2 1 1 G H5' H 1 4.42 0.02 . 2 . . . . . . . . 4345 1 8 . 2 2 1 1 G H5'' H 1 4.33 0.02 . 2 . . . . . . . . 4345 1 9 . 2 2 1 1 G C1' C 13 90.8 0.2 . 1 . . . . . . . . 4345 1 10 . 2 2 1 1 G C2' C 13 75.5 0.2 . 1 . . . . . . . . 4345 1 11 . 2 2 1 1 G C3' C 13 75.4 0.2 . 1 . . . . . . . . 4345 1 12 . 2 2 1 1 G C4' C 13 84.2 0.2 . 1 . . . . . . . . 4345 1 13 . 2 2 1 1 G C5' C 13 67.8 0.2 . 1 . . . . . . . . 4345 1 14 . 2 2 2 2 G H1 H 1 12.43 0.02 . 1 . . . . . . . . 4345 1 15 . 2 2 2 2 G H8 H 1 7.66 0.02 . 1 . . . . . . . . 4345 1 16 . 2 2 2 2 G C8 C 13 137.6 0.2 . 1 . . . . . . . . 4345 1 17 . 2 2 2 2 G N1 N 15 147.3 0.2 . 1 . . . . . . . . 4345 1 18 . 2 2 2 2 G H1' H 1 5.94 0.02 . 1 . . . . . . . . 4345 1 19 . 2 2 2 2 G H2' H 1 4.69 0.02 . 1 . . . . . . . . 4345 1 20 . 2 2 2 2 G H3' H 1 4.32 0.02 . 1 . . . . . . . . 4345 1 21 . 2 2 2 2 G H4' H 1 4.64 0.02 . 1 . . . . . . . . 4345 1 22 . 2 2 2 2 G H5' H 1 4.37 0.02 . 2 . . . . . . . . 4345 1 23 . 2 2 2 2 G H5'' H 1 4.51 0.02 . 2 . . . . . . . . 4345 1 24 . 2 2 2 2 G C1' C 13 93.1 0.2 . 1 . . . . . . . . 4345 1 25 . 2 2 2 2 G C2' C 13 75.9 0.2 . 1 . . . . . . . . 4345 1 26 . 2 2 2 2 G C3' C 13 74.0 0.2 . 1 . . . . . . . . 4345 1 27 . 2 2 2 2 G C4' C 13 83.2 0.2 . 1 . . . . . . . . 4345 1 28 . 2 2 2 2 G C5' C 13 67.4 0.2 . 1 . . . . . . . . 4345 1 29 . 2 2 3 3 A H2 H 1 7.83 0.02 . 1 . . . . . . . . 4345 1 30 . 2 2 3 3 A H8 H 1 7.94 0.02 . 1 . . . . . . . . 4345 1 31 . 2 2 3 3 A C2 C 13 154.4 0.2 . 1 . . . . . . . . 4345 1 32 . 2 2 3 3 A C8 C 13 140.5 0.2 . 1 . . . . . . . . 4345 1 33 . 2 2 3 3 A H1' H 1 6.03 0.02 . 1 . . . . . . . . 4345 1 34 . 2 2 3 3 A H2' H 1 4.65 0.02 . 1 . . . . . . . . 4345 1 35 . 2 2 3 3 A H3' H 1 4.65 0.02 . 1 . . . . . . . . 4345 1 36 . 2 2 3 3 A H4' H 1 4.52 0.02 . 1 . . . . . . . . 4345 1 37 . 2 2 3 3 A H5' H 1 4.12 0.02 . 2 . . . . . . . . 4345 1 38 . 2 2 3 3 A H5'' H 1 4.65 0.02 . 2 . . . . . . . . 4345 1 39 . 2 2 3 3 A C1' C 13 93.3 0.2 . 1 . . . . . . . . 4345 1 40 . 2 2 3 3 A C2' C 13 76.1 0.2 . 1 . . . . . . . . 4345 1 41 . 2 2 3 3 A C3' C 13 73.1 0.2 . 1 . . . . . . . . 4345 1 42 . 2 2 3 3 A C4' C 13 82.5 0.2 . 1 . . . . . . . . 4345 1 43 . 2 2 3 3 A C5' C 13 65.4 0.2 . 1 . . . . . . . . 4345 1 44 . 2 2 4 4 C H41 H 1 8.38 0.02 . 2 . . . . . . . . 4345 1 45 . 2 2 4 4 C H42 H 1 6.99 0.02 . 2 . . . . . . . . 4345 1 46 . 2 2 4 4 C H5 H 1 5.26 0.02 . 1 . . . . . . . . 4345 1 47 . 2 2 4 4 C H6 H 1 7.34 0.02 . 1 . . . . . . . . 4345 1 48 . 2 2 4 4 C C5 C 13 97.7 0.2 . 1 . . . . . . . . 4345 1 49 . 2 2 4 4 C C6 C 13 140.6 0.2 . 1 . . . . . . . . 4345 1 50 . 2 2 4 4 C N4 N 15 97.2 0.2 . 1 . . . . . . . . 4345 1 51 . 2 2 4 4 C H1' H 1 5.34 0.02 . 1 . . . . . . . . 4345 1 52 . 2 2 4 4 C H2' H 1 4.29 0.02 . 1 . . . . . . . . 4345 1 53 . 2 2 4 4 C H3' H 1 4.20 0.02 . 1 . . . . . . . . 4345 1 54 . 2 2 4 4 C H4' H 1 4.42 0.02 . 1 . . . . . . . . 4345 1 55 . 2 2 4 4 C H5' H 1 4.06 0.02 . 2 . . . . . . . . 4345 1 56 . 2 2 4 4 C H5'' H 1 4.47 0.02 . 2 . . . . . . . . 4345 1 57 . 2 2 4 4 C C1' C 13 94.2 0.2 . 1 . . . . . . . . 4345 1 58 . 2 2 4 4 C C2' C 13 76.0 0.2 . 1 . . . . . . . . 4345 1 59 . 2 2 4 4 C C3' C 13 73.0 0.2 . 1 . . . . . . . . 4345 1 60 . 2 2 4 4 C C4' C 13 82.3 0.2 . 1 . . . . . . . . 4345 1 61 . 2 2 4 4 C C5' C 13 65.6 0.2 . 1 . . . . . . . . 4345 1 62 . 2 2 5 5 C H41 H 1 8.31 0.02 . 2 . . . . . . . . 4345 1 63 . 2 2 5 5 C H42 H 1 6.42 0.02 . 2 . . . . . . . . 4345 1 64 . 2 2 5 5 C H5 H 1 5.16 0.02 . 1 . . . . . . . . 4345 1 65 . 2 2 5 5 C H6 H 1 7.50 0.02 . 1 . . . . . . . . 4345 1 66 . 2 2 5 5 C C5 C 13 98.2 0.2 . 1 . . . . . . . . 4345 1 67 . 2 2 5 5 C C6 C 13 141.1 0.2 . 1 . . . . . . . . 4345 1 68 . 2 2 5 5 C N4 N 15 97.1 0.2 . 1 . . . . . . . . 4345 1 69 . 2 2 5 5 C H1' H 1 5.35 0.02 . 1 . . . . . . . . 4345 1 70 . 2 2 5 5 C H2' H 1 4.61 0.02 . 1 . . . . . . . . 4345 1 71 . 2 2 5 5 C H3' H 1 4.29 0.02 . 1 . . . . . . . . 4345 1 72 . 2 2 5 5 C H4' H 1 4.35 0.02 . 1 . . . . . . . . 4345 1 73 . 2 2 5 5 C H5' H 1 4.07 0.02 . 2 . . . . . . . . 4345 1 74 . 2 2 5 5 C H5'' H 1 4.52 0.02 . 2 . . . . . . . . 4345 1 75 . 2 2 5 5 C C1' C 13 95.1 0.2 . 1 . . . . . . . . 4345 1 76 . 2 2 5 5 C C2' C 13 75.2 0.2 . 1 . . . . . . . . 4345 1 77 . 2 2 5 5 C C3' C 13 72.8 0.2 . 1 . . . . . . . . 4345 1 78 . 2 2 5 5 C C4' C 13 82.6 0.2 . 1 . . . . . . . . 4345 1 79 . 2 2 5 5 C C5' C 13 65.2 0.2 . 1 . . . . . . . . 4345 1 80 . 2 2 6 6 G H1 H 1 10.95 0.02 . 1 . . . . . . . . 4345 1 81 . 2 2 6 6 G H21 H 1 6.45 0.02 . 9 . . . . . . . . 4345 1 82 . 2 2 6 6 G H8 H 1 7.52 0.02 . 1 . . . . . . . . 4345 1 83 . 2 2 6 6 G C8 C 13 136.2 0.2 . 1 . . . . . . . . 4345 1 84 . 2 2 6 6 G N1 N 15 144.3 0.2 . 1 . . . . . . . . 4345 1 85 . 2 2 6 6 G N2 N 15 72.9 0.2 . 9 . . . . . . . . 4345 1 86 . 2 2 6 6 G H1' H 1 5.51 0.02 . 1 . . . . . . . . 4345 1 87 . 2 2 6 6 G H2' H 1 3.43 0.02 . 1 . . . . . . . . 4345 1 88 . 2 2 6 6 G H3' H 1 4.45 0.02 . 1 . . . . . . . . 4345 1 89 . 2 2 6 6 G H4' H 1 4.22 0.02 . 1 . . . . . . . . 4345 1 90 . 2 2 6 6 G H5' H 1 4.45 0.02 . 2 . . . . . . . . 4345 1 91 . 2 2 6 6 G C1' C 13 93.2 0.2 . 1 . . . . . . . . 4345 1 92 . 2 2 6 6 G C2' C 13 76.1 0.2 . 1 . . . . . . . . 4345 1 93 . 2 2 6 6 G C3' C 13 73.0 0.2 . 1 . . . . . . . . 4345 1 94 . 2 2 6 6 G C4' C 13 83.3 0.2 . 1 . . . . . . . . 4345 1 95 . 2 2 7 7 G H1 H 1 11.18 0.02 . 1 . . . . . . . . 4345 1 96 . 2 2 7 7 G H8 H 1 8.00 0.02 . 1 . . . . . . . . 4345 1 97 . 2 2 7 7 G C8 C 13 138.5 0.2 . 1 . . . . . . . . 4345 1 98 . 2 2 7 7 G N1 N 15 144.4 0.2 . 1 . . . . . . . . 4345 1 99 . 2 2 7 7 G H1' H 1 5.80 0.02 . 1 . . . . . . . . 4345 1 100 . 2 2 7 7 G H2' H 1 5.07 0.02 . 1 . . . . . . . . 4345 1 101 . 2 2 7 7 G H3' H 1 4.89 0.02 . 1 . . . . . . . . 4345 1 102 . 2 2 7 7 G H4' H 1 4.67 0.02 . 1 . . . . . . . . 4345 1 103 . 2 2 7 7 G C1' C 13 89.1 0.2 . 1 . . . . . . . . 4345 1 104 . 2 2 7 7 G C2' C 13 76.3 0.2 . 1 . . . . . . . . 4345 1 105 . 2 2 7 7 G C3' C 13 80.0 0.2 . 1 . . . . . . . . 4345 1 106 . 2 2 7 7 G C4' C 13 87.5 0.2 . 1 . . . . . . . . 4345 1 107 . 2 2 8 8 A H2 H 1 7.84 0.02 . 1 . . . . . . . . 4345 1 108 . 2 2 8 8 A H8 H 1 8.04 0.02 . 1 . . . . . . . . 4345 1 109 . 2 2 8 8 A C2 C 13 154.9 0.2 . 1 . . . . . . . . 4345 1 110 . 2 2 8 8 A C8 C 13 140.8 0.2 . 1 . . . . . . . . 4345 1 111 . 2 2 8 8 A H1' H 1 6.04 0.02 . 1 . . . . . . . . 4345 1 112 . 2 2 8 8 A H2' H 1 4.94 0.02 . 1 . . . . . . . . 4345 1 113 . 2 2 8 8 A H3' H 1 4.59 0.02 . 1 . . . . . . . . 4345 1 114 . 2 2 8 8 A H4' H 1 4.94 0.02 . 1 . . . . . . . . 4345 1 115 . 2 2 8 8 A C1' C 13 89.0 0.2 . 1 . . . . . . . . 4345 1 116 . 2 2 8 8 A C2' C 13 79.7 0.2 . 1 . . . . . . . . 4345 1 117 . 2 2 8 8 A C3' C 13 78.8 0.2 . 1 . . . . . . . . 4345 1 118 . 2 2 8 8 A C4' C 13 85.4 0.2 . 1 . . . . . . . . 4345 1 119 . 2 2 9 9 G H1 H 1 12.76 0.02 . 1 . . . . . . . . 4345 1 120 . 2 2 9 9 G H21 H 1 8.69 0.02 . 1 . . . . . . . . 4345 1 121 . 2 2 9 9 G H8 H 1 8.10 0.02 . 1 . . . . . . . . 4345 1 122 . 2 2 9 9 G C8 C 13 138.2 0.2 . 1 . . . . . . . . 4345 1 123 . 2 2 9 9 G N1 N 15 148.8 0.2 . 1 . . . . . . . . 4345 1 124 . 2 2 9 9 G N2 N 15 73.4 0.2 . 1 . . . . . . . . 4345 1 125 . 2 2 9 9 G H1' H 1 6.78 0.02 . 1 . . . . . . . . 4345 1 126 . 2 2 9 9 G H2' H 1 5.00 0.02 . 1 . . . . . . . . 4345 1 127 . 2 2 9 9 G H3' H 1 4.53 0.02 . 1 . . . . . . . . 4345 1 128 . 2 2 9 9 G H4' H 1 4.99 0.02 . 1 . . . . . . . . 4345 1 129 . 2 2 9 9 G H5' H 1 4.38 0.02 . 2 . . . . . . . . 4345 1 130 . 2 2 9 9 G C1' C 13 94.0 0.2 . 1 . . . . . . . . 4345 1 131 . 2 2 9 9 G C2' C 13 79.9 0.2 . 1 . . . . . . . . 4345 1 132 . 2 2 9 9 G C4' C 13 83.8 0.2 . 1 . . . . . . . . 4345 1 133 . 2 2 10 10 U H3 H 1 11.89 0.02 . 1 . . . . . . . . 4345 1 134 . 2 2 10 10 U H5 H 1 5.50 0.02 . 1 . . . . . . . . 4345 1 135 . 2 2 10 10 U H6 H 1 8.02 0.02 . 1 . . . . . . . . 4345 1 136 . 2 2 10 10 U C5 C 13 104.5 0.2 . 1 . . . . . . . . 4345 1 137 . 2 2 10 10 U C6 C 13 140.5 0.2 . 1 . . . . . . . . 4345 1 138 . 2 2 10 10 U N1 N 15 158.5 0.2 . 1 . . . . . . . . 4345 1 139 . 2 2 10 10 U H1' H 1 5.51 0.02 . 1 . . . . . . . . 4345 1 140 . 2 2 10 10 U H2' H 1 4.46 0.02 . 1 . . . . . . . . 4345 1 141 . 2 2 10 10 U H3' H 1 4.42 0.02 . 1 . . . . . . . . 4345 1 142 . 2 2 10 10 U H4' H 1 4.39 0.02 . 1 . . . . . . . . 4345 1 143 . 2 2 10 10 U H5' H 1 4.26 0.02 . 2 . . . . . . . . 4345 1 144 . 2 2 10 10 U H5'' H 1 4.32 0.02 . 2 . . . . . . . . 4345 1 145 . 2 2 10 10 U C1' C 13 94.3 0.2 . 1 . . . . . . . . 4345 1 146 . 2 2 10 10 U C2' C 13 75.9 0.2 . 1 . . . . . . . . 4345 1 147 . 2 2 10 10 U C3' C 13 72.7 0.2 . 1 . . . . . . . . 4345 1 148 . 2 2 10 10 U C4' C 13 82.3 0.2 . 1 . . . . . . . . 4345 1 149 . 2 2 10 10 U C5' C 13 67.9 0.2 . 1 . . . . . . . . 4345 1 150 . 2 2 11 11 G H1 H 1 12.95 0.02 . 1 . . . . . . . . 4345 1 151 . 2 2 11 11 G H8 H 1 7.92 0.02 . 1 . . . . . . . . 4345 1 152 . 2 2 11 11 G C8 C 13 137.7 0.2 . 1 . . . . . . . . 4345 1 153 . 2 2 11 11 G N1 N 15 147.8 0.2 . 1 . . . . . . . . 4345 1 154 . 2 2 11 11 G H1' H 1 5.88 0.02 . 1 . . . . . . . . 4345 1 155 . 2 2 11 11 G H2' H 1 4.57 0.02 . 1 . . . . . . . . 4345 1 156 . 2 2 11 11 G H3' H 1 4.59 0.02 . 1 . . . . . . . . 4345 1 157 . 2 2 11 11 G H4' H 1 4.58 0.02 . 1 . . . . . . . . 4345 1 158 . 2 2 11 11 G H5' H 1 4.36 0.02 . 2 . . . . . . . . 4345 1 159 . 2 2 11 11 G H5'' H 1 4.16 0.02 . 2 . . . . . . . . 4345 1 160 . 2 2 11 11 G C1' C 13 93.3 0.2 . 1 . . . . . . . . 4345 1 161 . 2 2 11 11 G C2' C 13 75.7 0.2 . 1 . . . . . . . . 4345 1 162 . 2 2 11 11 G C3' C 13 73.6 0.2 . 1 . . . . . . . . 4345 1 163 . 2 2 11 11 G C4' C 13 82.7 0.2 . 1 . . . . . . . . 4345 1 164 . 2 2 11 11 G C5' C 13 67.4 0.2 . 1 . . . . . . . . 4345 1 165 . 2 2 12 12 U H3 H 1 14.19 0.02 . 1 . . . . . . . . 4345 1 166 . 2 2 12 12 U H5 H 1 5.17 0.02 . 1 . . . . . . . . 4345 1 167 . 2 2 12 12 U H6 H 1 7.78 0.02 . 1 . . . . . . . . 4345 1 168 . 2 2 12 12 U C5 C 13 103.0 0.2 . 1 . . . . . . . . 4345 1 169 . 2 2 12 12 U C6 C 13 142.3 0.2 . 1 . . . . . . . . 4345 1 170 . 2 2 12 12 U N1 N 15 162.4 0.2 . 1 . . . . . . . . 4345 1 171 . 2 2 12 12 U H1' H 1 5.59 0.02 . 1 . . . . . . . . 4345 1 172 . 2 2 12 12 U H2' H 1 4.48 0.02 . 1 . . . . . . . . 4345 1 173 . 2 2 12 12 U H3' H 1 4.43 0.02 . 1 . . . . . . . . 4345 1 174 . 2 2 12 12 U H4' H 1 4.44 0.02 . 1 . . . . . . . . 4345 1 175 . 2 2 12 12 U H5' H 1 4.15 0.02 . 2 . . . . . . . . 4345 1 176 . 2 2 12 12 U H5'' H 1 4.54 0.02 . 2 . . . . . . . . 4345 1 177 . 2 2 12 12 U C1' C 13 94.5 0.2 . 1 . . . . . . . . 4345 1 178 . 2 2 12 12 U C2' C 13 76.0 0.2 . 1 . . . . . . . . 4345 1 179 . 2 2 12 12 U C3' C 13 73.1 0.2 . 1 . . . . . . . . 4345 1 180 . 2 2 12 12 U C4' C 13 82.3 0.2 . 1 . . . . . . . . 4345 1 181 . 2 2 12 12 U C5' C 13 65.3 0.2 . 1 . . . . . . . . 4345 1 182 . 2 2 13 13 C H41 H 1 8.19 0.02 . 2 . . . . . . . . 4345 1 183 . 2 2 13 13 C H42 H 1 6.73 0.02 . 2 . . . . . . . . 4345 1 184 . 2 2 13 13 C H5 H 1 5.56 0.02 . 1 . . . . . . . . 4345 1 185 . 2 2 13 13 C H6 H 1 7.67 0.02 . 1 . . . . . . . . 4345 1 186 . 2 2 13 13 C C5 C 13 98.4 0.2 . 1 . . . . . . . . 4345 1 187 . 2 2 13 13 C C6 C 13 141.2 0.2 . 1 . . . . . . . . 4345 1 188 . 2 2 13 13 C N4 N 15 97.9 0.2 . 1 . . . . . . . . 4345 1 189 . 2 2 13 13 C H1' H 1 5.60 0.02 . 1 . . . . . . . . 4345 1 190 . 2 2 13 13 C H2' H 1 4.30 0.02 . 1 . . . . . . . . 4345 1 191 . 2 2 13 13 C H3' H 1 4.50 0.02 . 1 . . . . . . . . 4345 1 192 . 2 2 13 13 C H4' H 1 4.42 0.02 . 1 . . . . . . . . 4345 1 193 . 2 2 13 13 C H5' H 1 4.11 0.02 . 2 . . . . . . . . 4345 1 194 . 2 2 13 13 C H5'' H 1 4.57 0.02 . 2 . . . . . . . . 4345 1 195 . 2 2 13 13 C C1' C 13 94.7 0.2 . 1 . . . . . . . . 4345 1 196 . 2 2 13 13 C C2' C 13 76.0 0.2 . 1 . . . . . . . . 4345 1 197 . 2 2 13 13 C C3' C 13 72.6 0.2 . 1 . . . . . . . . 4345 1 198 . 2 2 13 13 C C4' C 13 72.4 0.2 . 1 . . . . . . . . 4345 1 199 . 2 2 13 13 C C5' C 13 64.9 0.2 . 1 . . . . . . . . 4345 1 200 . 2 2 14 14 G H1 H 1 10.49 0.02 . 1 . . . . . . . . 4345 1 201 . 2 2 14 14 G H8 H 1 7.78 0.02 . 1 . . . . . . . . 4345 1 202 . 2 2 14 14 G C8 C 13 137.2 0.2 . 1 . . . . . . . . 4345 1 203 . 2 2 14 14 G N1 N 15 146.0 0.2 . 1 . . . . . . . . 4345 1 204 . 2 2 14 14 G H1' H 1 5.63 0.02 . 1 . . . . . . . . 4345 1 205 . 2 2 14 14 G H2' H 1 4.57 0.02 . 1 . . . . . . . . 4345 1 206 . 2 2 14 14 G H3' H 1 4.69 0.02 . 1 . . . . . . . . 4345 1 207 . 2 2 14 14 G H4' H 1 4.44 0.02 . 1 . . . . . . . . 4345 1 208 . 2 2 14 14 G H5' H 1 4.43 0.02 . 2 . . . . . . . . 4345 1 209 . 2 2 14 14 G H5'' H 1 4.12 0.02 . 2 . . . . . . . . 4345 1 210 . 2 2 14 14 G C1' C 13 92.4 0.2 . 1 . . . . . . . . 4345 1 211 . 2 2 14 14 G C2' C 13 76.7 0.2 . 1 . . . . . . . . 4345 1 212 . 2 2 14 14 G C3' C 13 74.9 0.2 . 1 . . . . . . . . 4345 1 213 . 2 2 14 14 G C4' C 13 83.2 0.2 . 1 . . . . . . . . 4345 1 214 . 2 2 14 14 G C5' C 13 65.9 0.2 . 1 . . . . . . . . 4345 1 215 . 2 2 15 15 C H41 H 1 7.11 0.02 . 2 . . . . . . . . 4345 1 216 . 2 2 15 15 C H5 H 1 5.72 0.02 . 1 . . . . . . . . 4345 1 217 . 2 2 15 15 C H6 H 1 7.77 0.02 . 1 . . . . . . . . 4345 1 218 . 2 2 15 15 C C5 C 13 98.6 0.2 . 1 . . . . . . . . 4345 1 219 . 2 2 15 15 C C6 C 13 144.5 0.2 . 1 . . . . . . . . 4345 1 220 . 2 2 15 15 C N4 N 15 97.1 0.2 . 1 . . . . . . . . 4345 1 221 . 2 2 15 15 C H1' H 1 5.68 0.02 . 1 . . . . . . . . 4345 1 222 . 2 2 15 15 C H2' H 1 4.38 0.02 . 1 . . . . . . . . 4345 1 223 . 2 2 15 15 C H3' H 1 4.32 0.02 . 1 . . . . . . . . 4345 1 224 . 2 2 15 15 C H4' H 1 4.15 0.02 . 1 . . . . . . . . 4345 1 225 . 2 2 15 15 C H5' H 1 4.15 0.02 . 2 . . . . . . . . 4345 1 226 . 2 2 15 15 C H5'' H 1 3.98 0.02 . 2 . . . . . . . . 4345 1 227 . 2 2 15 15 C C1' C 13 92.0 0.2 . 1 . . . . . . . . 4345 1 228 . 2 2 15 15 C C2' C 13 76.4 0.2 . 1 . . . . . . . . 4345 1 229 . 2 2 15 15 C C3' C 13 76.0 0.2 . 1 . . . . . . . . 4345 1 230 . 2 2 15 15 C C4' C 13 84.2 0.2 . 1 . . . . . . . . 4345 1 231 . 2 2 15 15 C C5' C 13 66.6 0.2 . 1 . . . . . . . . 4345 1 232 . 2 2 16 16 A H2 H 1 7.92 0.02 . 1 . . . . . . . . 4345 1 233 . 2 2 16 16 A H8 H 1 8.01 0.02 . 1 . . . . . . . . 4345 1 234 . 2 2 16 16 A C2 C 13 155.0 0.2 . 1 . . . . . . . . 4345 1 235 . 2 2 16 16 A C8 C 13 141.1 0.2 . 1 . . . . . . . . 4345 1 236 . 2 2 16 16 A H1' H 1 5.63 0.02 . 1 . . . . . . . . 4345 1 237 . 2 2 16 16 A H2' H 1 4.38 0.02 . 1 . . . . . . . . 4345 1 238 . 2 2 16 16 A H3' H 1 4.57 0.02 . 1 . . . . . . . . 4345 1 239 . 2 2 16 16 A H4' H 1 4.22 0.02 . 1 . . . . . . . . 4345 1 240 . 2 2 16 16 A H5' H 1 3.77 0.02 . 2 . . . . . . . . 4345 1 241 . 2 2 16 16 A H5'' H 1 3.88 0.02 . 2 . . . . . . . . 4345 1 242 . 2 2 16 16 A C1' C 13 91.7 0.2 . 1 . . . . . . . . 4345 1 243 . 2 2 16 16 A C2' C 13 77.5 0.2 . 1 . . . . . . . . 4345 1 244 . 2 2 16 16 A C3' C 13 76.6 0.2 . 1 . . . . . . . . 4345 1 245 . 2 2 16 16 A C4' C 13 84.4 0.2 . 1 . . . . . . . . 4345 1 246 . 2 2 16 16 A C5' C 13 66.9 0.2 . 1 . . . . . . . . 4345 1 247 . 2 2 17 17 A H2 H 1 8.03 0.02 . 1 . . . . . . . . 4345 1 248 . 2 2 17 17 A H8 H 1 8.27 0.02 . 1 . . . . . . . . 4345 1 249 . 2 2 17 17 A C2 C 13 155.3 0.2 . 1 . . . . . . . . 4345 1 250 . 2 2 17 17 A C8 C 13 142.8 0.2 . 1 . . . . . . . . 4345 1 251 . 2 2 17 17 A H1' H 1 6.10 0.02 . 1 . . . . . . . . 4345 1 252 . 2 2 17 17 A H2' H 1 4.77 0.02 . 1 . . . . . . . . 4345 1 253 . 2 2 17 17 A H3' H 1 5.43 0.02 . 1 . . . . . . . . 4345 1 254 . 2 2 17 17 A H4' H 1 4.55 0.02 . 1 . . . . . . . . 4345 1 255 . 2 2 17 17 A H5' H 1 4.44 0.02 . 2 . . . . . . . . 4345 1 256 . 2 2 17 17 A H5'' H 1 4.53 0.02 . 2 . . . . . . . . 4345 1 257 . 2 2 17 17 A C1' C 13 97.8 0.2 . 1 . . . . . . . . 4345 1 258 . 2 2 17 17 A C2' C 13 77.4 0.2 . 1 . . . . . . . . 4345 1 259 . 2 2 17 17 A C3' C 13 75.5 0.2 . 1 . . . . . . . . 4345 1 260 . 2 2 17 17 A C4' C 13 83.6 0.2 . 1 . . . . . . . . 4345 1 261 . 2 2 17 17 A C5' C 13 67.4 0.2 . 1 . . . . . . . . 4345 1 262 . 2 2 18 18 G H1 H 1 12.27 0.02 . 1 . . . . . . . . 4345 1 263 . 2 2 18 18 G H8 H 1 7.82 0.02 . 1 . . . . . . . . 4345 1 264 . 2 2 18 18 G C8 C 13 137.9 0.2 . 1 . . . . . . . . 4345 1 265 . 2 2 18 18 G N1 N 15 146.9 0.2 . 1 . . . . . . . . 4345 1 266 . 2 2 18 18 G H1' H 1 4.07 0.02 . 1 . . . . . . . . 4345 1 267 . 2 2 18 18 G H2' H 1 4.42 0.02 . 1 . . . . . . . . 4345 1 268 . 2 2 18 18 G H3' H 1 4.30 0.02 . 1 . . . . . . . . 4345 1 269 . 2 2 18 18 G H4' H 1 4.40 0.02 . 1 . . . . . . . . 4345 1 270 . 2 2 18 18 G H5' H 1 4.58 0.02 . 2 . . . . . . . . 4345 1 271 . 2 2 18 18 G H5'' H 1 4.22 0.02 . 2 . . . . . . . . 4345 1 272 . 2 2 18 18 G C1' C 13 92.9 0.2 . 1 . . . . . . . . 4345 1 273 . 2 2 18 18 G C2' C 13 75.4 0.2 . 1 . . . . . . . . 4345 1 274 . 2 2 18 18 G C3' C 13 74.8 0.2 . 1 . . . . . . . . 4345 1 275 . 2 2 18 18 G C4' C 13 83.3 0.2 . 1 . . . . . . . . 4345 1 276 . 2 2 18 18 G C5' C 13 66.9 0.2 . 1 . . . . . . . . 4345 1 277 . 2 2 19 19 A H2 H 1 7.79 0.02 . 1 . . . . . . . . 4345 1 278 . 2 2 19 19 A H8 H 1 7.79 0.02 . 1 . . . . . . . . 4345 1 279 . 2 2 19 19 A C2 C 13 154.2 0.2 . 1 . . . . . . . . 4345 1 280 . 2 2 19 19 A C8 C 13 139.9 0.2 . 1 . . . . . . . . 4345 1 281 . 2 2 19 19 A H1' H 1 6.02 0.02 . 1 . . . . . . . . 4345 1 282 . 2 2 19 19 A H2' H 1 4.50 0.02 . 1 . . . . . . . . 4345 1 283 . 2 2 19 19 A H3' H 1 4.64 0.02 . 1 . . . . . . . . 4345 1 284 . 2 2 19 19 A H4' H 1 4.50 0.02 . 1 . . . . . . . . 4345 1 285 . 2 2 19 19 A H5' H 1 4.13 0.02 . 2 . . . . . . . . 4345 1 286 . 2 2 19 19 A H5'' H 1 4.56 0.02 . 2 . . . . . . . . 4345 1 287 . 2 2 19 19 A C1' C 13 93.3 0.2 . 1 . . . . . . . . 4345 1 288 . 2 2 19 19 A C2' C 13 76.1 0.2 . 1 . . . . . . . . 4345 1 289 . 2 2 19 19 A C3' C 13 72.7 0.2 . 1 . . . . . . . . 4345 1 290 . 2 2 19 19 A C4' C 13 82.6 0.2 . 1 . . . . . . . . 4345 1 291 . 2 2 19 19 A C5' C 13 64.9 0.2 . 1 . . . . . . . . 4345 1 292 . 2 2 20 20 C H41 H 1 8.55 0.02 . 2 . . . . . . . . 4345 1 293 . 2 2 20 20 C H42 H 1 6.99 0.02 . 2 . . . . . . . . 4345 1 294 . 2 2 20 20 C H5 H 1 5.22 0.02 . 1 . . . . . . . . 4345 1 295 . 2 2 20 20 C H6 H 1 7.42 0.02 . 1 . . . . . . . . 4345 1 296 . 2 2 20 20 C C5 C 13 97.8 0.2 . 1 . . . . . . . . 4345 1 297 . 2 2 20 20 C C6 C 13 141.0 0.0 . 1 . . . . . . . . 4345 1 298 . 2 2 20 20 C N4 N 15 98.3 0.2 . 1 . . . . . . . . 4345 1 299 . 2 2 20 20 C H1' H 1 5.51 0.02 . 1 . . . . . . . . 4345 1 300 . 2 2 20 20 C H2' H 1 4.41 0.02 . 1 . . . . . . . . 4345 1 301 . 2 2 20 20 C H3' H 1 4.40 0.02 . 1 . . . . . . . . 4345 1 302 . 2 2 20 20 C H4' H 1 4.41 0.02 . 1 . . . . . . . . 4345 1 303 . 2 2 20 20 C H5' H 1 4.07 0.02 . 2 . . . . . . . . 4345 1 304 . 2 2 20 20 C H5'' H 1 4.51 0.02 . 2 . . . . . . . . 4345 1 305 . 2 2 20 20 C C1' C 13 93.6 0.2 . 1 . . . . . . . . 4345 1 306 . 2 2 20 20 C C2' C 13 76.4 0.2 . 1 . . . . . . . . 4345 1 307 . 2 2 20 20 C C3' C 13 73.1 0.2 . 1 . . . . . . . . 4345 1 308 . 2 2 20 20 C C4' C 13 82.1 0.2 . 1 . . . . . . . . 4345 1 309 . 2 2 20 20 C C5' C 13 65.3 0.2 . 1 . . . . . . . . 4345 1 310 . 2 2 21 21 G H1 H 1 11.09 0.02 . 1 . . . . . . . . 4345 1 311 . 2 2 21 21 G H21 H 1 6.35 0.02 . 1 . . . . . . . . 4345 1 312 . 2 2 21 21 G H8 H 1 7.53 0.02 . 1 . . . . . . . . 4345 1 313 . 2 2 21 21 G C8 C 13 137.6 0.2 . 1 . . . . . . . . 4345 1 314 . 2 2 21 21 G N1 N 15 143.9 0.2 . 1 . . . . . . . . 4345 1 315 . 2 2 21 21 G N2 N 15 72.9 0.2 . 1 . . . . . . . . 4345 1 316 . 2 2 21 21 G H1' H 1 5.80 0.02 . 1 . . . . . . . . 4345 1 317 . 2 2 21 21 G H2' H 1 4.65 0.02 . 1 . . . . . . . . 4345 1 318 . 2 2 21 21 G H3' H 1 4.28 0.02 . 1 . . . . . . . . 4345 1 319 . 2 2 21 21 G H4' H 1 4.52 0.02 . 1 . . . . . . . . 4345 1 320 . 2 2 21 21 G H5' H 1 4.08 0.02 . 2 . . . . . . . . 4345 1 321 . 2 2 21 21 G H5'' H 1 4.41 0.02 . 2 . . . . . . . . 4345 1 322 . 2 2 21 21 G C1' C 13 94.0 0.2 . 1 . . . . . . . . 4345 1 323 . 2 2 21 21 G C2' C 13 75.6 0.2 . 1 . . . . . . . . 4345 1 324 . 2 2 21 21 G C3' C 13 74.1 0.2 . 1 . . . . . . . . 4345 1 325 . 2 2 21 21 G C4' C 13 83.1 0.2 . 1 . . . . . . . . 4345 1 326 . 2 2 21 21 G C5' C 13 64.8 0.2 . 1 . . . . . . . . 4345 1 327 . 2 2 22 22 C H41 H 1 7.97 0.02 . 2 . . . . . . . . 4345 1 328 . 2 2 22 22 C H42 H 1 6.99 0.02 . 2 . . . . . . . . 4345 1 329 . 2 2 22 22 C H5 H 1 5.23 0.02 . 1 . . . . . . . . 4345 1 330 . 2 2 22 22 C H6 H 1 7.55 0.02 . 1 . . . . . . . . 4345 1 331 . 2 2 22 22 C C5 C 13 97.7 0.2 . 1 . . . . . . . . 4345 1 332 . 2 2 22 22 C C6 C 13 140.5 0.2 . 1 . . . . . . . . 4345 1 333 . 2 2 22 22 C N4 N 15 98.8 0.2 . 1 . . . . . . . . 4345 1 334 . 2 2 22 22 C H1' H 1 5.60 0.02 . 1 . . . . . . . . 4345 1 335 . 2 2 22 22 C H2' H 1 4.47 0.02 . 1 . . . . . . . . 4345 1 336 . 2 2 22 22 C H3' H 1 4.52 0.02 . 1 . . . . . . . . 4345 1 337 . 2 2 22 22 C H4' H 1 4.47 0.02 . 1 . . . . . . . . 4345 1 338 . 2 2 22 22 C H5' H 1 4.11 0.02 . 2 . . . . . . . . 4345 1 339 . 2 2 22 22 C H5'' H 1 4.52 0.02 . 2 . . . . . . . . 4345 1 340 . 2 2 22 22 C C1' C 13 94.2 0.2 . 1 . . . . . . . . 4345 1 341 . 2 2 22 22 C C2' C 13 75.7 0.2 . 1 . . . . . . . . 4345 1 342 . 2 2 22 22 C C3' C 13 72.0 0.2 . 1 . . . . . . . . 4345 1 343 . 2 2 22 22 C C4' C 13 82.5 0.2 . 1 . . . . . . . . 4345 1 344 . 2 2 22 22 C C5' C 13 64.8 0.2 . 1 . . . . . . . . 4345 1 345 . 2 2 23 23 A H2 H 1 7.65 0.02 . 1 . . . . . . . . 4345 1 346 . 2 2 23 23 A H8 H 1 8.18 0.02 . 1 . . . . . . . . 4345 1 347 . 2 2 23 23 A C2 C 13 154.9 0.2 . 1 . . . . . . . . 4345 1 348 . 2 2 23 23 A C8 C 13 140.2 0.2 . 1 . . . . . . . . 4345 1 349 . 2 2 23 23 A H1' H 1 6.03 0.02 . 1 . . . . . . . . 4345 1 350 . 2 2 23 23 A H2' H 1 4.03 0.02 . 1 . . . . . . . . 4345 1 351 . 2 2 23 23 A H3' H 1 4.65 0.02 . 1 . . . . . . . . 4345 1 352 . 2 2 23 23 A H4' H 1 4.20 0.02 . 1 . . . . . . . . 4345 1 353 . 2 2 23 23 A C1' C 13 91.0 0.2 . 1 . . . . . . . . 4345 1 354 . 2 2 23 23 A C2' C 13 76.3 0.2 . 1 . . . . . . . . 4345 1 355 . 2 2 23 23 A C5' C 13 87.8 0.2 . 1 . . . . . . . . 4345 1 356 . 2 2 24 24 G H1 H 1 8.98 0.02 . 1 . . . . . . . . 4345 1 357 . 2 2 24 24 G H8 H 1 7.38 0.02 . 1 . . . . . . . . 4345 1 358 . 2 2 24 24 G C8 C 13 142.3 0.2 . 1 . . . . . . . . 4345 1 359 . 2 2 24 24 G N1 N 15 146.0 0.2 . 1 . . . . . . . . 4345 1 360 . 2 2 24 24 G H1' H 1 4.63 0.02 . 1 . . . . . . . . 4345 1 361 . 2 2 24 24 G H2' H 1 5.14 0.02 . 1 . . . . . . . . 4345 1 362 . 2 2 24 24 G H3' H 1 4.45 0.02 . 1 . . . . . . . . 4345 1 363 . 2 2 24 24 G H4' H 1 3.44 0.02 . 1 . . . . . . . . 4345 1 364 . 2 2 24 24 G H5' H 1 3.81 0.02 . 2 . . . . . . . . 4345 1 365 . 2 2 24 24 G H5'' H 1 4.04 0.02 . 2 . . . . . . . . 4345 1 366 . 2 2 24 24 G C1' C 13 90.8 0.2 . 1 . . . . . . . . 4345 1 367 . 2 2 24 24 G C2' C 13 71.5 0.2 . 1 . . . . . . . . 4345 1 368 . 2 2 24 24 G C3' C 13 79.2 0.2 . 1 . . . . . . . . 4345 1 369 . 2 2 24 24 G C4' C 13 85.5 0.2 . 1 . . . . . . . . 4345 1 370 . 2 2 24 24 G C5' C 13 69.0 0.2 . 1 . . . . . . . . 4345 1 371 . 2 2 25 25 A H2 H 1 8.32 0.02 . 1 . . . . . . . . 4345 1 372 . 2 2 25 25 A H8 H 1 8.67 0.02 . 1 . . . . . . . . 4345 1 373 . 2 2 25 25 A C2 C 13 156.4 0.2 . 1 . . . . . . . . 4345 1 374 . 2 2 25 25 A C8 C 13 143.1 0.2 . 1 . . . . . . . . 4345 1 375 . 2 2 25 25 A H1' H 1 6.24 0.02 . 1 . . . . . . . . 4345 1 376 . 2 2 25 25 A H2' H 1 4.63 0.02 . 1 . . . . . . . . 4345 1 377 . 2 2 25 25 A H3' H 1 4.60 0.02 . 1 . . . . . . . . 4345 1 378 . 2 2 25 25 A H4' H 1 5.24 0.02 . 1 . . . . . . . . 4345 1 379 . 2 2 25 25 A H5' H 1 4.32 0.02 . 2 . . . . . . . . 4345 1 380 . 2 2 25 25 A H5'' H 1 4.04 0.02 . 2 . . . . . . . . 4345 1 381 . 2 2 25 25 A C1' C 13 89.7 0.2 . 1 . . . . . . . . 4345 1 382 . 2 2 25 25 A C2' C 13 80.1 0.2 . 1 . . . . . . . . 4345 1 383 . 2 2 25 25 A C3' C 13 78.3 0.2 . 1 . . . . . . . . 4345 1 384 . 2 2 25 25 A C4' C 13 85.4 0.2 . 1 . . . . . . . . 4345 1 385 . 2 2 26 26 G H1 H 1 10.92 0.02 . 9 . . . . . . . . 4345 1 386 . 2 2 26 26 G H8 H 1 8.40 0.02 . 1 . . . . . . . . 4345 1 387 . 2 2 26 26 G C8 C 13 139.0 0.2 . 9 . . . . . . . . 4345 1 388 . 2 2 26 26 G N1 N 15 147.4 0.2 . 1 . . . . . . . . 4345 1 389 . 2 2 26 26 G H1' H 1 6.17 0.02 . 1 . . . . . . . . 4345 1 390 . 2 2 26 26 G H2' H 1 5.14 0.02 . 1 . . . . . . . . 4345 1 391 . 2 2 26 26 G H3' H 1 5.08 0.02 . 1 . . . . . . . . 4345 1 392 . 2 2 26 26 G H4' H 1 4.88 0.02 . 1 . . . . . . . . 4345 1 393 . 2 2 26 26 G H5' H 1 4.48 0.02 . 2 . . . . . . . . 4345 1 394 . 2 2 26 26 G H5'' H 1 4.31 0.02 . 2 . . . . . . . . 4345 1 395 . 2 2 26 26 G C1' C 13 86.1 0.2 . 1 . . . . . . . . 4345 1 396 . 2 2 26 26 G C2' C 13 77.5 0.2 . 1 . . . . . . . . 4345 1 397 . 2 2 26 26 G C3' C 13 82.1 0.2 . 1 . . . . . . . . 4345 1 398 . 2 2 26 26 G C4' C 13 87.2 0.2 . 1 . . . . . . . . 4345 1 399 . 2 2 27 27 A H2 H 1 8.14 0.02 . 1 . . . . . . . . 4345 1 400 . 2 2 27 27 A H8 H 1 8.25 0.02 . 1 . . . . . . . . 4345 1 401 . 2 2 27 27 A C2 C 13 155.3 0.2 . 1 . . . . . . . . 4345 1 402 . 2 2 27 27 A C8 C 13 143.7 0.2 . 1 . . . . . . . . 4345 1 403 . 2 2 27 27 A H1' H 1 6.30 0.02 . 1 . . . . . . . . 4345 1 404 . 2 2 27 27 A H2' H 1 4.90 0.02 . 1 . . . . . . . . 4345 1 405 . 2 2 27 27 A H3' H 1 4.62 0.02 . 1 . . . . . . . . 4345 1 406 . 2 2 27 27 A H4' H 1 4.82 0.02 . 1 . . . . . . . . 4345 1 407 . 2 2 27 27 A H5' H 1 4.26 0.02 . 2 . . . . . . . . 4345 1 408 . 2 2 27 27 A C1' C 13 94.6 0.2 . 1 . . . . . . . . 4345 1 409 . 2 2 27 27 A C4' C 13 81.7 0.2 . 1 . . . . . . . . 4345 1 410 . 2 2 28 28 U H3 H 1 11.79 0.02 . 9 . . . . . . . . 4345 1 411 . 2 2 28 28 U H5 H 1 4.95 0.02 . 9 . . . . . . . . 4345 1 412 . 2 2 28 28 U H6 H 1 7.35 0.02 . 1 . . . . . . . . 4345 1 413 . 2 2 28 28 U C5 C 13 105.5 0.2 . 9 . . . . . . . . 4345 1 414 . 2 2 28 28 U C6 C 13 142.5 0.2 . 1 . . . . . . . . 4345 1 415 . 2 2 28 28 U N1 N 15 158.4 0.2 . 1 . . . . . . . . 4345 1 416 . 2 2 28 28 U H1' H 1 5.73 0.02 . 1 . . . . . . . . 4345 1 417 . 2 2 28 28 U H2' H 1 4.53 0.02 . 1 . . . . . . . . 4345 1 418 . 2 2 28 28 U H4' H 1 4.40 0.02 . 1 . . . . . . . . 4345 1 419 . 2 2 28 28 U H5' H 1 4.36 0.02 . 2 . . . . . . . . 4345 1 420 . 2 2 28 28 U C1' C 13 93.0 0.2 . 1 . . . . . . . . 4345 1 421 . 2 2 29 29 G H1 H 1 12.47 0.02 . 1 . . . . . . . . 4345 1 422 . 2 2 29 29 G H8 H 1 7.74 0.02 . 1 . . . . . . . . 4345 1 423 . 2 2 29 29 G C8 C 13 137.2 0.2 . 1 . . . . . . . . 4345 1 424 . 2 2 29 29 G N1 N 15 147.0 0.2 . 1 . . . . . . . . 4345 1 425 . 2 2 29 29 G H1' H 1 5.52 0.02 . 1 . . . . . . . . 4345 1 426 . 2 2 29 29 G H2' H 1 4.31 0.02 . 1 . . . . . . . . 4345 1 427 . 2 2 29 29 G H3' H 1 4.55 0.02 . 1 . . . . . . . . 4345 1 428 . 2 2 29 29 G H4' H 1 4.50 0.02 . 1 . . . . . . . . 4345 1 429 . 2 2 29 29 G H5' H 1 4.30 0.02 . 2 . . . . . . . . 4345 1 430 . 2 2 29 29 G C1' C 13 94.2 0.2 . 1 . . . . . . . . 4345 1 431 . 2 2 29 29 G C2' C 13 75.8 0.2 . 1 . . . . . . . . 4345 1 432 . 2 2 29 29 G C3' C 13 74.0 0.2 . 1 . . . . . . . . 4345 1 433 . 2 2 29 29 G C4' C 13 83.0 0.2 . 1 . . . . . . . . 4345 1 434 . 2 2 29 29 G C5' C 13 68.6 0.2 . 1 . . . . . . . . 4345 1 435 . 2 2 30 30 G H1 H 1 13.25 0.02 . 1 . . . . . . . . 4345 1 436 . 2 2 30 30 G H8 H 1 7.21 0.02 . 1 . . . . . . . . 4345 1 437 . 2 2 30 30 G C8 C 13 136.7 0.2 . 1 . . . . . . . . 4345 1 438 . 2 2 30 30 G N1 N 15 148.2 0.2 . 1 . . . . . . . . 4345 1 439 . 2 2 30 30 G H1' H 1 5.81 0.02 . 1 . . . . . . . . 4345 1 440 . 2 2 30 30 G H2' H 1 4.53 0.02 . 1 . . . . . . . . 4345 1 441 . 2 2 30 30 G H3' H 1 4.56 0.02 . 1 . . . . . . . . 4345 1 442 . 2 2 30 30 G H4' H 1 4.51 0.02 . 1 . . . . . . . . 4345 1 443 . 2 2 30 30 G H5' H 1 4.57 0.02 . 2 . . . . . . . . 4345 1 444 . 2 2 30 30 G H5'' H 1 4.11 0.02 . 2 . . . . . . . . 4345 1 445 . 2 2 30 30 G C1' C 13 93.6 0.2 . 1 . . . . . . . . 4345 1 446 . 2 2 30 30 G C2' C 13 75.8 0.2 . 1 . . . . . . . . 4345 1 447 . 2 2 30 30 G C3' C 13 72.9 0.2 . 1 . . . . . . . . 4345 1 448 . 2 2 30 30 G C4' C 13 82.6 0.2 . 1 . . . . . . . . 4345 1 449 . 2 2 30 30 G C5' C 13 65.1 0.2 . 1 . . . . . . . . 4345 1 450 . 2 2 31 31 U H3 H 1 14.20 0.02 . 1 . . . . . . . . 4345 1 451 . 2 2 31 31 U H5 H 1 5.10 0.02 . 1 . . . . . . . . 4345 1 452 . 2 2 31 31 U H6 H 1 7.66 0.02 . 1 . . . . . . . . 4345 1 453 . 2 2 31 31 U C5 C 13 102.9 0.2 . 1 . . . . . . . . 4345 1 454 . 2 2 31 31 U C6 C 13 142.3 0.2 . 1 . . . . . . . . 4345 1 455 . 2 2 31 31 U N1 N 15 162.5 0.2 . 1 . . . . . . . . 4345 1 456 . 2 2 31 31 U H1' H 1 5.58 0.02 . 1 . . . . . . . . 4345 1 457 . 2 2 31 31 U H2' H 1 4.57 0.02 . 1 . . . . . . . . 4345 1 458 . 2 2 31 31 U H3' H 1 4.51 0.02 . 1 . . . . . . . . 4345 1 459 . 2 2 31 31 U H4' H 1 4.46 0.02 . 1 . . . . . . . . 4345 1 460 . 2 2 31 31 U H5' H 1 4.13 0.02 . 2 . . . . . . . . 4345 1 461 . 2 2 31 31 U H5'' H 1 4.44 0.02 . 2 . . . . . . . . 4345 1 462 . 2 2 31 31 U C1' C 13 94.3 0.2 . 1 . . . . . . . . 4345 1 463 . 2 2 31 31 U C2' C 13 75.6 0.2 . 1 . . . . . . . . 4345 1 464 . 2 2 31 31 U C3' C 13 72.7 0.2 . 1 . . . . . . . . 4345 1 465 . 2 2 31 31 U C4' C 13 82.2 0.2 . 1 . . . . . . . . 4345 1 466 . 2 2 31 31 U C5' C 13 65.3 0.2 . 1 . . . . . . . . 4345 1 467 . 2 2 32 32 C H41 H 1 8.64 0.02 . 2 . . . . . . . . 4345 1 468 . 2 2 32 32 C H42 H 1 7.13 0.02 . 2 . . . . . . . . 4345 1 469 . 2 2 32 32 C H5 H 1 5.69 0.02 . 1 . . . . . . . . 4345 1 470 . 2 2 32 32 C H6 H 1 7.84 0.02 . 1 . . . . . . . . 4345 1 471 . 2 2 32 32 C C5 C 13 98.1 0.2 . 1 . . . . . . . . 4345 1 472 . 2 2 32 32 C C6 C 13 142.1 0.2 . 1 . . . . . . . . 4345 1 473 . 2 2 32 32 C N4 N 15 98.2 0.2 . 1 . . . . . . . . 4345 1 474 . 2 2 32 32 C H1' H 1 5.60 0.02 . 1 . . . . . . . . 4345 1 475 . 2 2 32 32 C H2' H 1 4.40 0.02 . 1 . . . . . . . . 4345 1 476 . 2 2 32 32 C H3' H 1 4.68 0.02 . 1 . . . . . . . . 4345 1 477 . 2 2 32 32 C H4' H 1 4.48 0.02 . 1 . . . . . . . . 4345 1 478 . 2 2 32 32 C H5' H 1 4.15 0.02 . 2 . . . . . . . . 4345 1 479 . 2 2 32 32 C H5'' H 1 4.52 0.02 . 2 . . . . . . . . 4345 1 480 . 2 2 32 32 C C1' C 13 94.3 0.2 . 1 . . . . . . . . 4345 1 481 . 2 2 32 32 C C2' C 13 76.8 0.2 . 1 . . . . . . . . 4345 1 482 . 2 2 32 32 C C3' C 13 74.5 0.2 . 1 . . . . . . . . 4345 1 483 . 2 2 32 32 C C4' C 13 83.0 0.2 . 1 . . . . . . . . 4345 1 484 . 2 2 32 32 C C5' C 13 64.6 0.2 . 1 . . . . . . . . 4345 1 485 . 2 2 33 33 C H5 H 1 5.52 0.02 . 1 . . . . . . . . 4345 1 486 . 2 2 33 33 C H6 H 1 7.70 0.02 . 1 . . . . . . . . 4345 1 487 . 2 2 33 33 C C5 C 13 98.7 0.2 . 1 . . . . . . . . 4345 1 488 . 2 2 33 33 C C6 C 13 143.5 0.2 . 1 . . . . . . . . 4345 1 489 . 2 2 33 33 C H1' H 1 5.77 0.02 . 1 . . . . . . . . 4345 1 490 . 2 2 33 33 C H2' H 1 4.03 0.02 . 1 . . . . . . . . 4345 1 491 . 2 2 33 33 C H3' H 1 4.20 0.02 . 1 . . . . . . . . 4345 1 492 . 2 2 33 33 C H4' H 1 4.20 0.02 . 1 . . . . . . . . 4345 1 493 . 2 2 33 33 C H5' H 1 4.06 0.02 . 2 . . . . . . . . 4345 1 494 . 2 2 33 33 C H5'' H 1 4.54 0.02 . 2 . . . . . . . . 4345 1 495 . 2 2 33 33 C C1' C 13 93.1 0.2 . 1 . . . . . . . . 4345 1 496 . 2 2 33 33 C C2' C 13 77.9 0.2 . 1 . . . . . . . . 4345 1 497 . 2 2 33 33 C C3' C 13 70.2 0.2 . 1 . . . . . . . . 4345 1 498 . 2 2 33 33 C C4' C 13 83.8 0.2 . 1 . . . . . . . . 4345 1 499 . 2 2 33 33 C C5' C 13 65.6 0.2 . 1 . . . . . . . . 4345 1 stop_ save_ save_SHIFT_SET_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode SHIFT_SET_2 _Assigned_chem_shift_list.Entry_ID 4345 _Assigned_chem_shift_list.ID 2 _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 . 4345 2 . . 2 $SAMPLE_2 . 4345 2 . . 3 $SAMPLE_3 . 4345 2 . . 4 $SAMPLE_4 . 4345 2 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 ALA HA H 1 4.40 0.02 . 1 . . . . . . . . 4345 2 2 . 1 1 1 1 ALA HB1 H 1 1.50 0.02 . 1 . . . . . . . . 4345 2 3 . 1 1 1 1 ALA HB2 H 1 1.50 0.02 . 1 . . . . . . . . 4345 2 4 . 1 1 1 1 ALA HB3 H 1 1.50 0.02 . 1 . . . . . . . . 4345 2 5 . 1 1 1 1 ALA CA C 13 51.1 0.2 . 1 . . . . . . . . 4345 2 6 . 1 1 1 1 ALA CB C 13 18.2 0.2 . 1 . . . . . . . . 4345 2 7 . 1 1 2 2 PRO HA H 1 4.54 0.02 . 1 . . . . . . . . 4345 2 8 . 1 1 2 2 PRO HB2 H 1 2.32 0.02 . 1 . . . . . . . . 4345 2 9 . 1 1 2 2 PRO HB3 H 1 1.87 0.02 . 1 . . . . . . . . 4345 2 10 . 1 1 2 2 PRO HG2 H 1 2.05 0.02 . 1 . . . . . . . . 4345 2 11 . 1 1 2 2 PRO HG3 H 1 2.05 0.02 . 1 . . . . . . . . 4345 2 12 . 1 1 2 2 PRO HD2 H 1 3.71 0.02 . 2 . . . . . . . . 4345 2 13 . 1 1 2 2 PRO HD3 H 1 3.61 0.02 . 2 . . . . . . . . 4345 2 14 . 1 1 2 2 PRO C C 13 177.0 0.2 . 1 . . . . . . . . 4345 2 15 . 1 1 2 2 PRO CA C 13 63.2 0.2 . 1 . . . . . . . . 4345 2 16 . 1 1 2 2 PRO CB C 13 32.3 0.2 . 1 . . . . . . . . 4345 2 17 . 1 1 2 2 PRO CG C 13 27.7 0.2 . 1 . . . . . . . . 4345 2 18 . 1 1 2 2 PRO CD C 13 50.5 0.2 . 1 . . . . . . . . 4345 2 19 . 1 1 3 3 VAL H H 1 8.37 0.02 . 1 . . . . . . . . 4345 2 20 . 1 1 3 3 VAL HA H 1 4.08 0.02 . 1 . . . . . . . . 4345 2 21 . 1 1 3 3 VAL HB H 1 2.06 0.02 . 1 . . . . . . . . 4345 2 22 . 1 1 3 3 VAL HG11 H 1 0.96 0.02 . 2 . . . . . . . . 4345 2 23 . 1 1 3 3 VAL HG12 H 1 0.96 0.02 . 2 . . . . . . . . 4345 2 24 . 1 1 3 3 VAL HG13 H 1 0.96 0.02 . 2 . . . . . . . . 4345 2 25 . 1 1 3 3 VAL HG21 H 1 0.98 0.02 . 2 . . . . . . . . 4345 2 26 . 1 1 3 3 VAL HG22 H 1 0.98 0.02 . 2 . . . . . . . . 4345 2 27 . 1 1 3 3 VAL HG23 H 1 0.98 0.02 . 2 . . . . . . . . 4345 2 28 . 1 1 3 3 VAL C C 13 176.7 0.2 . 1 . . . . . . . . 4345 2 29 . 1 1 3 3 VAL CA C 13 62.6 0.2 . 1 . . . . . . . . 4345 2 30 . 1 1 3 3 VAL CB C 13 33.0 0.2 . 1 . . . . . . . . 4345 2 31 . 1 1 3 3 VAL CG1 C 13 21.6 0.2 . 1 . . . . . . . . 4345 2 32 . 1 1 3 3 VAL CG2 C 13 21.1 0.2 . 1 . . . . . . . . 4345 2 33 . 1 1 3 3 VAL N N 15 121.3 0.2 . 1 . . . . . . . . 4345 2 34 . 1 1 4 4 LYS H H 1 8.50 0.02 . 1 . . . . . . . . 4345 2 35 . 1 1 4 4 LYS HA H 1 4.35 0.02 . 1 . . . . . . . . 4345 2 36 . 1 1 4 4 LYS HB2 H 1 1.84 0.02 . 1 . . . . . . . . 4345 2 37 . 1 1 4 4 LYS HB3 H 1 1.71 0.02 . 1 . . . . . . . . 4345 2 38 . 1 1 4 4 LYS HG2 H 1 1.45 0.02 . 4 . . . . . . . . 4345 2 39 . 1 1 4 4 LYS HE2 H 1 2.95 0.02 . 1 . . . . . . . . 4345 2 40 . 1 1 4 4 LYS C C 13 176.9 0.2 . 1 . . . . . . . . 4345 2 41 . 1 1 4 4 LYS CA C 13 56.6 0.2 . 1 . . . . . . . . 4345 2 42 . 1 1 4 4 LYS CB C 13 33.2 0.2 . 1 . . . . . . . . 4345 2 43 . 1 1 4 4 LYS CG C 13 25.9 0.2 . 1 . . . . . . . . 4345 2 44 . 1 1 4 4 LYS CE C 13 42.4 0.2 . 1 . . . . . . . . 4345 2 45 . 1 1 4 4 LYS N N 15 125.8 0.2 . 1 . . . . . . . . 4345 2 46 . 1 1 5 5 SER H H 1 8.34 0.02 . 1 . . . . . . . . 4345 2 47 . 1 1 5 5 SER HA H 1 4.41 0.02 . 1 . . . . . . . . 4345 2 48 . 1 1 5 5 SER HB2 H 1 3.91 0.02 . 2 . . . . . . . . 4345 2 49 . 1 1 5 5 SER HB3 H 1 3.85 0.02 . 2 . . . . . . . . 4345 2 50 . 1 1 5 5 SER C C 13 175.2 0.2 . 1 . . . . . . . . 4345 2 51 . 1 1 5 5 SER CA C 13 58.7 0.2 . 1 . . . . . . . . 4345 2 52 . 1 1 5 5 SER CB C 13 64.1 0.2 . 1 . . . . . . . . 4345 2 53 . 1 1 5 5 SER N N 15 117.3 0.2 . 1 . . . . . . . . 4345 2 54 . 1 1 6 6 GLN H H 1 8.60 0.02 . 1 . . . . . . . . 4345 2 55 . 1 1 6 6 GLN HA H 1 4.31 0.02 . 1 . . . . . . . . 4345 2 56 . 1 1 6 6 GLN HB2 H 1 2.10 0.02 . 1 . . . . . . . . 4345 2 57 . 1 1 6 6 GLN HB3 H 1 1.95 0.02 . 1 . . . . . . . . 4345 2 58 . 1 1 6 6 GLN HG2 H 1 2.33 0.02 . 1 . . . . . . . . 4345 2 59 . 1 1 6 6 GLN HG3 H 1 2.33 0.02 . 1 . . . . . . . . 4345 2 60 . 1 1 6 6 GLN HE21 H 1 6.59 0.02 . 2 . . . . . . . . 4345 2 61 . 1 1 6 6 GLN HE22 H 1 7.47 0.02 . 2 . . . . . . . . 4345 2 62 . 1 1 6 6 GLN C C 13 176.5 0.2 . 1 . . . . . . . . 4345 2 63 . 1 1 6 6 GLN CA C 13 56.4 0.2 . 1 . . . . . . . . 4345 2 64 . 1 1 6 6 GLN CB C 13 29.3 0.2 . 1 . . . . . . . . 4345 2 65 . 1 1 6 6 GLN CG C 13 34.3 0.2 . 1 . . . . . . . . 4345 2 66 . 1 1 6 6 GLN CD C 13 180.6 0.2 . 1 . . . . . . . . 4345 2 67 . 1 1 6 6 GLN N N 15 122.8 0.2 . 1 . . . . . . . . 4345 2 68 . 1 1 6 6 GLN NE2 N 15 111.9 0.2 . 1 . . . . . . . . 4345 2 69 . 1 1 7 7 GLU H H 1 8.34 0.02 . 1 . . . . . . . . 4345 2 70 . 1 1 7 7 GLU HA H 1 4.29 0.02 . 1 . . . . . . . . 4345 2 71 . 1 1 7 7 GLU HB2 H 1 2.00 0.02 . 1 . . . . . . . . 4345 2 72 . 1 1 7 7 GLU HB3 H 1 1.95 0.02 . 1 . . . . . . . . 4345 2 73 . 1 1 7 7 GLU HG2 H 1 2.25 0.02 . 1 . . . . . . . . 4345 2 74 . 1 1 7 7 GLU HG3 H 1 2.25 0.02 . 1 . . . . . . . . 4345 2 75 . 1 1 7 7 GLU C C 13 177.6 0.2 . 1 . . . . . . . . 4345 2 76 . 1 1 7 7 GLU CA C 13 57.7 0.2 . 1 . . . . . . . . 4345 2 77 . 1 1 7 7 GLU CB C 13 30.5 0.2 . 1 . . . . . . . . 4345 2 78 . 1 1 7 7 GLU CG C 13 36.4 0.2 . 1 . . . . . . . . 4345 2 79 . 1 1 7 7 GLU N N 15 121.7 0.2 . 1 . . . . . . . . 4345 2 80 . 1 1 8 8 SER H H 1 8.39 0.02 . 1 . . . . . . . . 4345 2 81 . 1 1 8 8 SER HA H 1 4.46 0.02 . 1 . . . . . . . . 4345 2 82 . 1 1 8 8 SER HB2 H 1 4.10 0.02 . 1 . . . . . . . . 4345 2 83 . 1 1 8 8 SER HB3 H 1 3.97 0.02 . 1 . . . . . . . . 4345 2 84 . 1 1 8 8 SER C C 13 176.8 0.2 . 1 . . . . . . . . 4345 2 85 . 1 1 8 8 SER CA C 13 59.2 0.2 . 1 . . . . . . . . 4345 2 86 . 1 1 8 8 SER CB C 13 64.5 0.2 . 1 . . . . . . . . 4345 2 87 . 1 1 8 8 SER N N 15 116.9 0.2 . 1 . . . . . . . . 4345 2 88 . 1 1 9 9 ILE H H 1 8.53 0.02 . 1 . . . . . . . . 4345 2 89 . 1 1 9 9 ILE HA H 1 3.86 0.02 . 1 . . . . . . . . 4345 2 90 . 1 1 9 9 ILE HB H 1 1.98 0.02 . 1 . . . . . . . . 4345 2 91 . 1 1 9 9 ILE HG12 H 1 1.28 0.02 . 2 . . . . . . . . 4345 2 92 . 1 1 9 9 ILE HG13 H 1 1.38 0.02 . 2 . . . . . . . . 4345 2 93 . 1 1 9 9 ILE HG21 H 1 0.98 0.02 . 1 . . . . . . . . 4345 2 94 . 1 1 9 9 ILE HG22 H 1 0.98 0.02 . 1 . . . . . . . . 4345 2 95 . 1 1 9 9 ILE HG23 H 1 0.98 0.02 . 1 . . . . . . . . 4345 2 96 . 1 1 9 9 ILE HD11 H 1 0.59 0.02 . 1 . . . . . . . . 4345 2 97 . 1 1 9 9 ILE HD12 H 1 0.59 0.02 . 1 . . . . . . . . 4345 2 98 . 1 1 9 9 ILE HD13 H 1 0.59 0.02 . 1 . . . . . . . . 4345 2 99 . 1 1 9 9 ILE C C 13 177.2 0.2 . 1 . . . . . . . . 4345 2 100 . 1 1 9 9 ILE CA C 13 63.3 0.2 . 1 . . . . . . . . 4345 2 101 . 1 1 9 9 ILE CB C 13 37.9 0.2 . 1 . . . . . . . . 4345 2 102 . 1 1 9 9 ILE CG1 C 13 29.1 0.2 . 1 . . . . . . . . 4345 2 103 . 1 1 9 9 ILE CG2 C 13 17.6 0.2 . 1 . . . . . . . . 4345 2 104 . 1 1 9 9 ILE CD1 C 13 13.6 0.2 . 1 . . . . . . . . 4345 2 105 . 1 1 9 9 ILE N N 15 122.2 0.2 . 1 . . . . . . . . 4345 2 106 . 1 1 10 10 ASN H H 1 8.30 0.02 . 1 . . . . . . . . 4345 2 107 . 1 1 10 10 ASN HA H 1 4.24 0.02 . 1 . . . . . . . . 4345 2 108 . 1 1 10 10 ASN HB2 H 1 2.85 0.02 . 1 . . . . . . . . 4345 2 109 . 1 1 10 10 ASN HB3 H 1 2.85 0.02 . 1 . . . . . . . . 4345 2 110 . 1 1 10 10 ASN HD21 H 1 6.82 0.02 . 2 . . . . . . . . 4345 2 111 . 1 1 10 10 ASN HD22 H 1 7.46 0.02 . 2 . . . . . . . . 4345 2 112 . 1 1 10 10 ASN C C 13 178.6 0.2 . 1 . . . . . . . . 4345 2 113 . 1 1 10 10 ASN CA C 13 57.2 0.2 . 1 . . . . . . . . 4345 2 114 . 1 1 10 10 ASN CB C 13 37.2 0.2 . 1 . . . . . . . . 4345 2 115 . 1 1 10 10 ASN CG C 13 175.7 0.2 . 1 . . . . . . . . 4345 2 116 . 1 1 10 10 ASN N N 15 120.9 0.2 . 1 . . . . . . . . 4345 2 117 . 1 1 10 10 ASN ND2 N 15 109.1 0.2 . 1 . . . . . . . . 4345 2 118 . 1 1 11 11 GLN H H 1 8.04 0.02 . 1 . . . . . . . . 4345 2 119 . 1 1 11 11 GLN HA H 1 4.10 0.02 . 1 . . . . . . . . 4345 2 120 . 1 1 11 11 GLN HB2 H 1 2.24 0.02 . 1 . . . . . . . . 4345 2 121 . 1 1 11 11 GLN HB3 H 1 2.16 0.02 . 1 . . . . . . . . 4345 2 122 . 1 1 11 11 GLN HG2 H 1 1.94 0.02 . 1 . . . . . . . . 4345 2 123 . 1 1 11 11 GLN HG3 H 1 2.44 0.02 . 1 . . . . . . . . 4345 2 124 . 1 1 11 11 GLN HE21 H 1 6.82 0.02 . 2 . . . . . . . . 4345 2 125 . 1 1 11 11 GLN HE22 H 1 7.45 0.02 . 2 . . . . . . . . 4345 2 126 . 1 1 11 11 GLN C C 13 179.1 0.2 . 1 . . . . . . . . 4345 2 127 . 1 1 11 11 GLN CA C 13 59.1 0.2 . 1 . . . . . . . . 4345 2 128 . 1 1 11 11 GLN CB C 13 28.6 0.2 . 1 . . . . . . . . 4345 2 129 . 1 1 11 11 GLN CG C 13 34.3 0.2 . 1 . . . . . . . . 4345 2 130 . 1 1 11 11 GLN CD C 13 180.4 0.2 . 1 . . . . . . . . 4345 2 131 . 1 1 11 11 GLN N N 15 120.4 0.2 . 1 . . . . . . . . 4345 2 132 . 1 1 11 11 GLN NE2 N 15 111.4 0.2 . 1 . . . . . . . . 4345 2 133 . 1 1 12 12 LYS H H 1 7.83 0.02 . 1 . . . . . . . . 4345 2 134 . 1 1 12 12 LYS HA H 1 4.12 0.02 . 1 . . . . . . . . 4345 2 135 . 1 1 12 12 LYS HB2 H 1 1.79 0.02 . 2 . . . . . . . . 4345 2 136 . 1 1 12 12 LYS HB3 H 1 1.83 0.02 . 2 . . . . . . . . 4345 2 137 . 1 1 12 12 LYS HG2 H 1 1.54 0.02 . 4 . . . . . . . . 4345 2 138 . 1 1 12 12 LYS HG3 H 1 1.64 0.02 . 4 . . . . . . . . 4345 2 139 . 1 1 12 12 LYS HD2 H 1 0.00 0.02 . 4 . . . . . . . . 4345 2 140 . 1 1 12 12 LYS HE2 H 1 3.06 0.02 . 2 . . . . . . . . 4345 2 141 . 1 1 12 12 LYS C C 13 180.4 0.2 . 1 . . . . . . . . 4345 2 142 . 1 1 12 12 LYS CA C 13 59.7 0.2 . 1 . . . . . . . . 4345 2 143 . 1 1 12 12 LYS CB C 13 33.7 0.2 . 1 . . . . . . . . 4345 2 144 . 1 1 12 12 LYS CG C 13 26.3 0.2 . 1 . . . . . . . . 4345 2 145 . 1 1 12 12 LYS N N 15 119.7 0.2 . 1 . . . . . . . . 4345 2 146 . 1 1 13 13 LEU H H 1 8.51 0.02 . 1 . . . . . . . . 4345 2 147 . 1 1 13 13 LEU HA H 1 3.82 0.02 . 1 . . . . . . . . 4345 2 148 . 1 1 13 13 LEU HB2 H 1 1.31 0.02 . 1 . . . . . . . . 4345 2 149 . 1 1 13 13 LEU HB3 H 1 1.63 0.02 . 1 . . . . . . . . 4345 2 150 . 1 1 13 13 LEU HG H 1 1.42 0.02 . 1 . . . . . . . . 4345 2 151 . 1 1 13 13 LEU HD11 H 1 0.51 0.02 . 1 . . . . . . . . 4345 2 152 . 1 1 13 13 LEU HD12 H 1 0.51 0.02 . 1 . . . . . . . . 4345 2 153 . 1 1 13 13 LEU HD13 H 1 0.51 0.02 . 1 . . . . . . . . 4345 2 154 . 1 1 13 13 LEU HD21 H 1 0.43 0.02 . 1 . . . . . . . . 4345 2 155 . 1 1 13 13 LEU HD22 H 1 0.43 0.02 . 1 . . . . . . . . 4345 2 156 . 1 1 13 13 LEU HD23 H 1 0.43 0.02 . 1 . . . . . . . . 4345 2 157 . 1 1 13 13 LEU C C 13 178.5 0.2 . 1 . . . . . . . . 4345 2 158 . 1 1 13 13 LEU CA C 13 57.3 0.2 . 1 . . . . . . . . 4345 2 159 . 1 1 13 13 LEU CB C 13 41.8 0.2 . 1 . . . . . . . . 4345 2 160 . 1 1 13 13 LEU CG C 13 27.4 0.2 . 1 . . . . . . . . 4345 2 161 . 1 1 13 13 LEU CD1 C 13 25.0 0.2 . 1 . . . . . . . . 4345 2 162 . 1 1 13 13 LEU CD2 C 13 23.9 0.2 . 1 . . . . . . . . 4345 2 163 . 1 1 13 13 LEU N N 15 120.0 0.2 . 1 . . . . . . . . 4345 2 164 . 1 1 14 14 ALA H H 1 8.04 0.02 . 1 . . . . . . . . 4345 2 165 . 1 1 14 14 ALA HA H 1 3.93 0.02 . 1 . . . . . . . . 4345 2 166 . 1 1 14 14 ALA HB1 H 1 1.48 0.02 . 1 . . . . . . . . 4345 2 167 . 1 1 14 14 ALA HB2 H 1 1.48 0.02 . 1 . . . . . . . . 4345 2 168 . 1 1 14 14 ALA HB3 H 1 1.48 0.02 . 1 . . . . . . . . 4345 2 169 . 1 1 14 14 ALA C C 13 180.8 0.2 . 1 . . . . . . . . 4345 2 170 . 1 1 14 14 ALA CA C 13 55.5 0.2 . 1 . . . . . . . . 4345 2 171 . 1 1 14 14 ALA CB C 13 17.9 0.2 . 1 . . . . . . . . 4345 2 172 . 1 1 14 14 ALA N N 15 121.5 0.2 . 1 . . . . . . . . 4345 2 173 . 1 1 15 15 LEU H H 1 7.36 0.02 . 1 . . . . . . . . 4345 2 174 . 1 1 15 15 LEU HA H 1 4.29 0.02 . 1 . . . . . . . . 4345 2 175 . 1 1 15 15 LEU HB2 H 1 1.79 0.02 . 1 . . . . . . . . 4345 2 176 . 1 1 15 15 LEU HB3 H 1 1.55 0.02 . 1 . . . . . . . . 4345 2 177 . 1 1 15 15 LEU HG H 1 1.64 0.02 . 1 . . . . . . . . 4345 2 178 . 1 1 15 15 LEU HD11 H 1 0.98 0.02 . 1 . . . . . . . . 4345 2 179 . 1 1 15 15 LEU HD12 H 1 0.98 0.02 . 1 . . . . . . . . 4345 2 180 . 1 1 15 15 LEU HD13 H 1 0.98 0.02 . 1 . . . . . . . . 4345 2 181 . 1 1 15 15 LEU HD21 H 1 0.88 0.02 . 1 . . . . . . . . 4345 2 182 . 1 1 15 15 LEU HD22 H 1 0.88 0.02 . 1 . . . . . . . . 4345 2 183 . 1 1 15 15 LEU HD23 H 1 0.88 0.02 . 1 . . . . . . . . 4345 2 184 . 1 1 15 15 LEU C C 13 180.9 0.2 . 1 . . . . . . . . 4345 2 185 . 1 1 15 15 LEU CA C 13 57.5 0.2 . 1 . . . . . . . . 4345 2 186 . 1 1 15 15 LEU CB C 13 42.3 0.2 . 1 . . . . . . . . 4345 2 187 . 1 1 15 15 LEU CG C 13 28.1 0.2 . 1 . . . . . . . . 4345 2 188 . 1 1 15 15 LEU CD1 C 13 25.0 0.2 . 1 . . . . . . . . 4345 2 189 . 1 1 15 15 LEU CD2 C 13 24.7 0.2 . 1 . . . . . . . . 4345 2 190 . 1 1 15 15 LEU N N 15 116.4 0.2 . 1 . . . . . . . . 4345 2 191 . 1 1 16 16 VAL H H 1 7.85 0.02 . 1 . . . . . . . . 4345 2 192 . 1 1 16 16 VAL HA H 1 3.64 0.02 . 1 . . . . . . . . 4345 2 193 . 1 1 16 16 VAL HB H 1 2.26 0.02 . 1 . . . . . . . . 4345 2 194 . 1 1 16 16 VAL HG11 H 1 1.20 0.02 . 1 . . . . . . . . 4345 2 195 . 1 1 16 16 VAL HG12 H 1 1.20 0.02 . 1 . . . . . . . . 4345 2 196 . 1 1 16 16 VAL HG13 H 1 1.20 0.02 . 1 . . . . . . . . 4345 2 197 . 1 1 16 16 VAL HG21 H 1 0.95 0.02 . 1 . . . . . . . . 4345 2 198 . 1 1 16 16 VAL HG22 H 1 0.95 0.02 . 1 . . . . . . . . 4345 2 199 . 1 1 16 16 VAL HG23 H 1 0.95 0.02 . 1 . . . . . . . . 4345 2 200 . 1 1 16 16 VAL C C 13 178.1 0.2 . 1 . . . . . . . . 4345 2 201 . 1 1 16 16 VAL CA C 13 66.5 0.2 . 1 . . . . . . . . 4345 2 202 . 1 1 16 16 VAL CB C 13 31.6 0.2 . 1 . . . . . . . . 4345 2 203 . 1 1 16 16 VAL CG1 C 13 23.6 0.2 . 1 . . . . . . . . 4345 2 204 . 1 1 16 16 VAL CG2 C 13 22.1 0.2 . 1 . . . . . . . . 4345 2 205 . 1 1 16 16 VAL N N 15 124.2 0.2 . 1 . . . . . . . . 4345 2 206 . 1 1 17 17 ILE H H 1 7.87 0.02 . 1 . . . . . . . . 4345 2 207 . 1 1 17 17 ILE HA H 1 3.70 0.02 . 1 . . . . . . . . 4345 2 208 . 1 1 17 17 ILE HB H 1 1.91 0.02 . 1 . . . . . . . . 4345 2 209 . 1 1 17 17 ILE HG12 H 1 0.93 0.02 . 2 . . . . . . . . 4345 2 210 . 1 1 17 17 ILE HG13 H 1 1.21 0.02 . 2 . . . . . . . . 4345 2 211 . 1 1 17 17 ILE HG21 H 1 0.67 0.02 . 1 . . . . . . . . 4345 2 212 . 1 1 17 17 ILE HG22 H 1 0.67 0.02 . 1 . . . . . . . . 4345 2 213 . 1 1 17 17 ILE HG23 H 1 0.67 0.02 . 1 . . . . . . . . 4345 2 214 . 1 1 17 17 ILE HD11 H 1 0.02 0.02 . 1 . . . . . . . . 4345 2 215 . 1 1 17 17 ILE HD12 H 1 0.02 0.02 . 1 . . . . . . . . 4345 2 216 . 1 1 17 17 ILE HD13 H 1 0.02 0.02 . 1 . . . . . . . . 4345 2 217 . 1 1 17 17 ILE C C 13 179.0 0.2 . 1 . . . . . . . . 4345 2 218 . 1 1 17 17 ILE CA C 13 62.9 0.2 . 1 . . . . . . . . 4345 2 219 . 1 1 17 17 ILE CB C 13 36.4 0.2 . 1 . . . . . . . . 4345 2 220 . 1 1 17 17 ILE CG1 C 13 27.4 0.2 . 1 . . . . . . . . 4345 2 221 . 1 1 17 17 ILE CG2 C 13 17.3 0.2 . 1 . . . . . . . . 4345 2 222 . 1 1 17 17 ILE CD1 C 13 9.9 0.2 . 1 . . . . . . . . 4345 2 223 . 1 1 17 17 ILE N N 15 118.9 0.2 . 1 . . . . . . . . 4345 2 224 . 1 1 18 18 LYS H H 1 7.55 0.02 . 1 . . . . . . . . 4345 2 225 . 1 1 18 18 LYS HA H 1 4.29 0.02 . 1 . . . . . . . . 4345 2 226 . 1 1 18 18 LYS HB2 H 1 1.92 0.02 . 1 . . . . . . . . 4345 2 227 . 1 1 18 18 LYS HB3 H 1 1.92 0.02 . 1 . . . . . . . . 4345 2 228 . 1 1 18 18 LYS HG2 H 1 1.52 0.02 . 4 . . . . . . . . 4345 2 229 . 1 1 18 18 LYS C C 13 178.0 0.2 . 1 . . . . . . . . 4345 2 230 . 1 1 18 18 LYS CA C 13 58.5 0.2 . 1 . . . . . . . . 4345 2 231 . 1 1 18 18 LYS CB C 13 34.0 0.2 . 1 . . . . . . . . 4345 2 232 . 1 1 18 18 LYS CG C 13 25.6 0.2 . 1 . . . . . . . . 4345 2 233 . 1 1 18 18 LYS N N 15 117.5 0.2 . 1 . . . . . . . . 4345 2 234 . 1 1 19 19 SER H H 1 7.94 0.02 . 1 . . . . . . . . 4345 2 235 . 1 1 19 19 SER HA H 1 4.95 0.02 . 1 . . . . . . . . 4345 2 236 . 1 1 19 19 SER HB2 H 1 4.12 0.02 . 1 . . . . . . . . 4345 2 237 . 1 1 19 19 SER HB3 H 1 3.83 0.02 . 1 . . . . . . . . 4345 2 238 . 1 1 19 19 SER C C 13 174.5 0.2 . 1 . . . . . . . . 4345 2 239 . 1 1 19 19 SER CA C 13 59.2 0.2 . 1 . . . . . . . . 4345 2 240 . 1 1 19 19 SER CB C 13 67.7 0.2 . 1 . . . . . . . . 4345 2 241 . 1 1 19 19 SER N N 15 110.4 0.2 . 1 . . . . . . . . 4345 2 242 . 1 1 20 20 GLY H H 1 8.99 0.02 . 1 . . . . . . . . 4345 2 243 . 1 1 20 20 GLY HA2 H 1 4.52 0.02 . 2 . . . . . . . . 4345 2 244 . 1 1 20 20 GLY HA3 H 1 3.74 0.02 . 2 . . . . . . . . 4345 2 245 . 1 1 20 20 GLY C C 13 173.6 0.2 . 1 . . . . . . . . 4345 2 246 . 1 1 20 20 GLY CA C 13 44.1 0.2 . 1 . . . . . . . . 4345 2 247 . 1 1 20 20 GLY N N 15 115.2 0.2 . 1 . . . . . . . . 4345 2 248 . 1 1 21 21 LYS H H 1 9.00 0.02 . 1 . . . . . . . . 4345 2 249 . 1 1 21 21 LYS HA H 1 4.98 0.02 . 1 . . . . . . . . 4345 2 250 . 1 1 21 21 LYS HB2 H 1 1.66 0.02 . 1 . . . . . . . . 4345 2 251 . 1 1 21 21 LYS HB3 H 1 1.72 0.02 . 1 . . . . . . . . 4345 2 252 . 1 1 21 21 LYS HG2 H 1 1.49 0.02 . 4 . . . . . . . . 4345 2 253 . 1 1 21 21 LYS HG3 H 1 1.37 0.02 . 4 . . . . . . . . 4345 2 254 . 1 1 21 21 LYS HE2 H 1 2.96 0.02 . 2 . . . . . . . . 4345 2 255 . 1 1 21 21 LYS C C 13 175.7 0.2 . 1 . . . . . . . . 4345 2 256 . 1 1 21 21 LYS CA C 13 55.5 0.2 . 1 . . . . . . . . 4345 2 257 . 1 1 21 21 LYS CB C 13 36.8 0.2 . 1 . . . . . . . . 4345 2 258 . 1 1 21 21 LYS CG C 13 25.6 0.2 . 1 . . . . . . . . 4345 2 259 . 1 1 21 21 LYS N N 15 119.4 0.2 . 1 . . . . . . . . 4345 2 260 . 1 1 22 22 TYR H H 1 8.55 0.02 . 1 . . . . . . . . 4345 2 261 . 1 1 22 22 TYR HA H 1 5.53 0.02 . 1 . . . . . . . . 4345 2 262 . 1 1 22 22 TYR HB2 H 1 2.78 0.02 . 1 . . . . . . . . 4345 2 263 . 1 1 22 22 TYR HB3 H 1 2.78 0.02 . 1 . . . . . . . . 4345 2 264 . 1 1 22 22 TYR HD1 H 1 6.55 0.02 . 1 . . . . . . . . 4345 2 265 . 1 1 22 22 TYR HD2 H 1 6.55 0.02 . 1 . . . . . . . . 4345 2 266 . 1 1 22 22 TYR HE1 H 1 6.87 0.02 . 1 . . . . . . . . 4345 2 267 . 1 1 22 22 TYR HE2 H 1 6.87 0.02 . 1 . . . . . . . . 4345 2 268 . 1 1 22 22 TYR C C 13 173.1 0.2 . 1 . . . . . . . . 4345 2 269 . 1 1 22 22 TYR CA C 13 56.3 0.2 . 1 . . . . . . . . 4345 2 270 . 1 1 22 22 TYR CB C 13 41.2 0.2 . 1 . . . . . . . . 4345 2 271 . 1 1 22 22 TYR CD1 C 13 133.4 0.2 . 1 . . . . . . . . 4345 2 272 . 1 1 22 22 TYR CD2 C 13 133.4 0.2 . 1 . . . . . . . . 4345 2 273 . 1 1 22 22 TYR CE1 C 13 118.7 0.2 . 1 . . . . . . . . 4345 2 274 . 1 1 22 22 TYR CE2 C 13 118.7 0.2 . 1 . . . . . . . . 4345 2 275 . 1 1 22 22 TYR N N 15 123.0 0.2 . 1 . . . . . . . . 4345 2 276 . 1 1 23 23 THR H H 1 9.13 0.02 . 1 . . . . . . . . 4345 2 277 . 1 1 23 23 THR HA H 1 4.64 0.02 . 1 . . . . . . . . 4345 2 278 . 1 1 23 23 THR HB H 1 3.92 0.02 . 1 . . . . . . . . 4345 2 279 . 1 1 23 23 THR HG21 H 1 1.06 0.02 . 1 . . . . . . . . 4345 2 280 . 1 1 23 23 THR HG22 H 1 1.06 0.02 . 1 . . . . . . . . 4345 2 281 . 1 1 23 23 THR HG23 H 1 1.06 0.02 . 1 . . . . . . . . 4345 2 282 . 1 1 23 23 THR C C 13 171.1 0.2 . 1 . . . . . . . . 4345 2 283 . 1 1 23 23 THR CA C 13 61.1 0.2 . 1 . . . . . . . . 4345 2 284 . 1 1 23 23 THR CB C 13 70.6 0.2 . 1 . . . . . . . . 4345 2 285 . 1 1 23 23 THR CG2 C 13 19.2 0.2 . 1 . . . . . . . . 4345 2 286 . 1 1 23 23 THR N N 15 113.3 0.2 . 1 . . . . . . . . 4345 2 287 . 1 1 24 24 LEU H H 1 8.65 0.02 . 1 . . . . . . . . 4345 2 288 . 1 1 24 24 LEU HA H 1 4.80 0.02 . 1 . . . . . . . . 4345 2 289 . 1 1 24 24 LEU HB2 H 1 1.89 0.02 . 1 . . . . . . . . 4345 2 290 . 1 1 24 24 LEU HB3 H 1 1.07 0.02 . 1 . . . . . . . . 4345 2 291 . 1 1 24 24 LEU HG H 1 1.91 0.02 . 1 . . . . . . . . 4345 2 292 . 1 1 24 24 LEU HD11 H 1 0.83 0.02 . 1 . . . . . . . . 4345 2 293 . 1 1 24 24 LEU HD12 H 1 0.83 0.02 . 1 . . . . . . . . 4345 2 294 . 1 1 24 24 LEU HD13 H 1 0.83 0.02 . 1 . . . . . . . . 4345 2 295 . 1 1 24 24 LEU HD21 H 1 0.78 0.02 . 1 . . . . . . . . 4345 2 296 . 1 1 24 24 LEU HD22 H 1 0.78 0.02 . 1 . . . . . . . . 4345 2 297 . 1 1 24 24 LEU HD23 H 1 0.78 0.02 . 1 . . . . . . . . 4345 2 298 . 1 1 24 24 LEU C C 13 176.7 0.2 . 1 . . . . . . . . 4345 2 299 . 1 1 24 24 LEU CA C 13 53.5 0.2 . 1 . . . . . . . . 4345 2 300 . 1 1 24 24 LEU CB C 13 43.6 0.2 . 1 . . . . . . . . 4345 2 301 . 1 1 24 24 LEU CG C 13 27.1 0.2 . 1 . . . . . . . . 4345 2 302 . 1 1 24 24 LEU CD1 C 13 25.7 0.2 . 2 . . . . . . . . 4345 2 303 . 1 1 24 24 LEU CD2 C 13 26.8 0.2 . 2 . . . . . . . . 4345 2 304 . 1 1 24 24 LEU N N 15 125.3 0.2 . 1 . . . . . . . . 4345 2 305 . 1 1 25 25 GLY H H 1 8.20 0.02 . 1 . . . . . . . . 4345 2 306 . 1 1 25 25 GLY HA2 H 1 4.62 0.02 . 2 . . . . . . . . 4345 2 307 . 1 1 25 25 GLY HA3 H 1 4.40 0.02 . 2 . . . . . . . . 4345 2 308 . 1 1 25 25 GLY C C 13 176.8 0.2 . 1 . . . . . . . . 4345 2 309 . 1 1 25 25 GLY CA C 13 44.4 0.2 . 1 . . . . . . . . 4345 2 310 . 1 1 25 25 GLY N N 15 107.2 0.2 . 1 . . . . . . . . 4345 2 311 . 1 1 26 26 TYR H H 1 9.57 0.02 . 1 . . . . . . . . 4345 2 312 . 1 1 26 26 TYR HA H 1 4.00 0.02 . 1 . . . . . . . . 4345 2 313 . 1 1 26 26 TYR HB2 H 1 3.04 0.02 . 1 . . . . . . . . 4345 2 314 . 1 1 26 26 TYR HB3 H 1 2.82 0.02 . 1 . . . . . . . . 4345 2 315 . 1 1 26 26 TYR HD1 H 1 7.06 0.02 . 1 . . . . . . . . 4345 2 316 . 1 1 26 26 TYR HD2 H 1 7.06 0.02 . 1 . . . . . . . . 4345 2 317 . 1 1 26 26 TYR HE1 H 1 6.93 0.02 . 1 . . . . . . . . 4345 2 318 . 1 1 26 26 TYR HE2 H 1 6.93 0.02 . 1 . . . . . . . . 4345 2 319 . 1 1 26 26 TYR C C 13 176.5 0.2 . 1 . . . . . . . . 4345 2 320 . 1 1 26 26 TYR CA C 13 63.7 0.2 . 1 . . . . . . . . 4345 2 321 . 1 1 26 26 TYR CB C 13 35.9 0.2 . 1 . . . . . . . . 4345 2 322 . 1 1 26 26 TYR CD1 C 13 133.2 0.2 . 1 . . . . . . . . 4345 2 323 . 1 1 26 26 TYR CD2 C 13 133.2 0.2 . 1 . . . . . . . . 4345 2 324 . 1 1 26 26 TYR CE1 C 13 119.3 0.2 . 1 . . . . . . . . 4345 2 325 . 1 1 26 26 TYR CE2 C 13 119.3 0.2 . 1 . . . . . . . . 4345 2 326 . 1 1 26 26 TYR N N 15 124.9 0.2 . 1 . . . . . . . . 4345 2 327 . 1 1 27 27 LYS H H 1 9.55 0.02 . 1 . . . . . . . . 4345 2 328 . 1 1 27 27 LYS HA H 1 3.65 0.02 . 1 . . . . . . . . 4345 2 329 . 1 1 27 27 LYS HB2 H 1 1.69 0.02 . 2 . . . . . . . . 4345 2 330 . 1 1 27 27 LYS HB3 H 1 1.74 0.02 . 2 . . . . . . . . 4345 2 331 . 1 1 27 27 LYS HG2 H 1 1.48 0.02 . 4 . . . . . . . . 4345 2 332 . 1 1 27 27 LYS HD2 H 1 2.02 0.02 . 2 . . . . . . . . 4345 2 333 . 1 1 27 27 LYS HD3 H 1 2.18 0.02 . 2 . . . . . . . . 4345 2 334 . 1 1 27 27 LYS HE2 H 1 3.14 0.02 . 1 . . . . . . . . 4345 2 335 . 1 1 27 27 LYS HE3 H 1 3.00 0.02 . 1 . . . . . . . . 4345 2 336 . 1 1 27 27 LYS C C 13 181.0 0.2 . 1 . . . . . . . . 4345 2 337 . 1 1 27 27 LYS CA C 13 61.5 0.2 . 1 . . . . . . . . 4345 2 338 . 1 1 27 27 LYS CB C 13 31.3 0.2 . 1 . . . . . . . . 4345 2 339 . 1 1 27 27 LYS CG C 13 26.5 0.2 . 1 . . . . . . . . 4345 2 340 . 1 1 27 27 LYS CE C 13 42.0 0.2 . 1 . . . . . . . . 4345 2 341 . 1 1 27 27 LYS N N 15 119.9 0.2 . 1 . . . . . . . . 4345 2 342 . 1 1 28 28 SER H H 1 9.73 0.02 . 1 . . . . . . . . 4345 2 343 . 1 1 28 28 SER HA H 1 3.91 0.02 . 1 . . . . . . . . 4345 2 344 . 1 1 28 28 SER HB2 H 1 4.01 0.02 . 2 . . . . . . . . 4345 2 345 . 1 1 28 28 SER HB3 H 1 3.82 0.02 . 2 . . . . . . . . 4345 2 346 . 1 1 28 28 SER C C 13 179.2 0.2 . 1 . . . . . . . . 4345 2 347 . 1 1 28 28 SER CA C 13 61.3 0.2 . 1 . . . . . . . . 4345 2 348 . 1 1 28 28 SER N N 15 117.8 0.2 . 1 . . . . . . . . 4345 2 349 . 1 1 29 29 THR H H 1 8.41 0.02 . 1 . . . . . . . . 4345 2 350 . 1 1 29 29 THR HA H 1 3.71 0.02 . 1 . . . . . . . . 4345 2 351 . 1 1 29 29 THR HB H 1 4.17 0.02 . 1 . . . . . . . . 4345 2 352 . 1 1 29 29 THR HG21 H 1 0.93 0.02 . 1 . . . . . . . . 4345 2 353 . 1 1 29 29 THR HG22 H 1 0.93 0.02 . 1 . . . . . . . . 4345 2 354 . 1 1 29 29 THR HG23 H 1 0.93 0.02 . 1 . . . . . . . . 4345 2 355 . 1 1 29 29 THR C C 13 178.4 0.2 . 1 . . . . . . . . 4345 2 356 . 1 1 29 29 THR CA C 13 68.5 0.2 . 1 . . . . . . . . 4345 2 357 . 1 1 29 29 THR CB C 13 66.8 0.2 . 1 . . . . . . . . 4345 2 358 . 1 1 29 29 THR CG2 C 13 23.0 0.2 . 1 . . . . . . . . 4345 2 359 . 1 1 29 29 THR N N 15 125.8 0.2 . 1 . . . . . . . . 4345 2 360 . 1 1 30 30 VAL H H 1 8.86 0.02 . 1 . . . . . . . . 4345 2 361 . 1 1 30 30 VAL HA H 1 3.18 0.02 . 1 . . . . . . . . 4345 2 362 . 1 1 30 30 VAL HB H 1 1.74 0.02 . 1 . . . . . . . . 4345 2 363 . 1 1 30 30 VAL HG11 H 1 0.45 0.02 . 1 . . . . . . . . 4345 2 364 . 1 1 30 30 VAL HG12 H 1 0.45 0.02 . 1 . . . . . . . . 4345 2 365 . 1 1 30 30 VAL HG13 H 1 0.45 0.02 . 1 . . . . . . . . 4345 2 366 . 1 1 30 30 VAL HG21 H 1 0.38 0.02 . 1 . . . . . . . . 4345 2 367 . 1 1 30 30 VAL HG22 H 1 0.38 0.02 . 1 . . . . . . . . 4345 2 368 . 1 1 30 30 VAL HG23 H 1 0.38 0.02 . 1 . . . . . . . . 4345 2 369 . 1 1 30 30 VAL C C 13 178.2 0.2 . 1 . . . . . . . . 4345 2 370 . 1 1 30 30 VAL CA C 13 68.6 0.2 . 1 . . . . . . . . 4345 2 371 . 1 1 30 30 VAL CB C 13 31.3 0.2 . 1 . . . . . . . . 4345 2 372 . 1 1 30 30 VAL CG1 C 13 23.9 0.2 . 1 . . . . . . . . 4345 2 373 . 1 1 30 30 VAL CG2 C 13 21.2 0.2 . 1 . . . . . . . . 4345 2 374 . 1 1 30 30 VAL N N 15 125.3 0.2 . 1 . . . . . . . . 4345 2 375 . 1 1 31 31 LYS H H 1 7.62 0.02 . 1 . . . . . . . . 4345 2 376 . 1 1 31 31 LYS HA H 1 3.81 0.02 . 1 . . . . . . . . 4345 2 377 . 1 1 31 31 LYS HB2 H 1 1.83 0.02 . 1 . . . . . . . . 4345 2 378 . 1 1 31 31 LYS HB3 H 1 1.76 0.02 . 1 . . . . . . . . 4345 2 379 . 1 1 31 31 LYS HG2 H 1 1.52 0.02 . 4 . . . . . . . . 4345 2 380 . 1 1 31 31 LYS HG3 H 1 1.71 0.02 . 4 . . . . . . . . 4345 2 381 . 1 1 31 31 LYS HE2 H 1 2.75 0.02 . 2 . . . . . . . . 4345 2 382 . 1 1 31 31 LYS HE3 H 1 2.87 0.02 . 2 . . . . . . . . 4345 2 383 . 1 1 31 31 LYS C C 13 178.6 0.2 . 1 . . . . . . . . 4345 2 384 . 1 1 31 31 LYS CA C 13 61.1 0.2 . 1 . . . . . . . . 4345 2 385 . 1 1 31 31 LYS CB C 13 32.6 0.2 . 1 . . . . . . . . 4345 2 386 . 1 1 31 31 LYS CG C 13 26.7 0.2 . 1 . . . . . . . . 4345 2 387 . 1 1 31 31 LYS N N 15 119.6 0.2 . 1 . . . . . . . . 4345 2 388 . 1 1 32 32 SER H H 1 7.96 0.02 . 1 . . . . . . . . 4345 2 389 . 1 1 32 32 SER HA H 1 4.12 0.02 . 1 . . . . . . . . 4345 2 390 . 1 1 32 32 SER HB2 H 1 4.01 0.02 . 1 . . . . . . . . 4345 2 391 . 1 1 32 32 SER HB3 H 1 3.64 0.02 . 1 . . . . . . . . 4345 2 392 . 1 1 32 32 SER C C 13 175.8 0.2 . 1 . . . . . . . . 4345 2 393 . 1 1 32 32 SER CA C 13 62.1 0.2 . 1 . . . . . . . . 4345 2 394 . 1 1 32 32 SER CB C 13 63.5 0.2 . 1 . . . . . . . . 4345 2 395 . 1 1 32 32 SER N N 15 114.7 0.2 . 1 . . . . . . . . 4345 2 396 . 1 1 33 33 LEU H H 1 7.87 0.02 . 1 . . . . . . . . 4345 2 397 . 1 1 33 33 LEU HA H 1 3.97 0.02 . 1 . . . . . . . . 4345 2 398 . 1 1 33 33 LEU HB2 H 1 1.37 0.02 . 1 . . . . . . . . 4345 2 399 . 1 1 33 33 LEU HB3 H 1 1.70 0.02 . 1 . . . . . . . . 4345 2 400 . 1 1 33 33 LEU HG H 1 1.66 0.02 . 1 . . . . . . . . 4345 2 401 . 1 1 33 33 LEU HD11 H 1 0.85 0.02 . 1 . . . . . . . . 4345 2 402 . 1 1 33 33 LEU HD12 H 1 0.85 0.02 . 1 . . . . . . . . 4345 2 403 . 1 1 33 33 LEU HD13 H 1 0.85 0.02 . 1 . . . . . . . . 4345 2 404 . 1 1 33 33 LEU HD21 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 405 . 1 1 33 33 LEU HD22 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 406 . 1 1 33 33 LEU HD23 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 407 . 1 1 33 33 LEU C C 13 181.0 0.2 . 1 . . . . . . . . 4345 2 408 . 1 1 33 33 LEU CA C 13 59.8 0.2 . 1 . . . . . . . . 4345 2 409 . 1 1 33 33 LEU CB C 13 43.1 0.2 . 1 . . . . . . . . 4345 2 410 . 1 1 33 33 LEU CG C 13 27.9 0.2 . 1 . . . . . . . . 4345 2 411 . 1 1 33 33 LEU CD1 C 13 27.8 0.2 . 1 . . . . . . . . 4345 2 412 . 1 1 33 33 LEU CD2 C 13 24.1 0.2 . 1 . . . . . . . . 4345 2 413 . 1 1 33 33 LEU N N 15 124.3 0.2 . 1 . . . . . . . . 4345 2 414 . 1 1 34 34 ARG H H 1 8.58 0.02 . 1 . . . . . . . . 4345 2 415 . 1 1 34 34 ARG HA H 1 4.00 0.02 . 1 . . . . . . . . 4345 2 416 . 1 1 34 34 ARG HB2 H 1 1.85 0.02 . 1 . . . . . . . . 4345 2 417 . 1 1 34 34 ARG HB3 H 1 1.80 0.02 . 1 . . . . . . . . 4345 2 418 . 1 1 34 34 ARG HG2 H 1 1.43 0.02 . 2 . . . . . . . . 4345 2 419 . 1 1 34 34 ARG HG3 H 1 1.55 0.02 . 2 . . . . . . . . 4345 2 420 . 1 1 34 34 ARG HD2 H 1 2.83 0.02 . 2 . . . . . . . . 4345 2 421 . 1 1 34 34 ARG HD3 H 1 2.90 0.02 . 2 . . . . . . . . 4345 2 422 . 1 1 34 34 ARG HE H 1 6.83 0.02 . 1 . . . . . . . . 4345 2 423 . 1 1 34 34 ARG C C 13 179.2 0.2 . 1 . . . . . . . . 4345 2 424 . 1 1 34 34 ARG CA C 13 59.8 0.2 . 1 . . . . . . . . 4345 2 425 . 1 1 34 34 ARG CB C 13 30.0 0.2 . 1 . . . . . . . . 4345 2 426 . 1 1 34 34 ARG CD C 13 43.9 0.2 . 1 . . . . . . . . 4345 2 427 . 1 1 34 34 ARG N N 15 121.4 0.2 . 1 . . . . . . . . 4345 2 428 . 1 1 34 34 ARG NE N 15 83.9 0.2 . 1 . . . . . . . . 4345 2 429 . 1 1 35 35 GLN H H 1 7.85 0.02 . 1 . . . . . . . . 4345 2 430 . 1 1 35 35 GLN HA H 1 4.30 0.02 . 1 . . . . . . . . 4345 2 431 . 1 1 35 35 GLN HB2 H 1 2.23 0.02 . 1 . . . . . . . . 4345 2 432 . 1 1 35 35 GLN HB3 H 1 1.83 0.02 . 1 . . . . . . . . 4345 2 433 . 1 1 35 35 GLN HG2 H 1 2.59 0.02 . 2 . . . . . . . . 4345 2 434 . 1 1 35 35 GLN HG3 H 1 2.40 0.02 . 2 . . . . . . . . 4345 2 435 . 1 1 35 35 GLN HE21 H 1 6.83 0.02 . 2 . . . . . . . . 4345 2 436 . 1 1 35 35 GLN HE22 H 1 7.28 0.02 . 2 . . . . . . . . 4345 2 437 . 1 1 35 35 GLN C C 13 177.0 0.2 . 1 . . . . . . . . 4345 2 438 . 1 1 35 35 GLN CA C 13 56.0 0.2 . 1 . . . . . . . . 4345 2 439 . 1 1 35 35 GLN CB C 13 29.5 0.2 . 1 . . . . . . . . 4345 2 440 . 1 1 35 35 GLN CG C 13 34.3 0.2 . 1 . . . . . . . . 4345 2 441 . 1 1 35 35 GLN CD C 13 180.4 0.2 . 1 . . . . . . . . 4345 2 442 . 1 1 35 35 GLN N N 15 113.9 0.2 . 1 . . . . . . . . 4345 2 443 . 1 1 35 35 GLN NE2 N 15 110.4 0.2 . 1 . . . . . . . . 4345 2 444 . 1 1 36 36 GLY H H 1 7.81 0.02 . 1 . . . . . . . . 4345 2 445 . 1 1 36 36 GLY HA2 H 1 3.96 0.02 . 2 . . . . . . . . 4345 2 446 . 1 1 36 36 GLY HA3 H 1 4.07 0.02 . 2 . . . . . . . . 4345 2 447 . 1 1 36 36 GLY C C 13 176.0 0.2 . 1 . . . . . . . . 4345 2 448 . 1 1 36 36 GLY CA C 13 46.9 0.2 . 1 . . . . . . . . 4345 2 449 . 1 1 36 36 GLY N N 15 108.9 0.2 . 1 . . . . . . . . 4345 2 450 . 1 1 37 37 LYS H H 1 8.13 0.02 . 1 . . . . . . . . 4345 2 451 . 1 1 37 37 LYS HA H 1 4.31 0.02 . 1 . . . . . . . . 4345 2 452 . 1 1 37 37 LYS HB2 H 1 1.91 0.02 . 2 . . . . . . . . 4345 2 453 . 1 1 37 37 LYS HB3 H 1 1.52 0.02 . 2 . . . . . . . . 4345 2 454 . 1 1 37 37 LYS HG2 H 1 1.64 0.02 . 4 . . . . . . . . 4345 2 455 . 1 1 37 37 LYS HG3 H 1 1.32 0.02 . 4 . . . . . . . . 4345 2 456 . 1 1 37 37 LYS C C 13 176.8 0.2 . 1 . . . . . . . . 4345 2 457 . 1 1 37 37 LYS CA C 13 56.4 0.2 . 1 . . . . . . . . 4345 2 458 . 1 1 37 37 LYS CB C 13 35.4 0.2 . 1 . . . . . . . . 4345 2 459 . 1 1 37 37 LYS N N 15 116.1 0.2 . 1 . . . . . . . . 4345 2 460 . 1 1 38 38 SER H H 1 7.27 0.02 . 1 . . . . . . . . 4345 2 461 . 1 1 38 38 SER HA H 1 4.11 0.02 . 1 . . . . . . . . 4345 2 462 . 1 1 38 38 SER HB2 H 1 3.42 0.02 . 2 . . . . . . . . 4345 2 463 . 1 1 38 38 SER HB3 H 1 3.54 0.02 . 2 . . . . . . . . 4345 2 464 . 1 1 38 38 SER C C 13 176.2 0.2 . 1 . . . . . . . . 4345 2 465 . 1 1 38 38 SER CA C 13 59.0 0.2 . 1 . . . . . . . . 4345 2 466 . 1 1 38 38 SER CB C 13 63.2 0.2 . 1 . . . . . . . . 4345 2 467 . 1 1 38 38 SER N N 15 111.8 0.2 . 1 . . . . . . . . 4345 2 468 . 1 1 39 39 LYS H H 1 9.30 0.02 . 1 . . . . . . . . 4345 2 469 . 1 1 39 39 LYS HA H 1 4.51 0.02 . 1 . . . . . . . . 4345 2 470 . 1 1 39 39 LYS HB2 H 1 2.03 0.02 . 1 . . . . . . . . 4345 2 471 . 1 1 39 39 LYS HB3 H 1 1.42 0.02 . 1 . . . . . . . . 4345 2 472 . 1 1 39 39 LYS HG2 H 1 1.28 0.02 . 4 . . . . . . . . 4345 2 473 . 1 1 39 39 LYS C C 13 176.9 0.2 . 1 . . . . . . . . 4345 2 474 . 1 1 39 39 LYS CA C 13 55.9 0.2 . 1 . . . . . . . . 4345 2 475 . 1 1 39 39 LYS CB C 13 34.8 0.2 . 1 . . . . . . . . 4345 2 476 . 1 1 39 39 LYS N N 15 124.8 0.2 . 1 . . . . . . . . 4345 2 477 . 1 1 40 40 LEU H H 1 7.69 0.02 . 1 . . . . . . . . 4345 2 478 . 1 1 40 40 LEU HA H 1 4.64 0.02 . 1 . . . . . . . . 4345 2 479 . 1 1 40 40 LEU HB2 H 1 2.10 0.02 . 1 . . . . . . . . 4345 2 480 . 1 1 40 40 LEU HB3 H 1 1.11 0.02 . 1 . . . . . . . . 4345 2 481 . 1 1 40 40 LEU HG H 1 1.21 0.02 . 1 . . . . . . . . 4345 2 482 . 1 1 40 40 LEU HD11 H 1 0.56 0.02 . 1 . . . . . . . . 4345 2 483 . 1 1 40 40 LEU HD12 H 1 0.56 0.02 . 1 . . . . . . . . 4345 2 484 . 1 1 40 40 LEU HD13 H 1 0.56 0.02 . 1 . . . . . . . . 4345 2 485 . 1 1 40 40 LEU HD21 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 486 . 1 1 40 40 LEU HD22 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 487 . 1 1 40 40 LEU HD23 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 488 . 1 1 40 40 LEU C C 13 174.8 0.2 . 1 . . . . . . . . 4345 2 489 . 1 1 40 40 LEU CA C 13 55.7 0.2 . 1 . . . . . . . . 4345 2 490 . 1 1 40 40 LEU CB C 13 45.2 0.2 . 1 . . . . . . . . 4345 2 491 . 1 1 40 40 LEU CG C 13 27.4 0.2 . 1 . . . . . . . . 4345 2 492 . 1 1 40 40 LEU CD1 C 13 27.9 0.2 . 1 . . . . . . . . 4345 2 493 . 1 1 40 40 LEU CD2 C 13 24.5 0.2 . 1 . . . . . . . . 4345 2 494 . 1 1 40 40 LEU N N 15 121.5 0.2 . 1 . . . . . . . . 4345 2 495 . 1 1 41 41 ILE H H 1 8.43 0.02 . 1 . . . . . . . . 4345 2 496 . 1 1 41 41 ILE HA H 1 5.55 0.02 . 1 . . . . . . . . 4345 2 497 . 1 1 41 41 ILE HB H 1 1.52 0.02 . 1 . . . . . . . . 4345 2 498 . 1 1 41 41 ILE HG12 H 1 0.91 0.02 . 2 . . . . . . . . 4345 2 499 . 1 1 41 41 ILE HG13 H 1 1.20 0.02 . 2 . . . . . . . . 4345 2 500 . 1 1 41 41 ILE HG21 H 1 0.82 0.02 . 1 . . . . . . . . 4345 2 501 . 1 1 41 41 ILE HG22 H 1 0.82 0.02 . 1 . . . . . . . . 4345 2 502 . 1 1 41 41 ILE HG23 H 1 0.82 0.02 . 1 . . . . . . . . 4345 2 503 . 1 1 41 41 ILE HD11 H 1 0.70 0.02 . 1 . . . . . . . . 4345 2 504 . 1 1 41 41 ILE HD12 H 1 0.70 0.02 . 1 . . . . . . . . 4345 2 505 . 1 1 41 41 ILE HD13 H 1 0.70 0.02 . 1 . . . . . . . . 4345 2 506 . 1 1 41 41 ILE C C 13 173.9 0.2 . 1 . . . . . . . . 4345 2 507 . 1 1 41 41 ILE CA C 13 58.8 0.2 . 1 . . . . . . . . 4345 2 508 . 1 1 41 41 ILE CB C 13 41.0 0.2 . 1 . . . . . . . . 4345 2 509 . 1 1 41 41 ILE CG2 C 13 19.4 0.2 . 1 . . . . . . . . 4345 2 510 . 1 1 41 41 ILE CD1 C 13 15.9 0.2 . 1 . . . . . . . . 4345 2 511 . 1 1 41 41 ILE N N 15 118.9 0.2 . 1 . . . . . . . . 4345 2 512 . 1 1 42 42 ILE H H 1 8.86 0.02 . 1 . . . . . . . . 4345 2 513 . 1 1 42 42 ILE HA H 1 5.22 0.02 . 1 . . . . . . . . 4345 2 514 . 1 1 42 42 ILE HB H 1 1.57 0.02 . 1 . . . . . . . . 4345 2 515 . 1 1 42 42 ILE HG12 H 1 1.38 0.02 . 2 . . . . . . . . 4345 2 516 . 1 1 42 42 ILE HG13 H 1 0.91 0.02 . 2 . . . . . . . . 4345 2 517 . 1 1 42 42 ILE HG21 H 1 0.70 0.02 . 1 . . . . . . . . 4345 2 518 . 1 1 42 42 ILE HG22 H 1 0.70 0.02 . 1 . . . . . . . . 4345 2 519 . 1 1 42 42 ILE HG23 H 1 0.70 0.02 . 1 . . . . . . . . 4345 2 520 . 1 1 42 42 ILE HD11 H 1 0.58 0.02 . 1 . . . . . . . . 4345 2 521 . 1 1 42 42 ILE HD12 H 1 0.58 0.02 . 1 . . . . . . . . 4345 2 522 . 1 1 42 42 ILE HD13 H 1 0.58 0.02 . 1 . . . . . . . . 4345 2 523 . 1 1 42 42 ILE C C 13 174.9 0.2 . 1 . . . . . . . . 4345 2 524 . 1 1 42 42 ILE CA C 13 59.7 0.2 . 1 . . . . . . . . 4345 2 525 . 1 1 42 42 ILE CB C 13 41.4 0.2 . 1 . . . . . . . . 4345 2 526 . 1 1 42 42 ILE CG2 C 13 19.4 0.2 . 1 . . . . . . . . 4345 2 527 . 1 1 42 42 ILE CD1 C 13 15.3 0.2 . 1 . . . . . . . . 4345 2 528 . 1 1 42 42 ILE N N 15 123.9 0.2 . 1 . . . . . . . . 4345 2 529 . 1 1 43 43 ILE H H 1 8.48 0.02 . 1 . . . . . . . . 4345 2 530 . 1 1 43 43 ILE HA H 1 4.56 0.02 . 1 . . . . . . . . 4345 2 531 . 1 1 43 43 ILE HB H 1 1.54 0.02 . 1 . . . . . . . . 4345 2 532 . 1 1 43 43 ILE HG12 H 1 1.50 0.02 . 2 . . . . . . . . 4345 2 533 . 1 1 43 43 ILE HG21 H 1 1.14 0.02 . 1 . . . . . . . . 4345 2 534 . 1 1 43 43 ILE HG22 H 1 1.14 0.02 . 1 . . . . . . . . 4345 2 535 . 1 1 43 43 ILE HG23 H 1 1.14 0.02 . 1 . . . . . . . . 4345 2 536 . 1 1 43 43 ILE HD11 H 1 0.77 0.02 . 1 . . . . . . . . 4345 2 537 . 1 1 43 43 ILE HD12 H 1 0.77 0.02 . 1 . . . . . . . . 4345 2 538 . 1 1 43 43 ILE HD13 H 1 0.77 0.02 . 1 . . . . . . . . 4345 2 539 . 1 1 43 43 ILE C C 13 176.7 0.2 . 1 . . . . . . . . 4345 2 540 . 1 1 43 43 ILE CA C 13 60.6 0.2 . 1 . . . . . . . . 4345 2 541 . 1 1 43 43 ILE CB C 13 41.2 0.2 . 1 . . . . . . . . 4345 2 542 . 1 1 43 43 ILE CG2 C 13 17.5 0.2 . 1 . . . . . . . . 4345 2 543 . 1 1 43 43 ILE CD1 C 13 14.8 0.2 . 1 . . . . . . . . 4345 2 544 . 1 1 43 43 ILE N N 15 124.8 0.2 . 1 . . . . . . . . 4345 2 545 . 1 1 44 44 ALA H H 1 8.77 0.02 . 1 . . . . . . . . 4345 2 546 . 1 1 44 44 ALA HA H 1 4.45 0.02 . 1 . . . . . . . . 4345 2 547 . 1 1 44 44 ALA HB1 H 1 1.69 0.02 . 1 . . . . . . . . 4345 2 548 . 1 1 44 44 ALA HB2 H 1 1.69 0.02 . 1 . . . . . . . . 4345 2 549 . 1 1 44 44 ALA HB3 H 1 1.69 0.02 . 1 . . . . . . . . 4345 2 550 . 1 1 44 44 ALA C C 13 179.4 0.2 . 1 . . . . . . . . 4345 2 551 . 1 1 44 44 ALA CA C 13 53.6 0.2 . 1 . . . . . . . . 4345 2 552 . 1 1 44 44 ALA CB C 13 19.1 0.2 . 1 . . . . . . . . 4345 2 553 . 1 1 44 44 ALA N N 15 129.8 0.2 . 1 . . . . . . . . 4345 2 554 . 1 1 45 45 ALA H H 1 8.85 0.02 . 1 . . . . . . . . 4345 2 555 . 1 1 45 45 ALA HA H 1 4.31 0.02 . 1 . . . . . . . . 4345 2 556 . 1 1 45 45 ALA HB1 H 1 1.38 0.02 . 1 . . . . . . . . 4345 2 557 . 1 1 45 45 ALA HB2 H 1 1.38 0.02 . 1 . . . . . . . . 4345 2 558 . 1 1 45 45 ALA HB3 H 1 1.38 0.02 . 1 . . . . . . . . 4345 2 559 . 1 1 45 45 ALA C C 13 178.6 0.2 . 1 . . . . . . . . 4345 2 560 . 1 1 45 45 ALA CA C 13 55.3 0.2 . 1 . . . . . . . . 4345 2 561 . 1 1 45 45 ALA CB C 13 19.0 0.2 . 1 . . . . . . . . 4345 2 562 . 1 1 45 45 ALA N N 15 124.4 0.2 . 1 . . . . . . . . 4345 2 563 . 1 1 46 46 ASN H H 1 8.27 0.02 . 1 . . . . . . . . 4345 2 564 . 1 1 46 46 ASN HA H 1 4.76 0.02 . 1 . . . . . . . . 4345 2 565 . 1 1 46 46 ASN HB2 H 1 3.21 0.02 . 1 . . . . . . . . 4345 2 566 . 1 1 46 46 ASN HB3 H 1 2.92 0.02 . 1 . . . . . . . . 4345 2 567 . 1 1 46 46 ASN HD21 H 1 6.86 0.02 . 2 . . . . . . . . 4345 2 568 . 1 1 46 46 ASN HD22 H 1 7.76 0.02 . 2 . . . . . . . . 4345 2 569 . 1 1 46 46 ASN C C 13 175.4 0.2 . 1 . . . . . . . . 4345 2 570 . 1 1 46 46 ASN CA C 13 52.6 0.2 . 1 . . . . . . . . 4345 2 571 . 1 1 46 46 ASN CB C 13 36.8 0.2 . 1 . . . . . . . . 4345 2 572 . 1 1 46 46 ASN N N 15 111.9 0.2 . 1 . . . . . . . . 4345 2 573 . 1 1 46 46 ASN ND2 N 15 111.4 0.2 . 1 . . . . . . . . 4345 2 574 . 1 1 47 47 THR H H 1 7.50 0.02 . 1 . . . . . . . . 4345 2 575 . 1 1 47 47 THR HA H 1 4.31 0.02 . 1 . . . . . . . . 4345 2 576 . 1 1 47 47 THR HB H 1 3.93 0.02 . 1 . . . . . . . . 4345 2 577 . 1 1 47 47 THR HG21 H 1 1.18 0.02 . 1 . . . . . . . . 4345 2 578 . 1 1 47 47 THR HG22 H 1 1.18 0.02 . 1 . . . . . . . . 4345 2 579 . 1 1 47 47 THR HG23 H 1 1.18 0.02 . 1 . . . . . . . . 4345 2 580 . 1 1 47 47 THR CA C 13 62.5 0.2 . 1 . . . . . . . . 4345 2 581 . 1 1 47 47 THR CB C 13 70.5 0.2 . 1 . . . . . . . . 4345 2 582 . 1 1 47 47 THR CG2 C 13 46.9 0.2 . 1 . . . . . . . . 4345 2 583 . 1 1 47 47 THR N N 15 120.2 0.2 . 1 . . . . . . . . 4345 2 584 . 1 1 48 48 PRO HA H 1 4.27 0.02 . 1 . . . . . . . . 4345 2 585 . 1 1 48 48 PRO HB2 H 1 2.32 0.02 . 2 . . . . . . . . 4345 2 586 . 1 1 48 48 PRO HB3 H 1 1.60 0.02 . 2 . . . . . . . . 4345 2 587 . 1 1 48 48 PRO HG2 H 1 1.75 0.02 . 1 . . . . . . . . 4345 2 588 . 1 1 48 48 PRO HG3 H 1 1.75 0.02 . 1 . . . . . . . . 4345 2 589 . 1 1 48 48 PRO HD2 H 1 3.46 0.02 . 2 . . . . . . . . 4345 2 590 . 1 1 48 48 PRO HD3 H 1 2.88 0.02 . 2 . . . . . . . . 4345 2 591 . 1 1 48 48 PRO C C 13 178.0 0.2 . 1 . . . . . . . . 4345 2 592 . 1 1 48 48 PRO CA C 13 63.3 0.2 . 1 . . . . . . . . 4345 2 593 . 1 1 48 48 PRO CB C 13 32.9 0.2 . 1 . . . . . . . . 4345 2 594 . 1 1 48 48 PRO CG C 13 28.3 0.2 . 1 . . . . . . . . 4345 2 595 . 1 1 48 48 PRO CD C 13 50.9 0.2 . 1 . . . . . . . . 4345 2 596 . 1 1 49 49 VAL H H 1 8.53 0.02 . 1 . . . . . . . . 4345 2 597 . 1 1 49 49 VAL HA H 1 3.64 0.02 . 1 . . . . . . . . 4345 2 598 . 1 1 49 49 VAL HB H 1 2.12 0.02 . 1 . . . . . . . . 4345 2 599 . 1 1 49 49 VAL HG11 H 1 1.01 0.02 . 1 . . . . . . . . 4345 2 600 . 1 1 49 49 VAL HG12 H 1 1.01 0.02 . 1 . . . . . . . . 4345 2 601 . 1 1 49 49 VAL HG13 H 1 1.01 0.02 . 1 . . . . . . . . 4345 2 602 . 1 1 49 49 VAL HG21 H 1 1.09 0.02 . 1 . . . . . . . . 4345 2 603 . 1 1 49 49 VAL HG22 H 1 1.09 0.02 . 1 . . . . . . . . 4345 2 604 . 1 1 49 49 VAL HG23 H 1 1.09 0.02 . 1 . . . . . . . . 4345 2 605 . 1 1 49 49 VAL C C 13 178.0 0.2 . 1 . . . . . . . . 4345 2 606 . 1 1 49 49 VAL CA C 13 67.1 0.2 . 1 . . . . . . . . 4345 2 607 . 1 1 49 49 VAL CB C 13 32.0 0.2 . 1 . . . . . . . . 4345 2 608 . 1 1 49 49 VAL CG1 C 13 22.0 0.2 . 1 . . . . . . . . 4345 2 609 . 1 1 49 49 VAL CG2 C 13 21.0 0.2 . 1 . . . . . . . . 4345 2 610 . 1 1 49 49 VAL N N 15 123.8 0.2 . 1 . . . . . . . . 4345 2 611 . 1 1 50 50 LEU H H 1 8.81 0.02 . 1 . . . . . . . . 4345 2 612 . 1 1 50 50 LEU HA H 1 4.20 0.02 . 1 . . . . . . . . 4345 2 613 . 1 1 50 50 LEU HB2 H 1 1.66 0.02 . 1 . . . . . . . . 4345 2 614 . 1 1 50 50 LEU HB3 H 1 1.52 0.02 . 1 . . . . . . . . 4345 2 615 . 1 1 50 50 LEU HG H 1 1.64 0.02 . 1 . . . . . . . . 4345 2 616 . 1 1 50 50 LEU HD11 H 1 0.88 0.02 . 1 . . . . . . . . 4345 2 617 . 1 1 50 50 LEU HD12 H 1 0.88 0.02 . 1 . . . . . . . . 4345 2 618 . 1 1 50 50 LEU HD13 H 1 0.88 0.02 . 1 . . . . . . . . 4345 2 619 . 1 1 50 50 LEU HD21 H 1 0.94 0.02 . 1 . . . . . . . . 4345 2 620 . 1 1 50 50 LEU HD22 H 1 0.94 0.02 . 1 . . . . . . . . 4345 2 621 . 1 1 50 50 LEU HD23 H 1 0.94 0.02 . 1 . . . . . . . . 4345 2 622 . 1 1 50 50 LEU C C 13 180.1 0.2 . 1 . . . . . . . . 4345 2 623 . 1 1 50 50 LEU CA C 13 58.8 0.2 . 1 . . . . . . . . 4345 2 624 . 1 1 50 50 LEU CB C 13 41.8 0.2 . 1 . . . . . . . . 4345 2 625 . 1 1 50 50 LEU CG C 13 27.7 0.2 . 1 . . . . . . . . 4345 2 626 . 1 1 50 50 LEU CD1 C 13 24.7 0.2 . 1 . . . . . . . . 4345 2 627 . 1 1 50 50 LEU CD2 C 13 24.9 0.2 . 1 . . . . . . . . 4345 2 628 . 1 1 50 50 LEU N N 15 121.3 0.2 . 1 . . . . . . . . 4345 2 629 . 1 1 51 51 ARG H H 1 6.84 0.02 . 1 . . . . . . . . 4345 2 630 . 1 1 51 51 ARG HA H 1 4.25 0.02 . 1 . . . . . . . . 4345 2 631 . 1 1 51 51 ARG HB2 H 1 1.60 0.02 . 1 . . . . . . . . 4345 2 632 . 1 1 51 51 ARG HB3 H 1 1.54 0.02 . 1 . . . . . . . . 4345 2 633 . 1 1 51 51 ARG HG2 H 1 1.36 0.02 . 1 . . . . . . . . 4345 2 634 . 1 1 51 51 ARG HG3 H 1 1.19 0.02 . 1 . . . . . . . . 4345 2 635 . 1 1 51 51 ARG HD2 H 1 2.30 0.02 . 1 . . . . . . . . 4345 2 636 . 1 1 51 51 ARG HD3 H 1 2.60 0.02 . 1 . . . . . . . . 4345 2 637 . 1 1 51 51 ARG HE H 1 7.14 0.02 . 1 . . . . . . . . 4345 2 638 . 1 1 51 51 ARG C C 13 178.6 0.2 . 1 . . . . . . . . 4345 2 639 . 1 1 51 51 ARG CA C 13 58.3 0.2 . 1 . . . . . . . . 4345 2 640 . 1 1 51 51 ARG CB C 13 33.0 0.2 . 1 . . . . . . . . 4345 2 641 . 1 1 51 51 ARG CG C 13 27.4 0.2 . 1 . . . . . . . . 4345 2 642 . 1 1 51 51 ARG CD C 13 42.8 0.2 . 1 . . . . . . . . 4345 2 643 . 1 1 51 51 ARG N N 15 116.9 0.2 . 1 . . . . . . . . 4345 2 644 . 1 1 51 51 ARG NE N 15 83.8 0.2 . 1 . . . . . . . . 4345 2 645 . 1 1 52 52 LYS H H 1 8.44 0.02 . 1 . . . . . . . . 4345 2 646 . 1 1 52 52 LYS HA H 1 3.86 0.02 . 1 . . . . . . . . 4345 2 647 . 1 1 52 52 LYS HB2 H 1 2.02 0.02 . 1 . . . . . . . . 4345 2 648 . 1 1 52 52 LYS HB3 H 1 1.80 0.02 . 1 . . . . . . . . 4345 2 649 . 1 1 52 52 LYS HG2 H 1 1.74 0.02 . 4 . . . . . . . . 4345 2 650 . 1 1 52 52 LYS HG3 H 1 1.46 0.02 . 4 . . . . . . . . 4345 2 651 . 1 1 52 52 LYS HD2 H 1 1.74 0.02 . 4 . . . . . . . . 4345 2 652 . 1 1 52 52 LYS HE2 H 1 3.13 0.02 . 1 . . . . . . . . 4345 2 653 . 1 1 52 52 LYS HE3 H 1 2.91 0.02 . 1 . . . . . . . . 4345 2 654 . 1 1 52 52 LYS C C 13 178.1 0.2 . 1 . . . . . . . . 4345 2 655 . 1 1 52 52 LYS CA C 13 61.4 0.2 . 1 . . . . . . . . 4345 2 656 . 1 1 52 52 LYS CB C 13 33.4 0.2 . 1 . . . . . . . . 4345 2 657 . 1 1 52 52 LYS CG C 13 31.3 0.2 . 1 . . . . . . . . 4345 2 658 . 1 1 52 52 LYS N N 15 120.3 0.2 . 1 . . . . . . . . 4345 2 659 . 1 1 53 53 SER H H 1 8.54 0.02 . 1 . . . . . . . . 4345 2 660 . 1 1 53 53 SER HA H 1 4.40 0.02 . 1 . . . . . . . . 4345 2 661 . 1 1 53 53 SER HB2 H 1 4.01 0.02 . 1 . . . . . . . . 4345 2 662 . 1 1 53 53 SER HB3 H 1 4.01 0.02 . 1 . . . . . . . . 4345 2 663 . 1 1 53 53 SER C C 13 177.8 0.2 . 1 . . . . . . . . 4345 2 664 . 1 1 53 53 SER CA C 13 61.9 0.2 . 1 . . . . . . . . 4345 2 665 . 1 1 53 53 SER CB C 13 63.1 0.2 . 1 . . . . . . . . 4345 2 666 . 1 1 53 53 SER N N 15 112.8 0.2 . 1 . . . . . . . . 4345 2 667 . 1 1 54 54 GLU H H 1 7.80 0.02 . 1 . . . . . . . . 4345 2 668 . 1 1 54 54 GLU HA H 1 4.26 0.02 . 1 . . . . . . . . 4345 2 669 . 1 1 54 54 GLU HB2 H 1 2.50 0.02 . 1 . . . . . . . . 4345 2 670 . 1 1 54 54 GLU HB3 H 1 2.50 0.02 . 1 . . . . . . . . 4345 2 671 . 1 1 54 54 GLU HG2 H 1 2.49 0.02 . 2 . . . . . . . . 4345 2 672 . 1 1 54 54 GLU HG3 H 1 2.62 0.02 . 2 . . . . . . . . 4345 2 673 . 1 1 54 54 GLU C C 13 178.7 0.2 . 1 . . . . . . . . 4345 2 674 . 1 1 54 54 GLU CA C 13 59.8 0.2 . 1 . . . . . . . . 4345 2 675 . 1 1 54 54 GLU CB C 13 29.8 0.2 . 1 . . . . . . . . 4345 2 676 . 1 1 54 54 GLU CG C 13 35.7 0.2 . 1 . . . . . . . . 4345 2 677 . 1 1 54 54 GLU N N 15 123.8 0.2 . 1 . . . . . . . . 4345 2 678 . 1 1 55 55 LEU H H 1 8.37 0.02 . 1 . . . . . . . . 4345 2 679 . 1 1 55 55 LEU HA H 1 3.96 0.02 . 1 . . . . . . . . 4345 2 680 . 1 1 55 55 LEU HB2 H 1 2.25 0.02 . 1 . . . . . . . . 4345 2 681 . 1 1 55 55 LEU HB3 H 1 1.16 0.02 . 1 . . . . . . . . 4345 2 682 . 1 1 55 55 LEU HG H 1 1.62 0.02 . 1 . . . . . . . . 4345 2 683 . 1 1 55 55 LEU HD11 H 1 0.96 0.02 . 1 . . . . . . . . 4345 2 684 . 1 1 55 55 LEU HD12 H 1 0.96 0.02 . 1 . . . . . . . . 4345 2 685 . 1 1 55 55 LEU HD13 H 1 0.96 0.02 . 1 . . . . . . . . 4345 2 686 . 1 1 55 55 LEU HD21 H 1 0.71 0.02 . 1 . . . . . . . . 4345 2 687 . 1 1 55 55 LEU HD22 H 1 0.71 0.02 . 1 . . . . . . . . 4345 2 688 . 1 1 55 55 LEU HD23 H 1 0.71 0.02 . 1 . . . . . . . . 4345 2 689 . 1 1 55 55 LEU C C 13 179.3 0.2 . 1 . . . . . . . . 4345 2 690 . 1 1 55 55 LEU CA C 13 58.9 0.2 . 1 . . . . . . . . 4345 2 691 . 1 1 55 55 LEU CB C 13 42.2 0.2 . 1 . . . . . . . . 4345 2 692 . 1 1 55 55 LEU CG C 13 28.0 0.2 . 1 . . . . . . . . 4345 2 693 . 1 1 55 55 LEU CD1 C 13 26.7 0.2 . 1 . . . . . . . . 4345 2 694 . 1 1 55 55 LEU CD2 C 13 23.9 0.2 . 1 . . . . . . . . 4345 2 695 . 1 1 55 55 LEU N N 15 119.3 0.2 . 1 . . . . . . . . 4345 2 696 . 1 1 56 56 GLU H H 1 8.60 0.02 . 1 . . . . . . . . 4345 2 697 . 1 1 56 56 GLU HA H 1 3.80 0.02 . 1 . . . . . . . . 4345 2 698 . 1 1 56 56 GLU HB2 H 1 2.02 0.02 . 1 . . . . . . . . 4345 2 699 . 1 1 56 56 GLU HB3 H 1 2.30 0.02 . 1 . . . . . . . . 4345 2 700 . 1 1 56 56 GLU HG2 H 1 2.64 0.02 . 2 . . . . . . . . 4345 2 701 . 1 1 56 56 GLU HG3 H 1 2.20 0.02 . 2 . . . . . . . . 4345 2 702 . 1 1 56 56 GLU C C 13 179.6 0.2 . 1 . . . . . . . . 4345 2 703 . 1 1 56 56 GLU CA C 13 60.2 0.2 . 1 . . . . . . . . 4345 2 704 . 1 1 56 56 GLU CB C 13 29.3 0.2 . 1 . . . . . . . . 4345 2 705 . 1 1 56 56 GLU CG C 13 37.3 0.2 . 1 . . . . . . . . 4345 2 706 . 1 1 56 56 GLU N N 15 116.7 0.2 . 1 . . . . . . . . 4345 2 707 . 1 1 57 57 TYR H H 1 8.18 0.02 . 1 . . . . . . . . 4345 2 708 . 1 1 57 57 TYR HA H 1 4.33 0.02 . 1 . . . . . . . . 4345 2 709 . 1 1 57 57 TYR HB2 H 1 3.18 0.02 . 1 . . . . . . . . 4345 2 710 . 1 1 57 57 TYR HB3 H 1 3.10 0.02 . 1 . . . . . . . . 4345 2 711 . 1 1 57 57 TYR HD1 H 1 6.57 0.02 . 1 . . . . . . . . 4345 2 712 . 1 1 57 57 TYR HD2 H 1 6.57 0.02 . 1 . . . . . . . . 4345 2 713 . 1 1 57 57 TYR HE1 H 1 6.58 0.02 . 1 . . . . . . . . 4345 2 714 . 1 1 57 57 TYR HE2 H 1 6.58 0.02 . 1 . . . . . . . . 4345 2 715 . 1 1 57 57 TYR C C 13 177.7 0.2 . 1 . . . . . . . . 4345 2 716 . 1 1 57 57 TYR CA C 13 61.5 0.2 . 1 . . . . . . . . 4345 2 717 . 1 1 57 57 TYR CB C 13 38.1 0.2 . 1 . . . . . . . . 4345 2 718 . 1 1 57 57 TYR CD1 C 13 133.6 0.2 . 1 . . . . . . . . 4345 2 719 . 1 1 57 57 TYR CD2 C 13 133.6 0.2 . 1 . . . . . . . . 4345 2 720 . 1 1 57 57 TYR CE1 C 13 118.5 0.2 . 1 . . . . . . . . 4345 2 721 . 1 1 57 57 TYR CE2 C 13 118.5 0.2 . 1 . . . . . . . . 4345 2 722 . 1 1 57 57 TYR N N 15 122.7 0.2 . 1 . . . . . . . . 4345 2 723 . 1 1 58 58 TYR H H 1 8.34 0.02 . 1 . . . . . . . . 4345 2 724 . 1 1 58 58 TYR HA H 1 4.07 0.02 . 1 . . . . . . . . 4345 2 725 . 1 1 58 58 TYR HB2 H 1 3.03 0.02 . 1 . . . . . . . . 4345 2 726 . 1 1 58 58 TYR HB3 H 1 2.78 0.02 . 1 . . . . . . . . 4345 2 727 . 1 1 58 58 TYR HD1 H 1 7.22 0.02 . 1 . . . . . . . . 4345 2 728 . 1 1 58 58 TYR HD2 H 1 7.22 0.02 . 1 . . . . . . . . 4345 2 729 . 1 1 58 58 TYR HE1 H 1 7.01 0.02 . 1 . . . . . . . . 4345 2 730 . 1 1 58 58 TYR HE2 H 1 7.01 0.02 . 1 . . . . . . . . 4345 2 731 . 1 1 58 58 TYR C C 13 180.2 0.2 . 1 . . . . . . . . 4345 2 732 . 1 1 58 58 TYR CA C 13 62.5 0.2 . 1 . . . . . . . . 4345 2 733 . 1 1 58 58 TYR CB C 13 39.1 0.2 . 1 . . . . . . . . 4345 2 734 . 1 1 58 58 TYR CD1 C 13 133.4 0.2 . 1 . . . . . . . . 4345 2 735 . 1 1 58 58 TYR CD2 C 13 133.4 0.2 . 1 . . . . . . . . 4345 2 736 . 1 1 58 58 TYR CE1 C 13 118.7 0.2 . 1 . . . . . . . . 4345 2 737 . 1 1 58 58 TYR CE2 C 13 118.7 0.2 . 1 . . . . . . . . 4345 2 738 . 1 1 58 58 TYR N N 15 117.0 0.2 . 1 . . . . . . . . 4345 2 739 . 1 1 59 59 ALA H H 1 8.94 0.02 . 1 . . . . . . . . 4345 2 740 . 1 1 59 59 ALA HA H 1 4.06 0.02 . 1 . . . . . . . . 4345 2 741 . 1 1 59 59 ALA HB1 H 1 1.39 0.02 . 1 . . . . . . . . 4345 2 742 . 1 1 59 59 ALA HB2 H 1 1.39 0.02 . 1 . . . . . . . . 4345 2 743 . 1 1 59 59 ALA HB3 H 1 1.39 0.02 . 1 . . . . . . . . 4345 2 744 . 1 1 59 59 ALA C C 13 179.1 0.2 . 1 . . . . . . . . 4345 2 745 . 1 1 59 59 ALA CA C 13 55.8 0.2 . 1 . . . . . . . . 4345 2 746 . 1 1 59 59 ALA CB C 13 17.3 0.2 . 1 . . . . . . . . 4345 2 747 . 1 1 59 59 ALA N N 15 124.3 0.2 . 1 . . . . . . . . 4345 2 748 . 1 1 60 60 MET H H 1 8.23 0.02 . 1 . . . . . . . . 4345 2 749 . 1 1 60 60 MET HA H 1 4.18 0.02 . 1 . . . . . . . . 4345 2 750 . 1 1 60 60 MET HB2 H 1 2.27 0.02 . 1 . . . . . . . . 4345 2 751 . 1 1 60 60 MET HB3 H 1 2.42 0.02 . 1 . . . . . . . . 4345 2 752 . 1 1 60 60 MET HG2 H 1 2.74 0.02 . 2 . . . . . . . . 4345 2 753 . 1 1 60 60 MET HG3 H 1 2.52 0.02 . 2 . . . . . . . . 4345 2 754 . 1 1 60 60 MET HE1 H 1 2.08 0.02 . 1 . . . . . . . . 4345 2 755 . 1 1 60 60 MET HE2 H 1 2.08 0.02 . 1 . . . . . . . . 4345 2 756 . 1 1 60 60 MET HE3 H 1 2.08 0.02 . 1 . . . . . . . . 4345 2 757 . 1 1 60 60 MET C C 13 181.1 0.2 . 1 . . . . . . . . 4345 2 758 . 1 1 60 60 MET CA C 13 59.1 0.2 . 1 . . . . . . . . 4345 2 759 . 1 1 60 60 MET CB C 13 31.2 0.2 . 1 . . . . . . . . 4345 2 760 . 1 1 60 60 MET CG C 13 31.9 0.2 . 1 . . . . . . . . 4345 2 761 . 1 1 60 60 MET CE C 13 17.1 0.2 . 1 . . . . . . . . 4345 2 762 . 1 1 60 60 MET N N 15 120.3 0.2 . 1 . . . . . . . . 4345 2 763 . 1 1 61 61 LEU H H 1 7.92 0.02 . 1 . . . . . . . . 4345 2 764 . 1 1 61 61 LEU HA H 1 3.96 0.02 . 1 . . . . . . . . 4345 2 765 . 1 1 61 61 LEU HB2 H 1 1.49 0.02 . 1 . . . . . . . . 4345 2 766 . 1 1 61 61 LEU HB3 H 1 1.68 0.02 . 1 . . . . . . . . 4345 2 767 . 1 1 61 61 LEU HG H 1 1.39 0.02 . 1 . . . . . . . . 4345 2 768 . 1 1 61 61 LEU HD11 H 1 0.64 0.02 . 1 . . . . . . . . 4345 2 769 . 1 1 61 61 LEU HD12 H 1 0.64 0.02 . 1 . . . . . . . . 4345 2 770 . 1 1 61 61 LEU HD13 H 1 0.64 0.02 . 1 . . . . . . . . 4345 2 771 . 1 1 61 61 LEU HD21 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 772 . 1 1 61 61 LEU HD22 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 773 . 1 1 61 61 LEU HD23 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 774 . 1 1 61 61 LEU C C 13 179.0 0.2 . 1 . . . . . . . . 4345 2 775 . 1 1 61 61 LEU CA C 13 57.9 0.2 . 1 . . . . . . . . 4345 2 776 . 1 1 61 61 LEU CB C 13 42.5 0.2 . 1 . . . . . . . . 4345 2 777 . 1 1 61 61 LEU CG C 13 26.9 0.2 . 1 . . . . . . . . 4345 2 778 . 1 1 61 61 LEU CD1 C 13 25.5 0.2 . 1 . . . . . . . . 4345 2 779 . 1 1 61 61 LEU CD2 C 13 23.5 0.2 . 1 . . . . . . . . 4345 2 780 . 1 1 61 61 LEU N N 15 120.4 0.2 . 1 . . . . . . . . 4345 2 781 . 1 1 62 62 SER H H 1 7.58 0.02 . 1 . . . . . . . . 4345 2 782 . 1 1 62 62 SER HA H 1 4.49 0.02 . 1 . . . . . . . . 4345 2 783 . 1 1 62 62 SER HB2 H 1 4.12 0.02 . 1 . . . . . . . . 4345 2 784 . 1 1 62 62 SER HB3 H 1 3.97 0.02 . 1 . . . . . . . . 4345 2 785 . 1 1 62 62 SER C C 13 174.0 0.2 . 1 . . . . . . . . 4345 2 786 . 1 1 62 62 SER CA C 13 58.0 0.2 . 1 . . . . . . . . 4345 2 787 . 1 1 62 62 SER CB C 13 63.7 0.2 . 1 . . . . . . . . 4345 2 788 . 1 1 62 62 SER N N 15 110.3 0.2 . 1 . . . . . . . . 4345 2 789 . 1 1 63 63 LYS H H 1 7.88 0.02 . 1 . . . . . . . . 4345 2 790 . 1 1 63 63 LYS HA H 1 3.94 0.02 . 1 . . . . . . . . 4345 2 791 . 1 1 63 63 LYS HB2 H 1 2.08 0.02 . 1 . . . . . . . . 4345 2 792 . 1 1 63 63 LYS HB3 H 1 1.91 0.02 . 1 . . . . . . . . 4345 2 793 . 1 1 63 63 LYS HG2 H 1 1.39 0.02 . 4 . . . . . . . . 4345 2 794 . 1 1 63 63 LYS C C 13 176.2 0.2 . 1 . . . . . . . . 4345 2 795 . 1 1 63 63 LYS CA C 13 57.6 0.2 . 1 . . . . . . . . 4345 2 796 . 1 1 63 63 LYS CB C 13 29.2 0.2 . 1 . . . . . . . . 4345 2 797 . 1 1 63 63 LYS N N 15 120.7 0.2 . 1 . . . . . . . . 4345 2 798 . 1 1 64 64 THR H H 1 8.79 0.02 . 1 . . . . . . . . 4345 2 799 . 1 1 64 64 THR HA H 1 4.19 0.02 . 1 . . . . . . . . 4345 2 800 . 1 1 64 64 THR HB H 1 3.44 0.02 . 1 . . . . . . . . 4345 2 801 . 1 1 64 64 THR HG21 H 1 1.02 0.02 . 1 . . . . . . . . 4345 2 802 . 1 1 64 64 THR HG22 H 1 1.02 0.02 . 1 . . . . . . . . 4345 2 803 . 1 1 64 64 THR HG23 H 1 1.02 0.02 . 1 . . . . . . . . 4345 2 804 . 1 1 64 64 THR C C 13 173.9 0.2 . 1 . . . . . . . . 4345 2 805 . 1 1 64 64 THR CA C 13 63.3 0.2 . 1 . . . . . . . . 4345 2 806 . 1 1 64 64 THR CB C 13 70.3 0.2 . 1 . . . . . . . . 4345 2 807 . 1 1 64 64 THR CG2 C 13 21.7 0.2 . 1 . . . . . . . . 4345 2 808 . 1 1 64 64 THR N N 15 118.8 0.2 . 1 . . . . . . . . 4345 2 809 . 1 1 65 65 LYS H H 1 7.87 0.02 . 1 . . . . . . . . 4345 2 810 . 1 1 65 65 LYS HA H 1 4.09 0.02 . 1 . . . . . . . . 4345 2 811 . 1 1 65 65 LYS HB2 H 1 1.82 0.02 . 1 . . . . . . . . 4345 2 812 . 1 1 65 65 LYS HB3 H 1 1.76 0.02 . 1 . . . . . . . . 4345 2 813 . 1 1 65 65 LYS HG2 H 1 1.57 0.02 . 4 . . . . . . . . 4345 2 814 . 1 1 65 65 LYS HG3 H 1 1.46 0.02 . 4 . . . . . . . . 4345 2 815 . 1 1 65 65 LYS C C 13 174.6 0.2 . 1 . . . . . . . . 4345 2 816 . 1 1 65 65 LYS CA C 13 57.3 0.2 . 1 . . . . . . . . 4345 2 817 . 1 1 65 65 LYS CB C 13 34.3 0.2 . 1 . . . . . . . . 4345 2 818 . 1 1 65 65 LYS N N 15 127.7 0.2 . 1 . . . . . . . . 4345 2 819 . 1 1 66 66 VAL H H 1 7.99 0.02 . 1 . . . . . . . . 4345 2 820 . 1 1 66 66 VAL HA H 1 4.41 0.02 . 1 . . . . . . . . 4345 2 821 . 1 1 66 66 VAL HB H 1 1.74 0.02 . 1 . . . . . . . . 4345 2 822 . 1 1 66 66 VAL HG11 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 823 . 1 1 66 66 VAL HG12 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 824 . 1 1 66 66 VAL HG13 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 825 . 1 1 66 66 VAL HG21 H 1 0.30 0.02 . 1 . . . . . . . . 4345 2 826 . 1 1 66 66 VAL HG22 H 1 0.30 0.02 . 1 . . . . . . . . 4345 2 827 . 1 1 66 66 VAL HG23 H 1 0.30 0.02 . 1 . . . . . . . . 4345 2 828 . 1 1 66 66 VAL C C 13 175.1 0.2 . 1 . . . . . . . . 4345 2 829 . 1 1 66 66 VAL CA C 13 61.0 0.2 . 1 . . . . . . . . 4345 2 830 . 1 1 66 66 VAL CB C 13 34.6 0.2 . 1 . . . . . . . . 4345 2 831 . 1 1 66 66 VAL CG1 C 13 21.9 0.2 . 1 . . . . . . . . 4345 2 832 . 1 1 66 66 VAL CG2 C 13 21.9 0.2 . 1 . . . . . . . . 4345 2 833 . 1 1 66 66 VAL N N 15 121.4 0.2 . 1 . . . . . . . . 4345 2 834 . 1 1 67 67 TYR H H 1 9.03 0.02 . 1 . . . . . . . . 4345 2 835 . 1 1 67 67 TYR HA H 1 4.67 0.02 . 1 . . . . . . . . 4345 2 836 . 1 1 67 67 TYR HB2 H 1 2.79 0.02 . 1 . . . . . . . . 4345 2 837 . 1 1 67 67 TYR HB3 H 1 2.73 0.02 . 1 . . . . . . . . 4345 2 838 . 1 1 67 67 TYR HD1 H 1 7.02 0.02 . 1 . . . . . . . . 4345 2 839 . 1 1 67 67 TYR HD2 H 1 7.02 0.02 . 1 . . . . . . . . 4345 2 840 . 1 1 67 67 TYR HE1 H 1 6.89 0.02 . 1 . . . . . . . . 4345 2 841 . 1 1 67 67 TYR HE2 H 1 6.89 0.02 . 1 . . . . . . . . 4345 2 842 . 1 1 67 67 TYR C C 13 173.7 0.2 . 1 . . . . . . . . 4345 2 843 . 1 1 67 67 TYR CA C 13 56.7 0.2 . 1 . . . . . . . . 4345 2 844 . 1 1 67 67 TYR CB C 13 41.1 0.2 . 1 . . . . . . . . 4345 2 845 . 1 1 67 67 TYR CD1 C 13 133.2 0.2 . 1 . . . . . . . . 4345 2 846 . 1 1 67 67 TYR CD2 C 13 133.2 0.2 . 1 . . . . . . . . 4345 2 847 . 1 1 67 67 TYR CE1 C 13 118.7 0.2 . 1 . . . . . . . . 4345 2 848 . 1 1 67 67 TYR CE2 C 13 118.7 0.2 . 1 . . . . . . . . 4345 2 849 . 1 1 67 67 TYR N N 15 128.4 0.2 . 1 . . . . . . . . 4345 2 850 . 1 1 68 68 TYR H H 1 7.95 0.02 . 1 . . . . . . . . 4345 2 851 . 1 1 68 68 TYR HA H 1 4.57 0.02 . 1 . . . . . . . . 4345 2 852 . 1 1 68 68 TYR HB2 H 1 2.52 0.02 . 1 . . . . . . . . 4345 2 853 . 1 1 68 68 TYR HB3 H 1 2.93 0.02 . 1 . . . . . . . . 4345 2 854 . 1 1 68 68 TYR HD1 H 1 7.01 0.02 . 1 . . . . . . . . 4345 2 855 . 1 1 68 68 TYR HD2 H 1 7.01 0.02 . 1 . . . . . . . . 4345 2 856 . 1 1 68 68 TYR HE1 H 1 6.64 0.02 . 1 . . . . . . . . 4345 2 857 . 1 1 68 68 TYR HE2 H 1 6.64 0.02 . 1 . . . . . . . . 4345 2 858 . 1 1 68 68 TYR C C 13 174.5 0.2 . 1 . . . . . . . . 4345 2 859 . 1 1 68 68 TYR CA C 13 58.0 0.2 . 1 . . . . . . . . 4345 2 860 . 1 1 68 68 TYR CB C 13 37.3 0.2 . 1 . . . . . . . . 4345 2 861 . 1 1 68 68 TYR CD1 C 13 133.2 0.2 . 1 . . . . . . . . 4345 2 862 . 1 1 68 68 TYR CD2 C 13 133.2 0.2 . 1 . . . . . . . . 4345 2 863 . 1 1 68 68 TYR CE1 C 13 118.5 0.2 . 1 . . . . . . . . 4345 2 864 . 1 1 68 68 TYR CE2 C 13 118.5 0.2 . 1 . . . . . . . . 4345 2 865 . 1 1 68 68 TYR N N 15 127.8 0.2 . 1 . . . . . . . . 4345 2 866 . 1 1 69 69 PHE H H 1 8.41 0.02 . 1 . . . . . . . . 4345 2 867 . 1 1 69 69 PHE HA H 1 4.44 0.02 . 1 . . . . . . . . 4345 2 868 . 1 1 69 69 PHE HB2 H 1 2.80 0.02 . 1 . . . . . . . . 4345 2 869 . 1 1 69 69 PHE HB3 H 1 2.98 0.02 . 1 . . . . . . . . 4345 2 870 . 1 1 69 69 PHE HD1 H 1 7.17 0.02 . 1 . . . . . . . . 4345 2 871 . 1 1 69 69 PHE HD2 H 1 7.17 0.02 . 1 . . . . . . . . 4345 2 872 . 1 1 69 69 PHE HE1 H 1 7.17 0.02 . 1 . . . . . . . . 4345 2 873 . 1 1 69 69 PHE HE2 H 1 7.17 0.02 . 1 . . . . . . . . 4345 2 874 . 1 1 69 69 PHE HZ H 1 7.15 0.02 . 3 . . . . . . . . 4345 2 875 . 1 1 69 69 PHE C C 13 176.6 0.2 . 1 . . . . . . . . 4345 2 876 . 1 1 69 69 PHE CA C 13 57.8 0.2 . 1 . . . . . . . . 4345 2 877 . 1 1 69 69 PHE CB C 13 41.3 0.2 . 1 . . . . . . . . 4345 2 878 . 1 1 69 69 PHE CD1 C 13 132.4 0.2 . 1 . . . . . . . . 4345 2 879 . 1 1 69 69 PHE CD2 C 13 132.4 0.2 . 1 . . . . . . . . 4345 2 880 . 1 1 69 69 PHE CE1 C 13 132.4 0.2 . 1 . . . . . . . . 4345 2 881 . 1 1 69 69 PHE CE2 C 13 132.4 0.2 . 1 . . . . . . . . 4345 2 882 . 1 1 69 69 PHE CZ C 13 132.4 0.2 . 3 . . . . . . . . 4345 2 883 . 1 1 69 69 PHE N N 15 126.9 0.2 . 1 . . . . . . . . 4345 2 884 . 1 1 70 70 GLN H H 1 8.74 0.02 . 1 . . . . . . . . 4345 2 885 . 1 1 70 70 GLN HA H 1 4.14 0.02 . 1 . . . . . . . . 4345 2 886 . 1 1 70 70 GLN HB2 H 1 1.93 0.02 . 2 . . . . . . . . 4345 2 887 . 1 1 70 70 GLN HB3 H 1 1.75 0.02 . 2 . . . . . . . . 4345 2 888 . 1 1 70 70 GLN HG2 H 1 2.25 0.02 . 1 . . . . . . . . 4345 2 889 . 1 1 70 70 GLN HG3 H 1 2.30 0.02 . 1 . . . . . . . . 4345 2 890 . 1 1 70 70 GLN HE21 H 1 6.79 0.02 . 1 . . . . . . . . 4345 2 891 . 1 1 70 70 GLN HE22 H 1 7.30 0.02 . 1 . . . . . . . . 4345 2 892 . 1 1 70 70 GLN C C 13 176.0 0.2 . 1 . . . . . . . . 4345 2 893 . 1 1 70 70 GLN CA C 13 56.2 0.2 . 1 . . . . . . . . 4345 2 894 . 1 1 70 70 GLN CB C 13 27.3 0.2 . 1 . . . . . . . . 4345 2 895 . 1 1 70 70 GLN CG C 13 34.3 0.2 . 1 . . . . . . . . 4345 2 896 . 1 1 70 70 GLN CD C 13 180.9 0.2 . 1 . . . . . . . . 4345 2 897 . 1 1 70 70 GLN N N 15 127.8 0.2 . 1 . . . . . . . . 4345 2 898 . 1 1 70 70 GLN NE2 N 15 112.3 0.2 . 1 . . . . . . . . 4345 2 899 . 1 1 71 71 GLY H H 1 6.96 0.02 . 1 . . . . . . . . 4345 2 900 . 1 1 71 71 GLY HA2 H 1 3.66 0.02 . 2 . . . . . . . . 4345 2 901 . 1 1 71 71 GLY HA3 H 1 4.14 0.02 . 2 . . . . . . . . 4345 2 902 . 1 1 71 71 GLY C C 13 172.8 0.2 . 1 . . . . . . . . 4345 2 903 . 1 1 71 71 GLY CA C 13 44.3 0.2 . 1 . . . . . . . . 4345 2 904 . 1 1 71 71 GLY N N 15 107.4 0.2 . 1 . . . . . . . . 4345 2 905 . 1 1 72 72 GLY H H 1 8.45 0.02 . 1 . . . . . . . . 4345 2 906 . 1 1 72 72 GLY HA2 H 1 4.55 0.02 . 2 . . . . . . . . 4345 2 907 . 1 1 72 72 GLY HA3 H 1 4.16 0.02 . 2 . . . . . . . . 4345 2 908 . 1 1 72 72 GLY C C 13 173.9 0.2 . 1 . . . . . . . . 4345 2 909 . 1 1 72 72 GLY CA C 13 44.7 0.2 . 1 . . . . . . . . 4345 2 910 . 1 1 72 72 GLY N N 15 106.0 0.2 . 1 . . . . . . . . 4345 2 911 . 1 1 73 73 ASN H H 1 9.12 0.02 . 1 . . . . . . . . 4345 2 912 . 1 1 73 73 ASN HA H 1 4.44 0.02 . 1 . . . . . . . . 4345 2 913 . 1 1 73 73 ASN HB2 H 1 3.10 0.02 . 1 . . . . . . . . 4345 2 914 . 1 1 73 73 ASN HB3 H 1 2.46 0.02 . 1 . . . . . . . . 4345 2 915 . 1 1 73 73 ASN HD21 H 1 7.02 0.02 . 2 . . . . . . . . 4345 2 916 . 1 1 73 73 ASN HD22 H 1 7.98 0.02 . 2 . . . . . . . . 4345 2 917 . 1 1 73 73 ASN C C 13 179.3 0.2 . 1 . . . . . . . . 4345 2 918 . 1 1 73 73 ASN CA C 13 55.2 0.2 . 1 . . . . . . . . 4345 2 919 . 1 1 73 73 ASN CB C 13 37.1 0.2 . 1 . . . . . . . . 4345 2 920 . 1 1 73 73 ASN N N 15 118.9 0.2 . 1 . . . . . . . . 4345 2 921 . 1 1 73 73 ASN ND2 N 15 113.8 0.2 . 1 . . . . . . . . 4345 2 922 . 1 1 74 74 ASN H H 1 8.86 0.02 . 1 . . . . . . . . 4345 2 923 . 1 1 74 74 ASN HA H 1 4.33 0.02 . 1 . . . . . . . . 4345 2 924 . 1 1 74 74 ASN HB2 H 1 2.70 0.02 . 1 . . . . . . . . 4345 2 925 . 1 1 74 74 ASN HB3 H 1 2.70 0.02 . 1 . . . . . . . . 4345 2 926 . 1 1 74 74 ASN HD21 H 1 7.01 0.02 . 2 . . . . . . . . 4345 2 927 . 1 1 74 74 ASN HD22 H 1 7.73 0.02 . 2 . . . . . . . . 4345 2 928 . 1 1 74 74 ASN C C 13 176.9 0.2 . 1 . . . . . . . . 4345 2 929 . 1 1 74 74 ASN CA C 13 56.9 0.2 . 1 . . . . . . . . 4345 2 930 . 1 1 74 74 ASN CB C 13 37.3 0.2 . 1 . . . . . . . . 4345 2 931 . 1 1 74 74 ASN N N 15 122.9 0.2 . 1 . . . . . . . . 4345 2 932 . 1 1 74 74 ASN ND2 N 15 114.2 0.2 . 1 . . . . . . . . 4345 2 933 . 1 1 75 75 GLU H H 1 7.84 0.02 . 1 . . . . . . . . 4345 2 934 . 1 1 75 75 GLU HA H 1 4.06 0.02 . 1 . . . . . . . . 4345 2 935 . 1 1 75 75 GLU HB2 H 1 2.26 0.02 . 2 . . . . . . . . 4345 2 936 . 1 1 75 75 GLU HB3 H 1 2.37 0.02 . 2 . . . . . . . . 4345 2 937 . 1 1 75 75 GLU HG2 H 1 2.49 0.02 . 2 . . . . . . . . 4345 2 938 . 1 1 75 75 GLU HG3 H 1 2.32 0.02 . 2 . . . . . . . . 4345 2 939 . 1 1 75 75 GLU C C 13 179.6 0.2 . 1 . . . . . . . . 4345 2 940 . 1 1 75 75 GLU CA C 13 60.0 0.2 . 1 . . . . . . . . 4345 2 941 . 1 1 75 75 GLU CB C 13 29.6 0.2 . 1 . . . . . . . . 4345 2 942 . 1 1 75 75 GLU CG C 13 38.1 0.2 . 1 . . . . . . . . 4345 2 943 . 1 1 75 75 GLU N N 15 122.3 0.2 . 1 . . . . . . . . 4345 2 944 . 1 1 76 76 LEU H H 1 9.03 0.02 . 1 . . . . . . . . 4345 2 945 . 1 1 76 76 LEU HA H 1 3.51 0.02 . 1 . . . . . . . . 4345 2 946 . 1 1 76 76 LEU HB2 H 1 0.68 0.02 . 1 . . . . . . . . 4345 2 947 . 1 1 76 76 LEU HB3 H 1 2.33 0.02 . 1 . . . . . . . . 4345 2 948 . 1 1 76 76 LEU HG H 1 0.89 0.02 . 1 . . . . . . . . 4345 2 949 . 1 1 76 76 LEU HD11 H 1 -0.28 0.02 . 1 . . . . . . . . 4345 2 950 . 1 1 76 76 LEU HD12 H 1 -0.28 0.02 . 1 . . . . . . . . 4345 2 951 . 1 1 76 76 LEU HD13 H 1 -0.28 0.02 . 1 . . . . . . . . 4345 2 952 . 1 1 76 76 LEU HD21 H 1 0.42 0.02 . 1 . . . . . . . . 4345 2 953 . 1 1 76 76 LEU HD22 H 1 0.42 0.02 . 1 . . . . . . . . 4345 2 954 . 1 1 76 76 LEU HD23 H 1 0.42 0.02 . 1 . . . . . . . . 4345 2 955 . 1 1 76 76 LEU C C 13 178.2 0.2 . 1 . . . . . . . . 4345 2 956 . 1 1 76 76 LEU CA C 13 57.3 0.2 . 1 . . . . . . . . 4345 2 957 . 1 1 76 76 LEU CB C 13 39.0 0.2 . 1 . . . . . . . . 4345 2 958 . 1 1 76 76 LEU CG C 13 26.4 0.2 . 1 . . . . . . . . 4345 2 959 . 1 1 76 76 LEU CD1 C 13 21.3 0.2 . 1 . . . . . . . . 4345 2 960 . 1 1 76 76 LEU CD2 C 13 26.3 0.2 . 1 . . . . . . . . 4345 2 961 . 1 1 76 76 LEU N N 15 124.2 0.2 . 1 . . . . . . . . 4345 2 962 . 1 1 77 77 GLY H H 1 7.41 0.02 . 1 . . . . . . . . 4345 2 963 . 1 1 77 77 GLY HA2 H 1 3.15 0.02 . 2 . . . . . . . . 4345 2 964 . 1 1 77 77 GLY HA3 H 1 3.80 0.02 . 2 . . . . . . . . 4345 2 965 . 1 1 77 77 GLY C C 13 176.0 0.2 . 1 . . . . . . . . 4345 2 966 . 1 1 77 77 GLY CA C 13 47.5 0.2 . 1 . . . . . . . . 4345 2 967 . 1 1 77 77 GLY N N 15 104.8 0.2 . 1 . . . . . . . . 4345 2 968 . 1 1 78 78 THR H H 1 7.69 0.02 . 1 . . . . . . . . 4345 2 969 . 1 1 78 78 THR HA H 1 3.96 0.02 . 1 . . . . . . . . 4345 2 970 . 1 1 78 78 THR HB H 1 4.07 0.02 . 1 . . . . . . . . 4345 2 971 . 1 1 78 78 THR HG21 H 1 1.17 0.02 . 1 . . . . . . . . 4345 2 972 . 1 1 78 78 THR HG22 H 1 1.17 0.02 . 1 . . . . . . . . 4345 2 973 . 1 1 78 78 THR HG23 H 1 1.17 0.02 . 1 . . . . . . . . 4345 2 974 . 1 1 78 78 THR C C 13 178.5 0.2 . 1 . . . . . . . . 4345 2 975 . 1 1 78 78 THR CA C 13 66.3 0.2 . 1 . . . . . . . . 4345 2 976 . 1 1 78 78 THR CB C 13 68.9 0.2 . 1 . . . . . . . . 4345 2 977 . 1 1 78 78 THR CG2 C 13 21.9 0.2 . 1 . . . . . . . . 4345 2 978 . 1 1 78 78 THR N N 15 117.0 0.2 . 1 . . . . . . . . 4345 2 979 . 1 1 79 79 ALA H H 1 8.08 0.02 . 1 . . . . . . . . 4345 2 980 . 1 1 79 79 ALA HA H 1 4.07 0.02 . 1 . . . . . . . . 4345 2 981 . 1 1 79 79 ALA HB1 H 1 1.37 0.02 . 1 . . . . . . . . 4345 2 982 . 1 1 79 79 ALA HB2 H 1 1.37 0.02 . 1 . . . . . . . . 4345 2 983 . 1 1 79 79 ALA HB3 H 1 1.37 0.02 . 1 . . . . . . . . 4345 2 984 . 1 1 79 79 ALA C C 13 179.1 0.2 . 1 . . . . . . . . 4345 2 985 . 1 1 79 79 ALA CA C 13 55.0 0.2 . 1 . . . . . . . . 4345 2 986 . 1 1 79 79 ALA CB C 13 18.3 0.2 . 1 . . . . . . . . 4345 2 987 . 1 1 79 79 ALA N N 15 126.1 0.2 . 1 . . . . . . . . 4345 2 988 . 1 1 80 80 VAL H H 1 7.14 0.02 . 1 . . . . . . . . 4345 2 989 . 1 1 80 80 VAL HA H 1 4.12 0.02 . 1 . . . . . . . . 4345 2 990 . 1 1 80 80 VAL HB H 1 2.16 0.02 . 1 . . . . . . . . 4345 2 991 . 1 1 80 80 VAL HG11 H 1 0.47 0.02 . 1 . . . . . . . . 4345 2 992 . 1 1 80 80 VAL HG12 H 1 0.47 0.02 . 1 . . . . . . . . 4345 2 993 . 1 1 80 80 VAL HG13 H 1 0.47 0.02 . 1 . . . . . . . . 4345 2 994 . 1 1 80 80 VAL HG21 H 1 0.70 0.02 . 1 . . . . . . . . 4345 2 995 . 1 1 80 80 VAL HG22 H 1 0.70 0.02 . 1 . . . . . . . . 4345 2 996 . 1 1 80 80 VAL HG23 H 1 0.70 0.02 . 1 . . . . . . . . 4345 2 997 . 1 1 80 80 VAL C C 13 174.9 0.2 . 1 . . . . . . . . 4345 2 998 . 1 1 80 80 VAL CA C 13 60.3 0.2 . 1 . . . . . . . . 4345 2 999 . 1 1 80 80 VAL CB C 13 30.2 0.2 . 1 . . . . . . . . 4345 2 1000 . 1 1 80 80 VAL CG1 C 13 22.4 0.2 . 1 . . . . . . . . 4345 2 1001 . 1 1 80 80 VAL CG2 C 13 19.6 0.2 . 1 . . . . . . . . 4345 2 1002 . 1 1 80 80 VAL N N 15 106.8 0.2 . 1 . . . . . . . . 4345 2 1003 . 1 1 81 81 GLY H H 1 7.69 0.02 . 1 . . . . . . . . 4345 2 1004 . 1 1 81 81 GLY HA2 H 1 3.67 0.02 . 2 . . . . . . . . 4345 2 1005 . 1 1 81 81 GLY HA3 H 1 3.78 0.02 . 2 . . . . . . . . 4345 2 1006 . 1 1 81 81 GLY C C 13 174.9 0.2 . 1 . . . . . . . . 4345 2 1007 . 1 1 81 81 GLY CA C 13 46.2 0.2 . 1 . . . . . . . . 4345 2 1008 . 1 1 81 81 GLY N N 15 107.8 0.2 . 1 . . . . . . . . 4345 2 1009 . 1 1 82 82 LYS H H 1 7.83 0.02 . 1 . . . . . . . . 4345 2 1010 . 1 1 82 82 LYS HA H 1 4.31 0.02 . 1 . . . . . . . . 4345 2 1011 . 1 1 82 82 LYS HB2 H 1 0.65 0.02 . 2 . . . . . . . . 4345 2 1012 . 1 1 82 82 LYS HB3 H 1 -0.1 0.02 . 2 . . . . . . . . 4345 2 1013 . 1 1 82 82 LYS HG2 H 1 1.35 0.02 . 4 . . . . . . . . 4345 2 1014 . 1 1 82 82 LYS HG3 H 1 1.58 0.02 . 4 . . . . . . . . 4345 2 1015 . 1 1 82 82 LYS C C 13 176.8 0.2 . 1 . . . . . . . . 4345 2 1016 . 1 1 82 82 LYS CA C 13 51.7 0.2 . 1 . . . . . . . . 4345 2 1017 . 1 1 82 82 LYS CB C 13 33.0 0.2 . 1 . . . . . . . . 4345 2 1018 . 1 1 82 82 LYS N N 15 117.4 0.2 . 1 . . . . . . . . 4345 2 1019 . 1 1 83 83 LEU H H 1 8.21 0.02 . 1 . . . . . . . . 4345 2 1020 . 1 1 83 83 LEU HA H 1 4.16 0.02 . 1 . . . . . . . . 4345 2 1021 . 1 1 83 83 LEU HB2 H 1 1.80 0.02 . 1 . . . . . . . . 4345 2 1022 . 1 1 83 83 LEU HB3 H 1 1.31 0.02 . 1 . . . . . . . . 4345 2 1023 . 1 1 83 83 LEU HG H 1 1.53 0.02 . 1 . . . . . . . . 4345 2 1024 . 1 1 83 83 LEU HD11 H 1 0.82 0.02 . 1 . . . . . . . . 4345 2 1025 . 1 1 83 83 LEU HD12 H 1 0.82 0.02 . 1 . . . . . . . . 4345 2 1026 . 1 1 83 83 LEU HD13 H 1 0.82 0.02 . 1 . . . . . . . . 4345 2 1027 . 1 1 83 83 LEU HD21 H 1 0.94 0.02 . 1 . . . . . . . . 4345 2 1028 . 1 1 83 83 LEU HD22 H 1 0.94 0.02 . 1 . . . . . . . . 4345 2 1029 . 1 1 83 83 LEU HD23 H 1 0.94 0.02 . 1 . . . . . . . . 4345 2 1030 . 1 1 83 83 LEU C C 13 176.2 0.2 . 1 . . . . . . . . 4345 2 1031 . 1 1 83 83 LEU CA C 13 54.0 0.2 . 1 . . . . . . . . 4345 2 1032 . 1 1 83 83 LEU CB C 13 40.5 0.2 . 1 . . . . . . . . 4345 2 1033 . 1 1 83 83 LEU CG C 13 27.7 0.2 . 1 . . . . . . . . 4345 2 1034 . 1 1 83 83 LEU CD1 C 13 24.1 0.2 . 1 . . . . . . . . 4345 2 1035 . 1 1 83 83 LEU CD2 C 13 24.4 0.2 . 1 . . . . . . . . 4345 2 1036 . 1 1 83 83 LEU N N 15 119.5 0.2 . 1 . . . . . . . . 4345 2 1037 . 1 1 84 84 PHE H H 1 5.98 0.02 . 1 . . . . . . . . 4345 2 1038 . 1 1 84 84 PHE HA H 1 4.54 0.02 . 1 . . . . . . . . 4345 2 1039 . 1 1 84 84 PHE HB2 H 1 2.67 0.02 . 1 . . . . . . . . 4345 2 1040 . 1 1 84 84 PHE HB3 H 1 2.19 0.02 . 1 . . . . . . . . 4345 2 1041 . 1 1 84 84 PHE HD1 H 1 6.55 0.02 . 1 . . . . . . . . 4345 2 1042 . 1 1 84 84 PHE HD2 H 1 6.55 0.02 . 1 . . . . . . . . 4345 2 1043 . 1 1 84 84 PHE HE1 H 1 6.25 0.02 . 1 . . . . . . . . 4345 2 1044 . 1 1 84 84 PHE HE2 H 1 6.25 0.02 . 1 . . . . . . . . 4345 2 1045 . 1 1 84 84 PHE HZ H 1 6.30 0.02 . 1 . . . . . . . . 4345 2 1046 . 1 1 84 84 PHE C C 13 173.8 0.2 . 1 . . . . . . . . 4345 2 1047 . 1 1 84 84 PHE CA C 13 53.4 0.2 . 1 . . . . . . . . 4345 2 1048 . 1 1 84 84 PHE CB C 13 40.4 0.2 . 1 . . . . . . . . 4345 2 1049 . 1 1 84 84 PHE CD1 C 13 128.2 0.2 . 1 . . . . . . . . 4345 2 1050 . 1 1 84 84 PHE CD2 C 13 128.2 0.2 . 1 . . . . . . . . 4345 2 1051 . 1 1 84 84 PHE CE1 C 13 130.1 0.2 . 1 . . . . . . . . 4345 2 1052 . 1 1 84 84 PHE CE2 C 13 130.1 0.2 . 1 . . . . . . . . 4345 2 1053 . 1 1 84 84 PHE CZ C 13 133.0 0.2 . 3 . . . . . . . . 4345 2 1054 . 1 1 84 84 PHE N N 15 114.3 0.2 . 1 . . . . . . . . 4345 2 1055 . 1 1 85 85 ARG H H 1 7.78 0.02 . 1 . . . . . . . . 4345 2 1056 . 1 1 85 85 ARG HA H 1 3.73 0.02 . 1 . . . . . . . . 4345 2 1057 . 1 1 85 85 ARG HB2 H 1 1.50 0.02 . 2 . . . . . . . . 4345 2 1058 . 1 1 85 85 ARG HB3 H 1 1.22 0.02 . 2 . . . . . . . . 4345 2 1059 . 1 1 85 85 ARG HG2 H 1 1.50 0.02 . 2 . . . . . . . . 4345 2 1060 . 1 1 85 85 ARG HG3 H 1 1.03 0.02 . 2 . . . . . . . . 4345 2 1061 . 1 1 85 85 ARG HD2 H 1 2.85 0.02 . 1 . . . . . . . . 4345 2 1062 . 1 1 85 85 ARG HD3 H 1 3.01 0.02 . 1 . . . . . . . . 4345 2 1063 . 1 1 85 85 ARG HE H 1 7.10 0.02 . 1 . . . . . . . . 4345 2 1064 . 1 1 85 85 ARG C C 13 176.7 0.2 . 1 . . . . . . . . 4345 2 1065 . 1 1 85 85 ARG CA C 13 56.8 0.2 . 1 . . . . . . . . 4345 2 1066 . 1 1 85 85 ARG CB C 13 31.7 0.2 . 1 . . . . . . . . 4345 2 1067 . 1 1 85 85 ARG CD C 13 43.5 0.2 . 1 . . . . . . . . 4345 2 1068 . 1 1 85 85 ARG N N 15 117.3 0.2 . 1 . . . . . . . . 4345 2 1069 . 1 1 85 85 ARG NE N 15 83.9 0.2 . 1 . . . . . . . . 4345 2 1070 . 1 1 86 86 VAL H H 1 7.64 0.02 . 1 . . . . . . . . 4345 2 1071 . 1 1 86 86 VAL HA H 1 3.89 0.02 . 1 . . . . . . . . 4345 2 1072 . 1 1 86 86 VAL HB H 1 1.29 0.02 . 1 . . . . . . . . 4345 2 1073 . 1 1 86 86 VAL HG11 H 1 0.41 0.02 . 1 . . . . . . . . 4345 2 1074 . 1 1 86 86 VAL HG12 H 1 0.41 0.02 . 1 . . . . . . . . 4345 2 1075 . 1 1 86 86 VAL HG13 H 1 0.41 0.02 . 1 . . . . . . . . 4345 2 1076 . 1 1 86 86 VAL HG21 H 1 0.54 0.02 . 1 . . . . . . . . 4345 2 1077 . 1 1 86 86 VAL HG22 H 1 0.54 0.02 . 1 . . . . . . . . 4345 2 1078 . 1 1 86 86 VAL HG23 H 1 0.54 0.02 . 1 . . . . . . . . 4345 2 1079 . 1 1 86 86 VAL C C 13 174.6 0.2 . 1 . . . . . . . . 4345 2 1080 . 1 1 86 86 VAL CA C 13 61.5 0.2 . 1 . . . . . . . . 4345 2 1081 . 1 1 86 86 VAL CB C 13 36.1 0.2 . 1 . . . . . . . . 4345 2 1082 . 1 1 86 86 VAL CG1 C 13 23.9 0.2 . 1 . . . . . . . . 4345 2 1083 . 1 1 86 86 VAL CG2 C 13 22.6 0.2 . 1 . . . . . . . . 4345 2 1084 . 1 1 86 86 VAL N N 15 119.9 0.2 . 1 . . . . . . . . 4345 2 1085 . 1 1 87 87 GLY H H 1 9.93 0.02 . 1 . . . . . . . . 4345 2 1086 . 1 1 87 87 GLY HA2 H 1 3.92 0.02 . 2 . . . . . . . . 4345 2 1087 . 1 1 87 87 GLY HA3 H 1 4.04 0.02 . 2 . . . . . . . . 4345 2 1088 . 1 1 87 87 GLY C C 13 174.6 0.2 . 1 . . . . . . . . 4345 2 1089 . 1 1 87 87 GLY CA C 13 46.4 0.2 . 1 . . . . . . . . 4345 2 1090 . 1 1 87 87 GLY N N 15 114.7 0.2 . 1 . . . . . . . . 4345 2 1091 . 1 1 88 88 VAL H H 1 7.08 0.02 . 1 . . . . . . . . 4345 2 1092 . 1 1 88 88 VAL HA H 1 5.40 0.02 . 1 . . . . . . . . 4345 2 1093 . 1 1 88 88 VAL HB H 1 2.22 0.02 . 1 . . . . . . . . 4345 2 1094 . 1 1 88 88 VAL HG11 H 1 0.96 0.02 . 1 . . . . . . . . 4345 2 1095 . 1 1 88 88 VAL HG12 H 1 0.96 0.02 . 1 . . . . . . . . 4345 2 1096 . 1 1 88 88 VAL HG13 H 1 0.96 0.02 . 1 . . . . . . . . 4345 2 1097 . 1 1 88 88 VAL HG21 H 1 0.89 0.02 . 1 . . . . . . . . 4345 2 1098 . 1 1 88 88 VAL HG22 H 1 0.89 0.02 . 1 . . . . . . . . 4345 2 1099 . 1 1 88 88 VAL HG23 H 1 0.89 0.02 . 1 . . . . . . . . 4345 2 1100 . 1 1 88 88 VAL C C 13 171.4 0.2 . 1 . . . . . . . . 4345 2 1101 . 1 1 88 88 VAL CA C 13 59.3 0.2 . 1 . . . . . . . . 4345 2 1102 . 1 1 88 88 VAL CB C 13 36.1 0.2 . 1 . . . . . . . . 4345 2 1103 . 1 1 88 88 VAL CG1 C 13 23.3 0.2 . 1 . . . . . . . . 4345 2 1104 . 1 1 88 88 VAL CG2 C 13 18.8 0.2 . 1 . . . . . . . . 4345 2 1105 . 1 1 88 88 VAL N N 15 115.8 0.2 . 1 . . . . . . . . 4345 2 1106 . 1 1 89 89 VAL H H 1 8.47 0.02 . 1 . . . . . . . . 4345 2 1107 . 1 1 89 89 VAL HA H 1 4.53 0.02 . 1 . . . . . . . . 4345 2 1108 . 1 1 89 89 VAL HB H 1 1.64 0.02 . 1 . . . . . . . . 4345 2 1109 . 1 1 89 89 VAL HG11 H 1 0.64 0.02 . 1 . . . . . . . . 4345 2 1110 . 1 1 89 89 VAL HG12 H 1 0.64 0.02 . 1 . . . . . . . . 4345 2 1111 . 1 1 89 89 VAL HG13 H 1 0.64 0.02 . 1 . . . . . . . . 4345 2 1112 . 1 1 89 89 VAL HG21 H 1 0.70 0.02 . 1 . . . . . . . . 4345 2 1113 . 1 1 89 89 VAL HG22 H 1 0.70 0.02 . 1 . . . . . . . . 4345 2 1114 . 1 1 89 89 VAL HG23 H 1 0.70 0.02 . 1 . . . . . . . . 4345 2 1115 . 1 1 89 89 VAL C C 13 174.0 0.2 . 1 . . . . . . . . 4345 2 1116 . 1 1 89 89 VAL CA C 13 60.1 0.2 . 1 . . . . . . . . 4345 2 1117 . 1 1 89 89 VAL CB C 13 36.1 0.2 . 1 . . . . . . . . 4345 2 1118 . 1 1 89 89 VAL CG1 C 13 22.5 0.2 . 1 . . . . . . . . 4345 2 1119 . 1 1 89 89 VAL CG2 C 13 20.9 0.2 . 1 . . . . . . . . 4345 2 1120 . 1 1 89 89 VAL N N 15 125.8 0.2 . 1 . . . . . . . . 4345 2 1121 . 1 1 90 90 SER H H 1 8.79 0.02 . 1 . . . . . . . . 4345 2 1122 . 1 1 90 90 SER HA H 1 5.25 0.02 . 1 . . . . . . . . 4345 2 1123 . 1 1 90 90 SER HB2 H 1 3.92 0.02 . 1 . . . . . . . . 4345 2 1124 . 1 1 90 90 SER HB3 H 1 3.89 0.02 . 1 . . . . . . . . 4345 2 1125 . 1 1 90 90 SER C C 13 174.7 0.2 . 1 . . . . . . . . 4345 2 1126 . 1 1 90 90 SER CA C 13 55.0 0.2 . 1 . . . . . . . . 4345 2 1127 . 1 1 90 90 SER CB C 13 65.3 0.2 . 1 . . . . . . . . 4345 2 1128 . 1 1 90 90 SER N N 15 120.3 0.2 . 1 . . . . . . . . 4345 2 1129 . 1 1 91 91 ILE H H 1 9.20 0.02 . 1 . . . . . . . . 4345 2 1130 . 1 1 91 91 ILE HA H 1 4.14 0.02 . 1 . . . . . . . . 4345 2 1131 . 1 1 91 91 ILE HB H 1 2.11 0.02 . 1 . . . . . . . . 4345 2 1132 . 1 1 91 91 ILE HG12 H 1 0.95 0.02 . 2 . . . . . . . . 4345 2 1133 . 1 1 91 91 ILE HG13 H 1 1.27 0.02 . 2 . . . . . . . . 4345 2 1134 . 1 1 91 91 ILE HG21 H 1 0.74 0.02 . 1 . . . . . . . . 4345 2 1135 . 1 1 91 91 ILE HG22 H 1 0.74 0.02 . 1 . . . . . . . . 4345 2 1136 . 1 1 91 91 ILE HG23 H 1 0.74 0.02 . 1 . . . . . . . . 4345 2 1137 . 1 1 91 91 ILE HD11 H 1 0.65 0.02 . 1 . . . . . . . . 4345 2 1138 . 1 1 91 91 ILE HD12 H 1 0.65 0.02 . 1 . . . . . . . . 4345 2 1139 . 1 1 91 91 ILE HD13 H 1 0.65 0.02 . 1 . . . . . . . . 4345 2 1140 . 1 1 91 91 ILE C C 13 174.1 0.2 . 1 . . . . . . . . 4345 2 1141 . 1 1 91 91 ILE CA C 13 60.9 0.2 . 1 . . . . . . . . 4345 2 1142 . 1 1 91 91 ILE CB C 13 37.1 0.2 . 1 . . . . . . . . 4345 2 1143 . 1 1 91 91 ILE CG2 C 13 17.5 0.2 . 1 . . . . . . . . 4345 2 1144 . 1 1 91 91 ILE CD1 C 13 12.3 0.2 . 1 . . . . . . . . 4345 2 1145 . 1 1 91 91 ILE N N 15 127.1 0.2 . 1 . . . . . . . . 4345 2 1146 . 1 1 92 92 LEU H H 1 8.70 0.02 . 1 . . . . . . . . 4345 2 1147 . 1 1 92 92 LEU HA H 1 4.77 0.02 . 1 . . . . . . . . 4345 2 1148 . 1 1 92 92 LEU HB2 H 1 1.32 0.02 . 1 . . . . . . . . 4345 2 1149 . 1 1 92 92 LEU HB3 H 1 1.71 0.02 . 1 . . . . . . . . 4345 2 1150 . 1 1 92 92 LEU HG H 1 1.52 0.02 . 1 . . . . . . . . 4345 2 1151 . 1 1 92 92 LEU HD11 H 1 0.74 0.02 . 1 . . . . . . . . 4345 2 1152 . 1 1 92 92 LEU HD12 H 1 0.74 0.02 . 1 . . . . . . . . 4345 2 1153 . 1 1 92 92 LEU HD13 H 1 0.74 0.02 . 1 . . . . . . . . 4345 2 1154 . 1 1 92 92 LEU HD21 H 1 0.66 0.02 . 1 . . . . . . . . 4345 2 1155 . 1 1 92 92 LEU HD22 H 1 0.66 0.02 . 1 . . . . . . . . 4345 2 1156 . 1 1 92 92 LEU HD23 H 1 0.66 0.02 . 1 . . . . . . . . 4345 2 1157 . 1 1 92 92 LEU C C 13 177.1 0.2 . 1 . . . . . . . . 4345 2 1158 . 1 1 92 92 LEU CA C 13 56.4 0.2 . 1 . . . . . . . . 4345 2 1159 . 1 1 92 92 LEU CB C 13 42.5 0.2 . 1 . . . . . . . . 4345 2 1160 . 1 1 92 92 LEU CG C 13 29.2 0.2 . 1 . . . . . . . . 4345 2 1161 . 1 1 92 92 LEU CD1 C 13 25.9 0.2 . 1 . . . . . . . . 4345 2 1162 . 1 1 92 92 LEU CD2 C 13 24.4 0.2 . 1 . . . . . . . . 4345 2 1163 . 1 1 92 92 LEU N N 15 129.9 0.2 . 1 . . . . . . . . 4345 2 1164 . 1 1 93 93 GLU H H 1 8.18 0.02 . 1 . . . . . . . . 4345 2 1165 . 1 1 93 93 GLU HA H 1 4.57 0.02 . 1 . . . . . . . . 4345 2 1166 . 1 1 93 93 GLU HB2 H 1 2.26 0.02 . 1 . . . . . . . . 4345 2 1167 . 1 1 93 93 GLU HB3 H 1 1.80 0.02 . 2 . . . . . . . . 4345 2 1168 . 1 1 93 93 GLU HG2 H 1 2.30 0.02 . 1 . . . . . . . . 4345 2 1169 . 1 1 93 93 GLU HG3 H 1 2.30 0.02 . 1 . . . . . . . . 4345 2 1170 . 1 1 93 93 GLU C C 13 176.3 0.2 . 1 . . . . . . . . 4345 2 1171 . 1 1 93 93 GLU CA C 13 55.9 0.2 . 1 . . . . . . . . 4345 2 1172 . 1 1 93 93 GLU CB C 13 33.6 0.2 . 1 . . . . . . . . 4345 2 1173 . 1 1 93 93 GLU CG C 13 36.0 0.2 . 1 . . . . . . . . 4345 2 1174 . 1 1 93 93 GLU N N 15 116.3 0.2 . 1 . . . . . . . . 4345 2 1175 . 1 1 94 94 ALA H H 1 9.16 0.02 . 1 . . . . . . . . 4345 2 1176 . 1 1 94 94 ALA HA H 1 4.04 0.02 . 1 . . . . . . . . 4345 2 1177 . 1 1 94 94 ALA HB1 H 1 1.42 0.02 . 1 . . . . . . . . 4345 2 1178 . 1 1 94 94 ALA HB2 H 1 1.42 0.02 . 1 . . . . . . . . 4345 2 1179 . 1 1 94 94 ALA HB3 H 1 1.42 0.02 . 1 . . . . . . . . 4345 2 1180 . 1 1 94 94 ALA C C 13 178.4 0.2 . 1 . . . . . . . . 4345 2 1181 . 1 1 94 94 ALA CA C 13 53.7 0.2 . 1 . . . . . . . . 4345 2 1182 . 1 1 94 94 ALA CB C 13 20.1 0.2 . 1 . . . . . . . . 4345 2 1183 . 1 1 94 94 ALA N N 15 125.0 0.2 . 1 . . . . . . . . 4345 2 1184 . 1 1 95 95 GLY H H 1 8.46 0.02 . 1 . . . . . . . . 4345 2 1185 . 1 1 95 95 GLY HA2 H 1 3.69 0.02 . 2 . . . . . . . . 4345 2 1186 . 1 1 95 95 GLY HA3 H 1 4.14 0.02 . 2 . . . . . . . . 4345 2 1187 . 1 1 95 95 GLY C C 13 175.7 0.2 . 1 . . . . . . . . 4345 2 1188 . 1 1 95 95 GLY CA C 13 46.5 0.2 . 1 . . . . . . . . 4345 2 1189 . 1 1 95 95 GLY N N 15 105.9 0.2 . 1 . . . . . . . . 4345 2 1190 . 1 1 96 96 ASP H H 1 8.76 0.02 . 1 . . . . . . . . 4345 2 1191 . 1 1 96 96 ASP HA H 1 4.65 0.02 . 1 . . . . . . . . 4345 2 1192 . 1 1 96 96 ASP HB2 H 1 2.88 0.02 . 1 . . . . . . . . 4345 2 1193 . 1 1 96 96 ASP HB3 H 1 2.43 0.02 . 1 . . . . . . . . 4345 2 1194 . 1 1 96 96 ASP C C 13 176.7 0.2 . 1 . . . . . . . . 4345 2 1195 . 1 1 96 96 ASP CA C 13 54.7 0.2 . 1 . . . . . . . . 4345 2 1196 . 1 1 96 96 ASP CB C 13 41.2 0.2 . 1 . . . . . . . . 4345 2 1197 . 1 1 96 96 ASP N N 15 124.9 0.2 . 1 . . . . . . . . 4345 2 1198 . 1 1 97 97 SER H H 1 7.73 0.02 . 1 . . . . . . . . 4345 2 1199 . 1 1 97 97 SER HA H 1 4.36 0.02 . 1 . . . . . . . . 4345 2 1200 . 1 1 97 97 SER HB2 H 1 3.92 0.02 . 2 . . . . . . . . 4345 2 1201 . 1 1 97 97 SER HB3 H 1 3.80 0.02 . 2 . . . . . . . . 4345 2 1202 . 1 1 97 97 SER C C 13 175.6 0.2 . 1 . . . . . . . . 4345 2 1203 . 1 1 97 97 SER CA C 13 58.4 0.2 . 1 . . . . . . . . 4345 2 1204 . 1 1 97 97 SER CB C 13 65.6 0.2 . 1 . . . . . . . . 4345 2 1205 . 1 1 97 97 SER N N 15 112.4 0.2 . 1 . . . . . . . . 4345 2 1206 . 1 1 98 98 ASP H H 1 8.42 0.02 . 1 . . . . . . . . 4345 2 1207 . 1 1 98 98 ASP HA H 1 4.80 0.02 . 1 . . . . . . . . 4345 2 1208 . 1 1 98 98 ASP HB2 H 1 2.61 0.02 . 1 . . . . . . . . 4345 2 1209 . 1 1 98 98 ASP HB3 H 1 3.01 0.02 . 1 . . . . . . . . 4345 2 1210 . 1 1 98 98 ASP C C 13 179.6 0.2 . 1 . . . . . . . . 4345 2 1211 . 1 1 98 98 ASP CA C 13 53.9 0.2 . 1 . . . . . . . . 4345 2 1212 . 1 1 98 98 ASP CB C 13 40.1 0.2 . 1 . . . . . . . . 4345 2 1213 . 1 1 98 98 ASP N N 15 126.0 0.2 . 1 . . . . . . . . 4345 2 1214 . 1 1 99 99 ILE H H 1 7.83 0.02 . 1 . . . . . . . . 4345 2 1215 . 1 1 99 99 ILE HA H 1 3.69 0.02 . 1 . . . . . . . . 4345 2 1216 . 1 1 99 99 ILE HB H 1 1.71 0.02 . 1 . . . . . . . . 4345 2 1217 . 1 1 99 99 ILE HG12 H 1 1.23 0.02 . 2 . . . . . . . . 4345 2 1218 . 1 1 99 99 ILE HG13 H 1 0.98 0.02 . 2 . . . . . . . . 4345 2 1219 . 1 1 99 99 ILE HG21 H 1 0.69 0.02 . 1 . . . . . . . . 4345 2 1220 . 1 1 99 99 ILE HG22 H 1 0.69 0.02 . 1 . . . . . . . . 4345 2 1221 . 1 1 99 99 ILE HG23 H 1 0.69 0.02 . 1 . . . . . . . . 4345 2 1222 . 1 1 99 99 ILE HD11 H 1 0.51 0.02 . 1 . . . . . . . . 4345 2 1223 . 1 1 99 99 ILE HD12 H 1 0.51 0.02 . 1 . . . . . . . . 4345 2 1224 . 1 1 99 99 ILE HD13 H 1 0.51 0.02 . 1 . . . . . . . . 4345 2 1225 . 1 1 99 99 ILE C C 13 174.6 0.2 . 1 . . . . . . . . 4345 2 1226 . 1 1 99 99 ILE CA C 13 64.9 0.2 . 1 . . . . . . . . 4345 2 1227 . 1 1 99 99 ILE CB C 13 38.9 0.2 . 1 . . . . . . . . 4345 2 1228 . 1 1 99 99 ILE CG2 C 13 16.2 0.2 . 1 . . . . . . . . 4345 2 1229 . 1 1 99 99 ILE CD1 C 13 14.3 0.2 . 1 . . . . . . . . 4345 2 1230 . 1 1 99 99 ILE N N 15 119.7 0.2 . 1 . . . . . . . . 4345 2 1231 . 1 1 100 100 LEU H H 1 8.44 0.02 . 1 . . . . . . . . 4345 2 1232 . 1 1 100 100 LEU HA H 1 4.12 0.02 . 1 . . . . . . . . 4345 2 1233 . 1 1 100 100 LEU HB2 H 1 1.78 0.02 . 1 . . . . . . . . 4345 2 1234 . 1 1 100 100 LEU HB3 H 1 1.59 0.02 . 1 . . . . . . . . 4345 2 1235 . 1 1 100 100 LEU HG H 1 1.53 0.02 . 1 . . . . . . . . 4345 2 1236 . 1 1 100 100 LEU HD11 H 1 0.92 0.02 . 1 . . . . . . . . 4345 2 1237 . 1 1 100 100 LEU HD12 H 1 0.92 0.02 . 1 . . . . . . . . 4345 2 1238 . 1 1 100 100 LEU HD13 H 1 0.92 0.02 . 1 . . . . . . . . 4345 2 1239 . 1 1 100 100 LEU HD21 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 1240 . 1 1 100 100 LEU HD22 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 1241 . 1 1 100 100 LEU HD23 H 1 0.75 0.02 . 1 . . . . . . . . 4345 2 1242 . 1 1 100 100 LEU C C 13 179.3 0.2 . 1 . . . . . . . . 4345 2 1243 . 1 1 100 100 LEU CA C 13 56.7 0.2 . 1 . . . . . . . . 4345 2 1244 . 1 1 100 100 LEU CB C 13 40.2 0.2 . 1 . . . . . . . . 4345 2 1245 . 1 1 100 100 LEU CG C 13 27.4 0.2 . 1 . . . . . . . . 4345 2 1246 . 1 1 100 100 LEU CD1 C 13 25.6 0.2 . 1 . . . . . . . . 4345 2 1247 . 1 1 100 100 LEU CD2 C 13 23.1 0.2 . 1 . . . . . . . . 4345 2 1248 . 1 1 100 100 LEU N N 15 117.0 0.2 . 1 . . . . . . . . 4345 2 1249 . 1 1 101 101 THR H H 1 7.64 0.02 . 1 . . . . . . . . 4345 2 1250 . 1 1 101 101 THR HA H 1 4.44 0.02 . 1 . . . . . . . . 4345 2 1251 . 1 1 101 101 THR HB H 1 4.37 0.02 . 1 . . . . . . . . 4345 2 1252 . 1 1 101 101 THR HG21 H 1 1.18 0.02 . 1 . . . . . . . . 4345 2 1253 . 1 1 101 101 THR HG22 H 1 1.18 0.02 . 1 . . . . . . . . 4345 2 1254 . 1 1 101 101 THR HG23 H 1 1.18 0.02 . 1 . . . . . . . . 4345 2 1255 . 1 1 101 101 THR C C 13 176.4 0.2 . 1 . . . . . . . . 4345 2 1256 . 1 1 101 101 THR CA C 13 62.8 0.2 . 1 . . . . . . . . 4345 2 1257 . 1 1 101 101 THR CB C 13 69.5 0.2 . 1 . . . . . . . . 4345 2 1258 . 1 1 101 101 THR CG2 C 13 22.0 0.2 . 1 . . . . . . . . 4345 2 1259 . 1 1 101 101 THR N N 15 108.3 0.2 . 1 . . . . . . . . 4345 2 1260 . 1 1 102 102 THR H H 1 7.47 0.02 . 1 . . . . . . . . 4345 2 1261 . 1 1 102 102 THR HA H 1 4.43 0.02 . 1 . . . . . . . . 4345 2 1262 . 1 1 102 102 THR HB H 1 4.19 0.02 . 1 . . . . . . . . 4345 2 1263 . 1 1 102 102 THR HG21 H 1 1.15 0.02 . 1 . . . . . . . . 4345 2 1264 . 1 1 102 102 THR HG22 H 1 1.15 0.02 . 1 . . . . . . . . 4345 2 1265 . 1 1 102 102 THR HG23 H 1 1.15 0.02 . 1 . . . . . . . . 4345 2 1266 . 1 1 102 102 THR C C 13 175.2 0.2 . 1 . . . . . . . . 4345 2 1267 . 1 1 102 102 THR CA C 13 62.7 0.2 . 1 . . . . . . . . 4345 2 1268 . 1 1 102 102 THR CB C 13 70.2 0.2 . 1 . . . . . . . . 4345 2 1269 . 1 1 102 102 THR CG2 C 13 21.9 0.2 . 1 . . . . . . . . 4345 2 1270 . 1 1 102 102 THR N N 15 111.3 0.2 . 1 . . . . . . . . 4345 2 1271 . 1 1 103 103 LEU H H 1 7.53 0.02 . 1 . . . . . . . . 4345 2 1272 . 1 1 103 103 LEU HA H 1 4.40 0.02 . 1 . . . . . . . . 4345 2 1273 . 1 1 103 103 LEU HB2 H 1 1.52 0.02 . 2 . . . . . . . . 4345 2 1274 . 1 1 103 103 LEU HB3 H 1 1.43 0.02 . 2 . . . . . . . . 4345 2 1275 . 1 1 103 103 LEU HG H 1 1.50 0.02 . 1 . . . . . . . . 4345 2 1276 . 1 1 103 103 LEU HD11 H 1 0.50 0.02 . 1 . . . . . . . . 4345 2 1277 . 1 1 103 103 LEU HD12 H 1 0.50 0.02 . 1 . . . . . . . . 4345 2 1278 . 1 1 103 103 LEU HD13 H 1 0.50 0.02 . 1 . . . . . . . . 4345 2 1279 . 1 1 103 103 LEU HD21 H 1 0.50 0.02 . 1 . . . . . . . . 4345 2 1280 . 1 1 103 103 LEU HD22 H 1 0.50 0.02 . 1 . . . . . . . . 4345 2 1281 . 1 1 103 103 LEU HD23 H 1 0.50 0.02 . 1 . . . . . . . . 4345 2 1282 . 1 1 103 103 LEU C C 13 175.9 0.2 . 1 . . . . . . . . 4345 2 1283 . 1 1 103 103 LEU CA C 13 55.3 0.2 . 1 . . . . . . . . 4345 2 1284 . 1 1 103 103 LEU CB C 13 42.4 0.2 . 1 . . . . . . . . 4345 2 1285 . 1 1 103 103 LEU CG C 13 27.0 0.2 . 1 . . . . . . . . 4345 2 1286 . 1 1 103 103 LEU CD1 C 13 25.6 0.2 . 2 . . . . . . . . 4345 2 1287 . 1 1 103 103 LEU CD2 C 13 23.9 0.2 . 2 . . . . . . . . 4345 2 1288 . 1 1 103 103 LEU N N 15 122.8 0.2 . 1 . . . . . . . . 4345 2 1289 . 1 1 104 104 ALA H H 1 7.72 0.02 . 1 . . . . . . . . 4345 2 1290 . 1 1 104 104 ALA HA H 1 4.18 0.02 . 1 . . . . . . . . 4345 2 1291 . 1 1 104 104 ALA HB1 H 1 1.40 0.02 . 1 . . . . . . . . 4345 2 1292 . 1 1 104 104 ALA HB2 H 1 1.40 0.02 . 1 . . . . . . . . 4345 2 1293 . 1 1 104 104 ALA HB3 H 1 1.40 0.02 . 1 . . . . . . . . 4345 2 1294 . 1 1 104 104 ALA CA C 13 53.9 0.2 . 1 . . . . . . . . 4345 2 1295 . 1 1 104 104 ALA CB C 13 20.8 0.2 . 1 . . . . . . . . 4345 2 1296 . 1 1 104 104 ALA N N 15 129.8 0.2 . 1 . . . . . . . . 4345 2 stop_ save_