data_4083 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 4083 _Entry.Title ; Assignments, Secondary Structure, Global Fold, and Dynamics of Chemotaxis Y Protein Using Three- and Four-Dimensional Heteronuclear (13C, 15N) NMR Spectroscopy ; _Entry.Type macromolecule _Entry.Version_type update _Entry.Submission_date 1997-12-23 _Entry.Accession_date 1997-12-23 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination BMRB _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Frankln Moy . L. . 4083 2 David Lowry . F. . 4083 3 Philip Matsumura . . . 4083 4 Frederick Dahlquist . W. . 4083 5 James Krywko . E. . 4083 6 Peter Domaille . J. . 4083 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 4083 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 423 4083 '15N chemical shifts' 127 4083 '1H chemical shifts' 886 4083 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 . . 2001-02-17 . reformat BMRB 'Format updated to NMR-STAR version 2.1' 4083 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 4083 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation ; Moy, F. L., Lowry, D. F., Matsumura, P., Dahlquist, F. W., Krywko, J. E., and Domaille, P. J., "Assignments, Secondary Structure, Global Fold, and Dynamics of Chemotaxis Y Protein Using Three- and Four-Dimensional Heteronuclear (13C, 15N) NMR Spectroscopy," Biochemistry 33, 10731-10742 (1994). ; _Citation.Title ; Assignments, Secondary Structure, Global Fold, and Dynamics of Chemotaxis Y Protein Using Three- and Four-Dimensional Heteronuclear (13C, 15N) NMR Spectroscopy ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Biochemistry _Citation.Journal_name_full . _Citation.Journal_volume 33 _Citation.Journal_issue 35 _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 10731 _Citation.Page_last 10742 _Citation.Year 1994 _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 Frankln Moy . L. . 4083 1 2 David Lowry . F. . 4083 1 3 Philip Matsumura . . . 4083 1 4 Frederick Dahlquist . W. . 4083 1 5 James Krywko . E. . 4083 1 6 Peter Domaille . J. . 4083 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'chemotaxis Y protein' 4083 1 CheY 4083 1 NMR 4083 1 'nuclear magnetic resonance' 4083 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_CheY _Assembly.Sf_category assembly _Assembly.Sf_framecode system_CheY _Assembly.Entry_ID 4083 _Assembly.ID 1 _Assembly.Name CheY _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 . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 4083 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 CheY 1 $CheY . . . native . . . . . 4083 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID CheY abbreviation 4083 1 CheY system 4083 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID ; Recombinant E. coli CheY, a 128 residue protein is involved in regulating bacterial chemotaxis by binding to the flagellar motor of a bacteria. ; 4083 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_CheY _Entity.Sf_category entity _Entity.Sf_framecode CheY _Entity.Entry_ID 4083 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'E. coli CheY' _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 ; ADKELKFLVVDDFSTMRRIV RNLLKELGFNNVEEAEDGVD ALNKLQAGGYGFVISDWNMP NMDGLELLKTIRADGAMSAL PVLMVTAEAKKENIIAAAQA GASGYVVKPFTAATLEEKLN KIFEKLGM ; _Entity.Polymer_seq_one_letter_code ; ADKELKFLVVDDFSTMRRIV RNLLKELGFNNVEEAEDGVD ALNKLQAGGYGFVISDWNMP NMDGLELLKTIRADGAMSAL PVLMVTAEAKKENIIAAAQA GASGYVVKPFTAATLEEKLN KIFEKLGM ; _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 MG _Entity.Nonpolymer_comp_label $chem_comp_MG _Entity.Number_of_monomers 128 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 2950 . "che Y protein" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 2 no BMRB 2951 . "che Y protein" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 3 no BMRB 3440 . "che Y protein" . . . . . 100.00 129 99.22 100.00 2.03e-84 . . . . 4083 1 4 no BMRB 4472 . "Chemotaxis protein Y" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 5 no PDB 1A0O . "Chey-Binding Domain Of Chea In Complex With Chey" . . . . . 100.00 128 100.00 100.00 1.27e-84 . . . . 4083 1 6 no PDB 1AB5 . "Structure Of Chey Mutant F14n, V21t" . . . . . 97.66 125 98.40 98.40 1.36e-80 . . . . 4083 1 7 no PDB 1AB6 . "Structure Of Chey Mutant F14n, V86t" . . . . . 97.66 125 98.40 98.40 1.36e-80 . . . . 4083 1 8 no PDB 1BDJ . "Complex Structure Of Hpt Domain And Chey" . . . . . 100.00 128 100.00 100.00 1.27e-84 . . . . 4083 1 9 no PDB 1C4W . "1.9 A Structure Of A-Thiophosphonate Modified Chey D57c" . . . . . 100.00 128 99.22 99.22 1.06e-83 . . . . 4083 1 10 no PDB 1CEY . "Assignments, Secondary Structure, Global Fold, And Dynamics Of Chemotaxis Y Protein Using Three-And Four-Dimensional Heteronucl" . . . . . 99.22 128 100.00 100.00 3.92e-84 . . . . 4083 1 11 no PDB 1CHN . "Magnesium Binding To The Bacterial Chemotaxis Protein Chey Results In Large Conformational Changes Involving Its Functional Sur" . . . . . 100.00 128 100.00 100.00 1.27e-84 . . . . 4083 1 12 no PDB 1CYE . "Three Dimensional Structure Of Chemotactic Che Y Protein In Aqueous Solution By Nuclear Magnetic Resonance Methods" . . . . . 100.00 129 99.22 100.00 2.03e-84 . . . . 4083 1 13 no PDB 1D4Z . "Crystal Structure Of Chey-95iv, A Hyperactive Chey Mutant" . . . . . 100.00 128 99.22 100.00 2.01e-84 . . . . 4083 1 14 no PDB 1DJM . "Solution Structure Of Bef3-Activated Chey From Escherichia Coli" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 15 no PDB 1E6K . "Two-Component Signal Transduction System D12a Mutant Of Chey" . . . . . 100.00 130 98.44 99.22 2.67e-83 . . . . 4083 1 16 no PDB 1E6L . "Two-Component Signal Transduction System D13a Mutant Of Chey" . . . . . 99.22 127 99.21 99.21 4.93e-83 . . . . 4083 1 17 no PDB 1E6M . "Two-Component Signal Transduction System D57a Mutant Of Chey" . . . . . 100.00 128 98.44 99.22 3.15e-83 . . . . 4083 1 18 no PDB 1EAY . "Chey-Binding (P2) Domain Of Chea In Complex With Chey From Escherichia Coli" . . . . . 100.00 128 100.00 100.00 1.27e-84 . . . . 4083 1 19 no PDB 1EHC . "Structure Of Signal Transduction Protein Chey" . . . . . 100.00 128 99.22 99.22 1.00e-83 . . . . 4083 1 20 no PDB 1F4V . "Crystal Structure Of Activated Chey Bound To The N-Terminus Of Flim" . . . . . 100.00 128 100.00 100.00 1.27e-84 . . . . 4083 1 21 no PDB 1FFG . "Chey-binding Domain Of Chea In Complex With Chey At 2.1 A Resolution" . . . . . 100.00 128 100.00 100.00 1.27e-84 . . . . 4083 1 22 no PDB 1FFS . "Chey-Binding Domain Of Chea In Complex With Chey From Crystals Soaked In Acetyl Phosphate" . . . . . 100.00 128 100.00 100.00 1.27e-84 . . . . 4083 1 23 no PDB 1FFW . "Chey-Binding Domain Of Chea In Complex With Chey With A Bound Imido Diphosphate" . . . . . 100.00 128 100.00 100.00 1.27e-84 . . . . 4083 1 24 no PDB 1FQW . "Crystal Structure Of Activated Chey" . . . . . 100.00 128 100.00 100.00 1.27e-84 . . . . 4083 1 25 no PDB 1JBE . "1.08 A Structure Of Apo-Chey Reveals Meta-Active Conformation" . . . . . 100.00 128 98.44 98.44 1.19e-82 . . . . 4083 1 26 no PDB 1KMI . "Crystal Structure Of An E.Coli Chemotaxis Protein, Chez" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 27 no PDB 1MIH . "A Role For Chey Glu 89 In Chez-Mediated Dephosphorylation Of The E. Coli Chemotaxis Response Regulator Chey" . . . . . 100.00 129 99.22 99.22 6.00e-84 . . . . 4083 1 28 no PDB 1VLZ . "Uncoupled Phosphorylation And Activation In Bacterial Chemotaxis: The 2.1 Angstrom Structure Of A Threonine To Isoleucine Mutan" . . . . . 100.00 128 99.22 99.22 1.00e-83 . . . . 4083 1 29 no PDB 1YMU . "Signal Transduction Protein Chey Mutant With Met 17 Replaced By Gly (M17g)" . . . . . 100.00 130 98.44 99.22 5.93e-83 . . . . 4083 1 30 no PDB 1ZDM . "Crystal Structure Of Activated Chey Bound To Xe" . . . . . 100.00 129 99.22 99.22 1.09e-83 . . . . 4083 1 31 no PDB 2B1J . "Crystal Structure Of Unphosphorylated Chey Bound To The N- Terminus Of Flim" . . . . . 100.00 128 100.00 100.00 1.27e-84 . . . . 4083 1 32 no PDB 2CHE . "Structure Of The Mg2+-Bound Form Of Chey And Mechanism Of Phosphoryl Transfer In Bacterial Chemotaxis" . . . . . 100.00 128 97.66 99.22 5.32e-83 . . . . 4083 1 33 no PDB 2CHF . "Structure Of The Mg2+-Bound Form Of Chey And The Mechanism Of Phosphoryl Transfer In Bacterial Chemotaxis" . . . . . 100.00 128 97.66 99.22 5.32e-83 . . . . 4083 1 34 no PDB 2FKA . "Crystal Structure Of Mg(2+) And Bef(3)(-)-Bound Chey In Complex With Chez(200-214) Solved From A F432 Crystal Grown In Caps (Ph" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 35 no PDB 2FLK . "Crystal Structure Of Chey In Complex With Chez(200-214) Solved From A F432 Crystal Grown In Caps (Ph 10.5)" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 36 no PDB 2FLW . "Crystal Structure Of Mg2+ And Bef3- Ound Chey In Complex With Chez 200-214 Solved From A F432 Crystal Grown In Hepes (ph 7.5)" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 37 no PDB 2FMF . "Crystal Structure Of Chey In Complex With Chez 200-214 Solved From A F432 Crystal Grown In Hepes (ph 7.5)" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 38 no PDB 2FMH . "Crystal Structure Of Mg2+ And Bef3- Bound Chey In Complex With Chez 200-214 Solved From A F432 Crystal Grown In Tris (Ph 8.4)" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 39 no PDB 2FMI . "Crystal Structure Of Chey In Complex With Chez 200-214 Solved From A F432 Crystal Grown In Tris (Ph 8.4)" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 40 no PDB 2FMK . "Crystal Structure Of Mg2+ And Bef3- Bound Chey In Complex With Chez 200-214 Solved From A P2(1)2(1)2 Crystal Grown In Mes (Ph 6" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 41 no PDB 2ID7 . "1.75 A Structure Of T87i Phosphono-Chey" . . . . . 100.00 128 98.44 98.44 8.89e-83 . . . . 4083 1 42 no PDB 2ID9 . "1.85 A Structure Of T87i/y106w Phosphono-chey" . . . . . 100.00 128 97.66 98.44 7.00e-82 . . . . 4083 1 43 no PDB 2IDM . "2.00 A Structure Of T87iY106W PHOSPHONO-Chey" . . . . . 100.00 128 97.66 98.44 7.00e-82 . . . . 4083 1 44 no PDB 2LP4 . "Solution Structure Of P1-CheyP2 COMPLEX IN BACTERIAL CHEMOTAXIS" . . . . . 100.00 128 100.00 100.00 1.27e-84 . . . . 4083 1 45 no PDB 2PL9 . "Crystal Structure Of Chey-mg(2+)-bef(3)(-) In Complex With Chez(c19) Peptide Solved From A P2(1)2(1)2 Crystal" . . . . . 100.00 128 97.66 99.22 5.32e-83 . . . . 4083 1 46 no PDB 2PMC . "Crystal Structure Of Chey-mg(2+) In Complex With Chez(c15) Peptide Solved From A P1 Crystal" . . . . . 100.00 128 97.66 99.22 5.32e-83 . . . . 4083 1 47 no PDB 3CHY . "Crystal Structure Of Escherichia Coli Chey Refined At 1.7- Angstrom Resolution" . . . . . 100.00 128 100.00 100.00 1.27e-84 . . . . 4083 1 48 no PDB 3F7N . "Crystal Structure Of Chey Triple Mutant F14e, N59m, E89l Complexed With Bef3- And Mn2+" . . . . . 100.00 128 97.66 97.66 7.90e-81 . . . . 4083 1 49 no PDB 3FFT . "Crystal Structure Of Chey Double Mutant F14e, E89r Complexed With Bef3- And Mn2+" . . . . . 100.00 128 98.44 98.44 1.83e-82 . . . . 4083 1 50 no PDB 3FFW . "Crystal Structure Of Chey Triple Mutant F14q, N59k, E89y Complexed With Bef3- And Mn2+" . . . . . 100.00 128 97.66 97.66 1.89e-81 . . . . 4083 1 51 no PDB 3FFX . "Crystal Structure Of Chey Triple Mutant F14e, N59r, E89h Complexed With Bef3- And Mn2+" . . . . . 100.00 128 97.66 97.66 6.85e-82 . . . . 4083 1 52 no PDB 3FGZ . "Crystal Structure Of Chey Triple Mutant F14e, N59m, E89r Complexed With Bef3- And Mn2+" . . . . . 100.00 128 97.66 97.66 2.77e-81 . . . . 4083 1 53 no PDB 3MYY . "Structure Of E. Coli Chey Mutant A113p Bound To Beryllium Fluoride" . . . . . 100.00 128 99.22 99.22 6.40e-84 . . . . 4083 1 54 no PDB 3OLV . "Structural And Functional Effects Of Substitution At Position T+1 In Chey: Cheya88v-Bef3-Mg Complex" . . . . . 100.00 129 99.22 99.22 3.51e-84 . . . . 4083 1 55 no PDB 3OLW . "Structural And Functional Effects Of Substitution At Position T+1 In Chey: Cheya88t-Bef3-Mn Complex" . . . . . 100.00 129 99.22 99.22 3.05e-84 . . . . 4083 1 56 no PDB 3OLX . "Structural And Functional Effects Of Substitution At Position T+1 In Chey: Cheya88s-Bef3-Mn Complex" . . . . . 100.00 129 99.22 100.00 2.13e-84 . . . . 4083 1 57 no PDB 3OLY . "Structural And Functional Effects Of Substitution At Position T+1 In Chey: Cheya88m-Bef3-Mn Complex" . . . . . 100.00 129 99.22 99.22 4.66e-84 . . . . 4083 1 58 no PDB 3OO0 . "Structure Of Apo Chey A113p" . . . . . 100.00 129 99.22 99.22 5.68e-84 . . . . 4083 1 59 no PDB 3OO1 . "Structure Of E. Coli Chey Mutant A113p In The Absence Of Sulfate" . . . . . 100.00 129 99.22 99.22 5.68e-84 . . . . 4083 1 60 no PDB 3RVJ . "Structure Of The Chey-Bef3 Complex With Substitutions At 59 And 89: N59d And E89q" . . . . . 100.00 132 98.44 100.00 8.41e-84 . . . . 4083 1 61 no PDB 3RVK . "Structure Of The Chey-Mn2+ Complex With Substitutions At 59 And 89: N59d E89q" . . . . . 100.00 132 98.44 100.00 8.41e-84 . . . . 4083 1 62 no PDB 3RVL . "Structure Of The Chey-Bef3 Complex With Substitutions At 59 And 89: N59d And E89r" . . . . . 100.00 132 98.44 99.22 1.91e-83 . . . . 4083 1 63 no PDB 3RVM . "Structure Of The Chey-Mn2+ Complex With Substitutions At 59 And 89: N59d And E89r" . . . . . 100.00 132 98.44 99.22 1.91e-83 . . . . 4083 1 64 no PDB 3RVN . "Structure Of The Chey-Bef3 Complex With Substitutions At 59 And 89: N59d And E89y" . . . . . 100.00 132 98.44 99.22 3.25e-83 . . . . 4083 1 65 no PDB 3RVO . "Structure Of Chey-Mn2+ Complex With Substitutions At 59 And 89: N59d E89y" . . . . . 100.00 132 98.44 99.22 3.25e-83 . . . . 4083 1 66 no PDB 3RVP . "Structure Of The Chey-Bef3 Complex With Substitutions At 59 And 89: N59d And E89k" . . . . . 100.00 132 98.44 100.00 1.53e-83 . . . . 4083 1 67 no PDB 3RVQ . "Structure Of The Chey-Mn2+ Complex With Substitutions At 59 And 89: N59d E89k" . . . . . 100.00 132 98.44 100.00 1.53e-83 . . . . 4083 1 68 no PDB 3RVR . "Structure Of The Cheyn59dE89R MOLYBDATE COMPLEX" . . . . . 100.00 132 98.44 99.22 1.91e-83 . . . . 4083 1 69 no PDB 3RVS . "Structure Of The Cheyn59dE89R TUNGSTATE COMPLEX" . . . . . 100.00 132 98.44 99.22 1.91e-83 . . . . 4083 1 70 no PDB 5CHY . "Structure Of Chemotaxis Protein Chey" . . . . . 100.00 128 99.22 100.00 6.69e-84 . . . . 4083 1 71 no PDB 6CHY . "Structure Of Chemotaxis Protein Chey" . . . . . 100.00 128 98.44 99.22 5.68e-83 . . . . 4083 1 72 no DBJ BAA15698 . "chemotaxis regulator transmitting signal to flagellar motor component [Escherichia coli str. K12 substr. W3110]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 73 no DBJ BAB36015 . "chemotaxis protein CheY [Escherichia coli O157:H7 str. Sakai]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 74 no DBJ BAG77641 . "chemotactic response regulator CheY [Escherichia coli SE11]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 75 no DBJ BAI25973 . "chemotaxis regulator CheY, transmitting signal to flagellar motor component [Escherichia coli O26:H11 str. 11368]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 76 no DBJ BAI30936 . "chemotaxis regulator CheY, transmitting signal to flagellar motor component [Escherichia coli O103:H2 str. 12009]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 77 no EMBL CAD05667 . "chemotaxis protein CheY [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 78 no EMBL CAP76371 . "chemotaxis protein cheY [Escherichia coli LF82]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 79 no EMBL CAQ32359 . "chemotaxis regulator transmitting signal to flagellar motor component [Escherichia coli BL21(DE3)]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 80 no EMBL CAQ98822 . "chemotaxis regulator transmitting signal to flagellar motor component [Escherichia coli IAI1]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 81 no EMBL CAR03242 . "chemotaxis regulator transmitting signal to flagellar motor component [Escherichia coli S88]" . . . . . 100.00 129 99.22 100.00 2.40e-84 . . . . 4083 1 82 no GB AAA23570 . "cheY protein [Escherichia coli]" . . . . . 100.00 129 99.22 99.22 5.68e-84 . . . . 4083 1 83 no GB AAA23577 . "CheY [Escherichia coli]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 84 no GB AAA27037 . "CheY [Salmonella enterica subsp. enterica serovar Typhimurium]" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 85 no GB AAC74952 . "chemotaxis regulator transmitting signal to flagellar motor component [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 86 no GB AAG56872 . "chemotaxis regulator transmits chemoreceptor signals to flagelllar motor components [Escherichia coli O157:H7 str. EDL933]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 87 no PIR AH0745 . "chemotaxis protein CheY [imported] - Salmonella enterica subsp. enterica serovar Typhi (strain CT18)" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 88 no REF NP_310619 . "chemotaxis regulatory protein CheY [Escherichia coli O157:H7 str. Sakai]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 89 no REF NP_416396 . "chemotaxis regulator transmitting signal to flagellar motor component [Escherichia coli str. K-12 substr. MG1655]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 90 no REF NP_456482 . "chemotaxis protein CheY [Salmonella enterica subsp. enterica serovar Typhi str. CT18]" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 91 no REF NP_460873 . "chemotaxis regulatory protein CheY [Salmonella enterica subsp. enterica serovar Typhimurium str. LT2]" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 92 no REF NP_707777 . "chemotaxis regulatory protein CheY [Shigella flexneri 2a str. 301]" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 93 no SP P0A2D5 . "RecName: Full=Chemotaxis protein CheY" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 94 no SP P0A2D6 . "RecName: Full=Chemotaxis protein CheY" . . . . . 100.00 129 97.66 99.22 3.29e-83 . . . . 4083 1 95 no SP P0AE67 . "RecName: Full=Chemotaxis protein CheY" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 96 no SP P0AE68 . "RecName: Full=Chemotaxis protein CheY" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 97 no SP P0AE69 . "RecName: Full=Chemotaxis protein CheY" . . . . . 100.00 129 100.00 100.00 7.62e-85 . . . . 4083 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID CheY abbreviation 4083 1 'E. coli CheY' common 4083 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 . 4083 1 2 3 ASP . 4083 1 3 4 LYS . 4083 1 4 5 GLU . 4083 1 5 6 LEU . 4083 1 6 7 LYS . 4083 1 7 8 PHE . 4083 1 8 9 LEU . 4083 1 9 10 VAL . 4083 1 10 11 VAL . 4083 1 11 12 ASP . 4083 1 12 13 ASP . 4083 1 13 14 PHE . 4083 1 14 15 SER . 4083 1 15 16 THR . 4083 1 16 17 MET . 4083 1 17 18 ARG . 4083 1 18 19 ARG . 4083 1 19 20 ILE . 4083 1 20 21 VAL . 4083 1 21 22 ARG . 4083 1 22 23 ASN . 4083 1 23 24 LEU . 4083 1 24 25 LEU . 4083 1 25 26 LYS . 4083 1 26 27 GLU . 4083 1 27 28 LEU . 4083 1 28 29 GLY . 4083 1 29 30 PHE . 4083 1 30 31 ASN . 4083 1 31 32 ASN . 4083 1 32 33 VAL . 4083 1 33 34 GLU . 4083 1 34 35 GLU . 4083 1 35 36 ALA . 4083 1 36 37 GLU . 4083 1 37 38 ASP . 4083 1 38 39 GLY . 4083 1 39 40 VAL . 4083 1 40 41 ASP . 4083 1 41 42 ALA . 4083 1 42 43 LEU . 4083 1 43 44 ASN . 4083 1 44 45 LYS . 4083 1 45 46 LEU . 4083 1 46 47 GLN . 4083 1 47 48 ALA . 4083 1 48 49 GLY . 4083 1 49 50 GLY . 4083 1 50 51 TYR . 4083 1 51 52 GLY . 4083 1 52 53 PHE . 4083 1 53 54 VAL . 4083 1 54 55 ILE . 4083 1 55 56 SER . 4083 1 56 57 ASP . 4083 1 57 58 TRP . 4083 1 58 59 ASN . 4083 1 59 60 MET . 4083 1 60 61 PRO . 4083 1 61 62 ASN . 4083 1 62 63 MET . 4083 1 63 64 ASP . 4083 1 64 65 GLY . 4083 1 65 66 LEU . 4083 1 66 67 GLU . 4083 1 67 68 LEU . 4083 1 68 69 LEU . 4083 1 69 70 LYS . 4083 1 70 71 THR . 4083 1 71 72 ILE . 4083 1 72 73 ARG . 4083 1 73 74 ALA . 4083 1 74 75 ASP . 4083 1 75 76 GLY . 4083 1 76 77 ALA . 4083 1 77 78 MET . 4083 1 78 79 SER . 4083 1 79 80 ALA . 4083 1 80 81 LEU . 4083 1 81 82 PRO . 4083 1 82 83 VAL . 4083 1 83 84 LEU . 4083 1 84 85 MET . 4083 1 85 86 VAL . 4083 1 86 87 THR . 4083 1 87 88 ALA . 4083 1 88 89 GLU . 4083 1 89 90 ALA . 4083 1 90 91 LYS . 4083 1 91 92 LYS . 4083 1 92 93 GLU . 4083 1 93 94 ASN . 4083 1 94 95 ILE . 4083 1 95 96 ILE . 4083 1 96 97 ALA . 4083 1 97 98 ALA . 4083 1 98 99 ALA . 4083 1 99 100 GLN . 4083 1 100 101 ALA . 4083 1 101 102 GLY . 4083 1 102 103 ALA . 4083 1 103 104 SER . 4083 1 104 105 GLY . 4083 1 105 106 TYR . 4083 1 106 107 VAL . 4083 1 107 108 VAL . 4083 1 108 109 LYS . 4083 1 109 110 PRO . 4083 1 110 111 PHE . 4083 1 111 112 THR . 4083 1 112 113 ALA . 4083 1 113 114 ALA . 4083 1 114 115 THR . 4083 1 115 116 LEU . 4083 1 116 117 GLU . 4083 1 117 118 GLU . 4083 1 118 119 LYS . 4083 1 119 120 LEU . 4083 1 120 121 ASN . 4083 1 121 122 LYS . 4083 1 122 123 ILE . 4083 1 123 124 PHE . 4083 1 124 125 GLU . 4083 1 125 126 LYS . 4083 1 126 127 LEU . 4083 1 127 128 GLY . 4083 1 128 129 MET . 4083 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 4083 1 . ASP 2 2 4083 1 . LYS 3 3 4083 1 . GLU 4 4 4083 1 . LEU 5 5 4083 1 . LYS 6 6 4083 1 . PHE 7 7 4083 1 . LEU 8 8 4083 1 . VAL 9 9 4083 1 . VAL 10 10 4083 1 . ASP 11 11 4083 1 . ASP 12 12 4083 1 . PHE 13 13 4083 1 . SER 14 14 4083 1 . THR 15 15 4083 1 . MET 16 16 4083 1 . ARG 17 17 4083 1 . ARG 18 18 4083 1 . ILE 19 19 4083 1 . VAL 20 20 4083 1 . ARG 21 21 4083 1 . ASN 22 22 4083 1 . LEU 23 23 4083 1 . LEU 24 24 4083 1 . LYS 25 25 4083 1 . GLU 26 26 4083 1 . LEU 27 27 4083 1 . GLY 28 28 4083 1 . PHE 29 29 4083 1 . ASN 30 30 4083 1 . ASN 31 31 4083 1 . VAL 32 32 4083 1 . GLU 33 33 4083 1 . GLU 34 34 4083 1 . ALA 35 35 4083 1 . GLU 36 36 4083 1 . ASP 37 37 4083 1 . GLY 38 38 4083 1 . VAL 39 39 4083 1 . ASP 40 40 4083 1 . ALA 41 41 4083 1 . LEU 42 42 4083 1 . ASN 43 43 4083 1 . LYS 44 44 4083 1 . LEU 45 45 4083 1 . GLN 46 46 4083 1 . ALA 47 47 4083 1 . GLY 48 48 4083 1 . GLY 49 49 4083 1 . TYR 50 50 4083 1 . GLY 51 51 4083 1 . PHE 52 52 4083 1 . VAL 53 53 4083 1 . ILE 54 54 4083 1 . SER 55 55 4083 1 . ASP 56 56 4083 1 . TRP 57 57 4083 1 . ASN 58 58 4083 1 . MET 59 59 4083 1 . PRO 60 60 4083 1 . ASN 61 61 4083 1 . MET 62 62 4083 1 . ASP 63 63 4083 1 . GLY 64 64 4083 1 . LEU 65 65 4083 1 . GLU 66 66 4083 1 . LEU 67 67 4083 1 . LEU 68 68 4083 1 . LYS 69 69 4083 1 . THR 70 70 4083 1 . ILE 71 71 4083 1 . ARG 72 72 4083 1 . ALA 73 73 4083 1 . ASP 74 74 4083 1 . GLY 75 75 4083 1 . ALA 76 76 4083 1 . MET 77 77 4083 1 . SER 78 78 4083 1 . ALA 79 79 4083 1 . LEU 80 80 4083 1 . PRO 81 81 4083 1 . VAL 82 82 4083 1 . LEU 83 83 4083 1 . MET 84 84 4083 1 . VAL 85 85 4083 1 . THR 86 86 4083 1 . ALA 87 87 4083 1 . GLU 88 88 4083 1 . ALA 89 89 4083 1 . LYS 90 90 4083 1 . LYS 91 91 4083 1 . GLU 92 92 4083 1 . ASN 93 93 4083 1 . ILE 94 94 4083 1 . ILE 95 95 4083 1 . ALA 96 96 4083 1 . ALA 97 97 4083 1 . ALA 98 98 4083 1 . GLN 99 99 4083 1 . ALA 100 100 4083 1 . GLY 101 101 4083 1 . ALA 102 102 4083 1 . SER 103 103 4083 1 . GLY 104 104 4083 1 . TYR 105 105 4083 1 . VAL 106 106 4083 1 . VAL 107 107 4083 1 . LYS 108 108 4083 1 . PRO 109 109 4083 1 . PHE 110 110 4083 1 . THR 111 111 4083 1 . ALA 112 112 4083 1 . ALA 113 113 4083 1 . THR 114 114 4083 1 . LEU 115 115 4083 1 . GLU 116 116 4083 1 . GLU 117 117 4083 1 . LYS 118 118 4083 1 . LEU 119 119 4083 1 . ASN 120 120 4083 1 . LYS 121 121 4083 1 . ILE 122 122 4083 1 . PHE 123 123 4083 1 . GLU 124 124 4083 1 . LYS 125 125 4083 1 . LEU 126 126 4083 1 . GLY 127 127 4083 1 . MET 128 128 4083 1 stop_ save_ save_MG _Entity.Sf_category entity _Entity.Sf_framecode MG _Entity.Entry_ID 4083 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name MG _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID MG _Entity.Nonpolymer_comp_label $chem_comp_MG _Entity.Number_of_monomers . _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 . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 . MG . 4083 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 4083 _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 $CheY . 562 organism . 'Escherichia coli' 'E. coli' . . Eubacteria . Escherichia coli . . . . . . . . . . . . . . . . . . . . . 4083 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 4083 _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 $CheY . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli . . . . . . . . . . . . . . . . . . . . . . . 4083 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_MG _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_MG _Chem_comp.Entry_ID 4083 _Chem_comp.ID MG _Chem_comp.Provenance . _Chem_comp.Name 'MAGNESIUM ION' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code MG _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2011-06-04 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code MG _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Mg _Chem_comp.Formula_weight 24.305 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site PDBJ _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Thu Jun 23 09:23:39 2011 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID InChI=1S/Mg/q+2 InChI InChI 1.03 4083 MG JLVVSXFLKOJNIY-UHFFFAOYSA-N InChIKey InChI 1.03 4083 MG [Mg++] SMILES CACTVS 3.341 4083 MG [Mg++] SMILES_CANONICAL CACTVS 3.341 4083 MG [Mg+2] SMILES ACDLabs 10.04 4083 MG [Mg+2] SMILES 'OpenEye OEToolkits' 1.5.0 4083 MG [Mg+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 4083 MG stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID magnesium 'SYSTEMATIC NAME' ACDLabs 10.04 4083 MG 'magnesium(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 4083 MG stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID MG . MG . . MG . . N 2 . . . . no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 4083 MG stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_one _Sample.Sf_category sample _Sample.Sf_framecode sample_one _Sample.Entry_ID 4083 _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 'E. coli CheY' [U-15N] . . 1 $CheY . . . 1.0 4.0 mM . . . . 4083 1 2 'sodium phosphate' . . . . . . . 100 . . mM . . . . 4083 1 3 'magnesium chloride' . . . . . . . . 4 5 mM . . . . 4083 1 4 'sodium azide' . . . . . . . 0.02 . . % . . . . 4083 1 5 D2O . . . . . . . 10 . . % . . . . 4083 1 6 H2O . . . . . . . 90 . . % . . . . 4083 1 stop_ save_ save_sample_two _Sample.Sf_category sample _Sample.Sf_framecode sample_two _Sample.Entry_ID 4083 _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 'E. coli CheY' '[U-13C; U-15N]' . . 1 $CheY . . . 1.0 4.0 mM . . . . 4083 2 2 'sodium phosphate' . . . . . . . 100 . . mM . . . . 4083 2 3 'magnesium chloride' . . . . . . . . 4 5 mM . . . . 4083 2 4 'sodium azide' . . . . . . . 0.02 . . % . . . . 4083 2 5 D2O . . . . . . . 10 . . % . . . . 4083 2 6 H2O . . . . . . . 90 . . % . . . . 4083 2 stop_ save_ save_sample_three _Sample.Sf_category sample _Sample.Sf_framecode sample_three _Sample.Entry_ID 4083 _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 'E. coli CheY' '[U-13C; U-15N]' . . 1 $CheY . . . 1.0 4.0 mM . . . . 4083 3 2 'sodium phosphate' . . . . . . . 100 . . mM . . . . 4083 3 3 'magnesium chloride' . . . . . . . . 4 5 mM . . . . 4083 3 4 'sodium azide' . . . . . . . 0.02 . . % . . . . 4083 3 5 D2O . . . . . . . 99.8 . . % . . . . 4083 3 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions _Sample_condition_list.Entry_ID 4083 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.75 0.05 n/a 4083 1 temperature 303 . K 4083 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_one _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_one _NMR_spectrometer.Entry_ID 4083 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AMX _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 4083 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_one Bruker AMX . 600 . . . 4083 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 4083 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 . . . . . . . . . . . . . . . . . 1 $sample_conditions . . . 1 $NMR_spectrometer_one . . . . . . . . . . . . . . . . 4083 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference _Chem_shift_reference.Entry_ID 4083 _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 carbons' . . . . ppm 0.00 external . . . . . 1 $entry_citation . . 1 $entry_citation 4083 1 H 1 TSP 'methyl protons' . . . . ppm 0.00 external . . . . . 1 $entry_citation . . 1 $entry_citation 4083 1 N 15 'liquid ammonia' nitrogen . . . . ppm 0.00 external . . . . . 1 $entry_citation . . 1 $entry_citation 4083 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_chemical_shift_assignment _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_assignment _Assigned_chem_shift_list.Entry_ID 4083 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_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 . . 3 $sample_three . 4083 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ALA HA H 1 3.90 . . 1 . . . . . . . . 4083 1 2 . 1 1 1 1 ALA HB1 H 1 0.81 . . 1 . . . . . . . . 4083 1 3 . 1 1 1 1 ALA HB2 H 1 0.81 . . 1 . . . . . . . . 4083 1 4 . 1 1 1 1 ALA HB3 H 1 0.81 . . 1 . . . . . . . . 4083 1 5 . 1 1 1 1 ALA CA C 13 50.9 . . 1 . . . . . . . . 4083 1 6 . 1 1 1 1 ALA CB C 13 18.5 . . 1 . . . . . . . . 4083 1 7 . 1 1 2 2 ASP HA H 1 4.49 . . 1 . . . . . . . . 4083 1 8 . 1 1 2 2 ASP HB2 H 1 2.73 . . 2 . . . . . . . . 4083 1 9 . 1 1 2 2 ASP HB3 H 1 2.64 . . 2 . . . . . . . . 4083 1 10 . 1 1 2 2 ASP CA C 13 53.7 . . 1 . . . . . . . . 4083 1 11 . 1 1 2 2 ASP CB C 13 41.6 . . 1 . . . . . . . . 4083 1 12 . 1 1 3 3 LYS H H 1 8.48 . . 1 . . . . . . . . 4083 1 13 . 1 1 3 3 LYS HA H 1 4.26 . . 1 . . . . . . . . 4083 1 14 . 1 1 3 3 LYS HB2 H 1 1.98 . . 2 . . . . . . . . 4083 1 15 . 1 1 3 3 LYS HB3 H 1 1.77 . . 2 . . . . . . . . 4083 1 16 . 1 1 3 3 LYS HG2 H 1 1.38 . . 2 . . . . . . . . 4083 1 17 . 1 1 3 3 LYS HG3 H 1 1.27 . . 2 . . . . . . . . 4083 1 18 . 1 1 3 3 LYS HD2 H 1 1.19 . . 2 . . . . . . . . 4083 1 19 . 1 1 3 3 LYS HD3 H 1 1.15 . . 2 . . . . . . . . 4083 1 20 . 1 1 3 3 LYS HE2 H 1 2.78 . . 1 . . . . . . . . 4083 1 21 . 1 1 3 3 LYS HE3 H 1 2.78 . . 1 . . . . . . . . 4083 1 22 . 1 1 3 3 LYS CA C 13 57.0 . . 1 . . . . . . . . 4083 1 23 . 1 1 3 3 LYS CB C 13 30.5 . . 1 . . . . . . . . 4083 1 24 . 1 1 3 3 LYS CG C 13 24.5 . . 1 . . . . . . . . 4083 1 25 . 1 1 3 3 LYS CD C 13 27.8 . . 1 . . . . . . . . 4083 1 26 . 1 1 3 3 LYS CE C 13 42.0 . . 1 . . . . . . . . 4083 1 27 . 1 1 3 3 LYS N N 15 120.8 . . 1 . . . . . . . . 4083 1 28 . 1 1 4 4 GLU H H 1 8.68 . . 1 . . . . . . . . 4083 1 29 . 1 1 4 4 GLU HA H 1 4.48 . . 1 . . . . . . . . 4083 1 30 . 1 1 4 4 GLU HB2 H 1 2.27 . . 2 . . . . . . . . 4083 1 31 . 1 1 4 4 GLU HB3 H 1 1.97 . . 2 . . . . . . . . 4083 1 32 . 1 1 4 4 GLU HG2 H 1 2.35 . . 1 . . . . . . . . 4083 1 33 . 1 1 4 4 GLU HG3 H 1 2.35 . . 1 . . . . . . . . 4083 1 34 . 1 1 4 4 GLU CA C 13 55.7 . . 1 . . . . . . . . 4083 1 35 . 1 1 4 4 GLU CB C 13 29.0 . . 1 . . . . . . . . 4083 1 36 . 1 1 4 4 GLU CG C 13 36.3 . . 1 . . . . . . . . 4083 1 37 . 1 1 4 4 GLU N N 15 117.9 . . 1 . . . . . . . . 4083 1 38 . 1 1 5 5 LEU H H 1 7.51 . . 1 . . . . . . . . 4083 1 39 . 1 1 5 5 LEU HA H 1 3.84 . . 1 . . . . . . . . 4083 1 40 . 1 1 5 5 LEU HB2 H 1 1.80 . . 2 . . . . . . . . 4083 1 41 . 1 1 5 5 LEU HB3 H 1 1.63 . . 2 . . . . . . . . 4083 1 42 . 1 1 5 5 LEU HG H 1 1.21 . . 1 . . . . . . . . 4083 1 43 . 1 1 5 5 LEU HD11 H 1 0.81 . . 2 . . . . . . . . 4083 1 44 . 1 1 5 5 LEU HD12 H 1 0.81 . . 2 . . . . . . . . 4083 1 45 . 1 1 5 5 LEU HD13 H 1 0.81 . . 2 . . . . . . . . 4083 1 46 . 1 1 5 5 LEU HD21 H 1 0.65 . . 2 . . . . . . . . 4083 1 47 . 1 1 5 5 LEU HD22 H 1 0.65 . . 2 . . . . . . . . 4083 1 48 . 1 1 5 5 LEU HD23 H 1 0.65 . . 2 . . . . . . . . 4083 1 49 . 1 1 5 5 LEU CA C 13 56.4 . . 1 . . . . . . . . 4083 1 50 . 1 1 5 5 LEU CB C 13 43.1 . . 1 . . . . . . . . 4083 1 51 . 1 1 5 5 LEU CG C 13 26.2 . . 1 . . . . . . . . 4083 1 52 . 1 1 5 5 LEU CD1 C 13 25.0 . . 2 . . . . . . . . 4083 1 53 . 1 1 5 5 LEU CD2 C 13 26.5 . . 2 . . . . . . . . 4083 1 54 . 1 1 5 5 LEU N N 15 122.7 . . 1 . . . . . . . . 4083 1 55 . 1 1 6 6 LYS H H 1 8.47 . . 1 . . . . . . . . 4083 1 56 . 1 1 6 6 LYS HA H 1 5.10 . . 1 . . . . . . . . 4083 1 57 . 1 1 6 6 LYS HB2 H 1 1.88 . . 2 . . . . . . . . 4083 1 58 . 1 1 6 6 LYS HB3 H 1 1.50 . . 2 . . . . . . . . 4083 1 59 . 1 1 6 6 LYS HG2 H 1 1.13 . . 1 . . . . . . . . 4083 1 60 . 1 1 6 6 LYS HG3 H 1 1.13 . . 1 . . . . . . . . 4083 1 61 . 1 1 6 6 LYS HD2 H 1 1.16 . . 2 . . . . . . . . 4083 1 62 . 1 1 6 6 LYS HD3 H 1 0.83 . . 2 . . . . . . . . 4083 1 63 . 1 1 6 6 LYS HE2 H 1 2.47 . . 2 . . . . . . . . 4083 1 64 . 1 1 6 6 LYS HE3 H 1 2.22 . . 2 . . . . . . . . 4083 1 65 . 1 1 6 6 LYS CA C 13 56.1 . . 1 . . . . . . . . 4083 1 66 . 1 1 6 6 LYS CB C 13 33.5 . . 1 . . . . . . . . 4083 1 67 . 1 1 6 6 LYS CD C 13 29.1 . . 1 . . . . . . . . 4083 1 68 . 1 1 6 6 LYS CE C 13 41.2 . . 1 . . . . . . . . 4083 1 69 . 1 1 6 6 LYS N N 15 124.7 . . 1 . . . . . . . . 4083 1 70 . 1 1 7 7 PHE H H 1 9.20 . . 1 . . . . . . . . 4083 1 71 . 1 1 7 7 PHE HA H 1 5.41 . . 1 . . . . . . . . 4083 1 72 . 1 1 7 7 PHE HB2 H 1 3.21 . . 2 . . . . . . . . 4083 1 73 . 1 1 7 7 PHE HB3 H 1 2.54 . . 2 . . . . . . . . 4083 1 74 . 1 1 7 7 PHE HD1 H 1 7.02 . . 1 . . . . . . . . 4083 1 75 . 1 1 7 7 PHE HD2 H 1 7.02 . . 1 . . . . . . . . 4083 1 76 . 1 1 7 7 PHE HE1 H 1 6.21 . . 1 . . . . . . . . 4083 1 77 . 1 1 7 7 PHE HE2 H 1 6.21 . . 1 . . . . . . . . 4083 1 78 . 1 1 7 7 PHE HZ H 1 5.66 . . 1 . . . . . . . . 4083 1 79 . 1 1 7 7 PHE CA C 13 57.1 . . 1 . . . . . . . . 4083 1 80 . 1 1 7 7 PHE CB C 13 43.4 . . 1 . . . . . . . . 4083 1 81 . 1 1 7 7 PHE CD1 C 13 130.9 . . 1 . . . . . . . . 4083 1 82 . 1 1 7 7 PHE CD2 C 13 130.9 . . 1 . . . . . . . . 4083 1 83 . 1 1 7 7 PHE CE1 C 13 131.2 . . 1 . . . . . . . . 4083 1 84 . 1 1 7 7 PHE CE2 C 13 131.2 . . 1 . . . . . . . . 4083 1 85 . 1 1 7 7 PHE CZ C 13 128.0 . . 1 . . . . . . . . 4083 1 86 . 1 1 7 7 PHE N N 15 127.2 . . 1 . . . . . . . . 4083 1 87 . 1 1 8 8 LEU H H 1 8.78 . . 1 . . . . . . . . 4083 1 88 . 1 1 8 8 LEU HA H 1 5.13 . . 1 . . . . . . . . 4083 1 89 . 1 1 8 8 LEU HB2 H 1 1.70 . . 2 . . . . . . . . 4083 1 90 . 1 1 8 8 LEU HB3 H 1 1.09 . . 2 . . . . . . . . 4083 1 91 . 1 1 8 8 LEU HG H 1 1.16 . . 1 . . . . . . . . 4083 1 92 . 1 1 8 8 LEU HD11 H 1 0.56 . . 2 . . . . . . . . 4083 1 93 . 1 1 8 8 LEU HD12 H 1 0.56 . . 2 . . . . . . . . 4083 1 94 . 1 1 8 8 LEU HD13 H 1 0.56 . . 2 . . . . . . . . 4083 1 95 . 1 1 8 8 LEU HD21 H 1 0.38 . . 2 . . . . . . . . 4083 1 96 . 1 1 8 8 LEU HD22 H 1 0.38 . . 2 . . . . . . . . 4083 1 97 . 1 1 8 8 LEU HD23 H 1 0.38 . . 2 . . . . . . . . 4083 1 98 . 1 1 8 8 LEU CA C 13 52.9 . . 1 . . . . . . . . 4083 1 99 . 1 1 8 8 LEU CB C 13 43.9 . . 1 . . . . . . . . 4083 1 100 . 1 1 8 8 LEU CD1 C 13 22.7 . . 2 . . . . . . . . 4083 1 101 . 1 1 8 8 LEU CD2 C 13 27.1 . . 2 . . . . . . . . 4083 1 102 . 1 1 8 8 LEU N N 15 120.5 . . 1 . . . . . . . . 4083 1 103 . 1 1 9 9 VAL H H 1 9.04 . . 1 . . . . . . . . 4083 1 104 . 1 1 9 9 VAL HA H 1 4.80 . . 1 . . . . . . . . 4083 1 105 . 1 1 9 9 VAL HB H 1 1.99 . . 1 . . . . . . . . 4083 1 106 . 1 1 9 9 VAL HG11 H 1 0.99 . . 1 . . . . . . . . 4083 1 107 . 1 1 9 9 VAL HG12 H 1 0.99 . . 1 . . . . . . . . 4083 1 108 . 1 1 9 9 VAL HG13 H 1 0.99 . . 1 . . . . . . . . 4083 1 109 . 1 1 9 9 VAL HG21 H 1 0.99 . . 1 . . . . . . . . 4083 1 110 . 1 1 9 9 VAL HG22 H 1 0.99 . . 1 . . . . . . . . 4083 1 111 . 1 1 9 9 VAL HG23 H 1 0.99 . . 1 . . . . . . . . 4083 1 112 . 1 1 9 9 VAL CA C 13 61.4 . . 1 . . . . . . . . 4083 1 113 . 1 1 9 9 VAL CB C 13 33.0 . . 1 . . . . . . . . 4083 1 114 . 1 1 9 9 VAL CG1 C 13 21.1 . . 1 . . . . . . . . 4083 1 115 . 1 1 9 9 VAL CG2 C 13 21.1 . . 1 . . . . . . . . 4083 1 116 . 1 1 9 9 VAL N N 15 126.1 . . 1 . . . . . . . . 4083 1 117 . 1 1 10 10 VAL H H 1 9.21 . . 1 . . . . . . . . 4083 1 118 . 1 1 10 10 VAL HA H 1 4.82 . . 1 . . . . . . . . 4083 1 119 . 1 1 10 10 VAL HB H 1 2.27 . . 1 . . . . . . . . 4083 1 120 . 1 1 10 10 VAL HG11 H 1 0.65 . . 2 . . . . . . . . 4083 1 121 . 1 1 10 10 VAL HG12 H 1 0.65 . . 2 . . . . . . . . 4083 1 122 . 1 1 10 10 VAL HG13 H 1 0.65 . . 2 . . . . . . . . 4083 1 123 . 1 1 10 10 VAL HG21 H 1 0.68 . . 2 . . . . . . . . 4083 1 124 . 1 1 10 10 VAL HG22 H 1 0.68 . . 2 . . . . . . . . 4083 1 125 . 1 1 10 10 VAL HG23 H 1 0.68 . . 2 . . . . . . . . 4083 1 126 . 1 1 10 10 VAL CA C 13 59.7 . . 1 . . . . . . . . 4083 1 127 . 1 1 10 10 VAL CB C 13 32.6 . . 1 . . . . . . . . 4083 1 128 . 1 1 10 10 VAL CG1 C 13 21.4 . . 2 . . . . . . . . 4083 1 129 . 1 1 10 10 VAL CG2 C 13 21.3 . . 2 . . . . . . . . 4083 1 130 . 1 1 10 10 VAL N N 15 126.2 . . 1 . . . . . . . . 4083 1 131 . 1 1 11 11 ASP H H 1 8.11 . . 1 . . . . . . . . 4083 1 132 . 1 1 11 11 ASP HA H 1 4.65 . . 1 . . . . . . . . 4083 1 133 . 1 1 11 11 ASP HB2 H 1 2.74 . . 2 . . . . . . . . 4083 1 134 . 1 1 11 11 ASP HB3 H 1 2.53 . . 2 . . . . . . . . 4083 1 135 . 1 1 11 11 ASP CA C 13 55.4 . . 1 . . . . . . . . 4083 1 136 . 1 1 11 11 ASP CB C 13 43.6 . . 1 . . . . . . . . 4083 1 137 . 1 1 11 11 ASP N N 15 123.4 . . 1 . . . . . . . . 4083 1 138 . 1 1 12 12 ASP H H 1 9.38 . . 1 . . . . . . . . 4083 1 139 . 1 1 12 12 ASP HA H 1 5.08 . . 1 . . . . . . . . 4083 1 140 . 1 1 12 12 ASP HB2 H 1 2.98 . . 2 . . . . . . . . 4083 1 141 . 1 1 12 12 ASP HB3 H 1 2.80 . . 2 . . . . . . . . 4083 1 142 . 1 1 12 12 ASP CA C 13 55.0 . . 1 . . . . . . . . 4083 1 143 . 1 1 12 12 ASP CB C 13 40.1 . . 1 . . . . . . . . 4083 1 144 . 1 1 12 12 ASP N N 15 122.9 . . 1 . . . . . . . . 4083 1 145 . 1 1 13 13 PHE HA H 1 5.26 . . 1 . . . . . . . . 4083 1 146 . 1 1 13 13 PHE HB2 H 1 3.22 . . 1 . . . . . . . . 4083 1 147 . 1 1 13 13 PHE HB3 H 1 3.22 . . 1 . . . . . . . . 4083 1 148 . 1 1 13 13 PHE HD1 H 1 7.42 . . 1 . . . . . . . . 4083 1 149 . 1 1 13 13 PHE HD2 H 1 7.42 . . 1 . . . . . . . . 4083 1 150 . 1 1 13 13 PHE HE1 H 1 7.36 . . 1 . . . . . . . . 4083 1 151 . 1 1 13 13 PHE HE2 H 1 7.36 . . 1 . . . . . . . . 4083 1 152 . 1 1 13 13 PHE HZ H 1 6.71 . . 1 . . . . . . . . 4083 1 153 . 1 1 13 13 PHE CA C 13 54.3 . . 1 . . . . . . . . 4083 1 154 . 1 1 13 13 PHE CB C 13 38.1 . . 1 . . . . . . . . 4083 1 155 . 1 1 13 13 PHE CD1 C 13 130.5 . . 1 . . . . . . . . 4083 1 156 . 1 1 13 13 PHE CD2 C 13 130.5 . . 1 . . . . . . . . 4083 1 157 . 1 1 13 13 PHE CE1 C 13 128.8 . . 1 . . . . . . . . 4083 1 158 . 1 1 13 13 PHE CE2 C 13 128.8 . . 1 . . . . . . . . 4083 1 159 . 1 1 13 13 PHE CZ C 13 128.5 . . 1 . . . . . . . . 4083 1 160 . 1 1 15 15 THR HA H 1 3.77 . . 1 . . . . . . . . 4083 1 161 . 1 1 15 15 THR HB H 1 3.23 . . 1 . . . . . . . . 4083 1 162 . 1 1 15 15 THR HG21 H 1 1.15 . . 1 . . . . . . . . 4083 1 163 . 1 1 15 15 THR HG22 H 1 1.15 . . 1 . . . . . . . . 4083 1 164 . 1 1 15 15 THR HG23 H 1 1.15 . . 1 . . . . . . . . 4083 1 165 . 1 1 15 15 THR CA C 13 65.4 . . 1 . . . . . . . . 4083 1 166 . 1 1 15 15 THR CB C 13 68.1 . . 1 . . . . . . . . 4083 1 167 . 1 1 15 15 THR CG2 C 13 21.5 . . 1 . . . . . . . . 4083 1 168 . 1 1 16 16 MET H H 1 6.49 . . 1 . . . . . . . . 4083 1 169 . 1 1 16 16 MET HA H 1 4.51 . . 1 . . . . . . . . 4083 1 170 . 1 1 16 16 MET HB2 H 1 2.18 . . 1 . . . . . . . . 4083 1 171 . 1 1 16 16 MET HB3 H 1 2.18 . . 1 . . . . . . . . 4083 1 172 . 1 1 16 16 MET HG2 H 1 2.76 . . 2 . . . . . . . . 4083 1 173 . 1 1 16 16 MET HG3 H 1 2.66 . . 2 . . . . . . . . 4083 1 174 . 1 1 16 16 MET CA C 13 55.9 . . 1 . . . . . . . . 4083 1 175 . 1 1 16 16 MET CB C 13 31.1 . . 1 . . . . . . . . 4083 1 176 . 1 1 16 16 MET CG C 13 32.6 . . 1 . . . . . . . . 4083 1 177 . 1 1 16 16 MET N N 15 117.8 . . 1 . . . . . . . . 4083 1 178 . 1 1 17 17 ARG H H 1 7.57 . . 1 . . . . . . . . 4083 1 179 . 1 1 17 17 ARG HA H 1 3.82 . . 1 . . . . . . . . 4083 1 180 . 1 1 17 17 ARG HB2 H 1 2.03 . . 2 . . . . . . . . 4083 1 181 . 1 1 17 17 ARG HB3 H 1 1.81 . . 2 . . . . . . . . 4083 1 182 . 1 1 17 17 ARG HG2 H 1 1.38 . . 2 . . . . . . . . 4083 1 183 . 1 1 17 17 ARG HG3 H 1 1.28 . . 2 . . . . . . . . 4083 1 184 . 1 1 17 17 ARG HD2 H 1 2.92 . . 1 . . . . . . . . 4083 1 185 . 1 1 17 17 ARG HD3 H 1 2.92 . . 1 . . . . . . . . 4083 1 186 . 1 1 17 17 ARG CA C 13 60.5 . . 1 . . . . . . . . 4083 1 187 . 1 1 17 17 ARG CB C 13 30.5 . . 1 . . . . . . . . 4083 1 188 . 1 1 17 17 ARG CG C 13 24.3 . . 1 . . . . . . . . 4083 1 189 . 1 1 17 17 ARG CD C 13 41.4 . . 1 . . . . . . . . 4083 1 190 . 1 1 17 17 ARG N N 15 115.8 . . 1 . . . . . . . . 4083 1 191 . 1 1 18 18 ARG H H 1 7.62 . . 1 . . . . . . . . 4083 1 192 . 1 1 18 18 ARG HA H 1 3.93 . . 1 . . . . . . . . 4083 1 193 . 1 1 18 18 ARG HB2 H 1 1.93 . . 1 . . . . . . . . 4083 1 194 . 1 1 18 18 ARG HB3 H 1 1.93 . . 1 . . . . . . . . 4083 1 195 . 1 1 18 18 ARG HG2 H 1 1.70 . . 2 . . . . . . . . 4083 1 196 . 1 1 18 18 ARG HG3 H 1 1.63 . . 2 . . . . . . . . 4083 1 197 . 1 1 18 18 ARG HD2 H 1 3.22 . . 2 . . . . . . . . 4083 1 198 . 1 1 18 18 ARG HD3 H 1 3.05 . . 2 . . . . . . . . 4083 1 199 . 1 1 18 18 ARG CA C 13 58.8 . . 1 . . . . . . . . 4083 1 200 . 1 1 18 18 ARG CB C 13 29.4 . . 1 . . . . . . . . 4083 1 201 . 1 1 18 18 ARG CG C 13 27.2 . . 1 . . . . . . . . 4083 1 202 . 1 1 18 18 ARG CD C 13 43.1 . . 1 . . . . . . . . 4083 1 203 . 1 1 18 18 ARG N N 15 115.6 . . 1 . . . . . . . . 4083 1 204 . 1 1 19 19 ILE H H 1 7.76 . . 1 . . . . . . . . 4083 1 205 . 1 1 19 19 ILE HA H 1 3.72 . . 1 . . . . . . . . 4083 1 206 . 1 1 19 19 ILE HB H 1 2.11 . . 1 . . . . . . . . 4083 1 207 . 1 1 19 19 ILE HG12 H 1 1.80 . . 2 . . . . . . . . 4083 1 208 . 1 1 19 19 ILE HG13 H 1 1.09 . . 2 . . . . . . . . 4083 1 209 . 1 1 19 19 ILE HG21 H 1 0.79 . . 1 . . . . . . . . 4083 1 210 . 1 1 19 19 ILE HG22 H 1 0.79 . . 1 . . . . . . . . 4083 1 211 . 1 1 19 19 ILE HG23 H 1 0.79 . . 1 . . . . . . . . 4083 1 212 . 1 1 19 19 ILE HD11 H 1 0.81 . . 1 . . . . . . . . 4083 1 213 . 1 1 19 19 ILE HD12 H 1 0.81 . . 1 . . . . . . . . 4083 1 214 . 1 1 19 19 ILE HD13 H 1 0.81 . . 1 . . . . . . . . 4083 1 215 . 1 1 19 19 ILE CA C 13 65.4 . . 1 . . . . . . . . 4083 1 216 . 1 1 19 19 ILE CB C 13 37.8 . . 1 . . . . . . . . 4083 1 217 . 1 1 19 19 ILE CG1 C 13 29.3 . . 1 . . . . . . . . 4083 1 218 . 1 1 19 19 ILE CG2 C 13 16.3 . . 1 . . . . . . . . 4083 1 219 . 1 1 19 19 ILE CD1 C 13 13.2 . . 1 . . . . . . . . 4083 1 220 . 1 1 19 19 ILE N N 15 119.0 . . 1 . . . . . . . . 4083 1 221 . 1 1 20 20 VAL H H 1 8.28 . . 1 . . . . . . . . 4083 1 222 . 1 1 20 20 VAL HA H 1 3.43 . . 1 . . . . . . . . 4083 1 223 . 1 1 20 20 VAL HB H 1 2.15 . . 1 . . . . . . . . 4083 1 224 . 1 1 20 20 VAL HG11 H 1 1.16 . . 2 . . . . . . . . 4083 1 225 . 1 1 20 20 VAL HG12 H 1 1.16 . . 2 . . . . . . . . 4083 1 226 . 1 1 20 20 VAL HG13 H 1 1.16 . . 2 . . . . . . . . 4083 1 227 . 1 1 20 20 VAL HG21 H 1 0.94 . . 2 . . . . . . . . 4083 1 228 . 1 1 20 20 VAL HG22 H 1 0.94 . . 2 . . . . . . . . 4083 1 229 . 1 1 20 20 VAL HG23 H 1 0.94 . . 2 . . . . . . . . 4083 1 230 . 1 1 20 20 VAL CA C 13 67.2 . . 1 . . . . . . . . 4083 1 231 . 1 1 20 20 VAL CB C 13 31.0 . . 1 . . . . . . . . 4083 1 232 . 1 1 20 20 VAL CG1 C 13 23.4 . . 2 . . . . . . . . 4083 1 233 . 1 1 20 20 VAL CG2 C 13 22.6 . . 2 . . . . . . . . 4083 1 234 . 1 1 20 20 VAL N N 15 117.8 . . 1 . . . . . . . . 4083 1 235 . 1 1 21 21 ARG H H 1 8.60 . . 1 . . . . . . . . 4083 1 236 . 1 1 21 21 ARG HA H 1 3.82 . . 1 . . . . . . . . 4083 1 237 . 1 1 21 21 ARG HB2 H 1 2.03 . . 2 . . . . . . . . 4083 1 238 . 1 1 21 21 ARG HB3 H 1 1.80 . . 2 . . . . . . . . 4083 1 239 . 1 1 21 21 ARG HG2 H 1 1.52 . . 1 . . . . . . . . 4083 1 240 . 1 1 21 21 ARG HG3 H 1 1.52 . . 1 . . . . . . . . 4083 1 241 . 1 1 21 21 ARG HD2 H 1 3.27 . . 2 . . . . . . . . 4083 1 242 . 1 1 21 21 ARG HD3 H 1 3.10 . . 2 . . . . . . . . 4083 1 243 . 1 1 21 21 ARG CA C 13 60.4 . . 1 . . . . . . . . 4083 1 244 . 1 1 21 21 ARG CB C 13 30.5 . . 1 . . . . . . . . 4083 1 245 . 1 1 21 21 ARG CG C 13 27.4 . . 1 . . . . . . . . 4083 1 246 . 1 1 21 21 ARG CD C 13 43.8 . . 1 . . . . . . . . 4083 1 247 . 1 1 21 21 ARG N N 15 118.2 . . 1 . . . . . . . . 4083 1 248 . 1 1 22 22 ASN H H 1 8.42 . . 1 . . . . . . . . 4083 1 249 . 1 1 22 22 ASN HA H 1 4.56 . . 1 . . . . . . . . 4083 1 250 . 1 1 22 22 ASN HB2 H 1 3.03 . . 2 . . . . . . . . 4083 1 251 . 1 1 22 22 ASN HB3 H 1 2.84 . . 2 . . . . . . . . 4083 1 252 . 1 1 22 22 ASN HD21 H 1 7.53 . . 2 . . . . . . . . 4083 1 253 . 1 1 22 22 ASN HD22 H 1 7.02 . . 2 . . . . . . . . 4083 1 254 . 1 1 22 22 ASN CA C 13 55.7 . . 1 . . . . . . . . 4083 1 255 . 1 1 22 22 ASN CB C 13 37.5 . . 1 . . . . . . . . 4083 1 256 . 1 1 22 22 ASN N N 15 117.7 . . 1 . . . . . . . . 4083 1 257 . 1 1 22 22 ASN ND2 N 15 109.7 . . 1 . . . . . . . . 4083 1 258 . 1 1 23 23 LEU H H 1 8.44 . . 1 . . . . . . . . 4083 1 259 . 1 1 23 23 LEU HA H 1 4.16 . . 1 . . . . . . . . 4083 1 260 . 1 1 23 23 LEU HB2 H 1 2.06 . . 2 . . . . . . . . 4083 1 261 . 1 1 23 23 LEU HB3 H 1 1.16 . . 2 . . . . . . . . 4083 1 262 . 1 1 23 23 LEU HD11 H 1 0.73 . . 2 . . . . . . . . 4083 1 263 . 1 1 23 23 LEU HD12 H 1 0.73 . . 2 . . . . . . . . 4083 1 264 . 1 1 23 23 LEU HD13 H 1 0.73 . . 2 . . . . . . . . 4083 1 265 . 1 1 23 23 LEU HD21 H 1 0.87 . . 2 . . . . . . . . 4083 1 266 . 1 1 23 23 LEU HD22 H 1 0.87 . . 2 . . . . . . . . 4083 1 267 . 1 1 23 23 LEU HD23 H 1 0.87 . . 2 . . . . . . . . 4083 1 268 . 1 1 23 23 LEU CA C 13 58.0 . . 1 . . . . . . . . 4083 1 269 . 1 1 23 23 LEU CB C 13 42.3 . . 1 . . . . . . . . 4083 1 270 . 1 1 23 23 LEU CD1 C 13 26.5 . . 2 . . . . . . . . 4083 1 271 . 1 1 23 23 LEU CD2 C 13 22.4 . . 2 . . . . . . . . 4083 1 272 . 1 1 23 23 LEU N N 15 121.8 . . 1 . . . . . . . . 4083 1 273 . 1 1 24 24 LEU H H 1 8.33 . . 1 . . . . . . . . 4083 1 274 . 1 1 24 24 LEU HA H 1 3.83 . . 1 . . . . . . . . 4083 1 275 . 1 1 24 24 LEU HB2 H 1 1.83 . . 2 . . . . . . . . 4083 1 276 . 1 1 24 24 LEU HB3 H 1 1.34 . . 2 . . . . . . . . 4083 1 277 . 1 1 24 24 LEU HG H 1 1.42 . . 1 . . . . . . . . 4083 1 278 . 1 1 24 24 LEU HD11 H 1 0.17 . . 2 . . . . . . . . 4083 1 279 . 1 1 24 24 LEU HD12 H 1 0.17 . . 2 . . . . . . . . 4083 1 280 . 1 1 24 24 LEU HD13 H 1 0.17 . . 2 . . . . . . . . 4083 1 281 . 1 1 24 24 LEU HD21 H 1 -0.14 . . 2 . . . . . . . . 4083 1 282 . 1 1 24 24 LEU HD22 H 1 -0.14 . . 2 . . . . . . . . 4083 1 283 . 1 1 24 24 LEU HD23 H 1 -0.14 . . 2 . . . . . . . . 4083 1 284 . 1 1 24 24 LEU CA C 13 58.2 . . 1 . . . . . . . . 4083 1 285 . 1 1 24 24 LEU CB C 13 40.1 . . 1 . . . . . . . . 4083 1 286 . 1 1 24 24 LEU CG C 13 26.5 . . 1 . . . . . . . . 4083 1 287 . 1 1 24 24 LEU CD1 C 13 26.7 . . 2 . . . . . . . . 4083 1 288 . 1 1 24 24 LEU CD2 C 13 22.3 . . 2 . . . . . . . . 4083 1 289 . 1 1 24 24 LEU N N 15 116.6 . . 1 . . . . . . . . 4083 1 290 . 1 1 25 25 LYS H H 1 7.94 . . 1 . . . . . . . . 4083 1 291 . 1 1 25 25 LYS HA H 1 3.75 . . 1 . . . . . . . . 4083 1 292 . 1 1 25 25 LYS HB2 H 1 2.07 . . 1 . . . . . . . . 4083 1 293 . 1 1 25 25 LYS HB3 H 1 2.07 . . 1 . . . . . . . . 4083 1 294 . 1 1 25 25 LYS HG2 H 1 1.63 . . 2 . . . . . . . . 4083 1 295 . 1 1 25 25 LYS HG3 H 1 1.41 . . 2 . . . . . . . . 4083 1 296 . 1 1 25 25 LYS HD2 H 1 1.79 . . 1 . . . . . . . . 4083 1 297 . 1 1 25 25 LYS HD3 H 1 1.79 . . 1 . . . . . . . . 4083 1 298 . 1 1 25 25 LYS HE2 H 1 2.98 . . 1 . . . . . . . . 4083 1 299 . 1 1 25 25 LYS HE3 H 1 2.98 . . 1 . . . . . . . . 4083 1 300 . 1 1 25 25 LYS CA C 13 59.8 . . 1 . . . . . . . . 4083 1 301 . 1 1 25 25 LYS CB C 13 31.6 . . 1 . . . . . . . . 4083 1 302 . 1 1 25 25 LYS CG C 13 24.7 . . 1 . . . . . . . . 4083 1 303 . 1 1 25 25 LYS CD C 13 29.6 . . 1 . . . . . . . . 4083 1 304 . 1 1 25 25 LYS CE C 13 41.4 . . 1 . . . . . . . . 4083 1 305 . 1 1 25 25 LYS N N 15 119.2 . . 1 . . . . . . . . 4083 1 306 . 1 1 26 26 GLU H H 1 7.95 . . 1 . . . . . . . . 4083 1 307 . 1 1 26 26 GLU HA H 1 3.99 . . 1 . . . . . . . . 4083 1 308 . 1 1 26 26 GLU HB2 H 1 2.3 . . 2 . . . . . . . . 4083 1 309 . 1 1 26 26 GLU HB3 H 1 2.17 . . 2 . . . . . . . . 4083 1 310 . 1 1 26 26 GLU HG2 H 1 2.45 . . 1 . . . . . . . . 4083 1 311 . 1 1 26 26 GLU HG3 H 1 2.45 . . 1 . . . . . . . . 4083 1 312 . 1 1 26 26 GLU CA C 13 59.3 . . 1 . . . . . . . . 4083 1 313 . 1 1 26 26 GLU CB C 13 28.8 . . 1 . . . . . . . . 4083 1 314 . 1 1 26 26 GLU CG C 13 36.0 . . 1 . . . . . . . . 4083 1 315 . 1 1 26 26 GLU N N 15 120.9 . . 1 . . . . . . . . 4083 1 316 . 1 1 27 27 LEU H H 1 7.43 . . 1 . . . . . . . . 4083 1 317 . 1 1 27 27 LEU HA H 1 4.28 . . 1 . . . . . . . . 4083 1 318 . 1 1 27 27 LEU HB2 H 1 2.16 . . 2 . . . . . . . . 4083 1 319 . 1 1 27 27 LEU HB3 H 1 1.83 . . 2 . . . . . . . . 4083 1 320 . 1 1 27 27 LEU HD11 H 1 0.88 . . 1 . . . . . . . . 4083 1 321 . 1 1 27 27 LEU HD12 H 1 0.88 . . 1 . . . . . . . . 4083 1 322 . 1 1 27 27 LEU HD13 H 1 0.88 . . 1 . . . . . . . . 4083 1 323 . 1 1 27 27 LEU HD21 H 1 0.88 . . 1 . . . . . . . . 4083 1 324 . 1 1 27 27 LEU HD22 H 1 0.88 . . 1 . . . . . . . . 4083 1 325 . 1 1 27 27 LEU HD23 H 1 0.88 . . 1 . . . . . . . . 4083 1 326 . 1 1 27 27 LEU CA C 13 54.3 . . 1 . . . . . . . . 4083 1 327 . 1 1 27 27 LEU CB C 13 42.2 . . 1 . . . . . . . . 4083 1 328 . 1 1 27 27 LEU CG C 13 26.1 . . 1 . . . . . . . . 4083 1 329 . 1 1 27 27 LEU CD1 C 13 24.8 . . 2 . . . . . . . . 4083 1 330 . 1 1 27 27 LEU CD2 C 13 21.8 . . 2 . . . . . . . . 4083 1 331 . 1 1 27 27 LEU N N 15 115.7 . . 1 . . . . . . . . 4083 1 332 . 1 1 28 28 GLY H H 1 7.74 . . 1 . . . . . . . . 4083 1 333 . 1 1 28 28 GLY HA2 H 1 3.94 . . 2 . . . . . . . . 4083 1 334 . 1 1 28 28 GLY HA3 H 1 3.54 . . 2 . . . . . . . . 4083 1 335 . 1 1 28 28 GLY CA C 13 44.6 . . 1 . . . . . . . . 4083 1 336 . 1 1 28 28 GLY N N 15 104.9 . . 1 . . . . . . . . 4083 1 337 . 1 1 29 29 PHE H H 1 8.17 . . 1 . . . . . . . . 4083 1 338 . 1 1 29 29 PHE HA H 1 4.86 . . 1 . . . . . . . . 4083 1 339 . 1 1 29 29 PHE HB2 H 1 3.08 . . 2 . . . . . . . . 4083 1 340 . 1 1 29 29 PHE HB3 H 1 2.45 . . 2 . . . . . . . . 4083 1 341 . 1 1 29 29 PHE HD1 H 1 7.29 . . 1 . . . . . . . . 4083 1 342 . 1 1 29 29 PHE HD2 H 1 7.29 . . 1 . . . . . . . . 4083 1 343 . 1 1 29 29 PHE HE1 H 1 7.31 . . 1 . . . . . . . . 4083 1 344 . 1 1 29 29 PHE HE2 H 1 7.31 . . 1 . . . . . . . . 4083 1 345 . 1 1 29 29 PHE CA C 13 57.1 . . 1 . . . . . . . . 4083 1 346 . 1 1 29 29 PHE CB C 13 38.6 . . 1 . . . . . . . . 4083 1 347 . 1 1 29 29 PHE CD1 C 13 132.9 . . 1 . . . . . . . . 4083 1 348 . 1 1 29 29 PHE CD2 C 13 132.9 . . 1 . . . . . . . . 4083 1 349 . 1 1 29 29 PHE CE1 C 13 130.8 . . 1 . . . . . . . . 4083 1 350 . 1 1 29 29 PHE CE2 C 13 130.8 . . 1 . . . . . . . . 4083 1 351 . 1 1 29 29 PHE N N 15 119.7 . . 1 . . . . . . . . 4083 1 352 . 1 1 30 30 ASN H H 1 8.28 . . 1 . . . . . . . . 4083 1 353 . 1 1 30 30 ASN HA H 1 4.68 . . 1 . . . . . . . . 4083 1 354 . 1 1 30 30 ASN HB2 H 1 2.83 . . 2 . . . . . . . . 4083 1 355 . 1 1 30 30 ASN HB3 H 1 2.66 . . 2 . . . . . . . . 4083 1 356 . 1 1 30 30 ASN HD21 H 1 7.39 . . 2 . . . . . . . . 4083 1 357 . 1 1 30 30 ASN HD22 H 1 6.88 . . 2 . . . . . . . . 4083 1 358 . 1 1 30 30 ASN CA C 13 53.6 . . 1 . . . . . . . . 4083 1 359 . 1 1 30 30 ASN CB C 13 40.5 . . 1 . . . . . . . . 4083 1 360 . 1 1 30 30 ASN N N 15 116.8 . . 1 . . . . . . . . 4083 1 361 . 1 1 30 30 ASN ND2 N 15 111.8 . . 1 . . . . . . . . 4083 1 362 . 1 1 31 31 ASN H H 1 9.82 . . 1 . . . . . . . . 4083 1 363 . 1 1 31 31 ASN HA H 1 5.01 . . 1 . . . . . . . . 4083 1 364 . 1 1 31 31 ASN HB2 H 1 3.27 . . 2 . . . . . . . . 4083 1 365 . 1 1 31 31 ASN HB3 H 1 2.88 . . 2 . . . . . . . . 4083 1 366 . 1 1 31 31 ASN HD21 H 1 7.56 . . 2 . . . . . . . . 4083 1 367 . 1 1 31 31 ASN HD22 H 1 7.00 . . 2 . . . . . . . . 4083 1 368 . 1 1 31 31 ASN CA C 13 52.1 . . 1 . . . . . . . . 4083 1 369 . 1 1 31 31 ASN CB C 13 36.4 . . 1 . . . . . . . . 4083 1 370 . 1 1 31 31 ASN N N 15 123.0 . . 1 . . . . . . . . 4083 1 371 . 1 1 31 31 ASN ND2 N 15 109.2 . . 1 . . . . . . . . 4083 1 372 . 1 1 32 32 VAL H H 1 7.53 . . 1 . . . . . . . . 4083 1 373 . 1 1 32 32 VAL HA H 1 4.99 . . 1 . . . . . . . . 4083 1 374 . 1 1 32 32 VAL HB H 1 1.85 . . 1 . . . . . . . . 4083 1 375 . 1 1 32 32 VAL HG11 H 1 0.83 . . 1 . . . . . . . . 4083 1 376 . 1 1 32 32 VAL HG12 H 1 0.83 . . 1 . . . . . . . . 4083 1 377 . 1 1 32 32 VAL HG13 H 1 0.83 . . 1 . . . . . . . . 4083 1 378 . 1 1 32 32 VAL HG21 H 1 0.83 . . 1 . . . . . . . . 4083 1 379 . 1 1 32 32 VAL HG22 H 1 0.83 . . 1 . . . . . . . . 4083 1 380 . 1 1 32 32 VAL HG23 H 1 0.83 . . 1 . . . . . . . . 4083 1 381 . 1 1 32 32 VAL CA C 13 60.8 . . 1 . . . . . . . . 4083 1 382 . 1 1 32 32 VAL CB C 13 36.3 . . 1 . . . . . . . . 4083 1 383 . 1 1 32 32 VAL CG1 C 13 22.6 . . 1 . . . . . . . . 4083 1 384 . 1 1 32 32 VAL CG2 C 13 22.6 . . 1 . . . . . . . . 4083 1 385 . 1 1 32 32 VAL N N 15 120.8 . . 1 . . . . . . . . 4083 1 386 . 1 1 33 33 GLU H H 1 9.06 . . 1 . . . . . . . . 4083 1 387 . 1 1 33 33 GLU HA H 1 4.93 . . 1 . . . . . . . . 4083 1 388 . 1 1 33 33 GLU HB2 H 1 2.31 . . 2 . . . . . . . . 4083 1 389 . 1 1 33 33 GLU HB3 H 1 2.16 . . 2 . . . . . . . . 4083 1 390 . 1 1 33 33 GLU HG2 H 1 2.57 . . 1 . . . . . . . . 4083 1 391 . 1 1 33 33 GLU HG3 H 1 2.45 . . 2 . . . . . . . . 4083 1 392 . 1 1 33 33 GLU CA C 13 53.8 . . 1 . . . . . . . . 4083 1 393 . 1 1 33 33 GLU CB C 13 34.0 . . 1 . . . . . . . . 4083 1 394 . 1 1 33 33 GLU CG C 13 36.2 . . 1 . . . . . . . . 4083 1 395 . 1 1 33 33 GLU N N 15 125.4 . . 1 . . . . . . . . 4083 1 396 . 1 1 34 34 GLU H H 1 8.92 . . 1 . . . . . . . . 4083 1 397 . 1 1 34 34 GLU HA H 1 5.44 . . 1 . . . . . . . . 4083 1 398 . 1 1 34 34 GLU HB2 H 1 1.90 . . 1 . . . . . . . . 4083 1 399 . 1 1 34 34 GLU HB3 H 1 1.90 . . 1 . . . . . . . . 4083 1 400 . 1 1 34 34 GLU HG2 H 1 2.15 . . 1 . . . . . . . . 4083 1 401 . 1 1 34 34 GLU HG3 H 1 2.06 . . 2 . . . . . . . . 4083 1 402 . 1 1 34 34 GLU CA C 13 54.7 . . 1 . . . . . . . . 4083 1 403 . 1 1 34 34 GLU CB C 13 34.8 . . 1 . . . . . . . . 4083 1 404 . 1 1 34 34 GLU CG C 13 35.5 . . 1 . . . . . . . . 4083 1 405 . 1 1 34 34 GLU N N 15 119.6 . . 1 . . . . . . . . 4083 1 406 . 1 1 35 35 ALA H H 1 8.84 . . 1 . . . . . . . . 4083 1 407 . 1 1 35 35 ALA HA H 1 4.81 . . 1 . . . . . . . . 4083 1 408 . 1 1 35 35 ALA HB1 H 1 1.30 . . 1 . . . . . . . . 4083 1 409 . 1 1 35 35 ALA HB2 H 1 1.30 . . 1 . . . . . . . . 4083 1 410 . 1 1 35 35 ALA HB3 H 1 1.30 . . 1 . . . . . . . . 4083 1 411 . 1 1 35 35 ALA CA C 13 50.1 . . 1 . . . . . . . . 4083 1 412 . 1 1 35 35 ALA CB C 13 22.7 . . 1 . . . . . . . . 4083 1 413 . 1 1 35 35 ALA N N 15 119.0 . . 1 . . . . . . . . 4083 1 414 . 1 1 36 36 GLU H H 1 9.48 . . 1 . . . . . . . . 4083 1 415 . 1 1 36 36 GLU HA H 1 4.62 . . 1 . . . . . . . . 4083 1 416 . 1 1 36 36 GLU HB2 H 1 2.06 . . 1 . . . . . . . . 4083 1 417 . 1 1 36 36 GLU HB3 H 1 2.06 . . 1 . . . . . . . . 4083 1 418 . 1 1 36 36 GLU HG2 H 1 2.20 . . 1 . . . . . . . . 4083 1 419 . 1 1 36 36 GLU HG3 H 1 2.20 . . 1 . . . . . . . . 4083 1 420 . 1 1 36 36 GLU CA C 13 56.7 . . 1 . . . . . . . . 4083 1 421 . 1 1 36 36 GLU CB C 13 31.8 . . 1 . . . . . . . . 4083 1 422 . 1 1 36 36 GLU CG C 13 35.7 . . 1 . . . . . . . . 4083 1 423 . 1 1 36 36 GLU N N 15 116.1 . . 1 . . . . . . . . 4083 1 424 . 1 1 37 37 ASP H H 1 7.49 . . 1 . . . . . . . . 4083 1 425 . 1 1 37 37 ASP HA H 1 5.30 . . 1 . . . . . . . . 4083 1 426 . 1 1 37 37 ASP HB2 H 1 3.51 . . 2 . . . . . . . . 4083 1 427 . 1 1 37 37 ASP HB3 H 1 3.30 . . 2 . . . . . . . . 4083 1 428 . 1 1 37 37 ASP CA C 13 53.7 . . 1 . . . . . . . . 4083 1 429 . 1 1 37 37 ASP CB C 13 41.3 . . 1 . . . . . . . . 4083 1 430 . 1 1 37 37 ASP N N 15 108.9 . . 1 . . . . . . . . 4083 1 431 . 1 1 38 38 GLY H H 1 8.08 . . 1 . . . . . . . . 4083 1 432 . 1 1 38 38 GLY HA2 H 1 3.75 . . 2 . . . . . . . . 4083 1 433 . 1 1 38 38 GLY HA3 H 1 3.61 . . 2 . . . . . . . . 4083 1 434 . 1 1 38 38 GLY CA C 13 48.4 . . 1 . . . . . . . . 4083 1 435 . 1 1 38 38 GLY N N 15 100.8 . . 1 . . . . . . . . 4083 1 436 . 1 1 39 39 VAL H H 1 7.95 . . 1 . . . . . . . . 4083 1 437 . 1 1 39 39 VAL HA H 1 3.50 . . 1 . . . . . . . . 4083 1 438 . 1 1 39 39 VAL HB H 1 2.26 . . 1 . . . . . . . . 4083 1 439 . 1 1 39 39 VAL HG11 H 1 0.90 . . 1 . . . . . . . . 4083 1 440 . 1 1 39 39 VAL HG12 H 1 0.90 . . 1 . . . . . . . . 4083 1 441 . 1 1 39 39 VAL HG13 H 1 0.90 . . 1 . . . . . . . . 4083 1 442 . 1 1 39 39 VAL HG21 H 1 0.90 . . 1 . . . . . . . . 4083 1 443 . 1 1 39 39 VAL HG22 H 1 0.90 . . 1 . . . . . . . . 4083 1 444 . 1 1 39 39 VAL HG23 H 1 0.90 . . 1 . . . . . . . . 4083 1 445 . 1 1 39 39 VAL CA C 13 65.9 . . 1 . . . . . . . . 4083 1 446 . 1 1 39 39 VAL CB C 13 31.4 . . 1 . . . . . . . . 4083 1 447 . 1 1 39 39 VAL CG1 C 13 21.1 . . 1 . . . . . . . . 4083 1 448 . 1 1 39 39 VAL CG2 C 13 21.1 . . 1 . . . . . . . . 4083 1 449 . 1 1 39 39 VAL N N 15 121.4 . . 1 . . . . . . . . 4083 1 450 . 1 1 40 40 ASP H H 1 8.57 . . 1 . . . . . . . . 4083 1 451 . 1 1 40 40 ASP HA H 1 4.44 . . 1 . . . . . . . . 4083 1 452 . 1 1 40 40 ASP HB2 H 1 2.97 . . 2 . . . . . . . . 4083 1 453 . 1 1 40 40 ASP HB3 H 1 2.60 . . 2 . . . . . . . . 4083 1 454 . 1 1 40 40 ASP CA C 13 56.4 . . 1 . . . . . . . . 4083 1 455 . 1 1 40 40 ASP CB C 13 42.4 . . 1 . . . . . . . . 4083 1 456 . 1 1 40 40 ASP N N 15 119.8 . . 1 . . . . . . . . 4083 1 457 . 1 1 41 41 ALA H H 1 8.30 . . 1 . . . . . . . . 4083 1 458 . 1 1 41 41 ALA HA H 1 3.61 . . 1 . . . . . . . . 4083 1 459 . 1 1 41 41 ALA HB1 H 1 1.36 . . 1 . . . . . . . . 4083 1 460 . 1 1 41 41 ALA HB2 H 1 1.36 . . 1 . . . . . . . . 4083 1 461 . 1 1 41 41 ALA HB3 H 1 1.36 . . 1 . . . . . . . . 4083 1 462 . 1 1 41 41 ALA CA C 13 55.0 . . 1 . . . . . . . . 4083 1 463 . 1 1 41 41 ALA CB C 13 19.8 . . 1 . . . . . . . . 4083 1 464 . 1 1 41 41 ALA N N 15 115.6 . . 1 . . . . . . . . 4083 1 465 . 1 1 42 42 LEU H H 1 8.12 . . 1 . . . . . . . . 4083 1 466 . 1 1 42 42 LEU HA H 1 3.75 . . 1 . . . . . . . . 4083 1 467 . 1 1 42 42 LEU HB2 H 1 1.74 . . 2 . . . . . . . . 4083 1 468 . 1 1 42 42 LEU HB3 H 1 1.51 . . 2 . . . . . . . . 4083 1 469 . 1 1 42 42 LEU CA C 13 58.2 . . 1 . . . . . . . . 4083 1 470 . 1 1 42 42 LEU CB C 13 41.2 . . 1 . . . . . . . . 4083 1 471 . 1 1 42 42 LEU N N 15 117.1 . . 1 . . . . . . . . 4083 1 472 . 1 1 43 43 ASN H H 1 7.85 . . 1 . . . . . . . . 4083 1 473 . 1 1 43 43 ASN HA H 1 4.39 . . 1 . . . . . . . . 4083 1 474 . 1 1 43 43 ASN HB2 H 1 3.05 . . 2 . . . . . . . . 4083 1 475 . 1 1 43 43 ASN HB3 H 1 2.88 . . 2 . . . . . . . . 4083 1 476 . 1 1 43 43 ASN HD21 H 1 7.78 . . 2 . . . . . . . . 4083 1 477 . 1 1 43 43 ASN HD22 H 1 6.83 . . 2 . . . . . . . . 4083 1 478 . 1 1 43 43 ASN CA C 13 56.0 . . 1 . . . . . . . . 4083 1 479 . 1 1 43 43 ASN CB C 13 38.0 . . 1 . . . . . . . . 4083 1 480 . 1 1 43 43 ASN N N 15 115.6 . . 1 . . . . . . . . 4083 1 481 . 1 1 43 43 ASN ND2 N 15 111.1 . . 1 . . . . . . . . 4083 1 482 . 1 1 44 44 LYS H H 1 7.92 . . 1 . . . . . . . . 4083 1 483 . 1 1 44 44 LYS HA H 1 4.11 . . 1 . . . . . . . . 4083 1 484 . 1 1 44 44 LYS HB2 H 1 1.76 . . 1 . . . . . . . . 4083 1 485 . 1 1 44 44 LYS HB3 H 1 1.76 . . 1 . . . . . . . . 4083 1 486 . 1 1 44 44 LYS HG2 H 1 1.43 . . 1 . . . . . . . . 4083 1 487 . 1 1 44 44 LYS HG3 H 1 1.43 . . 1 . . . . . . . . 4083 1 488 . 1 1 44 44 LYS HD2 H 1 1.69 . . 1 . . . . . . . . 4083 1 489 . 1 1 44 44 LYS HD3 H 1 1.69 . . 1 . . . . . . . . 4083 1 490 . 1 1 44 44 LYS HE2 H 1 2.96 . . 1 . . . . . . . . 4083 1 491 . 1 1 44 44 LYS HE3 H 1 2.96 . . 1 . . . . . . . . 4083 1 492 . 1 1 44 44 LYS CA C 13 60.0 . . 1 . . . . . . . . 4083 1 493 . 1 1 44 44 LYS CB C 13 31.9 . . 1 . . . . . . . . 4083 1 494 . 1 1 44 44 LYS CG C 13 24.5 . . 1 . . . . . . . . 4083 1 495 . 1 1 44 44 LYS CD C 13 29.0 . . 1 . . . . . . . . 4083 1 496 . 1 1 44 44 LYS CE C 13 41.7 . . 1 . . . . . . . . 4083 1 497 . 1 1 44 44 LYS N N 15 119.0 . . 1 . . . . . . . . 4083 1 498 . 1 1 45 45 LEU H H 1 8.75 . . 1 . . . . . . . . 4083 1 499 . 1 1 45 45 LEU HA H 1 3.83 . . 1 . . . . . . . . 4083 1 500 . 1 1 45 45 LEU HB2 H 1 1.75 . . 2 . . . . . . . . 4083 1 501 . 1 1 45 45 LEU HB3 H 1 1.41 . . 2 . . . . . . . . 4083 1 502 . 1 1 45 45 LEU HD11 H 1 0.53 . . 2 . . . . . . . . 4083 1 503 . 1 1 45 45 LEU HD12 H 1 0.53 . . 2 . . . . . . . . 4083 1 504 . 1 1 45 45 LEU HD13 H 1 0.53 . . 2 . . . . . . . . 4083 1 505 . 1 1 45 45 LEU HD21 H 1 0.36 . . 2 . . . . . . . . 4083 1 506 . 1 1 45 45 LEU HD22 H 1 0.36 . . 2 . . . . . . . . 4083 1 507 . 1 1 45 45 LEU HD23 H 1 0.36 . . 2 . . . . . . . . 4083 1 508 . 1 1 45 45 LEU CA C 13 57.2 . . 1 . . . . . . . . 4083 1 509 . 1 1 45 45 LEU CB C 13 42.1 . . 1 . . . . . . . . 4083 1 510 . 1 1 45 45 LEU CD1 C 13 25.3 . . 2 . . . . . . . . 4083 1 511 . 1 1 45 45 LEU CD2 C 13 22.6 . . 2 . . . . . . . . 4083 1 512 . 1 1 45 45 LEU N N 15 117.3 . . 1 . . . . . . . . 4083 1 513 . 1 1 46 46 GLN H H 1 7.84 . . 1 . . . . . . . . 4083 1 514 . 1 1 46 46 GLN HA H 1 4.03 . . 1 . . . . . . . . 4083 1 515 . 1 1 46 46 GLN HB2 H 1 2.15 . . 1 . . . . . . . . 4083 1 516 . 1 1 46 46 GLN HB3 H 1 2.15 . . 1 . . . . . . . . 4083 1 517 . 1 1 46 46 GLN HG2 H 1 2.56 . . 1 . . . . . . . . 4083 1 518 . 1 1 46 46 GLN HG3 H 1 2.56 . . 1 . . . . . . . . 4083 1 519 . 1 1 46 46 GLN HE21 H 1 6.83 . . 2 . . . . . . . . 4083 1 520 . 1 1 46 46 GLN HE22 H 1 6.78 . . 2 . . . . . . . . 4083 1 521 . 1 1 46 46 GLN CA C 13 57.7 . . 1 . . . . . . . . 4083 1 522 . 1 1 46 46 GLN CB C 13 28.1 . . 1 . . . . . . . . 4083 1 523 . 1 1 46 46 GLN CG C 13 33.8 . . 1 . . . . . . . . 4083 1 524 . 1 1 46 46 GLN N N 15 115.3 . . 1 . . . . . . . . 4083 1 525 . 1 1 46 46 GLN NE2 N 15 107.9 . . 1 . . . . . . . . 4083 1 526 . 1 1 47 47 ALA H H 1 7.60 . . 1 . . . . . . . . 4083 1 527 . 1 1 47 47 ALA HA H 1 4.31 . . 1 . . . . . . . . 4083 1 528 . 1 1 47 47 ALA HB1 H 1 1.67 . . 1 . . . . . . . . 4083 1 529 . 1 1 47 47 ALA HB2 H 1 1.67 . . 1 . . . . . . . . 4083 1 530 . 1 1 47 47 ALA HB3 H 1 1.67 . . 1 . . . . . . . . 4083 1 531 . 1 1 47 47 ALA CA C 13 53.3 . . 1 . . . . . . . . 4083 1 532 . 1 1 47 47 ALA CB C 13 19.0 . . 1 . . . . . . . . 4083 1 533 . 1 1 47 47 ALA N N 15 119.1 . . 1 . . . . . . . . 4083 1 534 . 1 1 48 48 GLY H H 1 7.58 . . 1 . . . . . . . . 4083 1 535 . 1 1 48 48 GLY HA2 H 1 4.31 . . 2 . . . . . . . . 4083 1 536 . 1 1 48 48 GLY HA3 H 1 4.08 . . 2 . . . . . . . . 4083 1 537 . 1 1 48 48 GLY CA C 13 44.5 . . 1 . . . . . . . . 4083 1 538 . 1 1 48 48 GLY N N 15 102.7 . . 1 . . . . . . . . 4083 1 539 . 1 1 49 49 GLY H H 1 8.34 . . 1 . . . . . . . . 4083 1 540 . 1 1 49 49 GLY HA2 H 1 3.94 . . 2 . . . . . . . . 4083 1 541 . 1 1 49 49 GLY HA3 H 1 3.67 . . 2 . . . . . . . . 4083 1 542 . 1 1 49 49 GLY CA C 13 45.2 . . 1 . . . . . . . . 4083 1 543 . 1 1 49 49 GLY N N 15 102.5 . . 1 . . . . . . . . 4083 1 544 . 1 1 50 50 TYR H H 1 8.07 . . 1 . . . . . . . . 4083 1 545 . 1 1 50 50 TYR HA H 1 4.07 . . 1 . . . . . . . . 4083 1 546 . 1 1 50 50 TYR HB2 H 1 3.05 . . 2 . . . . . . . . 4083 1 547 . 1 1 50 50 TYR HB3 H 1 2.53 . . 2 . . . . . . . . 4083 1 548 . 1 1 50 50 TYR HD1 H 1 6.93 . . 1 . . . . . . . . 4083 1 549 . 1 1 50 50 TYR HD2 H 1 6.93 . . 1 . . . . . . . . 4083 1 550 . 1 1 50 50 TYR HE1 H 1 6.69 . . 1 . . . . . . . . 4083 1 551 . 1 1 50 50 TYR HE2 H 1 6.69 . . 1 . . . . . . . . 4083 1 552 . 1 1 50 50 TYR CA C 13 60.6 . . 1 . . . . . . . . 4083 1 553 . 1 1 50 50 TYR CB C 13 39.0 . . 1 . . . . . . . . 4083 1 554 . 1 1 50 50 TYR N N 15 117.2 . . 1 . . . . . . . . 4083 1 555 . 1 1 51 51 GLY H H 1 9.53 . . 1 . . . . . . . . 4083 1 556 . 1 1 51 51 GLY HA2 H 1 4.51 . . 2 . . . . . . . . 4083 1 557 . 1 1 51 51 GLY HA3 H 1 3.44 . . 2 . . . . . . . . 4083 1 558 . 1 1 51 51 GLY CA C 13 44.3 . . 1 . . . . . . . . 4083 1 559 . 1 1 51 51 GLY N N 15 105.7 . . 1 . . . . . . . . 4083 1 560 . 1 1 52 52 PHE H H 1 7.55 . . 1 . . . . . . . . 4083 1 561 . 1 1 52 52 PHE HA H 1 4.10 . . 1 . . . . . . . . 4083 1 562 . 1 1 52 52 PHE HB2 H 1 2.01 . . 1 . . . . . . . . 4083 1 563 . 1 1 52 52 PHE HB3 H 1 2.01 . . 1 . . . . . . . . 4083 1 564 . 1 1 52 52 PHE HD1 H 1 6.89 . . 1 . . . . . . . . 4083 1 565 . 1 1 52 52 PHE HD2 H 1 6.89 . . 1 . . . . . . . . 4083 1 566 . 1 1 52 52 PHE HE1 H 1 6.87 . . 1 . . . . . . . . 4083 1 567 . 1 1 52 52 PHE HE2 H 1 6.87 . . 1 . . . . . . . . 4083 1 568 . 1 1 52 52 PHE HZ H 1 6.79 . . 1 . . . . . . . . 4083 1 569 . 1 1 52 52 PHE CA C 13 58.0 . . 1 . . . . . . . . 4083 1 570 . 1 1 52 52 PHE CB C 13 43.4 . . 1 . . . . . . . . 4083 1 571 . 1 1 52 52 PHE CD1 C 13 132.0 . . 1 . . . . . . . . 4083 1 572 . 1 1 52 52 PHE CD2 C 13 132.0 . . 1 . . . . . . . . 4083 1 573 . 1 1 52 52 PHE CE1 C 13 130.0 . . 1 . . . . . . . . 4083 1 574 . 1 1 52 52 PHE CE2 C 13 130.0 . . 1 . . . . . . . . 4083 1 575 . 1 1 52 52 PHE CZ C 13 128.4 . . 1 . . . . . . . . 4083 1 576 . 1 1 52 52 PHE N N 15 120.1 . . 1 . . . . . . . . 4083 1 577 . 1 1 53 53 VAL H H 1 8.21 . . 1 . . . . . . . . 4083 1 578 . 1 1 53 53 VAL HA H 1 5.13 . . 1 . . . . . . . . 4083 1 579 . 1 1 53 53 VAL HB H 1 2.09 . . 1 . . . . . . . . 4083 1 580 . 1 1 53 53 VAL HG11 H 1 0.83 . . 2 . . . . . . . . 4083 1 581 . 1 1 53 53 VAL HG12 H 1 0.83 . . 2 . . . . . . . . 4083 1 582 . 1 1 53 53 VAL HG13 H 1 0.83 . . 2 . . . . . . . . 4083 1 583 . 1 1 53 53 VAL HG21 H 1 0.74 . . 2 . . . . . . . . 4083 1 584 . 1 1 53 53 VAL HG22 H 1 0.74 . . 2 . . . . . . . . 4083 1 585 . 1 1 53 53 VAL HG23 H 1 0.74 . . 2 . . . . . . . . 4083 1 586 . 1 1 53 53 VAL CA C 13 61.1 . . 1 . . . . . . . . 4083 1 587 . 1 1 53 53 VAL CB C 13 34.6 . . 1 . . . . . . . . 4083 1 588 . 1 1 53 53 VAL CG1 C 13 22.3 . . 2 . . . . . . . . 4083 1 589 . 1 1 53 53 VAL CG2 C 13 20.6 . . 2 . . . . . . . . 4083 1 590 . 1 1 53 53 VAL N N 15 125.6 . . 1 . . . . . . . . 4083 1 591 . 1 1 54 54 ILE H H 1 9.23 . . 1 . . . . . . . . 4083 1 592 . 1 1 54 54 ILE HA H 1 5.10 . . 1 . . . . . . . . 4083 1 593 . 1 1 54 54 ILE HB H 1 1.87 . . 1 . . . . . . . . 4083 1 594 . 1 1 54 54 ILE HG12 H 1 2.01 . . 2 . . . . . . . . 4083 1 595 . 1 1 54 54 ILE HG13 H 1 1.21 . . 2 . . . . . . . . 4083 1 596 . 1 1 54 54 ILE HG21 H 1 0.91 . . 1 . . . . . . . . 4083 1 597 . 1 1 54 54 ILE HG22 H 1 0.91 . . 1 . . . . . . . . 4083 1 598 . 1 1 54 54 ILE HG23 H 1 0.91 . . 1 . . . . . . . . 4083 1 599 . 1 1 54 54 ILE HD11 H 1 0.77 . . 1 . . . . . . . . 4083 1 600 . 1 1 54 54 ILE HD12 H 1 0.77 . . 1 . . . . . . . . 4083 1 601 . 1 1 54 54 ILE HD13 H 1 0.77 . . 1 . . . . . . . . 4083 1 602 . 1 1 54 54 ILE CA C 13 60.4 . . 1 . . . . . . . . 4083 1 603 . 1 1 54 54 ILE CB C 13 40.1 . . 1 . . . . . . . . 4083 1 604 . 1 1 54 54 ILE CG1 C 13 27.8 . . 1 . . . . . . . . 4083 1 605 . 1 1 54 54 ILE CG2 C 13 17.7 . . 1 . . . . . . . . 4083 1 606 . 1 1 54 54 ILE CD1 C 13 14.0 . . 1 . . . . . . . . 4083 1 607 . 1 1 54 54 ILE N N 15 126.7 . . 1 . . . . . . . . 4083 1 608 . 1 1 55 55 SER H H 1 8.93 . . 1 . . . . . . . . 4083 1 609 . 1 1 55 55 SER HA H 1 5.40 . . 1 . . . . . . . . 4083 1 610 . 1 1 55 55 SER HB2 H 1 3.64 . . 2 . . . . . . . . 4083 1 611 . 1 1 55 55 SER HB3 H 1 3.06 . . 2 . . . . . . . . 4083 1 612 . 1 1 55 55 SER CA C 13 56.2 . . 1 . . . . . . . . 4083 1 613 . 1 1 55 55 SER CB C 13 65.8 . . 1 . . . . . . . . 4083 1 614 . 1 1 55 55 SER N N 15 117.4 . . 1 . . . . . . . . 4083 1 615 . 1 1 56 56 ASP H H 1 8.44 . . 1 . . . . . . . . 4083 1 616 . 1 1 56 56 ASP HA H 1 5.10 . . 1 . . . . . . . . 4083 1 617 . 1 1 56 56 ASP HB2 H 1 3.26 . . 2 . . . . . . . . 4083 1 618 . 1 1 56 56 ASP HB3 H 1 2.92 . . 2 . . . . . . . . 4083 1 619 . 1 1 56 56 ASP CA C 13 54.5 . . 1 . . . . . . . . 4083 1 620 . 1 1 56 56 ASP CB C 13 38.7 . . 1 . . . . . . . . 4083 1 621 . 1 1 56 56 ASP N N 15 125.4 . . 1 . . . . . . . . 4083 1 622 . 1 1 57 57 TRP HA H 1 4.21 . . 1 . . . . . . . . 4083 1 623 . 1 1 57 57 TRP HB2 H 1 3.60 . . 2 . . . . . . . . 4083 1 624 . 1 1 57 57 TRP HB3 H 1 3.51 . . 2 . . . . . . . . 4083 1 625 . 1 1 57 57 TRP HD1 H 1 7.27 . . 1 . . . . . . . . 4083 1 626 . 1 1 57 57 TRP HE1 H 1 10.3 . . 1 . . . . . . . . 4083 1 627 . 1 1 57 57 TRP HE3 H 1 7.42 . . 1 . . . . . . . . 4083 1 628 . 1 1 57 57 TRP HZ2 H 1 7.47 . . 3 . . . . . . . . 4083 1 629 . 1 1 57 57 TRP HZ3 H 1 6.79 . . 3 . . . . . . . . 4083 1 630 . 1 1 57 57 TRP HH2 H 1 7.28 . . 1 . . . . . . . . 4083 1 631 . 1 1 57 57 TRP CA C 13 59.8 . . 1 . . . . . . . . 4083 1 632 . 1 1 57 57 TRP CB C 13 30.6 . . 1 . . . . . . . . 4083 1 633 . 1 1 57 57 TRP CD1 C 13 126.6 . . 1 . . . . . . . . 4083 1 634 . 1 1 57 57 TRP CD2 C 13 126.6 . . 1 . . . . . . . . 4083 1 635 . 1 1 57 57 TRP CE2 C 13 118.5 . . 1 . . . . . . . . 4083 1 636 . 1 1 57 57 TRP CZ2 C 13 114.7 . . 1 . . . . . . . . 4083 1 637 . 1 1 57 57 TRP CZ3 C 13 120.0 . . 1 . . . . . . . . 4083 1 638 . 1 1 57 57 TRP CH2 C 13 124.2 . . 1 . . . . . . . . 4083 1 639 . 1 1 57 57 TRP NE1 N 15 129.4 . . 1 . . . . . . . . 4083 1 640 . 1 1 58 58 ASN H H 1 8.14 . . 1 . . . . . . . . 4083 1 641 . 1 1 58 58 ASN HA H 1 5.12 . . 1 . . . . . . . . 4083 1 642 . 1 1 58 58 ASN HB2 H 1 2.86 . . 1 . . . . . . . . 4083 1 643 . 1 1 58 58 ASN HB3 H 1 2.86 . . 1 . . . . . . . . 4083 1 644 . 1 1 58 58 ASN CA C 13 54.7 . . 1 . . . . . . . . 4083 1 645 . 1 1 58 58 ASN N N 15 115.0 . . 1 . . . . . . . . 4083 1 646 . 1 1 59 59 MET H H 1 7.36 . . 1 . . . . . . . . 4083 1 647 . 1 1 59 59 MET HA H 1 4.80 . . 1 . . . . . . . . 4083 1 648 . 1 1 59 59 MET HB2 H 1 2.20 . . 2 . . . . . . . . 4083 1 649 . 1 1 59 59 MET HB3 H 1 2.07 . . 2 . . . . . . . . 4083 1 650 . 1 1 59 59 MET CA C 13 53.8 . . 1 . . . . . . . . 4083 1 651 . 1 1 59 59 MET CB C 13 34.3 . . 1 . . . . . . . . 4083 1 652 . 1 1 59 59 MET N N 15 122.5 . . 1 . . . . . . . . 4083 1 653 . 1 1 60 60 PRO HA H 1 4.42 . . 1 . . . . . . . . 4083 1 654 . 1 1 60 60 PRO HB2 H 1 1.94 . . 1 . . . . . . . . 4083 1 655 . 1 1 60 60 PRO HB3 H 1 1.94 . . 1 . . . . . . . . 4083 1 656 . 1 1 60 60 PRO HG2 H 1 2.14 . . 1 . . . . . . . . 4083 1 657 . 1 1 60 60 PRO HG3 H 1 2.14 . . 1 . . . . . . . . 4083 1 658 . 1 1 60 60 PRO HD2 H 1 3.80 . . 2 . . . . . . . . 4083 1 659 . 1 1 60 60 PRO HD3 H 1 3.64 . . 2 . . . . . . . . 4083 1 660 . 1 1 60 60 PRO CA C 13 62.1 . . 1 . . . . . . . . 4083 1 661 . 1 1 60 60 PRO CB C 13 32.7 . . 1 . . . . . . . . 4083 1 662 . 1 1 60 60 PRO CG C 13 26.8 . . 1 . . . . . . . . 4083 1 663 . 1 1 60 60 PRO CD C 13 50.2 . . 1 . . . . . . . . 4083 1 664 . 1 1 61 61 ASN H H 1 8.62 . . 1 . . . . . . . . 4083 1 665 . 1 1 61 61 ASN HA H 1 4.05 . . 1 . . . . . . . . 4083 1 666 . 1 1 61 61 ASN HB2 H 1 3.28 . . 2 . . . . . . . . 4083 1 667 . 1 1 61 61 ASN HB3 H 1 2.65 . . 2 . . . . . . . . 4083 1 668 . 1 1 61 61 ASN HD21 H 1 7.91 . . 2 . . . . . . . . 4083 1 669 . 1 1 61 61 ASN HD22 H 1 7.02 . . 2 . . . . . . . . 4083 1 670 . 1 1 61 61 ASN CA C 13 59.0 . . 1 . . . . . . . . 4083 1 671 . 1 1 61 61 ASN CB C 13 37.5 . . 1 . . . . . . . . 4083 1 672 . 1 1 61 61 ASN N N 15 110.6 . . 1 . . . . . . . . 4083 1 673 . 1 1 61 61 ASN ND2 N 15 115.1 . . 1 . . . . . . . . 4083 1 674 . 1 1 62 62 MET H H 1 9.27 . . 1 . . . . . . . . 4083 1 675 . 1 1 62 62 MET HA H 1 4.21 . . 1 . . . . . . . . 4083 1 676 . 1 1 62 62 MET HB2 H 1 2.19 . . 1 . . . . . . . . 4083 1 677 . 1 1 62 62 MET HB3 H 1 2.19 . . 1 . . . . . . . . 4083 1 678 . 1 1 62 62 MET HE1 H 1 2.41 . . 1 . . . . . . . . 4083 1 679 . 1 1 62 62 MET HE2 H 1 2.41 . . 1 . . . . . . . . 4083 1 680 . 1 1 62 62 MET HE3 H 1 2.41 . . 1 . . . . . . . . 4083 1 681 . 1 1 62 62 MET CA C 13 56.9 . . 1 . . . . . . . . 4083 1 682 . 1 1 62 62 MET CB C 13 35.5 . . 1 . . . . . . . . 4083 1 683 . 1 1 62 62 MET CG C 13 31.0 . . 1 . . . . . . . . 4083 1 684 . 1 1 62 62 MET N N 15 121.7 . . 1 . . . . . . . . 4083 1 685 . 1 1 63 63 ASP H H 1 8.60 . . 1 . . . . . . . . 4083 1 686 . 1 1 63 63 ASP HA H 1 4.49 . . 1 . . . . . . . . 4083 1 687 . 1 1 63 63 ASP HB2 H 1 3.72 . . 2 . . . . . . . . 4083 1 688 . 1 1 63 63 ASP HB3 H 1 2.92 . . 2 . . . . . . . . 4083 1 689 . 1 1 63 63 ASP CA C 13 53.0 . . 1 . . . . . . . . 4083 1 690 . 1 1 63 63 ASP CB C 13 40.5 . . 1 . . . . . . . . 4083 1 691 . 1 1 63 63 ASP N N 15 125.8 . . 1 . . . . . . . . 4083 1 692 . 1 1 64 64 GLY H H 1 8.63 . . 1 . . . . . . . . 4083 1 693 . 1 1 64 64 GLY HA2 H 1 3.99 . . 2 . . . . . . . . 4083 1 694 . 1 1 64 64 GLY HA3 H 1 3.48 . . 2 . . . . . . . . 4083 1 695 . 1 1 64 64 GLY CA C 13 47.2 . . 1 . . . . . . . . 4083 1 696 . 1 1 64 64 GLY N N 15 102.1 . . 1 . . . . . . . . 4083 1 697 . 1 1 65 65 LEU H H 1 7.56 . . 1 . . . . . . . . 4083 1 698 . 1 1 65 65 LEU HA H 1 3.74 . . 1 . . . . . . . . 4083 1 699 . 1 1 65 65 LEU HB2 H 1 1.49 . . 2 . . . . . . . . 4083 1 700 . 1 1 65 65 LEU HB3 H 1 0.86 . . 2 . . . . . . . . 4083 1 701 . 1 1 65 65 LEU HG H 1 1.16 . . 1 . . . . . . . . 4083 1 702 . 1 1 65 65 LEU HD11 H 1 0.73 . . 1 . . . . . . . . 4083 1 703 . 1 1 65 65 LEU HD12 H 1 0.73 . . 1 . . . . . . . . 4083 1 704 . 1 1 65 65 LEU HD13 H 1 0.73 . . 1 . . . . . . . . 4083 1 705 . 1 1 65 65 LEU HD21 H 1 0.73 . . 1 . . . . . . . . 4083 1 706 . 1 1 65 65 LEU HD22 H 1 0.73 . . 1 . . . . . . . . 4083 1 707 . 1 1 65 65 LEU HD23 H 1 0.73 . . 1 . . . . . . . . 4083 1 708 . 1 1 65 65 LEU CA C 13 56.9 . . 1 . . . . . . . . 4083 1 709 . 1 1 65 65 LEU CB C 13 40.5 . . 1 . . . . . . . . 4083 1 710 . 1 1 65 65 LEU CG C 13 26.8 . . 1 . . . . . . . . 4083 1 711 . 1 1 65 65 LEU CD1 C 13 24.3 . . 1 . . . . . . . . 4083 1 712 . 1 1 65 65 LEU CD2 C 13 24.3 . . 1 . . . . . . . . 4083 1 713 . 1 1 65 65 LEU N N 15 120.5 . . 1 . . . . . . . . 4083 1 714 . 1 1 66 66 GLU H H 1 8.19 . . 1 . . . . . . . . 4083 1 715 . 1 1 66 66 GLU HA H 1 3.84 . . 1 . . . . . . . . 4083 1 716 . 1 1 66 66 GLU HB2 H 1 1.97 . . 2 . . . . . . . . 4083 1 717 . 1 1 66 66 GLU HB3 H 1 1.86 . . 2 . . . . . . . . 4083 1 718 . 1 1 66 66 GLU HG2 H 1 2.31 . . 1 . . . . . . . . 4083 1 719 . 1 1 66 66 GLU HG3 H 1 2.31 . . 1 . . . . . . . . 4083 1 720 . 1 1 66 66 GLU CA C 13 58.9 . . 1 . . . . . . . . 4083 1 721 . 1 1 66 66 GLU CB C 13 28.9 . . 1 . . . . . . . . 4083 1 722 . 1 1 66 66 GLU CG C 13 36.0 . . 1 . . . . . . . . 4083 1 723 . 1 1 66 66 GLU N N 15 118.5 . . 1 . . . . . . . . 4083 1 724 . 1 1 67 67 LEU H H 1 8.32 . . 1 . . . . . . . . 4083 1 725 . 1 1 67 67 LEU HA H 1 4.09 . . 1 . . . . . . . . 4083 1 726 . 1 1 67 67 LEU HB2 H 1 2.07 . . 2 . . . . . . . . 4083 1 727 . 1 1 67 67 LEU HB3 H 1 1.15 . . 2 . . . . . . . . 4083 1 728 . 1 1 67 67 LEU HG H 1 1.35 . . 1 . . . . . . . . 4083 1 729 . 1 1 67 67 LEU HD11 H 1 0.78 . . 2 . . . . . . . . 4083 1 730 . 1 1 67 67 LEU HD12 H 1 0.78 . . 2 . . . . . . . . 4083 1 731 . 1 1 67 67 LEU HD13 H 1 0.78 . . 2 . . . . . . . . 4083 1 732 . 1 1 67 67 LEU HD21 H 1 0.90 . . 2 . . . . . . . . 4083 1 733 . 1 1 67 67 LEU HD22 H 1 0.90 . . 2 . . . . . . . . 4083 1 734 . 1 1 67 67 LEU HD23 H 1 0.90 . . 2 . . . . . . . . 4083 1 735 . 1 1 67 67 LEU CA C 13 58.6 . . 1 . . . . . . . . 4083 1 736 . 1 1 67 67 LEU CB C 13 41.0 . . 1 . . . . . . . . 4083 1 737 . 1 1 67 67 LEU CG C 13 26.7 . . 1 . . . . . . . . 4083 1 738 . 1 1 67 67 LEU CD1 C 13 25.9 . . 2 . . . . . . . . 4083 1 739 . 1 1 67 67 LEU CD2 C 13 22.4 . . 2 . . . . . . . . 4083 1 740 . 1 1 67 67 LEU N N 15 122.4 . . 1 . . . . . . . . 4083 1 741 . 1 1 68 68 LEU H H 1 8.20 . . 1 . . . . . . . . 4083 1 742 . 1 1 68 68 LEU HA H 1 3.78 . . 1 . . . . . . . . 4083 1 743 . 1 1 68 68 LEU HB2 H 1 2.11 . . 2 . . . . . . . . 4083 1 744 . 1 1 68 68 LEU HB3 H 1 1.60 . . 2 . . . . . . . . 4083 1 745 . 1 1 68 68 LEU HD11 H 1 0.83 . . 2 . . . . . . . . 4083 1 746 . 1 1 68 68 LEU HD12 H 1 0.83 . . 2 . . . . . . . . 4083 1 747 . 1 1 68 68 LEU HD13 H 1 0.83 . . 2 . . . . . . . . 4083 1 748 . 1 1 68 68 LEU HD21 H 1 0.65 . . 2 . . . . . . . . 4083 1 749 . 1 1 68 68 LEU HD22 H 1 0.65 . . 2 . . . . . . . . 4083 1 750 . 1 1 68 68 LEU HD23 H 1 0.65 . . 2 . . . . . . . . 4083 1 751 . 1 1 68 68 LEU CA C 13 58.3 . . 1 . . . . . . . . 4083 1 752 . 1 1 68 68 LEU CB C 13 41.0 . . 1 . . . . . . . . 4083 1 753 . 1 1 68 68 LEU CD1 C 13 27.5 . . 2 . . . . . . . . 4083 1 754 . 1 1 68 68 LEU CD2 C 13 22.2 . . 2 . . . . . . . . 4083 1 755 . 1 1 68 68 LEU N N 15 119.4 . . 1 . . . . . . . . 4083 1 756 . 1 1 69 69 LYS H H 1 8.36 . . 1 . . . . . . . . 4083 1 757 . 1 1 69 69 LYS HA H 1 3.80 . . 1 . . . . . . . . 4083 1 758 . 1 1 69 69 LYS HB2 H 1 1.86 . . 2 . . . . . . . . 4083 1 759 . 1 1 69 69 LYS HB3 H 1 1.77 . . 2 . . . . . . . . 4083 1 760 . 1 1 69 69 LYS HG2 H 1 1.41 . . 1 . . . . . . . . 4083 1 761 . 1 1 69 69 LYS HG3 H 1 1.41 . . 1 . . . . . . . . 4083 1 762 . 1 1 69 69 LYS HD2 H 1 1.67 . . 1 . . . . . . . . 4083 1 763 . 1 1 69 69 LYS HD3 H 1 1.67 . . 1 . . . . . . . . 4083 1 764 . 1 1 69 69 LYS HE2 H 1 2.96 . . 1 . . . . . . . . 4083 1 765 . 1 1 69 69 LYS HE3 H 1 2.96 . . 1 . . . . . . . . 4083 1 766 . 1 1 69 69 LYS CA C 13 59.8 . . 1 . . . . . . . . 4083 1 767 . 1 1 69 69 LYS CB C 13 32.0 . . 1 . . . . . . . . 4083 1 768 . 1 1 69 69 LYS CG C 13 24.5 . . 1 . . . . . . . . 4083 1 769 . 1 1 69 69 LYS CD C 13 29.0 . . 1 . . . . . . . . 4083 1 770 . 1 1 69 69 LYS CE C 13 41.7 . . 1 . . . . . . . . 4083 1 771 . 1 1 69 69 LYS N N 15 114.7 . . 1 . . . . . . . . 4083 1 772 . 1 1 70 70 THR H H 1 8.00 . . 1 . . . . . . . . 4083 1 773 . 1 1 70 70 THR HA H 1 3.81 . . 1 . . . . . . . . 4083 1 774 . 1 1 70 70 THR HB H 1 4.35 . . 1 . . . . . . . . 4083 1 775 . 1 1 70 70 THR HG21 H 1 1.20 . . 1 . . . . . . . . 4083 1 776 . 1 1 70 70 THR HG22 H 1 1.20 . . 1 . . . . . . . . 4083 1 777 . 1 1 70 70 THR HG23 H 1 1.20 . . 1 . . . . . . . . 4083 1 778 . 1 1 70 70 THR CA C 13 67.1 . . 1 . . . . . . . . 4083 1 779 . 1 1 70 70 THR CB C 13 68.1 . . 1 . . . . . . . . 4083 1 780 . 1 1 70 70 THR CG2 C 13 22.2 . . 1 . . . . . . . . 4083 1 781 . 1 1 70 70 THR N N 15 116.0 . . 1 . . . . . . . . 4083 1 782 . 1 1 71 71 ILE H H 1 8.45 . . 1 . . . . . . . . 4083 1 783 . 1 1 71 71 ILE HA H 1 3.39 . . 1 . . . . . . . . 4083 1 784 . 1 1 71 71 ILE HB H 1 1.88 . . 1 . . . . . . . . 4083 1 785 . 1 1 71 71 ILE HG12 H 1 1.68 . . 2 . . . . . . . . 4083 1 786 . 1 1 71 71 ILE HG13 H 1 0.81 . . 2 . . . . . . . . 4083 1 787 . 1 1 71 71 ILE HG21 H 1 0.74 . . 1 . . . . . . . . 4083 1 788 . 1 1 71 71 ILE HG22 H 1 0.74 . . 1 . . . . . . . . 4083 1 789 . 1 1 71 71 ILE HG23 H 1 0.74 . . 1 . . . . . . . . 4083 1 790 . 1 1 71 71 ILE HD11 H 1 0.56 . . 1 . . . . . . . . 4083 1 791 . 1 1 71 71 ILE HD12 H 1 0.56 . . 1 . . . . . . . . 4083 1 792 . 1 1 71 71 ILE HD13 H 1 0.56 . . 1 . . . . . . . . 4083 1 793 . 1 1 71 71 ILE CA C 13 65.7 . . 1 . . . . . . . . 4083 1 794 . 1 1 71 71 ILE CB C 13 38.6 . . 1 . . . . . . . . 4083 1 795 . 1 1 71 71 ILE CG1 C 13 29.3 . . 1 . . . . . . . . 4083 1 796 . 1 1 71 71 ILE CG2 C 13 17.1 . . 1 . . . . . . . . 4083 1 797 . 1 1 71 71 ILE CD1 C 13 14.5 . . 1 . . . . . . . . 4083 1 798 . 1 1 71 71 ILE N N 15 122.2 . . 1 . . . . . . . . 4083 1 799 . 1 1 72 72 ARG H H 1 8.12 . . 1 . . . . . . . . 4083 1 800 . 1 1 72 72 ARG HA H 1 4.01 . . 1 . . . . . . . . 4083 1 801 . 1 1 72 72 ARG HB2 H 1 1.98 . . 2 . . . . . . . . 4083 1 802 . 1 1 72 72 ARG HB3 H 1 1.64 . . 2 . . . . . . . . 4083 1 803 . 1 1 72 72 ARG CA C 13 57.0 . . 1 . . . . . . . . 4083 1 804 . 1 1 72 72 ARG CB C 13 29.0 . . 1 . . . . . . . . 4083 1 805 . 1 1 72 72 ARG N N 15 112.0 . . 1 . . . . . . . . 4083 1 806 . 1 1 73 73 ALA H H 1 7.28 . . 1 . . . . . . . . 4083 1 807 . 1 1 73 73 ALA HA H 1 4.34 . . 1 . . . . . . . . 4083 1 808 . 1 1 73 73 ALA HB1 H 1 1.42 . . 1 . . . . . . . . 4083 1 809 . 1 1 73 73 ALA HB2 H 1 1.42 . . 1 . . . . . . . . 4083 1 810 . 1 1 73 73 ALA HB3 H 1 1.42 . . 1 . . . . . . . . 4083 1 811 . 1 1 73 73 ALA CA C 13 51.7 . . 1 . . . . . . . . 4083 1 812 . 1 1 73 73 ALA CB C 13 19.1 . . 1 . . . . . . . . 4083 1 813 . 1 1 73 73 ALA N N 15 117.6 . . 1 . . . . . . . . 4083 1 814 . 1 1 74 74 ASP H H 1 7.40 . . 1 . . . . . . . . 4083 1 815 . 1 1 74 74 ASP HA H 1 4.58 . . 1 . . . . . . . . 4083 1 816 . 1 1 74 74 ASP HB2 H 1 2.90 . . 1 . . . . . . . . 4083 1 817 . 1 1 74 74 ASP HB3 H 1 2.60 . . 1 . . . . . . . . 4083 1 818 . 1 1 74 74 ASP CA C 13 53.8 . . 1 . . . . . . . . 4083 1 819 . 1 1 74 74 ASP CB C 13 43.8 . . 1 . . . . . . . . 4083 1 820 . 1 1 74 74 ASP N N 15 120.4 . . 1 . . . . . . . . 4083 1 821 . 1 1 75 75 GLY H H 1 8.74 . . 1 . . . . . . . . 4083 1 822 . 1 1 75 75 GLY HA2 H 1 3.90 . . 1 . . . . . . . . 4083 1 823 . 1 1 75 75 GLY HA3 H 1 3.90 . . 1 . . . . . . . . 4083 1 824 . 1 1 75 75 GLY CA C 13 47.2 . . 1 . . . . . . . . 4083 1 825 . 1 1 75 75 GLY N N 15 111.1 . . 1 . . . . . . . . 4083 1 826 . 1 1 76 76 ALA H H 1 8.57 . . 1 . . . . . . . . 4083 1 827 . 1 1 76 76 ALA HA H 1 4.50 . . 1 . . . . . . . . 4083 1 828 . 1 1 76 76 ALA HB1 H 1 1.49 . . 1 . . . . . . . . 4083 1 829 . 1 1 76 76 ALA HB2 H 1 1.49 . . 1 . . . . . . . . 4083 1 830 . 1 1 76 76 ALA HB3 H 1 1.49 . . 1 . . . . . . . . 4083 1 831 . 1 1 76 76 ALA CA C 13 53.3 . . 1 . . . . . . . . 4083 1 832 . 1 1 76 76 ALA CB C 13 19.4 . . 1 . . . . . . . . 4083 1 833 . 1 1 76 76 ALA N N 15 120.5 . . 1 . . . . . . . . 4083 1 834 . 1 1 77 77 MET H H 1 8.48 . . 1 . . . . . . . . 4083 1 835 . 1 1 77 77 MET HA H 1 4.59 . . 1 . . . . . . . . 4083 1 836 . 1 1 77 77 MET HB2 H 1 2.23 . . 2 . . . . . . . . 4083 1 837 . 1 1 77 77 MET HB3 H 1 2.13 . . 2 . . . . . . . . 4083 1 838 . 1 1 77 77 MET HG2 H 1 2.62 . . 2 . . . . . . . . 4083 1 839 . 1 1 77 77 MET HG3 H 1 2.39 . . 2 . . . . . . . . 4083 1 840 . 1 1 77 77 MET CA C 13 55.8 . . 1 . . . . . . . . 4083 1 841 . 1 1 77 77 MET CB C 13 34.2 . . 1 . . . . . . . . 4083 1 842 . 1 1 77 77 MET CG C 13 34.0 . . 1 . . . . . . . . 4083 1 843 . 1 1 77 77 MET N N 15 114.7 . . 1 . . . . . . . . 4083 1 844 . 1 1 78 78 SER H H 1 7.45 . . 1 . . . . . . . . 4083 1 845 . 1 1 78 78 SER HA H 1 4.38 . . 1 . . . . . . . . 4083 1 846 . 1 1 78 78 SER HB2 H 1 4.07 . . 2 . . . . . . . . 4083 1 847 . 1 1 78 78 SER HB3 H 1 3.98 . . 2 . . . . . . . . 4083 1 848 . 1 1 78 78 SER CA C 13 61.8 . . 1 . . . . . . . . 4083 1 849 . 1 1 78 78 SER CB C 13 63.3 . . 1 . . . . . . . . 4083 1 850 . 1 1 78 78 SER N N 15 111.3 . . 1 . . . . . . . . 4083 1 851 . 1 1 79 79 ALA H H 1 8.20 . . 1 . . . . . . . . 4083 1 852 . 1 1 79 79 ALA HA H 1 4.45 . . 1 . . . . . . . . 4083 1 853 . 1 1 79 79 ALA HB1 H 1 1.33 . . 1 . . . . . . . . 4083 1 854 . 1 1 79 79 ALA HB2 H 1 1.33 . . 1 . . . . . . . . 4083 1 855 . 1 1 79 79 ALA HB3 H 1 1.33 . . 1 . . . . . . . . 4083 1 856 . 1 1 79 79 ALA CA C 13 50.9 . . 1 . . . . . . . . 4083 1 857 . 1 1 79 79 ALA CB C 13 18.7 . . 1 . . . . . . . . 4083 1 858 . 1 1 79 79 ALA N N 15 121.8 . . 1 . . . . . . . . 4083 1 859 . 1 1 80 80 LEU H H 1 7.83 . . 1 . . . . . . . . 4083 1 860 . 1 1 80 80 LEU HA H 1 4.16 . . 1 . . . . . . . . 4083 1 861 . 1 1 80 80 LEU HB2 H 1 1.54 . . 2 . . . . . . . . 4083 1 862 . 1 1 80 80 LEU HB3 H 1 1.29 . . 2 . . . . . . . . 4083 1 863 . 1 1 80 80 LEU HG H 1 1.54 . . 1 . . . . . . . . 4083 1 864 . 1 1 80 80 LEU HD11 H 1 0.71 . . 1 . . . . . . . . 4083 1 865 . 1 1 80 80 LEU HD12 H 1 0.71 . . 1 . . . . . . . . 4083 1 866 . 1 1 80 80 LEU HD13 H 1 0.71 . . 1 . . . . . . . . 4083 1 867 . 1 1 80 80 LEU HD21 H 1 0.71 . . 1 . . . . . . . . 4083 1 868 . 1 1 80 80 LEU HD22 H 1 0.71 . . 1 . . . . . . . . 4083 1 869 . 1 1 80 80 LEU HD23 H 1 0.71 . . 1 . . . . . . . . 4083 1 870 . 1 1 80 80 LEU CA C 13 53.6 . . 1 . . . . . . . . 4083 1 871 . 1 1 80 80 LEU CB C 13 42.8 . . 1 . . . . . . . . 4083 1 872 . 1 1 80 80 LEU CG C 13 26.5 . . 1 . . . . . . . . 4083 1 873 . 1 1 80 80 LEU CD1 C 13 25.0 . . 1 . . . . . . . . 4083 1 874 . 1 1 80 80 LEU CD2 C 13 25.0 . . 1 . . . . . . . . 4083 1 875 . 1 1 80 80 LEU N N 15 122.6 . . 1 . . . . . . . . 4083 1 876 . 1 1 81 81 PRO HA H 1 4.01 . . 1 . . . . . . . . 4083 1 877 . 1 1 81 81 PRO HB2 H 1 1.39 . . 2 . . . . . . . . 4083 1 878 . 1 1 81 81 PRO HB3 H 1 0.42 . . 2 . . . . . . . . 4083 1 879 . 1 1 81 81 PRO HG2 H 1 1.86 . . 2 . . . . . . . . 4083 1 880 . 1 1 81 81 PRO HG3 H 1 1.68 . . 2 . . . . . . . . 4083 1 881 . 1 1 81 81 PRO HD2 H 1 3.88 . . 2 . . . . . . . . 4083 1 882 . 1 1 81 81 PRO HD3 H 1 3.56 . . 2 . . . . . . . . 4083 1 883 . 1 1 81 81 PRO CA C 13 62.3 . . 1 . . . . . . . . 4083 1 884 . 1 1 81 81 PRO CB C 13 31.4 . . 1 . . . . . . . . 4083 1 885 . 1 1 81 81 PRO CG C 13 27.8 . . 1 . . . . . . . . 4083 1 886 . 1 1 81 81 PRO CD C 13 51.1 . . 1 . . . . . . . . 4083 1 887 . 1 1 82 82 VAL H H 1 7.68 . . 1 . . . . . . . . 4083 1 888 . 1 1 82 82 VAL HA H 1 4.79 . . 1 . . . . . . . . 4083 1 889 . 1 1 82 82 VAL HB H 1 1.68 . . 1 . . . . . . . . 4083 1 890 . 1 1 82 82 VAL HG11 H 1 0.68 . . 1 . . . . . . . . 4083 1 891 . 1 1 82 82 VAL HG12 H 1 0.68 . . 1 . . . . . . . . 4083 1 892 . 1 1 82 82 VAL HG13 H 1 0.68 . . 1 . . . . . . . . 4083 1 893 . 1 1 82 82 VAL HG21 H 1 0.68 . . 1 . . . . . . . . 4083 1 894 . 1 1 82 82 VAL HG22 H 1 0.68 . . 1 . . . . . . . . 4083 1 895 . 1 1 82 82 VAL HG23 H 1 0.68 . . 1 . . . . . . . . 4083 1 896 . 1 1 82 82 VAL CA C 13 60.2 . . 1 . . . . . . . . 4083 1 897 . 1 1 82 82 VAL CB C 13 35.9 . . 1 . . . . . . . . 4083 1 898 . 1 1 82 82 VAL CG1 C 13 20.5 . . 1 . . . . . . . . 4083 1 899 . 1 1 82 82 VAL CG2 C 13 20.5 . . 1 . . . . . . . . 4083 1 900 . 1 1 82 82 VAL N N 15 117.5 . . 1 . . . . . . . . 4083 1 901 . 1 1 83 83 LEU H H 1 9.10 . . 1 . . . . . . . . 4083 1 902 . 1 1 83 83 LEU HA H 1 4.55 . . 1 . . . . . . . . 4083 1 903 . 1 1 83 83 LEU HB2 H 1 2.11 . . 2 . . . . . . . . 4083 1 904 . 1 1 83 83 LEU HB3 H 1 1.15 . . 2 . . . . . . . . 4083 1 905 . 1 1 83 83 LEU HG H 1 1.31 . . 1 . . . . . . . . 4083 1 906 . 1 1 83 83 LEU HD11 H 1 0.51 . . 1 . . . . . . . . 4083 1 907 . 1 1 83 83 LEU HD12 H 1 0.51 . . 1 . . . . . . . . 4083 1 908 . 1 1 83 83 LEU HD13 H 1 0.51 . . 1 . . . . . . . . 4083 1 909 . 1 1 83 83 LEU HD21 H 1 0.51 . . 1 . . . . . . . . 4083 1 910 . 1 1 83 83 LEU HD22 H 1 0.51 . . 1 . . . . . . . . 4083 1 911 . 1 1 83 83 LEU HD23 H 1 0.51 . . 1 . . . . . . . . 4083 1 912 . 1 1 83 83 LEU CA C 13 52.5 . . 1 . . . . . . . . 4083 1 913 . 1 1 83 83 LEU CB C 13 45.4 . . 1 . . . . . . . . 4083 1 914 . 1 1 83 83 LEU CG C 13 26.7 . . 1 . . . . . . . . 4083 1 915 . 1 1 83 83 LEU CD1 C 13 25.8 . . 1 . . . . . . . . 4083 1 916 . 1 1 83 83 LEU CD2 C 13 25.8 . . 1 . . . . . . . . 4083 1 917 . 1 1 83 83 LEU N N 15 129.0 . . 1 . . . . . . . . 4083 1 918 . 1 1 84 84 MET H H 1 8.09 . . 1 . . . . . . . . 4083 1 919 . 1 1 84 84 MET HA H 1 5.53 . . 1 . . . . . . . . 4083 1 920 . 1 1 84 84 MET HB2 H 1 2.14 . . 2 . . . . . . . . 4083 1 921 . 1 1 84 84 MET HB3 H 1 2.06 . . 2 . . . . . . . . 4083 1 922 . 1 1 84 84 MET HG2 H 1 2.45 . . 1 . . . . . . . . 4083 1 923 . 1 1 84 84 MET HG3 H 1 2.45 . . 1 . . . . . . . . 4083 1 924 . 1 1 84 84 MET CA C 13 52.7 . . 1 . . . . . . . . 4083 1 925 . 1 1 84 84 MET CB C 13 31.9 . . 1 . . . . . . . . 4083 1 926 . 1 1 84 84 MET CG C 13 31.9 . . 1 . . . . . . . . 4083 1 927 . 1 1 84 84 MET N N 15 123.4 . . 1 . . . . . . . . 4083 1 928 . 1 1 85 85 VAL H H 1 9.11 . . 1 . . . . . . . . 4083 1 929 . 1 1 85 85 VAL HA H 1 4.99 . . 1 . . . . . . . . 4083 1 930 . 1 1 85 85 VAL HB H 1 2.14 . . 1 . . . . . . . . 4083 1 931 . 1 1 85 85 VAL HG11 H 1 1.11 . . 2 . . . . . . . . 4083 1 932 . 1 1 85 85 VAL HG12 H 1 1.11 . . 2 . . . . . . . . 4083 1 933 . 1 1 85 85 VAL HG13 H 1 1.11 . . 2 . . . . . . . . 4083 1 934 . 1 1 85 85 VAL HG21 H 1 0.82 . . 2 . . . . . . . . 4083 1 935 . 1 1 85 85 VAL HG22 H 1 0.82 . . 2 . . . . . . . . 4083 1 936 . 1 1 85 85 VAL HG23 H 1 0.82 . . 2 . . . . . . . . 4083 1 937 . 1 1 85 85 VAL CA C 13 60.9 . . 1 . . . . . . . . 4083 1 938 . 1 1 85 85 VAL CB C 13 33.0 . . 1 . . . . . . . . 4083 1 939 . 1 1 85 85 VAL CG1 C 13 22.7 . . 2 . . . . . . . . 4083 1 940 . 1 1 85 85 VAL CG2 C 13 20.3 . . 2 . . . . . . . . 4083 1 941 . 1 1 85 85 VAL N N 15 122.4 . . 1 . . . . . . . . 4083 1 942 . 1 1 86 86 THR H H 1 8.50 . . 1 . . . . . . . . 4083 1 943 . 1 1 86 86 THR HA H 1 5.10 . . 1 . . . . . . . . 4083 1 944 . 1 1 86 86 THR HB H 1 4.07 . . 1 . . . . . . . . 4083 1 945 . 1 1 86 86 THR HG21 H 1 0.92 . . 1 . . . . . . . . 4083 1 946 . 1 1 86 86 THR HG22 H 1 0.92 . . 1 . . . . . . . . 4083 1 947 . 1 1 86 86 THR HG23 H 1 0.92 . . 1 . . . . . . . . 4083 1 948 . 1 1 86 86 THR CA C 13 58.6 . . 1 . . . . . . . . 4083 1 949 . 1 1 86 86 THR CB C 13 70.4 . . 1 . . . . . . . . 4083 1 950 . 1 1 86 86 THR CG2 C 13 19.4 . . 1 . . . . . . . . 4083 1 951 . 1 1 86 86 THR N N 15 115.2 . . 1 . . . . . . . . 4083 1 952 . 1 1 87 87 ALA H H 1 8.81 . . 1 . . . . . . . . 4083 1 953 . 1 1 87 87 ALA HA H 1 4.63 . . 1 . . . . . . . . 4083 1 954 . 1 1 87 87 ALA HB1 H 1 1.53 . . 1 . . . . . . . . 4083 1 955 . 1 1 87 87 ALA HB2 H 1 1.53 . . 1 . . . . . . . . 4083 1 956 . 1 1 87 87 ALA HB3 H 1 1.53 . . 1 . . . . . . . . 4083 1 957 . 1 1 87 87 ALA CA C 13 52.5 . . 1 . . . . . . . . 4083 1 958 . 1 1 87 87 ALA CB C 13 19.7 . . 1 . . . . . . . . 4083 1 959 . 1 1 87 87 ALA N N 15 124.8 . . 1 . . . . . . . . 4083 1 960 . 1 1 88 88 GLU H H 1 7.97 . . 1 . . . . . . . . 4083 1 961 . 1 1 88 88 GLU HA H 1 4.32 . . 1 . . . . . . . . 4083 1 962 . 1 1 88 88 GLU HB2 H 1 1.90 . . 1 . . . . . . . . 4083 1 963 . 1 1 88 88 GLU HB3 H 1 1.90 . . 1 . . . . . . . . 4083 1 964 . 1 1 88 88 GLU HG2 H 1 2.10 . . 1 . . . . . . . . 4083 1 965 . 1 1 88 88 GLU HG3 H 1 2.10 . . 1 . . . . . . . . 4083 1 966 . 1 1 88 88 GLU CA C 13 56.0 . . 1 . . . . . . . . 4083 1 967 . 1 1 88 88 GLU CB C 13 29.2 . . 1 . . . . . . . . 4083 1 968 . 1 1 88 88 GLU N N 15 115.3 . . 1 . . . . . . . . 4083 1 969 . 1 1 89 89 ALA HA H 1 4.21 . . 1 . . . . . . . . 4083 1 970 . 1 1 89 89 ALA HB1 H 1 1.28 . . 1 . . . . . . . . 4083 1 971 . 1 1 89 89 ALA HB2 H 1 1.28 . . 1 . . . . . . . . 4083 1 972 . 1 1 89 89 ALA HB3 H 1 1.28 . . 1 . . . . . . . . 4083 1 973 . 1 1 89 89 ALA CA C 13 51.3 . . 1 . . . . . . . . 4083 1 974 . 1 1 89 89 ALA CB C 13 17.4 . . 1 . . . . . . . . 4083 1 975 . 1 1 90 90 LYS H H 1 7.38 . . 1 . . . . . . . . 4083 1 976 . 1 1 90 90 LYS HA H 1 4.40 . . 1 . . . . . . . . 4083 1 977 . 1 1 90 90 LYS HB2 H 1 1.78 . . 2 . . . . . . . . 4083 1 978 . 1 1 90 90 LYS HB3 H 1 1.55 . . 2 . . . . . . . . 4083 1 979 . 1 1 90 90 LYS HG2 H 1 1.30 . . 1 . . . . . . . . 4083 1 980 . 1 1 90 90 LYS HG3 H 1 1.30 . . 1 . . . . . . . . 4083 1 981 . 1 1 90 90 LYS HD2 H 1 1.60 . . 1 . . . . . . . . 4083 1 982 . 1 1 90 90 LYS HD3 H 1 1.60 . . 1 . . . . . . . . 4083 1 983 . 1 1 90 90 LYS HE2 H 1 2.90 . . 1 . . . . . . . . 4083 1 984 . 1 1 90 90 LYS HE3 H 1 2.90 . . 1 . . . . . . . . 4083 1 985 . 1 1 90 90 LYS CA C 13 55.1 . . 1 . . . . . . . . 4083 1 986 . 1 1 90 90 LYS CB C 13 33.0 . . 1 . . . . . . . . 4083 1 987 . 1 1 90 90 LYS CG C 13 24.8 . . 1 . . . . . . . . 4083 1 988 . 1 1 90 90 LYS CD C 13 28.9 . . 1 . . . . . . . . 4083 1 989 . 1 1 90 90 LYS CE C 13 41.7 . . 1 . . . . . . . . 4083 1 990 . 1 1 90 90 LYS N N 15 119.8 . . 1 . . . . . . . . 4083 1 991 . 1 1 91 91 LYS HA H 1 3.76 . . 1 . . . . . . . . 4083 1 992 . 1 1 91 91 LYS HB2 H 1 1.87 . . 2 . . . . . . . . 4083 1 993 . 1 1 91 91 LYS HB3 H 1 1.77 . . 2 . . . . . . . . 4083 1 994 . 1 1 91 91 LYS HG2 H 1 1.40 . . 1 . . . . . . . . 4083 1 995 . 1 1 91 91 LYS HG3 H 1 1.40 . . 1 . . . . . . . . 4083 1 996 . 1 1 91 91 LYS HD2 H 1 1.66 . . 1 . . . . . . . . 4083 1 997 . 1 1 91 91 LYS HD3 H 1 1.66 . . 1 . . . . . . . . 4083 1 998 . 1 1 91 91 LYS HE2 H 1 2.92 . . 1 . . . . . . . . 4083 1 999 . 1 1 91 91 LYS HE3 H 1 2.92 . . 1 . . . . . . . . 4083 1 1000 . 1 1 91 91 LYS CA C 13 59.8 . . 1 . . . . . . . . 4083 1 1001 . 1 1 91 91 LYS CB C 13 31.9 . . 1 . . . . . . . . 4083 1 1002 . 1 1 91 91 LYS CG C 13 24.5 . . 1 . . . . . . . . 4083 1 1003 . 1 1 91 91 LYS CD C 13 29.0 . . 1 . . . . . . . . 4083 1 1004 . 1 1 91 91 LYS CE C 13 41.8 . . 1 . . . . . . . . 4083 1 1005 . 1 1 92 92 GLU H H 1 9.59 . . 1 . . . . . . . . 4083 1 1006 . 1 1 92 92 GLU HA H 1 3.95 . . 1 . . . . . . . . 4083 1 1007 . 1 1 92 92 GLU HB2 H 1 1.93 . . 1 . . . . . . . . 4083 1 1008 . 1 1 92 92 GLU HB3 H 1 1.93 . . 1 . . . . . . . . 4083 1 1009 . 1 1 92 92 GLU HG2 H 1 2.27 . . 1 . . . . . . . . 4083 1 1010 . 1 1 92 92 GLU HG3 H 1 2.27 . . 1 . . . . . . . . 4083 1 1011 . 1 1 92 92 GLU CA C 13 59.8 . . 1 . . . . . . . . 4083 1 1012 . 1 1 92 92 GLU CB C 13 28.5 . . 1 . . . . . . . . 4083 1 1013 . 1 1 92 92 GLU CG C 13 36.3 . . 1 . . . . . . . . 4083 1 1014 . 1 1 92 92 GLU N N 15 114.9 . . 1 . . . . . . . . 4083 1 1015 . 1 1 93 93 ASN H H 1 7.23 . . 1 . . . . . . . . 4083 1 1016 . 1 1 93 93 ASN HA H 1 4.56 . . 1 . . . . . . . . 4083 1 1017 . 1 1 93 93 ASN HB2 H 1 2.56 . . 2 . . . . . . . . 4083 1 1018 . 1 1 93 93 ASN HB3 H 1 2.05 . . 2 . . . . . . . . 4083 1 1019 . 1 1 93 93 ASN HD21 H 1 7.30 . . 2 . . . . . . . . 4083 1 1020 . 1 1 93 93 ASN HD22 H 1 6.85 . . 2 . . . . . . . . 4083 1 1021 . 1 1 93 93 ASN CA C 13 54.7 . . 1 . . . . . . . . 4083 1 1022 . 1 1 93 93 ASN CB C 13 36.9 . . 1 . . . . . . . . 4083 1 1023 . 1 1 93 93 ASN N N 15 116.7 . . 1 . . . . . . . . 4083 1 1024 . 1 1 93 93 ASN ND2 N 15 109.4 . . 1 . . . . . . . . 4083 1 1025 . 1 1 94 94 ILE H H 1 7.44 . . 1 . . . . . . . . 4083 1 1026 . 1 1 94 94 ILE HA H 1 3.17 . . 1 . . . . . . . . 4083 1 1027 . 1 1 94 94 ILE HB H 1 1.67 . . 1 . . . . . . . . 4083 1 1028 . 1 1 94 94 ILE HG12 H 1 1.00 . . 2 . . . . . . . . 4083 1 1029 . 1 1 94 94 ILE HG13 H 1 0.26 . . 2 . . . . . . . . 4083 1 1030 . 1 1 94 94 ILE HG21 H 1 0.55 . . 1 . . . . . . . . 4083 1 1031 . 1 1 94 94 ILE HG22 H 1 0.55 . . 1 . . . . . . . . 4083 1 1032 . 1 1 94 94 ILE HG23 H 1 0.55 . . 1 . . . . . . . . 4083 1 1033 . 1 1 94 94 ILE HD11 H 1 0.38 . . 1 . . . . . . . . 4083 1 1034 . 1 1 94 94 ILE HD12 H 1 0.38 . . 1 . . . . . . . . 4083 1 1035 . 1 1 94 94 ILE HD13 H 1 0.38 . . 1 . . . . . . . . 4083 1 1036 . 1 1 94 94 ILE CA C 13 64.8 . . 1 . . . . . . . . 4083 1 1037 . 1 1 94 94 ILE CB C 13 37.3 . . 1 . . . . . . . . 4083 1 1038 . 1 1 94 94 ILE CG1 C 13 27.8 . . 1 . . . . . . . . 4083 1 1039 . 1 1 94 94 ILE CG2 C 13 16.7 . . 1 . . . . . . . . 4083 1 1040 . 1 1 94 94 ILE CD1 C 13 12.3 . . 1 . . . . . . . . 4083 1 1041 . 1 1 94 94 ILE N N 15 120.3 . . 1 . . . . . . . . 4083 1 1042 . 1 1 95 95 ILE H H 1 7.96 . . 1 . . . . . . . . 4083 1 1043 . 1 1 95 95 ILE HA H 1 3.79 . . 1 . . . . . . . . 4083 1 1044 . 1 1 95 95 ILE HB H 1 1.67 . . 1 . . . . . . . . 4083 1 1045 . 1 1 95 95 ILE HG12 H 1 1.59 . . 2 . . . . . . . . 4083 1 1046 . 1 1 95 95 ILE HG13 H 1 1.17 . . 2 . . . . . . . . 4083 1 1047 . 1 1 95 95 ILE HG21 H 1 0.90 . . 1 . . . . . . . . 4083 1 1048 . 1 1 95 95 ILE HG22 H 1 0.90 . . 1 . . . . . . . . 4083 1 1049 . 1 1 95 95 ILE HG23 H 1 0.90 . . 1 . . . . . . . . 4083 1 1050 . 1 1 95 95 ILE HD11 H 1 0.81 . . 1 . . . . . . . . 4083 1 1051 . 1 1 95 95 ILE HD12 H 1 0.81 . . 1 . . . . . . . . 4083 1 1052 . 1 1 95 95 ILE HD13 H 1 0.81 . . 1 . . . . . . . . 4083 1 1053 . 1 1 95 95 ILE CA C 13 64.3 . . 1 . . . . . . . . 4083 1 1054 . 1 1 95 95 ILE CB C 13 37.6 . . 1 . . . . . . . . 4083 1 1055 . 1 1 95 95 ILE CG1 C 13 28.6 . . 1 . . . . . . . . 4083 1 1056 . 1 1 95 95 ILE CG2 C 13 16.8 . . 1 . . . . . . . . 4083 1 1057 . 1 1 95 95 ILE CD1 C 13 12.8 . . 1 . . . . . . . . 4083 1 1058 . 1 1 95 95 ILE N N 15 118.3 . . 1 . . . . . . . . 4083 1 1059 . 1 1 96 96 ALA H H 1 7.64 . . 1 . . . . . . . . 4083 1 1060 . 1 1 96 96 ALA HA H 1 4.21 . . 1 . . . . . . . . 4083 1 1061 . 1 1 96 96 ALA HB1 H 1 1.72 . . 1 . . . . . . . . 4083 1 1062 . 1 1 96 96 ALA HB2 H 1 1.72 . . 1 . . . . . . . . 4083 1 1063 . 1 1 96 96 ALA HB3 H 1 1.72 . . 1 . . . . . . . . 4083 1 1064 . 1 1 96 96 ALA CA C 13 55.0 . . 1 . . . . . . . . 4083 1 1065 . 1 1 96 96 ALA CB C 13 18.1 . . 1 . . . . . . . . 4083 1 1066 . 1 1 96 96 ALA N N 15 120.5 . . 1 . . . . . . . . 4083 1 1067 . 1 1 97 97 ALA H H 1 8.46 . . 1 . . . . . . . . 4083 1 1068 . 1 1 97 97 ALA HA H 1 3.92 . . 1 . . . . . . . . 4083 1 1069 . 1 1 97 97 ALA HB1 H 1 1.53 . . 1 . . . . . . . . 4083 1 1070 . 1 1 97 97 ALA HB2 H 1 1.53 . . 1 . . . . . . . . 4083 1 1071 . 1 1 97 97 ALA HB3 H 1 1.53 . . 1 . . . . . . . . 4083 1 1072 . 1 1 97 97 ALA CA C 13 54.8 . . 1 . . . . . . . . 4083 1 1073 . 1 1 97 97 ALA CB C 13 16.9 . . 1 . . . . . . . . 4083 1 1074 . 1 1 97 97 ALA N N 15 117.9 . . 1 . . . . . . . . 4083 1 1075 . 1 1 98 98 ALA H H 1 8.16 . . 1 . . . . . . . . 4083 1 1076 . 1 1 98 98 ALA HA H 1 4.21 . . 1 . . . . . . . . 4083 1 1077 . 1 1 98 98 ALA HB1 H 1 1.59 . . 1 . . . . . . . . 4083 1 1078 . 1 1 98 98 ALA HB2 H 1 1.59 . . 1 . . . . . . . . 4083 1 1079 . 1 1 98 98 ALA HB3 H 1 1.59 . . 1 . . . . . . . . 4083 1 1080 . 1 1 98 98 ALA CA C 13 55.3 . . 1 . . . . . . . . 4083 1 1081 . 1 1 98 98 ALA CB C 13 17.7 . . 1 . . . . . . . . 4083 1 1082 . 1 1 98 98 ALA N N 15 120.5 . . 1 . . . . . . . . 4083 1 1083 . 1 1 99 99 GLN H H 1 8.70 . . 1 . . . . . . . . 4083 1 1084 . 1 1 99 99 GLN HA H 1 4.04 . . 1 . . . . . . . . 4083 1 1085 . 1 1 99 99 GLN HB2 H 1 2.19 . . 2 . . . . . . . . 4083 1 1086 . 1 1 99 99 GLN HB3 H 1 2.10 . . 2 . . . . . . . . 4083 1 1087 . 1 1 99 99 GLN HG2 H 1 2.63 . . 2 . . . . . . . . 4083 1 1088 . 1 1 99 99 GLN HG3 H 1 2.44 . . 2 . . . . . . . . 4083 1 1089 . 1 1 99 99 GLN HE21 H 1 7.36 . . 2 . . . . . . . . 4083 1 1090 . 1 1 99 99 GLN HE22 H 1 6.77 . . 2 . . . . . . . . 4083 1 1091 . 1 1 99 99 GLN CA C 13 58.5 . . 1 . . . . . . . . 4083 1 1092 . 1 1 99 99 GLN CB C 13 28.1 . . 1 . . . . . . . . 4083 1 1093 . 1 1 99 99 GLN CG C 13 34.2 . . 1 . . . . . . . . 4083 1 1094 . 1 1 99 99 GLN N N 15 117.5 . . 1 . . . . . . . . 4083 1 1095 . 1 1 99 99 GLN NE2 N 15 109.8 . . 1 . . . . . . . . 4083 1 1096 . 1 1 100 100 ALA H H 1 7.56 . . 1 . . . . . . . . 4083 1 1097 . 1 1 100 100 ALA HA H 1 4.35 . . 1 . . . . . . . . 4083 1 1098 . 1 1 100 100 ALA HB1 H 1 1.43 . . 1 . . . . . . . . 4083 1 1099 . 1 1 100 100 ALA HB2 H 1 1.43 . . 1 . . . . . . . . 4083 1 1100 . 1 1 100 100 ALA HB3 H 1 1.43 . . 1 . . . . . . . . 4083 1 1101 . 1 1 100 100 ALA CA C 13 51.7 . . 1 . . . . . . . . 4083 1 1102 . 1 1 100 100 ALA CB C 13 19.1 . . 1 . . . . . . . . 4083 1 1103 . 1 1 100 100 ALA N N 15 117.0 . . 1 . . . . . . . . 4083 1 1104 . 1 1 101 101 GLY H H 1 7.59 . . 1 . . . . . . . . 4083 1 1105 . 1 1 101 101 GLY HA2 H 1 4.22 . . 2 . . . . . . . . 4083 1 1106 . 1 1 101 101 GLY HA3 H 1 3.89 . . 2 . . . . . . . . 4083 1 1107 . 1 1 101 101 GLY CA C 13 45.6 . . 1 . . . . . . . . 4083 1 1108 . 1 1 101 101 GLY N N 15 101.1 . . 1 . . . . . . . . 4083 1 1109 . 1 1 102 102 ALA H H 1 8.72 . . 1 . . . . . . . . 4083 1 1110 . 1 1 102 102 ALA HA H 1 3.94 . . 1 . . . . . . . . 4083 1 1111 . 1 1 102 102 ALA HB1 H 1 1.37 . . 1 . . . . . . . . 4083 1 1112 . 1 1 102 102 ALA HB2 H 1 1.37 . . 1 . . . . . . . . 4083 1 1113 . 1 1 102 102 ALA HB3 H 1 1.37 . . 1 . . . . . . . . 4083 1 1114 . 1 1 102 102 ALA CA C 13 53.5 . . 1 . . . . . . . . 4083 1 1115 . 1 1 102 102 ALA CB C 13 18.4 . . 1 . . . . . . . . 4083 1 1116 . 1 1 102 102 ALA N N 15 123.6 . . 1 . . . . . . . . 4083 1 1117 . 1 1 103 103 SER H H 1 9.04 . . 1 . . . . . . . . 4083 1 1118 . 1 1 103 103 SER HA H 1 4.42 . . 1 . . . . . . . . 4083 1 1119 . 1 1 103 103 SER HB2 H 1 3.98 . . 2 . . . . . . . . 4083 1 1120 . 1 1 103 103 SER HB3 H 1 3.27 . . 2 . . . . . . . . 4083 1 1121 . 1 1 103 103 SER CA C 13 60.0 . . 1 . . . . . . . . 4083 1 1122 . 1 1 103 103 SER CB C 13 61.0 . . 1 . . . . . . . . 4083 1 1123 . 1 1 103 103 SER N N 15 116.6 . . 1 . . . . . . . . 4083 1 1124 . 1 1 104 104 GLY H H 1 7.64 . . 1 . . . . . . . . 4083 1 1125 . 1 1 104 104 GLY HA2 H 1 4.14 . . 2 . . . . . . . . 4083 1 1126 . 1 1 104 104 GLY HA3 H 1 3.85 . . 2 . . . . . . . . 4083 1 1127 . 1 1 104 104 GLY CA C 13 44.7 . . 1 . . . . . . . . 4083 1 1128 . 1 1 104 104 GLY N N 15 101.3 . . 1 . . . . . . . . 4083 1 1129 . 1 1 105 105 TYR H H 1 8.44 . . 1 . . . . . . . . 4083 1 1130 . 1 1 105 105 TYR HA H 1 5.88 . . 1 . . . . . . . . 4083 1 1131 . 1 1 105 105 TYR HB2 H 1 2.81 . . 1 . . . . . . . . 4083 1 1132 . 1 1 105 105 TYR HB3 H 1 2.81 . . 1 . . . . . . . . 4083 1 1133 . 1 1 105 105 TYR HD1 H 1 6.78 . . 1 . . . . . . . . 4083 1 1134 . 1 1 105 105 TYR HD2 H 1 6.78 . . 1 . . . . . . . . 4083 1 1135 . 1 1 105 105 TYR HE1 H 1 6.60 . . 1 . . . . . . . . 4083 1 1136 . 1 1 105 105 TYR HE2 H 1 6.60 . . 1 . . . . . . . . 4083 1 1137 . 1 1 105 105 TYR CA C 13 56.0 . . 1 . . . . . . . . 4083 1 1138 . 1 1 105 105 TYR CB C 13 41.3 . . 1 . . . . . . . . 4083 1 1139 . 1 1 105 105 TYR CD1 C 13 133.0 . . 1 . . . . . . . . 4083 1 1140 . 1 1 105 105 TYR CD2 C 13 133.0 . . 1 . . . . . . . . 4083 1 1141 . 1 1 105 105 TYR CE1 C 13 117.3 . . 1 . . . . . . . . 4083 1 1142 . 1 1 105 105 TYR CE2 C 13 117.3 . . 1 . . . . . . . . 4083 1 1143 . 1 1 105 105 TYR N N 15 117.9 . . 1 . . . . . . . . 4083 1 1144 . 1 1 106 106 VAL H H 1 8.95 . . 1 . . . . . . . . 4083 1 1145 . 1 1 106 106 VAL HA H 1 4.29 . . 1 . . . . . . . . 4083 1 1146 . 1 1 106 106 VAL HB H 1 1.49 . . 1 . . . . . . . . 4083 1 1147 . 1 1 106 106 VAL HG11 H 1 0.48 . . 2 . . . . . . . . 4083 1 1148 . 1 1 106 106 VAL HG12 H 1 0.48 . . 2 . . . . . . . . 4083 1 1149 . 1 1 106 106 VAL HG13 H 1 0.48 . . 2 . . . . . . . . 4083 1 1150 . 1 1 106 106 VAL HG21 H 1 0.40 . . 2 . . . . . . . . 4083 1 1151 . 1 1 106 106 VAL HG22 H 1 0.40 . . 2 . . . . . . . . 4083 1 1152 . 1 1 106 106 VAL HG23 H 1 0.40 . . 2 . . . . . . . . 4083 1 1153 . 1 1 106 106 VAL CA C 13 59.4 . . 1 . . . . . . . . 4083 1 1154 . 1 1 106 106 VAL CB C 13 35.2 . . 1 . . . . . . . . 4083 1 1155 . 1 1 106 106 VAL CG1 C 13 21.6 . . 2 . . . . . . . . 4083 1 1156 . 1 1 106 106 VAL CG2 C 13 20.6 . . 2 . . . . . . . . 4083 1 1157 . 1 1 106 106 VAL N N 15 118.9 . . 1 . . . . . . . . 4083 1 1158 . 1 1 107 107 VAL H H 1 8.11 . . 1 . . . . . . . . 4083 1 1159 . 1 1 107 107 VAL HA H 1 4.99 . . 1 . . . . . . . . 4083 1 1160 . 1 1 107 107 VAL HB H 1 1.86 . . 1 . . . . . . . . 4083 1 1161 . 1 1 107 107 VAL HG11 H 1 0.82 . . 1 . . . . . . . . 4083 1 1162 . 1 1 107 107 VAL HG12 H 1 0.82 . . 1 . . . . . . . . 4083 1 1163 . 1 1 107 107 VAL HG13 H 1 0.82 . . 1 . . . . . . . . 4083 1 1164 . 1 1 107 107 VAL HG21 H 1 0.82 . . 1 . . . . . . . . 4083 1 1165 . 1 1 107 107 VAL HG22 H 1 0.82 . . 1 . . . . . . . . 4083 1 1166 . 1 1 107 107 VAL HG23 H 1 0.82 . . 1 . . . . . . . . 4083 1 1167 . 1 1 107 107 VAL CA C 13 60.4 . . 1 . . . . . . . . 4083 1 1168 . 1 1 107 107 VAL CB C 13 36.3 . . 1 . . . . . . . . 4083 1 1169 . 1 1 107 107 VAL CG1 C 13 22.6 . . 1 . . . . . . . . 4083 1 1170 . 1 1 107 107 VAL CG2 C 13 22.6 . . 1 . . . . . . . . 4083 1 1171 . 1 1 107 107 VAL N N 15 125.1 . . 1 . . . . . . . . 4083 1 1172 . 1 1 108 108 LYS H H 1 8.45 . . 1 . . . . . . . . 4083 1 1173 . 1 1 108 108 LYS HA H 1 4.64 . . 1 . . . . . . . . 4083 1 1174 . 1 1 108 108 LYS HB2 H 1 1.72 . . 1 . . . . . . . . 4083 1 1175 . 1 1 108 108 LYS HB3 H 1 1.72 . . 1 . . . . . . . . 4083 1 1176 . 1 1 108 108 LYS HG2 H 1 1.33 . . 1 . . . . . . . . 4083 1 1177 . 1 1 108 108 LYS HG3 H 1 1.33 . . 1 . . . . . . . . 4083 1 1178 . 1 1 108 108 LYS HD2 H 1 1.62 . . 1 . . . . . . . . 4083 1 1179 . 1 1 108 108 LYS HD3 H 1 1.62 . . 1 . . . . . . . . 4083 1 1180 . 1 1 108 108 LYS HE2 H 1 2.93 . . 1 . . . . . . . . 4083 1 1181 . 1 1 108 108 LYS HE3 H 1 2.93 . . 1 . . . . . . . . 4083 1 1182 . 1 1 108 108 LYS CA C 13 53.4 . . 1 . . . . . . . . 4083 1 1183 . 1 1 108 108 LYS CB C 13 32.9 . . 1 . . . . . . . . 4083 1 1184 . 1 1 108 108 LYS CG C 13 24.4 . . 1 . . . . . . . . 4083 1 1185 . 1 1 108 108 LYS CD C 13 29.4 . . 1 . . . . . . . . 4083 1 1186 . 1 1 108 108 LYS CE C 13 41.2 . . 1 . . . . . . . . 4083 1 1187 . 1 1 108 108 LYS N N 15 122.5 . . 1 . . . . . . . . 4083 1 1188 . 1 1 109 109 PRO HA H 1 4.39 . . 1 . . . . . . . . 4083 1 1189 . 1 1 109 109 PRO HB2 H 1 2.27 . . 2 . . . . . . . . 4083 1 1190 . 1 1 109 109 PRO HB3 H 1 1.99 . . 2 . . . . . . . . 4083 1 1191 . 1 1 109 109 PRO HG2 H 1 1.93 . . 1 . . . . . . . . 4083 1 1192 . 1 1 109 109 PRO HG3 H 1 1.93 . . 1 . . . . . . . . 4083 1 1193 . 1 1 109 109 PRO HD2 H 1 3.67 . . 2 . . . . . . . . 4083 1 1194 . 1 1 109 109 PRO HD3 H 1 3.48 . . 2 . . . . . . . . 4083 1 1195 . 1 1 109 109 PRO CA C 13 62.2 . . 1 . . . . . . . . 4083 1 1196 . 1 1 109 109 PRO CB C 13 34.4 . . 1 . . . . . . . . 4083 1 1197 . 1 1 109 109 PRO CG C 13 24.4 . . 1 . . . . . . . . 4083 1 1198 . 1 1 109 109 PRO CD C 13 50.0 . . 1 . . . . . . . . 4083 1 1199 . 1 1 110 110 PHE H H 1 7.75 . . 1 . . . . . . . . 4083 1 1200 . 1 1 110 110 PHE HA H 1 5.50 . . 1 . . . . . . . . 4083 1 1201 . 1 1 110 110 PHE HB2 H 1 3.39 . . 2 . . . . . . . . 4083 1 1202 . 1 1 110 110 PHE HB3 H 1 2.99 . . 2 . . . . . . . . 4083 1 1203 . 1 1 110 110 PHE HD1 H 1 7.09 . . 1 . . . . . . . . 4083 1 1204 . 1 1 110 110 PHE HD2 H 1 7.09 . . 1 . . . . . . . . 4083 1 1205 . 1 1 110 110 PHE HE1 H 1 7.08 . . 1 . . . . . . . . 4083 1 1206 . 1 1 110 110 PHE HE2 H 1 7.08 . . 1 . . . . . . . . 4083 1 1207 . 1 1 110 110 PHE HZ H 1 7.00 . . 1 . . . . . . . . 4083 1 1208 . 1 1 110 110 PHE CA C 13 53.6 . . 1 . . . . . . . . 4083 1 1209 . 1 1 110 110 PHE CB C 13 40.6 . . 1 . . . . . . . . 4083 1 1210 . 1 1 110 110 PHE CD1 C 13 133.0 . . 1 . . . . . . . . 4083 1 1211 . 1 1 110 110 PHE CD2 C 13 133.0 . . 1 . . . . . . . . 4083 1 1212 . 1 1 110 110 PHE CE1 C 13 130.3 . . 1 . . . . . . . . 4083 1 1213 . 1 1 110 110 PHE CE2 C 13 130.3 . . 1 . . . . . . . . 4083 1 1214 . 1 1 110 110 PHE CZ C 13 127.9 . . 1 . . . . . . . . 4083 1 1215 . 1 1 110 110 PHE N N 15 114.5 . . 1 . . . . . . . . 4083 1 1216 . 1 1 111 111 THR H H 1 7.86 . . 1 . . . . . . . . 4083 1 1217 . 1 1 111 111 THR HA H 1 4.54 . . 1 . . . . . . . . 4083 1 1218 . 1 1 111 111 THR HB H 1 4.80 . . 1 . . . . . . . . 4083 1 1219 . 1 1 111 111 THR HG21 H 1 1.34 . . 1 . . . . . . . . 4083 1 1220 . 1 1 111 111 THR HG22 H 1 1.34 . . 1 . . . . . . . . 4083 1 1221 . 1 1 111 111 THR HG23 H 1 1.34 . . 1 . . . . . . . . 4083 1 1222 . 1 1 111 111 THR CA C 13 59.3 . . 1 . . . . . . . . 4083 1 1223 . 1 1 111 111 THR CB C 13 71.7 . . 1 . . . . . . . . 4083 1 1224 . 1 1 111 111 THR CG2 C 13 21.6 . . 1 . . . . . . . . 4083 1 1225 . 1 1 111 111 THR N N 15 107.3 . . 1 . . . . . . . . 4083 1 1226 . 1 1 112 112 ALA H H 1 9.20 . . 1 . . . . . . . . 4083 1 1227 . 1 1 112 112 ALA HA H 1 3.97 . . 1 . . . . . . . . 4083 1 1228 . 1 1 112 112 ALA HB1 H 1 1.50 . . 1 . . . . . . . . 4083 1 1229 . 1 1 112 112 ALA HB2 H 1 1.50 . . 1 . . . . . . . . 4083 1 1230 . 1 1 112 112 ALA HB3 H 1 1.50 . . 1 . . . . . . . . 4083 1 1231 . 1 1 112 112 ALA CA C 13 55.8 . . 1 . . . . . . . . 4083 1 1232 . 1 1 112 112 ALA CB C 13 17.1 . . 1 . . . . . . . . 4083 1 1233 . 1 1 112 112 ALA N N 15 121.7 . . 1 . . . . . . . . 4083 1 1234 . 1 1 113 113 ALA H H 1 8.21 . . 1 . . . . . . . . 4083 1 1235 . 1 1 113 113 ALA HA H 1 4.25 . . 1 . . . . . . . . 4083 1 1236 . 1 1 113 113 ALA HB1 H 1 1.47 . . 1 . . . . . . . . 4083 1 1237 . 1 1 113 113 ALA HB2 H 1 1.47 . . 1 . . . . . . . . 4083 1 1238 . 1 1 113 113 ALA HB3 H 1 1.47 . . 1 . . . . . . . . 4083 1 1239 . 1 1 113 113 ALA CA C 13 54.9 . . 1 . . . . . . . . 4083 1 1240 . 1 1 113 113 ALA CB C 13 18.0 . . 1 . . . . . . . . 4083 1 1241 . 1 1 113 113 ALA N N 15 117.1 . . 1 . . . . . . . . 4083 1 1242 . 1 1 114 114 THR H H 1 7.81 . . 1 . . . . . . . . 4083 1 1243 . 1 1 114 114 THR HA H 1 4.06 . . 1 . . . . . . . . 4083 1 1244 . 1 1 114 114 THR HB H 1 4.30 . . 1 . . . . . . . . 4083 1 1245 . 1 1 114 114 THR HG21 H 1 1.22 . . 1 . . . . . . . . 4083 1 1246 . 1 1 114 114 THR HG22 H 1 1.22 . . 1 . . . . . . . . 4083 1 1247 . 1 1 114 114 THR HG23 H 1 1.22 . . 1 . . . . . . . . 4083 1 1248 . 1 1 114 114 THR CA C 13 65.8 . . 1 . . . . . . . . 4083 1 1249 . 1 1 114 114 THR CB C 13 68.3 . . 1 . . . . . . . . 4083 1 1250 . 1 1 114 114 THR CG2 C 13 22.3 . . 1 . . . . . . . . 4083 1 1251 . 1 1 114 114 THR N N 15 115.5 . . 1 . . . . . . . . 4083 1 1252 . 1 1 115 115 LEU H H 1 8.24 . . 1 . . . . . . . . 4083 1 1253 . 1 1 115 115 LEU HA H 1 3.65 . . 1 . . . . . . . . 4083 1 1254 . 1 1 115 115 LEU HB2 H 1 2.07 . . 2 . . . . . . . . 4083 1 1255 . 1 1 115 115 LEU HB3 H 1 1.43 . . 2 . . . . . . . . 4083 1 1256 . 1 1 115 115 LEU HG H 1 1.33 . . 1 . . . . . . . . 4083 1 1257 . 1 1 115 115 LEU HD11 H 1 0.74 . . 2 . . . . . . . . 4083 1 1258 . 1 1 115 115 LEU HD12 H 1 0.74 . . 2 . . . . . . . . 4083 1 1259 . 1 1 115 115 LEU HD13 H 1 0.74 . . 2 . . . . . . . . 4083 1 1260 . 1 1 115 115 LEU HD21 H 1 0.45 . . 2 . . . . . . . . 4083 1 1261 . 1 1 115 115 LEU HD22 H 1 0.45 . . 2 . . . . . . . . 4083 1 1262 . 1 1 115 115 LEU HD23 H 1 0.45 . . 2 . . . . . . . . 4083 1 1263 . 1 1 115 115 LEU CA C 13 58.1 . . 1 . . . . . . . . 4083 1 1264 . 1 1 115 115 LEU CB C 13 40.9 . . 1 . . . . . . . . 4083 1 1265 . 1 1 115 115 LEU CG C 13 26.7 . . 1 . . . . . . . . 4083 1 1266 . 1 1 115 115 LEU CD2 C 13 21.2 . . 1 . . . . . . . . 4083 1 1267 . 1 1 115 115 LEU N N 15 120.7 . . 1 . . . . . . . . 4083 1 1268 . 1 1 116 116 GLU H H 1 8.89 . . 1 . . . . . . . . 4083 1 1269 . 1 1 116 116 GLU HA H 1 3.64 . . 1 . . . . . . . . 4083 1 1270 . 1 1 116 116 GLU HB2 H 1 2.25 . . 1 . . . . . . . . 4083 1 1271 . 1 1 116 116 GLU HB3 H 1 2.25 . . 1 . . . . . . . . 4083 1 1272 . 1 1 116 116 GLU HG2 H 1 2.41 . . 1 . . . . . . . . 4083 1 1273 . 1 1 116 116 GLU HG3 H 1 2.21 . . 2 . . . . . . . . 4083 1 1274 . 1 1 116 116 GLU CA C 13 59.9 . . 1 . . . . . . . . 4083 1 1275 . 1 1 116 116 GLU CB C 13 29.6 . . 1 . . . . . . . . 4083 1 1276 . 1 1 116 116 GLU CG C 13 35.5 . . 1 . . . . . . . . 4083 1 1277 . 1 1 116 116 GLU N N 15 117.7 . . 1 . . . . . . . . 4083 1 1278 . 1 1 117 117 GLU H H 1 7.66 . . 1 . . . . . . . . 4083 1 1279 . 1 1 117 117 GLU HA H 1 4.07 . . 1 . . . . . . . . 4083 1 1280 . 1 1 117 117 GLU HB2 H 1 2.20 . . 1 . . . . . . . . 4083 1 1281 . 1 1 117 117 GLU HB3 H 1 2.20 . . 1 . . . . . . . . 4083 1 1282 . 1 1 117 117 GLU HG2 H 1 2.46 . . 1 . . . . . . . . 4083 1 1283 . 1 1 117 117 GLU HG3 H 1 2.46 . . 1 . . . . . . . . 4083 1 1284 . 1 1 117 117 GLU CA C 13 59.4 . . 1 . . . . . . . . 4083 1 1285 . 1 1 117 117 GLU CB C 13 29.3 . . 1 . . . . . . . . 4083 1 1286 . 1 1 117 117 GLU CG C 13 36.0 . . 1 . . . . . . . . 4083 1 1287 . 1 1 117 117 GLU N N 15 116.6 . . 1 . . . . . . . . 4083 1 1288 . 1 1 118 118 LYS H H 1 7.84 . . 1 . . . . . . . . 4083 1 1289 . 1 1 118 118 LYS HA H 1 3.95 . . 1 . . . . . . . . 4083 1 1290 . 1 1 118 118 LYS HB2 H 1 1.92 . . 2 . . . . . . . . 4083 1 1291 . 1 1 118 118 LYS HB3 H 1 1.42 . . 2 . . . . . . . . 4083 1 1292 . 1 1 118 118 LYS HG2 H 1 1.09 . . 1 . . . . . . . . 4083 1 1293 . 1 1 118 118 LYS HG3 H 1 1.09 . . 1 . . . . . . . . 4083 1 1294 . 1 1 118 118 LYS HD2 H 1 1.61 . . 1 . . . . . . . . 4083 1 1295 . 1 1 118 118 LYS HD3 H 1 1.61 . . 1 . . . . . . . . 4083 1 1296 . 1 1 118 118 LYS HE2 H 1 2.87 . . 1 . . . . . . . . 4083 1 1297 . 1 1 118 118 LYS HE3 H 1 2.87 . . 1 . . . . . . . . 4083 1 1298 . 1 1 118 118 LYS CA C 13 57.5 . . 1 . . . . . . . . 4083 1 1299 . 1 1 118 118 LYS CB C 13 31.5 . . 1 . . . . . . . . 4083 1 1300 . 1 1 118 118 LYS CG C 13 24.5 . . 1 . . . . . . . . 4083 1 1301 . 1 1 118 118 LYS CD C 13 27.5 . . 1 . . . . . . . . 4083 1 1302 . 1 1 118 118 LYS CE C 13 41.6 . . 1 . . . . . . . . 4083 1 1303 . 1 1 118 118 LYS N N 15 115.6 . . 1 . . . . . . . . 4083 1 1304 . 1 1 119 119 LEU H H 1 8.55 . . 1 . . . . . . . . 4083 1 1305 . 1 1 119 119 LEU HA H 1 3.41 . . 1 . . . . . . . . 4083 1 1306 . 1 1 119 119 LEU HB2 H 1 1.64 . . 2 . . . . . . . . 4083 1 1307 . 1 1 119 119 LEU HB3 H 1 0.83 . . 2 . . . . . . . . 4083 1 1308 . 1 1 119 119 LEU HG H 1 1.45 . . 1 . . . . . . . . 4083 1 1309 . 1 1 119 119 LEU HD11 H 1 0.38 . . 2 . . . . . . . . 4083 1 1310 . 1 1 119 119 LEU HD12 H 1 0.38 . . 2 . . . . . . . . 4083 1 1311 . 1 1 119 119 LEU HD13 H 1 0.38 . . 2 . . . . . . . . 4083 1 1312 . 1 1 119 119 LEU HD21 H 1 0.08 . . 2 . . . . . . . . 4083 1 1313 . 1 1 119 119 LEU HD22 H 1 0.08 . . 2 . . . . . . . . 4083 1 1314 . 1 1 119 119 LEU HD23 H 1 0.08 . . 2 . . . . . . . . 4083 1 1315 . 1 1 119 119 LEU CA C 13 57.8 . . 1 . . . . . . . . 4083 1 1316 . 1 1 119 119 LEU CB C 13 40.4 . . 1 . . . . . . . . 4083 1 1317 . 1 1 119 119 LEU CG C 13 26.1 . . 1 . . . . . . . . 4083 1 1318 . 1 1 119 119 LEU CD1 C 13 25.7 . . 1 . . . . . . . . 4083 1 1319 . 1 1 119 119 LEU CD2 C 13 25.7 . . 1 . . . . . . . . 4083 1 1320 . 1 1 119 119 LEU N N 15 116.8 . . 1 . . . . . . . . 4083 1 1321 . 1 1 120 120 ASN H H 1 8.58 . . 1 . . . . . . . . 4083 1 1322 . 1 1 120 120 ASN HA H 1 4.56 . . 1 . . . . . . . . 4083 1 1323 . 1 1 120 120 ASN HB2 H 1 3.03 . . 2 . . . . . . . . 4083 1 1324 . 1 1 120 120 ASN HB3 H 1 2.86 . . 2 . . . . . . . . 4083 1 1325 . 1 1 120 120 ASN HD21 H 1 7.53 . . 2 . . . . . . . . 4083 1 1326 . 1 1 120 120 ASN HD22 H 1 6.86 . . 2 . . . . . . . . 4083 1 1327 . 1 1 120 120 ASN CA C 13 56.0 . . 1 . . . . . . . . 4083 1 1328 . 1 1 120 120 ASN CB C 13 37.3 . . 1 . . . . . . . . 4083 1 1329 . 1 1 120 120 ASN N N 15 114.5 . . 1 . . . . . . . . 4083 1 1330 . 1 1 120 120 ASN ND2 N 15 110.1 . . 1 . . . . . . . . 4083 1 1331 . 1 1 121 121 LYS H H 1 7.78 . . 1 . . . . . . . . 4083 1 1332 . 1 1 121 121 LYS HA H 1 4.15 . . 1 . . . . . . . . 4083 1 1333 . 1 1 121 121 LYS HB2 H 1 1.95 . . 1 . . . . . . . . 4083 1 1334 . 1 1 121 121 LYS HB3 H 1 1.95 . . 1 . . . . . . . . 4083 1 1335 . 1 1 121 121 LYS HD2 H 1 1.60 . . 1 . . . . . . . . 4083 1 1336 . 1 1 121 121 LYS HD3 H 1 1.60 . . 1 . . . . . . . . 4083 1 1337 . 1 1 121 121 LYS HE2 H 1 2.97 . . 1 . . . . . . . . 4083 1 1338 . 1 1 121 121 LYS HE3 H 1 2.97 . . 1 . . . . . . . . 4083 1 1339 . 1 1 121 121 LYS CA C 13 58.7 . . 1 . . . . . . . . 4083 1 1340 . 1 1 121 121 LYS CB C 13 32.0 . . 1 . . . . . . . . 4083 1 1341 . 1 1 121 121 LYS CG C 13 25.1 . . 1 . . . . . . . . 4083 1 1342 . 1 1 121 121 LYS CD C 13 28.3 . . 1 . . . . . . . . 4083 1 1343 . 1 1 121 121 LYS CE C 13 41.8 . . 1 . . . . . . . . 4083 1 1344 . 1 1 121 121 LYS N N 15 117.9 . . 1 . . . . . . . . 4083 1 1345 . 1 1 122 122 ILE H H 1 7.51 . . 1 . . . . . . . . 4083 1 1346 . 1 1 122 122 ILE HA H 1 3.73 . . 1 . . . . . . . . 4083 1 1347 . 1 1 122 122 ILE HB H 1 1.89 . . 1 . . . . . . . . 4083 1 1348 . 1 1 122 122 ILE HG12 H 1 1.87 . . 2 . . . . . . . . 4083 1 1349 . 1 1 122 122 ILE HG13 H 1 0.86 . . 2 . . . . . . . . 4083 1 1350 . 1 1 122 122 ILE HG21 H 1 0.91 . . 1 . . . . . . . . 4083 1 1351 . 1 1 122 122 ILE HG22 H 1 0.91 . . 1 . . . . . . . . 4083 1 1352 . 1 1 122 122 ILE HG23 H 1 0.91 . . 1 . . . . . . . . 4083 1 1353 . 1 1 122 122 ILE HD11 H 1 0.68 . . 1 . . . . . . . . 4083 1 1354 . 1 1 122 122 ILE HD12 H 1 0.68 . . 1 . . . . . . . . 4083 1 1355 . 1 1 122 122 ILE HD13 H 1 0.68 . . 1 . . . . . . . . 4083 1 1356 . 1 1 122 122 ILE CA C 13 65.4 . . 1 . . . . . . . . 4083 1 1357 . 1 1 122 122 ILE CB C 13 37.7 . . 1 . . . . . . . . 4083 1 1358 . 1 1 122 122 ILE CG1 C 13 29.8 . . 1 . . . . . . . . 4083 1 1359 . 1 1 122 122 ILE CG2 C 13 17.8 . . 1 . . . . . . . . 4083 1 1360 . 1 1 122 122 ILE CD1 C 13 15.2 . . 1 . . . . . . . . 4083 1 1361 . 1 1 122 122 ILE N N 15 120.5 . . 1 . . . . . . . . 4083 1 1362 . 1 1 123 123 PHE H H 1 9.14 . . 1 . . . . . . . . 4083 1 1363 . 1 1 123 123 PHE HA H 1 4.67 . . 1 . . . . . . . . 4083 1 1364 . 1 1 123 123 PHE HB2 H 1 3.48 . . 2 . . . . . . . . 4083 1 1365 . 1 1 123 123 PHE HB3 H 1 3.33 . . 2 . . . . . . . . 4083 1 1366 . 1 1 123 123 PHE HD1 H 1 7.48 . . 1 . . . . . . . . 4083 1 1367 . 1 1 123 123 PHE HD2 H 1 7.48 . . 1 . . . . . . . . 4083 1 1368 . 1 1 123 123 PHE HE1 H 1 7.26 . . 1 . . . . . . . . 4083 1 1369 . 1 1 123 123 PHE HE2 H 1 7.26 . . 1 . . . . . . . . 4083 1 1370 . 1 1 123 123 PHE HZ H 1 6.69 . . 1 . . . . . . . . 4083 1 1371 . 1 1 123 123 PHE CA C 13 58.7 . . 1 . . . . . . . . 4083 1 1372 . 1 1 123 123 PHE CB C 13 37.2 . . 1 . . . . . . . . 4083 1 1373 . 1 1 123 123 PHE CD1 C 13 130.8 . . 1 . . . . . . . . 4083 1 1374 . 1 1 123 123 PHE CD2 C 13 130.8 . . 1 . . . . . . . . 4083 1 1375 . 1 1 123 123 PHE CE1 C 13 130.8 . . 1 . . . . . . . . 4083 1 1376 . 1 1 123 123 PHE CE2 C 13 130.8 . . 1 . . . . . . . . 4083 1 1377 . 1 1 123 123 PHE CZ C 13 128.4 . . 1 . . . . . . . . 4083 1 1378 . 1 1 123 123 PHE N N 15 117.3 . . 1 . . . . . . . . 4083 1 1379 . 1 1 124 124 GLU H H 1 8.32 . . 1 . . . . . . . . 4083 1 1380 . 1 1 124 124 GLU HA H 1 4.24 . . 1 . . . . . . . . 4083 1 1381 . 1 1 124 124 GLU HB2 H 1 2.27 . . 2 . . . . . . . . 4083 1 1382 . 1 1 124 124 GLU HB3 H 1 2.20 . . 2 . . . . . . . . 4083 1 1383 . 1 1 124 124 GLU HG2 H 1 2.46 . . 1 . . . . . . . . 4083 1 1384 . 1 1 124 124 GLU HG3 H 1 2.46 . . 1 . . . . . . . . 4083 1 1385 . 1 1 124 124 GLU CA C 13 59.2 . . 1 . . . . . . . . 4083 1 1386 . 1 1 124 124 GLU CB C 13 29.8 . . 1 . . . . . . . . 4083 1 1387 . 1 1 124 124 GLU CG C 13 36.0 . . 1 . . . . . . . . 4083 1 1388 . 1 1 124 124 GLU N N 15 116.5 . . 1 . . . . . . . . 4083 1 1389 . 1 1 125 125 LYS H H 1 7.75 . . 1 . . . . . . . . 4083 1 1390 . 1 1 125 125 LYS HA H 1 4.18 . . 1 . . . . . . . . 4083 1 1391 . 1 1 125 125 LYS HB2 H 1 2.07 . . 2 . . . . . . . . 4083 1 1392 . 1 1 125 125 LYS HB3 H 1 1.91 . . 2 . . . . . . . . 4083 1 1393 . 1 1 125 125 LYS HG2 H 1 1.65 . . 1 . . . . . . . . 4083 1 1394 . 1 1 125 125 LYS HG3 H 1 1.65 . . 1 . . . . . . . . 4083 1 1395 . 1 1 125 125 LYS HD2 H 1 1.74 . . 1 . . . . . . . . 4083 1 1396 . 1 1 125 125 LYS HD3 H 1 1.74 . . 1 . . . . . . . . 4083 1 1397 . 1 1 125 125 LYS HE2 H 1 3.03 . . 1 . . . . . . . . 4083 1 1398 . 1 1 125 125 LYS HE3 H 1 3.03 . . 1 . . . . . . . . 4083 1 1399 . 1 1 125 125 LYS CA C 13 58.4 . . 1 . . . . . . . . 4083 1 1400 . 1 1 125 125 LYS CB C 13 32.2 . . 1 . . . . . . . . 4083 1 1401 . 1 1 125 125 LYS CG C 13 25.0 . . 1 . . . . . . . . 4083 1 1402 . 1 1 125 125 LYS CD C 13 28.6 . . 1 . . . . . . . . 4083 1 1403 . 1 1 125 125 LYS CE C 13 41.8 . . 1 . . . . . . . . 4083 1 1404 . 1 1 125 125 LYS N N 15 118.7 . . 1 . . . . . . . . 4083 1 1405 . 1 1 126 126 LEU H H 1 7.96 . . 1 . . . . . . . . 4083 1 1406 . 1 1 126 126 LEU HA H 1 4.42 . . 1 . . . . . . . . 4083 1 1407 . 1 1 126 126 LEU HB2 H 1 1.83 . . 2 . . . . . . . . 4083 1 1408 . 1 1 126 126 LEU HB3 H 1 1.76 . . 2 . . . . . . . . 4083 1 1409 . 1 1 126 126 LEU HG H 1 1.93 . . 1 . . . . . . . . 4083 1 1410 . 1 1 126 126 LEU HD11 H 1 0.93 . . 1 . . . . . . . . 4083 1 1411 . 1 1 126 126 LEU HD12 H 1 0.93 . . 1 . . . . . . . . 4083 1 1412 . 1 1 126 126 LEU HD13 H 1 0.93 . . 1 . . . . . . . . 4083 1 1413 . 1 1 126 126 LEU HD21 H 1 0.93 . . 1 . . . . . . . . 4083 1 1414 . 1 1 126 126 LEU HD22 H 1 0.93 . . 1 . . . . . . . . 4083 1 1415 . 1 1 126 126 LEU HD23 H 1 0.93 . . 1 . . . . . . . . 4083 1 1416 . 1 1 126 126 LEU CA C 13 54.6 . . 1 . . . . . . . . 4083 1 1417 . 1 1 126 126 LEU CB C 13 42.5 . . 1 . . . . . . . . 4083 1 1418 . 1 1 126 126 LEU CG C 13 27.0 . . 1 . . . . . . . . 4083 1 1419 . 1 1 126 126 LEU CD1 C 13 22.0 . . 1 . . . . . . . . 4083 1 1420 . 1 1 126 126 LEU CD2 C 13 22.0 . . 1 . . . . . . . . 4083 1 1421 . 1 1 126 126 LEU N N 15 115.1 . . 1 . . . . . . . . 4083 1 1422 . 1 1 127 127 GLY H H 1 7.97 . . 1 . . . . . . . . 4083 1 1423 . 1 1 127 127 GLY HA2 H 1 4.01 . . 1 . . . . . . . . 4083 1 1424 . 1 1 127 127 GLY HA3 H 1 4.01 . . 1 . . . . . . . . 4083 1 1425 . 1 1 127 127 GLY CA C 13 46.5 . . 1 . . . . . . . . 4083 1 1426 . 1 1 127 127 GLY N N 15 108.8 . . 1 . . . . . . . . 4083 1 1427 . 1 1 128 128 MET H H 1 8.25 . . 1 . . . . . . . . 4083 1 1428 . 1 1 128 128 MET HA H 1 4.21 . . 1 . . . . . . . . 4083 1 1429 . 1 1 128 128 MET HB2 H 1 2.18 . . 2 . . . . . . . . 4083 1 1430 . 1 1 128 128 MET HB3 H 1 1.85 . . 2 . . . . . . . . 4083 1 1431 . 1 1 128 128 MET HG2 H 1 2.60 . . 2 . . . . . . . . 4083 1 1432 . 1 1 128 128 MET HG3 H 1 2.44 . . 2 . . . . . . . . 4083 1 1433 . 1 1 128 128 MET CA C 13 57.0 . . 1 . . . . . . . . 4083 1 1434 . 1 1 128 128 MET CB C 13 35.5 . . 1 . . . . . . . . 4083 1 1435 . 1 1 128 128 MET CG C 13 32.4 . . 1 . . . . . . . . 4083 1 1436 . 1 1 128 128 MET N N 15 123.1 . . 1 . . . . . . . . 4083 1 stop_ save_