data_7056 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 7056 _Entry.Title ; 1H, 13C, 15N assignments of an independently folded C-terminal domain of influenza polymerase subunit PB2 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-04-07 _Entry.Accession_date 2006-04-07 _Entry.Last_release_date 2007-03-09 _Entry.Original_release_date 2007-03-09 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Julien Boudet . . . 7056 2 Catherine Bougault . M. . 7056 3 Jean-Pierre Simorre . . . 7056 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID . . 'Institut de Biologie Structurale Jean-Pierre Ebel' . 7056 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 7056 coupling_constants 1 7056 heteronucl_NOEs 1 7056 heteronucl_T1_relaxation 1 7056 heteronucl_T2_relaxation 1 7056 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 716 7056 '15N chemical shifts' 166 7056 '1H chemical shifts' 1161 7056 'coupling constants' 56 7056 'heteronuclear NOE values' 69 7056 'T1 relaxation values' 68 7056 'T1rho relaxation values' 70 7056 'T2 relaxation values' 69 7056 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 . . 2007-03-09 2006-04-07 original author . 7056 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 7056 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 17310249 _Citation.Full_citation . _Citation.Title 'Structure and nuclear import function of the C-terminal domain of influenza virus polymerase PB2 subunit.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Struct. Mol. Biol.' _Citation.Journal_name_full . _Citation.Journal_volume 14 _Citation.Journal_issue 3 _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 229 _Citation.Page_last 233 _Citation.Year 2007 _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 Franck Tarendeau . . . 7056 1 2 Julien Boudet . . . 7056 1 3 Delphine Guiligay . . . 7056 1 4 Philippe Mas . . . 7056 1 5 Catherine Bougault . M. . 7056 1 6 S. Boulo . . . 7056 1 7 F. Baudin . . . 7056 1 8 R. Ruigrok . W. . 7056 1 9 N. Daigle . . . 7056 1 10 J. Ellenberg . . . 7056 1 11 Stephen Cusack . . . 7056 1 12 Jean-Pierre Simorre . . . 7056 1 13 Darren Hart . J. . 7056 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID ESPRIT 7056 1 Influenza 7056 1 PB2 7056 1 RNA-polymerase 7056 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 7056 _Assembly.ID 1 _Assembly.Name DPDE _Assembly.BMRB_code . _Assembly.Number_of_components 2 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass 8973 _Assembly.Enzyme_commission_number . _Assembly.Details 'C-terminal domain of influenza polymerase subunit PB2' _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID protein 7056 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 DPDE-trans 1 $DPDE . . yes native no no 1 . ; Polymer with Pro3 in the trans form (Major component in solution ,75%) ; 7056 1 2 DPDE-cis 1 $DPDE . . yes native no no 1 . ; Polymer with Pro3 in the cis form (Minorcomponent in solution ,25%) ; 7056 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID RNA-polymerase 7056 1 stop_ loop_ _Assembly_keyword.Keyword _Assembly_keyword.Entry_ID _Assembly_keyword.Assembly_ID ESPRIT 7056 1 Influenza 7056 1 PB2 7056 1 RNA-polymerase 7056 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_DPDE _Entity.Sf_category entity _Entity.Sf_framecode DPDE _Entity.Entry_ID 7056 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name DPDE-trans _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GDPDESTSGVESAVLRGFLI LGKEDRRYGPALSINELSNL AKGEKANVLIGQGDVVLVMK RKRDSSILTDSQTATKRIRM AIN ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details ; The presently studied DPDE biopolymer (D2-N83) corresponds to the fragment 678-759 of C-terminal domain of influenza polymerase subunit PB2. Consequently residue numbering is G677-N759 instead of G1-N83. ; _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 83 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 8973 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'Pro3 in trans conformational state' _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2GMO . "Nmr-Structure Of An Independently Folded C-Terminal Domain Of Influenza Polymerase Subunit Pb2" . . . . . 100.00 83 100.00 100.00 1.47e-50 . . . . 7056 1 2 no PDB 2JDQ . "C-Terminal Domain Of Influenza A Virus Polymerase Pb2 Subunit In Complex With Human Importin Alpha5" . . . . . 100.00 83 100.00 100.00 1.47e-50 . . . . 7056 1 3 no PDB 2VY6 . "Two Domains From The C-Terminal Region Of Influenza A Virus Polymerase Pb2 Subunit" . . . . . 91.57 217 100.00 100.00 6.14e-44 . . . . 7056 1 4 no PDB 3R2V . "Crystal Structure Of Polymerase Basic Protein 2 E538-R753 From Influenza A Virus AYOKOHAMA201703 H3N2" . . . . . 91.57 216 98.68 100.00 1.21e-43 . . . . 7056 1 5 no DBJ BAD02350 . "polymerase subunit 2 [Influenza A virus (A/Yokohama/22/2002(H1N2))]" . . . . . 98.80 759 98.78 100.00 3.75e-45 . . . . 7056 1 6 no DBJ BAD02361 . "polymerase subunit 2 [Influenza A virus (A/Yokohama/47/2002(H1N2))]" . . . . . 98.80 759 98.78 100.00 3.75e-45 . . . . 7056 1 7 no DBJ BAG49630 . "polymerase basic protein 2 [Influenza A virus (A/Morioka/17/2002(H1N1))]" . . . . . 98.80 759 97.56 98.78 2.53e-44 . . . . 7056 1 8 no DBJ BAG49631 . "polymerase basic protein 2 [Influenza A virus (A/Morioka/3/2005(H1N1))]" . . . . . 98.80 759 97.56 98.78 2.38e-44 . . . . 7056 1 9 no DBJ BAG49632 . "polymerase basic protein 2 [Influenza A virus (A/Morioka/4/2005(H1N1))]" . . . . . 98.80 759 97.56 98.78 2.38e-44 . . . . 7056 1 10 no EMBL CAA23855 . "unnamed protein product [Influenza A virus (A/Puerto Rico/8/1934(H1N1))]" . . . . . 98.80 759 97.56 98.78 2.51e-44 . . . . 7056 1 11 no EMBL CAA33357 . "RNA polymerase [Influenza A virus (A/Chile/1/1983(H1N1))]" . . . . . 98.80 759 97.56 98.78 2.48e-44 . . . . 7056 1 12 no EMBL CAA67496 . "polymerase basic protein 2 [Influenza A virus (A/Fort Monmouth/1/1947-mouse adapted(H1N1))]" . . . . . 98.80 759 97.56 98.78 1.98e-44 . . . . 7056 1 13 no EMBL CAA67497 . "polymerase basic protein 2 [Influenza A virus (A/Fort Monmouth/1/1947-mouse adapted(H1N1))]" . . . . . 98.80 759 97.56 98.78 2.13e-44 . . . . 7056 1 14 no EMBL CAD92256 . "PB2 protein [Influenza A virus (A/England/939/69(H3N2)) x (A/PR/8/34(H1N1))]" . . . . . 98.80 759 98.78 98.78 9.45e-45 . . . . 7056 1 15 no GB AAA19213 . "PB2 protein [Influenza A virus (A/Leningrad/134/1957(H2N2))]" . . . . . 98.80 759 98.78 98.78 9.08e-45 . . . . 7056 1 16 no GB AAA19214 . "PB2 protein [Influenza A virus (A/Leningrad/134/17/1957(H2N2))]" . . . . . 98.80 759 98.78 98.78 9.08e-45 . . . . 7056 1 17 no GB AAA19215 . "polymerase PB2 [Influenza A virus (A/Leningrad/134/47/1957(H2N2))]" . . . . . 98.80 759 98.78 98.78 9.08e-45 . . . . 7056 1 18 no GB AAA43126 . "polymerase 2 [Influenza A virus (A/swine/Iowa/15/1930(H1N1))]" . . . . . 98.80 759 97.56 98.78 2.36e-44 . . . . 7056 1 19 no GB AAA43127 . "polymerase 2 [Influenza A virus (A/Singapore/1/1957(H2N2))]" . . . . . 98.80 759 98.78 98.78 7.19e-45 . . . . 7056 1 20 no PIR P3IV34 . "RNA-directed RNA polymerase (EC 2.7.7.48) 2 - influenza A virus (strain A/PR/8/34)" . . . . . 98.80 759 97.56 98.78 2.51e-44 . . . . 7056 1 21 no PIR P3IV61 . "RNA-directed RNA polymerase (EC 2.7.7.48) 2 - influenza A virus (strain A/Ann Arbor/6/60 [H2N2])" . . . . . 98.80 759 97.56 98.78 3.33e-44 . . . . 7056 1 22 no PIR S04930 . "RNA-directed RNA polymerase (EC 2.7.7.48) chain PB2 - influenza A virus (strain Chile/1/83[H1N1])" . . . . . 98.80 759 97.56 98.78 2.48e-44 . . . . 7056 1 23 no PRF 1607135A . "RNA polymerase" . . . . . 98.80 759 97.56 98.78 2.38e-44 . . . . 7056 1 24 no REF NP_040987 . "PB2 protein [Influenza A virus (A/Puerto Rico/8/34(H1N1))]" . . . . . 98.80 759 97.56 98.78 2.51e-44 . . . . 7056 1 25 no REF YP_308849 . "polymerase PB2 [Influenza A virus (A/New York/392/2004(H3N2))]" . . . . . 98.80 759 98.78 100.00 3.26e-45 . . . . 7056 1 26 no REF YP_308855 . "polymerase 2 [Influenza A virus (A/Korea/426/1968(H2N2))]" . . . . . 98.80 759 97.56 97.56 6.00e-44 . . . . 7056 1 27 no SP A3DRQ0 . "RecName: Full=Polymerase basic protein 2 [Influenza A virus (A/Memphis/10/1996(H1N1))]" . . . . . 98.80 759 97.56 98.78 2.48e-44 . . . . 7056 1 28 no SP A4GBY7 . "RecName: Full=Polymerase basic protein 2 [Influenza A virus (A/Brazil/11/1978(H1N1))]" . . . . . 98.80 759 97.56 98.78 2.33e-44 . . . . 7056 1 29 no SP A4GCJ6 . "RecName: Full=Polymerase basic protein 2 [Influenza A virus (A/Henry/1936(H1N1))]" . . . . . 98.80 759 97.56 98.78 2.61e-44 . . . . 7056 1 30 no SP A4GCK7 . "RecName: Full=Polymerase basic protein 2 [Influenza A virus (A/India/6263/1980(H1N1))]" . . . . . 98.80 759 97.56 98.78 2.33e-44 . . . . 7056 1 31 no SP A4GCL8 . "RecName: Full=Polymerase basic protein 2 [Influenza A virus (A/Iowa/1943(H1N1))]" . . . . . 98.80 759 98.78 98.78 9.74e-45 . . . . 7056 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'RNA polymerase' 7056 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'DPDE, C-terminal domain of influenza polymerase subunit PB2' . 7056 1 stop_ loop_ _Entity_keyword.Keyword _Entity_keyword.Entry_ID _Entity_keyword.Entity_ID Influenza 7056 1 PB2 7056 1 RNA-polymerase 7056 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 1 677 GLY . 7056 1 2 678 ASP . 7056 1 3 679 PRO . 7056 1 4 680 ASP . 7056 1 5 681 GLU . 7056 1 6 682 SER . 7056 1 7 683 THR . 7056 1 8 684 SER . 7056 1 9 685 GLY . 7056 1 10 686 VAL . 7056 1 11 687 GLU . 7056 1 12 688 SER . 7056 1 13 689 ALA . 7056 1 14 690 VAL . 7056 1 15 691 LEU . 7056 1 16 692 ARG . 7056 1 17 693 GLY . 7056 1 18 694 PHE . 7056 1 19 695 LEU . 7056 1 20 696 ILE . 7056 1 21 697 LEU . 7056 1 22 698 GLY . 7056 1 23 699 LYS . 7056 1 24 700 GLU . 7056 1 25 701 ASP . 7056 1 26 702 ARG . 7056 1 27 703 ARG . 7056 1 28 704 TYR . 7056 1 29 705 GLY . 7056 1 30 706 PRO . 7056 1 31 707 ALA . 7056 1 32 708 LEU . 7056 1 33 709 SER . 7056 1 34 710 ILE . 7056 1 35 711 ASN . 7056 1 36 712 GLU . 7056 1 37 713 LEU . 7056 1 38 714 SER . 7056 1 39 715 ASN . 7056 1 40 716 LEU . 7056 1 41 717 ALA . 7056 1 42 718 LYS . 7056 1 43 719 GLY . 7056 1 44 720 GLU . 7056 1 45 721 LYS . 7056 1 46 722 ALA . 7056 1 47 723 ASN . 7056 1 48 724 VAL . 7056 1 49 725 LEU . 7056 1 50 726 ILE . 7056 1 51 727 GLY . 7056 1 52 728 GLN . 7056 1 53 729 GLY . 7056 1 54 730 ASP . 7056 1 55 731 VAL . 7056 1 56 732 VAL . 7056 1 57 733 LEU . 7056 1 58 734 VAL . 7056 1 59 735 MET . 7056 1 60 736 LYS . 7056 1 61 737 ARG . 7056 1 62 738 LYS . 7056 1 63 739 ARG . 7056 1 64 740 ASP . 7056 1 65 741 SER . 7056 1 66 742 SER . 7056 1 67 743 ILE . 7056 1 68 744 LEU . 7056 1 69 745 THR . 7056 1 70 746 ASP . 7056 1 71 747 SER . 7056 1 72 748 GLN . 7056 1 73 749 THR . 7056 1 74 750 ALA . 7056 1 75 751 THR . 7056 1 76 752 LYS . 7056 1 77 753 ARG . 7056 1 78 754 ILE . 7056 1 79 755 ARG . 7056 1 80 756 MET . 7056 1 81 757 ALA . 7056 1 82 758 ILE . 7056 1 83 759 ASN . 7056 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 7056 1 . ASP 2 2 7056 1 . PRO 3 3 7056 1 . ASP 4 4 7056 1 . GLU 5 5 7056 1 . SER 6 6 7056 1 . THR 7 7 7056 1 . SER 8 8 7056 1 . GLY 9 9 7056 1 . VAL 10 10 7056 1 . GLU 11 11 7056 1 . SER 12 12 7056 1 . ALA 13 13 7056 1 . VAL 14 14 7056 1 . LEU 15 15 7056 1 . ARG 16 16 7056 1 . GLY 17 17 7056 1 . PHE 18 18 7056 1 . LEU 19 19 7056 1 . ILE 20 20 7056 1 . LEU 21 21 7056 1 . GLY 22 22 7056 1 . LYS 23 23 7056 1 . GLU 24 24 7056 1 . ASP 25 25 7056 1 . ARG 26 26 7056 1 . ARG 27 27 7056 1 . TYR 28 28 7056 1 . GLY 29 29 7056 1 . PRO 30 30 7056 1 . ALA 31 31 7056 1 . LEU 32 32 7056 1 . SER 33 33 7056 1 . ILE 34 34 7056 1 . ASN 35 35 7056 1 . GLU 36 36 7056 1 . LEU 37 37 7056 1 . SER 38 38 7056 1 . ASN 39 39 7056 1 . LEU 40 40 7056 1 . ALA 41 41 7056 1 . LYS 42 42 7056 1 . GLY 43 43 7056 1 . GLU 44 44 7056 1 . LYS 45 45 7056 1 . ALA 46 46 7056 1 . ASN 47 47 7056 1 . VAL 48 48 7056 1 . LEU 49 49 7056 1 . ILE 50 50 7056 1 . GLY 51 51 7056 1 . GLN 52 52 7056 1 . GLY 53 53 7056 1 . ASP 54 54 7056 1 . VAL 55 55 7056 1 . VAL 56 56 7056 1 . LEU 57 57 7056 1 . VAL 58 58 7056 1 . MET 59 59 7056 1 . LYS 60 60 7056 1 . ARG 61 61 7056 1 . LYS 62 62 7056 1 . ARG 63 63 7056 1 . ASP 64 64 7056 1 . SER 65 65 7056 1 . SER 66 66 7056 1 . ILE 67 67 7056 1 . LEU 68 68 7056 1 . THR 69 69 7056 1 . ASP 70 70 7056 1 . SER 71 71 7056 1 . GLN 72 72 7056 1 . THR 73 73 7056 1 . ALA 74 74 7056 1 . THR 75 75 7056 1 . LYS 76 76 7056 1 . ARG 77 77 7056 1 . ILE 78 78 7056 1 . ARG 79 79 7056 1 . MET 80 80 7056 1 . ALA 81 81 7056 1 . ILE 82 82 7056 1 . ASN 83 83 7056 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 7056 _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 $DPDE . 78586 . no . 'Influenza A virus (strain A/Victoria/3/75 H3N2)' A/Victoria/3/75 . Viruses . Orthomyxoviridae 'Influenza A H3N2 subtype' 'Influenza A virus (strain A/Victoria/3/75 H3N2)' . . . . . . . . . . . . . . . . . 'clone selected from ESPRIT technology' . . 7056 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 7056 _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 $DPDE . 'recombinant technology' . 'E. coli' 'E. coli BL21 codon plus RIL' . . . . . . . . . . . . . . . . . . . . . . . . . . 7056 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 7056 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details ; Sample contains 75% of P3-trans form and 25% of P3-cis form at pH = 7.5 at 10C in H2O 90%/ D2O 10% ; _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 DPDE-trans '[U-13C; U-15N]' . . 1 $DPDE . protein 0.45 0.4 0.5 mM 0.05 . . . 7056 1 2 DPDE-cis '[U-13C; U-15N]' . . 1 $DPDE . protein 0.15 0.1 0.2 mM 0.05 . . . 7056 1 3 'sodium chloride' . . . . . . salt 200 . . mM . . . . 7056 1 4 'Tris pH = 7.5' . . . . . . buffer 50 . . mM . . . . 7056 1 5 H2O . . . . . . . 90 . . % . . . . 7056 1 6 D2O . . . . . . . 10 . . % . . . . 7056 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 7056 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Same sample as before in D2O 99.9%' _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 DPDE-trans '[U-95% 13C; U-90% 15N]' . . 1 $DPDE . protein 0.45 0.4 0.5 mM 0.05 . . . 7056 2 2 DPDE-cis '[U-95% 13C; U-90% 15N]' . . 1 $DPDE . protein 0.15 0.1 0.2 mM 0.05 . . . 7056 2 3 'sodium chloride' . . . . . . salt 200 . . mM . . . . 7056 2 4 'Tris pH = 7.5' . . . . . . buffer 50 . . mM . . . . 7056 2 5 D2O . . . . . . . 99.9 . . % . . . . 7056 2 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 7056 _Sample_condition_list.ID 1 _Sample_condition_list.Details ; DPDE 0.6 mM Tris 50 mM NaCl 200 mM pH = 7.5 T = 10C ; 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 7.5 0.1 pH 7056 1 temperature 283 0.5 K 7056 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 7056 _Software.ID 1 _Software.Name NMRPipe _Software.Version 'Version 2.3' _Software.Details ; From NIH For Linux ; loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'Data processing and curve fitting' 7056 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 7056 _Software.ID 2 _Software.Name NMRView _Software.Version 'Version 5.2.2' _Software.Details ; From Bruce A. Johnson One Moon Scientific, Inc. ; loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis and peak assignments' 7056 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz_spectrometer _NMR_spectrometer.Entry_ID 7056 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova600 _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_800MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 800MHz_spectrometer _NMR_spectrometer.Entry_ID 7056 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model Inova800 _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 7056 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 1H15N_HSQC no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 2 HNCA no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 3 HN(CO)CA no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 4 HN(CA)CO no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 5 HNCACB no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 6 CBCA(CO)NH no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 7 H(CCO)NH no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 8 (H)C(CO)NH no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 9 H(C)CH-TOCSY no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 10 (H)CCH-TOCSY no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 11 1H13C_HSQC no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 12 methylselective-1H13C_HSQC no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 13 13C_NOESY_HSQC no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 14 15N_NOESY_HSQC no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 15 HNHA no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 16 1H15N_HSQC_t1 no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 17 1H15N_HSQC_t1rho no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 18 1H15N_HSQC_t2 no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 19 methylselective-13C_NOESY_HSQC no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 20 2D-1H1H-NOESY no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 21 15N_heteronuclear_{1H}-NOE no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 22 HNCO no . . . . . . . . . . . . . . . 1 $conditions_1 . . . . . . . . . . . . . . . . . . . . . 7056 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 7056 _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 DSS 'methyl protons' . . . . ppm 0.0 internal indirect 0.251449530 . . . . . . . . . 7056 1 H 1 DSS 'methyl protons' . . . . ppm 0 external direct 1.0 'outside sample' cylindrical parallel . . . . . . 7056 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 internal indirect 0.101329118 . . . . . . . . . 7056 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7056 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err 0.15 _Assigned_chem_shift_list.Chem_shift_15N_err 0.06 _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 'Chem shift list for DPDE-trans molecule (major form, 75%)' _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 1H15N_HSQC 1 $sample_1 isotropic 7056 1 2 HNCA 1 $sample_1 isotropic 7056 1 3 HN(CO)CA 1 $sample_1 isotropic 7056 1 4 HN(CA)CO 1 $sample_1 isotropic 7056 1 5 HNCACB 1 $sample_1 isotropic 7056 1 6 CBCA(CO)NH 1 $sample_1 isotropic 7056 1 7 H(CCO)NH 1 $sample_1 isotropic 7056 1 8 (H)C(CO)NH 1 $sample_1 isotropic 7056 1 9 H(C)CH-TOCSY 1 $sample_1 isotropic 7056 1 10 (H)CCH-TOCSY 1 $sample_1 isotropic 7056 1 11 1H13C_HSQC 1 $sample_1 isotropic 7056 1 12 methylselective-1H13C_HSQC 1 $sample_1 isotropic 7056 1 13 13C_NOESY_HSQC 1 $sample_1 isotropic 7056 1 14 15N_NOESY_HSQC 1 $sample_1 isotropic 7056 1 15 HNHA 1 $sample_1 isotropic 7056 1 20 2D-1H1H-NOESY 2 $sample_2 isotropic 7056 1 . HNCO 1 $sample_1 isotropic 7056 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 GLY HA2 H 1 3.695 0.01 . 2 . . . . 677 GLY HA1 . 7056 1 2 . 1 1 1 1 GLY HA3 H 1 3.562 0.01 . 2 . . . . 677 GLY HA2 . 7056 1 3 . 1 1 1 1 GLY CA C 13 43.378 0.15 . 1 . . . . 677 GLY CA . 7056 1 4 . 1 1 2 2 ASP HB2 H 1 2.771 0.01 . 2 . . . . 678 ASP HB1 . 7056 1 5 . 1 1 2 2 ASP HB3 H 1 2.547 0.01 . 2 . . . . 678 ASP HB2 . 7056 1 6 . 1 1 2 2 ASP CA C 13 53.560 0.15 . 1 . . . . 678 ASP CA . 7056 1 7 . 1 1 2 2 ASP CB C 13 40.595 0.15 . 1 . . . . 678 ASP CB . 7056 1 8 . 1 1 3 3 PRO HA H 1 4.374 0.01 . 1 . . . . 679 PRO HA . 7056 1 9 . 1 1 3 3 PRO HB2 H 1 2.305 0.01 . 2 . . . . 679 PRO HB1 . 7056 1 10 . 1 1 3 3 PRO HB3 H 1 1.927 0.01 . 2 . . . . 679 PRO HB2 . 7056 1 11 . 1 1 3 3 PRO HG2 H 1 2.004 0.01 . 1 . . . . 679 PRO HG1 . 7056 1 12 . 1 1 3 3 PRO HG3 H 1 2.004 0.01 . 1 . . . . 679 PRO HG2 . 7056 1 13 . 1 1 3 3 PRO HD2 H 1 3.893 0.01 . 2 . . . . 679 PRO HD1 . 7056 1 14 . 1 1 3 3 PRO HD3 H 1 3.743 0.01 . 2 . . . . 679 PRO HD2 . 7056 1 15 . 1 1 3 3 PRO C C 13 176.795 0.15 . 1 . . . . 679 PRO C . 7056 1 16 . 1 1 3 3 PRO CA C 13 64.054 0.15 . 1 . . . . 679 PRO CA . 7056 1 17 . 1 1 3 3 PRO CB C 13 32.063 0.15 . 1 . . . . 679 PRO CB . 7056 1 18 . 1 1 3 3 PRO CG C 13 27.484 0.15 . 1 . . . . 679 PRO CG . 7056 1 19 . 1 1 3 3 PRO CD C 13 50.824 0.15 . 1 . . . . 679 PRO CD . 7056 1 20 . 1 1 4 4 ASP H H 1 8.351 0.01 . 1 . . . . 680 ASP HN . 7056 1 21 . 1 1 4 4 ASP HA H 1 4.616 0.01 . 1 . . . . 680 ASP HA . 7056 1 22 . 1 1 4 4 ASP HB2 H 1 2.723 0.01 . 2 . . . . 680 ASP HB1 . 7056 1 23 . 1 1 4 4 ASP HB3 H 1 2.548 0.01 . 2 . . . . 680 ASP HB2 . 7056 1 24 . 1 1 4 4 ASP C C 13 176.506 0.15 . 1 . . . . 680 ASP C . 7056 1 25 . 1 1 4 4 ASP CA C 13 54.305 0.15 . 1 . . . . 680 ASP CA . 7056 1 26 . 1 1 4 4 ASP CB C 13 41.202 0.15 . 1 . . . . 680 ASP CB . 7056 1 27 . 1 1 4 4 ASP N N 15 118.950 0.06 . 1 . . . . 680 ASP N . 7056 1 28 . 1 1 5 5 GLU H H 1 8.252 0.01 . 1 . . . . 681 GLU HN . 7056 1 29 . 1 1 5 5 GLU HA H 1 4.318 0.01 . 1 . . . . 681 GLU HA . 7056 1 30 . 1 1 5 5 GLU HB2 H 1 2.127 0.01 . 2 . . . . 681 GLU HB1 . 7056 1 31 . 1 1 5 5 GLU HB3 H 1 1.980 0.01 . 2 . . . . 681 GLU HB2 . 7056 1 32 . 1 1 5 5 GLU HG2 H 1 2.289 0.01 . 2 . . . . 681 GLU HG1 . 7056 1 33 . 1 1 5 5 GLU HG3 H 1 2.268 0.01 . 2 . . . . 681 GLU HG2 . 7056 1 34 . 1 1 5 5 GLU C C 13 176.940 0.15 . 1 . . . . 681 GLU C . 7056 1 35 . 1 1 5 5 GLU CA C 13 56.870 0.15 . 1 . . . . 681 GLU CA . 7056 1 36 . 1 1 5 5 GLU CB C 13 30.190 0.15 . 1 . . . . 681 GLU CB . 7056 1 37 . 1 1 5 5 GLU CG C 13 36.222 0.15 . 1 . . . . 681 GLU CG . 7056 1 38 . 1 1 5 5 GLU N N 15 121.479 0.06 . 1 . . . . 681 GLU N . 7056 1 39 . 1 1 6 6 SER H H 1 8.454 0.01 . 1 . . . . 682 SER HN . 7056 1 40 . 1 1 6 6 SER HA H 1 4.481 0.01 . 1 . . . . 682 SER HA . 7056 1 41 . 1 1 6 6 SER HB2 H 1 3.932 0.01 . 2 . . . . 682 SER HB1 . 7056 1 42 . 1 1 6 6 SER HB3 H 1 3.853 0.01 . 2 . . . . 682 SER HB2 . 7056 1 43 . 1 1 6 6 SER C C 13 175.256 0.15 . 1 . . . . 682 SER C . 7056 1 44 . 1 1 6 6 SER CA C 13 59.016 0.15 . 1 . . . . 682 SER CA . 7056 1 45 . 1 1 6 6 SER CB C 13 63.810 0.15 . 1 . . . . 682 SER CB . 7056 1 46 . 1 1 6 6 SER N N 15 116.713 0.06 . 1 . . . . 682 SER N . 7056 1 47 . 1 1 7 7 THR H H 1 8.206 0.01 . 1 . . . . 683 THR HN . 7056 1 48 . 1 1 7 7 THR HA H 1 4.410 0.01 . 1 . . . . 683 THR HA . 7056 1 49 . 1 1 7 7 THR HB H 1 4.325 0.01 . 1 . . . . 683 THR HB . 7056 1 50 . 1 1 7 7 THR HG21 H 1 1.225 0.01 . 1 . . . . 683 THR HG21 . 7056 1 51 . 1 1 7 7 THR HG22 H 1 1.225 0.01 . 1 . . . . 683 THR HG21 . 7056 1 52 . 1 1 7 7 THR HG23 H 1 1.225 0.01 . 1 . . . . 683 THR HG21 . 7056 1 53 . 1 1 7 7 THR C C 13 174.999 0.15 . 1 . . . . 683 THR C . 7056 1 54 . 1 1 7 7 THR CA C 13 62.191 0.15 . 1 . . . . 683 THR CA . 7056 1 55 . 1 1 7 7 THR CB C 13 69.594 0.15 . 1 . . . . 683 THR CB . 7056 1 56 . 1 1 7 7 THR CG2 C 13 21.618 0.15 . 1 . . . . 683 THR CG2 . 7056 1 57 . 1 1 7 7 THR N N 15 115.459 0.06 . 1 . . . . 683 THR N . 7056 1 58 . 1 1 8 8 SER H H 1 8.348 0.01 . 1 . . . . 684 SER HN . 7056 1 59 . 1 1 8 8 SER HA H 1 4.437 0.01 . 1 . . . . 684 SER HA . 7056 1 60 . 1 1 8 8 SER HB2 H 1 3.902 0.01 . 1 . . . . 684 SER HB1 . 7056 1 61 . 1 1 8 8 SER HB3 H 1 3.902 0.01 . 1 . . . . 684 SER HB2 . 7056 1 62 . 1 1 8 8 SER C C 13 175.231 0.15 . 1 . . . . 684 SER C . 7056 1 63 . 1 1 8 8 SER CA C 13 58.891 0.15 . 1 . . . . 684 SER CA . 7056 1 64 . 1 1 8 8 SER CB C 13 63.839 0.15 . 1 . . . . 684 SER CB . 7056 1 65 . 1 1 8 8 SER N N 15 117.984 0.06 . 1 . . . . 684 SER N . 7056 1 66 . 1 1 9 9 GLY H H 1 8.478 0.01 . 1 . . . . 685 GLY HN . 7056 1 67 . 1 1 9 9 GLY HA2 H 1 4.012 0.01 . 1 . . . . 685 GLY HA1 . 7056 1 68 . 1 1 9 9 GLY HA3 H 1 4.012 0.01 . 1 . . . . 685 GLY HA2 . 7056 1 69 . 1 1 9 9 GLY C C 13 174.716 0.15 . 1 . . . . 685 GLY C . 7056 1 70 . 1 1 9 9 GLY CA C 13 45.685 0.15 . 1 . . . . 685 GLY CA . 7056 1 71 . 1 1 9 9 GLY N N 15 111.026 0.06 . 1 . . . . 685 GLY N . 7056 1 72 . 1 1 10 10 VAL H H 1 8.118 0.01 . 1 . . . . 686 VAL HN . 7056 1 73 . 1 1 10 10 VAL HA H 1 4.077 0.01 . 1 . . . . 686 VAL HA . 7056 1 74 . 1 1 10 10 VAL HB H 1 2.113 0.01 . 1 . . . . 686 VAL HB . 7056 1 75 . 1 1 10 10 VAL HG11 H 1 0.964 0.01 . 2 . . . . 686 VAL HG11 . 7056 1 76 . 1 1 10 10 VAL HG12 H 1 0.964 0.01 . 2 . . . . 686 VAL HG11 . 7056 1 77 . 1 1 10 10 VAL HG13 H 1 0.964 0.01 . 2 . . . . 686 VAL HG11 . 7056 1 78 . 1 1 10 10 VAL HG21 H 1 0.953 0.01 . 2 . . . . 686 VAL HG21 . 7056 1 79 . 1 1 10 10 VAL HG22 H 1 0.953 0.01 . 2 . . . . 686 VAL HG21 . 7056 1 80 . 1 1 10 10 VAL HG23 H 1 0.953 0.01 . 2 . . . . 686 VAL HG21 . 7056 1 81 . 1 1 10 10 VAL C C 13 176.711 0.15 . 1 . . . . 686 VAL C . 7056 1 82 . 1 1 10 10 VAL CA C 13 63.312 0.15 . 1 . . . . 686 VAL CA . 7056 1 83 . 1 1 10 10 VAL CB C 13 32.677 0.15 . 1 . . . . 686 VAL CB . 7056 1 84 . 1 1 10 10 VAL CG1 C 13 20.918 0.15 . 1 . . . . 686 VAL CG1 . 7056 1 85 . 1 1 10 10 VAL CG2 C 13 21.212 0.15 . 1 . . . . 686 VAL CG2 . 7056 1 86 . 1 1 10 10 VAL N N 15 119.913 0.06 . 1 . . . . 686 VAL N . 7056 1 87 . 1 1 11 11 GLU H H 1 8.601 0.01 . 1 . . . . 687 GLU HN . 7056 1 88 . 1 1 11 11 GLU HA H 1 4.174 0.01 . 1 . . . . 687 GLU HA . 7056 1 89 . 1 1 11 11 GLU HB2 H 1 2.023 0.01 . 1 . . . . 687 GLU HB1 . 7056 1 90 . 1 1 11 11 GLU HB3 H 1 2.023 0.01 . 1 . . . . 687 GLU HB2 . 7056 1 91 . 1 1 11 11 GLU HG2 H 1 2.322 0.01 . 2 . . . . 687 GLU HG1 . 7056 1 92 . 1 1 11 11 GLU HG3 H 1 2.254 0.01 . 2 . . . . 687 GLU HG2 . 7056 1 93 . 1 1 11 11 GLU C C 13 177.075 0.15 . 1 . . . . 687 GLU C . 7056 1 94 . 1 1 11 11 GLU CA C 13 57.969 0.15 . 1 . . . . 687 GLU CA . 7056 1 95 . 1 1 11 11 GLU CB C 13 29.946 0.15 . 1 . . . . 687 GLU CB . 7056 1 96 . 1 1 11 11 GLU CG C 13 36.651 0.15 . 1 . . . . 687 GLU CG . 7056 1 97 . 1 1 11 11 GLU N N 15 123.154 0.06 . 1 . . . . 687 GLU N . 7056 1 98 . 1 1 12 12 SER H H 1 8.381 0.01 . 1 . . . . 688 SER HN . 7056 1 99 . 1 1 12 12 SER HA H 1 4.307 0.01 . 1 . . . . 688 SER HA . 7056 1 100 . 1 1 12 12 SER HB2 H 1 3.924 0.01 . 2 . . . . 688 SER HB1 . 7056 1 101 . 1 1 12 12 SER HB3 H 1 3.855 0.01 . 2 . . . . 688 SER HB2 . 7056 1 102 . 1 1 12 12 SER C C 13 175.690 0.15 . 1 . . . . 688 SER C . 7056 1 103 . 1 1 12 12 SER CA C 13 59.439 0.15 . 1 . . . . 688 SER CA . 7056 1 104 . 1 1 12 12 SER CB C 13 63.467 0.15 . 1 . . . . 688 SER CB . 7056 1 105 . 1 1 12 12 SER N N 15 115.659 0.06 . 1 . . . . 688 SER N . 7056 1 106 . 1 1 13 13 ALA H H 1 8.320 0.01 . 1 . . . . 689 ALA HN . 7056 1 107 . 1 1 13 13 ALA HA H 1 4.231 0.01 . 1 . . . . 689 ALA HA . 7056 1 108 . 1 1 13 13 ALA HB1 H 1 1.474 0.01 . 1 . . . . 689 ALA HB1 . 7056 1 109 . 1 1 13 13 ALA HB2 H 1 1.474 0.01 . 1 . . . . 689 ALA HB1 . 7056 1 110 . 1 1 13 13 ALA HB3 H 1 1.474 0.01 . 1 . . . . 689 ALA HB1 . 7056 1 111 . 1 1 13 13 ALA C C 13 179.340 0.15 . 1 . . . . 689 ALA C . 7056 1 112 . 1 1 13 13 ALA CA C 13 54.181 0.15 . 1 . . . . 689 ALA CA . 7056 1 113 . 1 1 13 13 ALA CB C 13 18.717 0.15 . 1 . . . . 689 ALA CB . 7056 1 114 . 1 1 13 13 ALA N N 15 126.320 0.06 . 1 . . . . 689 ALA N . 7056 1 115 . 1 1 14 14 VAL H H 1 7.982 0.01 . 1 . . . . 690 VAL HN . 7056 1 116 . 1 1 14 14 VAL HA H 1 3.937 0.01 . 1 . . . . 690 VAL HA . 7056 1 117 . 1 1 14 14 VAL HB H 1 2.078 0.01 . 1 . . . . 690 VAL HB . 7056 1 118 . 1 1 14 14 VAL HG11 H 1 1.004 0.01 . 2 . . . . 690 VAL HG11 . 7056 1 119 . 1 1 14 14 VAL HG12 H 1 1.004 0.01 . 2 . . . . 690 VAL HG11 . 7056 1 120 . 1 1 14 14 VAL HG13 H 1 1.004 0.01 . 2 . . . . 690 VAL HG11 . 7056 1 121 . 1 1 14 14 VAL HG21 H 1 0.931 0.01 . 2 . . . . 690 VAL HG21 . 7056 1 122 . 1 1 14 14 VAL HG22 H 1 0.931 0.01 . 2 . . . . 690 VAL HG21 . 7056 1 123 . 1 1 14 14 VAL HG23 H 1 0.931 0.01 . 2 . . . . 690 VAL HG21 . 7056 1 124 . 1 1 14 14 VAL C C 13 177.472 0.15 . 1 . . . . 690 VAL C . 7056 1 125 . 1 1 14 14 VAL CA C 13 64.559 0.15 . 1 . . . . 690 VAL CA . 7056 1 126 . 1 1 14 14 VAL CB C 13 32.429 0.15 . 1 . . . . 690 VAL CB . 7056 1 127 . 1 1 14 14 VAL CG1 C 13 21.605 0.15 . 1 . . . . 690 VAL CG1 . 7056 1 128 . 1 1 14 14 VAL CG2 C 13 21.288 0.15 . 1 . . . . 690 VAL CG2 . 7056 1 129 . 1 1 14 14 VAL N N 15 117.763 0.06 . 1 . . . . 690 VAL N . 7056 1 130 . 1 1 15 15 LEU H H 1 8.039 0.01 . 1 . . . . 691 LEU HN . 7056 1 131 . 1 1 15 15 LEU HA H 1 4.404 0.01 . 1 . . . . 691 LEU HA . 7056 1 132 . 1 1 15 15 LEU HB2 H 1 1.714 0.01 . 2 . . . . 691 LEU HB1 . 7056 1 133 . 1 1 15 15 LEU HB3 H 1 1.608 0.01 . 2 . . . . 691 LEU HB2 . 7056 1 134 . 1 1 15 15 LEU HG H 1 1.545 0.01 . 1 . . . . 691 LEU HG . 7056 1 135 . 1 1 15 15 LEU HD11 H 1 0.733 0.01 . 2 . . . . 691 LEU HD11 . 7056 1 136 . 1 1 15 15 LEU HD12 H 1 0.733 0.01 . 2 . . . . 691 LEU HD11 . 7056 1 137 . 1 1 15 15 LEU HD13 H 1 0.733 0.01 . 2 . . . . 691 LEU HD11 . 7056 1 138 . 1 1 15 15 LEU HD21 H 1 0.544 0.01 . 2 . . . . 691 LEU HD21 . 7056 1 139 . 1 1 15 15 LEU HD22 H 1 0.544 0.01 . 2 . . . . 691 LEU HD21 . 7056 1 140 . 1 1 15 15 LEU HD23 H 1 0.544 0.01 . 2 . . . . 691 LEU HD21 . 7056 1 141 . 1 1 15 15 LEU C C 13 176.978 0.15 . 1 . . . . 691 LEU C . 7056 1 142 . 1 1 15 15 LEU CA C 13 54.984 0.15 . 1 . . . . 691 LEU CA . 7056 1 143 . 1 1 15 15 LEU CB C 13 41.720 0.15 . 1 . . . . 691 LEU CB . 7056 1 144 . 1 1 15 15 LEU CG C 13 27.023 0.15 . 1 . . . . 691 LEU CG . 7056 1 145 . 1 1 15 15 LEU CD1 C 13 25.446 0.15 . 1 . . . . 691 LEU CD1 . 7056 1 146 . 1 1 15 15 LEU CD2 C 13 23.216 0.15 . 1 . . . . 691 LEU CD2 . 7056 1 147 . 1 1 15 15 LEU N N 15 120.198 0.06 . 1 . . . . 691 LEU N . 7056 1 148 . 1 1 16 16 ARG H H 1 7.795 0.01 . 1 . . . . 692 ARG HN . 7056 1 149 . 1 1 16 16 ARG HA H 1 4.249 0.01 . 1 . . . . 692 ARG HA . 7056 1 150 . 1 1 16 16 ARG HB2 H 1 1.922 0.01 . 1 . . . . 692 ARG HB1 . 7056 1 151 . 1 1 16 16 ARG HB3 H 1 1.922 0.01 . 1 . . . . 692 ARG HB2 . 7056 1 152 . 1 1 16 16 ARG HG2 H 1 1.836 0.01 . 2 . . . . 692 ARG HG1 . 7056 1 153 . 1 1 16 16 ARG HG3 H 1 1.699 0.01 . 2 . . . . 692 ARG HG2 . 7056 1 154 . 1 1 16 16 ARG HD2 H 1 3.260 0.01 . 1 . . . . 692 ARG HD1 . 7056 1 155 . 1 1 16 16 ARG HD3 H 1 3.260 0.01 . 1 . . . . 692 ARG HD2 . 7056 1 156 . 1 1 16 16 ARG C C 13 178.009 0.15 . 1 . . . . 692 ARG C . 7056 1 157 . 1 1 16 16 ARG CA C 13 58.684 0.15 . 1 . . . . 692 ARG CA . 7056 1 158 . 1 1 16 16 ARG CB C 13 29.953 0.15 . 1 . . . . 692 ARG CB . 7056 1 159 . 1 1 16 16 ARG CG C 13 27.470 0.15 . 1 . . . . 692 ARG CG . 7056 1 160 . 1 1 16 16 ARG CD C 13 43.488 0.15 . 1 . . . . 692 ARG CD . 7056 1 161 . 1 1 16 16 ARG N N 15 121.039 0.06 . 1 . . . . 692 ARG N . 7056 1 162 . 1 1 17 17 GLY HA2 H 1 3.938 0.01 . 2 . . . . 693 GLY HA1 . 7056 1 163 . 1 1 17 17 GLY HA3 H 1 3.879 0.01 . 2 . . . . 693 GLY HA2 . 7056 1 164 . 1 1 17 17 GLY C C 13 173.327 0.15 . 1 . . . . 693 GLY C . 7056 1 165 . 1 1 17 17 GLY CA C 13 45.189 0.15 . 1 . . . . 693 GLY CA . 7056 1 166 . 1 1 18 18 PHE H H 1 8.198 0.01 . 1 . . . . 694 PHE HN . 7056 1 167 . 1 1 18 18 PHE HA H 1 4.949 0.01 . 1 . . . . 694 PHE HA . 7056 1 168 . 1 1 18 18 PHE HB2 H 1 2.947 0.01 . 2 . . . . 694 PHE HB1 . 7056 1 169 . 1 1 18 18 PHE HB3 H 1 2.679 0.01 . 2 . . . . 694 PHE HB2 . 7056 1 170 . 1 1 18 18 PHE HD1 H 1 6.948 0.01 . 1 . . . . 694 PHE HD1 . 7056 1 171 . 1 1 18 18 PHE HD2 H 1 6.948 0.01 . 1 . . . . 694 PHE HD2 . 7056 1 172 . 1 1 18 18 PHE HE1 H 1 7.215 0.01 . 1 . . . . 694 PHE HE1 . 7056 1 173 . 1 1 18 18 PHE HE2 H 1 7.215 0.01 . 1 . . . . 694 PHE HE2 . 7056 1 174 . 1 1 18 18 PHE HZ H 1 7.250 0.01 . 1 . . . . 694 PHE HZ . 7056 1 175 . 1 1 18 18 PHE C C 13 173.802 0.15 . 1 . . . . 694 PHE C . 7056 1 176 . 1 1 18 18 PHE CA C 13 57.510 0.15 . 1 . . . . 694 PHE CA . 7056 1 177 . 1 1 18 18 PHE CB C 13 42.048 0.15 . 1 . . . . 694 PHE CB . 7056 1 178 . 1 1 18 18 PHE CD1 C 13 131.639 0.15 . 1 . . . . 694 PHE CD1 . 7056 1 179 . 1 1 18 18 PHE CD2 C 13 131.639 0.15 . 1 . . . . 694 PHE CD2 . 7056 1 180 . 1 1 18 18 PHE N N 15 119.135 0.06 . 1 . . . . 694 PHE N . 7056 1 181 . 1 1 19 19 LEU H H 1 9.155 0.01 . 1 . . . . 695 LEU HN . 7056 1 182 . 1 1 19 19 LEU HA H 1 4.686 0.01 . 1 . . . . 695 LEU HA . 7056 1 183 . 1 1 19 19 LEU HB2 H 1 1.538 0.01 . 2 . . . . 695 LEU HB1 . 7056 1 184 . 1 1 19 19 LEU HB3 H 1 1.447 0.01 . 2 . . . . 695 LEU HB2 . 7056 1 185 . 1 1 19 19 LEU HG H 1 1.433 0.01 . 1 . . . . 695 LEU HG . 7056 1 186 . 1 1 19 19 LEU HD11 H 1 0.925 0.01 . 2 . . . . 695 LEU HD11 . 7056 1 187 . 1 1 19 19 LEU HD12 H 1 0.925 0.01 . 2 . . . . 695 LEU HD11 . 7056 1 188 . 1 1 19 19 LEU HD13 H 1 0.925 0.01 . 2 . . . . 695 LEU HD11 . 7056 1 189 . 1 1 19 19 LEU HD21 H 1 0.866 0.01 . 2 . . . . 695 LEU HD21 . 7056 1 190 . 1 1 19 19 LEU HD22 H 1 0.866 0.01 . 2 . . . . 695 LEU HD21 . 7056 1 191 . 1 1 19 19 LEU HD23 H 1 0.866 0.01 . 2 . . . . 695 LEU HD21 . 7056 1 192 . 1 1 19 19 LEU C C 13 176.188 0.15 . 1 . . . . 695 LEU C . 7056 1 193 . 1 1 19 19 LEU CA C 13 53.512 0.15 . 1 . . . . 695 LEU CA . 7056 1 194 . 1 1 19 19 LEU CB C 13 44.675 0.15 . 1 . . . . 695 LEU CB . 7056 1 195 . 1 1 19 19 LEU CG C 13 27.296 0.15 . 1 . . . . 695 LEU CG . 7056 1 196 . 1 1 19 19 LEU CD1 C 13 25.060 0.15 . 1 . . . . 695 LEU CD1 . 7056 1 197 . 1 1 19 19 LEU CD2 C 13 24.677 0.15 . 1 . . . . 695 LEU CD2 . 7056 1 198 . 1 1 19 19 LEU N N 15 121.967 0.06 . 1 . . . . 695 LEU N . 7056 1 199 . 1 1 20 20 ILE H H 1 8.900 0.01 . 1 . . . . 696 ILE HN . 7056 1 200 . 1 1 20 20 ILE HA H 1 4.328 0.01 . 1 . . . . 696 ILE HA . 7056 1 201 . 1 1 20 20 ILE HB H 1 1.914 0.01 . 1 . . . . 696 ILE HB . 7056 1 202 . 1 1 20 20 ILE HG12 H 1 1.660 0.01 . 1 . . . . 696 ILE HG11 . 7056 1 203 . 1 1 20 20 ILE HG13 H 1 1.023 0.01 . 1 . . . . 696 ILE HG12 . 7056 1 204 . 1 1 20 20 ILE HG21 H 1 0.872 0.01 . 1 . . . . 696 ILE HG21 . 7056 1 205 . 1 1 20 20 ILE HG22 H 1 0.872 0.01 . 1 . . . . 696 ILE HG21 . 7056 1 206 . 1 1 20 20 ILE HG23 H 1 0.872 0.01 . 1 . . . . 696 ILE HG21 . 7056 1 207 . 1 1 20 20 ILE HD11 H 1 0.822 0.01 . 1 . . . . 696 ILE HD11 . 7056 1 208 . 1 1 20 20 ILE HD12 H 1 0.822 0.01 . 1 . . . . 696 ILE HD11 . 7056 1 209 . 1 1 20 20 ILE HD13 H 1 0.822 0.01 . 1 . . . . 696 ILE HD11 . 7056 1 210 . 1 1 20 20 ILE C C 13 176.755 0.15 . 1 . . . . 696 ILE C . 7056 1 211 . 1 1 20 20 ILE CA C 13 61.955 0.15 . 1 . . . . 696 ILE CA . 7056 1 212 . 1 1 20 20 ILE CB C 13 37.134 0.15 . 1 . . . . 696 ILE CB . 7056 1 213 . 1 1 20 20 ILE CG1 C 13 27.987 0.15 . 1 . . . . 696 ILE CG1 . 7056 1 214 . 1 1 20 20 ILE CG2 C 13 17.467 0.15 . 1 . . . . 696 ILE CG2 . 7056 1 215 . 1 1 20 20 ILE CD1 C 13 12.993 0.15 . 1 . . . . 696 ILE CD1 . 7056 1 216 . 1 1 20 20 ILE N N 15 124.104 0.06 . 1 . . . . 696 ILE N . 7056 1 217 . 1 1 21 21 LEU H H 1 9.458 0.01 . 1 . . . . 697 LEU HN . 7056 1 218 . 1 1 21 21 LEU HA H 1 4.369 0.01 . 1 . . . . 697 LEU HA . 7056 1 219 . 1 1 21 21 LEU HB2 H 1 1.514 0.01 . 2 . . . . 697 LEU HB1 . 7056 1 220 . 1 1 21 21 LEU HB3 H 1 1.377 0.01 . 2 . . . . 697 LEU HB2 . 7056 1 221 . 1 1 21 21 LEU HG H 1 1.535 0.01 . 1 . . . . 697 LEU HG . 7056 1 222 . 1 1 21 21 LEU HD11 H 1 0.732 0.01 . 2 . . . . 697 LEU HD11 . 7056 1 223 . 1 1 21 21 LEU HD12 H 1 0.732 0.01 . 2 . . . . 697 LEU HD11 . 7056 1 224 . 1 1 21 21 LEU HD13 H 1 0.732 0.01 . 2 . . . . 697 LEU HD11 . 7056 1 225 . 1 1 21 21 LEU HD21 H 1 0.773 0.01 . 2 . . . . 697 LEU HD21 . 7056 1 226 . 1 1 21 21 LEU HD22 H 1 0.773 0.01 . 2 . . . . 697 LEU HD21 . 7056 1 227 . 1 1 21 21 LEU HD23 H 1 0.773 0.01 . 2 . . . . 697 LEU HD21 . 7056 1 228 . 1 1 21 21 LEU C C 13 177.554 0.15 . 1 . . . . 697 LEU C . 7056 1 229 . 1 1 21 21 LEU CA C 13 55.424 0.15 . 1 . . . . 697 LEU CA . 7056 1 230 . 1 1 21 21 LEU CB C 13 42.581 0.15 . 1 . . . . 697 LEU CB . 7056 1 231 . 1 1 21 21 LEU CG C 13 27.070 0.15 . 1 . . . . 697 LEU CG . 7056 1 232 . 1 1 21 21 LEU CD1 C 13 25.804 0.15 . 1 . . . . 697 LEU CD1 . 7056 1 233 . 1 1 21 21 LEU CD2 C 13 22.797 0.15 . 1 . . . . 697 LEU CD2 . 7056 1 234 . 1 1 21 21 LEU N N 15 129.126 0.06 . 1 . . . . 697 LEU N . 7056 1 235 . 1 1 22 22 GLY H H 1 7.411 0.01 . 1 . . . . 698 GLY HN . 7056 1 236 . 1 1 22 22 GLY HA2 H 1 4.460 0.01 . 2 . . . . 698 GLY HA1 . 7056 1 237 . 1 1 22 22 GLY HA3 H 1 3.905 0.01 . 2 . . . . 698 GLY HA2 . 7056 1 238 . 1 1 22 22 GLY C C 13 172.077 0.15 . 1 . . . . 698 GLY C . 7056 1 239 . 1 1 22 22 GLY CA C 13 44.984 0.15 . 1 . . . . 698 GLY CA . 7056 1 240 . 1 1 22 22 GLY N N 15 105.222 0.06 . 1 . . . . 698 GLY N . 7056 1 241 . 1 1 23 23 LYS H H 1 8.278 0.01 . 1 . . . . 699 LYS HN . 7056 1 242 . 1 1 23 23 LYS HA H 1 4.404 0.01 . 1 . . . . 699 LYS HA . 7056 1 243 . 1 1 23 23 LYS HB2 H 1 2.060 0.01 . 2 . . . . 699 LYS HB1 . 7056 1 244 . 1 1 23 23 LYS HB3 H 1 1.858 0.01 . 2 . . . . 699 LYS HB2 . 7056 1 245 . 1 1 23 23 LYS HG2 H 1 1.585 0.01 . 1 . . . . 699 LYS HG1 . 7056 1 246 . 1 1 23 23 LYS HG3 H 1 1.585 0.01 . 1 . . . . 699 LYS HG2 . 7056 1 247 . 1 1 23 23 LYS HD2 H 1 1.725 0.01 . 1 . . . . 699 LYS HD1 . 7056 1 248 . 1 1 23 23 LYS HD3 H 1 1.725 0.01 . 1 . . . . 699 LYS HD2 . 7056 1 249 . 1 1 23 23 LYS HE2 H 1 3.076 0.01 . 1 . . . . 699 LYS HE1 . 7056 1 250 . 1 1 23 23 LYS HE3 H 1 3.076 0.01 . 1 . . . . 699 LYS HE2 . 7056 1 251 . 1 1 23 23 LYS C C 13 174.056 0.15 . 1 . . . . 699 LYS C . 7056 1 252 . 1 1 23 23 LYS CA C 13 56.108 0.15 . 1 . . . . 699 LYS CA . 7056 1 253 . 1 1 23 23 LYS CB C 13 32.454 0.15 . 1 . . . . 699 LYS CB . 7056 1 254 . 1 1 23 23 LYS CG C 13 24.760 0.15 . 1 . . . . 699 LYS CG . 7056 1 255 . 1 1 23 23 LYS CD C 13 29.008 0.15 . 1 . . . . 699 LYS CD . 7056 1 256 . 1 1 23 23 LYS CE C 13 42.058 0.15 . 1 . . . . 699 LYS CE . 7056 1 257 . 1 1 23 23 LYS N N 15 120.181 0.06 . 1 . . . . 699 LYS N . 7056 1 258 . 1 1 24 24 GLU H H 1 7.477 0.01 . 1 . . . . 700 GLU HN . 7056 1 259 . 1 1 24 24 GLU HA H 1 3.889 0.01 . 1 . . . . 700 GLU HA . 7056 1 260 . 1 1 24 24 GLU HB2 H 1 1.731 0.01 . 2 . . . . 700 GLU HB1 . 7056 1 261 . 1 1 24 24 GLU HB3 H 1 1.634 0.01 . 2 . . . . 700 GLU HB2 . 7056 1 262 . 1 1 24 24 GLU HG2 H 1 1.841 0.01 . 2 . . . . 700 GLU HG1 . 7056 1 263 . 1 1 24 24 GLU HG3 H 1 1.766 0.01 . 2 . . . . 700 GLU HG2 . 7056 1 264 . 1 1 24 24 GLU C C 13 175.644 0.15 . 1 . . . . 700 GLU C . 7056 1 265 . 1 1 24 24 GLU CA C 13 56.735 0.15 . 1 . . . . 700 GLU CA . 7056 1 266 . 1 1 24 24 GLU CB C 13 30.856 0.15 . 1 . . . . 700 GLU CB . 7056 1 267 . 1 1 24 24 GLU CG C 13 35.501 0.15 . 1 . . . . 700 GLU CG . 7056 1 268 . 1 1 24 24 GLU N N 15 117.979 0.06 . 1 . . . . 700 GLU N . 7056 1 269 . 1 1 25 25 ASP H H 1 8.635 0.01 . 1 . . . . 701 ASP HN . 7056 1 270 . 1 1 25 25 ASP HA H 1 5.073 0.01 . 1 . . . . 701 ASP HA . 7056 1 271 . 1 1 25 25 ASP HB2 H 1 3.231 0.01 . 2 . . . . 701 ASP HB1 . 7056 1 272 . 1 1 25 25 ASP HB3 H 1 2.638 0.01 . 2 . . . . 701 ASP HB2 . 7056 1 273 . 1 1 25 25 ASP C C 13 178.382 0.15 . 1 . . . . 701 ASP C . 7056 1 274 . 1 1 25 25 ASP CA C 13 52.436 0.15 . 1 . . . . 701 ASP CA . 7056 1 275 . 1 1 25 25 ASP CB C 13 43.517 0.15 . 1 . . . . 701 ASP CB . 7056 1 276 . 1 1 25 25 ASP N N 15 124.520 0.06 . 1 . . . . 701 ASP N . 7056 1 277 . 1 1 26 26 ARG H H 1 9.430 0.01 . 1 . . . . 702 ARG HN . 7056 1 278 . 1 1 26 26 ARG HA H 1 4.249 0.01 . 1 . . . . 702 ARG HA . 7056 1 279 . 1 1 26 26 ARG HB2 H 1 1.927 0.01 . 2 . . . . 702 ARG HB1 . 7056 1 280 . 1 1 26 26 ARG HB3 H 1 1.817 0.01 . 2 . . . . 702 ARG HB2 . 7056 1 281 . 1 1 26 26 ARG HG2 H 1 1.666 0.01 . 2 . . . . 702 ARG HG1 . 7056 1 282 . 1 1 26 26 ARG HG3 H 1 1.597 0.01 . 2 . . . . 702 ARG HG2 . 7056 1 283 . 1 1 26 26 ARG HD2 H 1 3.178 0.01 . 1 . . . . 702 ARG HD1 . 7056 1 284 . 1 1 26 26 ARG HD3 H 1 3.178 0.01 . 1 . . . . 702 ARG HD2 . 7056 1 285 . 1 1 26 26 ARG C C 13 177.780 0.15 . 1 . . . . 702 ARG C . 7056 1 286 . 1 1 26 26 ARG CA C 13 58.684 0.15 . 1 . . . . 702 ARG CA . 7056 1 287 . 1 1 26 26 ARG CB C 13 29.593 0.15 . 1 . . . . 702 ARG CB . 7056 1 288 . 1 1 26 26 ARG CG C 13 27.297 0.15 . 1 . . . . 702 ARG CG . 7056 1 289 . 1 1 26 26 ARG CD C 13 43.219 0.15 . 1 . . . . 702 ARG CD . 7056 1 290 . 1 1 26 26 ARG N N 15 127.590 0.06 . 1 . . . . 702 ARG N . 7056 1 291 . 1 1 27 27 ARG H H 1 8.506 0.01 . 1 . . . . 703 ARG HN . 7056 1 292 . 1 1 27 27 ARG HA H 1 3.961 0.01 . 1 . . . . 703 ARG HA . 7056 1 293 . 1 1 27 27 ARG HB2 H 1 1.443 0.01 . 2 . . . . 703 ARG HB1 . 7056 1 294 . 1 1 27 27 ARG HB3 H 1 1.274 0.01 . 2 . . . . 703 ARG HB2 . 7056 1 295 . 1 1 27 27 ARG HG2 H 1 1.436 0.01 . 2 . . . . 703 ARG HG1 . 7056 1 296 . 1 1 27 27 ARG HG3 H 1 1.367 0.01 . 2 . . . . 703 ARG HG2 . 7056 1 297 . 1 1 27 27 ARG HD2 H 1 3.123 0.01 . 2 . . . . 703 ARG HD1 . 7056 1 298 . 1 1 27 27 ARG HD3 H 1 2.981 0.01 . 2 . . . . 703 ARG HD2 . 7056 1 299 . 1 1 27 27 ARG C C 13 177.750 0.15 . 1 . . . . 703 ARG C . 7056 1 300 . 1 1 27 27 ARG CA C 13 58.758 0.15 . 1 . . . . 703 ARG CA . 7056 1 301 . 1 1 27 27 ARG CB C 13 29.681 0.15 . 1 . . . . 703 ARG CB . 7056 1 302 . 1 1 27 27 ARG CG C 13 26.635 0.15 . 1 . . . . 703 ARG CG . 7056 1 303 . 1 1 27 27 ARG CD C 13 43.541 0.15 . 1 . . . . 703 ARG CD . 7056 1 304 . 1 1 27 27 ARG N N 15 121.236 0.06 . 1 . . . . 703 ARG N . 7056 1 305 . 1 1 28 28 TYR H H 1 7.792 0.01 . 1 . . . . 704 TYR HN . 7056 1 306 . 1 1 28 28 TYR HA H 1 4.559 0.01 . 1 . . . . 704 TYR HA . 7056 1 307 . 1 1 28 28 TYR HB2 H 1 3.315 0.01 . 2 . . . . 704 TYR HB1 . 7056 1 308 . 1 1 28 28 TYR HB3 H 1 2.553 0.01 . 2 . . . . 704 TYR HB2 . 7056 1 309 . 1 1 28 28 TYR HD1 H 1 7.136 0.01 . 1 . . . . 704 TYR HD1 . 7056 1 310 . 1 1 28 28 TYR HD2 H 1 7.136 0.01 . 1 . . . . 704 TYR HD2 . 7056 1 311 . 1 1 28 28 TYR HE1 H 1 6.757 0.01 . 1 . . . . 704 TYR HE1 . 7056 1 312 . 1 1 28 28 TYR HE2 H 1 6.757 0.01 . 1 . . . . 704 TYR HE2 . 7056 1 313 . 1 1 28 28 TYR C C 13 176.267 0.15 . 1 . . . . 704 TYR C . 7056 1 314 . 1 1 28 28 TYR CA C 13 58.380 0.15 . 1 . . . . 704 TYR CA . 7056 1 315 . 1 1 28 28 TYR CB C 13 37.346 0.15 . 1 . . . . 704 TYR CB . 7056 1 316 . 1 1 28 28 TYR CD1 C 13 133.563 0.15 . 1 . . . . 704 TYR CD1 . 7056 1 317 . 1 1 28 28 TYR CD2 C 13 133.563 0.15 . 1 . . . . 704 TYR CD2 . 7056 1 318 . 1 1 28 28 TYR CE1 C 13 118.063 0.15 . 1 . . . . 704 TYR CE1 . 7056 1 319 . 1 1 28 28 TYR CE2 C 13 118.063 0.15 . 1 . . . . 704 TYR CE2 . 7056 1 320 . 1 1 28 28 TYR N N 15 114.288 0.06 . 1 . . . . 704 TYR N . 7056 1 321 . 1 1 29 29 GLY H H 1 7.388 0.01 . 1 . . . . 705 GLY HN . 7056 1 322 . 1 1 29 29 GLY HA2 H 1 4.475 0.01 . 2 . . . . 705 GLY HA1 . 7056 1 323 . 1 1 29 29 GLY HA3 H 1 3.955 0.01 . 2 . . . . 705 GLY HA2 . 7056 1 324 . 1 1 29 29 GLY C C 13 171.500 0.15 . 1 . . . . 705 GLY C . 7056 1 325 . 1 1 29 29 GLY CA C 13 45.477 0.15 . 1 . . . . 705 GLY CA . 7056 1 326 . 1 1 29 29 GLY N N 15 107.706 0.06 . 1 . . . . 705 GLY N . 7056 1 327 . 1 1 30 30 PRO HA H 1 4.404 0.01 . 1 . . . . 706 PRO HA . 7056 1 328 . 1 1 30 30 PRO HB2 H 1 2.335 0.01 . 2 . . . . 706 PRO HB1 . 7056 1 329 . 1 1 30 30 PRO HB3 H 1 1.832 0.01 . 2 . . . . 706 PRO HB2 . 7056 1 330 . 1 1 30 30 PRO HG2 H 1 2.036 0.01 . 2 . . . . 706 PRO HG1 . 7056 1 331 . 1 1 30 30 PRO HG3 H 1 1.969 0.01 . 2 . . . . 706 PRO HG2 . 7056 1 332 . 1 1 30 30 PRO HD2 H 1 3.701 0.01 . 2 . . . . 706 PRO HD1 . 7056 1 333 . 1 1 30 30 PRO HD3 H 1 3.638 0.01 . 2 . . . . 706 PRO HD2 . 7056 1 334 . 1 1 30 30 PRO C C 13 176.422 0.15 . 1 . . . . 706 PRO C . 7056 1 335 . 1 1 30 30 PRO CA C 13 62.712 0.15 . 1 . . . . 706 PRO CA . 7056 1 336 . 1 1 30 30 PRO CB C 13 32.460 0.15 . 1 . . . . 706 PRO CB . 7056 1 337 . 1 1 30 30 PRO CG C 13 27.343 0.15 . 1 . . . . 706 PRO CG . 7056 1 338 . 1 1 30 30 PRO CD C 13 49.980 0.15 . 1 . . . . 706 PRO CD . 7056 1 339 . 1 1 31 31 ALA H H 1 8.640 0.01 . 1 . . . . 707 ALA HN . 7056 1 340 . 1 1 31 31 ALA HA H 1 3.952 0.01 . 1 . . . . 707 ALA HA . 7056 1 341 . 1 1 31 31 ALA HB1 H 1 1.196 0.01 . 1 . . . . 707 ALA HB1 . 7056 1 342 . 1 1 31 31 ALA HB2 H 1 1.196 0.01 . 1 . . . . 707 ALA HB1 . 7056 1 343 . 1 1 31 31 ALA HB3 H 1 1.196 0.01 . 1 . . . . 707 ALA HB1 . 7056 1 344 . 1 1 31 31 ALA C C 13 177.483 0.15 . 1 . . . . 707 ALA C . 7056 1 345 . 1 1 31 31 ALA CA C 13 52.485 0.15 . 1 . . . . 707 ALA CA . 7056 1 346 . 1 1 31 31 ALA CB C 13 19.294 0.15 . 1 . . . . 707 ALA CB . 7056 1 347 . 1 1 31 31 ALA N N 15 123.641 0.06 . 1 . . . . 707 ALA N . 7056 1 348 . 1 1 32 32 LEU H H 1 8.964 0.01 . 1 . . . . 708 LEU HN . 7056 1 349 . 1 1 32 32 LEU HA H 1 4.499 0.01 . 1 . . . . 708 LEU HA . 7056 1 350 . 1 1 32 32 LEU HB2 H 1 1.704 0.01 . 2 . . . . 708 LEU HB1 . 7056 1 351 . 1 1 32 32 LEU HB3 H 1 1.589 0.01 . 2 . . . . 708 LEU HB2 . 7056 1 352 . 1 1 32 32 LEU HG H 1 1.980 0.01 . 1 . . . . 708 LEU HG . 7056 1 353 . 1 1 32 32 LEU HD11 H 1 0.812 0.01 . 2 . . . . 708 LEU HD11 . 7056 1 354 . 1 1 32 32 LEU HD12 H 1 0.812 0.01 . 2 . . . . 708 LEU HD11 . 7056 1 355 . 1 1 32 32 LEU HD13 H 1 0.812 0.01 . 2 . . . . 708 LEU HD11 . 7056 1 356 . 1 1 32 32 LEU HD21 H 1 0.832 0.01 . 2 . . . . 708 LEU HD21 . 7056 1 357 . 1 1 32 32 LEU HD22 H 1 0.832 0.01 . 2 . . . . 708 LEU HD21 . 7056 1 358 . 1 1 32 32 LEU HD23 H 1 0.832 0.01 . 2 . . . . 708 LEU HD21 . 7056 1 359 . 1 1 32 32 LEU C C 13 176.925 0.15 . 1 . . . . 708 LEU C . 7056 1 360 . 1 1 32 32 LEU CA C 13 53.690 0.15 . 1 . . . . 708 LEU CA . 7056 1 361 . 1 1 32 32 LEU CB C 13 43.795 0.15 . 1 . . . . 708 LEU CB . 7056 1 362 . 1 1 32 32 LEU CG C 13 27.048 0.15 . 1 . . . . 708 LEU CG . 7056 1 363 . 1 1 32 32 LEU CD1 C 13 25.930 0.15 . 1 . . . . 708 LEU CD1 . 7056 1 364 . 1 1 32 32 LEU CD2 C 13 22.609 0.15 . 1 . . . . 708 LEU CD2 . 7056 1 365 . 1 1 32 32 LEU N N 15 124.931 0.06 . 1 . . . . 708 LEU N . 7056 1 366 . 1 1 33 33 SER H H 1 8.589 0.01 . 1 . . . . 709 SER HN . 7056 1 367 . 1 1 33 33 SER HA H 1 4.796 0.01 . 1 . . . . 709 SER HA . 7056 1 368 . 1 1 33 33 SER HB2 H 1 4.179 0.01 . 2 . . . . 709 SER HB1 . 7056 1 369 . 1 1 33 33 SER HB3 H 1 3.941 0.01 . 2 . . . . 709 SER HB2 . 7056 1 370 . 1 1 33 33 SER C C 13 176.503 0.15 . 1 . . . . 709 SER C . 7056 1 371 . 1 1 33 33 SER CA C 13 57.216 0.15 . 1 . . . . 709 SER CA . 7056 1 372 . 1 1 33 33 SER CB C 13 65.250 0.15 . 1 . . . . 709 SER CB . 7056 1 373 . 1 1 33 33 SER N N 15 114.628 0.06 . 1 . . . . 709 SER N . 7056 1 374 . 1 1 34 34 ILE H H 1 8.786 0.01 . 1 . . . . 710 ILE HN . 7056 1 375 . 1 1 34 34 ILE HA H 1 3.575 0.01 . 1 . . . . 710 ILE HA . 7056 1 376 . 1 1 34 34 ILE HB H 1 1.842 0.01 . 1 . . . . 710 ILE HB . 7056 1 377 . 1 1 34 34 ILE HG12 H 1 1.559 0.01 . 1 . . . . 710 ILE HG11 . 7056 1 378 . 1 1 34 34 ILE HG13 H 1 1.159 0.01 . 1 . . . . 710 ILE HG12 . 7056 1 379 . 1 1 34 34 ILE HG21 H 1 0.860 0.01 . 1 . . . . 710 ILE HG21 . 7056 1 380 . 1 1 34 34 ILE HG22 H 1 0.860 0.01 . 1 . . . . 710 ILE HG21 . 7056 1 381 . 1 1 34 34 ILE HG23 H 1 0.860 0.01 . 1 . . . . 710 ILE HG21 . 7056 1 382 . 1 1 34 34 ILE HD11 H 1 0.841 0.01 . 1 . . . . 710 ILE HD11 . 7056 1 383 . 1 1 34 34 ILE HD12 H 1 0.841 0.01 . 1 . . . . 710 ILE HD11 . 7056 1 384 . 1 1 34 34 ILE HD13 H 1 0.841 0.01 . 1 . . . . 710 ILE HD11 . 7056 1 385 . 1 1 34 34 ILE C C 13 178.089 0.15 . 1 . . . . 710 ILE C . 7056 1 386 . 1 1 34 34 ILE CA C 13 64.126 0.15 . 1 . . . . 710 ILE CA . 7056 1 387 . 1 1 34 34 ILE CB C 13 37.849 0.15 . 1 . . . . 710 ILE CB . 7056 1 388 . 1 1 34 34 ILE CG1 C 13 28.745 0.15 . 1 . . . . 710 ILE CG1 . 7056 1 389 . 1 1 34 34 ILE CG2 C 13 17.678 0.15 . 1 . . . . 710 ILE CG2 . 7056 1 390 . 1 1 34 34 ILE CD1 C 13 13.510 0.15 . 1 . . . . 710 ILE CD1 . 7056 1 391 . 1 1 34 34 ILE N N 15 121.501 0.06 . 1 . . . . 710 ILE N . 7056 1 392 . 1 1 35 35 ASN H H 1 8.272 0.01 . 1 . . . . 711 ASN HN . 7056 1 393 . 1 1 35 35 ASN HA H 1 4.503 0.01 . 1 . . . . 711 ASN HA . 7056 1 394 . 1 1 35 35 ASN HB2 H 1 2.801 0.01 . 2 . . . . 711 ASN HB1 . 7056 1 395 . 1 1 35 35 ASN HB3 H 1 2.763 0.01 . 2 . . . . 711 ASN HB2 . 7056 1 396 . 1 1 35 35 ASN HD21 H 1 7.710 0.01 . 2 . . . . 711 ASN HD21 . 7056 1 397 . 1 1 35 35 ASN HD22 H 1 7.033 0.01 . 2 . . . . 711 ASN HD22 . 7056 1 398 . 1 1 35 35 ASN C C 13 177.054 0.15 . 1 . . . . 711 ASN C . 7056 1 399 . 1 1 35 35 ASN CA C 13 55.437 0.15 . 1 . . . . 711 ASN CA . 7056 1 400 . 1 1 35 35 ASN CB C 13 38.148 0.15 . 1 . . . . 711 ASN CB . 7056 1 401 . 1 1 35 35 ASN CG C 13 176.590 0.15 . 1 . . . . 711 ASN CG . 7056 1 402 . 1 1 35 35 ASN N N 15 116.996 0.06 . 1 . . . . 711 ASN N . 7056 1 403 . 1 1 35 35 ASN ND2 N 15 113.626 0.06 . 1 . . . . 711 ASN ND2 . 7056 1 404 . 1 1 36 36 GLU H H 1 7.766 0.01 . 1 . . . . 712 GLU HN . 7056 1 405 . 1 1 36 36 GLU HA H 1 4.286 0.01 . 1 . . . . 712 GLU HA . 7056 1 406 . 1 1 36 36 GLU HB2 H 1 2.289 0.01 . 1 . . . . 712 GLU HB1 . 7056 1 407 . 1 1 36 36 GLU HB3 H 1 2.289 0.01 . 1 . . . . 712 GLU HB2 . 7056 1 408 . 1 1 36 36 GLU HG2 H 1 2.269 0.01 . 1 . . . . 712 GLU HG1 . 7056 1 409 . 1 1 36 36 GLU HG3 H 1 2.269 0.01 . 1 . . . . 712 GLU HG2 . 7056 1 410 . 1 1 36 36 GLU C C 13 177.858 0.15 . 1 . . . . 712 GLU C . 7056 1 411 . 1 1 36 36 GLU CA C 13 57.262 0.15 . 1 . . . . 712 GLU CA . 7056 1 412 . 1 1 36 36 GLU CB C 13 30.975 0.15 . 1 . . . . 712 GLU CB . 7056 1 413 . 1 1 36 36 GLU CG C 13 37.700 0.15 . 1 . . . . 712 GLU CG . 7056 1 414 . 1 1 36 36 GLU N N 15 118.618 0.06 . 1 . . . . 712 GLU N . 7056 1 415 . 1 1 37 37 LEU H H 1 7.601 0.01 . 1 . . . . 713 LEU HN . 7056 1 416 . 1 1 37 37 LEU HA H 1 3.980 0.01 . 1 . . . . 713 LEU HA . 7056 1 417 . 1 1 37 37 LEU HB2 H 1 1.625 0.01 . 2 . . . . 713 LEU HB1 . 7056 1 418 . 1 1 37 37 LEU HB3 H 1 1.507 0.01 . 2 . . . . 713 LEU HB2 . 7056 1 419 . 1 1 37 37 LEU HG H 1 1.618 0.01 . 1 . . . . 713 LEU HG . 7056 1 420 . 1 1 37 37 LEU HD11 H 1 0.241 0.01 . 2 . . . . 713 LEU HD11 . 7056 1 421 . 1 1 37 37 LEU HD12 H 1 0.241 0.01 . 2 . . . . 713 LEU HD11 . 7056 1 422 . 1 1 37 37 LEU HD13 H 1 0.241 0.01 . 2 . . . . 713 LEU HD11 . 7056 1 423 . 1 1 37 37 LEU HD21 H 1 0.299 0.01 . 2 . . . . 713 LEU HD21 . 7056 1 424 . 1 1 37 37 LEU HD22 H 1 0.299 0.01 . 2 . . . . 713 LEU HD21 . 7056 1 425 . 1 1 37 37 LEU HD23 H 1 0.299 0.01 . 2 . . . . 713 LEU HD21 . 7056 1 426 . 1 1 37 37 LEU C C 13 178.910 0.15 . 1 . . . . 713 LEU C . 7056 1 427 . 1 1 37 37 LEU CA C 13 56.857 0.15 . 1 . . . . 713 LEU CA . 7056 1 428 . 1 1 37 37 LEU CB C 13 41.036 0.15 . 1 . . . . 713 LEU CB . 7056 1 429 . 1 1 37 37 LEU CG C 13 26.105 0.15 . 1 . . . . 713 LEU CG . 7056 1 430 . 1 1 37 37 LEU CD1 C 13 25.172 0.15 . 1 . . . . 713 LEU CD1 . 7056 1 431 . 1 1 37 37 LEU CD2 C 13 22.687 0.15 . 1 . . . . 713 LEU CD2 . 7056 1 432 . 1 1 37 37 LEU N N 15 119.308 0.06 . 1 . . . . 713 LEU N . 7056 1 433 . 1 1 38 38 SER H H 1 7.773 0.01 . 1 . . . . 714 SER HN . 7056 1 434 . 1 1 38 38 SER HA H 1 4.286 0.01 . 1 . . . . 714 SER HA . 7056 1 435 . 1 1 38 38 SER HB2 H 1 3.975 0.01 . 1 . . . . 714 SER HB1 . 7056 1 436 . 1 1 38 38 SER HB3 H 1 3.975 0.01 . 1 . . . . 714 SER HB2 . 7056 1 437 . 1 1 38 38 SER C C 13 174.981 0.15 . 1 . . . . 714 SER C . 7056 1 438 . 1 1 38 38 SER CA C 13 61.126 0.15 . 1 . . . . 714 SER CA . 7056 1 439 . 1 1 38 38 SER CB C 13 62.854 0.15 . 1 . . . . 714 SER CB . 7056 1 440 . 1 1 38 38 SER N N 15 112.864 0.06 . 1 . . . . 714 SER N . 7056 1 441 . 1 1 39 39 ASN H H 1 7.660 0.01 . 1 . . . . 715 ASN HN . 7056 1 442 . 1 1 39 39 ASN HA H 1 4.766 0.01 . 1 . . . . 715 ASN HA . 7056 1 443 . 1 1 39 39 ASN HB2 H 1 2.984 0.01 . 2 . . . . 715 ASN HB1 . 7056 1 444 . 1 1 39 39 ASN HB3 H 1 2.788 0.01 . 2 . . . . 715 ASN HB2 . 7056 1 445 . 1 1 39 39 ASN HD21 H 1 7.689 0.01 . 2 . . . . 715 ASN HD21 . 7056 1 446 . 1 1 39 39 ASN HD22 H 1 7.084 0.01 . 2 . . . . 715 ASN HD22 . 7056 1 447 . 1 1 39 39 ASN C C 13 175.639 0.15 . 1 . . . . 715 ASN C . 7056 1 448 . 1 1 39 39 ASN CA C 13 53.375 0.15 . 1 . . . . 715 ASN CA . 7056 1 449 . 1 1 39 39 ASN CB C 13 39.128 0.15 . 1 . . . . 715 ASN CB . 7056 1 450 . 1 1 39 39 ASN CG C 13 177.060 0.15 . 1 . . . . 715 ASN CG . 7056 1 451 . 1 1 39 39 ASN N N 15 117.096 0.06 . 1 . . . . 715 ASN N . 7056 1 452 . 1 1 39 39 ASN ND2 N 15 113.959 0.06 . 1 . . . . 715 ASN ND2 . 7056 1 453 . 1 1 40 40 LEU H H 1 7.387 0.01 . 1 . . . . 716 LEU HN . 7056 1 454 . 1 1 40 40 LEU HA H 1 4.240 0.01 . 1 . . . . 716 LEU HA . 7056 1 455 . 1 1 40 40 LEU HB2 H 1 1.745 0.01 . 1 . . . . 716 LEU HB1 . 7056 1 456 . 1 1 40 40 LEU HB3 H 1 1.745 0.01 . 1 . . . . 716 LEU HB2 . 7056 1 457 . 1 1 40 40 LEU HG H 1 1.846 0.01 . 1 . . . . 716 LEU HG . 7056 1 458 . 1 1 40 40 LEU HD11 H 1 0.902 0.01 . 2 . . . . 716 LEU HD11 . 7056 1 459 . 1 1 40 40 LEU HD12 H 1 0.902 0.01 . 2 . . . . 716 LEU HD11 . 7056 1 460 . 1 1 40 40 LEU HD13 H 1 0.902 0.01 . 2 . . . . 716 LEU HD11 . 7056 1 461 . 1 1 40 40 LEU HD21 H 1 0.837 0.01 . 2 . . . . 716 LEU HD21 . 7056 1 462 . 1 1 40 40 LEU HD22 H 1 0.837 0.01 . 2 . . . . 716 LEU HD21 . 7056 1 463 . 1 1 40 40 LEU HD23 H 1 0.837 0.01 . 2 . . . . 716 LEU HD21 . 7056 1 464 . 1 1 40 40 LEU C C 13 176.561 0.15 . 1 . . . . 716 LEU C . 7056 1 465 . 1 1 40 40 LEU CA C 13 55.770 0.15 . 1 . . . . 716 LEU CA . 7056 1 466 . 1 1 40 40 LEU CB C 13 43.070 0.15 . 1 . . . . 716 LEU CB . 7056 1 467 . 1 1 40 40 LEU CG C 13 27.661 0.15 . 1 . . . . 716 LEU CG . 7056 1 468 . 1 1 40 40 LEU CD1 C 13 25.431 0.15 . 1 . . . . 716 LEU CD1 . 7056 1 469 . 1 1 40 40 LEU CD2 C 13 24.237 0.15 . 1 . . . . 716 LEU CD2 . 7056 1 470 . 1 1 40 40 LEU N N 15 121.348 0.06 . 1 . . . . 716 LEU N . 7056 1 471 . 1 1 41 41 ALA H H 1 9.013 0.01 . 1 . . . . 717 ALA HN . 7056 1 472 . 1 1 41 41 ALA HA H 1 4.468 0.01 . 1 . . . . 717 ALA HA . 7056 1 473 . 1 1 41 41 ALA HB1 H 1 1.446 0.01 . 1 . . . . 717 ALA HB1 . 7056 1 474 . 1 1 41 41 ALA HB2 H 1 1.446 0.01 . 1 . . . . 717 ALA HB1 . 7056 1 475 . 1 1 41 41 ALA HB3 H 1 1.446 0.01 . 1 . . . . 717 ALA HB1 . 7056 1 476 . 1 1 41 41 ALA C C 13 177.973 0.15 . 1 . . . . 717 ALA C . 7056 1 477 . 1 1 41 41 ALA CA C 13 50.874 0.15 . 1 . . . . 717 ALA CA . 7056 1 478 . 1 1 41 41 ALA CB C 13 20.051 0.15 . 1 . . . . 717 ALA CB . 7056 1 479 . 1 1 41 41 ALA N N 15 126.924 0.06 . 1 . . . . 717 ALA N . 7056 1 480 . 1 1 42 42 LYS H H 1 8.555 0.01 . 1 . . . . 718 LYS HN . 7056 1 481 . 1 1 42 42 LYS HA H 1 3.619 0.01 . 1 . . . . 718 LYS HA . 7056 1 482 . 1 1 42 42 LYS HB2 H 1 1.782 0.01 . 2 . . . . 718 LYS HB1 . 7056 1 483 . 1 1 42 42 LYS HB3 H 1 1.710 0.01 . 2 . . . . 718 LYS HB2 . 7056 1 484 . 1 1 42 42 LYS HG2 H 1 1.557 0.01 . 2 . . . . 718 LYS HG1 . 7056 1 485 . 1 1 42 42 LYS HG3 H 1 1.410 0.01 . 2 . . . . 718 LYS HG2 . 7056 1 486 . 1 1 42 42 LYS HD2 H 1 1.712 0.01 . 1 . . . . 718 LYS HD1 . 7056 1 487 . 1 1 42 42 LYS HD3 H 1 1.712 0.01 . 1 . . . . 718 LYS HD2 . 7056 1 488 . 1 1 42 42 LYS HE2 H 1 2.980 0.01 . 1 . . . . 718 LYS HE1 . 7056 1 489 . 1 1 42 42 LYS HE3 H 1 2.980 0.01 . 1 . . . . 718 LYS HE2 . 7056 1 490 . 1 1 42 42 LYS C C 13 177.880 0.15 . 1 . . . . 718 LYS C . 7056 1 491 . 1 1 42 42 LYS CA C 13 59.031 0.15 . 1 . . . . 718 LYS CA . 7056 1 492 . 1 1 42 42 LYS CB C 13 32.395 0.15 . 1 . . . . 718 LYS CB . 7056 1 493 . 1 1 42 42 LYS CG C 13 25.270 0.15 . 1 . . . . 718 LYS CG . 7056 1 494 . 1 1 42 42 LYS CD C 13 29.601 0.15 . 1 . . . . 718 LYS CD . 7056 1 495 . 1 1 42 42 LYS CE C 13 42.096 0.15 . 1 . . . . 718 LYS CE . 7056 1 496 . 1 1 42 42 LYS N N 15 120.279 0.06 . 1 . . . . 718 LYS N . 7056 1 497 . 1 1 43 43 GLY H H 1 8.486 0.01 . 1 . . . . 719 GLY HN . 7056 1 498 . 1 1 43 43 GLY HA2 H 1 4.208 0.01 . 2 . . . . 719 GLY HA1 . 7056 1 499 . 1 1 43 43 GLY HA3 H 1 3.700 0.01 . 2 . . . . 719 GLY HA2 . 7056 1 500 . 1 1 43 43 GLY C C 13 172.971 0.15 . 1 . . . . 719 GLY C . 7056 1 501 . 1 1 43 43 GLY CA C 13 45.626 0.15 . 1 . . . . 719 GLY CA . 7056 1 502 . 1 1 43 43 GLY N N 15 113.023 0.06 . 1 . . . . 719 GLY N . 7056 1 503 . 1 1 44 44 GLU H H 1 7.877 0.01 . 1 . . . . 720 GLU HN . 7056 1 504 . 1 1 44 44 GLU HA H 1 4.348 0.01 . 1 . . . . 720 GLU HA . 7056 1 505 . 1 1 44 44 GLU HB2 H 1 2.172 0.01 . 2 . . . . 720 GLU HB1 . 7056 1 506 . 1 1 44 44 GLU HB3 H 1 2.085 0.01 . 2 . . . . 720 GLU HB2 . 7056 1 507 . 1 1 44 44 GLU HG2 H 1 2.430 0.01 . 2 . . . . 720 GLU HG1 . 7056 1 508 . 1 1 44 44 GLU HG3 H 1 2.242 0.01 . 2 . . . . 720 GLU HG2 . 7056 1 509 . 1 1 44 44 GLU C C 13 175.125 0.15 . 1 . . . . 720 GLU C . 7056 1 510 . 1 1 44 44 GLU CA C 13 56.653 0.15 . 1 . . . . 720 GLU CA . 7056 1 511 . 1 1 44 44 GLU CB C 13 31.296 0.15 . 1 . . . . 720 GLU CB . 7056 1 512 . 1 1 44 44 GLU CG C 13 37.217 0.15 . 1 . . . . 720 GLU CG . 7056 1 513 . 1 1 44 44 GLU N N 15 121.135 0.06 . 1 . . . . 720 GLU N . 7056 1 514 . 1 1 45 45 LYS H H 1 8.166 0.01 . 1 . . . . 721 LYS HN . 7056 1 515 . 1 1 45 45 LYS HA H 1 5.415 0.01 . 1 . . . . 721 LYS HA . 7056 1 516 . 1 1 45 45 LYS HB2 H 1 1.067 0.01 . 2 . . . . 721 LYS HB1 . 7056 1 517 . 1 1 45 45 LYS HB3 H 1 1.003 0.01 . 2 . . . . 721 LYS HB2 . 7056 1 518 . 1 1 45 45 LYS HG2 H 1 1.334 0.01 . 2 . . . . 721 LYS HG1 . 7056 1 519 . 1 1 45 45 LYS HG3 H 1 0.958 0.01 . 2 . . . . 721 LYS HG2 . 7056 1 520 . 1 1 45 45 LYS HD2 H 1 1.219 0.01 . 2 . . . . 721 LYS HD1 . 7056 1 521 . 1 1 45 45 LYS HD3 H 1 1.155 0.01 . 2 . . . . 721 LYS HD2 . 7056 1 522 . 1 1 45 45 LYS HE2 H 1 2.795 0.01 . 2 . . . . 721 LYS HE1 . 7056 1 523 . 1 1 45 45 LYS HE3 H 1 2.760 0.01 . 2 . . . . 721 LYS HE2 . 7056 1 524 . 1 1 45 45 LYS C C 13 175.830 0.15 . 1 . . . . 721 LYS C . 7056 1 525 . 1 1 45 45 LYS CA C 13 54.736 0.15 . 1 . . . . 721 LYS CA . 7056 1 526 . 1 1 45 45 LYS CB C 13 35.430 0.15 . 1 . . . . 721 LYS CB . 7056 1 527 . 1 1 45 45 LYS CG C 13 25.849 0.15 . 1 . . . . 721 LYS CG . 7056 1 528 . 1 1 45 45 LYS CD C 13 29.967 0.15 . 1 . . . . 721 LYS CD . 7056 1 529 . 1 1 45 45 LYS CE C 13 42.341 0.15 . 1 . . . . 721 LYS CE . 7056 1 530 . 1 1 45 45 LYS N N 15 121.418 0.06 . 1 . . . . 721 LYS N . 7056 1 531 . 1 1 46 46 ALA H H 1 8.551 0.01 . 1 . . . . 722 ALA HN . 7056 1 532 . 1 1 46 46 ALA HA H 1 4.414 0.01 . 1 . . . . 722 ALA HA . 7056 1 533 . 1 1 46 46 ALA HB1 H 1 1.326 0.01 . 1 . . . . 722 ALA HB1 . 7056 1 534 . 1 1 46 46 ALA HB2 H 1 1.326 0.01 . 1 . . . . 722 ALA HB1 . 7056 1 535 . 1 1 46 46 ALA HB3 H 1 1.326 0.01 . 1 . . . . 722 ALA HB1 . 7056 1 536 . 1 1 46 46 ALA C C 13 175.137 0.15 . 1 . . . . 722 ALA C . 7056 1 537 . 1 1 46 46 ALA CA C 13 51.703 0.15 . 1 . . . . 722 ALA CA . 7056 1 538 . 1 1 46 46 ALA CB C 13 23.796 0.15 . 1 . . . . 722 ALA CB . 7056 1 539 . 1 1 46 46 ALA N N 15 120.067 0.06 . 1 . . . . 722 ALA N . 7056 1 540 . 1 1 47 47 ASN H H 1 9.112 0.01 . 1 . . . . 723 ASN HN . 7056 1 541 . 1 1 47 47 ASN HA H 1 5.622 0.01 . 1 . . . . 723 ASN HA . 7056 1 542 . 1 1 47 47 ASN HB2 H 1 2.221 0.01 . 2 . . . . 723 ASN HB1 . 7056 1 543 . 1 1 47 47 ASN HB3 H 1 2.015 0.01 . 2 . . . . 723 ASN HB2 . 7056 1 544 . 1 1 47 47 ASN HD21 H 1 7.803 0.01 . 2 . . . . 723 ASN HD21 . 7056 1 545 . 1 1 47 47 ASN HD22 H 1 7.232 0.01 . 2 . . . . 723 ASN HD22 . 7056 1 546 . 1 1 47 47 ASN C C 13 174.931 0.15 . 1 . . . . 723 ASN C . 7056 1 547 . 1 1 47 47 ASN CA C 13 52.802 0.15 . 1 . . . . 723 ASN CA . 7056 1 548 . 1 1 47 47 ASN CB C 13 40.675 0.15 . 1 . . . . 723 ASN CB . 7056 1 549 . 1 1 47 47 ASN CG C 13 174.300 0.15 . 1 . . . . 723 ASN CG . 7056 1 550 . 1 1 47 47 ASN N N 15 119.540 0.06 . 1 . . . . 723 ASN N . 7056 1 551 . 1 1 47 47 ASN ND2 N 15 115.595 0.06 . 1 . . . . 723 ASN ND2 . 7056 1 552 . 1 1 48 48 VAL H H 1 9.647 0.01 . 1 . . . . 724 VAL HN . 7056 1 553 . 1 1 48 48 VAL HA H 1 4.886 0.01 . 1 . . . . 724 VAL HA . 7056 1 554 . 1 1 48 48 VAL HB H 1 1.630 0.01 . 1 . . . . 724 VAL HB . 7056 1 555 . 1 1 48 48 VAL HG11 H 1 0.673 0.01 . 2 . . . . 724 VAL HG11 . 7056 1 556 . 1 1 48 48 VAL HG12 H 1 0.673 0.01 . 2 . . . . 724 VAL HG11 . 7056 1 557 . 1 1 48 48 VAL HG13 H 1 0.673 0.01 . 2 . . . . 724 VAL HG11 . 7056 1 558 . 1 1 48 48 VAL HG21 H 1 0.644 0.01 . 2 . . . . 724 VAL HG21 . 7056 1 559 . 1 1 48 48 VAL HG22 H 1 0.644 0.01 . 2 . . . . 724 VAL HG21 . 7056 1 560 . 1 1 48 48 VAL HG23 H 1 0.644 0.01 . 2 . . . . 724 VAL HG21 . 7056 1 561 . 1 1 48 48 VAL C C 13 172.724 0.15 . 1 . . . . 724 VAL C . 7056 1 562 . 1 1 48 48 VAL CA C 13 59.579 0.15 . 1 . . . . 724 VAL CA . 7056 1 563 . 1 1 48 48 VAL CB C 13 35.724 0.15 . 1 . . . . 724 VAL CB . 7056 1 564 . 1 1 48 48 VAL CG1 C 13 20.867 0.15 . 1 . . . . 724 VAL CG1 . 7056 1 565 . 1 1 48 48 VAL CG2 C 13 22.440 0.15 . 1 . . . . 724 VAL CG2 . 7056 1 566 . 1 1 48 48 VAL N N 15 121.149 0.06 . 1 . . . . 724 VAL N . 7056 1 567 . 1 1 49 49 LEU H H 1 8.201 0.01 . 1 . . . . 725 LEU HN . 7056 1 568 . 1 1 49 49 LEU HA H 1 4.681 0.01 . 1 . . . . 725 LEU HA . 7056 1 569 . 1 1 49 49 LEU HB2 H 1 1.684 0.01 . 2 . . . . 725 LEU HB1 . 7056 1 570 . 1 1 49 49 LEU HB3 H 1 1.290 0.01 . 2 . . . . 725 LEU HB2 . 7056 1 571 . 1 1 49 49 LEU HG H 1 1.342 0.01 . 1 . . . . 725 LEU HG . 7056 1 572 . 1 1 49 49 LEU HD11 H 1 0.780 0.01 . 2 . . . . 725 LEU HD11 . 7056 1 573 . 1 1 49 49 LEU HD12 H 1 0.780 0.01 . 2 . . . . 725 LEU HD11 . 7056 1 574 . 1 1 49 49 LEU HD13 H 1 0.780 0.01 . 2 . . . . 725 LEU HD11 . 7056 1 575 . 1 1 49 49 LEU HD21 H 1 0.779 0.01 . 2 . . . . 725 LEU HD21 . 7056 1 576 . 1 1 49 49 LEU HD22 H 1 0.779 0.01 . 2 . . . . 725 LEU HD21 . 7056 1 577 . 1 1 49 49 LEU HD23 H 1 0.779 0.01 . 2 . . . . 725 LEU HD21 . 7056 1 578 . 1 1 49 49 LEU C C 13 175.736 0.15 . 1 . . . . 725 LEU C . 7056 1 579 . 1 1 49 49 LEU CA C 13 54.423 0.15 . 1 . . . . 725 LEU CA . 7056 1 580 . 1 1 49 49 LEU CB C 13 42.663 0.15 . 1 . . . . 725 LEU CB . 7056 1 581 . 1 1 49 49 LEU CG C 13 27.301 0.15 . 1 . . . . 725 LEU CG . 7056 1 582 . 1 1 49 49 LEU CD1 C 13 25.452 0.15 . 1 . . . . 725 LEU CD1 . 7056 1 583 . 1 1 49 49 LEU CD2 C 13 25.016 0.15 . 1 . . . . 725 LEU CD2 . 7056 1 584 . 1 1 49 49 LEU N N 15 129.056 0.06 . 1 . . . . 725 LEU N . 7056 1 585 . 1 1 50 50 ILE H H 1 8.609 0.01 . 1 . . . . 726 ILE HN . 7056 1 586 . 1 1 50 50 ILE HA H 1 4.475 0.01 . 1 . . . . 726 ILE HA . 7056 1 587 . 1 1 50 50 ILE HB H 1 1.920 0.01 . 1 . . . . 726 ILE HB . 7056 1 588 . 1 1 50 50 ILE HG12 H 1 1.337 0.01 . 1 . . . . 726 ILE HG11 . 7056 1 589 . 1 1 50 50 ILE HG13 H 1 1.037 0.01 . 1 . . . . 726 ILE HG12 . 7056 1 590 . 1 1 50 50 ILE HG21 H 1 0.792 0.01 . 1 . . . . 726 ILE HG21 . 7056 1 591 . 1 1 50 50 ILE HG22 H 1 0.792 0.01 . 1 . . . . 726 ILE HG21 . 7056 1 592 . 1 1 50 50 ILE HG23 H 1 0.792 0.01 . 1 . . . . 726 ILE HG21 . 7056 1 593 . 1 1 50 50 ILE HD11 H 1 0.726 0.01 . 1 . . . . 726 ILE HD11 . 7056 1 594 . 1 1 50 50 ILE HD12 H 1 0.726 0.01 . 1 . . . . 726 ILE HD11 . 7056 1 595 . 1 1 50 50 ILE HD13 H 1 0.726 0.01 . 1 . . . . 726 ILE HD11 . 7056 1 596 . 1 1 50 50 ILE C C 13 176.176 0.15 . 1 . . . . 726 ILE C . 7056 1 597 . 1 1 50 50 ILE CA C 13 60.536 0.15 . 1 . . . . 726 ILE CA . 7056 1 598 . 1 1 50 50 ILE CB C 13 39.839 0.15 . 1 . . . . 726 ILE CB . 7056 1 599 . 1 1 50 50 ILE CG1 C 13 26.893 0.15 . 1 . . . . 726 ILE CG1 . 7056 1 600 . 1 1 50 50 ILE CG2 C 13 18.261 0.15 . 1 . . . . 726 ILE CG2 . 7056 1 601 . 1 1 50 50 ILE CD1 C 13 13.851 0.15 . 1 . . . . 726 ILE CD1 . 7056 1 602 . 1 1 50 50 ILE N N 15 123.184 0.06 . 1 . . . . 726 ILE N . 7056 1 603 . 1 1 51 51 GLY H H 1 8.410 0.01 . 1 . . . . 727 GLY HN . 7056 1 604 . 1 1 51 51 GLY HA2 H 1 4.054 0.01 . 2 . . . . 727 GLY HA1 . 7056 1 605 . 1 1 51 51 GLY HA3 H 1 3.891 0.01 . 2 . . . . 727 GLY HA2 . 7056 1 606 . 1 1 51 51 GLY C C 13 173.971 0.15 . 1 . . . . 727 GLY C . 7056 1 607 . 1 1 51 51 GLY CA C 13 45.430 0.15 . 1 . . . . 727 GLY CA . 7056 1 608 . 1 1 51 51 GLY N N 15 110.153 0.06 . 1 . . . . 727 GLY N . 7056 1 609 . 1 1 52 52 GLN H H 1 8.844 0.01 . 1 . . . . 728 GLN HN . 7056 1 610 . 1 1 52 52 GLN HA H 1 4.183 0.01 . 1 . . . . 728 GLN HA . 7056 1 611 . 1 1 52 52 GLN HB2 H 1 2.141 0.01 . 2 . . . . 728 GLN HB1 . 7056 1 612 . 1 1 52 52 GLN HB3 H 1 2.056 0.01 . 2 . . . . 728 GLN HB2 . 7056 1 613 . 1 1 52 52 GLN HG2 H 1 2.354 0.01 . 1 . . . . 728 GLN HG1 . 7056 1 614 . 1 1 52 52 GLN HG3 H 1 2.354 0.01 . 1 . . . . 728 GLN HG2 . 7056 1 615 . 1 1 52 52 GLN HE21 H 1 7.633 0.01 . 2 . . . . 728 GLN HE21 . 7056 1 616 . 1 1 52 52 GLN HE22 H 1 6.900 0.01 . 2 . . . . 728 GLN HE22 . 7056 1 617 . 1 1 52 52 GLN C C 13 176.826 0.15 . 1 . . . . 728 GLN C . 7056 1 618 . 1 1 52 52 GLN CA C 13 56.714 0.15 . 1 . . . . 728 GLN CA . 7056 1 619 . 1 1 52 52 GLN CB C 13 27.815 0.15 . 1 . . . . 728 GLN CB . 7056 1 620 . 1 1 52 52 GLN CG C 13 33.875 0.15 . 1 . . . . 728 GLN CG . 7056 1 621 . 1 1 52 52 GLN CD C 13 180.500 0.15 . 1 . . . . 728 GLN CD . 7056 1 622 . 1 1 52 52 GLN N N 15 121.039 0.06 . 1 . . . . 728 GLN N . 7056 1 623 . 1 1 52 52 GLN NE2 N 15 112.944 0.06 . 1 . . . . 728 GLN NE2 . 7056 1 624 . 1 1 53 53 GLY H H 1 8.493 0.01 . 1 . . . . 729 GLY HN . 7056 1 625 . 1 1 53 53 GLY HA2 H 1 4.089 0.01 . 2 . . . . 729 GLY HA1 . 7056 1 626 . 1 1 53 53 GLY HA3 H 1 3.716 0.01 . 2 . . . . 729 GLY HA2 . 7056 1 627 . 1 1 53 53 GLY C C 13 173.570 0.15 . 1 . . . . 729 GLY C . 7056 1 628 . 1 1 53 53 GLY CA C 13 45.884 0.15 . 1 . . . . 729 GLY CA . 7056 1 629 . 1 1 53 53 GLY N N 15 110.161 0.06 . 1 . . . . 729 GLY N . 7056 1 630 . 1 1 54 54 ASP H H 1 7.877 0.01 . 1 . . . . 730 ASP HN . 7056 1 631 . 1 1 54 54 ASP HA H 1 4.803 0.01 . 1 . . . . 730 ASP HA . 7056 1 632 . 1 1 54 54 ASP HB2 H 1 2.571 0.01 . 2 . . . . 730 ASP HB1 . 7056 1 633 . 1 1 54 54 ASP HB3 H 1 2.359 0.01 . 2 . . . . 730 ASP HB2 . 7056 1 634 . 1 1 54 54 ASP C C 13 173.563 0.15 . 1 . . . . 730 ASP C . 7056 1 635 . 1 1 54 54 ASP CA C 13 53.911 0.15 . 1 . . . . 730 ASP CA . 7056 1 636 . 1 1 54 54 ASP CB C 13 41.894 0.15 . 1 . . . . 730 ASP CB . 7056 1 637 . 1 1 54 54 ASP N N 15 121.816 0.06 . 1 . . . . 730 ASP N . 7056 1 638 . 1 1 55 55 VAL H H 1 8.290 0.01 . 1 . . . . 731 VAL HN . 7056 1 639 . 1 1 55 55 VAL HA H 1 5.003 0.01 . 1 . . . . 731 VAL HA . 7056 1 640 . 1 1 55 55 VAL HB H 1 1.852 0.01 . 1 . . . . 731 VAL HB . 7056 1 641 . 1 1 55 55 VAL HG11 H 1 0.710 0.01 . 2 . . . . 731 VAL HG11 . 7056 1 642 . 1 1 55 55 VAL HG12 H 1 0.710 0.01 . 2 . . . . 731 VAL HG11 . 7056 1 643 . 1 1 55 55 VAL HG13 H 1 0.710 0.01 . 2 . . . . 731 VAL HG11 . 7056 1 644 . 1 1 55 55 VAL HG21 H 1 0.834 0.01 . 2 . . . . 731 VAL HG21 . 7056 1 645 . 1 1 55 55 VAL HG22 H 1 0.834 0.01 . 2 . . . . 731 VAL HG21 . 7056 1 646 . 1 1 55 55 VAL HG23 H 1 0.834 0.01 . 2 . . . . 731 VAL HG21 . 7056 1 647 . 1 1 55 55 VAL C C 13 176.189 0.15 . 1 . . . . 731 VAL C . 7056 1 648 . 1 1 55 55 VAL CA C 13 61.021 0.15 . 1 . . . . 731 VAL CA . 7056 1 649 . 1 1 55 55 VAL CB C 13 33.757 0.15 . 1 . . . . 731 VAL CB . 7056 1 650 . 1 1 55 55 VAL CG1 C 13 23.196 0.15 . 1 . . . . 731 VAL CG1 . 7056 1 651 . 1 1 55 55 VAL CG2 C 13 21.955 0.15 . 1 . . . . 731 VAL CG2 . 7056 1 652 . 1 1 55 55 VAL N N 15 123.045 0.06 . 1 . . . . 731 VAL N . 7056 1 653 . 1 1 56 56 VAL H H 1 8.623 0.01 . 1 . . . . 732 VAL HN . 7056 1 654 . 1 1 56 56 VAL HA H 1 4.829 0.01 . 1 . . . . 732 VAL HA . 7056 1 655 . 1 1 56 56 VAL HB H 1 2.248 0.01 . 1 . . . . 732 VAL HB . 7056 1 656 . 1 1 56 56 VAL HG11 H 1 0.809 0.01 . 2 . . . . 732 VAL HG11 . 7056 1 657 . 1 1 56 56 VAL HG12 H 1 0.809 0.01 . 2 . . . . 732 VAL HG11 . 7056 1 658 . 1 1 56 56 VAL HG13 H 1 0.809 0.01 . 2 . . . . 732 VAL HG11 . 7056 1 659 . 1 1 56 56 VAL HG21 H 1 0.709 0.01 . 2 . . . . 732 VAL HG21 . 7056 1 660 . 1 1 56 56 VAL HG22 H 1 0.709 0.01 . 2 . . . . 732 VAL HG21 . 7056 1 661 . 1 1 56 56 VAL HG23 H 1 0.709 0.01 . 2 . . . . 732 VAL HG21 . 7056 1 662 . 1 1 56 56 VAL C C 13 172.946 0.15 . 1 . . . . 732 VAL C . 7056 1 663 . 1 1 56 56 VAL CA C 13 58.597 0.15 . 1 . . . . 732 VAL CA . 7056 1 664 . 1 1 56 56 VAL CB C 13 35.215 0.15 . 1 . . . . 732 VAL CB . 7056 1 665 . 1 1 56 56 VAL CG1 C 13 22.413 0.15 . 1 . . . . 732 VAL CG1 . 7056 1 666 . 1 1 56 56 VAL CG2 C 13 18.586 0.15 . 1 . . . . 732 VAL CG2 . 7056 1 667 . 1 1 56 56 VAL N N 15 119.848 0.06 . 1 . . . . 732 VAL N . 7056 1 668 . 1 1 57 57 LEU H H 1 8.267 0.01 . 1 . . . . 733 LEU HN . 7056 1 669 . 1 1 57 57 LEU HA H 1 4.835 0.01 . 1 . . . . 733 LEU HA . 7056 1 670 . 1 1 57 57 LEU HB2 H 1 1.407 0.01 . 2 . . . . 733 LEU HB1 . 7056 1 671 . 1 1 57 57 LEU HB3 H 1 1.361 0.01 . 2 . . . . 733 LEU HB2 . 7056 1 672 . 1 1 57 57 LEU HG H 1 0.790 0.01 . 1 . . . . 733 LEU HG . 7056 1 673 . 1 1 57 57 LEU HD11 H 1 0.569 0.01 . 2 . . . . 733 LEU HD11 . 7056 1 674 . 1 1 57 57 LEU HD12 H 1 0.569 0.01 . 2 . . . . 733 LEU HD11 . 7056 1 675 . 1 1 57 57 LEU HD13 H 1 0.569 0.01 . 2 . . . . 733 LEU HD11 . 7056 1 676 . 1 1 57 57 LEU HD21 H 1 0.569 0.01 . 2 . . . . 733 LEU HD21 . 7056 1 677 . 1 1 57 57 LEU HD22 H 1 0.569 0.01 . 2 . . . . 733 LEU HD21 . 7056 1 678 . 1 1 57 57 LEU HD23 H 1 0.569 0.01 . 2 . . . . 733 LEU HD21 . 7056 1 679 . 1 1 57 57 LEU C C 13 176.447 0.15 . 1 . . . . 733 LEU C . 7056 1 680 . 1 1 57 57 LEU CA C 13 54.289 0.15 . 1 . . . . 733 LEU CA . 7056 1 681 . 1 1 57 57 LEU CB C 13 43.416 0.15 . 1 . . . . 733 LEU CB . 7056 1 682 . 1 1 57 57 LEU CG C 13 27.186 0.15 . 1 . . . . 733 LEU CG . 7056 1 683 . 1 1 57 57 LEU CD1 C 13 23.779 0.15 . 1 . . . . 733 LEU CD1 . 7056 1 684 . 1 1 57 57 LEU CD2 C 13 23.779 0.15 . 1 . . . . 733 LEU CD2 . 7056 1 685 . 1 1 57 57 LEU N N 15 124.302 0.06 . 1 . . . . 733 LEU N . 7056 1 686 . 1 1 58 58 VAL H H 1 9.233 0.01 . 1 . . . . 734 VAL HN . 7056 1 687 . 1 1 58 58 VAL HA H 1 5.626 0.01 . 1 . . . . 734 VAL HA . 7056 1 688 . 1 1 58 58 VAL HB H 1 2.145 0.01 . 1 . . . . 734 VAL HB . 7056 1 689 . 1 1 58 58 VAL HG11 H 1 0.761 0.01 . 2 . . . . 734 VAL HG11 . 7056 1 690 . 1 1 58 58 VAL HG12 H 1 0.761 0.01 . 2 . . . . 734 VAL HG11 . 7056 1 691 . 1 1 58 58 VAL HG13 H 1 0.761 0.01 . 2 . . . . 734 VAL HG11 . 7056 1 692 . 1 1 58 58 VAL HG21 H 1 0.602 0.01 . 2 . . . . 734 VAL HG21 . 7056 1 693 . 1 1 58 58 VAL HG22 H 1 0.602 0.01 . 2 . . . . 734 VAL HG21 . 7056 1 694 . 1 1 58 58 VAL HG23 H 1 0.602 0.01 . 2 . . . . 734 VAL HG21 . 7056 1 695 . 1 1 58 58 VAL C C 13 174.229 0.15 . 1 . . . . 734 VAL C . 7056 1 696 . 1 1 58 58 VAL CA C 13 58.200 0.15 . 1 . . . . 734 VAL CA . 7056 1 697 . 1 1 58 58 VAL CB C 13 36.529 0.15 . 1 . . . . 734 VAL CB . 7056 1 698 . 1 1 58 58 VAL CG1 C 13 22.470 0.15 . 1 . . . . 734 VAL CG1 . 7056 1 699 . 1 1 58 58 VAL CG2 C 13 19.038 0.15 . 1 . . . . 734 VAL CG2 . 7056 1 700 . 1 1 58 58 VAL N N 15 119.408 0.06 . 1 . . . . 734 VAL N . 7056 1 701 . 1 1 59 59 MET H H 1 8.569 0.01 . 1 . . . . 735 MET HN . 7056 1 702 . 1 1 59 59 MET HA H 1 5.160 0.01 . 1 . . . . 735 MET HA . 7056 1 703 . 1 1 59 59 MET HB2 H 1 1.878 0.01 . 1 . . . . 735 MET HB1 . 7056 1 704 . 1 1 59 59 MET HB3 H 1 1.878 0.01 . 1 . . . . 735 MET HB2 . 7056 1 705 . 1 1 59 59 MET HG2 H 1 2.291 0.01 . 2 . . . . 735 MET HG1 . 7056 1 706 . 1 1 59 59 MET HG3 H 1 2.164 0.01 . 2 . . . . 735 MET HG2 . 7056 1 707 . 1 1 59 59 MET HE1 H 1 2.050 0.01 . 1 . . . . 735 MET HE1 . 7056 1 708 . 1 1 59 59 MET HE2 H 1 2.050 0.01 . 1 . . . . 735 MET HE1 . 7056 1 709 . 1 1 59 59 MET HE3 H 1 2.050 0.01 . 1 . . . . 735 MET HE1 . 7056 1 710 . 1 1 59 59 MET C C 13 175.478 0.15 . 1 . . . . 735 MET C . 7056 1 711 . 1 1 59 59 MET CA C 13 53.890 0.15 . 1 . . . . 735 MET CA . 7056 1 712 . 1 1 59 59 MET CB C 13 38.290 0.15 . 1 . . . . 735 MET CB . 7056 1 713 . 1 1 59 59 MET CG C 13 30.320 0.15 . 1 . . . . 735 MET CG . 7056 1 714 . 1 1 59 59 MET CE C 13 17.160 0.15 . 1 . . . . 735 MET CE . 7056 1 715 . 1 1 59 59 MET N N 15 115.458 0.06 . 1 . . . . 735 MET N . 7056 1 716 . 1 1 60 60 LYS H H 1 8.958 0.01 . 1 . . . . 736 LYS HN . 7056 1 717 . 1 1 60 60 LYS HA H 1 3.670 0.01 . 1 . . . . 736 LYS HA . 7056 1 718 . 1 1 60 60 LYS HB2 H 1 1.966 0.01 . 2 . . . . 736 LYS HB1 . 7056 1 719 . 1 1 60 60 LYS HB3 H 1 1.409 0.01 . 2 . . . . 736 LYS HB2 . 7056 1 720 . 1 1 60 60 LYS HG2 H 1 1.190 0.01 . 2 . . . . 736 LYS HG1 . 7056 1 721 . 1 1 60 60 LYS HG3 H 1 0.784 0.01 . 2 . . . . 736 LYS HG2 . 7056 1 722 . 1 1 60 60 LYS HD2 H 1 1.367 0.01 . 2 . . . . 736 LYS HD1 . 7056 1 723 . 1 1 60 60 LYS HD3 H 1 1.289 0.01 . 2 . . . . 736 LYS HD2 . 7056 1 724 . 1 1 60 60 LYS HE2 H 1 2.861 0.01 . 1 . . . . 736 LYS HE1 . 7056 1 725 . 1 1 60 60 LYS HE3 H 1 2.861 0.01 . 1 . . . . 736 LYS HE2 . 7056 1 726 . 1 1 60 60 LYS C C 13 176.557 0.15 . 1 . . . . 736 LYS C . 7056 1 727 . 1 1 60 60 LYS CA C 13 57.500 0.15 . 1 . . . . 736 LYS CA . 7056 1 728 . 1 1 60 60 LYS CB C 13 32.287 0.15 . 1 . . . . 736 LYS CB . 7056 1 729 . 1 1 60 60 LYS CG C 13 25.545 0.15 . 1 . . . . 736 LYS CG . 7056 1 730 . 1 1 60 60 LYS CD C 13 29.297 0.15 . 1 . . . . 736 LYS CD . 7056 1 731 . 1 1 60 60 LYS CE C 13 42.564 0.15 . 1 . . . . 736 LYS CE . 7056 1 732 . 1 1 60 60 LYS N N 15 127.418 0.06 . 1 . . . . 736 LYS N . 7056 1 733 . 1 1 61 61 ARG H H 1 7.942 0.01 . 1 . . . . 737 ARG HN . 7056 1 734 . 1 1 61 61 ARG HA H 1 4.045 0.01 . 1 . . . . 737 ARG HA . 7056 1 735 . 1 1 61 61 ARG HB2 H 1 1.728 0.01 . 2 . . . . 737 ARG HB1 . 7056 1 736 . 1 1 61 61 ARG HB3 H 1 1.427 0.01 . 2 . . . . 737 ARG HB2 . 7056 1 737 . 1 1 61 61 ARG HG2 H 1 1.534 0.01 . 2 . . . . 737 ARG HG1 . 7056 1 738 . 1 1 61 61 ARG HG3 H 1 1.362 0.01 . 2 . . . . 737 ARG HG2 . 7056 1 739 . 1 1 61 61 ARG HD2 H 1 3.122 0.01 . 2 . . . . 737 ARG HD1 . 7056 1 740 . 1 1 61 61 ARG HD3 H 1 3.008 0.01 . 2 . . . . 737 ARG HD2 . 7056 1 741 . 1 1 61 61 ARG C C 13 176.179 0.15 . 1 . . . . 737 ARG C . 7056 1 742 . 1 1 61 61 ARG CA C 13 57.399 0.15 . 1 . . . . 737 ARG CA . 7056 1 743 . 1 1 61 61 ARG CB C 13 31.224 0.15 . 1 . . . . 737 ARG CB . 7056 1 744 . 1 1 61 61 ARG CG C 13 28.707 0.15 . 1 . . . . 737 ARG CG . 7056 1 745 . 1 1 61 61 ARG CD C 13 43.587 0.15 . 1 . . . . 737 ARG CD . 7056 1 746 . 1 1 61 61 ARG N N 15 126.489 0.06 . 1 . . . . 737 ARG N . 7056 1 747 . 1 1 62 62 LYS H H 1 8.586 0.01 . 1 . . . . 738 LYS HN . 7056 1 748 . 1 1 62 62 LYS HA H 1 4.151 0.01 . 1 . . . . 738 LYS HA . 7056 1 749 . 1 1 62 62 LYS HB2 H 1 1.830 0.01 . 2 . . . . 738 LYS HB1 . 7056 1 750 . 1 1 62 62 LYS HB3 H 1 1.728 0.01 . 2 . . . . 738 LYS HB2 . 7056 1 751 . 1 1 62 62 LYS HG2 H 1 1.435 0.01 . 2 . . . . 738 LYS HG1 . 7056 1 752 . 1 1 62 62 LYS HG3 H 1 1.348 0.01 . 2 . . . . 738 LYS HG2 . 7056 1 753 . 1 1 62 62 LYS HD2 H 1 1.646 0.01 . 1 . . . . 738 LYS HD1 . 7056 1 754 . 1 1 62 62 LYS HD3 H 1 1.646 0.01 . 1 . . . . 738 LYS HD2 . 7056 1 755 . 1 1 62 62 LYS HE2 H 1 2.956 0.01 . 1 . . . . 738 LYS HE1 . 7056 1 756 . 1 1 62 62 LYS HE3 H 1 2.956 0.01 . 1 . . . . 738 LYS HE2 . 7056 1 757 . 1 1 62 62 LYS C C 13 176.200 0.15 . 1 . . . . 738 LYS C . 7056 1 758 . 1 1 62 62 LYS CA C 13 56.989 0.15 . 1 . . . . 738 LYS CA . 7056 1 759 . 1 1 62 62 LYS CB C 13 33.540 0.15 . 1 . . . . 738 LYS CB . 7056 1 760 . 1 1 62 62 LYS CG C 13 25.437 0.15 . 1 . . . . 738 LYS CG . 7056 1 761 . 1 1 62 62 LYS CD C 13 29.514 0.15 . 1 . . . . 738 LYS CD . 7056 1 762 . 1 1 62 62 LYS CE C 13 42.088 0.15 . 1 . . . . 738 LYS CE . 7056 1 763 . 1 1 62 62 LYS N N 15 122.001 0.06 . 1 . . . . 738 LYS N . 7056 1 764 . 1 1 63 63 ARG H H 1 8.200 0.01 . 1 . . . . 739 ARG HN . 7056 1 765 . 1 1 63 63 ARG HA H 1 4.317 0.01 . 1 . . . . 739 ARG HA . 7056 1 766 . 1 1 63 63 ARG HB2 H 1 1.816 0.01 . 2 . . . . 739 ARG HB1 . 7056 1 767 . 1 1 63 63 ARG HB3 H 1 1.753 0.01 . 2 . . . . 739 ARG HB2 . 7056 1 768 . 1 1 63 63 ARG HG2 H 1 1.596 0.01 . 1 . . . . 739 ARG HG1 . 7056 1 769 . 1 1 63 63 ARG HG3 H 1 1.596 0.01 . 1 . . . . 739 ARG HG2 . 7056 1 770 . 1 1 63 63 ARG HD2 H 1 3.162 0.01 . 1 . . . . 739 ARG HD1 . 7056 1 771 . 1 1 63 63 ARG HD3 H 1 3.162 0.01 . 1 . . . . 739 ARG HD2 . 7056 1 772 . 1 1 63 63 ARG C C 13 175.130 0.15 . 1 . . . . 739 ARG C . 7056 1 773 . 1 1 63 63 ARG CA C 13 55.900 0.15 . 1 . . . . 739 ARG CA . 7056 1 774 . 1 1 63 63 ARG CB C 13 31.309 0.15 . 1 . . . . 739 ARG CB . 7056 1 775 . 1 1 63 63 ARG CG C 13 27.065 0.15 . 1 . . . . 739 ARG CG . 7056 1 776 . 1 1 63 63 ARG CD C 13 43.455 0.15 . 1 . . . . 739 ARG CD . 7056 1 777 . 1 1 63 63 ARG N N 15 121.310 0.06 . 1 . . . . 739 ARG N . 7056 1 778 . 1 1 64 64 ASP H H 1 8.136 0.01 . 1 . . . . 740 ASP HN . 7056 1 779 . 1 1 64 64 ASP HA H 1 4.276 0.01 . 1 . . . . 740 ASP HA . 7056 1 780 . 1 1 64 64 ASP C C 13 180.961 0.15 . 1 . . . . 740 ASP C . 7056 1 781 . 1 1 64 64 ASP CA C 13 56.993 0.15 . 1 . . . . 740 ASP CA . 7056 1 782 . 1 1 64 64 ASP N N 15 128.063 0.06 . 1 . . . . 740 ASP N . 7056 1 783 . 1 1 65 65 SER HA H 1 4.435 0.01 . 1 . . . . 741 SER HA . 7056 1 784 . 1 1 65 65 SER HB2 H 1 3.945 0.01 . 1 . . . . 741 SER HB1 . 7056 1 785 . 1 1 65 65 SER HB3 H 1 3.945 0.01 . 1 . . . . 741 SER HB2 . 7056 1 786 . 1 1 65 65 SER C C 13 174.740 0.15 . 1 . . . . 741 SER C . 7056 1 787 . 1 1 65 65 SER CA C 13 58.597 0.15 . 1 . . . . 741 SER CA . 7056 1 788 . 1 1 65 65 SER CB C 13 63.777 0.15 . 1 . . . . 741 SER CB . 7056 1 789 . 1 1 66 66 SER H H 1 8.550 0.01 . 1 . . . . 742 SER HN . 7056 1 790 . 1 1 66 66 SER HA H 1 4.406 0.01 . 1 . . . . 742 SER HA . 7056 1 791 . 1 1 66 66 SER HB2 H 1 3.859 0.01 . 1 . . . . 742 SER HB1 . 7056 1 792 . 1 1 66 66 SER HB3 H 1 3.859 0.01 . 1 . . . . 742 SER HB2 . 7056 1 793 . 1 1 66 66 SER C C 13 174.480 0.15 . 1 . . . . 742 SER C . 7056 1 794 . 1 1 66 66 SER CA C 13 58.955 0.15 . 1 . . . . 742 SER CA . 7056 1 795 . 1 1 66 66 SER CB C 13 63.932 0.15 . 1 . . . . 742 SER CB . 7056 1 796 . 1 1 66 66 SER N N 15 118.440 0.06 . 1 . . . . 742 SER N . 7056 1 797 . 1 1 67 67 ILE H H 1 8.045 0.01 . 1 . . . . 743 ILE HN . 7056 1 798 . 1 1 67 67 ILE HA H 1 4.175 0.01 . 1 . . . . 743 ILE HA . 7056 1 799 . 1 1 67 67 ILE HB H 1 1.884 0.01 . 1 . . . . 743 ILE HB . 7056 1 800 . 1 1 67 67 ILE HG12 H 1 1.450 0.01 . 1 . . . . 743 ILE HG11 . 7056 1 801 . 1 1 67 67 ILE HG13 H 1 1.170 0.01 . 1 . . . . 743 ILE HG12 . 7056 1 802 . 1 1 67 67 ILE HG21 H 1 0.872 0.01 . 1 . . . . 743 ILE HG21 . 7056 1 803 . 1 1 67 67 ILE HG22 H 1 0.872 0.01 . 1 . . . . 743 ILE HG21 . 7056 1 804 . 1 1 67 67 ILE HG23 H 1 0.872 0.01 . 1 . . . . 743 ILE HG21 . 7056 1 805 . 1 1 67 67 ILE HD11 H 1 0.839 0.01 . 1 . . . . 743 ILE HD11 . 7056 1 806 . 1 1 67 67 ILE HD12 H 1 0.839 0.01 . 1 . . . . 743 ILE HD11 . 7056 1 807 . 1 1 67 67 ILE HD13 H 1 0.839 0.01 . 1 . . . . 743 ILE HD11 . 7056 1 808 . 1 1 67 67 ILE C C 13 176.401 0.15 . 1 . . . . 743 ILE C . 7056 1 809 . 1 1 67 67 ILE CA C 13 61.444 0.15 . 1 . . . . 743 ILE CA . 7056 1 810 . 1 1 67 67 ILE CB C 13 38.800 0.15 . 1 . . . . 743 ILE CB . 7056 1 811 . 1 1 67 67 ILE CG1 C 13 27.366 0.15 . 1 . . . . 743 ILE CG1 . 7056 1 812 . 1 1 67 67 ILE CG2 C 13 17.576 0.15 . 1 . . . . 743 ILE CG2 . 7056 1 813 . 1 1 67 67 ILE CD1 C 13 12.954 0.15 . 1 . . . . 743 ILE CD1 . 7056 1 814 . 1 1 67 67 ILE N N 15 122.128 0.06 . 1 . . . . 743 ILE N . 7056 1 815 . 1 1 68 68 LEU H H 1 8.333 0.01 . 1 . . . . 744 LEU HN . 7056 1 816 . 1 1 68 68 LEU HA H 1 4.449 0.01 . 1 . . . . 744 LEU HA . 7056 1 817 . 1 1 68 68 LEU HB2 H 1 1.681 0.01 . 2 . . . . 744 LEU HB1 . 7056 1 818 . 1 1 68 68 LEU HB3 H 1 1.590 0.01 . 2 . . . . 744 LEU HB2 . 7056 1 819 . 1 1 68 68 LEU HG H 1 1.638 0.01 . 1 . . . . 744 LEU HG . 7056 1 820 . 1 1 68 68 LEU HD11 H 1 0.925 0.01 . 2 . . . . 744 LEU HD11 . 7056 1 821 . 1 1 68 68 LEU HD12 H 1 0.925 0.01 . 2 . . . . 744 LEU HD11 . 7056 1 822 . 1 1 68 68 LEU HD13 H 1 0.925 0.01 . 2 . . . . 744 LEU HD11 . 7056 1 823 . 1 1 68 68 LEU HD21 H 1 0.860 0.01 . 2 . . . . 744 LEU HD21 . 7056 1 824 . 1 1 68 68 LEU HD22 H 1 0.860 0.01 . 2 . . . . 744 LEU HD21 . 7056 1 825 . 1 1 68 68 LEU HD23 H 1 0.860 0.01 . 2 . . . . 744 LEU HD21 . 7056 1 826 . 1 1 68 68 LEU C C 13 177.765 0.15 . 1 . . . . 744 LEU C . 7056 1 827 . 1 1 68 68 LEU CA C 13 55.338 0.15 . 1 . . . . 744 LEU CA . 7056 1 828 . 1 1 68 68 LEU CB C 13 42.263 0.15 . 1 . . . . 744 LEU CB . 7056 1 829 . 1 1 68 68 LEU CG C 13 27.039 0.15 . 1 . . . . 744 LEU CG . 7056 1 830 . 1 1 68 68 LEU CD1 C 13 25.060 0.15 . 1 . . . . 744 LEU CD1 . 7056 1 831 . 1 1 68 68 LEU CD2 C 13 23.379 0.15 . 1 . . . . 744 LEU CD2 . 7056 1 832 . 1 1 68 68 LEU N N 15 125.944 0.06 . 1 . . . . 744 LEU N . 7056 1 833 . 1 1 69 69 THR H H 1 8.137 0.01 . 1 . . . . 745 THR HN . 7056 1 834 . 1 1 69 69 THR HA H 1 4.301 0.01 . 1 . . . . 745 THR HA . 7056 1 835 . 1 1 69 69 THR HB H 1 4.278 0.01 . 1 . . . . 745 THR HB . 7056 1 836 . 1 1 69 69 THR HG21 H 1 1.199 0.01 . 1 . . . . 745 THR HG21 . 7056 1 837 . 1 1 69 69 THR HG22 H 1 1.199 0.01 . 1 . . . . 745 THR HG21 . 7056 1 838 . 1 1 69 69 THR HG23 H 1 1.199 0.01 . 1 . . . . 745 THR HG21 . 7056 1 839 . 1 1 69 69 THR C C 13 174.646 0.15 . 1 . . . . 745 THR C . 7056 1 840 . 1 1 69 69 THR CA C 13 61.979 0.15 . 1 . . . . 745 THR CA . 7056 1 841 . 1 1 69 69 THR CB C 13 69.914 0.15 . 1 . . . . 745 THR CB . 7056 1 842 . 1 1 69 69 THR CG2 C 13 21.619 0.15 . 1 . . . . 745 THR CG2 . 7056 1 843 . 1 1 69 69 THR N N 15 114.474 0.06 . 1 . . . . 745 THR N . 7056 1 844 . 1 1 70 70 ASP H H 1 8.434 0.01 . 1 . . . . 746 ASP HN . 7056 1 845 . 1 1 70 70 ASP HA H 1 4.629 0.01 . 1 . . . . 746 ASP HA . 7056 1 846 . 1 1 70 70 ASP HB2 H 1 2.732 0.01 . 2 . . . . 746 ASP HB1 . 7056 1 847 . 1 1 70 70 ASP HB3 H 1 2.697 0.01 . 2 . . . . 746 ASP HB2 . 7056 1 848 . 1 1 70 70 ASP C C 13 176.804 0.15 . 1 . . . . 746 ASP C . 7056 1 849 . 1 1 70 70 ASP CA C 13 54.788 0.15 . 1 . . . . 746 ASP CA . 7056 1 850 . 1 1 70 70 ASP CB C 13 41.104 0.15 . 1 . . . . 746 ASP CB . 7056 1 851 . 1 1 70 70 ASP N N 15 122.781 0.06 . 1 . . . . 746 ASP N . 7056 1 852 . 1 1 71 71 SER H H 1 8.363 0.01 . 1 . . . . 747 SER HN . 7056 1 853 . 1 1 71 71 SER HA H 1 4.393 0.01 . 1 . . . . 747 SER HA . 7056 1 854 . 1 1 71 71 SER HB2 H 1 3.945 0.01 . 2 . . . . 747 SER HB1 . 7056 1 855 . 1 1 71 71 SER HB3 H 1 3.883 0.01 . 2 . . . . 747 SER HB2 . 7056 1 856 . 1 1 71 71 SER C C 13 175.292 0.15 . 1 . . . . 747 SER C . 7056 1 857 . 1 1 71 71 SER CA C 13 59.228 0.15 . 1 . . . . 747 SER CA . 7056 1 858 . 1 1 71 71 SER CB C 13 63.537 0.15 . 1 . . . . 747 SER CB . 7056 1 859 . 1 1 71 71 SER N N 15 116.322 0.06 . 1 . . . . 747 SER N . 7056 1 860 . 1 1 72 72 GLN H H 1 8.446 0.01 . 1 . . . . 748 GLN HN . 7056 1 861 . 1 1 72 72 GLN HA H 1 4.365 0.01 . 1 . . . . 748 GLN HA . 7056 1 862 . 1 1 72 72 GLN HB2 H 1 2.171 0.01 . 2 . . . . 748 GLN HB1 . 7056 1 863 . 1 1 72 72 GLN HB3 H 1 2.093 0.01 . 2 . . . . 748 GLN HB2 . 7056 1 864 . 1 1 72 72 GLN HG2 H 1 2.417 0.01 . 2 . . . . 748 GLN HG1 . 7056 1 865 . 1 1 72 72 GLN HG3 H 1 2.386 0.01 . 2 . . . . 748 GLN HG2 . 7056 1 866 . 1 1 72 72 GLN HE21 H 1 7.646 0.01 . 2 . . . . 748 GLN HE21 . 7056 1 867 . 1 1 72 72 GLN HE22 H 1 6.900 0.01 . 2 . . . . 748 GLN HE22 . 7056 1 868 . 1 1 72 72 GLN C C 13 176.773 0.15 . 1 . . . . 748 GLN C . 7056 1 869 . 1 1 72 72 GLN CA C 13 56.552 0.15 . 1 . . . . 748 GLN CA . 7056 1 870 . 1 1 72 72 GLN CB C 13 29.295 0.15 . 1 . . . . 748 GLN CB . 7056 1 871 . 1 1 72 72 GLN CG C 13 34.092 0.15 . 1 . . . . 748 GLN CG . 7056 1 872 . 1 1 72 72 GLN CD C 13 180.630 0.15 . 1 . . . . 748 GLN CD . 7056 1 873 . 1 1 72 72 GLN N N 15 121.917 0.06 . 1 . . . . 748 GLN N . 7056 1 874 . 1 1 72 72 GLN NE2 N 15 112.886 0.06 . 1 . . . . 748 GLN NE2 . 7056 1 875 . 1 1 73 73 THR H H 1 8.131 0.01 . 1 . . . . 749 THR HN . 7056 1 876 . 1 1 73 73 THR HA H 1 4.234 0.01 . 1 . . . . 749 THR HA . 7056 1 877 . 1 1 73 73 THR HB H 1 4.244 0.01 . 1 . . . . 749 THR HB . 7056 1 878 . 1 1 73 73 THR HG21 H 1 1.225 0.01 . 1 . . . . 749 THR HG21 . 7056 1 879 . 1 1 73 73 THR HG22 H 1 1.225 0.01 . 1 . . . . 749 THR HG21 . 7056 1 880 . 1 1 73 73 THR HG23 H 1 1.225 0.01 . 1 . . . . 749 THR HG21 . 7056 1 881 . 1 1 73 73 THR C C 13 174.795 0.15 . 1 . . . . 749 THR C . 7056 1 882 . 1 1 73 73 THR CA C 13 62.727 0.15 . 1 . . . . 749 THR CA . 7056 1 883 . 1 1 73 73 THR CB C 13 69.617 0.15 . 1 . . . . 749 THR CB . 7056 1 884 . 1 1 73 73 THR CG2 C 13 21.731 0.15 . 1 . . . . 749 THR CG2 . 7056 1 885 . 1 1 73 73 THR N N 15 114.835 0.06 . 1 . . . . 749 THR N . 7056 1 886 . 1 1 74 74 ALA H H 1 8.301 0.01 . 1 . . . . 750 ALA HN . 7056 1 887 . 1 1 74 74 ALA HA H 1 4.330 0.01 . 1 . . . . 750 ALA HA . 7056 1 888 . 1 1 74 74 ALA HB1 H 1 1.427 0.01 . 1 . . . . 750 ALA HB1 . 7056 1 889 . 1 1 74 74 ALA HB2 H 1 1.427 0.01 . 1 . . . . 750 ALA HB1 . 7056 1 890 . 1 1 74 74 ALA HB3 H 1 1.427 0.01 . 1 . . . . 750 ALA HB1 . 7056 1 891 . 1 1 74 74 ALA C C 13 178.300 0.15 . 1 . . . . 750 ALA C . 7056 1 892 . 1 1 74 74 ALA CA C 13 53.251 0.15 . 1 . . . . 750 ALA CA . 7056 1 893 . 1 1 74 74 ALA CB C 13 19.176 0.15 . 1 . . . . 750 ALA CB . 7056 1 894 . 1 1 74 74 ALA N N 15 126.111 0.06 . 1 . . . . 750 ALA N . 7056 1 895 . 1 1 75 75 THR H H 1 8.097 0.01 . 1 . . . . 751 THR HN . 7056 1 896 . 1 1 75 75 THR HA H 1 4.238 0.01 . 1 . . . . 751 THR HA . 7056 1 897 . 1 1 75 75 THR HB H 1 4.202 0.01 . 1 . . . . 751 THR HB . 7056 1 898 . 1 1 75 75 THR HG21 H 1 1.225 0.01 . 1 . . . . 751 THR HG21 . 7056 1 899 . 1 1 75 75 THR HG22 H 1 1.225 0.01 . 1 . . . . 751 THR HG21 . 7056 1 900 . 1 1 75 75 THR HG23 H 1 1.225 0.01 . 1 . . . . 751 THR HG21 . 7056 1 901 . 1 1 75 75 THR C C 13 174.787 0.15 . 1 . . . . 751 THR C . 7056 1 902 . 1 1 75 75 THR CA C 13 62.665 0.15 . 1 . . . . 751 THR CA . 7056 1 903 . 1 1 75 75 THR CB C 13 69.704 0.15 . 1 . . . . 751 THR CB . 7056 1 904 . 1 1 75 75 THR CG2 C 13 21.725 0.15 . 1 . . . . 751 THR CG2 . 7056 1 905 . 1 1 75 75 THR N N 15 113.611 0.06 . 1 . . . . 751 THR N . 7056 1 906 . 1 1 76 76 LYS H H 1 8.256 0.01 . 1 . . . . 752 LYS HN . 7056 1 907 . 1 1 76 76 LYS HA H 1 4.261 0.01 . 1 . . . . 752 LYS HA . 7056 1 908 . 1 1 76 76 LYS HB2 H 1 1.845 0.01 . 2 . . . . 752 LYS HB1 . 7056 1 909 . 1 1 76 76 LYS HB3 H 1 1.785 0.01 . 2 . . . . 752 LYS HB2 . 7056 1 910 . 1 1 76 76 LYS HG2 H 1 1.473 0.01 . 2 . . . . 752 LYS HG1 . 7056 1 911 . 1 1 76 76 LYS HG3 H 1 1.414 0.01 . 2 . . . . 752 LYS HG2 . 7056 1 912 . 1 1 76 76 LYS HD2 H 1 1.673 0.01 . 1 . . . . 752 LYS HD1 . 7056 1 913 . 1 1 76 76 LYS HD3 H 1 1.673 0.01 . 1 . . . . 752 LYS HD2 . 7056 1 914 . 1 1 76 76 LYS HE2 H 1 2.968 0.01 . 1 . . . . 752 LYS HE1 . 7056 1 915 . 1 1 76 76 LYS HE3 H 1 2.968 0.01 . 1 . . . . 752 LYS HE2 . 7056 1 916 . 1 1 76 76 LYS C C 13 176.574 0.15 . 1 . . . . 752 LYS C . 7056 1 917 . 1 1 76 76 LYS CA C 13 56.798 0.15 . 1 . . . . 752 LYS CA . 7056 1 918 . 1 1 76 76 LYS CB C 13 32.951 0.15 . 1 . . . . 752 LYS CB . 7056 1 919 . 1 1 76 76 LYS CG C 13 24.923 0.15 . 1 . . . . 752 LYS CG . 7056 1 920 . 1 1 76 76 LYS CD C 13 29.189 0.15 . 1 . . . . 752 LYS CD . 7056 1 921 . 1 1 76 76 LYS CE C 13 42.220 0.15 . 1 . . . . 752 LYS CE . 7056 1 922 . 1 1 76 76 LYS N N 15 123.922 0.06 . 1 . . . . 752 LYS N . 7056 1 923 . 1 1 77 77 ARG H H 1 8.299 0.01 . 1 . . . . 753 ARG HN . 7056 1 924 . 1 1 77 77 ARG HA H 1 4.314 0.01 . 1 . . . . 753 ARG HA . 7056 1 925 . 1 1 77 77 ARG HB2 H 1 1.814 0.01 . 2 . . . . 753 ARG HB1 . 7056 1 926 . 1 1 77 77 ARG HB3 H 1 1.748 0.01 . 2 . . . . 753 ARG HB2 . 7056 1 927 . 1 1 77 77 ARG HG2 H 1 1.639 0.01 . 2 . . . . 753 ARG HG1 . 7056 1 928 . 1 1 77 77 ARG HG3 H 1 1.572 0.01 . 2 . . . . 753 ARG HG2 . 7056 1 929 . 1 1 77 77 ARG HD2 H 1 3.182 0.01 . 1 . . . . 753 ARG HD1 . 7056 1 930 . 1 1 77 77 ARG HD3 H 1 3.182 0.01 . 1 . . . . 753 ARG HD2 . 7056 1 931 . 1 1 77 77 ARG C C 13 176.508 0.15 . 1 . . . . 753 ARG C . 7056 1 932 . 1 1 77 77 ARG CA C 13 56.406 0.15 . 1 . . . . 753 ARG CA . 7056 1 933 . 1 1 77 77 ARG CB C 13 30.846 0.15 . 1 . . . . 753 ARG CB . 7056 1 934 . 1 1 77 77 ARG CG C 13 27.252 0.15 . 1 . . . . 753 ARG CG . 7056 1 935 . 1 1 77 77 ARG CD C 13 43.440 0.15 . 1 . . . . 753 ARG CD . 7056 1 936 . 1 1 77 77 ARG N N 15 122.358 0.06 . 1 . . . . 753 ARG N . 7056 1 937 . 1 1 78 78 ILE H H 1 8.215 0.01 . 1 . . . . 754 ILE HN . 7056 1 938 . 1 1 78 78 ILE HA H 1 4.112 0.01 . 1 . . . . 754 ILE HA . 7056 1 939 . 1 1 78 78 ILE HB H 1 1.863 0.01 . 1 . . . . 754 ILE HB . 7056 1 940 . 1 1 78 78 ILE HG12 H 1 1.501 0.01 . 1 . . . . 754 ILE HG11 . 7056 1 941 . 1 1 78 78 ILE HG13 H 1 1.192 0.01 . 1 . . . . 754 ILE HG12 . 7056 1 942 . 1 1 78 78 ILE HG21 H 1 0.873 0.01 . 1 . . . . 754 ILE HG21 . 7056 1 943 . 1 1 78 78 ILE HG22 H 1 0.873 0.01 . 1 . . . . 754 ILE HG21 . 7056 1 944 . 1 1 78 78 ILE HG23 H 1 0.873 0.01 . 1 . . . . 754 ILE HG21 . 7056 1 945 . 1 1 78 78 ILE HD11 H 1 0.839 0.01 . 1 . . . . 754 ILE HD11 . 7056 1 946 . 1 1 78 78 ILE HD12 H 1 0.839 0.01 . 1 . . . . 754 ILE HD11 . 7056 1 947 . 1 1 78 78 ILE HD13 H 1 0.839 0.01 . 1 . . . . 754 ILE HD11 . 7056 1 948 . 1 1 78 78 ILE C C 13 176.290 0.15 . 1 . . . . 754 ILE C . 7056 1 949 . 1 1 78 78 ILE CA C 13 61.409 0.15 . 1 . . . . 754 ILE CA . 7056 1 950 . 1 1 78 78 ILE CB C 13 38.678 0.15 . 1 . . . . 754 ILE CB . 7056 1 951 . 1 1 78 78 ILE CG1 C 13 27.555 0.15 . 1 . . . . 754 ILE CG1 . 7056 1 952 . 1 1 78 78 ILE CG2 C 13 17.630 0.15 . 1 . . . . 754 ILE CG2 . 7056 1 953 . 1 1 78 78 ILE CD1 C 13 12.954 0.15 . 1 . . . . 754 ILE CD1 . 7056 1 954 . 1 1 78 78 ILE N N 15 122.679 0.06 . 1 . . . . 754 ILE N . 7056 1 955 . 1 1 79 79 ARG H H 1 8.417 0.01 . 1 . . . . 755 ARG HN . 7056 1 956 . 1 1 79 79 ARG HA H 1 4.329 0.01 . 1 . . . . 755 ARG HA . 7056 1 957 . 1 1 79 79 ARG HB2 H 1 1.815 0.01 . 2 . . . . 755 ARG HB1 . 7056 1 958 . 1 1 79 79 ARG HB3 H 1 1.766 0.01 . 2 . . . . 755 ARG HB2 . 7056 1 959 . 1 1 79 79 ARG HG2 H 1 1.626 0.01 . 2 . . . . 755 ARG HG1 . 7056 1 960 . 1 1 79 79 ARG HG3 H 1 1.580 0.01 . 2 . . . . 755 ARG HG2 . 7056 1 961 . 1 1 79 79 ARG HD2 H 1 3.180 0.01 . 1 . . . . 755 ARG HD1 . 7056 1 962 . 1 1 79 79 ARG HD3 H 1 3.180 0.01 . 1 . . . . 755 ARG HD2 . 7056 1 963 . 1 1 79 79 ARG C C 13 176.171 0.15 . 1 . . . . 755 ARG C . 7056 1 964 . 1 1 79 79 ARG CA C 13 56.222 0.15 . 1 . . . . 755 ARG CA . 7056 1 965 . 1 1 79 79 ARG CB C 13 30.842 0.15 . 1 . . . . 755 ARG CB . 7056 1 966 . 1 1 79 79 ARG CG C 13 27.290 0.15 . 1 . . . . 755 ARG CG . 7056 1 967 . 1 1 79 79 ARG CD C 13 43.391 0.15 . 1 . . . . 755 ARG CD . 7056 1 968 . 1 1 79 79 ARG N N 15 125.176 0.06 . 1 . . . . 755 ARG N . 7056 1 969 . 1 1 80 80 MET H H 1 8.404 0.01 . 1 . . . . 756 MET HN . 7056 1 970 . 1 1 80 80 MET HA H 1 4.429 0.01 . 1 . . . . 756 MET HA . 7056 1 971 . 1 1 80 80 MET HB2 H 1 2.084 0.01 . 2 . . . . 756 MET HB1 . 7056 1 972 . 1 1 80 80 MET HB3 H 1 2.003 0.01 . 2 . . . . 756 MET HB2 . 7056 1 973 . 1 1 80 80 MET HG2 H 1 2.626 0.01 . 2 . . . . 756 MET HG1 . 7056 1 974 . 1 1 80 80 MET HG3 H 1 2.550 0.01 . 2 . . . . 756 MET HG2 . 7056 1 975 . 1 1 80 80 MET HE1 H 1 2.097 0.01 . 1 . . . . 756 MET HE1 . 7056 1 976 . 1 1 80 80 MET HE2 H 1 2.097 0.01 . 1 . . . . 756 MET HE1 . 7056 1 977 . 1 1 80 80 MET HE3 H 1 2.097 0.01 . 1 . . . . 756 MET HE1 . 7056 1 978 . 1 1 80 80 MET C C 13 175.754 0.15 . 1 . . . . 756 MET C . 7056 1 979 . 1 1 80 80 MET CA C 13 55.338 0.15 . 1 . . . . 756 MET CA . 7056 1 980 . 1 1 80 80 MET CB C 13 33.079 0.15 . 1 . . . . 756 MET CB . 7056 1 981 . 1 1 80 80 MET CG C 13 32.000 0.15 . 1 . . . . 756 MET CG . 7056 1 982 . 1 1 80 80 MET CE C 13 16.968 0.15 . 1 . . . . 756 MET CE . 7056 1 983 . 1 1 80 80 MET N N 15 122.225 0.06 . 1 . . . . 756 MET N . 7056 1 984 . 1 1 81 81 ALA H H 1 8.313 0.01 . 1 . . . . 757 ALA HN . 7056 1 985 . 1 1 81 81 ALA HA H 1 4.346 0.01 . 1 . . . . 757 ALA HA . 7056 1 986 . 1 1 81 81 ALA HB1 H 1 1.398 0.01 . 1 . . . . 757 ALA HB1 . 7056 1 987 . 1 1 81 81 ALA HB2 H 1 1.398 0.01 . 1 . . . . 757 ALA HB1 . 7056 1 988 . 1 1 81 81 ALA HB3 H 1 1.398 0.01 . 1 . . . . 757 ALA HB1 . 7056 1 989 . 1 1 81 81 ALA C C 13 177.389 0.15 . 1 . . . . 757 ALA C . 7056 1 990 . 1 1 81 81 ALA CA C 13 52.443 0.15 . 1 . . . . 757 ALA CA . 7056 1 991 . 1 1 81 81 ALA CB C 13 19.358 0.15 . 1 . . . . 757 ALA CB . 7056 1 992 . 1 1 81 81 ALA N N 15 125.584 0.06 . 1 . . . . 757 ALA N . 7056 1 993 . 1 1 82 82 ILE H H 1 8.170 0.01 . 1 . . . . 758 ILE HN . 7056 1 994 . 1 1 82 82 ILE HA H 1 4.183 0.01 . 1 . . . . 758 ILE HA . 7056 1 995 . 1 1 82 82 ILE HB H 1 1.888 0.01 . 1 . . . . 758 ILE HB . 7056 1 996 . 1 1 82 82 ILE HG12 H 1 1.468 0.01 . 1 . . . . 758 ILE HG11 . 7056 1 997 . 1 1 82 82 ILE HG13 H 1 1.171 0.01 . 1 . . . . 758 ILE HG12 . 7056 1 998 . 1 1 82 82 ILE HG21 H 1 0.898 0.01 . 1 . . . . 758 ILE HG21 . 7056 1 999 . 1 1 82 82 ILE HG22 H 1 0.898 0.01 . 1 . . . . 758 ILE HG21 . 7056 1 1000 . 1 1 82 82 ILE HG23 H 1 0.898 0.01 . 1 . . . . 758 ILE HG21 . 7056 1 1001 . 1 1 82 82 ILE HD11 H 1 0.839 0.01 . 1 . . . . 758 ILE HD11 . 7056 1 1002 . 1 1 82 82 ILE HD12 H 1 0.839 0.01 . 1 . . . . 758 ILE HD11 . 7056 1 1003 . 1 1 82 82 ILE HD13 H 1 0.839 0.01 . 1 . . . . 758 ILE HD11 . 7056 1 1004 . 1 1 82 82 ILE C C 13 175.303 0.15 . 1 . . . . 758 ILE C . 7056 1 1005 . 1 1 82 82 ILE CA C 13 61.236 0.15 . 1 . . . . 758 ILE CA . 7056 1 1006 . 1 1 82 82 ILE CB C 13 38.938 0.15 . 1 . . . . 758 ILE CB . 7056 1 1007 . 1 1 82 82 ILE CG1 C 13 27.052 0.15 . 1 . . . . 758 ILE CG1 . 7056 1 1008 . 1 1 82 82 ILE CG2 C 13 17.600 0.15 . 1 . . . . 758 ILE CG2 . 7056 1 1009 . 1 1 82 82 ILE CD1 C 13 13.110 0.15 . 1 . . . . 758 ILE CD1 . 7056 1 1010 . 1 1 82 82 ILE N N 15 119.935 0.06 . 1 . . . . 758 ILE N . 7056 1 1011 . 1 1 83 83 ASN H H 1 8.038 0.01 . 1 . . . . 759 ASN HN . 7056 1 1012 . 1 1 83 83 ASN HA H 1 4.465 0.01 . 1 . . . . 759 ASN HA . 7056 1 1013 . 1 1 83 83 ASN HB2 H 1 2.739 0.01 . 2 . . . . 759 ASN HB1 . 7056 1 1014 . 1 1 83 83 ASN HB3 H 1 2.681 0.01 . 2 . . . . 759 ASN HB2 . 7056 1 1015 . 1 1 83 83 ASN HD21 H 1 7.570 0.01 . 2 . . . . 759 ASN HD21 . 7056 1 1016 . 1 1 83 83 ASN HD22 H 1 6.845 0.01 . 2 . . . . 759 ASN HD22 . 7056 1 1017 . 1 1 83 83 ASN C C 13 179.478 0.15 . 1 . . . . 759 ASN C . 7056 1 1018 . 1 1 83 83 ASN CA C 13 54.765 0.15 . 1 . . . . 759 ASN CA . 7056 1 1019 . 1 1 83 83 ASN CB C 13 40.495 0.15 . 1 . . . . 759 ASN CB . 7056 1 1020 . 1 1 83 83 ASN CG C 13 178.220 0.15 . 1 . . . . 759 ASN CG . 7056 1 1021 . 1 1 83 83 ASN N N 15 127.510 0.06 . 1 . . . . 759 ASN N . 7056 1 1022 . 1 1 83 83 ASN ND2 N 15 113.178 0.06 . 1 . . . . 759 ASN ND2 . 7056 1 1023 . 2 1 1 1 GLY HA2 H 1 3.695 0.01 . 2 . . . . 677 GLY HA1 . 7056 1 1024 . 2 1 1 1 GLY HA3 H 1 3.562 0.01 . 2 . . . . 677 GLY HA2 . 7056 1 1025 . 2 1 1 1 GLY CA C 13 43.378 0.15 . 1 . . . . 677 GLY CA . 7056 1 1026 . 2 1 2 2 ASP HB2 H 1 2.623 0.01 . 2 . . . . 678 ASP HB1 . 7056 1 1027 . 2 1 2 2 ASP HB3 H 1 2.483 0.01 . 2 . . . . 678 ASP HB2 . 7056 1 1028 . 2 1 2 2 ASP CA C 13 52.616 0.15 . 1 . . . . 678 ASP CA . 7056 1 1029 . 2 1 2 2 ASP CB C 13 42.681 0.15 . 1 . . . . 678 ASP CB . 7056 1 1030 . 2 1 3 3 PRO HB2 H 1 2.318 0.01 . 2 . . . . 679 PRO HB1 . 7056 1 1031 . 2 1 3 3 PRO HB3 H 1 2.083 0.01 . 2 . . . . 679 PRO HB2 . 7056 1 1032 . 2 1 3 3 PRO HG2 H 1 1.936 0.01 . 2 . . . . 679 PRO HG1 . 7056 1 1033 . 2 1 3 3 PRO HG3 H 1 1.845 0.01 . 2 . . . . 679 PRO HG2 . 7056 1 1034 . 2 1 3 3 PRO HD2 H 1 3.561 0.01 . 2 . . . . 679 PRO HD1 . 7056 1 1035 . 2 1 3 3 PRO HD3 H 1 3.467 0.01 . 2 . . . . 679 PRO HD2 . 7056 1 1036 . 2 1 3 3 PRO C C 13 176.188 0.15 . 1 . . . . 679 PRO C . 7056 1 1037 . 2 1 3 3 PRO CA C 13 63.096 0.15 . 1 . . . . 679 PRO CA . 7056 1 1038 . 2 1 3 3 PRO CB C 13 34.526 0.15 . 1 . . . . 679 PRO CB . 7056 1 1039 . 2 1 3 3 PRO CG C 13 24.702 0.15 . 1 . . . . 679 PRO CG . 7056 1 1040 . 2 1 3 3 PRO CD C 13 50.213 0.15 . 1 . . . . 679 PRO CD . 7056 1 1041 . 2 1 4 4 ASP H H 1 8.774 0.01 . 1 . . . . 680 ASP HN . 7056 1 1042 . 2 1 4 4 ASP HA H 1 4.731 0.01 . 1 . . . . 680 ASP HA . 7056 1 1043 . 2 1 4 4 ASP HB2 H 1 2.696 0.01 . 2 . . . . 680 ASP HB1 . 7056 1 1044 . 2 1 4 4 ASP HB3 H 1 2.596 0.01 . 2 . . . . 680 ASP HB2 . 7056 1 1045 . 2 1 4 4 ASP C C 13 176.017 0.15 . 1 . . . . 680 ASP C . 7056 1 1046 . 2 1 4 4 ASP CA C 13 54.461 0.15 . 1 . . . . 680 ASP CA . 7056 1 1047 . 2 1 4 4 ASP CB C 13 41.361 0.15 . 1 . . . . 680 ASP CB . 7056 1 1048 . 2 1 4 4 ASP N N 15 121.088 0.06 . 1 . . . . 680 ASP N . 7056 1 1049 . 2 1 5 5 GLU H H 1 8.753 0.01 . 1 . . . . 681 GLU HN . 7056 1 1050 . 2 1 5 5 GLU HA H 1 4.291 0.01 . 1 . . . . 681 GLU HA . 7056 1 1051 . 2 1 5 5 GLU HB2 H 1 2.106 0.01 . 2 . . . . 681 GLU HB1 . 7056 1 1052 . 2 1 5 5 GLU HB3 H 1 1.954 0.01 . 2 . . . . 681 GLU HB2 . 7056 1 1053 . 2 1 5 5 GLU HG2 H 1 2.284 0.01 . 1 . . . . 681 GLU HG1 . 7056 1 1054 . 2 1 5 5 GLU HG3 H 1 2.284 0.01 . 1 . . . . 681 GLU HG2 . 7056 1 1055 . 2 1 5 5 GLU C C 13 176.818 0.15 . 1 . . . . 681 GLU C . 7056 1 1056 . 2 1 5 5 GLU CA C 13 56.833 0.15 . 1 . . . . 681 GLU CA . 7056 1 1057 . 2 1 5 5 GLU CB C 13 30.220 0.15 . 1 . . . . 681 GLU CB . 7056 1 1058 . 2 1 5 5 GLU CG C 13 36.183 0.15 . 1 . . . . 681 GLU CG . 7056 1 1059 . 2 1 5 5 GLU N N 15 122.396 0.06 . 1 . . . . 681 GLU N . 7056 1 1060 . 2 1 6 6 SER H H 1 8.454 0.01 . 1 . . . . 682 SER HN . 7056 1 1061 . 2 1 6 6 SER HA H 1 4.481 0.01 . 1 . . . . 682 SER HA . 7056 1 1062 . 2 1 6 6 SER HB2 H 1 3.932 0.01 . 2 . . . . 682 SER HB1 . 7056 1 1063 . 2 1 6 6 SER HB3 H 1 3.853 0.01 . 2 . . . . 682 SER HB2 . 7056 1 1064 . 2 1 6 6 SER C C 13 175.256 0.15 . 1 . . . . 682 SER C . 7056 1 1065 . 2 1 6 6 SER CA C 13 59.016 0.15 . 1 . . . . 682 SER CA . 7056 1 1066 . 2 1 6 6 SER CB C 13 63.810 0.15 . 1 . . . . 682 SER CB . 7056 1 1067 . 2 1 6 6 SER N N 15 116.713 0.06 . 1 . . . . 682 SER N . 7056 1 1068 . 2 1 7 7 THR H H 1 8.206 0.01 . 1 . . . . 683 THR HN . 7056 1 1069 . 2 1 7 7 THR HA H 1 4.410 0.01 . 1 . . . . 683 THR HA . 7056 1 1070 . 2 1 7 7 THR HB H 1 4.325 0.01 . 1 . . . . 683 THR HB . 7056 1 1071 . 2 1 7 7 THR HG21 H 1 1.225 0.01 . 1 . . . . 683 THR HG21 . 7056 1 1072 . 2 1 7 7 THR HG22 H 1 1.225 0.01 . 1 . . . . 683 THR HG21 . 7056 1 1073 . 2 1 7 7 THR HG23 H 1 1.225 0.01 . 1 . . . . 683 THR HG21 . 7056 1 1074 . 2 1 7 7 THR C C 13 174.999 0.15 . 1 . . . . 683 THR C . 7056 1 1075 . 2 1 7 7 THR CA C 13 62.191 0.15 . 1 . . . . 683 THR CA . 7056 1 1076 . 2 1 7 7 THR CB C 13 69.594 0.15 . 1 . . . . 683 THR CB . 7056 1 1077 . 2 1 7 7 THR CG2 C 13 21.618 0.15 . 1 . . . . 683 THR CG2 . 7056 1 1078 . 2 1 7 7 THR N N 15 115.459 0.06 . 1 . . . . 683 THR N . 7056 1 1079 . 2 1 8 8 SER H H 1 8.348 0.01 . 1 . . . . 684 SER HN . 7056 1 1080 . 2 1 8 8 SER HA H 1 4.437 0.01 . 1 . . . . 684 SER HA . 7056 1 1081 . 2 1 8 8 SER HB2 H 1 3.902 0.01 . 1 . . . . 684 SER HB1 . 7056 1 1082 . 2 1 8 8 SER HB3 H 1 3.902 0.01 . 1 . . . . 684 SER HB2 . 7056 1 1083 . 2 1 8 8 SER C C 13 175.231 0.15 . 1 . . . . 684 SER C . 7056 1 1084 . 2 1 8 8 SER CA C 13 58.891 0.15 . 1 . . . . 684 SER CA . 7056 1 1085 . 2 1 8 8 SER CB C 13 63.839 0.15 . 1 . . . . 684 SER CB . 7056 1 1086 . 2 1 8 8 SER N N 15 117.984 0.06 . 1 . . . . 684 SER N . 7056 1 1087 . 2 1 9 9 GLY H H 1 8.478 0.01 . 1 . . . . 685 GLY HN . 7056 1 1088 . 2 1 9 9 GLY HA2 H 1 4.012 0.01 . 1 . . . . 685 GLY HA1 . 7056 1 1089 . 2 1 9 9 GLY HA3 H 1 4.012 0.01 . 1 . . . . 685 GLY HA2 . 7056 1 1090 . 2 1 9 9 GLY C C 13 174.716 0.15 . 1 . . . . 685 GLY C . 7056 1 1091 . 2 1 9 9 GLY CA C 13 45.685 0.15 . 1 . . . . 685 GLY CA . 7056 1 1092 . 2 1 9 9 GLY N N 15 111.026 0.06 . 1 . . . . 685 GLY N . 7056 1 1093 . 2 1 10 10 VAL H H 1 8.118 0.01 . 1 . . . . 686 VAL HN . 7056 1 1094 . 2 1 10 10 VAL HA H 1 4.077 0.01 . 1 . . . . 686 VAL HA . 7056 1 1095 . 2 1 10 10 VAL HB H 1 2.113 0.01 . 1 . . . . 686 VAL HB . 7056 1 1096 . 2 1 10 10 VAL HG11 H 1 0.964 0.01 . 2 . . . . 686 VAL HG11 . 7056 1 1097 . 2 1 10 10 VAL HG12 H 1 0.964 0.01 . 2 . . . . 686 VAL HG11 . 7056 1 1098 . 2 1 10 10 VAL HG13 H 1 0.964 0.01 . 2 . . . . 686 VAL HG11 . 7056 1 1099 . 2 1 10 10 VAL HG21 H 1 0.953 0.01 . 2 . . . . 686 VAL HG21 . 7056 1 1100 . 2 1 10 10 VAL HG22 H 1 0.953 0.01 . 2 . . . . 686 VAL HG21 . 7056 1 1101 . 2 1 10 10 VAL HG23 H 1 0.953 0.01 . 2 . . . . 686 VAL HG21 . 7056 1 1102 . 2 1 10 10 VAL C C 13 176.711 0.15 . 1 . . . . 686 VAL C . 7056 1 1103 . 2 1 10 10 VAL CA C 13 63.312 0.15 . 1 . . . . 686 VAL CA . 7056 1 1104 . 2 1 10 10 VAL CB C 13 32.677 0.15 . 1 . . . . 686 VAL CB . 7056 1 1105 . 2 1 10 10 VAL CG1 C 13 20.918 0.15 . 1 . . . . 686 VAL CG1 . 7056 1 1106 . 2 1 10 10 VAL CG2 C 13 21.212 0.15 . 1 . . . . 686 VAL CG2 . 7056 1 1107 . 2 1 10 10 VAL N N 15 119.913 0.06 . 1 . . . . 686 VAL N . 7056 1 1108 . 2 1 11 11 GLU H H 1 8.601 0.01 . 1 . . . . 687 GLU HN . 7056 1 1109 . 2 1 11 11 GLU HA H 1 4.174 0.01 . 1 . . . . 687 GLU HA . 7056 1 1110 . 2 1 11 11 GLU HB2 H 1 2.023 0.01 . 1 . . . . 687 GLU HB1 . 7056 1 1111 . 2 1 11 11 GLU HB3 H 1 2.023 0.01 . 1 . . . . 687 GLU HB2 . 7056 1 1112 . 2 1 11 11 GLU HG2 H 1 2.322 0.01 . 2 . . . . 687 GLU HG1 . 7056 1 1113 . 2 1 11 11 GLU HG3 H 1 2.254 0.01 . 2 . . . . 687 GLU HG2 . 7056 1 1114 . 2 1 11 11 GLU C C 13 177.075 0.15 . 1 . . . . 687 GLU C . 7056 1 1115 . 2 1 11 11 GLU CA C 13 57.969 0.15 . 1 . . . . 687 GLU CA . 7056 1 1116 . 2 1 11 11 GLU CB C 13 29.946 0.15 . 1 . . . . 687 GLU CB . 7056 1 1117 . 2 1 11 11 GLU CG C 13 36.651 0.15 . 1 . . . . 687 GLU CG . 7056 1 1118 . 2 1 11 11 GLU N N 15 123.154 0.06 . 1 . . . . 687 GLU N . 7056 1 1119 . 2 1 12 12 SER H H 1 8.381 0.01 . 1 . . . . 688 SER HN . 7056 1 1120 . 2 1 12 12 SER HA H 1 4.307 0.01 . 1 . . . . 688 SER HA . 7056 1 1121 . 2 1 12 12 SER HB2 H 1 3.924 0.01 . 2 . . . . 688 SER HB1 . 7056 1 1122 . 2 1 12 12 SER HB3 H 1 3.855 0.01 . 2 . . . . 688 SER HB2 . 7056 1 1123 . 2 1 12 12 SER C C 13 175.690 0.15 . 1 . . . . 688 SER C . 7056 1 1124 . 2 1 12 12 SER CA C 13 59.439 0.15 . 1 . . . . 688 SER CA . 7056 1 1125 . 2 1 12 12 SER CB C 13 63.467 0.15 . 1 . . . . 688 SER CB . 7056 1 1126 . 2 1 12 12 SER N N 15 115.659 0.06 . 1 . . . . 688 SER N . 7056 1 1127 . 2 1 13 13 ALA H H 1 8.320 0.01 . 1 . . . . 689 ALA HN . 7056 1 1128 . 2 1 13 13 ALA HA H 1 4.231 0.01 . 1 . . . . 689 ALA HA . 7056 1 1129 . 2 1 13 13 ALA HB1 H 1 1.474 0.01 . 1 . . . . 689 ALA HB1 . 7056 1 1130 . 2 1 13 13 ALA HB2 H 1 1.474 0.01 . 1 . . . . 689 ALA HB1 . 7056 1 1131 . 2 1 13 13 ALA HB3 H 1 1.474 0.01 . 1 . . . . 689 ALA HB1 . 7056 1 1132 . 2 1 13 13 ALA C C 13 179.340 0.15 . 1 . . . . 689 ALA C . 7056 1 1133 . 2 1 13 13 ALA CA C 13 54.181 0.15 . 1 . . . . 689 ALA CA . 7056 1 1134 . 2 1 13 13 ALA CB C 13 18.717 0.15 . 1 . . . . 689 ALA CB . 7056 1 1135 . 2 1 13 13 ALA N N 15 126.320 0.06 . 1 . . . . 689 ALA N . 7056 1 1136 . 2 1 14 14 VAL H H 1 7.982 0.01 . 1 . . . . 690 VAL HN . 7056 1 1137 . 2 1 14 14 VAL HA H 1 3.937 0.01 . 1 . . . . 690 VAL HA . 7056 1 1138 . 2 1 14 14 VAL HB H 1 2.078 0.01 . 1 . . . . 690 VAL HB . 7056 1 1139 . 2 1 14 14 VAL HG11 H 1 1.004 0.01 . 2 . . . . 690 VAL HG11 . 7056 1 1140 . 2 1 14 14 VAL HG12 H 1 1.004 0.01 . 2 . . . . 690 VAL HG11 . 7056 1 1141 . 2 1 14 14 VAL HG13 H 1 1.004 0.01 . 2 . . . . 690 VAL HG11 . 7056 1 1142 . 2 1 14 14 VAL HG21 H 1 0.931 0.01 . 2 . . . . 690 VAL HG21 . 7056 1 1143 . 2 1 14 14 VAL HG22 H 1 0.931 0.01 . 2 . . . . 690 VAL HG21 . 7056 1 1144 . 2 1 14 14 VAL HG23 H 1 0.931 0.01 . 2 . . . . 690 VAL HG21 . 7056 1 1145 . 2 1 14 14 VAL C C 13 177.472 0.15 . 1 . . . . 690 VAL C . 7056 1 1146 . 2 1 14 14 VAL CA C 13 64.559 0.15 . 1 . . . . 690 VAL CA . 7056 1 1147 . 2 1 14 14 VAL CB C 13 32.429 0.15 . 1 . . . . 690 VAL CB . 7056 1 1148 . 2 1 14 14 VAL CG1 C 13 21.605 0.15 . 1 . . . . 690 VAL CG1 . 7056 1 1149 . 2 1 14 14 VAL CG2 C 13 21.288 0.15 . 1 . . . . 690 VAL CG2 . 7056 1 1150 . 2 1 14 14 VAL N N 15 117.763 0.06 . 1 . . . . 690 VAL N . 7056 1 1151 . 2 1 15 15 LEU H H 1 8.039 0.01 . 1 . . . . 691 LEU HN . 7056 1 1152 . 2 1 15 15 LEU HA H 1 4.404 0.01 . 1 . . . . 691 LEU HA . 7056 1 1153 . 2 1 15 15 LEU HB2 H 1 1.714 0.01 . 2 . . . . 691 LEU HB1 . 7056 1 1154 . 2 1 15 15 LEU HB3 H 1 1.608 0.01 . 2 . . . . 691 LEU HB2 . 7056 1 1155 . 2 1 15 15 LEU HG H 1 1.545 0.01 . 1 . . . . 691 LEU HG . 7056 1 1156 . 2 1 15 15 LEU HD11 H 1 0.733 0.01 . 2 . . . . 691 LEU HD11 . 7056 1 1157 . 2 1 15 15 LEU HD12 H 1 0.733 0.01 . 2 . . . . 691 LEU HD11 . 7056 1 1158 . 2 1 15 15 LEU HD13 H 1 0.733 0.01 . 2 . . . . 691 LEU HD11 . 7056 1 1159 . 2 1 15 15 LEU HD21 H 1 0.544 0.01 . 2 . . . . 691 LEU HD21 . 7056 1 1160 . 2 1 15 15 LEU HD22 H 1 0.544 0.01 . 2 . . . . 691 LEU HD21 . 7056 1 1161 . 2 1 15 15 LEU HD23 H 1 0.544 0.01 . 2 . . . . 691 LEU HD21 . 7056 1 1162 . 2 1 15 15 LEU C C 13 176.978 0.15 . 1 . . . . 691 LEU C . 7056 1 1163 . 2 1 15 15 LEU CA C 13 54.984 0.15 . 1 . . . . 691 LEU CA . 7056 1 1164 . 2 1 15 15 LEU CB C 13 41.720 0.15 . 1 . . . . 691 LEU CB . 7056 1 1165 . 2 1 15 15 LEU CG C 13 27.023 0.15 . 1 . . . . 691 LEU CG . 7056 1 1166 . 2 1 15 15 LEU CD1 C 13 25.446 0.15 . 1 . . . . 691 LEU CD1 . 7056 1 1167 . 2 1 15 15 LEU CD2 C 13 23.216 0.15 . 1 . . . . 691 LEU CD2 . 7056 1 1168 . 2 1 15 15 LEU N N 15 120.198 0.06 . 1 . . . . 691 LEU N . 7056 1 1169 . 2 1 16 16 ARG H H 1 7.795 0.01 . 1 . . . . 692 ARG HN . 7056 1 1170 . 2 1 16 16 ARG HA H 1 4.249 0.01 . 1 . . . . 692 ARG HA . 7056 1 1171 . 2 1 16 16 ARG HB2 H 1 1.922 0.01 . 1 . . . . 692 ARG HB1 . 7056 1 1172 . 2 1 16 16 ARG HB3 H 1 1.922 0.01 . 1 . . . . 692 ARG HB2 . 7056 1 1173 . 2 1 16 16 ARG HG2 H 1 1.836 0.01 . 2 . . . . 692 ARG HG1 . 7056 1 1174 . 2 1 16 16 ARG HG3 H 1 1.699 0.01 . 2 . . . . 692 ARG HG2 . 7056 1 1175 . 2 1 16 16 ARG HD2 H 1 3.260 0.01 . 1 . . . . 692 ARG HD1 . 7056 1 1176 . 2 1 16 16 ARG HD3 H 1 3.260 0.01 . 1 . . . . 692 ARG HD2 . 7056 1 1177 . 2 1 16 16 ARG C C 13 178.009 0.15 . 1 . . . . 692 ARG C . 7056 1 1178 . 2 1 16 16 ARG CA C 13 58.684 0.15 . 1 . . . . 692 ARG CA . 7056 1 1179 . 2 1 16 16 ARG CB C 13 29.953 0.15 . 1 . . . . 692 ARG CB . 7056 1 1180 . 2 1 16 16 ARG CG C 13 27.470 0.15 . 1 . . . . 692 ARG CG . 7056 1 1181 . 2 1 16 16 ARG CD C 13 43.488 0.15 . 1 . . . . 692 ARG CD . 7056 1 1182 . 2 1 16 16 ARG N N 15 121.039 0.06 . 1 . . . . 692 ARG N . 7056 1 1183 . 2 1 17 17 GLY HA2 H 1 3.938 0.01 . 2 . . . . 693 GLY HA1 . 7056 1 1184 . 2 1 17 17 GLY HA3 H 1 3.879 0.01 . 2 . . . . 693 GLY HA2 . 7056 1 1185 . 2 1 17 17 GLY C C 13 173.327 0.15 . 1 . . . . 693 GLY C . 7056 1 1186 . 2 1 17 17 GLY CA C 13 45.189 0.15 . 1 . . . . 693 GLY CA . 7056 1 1187 . 2 1 18 18 PHE H H 1 8.198 0.01 . 1 . . . . 694 PHE HN . 7056 1 1188 . 2 1 18 18 PHE HA H 1 4.949 0.01 . 1 . . . . 694 PHE HA . 7056 1 1189 . 2 1 18 18 PHE HB2 H 1 2.947 0.01 . 2 . . . . 694 PHE HB1 . 7056 1 1190 . 2 1 18 18 PHE HB3 H 1 2.679 0.01 . 2 . . . . 694 PHE HB2 . 7056 1 1191 . 2 1 18 18 PHE HD1 H 1 6.948 0.01 . 1 . . . . 694 PHE HD1 . 7056 1 1192 . 2 1 18 18 PHE HD2 H 1 6.948 0.01 . 1 . . . . 694 PHE HD2 . 7056 1 1193 . 2 1 18 18 PHE HE1 H 1 7.215 0.01 . 1 . . . . 694 PHE HE1 . 7056 1 1194 . 2 1 18 18 PHE HE2 H 1 7.215 0.01 . 1 . . . . 694 PHE HE2 . 7056 1 1195 . 2 1 18 18 PHE HZ H 1 7.250 0.01 . 1 . . . . 694 PHE HZ . 7056 1 1196 . 2 1 18 18 PHE C C 13 173.802 0.15 . 1 . . . . 694 PHE C . 7056 1 1197 . 2 1 18 18 PHE CA C 13 57.510 0.15 . 1 . . . . 694 PHE CA . 7056 1 1198 . 2 1 18 18 PHE CB C 13 42.048 0.15 . 1 . . . . 694 PHE CB . 7056 1 1199 . 2 1 18 18 PHE CD1 C 13 131.639 0.15 . 1 . . . . 694 PHE CD1 . 7056 1 1200 . 2 1 18 18 PHE CD2 C 13 131.639 0.15 . 1 . . . . 694 PHE CD2 . 7056 1 1201 . 2 1 18 18 PHE N N 15 119.135 0.06 . 1 . . . . 694 PHE N . 7056 1 1202 . 2 1 19 19 LEU H H 1 9.155 0.01 . 1 . . . . 695 LEU HN . 7056 1 1203 . 2 1 19 19 LEU HA H 1 4.686 0.01 . 1 . . . . 695 LEU HA . 7056 1 1204 . 2 1 19 19 LEU HB2 H 1 1.538 0.01 . 2 . . . . 695 LEU HB1 . 7056 1 1205 . 2 1 19 19 LEU HB3 H 1 1.447 0.01 . 2 . . . . 695 LEU HB2 . 7056 1 1206 . 2 1 19 19 LEU HG H 1 1.433 0.01 . 1 . . . . 695 LEU HG . 7056 1 1207 . 2 1 19 19 LEU HD11 H 1 0.925 0.01 . 2 . . . . 695 LEU HD11 . 7056 1 1208 . 2 1 19 19 LEU HD12 H 1 0.925 0.01 . 2 . . . . 695 LEU HD11 . 7056 1 1209 . 2 1 19 19 LEU HD13 H 1 0.925 0.01 . 2 . . . . 695 LEU HD11 . 7056 1 1210 . 2 1 19 19 LEU HD21 H 1 0.866 0.01 . 2 . . . . 695 LEU HD21 . 7056 1 1211 . 2 1 19 19 LEU HD22 H 1 0.866 0.01 . 2 . . . . 695 LEU HD21 . 7056 1 1212 . 2 1 19 19 LEU HD23 H 1 0.866 0.01 . 2 . . . . 695 LEU HD21 . 7056 1 1213 . 2 1 19 19 LEU C C 13 176.188 0.15 . 1 . . . . 695 LEU C . 7056 1 1214 . 2 1 19 19 LEU CA C 13 53.512 0.15 . 1 . . . . 695 LEU CA . 7056 1 1215 . 2 1 19 19 LEU CB C 13 44.675 0.15 . 1 . . . . 695 LEU CB . 7056 1 1216 . 2 1 19 19 LEU CG C 13 27.296 0.15 . 1 . . . . 695 LEU CG . 7056 1 1217 . 2 1 19 19 LEU CD1 C 13 25.060 0.15 . 1 . . . . 695 LEU CD1 . 7056 1 1218 . 2 1 19 19 LEU CD2 C 13 24.677 0.15 . 1 . . . . 695 LEU CD2 . 7056 1 1219 . 2 1 19 19 LEU N N 15 121.967 0.06 . 1 . . . . 695 LEU N . 7056 1 1220 . 2 1 20 20 ILE H H 1 8.900 0.01 . 1 . . . . 696 ILE HN . 7056 1 1221 . 2 1 20 20 ILE HA H 1 4.328 0.01 . 1 . . . . 696 ILE HA . 7056 1 1222 . 2 1 20 20 ILE HB H 1 1.914 0.01 . 1 . . . . 696 ILE HB . 7056 1 1223 . 2 1 20 20 ILE HG12 H 1 1.660 0.01 . 1 . . . . 696 ILE HG11 . 7056 1 1224 . 2 1 20 20 ILE HG13 H 1 1.023 0.01 . 1 . . . . 696 ILE HG12 . 7056 1 1225 . 2 1 20 20 ILE HG21 H 1 0.872 0.01 . 1 . . . . 696 ILE HG21 . 7056 1 1226 . 2 1 20 20 ILE HG22 H 1 0.872 0.01 . 1 . . . . 696 ILE HG21 . 7056 1 1227 . 2 1 20 20 ILE HG23 H 1 0.872 0.01 . 1 . . . . 696 ILE HG21 . 7056 1 1228 . 2 1 20 20 ILE HD11 H 1 0.822 0.01 . 1 . . . . 696 ILE HD11 . 7056 1 1229 . 2 1 20 20 ILE HD12 H 1 0.822 0.01 . 1 . . . . 696 ILE HD11 . 7056 1 1230 . 2 1 20 20 ILE HD13 H 1 0.822 0.01 . 1 . . . . 696 ILE HD11 . 7056 1 1231 . 2 1 20 20 ILE C C 13 176.755 0.15 . 1 . . . . 696 ILE C . 7056 1 1232 . 2 1 20 20 ILE CA C 13 61.955 0.15 . 1 . . . . 696 ILE CA . 7056 1 1233 . 2 1 20 20 ILE CB C 13 37.134 0.15 . 1 . . . . 696 ILE CB . 7056 1 1234 . 2 1 20 20 ILE CG1 C 13 27.987 0.15 . 1 . . . . 696 ILE CG1 . 7056 1 1235 . 2 1 20 20 ILE CG2 C 13 17.467 0.15 . 1 . . . . 696 ILE CG2 . 7056 1 1236 . 2 1 20 20 ILE CD1 C 13 12.993 0.15 . 1 . . . . 696 ILE CD1 . 7056 1 1237 . 2 1 20 20 ILE N N 15 124.104 0.06 . 1 . . . . 696 ILE N . 7056 1 1238 . 2 1 21 21 LEU H H 1 9.458 0.01 . 1 . . . . 697 LEU HN . 7056 1 1239 . 2 1 21 21 LEU HA H 1 4.369 0.01 . 1 . . . . 697 LEU HA . 7056 1 1240 . 2 1 21 21 LEU HB2 H 1 1.514 0.01 . 2 . . . . 697 LEU HB1 . 7056 1 1241 . 2 1 21 21 LEU HB3 H 1 1.377 0.01 . 2 . . . . 697 LEU HB2 . 7056 1 1242 . 2 1 21 21 LEU HG H 1 1.535 0.01 . 1 . . . . 697 LEU HG . 7056 1 1243 . 2 1 21 21 LEU HD11 H 1 0.732 0.01 . 2 . . . . 697 LEU HD11 . 7056 1 1244 . 2 1 21 21 LEU HD12 H 1 0.732 0.01 . 2 . . . . 697 LEU HD11 . 7056 1 1245 . 2 1 21 21 LEU HD13 H 1 0.732 0.01 . 2 . . . . 697 LEU HD11 . 7056 1 1246 . 2 1 21 21 LEU HD21 H 1 0.773 0.01 . 2 . . . . 697 LEU HD21 . 7056 1 1247 . 2 1 21 21 LEU HD22 H 1 0.773 0.01 . 2 . . . . 697 LEU HD21 . 7056 1 1248 . 2 1 21 21 LEU HD23 H 1 0.773 0.01 . 2 . . . . 697 LEU HD21 . 7056 1 1249 . 2 1 21 21 LEU C C 13 177.554 0.15 . 1 . . . . 697 LEU C . 7056 1 1250 . 2 1 21 21 LEU CA C 13 55.424 0.15 . 1 . . . . 697 LEU CA . 7056 1 1251 . 2 1 21 21 LEU CB C 13 42.581 0.15 . 1 . . . . 697 LEU CB . 7056 1 1252 . 2 1 21 21 LEU CG C 13 27.070 0.15 . 1 . . . . 697 LEU CG . 7056 1 1253 . 2 1 21 21 LEU CD1 C 13 25.804 0.15 . 1 . . . . 697 LEU CD1 . 7056 1 1254 . 2 1 21 21 LEU CD2 C 13 22.797 0.15 . 1 . . . . 697 LEU CD2 . 7056 1 1255 . 2 1 21 21 LEU N N 15 129.126 0.06 . 1 . . . . 697 LEU N . 7056 1 1256 . 2 1 22 22 GLY H H 1 7.411 0.01 . 1 . . . . 698 GLY HN . 7056 1 1257 . 2 1 22 22 GLY HA2 H 1 4.460 0.01 . 2 . . . . 698 GLY HA1 . 7056 1 1258 . 2 1 22 22 GLY HA3 H 1 3.905 0.01 . 2 . . . . 698 GLY HA2 . 7056 1 1259 . 2 1 22 22 GLY C C 13 172.077 0.15 . 1 . . . . 698 GLY C . 7056 1 1260 . 2 1 22 22 GLY CA C 13 44.984 0.15 . 1 . . . . 698 GLY CA . 7056 1 1261 . 2 1 22 22 GLY N N 15 105.222 0.06 . 1 . . . . 698 GLY N . 7056 1 1262 . 2 1 23 23 LYS H H 1 8.278 0.01 . 1 . . . . 699 LYS HN . 7056 1 1263 . 2 1 23 23 LYS HA H 1 4.404 0.01 . 1 . . . . 699 LYS HA . 7056 1 1264 . 2 1 23 23 LYS HB2 H 1 2.060 0.01 . 2 . . . . 699 LYS HB1 . 7056 1 1265 . 2 1 23 23 LYS HB3 H 1 1.858 0.01 . 2 . . . . 699 LYS HB2 . 7056 1 1266 . 2 1 23 23 LYS HG2 H 1 1.585 0.01 . 1 . . . . 699 LYS HG1 . 7056 1 1267 . 2 1 23 23 LYS HG3 H 1 1.585 0.01 . 1 . . . . 699 LYS HG2 . 7056 1 1268 . 2 1 23 23 LYS HD2 H 1 1.725 0.01 . 1 . . . . 699 LYS HD1 . 7056 1 1269 . 2 1 23 23 LYS HD3 H 1 1.725 0.01 . 1 . . . . 699 LYS HD2 . 7056 1 1270 . 2 1 23 23 LYS HE2 H 1 3.076 0.01 . 1 . . . . 699 LYS HE1 . 7056 1 1271 . 2 1 23 23 LYS HE3 H 1 3.076 0.01 . 1 . . . . 699 LYS HE2 . 7056 1 1272 . 2 1 23 23 LYS C C 13 174.056 0.15 . 1 . . . . 699 LYS C . 7056 1 1273 . 2 1 23 23 LYS CA C 13 56.108 0.15 . 1 . . . . 699 LYS CA . 7056 1 1274 . 2 1 23 23 LYS CB C 13 32.454 0.15 . 1 . . . . 699 LYS CB . 7056 1 1275 . 2 1 23 23 LYS CG C 13 24.760 0.15 . 1 . . . . 699 LYS CG . 7056 1 1276 . 2 1 23 23 LYS CD C 13 29.008 0.15 . 1 . . . . 699 LYS CD . 7056 1 1277 . 2 1 23 23 LYS CE C 13 42.058 0.15 . 1 . . . . 699 LYS CE . 7056 1 1278 . 2 1 23 23 LYS N N 15 120.181 0.06 . 1 . . . . 699 LYS N . 7056 1 1279 . 2 1 24 24 GLU H H 1 7.477 0.01 . 1 . . . . 700 GLU HN . 7056 1 1280 . 2 1 24 24 GLU HA H 1 3.889 0.01 . 1 . . . . 700 GLU HA . 7056 1 1281 . 2 1 24 24 GLU HB2 H 1 1.731 0.01 . 2 . . . . 700 GLU HB1 . 7056 1 1282 . 2 1 24 24 GLU HB3 H 1 1.634 0.01 . 2 . . . . 700 GLU HB2 . 7056 1 1283 . 2 1 24 24 GLU HG2 H 1 1.841 0.01 . 2 . . . . 700 GLU HG1 . 7056 1 1284 . 2 1 24 24 GLU HG3 H 1 1.766 0.01 . 2 . . . . 700 GLU HG2 . 7056 1 1285 . 2 1 24 24 GLU C C 13 175.644 0.15 . 1 . . . . 700 GLU C . 7056 1 1286 . 2 1 24 24 GLU CA C 13 56.735 0.15 . 1 . . . . 700 GLU CA . 7056 1 1287 . 2 1 24 24 GLU CB C 13 30.856 0.15 . 1 . . . . 700 GLU CB . 7056 1 1288 . 2 1 24 24 GLU CG C 13 35.501 0.15 . 1 . . . . 700 GLU CG . 7056 1 1289 . 2 1 24 24 GLU N N 15 117.979 0.06 . 1 . . . . 700 GLU N . 7056 1 1290 . 2 1 25 25 ASP H H 1 8.635 0.01 . 1 . . . . 701 ASP HN . 7056 1 1291 . 2 1 25 25 ASP HA H 1 5.073 0.01 . 1 . . . . 701 ASP HA . 7056 1 1292 . 2 1 25 25 ASP HB2 H 1 3.231 0.01 . 2 . . . . 701 ASP HB1 . 7056 1 1293 . 2 1 25 25 ASP HB3 H 1 2.638 0.01 . 2 . . . . 701 ASP HB2 . 7056 1 1294 . 2 1 25 25 ASP C C 13 178.382 0.15 . 1 . . . . 701 ASP C . 7056 1 1295 . 2 1 25 25 ASP CA C 13 52.436 0.15 . 1 . . . . 701 ASP CA . 7056 1 1296 . 2 1 25 25 ASP CB C 13 43.517 0.15 . 1 . . . . 701 ASP CB . 7056 1 1297 . 2 1 25 25 ASP N N 15 124.520 0.06 . 1 . . . . 701 ASP N . 7056 1 1298 . 2 1 26 26 ARG H H 1 9.430 0.01 . 1 . . . . 702 ARG HN . 7056 1 1299 . 2 1 26 26 ARG HA H 1 4.249 0.01 . 1 . . . . 702 ARG HA . 7056 1 1300 . 2 1 26 26 ARG HB2 H 1 1.927 0.01 . 2 . . . . 702 ARG HB1 . 7056 1 1301 . 2 1 26 26 ARG HB3 H 1 1.817 0.01 . 2 . . . . 702 ARG HB2 . 7056 1 1302 . 2 1 26 26 ARG HG2 H 1 1.666 0.01 . 2 . . . . 702 ARG HG1 . 7056 1 1303 . 2 1 26 26 ARG HG3 H 1 1.597 0.01 . 2 . . . . 702 ARG HG2 . 7056 1 1304 . 2 1 26 26 ARG HD2 H 1 3.178 0.01 . 1 . . . . 702 ARG HD1 . 7056 1 1305 . 2 1 26 26 ARG HD3 H 1 3.178 0.01 . 1 . . . . 702 ARG HD2 . 7056 1 1306 . 2 1 26 26 ARG C C 13 177.780 0.15 . 1 . . . . 702 ARG C . 7056 1 1307 . 2 1 26 26 ARG CA C 13 58.684 0.15 . 1 . . . . 702 ARG CA . 7056 1 1308 . 2 1 26 26 ARG CB C 13 29.593 0.15 . 1 . . . . 702 ARG CB . 7056 1 1309 . 2 1 26 26 ARG CG C 13 27.297 0.15 . 1 . . . . 702 ARG CG . 7056 1 1310 . 2 1 26 26 ARG CD C 13 43.219 0.15 . 1 . . . . 702 ARG CD . 7056 1 1311 . 2 1 26 26 ARG N N 15 127.590 0.06 . 1 . . . . 702 ARG N . 7056 1 1312 . 2 1 27 27 ARG H H 1 8.506 0.01 . 1 . . . . 703 ARG HN . 7056 1 1313 . 2 1 27 27 ARG HA H 1 3.961 0.01 . 1 . . . . 703 ARG HA . 7056 1 1314 . 2 1 27 27 ARG HB2 H 1 1.443 0.01 . 2 . . . . 703 ARG HB1 . 7056 1 1315 . 2 1 27 27 ARG HB3 H 1 1.274 0.01 . 2 . . . . 703 ARG HB2 . 7056 1 1316 . 2 1 27 27 ARG HG2 H 1 1.436 0.01 . 2 . . . . 703 ARG HG1 . 7056 1 1317 . 2 1 27 27 ARG HG3 H 1 1.367 0.01 . 2 . . . . 703 ARG HG2 . 7056 1 1318 . 2 1 27 27 ARG HD2 H 1 3.123 0.01 . 2 . . . . 703 ARG HD1 . 7056 1 1319 . 2 1 27 27 ARG HD3 H 1 2.981 0.01 . 2 . . . . 703 ARG HD2 . 7056 1 1320 . 2 1 27 27 ARG C C 13 177.750 0.15 . 1 . . . . 703 ARG C . 7056 1 1321 . 2 1 27 27 ARG CA C 13 58.758 0.15 . 1 . . . . 703 ARG CA . 7056 1 1322 . 2 1 27 27 ARG CB C 13 29.681 0.15 . 1 . . . . 703 ARG CB . 7056 1 1323 . 2 1 27 27 ARG CG C 13 26.635 0.15 . 1 . . . . 703 ARG CG . 7056 1 1324 . 2 1 27 27 ARG CD C 13 43.541 0.15 . 1 . . . . 703 ARG CD . 7056 1 1325 . 2 1 27 27 ARG N N 15 121.236 0.06 . 1 . . . . 703 ARG N . 7056 1 1326 . 2 1 28 28 TYR H H 1 7.792 0.01 . 1 . . . . 704 TYR HN . 7056 1 1327 . 2 1 28 28 TYR HA H 1 4.559 0.01 . 1 . . . . 704 TYR HA . 7056 1 1328 . 2 1 28 28 TYR HB2 H 1 3.315 0.01 . 2 . . . . 704 TYR HB1 . 7056 1 1329 . 2 1 28 28 TYR HB3 H 1 2.553 0.01 . 2 . . . . 704 TYR HB2 . 7056 1 1330 . 2 1 28 28 TYR HD1 H 1 7.136 0.01 . 1 . . . . 704 TYR HD1 . 7056 1 1331 . 2 1 28 28 TYR HD2 H 1 7.136 0.01 . 1 . . . . 704 TYR HD2 . 7056 1 1332 . 2 1 28 28 TYR HE1 H 1 6.757 0.01 . 1 . . . . 704 TYR HE1 . 7056 1 1333 . 2 1 28 28 TYR HE2 H 1 6.757 0.01 . 1 . . . . 704 TYR HE2 . 7056 1 1334 . 2 1 28 28 TYR C C 13 176.267 0.15 . 1 . . . . 704 TYR C . 7056 1 1335 . 2 1 28 28 TYR CA C 13 58.380 0.15 . 1 . . . . 704 TYR CA . 7056 1 1336 . 2 1 28 28 TYR CB C 13 37.346 0.15 . 1 . . . . 704 TYR CB . 7056 1 1337 . 2 1 28 28 TYR CD1 C 13 133.563 0.15 . 1 . . . . 704 TYR CD1 . 7056 1 1338 . 2 1 28 28 TYR CD2 C 13 133.563 0.15 . 1 . . . . 704 TYR CD2 . 7056 1 1339 . 2 1 28 28 TYR CE1 C 13 118.063 0.15 . 1 . . . . 704 TYR CE1 . 7056 1 1340 . 2 1 28 28 TYR CE2 C 13 118.063 0.15 . 1 . . . . 704 TYR CE2 . 7056 1 1341 . 2 1 28 28 TYR N N 15 114.288 0.06 . 1 . . . . 704 TYR N . 7056 1 1342 . 2 1 29 29 GLY H H 1 7.388 0.01 . 1 . . . . 705 GLY HN . 7056 1 1343 . 2 1 29 29 GLY HA2 H 1 4.475 0.01 . 2 . . . . 705 GLY HA1 . 7056 1 1344 . 2 1 29 29 GLY HA3 H 1 3.955 0.01 . 2 . . . . 705 GLY HA2 . 7056 1 1345 . 2 1 29 29 GLY C C 13 171.500 0.15 . 1 . . . . 705 GLY C . 7056 1 1346 . 2 1 29 29 GLY CA C 13 45.477 0.15 . 1 . . . . 705 GLY CA . 7056 1 1347 . 2 1 29 29 GLY N N 15 107.706 0.06 . 1 . . . . 705 GLY N . 7056 1 1348 . 2 1 30 30 PRO HA H 1 4.404 0.01 . 1 . . . . 706 PRO HA . 7056 1 1349 . 2 1 30 30 PRO HB2 H 1 2.335 0.01 . 2 . . . . 706 PRO HB1 . 7056 1 1350 . 2 1 30 30 PRO HB3 H 1 1.832 0.01 . 2 . . . . 706 PRO HB2 . 7056 1 1351 . 2 1 30 30 PRO HG2 H 1 2.036 0.01 . 2 . . . . 706 PRO HG1 . 7056 1 1352 . 2 1 30 30 PRO HG3 H 1 1.969 0.01 . 2 . . . . 706 PRO HG2 . 7056 1 1353 . 2 1 30 30 PRO HD2 H 1 3.701 0.01 . 2 . . . . 706 PRO HD1 . 7056 1 1354 . 2 1 30 30 PRO HD3 H 1 3.638 0.01 . 2 . . . . 706 PRO HD2 . 7056 1 1355 . 2 1 30 30 PRO C C 13 176.422 0.15 . 1 . . . . 706 PRO C . 7056 1 1356 . 2 1 30 30 PRO CA C 13 62.712 0.15 . 1 . . . . 706 PRO CA . 7056 1 1357 . 2 1 30 30 PRO CB C 13 32.460 0.15 . 1 . . . . 706 PRO CB . 7056 1 1358 . 2 1 30 30 PRO CG C 13 27.343 0.15 . 1 . . . . 706 PRO CG . 7056 1 1359 . 2 1 30 30 PRO CD C 13 49.980 0.15 . 1 . . . . 706 PRO CD . 7056 1 1360 . 2 1 31 31 ALA H H 1 8.640 0.01 . 1 . . . . 707 ALA HN . 7056 1 1361 . 2 1 31 31 ALA HA H 1 3.952 0.01 . 1 . . . . 707 ALA HA . 7056 1 1362 . 2 1 31 31 ALA HB1 H 1 1.196 0.01 . 1 . . . . 707 ALA HB1 . 7056 1 1363 . 2 1 31 31 ALA HB2 H 1 1.196 0.01 . 1 . . . . 707 ALA HB1 . 7056 1 1364 . 2 1 31 31 ALA HB3 H 1 1.196 0.01 . 1 . . . . 707 ALA HB1 . 7056 1 1365 . 2 1 31 31 ALA C C 13 177.483 0.15 . 1 . . . . 707 ALA C . 7056 1 1366 . 2 1 31 31 ALA CA C 13 52.485 0.15 . 1 . . . . 707 ALA CA . 7056 1 1367 . 2 1 31 31 ALA CB C 13 19.294 0.15 . 1 . . . . 707 ALA CB . 7056 1 1368 . 2 1 31 31 ALA N N 15 123.641 0.06 . 1 . . . . 707 ALA N . 7056 1 1369 . 2 1 32 32 LEU H H 1 8.964 0.01 . 1 . . . . 708 LEU HN . 7056 1 1370 . 2 1 32 32 LEU HA H 1 4.499 0.01 . 1 . . . . 708 LEU HA . 7056 1 1371 . 2 1 32 32 LEU HB2 H 1 1.704 0.01 . 2 . . . . 708 LEU HB1 . 7056 1 1372 . 2 1 32 32 LEU HB3 H 1 1.589 0.01 . 2 . . . . 708 LEU HB2 . 7056 1 1373 . 2 1 32 32 LEU HG H 1 1.980 0.01 . 1 . . . . 708 LEU HG . 7056 1 1374 . 2 1 32 32 LEU HD11 H 1 0.812 0.01 . 2 . . . . 708 LEU HD11 . 7056 1 1375 . 2 1 32 32 LEU HD12 H 1 0.812 0.01 . 2 . . . . 708 LEU HD11 . 7056 1 1376 . 2 1 32 32 LEU HD13 H 1 0.812 0.01 . 2 . . . . 708 LEU HD11 . 7056 1 1377 . 2 1 32 32 LEU HD21 H 1 0.832 0.01 . 2 . . . . 708 LEU HD21 . 7056 1 1378 . 2 1 32 32 LEU HD22 H 1 0.832 0.01 . 2 . . . . 708 LEU HD21 . 7056 1 1379 . 2 1 32 32 LEU HD23 H 1 0.832 0.01 . 2 . . . . 708 LEU HD21 . 7056 1 1380 . 2 1 32 32 LEU C C 13 176.925 0.15 . 1 . . . . 708 LEU C . 7056 1 1381 . 2 1 32 32 LEU CA C 13 53.690 0.15 . 1 . . . . 708 LEU CA . 7056 1 1382 . 2 1 32 32 LEU CB C 13 43.795 0.15 . 1 . . . . 708 LEU CB . 7056 1 1383 . 2 1 32 32 LEU CG C 13 27.048 0.15 . 1 . . . . 708 LEU CG . 7056 1 1384 . 2 1 32 32 LEU CD1 C 13 25.930 0.15 . 1 . . . . 708 LEU CD1 . 7056 1 1385 . 2 1 32 32 LEU CD2 C 13 22.609 0.15 . 1 . . . . 708 LEU CD2 . 7056 1 1386 . 2 1 32 32 LEU N N 15 124.931 0.06 . 1 . . . . 708 LEU N . 7056 1 1387 . 2 1 33 33 SER H H 1 8.589 0.01 . 1 . . . . 709 SER HN . 7056 1 1388 . 2 1 33 33 SER HA H 1 4.796 0.01 . 1 . . . . 709 SER HA . 7056 1 1389 . 2 1 33 33 SER HB2 H 1 4.179 0.01 . 2 . . . . 709 SER HB1 . 7056 1 1390 . 2 1 33 33 SER HB3 H 1 3.941 0.01 . 2 . . . . 709 SER HB2 . 7056 1 1391 . 2 1 33 33 SER C C 13 176.503 0.15 . 1 . . . . 709 SER C . 7056 1 1392 . 2 1 33 33 SER CA C 13 57.216 0.15 . 1 . . . . 709 SER CA . 7056 1 1393 . 2 1 33 33 SER CB C 13 65.250 0.15 . 1 . . . . 709 SER CB . 7056 1 1394 . 2 1 33 33 SER N N 15 114.628 0.06 . 1 . . . . 709 SER N . 7056 1 1395 . 2 1 34 34 ILE H H 1 8.786 0.01 . 1 . . . . 710 ILE HN . 7056 1 1396 . 2 1 34 34 ILE HA H 1 3.575 0.01 . 1 . . . . 710 ILE HA . 7056 1 1397 . 2 1 34 34 ILE HB H 1 1.842 0.01 . 1 . . . . 710 ILE HB . 7056 1 1398 . 2 1 34 34 ILE HG12 H 1 1.559 0.01 . 1 . . . . 710 ILE HG11 . 7056 1 1399 . 2 1 34 34 ILE HG13 H 1 1.159 0.01 . 1 . . . . 710 ILE HG12 . 7056 1 1400 . 2 1 34 34 ILE HG21 H 1 0.860 0.01 . 1 . . . . 710 ILE HG21 . 7056 1 1401 . 2 1 34 34 ILE HG22 H 1 0.860 0.01 . 1 . . . . 710 ILE HG21 . 7056 1 1402 . 2 1 34 34 ILE HG23 H 1 0.860 0.01 . 1 . . . . 710 ILE HG21 . 7056 1 1403 . 2 1 34 34 ILE HD11 H 1 0.841 0.01 . 1 . . . . 710 ILE HD11 . 7056 1 1404 . 2 1 34 34 ILE HD12 H 1 0.841 0.01 . 1 . . . . 710 ILE HD11 . 7056 1 1405 . 2 1 34 34 ILE HD13 H 1 0.841 0.01 . 1 . . . . 710 ILE HD11 . 7056 1 1406 . 2 1 34 34 ILE C C 13 178.089 0.15 . 1 . . . . 710 ILE C . 7056 1 1407 . 2 1 34 34 ILE CA C 13 64.126 0.15 . 1 . . . . 710 ILE CA . 7056 1 1408 . 2 1 34 34 ILE CB C 13 37.849 0.15 . 1 . . . . 710 ILE CB . 7056 1 1409 . 2 1 34 34 ILE CG1 C 13 28.745 0.15 . 1 . . . . 710 ILE CG1 . 7056 1 1410 . 2 1 34 34 ILE CG2 C 13 17.678 0.15 . 1 . . . . 710 ILE CG2 . 7056 1 1411 . 2 1 34 34 ILE CD1 C 13 13.510 0.15 . 1 . . . . 710 ILE CD1 . 7056 1 1412 . 2 1 34 34 ILE N N 15 121.501 0.06 . 1 . . . . 710 ILE N . 7056 1 1413 . 2 1 35 35 ASN H H 1 8.272 0.01 . 1 . . . . 711 ASN HN . 7056 1 1414 . 2 1 35 35 ASN HA H 1 4.503 0.01 . 1 . . . . 711 ASN HA . 7056 1 1415 . 2 1 35 35 ASN HB2 H 1 2.801 0.01 . 2 . . . . 711 ASN HB1 . 7056 1 1416 . 2 1 35 35 ASN HB3 H 1 2.763 0.01 . 2 . . . . 711 ASN HB2 . 7056 1 1417 . 2 1 35 35 ASN HD21 H 1 7.710 0.01 . 2 . . . . 711 ASN HD21 . 7056 1 1418 . 2 1 35 35 ASN HD22 H 1 7.033 0.01 . 2 . . . . 711 ASN HD22 . 7056 1 1419 . 2 1 35 35 ASN C C 13 177.054 0.15 . 1 . . . . 711 ASN C . 7056 1 1420 . 2 1 35 35 ASN CA C 13 55.437 0.15 . 1 . . . . 711 ASN CA . 7056 1 1421 . 2 1 35 35 ASN CB C 13 38.148 0.15 . 1 . . . . 711 ASN CB . 7056 1 1422 . 2 1 35 35 ASN CG C 13 176.590 0.15 . 1 . . . . 711 ASN CG . 7056 1 1423 . 2 1 35 35 ASN N N 15 116.996 0.06 . 1 . . . . 711 ASN N . 7056 1 1424 . 2 1 35 35 ASN ND2 N 15 113.626 0.06 . 1 . . . . 711 ASN ND2 . 7056 1 1425 . 2 1 36 36 GLU H H 1 7.766 0.01 . 1 . . . . 712 GLU HN . 7056 1 1426 . 2 1 36 36 GLU HA H 1 4.286 0.01 . 1 . . . . 712 GLU HA . 7056 1 1427 . 2 1 36 36 GLU HB2 H 1 2.289 0.01 . 1 . . . . 712 GLU HB1 . 7056 1 1428 . 2 1 36 36 GLU HB3 H 1 2.289 0.01 . 1 . . . . 712 GLU HB2 . 7056 1 1429 . 2 1 36 36 GLU HG2 H 1 2.269 0.01 . 1 . . . . 712 GLU HG1 . 7056 1 1430 . 2 1 36 36 GLU HG3 H 1 2.269 0.01 . 1 . . . . 712 GLU HG2 . 7056 1 1431 . 2 1 36 36 GLU C C 13 177.858 0.15 . 1 . . . . 712 GLU C . 7056 1 1432 . 2 1 36 36 GLU CA C 13 57.262 0.15 . 1 . . . . 712 GLU CA . 7056 1 1433 . 2 1 36 36 GLU CB C 13 30.975 0.15 . 1 . . . . 712 GLU CB . 7056 1 1434 . 2 1 36 36 GLU CG C 13 37.700 0.15 . 1 . . . . 712 GLU CG . 7056 1 1435 . 2 1 36 36 GLU N N 15 118.618 0.06 . 1 . . . . 712 GLU N . 7056 1 1436 . 2 1 37 37 LEU H H 1 7.601 0.01 . 1 . . . . 713 LEU HN . 7056 1 1437 . 2 1 37 37 LEU HA H 1 3.980 0.01 . 1 . . . . 713 LEU HA . 7056 1 1438 . 2 1 37 37 LEU HB2 H 1 1.625 0.01 . 2 . . . . 713 LEU HB1 . 7056 1 1439 . 2 1 37 37 LEU HB3 H 1 1.507 0.01 . 2 . . . . 713 LEU HB2 . 7056 1 1440 . 2 1 37 37 LEU HG H 1 1.618 0.01 . 1 . . . . 713 LEU HG . 7056 1 1441 . 2 1 37 37 LEU HD11 H 1 0.241 0.01 . 2 . . . . 713 LEU HD11 . 7056 1 1442 . 2 1 37 37 LEU HD12 H 1 0.241 0.01 . 2 . . . . 713 LEU HD11 . 7056 1 1443 . 2 1 37 37 LEU HD13 H 1 0.241 0.01 . 2 . . . . 713 LEU HD11 . 7056 1 1444 . 2 1 37 37 LEU HD21 H 1 0.299 0.01 . 2 . . . . 713 LEU HD21 . 7056 1 1445 . 2 1 37 37 LEU HD22 H 1 0.299 0.01 . 2 . . . . 713 LEU HD21 . 7056 1 1446 . 2 1 37 37 LEU HD23 H 1 0.299 0.01 . 2 . . . . 713 LEU HD21 . 7056 1 1447 . 2 1 37 37 LEU C C 13 178.910 0.15 . 1 . . . . 713 LEU C . 7056 1 1448 . 2 1 37 37 LEU CA C 13 56.857 0.15 . 1 . . . . 713 LEU CA . 7056 1 1449 . 2 1 37 37 LEU CB C 13 41.036 0.15 . 1 . . . . 713 LEU CB . 7056 1 1450 . 2 1 37 37 LEU CG C 13 26.105 0.15 . 1 . . . . 713 LEU CG . 7056 1 1451 . 2 1 37 37 LEU CD1 C 13 25.172 0.15 . 1 . . . . 713 LEU CD1 . 7056 1 1452 . 2 1 37 37 LEU CD2 C 13 22.687 0.15 . 1 . . . . 713 LEU CD2 . 7056 1 1453 . 2 1 37 37 LEU N N 15 119.308 0.06 . 1 . . . . 713 LEU N . 7056 1 1454 . 2 1 38 38 SER H H 1 7.773 0.01 . 1 . . . . 714 SER HN . 7056 1 1455 . 2 1 38 38 SER HA H 1 4.286 0.01 . 1 . . . . 714 SER HA . 7056 1 1456 . 2 1 38 38 SER HB2 H 1 3.975 0.01 . 1 . . . . 714 SER HB1 . 7056 1 1457 . 2 1 38 38 SER HB3 H 1 3.975 0.01 . 1 . . . . 714 SER HB2 . 7056 1 1458 . 2 1 38 38 SER C C 13 174.981 0.15 . 1 . . . . 714 SER C . 7056 1 1459 . 2 1 38 38 SER CA C 13 61.126 0.15 . 1 . . . . 714 SER CA . 7056 1 1460 . 2 1 38 38 SER CB C 13 62.854 0.15 . 1 . . . . 714 SER CB . 7056 1 1461 . 2 1 38 38 SER N N 15 112.864 0.06 . 1 . . . . 714 SER N . 7056 1 1462 . 2 1 39 39 ASN H H 1 7.660 0.01 . 1 . . . . 715 ASN HN . 7056 1 1463 . 2 1 39 39 ASN HA H 1 4.766 0.01 . 1 . . . . 715 ASN HA . 7056 1 1464 . 2 1 39 39 ASN HB2 H 1 2.984 0.01 . 2 . . . . 715 ASN HB1 . 7056 1 1465 . 2 1 39 39 ASN HB3 H 1 2.788 0.01 . 2 . . . . 715 ASN HB2 . 7056 1 1466 . 2 1 39 39 ASN HD21 H 1 7.689 0.01 . 2 . . . . 715 ASN HD21 . 7056 1 1467 . 2 1 39 39 ASN HD22 H 1 7.084 0.01 . 2 . . . . 715 ASN HD22 . 7056 1 1468 . 2 1 39 39 ASN C C 13 175.639 0.15 . 1 . . . . 715 ASN C . 7056 1 1469 . 2 1 39 39 ASN CA C 13 53.375 0.15 . 1 . . . . 715 ASN CA . 7056 1 1470 . 2 1 39 39 ASN CB C 13 39.128 0.15 . 1 . . . . 715 ASN CB . 7056 1 1471 . 2 1 39 39 ASN CG C 13 177.060 0.15 . 1 . . . . 715 ASN CG . 7056 1 1472 . 2 1 39 39 ASN N N 15 117.096 0.06 . 1 . . . . 715 ASN N . 7056 1 1473 . 2 1 39 39 ASN ND2 N 15 113.959 0.06 . 1 . . . . 715 ASN ND2 . 7056 1 1474 . 2 1 40 40 LEU H H 1 7.387 0.01 . 1 . . . . 716 LEU HN . 7056 1 1475 . 2 1 40 40 LEU HA H 1 4.240 0.01 . 1 . . . . 716 LEU HA . 7056 1 1476 . 2 1 40 40 LEU HB2 H 1 1.745 0.01 . 1 . . . . 716 LEU HB1 . 7056 1 1477 . 2 1 40 40 LEU HB3 H 1 1.745 0.01 . 1 . . . . 716 LEU HB2 . 7056 1 1478 . 2 1 40 40 LEU HG H 1 1.846 0.01 . 1 . . . . 716 LEU HG . 7056 1 1479 . 2 1 40 40 LEU HD11 H 1 0.902 0.01 . 2 . . . . 716 LEU HD11 . 7056 1 1480 . 2 1 40 40 LEU HD12 H 1 0.902 0.01 . 2 . . . . 716 LEU HD11 . 7056 1 1481 . 2 1 40 40 LEU HD13 H 1 0.902 0.01 . 2 . . . . 716 LEU HD11 . 7056 1 1482 . 2 1 40 40 LEU HD21 H 1 0.837 0.01 . 2 . . . . 716 LEU HD21 . 7056 1 1483 . 2 1 40 40 LEU HD22 H 1 0.837 0.01 . 2 . . . . 716 LEU HD21 . 7056 1 1484 . 2 1 40 40 LEU HD23 H 1 0.837 0.01 . 2 . . . . 716 LEU HD21 . 7056 1 1485 . 2 1 40 40 LEU C C 13 176.561 0.15 . 1 . . . . 716 LEU C . 7056 1 1486 . 2 1 40 40 LEU CA C 13 55.770 0.15 . 1 . . . . 716 LEU CA . 7056 1 1487 . 2 1 40 40 LEU CB C 13 43.070 0.15 . 1 . . . . 716 LEU CB . 7056 1 1488 . 2 1 40 40 LEU CG C 13 27.661 0.15 . 1 . . . . 716 LEU CG . 7056 1 1489 . 2 1 40 40 LEU CD1 C 13 25.431 0.15 . 1 . . . . 716 LEU CD1 . 7056 1 1490 . 2 1 40 40 LEU CD2 C 13 24.237 0.15 . 1 . . . . 716 LEU CD2 . 7056 1 1491 . 2 1 40 40 LEU N N 15 121.348 0.06 . 1 . . . . 716 LEU N . 7056 1 1492 . 2 1 41 41 ALA H H 1 9.013 0.01 . 1 . . . . 717 ALA HN . 7056 1 1493 . 2 1 41 41 ALA HA H 1 4.468 0.01 . 1 . . . . 717 ALA HA . 7056 1 1494 . 2 1 41 41 ALA HB1 H 1 1.446 0.01 . 1 . . . . 717 ALA HB1 . 7056 1 1495 . 2 1 41 41 ALA HB2 H 1 1.446 0.01 . 1 . . . . 717 ALA HB1 . 7056 1 1496 . 2 1 41 41 ALA HB3 H 1 1.446 0.01 . 1 . . . . 717 ALA HB1 . 7056 1 1497 . 2 1 41 41 ALA C C 13 177.973 0.15 . 1 . . . . 717 ALA C . 7056 1 1498 . 2 1 41 41 ALA CA C 13 50.874 0.15 . 1 . . . . 717 ALA CA . 7056 1 1499 . 2 1 41 41 ALA CB C 13 20.051 0.15 . 1 . . . . 717 ALA CB . 7056 1 1500 . 2 1 41 41 ALA N N 15 126.924 0.06 . 1 . . . . 717 ALA N . 7056 1 1501 . 2 1 42 42 LYS H H 1 8.555 0.01 . 1 . . . . 718 LYS HN . 7056 1 1502 . 2 1 42 42 LYS HA H 1 3.619 0.01 . 1 . . . . 718 LYS HA . 7056 1 1503 . 2 1 42 42 LYS HB2 H 1 1.782 0.01 . 2 . . . . 718 LYS HB1 . 7056 1 1504 . 2 1 42 42 LYS HB3 H 1 1.710 0.01 . 2 . . . . 718 LYS HB2 . 7056 1 1505 . 2 1 42 42 LYS HG2 H 1 1.557 0.01 . 2 . . . . 718 LYS HG1 . 7056 1 1506 . 2 1 42 42 LYS HG3 H 1 1.410 0.01 . 2 . . . . 718 LYS HG2 . 7056 1 1507 . 2 1 42 42 LYS HD2 H 1 1.712 0.01 . 1 . . . . 718 LYS HD1 . 7056 1 1508 . 2 1 42 42 LYS HD3 H 1 1.712 0.01 . 1 . . . . 718 LYS HD2 . 7056 1 1509 . 2 1 42 42 LYS HE2 H 1 2.980 0.01 . 1 . . . . 718 LYS HE1 . 7056 1 1510 . 2 1 42 42 LYS HE3 H 1 2.980 0.01 . 1 . . . . 718 LYS HE2 . 7056 1 1511 . 2 1 42 42 LYS C C 13 177.880 0.15 . 1 . . . . 718 LYS C . 7056 1 1512 . 2 1 42 42 LYS CA C 13 59.031 0.15 . 1 . . . . 718 LYS CA . 7056 1 1513 . 2 1 42 42 LYS CB C 13 32.395 0.15 . 1 . . . . 718 LYS CB . 7056 1 1514 . 2 1 42 42 LYS CG C 13 25.270 0.15 . 1 . . . . 718 LYS CG . 7056 1 1515 . 2 1 42 42 LYS CD C 13 29.601 0.15 . 1 . . . . 718 LYS CD . 7056 1 1516 . 2 1 42 42 LYS CE C 13 42.096 0.15 . 1 . . . . 718 LYS CE . 7056 1 1517 . 2 1 42 42 LYS N N 15 120.279 0.06 . 1 . . . . 718 LYS N . 7056 1 1518 . 2 1 43 43 GLY H H 1 8.486 0.01 . 1 . . . . 719 GLY HN . 7056 1 1519 . 2 1 43 43 GLY HA2 H 1 4.208 0.01 . 2 . . . . 719 GLY HA1 . 7056 1 1520 . 2 1 43 43 GLY HA3 H 1 3.700 0.01 . 2 . . . . 719 GLY HA2 . 7056 1 1521 . 2 1 43 43 GLY C C 13 172.971 0.15 . 1 . . . . 719 GLY C . 7056 1 1522 . 2 1 43 43 GLY CA C 13 45.626 0.15 . 1 . . . . 719 GLY CA . 7056 1 1523 . 2 1 43 43 GLY N N 15 113.023 0.06 . 1 . . . . 719 GLY N . 7056 1 1524 . 2 1 44 44 GLU H H 1 7.877 0.01 . 1 . . . . 720 GLU HN . 7056 1 1525 . 2 1 44 44 GLU HA H 1 4.348 0.01 . 1 . . . . 720 GLU HA . 7056 1 1526 . 2 1 44 44 GLU HB2 H 1 2.172 0.01 . 2 . . . . 720 GLU HB1 . 7056 1 1527 . 2 1 44 44 GLU HB3 H 1 2.085 0.01 . 2 . . . . 720 GLU HB2 . 7056 1 1528 . 2 1 44 44 GLU HG2 H 1 2.430 0.01 . 2 . . . . 720 GLU HG1 . 7056 1 1529 . 2 1 44 44 GLU HG3 H 1 2.242 0.01 . 2 . . . . 720 GLU HG2 . 7056 1 1530 . 2 1 44 44 GLU C C 13 175.125 0.15 . 1 . . . . 720 GLU C . 7056 1 1531 . 2 1 44 44 GLU CA C 13 56.653 0.15 . 1 . . . . 720 GLU CA . 7056 1 1532 . 2 1 44 44 GLU CB C 13 31.296 0.15 . 1 . . . . 720 GLU CB . 7056 1 1533 . 2 1 44 44 GLU CG C 13 37.217 0.15 . 1 . . . . 720 GLU CG . 7056 1 1534 . 2 1 44 44 GLU N N 15 121.135 0.06 . 1 . . . . 720 GLU N . 7056 1 1535 . 2 1 45 45 LYS H H 1 8.166 0.01 . 1 . . . . 721 LYS HN . 7056 1 1536 . 2 1 45 45 LYS HA H 1 5.415 0.01 . 1 . . . . 721 LYS HA . 7056 1 1537 . 2 1 45 45 LYS HB2 H 1 1.067 0.01 . 2 . . . . 721 LYS HB1 . 7056 1 1538 . 2 1 45 45 LYS HB3 H 1 1.003 0.01 . 2 . . . . 721 LYS HB2 . 7056 1 1539 . 2 1 45 45 LYS HG2 H 1 1.334 0.01 . 2 . . . . 721 LYS HG1 . 7056 1 1540 . 2 1 45 45 LYS HG3 H 1 0.958 0.01 . 2 . . . . 721 LYS HG2 . 7056 1 1541 . 2 1 45 45 LYS HD2 H 1 1.219 0.01 . 2 . . . . 721 LYS HD1 . 7056 1 1542 . 2 1 45 45 LYS HD3 H 1 1.155 0.01 . 2 . . . . 721 LYS HD2 . 7056 1 1543 . 2 1 45 45 LYS HE2 H 1 2.795 0.01 . 2 . . . . 721 LYS HE1 . 7056 1 1544 . 2 1 45 45 LYS HE3 H 1 2.760 0.01 . 2 . . . . 721 LYS HE2 . 7056 1 1545 . 2 1 45 45 LYS C C 13 175.830 0.15 . 1 . . . . 721 LYS C . 7056 1 1546 . 2 1 45 45 LYS CA C 13 54.736 0.15 . 1 . . . . 721 LYS CA . 7056 1 1547 . 2 1 45 45 LYS CB C 13 35.430 0.15 . 1 . . . . 721 LYS CB . 7056 1 1548 . 2 1 45 45 LYS CG C 13 25.849 0.15 . 1 . . . . 721 LYS CG . 7056 1 1549 . 2 1 45 45 LYS CD C 13 29.967 0.15 . 1 . . . . 721 LYS CD . 7056 1 1550 . 2 1 45 45 LYS CE C 13 42.341 0.15 . 1 . . . . 721 LYS CE . 7056 1 1551 . 2 1 45 45 LYS N N 15 121.418 0.06 . 1 . . . . 721 LYS N . 7056 1 1552 . 2 1 46 46 ALA H H 1 8.551 0.01 . 1 . . . . 722 ALA HN . 7056 1 1553 . 2 1 46 46 ALA HA H 1 4.414 0.01 . 1 . . . . 722 ALA HA . 7056 1 1554 . 2 1 46 46 ALA HB1 H 1 1.326 0.01 . 1 . . . . 722 ALA HB1 . 7056 1 1555 . 2 1 46 46 ALA HB2 H 1 1.326 0.01 . 1 . . . . 722 ALA HB1 . 7056 1 1556 . 2 1 46 46 ALA HB3 H 1 1.326 0.01 . 1 . . . . 722 ALA HB1 . 7056 1 1557 . 2 1 46 46 ALA C C 13 175.137 0.15 . 1 . . . . 722 ALA C . 7056 1 1558 . 2 1 46 46 ALA CA C 13 51.703 0.15 . 1 . . . . 722 ALA CA . 7056 1 1559 . 2 1 46 46 ALA CB C 13 23.796 0.15 . 1 . . . . 722 ALA CB . 7056 1 1560 . 2 1 46 46 ALA N N 15 120.067 0.06 . 1 . . . . 722 ALA N . 7056 1 1561 . 2 1 47 47 ASN H H 1 9.112 0.01 . 1 . . . . 723 ASN HN . 7056 1 1562 . 2 1 47 47 ASN HA H 1 5.622 0.01 . 1 . . . . 723 ASN HA . 7056 1 1563 . 2 1 47 47 ASN HB2 H 1 2.221 0.01 . 2 . . . . 723 ASN HB1 . 7056 1 1564 . 2 1 47 47 ASN HB3 H 1 2.015 0.01 . 2 . . . . 723 ASN HB2 . 7056 1 1565 . 2 1 47 47 ASN HD21 H 1 7.803 0.01 . 2 . . . . 723 ASN HD21 . 7056 1 1566 . 2 1 47 47 ASN HD22 H 1 7.232 0.01 . 2 . . . . 723 ASN HD22 . 7056 1 1567 . 2 1 47 47 ASN C C 13 174.931 0.15 . 1 . . . . 723 ASN C . 7056 1 1568 . 2 1 47 47 ASN CA C 13 52.802 0.15 . 1 . . . . 723 ASN CA . 7056 1 1569 . 2 1 47 47 ASN CB C 13 40.675 0.15 . 1 . . . . 723 ASN CB . 7056 1 1570 . 2 1 47 47 ASN CG C 13 174.300 0.15 . 1 . . . . 723 ASN CG . 7056 1 1571 . 2 1 47 47 ASN N N 15 119.540 0.06 . 1 . . . . 723 ASN N . 7056 1 1572 . 2 1 47 47 ASN ND2 N 15 115.595 0.06 . 1 . . . . 723 ASN ND2 . 7056 1 1573 . 2 1 48 48 VAL H H 1 9.647 0.01 . 1 . . . . 724 VAL HN . 7056 1 1574 . 2 1 48 48 VAL HA H 1 4.886 0.01 . 1 . . . . 724 VAL HA . 7056 1 1575 . 2 1 48 48 VAL HB H 1 1.630 0.01 . 1 . . . . 724 VAL HB . 7056 1 1576 . 2 1 48 48 VAL HG11 H 1 0.673 0.01 . 2 . . . . 724 VAL HG11 . 7056 1 1577 . 2 1 48 48 VAL HG12 H 1 0.673 0.01 . 2 . . . . 724 VAL HG11 . 7056 1 1578 . 2 1 48 48 VAL HG13 H 1 0.673 0.01 . 2 . . . . 724 VAL HG11 . 7056 1 1579 . 2 1 48 48 VAL HG21 H 1 0.644 0.01 . 2 . . . . 724 VAL HG21 . 7056 1 1580 . 2 1 48 48 VAL HG22 H 1 0.644 0.01 . 2 . . . . 724 VAL HG21 . 7056 1 1581 . 2 1 48 48 VAL HG23 H 1 0.644 0.01 . 2 . . . . 724 VAL HG21 . 7056 1 1582 . 2 1 48 48 VAL C C 13 172.724 0.15 . 1 . . . . 724 VAL C . 7056 1 1583 . 2 1 48 48 VAL CA C 13 59.579 0.15 . 1 . . . . 724 VAL CA . 7056 1 1584 . 2 1 48 48 VAL CB C 13 35.724 0.15 . 1 . . . . 724 VAL CB . 7056 1 1585 . 2 1 48 48 VAL CG1 C 13 20.867 0.15 . 1 . . . . 724 VAL CG1 . 7056 1 1586 . 2 1 48 48 VAL CG2 C 13 22.440 0.15 . 1 . . . . 724 VAL CG2 . 7056 1 1587 . 2 1 48 48 VAL N N 15 121.149 0.06 . 1 . . . . 724 VAL N . 7056 1 1588 . 2 1 49 49 LEU H H 1 8.201 0.01 . 1 . . . . 725 LEU HN . 7056 1 1589 . 2 1 49 49 LEU HA H 1 4.681 0.01 . 1 . . . . 725 LEU HA . 7056 1 1590 . 2 1 49 49 LEU HB2 H 1 1.684 0.01 . 2 . . . . 725 LEU HB1 . 7056 1 1591 . 2 1 49 49 LEU HB3 H 1 1.290 0.01 . 2 . . . . 725 LEU HB2 . 7056 1 1592 . 2 1 49 49 LEU HG H 1 1.342 0.01 . 1 . . . . 725 LEU HG . 7056 1 1593 . 2 1 49 49 LEU HD11 H 1 0.780 0.01 . 2 . . . . 725 LEU HD11 . 7056 1 1594 . 2 1 49 49 LEU HD12 H 1 0.780 0.01 . 2 . . . . 725 LEU HD11 . 7056 1 1595 . 2 1 49 49 LEU HD13 H 1 0.780 0.01 . 2 . . . . 725 LEU HD11 . 7056 1 1596 . 2 1 49 49 LEU HD21 H 1 0.779 0.01 . 2 . . . . 725 LEU HD21 . 7056 1 1597 . 2 1 49 49 LEU HD22 H 1 0.779 0.01 . 2 . . . . 725 LEU HD21 . 7056 1 1598 . 2 1 49 49 LEU HD23 H 1 0.779 0.01 . 2 . . . . 725 LEU HD21 . 7056 1 1599 . 2 1 49 49 LEU C C 13 175.736 0.15 . 1 . . . . 725 LEU C . 7056 1 1600 . 2 1 49 49 LEU CA C 13 54.423 0.15 . 1 . . . . 725 LEU CA . 7056 1 1601 . 2 1 49 49 LEU CB C 13 42.663 0.15 . 1 . . . . 725 LEU CB . 7056 1 1602 . 2 1 49 49 LEU CG C 13 27.301 0.15 . 1 . . . . 725 LEU CG . 7056 1 1603 . 2 1 49 49 LEU CD1 C 13 25.452 0.15 . 1 . . . . 725 LEU CD1 . 7056 1 1604 . 2 1 49 49 LEU CD2 C 13 25.016 0.15 . 1 . . . . 725 LEU CD2 . 7056 1 1605 . 2 1 49 49 LEU N N 15 129.056 0.06 . 1 . . . . 725 LEU N . 7056 1 1606 . 2 1 50 50 ILE H H 1 8.609 0.01 . 1 . . . . 726 ILE HN . 7056 1 1607 . 2 1 50 50 ILE HA H 1 4.475 0.01 . 1 . . . . 726 ILE HA . 7056 1 1608 . 2 1 50 50 ILE HB H 1 1.920 0.01 . 1 . . . . 726 ILE HB . 7056 1 1609 . 2 1 50 50 ILE HG12 H 1 1.337 0.01 . 1 . . . . 726 ILE HG11 . 7056 1 1610 . 2 1 50 50 ILE HG13 H 1 1.037 0.01 . 1 . . . . 726 ILE HG12 . 7056 1 1611 . 2 1 50 50 ILE HG21 H 1 0.792 0.01 . 1 . . . . 726 ILE HG21 . 7056 1 1612 . 2 1 50 50 ILE HG22 H 1 0.792 0.01 . 1 . . . . 726 ILE HG21 . 7056 1 1613 . 2 1 50 50 ILE HG23 H 1 0.792 0.01 . 1 . . . . 726 ILE HG21 . 7056 1 1614 . 2 1 50 50 ILE HD11 H 1 0.726 0.01 . 1 . . . . 726 ILE HD11 . 7056 1 1615 . 2 1 50 50 ILE HD12 H 1 0.726 0.01 . 1 . . . . 726 ILE HD11 . 7056 1 1616 . 2 1 50 50 ILE HD13 H 1 0.726 0.01 . 1 . . . . 726 ILE HD11 . 7056 1 1617 . 2 1 50 50 ILE C C 13 176.176 0.15 . 1 . . . . 726 ILE C . 7056 1 1618 . 2 1 50 50 ILE CA C 13 60.536 0.15 . 1 . . . . 726 ILE CA . 7056 1 1619 . 2 1 50 50 ILE CB C 13 39.839 0.15 . 1 . . . . 726 ILE CB . 7056 1 1620 . 2 1 50 50 ILE CG1 C 13 26.893 0.15 . 1 . . . . 726 ILE CG1 . 7056 1 1621 . 2 1 50 50 ILE CG2 C 13 18.261 0.15 . 1 . . . . 726 ILE CG2 . 7056 1 1622 . 2 1 50 50 ILE CD1 C 13 13.851 0.15 . 1 . . . . 726 ILE CD1 . 7056 1 1623 . 2 1 50 50 ILE N N 15 123.184 0.06 . 1 . . . . 726 ILE N . 7056 1 1624 . 2 1 51 51 GLY H H 1 8.410 0.01 . 1 . . . . 727 GLY HN . 7056 1 1625 . 2 1 51 51 GLY HA2 H 1 4.054 0.01 . 2 . . . . 727 GLY HA1 . 7056 1 1626 . 2 1 51 51 GLY HA3 H 1 3.891 0.01 . 2 . . . . 727 GLY HA2 . 7056 1 1627 . 2 1 51 51 GLY C C 13 173.971 0.15 . 1 . . . . 727 GLY C . 7056 1 1628 . 2 1 51 51 GLY CA C 13 45.430 0.15 . 1 . . . . 727 GLY CA . 7056 1 1629 . 2 1 51 51 GLY N N 15 110.153 0.06 . 1 . . . . 727 GLY N . 7056 1 1630 . 2 1 52 52 GLN H H 1 8.844 0.01 . 1 . . . . 728 GLN HN . 7056 1 1631 . 2 1 52 52 GLN HA H 1 4.183 0.01 . 1 . . . . 728 GLN HA . 7056 1 1632 . 2 1 52 52 GLN HB2 H 1 2.141 0.01 . 2 . . . . 728 GLN HB1 . 7056 1 1633 . 2 1 52 52 GLN HB3 H 1 2.056 0.01 . 2 . . . . 728 GLN HB2 . 7056 1 1634 . 2 1 52 52 GLN HG2 H 1 2.354 0.01 . 1 . . . . 728 GLN HG1 . 7056 1 1635 . 2 1 52 52 GLN HG3 H 1 2.354 0.01 . 1 . . . . 728 GLN HG2 . 7056 1 1636 . 2 1 52 52 GLN HE21 H 1 7.633 0.01 . 2 . . . . 728 GLN HE21 . 7056 1 1637 . 2 1 52 52 GLN HE22 H 1 6.900 0.01 . 2 . . . . 728 GLN HE22 . 7056 1 1638 . 2 1 52 52 GLN C C 13 176.826 0.15 . 1 . . . . 728 GLN C . 7056 1 1639 . 2 1 52 52 GLN CA C 13 56.714 0.15 . 1 . . . . 728 GLN CA . 7056 1 1640 . 2 1 52 52 GLN CB C 13 27.815 0.15 . 1 . . . . 728 GLN CB . 7056 1 1641 . 2 1 52 52 GLN CG C 13 33.875 0.15 . 1 . . . . 728 GLN CG . 7056 1 1642 . 2 1 52 52 GLN CD C 13 180.500 0.15 . 1 . . . . 728 GLN CD . 7056 1 1643 . 2 1 52 52 GLN N N 15 121.039 0.06 . 1 . . . . 728 GLN N . 7056 1 1644 . 2 1 52 52 GLN NE2 N 15 112.944 0.06 . 1 . . . . 728 GLN NE2 . 7056 1 1645 . 2 1 53 53 GLY H H 1 8.493 0.01 . 1 . . . . 729 GLY HN . 7056 1 1646 . 2 1 53 53 GLY HA2 H 1 4.089 0.01 . 2 . . . . 729 GLY HA1 . 7056 1 1647 . 2 1 53 53 GLY HA3 H 1 3.716 0.01 . 2 . . . . 729 GLY HA2 . 7056 1 1648 . 2 1 53 53 GLY C C 13 173.570 0.15 . 1 . . . . 729 GLY C . 7056 1 1649 . 2 1 53 53 GLY CA C 13 45.884 0.15 . 1 . . . . 729 GLY CA . 7056 1 1650 . 2 1 53 53 GLY N N 15 110.161 0.06 . 1 . . . . 729 GLY N . 7056 1 1651 . 2 1 54 54 ASP H H 1 7.877 0.01 . 1 . . . . 730 ASP HN . 7056 1 1652 . 2 1 54 54 ASP HA H 1 4.803 0.01 . 1 . . . . 730 ASP HA . 7056 1 1653 . 2 1 54 54 ASP HB2 H 1 2.571 0.01 . 2 . . . . 730 ASP HB1 . 7056 1 1654 . 2 1 54 54 ASP HB3 H 1 2.359 0.01 . 2 . . . . 730 ASP HB2 . 7056 1 1655 . 2 1 54 54 ASP C C 13 173.563 0.15 . 1 . . . . 730 ASP C . 7056 1 1656 . 2 1 54 54 ASP CA C 13 53.911 0.15 . 1 . . . . 730 ASP CA . 7056 1 1657 . 2 1 54 54 ASP CB C 13 41.894 0.15 . 1 . . . . 730 ASP CB . 7056 1 1658 . 2 1 54 54 ASP N N 15 121.816 0.06 . 1 . . . . 730 ASP N . 7056 1 1659 . 2 1 55 55 VAL H H 1 8.290 0.01 . 1 . . . . 731 VAL HN . 7056 1 1660 . 2 1 55 55 VAL HA H 1 5.003 0.01 . 1 . . . . 731 VAL HA . 7056 1 1661 . 2 1 55 55 VAL HB H 1 1.852 0.01 . 1 . . . . 731 VAL HB . 7056 1 1662 . 2 1 55 55 VAL HG11 H 1 0.710 0.01 . 2 . . . . 731 VAL HG11 . 7056 1 1663 . 2 1 55 55 VAL HG12 H 1 0.710 0.01 . 2 . . . . 731 VAL HG11 . 7056 1 1664 . 2 1 55 55 VAL HG13 H 1 0.710 0.01 . 2 . . . . 731 VAL HG11 . 7056 1 1665 . 2 1 55 55 VAL HG21 H 1 0.834 0.01 . 2 . . . . 731 VAL HG21 . 7056 1 1666 . 2 1 55 55 VAL HG22 H 1 0.834 0.01 . 2 . . . . 731 VAL HG21 . 7056 1 1667 . 2 1 55 55 VAL HG23 H 1 0.834 0.01 . 2 . . . . 731 VAL HG21 . 7056 1 1668 . 2 1 55 55 VAL C C 13 176.189 0.15 . 1 . . . . 731 VAL C . 7056 1 1669 . 2 1 55 55 VAL CA C 13 61.021 0.15 . 1 . . . . 731 VAL CA . 7056 1 1670 . 2 1 55 55 VAL CB C 13 33.757 0.15 . 1 . . . . 731 VAL CB . 7056 1 1671 . 2 1 55 55 VAL CG1 C 13 23.196 0.15 . 1 . . . . 731 VAL CG1 . 7056 1 1672 . 2 1 55 55 VAL CG2 C 13 21.955 0.15 . 1 . . . . 731 VAL CG2 . 7056 1 1673 . 2 1 55 55 VAL N N 15 123.045 0.06 . 1 . . . . 731 VAL N . 7056 1 1674 . 2 1 56 56 VAL H H 1 8.623 0.01 . 1 . . . . 732 VAL HN . 7056 1 1675 . 2 1 56 56 VAL HA H 1 4.829 0.01 . 1 . . . . 732 VAL HA . 7056 1 1676 . 2 1 56 56 VAL HB H 1 2.248 0.01 . 1 . . . . 732 VAL HB . 7056 1 1677 . 2 1 56 56 VAL HG11 H 1 0.809 0.01 . 2 . . . . 732 VAL HG11 . 7056 1 1678 . 2 1 56 56 VAL HG12 H 1 0.809 0.01 . 2 . . . . 732 VAL HG11 . 7056 1 1679 . 2 1 56 56 VAL HG13 H 1 0.809 0.01 . 2 . . . . 732 VAL HG11 . 7056 1 1680 . 2 1 56 56 VAL HG21 H 1 0.709 0.01 . 2 . . . . 732 VAL HG21 . 7056 1 1681 . 2 1 56 56 VAL HG22 H 1 0.709 0.01 . 2 . . . . 732 VAL HG21 . 7056 1 1682 . 2 1 56 56 VAL HG23 H 1 0.709 0.01 . 2 . . . . 732 VAL HG21 . 7056 1 1683 . 2 1 56 56 VAL C C 13 172.946 0.15 . 1 . . . . 732 VAL C . 7056 1 1684 . 2 1 56 56 VAL CA C 13 58.597 0.15 . 1 . . . . 732 VAL CA . 7056 1 1685 . 2 1 56 56 VAL CB C 13 35.215 0.15 . 1 . . . . 732 VAL CB . 7056 1 1686 . 2 1 56 56 VAL CG1 C 13 22.413 0.15 . 1 . . . . 732 VAL CG1 . 7056 1 1687 . 2 1 56 56 VAL CG2 C 13 18.586 0.15 . 1 . . . . 732 VAL CG2 . 7056 1 1688 . 2 1 56 56 VAL N N 15 119.848 0.06 . 1 . . . . 732 VAL N . 7056 1 1689 . 2 1 57 57 LEU H H 1 8.267 0.01 . 1 . . . . 733 LEU HN . 7056 1 1690 . 2 1 57 57 LEU HA H 1 4.835 0.01 . 1 . . . . 733 LEU HA . 7056 1 1691 . 2 1 57 57 LEU HB2 H 1 1.407 0.01 . 2 . . . . 733 LEU HB1 . 7056 1 1692 . 2 1 57 57 LEU HB3 H 1 1.361 0.01 . 2 . . . . 733 LEU HB2 . 7056 1 1693 . 2 1 57 57 LEU HG H 1 0.790 0.01 . 1 . . . . 733 LEU HG . 7056 1 1694 . 2 1 57 57 LEU HD11 H 1 0.569 0.01 . 2 . . . . 733 LEU HD11 . 7056 1 1695 . 2 1 57 57 LEU HD12 H 1 0.569 0.01 . 2 . . . . 733 LEU HD11 . 7056 1 1696 . 2 1 57 57 LEU HD13 H 1 0.569 0.01 . 2 . . . . 733 LEU HD11 . 7056 1 1697 . 2 1 57 57 LEU HD21 H 1 0.569 0.01 . 2 . . . . 733 LEU HD21 . 7056 1 1698 . 2 1 57 57 LEU HD22 H 1 0.569 0.01 . 2 . . . . 733 LEU HD21 . 7056 1 1699 . 2 1 57 57 LEU HD23 H 1 0.569 0.01 . 2 . . . . 733 LEU HD21 . 7056 1 1700 . 2 1 57 57 LEU C C 13 176.447 0.15 . 1 . . . . 733 LEU C . 7056 1 1701 . 2 1 57 57 LEU CA C 13 54.289 0.15 . 1 . . . . 733 LEU CA . 7056 1 1702 . 2 1 57 57 LEU CB C 13 43.416 0.15 . 1 . . . . 733 LEU CB . 7056 1 1703 . 2 1 57 57 LEU CG C 13 27.186 0.15 . 1 . . . . 733 LEU CG . 7056 1 1704 . 2 1 57 57 LEU CD1 C 13 23.779 0.15 . 1 . . . . 733 LEU CD1 . 7056 1 1705 . 2 1 57 57 LEU CD2 C 13 23.779 0.15 . 1 . . . . 733 LEU CD2 . 7056 1 1706 . 2 1 57 57 LEU N N 15 124.302 0.06 . 1 . . . . 733 LEU N . 7056 1 1707 . 2 1 58 58 VAL H H 1 9.233 0.01 . 1 . . . . 734 VAL HN . 7056 1 1708 . 2 1 58 58 VAL HA H 1 5.626 0.01 . 1 . . . . 734 VAL HA . 7056 1 1709 . 2 1 58 58 VAL HB H 1 2.145 0.01 . 1 . . . . 734 VAL HB . 7056 1 1710 . 2 1 58 58 VAL HG11 H 1 0.761 0.01 . 2 . . . . 734 VAL HG11 . 7056 1 1711 . 2 1 58 58 VAL HG12 H 1 0.761 0.01 . 2 . . . . 734 VAL HG11 . 7056 1 1712 . 2 1 58 58 VAL HG13 H 1 0.761 0.01 . 2 . . . . 734 VAL HG11 . 7056 1 1713 . 2 1 58 58 VAL HG21 H 1 0.602 0.01 . 2 . . . . 734 VAL HG21 . 7056 1 1714 . 2 1 58 58 VAL HG22 H 1 0.602 0.01 . 2 . . . . 734 VAL HG21 . 7056 1 1715 . 2 1 58 58 VAL HG23 H 1 0.602 0.01 . 2 . . . . 734 VAL HG21 . 7056 1 1716 . 2 1 58 58 VAL C C 13 174.229 0.15 . 1 . . . . 734 VAL C . 7056 1 1717 . 2 1 58 58 VAL CA C 13 58.200 0.15 . 1 . . . . 734 VAL CA . 7056 1 1718 . 2 1 58 58 VAL CB C 13 36.529 0.15 . 1 . . . . 734 VAL CB . 7056 1 1719 . 2 1 58 58 VAL CG1 C 13 22.470 0.15 . 1 . . . . 734 VAL CG1 . 7056 1 1720 . 2 1 58 58 VAL CG2 C 13 19.038 0.15 . 1 . . . . 734 VAL CG2 . 7056 1 1721 . 2 1 58 58 VAL N N 15 119.408 0.06 . 1 . . . . 734 VAL N . 7056 1 1722 . 2 1 59 59 MET H H 1 8.569 0.01 . 1 . . . . 735 MET HN . 7056 1 1723 . 2 1 59 59 MET HA H 1 5.160 0.01 . 1 . . . . 735 MET HA . 7056 1 1724 . 2 1 59 59 MET HB2 H 1 1.878 0.01 . 1 . . . . 735 MET HB1 . 7056 1 1725 . 2 1 59 59 MET HB3 H 1 1.878 0.01 . 1 . . . . 735 MET HB2 . 7056 1 1726 . 2 1 59 59 MET HG2 H 1 2.291 0.01 . 2 . . . . 735 MET HG1 . 7056 1 1727 . 2 1 59 59 MET HG3 H 1 2.164 0.01 . 2 . . . . 735 MET HG2 . 7056 1 1728 . 2 1 59 59 MET HE1 H 1 2.050 0.01 . 1 . . . . 735 MET HE1 . 7056 1 1729 . 2 1 59 59 MET HE2 H 1 2.050 0.01 . 1 . . . . 735 MET HE1 . 7056 1 1730 . 2 1 59 59 MET HE3 H 1 2.050 0.01 . 1 . . . . 735 MET HE1 . 7056 1 1731 . 2 1 59 59 MET C C 13 175.478 0.15 . 1 . . . . 735 MET C . 7056 1 1732 . 2 1 59 59 MET CA C 13 53.890 0.15 . 1 . . . . 735 MET CA . 7056 1 1733 . 2 1 59 59 MET CB C 13 38.290 0.15 . 1 . . . . 735 MET CB . 7056 1 1734 . 2 1 59 59 MET CG C 13 30.320 0.15 . 1 . . . . 735 MET CG . 7056 1 1735 . 2 1 59 59 MET CE C 13 17.160 0.15 . 1 . . . . 735 MET CE . 7056 1 1736 . 2 1 59 59 MET N N 15 115.458 0.06 . 1 . . . . 735 MET N . 7056 1 1737 . 2 1 60 60 LYS H H 1 8.958 0.01 . 1 . . . . 736 LYS HN . 7056 1 1738 . 2 1 60 60 LYS HA H 1 3.670 0.01 . 1 . . . . 736 LYS HA . 7056 1 1739 . 2 1 60 60 LYS HB2 H 1 1.966 0.01 . 2 . . . . 736 LYS HB1 . 7056 1 1740 . 2 1 60 60 LYS HB3 H 1 1.409 0.01 . 2 . . . . 736 LYS HB2 . 7056 1 1741 . 2 1 60 60 LYS HG2 H 1 1.190 0.01 . 2 . . . . 736 LYS HG1 . 7056 1 1742 . 2 1 60 60 LYS HG3 H 1 0.784 0.01 . 2 . . . . 736 LYS HG2 . 7056 1 1743 . 2 1 60 60 LYS HD2 H 1 1.367 0.01 . 2 . . . . 736 LYS HD1 . 7056 1 1744 . 2 1 60 60 LYS HD3 H 1 1.289 0.01 . 2 . . . . 736 LYS HD2 . 7056 1 1745 . 2 1 60 60 LYS HE2 H 1 2.861 0.01 . 1 . . . . 736 LYS HE1 . 7056 1 1746 . 2 1 60 60 LYS HE3 H 1 2.861 0.01 . 1 . . . . 736 LYS HE2 . 7056 1 1747 . 2 1 60 60 LYS C C 13 176.557 0.15 . 1 . . . . 736 LYS C . 7056 1 1748 . 2 1 60 60 LYS CA C 13 57.500 0.15 . 1 . . . . 736 LYS CA . 7056 1 1749 . 2 1 60 60 LYS CB C 13 32.287 0.15 . 1 . . . . 736 LYS CB . 7056 1 1750 . 2 1 60 60 LYS CG C 13 25.545 0.15 . 1 . . . . 736 LYS CG . 7056 1 1751 . 2 1 60 60 LYS CD C 13 29.297 0.15 . 1 . . . . 736 LYS CD . 7056 1 1752 . 2 1 60 60 LYS CE C 13 42.564 0.15 . 1 . . . . 736 LYS CE . 7056 1 1753 . 2 1 60 60 LYS N N 15 127.418 0.06 . 1 . . . . 736 LYS N . 7056 1 1754 . 2 1 61 61 ARG H H 1 7.942 0.01 . 1 . . . . 737 ARG HN . 7056 1 1755 . 2 1 61 61 ARG HA H 1 4.045 0.01 . 1 . . . . 737 ARG HA . 7056 1 1756 . 2 1 61 61 ARG HB2 H 1 1.728 0.01 . 2 . . . . 737 ARG HB1 . 7056 1 1757 . 2 1 61 61 ARG HB3 H 1 1.427 0.01 . 2 . . . . 737 ARG HB2 . 7056 1 1758 . 2 1 61 61 ARG HG2 H 1 1.534 0.01 . 2 . . . . 737 ARG HG1 . 7056 1 1759 . 2 1 61 61 ARG HG3 H 1 1.362 0.01 . 2 . . . . 737 ARG HG2 . 7056 1 1760 . 2 1 61 61 ARG HD2 H 1 3.122 0.01 . 2 . . . . 737 ARG HD1 . 7056 1 1761 . 2 1 61 61 ARG HD3 H 1 3.008 0.01 . 2 . . . . 737 ARG HD2 . 7056 1 1762 . 2 1 61 61 ARG C C 13 176.179 0.15 . 1 . . . . 737 ARG C . 7056 1 1763 . 2 1 61 61 ARG CA C 13 57.399 0.15 . 1 . . . . 737 ARG CA . 7056 1 1764 . 2 1 61 61 ARG CB C 13 31.224 0.15 . 1 . . . . 737 ARG CB . 7056 1 1765 . 2 1 61 61 ARG CG C 13 28.707 0.15 . 1 . . . . 737 ARG CG . 7056 1 1766 . 2 1 61 61 ARG CD C 13 43.587 0.15 . 1 . . . . 737 ARG CD . 7056 1 1767 . 2 1 61 61 ARG N N 15 126.489 0.06 . 1 . . . . 737 ARG N . 7056 1 1768 . 2 1 62 62 LYS H H 1 8.586 0.01 . 1 . . . . 738 LYS HN . 7056 1 1769 . 2 1 62 62 LYS HA H 1 4.151 0.01 . 1 . . . . 738 LYS HA . 7056 1 1770 . 2 1 62 62 LYS HB2 H 1 1.830 0.01 . 2 . . . . 738 LYS HB1 . 7056 1 1771 . 2 1 62 62 LYS HB3 H 1 1.728 0.01 . 2 . . . . 738 LYS HB2 . 7056 1 1772 . 2 1 62 62 LYS HG2 H 1 1.435 0.01 . 2 . . . . 738 LYS HG1 . 7056 1 1773 . 2 1 62 62 LYS HG3 H 1 1.348 0.01 . 2 . . . . 738 LYS HG2 . 7056 1 1774 . 2 1 62 62 LYS HD2 H 1 1.646 0.01 . 1 . . . . 738 LYS HD1 . 7056 1 1775 . 2 1 62 62 LYS HD3 H 1 1.646 0.01 . 1 . . . . 738 LYS HD2 . 7056 1 1776 . 2 1 62 62 LYS HE2 H 1 2.956 0.01 . 1 . . . . 738 LYS HE1 . 7056 1 1777 . 2 1 62 62 LYS HE3 H 1 2.956 0.01 . 1 . . . . 738 LYS HE2 . 7056 1 1778 . 2 1 62 62 LYS C C 13 176.200 0.15 . 1 . . . . 738 LYS C . 7056 1 1779 . 2 1 62 62 LYS CA C 13 56.989 0.15 . 1 . . . . 738 LYS CA . 7056 1 1780 . 2 1 62 62 LYS CB C 13 33.540 0.15 . 1 . . . . 738 LYS CB . 7056 1 1781 . 2 1 62 62 LYS CG C 13 25.437 0.15 . 1 . . . . 738 LYS CG . 7056 1 1782 . 2 1 62 62 LYS CD C 13 29.514 0.15 . 1 . . . . 738 LYS CD . 7056 1 1783 . 2 1 62 62 LYS CE C 13 42.088 0.15 . 1 . . . . 738 LYS CE . 7056 1 1784 . 2 1 62 62 LYS N N 15 122.001 0.06 . 1 . . . . 738 LYS N . 7056 1 1785 . 2 1 63 63 ARG H H 1 8.200 0.01 . 1 . . . . 739 ARG HN . 7056 1 1786 . 2 1 63 63 ARG HA H 1 4.317 0.01 . 1 . . . . 739 ARG HA . 7056 1 1787 . 2 1 63 63 ARG HB2 H 1 1.816 0.01 . 2 . . . . 739 ARG HB1 . 7056 1 1788 . 2 1 63 63 ARG HB3 H 1 1.753 0.01 . 2 . . . . 739 ARG HB2 . 7056 1 1789 . 2 1 63 63 ARG HG2 H 1 1.596 0.01 . 1 . . . . 739 ARG HG1 . 7056 1 1790 . 2 1 63 63 ARG HG3 H 1 1.596 0.01 . 1 . . . . 739 ARG HG2 . 7056 1 1791 . 2 1 63 63 ARG HD2 H 1 3.162 0.01 . 1 . . . . 739 ARG HD1 . 7056 1 1792 . 2 1 63 63 ARG HD3 H 1 3.162 0.01 . 1 . . . . 739 ARG HD2 . 7056 1 1793 . 2 1 63 63 ARG C C 13 175.130 0.15 . 1 . . . . 739 ARG C . 7056 1 1794 . 2 1 63 63 ARG CA C 13 55.900 0.15 . 1 . . . . 739 ARG CA . 7056 1 1795 . 2 1 63 63 ARG CB C 13 31.309 0.15 . 1 . . . . 739 ARG CB . 7056 1 1796 . 2 1 63 63 ARG CG C 13 27.065 0.15 . 1 . . . . 739 ARG CG . 7056 1 1797 . 2 1 63 63 ARG CD C 13 43.455 0.15 . 1 . . . . 739 ARG CD . 7056 1 1798 . 2 1 63 63 ARG N N 15 121.310 0.06 . 1 . . . . 739 ARG N . 7056 1 1799 . 2 1 64 64 ASP H H 1 8.136 0.01 . 1 . . . . 740 ASP HN . 7056 1 1800 . 2 1 64 64 ASP HA H 1 4.276 0.01 . 1 . . . . 740 ASP HA . 7056 1 1801 . 2 1 64 64 ASP C C 13 180.961 0.15 . 1 . . . . 740 ASP C . 7056 1 1802 . 2 1 64 64 ASP CA C 13 56.993 0.15 . 1 . . . . 740 ASP CA . 7056 1 1803 . 2 1 64 64 ASP N N 15 128.063 0.06 . 1 . . . . 740 ASP N . 7056 1 1804 . 2 1 65 65 SER HA H 1 4.435 0.01 . 1 . . . . 741 SER HA . 7056 1 1805 . 2 1 65 65 SER HB2 H 1 3.945 0.01 . 1 . . . . 741 SER HB1 . 7056 1 1806 . 2 1 65 65 SER HB3 H 1 3.945 0.01 . 1 . . . . 741 SER HB2 . 7056 1 1807 . 2 1 65 65 SER C C 13 174.740 0.15 . 1 . . . . 741 SER C . 7056 1 1808 . 2 1 65 65 SER CA C 13 58.597 0.15 . 1 . . . . 741 SER CA . 7056 1 1809 . 2 1 65 65 SER CB C 13 63.777 0.15 . 1 . . . . 741 SER CB . 7056 1 1810 . 2 1 66 66 SER H H 1 8.550 0.01 . 1 . . . . 742 SER HN . 7056 1 1811 . 2 1 66 66 SER HA H 1 4.406 0.01 . 1 . . . . 742 SER HA . 7056 1 1812 . 2 1 66 66 SER HB2 H 1 3.859 0.01 . 1 . . . . 742 SER HB1 . 7056 1 1813 . 2 1 66 66 SER HB3 H 1 3.859 0.01 . 1 . . . . 742 SER HB2 . 7056 1 1814 . 2 1 66 66 SER C C 13 174.480 0.15 . 1 . . . . 742 SER C . 7056 1 1815 . 2 1 66 66 SER CA C 13 58.955 0.15 . 1 . . . . 742 SER CA . 7056 1 1816 . 2 1 66 66 SER CB C 13 63.932 0.15 . 1 . . . . 742 SER CB . 7056 1 1817 . 2 1 66 66 SER N N 15 118.440 0.06 . 1 . . . . 742 SER N . 7056 1 1818 . 2 1 67 67 ILE H H 1 8.045 0.01 . 1 . . . . 743 ILE HN . 7056 1 1819 . 2 1 67 67 ILE HA H 1 4.175 0.01 . 1 . . . . 743 ILE HA . 7056 1 1820 . 2 1 67 67 ILE HB H 1 1.884 0.01 . 1 . . . . 743 ILE HB . 7056 1 1821 . 2 1 67 67 ILE HG12 H 1 1.450 0.01 . 1 . . . . 743 ILE HG11 . 7056 1 1822 . 2 1 67 67 ILE HG13 H 1 1.170 0.01 . 1 . . . . 743 ILE HG12 . 7056 1 1823 . 2 1 67 67 ILE HG21 H 1 0.872 0.01 . 1 . . . . 743 ILE HG21 . 7056 1 1824 . 2 1 67 67 ILE HG22 H 1 0.872 0.01 . 1 . . . . 743 ILE HG21 . 7056 1 1825 . 2 1 67 67 ILE HG23 H 1 0.872 0.01 . 1 . . . . 743 ILE HG21 . 7056 1 1826 . 2 1 67 67 ILE HD11 H 1 0.839 0.01 . 1 . . . . 743 ILE HD11 . 7056 1 1827 . 2 1 67 67 ILE HD12 H 1 0.839 0.01 . 1 . . . . 743 ILE HD11 . 7056 1 1828 . 2 1 67 67 ILE HD13 H 1 0.839 0.01 . 1 . . . . 743 ILE HD11 . 7056 1 1829 . 2 1 67 67 ILE C C 13 176.401 0.15 . 1 . . . . 743 ILE C . 7056 1 1830 . 2 1 67 67 ILE CA C 13 61.444 0.15 . 1 . . . . 743 ILE CA . 7056 1 1831 . 2 1 67 67 ILE CB C 13 38.800 0.15 . 1 . . . . 743 ILE CB . 7056 1 1832 . 2 1 67 67 ILE CG1 C 13 27.366 0.15 . 1 . . . . 743 ILE CG1 . 7056 1 1833 . 2 1 67 67 ILE CG2 C 13 17.576 0.15 . 1 . . . . 743 ILE CG2 . 7056 1 1834 . 2 1 67 67 ILE CD1 C 13 12.954 0.15 . 1 . . . . 743 ILE CD1 . 7056 1 1835 . 2 1 67 67 ILE N N 15 122.128 0.06 . 1 . . . . 743 ILE N . 7056 1 1836 . 2 1 68 68 LEU H H 1 8.333 0.01 . 1 . . . . 744 LEU HN . 7056 1 1837 . 2 1 68 68 LEU HA H 1 4.449 0.01 . 1 . . . . 744 LEU HA . 7056 1 1838 . 2 1 68 68 LEU HB2 H 1 1.681 0.01 . 2 . . . . 744 LEU HB1 . 7056 1 1839 . 2 1 68 68 LEU HB3 H 1 1.590 0.01 . 2 . . . . 744 LEU HB2 . 7056 1 1840 . 2 1 68 68 LEU HG H 1 1.638 0.01 . 1 . . . . 744 LEU HG . 7056 1 1841 . 2 1 68 68 LEU HD11 H 1 0.925 0.01 . 2 . . . . 744 LEU HD11 . 7056 1 1842 . 2 1 68 68 LEU HD12 H 1 0.925 0.01 . 2 . . . . 744 LEU HD11 . 7056 1 1843 . 2 1 68 68 LEU HD13 H 1 0.925 0.01 . 2 . . . . 744 LEU HD11 . 7056 1 1844 . 2 1 68 68 LEU HD21 H 1 0.860 0.01 . 2 . . . . 744 LEU HD21 . 7056 1 1845 . 2 1 68 68 LEU HD22 H 1 0.860 0.01 . 2 . . . . 744 LEU HD21 . 7056 1 1846 . 2 1 68 68 LEU HD23 H 1 0.860 0.01 . 2 . . . . 744 LEU HD21 . 7056 1 1847 . 2 1 68 68 LEU C C 13 177.765 0.15 . 1 . . . . 744 LEU C . 7056 1 1848 . 2 1 68 68 LEU CA C 13 55.338 0.15 . 1 . . . . 744 LEU CA . 7056 1 1849 . 2 1 68 68 LEU CB C 13 42.263 0.15 . 1 . . . . 744 LEU CB . 7056 1 1850 . 2 1 68 68 LEU CG C 13 27.039 0.15 . 1 . . . . 744 LEU CG . 7056 1 1851 . 2 1 68 68 LEU CD1 C 13 25.060 0.15 . 1 . . . . 744 LEU CD1 . 7056 1 1852 . 2 1 68 68 LEU CD2 C 13 23.379 0.15 . 1 . . . . 744 LEU CD2 . 7056 1 1853 . 2 1 68 68 LEU N N 15 125.944 0.06 . 1 . . . . 744 LEU N . 7056 1 1854 . 2 1 69 69 THR H H 1 8.137 0.01 . 1 . . . . 745 THR HN . 7056 1 1855 . 2 1 69 69 THR HA H 1 4.301 0.01 . 1 . . . . 745 THR HA . 7056 1 1856 . 2 1 69 69 THR HB H 1 4.278 0.01 . 1 . . . . 745 THR HB . 7056 1 1857 . 2 1 69 69 THR HG21 H 1 1.199 0.01 . 1 . . . . 745 THR HG21 . 7056 1 1858 . 2 1 69 69 THR HG22 H 1 1.199 0.01 . 1 . . . . 745 THR HG21 . 7056 1 1859 . 2 1 69 69 THR HG23 H 1 1.199 0.01 . 1 . . . . 745 THR HG21 . 7056 1 1860 . 2 1 69 69 THR C C 13 174.646 0.15 . 1 . . . . 745 THR C . 7056 1 1861 . 2 1 69 69 THR CA C 13 61.979 0.15 . 1 . . . . 745 THR CA . 7056 1 1862 . 2 1 69 69 THR CB C 13 69.914 0.15 . 1 . . . . 745 THR CB . 7056 1 1863 . 2 1 69 69 THR CG2 C 13 21.619 0.15 . 1 . . . . 745 THR CG2 . 7056 1 1864 . 2 1 69 69 THR N N 15 114.474 0.06 . 1 . . . . 745 THR N . 7056 1 1865 . 2 1 70 70 ASP H H 1 8.434 0.01 . 1 . . . . 746 ASP HN . 7056 1 1866 . 2 1 70 70 ASP HA H 1 4.629 0.01 . 1 . . . . 746 ASP HA . 7056 1 1867 . 2 1 70 70 ASP HB2 H 1 2.732 0.01 . 2 . . . . 746 ASP HB1 . 7056 1 1868 . 2 1 70 70 ASP HB3 H 1 2.697 0.01 . 2 . . . . 746 ASP HB2 . 7056 1 1869 . 2 1 70 70 ASP C C 13 176.804 0.15 . 1 . . . . 746 ASP C . 7056 1 1870 . 2 1 70 70 ASP CA C 13 54.788 0.15 . 1 . . . . 746 ASP CA . 7056 1 1871 . 2 1 70 70 ASP CB C 13 41.104 0.15 . 1 . . . . 746 ASP CB . 7056 1 1872 . 2 1 70 70 ASP N N 15 122.781 0.06 . 1 . . . . 746 ASP N . 7056 1 1873 . 2 1 71 71 SER H H 1 8.363 0.01 . 1 . . . . 747 SER HN . 7056 1 1874 . 2 1 71 71 SER HA H 1 4.393 0.01 . 1 . . . . 747 SER HA . 7056 1 1875 . 2 1 71 71 SER HB2 H 1 3.945 0.01 . 2 . . . . 747 SER HB1 . 7056 1 1876 . 2 1 71 71 SER HB3 H 1 3.883 0.01 . 2 . . . . 747 SER HB2 . 7056 1 1877 . 2 1 71 71 SER C C 13 175.292 0.15 . 1 . . . . 747 SER C . 7056 1 1878 . 2 1 71 71 SER CA C 13 59.228 0.15 . 1 . . . . 747 SER CA . 7056 1 1879 . 2 1 71 71 SER CB C 13 63.537 0.15 . 1 . . . . 747 SER CB . 7056 1 1880 . 2 1 71 71 SER N N 15 116.322 0.06 . 1 . . . . 747 SER N . 7056 1 1881 . 2 1 72 72 GLN H H 1 8.446 0.01 . 1 . . . . 748 GLN HN . 7056 1 1882 . 2 1 72 72 GLN HA H 1 4.365 0.01 . 1 . . . . 748 GLN HA . 7056 1 1883 . 2 1 72 72 GLN HB2 H 1 2.171 0.01 . 2 . . . . 748 GLN HB1 . 7056 1 1884 . 2 1 72 72 GLN HB3 H 1 2.093 0.01 . 2 . . . . 748 GLN HB2 . 7056 1 1885 . 2 1 72 72 GLN HG2 H 1 2.417 0.01 . 2 . . . . 748 GLN HG1 . 7056 1 1886 . 2 1 72 72 GLN HG3 H 1 2.386 0.01 . 2 . . . . 748 GLN HG2 . 7056 1 1887 . 2 1 72 72 GLN HE21 H 1 7.646 0.01 . 2 . . . . 748 GLN HE21 . 7056 1 1888 . 2 1 72 72 GLN HE22 H 1 6.900 0.01 . 2 . . . . 748 GLN HE22 . 7056 1 1889 . 2 1 72 72 GLN C C 13 176.773 0.15 . 1 . . . . 748 GLN C . 7056 1 1890 . 2 1 72 72 GLN CA C 13 56.552 0.15 . 1 . . . . 748 GLN CA . 7056 1 1891 . 2 1 72 72 GLN CB C 13 29.295 0.15 . 1 . . . . 748 GLN CB . 7056 1 1892 . 2 1 72 72 GLN CG C 13 34.092 0.15 . 1 . . . . 748 GLN CG . 7056 1 1893 . 2 1 72 72 GLN CD C 13 180.630 0.15 . 1 . . . . 748 GLN CD . 7056 1 1894 . 2 1 72 72 GLN N N 15 121.917 0.06 . 1 . . . . 748 GLN N . 7056 1 1895 . 2 1 72 72 GLN NE2 N 15 112.886 0.06 . 1 . . . . 748 GLN NE2 . 7056 1 1896 . 2 1 73 73 THR H H 1 8.131 0.01 . 1 . . . . 749 THR HN . 7056 1 1897 . 2 1 73 73 THR HA H 1 4.234 0.01 . 1 . . . . 749 THR HA . 7056 1 1898 . 2 1 73 73 THR HB H 1 4.244 0.01 . 1 . . . . 749 THR HB . 7056 1 1899 . 2 1 73 73 THR HG21 H 1 1.225 0.01 . 1 . . . . 749 THR HG21 . 7056 1 1900 . 2 1 73 73 THR HG22 H 1 1.225 0.01 . 1 . . . . 749 THR HG21 . 7056 1 1901 . 2 1 73 73 THR HG23 H 1 1.225 0.01 . 1 . . . . 749 THR HG21 . 7056 1 1902 . 2 1 73 73 THR C C 13 174.795 0.15 . 1 . . . . 749 THR C . 7056 1 1903 . 2 1 73 73 THR CA C 13 62.727 0.15 . 1 . . . . 749 THR CA . 7056 1 1904 . 2 1 73 73 THR CB C 13 69.617 0.15 . 1 . . . . 749 THR CB . 7056 1 1905 . 2 1 73 73 THR CG2 C 13 21.731 0.15 . 1 . . . . 749 THR CG2 . 7056 1 1906 . 2 1 73 73 THR N N 15 114.835 0.06 . 1 . . . . 749 THR N . 7056 1 1907 . 2 1 74 74 ALA H H 1 8.301 0.01 . 1 . . . . 750 ALA HN . 7056 1 1908 . 2 1 74 74 ALA HA H 1 4.330 0.01 . 1 . . . . 750 ALA HA . 7056 1 1909 . 2 1 74 74 ALA HB1 H 1 1.427 0.01 . 1 . . . . 750 ALA HB1 . 7056 1 1910 . 2 1 74 74 ALA HB2 H 1 1.427 0.01 . 1 . . . . 750 ALA HB1 . 7056 1 1911 . 2 1 74 74 ALA HB3 H 1 1.427 0.01 . 1 . . . . 750 ALA HB1 . 7056 1 1912 . 2 1 74 74 ALA C C 13 178.300 0.15 . 1 . . . . 750 ALA C . 7056 1 1913 . 2 1 74 74 ALA CA C 13 53.251 0.15 . 1 . . . . 750 ALA CA . 7056 1 1914 . 2 1 74 74 ALA CB C 13 19.176 0.15 . 1 . . . . 750 ALA CB . 7056 1 1915 . 2 1 74 74 ALA N N 15 126.111 0.06 . 1 . . . . 750 ALA N . 7056 1 1916 . 2 1 75 75 THR H H 1 8.097 0.01 . 1 . . . . 751 THR HN . 7056 1 1917 . 2 1 75 75 THR HA H 1 4.238 0.01 . 1 . . . . 751 THR HA . 7056 1 1918 . 2 1 75 75 THR HB H 1 4.202 0.01 . 1 . . . . 751 THR HB . 7056 1 1919 . 2 1 75 75 THR HG21 H 1 1.225 0.01 . 1 . . . . 751 THR HG21 . 7056 1 1920 . 2 1 75 75 THR HG22 H 1 1.225 0.01 . 1 . . . . 751 THR HG21 . 7056 1 1921 . 2 1 75 75 THR HG23 H 1 1.225 0.01 . 1 . . . . 751 THR HG21 . 7056 1 1922 . 2 1 75 75 THR C C 13 174.787 0.15 . 1 . . . . 751 THR C . 7056 1 1923 . 2 1 75 75 THR CA C 13 62.665 0.15 . 1 . . . . 751 THR CA . 7056 1 1924 . 2 1 75 75 THR CB C 13 69.704 0.15 . 1 . . . . 751 THR CB . 7056 1 1925 . 2 1 75 75 THR CG2 C 13 21.725 0.15 . 1 . . . . 751 THR CG2 . 7056 1 1926 . 2 1 75 75 THR N N 15 113.611 0.06 . 1 . . . . 751 THR N . 7056 1 1927 . 2 1 76 76 LYS H H 1 8.256 0.01 . 1 . . . . 752 LYS HN . 7056 1 1928 . 2 1 76 76 LYS HA H 1 4.261 0.01 . 1 . . . . 752 LYS HA . 7056 1 1929 . 2 1 76 76 LYS HB2 H 1 1.845 0.01 . 2 . . . . 752 LYS HB1 . 7056 1 1930 . 2 1 76 76 LYS HB3 H 1 1.785 0.01 . 2 . . . . 752 LYS HB2 . 7056 1 1931 . 2 1 76 76 LYS HG2 H 1 1.473 0.01 . 2 . . . . 752 LYS HG1 . 7056 1 1932 . 2 1 76 76 LYS HG3 H 1 1.414 0.01 . 2 . . . . 752 LYS HG2 . 7056 1 1933 . 2 1 76 76 LYS HD2 H 1 1.673 0.01 . 1 . . . . 752 LYS HD1 . 7056 1 1934 . 2 1 76 76 LYS HD3 H 1 1.673 0.01 . 1 . . . . 752 LYS HD2 . 7056 1 1935 . 2 1 76 76 LYS HE2 H 1 2.968 0.01 . 1 . . . . 752 LYS HE1 . 7056 1 1936 . 2 1 76 76 LYS HE3 H 1 2.968 0.01 . 1 . . . . 752 LYS HE2 . 7056 1 1937 . 2 1 76 76 LYS C C 13 176.574 0.15 . 1 . . . . 752 LYS C . 7056 1 1938 . 2 1 76 76 LYS CA C 13 56.798 0.15 . 1 . . . . 752 LYS CA . 7056 1 1939 . 2 1 76 76 LYS CB C 13 32.951 0.15 . 1 . . . . 752 LYS CB . 7056 1 1940 . 2 1 76 76 LYS CG C 13 24.923 0.15 . 1 . . . . 752 LYS CG . 7056 1 1941 . 2 1 76 76 LYS CD C 13 29.189 0.15 . 1 . . . . 752 LYS CD . 7056 1 1942 . 2 1 76 76 LYS CE C 13 42.220 0.15 . 1 . . . . 752 LYS CE . 7056 1 1943 . 2 1 76 76 LYS N N 15 123.922 0.06 . 1 . . . . 752 LYS N . 7056 1 1944 . 2 1 77 77 ARG H H 1 8.299 0.01 . 1 . . . . 753 ARG HN . 7056 1 1945 . 2 1 77 77 ARG HA H 1 4.314 0.01 . 1 . . . . 753 ARG HA . 7056 1 1946 . 2 1 77 77 ARG HB2 H 1 1.814 0.01 . 2 . . . . 753 ARG HB1 . 7056 1 1947 . 2 1 77 77 ARG HB3 H 1 1.748 0.01 . 2 . . . . 753 ARG HB2 . 7056 1 1948 . 2 1 77 77 ARG HG2 H 1 1.639 0.01 . 2 . . . . 753 ARG HG1 . 7056 1 1949 . 2 1 77 77 ARG HG3 H 1 1.572 0.01 . 2 . . . . 753 ARG HG2 . 7056 1 1950 . 2 1 77 77 ARG HD2 H 1 3.182 0.01 . 1 . . . . 753 ARG HD1 . 7056 1 1951 . 2 1 77 77 ARG HD3 H 1 3.182 0.01 . 1 . . . . 753 ARG HD2 . 7056 1 1952 . 2 1 77 77 ARG C C 13 176.508 0.15 . 1 . . . . 753 ARG C . 7056 1 1953 . 2 1 77 77 ARG CA C 13 56.406 0.15 . 1 . . . . 753 ARG CA . 7056 1 1954 . 2 1 77 77 ARG CB C 13 30.846 0.15 . 1 . . . . 753 ARG CB . 7056 1 1955 . 2 1 77 77 ARG CG C 13 27.252 0.15 . 1 . . . . 753 ARG CG . 7056 1 1956 . 2 1 77 77 ARG CD C 13 43.440 0.15 . 1 . . . . 753 ARG CD . 7056 1 1957 . 2 1 77 77 ARG N N 15 122.358 0.06 . 1 . . . . 753 ARG N . 7056 1 1958 . 2 1 78 78 ILE H H 1 8.215 0.01 . 1 . . . . 754 ILE HN . 7056 1 1959 . 2 1 78 78 ILE HA H 1 4.112 0.01 . 1 . . . . 754 ILE HA . 7056 1 1960 . 2 1 78 78 ILE HB H 1 1.863 0.01 . 1 . . . . 754 ILE HB . 7056 1 1961 . 2 1 78 78 ILE HG12 H 1 1.501 0.01 . 1 . . . . 754 ILE HG11 . 7056 1 1962 . 2 1 78 78 ILE HG13 H 1 1.192 0.01 . 1 . . . . 754 ILE HG12 . 7056 1 1963 . 2 1 78 78 ILE HG21 H 1 0.873 0.01 . 1 . . . . 754 ILE HG21 . 7056 1 1964 . 2 1 78 78 ILE HG22 H 1 0.873 0.01 . 1 . . . . 754 ILE HG21 . 7056 1 1965 . 2 1 78 78 ILE HG23 H 1 0.873 0.01 . 1 . . . . 754 ILE HG21 . 7056 1 1966 . 2 1 78 78 ILE HD11 H 1 0.839 0.01 . 1 . . . . 754 ILE HD11 . 7056 1 1967 . 2 1 78 78 ILE HD12 H 1 0.839 0.01 . 1 . . . . 754 ILE HD11 . 7056 1 1968 . 2 1 78 78 ILE HD13 H 1 0.839 0.01 . 1 . . . . 754 ILE HD11 . 7056 1 1969 . 2 1 78 78 ILE C C 13 176.290 0.15 . 1 . . . . 754 ILE C . 7056 1 1970 . 2 1 78 78 ILE CA C 13 61.409 0.15 . 1 . . . . 754 ILE CA . 7056 1 1971 . 2 1 78 78 ILE CB C 13 38.678 0.15 . 1 . . . . 754 ILE CB . 7056 1 1972 . 2 1 78 78 ILE CG1 C 13 27.555 0.15 . 1 . . . . 754 ILE CG1 . 7056 1 1973 . 2 1 78 78 ILE CG2 C 13 17.630 0.15 . 1 . . . . 754 ILE CG2 . 7056 1 1974 . 2 1 78 78 ILE CD1 C 13 12.954 0.15 . 1 . . . . 754 ILE CD1 . 7056 1 1975 . 2 1 78 78 ILE N N 15 122.679 0.06 . 1 . . . . 754 ILE N . 7056 1 1976 . 2 1 79 79 ARG H H 1 8.417 0.01 . 1 . . . . 755 ARG HN . 7056 1 1977 . 2 1 79 79 ARG HA H 1 4.329 0.01 . 1 . . . . 755 ARG HA . 7056 1 1978 . 2 1 79 79 ARG HB2 H 1 1.815 0.01 . 2 . . . . 755 ARG HB1 . 7056 1 1979 . 2 1 79 79 ARG HB3 H 1 1.766 0.01 . 2 . . . . 755 ARG HB2 . 7056 1 1980 . 2 1 79 79 ARG HG2 H 1 1.626 0.01 . 2 . . . . 755 ARG HG1 . 7056 1 1981 . 2 1 79 79 ARG HG3 H 1 1.580 0.01 . 2 . . . . 755 ARG HG2 . 7056 1 1982 . 2 1 79 79 ARG HD2 H 1 3.180 0.01 . 1 . . . . 755 ARG HD1 . 7056 1 1983 . 2 1 79 79 ARG HD3 H 1 3.180 0.01 . 1 . . . . 755 ARG HD2 . 7056 1 1984 . 2 1 79 79 ARG C C 13 176.171 0.15 . 1 . . . . 755 ARG C . 7056 1 1985 . 2 1 79 79 ARG CA C 13 56.222 0.15 . 1 . . . . 755 ARG CA . 7056 1 1986 . 2 1 79 79 ARG CB C 13 30.842 0.15 . 1 . . . . 755 ARG CB . 7056 1 1987 . 2 1 79 79 ARG CG C 13 27.290 0.15 . 1 . . . . 755 ARG CG . 7056 1 1988 . 2 1 79 79 ARG CD C 13 43.391 0.15 . 1 . . . . 755 ARG CD . 7056 1 1989 . 2 1 79 79 ARG N N 15 125.176 0.06 . 1 . . . . 755 ARG N . 7056 1 1990 . 2 1 80 80 MET H H 1 8.404 0.01 . 1 . . . . 756 MET HN . 7056 1 1991 . 2 1 80 80 MET HA H 1 4.429 0.01 . 1 . . . . 756 MET HA . 7056 1 1992 . 2 1 80 80 MET HB2 H 1 2.084 0.01 . 2 . . . . 756 MET HB1 . 7056 1 1993 . 2 1 80 80 MET HB3 H 1 2.003 0.01 . 2 . . . . 756 MET HB2 . 7056 1 1994 . 2 1 80 80 MET HG2 H 1 2.626 0.01 . 2 . . . . 756 MET HG1 . 7056 1 1995 . 2 1 80 80 MET HG3 H 1 2.550 0.01 . 2 . . . . 756 MET HG2 . 7056 1 1996 . 2 1 80 80 MET HE1 H 1 2.097 0.01 . 1 . . . . 756 MET HE1 . 7056 1 1997 . 2 1 80 80 MET HE2 H 1 2.097 0.01 . 1 . . . . 756 MET HE1 . 7056 1 1998 . 2 1 80 80 MET HE3 H 1 2.097 0.01 . 1 . . . . 756 MET HE1 . 7056 1 1999 . 2 1 80 80 MET C C 13 175.754 0.15 . 1 . . . . 756 MET C . 7056 1 2000 . 2 1 80 80 MET CA C 13 55.338 0.15 . 1 . . . . 756 MET CA . 7056 1 2001 . 2 1 80 80 MET CB C 13 33.079 0.15 . 1 . . . . 756 MET CB . 7056 1 2002 . 2 1 80 80 MET CG C 13 32.000 0.15 . 1 . . . . 756 MET CG . 7056 1 2003 . 2 1 80 80 MET CE C 13 16.968 0.15 . 1 . . . . 756 MET CE . 7056 1 2004 . 2 1 80 80 MET N N 15 122.225 0.06 . 1 . . . . 756 MET N . 7056 1 2005 . 2 1 81 81 ALA H H 1 8.313 0.01 . 1 . . . . 757 ALA HN . 7056 1 2006 . 2 1 81 81 ALA HA H 1 4.346 0.01 . 1 . . . . 757 ALA HA . 7056 1 2007 . 2 1 81 81 ALA HB1 H 1 1.398 0.01 . 1 . . . . 757 ALA HB1 . 7056 1 2008 . 2 1 81 81 ALA HB2 H 1 1.398 0.01 . 1 . . . . 757 ALA HB1 . 7056 1 2009 . 2 1 81 81 ALA HB3 H 1 1.398 0.01 . 1 . . . . 757 ALA HB1 . 7056 1 2010 . 2 1 81 81 ALA C C 13 177.389 0.15 . 1 . . . . 757 ALA C . 7056 1 2011 . 2 1 81 81 ALA CA C 13 52.443 0.15 . 1 . . . . 757 ALA CA . 7056 1 2012 . 2 1 81 81 ALA CB C 13 19.358 0.15 . 1 . . . . 757 ALA CB . 7056 1 2013 . 2 1 81 81 ALA N N 15 125.584 0.06 . 1 . . . . 757 ALA N . 7056 1 2014 . 2 1 82 82 ILE H H 1 8.170 0.01 . 1 . . . . 758 ILE HN . 7056 1 2015 . 2 1 82 82 ILE HA H 1 4.183 0.01 . 1 . . . . 758 ILE HA . 7056 1 2016 . 2 1 82 82 ILE HB H 1 1.888 0.01 . 1 . . . . 758 ILE HB . 7056 1 2017 . 2 1 82 82 ILE HG12 H 1 1.468 0.01 . 1 . . . . 758 ILE HG11 . 7056 1 2018 . 2 1 82 82 ILE HG13 H 1 1.171 0.01 . 1 . . . . 758 ILE HG12 . 7056 1 2019 . 2 1 82 82 ILE HG21 H 1 0.898 0.01 . 1 . . . . 758 ILE HG21 . 7056 1 2020 . 2 1 82 82 ILE HG22 H 1 0.898 0.01 . 1 . . . . 758 ILE HG21 . 7056 1 2021 . 2 1 82 82 ILE HG23 H 1 0.898 0.01 . 1 . . . . 758 ILE HG21 . 7056 1 2022 . 2 1 82 82 ILE HD11 H 1 0.839 0.01 . 1 . . . . 758 ILE HD11 . 7056 1 2023 . 2 1 82 82 ILE HD12 H 1 0.839 0.01 . 1 . . . . 758 ILE HD11 . 7056 1 2024 . 2 1 82 82 ILE HD13 H 1 0.839 0.01 . 1 . . . . 758 ILE HD11 . 7056 1 2025 . 2 1 82 82 ILE C C 13 175.303 0.15 . 1 . . . . 758 ILE C . 7056 1 2026 . 2 1 82 82 ILE CA C 13 61.236 0.15 . 1 . . . . 758 ILE CA . 7056 1 2027 . 2 1 82 82 ILE CB C 13 38.938 0.15 . 1 . . . . 758 ILE CB . 7056 1 2028 . 2 1 82 82 ILE CG1 C 13 27.052 0.15 . 1 . . . . 758 ILE CG1 . 7056 1 2029 . 2 1 82 82 ILE CG2 C 13 17.600 0.15 . 1 . . . . 758 ILE CG2 . 7056 1 2030 . 2 1 82 82 ILE CD1 C 13 13.110 0.15 . 1 . . . . 758 ILE CD1 . 7056 1 2031 . 2 1 82 82 ILE N N 15 119.935 0.06 . 1 . . . . 758 ILE N . 7056 1 2032 . 2 1 83 83 ASN H H 1 8.038 0.01 . 1 . . . . 759 ASN HN . 7056 1 2033 . 2 1 83 83 ASN HA H 1 4.465 0.01 . 1 . . . . 759 ASN HA . 7056 1 2034 . 2 1 83 83 ASN HB2 H 1 2.739 0.01 . 2 . . . . 759 ASN HB1 . 7056 1 2035 . 2 1 83 83 ASN HB3 H 1 2.681 0.01 . 2 . . . . 759 ASN HB2 . 7056 1 2036 . 2 1 83 83 ASN HD21 H 1 7.570 0.01 . 2 . . . . 759 ASN HD21 . 7056 1 2037 . 2 1 83 83 ASN HD22 H 1 6.845 0.01 . 2 . . . . 759 ASN HD22 . 7056 1 2038 . 2 1 83 83 ASN C C 13 179.478 0.15 . 1 . . . . 759 ASN C . 7056 1 2039 . 2 1 83 83 ASN CA C 13 54.765 0.15 . 1 . . . . 759 ASN CA . 7056 1 2040 . 2 1 83 83 ASN CB C 13 40.495 0.15 . 1 . . . . 759 ASN CB . 7056 1 2041 . 2 1 83 83 ASN CG C 13 178.220 0.15 . 1 . . . . 759 ASN CG . 7056 1 2042 . 2 1 83 83 ASN N N 15 127.510 0.06 . 1 . . . . 759 ASN N . 7056 1 2043 . 2 1 83 83 ASN ND2 N 15 113.178 0.06 . 1 . . . . 759 ASN ND2 . 7056 1 stop_ save_ ######################## # Coupling constants # ######################## save_J_coupling_list_1 _Coupling_constant_list.Sf_category coupling_constants _Coupling_constant_list.Sf_framecode J_coupling_list_1 _Coupling_constant_list.Entry_ID 7056 _Coupling_constant_list.ID 1 _Coupling_constant_list.Sample_condition_list_ID 1 _Coupling_constant_list.Sample_condition_list_label $conditions_1 _Coupling_constant_list.Spectrometer_frequency_1H 600 _Coupling_constant_list.Details . _Coupling_constant_list.Text_data_format . _Coupling_constant_list.Text_data . loop_ _Coupling_constant_experiment.Experiment_ID _Coupling_constant_experiment.Experiment_name _Coupling_constant_experiment.Sample_ID _Coupling_constant_experiment.Sample_label _Coupling_constant_experiment.Sample_state _Coupling_constant_experiment.Entry_ID _Coupling_constant_experiment.Coupling_constant_list_ID 15 HNHA 1 $sample_1 isotropic 7056 1 stop_ loop_ _Coupling_constant.ID _Coupling_constant.Code _Coupling_constant.Assembly_atom_ID_1 _Coupling_constant.Entity_assembly_ID_1 _Coupling_constant.Entity_ID_1 _Coupling_constant.Comp_index_ID_1 _Coupling_constant.Seq_ID_1 _Coupling_constant.Comp_ID_1 _Coupling_constant.Atom_ID_1 _Coupling_constant.Atom_type_1 _Coupling_constant.Atom_isotope_number_1 _Coupling_constant.Ambiguity_code_1 _Coupling_constant.Assembly_atom_ID_2 _Coupling_constant.Entity_assembly_ID_2 _Coupling_constant.Entity_ID_2 _Coupling_constant.Comp_index_ID_2 _Coupling_constant.Seq_ID_2 _Coupling_constant.Comp_ID_2 _Coupling_constant.Atom_ID_2 _Coupling_constant.Atom_type_2 _Coupling_constant.Atom_isotope_number_2 _Coupling_constant.Ambiguity_code_2 _Coupling_constant.Val _Coupling_constant.Val_min _Coupling_constant.Val_max _Coupling_constant.Val_err _Coupling_constant.Resonance_ID_1 _Coupling_constant.Resonance_ID_2 _Coupling_constant.Auth_entity_assembly_ID_1 _Coupling_constant.Auth_seq_ID_1 _Coupling_constant.Auth_comp_ID_1 _Coupling_constant.Auth_atom_ID_1 _Coupling_constant.Auth_entity_assembly_ID_2 _Coupling_constant.Auth_seq_ID_2 _Coupling_constant.Auth_comp_ID_2 _Coupling_constant.Auth_atom_ID_2 _Coupling_constant.Details _Coupling_constant.Entry_ID _Coupling_constant.Coupling_constant_list_ID 1 3JHNHA . 1 1 4 4 ASP H H 1 1 . 1 1 4 4 ASP HA H 1 1 8.00 7.29 8.71 0.71 . . . . . . . . . . . 7056 1 2 3JHNHA . 1 1 5 5 GLU H H 1 1 . 1 1 5 5 GLU HA H 1 1 6.80 6.68 6.92 0.12 . . . . . . . . . . . 7056 1 3 3JHNHA . 1 1 6 6 SER H H 1 1 . 1 1 6 6 SER HA H 1 1 7.26 7.05 7.47 0.21 . . . . . . . . . . . 7056 1 4 3JHNHA . 1 1 7 7 THR H H 1 1 . 1 1 7 7 THR HA H 1 1 7.74 7.02 8.46 0.72 . . . . . . . . . . . 7056 1 5 3JHNHA . 1 1 8 8 SER H H 1 1 . 1 1 8 8 SER HA H 1 1 7.74 7.05 8.43 0.69 . . . . . . . . . . . 7056 1 6 3JHNHA . 1 1 10 10 VAL H H 1 1 . 1 1 10 10 VAL HA H 1 1 7.04 6.98 7.10 0.06 . . . . . . . . . . . 7056 1 7 3JHNHA . 1 1 12 12 SER H H 1 1 . 1 1 12 12 SER HA H 1 1 6.18 5.96 6.40 0.22 . . . . . . . . . . . 7056 1 8 3JHNHA . 1 1 14 14 VAL H H 1 1 . 1 1 14 14 VAL HA H 1 1 6.44 6.31 6.57 0.13 . . . . . . . . . . . 7056 1 9 3JHNHA . 1 1 15 15 LEU H H 1 1 . 1 1 15 15 LEU HA H 1 1 7.52 7.17 7.87 0.35 . . . . . . . . . . . 7056 1 10 3JHNHA . 1 1 16 16 ARG H H 1 1 . 1 1 16 16 ARG HA H 1 1 5.06 4.72 5.40 0.34 . . . . . . . . . . . 7056 1 11 3JHNHA . 1 1 18 18 PHE H H 1 1 . 1 1 18 18 PHE HA H 1 1 9.85 9.27 10.43 0.58 . . . . . . . . . . . 7056 1 12 3JHNHA . 1 1 19 19 LEU H H 1 1 . 1 1 19 19 LEU HA H 1 1 9.83 9.12 10.54 0.71 . . . . . . . . . . . 7056 1 13 3JHNHA . 1 1 20 20 ILE H H 1 1 . 1 1 20 20 ILE HA H 1 1 7.49 7.18 7.80 0.31 . . . . . . . . . . . 7056 1 14 3JHNHA . 1 1 21 21 LEU H H 1 1 . 1 1 21 21 LEU HA H 1 1 8.26 6.97 9.55 1.29 . . . . . . . . . . . 7056 1 15 3JHNHA . 1 1 23 23 LYS H H 1 1 . 1 1 23 23 LYS HA H 1 1 6.38 6.25 6.51 0.13 . . . . . . . . . . . 7056 1 16 3JHNHA . 1 1 25 25 ASP H H 1 1 . 1 1 25 25 ASP HA H 1 1 8.96 8.49 9.43 0.47 . . . . . . . . . . . 7056 1 17 3JHNHA . 1 1 27 27 ARG H H 1 1 . 1 1 27 27 ARG HA H 1 1 5.66 5.51 5.81 0.15 . . . . . . . . . . . 7056 1 18 3JHNHA . 1 1 28 28 TYR H H 1 1 . 1 1 28 28 TYR HA H 1 1 9.45 9.04 9.86 0.41 . . . . . . . . . . . 7056 1 19 3JHNHA . 1 1 31 31 ALA H H 1 1 . 1 1 31 31 ALA HA H 1 1 5.90 4.94 6.86 0.96 . . . . . . . . . . . 7056 1 20 3JHNHA . 1 1 32 32 LEU H H 1 1 . 1 1 32 32 LEU HA H 1 1 7.21 6.53 7.89 0.68 . . . . . . . . . . . 7056 1 21 3JHNHA . 1 1 33 33 SER H H 1 1 . 1 1 33 33 SER HA H 1 1 7.83 7.67 7.99 0.16 . . . . . . . . . . . 7056 1 22 3JHNHA . 1 1 34 34 ILE H H 1 1 . 1 1 34 34 ILE HA H 1 1 5.76 4.86 6.66 0.90 . . . . . . . . . . . 7056 1 23 3JHNHA . 1 1 36 36 GLU H H 1 1 . 1 1 36 36 GLU HA H 1 1 8.11 7.94 8.28 0.17 . . . . . . . . . . . 7056 1 24 3JHNHA . 1 1 37 37 LEU H H 1 1 . 1 1 37 37 LEU HA H 1 1 4.39 4.06 4.72 0.33 . . . . . . . . . . . 7056 1 25 3JHNHA . 1 1 39 39 ASN H H 1 1 . 1 1 39 39 ASN HA H 1 1 8.20 8.00 8.40 0.20 . . . . . . . . . . . 7056 1 26 3JHNHA . 1 1 40 40 LEU H H 1 1 . 1 1 40 40 LEU HA H 1 1 5.79 5.67 5.91 0.12 . . . . . . . . . . . 7056 1 27 3JHNHA . 1 1 41 41 ALA H H 1 1 . 1 1 41 41 ALA HA H 1 1 7.25 6.97 7.53 0.28 . . . . . . . . . . . 7056 1 28 3JHNHA . 1 1 44 44 GLU H H 1 1 . 1 1 44 44 GLU HA H 1 1 7.16 7.00 7.32 0.16 . . . . . . . . . . . 7056 1 29 3JHNHA . 1 1 45 45 LYS H H 1 1 . 1 1 45 45 LYS HA H 1 1 8.01 7.75 8.27 0.26 . . . . . . . . . . . 7056 1 30 3JHNHA . 1 1 47 47 ASN H H 1 1 . 1 1 47 47 ASN HA H 1 1 9.01 8.46 9.56 0.55 . . . . . . . . . . . 7056 1 31 3JHNHA . 1 1 48 48 VAL H H 1 1 . 1 1 48 48 VAL HA H 1 1 9.02 8.68 9.36 0.34 . . . . . . . . . . . 7056 1 32 3JHNHA . 1 1 49 49 LEU H H 1 1 . 1 1 49 49 LEU HA H 1 1 6.70 6.27 7.13 0.43 . . . . . . . . . . . 7056 1 33 3JHNHA . 1 1 52 52 GLN H H 1 1 . 1 1 52 52 GLN HA H 1 1 7.78 6.03 9.53 1.75 . . . . . . . . . . . 7056 1 34 3JHNHA . 1 1 54 54 ASP H H 1 1 . 1 1 54 54 ASP HA H 1 1 8.90 8.80 9.00 0.10 . . . . . . . . . . . 7056 1 35 3JHNHA . 1 1 55 55 VAL H H 1 1 . 1 1 55 55 VAL HA H 1 1 10.40 9.53 11.27 0.87 . . . . . . . . . . . 7056 1 36 3JHNHA . 1 1 56 56 VAL H H 1 1 . 1 1 56 56 VAL HA H 1 1 9.66 9.08 10.24 0.58 . . . . . . . . . . . 7056 1 37 3JHNHA . 1 1 57 57 LEU H H 1 1 . 1 1 57 57 LEU HA H 1 1 7.05 6.55 7.55 0.50 . . . . . . . . . . . 7056 1 38 3JHNHA . 1 1 58 58 VAL H H 1 1 . 1 1 58 58 VAL HA H 1 1 9.23 8.61 9.85 0.62 . . . . . . . . . . . 7056 1 39 3JHNHA . 1 1 59 59 MET H H 1 1 . 1 1 59 59 MET HA H 1 1 8.12 7.70 8.54 0.42 . . . . . . . . . . . 7056 1 40 3JHNHA . 1 1 60 60 LYS H H 1 1 . 1 1 60 60 LYS HA H 1 1 6.52 5.43 7.61 1.09 . . . . . . . . . . . 7056 1 41 3JHNHA . 1 1 62 62 LYS H H 1 1 . 1 1 62 62 LYS HA H 1 1 3.88 3.53 4.23 0.35 . . . . . . . . . . . 7056 1 42 3JHNHA . 1 1 67 67 ILE H H 1 1 . 1 1 67 67 ILE HA H 1 1 7.84 7.77 7.91 0.07 . . . . . . . . . . . 7056 1 43 3JHNHA . 1 1 68 68 LEU H H 1 1 . 1 1 68 68 LEU HA H 1 1 6.71 6.26 7.16 0.45 . . . . . . . . . . . 7056 1 44 3JHNHA . 1 1 69 69 THR H H 1 1 . 1 1 69 69 THR HA H 1 1 7.42 6.92 7.92 0.50 . . . . . . . . . . . 7056 1 45 3JHNHA . 1 1 70 70 ASP H H 1 1 . 1 1 70 70 ASP HA H 1 1 7.38 7.14 7.62 0.24 . . . . . . . . . . . 7056 1 46 3JHNHA . 1 1 72 72 GLN H H 1 1 . 1 1 72 72 GLN HA H 1 1 8.81 7.13 10.49 1.68 . . . . . . . . . . . 7056 1 47 3JHNHA . 1 1 73 73 THR H H 1 1 . 1 1 73 73 THR HA H 1 1 8.76 8.15 9.37 0.61 . . . . . . . . . . . 7056 1 48 3JHNHA . 1 1 75 75 THR H H 1 1 . 1 1 75 75 THR HA H 1 1 7.14 7.01 7.27 0.13 . . . . . . . . . . . 7056 1 49 3JHNHA . 1 1 76 76 LYS H H 1 1 . 1 1 76 76 LYS HA H 1 1 8.50 7.92 9.08 0.58 . . . . . . . . . . . 7056 1 50 3JHNHA . 1 1 77 77 ARG H H 1 1 . 1 1 77 77 ARG HA H 1 1 6.42 6.27 6.57 0.15 . . . . . . . . . . . 7056 1 51 3JHNHA . 1 1 78 78 ILE H H 1 1 . 1 1 78 78 ILE HA H 1 1 7.63 7.37 7.89 0.26 . . . . . . . . . . . 7056 1 52 3JHNHA . 1 1 79 79 ARG H H 1 1 . 1 1 79 79 ARG HA H 1 1 7.39 7.27 7.51 0.12 . . . . . . . . . . . 7056 1 53 3JHNHA . 1 1 80 80 MET H H 1 1 . 1 1 80 80 MET HA H 1 1 7.20 6.90 7.50 0.30 . . . . . . . . . . . 7056 1 54 3JHNHA . 1 1 81 81 ALA H H 1 1 . 1 1 81 81 ALA HA H 1 1 7.39 6.98 7.80 0.41 . . . . . . . . . . . 7056 1 55 3JHNHA . 1 1 82 82 ILE H H 1 1 . 1 1 82 82 ILE HA H 1 1 8.84 8.79 8.89 0.05 . . . . . . . . . . . 7056 1 56 3JHNHA . 1 1 83 83 ASN H H 1 1 . 1 1 83 83 ASN HA H 1 1 8.40 8.38 8.42 0.02 . . . . . . . . . . . 7056 1 stop_ save_ ############################## # Heteronuclear NOE values # ############################## save_heteronucl_NOE_list_1 _Heteronucl_NOE_list.Sf_category heteronucl_NOEs _Heteronucl_NOE_list.Sf_framecode heteronucl_NOE_list_1 _Heteronucl_NOE_list.Entry_ID 7056 _Heteronucl_NOE_list.ID 1 _Heteronucl_NOE_list.Sample_condition_list_ID 1 _Heteronucl_NOE_list.Sample_condition_list_label $conditions_1 _Heteronucl_NOE_list.Spectrometer_frequency_1H 600 _Heteronucl_NOE_list.Heteronuclear_NOE_val_type 'Relative intensities' _Heteronucl_NOE_list.NOE_ref_val 1.0 _Heteronucl_NOE_list.NOE_ref_description . _Heteronucl_NOE_list.Details . _Heteronucl_NOE_list.Text_data_format . _Heteronucl_NOE_list.Text_data . loop_ _Heteronucl_NOE_experiment.Experiment_ID _Heteronucl_NOE_experiment.Experiment_name _Heteronucl_NOE_experiment.Sample_ID _Heteronucl_NOE_experiment.Sample_label _Heteronucl_NOE_experiment.Sample_state _Heteronucl_NOE_experiment.Entry_ID _Heteronucl_NOE_experiment.Heteronucl_NOE_list_ID 21 15N_heteronuclear_{1H}-NOE 1 $sample_1 isotropic 7056 1 stop_ loop_ _Heteronucl_NOE_software.Software_ID _Heteronucl_NOE_software.Software_label _Heteronucl_NOE_software.Method_ID _Heteronucl_NOE_software.Method_label _Heteronucl_NOE_software.Entry_ID _Heteronucl_NOE_software.Heteronucl_NOE_list_ID 1 $software_1 . . 7056 1 stop_ loop_ _Heteronucl_NOE.ID _Heteronucl_NOE.Assembly_atom_ID_1 _Heteronucl_NOE.Entity_assembly_ID_1 _Heteronucl_NOE.Entity_ID_1 _Heteronucl_NOE.Comp_index_ID_1 _Heteronucl_NOE.Seq_ID_1 _Heteronucl_NOE.Comp_ID_1 _Heteronucl_NOE.Atom_ID_1 _Heteronucl_NOE.Atom_type_1 _Heteronucl_NOE.Atom_isotope_number_1 _Heteronucl_NOE.Assembly_atom_ID_2 _Heteronucl_NOE.Entity_assembly_ID_2 _Heteronucl_NOE.Entity_ID_2 _Heteronucl_NOE.Comp_index_ID_2 _Heteronucl_NOE.Seq_ID_2 _Heteronucl_NOE.Comp_ID_2 _Heteronucl_NOE.Atom_ID_2 _Heteronucl_NOE.Atom_type_2 _Heteronucl_NOE.Atom_isotope_number_2 _Heteronucl_NOE.Val _Heteronucl_NOE.Val_err _Heteronucl_NOE.Resonance_ID_1 _Heteronucl_NOE.Resonance_ID_2 _Heteronucl_NOE.Auth_entity_assembly_ID_1 _Heteronucl_NOE.Auth_seq_ID_1 _Heteronucl_NOE.Auth_comp_ID_1 _Heteronucl_NOE.Auth_atom_ID_1 _Heteronucl_NOE.Auth_entity_assembly_ID_2 _Heteronucl_NOE.Auth_seq_ID_2 _Heteronucl_NOE.Auth_comp_ID_2 _Heteronucl_NOE.Auth_atom_ID_2 _Heteronucl_NOE.Entry_ID _Heteronucl_NOE.Heteronucl_NOE_list_ID 1 . 1 1 4 4 ASP N N 15 . 1 1 4 4 ASP H H 1 0.109 0.096 . . . . . . . . . . 7056 1 2 . 1 1 5 5 GLU N N 15 . 1 1 5 5 GLU H H 1 0.230 0.060 . . . . . . . . . . 7056 1 3 . 1 1 6 6 SER N N 15 . 1 1 6 6 SER H H 1 0.240 0.089 . . . . . . . . . . 7056 1 4 . 1 1 7 7 THR N N 15 . 1 1 7 7 THR H H 1 0.359 0.106 . . . . . . . . . . 7056 1 5 . 1 1 8 8 SER N N 15 . 1 1 8 8 SER H H 1 0.314 0.079 . . . . . . . . . . 7056 1 6 . 1 1 9 9 GLY N N 15 . 1 1 9 9 GLY H H 1 0.303 0.093 . . . . . . . . . . 7056 1 7 . 1 1 10 10 VAL N N 15 . 1 1 10 10 VAL H H 1 0.524 0.045 . . . . . . . . . . 7056 1 8 . 1 1 12 12 SER N N 15 . 1 1 12 12 SER H H 1 0.534 0.085 . . . . . . . . . . 7056 1 9 . 1 1 14 14 VAL N N 15 . 1 1 14 14 VAL H H 1 0.658 0.056 . . . . . . . . . . 7056 1 10 . 1 1 15 15 LEU N N 15 . 1 1 15 15 LEU H H 1 0.694 0.084 . . . . . . . . . . 7056 1 11 . 1 1 16 16 ARG N N 15 . 1 1 16 16 ARG H H 1 0.816 0.094 . . . . . . . . . . 7056 1 12 . 1 1 18 18 PHE N N 15 . 1 1 18 18 PHE H H 1 0.805 0.069 . . . . . . . . . . 7056 1 13 . 1 1 19 19 LEU N N 15 . 1 1 19 19 LEU H H 1 0.794 0.087 . . . . . . . . . . 7056 1 14 . 1 1 20 20 ILE N N 15 . 1 1 20 20 ILE H H 1 0.684 0.082 . . . . . . . . . . 7056 1 15 . 1 1 21 21 LEU N N 15 . 1 1 21 21 LEU H H 1 0.713 0.086 . . . . . . . . . . 7056 1 16 . 1 1 22 22 GLY N N 15 . 1 1 22 22 GLY H H 1 0.799 0.056 . . . . . . . . . . 7056 1 17 . 1 1 23 23 LYS N N 15 . 1 1 23 23 LYS H H 1 0.659 0.086 . . . . . . . . . . 7056 1 18 . 1 1 24 24 GLU N N 15 . 1 1 24 24 GLU H H 1 0.677 0.063 . . . . . . . . . . 7056 1 19 . 1 1 25 25 ASP N N 15 . 1 1 25 25 ASP H H 1 0.735 0.069 . . . . . . . . . . 7056 1 20 . 1 1 27 27 ARG N N 15 . 1 1 27 27 ARG H H 1 0.723 0.060 . . . . . . . . . . 7056 1 21 . 1 1 28 28 TYR N N 15 . 1 1 28 28 TYR H H 1 0.770 0.052 . . . . . . . . . . 7056 1 22 . 1 1 29 29 GLY N N 15 . 1 1 29 29 GLY H H 1 0.852 0.060 . . . . . . . . . . 7056 1 23 . 1 1 31 31 ALA N N 15 . 1 1 31 31 ALA H H 1 0.678 0.193 . . . . . . . . . . 7056 1 24 . 1 1 32 32 LEU N N 15 . 1 1 32 32 LEU H H 1 0.663 0.083 . . . . . . . . . . 7056 1 25 . 1 1 33 33 SER N N 15 . 1 1 33 33 SER H H 1 0.717 0.061 . . . . . . . . . . 7056 1 26 . 1 1 34 34 ILE N N 15 . 1 1 34 34 ILE H H 1 0.675 0.113 . . . . . . . . . . 7056 1 27 . 1 1 35 35 ASN N N 15 . 1 1 35 35 ASN H H 1 0.660 0.056 . . . . . . . . . . 7056 1 28 . 1 1 36 36 GLU N N 15 . 1 1 36 36 GLU H H 1 0.712 0.068 . . . . . . . . . . 7056 1 29 . 1 1 37 37 LEU N N 15 . 1 1 37 37 LEU H H 1 0.699 0.066 . . . . . . . . . . 7056 1 30 . 1 1 38 38 SER N N 15 . 1 1 38 38 SER H H 1 0.711 0.074 . . . . . . . . . . 7056 1 31 . 1 1 39 39 ASN N N 15 . 1 1 39 39 ASN H H 1 0.620 0.057 . . . . . . . . . . 7056 1 32 . 1 1 40 40 LEU N N 15 . 1 1 40 40 LEU H H 1 0.748 0.051 . . . . . . . . . . 7056 1 33 . 1 1 41 41 ALA N N 15 . 1 1 41 41 ALA H H 1 0.771 0.163 . . . . . . . . . . 7056 1 34 . 1 1 42 42 LYS N N 15 . 1 1 42 42 LYS H H 1 0.621 0.200 . . . . . . . . . . 7056 1 35 . 1 1 43 43 GLY N N 15 . 1 1 43 43 GLY H H 1 0.791 0.097 . . . . . . . . . . 7056 1 36 . 1 1 44 44 GLU N N 15 . 1 1 44 44 GLU H H 1 0.746 0.132 . . . . . . . . . . 7056 1 37 . 1 1 45 45 LYS N N 15 . 1 1 45 45 LYS H H 1 0.767 0.087 . . . . . . . . . . 7056 1 38 . 1 1 46 46 ALA N N 15 . 1 1 46 46 ALA H H 1 0.715 0.209 . . . . . . . . . . 7056 1 39 . 1 1 47 47 ASN N N 15 . 1 1 47 47 ASN H H 1 0.717 0.091 . . . . . . . . . . 7056 1 40 . 1 1 48 48 VAL N N 15 . 1 1 48 48 VAL H H 1 0.729 0.070 . . . . . . . . . . 7056 1 41 . 1 1 49 49 LEU N N 15 . 1 1 49 49 LEU H H 1 0.819 0.067 . . . . . . . . . . 7056 1 42 . 1 1 51 51 GLY N N 15 . 1 1 51 51 GLY H H 1 0.595 0.085 . . . . . . . . . . 7056 1 43 . 1 1 52 52 GLN N N 15 . 1 1 52 52 GLN H H 1 0.535 0.125 . . . . . . . . . . 7056 1 44 . 1 1 53 53 GLY N N 15 . 1 1 53 53 GLY H H 1 0.525 0.063 . . . . . . . . . . 7056 1 45 . 1 1 54 54 ASP N N 15 . 1 1 54 54 ASP H H 1 0.696 0.051 . . . . . . . . . . 7056 1 46 . 1 1 55 55 VAL N N 15 . 1 1 55 55 VAL H H 1 0.584 0.076 . . . . . . . . . . 7056 1 47 . 1 1 56 56 VAL N N 15 . 1 1 56 56 VAL H H 1 0.751 0.133 . . . . . . . . . . 7056 1 48 . 1 1 57 57 LEU N N 15 . 1 1 57 57 LEU H H 1 0.699 0.063 . . . . . . . . . . 7056 1 49 . 1 1 58 58 VAL N N 15 . 1 1 58 58 VAL H H 1 0.685 0.088 . . . . . . . . . . 7056 1 50 . 1 1 59 59 MET N N 15 . 1 1 59 59 MET H H 1 0.772 0.075 . . . . . . . . . . 7056 1 51 . 1 1 60 60 LYS N N 15 . 1 1 60 60 LYS H H 1 0.661 0.150 . . . . . . . . . . 7056 1 52 . 1 1 61 61 ARG N N 15 . 1 1 61 61 ARG H H 1 0.700 0.092 . . . . . . . . . . 7056 1 53 . 1 1 62 62 LYS N N 15 . 1 1 62 62 LYS H H 1 0.737 0.095 . . . . . . . . . . 7056 1 54 . 1 1 67 67 ILE N N 15 . 1 1 67 67 ILE H H 1 0.370 0.042 . . . . . . . . . . 7056 1 55 . 1 1 68 68 LEU N N 15 . 1 1 68 68 LEU H H 1 0.301 0.034 . . . . . . . . . . 7056 1 56 . 1 1 69 69 THR N N 15 . 1 1 69 69 THR H H 1 0.275 0.042 . . . . . . . . . . 7056 1 57 . 1 1 70 70 ASP N N 15 . 1 1 70 70 ASP H H 1 0.307 0.072 . . . . . . . . . . 7056 1 58 . 1 1 71 71 SER N N 15 . 1 1 71 71 SER H H 1 0.279 0.135 . . . . . . . . . . 7056 1 59 . 1 1 72 72 GLN N N 15 . 1 1 72 72 GLN H H 1 0.259 0.119 . . . . . . . . . . 7056 1 60 . 1 1 73 73 THR N N 15 . 1 1 73 73 THR H H 1 0.233 0.061 . . . . . . . . . . 7056 1 61 . 1 1 75 75 THR N N 15 . 1 1 75 75 THR H H 1 0.220 0.056 . . . . . . . . . . 7056 1 62 . 1 1 76 76 LYS N N 15 . 1 1 76 76 LYS H H 1 0.345 0.059 . . . . . . . . . . 7056 1 63 . 1 1 77 77 ARG N N 15 . 1 1 77 77 ARG H H 1 0.446 0.210 . . . . . . . . . . 7056 1 64 . 1 1 78 78 ILE N N 15 . 1 1 78 78 ILE H H 1 0.199 0.086 . . . . . . . . . . 7056 1 65 . 1 1 79 79 ARG N N 15 . 1 1 79 79 ARG H H 1 0.217 0.065 . . . . . . . . . . 7056 1 66 . 1 1 80 80 MET N N 15 . 1 1 80 80 MET H H 1 0.186 0.166 . . . . . . . . . . 7056 1 67 . 1 1 81 81 ALA N N 15 . 1 1 81 81 ALA H H 1 0.006 0.054 . . . . . . . . . . 7056 1 68 . 1 1 82 82 ILE N N 15 . 1 1 82 82 ILE H H 1 -0.411 0.053 . . . . . . . . . . 7056 1 69 . 1 1 83 83 ASN N N 15 . 1 1 83 83 ASN H H 1 -0.604 0.054 . . . . . . . . . . 7056 1 stop_ save_ ######################################## # Heteronuclear T1 relaxation values # ######################################## save_T1_list_1 _Heteronucl_T1_list.Sf_category heteronucl_T1_relaxation _Heteronucl_T1_list.Sf_framecode T1_list_1 _Heteronucl_T1_list.Entry_ID 7056 _Heteronucl_T1_list.ID 1 _Heteronucl_T1_list.Sample_condition_list_ID 1 _Heteronucl_T1_list.Sample_condition_list_label $conditions_1 _Heteronucl_T1_list.Spectrometer_frequency_1H 600 _Heteronucl_T1_list.T1_coherence_type Nz _Heteronucl_T1_list.T1_val_units s-1 _Heteronucl_T1_list.Details . _Heteronucl_T1_list.Text_data_format . _Heteronucl_T1_list.Text_data . loop_ _Heteronucl_T1_experiment.Experiment_ID _Heteronucl_T1_experiment.Experiment_name _Heteronucl_T1_experiment.Sample_ID _Heteronucl_T1_experiment.Sample_label _Heteronucl_T1_experiment.Sample_state _Heteronucl_T1_experiment.Entry_ID _Heteronucl_T1_experiment.Heteronucl_T1_list_ID 16 1H15N_HSQC_t1 1 $sample_1 isotropic 7056 1 stop_ loop_ _T1.ID _T1.Assembly_atom_ID _T1.Entity_assembly_ID _T1.Entity_ID _T1.Comp_index_ID _T1.Seq_ID _T1.Comp_ID _T1.Atom_ID _T1.Atom_type _T1.Atom_isotope_number _T1.Val _T1.Val_err _T1.Resonance_ID _T1.Auth_entity_assembly_ID _T1.Auth_seq_ID _T1.Auth_comp_ID _T1.Auth_atom_ID _T1.Entry_ID _T1.Heteronucl_T1_list_ID 1 . 1 1 4 4 ASP N N 15 0.587 0.038 . . . . . 7056 1 2 . 1 1 5 5 GLU N N 15 0.566 0.015 . . . . . 7056 1 3 . 1 1 6 6 SER N N 15 0.593 0.026 . . . . . 7056 1 4 . 1 1 7 7 THR N N 15 0.639 0.047 . . . . . 7056 1 5 . 1 1 8 8 SER N N 15 0.618 0.042 . . . . . 7056 1 6 . 1 1 9 9 GLY N N 15 0.613 0.054 . . . . . 7056 1 7 . 1 1 10 10 VAL N N 15 0.651 0.013 . . . . . 7056 1 8 . 1 1 12 12 SER N N 15 0.651 0.027 . . . . . 7056 1 9 . 1 1 14 14 VAL N N 15 0.720 0.023 . . . . . 7056 1 10 . 1 1 15 15 LEU N N 15 0.690 0.029 . . . . . 7056 1 11 . 1 1 16 16 ARG N N 15 0.731 0.026 . . . . . 7056 1 12 . 1 1 18 18 PHE N N 15 0.767 0.025 . . . . . 7056 1 13 . 1 1 19 19 LEU N N 15 0.747 0.034 . . . . . 7056 1 14 . 1 1 20 20 ILE N N 15 0.809 0.034 . . . . . 7056 1 15 . 1 1 21 21 LEU N N 15 0.771 0.049 . . . . . 7056 1 16 . 1 1 22 22 GLY N N 15 0.789 0.020 . . . . . 7056 1 17 . 1 1 23 23 LYS N N 15 0.751 0.020 . . . . . 7056 1 18 . 1 1 24 24 GLU N N 15 0.829 0.025 . . . . . 7056 1 19 . 1 1 25 25 ASP N N 15 0.718 0.032 . . . . . 7056 1 20 . 1 1 27 27 ARG N N 15 0.697 0.019 . . . . . 7056 1 21 . 1 1 28 28 TYR N N 15 0.777 0.028 . . . . . 7056 1 22 . 1 1 29 29 GLY N N 15 0.763 0.018 . . . . . 7056 1 23 . 1 1 31 31 ALA N N 15 0.871 0.021 . . . . . 7056 1 24 . 1 1 32 32 LEU N N 15 0.745 0.037 . . . . . 7056 1 25 . 1 1 33 33 SER N N 15 0.729 0.022 . . . . . 7056 1 26 . 1 1 34 34 ILE N N 15 0.775 0.026 . . . . . 7056 1 27 . 1 1 35 35 ASN N N 15 0.742 0.021 . . . . . 7056 1 28 . 1 1 36 36 GLU N N 15 0.770 0.021 . . . . . 7056 1 29 . 1 1 37 37 LEU N N 15 0.733 0.020 . . . . . 7056 1 30 . 1 1 38 38 SER N N 15 0.779 0.032 . . . . . 7056 1 31 . 1 1 39 39 ASN N N 15 0.746 0.025 . . . . . 7056 1 32 . 1 1 40 40 LEU N N 15 0.755 0.017 . . . . . 7056 1 33 . 1 1 41 41 ALA N N 15 0.774 0.029 . . . . . 7056 1 34 . 1 1 43 43 GLY N N 15 0.729 0.040 . . . . . 7056 1 35 . 1 1 44 44 GLU N N 15 0.734 0.022 . . . . . 7056 1 36 . 1 1 45 45 LYS N N 15 0.784 0.029 . . . . . 7056 1 37 . 1 1 47 47 ASN N N 15 0.789 0.036 . . . . . 7056 1 38 . 1 1 48 48 VAL N N 15 0.753 0.029 . . . . . 7056 1 39 . 1 1 49 49 LEU N N 15 0.716 0.028 . . . . . 7056 1 40 . 1 1 51 51 GLY N N 15 0.692 0.027 . . . . . 7056 1 41 . 1 1 52 52 GLN N N 15 0.700 0.052 . . . . . 7056 1 42 . 1 1 53 53 GLY N N 15 0.723 0.032 . . . . . 7056 1 43 . 1 1 54 54 ASP N N 15 0.714 0.013 . . . . . 7056 1 44 . 1 1 55 55 VAL N N 15 0.736 0.019 . . . . . 7056 1 45 . 1 1 56 56 VAL N N 15 0.691 0.031 . . . . . 7056 1 46 . 1 1 57 57 LEU N N 15 0.704 0.030 . . . . . 7056 1 47 . 1 1 58 58 VAL N N 15 0.760 0.040 . . . . . 7056 1 48 . 1 1 59 59 MET N N 15 0.792 0.040 . . . . . 7056 1 49 . 1 1 60 60 LYS N N 15 0.713 0.036 . . . . . 7056 1 50 . 1 1 61 61 ARG N N 15 0.713 0.038 . . . . . 7056 1 51 . 1 1 62 62 LYS N N 15 0.708 0.053 . . . . . 7056 1 52 . 1 1 64 64 ASP N N 15 0.670 0.059 . . . . . 7056 1 53 . 1 1 67 67 ILE N N 15 0.591 0.011 . . . . . 7056 1 54 . 1 1 68 68 LEU N N 15 0.560 0.009 . . . . . 7056 1 55 . 1 1 69 69 THR N N 15 0.592 0.014 . . . . . 7056 1 56 . 1 1 70 70 ASP N N 15 0.592 0.025 . . . . . 7056 1 57 . 1 1 71 71 SER N N 15 0.653 0.070 . . . . . 7056 1 58 . 1 1 72 72 GLN N N 15 0.555 0.045 . . . . . 7056 1 59 . 1 1 73 73 THR N N 15 0.576 0.025 . . . . . 7056 1 60 . 1 1 75 75 THR N N 15 0.594 0.019 . . . . . 7056 1 61 . 1 1 76 76 LYS N N 15 0.573 0.021 . . . . . 7056 1 62 . 1 1 77 77 ARG N N 15 0.562 0.023 . . . . . 7056 1 63 . 1 1 78 78 ILE N N 15 0.546 0.010 . . . . . 7056 1 64 . 1 1 79 79 ARG N N 15 0.554 0.017 . . . . . 7056 1 65 . 1 1 80 80 MET N N 15 0.587 0.028 . . . . . 7056 1 66 . 1 1 81 81 ALA N N 15 0.645 0.015 . . . . . 7056 1 67 . 1 1 82 82 ILE N N 15 0.700 0.009 . . . . . 7056 1 68 . 1 1 83 83 ASN N N 15 0.770 0.006 . . . . . 7056 1 stop_ save_ ########################################### # Heteronuclear T1rho relaxation values # ########################################### save_T1rho_list_1 _Heteronucl_T1rho_list.Sf_category heteronucl_T1rho_relaxation _Heteronucl_T1rho_list.Sf_framecode T1rho_list_1 _Heteronucl_T1rho_list.Entry_ID 7056 _Heteronucl_T1rho_list.ID 1 _Heteronucl_T1rho_list.Sample_condition_list_ID 1 _Heteronucl_T1rho_list.Sample_condition_list_label $conditions_1 _Heteronucl_T1rho_list.Spectrometer_frequency_1H 600 _Heteronucl_T1rho_list.Temp_calibration_method . _Heteronucl_T1rho_list.Temp_control_method . _Heteronucl_T1rho_list.T1rho_coherence_type Nx _Heteronucl_T1rho_list.T1rho_val_units s-1 _Heteronucl_T1rho_list.Rex_units s-1 _Heteronucl_T1rho_list.Details . _Heteronucl_T1rho_list.Text_data_format . _Heteronucl_T1rho_list.Text_data . loop_ _Heteronucl_T1rho_experiment.Experiment_ID _Heteronucl_T1rho_experiment.Experiment_name _Heteronucl_T1rho_experiment.Sample_ID _Heteronucl_T1rho_experiment.Sample_label _Heteronucl_T1rho_experiment.Sample_state _Heteronucl_T1rho_experiment.Entry_ID _Heteronucl_T1rho_experiment.Heteronucl_T1rho_list_ID 17 1H15N_HSQC_t1rho 1 $sample_1 isotropic 7056 1 stop_ loop_ _T1rho.ID _T1rho.Assembly_atom_ID _T1rho.Entity_assembly_ID _T1rho.Entity_ID _T1rho.Comp_index_ID _T1rho.Seq_ID _T1rho.Comp_ID _T1rho.Atom_ID _T1rho.Atom_type _T1rho.Atom_isotope_number _T1rho.T1rho_val _T1rho.T1rho_val_err _T1rho.Rex_val _T1rho.Rex_val_err _T1rho.Resonance_ID _T1rho.Auth_entity_assembly_ID _T1rho.Auth_seq_ID _T1rho.Auth_comp_ID _T1rho.Auth_atom_ID _T1rho.Entry_ID _T1rho.Heteronucl_T1rho_list_ID 1 . 1 1 4 4 ASP N N 15 0.057 0.004 . . . . . . . 7056 1 2 . 1 1 5 5 GLU N N 15 0.179 0.007 . . . . . . . 7056 1 3 . 1 1 6 6 SER N N 15 0.173 0.011 . . . . . . . 7056 1 4 . 1 1 7 7 THR N N 15 0.167 0.018 . . . . . . . 7056 1 5 . 1 1 8 8 SER N N 15 0.159 0.015 . . . . . . . 7056 1 6 . 1 1 9 9 GLY N N 15 0.151 0.020 . . . . . . . 7056 1 7 . 1 1 10 10 VAL N N 15 0.107 0.003 . . . . . . . 7056 1 8 . 1 1 12 12 SER N N 15 0.084 0.004 . . . . . . . 7056 1 9 . 1 1 14 14 VAL N N 15 0.081 0.003 . . . . . . . 7056 1 10 . 1 1 15 15 LEU N N 15 0.064 0.003 . . . . . . . 7056 1 11 . 1 1 16 16 ARG N N 15 0.066 0.003 . . . . . . . 7056 1 12 . 1 1 18 18 PHE N N 15 0.071 0.003 . . . . . . . 7056 1 13 . 1 1 19 19 LEU N N 15 0.080 0.005 . . . . . . . 7056 1 14 . 1 1 20 20 ILE N N 15 0.078 0.004 . . . . . . . 7056 1 15 . 1 1 21 21 LEU N N 15 0.079 0.006 . . . . . . . 7056 1 16 . 1 1 22 22 GLY N N 15 0.083 0.003 . . . . . . . 7056 1 17 . 1 1 23 23 LYS N N 15 0.085 0.003 . . . . . . . 7056 1 18 . 1 1 24 24 GLU N N 15 0.083 0.003 . . . . . . . 7056 1 19 . 1 1 25 25 ASP N N 15 0.081 0.004 . . . . . . . 7056 1 20 . 1 1 27 27 ARG N N 15 0.078 0.003 . . . . . . . 7056 1 21 . 1 1 28 28 TYR N N 15 0.079 0.004 . . . . . . . 7056 1 22 . 1 1 29 29 GLY N N 15 0.080 0.003 . . . . . . . 7056 1 23 . 1 1 31 31 ALA N N 15 0.079 0.002 . . . . . . . 7056 1 24 . 1 1 32 32 LEU N N 15 0.081 0.005 . . . . . . . 7056 1 25 . 1 1 33 33 SER N N 15 0.086 0.003 . . . . . . . 7056 1 26 . 1 1 34 34 ILE N N 15 0.075 0.003 . . . . . . . 7056 1 27 . 1 1 35 35 ASN N N 15 0.075 0.003 . . . . . . . 7056 1 28 . 1 1 36 36 GLU N N 15 0.085 0.003 . . . . . . . 7056 1 29 . 1 1 37 37 LEU N N 15 0.080 0.003 . . . . . . . 7056 1 30 . 1 1 38 38 SER N N 15 0.076 0.004 . . . . . . . 7056 1 31 . 1 1 39 39 ASN N N 15 0.078 0.003 . . . . . . . 7056 1 32 . 1 1 40 40 LEU N N 15 0.081 0.002 . . . . . . . 7056 1 33 . 1 1 41 41 ALA N N 15 0.076 0.003 . . . . . . . 7056 1 34 . 1 1 42 42 LYS N N 15 0.076 0.003 . . . . . . . 7056 1 35 . 1 1 43 43 GLY N N 15 0.078 0.005 . . . . . . . 7056 1 36 . 1 1 44 44 GLU N N 15 0.075 0.003 . . . . . . . 7056 1 37 . 1 1 45 45 LYS N N 15 0.084 0.004 . . . . . . . 7056 1 38 . 1 1 46 46 ALA N N 15 0.084 0.004 . . . . . . . 7056 1 39 . 1 1 47 47 ASN N N 15 0.081 0.005 . . . . . . . 7056 1 40 . 1 1 48 48 VAL N N 15 0.084 0.004 . . . . . . . 7056 1 41 . 1 1 49 49 LEU N N 15 0.083 0.004 . . . . . . . 7056 1 42 . 1 1 51 51 GLY N N 15 0.094 0.005 . . . . . . . 7056 1 43 . 1 1 52 52 GLN N N 15 0.110 0.011 . . . . . . . 7056 1 44 . 1 1 53 53 GLY N N 15 0.107 0.006 . . . . . . . 7056 1 45 . 1 1 54 54 ASP N N 15 0.094 0.002 . . . . . . . 7056 1 46 . 1 1 55 55 VAL N N 15 0.104 0.004 . . . . . . . 7056 1 47 . 1 1 56 56 VAL N N 15 0.075 0.004 . . . . . . . 7056 1 48 . 1 1 57 57 LEU N N 15 0.089 0.005 . . . . . . . 7056 1 49 . 1 1 58 58 VAL N N 15 0.073 0.005 . . . . . . . 7056 1 50 . 1 1 59 59 MET N N 15 0.074 0.005 . . . . . . . 7056 1 51 . 1 1 60 60 LYS N N 15 0.078 0.005 . . . . . . . 7056 1 52 . 1 1 61 61 ARG N N 15 0.077 0.005 . . . . . . . 7056 1 53 . 1 1 62 62 LYS N N 15 0.090 0.008 . . . . . . . 7056 1 54 . 1 1 64 64 ASP N N 15 0.343 0.072 . . . . . . . 7056 1 55 . 1 1 67 67 ILE N N 15 0.154 0.004 . . . . . . . 7056 1 56 . 1 1 68 68 LEU N N 15 0.163 0.004 . . . . . . . 7056 1 57 . 1 1 69 69 THR N N 15 0.178 0.006 . . . . . . . 7056 1 58 . 1 1 70 70 ASP N N 15 0.173 0.010 . . . . . . . 7056 1 59 . 1 1 71 71 SER N N 15 0.180 0.028 . . . . . . . 7056 1 60 . 1 1 72 72 GLN N N 15 0.189 0.031 . . . . . . . 7056 1 61 . 1 1 73 73 THR N N 15 0.183 0.012 . . . . . . . 7056 1 62 . 1 1 75 75 THR N N 15 0.199 0.010 . . . . . . . 7056 1 63 . 1 1 76 76 LYS N N 15 0.196 0.011 . . . . . . . 7056 1 64 . 1 1 77 77 ARG N N 15 0.184 0.011 . . . . . . . 7056 1 65 . 1 1 78 78 ILE N N 15 0.202 0.006 . . . . . . . 7056 1 66 . 1 1 79 79 ARG N N 15 0.176 0.008 . . . . . . . 7056 1 67 . 1 1 80 80 MET N N 15 0.208 0.016 . . . . . . . 7056 1 68 . 1 1 81 81 ALA N N 15 0.258 0.011 . . . . . . . 7056 1 69 . 1 1 82 82 ILE N N 15 0.307 0.008 . . . . . . . 7056 1 70 . 1 1 83 83 ASN N N 15 0.365 0.007 . . . . . . . 7056 1 stop_ save_ ######################################## # Heteronuclear T2 relaxation values # ######################################## save_T2_list_1 _Heteronucl_T2_list.Sf_category heteronucl_T2_relaxation _Heteronucl_T2_list.Sf_framecode T2_list_1 _Heteronucl_T2_list.Entry_ID 7056 _Heteronucl_T2_list.ID 1 _Heteronucl_T2_list.Sample_condition_list_ID 1 _Heteronucl_T2_list.Sample_condition_list_label $conditions_1 _Heteronucl_T2_list.Temp_calibration_method . _Heteronucl_T2_list.Temp_control_method . _Heteronucl_T2_list.Spectrometer_frequency_1H 600 _Heteronucl_T2_list.T2_coherence_type Nx _Heteronucl_T2_list.T2_val_units s-1 _Heteronucl_T2_list.Rex_units s-1 _Heteronucl_T2_list.Details . _Heteronucl_T2_list.Text_data_format . _Heteronucl_T2_list.Text_data . loop_ _Heteronucl_T2_experiment.Experiment_ID _Heteronucl_T2_experiment.Experiment_name _Heteronucl_T2_experiment.Sample_ID _Heteronucl_T2_experiment.Sample_label _Heteronucl_T2_experiment.Sample_state _Heteronucl_T2_experiment.Entry_ID _Heteronucl_T2_experiment.Heteronucl_T2_list_ID 18 1H15N_HSQC_t2 1 $sample_1 isotropic 7056 1 stop_ loop_ _T2.ID _T2.Assembly_atom_ID _T2.Entity_assembly_ID _T2.Entity_ID _T2.Comp_index_ID _T2.Seq_ID _T2.Comp_ID _T2.Atom_ID _T2.Atom_type _T2.Atom_isotope_number _T2.T2_val _T2.T2_val_err _T2.Rex_val _T2.Rex_err _T2.Resonance_ID _T2.Auth_entity_assembly_ID _T2.Auth_seq_ID _T2.Auth_comp_ID _T2.Auth_atom_ID _T2.Entry_ID _T2.Heteronucl_T2_list_ID 1 . 1 1 4 4 ASP N N 15 0.057 0.004 . . . . . . . 7056 1 2 . 1 1 5 5 GLU N N 15 0.180 0.003 . . . . . . . 7056 1 3 . 1 1 6 6 SER N N 15 0.177 0.005 . . . . . . . 7056 1 4 . 1 1 7 7 THR N N 15 0.163 0.010 . . . . . . . 7056 1 5 . 1 1 8 8 SER N N 15 0.148 0.007 . . . . . . . 7056 1 6 . 1 1 9 9 GLY N N 15 0.141 0.011 . . . . . . . 7056 1 7 . 1 1 10 10 VAL N N 15 0.105 0.001 . . . . . . . 7056 1 8 . 1 1 12 12 SER N N 15 0.085 0.003 . . . . . . . 7056 1 9 . 1 1 14 14 VAL N N 15 0.078 0.002 . . . . . . . 7056 1 10 . 1 1 15 15 LEU N N 15 0.068 0.003 . . . . . . . 7056 1 11 . 1 1 16 16 ARG N N 15 0.066 0.002 . . . . . . . 7056 1 12 . 1 1 18 18 PHE N N 15 0.069 0.002 . . . . . . . 7056 1 13 . 1 1 19 19 LEU N N 15 0.077 0.003 . . . . . . . 7056 1 14 . 1 1 20 20 ILE N N 15 0.081 0.004 . . . . . . . 7056 1 15 . 1 1 21 21 LEU N N 15 0.080 0.006 . . . . . . . 7056 1 16 . 1 1 22 22 GLY N N 15 0.085 0.002 . . . . . . . 7056 1 17 . 1 1 23 23 LYS N N 15 0.085 0.002 . . . . . . . 7056 1 18 . 1 1 24 24 GLU N N 15 0.080 0.002 . . . . . . . 7056 1 19 . 1 1 25 25 ASP N N 15 0.083 0.003 . . . . . . . 7056 1 20 . 1 1 27 27 ARG N N 15 0.078 0.002 . . . . . . . 7056 1 21 . 1 1 28 28 TYR N N 15 0.079 0.002 . . . . . . . 7056 1 22 . 1 1 29 29 GLY N N 15 0.078 0.002 . . . . . . . 7056 1 23 . 1 1 31 31 ALA N N 15 0.079 0.002 . . . . . . . 7056 1 24 . 1 1 32 32 LEU N N 15 0.080 0.005 . . . . . . . 7056 1 25 . 1 1 33 33 SER N N 15 0.086 0.002 . . . . . . . 7056 1 26 . 1 1 34 34 ILE N N 15 0.074 0.002 . . . . . . . 7056 1 27 . 1 1 35 35 ASN N N 15 0.072 0.002 . . . . . . . 7056 1 28 . 1 1 36 36 GLU N N 15 0.082 0.002 . . . . . . . 7056 1 29 . 1 1 37 37 LEU N N 15 0.079 0.002 . . . . . . . 7056 1 30 . 1 1 38 38 SER N N 15 0.077 0.003 . . . . . . . 7056 1 31 . 1 1 39 39 ASN N N 15 0.076 0.002 . . . . . . . 7056 1 32 . 1 1 40 40 LEU N N 15 0.081 0.002 . . . . . . . 7056 1 33 . 1 1 41 41 ALA N N 15 0.078 0.003 . . . . . . . 7056 1 34 . 1 1 43 43 GLY N N 15 0.080 0.004 . . . . . . . 7056 1 35 . 1 1 44 44 GLU N N 15 0.073 0.002 . . . . . . . 7056 1 36 . 1 1 45 45 LYS N N 15 0.087 0.003 . . . . . . . 7056 1 37 . 1 1 47 47 ASN N N 15 0.076 0.003 . . . . . . . 7056 1 38 . 1 1 48 48 VAL N N 15 0.080 0.003 . . . . . . . 7056 1 39 . 1 1 49 49 LEU N N 15 0.084 0.004 . . . . . . . 7056 1 40 . 1 1 51 51 GLY N N 15 0.094 0.003 . . . . . . . 7056 1 41 . 1 1 52 52 GLN N N 15 0.102 0.007 . . . . . . . 7056 1 42 . 1 1 53 53 GLY N N 15 0.104 0.004 . . . . . . . 7056 1 43 . 1 1 54 54 ASP N N 15 0.094 0.001 . . . . . . . 7056 1 44 . 1 1 55 55 VAL N N 15 0.121 0.003 . . . . . . . 7056 1 45 . 1 1 56 56 VAL N N 15 0.075 0.003 . . . . . . . 7056 1 46 . 1 1 57 57 LEU N N 15 0.102 0.005 . . . . . . . 7056 1 47 . 1 1 58 58 VAL N N 15 0.071 0.004 . . . . . . . 7056 1 48 . 1 1 59 59 MET N N 15 0.075 0.004 . . . . . . . 7056 1 49 . 1 1 60 60 LYS N N 15 0.073 0.005 . . . . . . . 7056 1 50 . 1 1 61 61 ARG N N 15 0.075 0.005 . . . . . . . 7056 1 51 . 1 1 62 62 LYS N N 15 0.087 0.006 . . . . . . . 7056 1 52 . 1 1 64 64 ASP N N 15 0.400 0.039 . . . . . . . 7056 1 53 . 1 1 67 67 ILE N N 15 0.159 0.002 . . . . . . . 7056 1 54 . 1 1 68 68 LEU N N 15 0.173 0.002 . . . . . . . 7056 1 55 . 1 1 69 69 THR N N 15 0.182 0.003 . . . . . . . 7056 1 56 . 1 1 70 70 ASP N N 15 0.183 0.006 . . . . . . . 7056 1 57 . 1 1 71 71 SER N N 15 0.170 0.016 . . . . . . . 7056 1 58 . 1 1 72 72 GLN N N 15 0.170 0.014 . . . . . . . 7056 1 59 . 1 1 73 73 THR N N 15 0.188 0.007 . . . . . . . 7056 1 60 . 1 1 74 74 ALA N N 15 0.164 0.006 . . . . . . . 7056 1 61 . 1 1 75 75 THR N N 15 0.209 0.006 . . . . . . . 7056 1 62 . 1 1 76 76 LYS N N 15 0.196 0.007 . . . . . . . 7056 1 63 . 1 1 77 77 ARG N N 15 0.187 0.007 . . . . . . . 7056 1 64 . 1 1 78 78 ILE N N 15 0.210 0.003 . . . . . . . 7056 1 65 . 1 1 79 79 ARG N N 15 0.186 0.005 . . . . . . . 7056 1 66 . 1 1 80 80 MET N N 15 0.206 0.008 . . . . . . . 7056 1 67 . 1 1 81 81 ALA N N 15 0.268 0.006 . . . . . . . 7056 1 68 . 1 1 82 82 ILE N N 15 0.335 0.004 . . . . . . . 7056 1 69 . 1 1 83 83 ASN N N 15 0.383 0.003 . . . . . . . 7056 1 stop_ save_