data_16191 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 16191 _Entry.Title ; NMR-Assignments of a Cytosolic Domain of the C-Terminus of Polycystin-2 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2009-03-02 _Entry.Accession_date 2009-03-02 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _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 'Hans Robert' Kalbitzer . . . 16191 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 16191 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 348 16191 '15N chemical shifts' 100 16191 '1H chemical shifts' 569 16191 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 5 . . 2010-04-15 2009-03-02 update BMRB 'add related PDB ID' 16191 4 . . 2009-08-20 2009-03-02 update BMRB 'added PubMed ID' 16191 3 . . 2009-07-17 2009-03-02 update author 'update chemical shifts' 16191 2 . . 2009-06-05 2009-03-02 update BMRB 'completed entry citation' 16191 1 . . 2009-04-16 2009-03-02 original author 'original release' 16191 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2KLE 'BMRB Entry Tracking System' 16191 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 16191 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19636966 _Citation.Full_citation . _Citation.Title 'NMR-assignments of a cytosolic domain of the C-terminus of polycystin-2' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR Assignments' _Citation.Journal_volume 3 _Citation.Journal_issue 1 _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 141 _Citation.Page_last 144 _Citation.Year 2009 _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 Frank Schumann . H. . 16191 1 2 Helen Hoffmeister . . . 16191 1 3 Maren Schmidt . . . 16191 1 4 Reto Bader . . . 16191 1 5 Elisabeth Besl . . . 16191 1 6 Ralph Witzgall . . . 16191 1 7 'Hans Robert' Kalbitzer . . . 16191 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 16191 _Assembly.ID 1 _Assembly.Name Monomer _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Polycystin-2 Polypeptide' 1 $Polycystin-2_Polypeptide A . yes native no no . . . 16191 1 2 Calcium 2 $CA B . no native no no . . . 16191 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Polycystin-2_Polypeptide _Entity.Sf_category entity _Entity.Sf_framecode Polycystin-2_Polypeptide _Entity.Entry_ID 16191 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Polycystin-2_Polypeptide _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 ; GSTAIGINDTYSEVKSDLAQ QKAEMELSDLIRKGYHKALV KLKLKKNTVDDISESLRQGG GKLNFDELRQDLKGKGHTDA EIEAIFTKYDQDGDQELTEH EHQQMRDDLEKEREDLDLDH SSL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 123 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment PKD2680-796 _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no BMRB 16590 . "EF-hand domain of polycystin-2" . . . . . 62.60 78 100.00 100.00 4.12e-45 . . . . 16191 1 2 no BMRB 17621 . POLYCYSTIN-2 . . . . . 61.79 79 100.00 100.00 7.52e-44 . . . . 16191 1 3 no BMRB 18268 . EF-hand_domain_of_polycystin-2 . . . . . 62.60 78 100.00 100.00 4.12e-45 . . . . 16191 1 4 no PDB 2KLD . "Solution Structure Of The Calcium Binding Domain Of The C- Terminal Cytosolic Domain Of Polycystin-2" . . . . . 100.00 123 100.00 100.00 1.04e-79 . . . . 16191 1 5 no PDB 2KLE . "Isic Refined Solution Structure Of The Calcium Binding Domain Of The C-Terminal Cytosolic Domain Of Polycystin-2" . . . . . 100.00 123 100.00 100.00 1.04e-79 . . . . 16191 1 6 no PDB 2KQ6 . "The Structure Of The Ef-Hand Domain Of Polycystin-2 Suggests Mechanism For Ca2+-Dependent Regulation Of Polycystin-2 Cha Activi" . . . . . 62.60 78 100.00 100.00 4.12e-45 . . . . 16191 1 7 no PDB 2Y4Q . "Solution Structure Of The Ef-hand Domain Of Human Polycystin 2" . . . . . 61.79 79 100.00 100.00 7.52e-44 . . . . 16191 1 8 no DBJ BAG56956 . "unnamed protein product [Homo sapiens]" . . . . . 95.12 294 100.00 100.00 6.46e-74 . . . . 16191 1 9 no DBJ BAG57494 . "unnamed protein product [Homo sapiens]" . . . . . 95.12 386 100.00 100.00 6.08e-73 . . . . 16191 1 10 no EMBL CAI38797 . "polycystic kidney disease 2 membrane protein [Bos taurus]" . . . . . 95.12 970 99.15 100.00 3.29e-69 . . . . 16191 1 11 no GB AAC16004 . "autosomal dominant polycystic kidney disease type II protein [Homo sapiens]" . . . . . 95.12 968 100.00 100.00 3.83e-70 . . . . 16191 1 12 no GB AAC50520 . "autosomal dominant polycystic kidney disease type II [Homo sapiens]" . . . . . 95.12 968 100.00 100.00 3.83e-70 . . . . 16191 1 13 no GB AAC50933 . "polycystwin, partial [Homo sapiens]" . . . . . 95.12 608 100.00 100.00 5.94e-72 . . . . 16191 1 14 no GB AAI11455 . "PKD2 protein, partial [synthetic construct]" . . . . . 95.12 968 100.00 100.00 3.83e-70 . . . . 16191 1 15 no GB AAI12262 . "Polycystin 2 [Homo sapiens]" . . . . . 95.12 968 100.00 100.00 2.79e-70 . . . . 16191 1 16 no REF NP_000288 . "polycystin-2 [Homo sapiens]" . . . . . 95.12 968 100.00 100.00 3.83e-70 . . . . 16191 1 17 no REF NP_001039777 . "polycystin-2 [Bos taurus]" . . . . . 95.12 970 99.15 100.00 3.29e-69 . . . . 16191 1 18 no REF NP_001232908 . "polycystin-2 [Sus scrofa]" . . . . . 95.12 970 98.29 99.15 2.15e-67 . . . . 16191 1 19 no REF XP_001099242 . "PREDICTED: polycystin-2 [Macaca mulatta]" . . . . . 95.12 969 100.00 100.00 1.68e-69 . . . . 16191 1 20 no REF XP_002717056 . "PREDICTED: polycystin-2 [Oryctolagus cuniculus]" . . . . . 95.12 970 100.00 100.00 2.52e-69 . . . . 16191 1 21 no SP Q13563 . "RecName: Full=Polycystin-2; AltName: Full=Autosomal dominant polycystic kidney disease type II protein; AltName: Full=Polycysti" . . . . . 95.12 968 100.00 100.00 3.83e-70 . . . . 16191 1 22 no SP Q4GZT3 . "RecName: Full=Polycystin-2; AltName: Full=Polycystic kidney disease 2 protein homolog; AltName: Full=Transient receptor potenti" . . . . . 95.12 970 99.15 100.00 3.29e-69 . . . . 16191 1 23 no TPG DAA28806 . "TPA: polycystin-2 [Bos taurus]" . . . . . 95.12 970 99.15 100.00 3.29e-69 . . . . 16191 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 1 674 GLY . 16191 1 2 675 SER . 16191 1 3 676 THR . 16191 1 4 677 ALA . 16191 1 5 678 ILE . 16191 1 6 679 GLY . 16191 1 7 680 ILE . 16191 1 8 681 ASN . 16191 1 9 682 ASP . 16191 1 10 683 THR . 16191 1 11 684 TYR . 16191 1 12 685 SER . 16191 1 13 686 GLU . 16191 1 14 687 VAL . 16191 1 15 688 LYS . 16191 1 16 689 SER . 16191 1 17 690 ASP . 16191 1 18 691 LEU . 16191 1 19 692 ALA . 16191 1 20 693 GLN . 16191 1 21 694 GLN . 16191 1 22 695 LYS . 16191 1 23 696 ALA . 16191 1 24 697 GLU . 16191 1 25 698 MET . 16191 1 26 699 GLU . 16191 1 27 700 LEU . 16191 1 28 701 SER . 16191 1 29 702 ASP . 16191 1 30 703 LEU . 16191 1 31 704 ILE . 16191 1 32 705 ARG . 16191 1 33 706 LYS . 16191 1 34 707 GLY . 16191 1 35 708 TYR . 16191 1 36 709 HIS . 16191 1 37 710 LYS . 16191 1 38 711 ALA . 16191 1 39 712 LEU . 16191 1 40 713 VAL . 16191 1 41 714 LYS . 16191 1 42 715 LEU . 16191 1 43 716 LYS . 16191 1 44 717 LEU . 16191 1 45 718 LYS . 16191 1 46 719 LYS . 16191 1 47 720 ASN . 16191 1 48 721 THR . 16191 1 49 722 VAL . 16191 1 50 723 ASP . 16191 1 51 724 ASP . 16191 1 52 725 ILE . 16191 1 53 726 SER . 16191 1 54 727 GLU . 16191 1 55 728 SER . 16191 1 56 729 LEU . 16191 1 57 730 ARG . 16191 1 58 731 GLN . 16191 1 59 732 GLY . 16191 1 60 733 GLY . 16191 1 61 734 GLY . 16191 1 62 735 LYS . 16191 1 63 736 LEU . 16191 1 64 737 ASN . 16191 1 65 738 PHE . 16191 1 66 739 ASP . 16191 1 67 740 GLU . 16191 1 68 741 LEU . 16191 1 69 742 ARG . 16191 1 70 743 GLN . 16191 1 71 744 ASP . 16191 1 72 745 LEU . 16191 1 73 746 LYS . 16191 1 74 747 GLY . 16191 1 75 748 LYS . 16191 1 76 749 GLY . 16191 1 77 750 HIS . 16191 1 78 751 THR . 16191 1 79 752 ASP . 16191 1 80 753 ALA . 16191 1 81 754 GLU . 16191 1 82 755 ILE . 16191 1 83 756 GLU . 16191 1 84 757 ALA . 16191 1 85 758 ILE . 16191 1 86 759 PHE . 16191 1 87 760 THR . 16191 1 88 761 LYS . 16191 1 89 762 TYR . 16191 1 90 763 ASP . 16191 1 91 764 GLN . 16191 1 92 765 ASP . 16191 1 93 766 GLY . 16191 1 94 767 ASP . 16191 1 95 768 GLN . 16191 1 96 769 GLU . 16191 1 97 770 LEU . 16191 1 98 771 THR . 16191 1 99 772 GLU . 16191 1 100 773 HIS . 16191 1 101 774 GLU . 16191 1 102 775 HIS . 16191 1 103 776 GLN . 16191 1 104 777 GLN . 16191 1 105 778 MET . 16191 1 106 779 ARG . 16191 1 107 780 ASP . 16191 1 108 781 ASP . 16191 1 109 782 LEU . 16191 1 110 783 GLU . 16191 1 111 784 LYS . 16191 1 112 785 GLU . 16191 1 113 786 ARG . 16191 1 114 787 GLU . 16191 1 115 788 ASP . 16191 1 116 789 LEU . 16191 1 117 790 ASP . 16191 1 118 791 LEU . 16191 1 119 792 ASP . 16191 1 120 793 HIS . 16191 1 121 794 SER . 16191 1 122 795 SER . 16191 1 123 796 LEU . 16191 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 16191 1 . SER 2 2 16191 1 . THR 3 3 16191 1 . ALA 4 4 16191 1 . ILE 5 5 16191 1 . GLY 6 6 16191 1 . ILE 7 7 16191 1 . ASN 8 8 16191 1 . ASP 9 9 16191 1 . THR 10 10 16191 1 . TYR 11 11 16191 1 . SER 12 12 16191 1 . GLU 13 13 16191 1 . VAL 14 14 16191 1 . LYS 15 15 16191 1 . SER 16 16 16191 1 . ASP 17 17 16191 1 . LEU 18 18 16191 1 . ALA 19 19 16191 1 . GLN 20 20 16191 1 . GLN 21 21 16191 1 . LYS 22 22 16191 1 . ALA 23 23 16191 1 . GLU 24 24 16191 1 . MET 25 25 16191 1 . GLU 26 26 16191 1 . LEU 27 27 16191 1 . SER 28 28 16191 1 . ASP 29 29 16191 1 . LEU 30 30 16191 1 . ILE 31 31 16191 1 . ARG 32 32 16191 1 . LYS 33 33 16191 1 . GLY 34 34 16191 1 . TYR 35 35 16191 1 . HIS 36 36 16191 1 . LYS 37 37 16191 1 . ALA 38 38 16191 1 . LEU 39 39 16191 1 . VAL 40 40 16191 1 . LYS 41 41 16191 1 . LEU 42 42 16191 1 . LYS 43 43 16191 1 . LEU 44 44 16191 1 . LYS 45 45 16191 1 . LYS 46 46 16191 1 . ASN 47 47 16191 1 . THR 48 48 16191 1 . VAL 49 49 16191 1 . ASP 50 50 16191 1 . ASP 51 51 16191 1 . ILE 52 52 16191 1 . SER 53 53 16191 1 . GLU 54 54 16191 1 . SER 55 55 16191 1 . LEU 56 56 16191 1 . ARG 57 57 16191 1 . GLN 58 58 16191 1 . GLY 59 59 16191 1 . GLY 60 60 16191 1 . GLY 61 61 16191 1 . LYS 62 62 16191 1 . LEU 63 63 16191 1 . ASN 64 64 16191 1 . PHE 65 65 16191 1 . ASP 66 66 16191 1 . GLU 67 67 16191 1 . LEU 68 68 16191 1 . ARG 69 69 16191 1 . GLN 70 70 16191 1 . ASP 71 71 16191 1 . LEU 72 72 16191 1 . LYS 73 73 16191 1 . GLY 74 74 16191 1 . LYS 75 75 16191 1 . GLY 76 76 16191 1 . HIS 77 77 16191 1 . THR 78 78 16191 1 . ASP 79 79 16191 1 . ALA 80 80 16191 1 . GLU 81 81 16191 1 . ILE 82 82 16191 1 . GLU 83 83 16191 1 . ALA 84 84 16191 1 . ILE 85 85 16191 1 . PHE 86 86 16191 1 . THR 87 87 16191 1 . LYS 88 88 16191 1 . TYR 89 89 16191 1 . ASP 90 90 16191 1 . GLN 91 91 16191 1 . ASP 92 92 16191 1 . GLY 93 93 16191 1 . ASP 94 94 16191 1 . GLN 95 95 16191 1 . GLU 96 96 16191 1 . LEU 97 97 16191 1 . THR 98 98 16191 1 . GLU 99 99 16191 1 . HIS 100 100 16191 1 . GLU 101 101 16191 1 . HIS 102 102 16191 1 . GLN 103 103 16191 1 . GLN 104 104 16191 1 . MET 105 105 16191 1 . ARG 106 106 16191 1 . ASP 107 107 16191 1 . ASP 108 108 16191 1 . LEU 109 109 16191 1 . GLU 110 110 16191 1 . LYS 111 111 16191 1 . GLU 112 112 16191 1 . ARG 113 113 16191 1 . GLU 114 114 16191 1 . ASP 115 115 16191 1 . LEU 116 116 16191 1 . ASP 117 117 16191 1 . LEU 118 118 16191 1 . ASP 119 119 16191 1 . HIS 120 120 16191 1 . SER 121 121 16191 1 . SER 122 122 16191 1 . LEU 123 123 16191 1 stop_ save_ save_CA _Entity.Sf_category entity _Entity.Sf_framecode CA _Entity.Entry_ID 16191 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name CA _Entity.Type non-polymer _Entity.Polymer_common_type . _Entity.Polymer_type . _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code . _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer . _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID CA _Entity.Nonpolymer_comp_label $chem_comp_CA _Entity.Number_of_monomers . _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state . _Entity.Src_method . _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . CA . 16191 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 16191 _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 $Polycystin-2_Polypeptide . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . . . . . . . . . 16191 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 16191 _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 $Polycystin-2_Polypeptide . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli . . . . . . . . . . . . . . . . pET41a . . . . . . 16191 1 stop_ save_ ################################# # Polymer residues and ligands # ################################# save_chem_comp_CA _Chem_comp.Sf_category chem_comp _Chem_comp.Sf_framecode chem_comp_CA _Chem_comp.Entry_ID 16191 _Chem_comp.ID CA _Chem_comp.Provenance . _Chem_comp.Name 'CALCIUM ION' _Chem_comp.Type non-polymer _Chem_comp.BMRB_code . _Chem_comp.PDB_code CA _Chem_comp.Ambiguous_flag no _Chem_comp.Initial_date 1999-07-08 _Chem_comp.Modified_date 2008-10-15 _Chem_comp.Release_status REL _Chem_comp.Replaced_by . _Chem_comp.Replaces . _Chem_comp.One_letter_code . _Chem_comp.Three_letter_code CA _Chem_comp.Number_atoms_all . _Chem_comp.Number_atoms_nh . _Chem_comp.PubChem_code . _Chem_comp.Subcomponent_list . _Chem_comp.InChI_code . _Chem_comp.Mon_nstd_flag . _Chem_comp.Mon_nstd_class . _Chem_comp.Mon_nstd_details . _Chem_comp.Mon_nstd_parent . _Chem_comp.Mon_nstd_parent_comp_ID . _Chem_comp.Std_deriv_one_letter_code . _Chem_comp.Std_deriv_three_letter_code . _Chem_comp.Std_deriv_BMRB_code . _Chem_comp.Std_deriv_PDB_code . _Chem_comp.Std_deriv_chem_comp_name . _Chem_comp.Synonyms . _Chem_comp.Formal_charge 2 _Chem_comp.Paramagnetic . _Chem_comp.Aromatic no _Chem_comp.Formula Ca _Chem_comp.Formula_weight 40.078 _Chem_comp.Formula_mono_iso_wt_nat . _Chem_comp.Formula_mono_iso_wt_13C . _Chem_comp.Formula_mono_iso_wt_15N . _Chem_comp.Formula_mono_iso_wt_13C_15N . _Chem_comp.Image_file_name . _Chem_comp.Image_file_format . _Chem_comp.Topo_file_name . _Chem_comp.Topo_file_format . _Chem_comp.Struct_file_name . _Chem_comp.Struct_file_format . _Chem_comp.Stereochem_param_file_name . _Chem_comp.Stereochem_param_file_format . _Chem_comp.Model_details . _Chem_comp.Model_erf . _Chem_comp.Model_source . _Chem_comp.Model_coordinates_details . _Chem_comp.Model_coordinates_missing_flag no _Chem_comp.Ideal_coordinates_details . _Chem_comp.Ideal_coordinates_missing_flag no _Chem_comp.Model_coordinates_db_code . _Chem_comp.Processing_site RCSB _Chem_comp.Vendor . _Chem_comp.Vendor_product_code . _Chem_comp.Details ; Information obtained from PDB's Chemical Component Dictionary at http://wwpdb-remediation.rutgers.edu/downloads.html Downloaded on Tue Nov 18 18:34:14 2008 ; _Chem_comp.DB_query_date . _Chem_comp.DB_last_query_revised_last_date . loop_ _Chem_comp_descriptor.Descriptor _Chem_comp_descriptor.Type _Chem_comp_descriptor.Program _Chem_comp_descriptor.Program_version _Chem_comp_descriptor.Entry_ID _Chem_comp_descriptor.Comp_ID BHPQYMZQTOCNFJ-UHFFFAOYAP InChIKey InChI 1.02b 16191 CA [Ca++] SMILES CACTVS 3.341 16191 CA [Ca++] SMILES_CANONICAL CACTVS 3.341 16191 CA [Ca+2] SMILES ACDLabs 10.04 16191 CA [Ca+2] SMILES 'OpenEye OEToolkits' 1.5.0 16191 CA [Ca+2] SMILES_CANONICAL 'OpenEye OEToolkits' 1.5.0 16191 CA InChI=1/Ca/q+2 InChI InChI 1.02b 16191 CA stop_ loop_ _Chem_comp_identifier.Identifier _Chem_comp_identifier.Type _Chem_comp_identifier.Program _Chem_comp_identifier.Program_version _Chem_comp_identifier.Entry_ID _Chem_comp_identifier.Comp_ID calcium 'SYSTEMATIC NAME' ACDLabs 10.04 16191 CA 'calcium(+2) cation' 'SYSTEMATIC NAME' 'OpenEye OEToolkits' 1.5.0 16191 CA stop_ loop_ _Chem_comp_atom.Atom_ID _Chem_comp_atom.BMRB_code _Chem_comp_atom.PDB_atom_ID _Chem_comp_atom.Alt_atom_ID _Chem_comp_atom.Auth_atom_ID _Chem_comp_atom.Type_symbol _Chem_comp_atom.Isotope_number _Chem_comp_atom.Chirality _Chem_comp_atom.Stereo_config _Chem_comp_atom.Charge _Chem_comp_atom.Partial_charge _Chem_comp_atom.Oxidation_number _Chem_comp_atom.Unpaired_electron_number _Chem_comp_atom.Align _Chem_comp_atom.Aromatic_flag _Chem_comp_atom.Leaving_atom_flag _Chem_comp_atom.Substruct_code _Chem_comp_atom.Ionizable _Chem_comp_atom.Drawing_2D_coord_x _Chem_comp_atom.Drawing_2D_coord_y _Chem_comp_atom.Model_Cartn_x _Chem_comp_atom.Model_Cartn_x_esd _Chem_comp_atom.Model_Cartn_y _Chem_comp_atom.Model_Cartn_y_esd _Chem_comp_atom.Model_Cartn_z _Chem_comp_atom.Model_Cartn_z_esd _Chem_comp_atom.Model_Cartn_x_ideal _Chem_comp_atom.Model_Cartn_y_ideal _Chem_comp_atom.Model_Cartn_z_ideal _Chem_comp_atom.PDBX_ordinal _Chem_comp_atom.Details _Chem_comp_atom.Entry_ID _Chem_comp_atom.Comp_ID CA . CA . . CA . . N 2 . . . . no no . . . . 0.000 . 0.000 . 0.000 . 0.000 0.000 0.000 1 . 16191 CA stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 16191 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _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 'Polycystin-2 Polypeptide' '[U-100% 13C; U-100% 15N]' . . 1 $Polycystin-2_Polypeptide . . 0.5 . . mM . . . . 16191 1 2 Ca2 'natural abundance' . . . . . . 5 . . mM . . . . 16191 1 3 DSS 'natural abundance' . . . . . . 0.1 . . mM . . . . 16191 1 4 'potassium phosphate buffer' 'natural abundance' . . . . . . 10 . . mM . . . . 16191 1 5 NaCl 'natural abundance' . . . . . . 500 . . mM . . . . 16191 1 6 DTE 'natural abundance' . . . . . . 2 . . mM . . . . 16191 1 7 H20 'natural abundance' . . . . . . 90 . . % . . . . 16191 1 8 D20 'natural abundance' . . . . . . 10 . . % . . . . 16191 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 16191 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.51 . M 16191 1 pH 6.8 . pH 16191 1 pressure 1 . atm 16191 1 temperature 293 . K 16191 1 stop_ save_ ############################ # Computer software used # ############################ save_Auremol _Software.Sf_category software _Software.Sf_framecode Auremol _Software.Entry_ID 16191 _Software.ID 1 _Software.Name AUREMOL _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 16191 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 16191 1 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 16191 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 16191 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 16191 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 800 . . . 16191 1 2 spectrometer_2 Bruker Avance . 600 . . . 16191 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 16191 _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 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16191 1 2 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16191 1 3 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16191 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16191 1 5 '3D HNCANNH' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16191 1 6 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16191 1 7 '2D 15N-TOCSY-HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16191 1 8 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16191 1 9 '2D 1H-1H NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16191 1 10 '3D 1H-15N-NOESY-HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . . . . . . . . . . . . . . . . . . . 16191 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 16191 _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 0.00 . indirect 0.251449530 . . . . . . . . . 16191 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 16191 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 16191 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_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 16191 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 16191 1 2 '3D HNCA' . . . 16191 1 3 '3D CBCA(CO)NH' . . . 16191 1 4 '3D HNCACB' . . . 16191 1 5 '3D HNCANNH' . . . 16191 1 6 '3D HNCO' . . . 16191 1 7 '2D 15N-TOCSY-HSQC' . . . 16191 1 8 '3D HCCH-TOCSY' . . . 16191 1 9 '2D 1H-1H NOESY' . . . 16191 1 10 '3D 1H-15N-NOESY-HSQC' . . . 16191 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 3 3 THR H H 1 8.34 0.01 . 1 . . . . 676 THR H . 16191 1 2 . 1 1 3 3 THR HA H 1 4.24 0.01 . 1 . . . . 676 THR HA . 16191 1 3 . 1 1 3 3 THR HB H 1 4.14 0.01 . 1 . . . . 676 THR HB . 16191 1 4 . 1 1 3 3 THR C C 13 174.1 0.1 . 1 . . . . 676 THR C . 16191 1 5 . 1 1 3 3 THR CA C 13 61.75 0.1 . 1 . . . . 676 THR CA . 16191 1 6 . 1 1 3 3 THR CB C 13 69.73 0.1 . 1 . . . . 676 THR CB . 16191 1 7 . 1 1 3 3 THR N N 15 116.48 0.1 . 1 . . . . 676 THR N . 16191 1 8 . 1 1 4 4 ALA H H 1 8.39 0.01 . 1 . . . . 677 ALA H . 16191 1 9 . 1 1 4 4 ALA HA H 1 4.33 0.01 . 1 . . . . 677 ALA HA . 16191 1 10 . 1 1 4 4 ALA HB1 H 1 1.36 0.01 . 1 . . . . 677 ALA HB1 . 16191 1 11 . 1 1 4 4 ALA HB2 H 1 1.36 0.01 . 1 . . . . 677 ALA HB2 . 16191 1 12 . 1 1 4 4 ALA HB3 H 1 1.36 0.01 . 1 . . . . 677 ALA HB3 . 16191 1 13 . 1 1 4 4 ALA C C 13 177.4 0.1 . 1 . . . . 677 ALA C . 16191 1 14 . 1 1 4 4 ALA CA C 13 52.24 0.1 . 1 . . . . 677 ALA CA . 16191 1 15 . 1 1 4 4 ALA CB C 13 19.11 0.1 . 1 . . . . 677 ALA CB . 16191 1 16 . 1 1 4 4 ALA N N 15 127.04 0.1 . 1 . . . . 677 ALA N . 16191 1 17 . 1 1 5 5 ILE H H 1 8.16 0.01 . 1 . . . . 678 ILE H . 16191 1 18 . 1 1 5 5 ILE HA H 1 4.12 0.01 . 1 . . . . 678 ILE HA . 16191 1 19 . 1 1 5 5 ILE HB H 1 1.85 0.01 . 1 . . . . 678 ILE HB . 16191 1 20 . 1 1 5 5 ILE HD11 H 1 0.85 0.01 . 1 . . . . 678 ILE HD11 . 16191 1 21 . 1 1 5 5 ILE HD12 H 1 0.85 0.01 . 1 . . . . 678 ILE HD12 . 16191 1 22 . 1 1 5 5 ILE HD13 H 1 0.85 0.01 . 1 . . . . 678 ILE HD13 . 16191 1 23 . 1 1 5 5 ILE HG12 H 1 1.11 0.01 . 2 . . . . 678 ILE HG12 . 16191 1 24 . 1 1 5 5 ILE HG13 H 1 0.9 0.01 . 2 . . . . 678 ILE HG13 . 16191 1 25 . 1 1 5 5 ILE C C 13 176.8 0.1 . 1 . . . . 678 ILE C . 16191 1 26 . 1 1 5 5 ILE CA C 13 61.09 0.1 . 1 . . . . 678 ILE CA . 16191 1 27 . 1 1 5 5 ILE CB C 13 38.6 0.1 . 1 . . . . 678 ILE CB . 16191 1 28 . 1 1 5 5 ILE CD1 C 13 13.09 0.1 . 1 . . . . 678 ILE CD1 . 16191 1 29 . 1 1 5 5 ILE CG1 C 13 27.46 0.1 . 1 . . . . 678 ILE CG1 . 16191 1 30 . 1 1 5 5 ILE CG2 C 13 17.61 0.1 . 1 . . . . 678 ILE CG2 . 16191 1 31 . 1 1 5 5 ILE N N 15 120.55 0.1 . 1 . . . . 678 ILE N . 16191 1 32 . 1 1 6 6 GLY H H 1 8.55 0.01 . 1 . . . . 679 GLY H . 16191 1 33 . 1 1 6 6 GLY HA2 H 1 3.92 0.01 . 2 . . . . 679 GLY HA2 . 16191 1 34 . 1 1 6 6 GLY HA3 H 1 3.99 0.01 . 2 . . . . 679 GLY HA3 . 16191 1 35 . 1 1 6 6 GLY C C 13 174.2 0.1 . 1 . . . . 679 GLY C . 16191 1 36 . 1 1 6 6 GLY CA C 13 45.24 0.1 . 1 . . . . 679 GLY CA . 16191 1 37 . 1 1 6 6 GLY N N 15 113.33 0.1 . 1 . . . . 679 GLY N . 16191 1 38 . 1 1 7 7 ILE H H 1 7.99 0.01 . 1 . . . . 680 ILE H . 16191 1 39 . 1 1 7 7 ILE HA H 1 4.14 0.01 . 1 . . . . 680 ILE HA . 16191 1 40 . 1 1 7 7 ILE HB H 1 1.85 0.01 . 1 . . . . 680 ILE HB . 16191 1 41 . 1 1 7 7 ILE HD11 H 1 0.86 0.01 . 1 . . . . 680 ILE HD11 . 16191 1 42 . 1 1 7 7 ILE HD12 H 1 0.86 0.01 . 1 . . . . 680 ILE HD12 . 16191 1 43 . 1 1 7 7 ILE HD13 H 1 0.86 0.01 . 1 . . . . 680 ILE HD13 . 16191 1 44 . 1 1 7 7 ILE HG12 H 1 1.19 0.01 . 1 . . . . 680 ILE HG12 . 16191 1 45 . 1 1 7 7 ILE HG13 H 1 1.19 0.01 . 1 . . . . 680 ILE HG13 . 16191 1 46 . 1 1 7 7 ILE HG21 H 1 0.86 0.01 . 1 . . . . 680 ILE HG21 . 16191 1 47 . 1 1 7 7 ILE HG22 H 1 0.86 0.01 . 1 . . . . 680 ILE HG22 . 16191 1 48 . 1 1 7 7 ILE HG23 H 1 0.86 0.01 . 1 . . . . 680 ILE HG23 . 16191 1 49 . 1 1 7 7 ILE C C 13 176.1 0.1 . 1 . . . . 680 ILE C . 16191 1 50 . 1 1 7 7 ILE CA C 13 61.18 0.1 . 1 . . . . 680 ILE CA . 16191 1 51 . 1 1 7 7 ILE CB C 13 38.56 0.1 . 1 . . . . 680 ILE CB . 16191 1 52 . 1 1 7 7 ILE CG1 C 13 27.41 0.1 . 1 . . . . 680 ILE CG1 . 16191 1 53 . 1 1 7 7 ILE N N 15 119.93 0.1 . 1 . . . . 680 ILE N . 16191 1 54 . 1 1 8 8 ASN H H 1 8.55 0.01 . 1 . . . . 681 ASN H . 16191 1 55 . 1 1 8 8 ASN HA H 1 4.75 0.01 . 1 . . . . 681 ASN HA . 16191 1 56 . 1 1 8 8 ASN HB2 H 1 2.76 0.01 . 1 . . . . 681 ASN HB2 . 16191 1 57 . 1 1 8 8 ASN HB3 H 1 2.76 0.01 . 1 . . . . 681 ASN HB3 . 16191 1 58 . 1 1 8 8 ASN HD21 H 1 7.54 0.01 . 2 . . . . 681 ASN HD21 . 16191 1 59 . 1 1 8 8 ASN HD22 H 1 6.86 0.01 . 2 . . . . 681 ASN HD22 . 16191 1 60 . 1 1 8 8 ASN C C 13 174.8 0.1 . 1 . . . . 681 ASN C . 16191 1 61 . 1 1 8 8 ASN CA C 13 53.21 0.1 . 1 . . . . 681 ASN CA . 16191 1 62 . 1 1 8 8 ASN CB C 13 38.35 0.1 . 1 . . . . 681 ASN CB . 16191 1 63 . 1 1 8 8 ASN N N 15 121.94 0.1 . 1 . . . . 681 ASN N . 16191 1 64 . 1 1 8 8 ASN ND2 N 15 112.31 0.1 . 1 . . . . 681 ASN ND2 . 16191 1 65 . 1 1 9 9 ASP H H 1 8.27 0.01 . 1 . . . . 682 ASP H . 16191 1 66 . 1 1 9 9 ASP HA H 1 4.61 0.01 . 1 . . . . 682 ASP HA . 16191 1 67 . 1 1 9 9 ASP HB2 H 1 2.62 0.01 . 1 . . . . 682 ASP HB2 . 16191 1 68 . 1 1 9 9 ASP HB3 H 1 2.62 0.01 . 1 . . . . 682 ASP HB3 . 16191 1 69 . 1 1 9 9 ASP C C 13 176.4 0.1 . 1 . . . . 682 ASP C . 16191 1 70 . 1 1 9 9 ASP CA C 13 54.23 0.1 . 1 . . . . 682 ASP CA . 16191 1 71 . 1 1 9 9 ASP CB C 13 41.08 0.1 . 1 . . . . 682 ASP CB . 16191 1 72 . 1 1 9 9 ASP N N 15 121.16 0.1 . 1 . . . . 682 ASP N . 16191 1 73 . 1 1 10 10 THR H H 1 8.08 0.01 . 1 . . . . 683 THR H . 16191 1 74 . 1 1 10 10 THR HA H 1 4.37 0.01 . 1 . . . . 683 THR HA . 16191 1 75 . 1 1 10 10 THR HB H 1 4.23 0.01 . 1 . . . . 683 THR HB . 16191 1 76 . 1 1 10 10 THR HG21 H 1 1.08 0.01 . 1 . . . . 683 THR HG2 . 16191 1 77 . 1 1 10 10 THR HG22 H 1 1.08 0.01 . 1 . . . . 683 THR HG2 . 16191 1 78 . 1 1 10 10 THR HG23 H 1 1.08 0.01 . 1 . . . . 683 THR HG2 . 16191 1 79 . 1 1 10 10 THR C C 13 174.4 0.1 . 1 . . . . 683 THR C . 16191 1 80 . 1 1 10 10 THR CA C 13 62.04 0.1 . 1 . . . . 683 THR CA . 16191 1 81 . 1 1 10 10 THR CB C 13 69.73 0.1 . 1 . . . . 683 THR CB . 16191 1 82 . 1 1 10 10 THR N N 15 114.02 0.1 . 1 . . . . 683 THR N . 16191 1 83 . 1 1 11 11 TYR H H 1 8.23 0.01 . 1 . . . . 684 TYR H . 16191 1 84 . 1 1 11 11 TYR HA H 1 4.56 0.01 . 1 . . . . 684 TYR HA . 16191 1 85 . 1 1 11 11 TYR HB2 H 1 2.98 0.01 . 2 . . . . 684 TYR HB2 . 16191 1 86 . 1 1 11 11 TYR HB3 H 1 3.06 0.01 . 2 . . . . 684 TYR HB3 . 16191 1 87 . 1 1 11 11 TYR HD1 H 1 7.18 0.01 . 3 . . . . 684 TYR HD1 . 16191 1 88 . 1 1 11 11 TYR HD2 H 1 7.18 0.01 . 3 . . . . 684 TYR HD2 . 16191 1 89 . 1 1 11 11 TYR HE1 H 1 6.77 0.01 . 3 . . . . 684 TYR HE1 . 16191 1 90 . 1 1 11 11 TYR HE2 H 1 6.77 0.01 . 3 . . . . 684 TYR HE2 . 16191 1 91 . 1 1 11 11 TYR C C 13 175.7 0.1 . 1 . . . . 684 TYR C . 16191 1 92 . 1 1 11 11 TYR CA C 13 58.17 0.1 . 1 . . . . 684 TYR CA . 16191 1 93 . 1 1 11 11 TYR CB C 13 38.56 0.1 . 1 . . . . 684 TYR CB . 16191 1 94 . 1 1 11 11 TYR CD1 C 13 133.22 0.1 . 3 . . . . 684 TYR CD1 . 16191 1 95 . 1 1 11 11 TYR CD2 C 13 133.22 0.1 . 3 . . . . 684 TYR CD2 . 16191 1 96 . 1 1 11 11 TYR CE1 C 13 118.18 0.1 . 3 . . . . 684 TYR CE1 . 16191 1 97 . 1 1 11 11 TYR CE2 C 13 118.18 0.1 . 3 . . . . 684 TYR CE2 . 16191 1 98 . 1 1 11 11 TYR N N 15 122.63 0.1 . 1 . . . . 684 TYR N . 16191 1 99 . 1 1 12 12 SER H H 1 8.07 0.01 . 1 . . . . 685 SER H . 16191 1 100 . 1 1 12 12 SER HA H 1 4.37 0.01 . 1 . . . . 685 SER HA . 16191 1 101 . 1 1 12 12 SER HB2 H 1 3.9 0.01 . 2 . . . . 685 SER HB2 . 16191 1 102 . 1 1 12 12 SER HB3 H 1 3.77 0.01 . 2 . . . . 685 SER HB3 . 16191 1 103 . 1 1 12 12 SER C C 13 174 0.1 . 1 . . . . 685 SER C . 16191 1 104 . 1 1 12 12 SER CA C 13 58.13 0.1 . 1 . . . . 685 SER CA . 16191 1 105 . 1 1 12 12 SER CB C 13 63.87 0.1 . 1 . . . . 685 SER CB . 16191 1 106 . 1 1 12 12 SER N N 15 117.81 0.1 . 1 . . . . 685 SER N . 16191 1 107 . 1 1 13 13 GLU H H 1 8.38 0.01 . 1 . . . . 686 GLU H . 16191 1 108 . 1 1 13 13 GLU HA H 1 4.24 0.01 . 1 . . . . 686 GLU HA . 16191 1 109 . 1 1 13 13 GLU HB2 H 1 1.95 0.01 . 1 . . . . 686 GLU HB2 . 16191 1 110 . 1 1 13 13 GLU HB3 H 1 1.95 0.01 . 1 . . . . 686 GLU HB3 . 16191 1 111 . 1 1 13 13 GLU HG2 H 1 2.21 0.01 . 1 . . . . 686 GLU HG2 . 16191 1 112 . 1 1 13 13 GLU HG3 H 1 2.21 0.01 . 1 . . . . 686 GLU HG3 . 16191 1 113 . 1 1 13 13 GLU C C 13 176.4 0.1 . 1 . . . . 686 GLU C . 16191 1 114 . 1 1 13 13 GLU CA C 13 56.41 0.1 . 1 . . . . 686 GLU CA . 16191 1 115 . 1 1 13 13 GLU CB C 13 30.12 0.1 . 1 . . . . 686 GLU CB . 16191 1 116 . 1 1 13 13 GLU N N 15 123.31 0.1 . 1 . . . . 686 GLU N . 16191 1 117 . 1 1 14 14 VAL H H 1 8.17 0.01 . 1 . . . . 687 VAL H . 16191 1 118 . 1 1 14 14 VAL HA H 1 4.05 0.01 . 1 . . . . 687 VAL HA . 16191 1 119 . 1 1 14 14 VAL HB H 1 2.03 0.01 . 1 . . . . 687 VAL HB . 16191 1 120 . 1 1 14 14 VAL HG11 H 1 0.91 0.01 . 1 . . . . 687 VAL HG11 . 16191 1 121 . 1 1 14 14 VAL HG12 H 1 0.91 0.01 . 1 . . . . 687 VAL HG12 . 16191 1 122 . 1 1 14 14 VAL HG13 H 1 0.91 0.01 . 1 . . . . 687 VAL HG13 . 16191 1 123 . 1 1 14 14 VAL HG21 H 1 0.91 0.01 . 1 . . . . 687 VAL HG21 . 16191 1 124 . 1 1 14 14 VAL HG22 H 1 0.91 0.01 . 1 . . . . 687 VAL HG22 . 16191 1 125 . 1 1 14 14 VAL HG23 H 1 0.91 0.01 . 1 . . . . 687 VAL HG23 . 16191 1 126 . 1 1 14 14 VAL C C 13 176.3 0.1 . 1 . . . . 687 VAL C . 16191 1 127 . 1 1 14 14 VAL CA C 13 62.48 0.1 . 1 . . . . 687 VAL CA . 16191 1 128 . 1 1 14 14 VAL CB C 13 32.57 0.1 . 1 . . . . 687 VAL CB . 16191 1 129 . 1 1 14 14 VAL CG1 C 13 21.1 0.1 . 1 . . . . 687 VAL CG1 . 16191 1 130 . 1 1 14 14 VAL CG2 C 13 21.1 0.1 . 1 . . . . 687 VAL CG2 . 16191 1 131 . 1 1 14 14 VAL N N 15 121.88 0.1 . 1 . . . . 687 VAL N . 16191 1 132 . 1 1 15 15 LYS H H 1 8.44 0.01 . 1 . . . . 688 LYS H . 16191 1 133 . 1 1 15 15 LYS HA H 1 4.32 0.01 . 1 . . . . 688 LYS HA . 16191 1 134 . 1 1 15 15 LYS HB2 H 1 1.77 0.01 . 1 . . . . 688 LYS HB2 . 16191 1 135 . 1 1 15 15 LYS HB3 H 1 1.77 0.01 . 1 . . . . 688 LYS HB3 . 16191 1 136 . 1 1 15 15 LYS HD2 H 1 1.58 0.01 . 1 . . . . 688 LYS HD2 . 16191 1 137 . 1 1 15 15 LYS HD3 H 1 1.58 0.01 . 1 . . . . 688 LYS HD3 . 16191 1 138 . 1 1 15 15 LYS HE2 H 1 2.95 0.01 . 1 . . . . 688 LYS HE2 . 16191 1 139 . 1 1 15 15 LYS HE3 H 1 2.95 0.01 . 1 . . . . 688 LYS HE3 . 16191 1 140 . 1 1 15 15 LYS HG2 H 1 1.41 0.01 . 1 . . . . 688 LYS HG2 . 16191 1 141 . 1 1 15 15 LYS HG3 H 1 1.41 0.01 . 1 . . . . 688 LYS HG3 . 16191 1 142 . 1 1 15 15 LYS C C 13 176.8 0.1 . 1 . . . . 688 LYS C . 16191 1 143 . 1 1 15 15 LYS CA C 13 56.3 0.1 . 1 . . . . 688 LYS CA . 16191 1 144 . 1 1 15 15 LYS CB C 13 32.9 0.1 . 1 . . . . 688 LYS CB . 16191 1 145 . 1 1 15 15 LYS N N 15 125.67 0.1 . 1 . . . . 688 LYS N . 16191 1 146 . 1 1 16 16 SER H H 1 8.37 0.01 . 1 . . . . 689 SER H . 16191 1 147 . 1 1 16 16 SER HA H 1 4.41 0.01 . 1 . . . . 689 SER HA . 16191 1 148 . 1 1 16 16 SER HB2 H 1 3.83 0.01 . 1 . . . . 689 SER HB2 . 16191 1 149 . 1 1 16 16 SER HB3 H 1 3.83 0.01 . 1 . . . . 689 SER HB3 . 16191 1 150 . 1 1 16 16 SER C C 13 174.5 0.1 . 1 . . . . 689 SER C . 16191 1 151 . 1 1 16 16 SER CA C 13 58.48 0.1 . 1 . . . . 689 SER CA . 16191 1 152 . 1 1 16 16 SER CB C 13 63.75 0.1 . 1 . . . . 689 SER CB . 16191 1 153 . 1 1 16 16 SER N N 15 117.33 0.1 . 1 . . . . 689 SER N . 16191 1 154 . 1 1 17 17 ASP H H 1 8.47 0.01 . 1 . . . . 690 ASP H . 16191 1 155 . 1 1 17 17 ASP HA H 1 4.57 0.01 . 1 . . . . 690 ASP HA . 16191 1 156 . 1 1 17 17 ASP HB2 H 1 2.67 0.01 . 1 . . . . 690 ASP HB2 . 16191 1 157 . 1 1 17 17 ASP HB3 H 1 2.67 0.01 . 1 . . . . 690 ASP HB3 . 16191 1 158 . 1 1 17 17 ASP C C 13 176.8 0.1 . 1 . . . . 690 ASP C . 16191 1 159 . 1 1 17 17 ASP CA C 13 54.59 0.1 . 1 . . . . 690 ASP CA . 16191 1 160 . 1 1 17 17 ASP CB C 13 40.77 0.1 . 1 . . . . 690 ASP CB . 16191 1 161 . 1 1 17 17 ASP N N 15 122.87 0.1 . 1 . . . . 690 ASP N . 16191 1 162 . 1 1 18 18 LEU H H 1 8.16 0.01 . 1 . . . . 691 LEU H . 16191 1 163 . 1 1 18 18 LEU HA H 1 4.12 0.01 . 1 . . . . 691 LEU HA . 16191 1 164 . 1 1 18 18 LEU HB2 H 1 1.63 0.01 . 1 . . . . 691 LEU HB2 . 16191 1 165 . 1 1 18 18 LEU HB3 H 1 1.63 0.01 . 1 . . . . 691 LEU HB3 . 16191 1 166 . 1 1 18 18 LEU C C 13 178.1 0.1 . 1 . . . . 691 LEU C . 16191 1 167 . 1 1 18 18 LEU CA C 13 56.15 0.1 . 1 . . . . 691 LEU CA . 16191 1 168 . 1 1 18 18 LEU CB C 13 42.15 0.1 . 1 . . . . 691 LEU CB . 16191 1 169 . 1 1 18 18 LEU CD1 C 13 24.17 0.1 . 1 . . . . 691 LEU CD1 . 16191 1 170 . 1 1 18 18 LEU CD2 C 13 24.17 0.1 . 1 . . . . 691 LEU CD2 . 16191 1 171 . 1 1 18 18 LEU CG C 13 27.07 0.1 . 1 . . . . 691 LEU CG . 16191 1 172 . 1 1 18 18 LEU N N 15 122.15 0.1 . 1 . . . . 691 LEU N . 16191 1 173 . 1 1 19 19 ALA H H 1 8.19 0.01 . 1 . . . . 692 ALA H . 16191 1 174 . 1 1 19 19 ALA HA H 1 4.2 0.01 . 1 . . . . 692 ALA HA . 16191 1 175 . 1 1 19 19 ALA HB1 H 1 1.32 0.01 . 1 . . . . 692 ALA HB1 . 16191 1 176 . 1 1 19 19 ALA HB2 H 1 1.32 0.01 . 1 . . . . 692 ALA HB2 . 16191 1 177 . 1 1 19 19 ALA HB3 H 1 1.32 0.01 . 1 . . . . 692 ALA HB3 . 16191 1 178 . 1 1 19 19 ALA C C 13 178.7 0.1 . 1 . . . . 692 ALA C . 16191 1 179 . 1 1 19 19 ALA CA C 13 53.67 0.1 . 1 . . . . 692 ALA CA . 16191 1 180 . 1 1 19 19 ALA CB C 13 18.52 0.1 . 1 . . . . 692 ALA CB . 16191 1 181 . 1 1 19 19 ALA N N 15 123.18 0.1 . 1 . . . . 692 ALA N . 16191 1 182 . 1 1 20 20 GLN H H 1 8.19 0.01 . 1 . . . . 693 GLN H . 16191 1 183 . 1 1 20 20 GLN HA H 1 4.19 0.01 . 1 . . . . 693 GLN HA . 16191 1 184 . 1 1 20 20 GLN HB2 H 1 2.06 0.01 . 1 . . . . 693 GLN HB2 . 16191 1 185 . 1 1 20 20 GLN HB3 H 1 2.06 0.01 . 1 . . . . 693 GLN HB3 . 16191 1 186 . 1 1 20 20 GLN HG2 H 1 2.42 0.01 . 1 . . . . 693 GLN HG2 . 16191 1 187 . 1 1 20 20 GLN HG3 H 1 2.42 0.01 . 1 . . . . 693 GLN HG3 . 16191 1 188 . 1 1 20 20 GLN C C 13 176.8 0.1 . 1 . . . . 693 GLN C . 16191 1 189 . 1 1 20 20 GLN CA C 13 56.76 0.1 . 1 . . . . 693 GLN CA . 16191 1 190 . 1 1 20 20 GLN CB C 13 28.77 0.1 . 1 . . . . 693 GLN CB . 16191 1 191 . 1 1 20 20 GLN CG C 13 34.19 0.1 . 1 . . . . 693 GLN CG . 16191 1 192 . 1 1 20 20 GLN N N 15 119.11 0.1 . 1 . . . . 693 GLN N . 16191 1 193 . 1 1 21 21 GLN H H 1 8.26 0.01 . 1 . . . . 694 GLN H . 16191 1 194 . 1 1 21 21 GLN HA H 1 4.19 0.01 . 1 . . . . 694 GLN HA . 16191 1 195 . 1 1 21 21 GLN HB2 H 1 2.04 0.01 . 1 . . . . 694 GLN HB2 . 16191 1 196 . 1 1 21 21 GLN HB3 H 1 2.04 0.01 . 1 . . . . 694 GLN HB3 . 16191 1 197 . 1 1 21 21 GLN HG2 H 1 2.38 0.01 . 1 . . . . 694 GLN HG2 . 16191 1 198 . 1 1 21 21 GLN HG3 H 1 2.38 0.01 . 1 . . . . 694 GLN HG3 . 16191 1 199 . 1 1 21 21 GLN C C 13 177.1 0.1 . 1 . . . . 694 GLN C . 16191 1 200 . 1 1 21 21 GLN CA C 13 56.92 0.1 . 1 . . . . 694 GLN CA . 16191 1 201 . 1 1 21 21 GLN CB C 13 28.98 0.1 . 1 . . . . 694 GLN CB . 16191 1 202 . 1 1 21 21 GLN N N 15 120.72 0.1 . 1 . . . . 694 GLN N . 16191 1 203 . 1 1 22 22 LYS H H 1 8.29 0.01 . 1 . . . . 695 LYS H . 16191 1 204 . 1 1 22 22 LYS HA H 1 4.14 0.01 . 1 . . . . 695 LYS HA . 16191 1 205 . 1 1 22 22 LYS HB2 H 1 1.81 0.01 . 1 . . . . 695 LYS HB2 . 16191 1 206 . 1 1 22 22 LYS HB3 H 1 1.81 0.01 . 1 . . . . 695 LYS HB3 . 16191 1 207 . 1 1 22 22 LYS HE2 H 1 2.77 0.01 . 1 . . . . 695 LYS HE2 . 16191 1 208 . 1 1 22 22 LYS HE3 H 1 2.77 0.01 . 1 . . . . 695 LYS HE3 . 16191 1 209 . 1 1 22 22 LYS HG2 H 1 1.46 0.01 . 1 . . . . 695 LYS HG2 . 16191 1 210 . 1 1 22 22 LYS HG3 H 1 1.46 0.01 . 1 . . . . 695 LYS HG3 . 16191 1 211 . 1 1 22 22 LYS C C 13 177.1 0.1 . 1 . . . . 695 LYS C . 16191 1 212 . 1 1 22 22 LYS CA C 13 57.41 0.1 . 1 . . . . 695 LYS CA . 16191 1 213 . 1 1 22 22 LYS CB C 13 32.46 0.1 . 1 . . . . 695 LYS CB . 16191 1 214 . 1 1 22 22 LYS N N 15 121.84 0.1 . 1 . . . . 695 LYS N . 16191 1 215 . 1 1 23 23 ALA H H 1 8.11 0.01 . 1 . . . . 696 ALA H . 16191 1 216 . 1 1 23 23 ALA HA H 1 4.25 0.01 . 1 . . . . 696 ALA HA . 16191 1 217 . 1 1 23 23 ALA HB1 H 1 1.43 0.01 . 1 . . . . 696 ALA HB1 . 16191 1 218 . 1 1 23 23 ALA HB2 H 1 1.43 0.01 . 1 . . . . 696 ALA HB2 . 16191 1 219 . 1 1 23 23 ALA HB3 H 1 1.43 0.01 . 1 . . . . 696 ALA HB3 . 16191 1 220 . 1 1 23 23 ALA C C 13 178.9 0.1 . 1 . . . . 696 ALA C . 16191 1 221 . 1 1 23 23 ALA CA C 13 53.44 0.1 . 1 . . . . 696 ALA CA . 16191 1 222 . 1 1 23 23 ALA CB C 13 18.52 0.1 . 1 . . . . 696 ALA CB . 16191 1 223 . 1 1 23 23 ALA N N 15 123.86 0.1 . 1 . . . . 696 ALA N . 16191 1 224 . 1 1 24 24 GLU H H 1 8.29 0.01 . 1 . . . . 697 GLU H . 16191 1 225 . 1 1 24 24 GLU HA H 1 4.18 0.01 . 1 . . . . 697 GLU HA . 16191 1 226 . 1 1 24 24 GLU HB2 H 1 2.05 0.01 . 1 . . . . 697 GLU HB2 . 16191 1 227 . 1 1 24 24 GLU HB3 H 1 2.05 0.01 . 1 . . . . 697 GLU HB3 . 16191 1 228 . 1 1 24 24 GLU HG2 H 1 2.25 0.01 . 1 . . . . 697 GLU HG2 . 16191 1 229 . 1 1 24 24 GLU HG3 H 1 2.25 0.01 . 1 . . . . 697 GLU HG3 . 16191 1 230 . 1 1 24 24 GLU C C 13 177.5 0.1 . 1 . . . . 697 GLU C . 16191 1 231 . 1 1 24 24 GLU CA C 13 57.37 0.1 . 1 . . . . 697 GLU CA . 16191 1 232 . 1 1 24 24 GLU CB C 13 29.87 0.1 . 1 . . . . 697 GLU CB . 16191 1 233 . 1 1 24 24 GLU CG C 13 36.47 0.1 . 1 . . . . 697 GLU CG . 16191 1 234 . 1 1 24 24 GLU N N 15 119.15 0.1 . 1 . . . . 697 GLU N . 16191 1 235 . 1 1 25 25 MET H H 1 8.2 0.01 . 1 . . . . 698 MET H . 16191 1 236 . 1 1 25 25 MET HA H 1 4.36 0.01 . 1 . . . . 698 MET HA . 16191 1 237 . 1 1 25 25 MET HB2 H 1 1.8 0.01 . 2 . . . . 698 MET HB2 . 16191 1 238 . 1 1 25 25 MET HB3 H 1 1.57 0.01 . 2 . . . . 698 MET HB3 . 16191 1 239 . 1 1 25 25 MET HG2 H 1 2.03 0.01 . 1 . . . . 698 MET HG2 . 16191 1 240 . 1 1 25 25 MET HG3 H 1 2.03 0.01 . 1 . . . . 698 MET HG3 . 16191 1 241 . 1 1 25 25 MET C C 13 176.9 0.1 . 1 . . . . 698 MET C . 16191 1 242 . 1 1 25 25 MET CA C 13 56.58 0.1 . 1 . . . . 698 MET CA . 16191 1 243 . 1 1 25 25 MET CB C 13 32.86 0.1 . 1 . . . . 698 MET CB . 16191 1 244 . 1 1 25 25 MET N N 15 120.41 0.1 . 1 . . . . 698 MET N . 16191 1 245 . 1 1 26 26 GLU H H 1 8.36 0.01 . 1 . . . . 699 GLU H . 16191 1 246 . 1 1 26 26 GLU HA H 1 4.33 0.01 . 1 . . . . 699 GLU HA . 16191 1 247 . 1 1 26 26 GLU HB2 H 1 2.02 0.01 . 1 . . . . 699 GLU HB2 . 16191 1 248 . 1 1 26 26 GLU HB3 H 1 2.02 0.01 . 1 . . . . 699 GLU HB3 . 16191 1 249 . 1 1 26 26 GLU HG2 H 1 2.31 0.01 . 1 . . . . 699 GLU HG2 . 16191 1 250 . 1 1 26 26 GLU HG3 H 1 2.31 0.01 . 1 . . . . 699 GLU HG3 . 16191 1 251 . 1 1 26 26 GLU C C 13 177.5 0.1 . 1 . . . . 699 GLU C . 16191 1 252 . 1 1 26 26 GLU CA C 13 57.21 0.1 . 1 . . . . 699 GLU CA . 16191 1 253 . 1 1 26 26 GLU CB C 13 29.83 0.1 . 1 . . . . 699 GLU CB . 16191 1 254 . 1 1 26 26 GLU CG C 13 35.87 0.1 . 1 . . . . 699 GLU CG . 16191 1 255 . 1 1 26 26 GLU N N 15 121.26 0.1 . 1 . . . . 699 GLU N . 16191 1 256 . 1 1 27 27 LEU H H 1 8.18 0.01 . 1 . . . . 700 LEU H . 16191 1 257 . 1 1 27 27 LEU HA H 1 4.22 0.01 . 1 . . . . 700 LEU HA . 16191 1 258 . 1 1 27 27 LEU HB2 H 1 1.99 0.01 . 1 . . . . 700 LEU HB2 . 16191 1 259 . 1 1 27 27 LEU HB3 H 1 1.99 0.01 . 1 . . . . 700 LEU HB3 . 16191 1 260 . 1 1 27 27 LEU HD11 H 1 0.89 0.01 . 1 . . . . 700 LEU HD11 . 16191 1 261 . 1 1 27 27 LEU HD12 H 1 0.89 0.01 . 1 . . . . 700 LEU HD12 . 16191 1 262 . 1 1 27 27 LEU HD13 H 1 0.89 0.01 . 1 . . . . 700 LEU HD13 . 16191 1 263 . 1 1 27 27 LEU HG H 1 1.61 0.01 . 1 . . . . 700 LEU HG . 16191 1 264 . 1 1 27 27 LEU C C 13 178 0.1 . 1 . . . . 700 LEU C . 16191 1 265 . 1 1 27 27 LEU CA C 13 55.42 0.1 . 1 . . . . 700 LEU CA . 16191 1 266 . 1 1 27 27 LEU N N 15 122.1 0.1 . 1 . . . . 700 LEU N . 16191 1 267 . 1 1 28 28 SER H H 1 8.22 0.01 . 1 . . . . 701 SER H . 16191 1 268 . 1 1 28 28 SER HA H 1 4.25 0.01 . 1 . . . . 701 SER HA . 16191 1 269 . 1 1 28 28 SER HB2 H 1 3.89 0.01 . 1 . . . . 701 SER HB2 . 16191 1 270 . 1 1 28 28 SER HB3 H 1 3.89 0.01 . 1 . . . . 701 SER HB3 . 16191 1 271 . 1 1 28 28 SER C C 13 175.6 0.1 . 1 . . . . 701 SER C . 16191 1 272 . 1 1 28 28 SER CA C 13 59.77 0.1 . 1 . . . . 701 SER CA . 16191 1 273 . 1 1 28 28 SER CB C 13 63.47 0.1 . 1 . . . . 701 SER CB . 16191 1 274 . 1 1 28 28 SER N N 15 115.01 0.1 . 1 . . . . 701 SER N . 16191 1 275 . 1 1 29 29 ASP H H 1 8.23 0.01 . 1 . . . . 702 ASP H . 16191 1 276 . 1 1 29 29 ASP HA H 1 4.52 0.01 . 1 . . . . 702 ASP HA . 16191 1 277 . 1 1 29 29 ASP HB2 H 1 2.69 0.01 . 1 . . . . 702 ASP HB2 . 16191 1 278 . 1 1 29 29 ASP HB3 H 1 2.69 0.01 . 1 . . . . 702 ASP HB3 . 16191 1 279 . 1 1 29 29 ASP C C 13 177.1 0.1 . 1 . . . . 702 ASP C . 16191 1 280 . 1 1 29 29 ASP CA C 13 55.9 0.1 . 1 . . . . 702 ASP CA . 16191 1 281 . 1 1 29 29 ASP CB C 13 40.9 0.1 . 1 . . . . 702 ASP CB . 16191 1 282 . 1 1 29 29 ASP N N 15 122.15 0.1 . 1 . . . . 702 ASP N . 16191 1 283 . 1 1 30 30 LEU H H 1 7.95 0.01 . 1 . . . . 703 LEU H . 16191 1 284 . 1 1 30 30 LEU HA H 1 4.1 0.01 . 1 . . . . 703 LEU HA . 16191 1 285 . 1 1 30 30 LEU HB2 H 1 1.69 0.01 . 1 . . . . 703 LEU HB2 . 16191 1 286 . 1 1 30 30 LEU HB3 H 1 1.69 0.01 . 1 . . . . 703 LEU HB3 . 16191 1 287 . 1 1 30 30 LEU C C 13 178.9 0.1 . 1 . . . . 703 LEU C . 16191 1 288 . 1 1 30 30 LEU CA C 13 56.74 0.1 . 1 . . . . 703 LEU CA . 16191 1 289 . 1 1 30 30 LEU CB C 13 42.15 0.1 . 1 . . . . 703 LEU CB . 16191 1 290 . 1 1 30 30 LEU N N 15 120.61 0.1 . 1 . . . . 703 LEU N . 16191 1 291 . 1 1 31 31 ILE H H 1 7.99 0.01 . 1 . . . . 704 ILE H . 16191 1 292 . 1 1 31 31 ILE HA H 1 4.09 0.01 . 1 . . . . 704 ILE HA . 16191 1 293 . 1 1 31 31 ILE HB H 1 1.91 0.01 . 1 . . . . 704 ILE HB . 16191 1 294 . 1 1 31 31 ILE HD11 H 1 0.7 0.01 . 1 . . . . 704 ILE HD11 . 16191 1 295 . 1 1 31 31 ILE HD12 H 1 0.7 0.01 . 1 . . . . 704 ILE HD12 . 16191 1 296 . 1 1 31 31 ILE HD13 H 1 0.7 0.01 . 1 . . . . 704 ILE HD13 . 16191 1 297 . 1 1 31 31 ILE HG12 H 1 1.55 0.01 . 2 . . . . 704 ILE HG12 . 16191 1 298 . 1 1 31 31 ILE HG13 H 1 1.18 0.01 . 2 . . . . 704 ILE HG13 . 16191 1 299 . 1 1 31 31 ILE HG21 H 1 0.75 0.01 . 1 . . . . 704 ILE HG21 . 16191 1 300 . 1 1 31 31 ILE HG22 H 1 0.75 0.01 . 1 . . . . 704 ILE HG22 . 16191 1 301 . 1 1 31 31 ILE HG23 H 1 0.75 0.01 . 1 . . . . 704 ILE HG23 . 16191 1 302 . 1 1 31 31 ILE C C 13 177.8 0.1 . 1 . . . . 704 ILE C . 16191 1 303 . 1 1 31 31 ILE CA C 13 62.7 0.1 . 1 . . . . 704 ILE CA . 16191 1 304 . 1 1 31 31 ILE CB C 13 37.8 0.1 . 1 . . . . 704 ILE CB . 16191 1 305 . 1 1 31 31 ILE CD1 C 13 12.79 0.1 . 1 . . . . 704 ILE CD1 . 16191 1 306 . 1 1 31 31 ILE CG1 C 13 28.3 0.1 . 1 . . . . 704 ILE CG1 . 16191 1 307 . 1 1 31 31 ILE CG2 C 13 17.56 0.1 . 1 . . . . 704 ILE CG2 . 16191 1 308 . 1 1 31 31 ILE N N 15 121.91 0.1 . 1 . . . . 704 ILE N . 16191 1 309 . 1 1 32 32 ARG H H 1 8.23 0.01 . 1 . . . . 705 ARG H . 16191 1 310 . 1 1 32 32 ARG HA H 1 4.21 0.01 . 1 . . . . 705 ARG HA . 16191 1 311 . 1 1 32 32 ARG HB2 H 1 1.86 0.01 . 1 . . . . 705 ARG HB2 . 16191 1 312 . 1 1 32 32 ARG HB3 H 1 1.86 0.01 . 1 . . . . 705 ARG HB3 . 16191 1 313 . 1 1 32 32 ARG HD2 H 1 2.97 0.01 . 1 . . . . 705 ARG HD2 . 16191 1 314 . 1 1 32 32 ARG HD3 H 1 2.97 0.01 . 1 . . . . 705 ARG HD3 . 16191 1 315 . 1 1 32 32 ARG HE H 1 7.09 0.01 . 1 . . . . 705 ARG HE . 16191 1 316 . 1 1 32 32 ARG HG2 H 1 1.48 0.01 . 2 . . . . 705 ARG HG2 . 16191 1 317 . 1 1 32 32 ARG HG3 H 1 1.4 0.01 . 2 . . . . 705 ARG HG3 . 16191 1 318 . 1 1 32 32 ARG CA C 13 57.69 0.1 . 1 . . . . 705 ARG CA . 16191 1 319 . 1 1 32 32 ARG CB C 13 30.36 0.1 . 1 . . . . 705 ARG CB . 16191 1 320 . 1 1 32 32 ARG CD C 13 43.46 0.1 . 1 . . . . 705 ARG CD . 16191 1 321 . 1 1 32 32 ARG CG C 13 27.2 0.1 . 1 . . . . 705 ARG CG . 16191 1 322 . 1 1 32 32 ARG N N 15 122.28 0.1 . 1 . . . . 705 ARG N . 16191 1 323 . 1 1 34 34 GLY N N 15 108.62 0.1 . 1 . . . . 707 GLY N . 16191 1 324 . 1 1 52 52 ILE H H 1 7.99 0.01 . 1 . . . . 725 ILE H . 16191 1 325 . 1 1 52 52 ILE HA H 1 3.45 0.01 . 1 . . . . 725 ILE HA . 16191 1 326 . 1 1 52 52 ILE HB H 1 1.7 0.01 . 1 . . . . 725 ILE HB . 16191 1 327 . 1 1 52 52 ILE HD11 H 1 0.74 0.01 . 1 . . . . 725 ILE HD11 . 16191 1 328 . 1 1 52 52 ILE HD12 H 1 0.74 0.01 . 1 . . . . 725 ILE HD12 . 16191 1 329 . 1 1 52 52 ILE HD13 H 1 0.74 0.01 . 1 . . . . 725 ILE HD13 . 16191 1 330 . 1 1 52 52 ILE HG21 H 1 0.38 0.01 . 1 . . . . 725 ILE HG21 . 16191 1 331 . 1 1 52 52 ILE HG22 H 1 0.38 0.01 . 1 . . . . 725 ILE HG22 . 16191 1 332 . 1 1 52 52 ILE HG23 H 1 0.38 0.01 . 1 . . . . 725 ILE HG23 . 16191 1 333 . 1 1 52 52 ILE CB C 13 37.81 0.1 . 1 . . . . 725 ILE CB . 16191 1 334 . 1 1 52 52 ILE CD1 C 13 14.32 0.1 . 1 . . . . 725 ILE CD1 . 16191 1 335 . 1 1 52 52 ILE CG1 C 13 31.15 0.1 . 1 . . . . 725 ILE CG1 . 16191 1 336 . 1 1 52 52 ILE CG2 C 13 17.27 0.1 . 1 . . . . 725 ILE CG2 . 16191 1 337 . 1 1 52 52 ILE N N 15 121.91 0.1 . 1 . . . . 725 ILE N . 16191 1 338 . 1 1 53 53 SER H H 1 8 0.01 . 1 . . . . 726 SER H . 16191 1 339 . 1 1 53 53 SER HA H 1 4.33 0.01 . 1 . . . . 726 SER HA . 16191 1 340 . 1 1 53 53 SER HB2 H 1 3.75 0.01 . 1 . . . . 726 SER HB2 . 16191 1 341 . 1 1 53 53 SER HB3 H 1 3.75 0.01 . 1 . . . . 726 SER HB3 . 16191 1 342 . 1 1 53 53 SER N N 15 117.27 0.1 . 1 . . . . 726 SER N . 16191 1 343 . 1 1 55 55 SER H H 1 8.02 0.01 . 1 . . . . 728 SER H . 16191 1 344 . 1 1 55 55 SER HA H 1 4.38 0.01 . 1 . . . . 728 SER HA . 16191 1 345 . 1 1 55 55 SER C C 13 177.7 0.1 . 1 . . . . 728 SER C . 16191 1 346 . 1 1 56 56 LEU H H 1 8.36 0.01 . 1 . . . . 729 LEU H . 16191 1 347 . 1 1 56 56 LEU HA H 1 4.24 0.01 . 1 . . . . 729 LEU HA . 16191 1 348 . 1 1 56 56 LEU HB2 H 1 1.44 0.01 . 1 . . . . 729 LEU HB2 . 16191 1 349 . 1 1 56 56 LEU HB3 H 1 1.44 0.01 . 1 . . . . 729 LEU HB3 . 16191 1 350 . 1 1 56 56 LEU HD11 H 1 0.55 0.01 . 2 . . . . 729 LEU HD11 . 16191 1 351 . 1 1 56 56 LEU HD12 H 1 0.55 0.01 . 2 . . . . 729 LEU HD12 . 16191 1 352 . 1 1 56 56 LEU HD13 H 1 0.55 0.01 . 2 . . . . 729 LEU HD13 . 16191 1 353 . 1 1 56 56 LEU HD21 H 1 0.46 0.01 . 2 . . . . 729 LEU HD21 . 16191 1 354 . 1 1 56 56 LEU HD22 H 1 0.46 0.01 . 2 . . . . 729 LEU HD22 . 16191 1 355 . 1 1 56 56 LEU HD23 H 1 0.46 0.01 . 2 . . . . 729 LEU HD23 . 16191 1 356 . 1 1 56 56 LEU HG H 1 1.07 0.01 . 1 . . . . 729 LEU HG . 16191 1 357 . 1 1 56 56 LEU C C 13 179.3 0.1 . 1 . . . . 729 LEU C . 16191 1 358 . 1 1 56 56 LEU CA C 13 58.01 0.1 . 1 . . . . 729 LEU CA . 16191 1 359 . 1 1 56 56 LEU CB C 13 42.11 0.1 . 1 . . . . 729 LEU CB . 16191 1 360 . 1 1 56 56 LEU CD1 C 13 23.21 0.1 . 1 . . . . 729 LEU CD1 . 16191 1 361 . 1 1 56 56 LEU CD2 C 13 23.21 0.1 . 1 . . . . 729 LEU CD2 . 16191 1 362 . 1 1 56 56 LEU CG C 13 26.32 0.1 . 1 . . . . 729 LEU CG . 16191 1 363 . 1 1 56 56 LEU N N 15 121.43 0.1 . 1 . . . . 729 LEU N . 16191 1 364 . 1 1 57 57 ARG H H 1 8.02 0.01 . 1 . . . . 730 ARG H . 16191 1 365 . 1 1 57 57 ARG HA H 1 4 0.01 . 1 . . . . 730 ARG HA . 16191 1 366 . 1 1 57 57 ARG HB2 H 1 1.87 0.01 . 1 . . . . 730 ARG HB2 . 16191 1 367 . 1 1 57 57 ARG HB3 H 1 1.87 0.01 . 1 . . . . 730 ARG HB3 . 16191 1 368 . 1 1 57 57 ARG HD2 H 1 3.26 0.01 . 2 . . . . 730 ARG HD2 . 16191 1 369 . 1 1 57 57 ARG HD3 H 1 3.21 0.01 . 2 . . . . 730 ARG HD3 . 16191 1 370 . 1 1 57 57 ARG HE H 1 7.2 0.01 . 1 . . . . 730 ARG HE . 16191 1 371 . 1 1 57 57 ARG HG2 H 1 1.71 0.01 . 1 . . . . 730 ARG HG2 . 16191 1 372 . 1 1 57 57 ARG HG3 H 1 1.71 0.01 . 1 . . . . 730 ARG HG3 . 16191 1 373 . 1 1 57 57 ARG CA C 13 59.43 0.1 . 1 . . . . 730 ARG CA . 16191 1 374 . 1 1 57 57 ARG CB C 13 29.9 0.1 . 1 . . . . 730 ARG CB . 16191 1 375 . 1 1 57 57 ARG N N 15 120.61 0.1 . 1 . . . . 730 ARG N . 16191 1 376 . 1 1 58 58 GLN H H 1 8.08 0.01 . 1 . . . . 731 GLN H . 16191 1 377 . 1 1 58 58 GLN HA H 1 4.13 0.01 . 1 . . . . 731 GLN HA . 16191 1 378 . 1 1 58 58 GLN HB2 H 1 2.14 0.01 . 2 . . . . 731 GLN HB2 . 16191 1 379 . 1 1 58 58 GLN HB3 H 1 1.96 0.01 . 2 . . . . 731 GLN HB3 . 16191 1 380 . 1 1 58 58 GLN HE21 H 1 7.65 0.01 . 2 . . . . 731 GLN HE21 . 16191 1 381 . 1 1 58 58 GLN HE22 H 1 6.86 0.01 . 2 . . . . 731 GLN HE22 . 16191 1 382 . 1 1 58 58 GLN HG2 H 1 2.46 0.01 . 1 . . . . 731 GLN HG2 . 16191 1 383 . 1 1 58 58 GLN HG3 H 1 2.46 0.01 . 1 . . . . 731 GLN HG3 . 16191 1 384 . 1 1 58 58 GLN C C 13 177.3 0.1 . 1 . . . . 731 GLN C . 16191 1 385 . 1 1 58 58 GLN CA C 13 58.4 0.1 . 1 . . . . 731 GLN CA . 16191 1 386 . 1 1 58 58 GLN CB C 13 28.53 0.1 . 1 . . . . 731 GLN CB . 16191 1 387 . 1 1 58 58 GLN CG C 13 34.09 0.1 . 1 . . . . 731 GLN CG . 16191 1 388 . 1 1 58 58 GLN N N 15 118.84 0.1 . 1 . . . . 731 GLN N . 16191 1 389 . 1 1 58 58 GLN NE2 N 15 112.27 0.1 . 1 . . . . 731 GLN NE2 . 16191 1 390 . 1 1 59 59 GLY H H 1 7.78 0.01 . 1 . . . . 732 GLY H . 16191 1 391 . 1 1 59 59 GLY HA2 H 1 4.42 0.01 . 2 . . . . 732 GLY HA2 . 16191 1 392 . 1 1 59 59 GLY HA3 H 1 3.69 0.01 . 2 . . . . 732 GLY HA3 . 16191 1 393 . 1 1 59 59 GLY C C 13 174 0.1 . 1 . . . . 732 GLY C . 16191 1 394 . 1 1 59 59 GLY CA C 13 44.88 0.1 . 1 . . . . 732 GLY CA . 16191 1 395 . 1 1 59 59 GLY N N 15 105.81 0.1 . 1 . . . . 732 GLY N . 16191 1 396 . 1 1 60 60 GLY H H 1 7.62 0.01 . 1 . . . . 733 GLY H . 16191 1 397 . 1 1 60 60 GLY HA2 H 1 3.89 0.01 . 2 . . . . 733 GLY HA2 . 16191 1 398 . 1 1 60 60 GLY HA3 H 1 3.69 0.01 . 2 . . . . 733 GLY HA3 . 16191 1 399 . 1 1 60 60 GLY C C 13 175.6 0.1 . 1 . . . . 733 GLY C . 16191 1 400 . 1 1 60 60 GLY CA C 13 45.71 0.1 . 1 . . . . 733 GLY CA . 16191 1 401 . 1 1 60 60 GLY N N 15 106.53 0.1 . 1 . . . . 733 GLY N . 16191 1 402 . 1 1 61 61 GLY H H 1 8.74 0.01 . 1 . . . . 734 GLY H . 16191 1 403 . 1 1 61 61 GLY HA2 H 1 4.36 0.01 . 2 . . . . 734 GLY HA2 . 16191 1 404 . 1 1 61 61 GLY HA3 H 1 3.44 0.01 . 2 . . . . 734 GLY HA3 . 16191 1 405 . 1 1 61 61 GLY C C 13 172.7 0.1 . 1 . . . . 734 GLY C . 16191 1 406 . 1 1 61 61 GLY CA C 13 44.86 0.1 . 1 . . . . 734 GLY CA . 16191 1 407 . 1 1 61 61 GLY N N 15 107.08 0.1 . 1 . . . . 734 GLY N . 16191 1 408 . 1 1 62 62 LYS H H 1 7.26 0.01 . 1 . . . . 735 LYS H . 16191 1 409 . 1 1 62 62 LYS HA H 1 5.19 0.01 . 1 . . . . 735 LYS HA . 16191 1 410 . 1 1 62 62 LYS HB2 H 1 1.82 0.01 . 2 . . . . 735 LYS HB2 . 16191 1 411 . 1 1 62 62 LYS HB3 H 1 1.68 0.01 . 2 . . . . 735 LYS HB3 . 16191 1 412 . 1 1 62 62 LYS HD2 H 1 1.56 0.01 . 1 . . . . 735 LYS HD2 . 16191 1 413 . 1 1 62 62 LYS HD3 H 1 1.56 0.01 . 1 . . . . 735 LYS HD3 . 16191 1 414 . 1 1 62 62 LYS HE2 H 1 2.93 0.01 . 1 . . . . 735 LYS HE2 . 16191 1 415 . 1 1 62 62 LYS HE3 H 1 2.93 0.01 . 1 . . . . 735 LYS HE3 . 16191 1 416 . 1 1 62 62 LYS HG2 H 1 1.23 0.01 . 1 . . . . 735 LYS HG2 . 16191 1 417 . 1 1 62 62 LYS HG3 H 1 1.23 0.01 . 1 . . . . 735 LYS HG3 . 16191 1 418 . 1 1 62 62 LYS C C 13 173.8 0.1 . 1 . . . . 735 LYS C . 16191 1 419 . 1 1 62 62 LYS CA C 13 55.08 0.1 . 1 . . . . 735 LYS CA . 16191 1 420 . 1 1 62 62 LYS CB C 13 35.05 0.1 . 1 . . . . 735 LYS CB . 16191 1 421 . 1 1 62 62 LYS CD C 13 29.73 0.1 . 1 . . . . 735 LYS CD . 16191 1 422 . 1 1 62 62 LYS CE C 13 42.2 0.1 . 1 . . . . 735 LYS CE . 16191 1 423 . 1 1 62 62 LYS CG C 13 23.21 0.1 . 1 . . . . 735 LYS CG . 16191 1 424 . 1 1 62 62 LYS N N 15 117.4 0.1 . 1 . . . . 735 LYS N . 16191 1 425 . 1 1 63 63 LEU H H 1 8.28 0.01 . 1 . . . . 736 LEU H . 16191 1 426 . 1 1 63 63 LEU HA H 1 4.86 0.01 . 1 . . . . 736 LEU HA . 16191 1 427 . 1 1 63 63 LEU HB2 H 1 1.64 0.01 . 2 . . . . 736 LEU HB2 . 16191 1 428 . 1 1 63 63 LEU HB3 H 1 1.43 0.01 . 2 . . . . 736 LEU HB3 . 16191 1 429 . 1 1 63 63 LEU HD11 H 1 0.93 0.01 . 1 . . . . 736 LEU HD11 . 16191 1 430 . 1 1 63 63 LEU HD12 H 1 0.93 0.01 . 1 . . . . 736 LEU HD12 . 16191 1 431 . 1 1 63 63 LEU HD13 H 1 0.93 0.01 . 1 . . . . 736 LEU HD13 . 16191 1 432 . 1 1 63 63 LEU HD21 H 1 0.93 0.01 . 1 . . . . 736 LEU HD21 . 16191 1 433 . 1 1 63 63 LEU HD22 H 1 0.93 0.01 . 1 . . . . 736 LEU HD22 . 16191 1 434 . 1 1 63 63 LEU HD23 H 1 0.93 0.01 . 1 . . . . 736 LEU HD23 . 16191 1 435 . 1 1 63 63 LEU HG H 1 0.76 0.01 . 1 . . . . 736 LEU HG . 16191 1 436 . 1 1 63 63 LEU C C 13 175.7 0.1 . 1 . . . . 736 LEU C . 16191 1 437 . 1 1 63 63 LEU CA C 13 54.1 0.1 . 1 . . . . 736 LEU CA . 16191 1 438 . 1 1 63 63 LEU CB C 13 48.4 0.1 . 1 . . . . 736 LEU CB . 16191 1 439 . 1 1 63 63 LEU CD1 C 13 24.82 0.1 . 1 . . . . 736 LEU CD1 . 16191 1 440 . 1 1 63 63 LEU CD2 C 13 24.82 0.1 . 1 . . . . 736 LEU CD2 . 16191 1 441 . 1 1 63 63 LEU CG C 13 27.16 0.1 . 1 . . . . 736 LEU CG . 16191 1 442 . 1 1 63 63 LEU N N 15 119.9 0.1 . 1 . . . . 736 LEU N . 16191 1 443 . 1 1 64 64 ASN H H 1 9.04 0.01 . 1 . . . . 737 ASN H . 16191 1 444 . 1 1 64 64 ASN HA H 1 5.15 0.01 . 1 . . . . 737 ASN HA . 16191 1 445 . 1 1 64 64 ASN HB2 H 1 3.28 0.01 . 2 . . . . 737 ASN HB2 . 16191 1 446 . 1 1 64 64 ASN HB3 H 1 2.92 0.01 . 2 . . . . 737 ASN HB3 . 16191 1 447 . 1 1 64 64 ASN C C 13 175 0.1 . 1 . . . . 737 ASN C . 16191 1 448 . 1 1 64 64 ASN CA C 13 52.03 0.1 . 1 . . . . 737 ASN CA . 16191 1 449 . 1 1 64 64 ASN CB C 13 38.89 0.1 . 1 . . . . 737 ASN CB . 16191 1 450 . 1 1 64 64 ASN N N 15 120.68 0.1 . 1 . . . . 737 ASN N . 16191 1 451 . 1 1 64 64 ASN ND2 N 15 112.28 0.1 . 1 . . . . 737 ASN ND2 . 16191 1 452 . 1 1 65 65 PHE H H 1 8.38 0.01 . 1 . . . . 738 PHE H . 16191 1 453 . 1 1 65 65 PHE HA H 1 3.66 0.01 . 1 . . . . 738 PHE HA . 16191 1 454 . 1 1 65 65 PHE HB2 H 1 2.77 0.01 . 2 . . . . 738 PHE HB2 . 16191 1 455 . 1 1 65 65 PHE HB3 H 1 2.53 0.01 . 2 . . . . 738 PHE HB3 . 16191 1 456 . 1 1 65 65 PHE HD1 H 1 6.49 0.01 . 3 . . . . 738 PHE HD1 . 16191 1 457 . 1 1 65 65 PHE HD2 H 1 6.49 0.01 . 3 . . . . 738 PHE HD2 . 16191 1 458 . 1 1 65 65 PHE HE1 H 1 7 0.01 . 3 . . . . 738 PHE HE1 . 16191 1 459 . 1 1 65 65 PHE HE2 H 1 7 0.01 . 3 . . . . 738 PHE HE2 . 16191 1 460 . 1 1 65 65 PHE HZ H 1 7.21 0.01 . 1 . . . . 738 PHE HZ . 16191 1 461 . 1 1 65 65 PHE CA C 13 60.3 0.1 . 1 . . . . 738 PHE CA . 16191 1 462 . 1 1 65 65 PHE CB C 13 38.45 0.1 . 1 . . . . 738 PHE CB . 16191 1 463 . 1 1 65 65 PHE CD1 C 13 131.07 0.1 . 3 . . . . 738 PHE CD1 . 16191 1 464 . 1 1 65 65 PHE CD2 C 13 131.07 0.1 . 3 . . . . 738 PHE CD2 . 16191 1 465 . 1 1 65 65 PHE CE1 C 13 130.4 0.1 . 3 . . . . 738 PHE CE1 . 16191 1 466 . 1 1 65 65 PHE CE2 C 13 130.4 0.1 . 3 . . . . 738 PHE CE2 . 16191 1 467 . 1 1 65 65 PHE CZ C 13 133.53 0.1 . 1 . . . . 738 PHE CZ . 16191 1 468 . 1 1 65 65 PHE N N 15 118.94 0.1 . 1 . . . . 738 PHE N . 16191 1 469 . 1 1 66 66 ASP H H 1 7.37 0.01 . 1 . . . . 739 ASP H . 16191 1 470 . 1 1 66 66 ASP C C 13 177.3 0.1 . 1 . . . . 739 ASP C . 16191 1 471 . 1 1 66 66 ASP CA C 13 59.66 0.1 . 1 . . . . 739 ASP CA . 16191 1 472 . 1 1 66 66 ASP CB C 13 40.9 0.1 . 1 . . . . 739 ASP CB . 16191 1 473 . 1 1 66 66 ASP N N 15 117.76 0.1 . 1 . . . . 739 ASP N . 16191 1 474 . 1 1 67 67 GLU H H 1 6.9 0.01 . 1 . . . . 740 GLU H . 16191 1 475 . 1 1 67 67 GLU HA H 1 4.15 0.01 . 1 . . . . 740 GLU HA . 16191 1 476 . 1 1 67 67 GLU HB2 H 1 2.08 0.01 . 2 . . . . 740 GLU HB2 . 16191 1 477 . 1 1 67 67 GLU HB3 H 1 1.97 0.01 . 2 . . . . 740 GLU HB3 . 16191 1 478 . 1 1 67 67 GLU C C 13 179.3 0.1 . 1 . . . . 740 GLU C . 16191 1 479 . 1 1 67 67 GLU CA C 13 59.02 0.1 . 1 . . . . 740 GLU CA . 16191 1 480 . 1 1 67 67 GLU CB C 13 28.23 0.1 . 1 . . . . 740 GLU CB . 16191 1 481 . 1 1 67 67 GLU N N 15 119.15 0.1 . 1 . . . . 740 GLU N . 16191 1 482 . 1 1 68 68 LEU H H 1 8.38 0.01 . 1 . . . . 741 LEU H . 16191 1 483 . 1 1 68 68 LEU HA H 1 4.05 0.01 . 1 . . . . 741 LEU HA . 16191 1 484 . 1 1 68 68 LEU HB2 H 1 1.92 0.01 . 2 . . . . 741 LEU HB2 . 16191 1 485 . 1 1 68 68 LEU HB3 H 1 1.54 0.01 . 2 . . . . 741 LEU HB3 . 16191 1 486 . 1 1 68 68 LEU HD11 H 1 0.59 0.01 . 2 . . . . 741 LEU HD11 . 16191 1 487 . 1 1 68 68 LEU HD12 H 1 0.59 0.01 . 2 . . . . 741 LEU HD12 . 16191 1 488 . 1 1 68 68 LEU HD13 H 1 0.59 0.01 . 2 . . . . 741 LEU HD13 . 16191 1 489 . 1 1 68 68 LEU HD21 H 1 0.55 0.01 . 2 . . . . 741 LEU HD21 . 16191 1 490 . 1 1 68 68 LEU HD22 H 1 0.55 0.01 . 2 . . . . 741 LEU HD22 . 16191 1 491 . 1 1 68 68 LEU HD23 H 1 0.55 0.01 . 2 . . . . 741 LEU HD23 . 16191 1 492 . 1 1 68 68 LEU HG H 1 1.89 0.01 . 1 . . . . 741 LEU HG . 16191 1 493 . 1 1 68 68 LEU C C 13 178 0.1 . 1 . . . . 741 LEU C . 16191 1 494 . 1 1 68 68 LEU CA C 13 57.63 0.1 . 1 . . . . 741 LEU CA . 16191 1 495 . 1 1 68 68 LEU CB C 13 41.7 0.1 . 1 . . . . 741 LEU CB . 16191 1 496 . 1 1 68 68 LEU CD1 C 13 25.99 0.1 . 2 . . . . 741 LEU CD1 . 16191 1 497 . 1 1 68 68 LEU CD2 C 13 22.19 0.1 . 2 . . . . 741 LEU CD2 . 16191 1 498 . 1 1 68 68 LEU CG C 13 27.09 0.1 . 1 . . . . 741 LEU CG . 16191 1 499 . 1 1 68 68 LEU N N 15 120.99 0.1 . 1 . . . . 741 LEU N . 16191 1 500 . 1 1 69 69 ARG H H 1 9.03 0.01 . 1 . . . . 742 ARG H . 16191 1 501 . 1 1 69 69 ARG HA H 1 3.72 0.01 . 1 . . . . 742 ARG HA . 16191 1 502 . 1 1 69 69 ARG HB2 H 1 1.97 0.01 . 1 . . . . 742 ARG HB2 . 16191 1 503 . 1 1 69 69 ARG HB3 H 1 1.97 0.01 . 1 . . . . 742 ARG HB3 . 16191 1 504 . 1 1 69 69 ARG HD2 H 1 3.1 0.01 . 1 . . . . 742 ARG HD2 . 16191 1 505 . 1 1 69 69 ARG HD3 H 1 3.1 0.01 . 1 . . . . 742 ARG HD3 . 16191 1 506 . 1 1 69 69 ARG HE H 1 6.96 0.01 . 1 . . . . 742 ARG HE . 16191 1 507 . 1 1 69 69 ARG HG2 H 1 1.73 0.01 . 2 . . . . 742 ARG HG2 . 16191 1 508 . 1 1 69 69 ARG HG3 H 1 1.55 0.01 . 2 . . . . 742 ARG HG3 . 16191 1 509 . 1 1 69 69 ARG C C 13 177.7 0.1 . 1 . . . . 742 ARG C . 16191 1 510 . 1 1 69 69 ARG CA C 13 60 0.1 . 1 . . . . 742 ARG CA . 16191 1 511 . 1 1 69 69 ARG CB C 13 29.84 0.1 . 1 . . . . 742 ARG CB . 16191 1 512 . 1 1 69 69 ARG CD C 13 43.81 0.1 . 1 . . . . 742 ARG CD . 16191 1 513 . 1 1 69 69 ARG CG C 13 27.51 0.1 . 1 . . . . 742 ARG CG . 16191 1 514 . 1 1 69 69 ARG N N 15 119.21 0.1 . 1 . . . . 742 ARG N . 16191 1 515 . 1 1 70 70 GLN H H 1 7.71 0.01 . 1 . . . . 743 GLN H . 16191 1 516 . 1 1 70 70 GLN HA H 1 3.92 0.01 . 1 . . . . 743 GLN HA . 16191 1 517 . 1 1 70 70 GLN HB2 H 1 2.14 0.01 . 1 . . . . 743 GLN HB2 . 16191 1 518 . 1 1 70 70 GLN HB3 H 1 2.14 0.01 . 1 . . . . 743 GLN HB3 . 16191 1 519 . 1 1 70 70 GLN HE21 H 1 7.83 0.01 . 2 . . . . 743 GLN HE21 . 16191 1 520 . 1 1 70 70 GLN HE22 H 1 7.1 0.01 . 2 . . . . 743 GLN HE22 . 16191 1 521 . 1 1 70 70 GLN HG2 H 1 2.54 0.01 . 1 . . . . 743 GLN HG2 . 16191 1 522 . 1 1 70 70 GLN HG3 H 1 2.54 0.01 . 1 . . . . 743 GLN HG3 . 16191 1 523 . 1 1 70 70 GLN C C 13 179 0.1 . 1 . . . . 743 GLN C . 16191 1 524 . 1 1 70 70 GLN CA C 13 58.91 0.1 . 1 . . . . 743 GLN CA . 16191 1 525 . 1 1 70 70 GLN CB C 13 28.21 0.1 . 1 . . . . 743 GLN CB . 16191 1 526 . 1 1 70 70 GLN CG C 13 34.12 0.1 . 1 . . . . 743 GLN CG . 16191 1 527 . 1 1 70 70 GLN N N 15 116.65 0.1 . 1 . . . . 743 GLN N . 16191 1 528 . 1 1 70 70 GLN NE2 N 15 116.58 0.1 . 1 . . . . 743 GLN NE2 . 16191 1 529 . 1 1 71 71 ASP H H 1 7.78 0.01 . 1 . . . . 744 ASP H . 16191 1 530 . 1 1 71 71 ASP HA H 1 4.43 0.01 . 1 . . . . 744 ASP HA . 16191 1 531 . 1 1 71 71 ASP HB2 H 1 2.71 0.01 . 1 . . . . 744 ASP HB2 . 16191 1 532 . 1 1 71 71 ASP HB3 H 1 2.71 0.01 . 1 . . . . 744 ASP HB3 . 16191 1 533 . 1 1 71 71 ASP C C 13 179.3 0.1 . 1 . . . . 744 ASP C . 16191 1 534 . 1 1 71 71 ASP CA C 13 56.95 0.1 . 1 . . . . 744 ASP CA . 16191 1 535 . 1 1 71 71 ASP CB C 13 41.19 0.1 . 1 . . . . 744 ASP CB . 16191 1 536 . 1 1 71 71 ASP N N 15 120.03 0.1 . 1 . . . . 744 ASP N . 16191 1 537 . 1 1 72 72 LEU H H 1 8.61 0.01 . 1 . . . . 745 LEU H . 16191 1 538 . 1 1 72 72 LEU HA H 1 4.09 0.01 . 1 . . . . 745 LEU HA . 16191 1 539 . 1 1 72 72 LEU HB2 H 1 1.77 0.01 . 1 . . . . 745 LEU HB2 . 16191 1 540 . 1 1 72 72 LEU HB3 H 1 1.77 0.01 . 1 . . . . 745 LEU HB3 . 16191 1 541 . 1 1 72 72 LEU HD11 H 1 0.91 0.01 . 2 . . . . 745 LEU HD11 . 16191 1 542 . 1 1 72 72 LEU HD12 H 1 0.91 0.01 . 2 . . . . 745 LEU HD12 . 16191 1 543 . 1 1 72 72 LEU HD13 H 1 0.91 0.01 . 2 . . . . 745 LEU HD13 . 16191 1 544 . 1 1 72 72 LEU HD21 H 1 0.62 0.01 . 2 . . . . 745 LEU HD21 . 16191 1 545 . 1 1 72 72 LEU HD22 H 1 0.62 0.01 . 2 . . . . 745 LEU HD22 . 16191 1 546 . 1 1 72 72 LEU HD23 H 1 0.62 0.01 . 2 . . . . 745 LEU HD23 . 16191 1 547 . 1 1 72 72 LEU C C 13 178.7 0.1 . 1 . . . . 745 LEU C . 16191 1 548 . 1 1 72 72 LEU CA C 13 57.06 0.1 . 1 . . . . 745 LEU CA . 16191 1 549 . 1 1 72 72 LEU CB C 13 42.29 0.1 . 1 . . . . 745 LEU CB . 16191 1 550 . 1 1 72 72 LEU CD1 C 13 25.53 0.1 . 2 . . . . 745 LEU CD1 . 16191 1 551 . 1 1 72 72 LEU CD2 C 13 23.89 0.1 . 2 . . . . 745 LEU CD2 . 16191 1 552 . 1 1 72 72 LEU CG C 13 27.01 0.1 . 1 . . . . 745 LEU CG . 16191 1 553 . 1 1 72 72 LEU N N 15 116.34 0.1 . 1 . . . . 745 LEU N . 16191 1 554 . 1 1 73 73 LYS H H 1 8.86 0.01 . 1 . . . . 746 LYS H . 16191 1 555 . 1 1 73 73 LYS HA H 1 4.45 0.01 . 1 . . . . 746 LYS HA . 16191 1 556 . 1 1 73 73 LYS HB2 H 1 1.8 0.01 . 1 . . . . 746 LYS HB2 . 16191 1 557 . 1 1 73 73 LYS HB3 H 1 1.8 0.01 . 1 . . . . 746 LYS HB3 . 16191 1 558 . 1 1 73 73 LYS HD2 H 1 1.61 0.01 . 1 . . . . 746 LYS HD2 . 16191 1 559 . 1 1 73 73 LYS HD3 H 1 1.61 0.01 . 1 . . . . 746 LYS HD3 . 16191 1 560 . 1 1 73 73 LYS HE2 H 1 2.74 0.01 . 1 . . . . 746 LYS HE2 . 16191 1 561 . 1 1 73 73 LYS HE3 H 1 2.74 0.01 . 1 . . . . 746 LYS HE3 . 16191 1 562 . 1 1 73 73 LYS HG2 H 1 1.45 0.01 . 1 . . . . 746 LYS HG2 . 16191 1 563 . 1 1 73 73 LYS HG3 H 1 1.45 0.01 . 1 . . . . 746 LYS HG3 . 16191 1 564 . 1 1 73 73 LYS CA C 13 57.39 0.1 . 1 . . . . 746 LYS CA . 16191 1 565 . 1 1 73 73 LYS CB C 13 33.05 0.1 . 1 . . . . 746 LYS CB . 16191 1 566 . 1 1 73 73 LYS CD C 13 29.5 0.1 . 1 . . . . 746 LYS CD . 16191 1 567 . 1 1 73 73 LYS CE C 13 42.2 0.1 . 1 . . . . 746 LYS CE . 16191 1 568 . 1 1 73 73 LYS CG C 13 25.7 0.1 . 1 . . . . 746 LYS CG . 16191 1 569 . 1 1 73 73 LYS N N 15 121.65 0.1 . 1 . . . . 746 LYS N . 16191 1 570 . 1 1 74 74 GLY H H 1 7.94 0.01 . 1 . . . . 747 GLY H . 16191 1 571 . 1 1 74 74 GLY HA2 H 1 4.05 0.01 . 1 . . . . 747 GLY HA2 . 16191 1 572 . 1 1 74 74 GLY HA3 H 1 4.05 0.01 . 1 . . . . 747 GLY HA3 . 16191 1 573 . 1 1 74 74 GLY C C 13 175.5 0.1 . 1 . . . . 747 GLY C . 16191 1 574 . 1 1 74 74 GLY CA C 13 46.49 0.1 . 1 . . . . 747 GLY CA . 16191 1 575 . 1 1 74 74 GLY N N 15 108.21 0.1 . 1 . . . . 747 GLY N . 16191 1 576 . 1 1 75 75 LYS H H 1 7.29 0.01 . 1 . . . . 748 LYS H . 16191 1 577 . 1 1 75 75 LYS HA H 1 4.43 0.01 . 1 . . . . 748 LYS HA . 16191 1 578 . 1 1 75 75 LYS HB2 H 1 1.71 0.01 . 1 . . . . 748 LYS HB2 . 16191 1 579 . 1 1 75 75 LYS HB3 H 1 1.71 0.01 . 1 . . . . 748 LYS HB3 . 16191 1 580 . 1 1 75 75 LYS HD2 H 1 1.45 0.01 . 2 . . . . 748 LYS HD2 . 16191 1 581 . 1 1 75 75 LYS HD3 H 1 1.38 0.01 . 2 . . . . 748 LYS HD3 . 16191 1 582 . 1 1 75 75 LYS HE2 H 1 2.7 0.01 . 1 . . . . 748 LYS HE2 . 16191 1 583 . 1 1 75 75 LYS HE3 H 1 2.7 0.01 . 1 . . . . 748 LYS HE3 . 16191 1 584 . 1 1 75 75 LYS HG2 H 1 1.57 0.01 . 1 . . . . 748 LYS HG2 . 16191 1 585 . 1 1 75 75 LYS HG3 H 1 1.57 0.01 . 1 . . . . 748 LYS HG3 . 16191 1 586 . 1 1 75 75 LYS C C 13 175.2 0.1 . 1 . . . . 748 LYS C . 16191 1 587 . 1 1 75 75 LYS CA C 13 55.84 0.1 . 1 . . . . 748 LYS CA . 16191 1 588 . 1 1 75 75 LYS CB C 13 33.89 0.1 . 1 . . . . 748 LYS CB . 16191 1 589 . 1 1 75 75 LYS CD C 13 29.43 0.1 . 1 . . . . 748 LYS CD . 16191 1 590 . 1 1 75 75 LYS CE C 13 42.42 0.1 . 1 . . . . 748 LYS CE . 16191 1 591 . 1 1 75 75 LYS CG C 13 25.99 0.1 . 1 . . . . 748 LYS CG . 16191 1 592 . 1 1 75 75 LYS N N 15 118.22 0.1 . 1 . . . . 748 LYS N . 16191 1 593 . 1 1 76 76 GLY H H 1 7.82 0.01 . 1 . . . . 749 GLY H . 16191 1 594 . 1 1 76 76 GLY HA2 H 1 4.22 0.01 . 2 . . . . 749 GLY HA2 . 16191 1 595 . 1 1 76 76 GLY HA3 H 1 4.06 0.01 . 2 . . . . 749 GLY HA3 . 16191 1 596 . 1 1 76 76 GLY C C 13 174.5 0.1 . 1 . . . . 749 GLY C . 16191 1 597 . 1 1 76 76 GLY CA C 13 45.94 0.1 . 1 . . . . 749 GLY CA . 16191 1 598 . 1 1 76 76 GLY N N 15 106.56 0.1 . 1 . . . . 749 GLY N . 16191 1 599 . 1 1 77 77 HIS H H 1 7.76 0.01 . 1 . . . . 750 HIS H . 16191 1 600 . 1 1 77 77 HIS HA H 1 4.34 0.01 . 1 . . . . 750 HIS HA . 16191 1 601 . 1 1 77 77 HIS HB2 H 1 3.06 0.01 . 1 . . . . 750 HIS HB2 . 16191 1 602 . 1 1 77 77 HIS HB3 H 1 3.06 0.01 . 1 . . . . 750 HIS HB3 . 16191 1 603 . 1 1 77 77 HIS HD2 H 1 7.3 0.01 . 1 . . . . 750 HIS HD2 . 16191 1 604 . 1 1 77 77 HIS HE1 H 1 8.23 0.01 . 1 . . . . 750 HIS HE1 . 16191 1 605 . 1 1 77 77 HIS C C 13 174.8 0.1 . 1 . . . . 750 HIS C . 16191 1 606 . 1 1 77 77 HIS CA C 13 55.04 0.1 . 1 . . . . 750 HIS CA . 16191 1 607 . 1 1 77 77 HIS CB C 13 29.03 0.1 . 1 . . . . 750 HIS CB . 16191 1 608 . 1 1 77 77 HIS CD2 C 13 122.98 0.1 . 1 . . . . 750 HIS CD2 . 16191 1 609 . 1 1 77 77 HIS CE1 C 13 137.36 0.1 . 1 . . . . 750 HIS CE1 . 16191 1 610 . 1 1 77 77 HIS N N 15 118.26 0.1 . 1 . . . . 750 HIS N . 16191 1 611 . 1 1 78 78 THR H H 1 9.02 0.01 . 1 . . . . 751 THR H . 16191 1 612 . 1 1 78 78 THR HA H 1 4.44 0.01 . 1 . . . . 751 THR HA . 16191 1 613 . 1 1 78 78 THR HB H 1 4.73 0.01 . 1 . . . . 751 THR HB . 16191 1 614 . 1 1 78 78 THR HG21 H 1 1.21 0.01 . 1 . . . . 751 THR HG2 . 16191 1 615 . 1 1 78 78 THR HG22 H 1 1.21 0.01 . 1 . . . . 751 THR HG2 . 16191 1 616 . 1 1 78 78 THR HG23 H 1 1.21 0.01 . 1 . . . . 751 THR HG2 . 16191 1 617 . 1 1 78 78 THR C C 13 175 0.1 . 1 . . . . 751 THR C . 16191 1 618 . 1 1 78 78 THR CA C 13 60.59 0.1 . 1 . . . . 751 THR CA . 16191 1 619 . 1 1 78 78 THR CB C 13 71.01 0.1 . 1 . . . . 751 THR CB . 16191 1 620 . 1 1 78 78 THR CG2 C 13 21.57 0.1 . 1 . . . . 751 THR CG2 . 16191 1 621 . 1 1 78 78 THR N N 15 113.85 0.1 . 1 . . . . 751 THR N . 16191 1 622 . 1 1 79 79 ASP H H 1 8.84 0.01 . 1 . . . . 752 ASP H . 16191 1 623 . 1 1 79 79 ASP HA H 1 4.67 0.01 . 1 . . . . 752 ASP HA . 16191 1 624 . 1 1 79 79 ASP HB2 H 1 2.7 0.01 . 2 . . . . 752 ASP HB2 . 16191 1 625 . 1 1 79 79 ASP HB3 H 1 2.64 0.01 . 2 . . . . 752 ASP HB3 . 16191 1 626 . 1 1 79 79 ASP C C 13 178.2 0.1 . 1 . . . . 752 ASP C . 16191 1 627 . 1 1 79 79 ASP CA C 13 58.13 0.1 . 1 . . . . 752 ASP CA . 16191 1 628 . 1 1 79 79 ASP CB C 13 40.53 0.1 . 1 . . . . 752 ASP CB . 16191 1 629 . 1 1 79 79 ASP N N 15 120.75 0.1 . 1 . . . . 752 ASP N . 16191 1 630 . 1 1 80 80 ALA H H 1 8.45 0.01 . 1 . . . . 753 ALA H . 16191 1 631 . 1 1 80 80 ALA HA H 1 4.13 0.01 . 1 . . . . 753 ALA HA . 16191 1 632 . 1 1 80 80 ALA HB1 H 1 1.42 0.01 . 1 . . . . 753 ALA HB1 . 16191 1 633 . 1 1 80 80 ALA HB2 H 1 1.42 0.01 . 1 . . . . 753 ALA HB2 . 16191 1 634 . 1 1 80 80 ALA HB3 H 1 1.42 0.01 . 1 . . . . 753 ALA HB3 . 16191 1 635 . 1 1 80 80 ALA C C 13 180.9 0.1 . 1 . . . . 753 ALA C . 16191 1 636 . 1 1 80 80 ALA CA C 13 55.08 0.1 . 1 . . . . 753 ALA CA . 16191 1 637 . 1 1 80 80 ALA CB C 13 18.04 0.1 . 1 . . . . 753 ALA CB . 16191 1 638 . 1 1 80 80 ALA N N 15 120.1 0.1 . 1 . . . . 753 ALA N . 16191 1 639 . 1 1 81 81 GLU H H 1 8.38 0.01 . 1 . . . . 754 GLU H . 16191 1 640 . 1 1 81 81 GLU HA H 1 4 0.01 . 1 . . . . 754 GLU HA . 16191 1 641 . 1 1 81 81 GLU HB2 H 1 2.17 0.01 . 2 . . . . 754 GLU HB2 . 16191 1 642 . 1 1 81 81 GLU HB3 H 1 2.32 0.01 . 2 . . . . 754 GLU HB3 . 16191 1 643 . 1 1 81 81 GLU CA C 13 59.11 0.1 . 1 . . . . 754 GLU CA . 16191 1 644 . 1 1 81 81 GLU CB C 13 29.79 0.1 . 1 . . . . 754 GLU CB . 16191 1 645 . 1 1 81 81 GLU CG C 13 35.66 0.1 . 1 . . . . 754 GLU CG . 16191 1 646 . 1 1 81 81 GLU N N 15 120.03 0.1 . 1 . . . . 754 GLU N . 16191 1 647 . 1 1 82 82 ILE H H 1 8.02 0.01 . 1 . . . . 755 ILE H . 16191 1 648 . 1 1 82 82 ILE HA H 1 3.24 0.01 . 1 . . . . 755 ILE HA . 16191 1 649 . 1 1 82 82 ILE HB H 1 1.8 0.01 . 1 . . . . 755 ILE HB . 16191 1 650 . 1 1 82 82 ILE HD11 H 1 0.72 0.01 . 1 . . . . 755 ILE HD11 . 16191 1 651 . 1 1 82 82 ILE HD12 H 1 0.72 0.01 . 1 . . . . 755 ILE HD12 . 16191 1 652 . 1 1 82 82 ILE HD13 H 1 0.72 0.01 . 1 . . . . 755 ILE HD13 . 16191 1 653 . 1 1 82 82 ILE HG12 H 1 0.67 0.01 . 1 . . . . 755 ILE HG12 . 16191 1 654 . 1 1 82 82 ILE HG13 H 1 0.67 0.01 . 1 . . . . 755 ILE HG13 . 16191 1 655 . 1 1 82 82 ILE HG21 H 1 0.46 0.01 . 1 . . . . 755 ILE HG21 . 16191 1 656 . 1 1 82 82 ILE HG22 H 1 0.46 0.01 . 1 . . . . 755 ILE HG22 . 16191 1 657 . 1 1 82 82 ILE HG23 H 1 0.46 0.01 . 1 . . . . 755 ILE HG23 . 16191 1 658 . 1 1 82 82 ILE C C 13 177.2 0.1 . 1 . . . . 755 ILE C . 16191 1 659 . 1 1 82 82 ILE CA C 13 65.51 0.1 . 1 . . . . 755 ILE CA . 16191 1 660 . 1 1 82 82 ILE CB C 13 38.41 0.1 . 1 . . . . 755 ILE CB . 16191 1 661 . 1 1 82 82 ILE CD1 C 13 15.16 0.1 . 1 . . . . 755 ILE CD1 . 16191 1 662 . 1 1 82 82 ILE CG1 C 13 28.51 0.1 . 1 . . . . 755 ILE CG1 . 16191 1 663 . 1 1 82 82 ILE CG2 C 13 17.5 0.1 . 1 . . . . 755 ILE CG2 . 16191 1 664 . 1 1 82 82 ILE N N 15 118.53 0.1 . 1 . . . . 755 ILE N . 16191 1 665 . 1 1 83 83 GLU H H 1 8.62 0.01 . 1 . . . . 756 GLU H . 16191 1 666 . 1 1 83 83 GLU HA H 1 4.13 0.01 . 1 . . . . 756 GLU HA . 16191 1 667 . 1 1 83 83 GLU HB2 H 1 2.05 0.01 . 1 . . . . 756 GLU HB2 . 16191 1 668 . 1 1 83 83 GLU HB3 H 1 2.05 0.01 . 1 . . . . 756 GLU HB3 . 16191 1 669 . 1 1 83 83 GLU HG2 H 1 2.27 0.01 . 1 . . . . 756 GLU HG2 . 16191 1 670 . 1 1 83 83 GLU HG3 H 1 2.27 0.01 . 1 . . . . 756 GLU HG3 . 16191 1 671 . 1 1 83 83 GLU C C 13 179 0.1 . 1 . . . . 756 GLU C . 16191 1 672 . 1 1 83 83 GLU CA C 13 59.56 0.1 . 1 . . . . 756 GLU CA . 16191 1 673 . 1 1 83 83 GLU CB C 13 29.26 0.1 . 1 . . . . 756 GLU CB . 16191 1 674 . 1 1 83 83 GLU CG C 13 36.83 0.1 . 1 . . . . 756 GLU CG . 16191 1 675 . 1 1 83 83 GLU N N 15 117.98 0.1 . 1 . . . . 756 GLU N . 16191 1 676 . 1 1 84 84 ALA H H 1 7.71 0.01 . 1 . . . . 757 ALA H . 16191 1 677 . 1 1 84 84 ALA HA H 1 4.13 0.01 . 1 . . . . 757 ALA HA . 16191 1 678 . 1 1 84 84 ALA HB1 H 1 1.54 0.01 . 1 . . . . 757 ALA HB1 . 16191 1 679 . 1 1 84 84 ALA HB2 H 1 1.54 0.01 . 1 . . . . 757 ALA HB2 . 16191 1 680 . 1 1 84 84 ALA HB3 H 1 1.54 0.01 . 1 . . . . 757 ALA HB3 . 16191 1 681 . 1 1 84 84 ALA C C 13 178.5 0.1 . 1 . . . . 757 ALA C . 16191 1 682 . 1 1 84 84 ALA CA C 13 55.08 0.1 . 1 . . . . 757 ALA CA . 16191 1 683 . 1 1 84 84 ALA CB C 13 18.52 0.1 . 1 . . . . 757 ALA CB . 16191 1 684 . 1 1 84 84 ALA N N 15 121.37 0.1 . 1 . . . . 757 ALA N . 16191 1 685 . 1 1 85 85 ILE H H 1 7.95 0.01 . 1 . . . . 758 ILE H . 16191 1 686 . 1 1 85 85 ILE HA H 1 3.8 0.01 . 1 . . . . 758 ILE HA . 16191 1 687 . 1 1 85 85 ILE HB H 1 1.97 0.01 . 1 . . . . 758 ILE HB . 16191 1 688 . 1 1 85 85 ILE HD11 H 1 0.77 0.01 . 1 . . . . 758 ILE HD11 . 16191 1 689 . 1 1 85 85 ILE HD12 H 1 0.77 0.01 . 1 . . . . 758 ILE HD12 . 16191 1 690 . 1 1 85 85 ILE HD13 H 1 0.77 0.01 . 1 . . . . 758 ILE HD13 . 16191 1 691 . 1 1 85 85 ILE HG12 H 1 1.12 0.01 . 1 . . . . 758 ILE HG12 . 16191 1 692 . 1 1 85 85 ILE HG13 H 1 1.12 0.01 . 1 . . . . 758 ILE HG13 . 16191 1 693 . 1 1 85 85 ILE HG21 H 1 0.92 0.01 . 1 . . . . 758 ILE HG21 . 16191 1 694 . 1 1 85 85 ILE HG22 H 1 0.92 0.01 . 1 . . . . 758 ILE HG22 . 16191 1 695 . 1 1 85 85 ILE HG23 H 1 0.92 0.01 . 1 . . . . 758 ILE HG23 . 16191 1 696 . 1 1 85 85 ILE C C 13 177.4 0.1 . 1 . . . . 758 ILE C . 16191 1 697 . 1 1 85 85 ILE CA C 13 64.92 0.1 . 1 . . . . 758 ILE CA . 16191 1 698 . 1 1 85 85 ILE CB C 13 38.56 0.1 . 1 . . . . 758 ILE CB . 16191 1 699 . 1 1 85 85 ILE CD1 C 13 14.24 0.1 . 1 . . . . 758 ILE CD1 . 16191 1 700 . 1 1 85 85 ILE CG1 C 13 29.95 0.1 . 1 . . . . 758 ILE CG1 . 16191 1 701 . 1 1 85 85 ILE CG2 C 13 17.7 0.1 . 1 . . . . 758 ILE CG2 . 16191 1 702 . 1 1 85 85 ILE N N 15 119.78 0.1 . 1 . . . . 758 ILE N . 16191 1 703 . 1 1 86 86 PHE H H 1 8.54 0.01 . 1 . . . . 759 PHE H . 16191 1 704 . 1 1 86 86 PHE HA H 1 4.15 0.01 . 1 . . . . 759 PHE HA . 16191 1 705 . 1 1 86 86 PHE HB2 H 1 3.07 0.01 . 2 . . . . 759 PHE HB2 . 16191 1 706 . 1 1 86 86 PHE HB3 H 1 3.07 0.01 . 2 . . . . 759 PHE HB3 . 16191 1 707 . 1 1 86 86 PHE HD1 H 1 6.61 0.01 . 3 . . . . 759 PHE HD1 . 16191 1 708 . 1 1 86 86 PHE HD2 H 1 6.61 0.01 . 3 . . . . 759 PHE HD2 . 16191 1 709 . 1 1 86 86 PHE HE1 H 1 7.03 0.01 . 3 . . . . 759 PHE HE1 . 16191 1 710 . 1 1 86 86 PHE HE2 H 1 7.03 0.01 . 3 . . . . 759 PHE HE2 . 16191 1 711 . 1 1 86 86 PHE HZ H 1 7.16 0.01 . 1 . . . . 759 PHE HZ . 16191 1 712 . 1 1 86 86 PHE C C 13 177.4 0.1 . 1 . . . . 759 PHE C . 16191 1 713 . 1 1 86 86 PHE CA C 13 61.1 0.1 . 1 . . . . 759 PHE CA . 16191 1 714 . 1 1 86 86 PHE CB C 13 38.84 0.1 . 1 . . . . 759 PHE CB . 16191 1 715 . 1 1 86 86 PHE CD1 C 13 131.34 0.1 . 3 . . . . 759 PHE CD1 . 16191 1 716 . 1 1 86 86 PHE CD2 C 13 131.34 0.1 . 3 . . . . 759 PHE CD2 . 16191 1 717 . 1 1 86 86 PHE CE1 C 13 130.72 0.1 . 3 . . . . 759 PHE CE1 . 16191 1 718 . 1 1 86 86 PHE CE2 C 13 130.72 0.1 . 3 . . . . 759 PHE CE2 . 16191 1 719 . 1 1 86 86 PHE CZ C 13 133.22 0.1 . 1 . . . . 759 PHE CZ . 16191 1 720 . 1 1 86 86 PHE N N 15 120.27 0.1 . 1 . . . . 759 PHE N . 16191 1 721 . 1 1 87 87 THR H H 1 8.41 0.01 . 1 . . . . 760 THR H . 16191 1 722 . 1 1 87 87 THR HA H 1 3.95 0.01 . 1 . . . . 760 THR HA . 16191 1 723 . 1 1 87 87 THR HB H 1 4.19 0.01 . 1 . . . . 760 THR HB . 16191 1 724 . 1 1 87 87 THR HG21 H 1 1.31 0.01 . 1 . . . . 760 THR HG2 . 16191 1 725 . 1 1 87 87 THR HG22 H 1 1.31 0.01 . 1 . . . . 760 THR HG2 . 16191 1 726 . 1 1 87 87 THR HG23 H 1 1.31 0.01 . 1 . . . . 760 THR HG2 . 16191 1 727 . 1 1 87 87 THR C C 13 176.1 0.1 . 1 . . . . 760 THR C . 16191 1 728 . 1 1 87 87 THR CA C 13 65.98 0.1 . 1 . . . . 760 THR CA . 16191 1 729 . 1 1 87 87 THR CB C 13 69.02 0.1 . 1 . . . . 760 THR CB . 16191 1 730 . 1 1 87 87 THR CG2 C 13 22.04 0.1 . 1 . . . . 760 THR CG2 . 16191 1 731 . 1 1 87 87 THR N N 15 111.79 0.1 . 1 . . . . 760 THR N . 16191 1 732 . 1 1 88 88 LYS H H 1 7.46 0.01 . 1 . . . . 761 LYS H . 16191 1 733 . 1 1 88 88 LYS HA H 1 3.87 0.01 . 1 . . . . 761 LYS HA . 16191 1 734 . 1 1 88 88 LYS HB2 H 1 1.59 0.01 . 2 . . . . 761 LYS HB2 . 16191 1 735 . 1 1 88 88 LYS HB3 H 1 1.47 0.01 . 2 . . . . 761 LYS HB3 . 16191 1 736 . 1 1 88 88 LYS HD2 H 1 1.45 0.01 . 2 . . . . 761 LYS HD2 . 16191 1 737 . 1 1 88 88 LYS HD3 H 1 1.37 0.01 . 2 . . . . 761 LYS HD3 . 16191 1 738 . 1 1 88 88 LYS HE2 H 1 2.62 0.01 . 1 . . . . 761 LYS HE2 . 16191 1 739 . 1 1 88 88 LYS HE3 H 1 2.62 0.01 . 1 . . . . 761 LYS HE3 . 16191 1 740 . 1 1 88 88 LYS HG2 H 1 0.16 0.01 . 1 . . . . 761 LYS HG2 . 16191 1 741 . 1 1 88 88 LYS HG3 H 1 0.16 0.01 . 1 . . . . 761 LYS HG3 . 16191 1 742 . 1 1 88 88 LYS C C 13 177.7 0.1 . 1 . . . . 761 LYS C . 16191 1 743 . 1 1 88 88 LYS CA C 13 58.65 0.1 . 1 . . . . 761 LYS CA . 16191 1 744 . 1 1 88 88 LYS CB C 13 33.13 0.1 . 1 . . . . 761 LYS CB . 16191 1 745 . 1 1 88 88 LYS CD C 13 29.36 0.1 . 1 . . . . 761 LYS CD . 16191 1 746 . 1 1 88 88 LYS CE C 13 42.39 0.1 . 1 . . . . 761 LYS CE . 16191 1 747 . 1 1 88 88 LYS CG C 13 24.96 0.1 . 1 . . . . 761 LYS CG . 16191 1 748 . 1 1 88 88 LYS N N 15 119.31 0.1 . 1 . . . . 761 LYS N . 16191 1 749 . 1 1 89 89 TYR H H 1 7.93 0.01 . 1 . . . . 762 TYR H . 16191 1 750 . 1 1 89 89 TYR HA H 1 4.47 0.01 . 1 . . . . 762 TYR HA . 16191 1 751 . 1 1 89 89 TYR HB2 H 1 3.06 0.01 . 2 . . . . 762 TYR HB2 . 16191 1 752 . 1 1 89 89 TYR HB3 H 1 2.98 0.01 . 2 . . . . 762 TYR HB3 . 16191 1 753 . 1 1 89 89 TYR HD1 H 1 7.49 0.01 . 3 . . . . 762 TYR HD1 . 16191 1 754 . 1 1 89 89 TYR HD2 H 1 7.49 0.01 . 3 . . . . 762 TYR HD2 . 16191 1 755 . 1 1 89 89 TYR HE1 H 1 6.64 0.01 . 3 . . . . 762 TYR HE1 . 16191 1 756 . 1 1 89 89 TYR HE2 H 1 6.64 0.01 . 3 . . . . 762 TYR HE2 . 16191 1 757 . 1 1 89 89 TYR C C 13 176.4 0.1 . 1 . . . . 762 TYR C . 16191 1 758 . 1 1 89 89 TYR CA C 13 60.84 0.1 . 1 . . . . 762 TYR CA . 16191 1 759 . 1 1 89 89 TYR CB C 13 38.56 0.1 . 1 . . . . 762 TYR CB . 16191 1 760 . 1 1 89 89 TYR CD1 C 13 133.65 0.1 . 3 . . . . 762 TYR CD1 . 16191 1 761 . 1 1 89 89 TYR CD2 C 13 133.65 0.1 . 3 . . . . 762 TYR CD2 . 16191 1 762 . 1 1 89 89 TYR CE1 C 13 117.36 0.1 . 3 . . . . 762 TYR CE1 . 16191 1 763 . 1 1 89 89 TYR CE2 C 13 117.36 0.1 . 3 . . . . 762 TYR CE2 . 16191 1 764 . 1 1 89 89 TYR N N 15 111.83 0.1 . 1 . . . . 762 TYR N . 16191 1 765 . 1 1 90 90 ASP H H 1 7.92 0.01 . 1 . . . . 763 ASP H . 16191 1 766 . 1 1 90 90 ASP HA H 1 4.97 0.01 . 1 . . . . 763 ASP HA . 16191 1 767 . 1 1 90 90 ASP HB2 H 1 2.9 0.01 . 2 . . . . 763 ASP HB2 . 16191 1 768 . 1 1 90 90 ASP HB3 H 1 2.74 0.01 . 2 . . . . 763 ASP HB3 . 16191 1 769 . 1 1 90 90 ASP C C 13 177.8 0.1 . 1 . . . . 763 ASP C . 16191 1 770 . 1 1 90 90 ASP CA C 13 53.2 0.1 . 1 . . . . 763 ASP CA . 16191 1 771 . 1 1 90 90 ASP CB C 13 39.17 0.1 . 1 . . . . 763 ASP CB . 16191 1 772 . 1 1 90 90 ASP N N 15 120.72 0.1 . 1 . . . . 763 ASP N . 16191 1 773 . 1 1 91 91 GLN H H 1 7.89 0.01 . 1 . . . . 764 GLN H . 16191 1 774 . 1 1 91 91 GLN HA H 1 4.61 0.01 . 1 . . . . 764 GLN HA . 16191 1 775 . 1 1 91 91 GLN HB2 H 1 2.1 0.01 . 1 . . . . 764 GLN HB2 . 16191 1 776 . 1 1 91 91 GLN HB3 H 1 2.1 0.01 . 1 . . . . 764 GLN HB3 . 16191 1 777 . 1 1 91 91 GLN HE21 H 1 7.86 0.01 . 2 . . . . 764 GLN HE21 . 16191 1 778 . 1 1 91 91 GLN HE22 H 1 7 0.01 . 2 . . . . 764 GLN HE22 . 16191 1 779 . 1 1 91 91 GLN HG2 H 1 2.5 0.01 . 1 . . . . 764 GLN HG2 . 16191 1 780 . 1 1 91 91 GLN HG3 H 1 2.5 0.01 . 1 . . . . 764 GLN HG3 . 16191 1 781 . 1 1 91 91 GLN C C 13 176.8 0.1 . 1 . . . . 764 GLN C . 16191 1 782 . 1 1 91 91 GLN CA C 13 58.92 0.1 . 1 . . . . 764 GLN CA . 16191 1 783 . 1 1 91 91 GLN CB C 13 29.28 0.1 . 1 . . . . 764 GLN CB . 16191 1 784 . 1 1 91 91 GLN CG C 13 34.19 0.1 . 1 . . . . 764 GLN CG . 16191 1 785 . 1 1 91 91 GLN N N 15 125.88 0.1 . 1 . . . . 764 GLN N . 16191 1 786 . 1 1 91 91 GLN NE2 N 15 112.24 0.1 . 1 . . . . 764 GLN NE2 . 16191 1 787 . 1 1 92 92 ASP H H 1 8.05 0.01 . 1 . . . . 765 ASP H . 16191 1 788 . 1 1 92 92 ASP HA H 1 4.61 0.01 . 1 . . . . 765 ASP HA . 16191 1 789 . 1 1 92 92 ASP HB2 H 1 2.98 0.01 . 2 . . . . 765 ASP HB2 . 16191 1 790 . 1 1 92 92 ASP HB3 H 1 2.65 0.01 . 2 . . . . 765 ASP HB3 . 16191 1 791 . 1 1 92 92 ASP C C 13 177.6 0.1 . 1 . . . . 765 ASP C . 16191 1 792 . 1 1 92 92 ASP CA C 13 52.38 0.1 . 1 . . . . 765 ASP CA . 16191 1 793 . 1 1 92 92 ASP CB C 13 39.42 0.1 . 1 . . . . 765 ASP CB . 16191 1 794 . 1 1 92 92 ASP N N 15 114.26 0.1 . 1 . . . . 765 ASP N . 16191 1 795 . 1 1 93 93 GLY H H 1 7.62 0.01 . 1 . . . . 766 GLY H . 16191 1 796 . 1 1 93 93 GLY HA2 H 1 3.86 0.01 . 1 . . . . 766 GLY HA2 . 16191 1 797 . 1 1 93 93 GLY HA3 H 1 3.86 0.01 . 1 . . . . 766 GLY HA3 . 16191 1 798 . 1 1 93 93 GLY C C 13 174.7 0.1 . 1 . . . . 766 GLY C . 16191 1 799 . 1 1 93 93 GLY CA C 13 47.11 0.1 . 1 . . . . 766 GLY CA . 16191 1 800 . 1 1 93 93 GLY N N 15 108.44 0.1 . 1 . . . . 766 GLY N . 16191 1 801 . 1 1 94 94 ASP H H 1 8.08 0.01 . 1 . . . . 767 ASP H . 16191 1 802 . 1 1 94 94 ASP HA H 1 4.49 0.01 . 1 . . . . 767 ASP HA . 16191 1 803 . 1 1 94 94 ASP HB2 H 1 3 0.01 . 2 . . . . 767 ASP HB2 . 16191 1 804 . 1 1 94 94 ASP HB3 H 1 2.32 0.01 . 2 . . . . 767 ASP HB3 . 16191 1 805 . 1 1 94 94 ASP C C 13 176.5 0.1 . 1 . . . . 767 ASP C . 16191 1 806 . 1 1 94 94 ASP CA C 13 53.09 0.1 . 1 . . . . 767 ASP CA . 16191 1 807 . 1 1 94 94 ASP N N 15 119.76 0.1 . 1 . . . . 767 ASP N . 16191 1 808 . 1 1 95 95 GLN H H 1 10.03 0.01 . 1 . . . . 768 GLN H . 16191 1 809 . 1 1 95 95 GLN HA H 1 4.28 0.01 . 1 . . . . 768 GLN HA . 16191 1 810 . 1 1 95 95 GLN HB2 H 1 2.39 0.01 . 2 . . . . 768 GLN HB2 . 16191 1 811 . 1 1 95 95 GLN HB3 H 1 2.11 0.01 . 2 . . . . 768 GLN HB3 . 16191 1 812 . 1 1 95 95 GLN HE21 H 1 7.48 0.01 . 2 . . . . 768 GLN HE21 . 16191 1 813 . 1 1 95 95 GLN HE22 H 1 6.67 0.01 . 2 . . . . 768 GLN HE22 . 16191 1 814 . 1 1 95 95 GLN HG2 H 1 2.22 0.01 . 2 . . . . 768 GLN HG2 . 16191 1 815 . 1 1 95 95 GLN HG3 H 1 2.07 0.01 . 2 . . . . 768 GLN HG3 . 16191 1 816 . 1 1 95 95 GLN C C 13 174.2 0.1 . 1 . . . . 768 GLN C . 16191 1 817 . 1 1 95 95 GLN CA C 13 56.92 0.1 . 1 . . . . 768 GLN CA . 16191 1 818 . 1 1 95 95 GLN CB C 13 26.05 0.1 . 1 . . . . 768 GLN CB . 16191 1 819 . 1 1 95 95 GLN CG C 13 34.12 0.1 . 1 . . . . 768 GLN CG . 16191 1 820 . 1 1 95 95 GLN N N 15 115.45 0.1 . 1 . . . . 768 GLN N . 16191 1 821 . 1 1 95 95 GLN NE2 N 15 112.75 0.1 . 1 . . . . 768 GLN NE2 . 16191 1 822 . 1 1 96 96 GLU H H 1 7.98 0.01 . 1 . . . . 769 GLU H . 16191 1 823 . 1 1 96 96 GLU HA H 1 4.75 0.01 . 1 . . . . 769 GLU HA . 16191 1 824 . 1 1 96 96 GLU HB2 H 1 1.82 0.01 . 1 . . . . 769 GLU HB2 . 16191 1 825 . 1 1 96 96 GLU HB3 H 1 1.82 0.01 . 1 . . . . 769 GLU HB3 . 16191 1 826 . 1 1 96 96 GLU HG2 H 1 2.35 0.01 . 1 . . . . 769 GLU HG2 . 16191 1 827 . 1 1 96 96 GLU HG3 H 1 2.35 0.01 . 1 . . . . 769 GLU HG3 . 16191 1 828 . 1 1 96 96 GLU C C 13 174.4 0.1 . 1 . . . . 769 GLU C . 16191 1 829 . 1 1 96 96 GLU CA C 13 54.88 0.1 . 1 . . . . 769 GLU CA . 16191 1 830 . 1 1 96 96 GLU CB C 13 32.59 0.1 . 1 . . . . 769 GLU CB . 16191 1 831 . 1 1 96 96 GLU CG C 13 37.41 0.1 . 1 . . . . 769 GLU CG . 16191 1 832 . 1 1 96 96 GLU N N 15 118.12 0.1 . 1 . . . . 769 GLU N . 16191 1 833 . 1 1 97 97 LEU H H 1 9.31 0.01 . 1 . . . . 770 LEU H . 16191 1 834 . 1 1 97 97 LEU HA H 1 5.33 0.01 . 1 . . . . 770 LEU HA . 16191 1 835 . 1 1 97 97 LEU HB2 H 1 1.73 0.01 . 1 . . . . 770 LEU HB2 . 16191 1 836 . 1 1 97 97 LEU HB3 H 1 1.73 0.01 . 1 . . . . 770 LEU HB3 . 16191 1 837 . 1 1 97 97 LEU HD11 H 1 1.1 0.01 . 1 . . . . 770 LEU HD11 . 16191 1 838 . 1 1 97 97 LEU HD12 H 1 1.1 0.01 . 1 . . . . 770 LEU HD12 . 16191 1 839 . 1 1 97 97 LEU HD13 H 1 1.1 0.01 . 1 . . . . 770 LEU HD13 . 16191 1 840 . 1 1 97 97 LEU HD21 H 1 0.72 0.01 . 1 . . . . 770 LEU HD21 . 16191 1 841 . 1 1 97 97 LEU HD22 H 1 0.72 0.01 . 1 . . . . 770 LEU HD22 . 16191 1 842 . 1 1 97 97 LEU HD23 H 1 0.72 0.01 . 1 . . . . 770 LEU HD23 . 16191 1 843 . 1 1 97 97 LEU HG H 1 1.55 0.01 . 1 . . . . 770 LEU HG . 16191 1 844 . 1 1 97 97 LEU C C 13 175.7 0.1 . 1 . . . . 770 LEU C . 16191 1 845 . 1 1 97 97 LEU CA C 13 53.2 0.1 . 1 . . . . 770 LEU CA . 16191 1 846 . 1 1 97 97 LEU CB C 13 44.42 0.1 . 1 . . . . 770 LEU CB . 16191 1 847 . 1 1 97 97 LEU CD1 C 13 25.05 0.1 . 1 . . . . 770 LEU CD1 . 16191 1 848 . 1 1 97 97 LEU CD2 C 13 24.5 0.1 . 1 . . . . 770 LEU CD2 . 16191 1 849 . 1 1 97 97 LEU CG C 13 26.52 0.1 . 1 . . . . 770 LEU CG . 16191 1 850 . 1 1 97 97 LEU N N 15 129.84 0.1 . 1 . . . . 770 LEU N . 16191 1 851 . 1 1 98 98 THR H H 1 8.46 0.01 . 1 . . . . 771 THR H . 16191 1 852 . 1 1 98 98 THR HA H 1 5.11 0.01 . 1 . . . . 771 THR HA . 16191 1 853 . 1 1 98 98 THR HB H 1 3.69 0.01 . 1 . . . . 771 THR HB . 16191 1 854 . 1 1 98 98 THR HG21 H 1 1.38 0.01 . 1 . . . . 771 THR HG2 . 16191 1 855 . 1 1 98 98 THR HG22 H 1 1.38 0.01 . 1 . . . . 771 THR HG2 . 16191 1 856 . 1 1 98 98 THR HG23 H 1 1.38 0.01 . 1 . . . . 771 THR HG2 . 16191 1 857 . 1 1 98 98 THR C C 13 174.1 0.1 . 1 . . . . 771 THR C . 16191 1 858 . 1 1 98 98 THR CA C 13 59.53 0.1 . 1 . . . . 771 THR CA . 16191 1 859 . 1 1 98 98 THR CB C 13 72.19 0.1 . 1 . . . . 771 THR CB . 16191 1 860 . 1 1 98 98 THR CG2 C 13 21.81 0.1 . 1 . . . . 771 THR CG2 . 16191 1 861 . 1 1 98 98 THR N N 15 114.02 0.1 . 1 . . . . 771 THR N . 16191 1 862 . 1 1 99 99 GLU H H 1 8.29 0.01 . 1 . . . . 772 GLU H . 16191 1 863 . 1 1 99 99 GLU HA H 1 4.24 0.01 . 1 . . . . 772 GLU HA . 16191 1 864 . 1 1 99 99 GLU C C 13 178.6 0.1 . 1 . . . . 772 GLU C . 16191 1 865 . 1 1 99 99 GLU CA C 13 58.78 0.1 . 1 . . . . 772 GLU CA . 16191 1 866 . 1 1 99 99 GLU CB C 13 30.31 0.1 . 1 . . . . 772 GLU CB . 16191 1 867 . 1 1 99 99 GLU N N 15 119.78 0.1 . 1 . . . . 772 GLU N . 16191 1 868 . 1 1 100 100 HIS H H 1 8.56 0.01 . 1 . . . . 773 HIS H . 16191 1 869 . 1 1 100 100 HIS HA H 1 4.5 0.01 . 1 . . . . 773 HIS HA . 16191 1 870 . 1 1 100 100 HIS HB2 H 1 3.2 0.01 . 1 . . . . 773 HIS HB2 . 16191 1 871 . 1 1 100 100 HIS HB3 H 1 3.2 0.01 . 1 . . . . 773 HIS HB3 . 16191 1 872 . 1 1 100 100 HIS HD2 H 1 7.08 0.01 . 1 . . . . 773 HIS HD2 . 16191 1 873 . 1 1 100 100 HIS HE1 H 1 7.92 0.01 . 1 . . . . 773 HIS HE1 . 16191 1 874 . 1 1 100 100 HIS C C 13 177.9 0.1 . 1 . . . . 773 HIS C . 16191 1 875 . 1 1 100 100 HIS CA C 13 59.42 0.1 . 1 . . . . 773 HIS CA . 16191 1 876 . 1 1 100 100 HIS CB C 13 30.07 0.1 . 1 . . . . 773 HIS CB . 16191 1 877 . 1 1 100 100 HIS CD2 C 13 120.05 0.1 . 1 . . . . 773 HIS CD2 . 16191 1 878 . 1 1 100 100 HIS CE1 C 13 138.1 0.1 . 1 . . . . 773 HIS CE1 . 16191 1 879 . 1 1 100 100 HIS N N 15 118.22 0.1 . 1 . . . . 773 HIS N . 16191 1 880 . 1 1 101 101 GLU H H 1 7.86 0.01 . 1 . . . . 774 GLU H . 16191 1 881 . 1 1 101 101 GLU HA H 1 4.1 0.01 . 1 . . . . 774 GLU HA . 16191 1 882 . 1 1 101 101 GLU HB2 H 1 2.04 0.01 . 1 . . . . 774 GLU HB2 . 16191 1 883 . 1 1 101 101 GLU HB3 H 1 2.04 0.01 . 1 . . . . 774 GLU HB3 . 16191 1 884 . 1 1 101 101 GLU HG2 H 1 2.44 0.01 . 1 . . . . 774 GLU HG2 . 16191 1 885 . 1 1 101 101 GLU HG3 H 1 2.44 0.01 . 1 . . . . 774 GLU HG3 . 16191 1 886 . 1 1 101 101 GLU C C 13 179.9 0.1 . 1 . . . . 774 GLU C . 16191 1 887 . 1 1 101 101 GLU CA C 13 59.1 0.1 . 1 . . . . 774 GLU CA . 16191 1 888 . 1 1 101 101 GLU CB C 13 29.42 0.1 . 1 . . . . 774 GLU CB . 16191 1 889 . 1 1 101 101 GLU N N 15 120.72 0.1 . 1 . . . . 774 GLU N . 16191 1 890 . 1 1 102 102 HIS H H 1 8.78 0.01 . 1 . . . . 775 HIS H . 16191 1 891 . 1 1 102 102 HIS HA H 1 4.09 0.01 . 1 . . . . 775 HIS HA . 16191 1 892 . 1 1 102 102 HIS HB2 H 1 3.06 0.01 . 2 . . . . 775 HIS HB2 . 16191 1 893 . 1 1 102 102 HIS HB3 H 1 2.73 0.01 . 2 . . . . 775 HIS HB3 . 16191 1 894 . 1 1 102 102 HIS HD2 H 1 6.76 0.01 . 1 . . . . 775 HIS HD2 . 16191 1 895 . 1 1 102 102 HIS HE1 H 1 7.65 0.01 . 1 . . . . 775 HIS HE1 . 16191 1 896 . 1 1 102 102 HIS C C 13 176.7 0.1 . 1 . . . . 775 HIS C . 16191 1 897 . 1 1 102 102 HIS CA C 13 58.61 0.1 . 1 . . . . 775 HIS CA . 16191 1 898 . 1 1 102 102 HIS CB C 13 29.8 0.1 . 1 . . . . 775 HIS CB . 16191 1 899 . 1 1 102 102 HIS CD2 C 13 117.79 0.1 . 1 . . . . 775 HIS CD2 . 16191 1 900 . 1 1 102 102 HIS CE1 C 13 138.22 0.1 . 1 . . . . 775 HIS CE1 . 16191 1 901 . 1 1 102 102 HIS N N 15 119.9 0.1 . 1 . . . . 775 HIS N . 16191 1 902 . 1 1 103 103 GLN H H 1 8.06 0.01 . 1 . . . . 776 GLN H . 16191 1 903 . 1 1 103 103 GLN HA H 1 4.28 0.01 . 1 . . . . 776 GLN HA . 16191 1 904 . 1 1 103 103 GLN HB2 H 1 2.22 0.01 . 1 . . . . 776 GLN HB2 . 16191 1 905 . 1 1 103 103 GLN HB3 H 1 2.22 0.01 . 1 . . . . 776 GLN HB3 . 16191 1 906 . 1 1 103 103 GLN HG2 H 1 2.45 0.01 . 1 . . . . 776 GLN HG2 . 16191 1 907 . 1 1 103 103 GLN HG3 H 1 2.45 0.01 . 1 . . . . 776 GLN HG3 . 16191 1 908 . 1 1 103 103 GLN C C 13 177.4 0.1 . 1 . . . . 776 GLN C . 16191 1 909 . 1 1 103 103 GLN CA C 13 58.46 0.1 . 1 . . . . 776 GLN CA . 16191 1 910 . 1 1 103 103 GLN CB C 13 27.44 0.1 . 1 . . . . 776 GLN CB . 16191 1 911 . 1 1 103 103 GLN CG C 13 33.31 0.1 . 1 . . . . 776 GLN CG . 16191 1 912 . 1 1 103 103 GLN N N 15 119.35 0.1 . 1 . . . . 776 GLN N . 16191 1 913 . 1 1 104 104 GLN H H 1 7.19 0.01 . 1 . . . . 777 GLN H . 16191 1 914 . 1 1 104 104 GLN HA H 1 3.97 0.01 . 1 . . . . 777 GLN HA . 16191 1 915 . 1 1 104 104 GLN HB2 H 1 2.1 0.01 . 1 . . . . 777 GLN HB2 . 16191 1 916 . 1 1 104 104 GLN HB3 H 1 2.1 0.01 . 1 . . . . 777 GLN HB3 . 16191 1 917 . 1 1 104 104 GLN HE21 H 1 7.81 0.01 . 2 . . . . 777 GLN HE21 . 16191 1 918 . 1 1 104 104 GLN HE22 H 1 6.9 0.01 . 2 . . . . 777 GLN HE22 . 16191 1 919 . 1 1 104 104 GLN HG2 H 1 2.32 0.01 . 1 . . . . 777 GLN HG2 . 16191 1 920 . 1 1 104 104 GLN HG3 H 1 2.32 0.01 . 1 . . . . 777 GLN HG3 . 16191 1 921 . 1 1 104 104 GLN C C 13 178.5 0.1 . 1 . . . . 777 GLN C . 16191 1 922 . 1 1 104 104 GLN CA C 13 58.01 0.1 . 1 . . . . 777 GLN CA . 16191 1 923 . 1 1 104 104 GLN CB C 13 28.26 0.1 . 1 . . . . 777 GLN CB . 16191 1 924 . 1 1 104 104 GLN CG C 13 33.63 0.1 . 1 . . . . 777 GLN CG . 16191 1 925 . 1 1 104 104 GLN N N 15 116.03 0.1 . 1 . . . . 777 GLN N . 16191 1 926 . 1 1 104 104 GLN NE2 N 15 115.59 0.1 . 1 . . . . 777 GLN NE2 . 16191 1 927 . 1 1 105 105 MET H H 1 8.12 0.01 . 1 . . . . 778 MET H . 16191 1 928 . 1 1 105 105 MET HA H 1 4.32 0.01 . 1 . . . . 778 MET HA . 16191 1 929 . 1 1 105 105 MET HB2 H 1 1.8 0.01 . 1 . . . . 778 MET HB2 . 16191 1 930 . 1 1 105 105 MET HB3 H 1 1.8 0.01 . 1 . . . . 778 MET HB3 . 16191 1 931 . 1 1 105 105 MET HE1 H 1 1.51 0.01 . 1 . . . . 778 MET HE1 . 16191 1 932 . 1 1 105 105 MET HE2 H 1 1.51 0.01 . 1 . . . . 778 MET HE2 . 16191 1 933 . 1 1 105 105 MET HE3 H 1 1.51 0.01 . 1 . . . . 778 MET HE3 . 16191 1 934 . 1 1 105 105 MET HG2 H 1 2.02 0.01 . 1 . . . . 778 MET HG2 . 16191 1 935 . 1 1 105 105 MET HG3 H 1 2.02 0.01 . 1 . . . . 778 MET HG3 . 16191 1 936 . 1 1 105 105 MET CA C 13 55.62 0.1 . 1 . . . . 778 MET CA . 16191 1 937 . 1 1 105 105 MET N N 15 120.01 0.1 . 1 . . . . 778 MET N . 16191 1 938 . 1 1 108 108 ASP H H 1 8.48 0.01 . 1 . . . . 781 ASP H . 16191 1 939 . 1 1 108 108 ASP C C 13 178.7 0.1 . 1 . . . . 781 ASP C . 16191 1 940 . 1 1 108 108 ASP CA C 13 56.6 0.1 . 1 . . . . 781 ASP CA . 16191 1 941 . 1 1 108 108 ASP N N 15 121.54 0.1 . 1 . . . . 781 ASP N . 16191 1 942 . 1 1 109 109 LEU H H 1 7.92 0.01 . 1 . . . . 782 LEU H . 16191 1 943 . 1 1 109 109 LEU HA H 1 4.35 0.01 . 1 . . . . 782 LEU HA . 16191 1 944 . 1 1 109 109 LEU HB2 H 1 1.58 0.01 . 1 . . . . 782 LEU HB2 . 16191 1 945 . 1 1 109 109 LEU HB3 H 1 1.58 0.01 . 1 . . . . 782 LEU HB3 . 16191 1 946 . 1 1 109 109 LEU HD11 H 1 0.85 0.01 . 1 . . . . 782 LEU HD11 . 16191 1 947 . 1 1 109 109 LEU HD12 H 1 0.85 0.01 . 1 . . . . 782 LEU HD12 . 16191 1 948 . 1 1 109 109 LEU HD13 H 1 0.85 0.01 . 1 . . . . 782 LEU HD13 . 16191 1 949 . 1 1 109 109 LEU C C 13 178.6 0.1 . 1 . . . . 782 LEU C . 16191 1 950 . 1 1 109 109 LEU CA C 13 57.56 0.1 . 1 . . . . 782 LEU CA . 16191 1 951 . 1 1 109 109 LEU CB C 13 41.5 0.1 . 1 . . . . 782 LEU CB . 16191 1 952 . 1 1 109 109 LEU N N 15 121.54 0.1 . 1 . . . . 782 LEU N . 16191 1 953 . 1 1 110 110 GLU H H 1 7.8 0.01 . 1 . . . . 783 GLU H . 16191 1 954 . 1 1 110 110 GLU HA H 1 4.24 0.01 . 1 . . . . 783 GLU HA . 16191 1 955 . 1 1 110 110 GLU HB2 H 1 2.07 0.01 . 1 . . . . 783 GLU HB2 . 16191 1 956 . 1 1 110 110 GLU HB3 H 1 2.07 0.01 . 1 . . . . 783 GLU HB3 . 16191 1 957 . 1 1 110 110 GLU HG2 H 1 2.33 0.01 . 1 . . . . 783 GLU HG2 . 16191 1 958 . 1 1 110 110 GLU HG3 H 1 2.33 0.01 . 1 . . . . 783 GLU HG3 . 16191 1 959 . 1 1 110 110 GLU CA C 13 58.49 0.1 . 1 . . . . 783 GLU CA . 16191 1 960 . 1 1 110 110 GLU CB C 13 29 0.1 . 1 . . . . 783 GLU CB . 16191 1 961 . 1 1 110 110 GLU CG C 13 36.24 0.1 . 1 . . . . 783 GLU CG . 16191 1 962 . 1 1 110 110 GLU N N 15 118.26 0.1 . 1 . . . . 783 GLU N . 16191 1 963 . 1 1 116 116 LEU C C 13 178.8 0.1 . 1 . . . . 789 LEU C . 16191 1 964 . 1 1 117 117 ASP H H 1 8.56 0.01 . 1 . . . . 790 ASP H . 16191 1 965 . 1 1 117 117 ASP HA H 1 4.48 0.01 . 1 . . . . 790 ASP HA . 16191 1 966 . 1 1 117 117 ASP HB2 H 1 2.75 0.01 . 1 . . . . 790 ASP HB2 . 16191 1 967 . 1 1 117 117 ASP HB3 H 1 2.75 0.01 . 1 . . . . 790 ASP HB3 . 16191 1 968 . 1 1 117 117 ASP C C 13 176.5 0.1 . 1 . . . . 790 ASP C . 16191 1 969 . 1 1 117 117 ASP CA C 13 54.45 0.1 . 1 . . . . 790 ASP CA . 16191 1 970 . 1 1 117 117 ASP CB C 13 40.45 0.1 . 1 . . . . 790 ASP CB . 16191 1 971 . 1 1 117 117 ASP N N 15 122.9 0.1 . 1 . . . . 790 ASP N . 16191 1 972 . 1 1 118 118 LEU H H 1 8.06 0.01 . 1 . . . . 791 LEU H . 16191 1 973 . 1 1 118 118 LEU HA H 1 4.23 0.01 . 1 . . . . 791 LEU HA . 16191 1 974 . 1 1 118 118 LEU HB2 H 1 1.6 0.01 . 1 . . . . 791 LEU HB2 . 16191 1 975 . 1 1 118 118 LEU HB3 H 1 1.6 0.01 . 1 . . . . 791 LEU HB3 . 16191 1 976 . 1 1 118 118 LEU C C 13 177.5 0.1 . 1 . . . . 791 LEU C . 16191 1 977 . 1 1 118 118 LEU CA C 13 55.52 0.1 . 1 . . . . 791 LEU CA . 16191 1 978 . 1 1 118 118 LEU CB C 13 42.44 0.1 . 1 . . . . 791 LEU CB . 16191 1 979 . 1 1 118 118 LEU N N 15 121.54 0.1 . 1 . . . . 791 LEU N . 16191 1 980 . 1 1 119 119 ASP H H 1 8.28 0.01 . 1 . . . . 792 ASP H . 16191 1 981 . 1 1 119 119 ASP HA H 1 4.63 0.01 . 1 . . . . 792 ASP HA . 16191 1 982 . 1 1 119 119 ASP C C 13 176.4 0.1 . 1 . . . . 792 ASP C . 16191 1 983 . 1 1 119 119 ASP CA C 13 54.88 0.1 . 1 . . . . 792 ASP CA . 16191 1 984 . 1 1 119 119 ASP CB C 13 40.87 0.1 . 1 . . . . 792 ASP CB . 16191 1 985 . 1 1 119 119 ASP N N 15 119.62 0.1 . 1 . . . . 792 ASP N . 16191 1 986 . 1 1 120 120 HIS H H 1 8.29 0.01 . 1 . . . . 793 HIS H . 16191 1 987 . 1 1 120 120 HIS HA H 1 4.59 0.01 . 1 . . . . 793 HIS HA . 16191 1 988 . 1 1 120 120 HIS HB2 H 1 3.29 0.01 . 2 . . . . 793 HIS HB2 . 16191 1 989 . 1 1 120 120 HIS HB3 H 1 3.11 0.01 . 2 . . . . 793 HIS HB3 . 16191 1 990 . 1 1 120 120 HIS HD2 H 1 7.06 0.01 . 1 . . . . 793 HIS HD2 . 16191 1 991 . 1 1 120 120 HIS HE1 H 1 7.83 0.01 . 1 . . . . 793 HIS HE1 . 16191 1 992 . 1 1 120 120 HIS C C 13 174.9 0.1 . 1 . . . . 793 HIS C . 16191 1 993 . 1 1 120 120 HIS CA C 13 55.81 0.1 . 1 . . . . 793 HIS CA . 16191 1 994 . 1 1 120 120 HIS CB C 13 29.19 0.1 . 1 . . . . 793 HIS CB . 16191 1 995 . 1 1 120 120 HIS CD2 C 13 119.7 0.1 . 1 . . . . 793 HIS CD2 . 16191 1 996 . 1 1 120 120 HIS CE1 C 13 138.61 0.1 . 1 . . . . 793 HIS CE1 . 16191 1 997 . 1 1 120 120 HIS N N 15 119.25 0.1 . 1 . . . . 793 HIS N . 16191 1 998 . 1 1 121 121 SER C C 13 176.4 0.1 . 1 . . . . 794 SER C . 16191 1 999 . 1 1 121 121 SER CA C 13 58.92 0.1 . 1 . . . . 794 SER CA . 16191 1 1000 . 1 1 121 121 SER CB C 13 63.86 0.1 . 1 . . . . 794 SER CB . 16191 1 1001 . 1 1 121 121 SER N N 15 116.61 0.1 . 1 . . . . 794 SER N . 16191 1 1002 . 1 1 122 122 SER H H 1 8.34 0.01 . 1 . . . . 795 SER H . 16191 1 1003 . 1 1 122 122 SER HA H 1 4.38 0.01 . 1 . . . . 795 SER HA . 16191 1 1004 . 1 1 122 122 SER HB2 H 1 3.97 0.01 . 2 . . . . 795 SER HB2 . 16191 1 1005 . 1 1 122 122 SER HB3 H 1 3.83 0.01 . 2 . . . . 795 SER HB3 . 16191 1 1006 . 1 1 122 122 SER C C 13 173.5 0.1 . 1 . . . . 795 SER C . 16191 1 1007 . 1 1 122 122 SER CA C 13 58.04 0.1 . 1 . . . . 795 SER CA . 16191 1 1008 . 1 1 122 122 SER CB C 13 63.86 0.1 . 1 . . . . 795 SER CB . 16191 1 1009 . 1 1 122 122 SER N N 15 118.26 0.1 . 1 . . . . 795 SER N . 16191 1 1010 . 1 1 123 123 LEU H H 1 7.84 0.01 . 1 . . . . 796 LEU H . 16191 1 1011 . 1 1 123 123 LEU HA H 1 4.35 0.01 . 1 . . . . 796 LEU HA . 16191 1 1012 . 1 1 123 123 LEU HB2 H 1 1.58 0.01 . 1 . . . . 796 LEU HB2 . 16191 1 1013 . 1 1 123 123 LEU HB3 H 1 1.58 0.01 . 1 . . . . 796 LEU HB3 . 16191 1 1014 . 1 1 123 123 LEU HG H 1 1.55 0.01 . 1 . . . . 796 LEU HG . 16191 1 1015 . 1 1 123 123 LEU CA C 13 56.74 0.1 . 1 . . . . 796 LEU CA . 16191 1 1016 . 1 1 123 123 LEU CB C 13 43.01 0.1 . 1 . . . . 796 LEU CB . 16191 1 1017 . 1 1 123 123 LEU N N 15 129.16 0.1 . 1 . . . . 796 LEU N . 16191 1 stop_ save_