data_5761 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 5761 _Entry.Title ; 1H, 13C and 15N Chemical Shift Assignments for Gamma-Adaptin Ear Domain ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2003-04-07 _Entry.Accession_date 2003-04-07 _Entry.Last_release_date 2003-12-19 _Entry.Original_release_date 2003-12-19 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 2.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Alexei Denisov . Yu. . 5761 2 Kalle Gehring . . . 5761 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 5761 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '1H chemical shifts' 393 5761 '13C chemical shifts' 330 5761 '15N chemical shifts' 105 5761 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2003-12-19 2003-04-07 original author . 5761 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 5761 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID . _Citation.Full_citation . _Citation.Title 'Characterization of a gamma-adaptin ear-binding motif in enthoprotin' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'FEBS Lett.' _Citation.Journal_name_full . _Citation.Journal_volume 555 _Citation.Journal_issue 3 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 437 _Citation.Page_last 442 _Citation.Year 2003 _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 Sylwia Wasiak . . . 5761 1 2 Alexei Denisov . Yu. . 5761 1 3 Z. Han . . . 5761 1 4 P. Leventis . A. . 5761 1 5 E. Heuvel . . . 5761 1 6 G. Boulianne . L. . 5761 1 7 B. Kay . K. . 5761 1 8 Kalle Gehring . . . 5761 1 9 Peter McPherson . S. . 5761 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID Gamma-adaptin 5761 1 'NMR assignments' 5761 1 enthoprotin 5761 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_system_gamma-ear _Assembly.Sf_category assembly _Assembly.Sf_framecode system_gamma-ear _Assembly.Entry_ID 5761 _Assembly.ID 1 _Assembly.Name 'gamma-adaptin ear domain' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID monomer 5761 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'gamma-ear monomer' 1 $gamma-ear_monomer . . . native . . . . . 5761 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID . PDB 1GYU . . . . . . 5761 1 stop_ loop_ _Assembly_common_name.Name _Assembly_common_name.Type _Assembly_common_name.Entry_ID _Assembly_common_name.Assembly_ID 'gamma-adaptin ear domain' system 5761 1 gamma-ear abbreviation 5761 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_gamma-ear_monomer _Entity.Sf_category entity _Entity.Sf_framecode gamma-ear_monomer _Entity.Entry_ID 5761 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'gamma-adaptin ear domain' _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 ; IPSITAYSKNGLKIEFTFER SNTNPSVTVITIQASNSTEL DMTDFVFQAAVPKTFQLQLL SPSSSVVPAFNTGTITQVIK VLNPQKQQLRMRIKLTYNHK GSAMQDLAEVNNFPPQSWQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer . _Entity.Nstd_chirality . _Entity.Nstd_linkage . _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 119 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic . _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1GYU . "Gamma-Adaptin Appendage Domain From Clathrin Adaptor Ap1" . . . . . 100.00 140 100.00 100.00 6.87e-80 . . . . 5761 1 2 no PDB 1GYV . "Gamma-Adaptin Appendage Domain From Clathrin Adaptor Ap1, L762e Mutant" . . . . . 100.00 120 99.16 99.16 1.61e-78 . . . . 5761 1 3 no PDB 1GYW . "Gamma-Adaptin Appendage Domain From Clathrin Adaptor Ap1 A753d Mutant" . . . . . 100.00 128 99.16 99.16 5.19e-78 . . . . 5761 1 4 no PDB 1IU1 . "Crystal Structure Of Human Gamma1-Adaptin Ear Domain" . . . . . 100.00 146 99.16 100.00 1.29e-78 . . . . 5761 1 5 no PDB 2A7B . "On The Routine Use Of Soft X-Rays In Macromolecular Crystallography, Part Iii- The Optimal Data Collection Wavelength" . . . . . 100.00 120 100.00 100.00 1.39e-79 . . . . 5761 1 6 no DBJ BAA33389 . "gamma1-adaptin [Homo sapiens]" . . . . . 100.00 822 99.16 100.00 6.70e-74 . . . . 5761 1 7 no DBJ BAB86336 . "gamma-adaptin [Rattus norvegicus]" . . . . . 100.00 310 98.32 100.00 2.88e-76 . . . . 5761 1 8 no DBJ BAC25904 . "unnamed protein product [Mus musculus]" . . . . . 100.00 421 100.00 100.00 3.49e-76 . . . . 5761 1 9 no DBJ BAC28629 . "unnamed protein product [Mus musculus]" . . . . . 100.00 695 100.00 100.00 2.00e-74 . . . . 5761 1 10 no DBJ BAC29406 . "unnamed protein product [Mus musculus]" . . . . . 100.00 825 100.00 100.00 5.89e-74 . . . . 5761 1 11 no EMBL CAA38296 . "gamma adaptin [Mus musculus]" . . . . . 100.00 822 100.00 100.00 5.63e-74 . . . . 5761 1 12 no EMBL CAA72902 . "gamma-adaptin [Homo sapiens]" . . . . . 100.00 825 99.16 100.00 9.05e-74 . . . . 5761 1 13 no EMBL CAB53673 . "hypothetical protein [Homo sapiens]" . . . . . 100.00 284 99.16 100.00 1.49e-77 . . . . 5761 1 14 no EMBL CAH92944 . "hypothetical protein [Pongo abelii]" . . . . . 100.00 822 99.16 100.00 9.49e-74 . . . . 5761 1 15 no GB AAH36283 . "Adaptor-related protein complex 1, gamma 1 subunit [Homo sapiens]" . . . . . 100.00 825 99.16 100.00 9.92e-74 . . . . 5761 1 16 no GB AAH52703 . "Adaptor protein complex AP-1, gamma 1 subunit [Mus musculus]" . . . . . 100.00 825 100.00 100.00 5.89e-74 . . . . 5761 1 17 no GB AAH54535 . "Adaptor protein complex AP-1, gamma 1 subunit [Mus musculus]" . . . . . 100.00 825 100.00 100.00 5.89e-74 . . . . 5761 1 18 no GB AAI66845 . "Ap1g1 protein [Rattus norvegicus]" . . . . . 100.00 822 100.00 100.00 6.37e-74 . . . . 5761 1 19 no GB ACE86968 . "adaptor-related protein complex 1, gamma 1 subunit protein [synthetic construct]" . . . . . 100.00 825 99.16 100.00 9.92e-74 . . . . 5761 1 20 no PRF 1704251A . "gamma adaptin" . . . . . 100.00 822 100.00 100.00 5.63e-74 . . . . 5761 1 21 no REF NP_001025178 . "AP-1 complex subunit gamma-1 isoform a [Homo sapiens]" . . . . . 100.00 825 99.16 100.00 9.05e-74 . . . . 5761 1 22 no REF NP_001119 . "AP-1 complex subunit gamma-1 isoform b [Homo sapiens]" . . . . . 100.00 822 99.16 100.00 8.06e-74 . . . . 5761 1 23 no REF NP_001126734 . "AP-1 complex subunit gamma-1 [Pongo abelii]" . . . . . 100.00 822 99.16 100.00 9.49e-74 . . . . 5761 1 24 no REF NP_001178365 . "AP-1 complex subunit gamma-1 [Bos taurus]" . . . . . 100.00 825 99.16 100.00 8.08e-74 . . . . 5761 1 25 no REF NP_001288140 . "AP-1 complex subunit gamma-1 isoform 2 [Mus musculus]" . . . . . 100.00 822 100.00 100.00 5.63e-74 . . . . 5761 1 26 no SP O43747 . "RecName: Full=AP-1 complex subunit gamma-1; AltName: Full=Adaptor protein complex AP-1 subunit gamma-1; AltName: Full=Adaptor-r" . . . . . 100.00 822 99.16 100.00 8.06e-74 . . . . 5761 1 27 no SP P22892 . "RecName: Full=AP-1 complex subunit gamma-1; AltName: Full=Adaptor protein complex AP-1 subunit gamma-1; AltName: Full=Adaptor-r" . . . . . 100.00 822 100.00 100.00 5.63e-74 . . . . 5761 1 28 no SP Q5R5M2 . "RecName: Full=AP-1 complex subunit gamma-1; AltName: Full=Adaptor protein complex AP-1 subunit gamma-1; AltName: Full=Adaptor-r" . . . . . 100.00 822 99.16 100.00 9.49e-74 . . . . 5761 1 29 no TPG DAA20238 . "TPA: adaptor-related protein complex 1, gamma 1 subunit isoform 1 [Bos taurus]" . . . . . 100.00 825 99.16 100.00 8.08e-74 . . . . 5761 1 30 no TPG DAA20239 . "TPA: adaptor-related protein complex 1, gamma 1 subunit isoform 2 [Bos taurus]" . . . . . 100.00 822 99.16 100.00 8.75e-74 . . . . 5761 1 stop_ loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'gamma-adaptin ear domain' common 5761 1 gamma-ear abbreviation 5761 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 1 704 ILE . 5761 1 2 705 PRO . 5761 1 3 706 SER . 5761 1 4 707 ILE . 5761 1 5 708 THR . 5761 1 6 709 ALA . 5761 1 7 710 TYR . 5761 1 8 711 SER . 5761 1 9 712 LYS . 5761 1 10 713 ASN . 5761 1 11 714 GLY . 5761 1 12 715 LEU . 5761 1 13 716 LYS . 5761 1 14 717 ILE . 5761 1 15 718 GLU . 5761 1 16 719 PHE . 5761 1 17 720 THR . 5761 1 18 721 PHE . 5761 1 19 722 GLU . 5761 1 20 723 ARG . 5761 1 21 724 SER . 5761 1 22 725 ASN . 5761 1 23 726 THR . 5761 1 24 727 ASN . 5761 1 25 728 PRO . 5761 1 26 729 SER . 5761 1 27 730 VAL . 5761 1 28 731 THR . 5761 1 29 732 VAL . 5761 1 30 733 ILE . 5761 1 31 734 THR . 5761 1 32 735 ILE . 5761 1 33 736 GLN . 5761 1 34 737 ALA . 5761 1 35 738 SER . 5761 1 36 739 ASN . 5761 1 37 740 SER . 5761 1 38 741 THR . 5761 1 39 742 GLU . 5761 1 40 743 LEU . 5761 1 41 744 ASP . 5761 1 42 745 MET . 5761 1 43 746 THR . 5761 1 44 747 ASP . 5761 1 45 748 PHE . 5761 1 46 749 VAL . 5761 1 47 750 PHE . 5761 1 48 751 GLN . 5761 1 49 752 ALA . 5761 1 50 753 ALA . 5761 1 51 754 VAL . 5761 1 52 755 PRO . 5761 1 53 756 LYS . 5761 1 54 757 THR . 5761 1 55 758 PHE . 5761 1 56 759 GLN . 5761 1 57 760 LEU . 5761 1 58 761 GLN . 5761 1 59 762 LEU . 5761 1 60 763 LEU . 5761 1 61 764 SER . 5761 1 62 765 PRO . 5761 1 63 766 SER . 5761 1 64 767 SER . 5761 1 65 768 SER . 5761 1 66 769 VAL . 5761 1 67 770 VAL . 5761 1 68 771 PRO . 5761 1 69 772 ALA . 5761 1 70 773 PHE . 5761 1 71 774 ASN . 5761 1 72 775 THR . 5761 1 73 776 GLY . 5761 1 74 777 THR . 5761 1 75 778 ILE . 5761 1 76 779 THR . 5761 1 77 780 GLN . 5761 1 78 781 VAL . 5761 1 79 782 ILE . 5761 1 80 783 LYS . 5761 1 81 784 VAL . 5761 1 82 785 LEU . 5761 1 83 786 ASN . 5761 1 84 787 PRO . 5761 1 85 788 GLN . 5761 1 86 789 LYS . 5761 1 87 790 GLN . 5761 1 88 791 GLN . 5761 1 89 792 LEU . 5761 1 90 793 ARG . 5761 1 91 794 MET . 5761 1 92 795 ARG . 5761 1 93 796 ILE . 5761 1 94 797 LYS . 5761 1 95 798 LEU . 5761 1 96 799 THR . 5761 1 97 800 TYR . 5761 1 98 801 ASN . 5761 1 99 802 HIS . 5761 1 100 803 LYS . 5761 1 101 804 GLY . 5761 1 102 805 SER . 5761 1 103 806 ALA . 5761 1 104 807 MET . 5761 1 105 808 GLN . 5761 1 106 809 ASP . 5761 1 107 810 LEU . 5761 1 108 811 ALA . 5761 1 109 812 GLU . 5761 1 110 813 VAL . 5761 1 111 814 ASN . 5761 1 112 815 ASN . 5761 1 113 816 PHE . 5761 1 114 817 PRO . 5761 1 115 818 PRO . 5761 1 116 819 GLN . 5761 1 117 820 SER . 5761 1 118 821 TRP . 5761 1 119 822 GLN . 5761 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 . ILE 1 1 5761 1 . PRO 2 2 5761 1 . SER 3 3 5761 1 . ILE 4 4 5761 1 . THR 5 5 5761 1 . ALA 6 6 5761 1 . TYR 7 7 5761 1 . SER 8 8 5761 1 . LYS 9 9 5761 1 . ASN 10 10 5761 1 . GLY 11 11 5761 1 . LEU 12 12 5761 1 . LYS 13 13 5761 1 . ILE 14 14 5761 1 . GLU 15 15 5761 1 . PHE 16 16 5761 1 . THR 17 17 5761 1 . PHE 18 18 5761 1 . GLU 19 19 5761 1 . ARG 20 20 5761 1 . SER 21 21 5761 1 . ASN 22 22 5761 1 . THR 23 23 5761 1 . ASN 24 24 5761 1 . PRO 25 25 5761 1 . SER 26 26 5761 1 . VAL 27 27 5761 1 . THR 28 28 5761 1 . VAL 29 29 5761 1 . ILE 30 30 5761 1 . THR 31 31 5761 1 . ILE 32 32 5761 1 . GLN 33 33 5761 1 . ALA 34 34 5761 1 . SER 35 35 5761 1 . ASN 36 36 5761 1 . SER 37 37 5761 1 . THR 38 38 5761 1 . GLU 39 39 5761 1 . LEU 40 40 5761 1 . ASP 41 41 5761 1 . MET 42 42 5761 1 . THR 43 43 5761 1 . ASP 44 44 5761 1 . PHE 45 45 5761 1 . VAL 46 46 5761 1 . PHE 47 47 5761 1 . GLN 48 48 5761 1 . ALA 49 49 5761 1 . ALA 50 50 5761 1 . VAL 51 51 5761 1 . PRO 52 52 5761 1 . LYS 53 53 5761 1 . THR 54 54 5761 1 . PHE 55 55 5761 1 . GLN 56 56 5761 1 . LEU 57 57 5761 1 . GLN 58 58 5761 1 . LEU 59 59 5761 1 . LEU 60 60 5761 1 . SER 61 61 5761 1 . PRO 62 62 5761 1 . SER 63 63 5761 1 . SER 64 64 5761 1 . SER 65 65 5761 1 . VAL 66 66 5761 1 . VAL 67 67 5761 1 . PRO 68 68 5761 1 . ALA 69 69 5761 1 . PHE 70 70 5761 1 . ASN 71 71 5761 1 . THR 72 72 5761 1 . GLY 73 73 5761 1 . THR 74 74 5761 1 . ILE 75 75 5761 1 . THR 76 76 5761 1 . GLN 77 77 5761 1 . VAL 78 78 5761 1 . ILE 79 79 5761 1 . LYS 80 80 5761 1 . VAL 81 81 5761 1 . LEU 82 82 5761 1 . ASN 83 83 5761 1 . PRO 84 84 5761 1 . GLN 85 85 5761 1 . LYS 86 86 5761 1 . GLN 87 87 5761 1 . GLN 88 88 5761 1 . LEU 89 89 5761 1 . ARG 90 90 5761 1 . MET 91 91 5761 1 . ARG 92 92 5761 1 . ILE 93 93 5761 1 . LYS 94 94 5761 1 . LEU 95 95 5761 1 . THR 96 96 5761 1 . TYR 97 97 5761 1 . ASN 98 98 5761 1 . HIS 99 99 5761 1 . LYS 100 100 5761 1 . GLY 101 101 5761 1 . SER 102 102 5761 1 . ALA 103 103 5761 1 . MET 104 104 5761 1 . GLN 105 105 5761 1 . ASP 106 106 5761 1 . LEU 107 107 5761 1 . ALA 108 108 5761 1 . GLU 109 109 5761 1 . VAL 110 110 5761 1 . ASN 111 111 5761 1 . ASN 112 112 5761 1 . PHE 113 113 5761 1 . PRO 114 114 5761 1 . PRO 115 115 5761 1 . GLN 116 116 5761 1 . SER 117 117 5761 1 . TRP 118 118 5761 1 . GLN 119 119 5761 1 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 5761 _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 $gamma-ear_monomer . 10090 . . 'Mus musculus' Mouse . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 5761 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 5761 _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 $gamma-ear_monomer . 'recombinant technology' 'Escherichia coli' 'E. coli' . . Escherichia coli BL21Gold . . . . . . . . . . . . plasmid . . pGET-2TK . . . . . . 5761 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 5761 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'gamma-adaptin ear domain' '[U-99% 13C; U-99% 15N]' . . 1 $gamma-ear_monomer . . 1.5 . . mM . . . . 5761 1 2 'sodium phosphate buffer' . . . . . . . 50 . . mM . . . . 5761 1 3 NaCl . . . . . . . 150 . . mM . . . . 5761 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 5761 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'gamma-adaptin ear domain' '[U-99% 15N]' . . 1 $gamma-ear_monomer . . 1.5 . . mM . . . . 5761 2 2 'sodium phosphate buffer' . . . . . . . 50 . . mM . . . . 5761 2 3 NaCl . . . . . . . 150 . . mM . . . . 5761 2 stop_ save_ ####################### # Sample conditions # ####################### save_Ex-cond_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode Ex-cond_1 _Sample_condition_list.Entry_ID 5761 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.2 0.1 n/a 5761 1 temperature 303 0.5 K 5761 1 'ionic strength' 0.20 . M 5761 1 stop_ save_ ############################ # Computer software used # ############################ save_XWINNMR _Software.Sf_category software _Software.Sf_framecode XWINNMR _Software.Entry_ID 5761 _Software.ID 1 _Software.Name XWINNMR _Software.Version 3.1 _Software.Details Bruker loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 5761 1 processing 5761 1 stop_ save_ save_XEASY _Software.Sf_category software _Software.Sf_framecode XEASY _Software.Entry_ID 5761 _Software.ID 2 _Software.Name XEASY _Software.Version 1.3.13 _Software.Details 'Bartels et al.' loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'data analysis' 5761 2 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer _NMR_spectrometer.Entry_ID 5761 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model DRX _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode spectrometer_list _NMR_spectrometer_list.Entry_ID 5761 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer Bruker DRX . 600 . . . 5761 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 5761 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D HNCACB' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5761 1 2 '3D CBCA(CO)HN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5761 1 3 '3D HNCO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5761 1 4 '3D 15N-HMQC-NOESY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5761 1 5 '3D 15N-HMQC-TOCSY' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5761 1 6 '2D 15N-HSQC' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 5761 1 stop_ save_ save_NMR_spec_expt__0_1 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_1 _NMR_spec_expt.Entry_ID 5761 _NMR_spec_expt.ID 1 _NMR_spec_expt.Name '3D HNCACB' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_2 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_2 _NMR_spec_expt.Entry_ID 5761 _NMR_spec_expt.ID 2 _NMR_spec_expt.Name '3D CBCA(CO)HN' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_3 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_3 _NMR_spec_expt.Entry_ID 5761 _NMR_spec_expt.ID 3 _NMR_spec_expt.Name '3D HNCO' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_4 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_4 _NMR_spec_expt.Entry_ID 5761 _NMR_spec_expt.ID 4 _NMR_spec_expt.Name '3D 15N-HMQC-NOESY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_5 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_5 _NMR_spec_expt.Entry_ID 5761 _NMR_spec_expt.ID 5 _NMR_spec_expt.Name '3D 15N-HMQC-TOCSY' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ save_NMR_spec_expt__0_6 _NMR_spec_expt.Sf_category NMR_spectrometer_expt _NMR_spec_expt.Sf_framecode NMR_spec_expt__0_6 _NMR_spec_expt.Entry_ID 5761 _NMR_spec_expt.ID 6 _NMR_spec_expt.Name '2D 15N-HSQC' _NMR_spec_expt.Type . _NMR_spec_expt.Sample_volume . _NMR_spec_expt.Sample_volume_units . _NMR_spec_expt.NMR_tube_type . _NMR_spec_expt.Sample_spinning_rate . _NMR_spec_expt.Sample_angle . _NMR_spec_expt.NMR_spectrometer_ID . _NMR_spec_expt.NMR_spectrometer_label . _NMR_spec_expt.NMR_spectrometer_probe_ID . _NMR_spec_expt.NMR_spectrometer_probe_label . _NMR_spec_expt.Carrier_freq_switch_time . _NMR_spec_expt.Software_ID . _NMR_spec_expt.Software_label . _NMR_spec_expt.Method_ID . _NMR_spec_expt.Method_label . _NMR_spec_expt.Pulse_seq_accession_BMRB_code . _NMR_spec_expt.Details . save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference _Chem_shift_reference.Entry_ID 5761 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . . . . . . . 5761 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . . . . . . . 5761 1 C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . . . . . . . 5761 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode shift_set_1 _Assigned_chem_shift_list.Entry_ID 5761 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $Ex-cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID . . 1 $sample_1 . 5761 1 . . 2 $sample_2 . 5761 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 2 2 PRO CA C 13 62.5 0.20 . 1 . . . . . . . . 5761 1 2 . 1 1 2 2 PRO CB C 13 31.2 0.20 . 1 . . . . . . . . 5761 1 3 . 1 1 2 2 PRO C C 13 176.2 0.20 . 1 . . . . . . . . 5761 1 4 . 1 1 3 3 SER N N 15 113.8 0.25 . 1 . . . . . . . . 5761 1 5 . 1 1 3 3 SER H H 1 7.95 0.01 . 1 . . . . . . . . 5761 1 6 . 1 1 3 3 SER CA C 13 56.3 0.20 . 1 . . . . . . . . 5761 1 7 . 1 1 3 3 SER HA H 1 5.10 0.01 . 1 . . . . . . . . 5761 1 8 . 1 1 3 3 SER CB C 13 63.8 0.20 . 1 . . . . . . . . 5761 1 9 . 1 1 3 3 SER HB2 H 1 4.01 0.01 . 2 . . . . . . . . 5761 1 10 . 1 1 3 3 SER C C 13 176.5 0.20 . 1 . . . . . . . . 5761 1 11 . 1 1 4 4 ILE N N 15 110.6 0.25 . 1 . . . . . . . . 5761 1 12 . 1 1 4 4 ILE H H 1 8.39 0.01 . 1 . . . . . . . . 5761 1 13 . 1 1 4 4 ILE CA C 13 58.1 0.20 . 1 . . . . . . . . 5761 1 14 . 1 1 4 4 ILE HA H 1 4.93 0.01 . 1 . . . . . . . . 5761 1 15 . 1 1 4 4 ILE CB C 13 41.7 0.20 . 1 . . . . . . . . 5761 1 16 . 1 1 4 4 ILE C C 13 176.6 0.20 . 1 . . . . . . . . 5761 1 17 . 1 1 5 5 THR N N 15 119.6 0.25 . 1 . . . . . . . . 5761 1 18 . 1 1 5 5 THR H H 1 8.85 0.01 . 1 . . . . . . . . 5761 1 19 . 1 1 5 5 THR CA C 13 61.5 0.20 . 1 . . . . . . . . 5761 1 20 . 1 1 5 5 THR CB C 13 66.9 0.20 . 1 . . . . . . . . 5761 1 21 . 1 1 5 5 THR C C 13 175.1 0.20 . 1 . . . . . . . . 5761 1 22 . 1 1 6 6 ALA N N 15 131.2 0.25 . 1 . . . . . . . . 5761 1 23 . 1 1 6 6 ALA H H 1 8.43 0.01 . 1 . . . . . . . . 5761 1 24 . 1 1 6 6 ALA CA C 13 51.2 0.20 . 1 . . . . . . . . 5761 1 25 . 1 1 6 6 ALA HA H 1 3.84 0.01 . 1 . . . . . . . . 5761 1 26 . 1 1 6 6 ALA CB C 13 17.8 0.20 . 1 . . . . . . . . 5761 1 27 . 1 1 6 6 ALA HB1 H 1 0.16 0.01 . 1 . . . . . . . . 5761 1 28 . 1 1 6 6 ALA HB2 H 1 0.16 0.01 . 1 . . . . . . . . 5761 1 29 . 1 1 6 6 ALA HB3 H 1 0.16 0.01 . 1 . . . . . . . . 5761 1 30 . 1 1 6 6 ALA C C 13 177.2 0.20 . 1 . . . . . . . . 5761 1 31 . 1 1 7 7 TYR N N 15 116.1 0.25 . 1 . . . . . . . . 5761 1 32 . 1 1 7 7 TYR H H 1 7.42 0.01 . 1 . . . . . . . . 5761 1 33 . 1 1 7 7 TYR CA C 13 56.2 0.20 . 1 . . . . . . . . 5761 1 34 . 1 1 7 7 TYR HA H 1 4.30 0.01 . 1 . . . . . . . . 5761 1 35 . 1 1 7 7 TYR CB C 13 41.4 0.20 . 1 . . . . . . . . 5761 1 36 . 1 1 7 7 TYR HB2 H 1 2.73 0.01 . 2 . . . . . . . . 5761 1 37 . 1 1 7 7 TYR HB3 H 1 2.41 0.01 . 2 . . . . . . . . 5761 1 38 . 1 1 7 7 TYR C C 13 174.8 0.20 . 1 . . . . . . . . 5761 1 39 . 1 1 8 8 SER N N 15 122.4 0.25 . 1 . . . . . . . . 5761 1 40 . 1 1 8 8 SER H H 1 8.30 0.01 . 1 . . . . . . . . 5761 1 41 . 1 1 8 8 SER CA C 13 55.2 0.20 . 1 . . . . . . . . 5761 1 42 . 1 1 8 8 SER CB C 13 61.2 0.20 . 1 . . . . . . . . 5761 1 43 . 1 1 8 8 SER C C 13 173.4 0.20 . 1 . . . . . . . . 5761 1 44 . 1 1 9 9 LYS N N 15 128.0 0.25 . 1 . . . . . . . . 5761 1 45 . 1 1 9 9 LYS H H 1 8.35 0.01 . 1 . . . . . . . . 5761 1 46 . 1 1 9 9 LYS CA C 13 55.9 0.20 . 1 . . . . . . . . 5761 1 47 . 1 1 9 9 LYS HA H 1 4.22 0.01 . 1 . . . . . . . . 5761 1 48 . 1 1 9 9 LYS CB C 13 34.3 0.20 . 1 . . . . . . . . 5761 1 49 . 1 1 9 9 LYS HB2 H 1 1.60 0.01 . 2 . . . . . . . . 5761 1 50 . 1 1 10 10 ASN CA C 13 53.3 0.20 . 1 . . . . . . . . 5761 1 51 . 1 1 10 10 ASN CB C 13 36.1 0.20 . 1 . . . . . . . . 5761 1 52 . 1 1 10 10 ASN C C 13 176.0 0.20 . 1 . . . . . . . . 5761 1 53 . 1 1 11 11 GLY N N 15 104.9 0.25 . 1 . . . . . . . . 5761 1 54 . 1 1 11 11 GLY H H 1 8.39 0.01 . 1 . . . . . . . . 5761 1 55 . 1 1 11 11 GLY CA C 13 44.0 0.20 . 1 . . . . . . . . 5761 1 56 . 1 1 11 11 GLY C C 13 173.3 0.20 . 1 . . . . . . . . 5761 1 57 . 1 1 12 12 LEU N N 15 123.5 0.25 . 1 . . . . . . . . 5761 1 58 . 1 1 12 12 LEU H H 1 7.97 0.01 . 1 . . . . . . . . 5761 1 59 . 1 1 12 12 LEU CA C 13 52.0 0.20 . 1 . . . . . . . . 5761 1 60 . 1 1 12 12 LEU HA H 1 5.04 0.01 . 1 . . . . . . . . 5761 1 61 . 1 1 12 12 LEU CB C 13 42.0 0.20 . 1 . . . . . . . . 5761 1 62 . 1 1 12 12 LEU HD11 H 1 1.12 0.01 . 2 . . . . . . . . 5761 1 63 . 1 1 12 12 LEU HD12 H 1 1.12 0.01 . 2 . . . . . . . . 5761 1 64 . 1 1 12 12 LEU HD13 H 1 1.12 0.01 . 2 . . . . . . . . 5761 1 65 . 1 1 12 12 LEU C C 13 175.8 0.20 . 1 . . . . . . . . 5761 1 66 . 1 1 13 13 LYS N N 15 128.1 0.25 . 1 . . . . . . . . 5761 1 67 . 1 1 13 13 LYS H H 1 8.83 0.01 . 1 . . . . . . . . 5761 1 68 . 1 1 13 13 LYS CA C 13 53.4 0.20 . 1 . . . . . . . . 5761 1 69 . 1 1 13 13 LYS HA H 1 5.32 0.01 . 1 . . . . . . . . 5761 1 70 . 1 1 13 13 LYS CB C 13 34.5 0.20 . 1 . . . . . . . . 5761 1 71 . 1 1 13 13 LYS HB2 H 1 1.79 0.01 . 2 . . . . . . . . 5761 1 72 . 1 1 13 13 LYS C C 13 176.5 0.20 . 1 . . . . . . . . 5761 1 73 . 1 1 14 14 ILE N N 15 123.1 0.25 . 1 . . . . . . . . 5761 1 74 . 1 1 14 14 ILE H H 1 9.25 0.01 . 1 . . . . . . . . 5761 1 75 . 1 1 14 14 ILE CA C 13 58.4 0.20 . 1 . . . . . . . . 5761 1 76 . 1 1 14 14 ILE HA H 1 5.09 0.01 . 1 . . . . . . . . 5761 1 77 . 1 1 14 14 ILE CB C 13 38.8 0.20 . 1 . . . . . . . . 5761 1 78 . 1 1 14 14 ILE HG21 H 1 0.90 0.01 . 1 . . . . . . . . 5761 1 79 . 1 1 14 14 ILE HG22 H 1 0.90 0.01 . 1 . . . . . . . . 5761 1 80 . 1 1 14 14 ILE HG23 H 1 0.90 0.01 . 1 . . . . . . . . 5761 1 81 . 1 1 14 14 ILE C C 13 176.2 0.20 . 1 . . . . . . . . 5761 1 82 . 1 1 15 15 GLU N N 15 128.6 0.25 . 1 . . . . . . . . 5761 1 83 . 1 1 15 15 GLU H H 1 8.97 0.01 . 1 . . . . . . . . 5761 1 84 . 1 1 15 15 GLU CA C 13 53.0 0.20 . 1 . . . . . . . . 5761 1 85 . 1 1 15 15 GLU HA H 1 5.17 0.01 . 1 . . . . . . . . 5761 1 86 . 1 1 15 15 GLU CB C 13 32.2 0.20 . 1 . . . . . . . . 5761 1 87 . 1 1 15 15 GLU HB2 H 1 2.18 0.01 . 2 . . . . . . . . 5761 1 88 . 1 1 15 15 GLU HB3 H 1 2.09 0.01 . 2 . . . . . . . . 5761 1 89 . 1 1 15 15 GLU HG2 H 1 1.92 0.01 . 2 . . . . . . . . 5761 1 90 . 1 1 15 15 GLU C C 13 176.8 0.20 . 1 . . . . . . . . 5761 1 91 . 1 1 16 16 PHE N N 15 121.8 0.25 . 1 . . . . . . . . 5761 1 92 . 1 1 16 16 PHE H H 1 9.31 0.01 . 1 . . . . . . . . 5761 1 93 . 1 1 16 16 PHE CA C 13 51.5 0.20 . 1 . . . . . . . . 5761 1 94 . 1 1 16 16 PHE HA H 1 5.44 0.01 . 1 . . . . . . . . 5761 1 95 . 1 1 16 16 PHE CB C 13 39.6 0.20 . 1 . . . . . . . . 5761 1 96 . 1 1 16 16 PHE HB2 H 1 3.05 0.01 . 2 . . . . . . . . 5761 1 97 . 1 1 16 16 PHE C C 13 175.8 0.20 . 1 . . . . . . . . 5761 1 98 . 1 1 17 17 THR N N 15 112.7 0.25 . 1 . . . . . . . . 5761 1 99 . 1 1 17 17 THR H H 1 8.20 0.01 . 1 . . . . . . . . 5761 1 100 . 1 1 17 17 THR CA C 13 58.8 0.20 . 1 . . . . . . . . 5761 1 101 . 1 1 17 17 THR HA H 1 4.65 0.01 . 1 . . . . . . . . 5761 1 102 . 1 1 17 17 THR CB C 13 69.6 0.20 . 1 . . . . . . . . 5761 1 103 . 1 1 17 17 THR HB H 1 4.16 0.01 . 1 . . . . . . . . 5761 1 104 . 1 1 17 17 THR HG21 H 1 1.20 0.01 . 1 . . . . . . . . 5761 1 105 . 1 1 17 17 THR HG22 H 1 1.20 0.01 . 1 . . . . . . . . 5761 1 106 . 1 1 17 17 THR HG23 H 1 1.20 0.01 . 1 . . . . . . . . 5761 1 107 . 1 1 17 17 THR C C 13 174.8 0.20 . 1 . . . . . . . . 5761 1 108 . 1 1 18 18 PHE N N 15 118.0 0.25 . 1 . . . . . . . . 5761 1 109 . 1 1 18 18 PHE H H 1 9.04 0.01 . 1 . . . . . . . . 5761 1 110 . 1 1 18 18 PHE CA C 13 56.2 0.20 . 1 . . . . . . . . 5761 1 111 . 1 1 18 18 PHE HA H 1 5.44 0.01 . 1 . . . . . . . . 5761 1 112 . 1 1 18 18 PHE CB C 13 44.3 0.20 . 1 . . . . . . . . 5761 1 113 . 1 1 18 18 PHE HB2 H 1 2.68 0.01 . 2 . . . . . . . . 5761 1 114 . 1 1 18 18 PHE C C 13 176.5 0.20 . 1 . . . . . . . . 5761 1 115 . 1 1 19 19 GLU N N 15 120.7 0.25 . 1 . . . . . . . . 5761 1 116 . 1 1 19 19 GLU H H 1 9.03 0.01 . 1 . . . . . . . . 5761 1 117 . 1 1 19 19 GLU CA C 13 54.4 0.20 . 1 . . . . . . . . 5761 1 118 . 1 1 19 19 GLU HA H 1 4.67 0.01 . 1 . . . . . . . . 5761 1 119 . 1 1 19 19 GLU CB C 13 33.1 0.20 . 1 . . . . . . . . 5761 1 120 . 1 1 19 19 GLU HB2 H 1 2.22 0.01 . 2 . . . . . . . . 5761 1 121 . 1 1 19 19 GLU HB3 H 1 2.02 0.01 . 2 . . . . . . . . 5761 1 122 . 1 1 19 19 GLU HG2 H 1 1.93 0.01 . 2 . . . . . . . . 5761 1 123 . 1 1 19 19 GLU C C 13 176.0 0.20 . 1 . . . . . . . . 5761 1 124 . 1 1 20 20 ARG N N 15 124.1 0.25 . 1 . . . . . . . . 5761 1 125 . 1 1 20 20 ARG H H 1 8.80 0.01 . 1 . . . . . . . . 5761 1 126 . 1 1 20 20 ARG CA C 13 53.8 0.20 . 1 . . . . . . . . 5761 1 127 . 1 1 20 20 ARG HA H 1 5.43 0.01 . 1 . . . . . . . . 5761 1 128 . 1 1 20 20 ARG CB C 13 31.3 0.20 . 1 . . . . . . . . 5761 1 129 . 1 1 20 20 ARG HB2 H 1 1.63 0.01 . 2 . . . . . . . . 5761 1 130 . 1 1 20 20 ARG C C 13 176.3 0.20 . 1 . . . . . . . . 5761 1 131 . 1 1 21 21 SER N N 15 118.0 0.25 . 1 . . . . . . . . 5761 1 132 . 1 1 21 21 SER H H 1 8.82 0.01 . 1 . . . . . . . . 5761 1 133 . 1 1 21 21 SER CA C 13 55.9 0.20 . 1 . . . . . . . . 5761 1 134 . 1 1 21 21 SER CB C 13 63.1 0.20 . 1 . . . . . . . . 5761 1 135 . 1 1 21 21 SER HB2 H 1 3.99 0.01 . 2 . . . . . . . . 5761 1 136 . 1 1 21 21 SER HB3 H 1 3.94 0.01 . 2 . . . . . . . . 5761 1 137 . 1 1 24 24 ASN N N 15 124.6 0.25 . 1 . . . . . . . . 5761 1 138 . 1 1 24 24 ASN H H 1 8.54 0.01 . 1 . . . . . . . . 5761 1 139 . 1 1 24 24 ASN CA C 13 57.7 0.20 . 1 . . . . . . . . 5761 1 140 . 1 1 24 24 ASN CB C 13 38.7 0.20 . 1 . . . . . . . . 5761 1 141 . 1 1 25 25 PRO CA C 13 63.5 0.20 . 1 . . . . . . . . 5761 1 142 . 1 1 25 25 PRO CB C 13 31.0 0.20 . 1 . . . . . . . . 5761 1 143 . 1 1 25 25 PRO C C 13 178.4 0.20 . 1 . . . . . . . . 5761 1 144 . 1 1 26 26 SER N N 15 112.6 0.25 . 1 . . . . . . . . 5761 1 145 . 1 1 26 26 SER H H 1 8.06 0.01 . 1 . . . . . . . . 5761 1 146 . 1 1 26 26 SER CA C 13 58.2 0.20 . 1 . . . . . . . . 5761 1 147 . 1 1 26 26 SER CB C 13 62.3 0.20 . 1 . . . . . . . . 5761 1 148 . 1 1 26 26 SER C C 13 174.8 0.20 . 1 . . . . . . . . 5761 1 149 . 1 1 27 27 VAL N N 15 122.5 0.25 . 1 . . . . . . . . 5761 1 150 . 1 1 27 27 VAL H H 1 7.75 0.01 . 1 . . . . . . . . 5761 1 151 . 1 1 27 27 VAL CA C 13 60.1 0.20 . 1 . . . . . . . . 5761 1 152 . 1 1 27 27 VAL HA H 1 5.03 0.01 . 1 . . . . . . . . 5761 1 153 . 1 1 27 27 VAL CB C 13 32.5 0.20 . 1 . . . . . . . . 5761 1 154 . 1 1 27 27 VAL HB H 1 2.12 0.01 . 1 . . . . . . . . 5761 1 155 . 1 1 27 27 VAL HG11 H 1 0.90 0.01 . 2 . . . . . . . . 5761 1 156 . 1 1 27 27 VAL HG12 H 1 0.90 0.01 . 2 . . . . . . . . 5761 1 157 . 1 1 27 27 VAL HG13 H 1 0.90 0.01 . 2 . . . . . . . . 5761 1 158 . 1 1 27 27 VAL C C 13 177.1 0.20 . 1 . . . . . . . . 5761 1 159 . 1 1 28 28 THR N N 15 125.3 0.25 . 1 . . . . . . . . 5761 1 160 . 1 1 28 28 THR H H 1 9.11 0.01 . 1 . . . . . . . . 5761 1 161 . 1 1 28 28 THR CA C 13 61.3 0.20 . 1 . . . . . . . . 5761 1 162 . 1 1 28 28 THR HA H 1 4.77 0.01 . 1 . . . . . . . . 5761 1 163 . 1 1 28 28 THR CB C 13 69.6 0.20 . 1 . . . . . . . . 5761 1 164 . 1 1 28 28 THR HB H 1 4.05 0.01 . 1 . . . . . . . . 5761 1 165 . 1 1 28 28 THR HG21 H 1 1.38 0.01 . 1 . . . . . . . . 5761 1 166 . 1 1 28 28 THR HG22 H 1 1.38 0.01 . 1 . . . . . . . . 5761 1 167 . 1 1 28 28 THR HG23 H 1 1.38 0.01 . 1 . . . . . . . . 5761 1 168 . 1 1 28 28 THR C C 13 173.4 0.20 . 1 . . . . . . . . 5761 1 169 . 1 1 29 29 VAL N N 15 128.7 0.25 . 1 . . . . . . . . 5761 1 170 . 1 1 29 29 VAL H H 1 9.17 0.01 . 1 . . . . . . . . 5761 1 171 . 1 1 29 29 VAL CA C 13 61.3 0.20 . 1 . . . . . . . . 5761 1 172 . 1 1 29 29 VAL HA H 1 4.51 0.01 . 1 . . . . . . . . 5761 1 173 . 1 1 29 29 VAL CB C 13 31.1 0.20 . 1 . . . . . . . . 5761 1 174 . 1 1 29 29 VAL HB H 1 2.12 0.01 . 1 . . . . . . . . 5761 1 175 . 1 1 29 29 VAL HG11 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 176 . 1 1 29 29 VAL HG12 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 177 . 1 1 29 29 VAL HG13 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 178 . 1 1 29 29 VAL C C 13 177.1 0.20 . 1 . . . . . . . . 5761 1 179 . 1 1 30 30 ILE N N 15 131.5 0.25 . 1 . . . . . . . . 5761 1 180 . 1 1 30 30 ILE H H 1 9.64 0.01 . 1 . . . . . . . . 5761 1 181 . 1 1 30 30 ILE CA C 13 58.3 0.20 . 1 . . . . . . . . 5761 1 182 . 1 1 30 30 ILE HA H 1 4.79 0.01 . 1 . . . . . . . . 5761 1 183 . 1 1 30 30 ILE CB C 13 38.7 0.20 . 1 . . . . . . . . 5761 1 184 . 1 1 30 30 ILE C C 13 176.2 0.20 . 1 . . . . . . . . 5761 1 185 . 1 1 31 31 THR N N 15 123.4 0.25 . 1 . . . . . . . . 5761 1 186 . 1 1 31 31 THR H H 1 8.65 0.01 . 1 . . . . . . . . 5761 1 187 . 1 1 31 31 THR CA C 13 61.2 0.20 . 1 . . . . . . . . 5761 1 188 . 1 1 31 31 THR HA H 1 4.62 0.01 . 1 . . . . . . . . 5761 1 189 . 1 1 31 31 THR CB C 13 67.4 0.20 . 1 . . . . . . . . 5761 1 190 . 1 1 31 31 THR HB H 1 3.90 0.01 . 1 . . . . . . . . 5761 1 191 . 1 1 31 31 THR HG21 H 1 0.96 0.01 . 1 . . . . . . . . 5761 1 192 . 1 1 31 31 THR HG22 H 1 0.96 0.01 . 1 . . . . . . . . 5761 1 193 . 1 1 31 31 THR HG23 H 1 0.96 0.01 . 1 . . . . . . . . 5761 1 194 . 1 1 31 31 THR C C 13 175.4 0.20 . 1 . . . . . . . . 5761 1 195 . 1 1 32 32 ILE N N 15 126.3 0.25 . 1 . . . . . . . . 5761 1 196 . 1 1 32 32 ILE H H 1 9.19 0.01 . 1 . . . . . . . . 5761 1 197 . 1 1 32 32 ILE CA C 13 57.7 0.20 . 1 . . . . . . . . 5761 1 198 . 1 1 32 32 ILE HA H 1 5.03 0.01 . 1 . . . . . . . . 5761 1 199 . 1 1 32 32 ILE CB C 13 36.9 0.20 . 1 . . . . . . . . 5761 1 200 . 1 1 32 32 ILE C C 13 176.4 0.20 . 1 . . . . . . . . 5761 1 201 . 1 1 33 33 GLN N N 15 120.5 0.25 . 1 . . . . . . . . 5761 1 202 . 1 1 33 33 GLN H H 1 8.77 0.01 . 1 . . . . . . . . 5761 1 203 . 1 1 33 33 GLN CA C 13 52.7 0.20 . 1 . . . . . . . . 5761 1 204 . 1 1 33 33 GLN HA H 1 5.34 0.01 . 1 . . . . . . . . 5761 1 205 . 1 1 33 33 GLN CB C 13 30.3 0.20 . 1 . . . . . . . . 5761 1 206 . 1 1 33 33 GLN HB2 H 1 2.16 0.01 . 2 . . . . . . . . 5761 1 207 . 1 1 33 33 GLN HB3 H 1 1.88 0.01 . 2 . . . . . . . . 5761 1 208 . 1 1 33 33 GLN C C 13 176.7 0.20 . 1 . . . . . . . . 5761 1 209 . 1 1 34 34 ALA N N 15 130.4 0.25 . 1 . . . . . . . . 5761 1 210 . 1 1 34 34 ALA H H 1 9.29 0.01 . 1 . . . . . . . . 5761 1 211 . 1 1 34 34 ALA CA C 13 48.7 0.20 . 1 . . . . . . . . 5761 1 212 . 1 1 34 34 ALA HA H 1 5.66 0.01 . 1 . . . . . . . . 5761 1 213 . 1 1 34 34 ALA CB C 13 19.8 0.20 . 1 . . . . . . . . 5761 1 214 . 1 1 34 34 ALA HB1 H 1 0.87 0.01 . 1 . . . . . . . . 5761 1 215 . 1 1 34 34 ALA HB2 H 1 0.87 0.01 . 1 . . . . . . . . 5761 1 216 . 1 1 34 34 ALA HB3 H 1 0.87 0.01 . 1 . . . . . . . . 5761 1 217 . 1 1 34 34 ALA C C 13 176.0 0.20 . 1 . . . . . . . . 5761 1 218 . 1 1 35 35 SER N N 15 114.6 0.25 . 1 . . . . . . . . 5761 1 219 . 1 1 35 35 SER H H 1 9.15 0.01 . 1 . . . . . . . . 5761 1 220 . 1 1 35 35 SER CA C 13 56.0 0.20 . 1 . . . . . . . . 5761 1 221 . 1 1 35 35 SER HA H 1 4.57 0.01 . 1 . . . . . . . . 5761 1 222 . 1 1 35 35 SER CB C 13 65.4 0.20 . 1 . . . . . . . . 5761 1 223 . 1 1 35 35 SER HB2 H 1 3.87 0.01 . 2 . . . . . . . . 5761 1 224 . 1 1 35 35 SER C C 13 172.5 0.20 . 1 . . . . . . . . 5761 1 225 . 1 1 36 36 ASN N N 15 121.1 0.25 . 1 . . . . . . . . 5761 1 226 . 1 1 36 36 ASN H H 1 9.30 0.01 . 1 . . . . . . . . 5761 1 227 . 1 1 36 36 ASN CA C 13 49.0 0.20 . 1 . . . . . . . . 5761 1 228 . 1 1 36 36 ASN HA H 1 5.44 0.01 . 1 . . . . . . . . 5761 1 229 . 1 1 36 36 ASN CB C 13 39.1 0.20 . 1 . . . . . . . . 5761 1 230 . 1 1 36 36 ASN HB2 H 1 2.89 0.01 . 2 . . . . . . . . 5761 1 231 . 1 1 36 36 ASN HB3 H 1 2.68 0.01 . 2 . . . . . . . . 5761 1 232 . 1 1 36 36 ASN C C 13 175.2 0.20 . 1 . . . . . . . . 5761 1 233 . 1 1 37 37 SER N N 15 117.6 0.25 . 1 . . . . . . . . 5761 1 234 . 1 1 37 37 SER H H 1 9.02 0.01 . 1 . . . . . . . . 5761 1 235 . 1 1 37 37 SER CA C 13 56.5 0.20 . 1 . . . . . . . . 5761 1 236 . 1 1 37 37 SER CB C 13 62.8 0.20 . 1 . . . . . . . . 5761 1 237 . 1 1 37 37 SER C C 13 176.7 0.20 . 1 . . . . . . . . 5761 1 238 . 1 1 38 38 THR N N 15 114.3 0.25 . 1 . . . . . . . . 5761 1 239 . 1 1 38 38 THR H H 1 8.50 0.01 . 1 . . . . . . . . 5761 1 240 . 1 1 38 38 THR CA C 13 60.1 0.20 . 1 . . . . . . . . 5761 1 241 . 1 1 38 38 THR HA H 1 4.61 0.01 . 1 . . . . . . . . 5761 1 242 . 1 1 38 38 THR CB C 13 69.6 0.20 . 1 . . . . . . . . 5761 1 243 . 1 1 38 38 THR HG21 H 1 1.45 0.01 . 1 . . . . . . . . 5761 1 244 . 1 1 38 38 THR HG22 H 1 1.45 0.01 . 1 . . . . . . . . 5761 1 245 . 1 1 38 38 THR HG23 H 1 1.45 0.01 . 1 . . . . . . . . 5761 1 246 . 1 1 38 38 THR C C 13 173.3 0.20 . 1 . . . . . . . . 5761 1 247 . 1 1 39 39 GLU N N 15 113.8 0.25 . 1 . . . . . . . . 5761 1 248 . 1 1 39 39 GLU H H 1 9.05 0.01 . 1 . . . . . . . . 5761 1 249 . 1 1 39 39 GLU CA C 13 54.4 0.20 . 1 . . . . . . . . 5761 1 250 . 1 1 39 39 GLU CB C 13 28.5 0.20 . 1 . . . . . . . . 5761 1 251 . 1 1 39 39 GLU C C 13 176.5 0.20 . 1 . . . . . . . . 5761 1 252 . 1 1 40 40 LEU N N 15 120.1 0.25 . 1 . . . . . . . . 5761 1 253 . 1 1 40 40 LEU H H 1 7.77 0.01 . 1 . . . . . . . . 5761 1 254 . 1 1 40 40 LEU CA C 13 51.8 0.20 . 1 . . . . . . . . 5761 1 255 . 1 1 40 40 LEU HA H 1 4.77 0.01 . 1 . . . . . . . . 5761 1 256 . 1 1 40 40 LEU CB C 13 45.5 0.20 . 1 . . . . . . . . 5761 1 257 . 1 1 40 40 LEU HB2 H 1 1.66 0.01 . 2 . . . . . . . . 5761 1 258 . 1 1 40 40 LEU C C 13 177.7 0.20 . 1 . . . . . . . . 5761 1 259 . 1 1 41 41 ASP N N 15 122.8 0.25 . 1 . . . . . . . . 5761 1 260 . 1 1 41 41 ASP H H 1 8.87 0.01 . 1 . . . . . . . . 5761 1 261 . 1 1 41 41 ASP CA C 13 54.2 0.20 . 1 . . . . . . . . 5761 1 262 . 1 1 41 41 ASP CB C 13 39.8 0.20 . 1 . . . . . . . . 5761 1 263 . 1 1 41 41 ASP C C 13 176.6 0.20 . 1 . . . . . . . . 5761 1 264 . 1 1 42 42 MET N N 15 121.6 0.25 . 1 . . . . . . . . 5761 1 265 . 1 1 42 42 MET H H 1 7.84 0.01 . 1 . . . . . . . . 5761 1 266 . 1 1 42 42 MET CA C 13 53.7 0.20 . 1 . . . . . . . . 5761 1 267 . 1 1 42 42 MET HA H 1 5.35 0.01 . 1 . . . . . . . . 5761 1 268 . 1 1 42 42 MET CB C 13 31.1 0.20 . 1 . . . . . . . . 5761 1 269 . 1 1 42 42 MET C C 13 177.0 0.20 . 1 . . . . . . . . 5761 1 270 . 1 1 43 43 THR N N 15 112.9 0.25 . 1 . . . . . . . . 5761 1 271 . 1 1 43 43 THR H H 1 9.20 0.01 . 1 . . . . . . . . 5761 1 272 . 1 1 43 43 THR CA C 13 59.1 0.20 . 1 . . . . . . . . 5761 1 273 . 1 1 43 43 THR HA H 1 5.04 0.01 . 1 . . . . . . . . 5761 1 274 . 1 1 43 43 THR CB C 13 69.8 0.20 . 1 . . . . . . . . 5761 1 275 . 1 1 43 43 THR C C 13 174.5 0.20 . 1 . . . . . . . . 5761 1 276 . 1 1 44 44 ASP N N 15 118.5 0.25 . 1 . . . . . . . . 5761 1 277 . 1 1 44 44 ASP H H 1 8.89 0.01 . 1 . . . . . . . . 5761 1 278 . 1 1 44 44 ASP CA C 13 53.9 0.20 . 1 . . . . . . . . 5761 1 279 . 1 1 44 44 ASP HA H 1 4.22 0.01 . 1 . . . . . . . . 5761 1 280 . 1 1 44 44 ASP CB C 13 38.6 0.20 . 1 . . . . . . . . 5761 1 281 . 1 1 44 44 ASP HB2 H 1 2.77 0.01 . 2 . . . . . . . . 5761 1 282 . 1 1 44 44 ASP C C 13 175.4 0.20 . 1 . . . . . . . . 5761 1 283 . 1 1 45 45 PHE N N 15 117.9 0.25 . 1 . . . . . . . . 5761 1 284 . 1 1 45 45 PHE H H 1 9.04 0.01 . 1 . . . . . . . . 5761 1 285 . 1 1 45 45 PHE CA C 13 57.8 0.20 . 1 . . . . . . . . 5761 1 286 . 1 1 45 45 PHE HA H 1 4.82 0.01 . 1 . . . . . . . . 5761 1 287 . 1 1 45 45 PHE CB C 13 38.8 0.20 . 1 . . . . . . . . 5761 1 288 . 1 1 45 45 PHE C C 13 177.5 0.20 . 1 . . . . . . . . 5761 1 289 . 1 1 46 46 VAL N N 15 131.2 0.25 . 1 . . . . . . . . 5761 1 290 . 1 1 46 46 VAL H H 1 8.90 0.01 . 1 . . . . . . . . 5761 1 291 . 1 1 46 46 VAL CA C 13 61.4 0.20 . 1 . . . . . . . . 5761 1 292 . 1 1 46 46 VAL HA H 1 3.99 0.01 . 1 . . . . . . . . 5761 1 293 . 1 1 46 46 VAL CB C 13 33.4 0.20 . 1 . . . . . . . . 5761 1 294 . 1 1 46 46 VAL HB H 1 1.95 0.01 . 1 . . . . . . . . 5761 1 295 . 1 1 46 46 VAL HG11 H 1 0.80 0.01 . 2 . . . . . . . . 5761 1 296 . 1 1 46 46 VAL HG12 H 1 0.80 0.01 . 2 . . . . . . . . 5761 1 297 . 1 1 46 46 VAL HG13 H 1 0.80 0.01 . 2 . . . . . . . . 5761 1 298 . 1 1 46 46 VAL C C 13 174.4 0.20 . 1 . . . . . . . . 5761 1 299 . 1 1 47 47 PHE N N 15 128.7 0.25 . 1 . . . . . . . . 5761 1 300 . 1 1 47 47 PHE H H 1 8.57 0.01 . 1 . . . . . . . . 5761 1 301 . 1 1 47 47 PHE CA C 13 55.4 0.20 . 1 . . . . . . . . 5761 1 302 . 1 1 47 47 PHE HA H 1 4.65 0.01 . 1 . . . . . . . . 5761 1 303 . 1 1 47 47 PHE CB C 13 39.9 0.20 . 1 . . . . . . . . 5761 1 304 . 1 1 47 47 PHE HB2 H 1 3.30 0.01 . 2 . . . . . . . . 5761 1 305 . 1 1 47 47 PHE HB3 H 1 2.73 0.01 . 2 . . . . . . . . 5761 1 306 . 1 1 47 47 PHE C C 13 174.8 0.20 . 1 . . . . . . . . 5761 1 307 . 1 1 48 48 GLN N N 15 125.0 0.25 . 1 . . . . . . . . 5761 1 308 . 1 1 48 48 GLN H H 1 7.98 0.01 . 1 . . . . . . . . 5761 1 309 . 1 1 48 48 GLN CA C 13 53.1 0.20 . 1 . . . . . . . . 5761 1 310 . 1 1 48 48 GLN HA H 1 4.37 0.01 . 1 . . . . . . . . 5761 1 311 . 1 1 48 48 GLN CB C 13 32.2 0.20 . 1 . . . . . . . . 5761 1 312 . 1 1 48 48 GLN HB2 H 1 2.19 0.01 . 2 . . . . . . . . 5761 1 313 . 1 1 48 48 GLN HB3 H 1 1.66 0.01 . 2 . . . . . . . . 5761 1 314 . 1 1 48 48 GLN HG2 H 1 1.97 0.01 . 2 . . . . . . . . 5761 1 315 . 1 1 48 48 GLN C C 13 174.1 0.20 . 1 . . . . . . . . 5761 1 316 . 1 1 49 49 ALA N N 15 120.4 0.25 . 1 . . . . . . . . 5761 1 317 . 1 1 49 49 ALA H H 1 7.83 0.01 . 1 . . . . . . . . 5761 1 318 . 1 1 49 49 ALA CA C 13 49.2 0.20 . 1 . . . . . . . . 5761 1 319 . 1 1 49 49 ALA HA H 1 5.11 0.01 . 1 . . . . . . . . 5761 1 320 . 1 1 49 49 ALA CB C 13 22.9 0.20 . 1 . . . . . . . . 5761 1 321 . 1 1 49 49 ALA HB1 H 1 1.30 0.01 . 1 . . . . . . . . 5761 1 322 . 1 1 49 49 ALA HB2 H 1 1.30 0.01 . 1 . . . . . . . . 5761 1 323 . 1 1 49 49 ALA HB3 H 1 1.30 0.01 . 1 . . . . . . . . 5761 1 324 . 1 1 49 49 ALA C C 13 176.1 0.20 . 1 . . . . . . . . 5761 1 325 . 1 1 50 50 ALA N N 15 121.7 0.25 . 1 . . . . . . . . 5761 1 326 . 1 1 50 50 ALA H H 1 8.79 0.01 . 1 . . . . . . . . 5761 1 327 . 1 1 50 50 ALA CA C 13 49.9 0.20 . 1 . . . . . . . . 5761 1 328 . 1 1 50 50 ALA HA H 1 4.82 0.01 . 1 . . . . . . . . 5761 1 329 . 1 1 50 50 ALA CB C 13 21.2 0.20 . 1 . . . . . . . . 5761 1 330 . 1 1 50 50 ALA HB1 H 1 1.33 0.01 . 1 . . . . . . . . 5761 1 331 . 1 1 50 50 ALA HB2 H 1 1.33 0.01 . 1 . . . . . . . . 5761 1 332 . 1 1 50 50 ALA HB3 H 1 1.33 0.01 . 1 . . . . . . . . 5761 1 333 . 1 1 50 50 ALA C C 13 177.7 0.20 . 1 . . . . . . . . 5761 1 334 . 1 1 51 51 VAL N N 15 114.3 0.25 . 1 . . . . . . . . 5761 1 335 . 1 1 51 51 VAL H H 1 8.48 0.01 . 1 . . . . . . . . 5761 1 336 . 1 1 51 51 VAL CA C 13 56.6 0.20 . 1 . . . . . . . . 5761 1 337 . 1 1 51 51 VAL HA H 1 4.99 0.01 . 1 . . . . . . . . 5761 1 338 . 1 1 51 51 VAL CB C 13 32.0 0.20 . 1 . . . . . . . . 5761 1 339 . 1 1 52 52 PRO CA C 13 61.3 0.20 . 1 . . . . . . . . 5761 1 340 . 1 1 52 52 PRO CB C 13 31.3 0.20 . 1 . . . . . . . . 5761 1 341 . 1 1 52 52 PRO C C 13 177.8 0.20 . 1 . . . . . . . . 5761 1 342 . 1 1 53 53 LYS N N 15 117.9 0.25 . 1 . . . . . . . . 5761 1 343 . 1 1 53 53 LYS H H 1 8.43 0.01 . 1 . . . . . . . . 5761 1 344 . 1 1 53 53 LYS CA C 13 57.3 0.20 . 1 . . . . . . . . 5761 1 345 . 1 1 53 53 LYS HA H 1 5.10 0.01 . 1 . . . . . . . . 5761 1 346 . 1 1 53 53 LYS CB C 13 31.3 0.20 . 1 . . . . . . . . 5761 1 347 . 1 1 54 54 THR CA C 13 61.9 0.20 . 1 . . . . . . . . 5761 1 348 . 1 1 54 54 THR CB C 13 67.7 0.20 . 1 . . . . . . . . 5761 1 349 . 1 1 54 54 THR C C 13 175.3 0.20 . 1 . . . . . . . . 5761 1 350 . 1 1 55 55 PHE N N 15 120.8 0.25 . 1 . . . . . . . . 5761 1 351 . 1 1 55 55 PHE H H 1 8.15 0.01 . 1 . . . . . . . . 5761 1 352 . 1 1 55 55 PHE CA C 13 54.9 0.20 . 1 . . . . . . . . 5761 1 353 . 1 1 55 55 PHE HA H 1 5.16 0.01 . 1 . . . . . . . . 5761 1 354 . 1 1 55 55 PHE CB C 13 40.2 0.20 . 1 . . . . . . . . 5761 1 355 . 1 1 55 55 PHE HB2 H 1 3.10 0.01 . 2 . . . . . . . . 5761 1 356 . 1 1 55 55 PHE HB3 H 1 2.96 0.01 . 2 . . . . . . . . 5761 1 357 . 1 1 55 55 PHE C C 13 176.2 0.20 . 1 . . . . . . . . 5761 1 358 . 1 1 56 56 GLN N N 15 116.2 0.25 . 1 . . . . . . . . 5761 1 359 . 1 1 56 56 GLN H H 1 8.27 0.01 . 1 . . . . . . . . 5761 1 360 . 1 1 56 56 GLN CA C 13 53.6 0.20 . 1 . . . . . . . . 5761 1 361 . 1 1 56 56 GLN HA H 1 4.80 0.01 . 1 . . . . . . . . 5761 1 362 . 1 1 56 56 GLN CB C 13 31.1 0.20 . 1 . . . . . . . . 5761 1 363 . 1 1 56 56 GLN HB2 H 1 2.38 0.01 . 2 . . . . . . . . 5761 1 364 . 1 1 56 56 GLN HB3 H 1 2.01 0.01 . 2 . . . . . . . . 5761 1 365 . 1 1 56 56 GLN HG2 H 1 2.19 0.01 . 2 . . . . . . . . 5761 1 366 . 1 1 56 56 GLN C C 13 175.5 0.20 . 1 . . . . . . . . 5761 1 367 . 1 1 57 57 LEU N N 15 123.7 0.25 . 1 . . . . . . . . 5761 1 368 . 1 1 57 57 LEU H H 1 8.80 0.01 . 1 . . . . . . . . 5761 1 369 . 1 1 57 57 LEU CA C 13 52.8 0.20 . 1 . . . . . . . . 5761 1 370 . 1 1 57 57 LEU HA H 1 5.44 0.01 . 1 . . . . . . . . 5761 1 371 . 1 1 57 57 LEU CB C 13 44.9 0.20 . 1 . . . . . . . . 5761 1 372 . 1 1 57 57 LEU HB2 H 1 1.61 0.01 . 2 . . . . . . . . 5761 1 373 . 1 1 57 57 LEU HD11 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 374 . 1 1 57 57 LEU HD12 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 375 . 1 1 57 57 LEU HD13 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 376 . 1 1 57 57 LEU C C 13 177.1 0.20 . 1 . . . . . . . . 5761 1 377 . 1 1 58 58 GLN N N 15 123.9 0.25 . 1 . . . . . . . . 5761 1 378 . 1 1 58 58 GLN H H 1 9.00 0.01 . 1 . . . . . . . . 5761 1 379 . 1 1 58 58 GLN CA C 13 53.5 0.20 . 1 . . . . . . . . 5761 1 380 . 1 1 58 58 GLN HA H 1 4.67 0.01 . 1 . . . . . . . . 5761 1 381 . 1 1 58 58 GLN CB C 13 30.6 0.20 . 1 . . . . . . . . 5761 1 382 . 1 1 58 58 GLN HB2 H 1 2.37 0.01 . 2 . . . . . . . . 5761 1 383 . 1 1 58 58 GLN HB3 H 1 2.04 0.01 . 2 . . . . . . . . 5761 1 384 . 1 1 58 58 GLN HG2 H 1 2.25 0.01 . 2 . . . . . . . . 5761 1 385 . 1 1 58 58 GLN HG3 H 1 1.97 0.01 . 2 . . . . . . . . 5761 1 386 . 1 1 58 58 GLN C C 13 174.9 0.20 . 1 . . . . . . . . 5761 1 387 . 1 1 59 59 LEU N N 15 127.3 0.25 . 1 . . . . . . . . 5761 1 388 . 1 1 59 59 LEU H H 1 8.95 0.01 . 1 . . . . . . . . 5761 1 389 . 1 1 59 59 LEU CA C 13 53.8 0.20 . 1 . . . . . . . . 5761 1 390 . 1 1 59 59 LEU HA H 1 4.91 0.01 . 1 . . . . . . . . 5761 1 391 . 1 1 59 59 LEU CB C 13 42.5 0.20 . 1 . . . . . . . . 5761 1 392 . 1 1 59 59 LEU HB2 H 1 1.60 0.01 . 2 . . . . . . . . 5761 1 393 . 1 1 59 59 LEU C C 13 177.7 0.20 . 1 . . . . . . . . 5761 1 394 . 1 1 60 60 LEU N N 15 127.2 0.25 . 1 . . . . . . . . 5761 1 395 . 1 1 60 60 LEU H H 1 8.66 0.01 . 1 . . . . . . . . 5761 1 396 . 1 1 60 60 LEU CA C 13 53.5 0.20 . 1 . . . . . . . . 5761 1 397 . 1 1 60 60 LEU HA H 1 4.70 0.01 . 1 . . . . . . . . 5761 1 398 . 1 1 60 60 LEU CB C 13 39.7 0.20 . 1 . . . . . . . . 5761 1 399 . 1 1 60 60 LEU C C 13 177.4 0.20 . 1 . . . . . . . . 5761 1 400 . 1 1 61 61 SER N N 15 113.8 0.25 . 1 . . . . . . . . 5761 1 401 . 1 1 61 61 SER H H 1 8.16 0.01 . 1 . . . . . . . . 5761 1 402 . 1 1 61 61 SER CA C 13 56.6 0.20 . 1 . . . . . . . . 5761 1 403 . 1 1 61 61 SER CB C 13 61.5 0.20 . 1 . . . . . . . . 5761 1 404 . 1 1 62 62 PRO CA C 13 60.5 0.20 . 1 . . . . . . . . 5761 1 405 . 1 1 62 62 PRO CB C 13 31.5 0.20 . 1 . . . . . . . . 5761 1 406 . 1 1 62 62 PRO C C 13 179.1 0.20 . 1 . . . . . . . . 5761 1 407 . 1 1 63 63 SER N N 15 114.8 0.25 . 1 . . . . . . . . 5761 1 408 . 1 1 63 63 SER H H 1 9.09 0.01 . 1 . . . . . . . . 5761 1 409 . 1 1 63 63 SER CA C 13 59.8 0.20 . 1 . . . . . . . . 5761 1 410 . 1 1 63 63 SER CB C 13 62.0 0.20 . 1 . . . . . . . . 5761 1 411 . 1 1 63 63 SER C C 13 175.9 0.20 . 1 . . . . . . . . 5761 1 412 . 1 1 64 64 SER N N 15 112.3 0.25 . 1 . . . . . . . . 5761 1 413 . 1 1 64 64 SER H H 1 7.43 0.01 . 1 . . . . . . . . 5761 1 414 . 1 1 64 64 SER CA C 13 55.7 0.20 . 1 . . . . . . . . 5761 1 415 . 1 1 64 64 SER HA H 1 4.26 0.01 . 1 . . . . . . . . 5761 1 416 . 1 1 64 64 SER CB C 13 62.5 0.20 . 1 . . . . . . . . 5761 1 417 . 1 1 64 64 SER HB2 H 1 3.68 0.01 . 2 . . . . . . . . 5761 1 418 . 1 1 65 65 SER CA C 13 57.1 0.20 . 1 . . . . . . . . 5761 1 419 . 1 1 65 65 SER CB C 13 63.8 0.20 . 1 . . . . . . . . 5761 1 420 . 1 1 65 65 SER C C 13 173.7 0.20 . 1 . . . . . . . . 5761 1 421 . 1 1 66 66 VAL N N 15 121.3 0.25 . 1 . . . . . . . . 5761 1 422 . 1 1 66 66 VAL H H 1 7.91 0.01 . 1 . . . . . . . . 5761 1 423 . 1 1 66 66 VAL CA C 13 59.0 0.20 . 1 . . . . . . . . 5761 1 424 . 1 1 66 66 VAL HA H 1 4.92 0.01 . 1 . . . . . . . . 5761 1 425 . 1 1 66 66 VAL CB C 13 33.8 0.20 . 1 . . . . . . . . 5761 1 426 . 1 1 66 66 VAL HB H 1 1.85 0.01 . 1 . . . . . . . . 5761 1 427 . 1 1 66 66 VAL HG11 H 1 0.94 0.01 . 2 . . . . . . . . 5761 1 428 . 1 1 66 66 VAL HG12 H 1 0.94 0.01 . 2 . . . . . . . . 5761 1 429 . 1 1 66 66 VAL HG13 H 1 0.94 0.01 . 2 . . . . . . . . 5761 1 430 . 1 1 66 66 VAL HG21 H 1 0.69 0.01 . 2 . . . . . . . . 5761 1 431 . 1 1 66 66 VAL HG22 H 1 0.69 0.01 . 2 . . . . . . . . 5761 1 432 . 1 1 66 66 VAL HG23 H 1 0.69 0.01 . 2 . . . . . . . . 5761 1 433 . 1 1 66 66 VAL C C 13 175.7 0.20 . 1 . . . . . . . . 5761 1 434 . 1 1 67 67 VAL N N 15 127.6 0.25 . 1 . . . . . . . . 5761 1 435 . 1 1 67 67 VAL H H 1 9.16 0.01 . 1 . . . . . . . . 5761 1 436 . 1 1 67 67 VAL CA C 13 56.7 0.20 . 1 . . . . . . . . 5761 1 437 . 1 1 67 67 VAL HA H 1 4.31 0.01 . 1 . . . . . . . . 5761 1 438 . 1 1 67 67 VAL CB C 13 29.0 0.20 . 1 . . . . . . . . 5761 1 439 . 1 1 67 67 VAL HB H 1 2.04 0.01 . 1 . . . . . . . . 5761 1 440 . 1 1 67 67 VAL HG11 H 1 0.59 0.01 . 2 . . . . . . . . 5761 1 441 . 1 1 67 67 VAL HG12 H 1 0.59 0.01 . 2 . . . . . . . . 5761 1 442 . 1 1 67 67 VAL HG13 H 1 0.59 0.01 . 2 . . . . . . . . 5761 1 443 . 1 1 68 68 PRO CA C 13 61.9 0.20 . 1 . . . . . . . . 5761 1 444 . 1 1 68 68 PRO CB C 13 31.9 0.20 . 1 . . . . . . . . 5761 1 445 . 1 1 68 68 PRO C C 13 176.8 0.20 . 1 . . . . . . . . 5761 1 446 . 1 1 69 69 ALA N N 15 120.3 0.25 . 1 . . . . . . . . 5761 1 447 . 1 1 69 69 ALA H H 1 8.37 0.01 . 1 . . . . . . . . 5761 1 448 . 1 1 69 69 ALA CA C 13 51.0 0.20 . 1 . . . . . . . . 5761 1 449 . 1 1 69 69 ALA CB C 13 19.2 0.20 . 1 . . . . . . . . 5761 1 450 . 1 1 69 69 ALA HB1 H 1 0.96 0.01 . 1 . . . . . . . . 5761 1 451 . 1 1 69 69 ALA HB2 H 1 0.96 0.01 . 1 . . . . . . . . 5761 1 452 . 1 1 69 69 ALA HB3 H 1 0.96 0.01 . 1 . . . . . . . . 5761 1 453 . 1 1 69 69 ALA C C 13 178.7 0.20 . 1 . . . . . . . . 5761 1 454 . 1 1 70 70 PHE N N 15 113.2 0.25 . 1 . . . . . . . . 5761 1 455 . 1 1 70 70 PHE H H 1 8.67 0.01 . 1 . . . . . . . . 5761 1 456 . 1 1 70 70 PHE CA C 13 57.7 0.20 . 1 . . . . . . . . 5761 1 457 . 1 1 70 70 PHE HA H 1 4.06 0.01 . 1 . . . . . . . . 5761 1 458 . 1 1 70 70 PHE CB C 13 35.0 0.20 . 1 . . . . . . . . 5761 1 459 . 1 1 70 70 PHE HB2 H 1 3.42 0.01 . 2 . . . . . . . . 5761 1 460 . 1 1 70 70 PHE HB3 H 1 3.05 0.01 . 2 . . . . . . . . 5761 1 461 . 1 1 70 70 PHE C C 13 176.3 0.20 . 1 . . . . . . . . 5761 1 462 . 1 1 71 71 ASN N N 15 113.2 0.25 . 1 . . . . . . . . 5761 1 463 . 1 1 71 71 ASN H H 1 9.47 0.01 . 1 . . . . . . . . 5761 1 464 . 1 1 71 71 ASN CA C 13 53.8 0.20 . 1 . . . . . . . . 5761 1 465 . 1 1 71 71 ASN HA H 1 5.05 0.01 . 1 . . . . . . . . 5761 1 466 . 1 1 71 71 ASN CB C 13 36.5 0.20 . 1 . . . . . . . . 5761 1 467 . 1 1 71 71 ASN HB2 H 1 3.11 0.01 . 2 . . . . . . . . 5761 1 468 . 1 1 71 71 ASN HB3 H 1 2.65 0.01 . 2 . . . . . . . . 5761 1 469 . 1 1 71 71 ASN C C 13 178.8 0.20 . 1 . . . . . . . . 5761 1 470 . 1 1 72 72 THR N N 15 106.7 0.25 . 1 . . . . . . . . 5761 1 471 . 1 1 72 72 THR H H 1 7.34 0.01 . 1 . . . . . . . . 5761 1 472 . 1 1 72 72 THR CA C 13 62.1 0.20 . 1 . . . . . . . . 5761 1 473 . 1 1 72 72 THR HA H 1 4.68 0.01 . 1 . . . . . . . . 5761 1 474 . 1 1 72 72 THR CB C 13 68.2 0.20 . 1 . . . . . . . . 5761 1 475 . 1 1 72 72 THR HB H 1 4.21 0.01 . 1 . . . . . . . . 5761 1 476 . 1 1 72 72 THR HG21 H 1 1.38 0.01 . 1 . . . . . . . . 5761 1 477 . 1 1 72 72 THR HG22 H 1 1.38 0.01 . 1 . . . . . . . . 5761 1 478 . 1 1 72 72 THR HG23 H 1 1.38 0.01 . 1 . . . . . . . . 5761 1 479 . 1 1 72 72 THR C C 13 175.8 0.20 . 1 . . . . . . . . 5761 1 480 . 1 1 73 73 GLY N N 15 107.0 0.25 . 1 . . . . . . . . 5761 1 481 . 1 1 73 73 GLY H H 1 7.20 0.01 . 1 . . . . . . . . 5761 1 482 . 1 1 73 73 GLY CA C 13 43.5 0.20 . 1 . . . . . . . . 5761 1 483 . 1 1 73 73 GLY HA2 H 1 4.12 0.01 . 2 . . . . . . . . 5761 1 484 . 1 1 73 73 GLY C C 13 172.7 0.20 . 1 . . . . . . . . 5761 1 485 . 1 1 74 74 THR N N 15 111.0 0.25 . 1 . . . . . . . . 5761 1 486 . 1 1 74 74 THR H H 1 8.34 0.01 . 1 . . . . . . . . 5761 1 487 . 1 1 74 74 THR CA C 13 58.2 0.20 . 1 . . . . . . . . 5761 1 488 . 1 1 74 74 THR HA H 1 5.23 0.01 . 1 . . . . . . . . 5761 1 489 . 1 1 74 74 THR CB C 13 71.4 0.20 . 1 . . . . . . . . 5761 1 490 . 1 1 74 74 THR C C 13 177.3 0.20 . 1 . . . . . . . . 5761 1 491 . 1 1 75 75 ILE N N 15 118.5 0.25 . 1 . . . . . . . . 5761 1 492 . 1 1 75 75 ILE H H 1 8.19 0.01 . 1 . . . . . . . . 5761 1 493 . 1 1 75 75 ILE CA C 13 60.3 0.20 . 1 . . . . . . . . 5761 1 494 . 1 1 75 75 ILE HA H 1 4.15 0.01 . 1 . . . . . . . . 5761 1 495 . 1 1 75 75 ILE CB C 13 39.2 0.20 . 1 . . . . . . . . 5761 1 496 . 1 1 75 75 ILE HG21 H 1 0.89 0.01 . 1 . . . . . . . . 5761 1 497 . 1 1 75 75 ILE HG22 H 1 0.89 0.01 . 1 . . . . . . . . 5761 1 498 . 1 1 75 75 ILE HG23 H 1 0.89 0.01 . 1 . . . . . . . . 5761 1 499 . 1 1 75 75 ILE C C 13 176.5 0.20 . 1 . . . . . . . . 5761 1 500 . 1 1 76 76 THR N N 15 117.8 0.25 . 1 . . . . . . . . 5761 1 501 . 1 1 76 76 THR H H 1 8.64 0.01 . 1 . . . . . . . . 5761 1 502 . 1 1 76 76 THR CA C 13 58.4 0.20 . 1 . . . . . . . . 5761 1 503 . 1 1 76 76 THR HA H 1 5.62 0.01 . 1 . . . . . . . . 5761 1 504 . 1 1 76 76 THR CB C 13 70.6 0.20 . 1 . . . . . . . . 5761 1 505 . 1 1 76 76 THR HB H 1 3.90 0.01 . 1 . . . . . . . . 5761 1 506 . 1 1 76 76 THR HG21 H 1 1.11 0.01 . 1 . . . . . . . . 5761 1 507 . 1 1 76 76 THR HG22 H 1 1.11 0.01 . 1 . . . . . . . . 5761 1 508 . 1 1 76 76 THR HG23 H 1 1.11 0.01 . 1 . . . . . . . . 5761 1 509 . 1 1 76 76 THR C C 13 175.2 0.20 . 1 . . . . . . . . 5761 1 510 . 1 1 77 77 GLN N N 15 123.6 0.25 . 1 . . . . . . . . 5761 1 511 . 1 1 77 77 GLN H H 1 7.99 0.01 . 1 . . . . . . . . 5761 1 512 . 1 1 77 77 GLN CA C 13 55.0 0.20 . 1 . . . . . . . . 5761 1 513 . 1 1 77 77 GLN HA H 1 4.45 0.01 . 1 . . . . . . . . 5761 1 514 . 1 1 77 77 GLN CB C 13 29.6 0.20 . 1 . . . . . . . . 5761 1 515 . 1 1 77 77 GLN HB2 H 1 2.09 0.01 . 2 . . . . . . . . 5761 1 516 . 1 1 77 77 GLN HB3 H 1 1.64 0.01 . 2 . . . . . . . . 5761 1 517 . 1 1 77 77 GLN C C 13 174.0 0.20 . 1 . . . . . . . . 5761 1 518 . 1 1 78 78 VAL N N 15 128.3 0.25 . 1 . . . . . . . . 5761 1 519 . 1 1 78 78 VAL H H 1 8.45 0.01 . 1 . . . . . . . . 5761 1 520 . 1 1 78 78 VAL CA C 13 60.9 0.20 . 1 . . . . . . . . 5761 1 521 . 1 1 78 78 VAL HA H 1 4.77 0.01 . 1 . . . . . . . . 5761 1 522 . 1 1 78 78 VAL CB C 13 32.0 0.20 . 1 . . . . . . . . 5761 1 523 . 1 1 78 78 VAL HB H 1 1.86 0.01 . 1 . . . . . . . . 5761 1 524 . 1 1 78 78 VAL HG11 H 1 0.91 0.01 . 2 . . . . . . . . 5761 1 525 . 1 1 78 78 VAL HG12 H 1 0.91 0.01 . 2 . . . . . . . . 5761 1 526 . 1 1 78 78 VAL HG13 H 1 0.91 0.01 . 2 . . . . . . . . 5761 1 527 . 1 1 78 78 VAL HG21 H 1 0.77 0.01 . 2 . . . . . . . . 5761 1 528 . 1 1 78 78 VAL HG22 H 1 0.77 0.01 . 2 . . . . . . . . 5761 1 529 . 1 1 78 78 VAL HG23 H 1 0.77 0.01 . 2 . . . . . . . . 5761 1 530 . 1 1 78 78 VAL C C 13 175.1 0.20 . 1 . . . . . . . . 5761 1 531 . 1 1 79 79 ILE N N 15 123.8 0.25 . 1 . . . . . . . . 5761 1 532 . 1 1 79 79 ILE H H 1 9.33 0.01 . 1 . . . . . . . . 5761 1 533 . 1 1 79 79 ILE CA C 13 58.1 0.20 . 1 . . . . . . . . 5761 1 534 . 1 1 79 79 ILE HA H 1 4.89 0.01 . 1 . . . . . . . . 5761 1 535 . 1 1 79 79 ILE CB C 13 40.1 0.20 . 1 . . . . . . . . 5761 1 536 . 1 1 79 79 ILE HB H 1 1.73 0.01 . 1 . . . . . . . . 5761 1 537 . 1 1 79 79 ILE HG21 H 1 0.83 0.01 . 1 . . . . . . . . 5761 1 538 . 1 1 79 79 ILE HG22 H 1 0.83 0.01 . 1 . . . . . . . . 5761 1 539 . 1 1 79 79 ILE HG23 H 1 0.83 0.01 . 1 . . . . . . . . 5761 1 540 . 1 1 79 79 ILE C C 13 176.2 0.20 . 1 . . . . . . . . 5761 1 541 . 1 1 80 80 LYS N N 15 124.0 0.25 . 1 . . . . . . . . 5761 1 542 . 1 1 80 80 LYS H H 1 9.21 0.01 . 1 . . . . . . . . 5761 1 543 . 1 1 80 80 LYS CA C 13 54.2 0.20 . 1 . . . . . . . . 5761 1 544 . 1 1 80 80 LYS HA H 1 5.06 0.01 . 1 . . . . . . . . 5761 1 545 . 1 1 80 80 LYS CB C 13 33.3 0.20 . 1 . . . . . . . . 5761 1 546 . 1 1 80 80 LYS HB2 H 1 1.78 0.01 . 2 . . . . . . . . 5761 1 547 . 1 1 80 80 LYS HB3 H 1 1.66 0.01 . 2 . . . . . . . . 5761 1 548 . 1 1 80 80 LYS C C 13 176.7 0.20 . 1 . . . . . . . . 5761 1 549 . 1 1 81 81 VAL N N 15 123.5 0.25 . 1 . . . . . . . . 5761 1 550 . 1 1 81 81 VAL H H 1 9.06 0.01 . 1 . . . . . . . . 5761 1 551 . 1 1 81 81 VAL CA C 13 59.5 0.20 . 1 . . . . . . . . 5761 1 552 . 1 1 81 81 VAL HA H 1 4.91 0.01 . 1 . . . . . . . . 5761 1 553 . 1 1 81 81 VAL CB C 13 33.1 0.20 . 1 . . . . . . . . 5761 1 554 . 1 1 81 81 VAL HB H 1 2.12 0.01 . 1 . . . . . . . . 5761 1 555 . 1 1 81 81 VAL HG11 H 1 0.99 0.01 . 2 . . . . . . . . 5761 1 556 . 1 1 81 81 VAL HG12 H 1 0.99 0.01 . 2 . . . . . . . . 5761 1 557 . 1 1 81 81 VAL HG13 H 1 0.99 0.01 . 2 . . . . . . . . 5761 1 558 . 1 1 81 81 VAL HG21 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 559 . 1 1 81 81 VAL HG22 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 560 . 1 1 81 81 VAL HG23 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 561 . 1 1 81 81 VAL C C 13 175.3 0.20 . 1 . . . . . . . . 5761 1 562 . 1 1 82 82 LEU N N 15 129.2 0.25 . 1 . . . . . . . . 5761 1 563 . 1 1 82 82 LEU H H 1 9.15 0.01 . 1 . . . . . . . . 5761 1 564 . 1 1 82 82 LEU CA C 13 53.6 0.20 . 1 . . . . . . . . 5761 1 565 . 1 1 82 82 LEU HA H 1 4.95 0.01 . 1 . . . . . . . . 5761 1 566 . 1 1 82 82 LEU CB C 13 42.2 0.20 . 1 . . . . . . . . 5761 1 567 . 1 1 82 82 LEU HB2 H 1 1.74 0.01 . 2 . . . . . . . . 5761 1 568 . 1 1 82 82 LEU HB3 H 1 1.66 0.01 . 2 . . . . . . . . 5761 1 569 . 1 1 82 82 LEU HD11 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 570 . 1 1 82 82 LEU HD12 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 571 . 1 1 82 82 LEU HD13 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 572 . 1 1 82 82 LEU C C 13 176.9 0.20 . 1 . . . . . . . . 5761 1 573 . 1 1 83 83 ASN N N 15 120.4 0.25 . 1 . . . . . . . . 5761 1 574 . 1 1 83 83 ASN H H 1 8.76 0.01 . 1 . . . . . . . . 5761 1 575 . 1 1 83 83 ASN CA C 13 53.2 0.20 . 1 . . . . . . . . 5761 1 576 . 1 1 83 83 ASN HA H 1 5.17 0.01 . 1 . . . . . . . . 5761 1 577 . 1 1 83 83 ASN CB C 13 38.6 0.20 . 1 . . . . . . . . 5761 1 578 . 1 1 83 83 ASN HB2 H 1 3.46 0.01 . 2 . . . . . . . . 5761 1 579 . 1 1 84 84 PRO CA C 13 63.6 0.20 . 1 . . . . . . . . 5761 1 580 . 1 1 84 84 PRO CB C 13 31.0 0.20 . 1 . . . . . . . . 5761 1 581 . 1 1 84 84 PRO C C 13 179.4 0.20 . 1 . . . . . . . . 5761 1 582 . 1 1 85 85 GLN N N 15 113.8 0.25 . 1 . . . . . . . . 5761 1 583 . 1 1 85 85 GLN H H 1 8.70 0.01 . 1 . . . . . . . . 5761 1 584 . 1 1 85 85 GLN CA C 13 54.0 0.20 . 1 . . . . . . . . 5761 1 585 . 1 1 85 85 GLN HA H 1 4.40 0.01 . 1 . . . . . . . . 5761 1 586 . 1 1 85 85 GLN CB C 13 27.0 0.20 . 1 . . . . . . . . 5761 1 587 . 1 1 85 85 GLN HB2 H 1 2.30 0.01 . 2 . . . . . . . . 5761 1 588 . 1 1 85 85 GLN HB3 H 1 1.91 0.01 . 2 . . . . . . . . 5761 1 589 . 1 1 85 85 GLN C C 13 176.3 0.20 . 1 . . . . . . . . 5761 1 590 . 1 1 86 86 LYS N N 15 118.6 0.25 . 1 . . . . . . . . 5761 1 591 . 1 1 86 86 LYS H H 1 7.63 0.01 . 1 . . . . . . . . 5761 1 592 . 1 1 86 86 LYS CA C 13 56.6 0.20 . 1 . . . . . . . . 5761 1 593 . 1 1 86 86 LYS HA H 1 3.83 0.01 . 1 . . . . . . . . 5761 1 594 . 1 1 86 86 LYS CB C 13 28.1 0.20 . 1 . . . . . . . . 5761 1 595 . 1 1 86 86 LYS HB2 H 1 2.00 0.01 . 2 . . . . . . . . 5761 1 596 . 1 1 86 86 LYS HG2 H 1 1.40 0.01 . 2 . . . . . . . . 5761 1 597 . 1 1 86 86 LYS C C 13 176.4 0.20 . 1 . . . . . . . . 5761 1 598 . 1 1 87 87 GLN N N 15 116.4 0.25 . 1 . . . . . . . . 5761 1 599 . 1 1 87 87 GLN H H 1 8.11 0.01 . 1 . . . . . . . . 5761 1 600 . 1 1 87 87 GLN CA C 13 52.6 0.20 . 1 . . . . . . . . 5761 1 601 . 1 1 87 87 GLN HA H 1 4.30 0.01 . 1 . . . . . . . . 5761 1 602 . 1 1 87 87 GLN CB C 13 30.1 0.20 . 1 . . . . . . . . 5761 1 603 . 1 1 87 87 GLN HB2 H 1 2.13 0.01 . 2 . . . . . . . . 5761 1 604 . 1 1 87 87 GLN HB3 H 1 1.58 0.01 . 2 . . . . . . . . 5761 1 605 . 1 1 87 87 GLN HG2 H 1 1.97 0.01 . 2 . . . . . . . . 5761 1 606 . 1 1 87 87 GLN C C 13 176.6 0.20 . 1 . . . . . . . . 5761 1 607 . 1 1 88 88 GLN N N 15 119.1 0.25 . 1 . . . . . . . . 5761 1 608 . 1 1 88 88 GLN H H 1 7.81 0.01 . 1 . . . . . . . . 5761 1 609 . 1 1 88 88 GLN CA C 13 54.9 0.20 . 1 . . . . . . . . 5761 1 610 . 1 1 88 88 GLN HA H 1 4.68 0.01 . 1 . . . . . . . . 5761 1 611 . 1 1 88 88 GLN CB C 13 26.6 0.20 . 1 . . . . . . . . 5761 1 612 . 1 1 89 89 LEU CA C 13 53.8 0.20 . 1 . . . . . . . . 5761 1 613 . 1 1 89 89 LEU CB C 13 41.3 0.20 . 1 . . . . . . . . 5761 1 614 . 1 1 89 89 LEU C C 13 174.3 0.20 . 1 . . . . . . . . 5761 1 615 . 1 1 90 90 ARG N N 15 118.7 0.25 . 1 . . . . . . . . 5761 1 616 . 1 1 90 90 ARG H H 1 6.24 0.01 . 1 . . . . . . . . 5761 1 617 . 1 1 90 90 ARG CA C 13 53.8 0.20 . 1 . . . . . . . . 5761 1 618 . 1 1 90 90 ARG HA H 1 4.73 0.01 . 1 . . . . . . . . 5761 1 619 . 1 1 90 90 ARG CB C 13 32.4 0.20 . 1 . . . . . . . . 5761 1 620 . 1 1 90 90 ARG HB2 H 1 1.94 0.01 . 2 . . . . . . . . 5761 1 621 . 1 1 90 90 ARG HB3 H 1 1.60 0.01 . 2 . . . . . . . . 5761 1 622 . 1 1 90 90 ARG HG2 H 1 1.46 0.01 . 2 . . . . . . . . 5761 1 623 . 1 1 90 90 ARG C C 13 174.7 0.20 . 1 . . . . . . . . 5761 1 624 . 1 1 91 91 MET N N 15 117.0 0.25 . 1 . . . . . . . . 5761 1 625 . 1 1 91 91 MET H H 1 8.40 0.01 . 1 . . . . . . . . 5761 1 626 . 1 1 91 91 MET CA C 13 54.3 0.20 . 1 . . . . . . . . 5761 1 627 . 1 1 91 91 MET HA H 1 5.07 0.01 . 1 . . . . . . . . 5761 1 628 . 1 1 91 91 MET CB C 13 38.6 0.20 . 1 . . . . . . . . 5761 1 629 . 1 1 91 91 MET HB2 H 1 2.44 0.01 . 2 . . . . . . . . 5761 1 630 . 1 1 91 91 MET HB3 H 1 2.16 0.01 . 2 . . . . . . . . 5761 1 631 . 1 1 91 91 MET C C 13 174.7 0.20 . 1 . . . . . . . . 5761 1 632 . 1 1 92 92 ARG N N 15 125.5 0.25 . 1 . . . . . . . . 5761 1 633 . 1 1 92 92 ARG H H 1 8.81 0.01 . 1 . . . . . . . . 5761 1 634 . 1 1 92 92 ARG CA C 13 53.9 0.20 . 1 . . . . . . . . 5761 1 635 . 1 1 92 92 ARG HA H 1 5.16 0.01 . 1 . . . . . . . . 5761 1 636 . 1 1 92 92 ARG CB C 13 31.4 0.20 . 1 . . . . . . . . 5761 1 637 . 1 1 92 92 ARG HB2 H 1 1.70 0.01 . 2 . . . . . . . . 5761 1 638 . 1 1 92 92 ARG HG2 H 1 1.48 0.01 . 2 . . . . . . . . 5761 1 639 . 1 1 92 92 ARG C C 13 177.1 0.20 . 1 . . . . . . . . 5761 1 640 . 1 1 93 93 ILE N N 15 119.3 0.25 . 1 . . . . . . . . 5761 1 641 . 1 1 93 93 ILE H H 1 9.34 0.01 . 1 . . . . . . . . 5761 1 642 . 1 1 93 93 ILE CA C 13 57.7 0.20 . 1 . . . . . . . . 5761 1 643 . 1 1 93 93 ILE HA H 1 5.04 0.01 . 1 . . . . . . . . 5761 1 644 . 1 1 93 93 ILE CB C 13 39.4 0.20 . 1 . . . . . . . . 5761 1 645 . 1 1 93 93 ILE C C 13 174.3 0.20 . 1 . . . . . . . . 5761 1 646 . 1 1 94 94 LYS N N 15 123.8 0.25 . 1 . . . . . . . . 5761 1 647 . 1 1 94 94 LYS H H 1 8.31 0.01 . 1 . . . . . . . . 5761 1 648 . 1 1 94 94 LYS CA C 13 53.6 0.20 . 1 . . . . . . . . 5761 1 649 . 1 1 94 94 LYS HA H 1 4.97 0.01 . 1 . . . . . . . . 5761 1 650 . 1 1 94 94 LYS CB C 13 34.7 0.20 . 1 . . . . . . . . 5761 1 651 . 1 1 94 94 LYS HB2 H 1 1.45 0.01 . 2 . . . . . . . . 5761 1 652 . 1 1 94 94 LYS HG2 H 1 1.18 0.01 . 2 . . . . . . . . 5761 1 653 . 1 1 94 94 LYS C C 13 175.3 0.20 . 1 . . . . . . . . 5761 1 654 . 1 1 95 95 LEU N N 15 125.5 0.25 . 1 . . . . . . . . 5761 1 655 . 1 1 95 95 LEU H H 1 8.65 0.01 . 1 . . . . . . . . 5761 1 656 . 1 1 95 95 LEU CA C 13 51.2 0.20 . 1 . . . . . . . . 5761 1 657 . 1 1 95 95 LEU HA H 1 5.13 0.01 . 1 . . . . . . . . 5761 1 658 . 1 1 95 95 LEU CB C 13 43.7 0.20 . 1 . . . . . . . . 5761 1 659 . 1 1 95 95 LEU HB2 H 1 1.48 0.01 . 2 . . . . . . . . 5761 1 660 . 1 1 95 95 LEU HB3 H 1 1.24 0.01 . 2 . . . . . . . . 5761 1 661 . 1 1 95 95 LEU C C 13 177.3 0.20 . 1 . . . . . . . . 5761 1 662 . 1 1 96 96 THR N N 15 113.0 0.25 . 1 . . . . . . . . 5761 1 663 . 1 1 96 96 THR H H 1 8.03 0.01 . 1 . . . . . . . . 5761 1 664 . 1 1 96 96 THR CA C 13 59.1 0.20 . 1 . . . . . . . . 5761 1 665 . 1 1 96 96 THR HA H 1 5.11 0.01 . 1 . . . . . . . . 5761 1 666 . 1 1 96 96 THR CB C 13 70.5 0.20 . 1 . . . . . . . . 5761 1 667 . 1 1 96 96 THR HB H 1 4.22 0.01 . 1 . . . . . . . . 5761 1 668 . 1 1 96 96 THR HG21 H 1 1.17 0.01 . 1 . . . . . . . . 5761 1 669 . 1 1 96 96 THR HG22 H 1 1.17 0.01 . 1 . . . . . . . . 5761 1 670 . 1 1 96 96 THR HG23 H 1 1.17 0.01 . 1 . . . . . . . . 5761 1 671 . 1 1 96 96 THR C C 13 173.4 0.20 . 1 . . . . . . . . 5761 1 672 . 1 1 97 97 TYR N N 15 114.6 0.25 . 1 . . . . . . . . 5761 1 673 . 1 1 97 97 TYR H H 1 8.04 0.01 . 1 . . . . . . . . 5761 1 674 . 1 1 97 97 TYR CA C 13 55.6 0.20 . 1 . . . . . . . . 5761 1 675 . 1 1 97 97 TYR HA H 1 4.83 0.01 . 1 . . . . . . . . 5761 1 676 . 1 1 97 97 TYR CB C 13 36.3 0.20 . 1 . . . . . . . . 5761 1 677 . 1 1 97 97 TYR C C 13 173.4 0.20 . 1 . . . . . . . . 5761 1 678 . 1 1 98 98 ASN N N 15 117.8 0.25 . 1 . . . . . . . . 5761 1 679 . 1 1 98 98 ASN H H 1 9.54 0.01 . 1 . . . . . . . . 5761 1 680 . 1 1 98 98 ASN CA C 13 50.8 0.20 . 1 . . . . . . . . 5761 1 681 . 1 1 98 98 ASN HA H 1 5.68 0.01 . 1 . . . . . . . . 5761 1 682 . 1 1 98 98 ASN CB C 13 39.3 0.20 . 1 . . . . . . . . 5761 1 683 . 1 1 98 98 ASN HB2 H 1 2.77 0.01 . 2 . . . . . . . . 5761 1 684 . 1 1 98 98 ASN HB3 H 1 2.55 0.01 . 2 . . . . . . . . 5761 1 685 . 1 1 98 98 ASN C C 13 176.3 0.20 . 1 . . . . . . . . 5761 1 686 . 1 1 99 99 HIS N N 15 122.9 0.25 . 1 . . . . . . . . 5761 1 687 . 1 1 99 99 HIS H H 1 9.12 0.01 . 1 . . . . . . . . 5761 1 688 . 1 1 99 99 HIS CA C 13 55.0 0.20 . 1 . . . . . . . . 5761 1 689 . 1 1 99 99 HIS HA H 1 5.10 0.01 . 1 . . . . . . . . 5761 1 690 . 1 1 99 99 HIS CB C 13 35.3 0.20 . 1 . . . . . . . . 5761 1 691 . 1 1 99 99 HIS HB2 H 1 3.25 0.01 . 2 . . . . . . . . 5761 1 692 . 1 1 99 99 HIS C C 13 176.3 0.20 . 1 . . . . . . . . 5761 1 693 . 1 1 100 100 LYS N N 15 126.2 0.25 . 1 . . . . . . . . 5761 1 694 . 1 1 100 100 LYS H H 1 9.31 0.01 . 1 . . . . . . . . 5761 1 695 . 1 1 100 100 LYS CA C 13 55.6 0.20 . 1 . . . . . . . . 5761 1 696 . 1 1 100 100 LYS CB C 13 29.4 0.20 . 1 . . . . . . . . 5761 1 697 . 1 1 100 100 LYS C C 13 177.7 0.20 . 1 . . . . . . . . 5761 1 698 . 1 1 101 101 GLY N N 15 105.3 0.25 . 1 . . . . . . . . 5761 1 699 . 1 1 101 101 GLY H H 1 8.62 0.01 . 1 . . . . . . . . 5761 1 700 . 1 1 101 101 GLY CA C 13 44.1 0.20 . 1 . . . . . . . . 5761 1 701 . 1 1 101 101 GLY C C 13 175.6 0.20 . 1 . . . . . . . . 5761 1 702 . 1 1 102 102 SER N N 15 115.8 0.25 . 1 . . . . . . . . 5761 1 703 . 1 1 102 102 SER H H 1 7.80 0.01 . 1 . . . . . . . . 5761 1 704 . 1 1 102 102 SER CA C 13 56.0 0.20 . 1 . . . . . . . . 5761 1 705 . 1 1 102 102 SER HA H 1 4.74 0.01 . 1 . . . . . . . . 5761 1 706 . 1 1 102 102 SER CB C 13 64.6 0.20 . 1 . . . . . . . . 5761 1 707 . 1 1 102 102 SER HB2 H 1 3.78 0.01 . 2 . . . . . . . . 5761 1 708 . 1 1 102 102 SER C C 13 173.2 0.20 . 1 . . . . . . . . 5761 1 709 . 1 1 103 103 ALA N N 15 127.0 0.25 . 1 . . . . . . . . 5761 1 710 . 1 1 103 103 ALA H H 1 8.33 0.01 . 1 . . . . . . . . 5761 1 711 . 1 1 103 103 ALA CA C 13 50.9 0.20 . 1 . . . . . . . . 5761 1 712 . 1 1 103 103 ALA HA H 1 4.69 0.01 . 1 . . . . . . . . 5761 1 713 . 1 1 103 103 ALA CB C 13 17.3 0.20 . 1 . . . . . . . . 5761 1 714 . 1 1 103 103 ALA HB1 H 1 1.33 0.01 . 1 . . . . . . . . 5761 1 715 . 1 1 103 103 ALA HB2 H 1 1.33 0.01 . 1 . . . . . . . . 5761 1 716 . 1 1 103 103 ALA HB3 H 1 1.33 0.01 . 1 . . . . . . . . 5761 1 717 . 1 1 103 103 ALA C C 13 178.3 0.20 . 1 . . . . . . . . 5761 1 718 . 1 1 104 104 MET N N 15 123.4 0.25 . 1 . . . . . . . . 5761 1 719 . 1 1 104 104 MET H H 1 9.05 0.01 . 1 . . . . . . . . 5761 1 720 . 1 1 104 104 MET CA C 13 51.6 0.20 . 1 . . . . . . . . 5761 1 721 . 1 1 104 104 MET CB C 13 30.7 0.20 . 1 . . . . . . . . 5761 1 722 . 1 1 104 104 MET C C 13 177.1 0.20 . 1 . . . . . . . . 5761 1 723 . 1 1 105 105 GLN N N 15 119.1 0.25 . 1 . . . . . . . . 5761 1 724 . 1 1 105 105 GLN H H 1 8.14 0.01 . 1 . . . . . . . . 5761 1 725 . 1 1 105 105 GLN CA C 13 52.9 0.20 . 1 . . . . . . . . 5761 1 726 . 1 1 105 105 GLN HA H 1 5.36 0.01 . 1 . . . . . . . . 5761 1 727 . 1 1 105 105 GLN CB C 13 31.1 0.20 . 1 . . . . . . . . 5761 1 728 . 1 1 105 105 GLN HB2 H 1 2.17 0.01 . 2 . . . . . . . . 5761 1 729 . 1 1 105 105 GLN HB3 H 1 1.97 0.01 . 2 . . . . . . . . 5761 1 730 . 1 1 105 105 GLN C C 13 175.7 0.20 . 1 . . . . . . . . 5761 1 731 . 1 1 106 106 ASP N N 15 121.3 0.25 . 1 . . . . . . . . 5761 1 732 . 1 1 106 106 ASP H H 1 8.91 0.01 . 1 . . . . . . . . 5761 1 733 . 1 1 106 106 ASP CA C 13 51.8 0.20 . 1 . . . . . . . . 5761 1 734 . 1 1 106 106 ASP HA H 1 5.07 0.01 . 1 . . . . . . . . 5761 1 735 . 1 1 106 106 ASP CB C 13 43.5 0.20 . 1 . . . . . . . . 5761 1 736 . 1 1 106 106 ASP HB2 H 1 2.71 0.01 . 2 . . . . . . . . 5761 1 737 . 1 1 106 106 ASP HB3 H 1 2.44 0.01 . 2 . . . . . . . . 5761 1 738 . 1 1 106 106 ASP C C 13 174.8 0.20 . 1 . . . . . . . . 5761 1 739 . 1 1 107 107 LEU N N 15 122.8 0.25 . 1 . . . . . . . . 5761 1 740 . 1 1 107 107 LEU H H 1 8.26 0.01 . 1 . . . . . . . . 5761 1 741 . 1 1 107 107 LEU CA C 13 52.7 0.20 . 1 . . . . . . . . 5761 1 742 . 1 1 107 107 LEU HA H 1 5.34 0.01 . 1 . . . . . . . . 5761 1 743 . 1 1 107 107 LEU CB C 13 44.3 0.20 . 1 . . . . . . . . 5761 1 744 . 1 1 107 107 LEU HB2 H 1 1.60 0.01 . 2 . . . . . . . . 5761 1 745 . 1 1 107 107 LEU HD11 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 746 . 1 1 107 107 LEU HD12 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 747 . 1 1 107 107 LEU HD13 H 1 0.84 0.01 . 2 . . . . . . . . 5761 1 748 . 1 1 107 107 LEU C C 13 176.9 0.20 . 1 . . . . . . . . 5761 1 749 . 1 1 108 108 ALA N N 15 124.2 0.25 . 1 . . . . . . . . 5761 1 750 . 1 1 108 108 ALA H H 1 8.89 0.01 . 1 . . . . . . . . 5761 1 751 . 1 1 108 108 ALA CA C 13 50.0 0.20 . 1 . . . . . . . . 5761 1 752 . 1 1 108 108 ALA HA H 1 4.82 0.01 . 1 . . . . . . . . 5761 1 753 . 1 1 108 108 ALA CB C 13 21.4 0.20 . 1 . . . . . . . . 5761 1 754 . 1 1 108 108 ALA HB1 H 1 1.48 0.01 . 1 . . . . . . . . 5761 1 755 . 1 1 108 108 ALA HB2 H 1 1.48 0.01 . 1 . . . . . . . . 5761 1 756 . 1 1 108 108 ALA HB3 H 1 1.48 0.01 . 1 . . . . . . . . 5761 1 757 . 1 1 108 108 ALA C C 13 176.6 0.20 . 1 . . . . . . . . 5761 1 758 . 1 1 109 109 GLU N N 15 120.8 0.25 . 1 . . . . . . . . 5761 1 759 . 1 1 109 109 GLU H H 1 8.71 0.01 . 1 . . . . . . . . 5761 1 760 . 1 1 109 109 GLU CA C 13 54.1 0.20 . 1 . . . . . . . . 5761 1 761 . 1 1 109 109 GLU HA H 1 4.83 0.01 . 1 . . . . . . . . 5761 1 762 . 1 1 109 109 GLU CB C 13 30.1 0.20 . 1 . . . . . . . . 5761 1 763 . 1 1 109 109 GLU HB2 H 1 2.26 0.01 . 2 . . . . . . . . 5761 1 764 . 1 1 109 109 GLU HB3 H 1 2.19 0.01 . 2 . . . . . . . . 5761 1 765 . 1 1 109 109 GLU HG2 H 1 2.04 0.01 . 2 . . . . . . . . 5761 1 766 . 1 1 109 109 GLU HG3 H 1 1.98 0.01 . 2 . . . . . . . . 5761 1 767 . 1 1 109 109 GLU C C 13 177.2 0.20 . 1 . . . . . . . . 5761 1 768 . 1 1 110 110 VAL N N 15 125.0 0.25 . 1 . . . . . . . . 5761 1 769 . 1 1 110 110 VAL H H 1 9.01 0.01 . 1 . . . . . . . . 5761 1 770 . 1 1 110 110 VAL CA C 13 61.1 0.20 . 1 . . . . . . . . 5761 1 771 . 1 1 110 110 VAL HA H 1 4.27 0.01 . 1 . . . . . . . . 5761 1 772 . 1 1 110 110 VAL CB C 13 30.9 0.20 . 1 . . . . . . . . 5761 1 773 . 1 1 110 110 VAL HB H 1 2.22 0.01 . 1 . . . . . . . . 5761 1 774 . 1 1 110 110 VAL HG11 H 1 0.89 0.01 . 2 . . . . . . . . 5761 1 775 . 1 1 110 110 VAL HG12 H 1 0.89 0.01 . 2 . . . . . . . . 5761 1 776 . 1 1 110 110 VAL HG13 H 1 0.89 0.01 . 2 . . . . . . . . 5761 1 777 . 1 1 110 110 VAL HG21 H 1 0.47 0.01 . 2 . . . . . . . . 5761 1 778 . 1 1 110 110 VAL HG22 H 1 0.47 0.01 . 2 . . . . . . . . 5761 1 779 . 1 1 110 110 VAL HG23 H 1 0.47 0.01 . 2 . . . . . . . . 5761 1 780 . 1 1 110 110 VAL C C 13 176.2 0.20 . 1 . . . . . . . . 5761 1 781 . 1 1 111 111 ASN N N 15 123.4 0.25 . 1 . . . . . . . . 5761 1 782 . 1 1 111 111 ASN H H 1 8.66 0.01 . 1 . . . . . . . . 5761 1 783 . 1 1 111 111 ASN CA C 13 51.1 0.20 . 1 . . . . . . . . 5761 1 784 . 1 1 111 111 ASN CB C 13 38.7 0.20 . 1 . . . . . . . . 5761 1 785 . 1 1 111 111 ASN C C 13 176.5 0.20 . 1 . . . . . . . . 5761 1 786 . 1 1 112 112 ASN N N 15 118.2 0.25 . 1 . . . . . . . . 5761 1 787 . 1 1 112 112 ASN H H 1 8.59 0.01 . 1 . . . . . . . . 5761 1 788 . 1 1 112 112 ASN CA C 13 51.2 0.20 . 1 . . . . . . . . 5761 1 789 . 1 1 112 112 ASN CB C 13 35.2 0.20 . 1 . . . . . . . . 5761 1 790 . 1 1 112 112 ASN C C 13 176.5 0.20 . 1 . . . . . . . . 5761 1 791 . 1 1 113 113 PHE N N 15 117.9 0.25 . 1 . . . . . . . . 5761 1 792 . 1 1 113 113 PHE H H 1 8.06 0.01 . 1 . . . . . . . . 5761 1 793 . 1 1 113 113 PHE CA C 13 56.7 0.20 . 1 . . . . . . . . 5761 1 794 . 1 1 113 113 PHE HA H 1 4.33 0.01 . 1 . . . . . . . . 5761 1 795 . 1 1 113 113 PHE CB C 13 36.6 0.20 . 1 . . . . . . . . 5761 1 796 . 1 1 113 113 PHE HB2 H 1 2.96 0.01 . 2 . . . . . . . . 5761 1 797 . 1 1 115 115 PRO CA C 13 63.7 0.20 . 1 . . . . . . . . 5761 1 798 . 1 1 115 115 PRO CB C 13 29.7 0.20 . 1 . . . . . . . . 5761 1 799 . 1 1 115 115 PRO C C 13 178.2 0.20 . 1 . . . . . . . . 5761 1 800 . 1 1 116 116 GLN N N 15 114.0 0.25 . 1 . . . . . . . . 5761 1 801 . 1 1 116 116 GLN H H 1 8.95 0.01 . 1 . . . . . . . . 5761 1 802 . 1 1 116 116 GLN CA C 13 57.0 0.20 . 1 . . . . . . . . 5761 1 803 . 1 1 116 116 GLN CB C 13 27.9 0.20 . 1 . . . . . . . . 5761 1 804 . 1 1 116 116 GLN C C 13 178.2 0.20 . 1 . . . . . . . . 5761 1 805 . 1 1 117 117 SER N N 15 111.4 0.25 . 1 . . . . . . . . 5761 1 806 . 1 1 117 117 SER H H 1 8.18 0.01 . 1 . . . . . . . . 5761 1 807 . 1 1 117 117 SER CA C 13 59.5 0.20 . 1 . . . . . . . . 5761 1 808 . 1 1 117 117 SER HA H 1 4.67 0.01 . 1 . . . . . . . . 5761 1 809 . 1 1 117 117 SER CB C 13 63.5 0.20 . 1 . . . . . . . . 5761 1 810 . 1 1 117 117 SER HB2 H 1 3.87 0.01 . 2 . . . . . . . . 5761 1 811 . 1 1 117 117 SER C C 13 174.6 0.20 . 1 . . . . . . . . 5761 1 812 . 1 1 118 118 TRP N N 15 118.1 0.25 . 1 . . . . . . . . 5761 1 813 . 1 1 118 118 TRP H H 1 7.12 0.01 . 1 . . . . . . . . 5761 1 814 . 1 1 118 118 TRP CA C 13 55.6 0.20 . 1 . . . . . . . . 5761 1 815 . 1 1 118 118 TRP HA H 1 4.89 0.01 . 1 . . . . . . . . 5761 1 816 . 1 1 118 118 TRP CB C 13 30.2 0.20 . 1 . . . . . . . . 5761 1 817 . 1 1 118 118 TRP HB2 H 1 3.41 0.01 . 2 . . . . . . . . 5761 1 818 . 1 1 118 118 TRP HB3 H 1 2.74 0.01 . 2 . . . . . . . . 5761 1 819 . 1 1 118 118 TRP NE1 N 15 130.4 0.25 . 1 . . . . . . . . 5761 1 820 . 1 1 118 118 TRP HE1 H 1 10.49 0.01 . 1 . . . . . . . . 5761 1 821 . 1 1 118 118 TRP C C 13 175.3 0.20 . 1 . . . . . . . . 5761 1 822 . 1 1 119 119 GLN N N 15 125.6 0.25 . 1 . . . . . . . . 5761 1 823 . 1 1 119 119 GLN H H 1 7.14 0.01 . 1 . . . . . . . . 5761 1 824 . 1 1 119 119 GLN CA C 13 57.3 0.20 . 1 . . . . . . . . 5761 1 825 . 1 1 119 119 GLN HA H 1 3.72 0.01 . 1 . . . . . . . . 5761 1 826 . 1 1 119 119 GLN CB C 13 27.5 0.20 . 1 . . . . . . . . 5761 1 827 . 1 1 119 119 GLN HB2 H 1 1.49 0.01 . 2 . . . . . . . . 5761 1 828 . 1 1 119 119 GLN HB3 H 1 1.30 0.01 . 2 . . . . . . . . 5761 1 stop_ save_