data_6607 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6607 _Entry.Title ; 1H, 13C and 15N resonance assignments of AT-Rich Interaction Domain (ARID) of Jumonji ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2005-04-25 _Entry.Accession_date 2005-04-25 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Hideki Kusunoki . . . 6607 2 Tsukasa Hasegawa . . . 6607 3 Chieko Komatsu . . . 6607 4 Takashi Takeuchi . . . 6607 5 Toshiyuki Kohno . . . 6607 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6607 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 495 6607 '15N chemical shifts' 120 6607 '1H chemical shifts' 800 6607 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 2 . . 2009-02-18 2005-04-25 update author 'update entry' 6607 1 . . 2007-09-17 2005-04-25 original author 'original release' 6607 stop_ save_ ############### # Citations # ############### save_citation _Citation.Sf_category citations _Citation.Sf_framecode citation _Citation.Entry_ID 6607 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16222563 _Citation.Full_citation . _Citation.Title ; 1H, 13C and 15N Resonance Assignments of the AT-Rich Interaction Domain (ARID) of Jumonji ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 33 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 74 _Citation.Page_last 74 _Citation.Year 2005 _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 Hideki Kusunoki . . . 6607 1 2 Tsukasa Hasegawa . . . 6607 1 3 Chieko Komatsu . . . 6607 1 4 Takashi Takeuchi . . . 6607 1 5 Toshiyuki Kohno . . . 6607 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6607 _Assembly.ID 1 _Assembly.Name Jumonji _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'not present' _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Jumonji 1 $JMJ_ARID . . no native no no . . . 6607 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_JMJ_ARID _Entity.Sf_category entity _Entity.Sf_framecode JMJ_ARID _Entity.Entry_ID 6607 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'JMJ ARID' _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 ; LGRRWGPNVQRLACIKKHLR SQGITMDELPLIGGCELDLA CFFRLINEMGGMQQVTDLKK WNKLADMLRIPKTAQDRLAK LQEAYCQYLLSYDSLSPEEH RRLEKEVLMEKEILEK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq 'L615 to K730' _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 116 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 13547 _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 2RQ5 . "Solution Structure Of The At-Rich Interaction Domain (Arid) Of JumonjiJARID2" . . . . . 100.00 121 100.00 100.00 4.99e-78 . . . . 6607 1 2 no DBJ BAA06736 . "jumonji protein [Mus musculus]" . . . . . 100.00 1234 100.00 100.00 1.42e-71 . . . . 6607 1 3 no DBJ BAC32264 . "unnamed protein product [Mus musculus]" . . . . . 100.00 1234 100.00 100.00 1.42e-71 . . . . 6607 1 4 no DBJ BAE27780 . "unnamed protein product [Mus musculus]" . . . . . 100.00 1062 100.00 100.00 3.01e-72 . . . . 6607 1 5 no DBJ BAE37641 . "unnamed protein product [Mus musculus]" . . . . . 100.00 1030 100.00 100.00 5.59e-73 . . . . 6607 1 6 no DBJ BAF85550 . "unnamed protein product [Homo sapiens]" . . . . . 100.00 1246 98.28 100.00 7.33e-71 . . . . 6607 1 7 no GB AAH03374 . "Jarid2 protein, partial [Mus musculus]" . . . . . 100.00 624 100.00 100.00 6.25e-73 . . . . 6607 1 8 no GB AAH46246 . "Jumonji, AT rich interactive domain 2 [Homo sapiens]" . . . . . 100.00 1246 98.28 100.00 7.33e-71 . . . . 6607 1 9 no GB AAH52444 . "Jumonji, AT rich interactive domain 2 [Mus musculus]" . . . . . 100.00 1234 100.00 100.00 1.42e-71 . . . . 6607 1 10 no GB AAH60695 . "Jumonji, AT rich interactive domain 2 [Mus musculus]" . . . . . 100.00 1234 100.00 100.00 1.42e-71 . . . . 6607 1 11 no GB AAI15759 . "Jarid2 protein, partial [Mus musculus]" . . . . . 100.00 914 100.00 100.00 1.31e-72 . . . . 6607 1 12 no REF NP_001191972 . "protein Jumonji [Mus musculus]" . . . . . 100.00 1234 100.00 100.00 1.42e-71 . . . . 6607 1 13 no REF NP_001191973 . "protein Jumonji [Mus musculus]" . . . . . 100.00 1234 100.00 100.00 1.42e-71 . . . . 6607 1 14 no REF NP_001253969 . "protein Jumonji isoform 2 [Homo sapiens]" . . . . . 100.00 1074 98.28 100.00 2.11e-71 . . . . 6607 1 15 no REF NP_004964 . "protein Jumonji isoform 1 [Homo sapiens]" . . . . . 100.00 1246 98.28 100.00 7.33e-71 . . . . 6607 1 16 no REF NP_068678 . "protein Jumonji [Mus musculus]" . . . . . 100.00 1234 100.00 100.00 1.42e-71 . . . . 6607 1 17 no SP Q62315 . "RecName: Full=Protein Jumonji; AltName: Full=Jumonji/ARID domain-containing protein 2 [Mus musculus]" . . . . . 100.00 1234 100.00 100.00 1.42e-71 . . . . 6607 1 18 no SP Q92833 . "RecName: Full=Protein Jumonji; AltName: Full=Jumonji/ARID domain-containing protein 2 [Homo sapiens]" . . . . . 100.00 1246 98.28 100.00 7.33e-71 . . . . 6607 1 19 no TPG DAA16223 . "TPA: jumonji, AT rich interactive domain 2 [Bos taurus]" . . . . . 100.00 1248 97.41 99.14 1.84e-70 . . . . 6607 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 1 615 LEU . 6607 1 2 616 GLY . 6607 1 3 617 ARG . 6607 1 4 618 ARG . 6607 1 5 619 TRP . 6607 1 6 620 GLY . 6607 1 7 621 PRO . 6607 1 8 622 ASN . 6607 1 9 623 VAL . 6607 1 10 624 GLN . 6607 1 11 625 ARG . 6607 1 12 626 LEU . 6607 1 13 627 ALA . 6607 1 14 628 CYS . 6607 1 15 629 ILE . 6607 1 16 630 LYS . 6607 1 17 631 LYS . 6607 1 18 632 HIS . 6607 1 19 633 LEU . 6607 1 20 634 ARG . 6607 1 21 635 SER . 6607 1 22 636 GLN . 6607 1 23 637 GLY . 6607 1 24 638 ILE . 6607 1 25 639 THR . 6607 1 26 640 MET . 6607 1 27 641 ASP . 6607 1 28 642 GLU . 6607 1 29 643 LEU . 6607 1 30 644 PRO . 6607 1 31 645 LEU . 6607 1 32 646 ILE . 6607 1 33 647 GLY . 6607 1 34 648 GLY . 6607 1 35 649 CYS . 6607 1 36 650 GLU . 6607 1 37 651 LEU . 6607 1 38 652 ASP . 6607 1 39 653 LEU . 6607 1 40 654 ALA . 6607 1 41 655 CYS . 6607 1 42 656 PHE . 6607 1 43 657 PHE . 6607 1 44 658 ARG . 6607 1 45 659 LEU . 6607 1 46 660 ILE . 6607 1 47 661 ASN . 6607 1 48 662 GLU . 6607 1 49 663 MET . 6607 1 50 664 GLY . 6607 1 51 665 GLY . 6607 1 52 666 MET . 6607 1 53 667 GLN . 6607 1 54 668 GLN . 6607 1 55 669 VAL . 6607 1 56 670 THR . 6607 1 57 671 ASP . 6607 1 58 672 LEU . 6607 1 59 673 LYS . 6607 1 60 674 LYS . 6607 1 61 675 TRP . 6607 1 62 676 ASN . 6607 1 63 677 LYS . 6607 1 64 678 LEU . 6607 1 65 679 ALA . 6607 1 66 680 ASP . 6607 1 67 681 MET . 6607 1 68 682 LEU . 6607 1 69 683 ARG . 6607 1 70 684 ILE . 6607 1 71 685 PRO . 6607 1 72 686 LYS . 6607 1 73 687 THR . 6607 1 74 688 ALA . 6607 1 75 689 GLN . 6607 1 76 690 ASP . 6607 1 77 691 ARG . 6607 1 78 692 LEU . 6607 1 79 693 ALA . 6607 1 80 694 LYS . 6607 1 81 695 LEU . 6607 1 82 696 GLN . 6607 1 83 697 GLU . 6607 1 84 698 ALA . 6607 1 85 699 TYR . 6607 1 86 700 CYS . 6607 1 87 701 GLN . 6607 1 88 702 TYR . 6607 1 89 703 LEU . 6607 1 90 704 LEU . 6607 1 91 705 SER . 6607 1 92 706 TYR . 6607 1 93 707 ASP . 6607 1 94 708 SER . 6607 1 95 709 LEU . 6607 1 96 710 SER . 6607 1 97 711 PRO . 6607 1 98 712 GLU . 6607 1 99 713 GLU . 6607 1 100 714 HIS . 6607 1 101 715 ARG . 6607 1 102 716 ARG . 6607 1 103 717 LEU . 6607 1 104 718 GLU . 6607 1 105 719 LYS . 6607 1 106 720 GLU . 6607 1 107 721 VAL . 6607 1 108 722 LEU . 6607 1 109 723 MET . 6607 1 110 724 GLU . 6607 1 111 725 LYS . 6607 1 112 726 GLU . 6607 1 113 727 ILE . 6607 1 114 728 LEU . 6607 1 115 729 GLU . 6607 1 116 730 LYS . 6607 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 . LEU 1 1 6607 1 . GLY 2 2 6607 1 . ARG 3 3 6607 1 . ARG 4 4 6607 1 . TRP 5 5 6607 1 . GLY 6 6 6607 1 . PRO 7 7 6607 1 . ASN 8 8 6607 1 . VAL 9 9 6607 1 . GLN 10 10 6607 1 . ARG 11 11 6607 1 . LEU 12 12 6607 1 . ALA 13 13 6607 1 . CYS 14 14 6607 1 . ILE 15 15 6607 1 . LYS 16 16 6607 1 . LYS 17 17 6607 1 . HIS 18 18 6607 1 . LEU 19 19 6607 1 . ARG 20 20 6607 1 . SER 21 21 6607 1 . GLN 22 22 6607 1 . GLY 23 23 6607 1 . ILE 24 24 6607 1 . THR 25 25 6607 1 . MET 26 26 6607 1 . ASP 27 27 6607 1 . GLU 28 28 6607 1 . LEU 29 29 6607 1 . PRO 30 30 6607 1 . LEU 31 31 6607 1 . ILE 32 32 6607 1 . GLY 33 33 6607 1 . GLY 34 34 6607 1 . CYS 35 35 6607 1 . GLU 36 36 6607 1 . LEU 37 37 6607 1 . ASP 38 38 6607 1 . LEU 39 39 6607 1 . ALA 40 40 6607 1 . CYS 41 41 6607 1 . PHE 42 42 6607 1 . PHE 43 43 6607 1 . ARG 44 44 6607 1 . LEU 45 45 6607 1 . ILE 46 46 6607 1 . ASN 47 47 6607 1 . GLU 48 48 6607 1 . MET 49 49 6607 1 . GLY 50 50 6607 1 . GLY 51 51 6607 1 . MET 52 52 6607 1 . GLN 53 53 6607 1 . GLN 54 54 6607 1 . VAL 55 55 6607 1 . THR 56 56 6607 1 . ASP 57 57 6607 1 . LEU 58 58 6607 1 . LYS 59 59 6607 1 . LYS 60 60 6607 1 . TRP 61 61 6607 1 . ASN 62 62 6607 1 . LYS 63 63 6607 1 . LEU 64 64 6607 1 . ALA 65 65 6607 1 . ASP 66 66 6607 1 . MET 67 67 6607 1 . LEU 68 68 6607 1 . ARG 69 69 6607 1 . ILE 70 70 6607 1 . PRO 71 71 6607 1 . LYS 72 72 6607 1 . THR 73 73 6607 1 . ALA 74 74 6607 1 . GLN 75 75 6607 1 . ASP 76 76 6607 1 . ARG 77 77 6607 1 . LEU 78 78 6607 1 . ALA 79 79 6607 1 . LYS 80 80 6607 1 . LEU 81 81 6607 1 . GLN 82 82 6607 1 . GLU 83 83 6607 1 . ALA 84 84 6607 1 . TYR 85 85 6607 1 . CYS 86 86 6607 1 . GLN 87 87 6607 1 . TYR 88 88 6607 1 . LEU 89 89 6607 1 . LEU 90 90 6607 1 . SER 91 91 6607 1 . TYR 92 92 6607 1 . ASP 93 93 6607 1 . SER 94 94 6607 1 . LEU 95 95 6607 1 . SER 96 96 6607 1 . PRO 97 97 6607 1 . GLU 98 98 6607 1 . GLU 99 99 6607 1 . HIS 100 100 6607 1 . ARG 101 101 6607 1 . ARG 102 102 6607 1 . LEU 103 103 6607 1 . GLU 104 104 6607 1 . LYS 105 105 6607 1 . GLU 106 106 6607 1 . VAL 107 107 6607 1 . LEU 108 108 6607 1 . MET 109 109 6607 1 . GLU 110 110 6607 1 . LYS 111 111 6607 1 . GLU 112 112 6607 1 . ILE 113 113 6607 1 . LEU 114 114 6607 1 . GLU 115 115 6607 1 . LYS 116 116 6607 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 6607 _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 $JMJ_ARID . 10090 . no . 'Mus musculus' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 6607 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 6607 _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 $JMJ_ARID . 'recombinant technology' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_Sample _Sample.Sf_category sample _Sample.Sf_framecode Sample _Sample.Entry_ID 6607 _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 'JMJ ARID' '[U-13C; U-15N]' . . 1 $JMJ_ARID . protein 1 0.3 1.6 mM . . . . 6607 1 2 'Sodium Phosphate' . . . . . . buffer 22.5 . . mM . . . . 6607 1 3 DTT . . . . . . 'reducing agent' 1.8 . . mM . . . . 6607 1 4 NaCl . . . . . . salt 90 . . mM . . . . 6607 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_condition _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_condition _Sample_condition_list.Entry_ID 6607 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 6.4 0.1 pH 6607 1 temperature 288 0.5 K 6607 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 6607 _Software.ID 1 _Software.Name NMRPipe _Software.Version . _Software.Details . save_ save_PIPP _Software.Sf_category software _Software.Sf_framecode PIPP _Software.Entry_ID 6607 _Software.ID 2 _Software.Name PIPP _Software.Version . _Software.Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_600MHz_spectrometer _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode 600MHz_spectrometer _NMR_spectrometer.Entry_ID 6607 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6607 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '1H15N HSQC' no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 2 '1H13C HSQC' no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 3 HNCO no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 4 HN(CA)CO no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 5 HNCA no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 6 HN(CO)CA no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 7 CBCA(CO)NH no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 8 HNCACB no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 9 (H)CC(CO)NH no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 10 H(CCCO)NH no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 11 HCCH-TOCSY no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 12 (HB)CB(CGCD)HD no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 13 (HB)CB(CGCDCE)HE no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 14 TOCSY no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 15 NOESY no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 16 HNHA no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 17 HNHB no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 18 '15N-edited NOESY-HSQC' no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 19 '13C-edited NOESY-HSQC' no . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 6607 1 stop_ 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 6607 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0 external indirect 0.251449530 . . . . . . . . . 6607 1 H 1 DSS 'methyl protons' . . . . ppm 0 internal direct 1.0 . . . . . . . . . 6607 1 N 15 DSS 'methyl protons' . . . . ppm 0 external indirect 0.101329118 . . . . . . . . . 6607 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_Assigned_chemical_shifts _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode Assigned_chemical_shifts _Assigned_chem_shift_list.Entry_ID 6607 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_condition _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 solution 6607 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $NMRPipe . . 6607 1 2 $PIPP . . 6607 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 LEU H H 1 8.40 0.02 . 1 . . . . 615 LEU H . 6607 1 2 . 1 1 1 1 LEU HA H 1 4.33 0.02 . 1 . . . . 615 LEU HA . 6607 1 3 . 1 1 1 1 LEU HB2 H 1 1.60 0.02 . 2 . . . . 615 LEU HB2 . 6607 1 4 . 1 1 1 1 LEU HB3 H 1 1.68 0.02 . 2 . . . . 615 LEU HB3 . 6607 1 5 . 1 1 1 1 LEU HG H 1 1.66 0.02 . 1 . . . . 615 LEU HG . 6607 1 6 . 1 1 1 1 LEU HD11 H 1 0.91 0.02 . 2 . . . . 615 LEU HD1 . 6607 1 7 . 1 1 1 1 LEU HD12 H 1 0.91 0.02 . 2 . . . . 615 LEU HD1 . 6607 1 8 . 1 1 1 1 LEU HD13 H 1 0.91 0.02 . 2 . . . . 615 LEU HD1 . 6607 1 9 . 1 1 1 1 LEU HD21 H 1 0.86 0.02 . 2 . . . . 615 LEU HD2 . 6607 1 10 . 1 1 1 1 LEU HD22 H 1 0.86 0.02 . 2 . . . . 615 LEU HD2 . 6607 1 11 . 1 1 1 1 LEU HD23 H 1 0.86 0.02 . 2 . . . . 615 LEU HD2 . 6607 1 12 . 1 1 1 1 LEU C C 13 178.10 0.05 . 1 . . . . 615 LEU C . 6607 1 13 . 1 1 1 1 LEU CA C 13 55.66 0.3 . 1 . . . . 615 LEU CA . 6607 1 14 . 1 1 1 1 LEU CB C 13 42.30 0.3 . 1 . . . . 615 LEU CB . 6607 1 15 . 1 1 1 1 LEU CG C 13 27.00 0.3 . 1 . . . . 615 LEU CG . 6607 1 16 . 1 1 1 1 LEU CD1 C 13 24.92 0.3 . 2 . . . . 615 LEU CD1 . 6607 1 17 . 1 1 1 1 LEU CD2 C 13 23.35 0.3 . 2 . . . . 615 LEU CD2 . 6607 1 18 . 1 1 1 1 LEU N N 15 123.74 0.1 . 1 . . . . 615 LEU N . 6607 1 19 . 1 1 2 2 GLY H H 1 8.40 0.02 . 1 . . . . 616 GLY H . 6607 1 20 . 1 1 2 2 GLY HA2 H 1 3.89 0.02 . 1 . . . . 616 GLY HA2 . 6607 1 21 . 1 1 2 2 GLY HA3 H 1 3.89 0.02 . 1 . . . . 616 GLY HA3 . 6607 1 22 . 1 1 2 2 GLY C C 13 174.20 0.05 . 1 . . . . 616 GLY C . 6607 1 23 . 1 1 2 2 GLY CA C 13 45.41 0.3 . 1 . . . . 616 GLY CA . 6607 1 24 . 1 1 2 2 GLY N N 15 109.04 0.1 . 1 . . . . 616 GLY N . 6607 1 25 . 1 1 3 3 ARG H H 1 8.17 0.02 . 1 . . . . 617 ARG H . 6607 1 26 . 1 1 3 3 ARG HA H 1 4.28 0.02 . 1 . . . . 617 ARG HA . 6607 1 27 . 1 1 3 3 ARG HB2 H 1 1.71 0.02 . 1 . . . . 617 ARG HB2 . 6607 1 28 . 1 1 3 3 ARG HB3 H 1 1.71 0.02 . 1 . . . . 617 ARG HB3 . 6607 1 29 . 1 1 3 3 ARG HG2 H 1 1.52 0.02 . 1 . . . . 617 ARG HG2 . 6607 1 30 . 1 1 3 3 ARG HG3 H 1 1.52 0.02 . 1 . . . . 617 ARG HG3 . 6607 1 31 . 1 1 3 3 ARG HD2 H 1 3.08 0.02 . 1 . . . . 617 ARG HD2 . 6607 1 32 . 1 1 3 3 ARG HD3 H 1 3.08 0.02 . 1 . . . . 617 ARG HD3 . 6607 1 33 . 1 1 3 3 ARG C C 13 176.34 0.05 . 1 . . . . 617 ARG C . 6607 1 34 . 1 1 3 3 ARG CA C 13 56.15 0.3 . 1 . . . . 617 ARG CA . 6607 1 35 . 1 1 3 3 ARG CB C 13 30.65 0.3 . 1 . . . . 617 ARG CB . 6607 1 36 . 1 1 3 3 ARG CG C 13 26.94 0.3 . 1 . . . . 617 ARG CG . 6607 1 37 . 1 1 3 3 ARG CD C 13 43.23 0.3 . 1 . . . . 617 ARG CD . 6607 1 38 . 1 1 3 3 ARG N N 15 120.71 0.1 . 1 . . . . 617 ARG N . 6607 1 39 . 1 1 4 4 ARG H H 1 8.40 0.02 . 1 . . . . 618 ARG H . 6607 1 40 . 1 1 4 4 ARG HA H 1 4.30 0.02 . 1 . . . . 618 ARG HA . 6607 1 41 . 1 1 4 4 ARG HB2 H 1 1.75 0.02 . 1 . . . . 618 ARG HB2 . 6607 1 42 . 1 1 4 4 ARG HB3 H 1 1.75 0.02 . 1 . . . . 618 ARG HB3 . 6607 1 43 . 1 1 4 4 ARG HG2 H 1 1.52 0.02 . 2 . . . . 618 ARG HG2 . 6607 1 44 . 1 1 4 4 ARG HG3 H 1 1.56 0.02 . 2 . . . . 618 ARG HG3 . 6607 1 45 . 1 1 4 4 ARG HD2 H 1 3.14 0.02 . 1 . . . . 618 ARG HD2 . 6607 1 46 . 1 1 4 4 ARG HD3 H 1 3.14 0.02 . 1 . . . . 618 ARG HD3 . 6607 1 47 . 1 1 4 4 ARG C C 13 175.90 0.05 . 1 . . . . 618 ARG C . 6607 1 48 . 1 1 4 4 ARG CA C 13 56.21 0.3 . 1 . . . . 618 ARG CA . 6607 1 49 . 1 1 4 4 ARG CB C 13 30.73 0.3 . 1 . . . . 618 ARG CB . 6607 1 50 . 1 1 4 4 ARG CG C 13 27.08 0.3 . 1 . . . . 618 ARG CG . 6607 1 51 . 1 1 4 4 ARG CD C 13 43.31 0.3 . 1 . . . . 618 ARG CD . 6607 1 52 . 1 1 4 4 ARG N N 15 122.40 0.1 . 1 . . . . 618 ARG N . 6607 1 53 . 1 1 5 5 TRP H H 1 8.44 0.02 . 1 . . . . 619 TRP H . 6607 1 54 . 1 1 5 5 TRP HA H 1 4.66 0.02 . 1 . . . . 619 TRP HA . 6607 1 55 . 1 1 5 5 TRP HB2 H 1 3.20 0.02 . 2 . . . . 619 TRP HB2 . 6607 1 56 . 1 1 5 5 TRP HB3 H 1 3.26 0.02 . 2 . . . . 619 TRP HB3 . 6607 1 57 . 1 1 5 5 TRP HD1 H 1 7.23 0.02 . 1 . . . . 619 TRP HD1 . 6607 1 58 . 1 1 5 5 TRP HE1 H 1 10.30 0.02 . 1 . . . . 619 TRP HE1 . 6607 1 59 . 1 1 5 5 TRP HZ2 H 1 7.37 0.02 . 1 . . . . 619 TRP HZ2 . 6607 1 60 . 1 1 5 5 TRP C C 13 175.98 0.05 . 1 . . . . 619 TRP C . 6607 1 61 . 1 1 5 5 TRP CA C 13 56.88 0.3 . 1 . . . . 619 TRP CA . 6607 1 62 . 1 1 5 5 TRP CB C 13 30.78 0.3 . 1 . . . . 619 TRP CB . 6607 1 63 . 1 1 5 5 TRP CD1 C 13 127.39 0.3 . 1 . . . . 619 TRP CD1 . 6607 1 64 . 1 1 5 5 TRP CZ2 C 13 114.15 0.3 . 1 . . . . 619 TRP CZ2 . 6607 1 65 . 1 1 5 5 TRP N N 15 123.06 0.1 . 1 . . . . 619 TRP N . 6607 1 66 . 1 1 5 5 TRP NE1 N 15 129.52 0.1 . 1 . . . . 619 TRP NE1 . 6607 1 67 . 1 1 6 6 GLY H H 1 7.66 0.02 . 1 . . . . 620 GLY H . 6607 1 68 . 1 1 6 6 GLY HA2 H 1 4.12 0.02 . 1 . . . . 620 GLY HA2 . 6607 1 69 . 1 1 6 6 GLY HA3 H 1 4.12 0.02 . 1 . . . . 620 GLY HA3 . 6607 1 70 . 1 1 6 6 GLY C C 13 171.82 0.05 . 1 . . . . 620 GLY C . 6607 1 71 . 1 1 6 6 GLY CA C 13 45.08 0.3 . 1 . . . . 620 GLY CA . 6607 1 72 . 1 1 6 6 GLY N N 15 110.93 0.1 . 1 . . . . 620 GLY N . 6607 1 73 . 1 1 7 7 PRO HA H 1 4.28 0.02 . 1 . . . . 621 PRO HA . 6607 1 74 . 1 1 7 7 PRO HB2 H 1 1.91 0.02 . 2 . . . . 621 PRO HB2 . 6607 1 75 . 1 1 7 7 PRO HB3 H 1 2.23 0.02 . 2 . . . . 621 PRO HB3 . 6607 1 76 . 1 1 7 7 PRO HG2 H 1 1.97 0.02 . 1 . . . . 621 PRO HG2 . 6607 1 77 . 1 1 7 7 PRO HG3 H 1 1.97 0.02 . 1 . . . . 621 PRO HG3 . 6607 1 78 . 1 1 7 7 PRO HD2 H 1 3.52 0.02 . 1 . . . . 621 PRO HD2 . 6607 1 79 . 1 1 7 7 PRO HD3 H 1 3.52 0.02 . 1 . . . . 621 PRO HD3 . 6607 1 80 . 1 1 7 7 PRO C C 13 178.62 0.05 . 1 . . . . 621 PRO C . 6607 1 81 . 1 1 7 7 PRO CA C 13 64.64 0.3 . 1 . . . . 621 PRO CA . 6607 1 82 . 1 1 7 7 PRO CB C 13 32.28 0.3 . 1 . . . . 621 PRO CB . 6607 1 83 . 1 1 7 7 PRO CG C 13 26.96 0.3 . 1 . . . . 621 PRO CG . 6607 1 84 . 1 1 7 7 PRO CD C 13 49.41 0.3 . 1 . . . . 621 PRO CD . 6607 1 85 . 1 1 8 8 ASN H H 1 8.73 0.02 . 1 . . . . 622 ASN H . 6607 1 86 . 1 1 8 8 ASN HA H 1 4.54 0.02 . 1 . . . . 622 ASN HA . 6607 1 87 . 1 1 8 8 ASN HB2 H 1 2.80 0.02 . 1 . . . . 622 ASN HB2 . 6607 1 88 . 1 1 8 8 ASN HB3 H 1 2.86 0.02 . 1 . . . . 622 ASN HB3 . 6607 1 89 . 1 1 8 8 ASN HD21 H 1 7.33 0.02 . 2 . . . . 622 ASN HD21 . 6607 1 90 . 1 1 8 8 ASN HD22 H 1 7.75 0.02 . 2 . . . . 622 ASN HD22 . 6607 1 91 . 1 1 8 8 ASN C C 13 176.90 0.05 . 1 . . . . 622 ASN C . 6607 1 92 . 1 1 8 8 ASN CA C 13 55.58 0.3 . 1 . . . . 622 ASN CA . 6607 1 93 . 1 1 8 8 ASN CB C 13 38.22 0.3 . 1 . . . . 622 ASN CB . 6607 1 94 . 1 1 8 8 ASN N N 15 118.85 0.1 . 1 . . . . 622 ASN N . 6607 1 95 . 1 1 8 8 ASN ND2 N 15 115.46 0.1 . 1 . . . . 622 ASN ND2 . 6607 1 96 . 1 1 9 9 VAL H H 1 7.70 0.02 . 1 . . . . 623 VAL H . 6607 1 97 . 1 1 9 9 VAL HA H 1 3.65 0.02 . 1 . . . . 623 VAL HA . 6607 1 98 . 1 1 9 9 VAL HB H 1 1.86 0.02 . 1 . . . . 623 VAL HB . 6607 1 99 . 1 1 9 9 VAL HG11 H 1 0.94 0.02 . 2 . . . . 623 VAL HG1 . 6607 1 100 . 1 1 9 9 VAL HG12 H 1 0.94 0.02 . 2 . . . . 623 VAL HG1 . 6607 1 101 . 1 1 9 9 VAL HG13 H 1 0.94 0.02 . 2 . . . . 623 VAL HG1 . 6607 1 102 . 1 1 9 9 VAL HG21 H 1 0.78 0.02 . 2 . . . . 623 VAL HG2 . 6607 1 103 . 1 1 9 9 VAL HG22 H 1 0.78 0.02 . 2 . . . . 623 VAL HG2 . 6607 1 104 . 1 1 9 9 VAL HG23 H 1 0.78 0.02 . 2 . . . . 623 VAL HG2 . 6607 1 105 . 1 1 9 9 VAL C C 13 178.00 0.05 . 1 . . . . 623 VAL C . 6607 1 106 . 1 1 9 9 VAL CA C 13 65.48 0.3 . 1 . . . . 623 VAL CA . 6607 1 107 . 1 1 9 9 VAL CB C 13 32.21 0.3 . 1 . . . . 623 VAL CB . 6607 1 108 . 1 1 9 9 VAL CG1 C 13 21.78 0.3 . 2 . . . . 623 VAL CG1 . 6607 1 109 . 1 1 9 9 VAL CG2 C 13 21.33 0.3 . 2 . . . . 623 VAL CG2 . 6607 1 110 . 1 1 9 9 VAL N N 15 121.81 0.1 . 1 . . . . 623 VAL N . 6607 1 111 . 1 1 10 10 GLN H H 1 8.01 0.02 . 1 . . . . 624 GLN H . 6607 1 112 . 1 1 10 10 GLN HA H 1 3.90 0.02 . 1 . . . . 624 GLN HA . 6607 1 113 . 1 1 10 10 GLN HB2 H 1 1.89 0.02 . 1 . . . . 624 GLN HB2 . 6607 1 114 . 1 1 10 10 GLN HB3 H 1 1.89 0.02 . 1 . . . . 624 GLN HB3 . 6607 1 115 . 1 1 10 10 GLN HG2 H 1 2.22 0.02 . 2 . . . . 624 GLN HG2 . 6607 1 116 . 1 1 10 10 GLN HG3 H 1 2.28 0.02 . 2 . . . . 624 GLN HG3 . 6607 1 117 . 1 1 10 10 GLN HE21 H 1 6.87 0.02 . 2 . . . . 624 GLN HE21 . 6607 1 118 . 1 1 10 10 GLN HE22 H 1 7.49 0.02 . 2 . . . . 624 GLN HE22 . 6607 1 119 . 1 1 10 10 GLN C C 13 177.58 0.05 . 1 . . . . 624 GLN C . 6607 1 120 . 1 1 10 10 GLN CA C 13 58.86 0.3 . 1 . . . . 624 GLN CA . 6607 1 121 . 1 1 10 10 GLN CB C 13 28.64 0.3 . 1 . . . . 624 GLN CB . 6607 1 122 . 1 1 10 10 GLN CG C 13 33.82 0.3 . 1 . . . . 624 GLN CG . 6607 1 123 . 1 1 10 10 GLN N N 15 120.82 0.1 . 1 . . . . 624 GLN N . 6607 1 124 . 1 1 10 10 GLN NE2 N 15 111.40 0.1 . 1 . . . . 624 GLN NE2 . 6607 1 125 . 1 1 11 11 ARG H H 1 8.02 0.02 . 1 . . . . 625 ARG H . 6607 1 126 . 1 1 11 11 ARG HA H 1 4.01 0.02 . 1 . . . . 625 ARG HA . 6607 1 127 . 1 1 11 11 ARG C C 13 178.31 0.05 . 1 . . . . 625 ARG C . 6607 1 128 . 1 1 11 11 ARG CA C 13 58.41 0.3 . 1 . . . . 625 ARG CA . 6607 1 129 . 1 1 11 11 ARG N N 15 119.94 0.1 . 1 . . . . 625 ARG N . 6607 1 130 . 1 1 12 12 LEU H H 1 8.23 0.02 . 1 . . . . 626 LEU H . 6607 1 131 . 1 1 12 12 LEU HA H 1 3.89 0.02 . 1 . . . . 626 LEU HA . 6607 1 132 . 1 1 12 12 LEU HB2 H 1 1.60 0.02 . 2 . . . . 626 LEU HB2 . 6607 1 133 . 1 1 12 12 LEU HB3 H 1 1.89 0.02 . 2 . . . . 626 LEU HB3 . 6607 1 134 . 1 1 12 12 LEU HD11 H 1 0.96 0.02 . 2 . . . . 626 LEU HD1 . 6607 1 135 . 1 1 12 12 LEU HD12 H 1 0.96 0.02 . 2 . . . . 626 LEU HD1 . 6607 1 136 . 1 1 12 12 LEU HD13 H 1 0.96 0.02 . 2 . . . . 626 LEU HD1 . 6607 1 137 . 1 1 12 12 LEU C C 13 178.18 0.05 . 1 . . . . 626 LEU C . 6607 1 138 . 1 1 12 12 LEU CA C 13 57.84 0.3 . 1 . . . . 626 LEU CA . 6607 1 139 . 1 1 12 12 LEU CB C 13 41.00 0.3 . 1 . . . . 626 LEU CB . 6607 1 140 . 1 1 12 12 LEU CD1 C 13 23.27 0.3 . 2 . . . . 626 LEU CD1 . 6607 1 141 . 1 1 12 12 LEU N N 15 118.74 0.1 . 1 . . . . 626 LEU N . 6607 1 142 . 1 1 13 13 ALA H H 1 7.89 0.02 . 1 . . . . 627 ALA H . 6607 1 143 . 1 1 13 13 ALA HA H 1 4.09 0.02 . 1 . . . . 627 ALA HA . 6607 1 144 . 1 1 13 13 ALA HB1 H 1 1.61 0.02 . 1 . . . . 627 ALA HB . 6607 1 145 . 1 1 13 13 ALA HB2 H 1 1.61 0.02 . 1 . . . . 627 ALA HB . 6607 1 146 . 1 1 13 13 ALA HB3 H 1 1.61 0.02 . 1 . . . . 627 ALA HB . 6607 1 147 . 1 1 13 13 ALA C C 13 181.49 0.05 . 1 . . . . 627 ALA C . 6607 1 148 . 1 1 13 13 ALA CA C 13 55.36 0.3 . 1 . . . . 627 ALA CA . 6607 1 149 . 1 1 13 13 ALA CB C 13 18.27 0.3 . 1 . . . . 627 ALA CB . 6607 1 150 . 1 1 13 13 ALA N N 15 120.50 0.1 . 1 . . . . 627 ALA N . 6607 1 151 . 1 1 14 14 CYS H H 1 8.05 0.02 . 1 . . . . 628 CYS H . 6607 1 152 . 1 1 14 14 CYS HA H 1 4.07 0.02 . 1 . . . . 628 CYS HA . 6607 1 153 . 1 1 14 14 CYS HB2 H 1 3.08 0.02 . 2 . . . . 628 CYS HB2 . 6607 1 154 . 1 1 14 14 CYS HB3 H 1 3.49 0.02 . 2 . . . . 628 CYS HB3 . 6607 1 155 . 1 1 14 14 CYS C C 13 176.12 0.05 . 1 . . . . 628 CYS C . 6607 1 156 . 1 1 14 14 CYS CA C 13 64.47 0.3 . 1 . . . . 628 CYS CA . 6607 1 157 . 1 1 14 14 CYS CB C 13 27.70 0.3 . 1 . . . . 628 CYS CB . 6607 1 158 . 1 1 14 14 CYS N N 15 118.67 0.1 . 1 . . . . 628 CYS N . 6607 1 159 . 1 1 15 15 ILE H H 1 8.02 0.02 . 1 . . . . 629 ILE H . 6607 1 160 . 1 1 15 15 ILE HA H 1 2.92 0.02 . 1 . . . . 629 ILE HA . 6607 1 161 . 1 1 15 15 ILE HB H 1 1.54 0.02 . 1 . . . . 629 ILE HB . 6607 1 162 . 1 1 15 15 ILE HG12 H 1 -0.92 0.02 . 2 . . . . 629 ILE HG12 . 6607 1 163 . 1 1 15 15 ILE HG13 H 1 0.85 0.02 . 2 . . . . 629 ILE HG13 . 6607 1 164 . 1 1 15 15 ILE HG21 H 1 0.58 0.02 . 1 . . . . 629 ILE HG2 . 6607 1 165 . 1 1 15 15 ILE HG22 H 1 0.58 0.02 . 1 . . . . 629 ILE HG2 . 6607 1 166 . 1 1 15 15 ILE HG23 H 1 0.58 0.02 . 1 . . . . 629 ILE HG2 . 6607 1 167 . 1 1 15 15 ILE HD11 H 1 0.22 0.02 . 1 . . . . 629 ILE HD1 . 6607 1 168 . 1 1 15 15 ILE HD12 H 1 0.22 0.02 . 1 . . . . 629 ILE HD1 . 6607 1 169 . 1 1 15 15 ILE HD13 H 1 0.22 0.02 . 1 . . . . 629 ILE HD1 . 6607 1 170 . 1 1 15 15 ILE C C 13 178.01 0.05 . 1 . . . . 629 ILE C . 6607 1 171 . 1 1 15 15 ILE CA C 13 66.17 0.3 . 1 . . . . 629 ILE CA . 6607 1 172 . 1 1 15 15 ILE CB C 13 38.25 0.3 . 1 . . . . 629 ILE CB . 6607 1 173 . 1 1 15 15 ILE CG1 C 13 27.61 0.3 . 1 . . . . 629 ILE CG1 . 6607 1 174 . 1 1 15 15 ILE CG2 C 13 16.67 0.3 . 1 . . . . 629 ILE CG2 . 6607 1 175 . 1 1 15 15 ILE CD1 C 13 14.28 0.3 . 1 . . . . 629 ILE CD1 . 6607 1 176 . 1 1 15 15 ILE N N 15 121.52 0.1 . 1 . . . . 629 ILE N . 6607 1 177 . 1 1 16 16 LYS H H 1 8.79 0.02 . 1 . . . . 630 LYS H . 6607 1 178 . 1 1 16 16 LYS HA H 1 3.85 0.02 . 1 . . . . 630 LYS HA . 6607 1 179 . 1 1 16 16 LYS HB2 H 1 1.86 0.02 . 1 . . . . 630 LYS HB2 . 6607 1 180 . 1 1 16 16 LYS HB3 H 1 1.86 0.02 . 1 . . . . 630 LYS HB3 . 6607 1 181 . 1 1 16 16 LYS HG2 H 1 1.69 0.02 . 1 . . . . 630 LYS HG2 . 6607 1 182 . 1 1 16 16 LYS HG3 H 1 1.69 0.02 . 1 . . . . 630 LYS HG3 . 6607 1 183 . 1 1 16 16 LYS HD2 H 1 1.30 0.02 . 1 . . . . 630 LYS HD2 . 6607 1 184 . 1 1 16 16 LYS HD3 H 1 1.30 0.02 . 1 . . . . 630 LYS HD3 . 6607 1 185 . 1 1 16 16 LYS HE2 H 1 2.83 0.02 . 2 . . . . 630 LYS HE2 . 6607 1 186 . 1 1 16 16 LYS HE3 H 1 2.92 0.02 . 2 . . . . 630 LYS HE3 . 6607 1 187 . 1 1 16 16 LYS C C 13 179.23 0.05 . 1 . . . . 630 LYS C . 6607 1 188 . 1 1 16 16 LYS CA C 13 61.05 0.3 . 1 . . . . 630 LYS CA . 6607 1 189 . 1 1 16 16 LYS CB C 13 32.73 0.3 . 1 . . . . 630 LYS CB . 6607 1 190 . 1 1 16 16 LYS CG C 13 30.04 0.3 . 1 . . . . 630 LYS CG . 6607 1 191 . 1 1 16 16 LYS CD C 13 26.55 0.3 . 1 . . . . 630 LYS CD . 6607 1 192 . 1 1 16 16 LYS CE C 13 42.01 0.3 . 1 . . . . 630 LYS CE . 6607 1 193 . 1 1 16 16 LYS N N 15 117.75 0.1 . 1 . . . . 630 LYS N . 6607 1 194 . 1 1 17 17 LYS H H 1 8.02 0.02 . 1 . . . . 631 LYS H . 6607 1 195 . 1 1 17 17 LYS HA H 1 4.11 0.02 . 1 . . . . 631 LYS HA . 6607 1 196 . 1 1 17 17 LYS HB2 H 1 1.91 0.02 . 2 . . . . 631 LYS HB2 . 6607 1 197 . 1 1 17 17 LYS HB3 H 1 2.00 0.02 . 2 . . . . 631 LYS HB3 . 6607 1 198 . 1 1 17 17 LYS HD2 H 1 1.50 0.02 . 1 . . . . 631 LYS HD2 . 6607 1 199 . 1 1 17 17 LYS HD3 H 1 1.50 0.02 . 1 . . . . 631 LYS HD3 . 6607 1 200 . 1 1 17 17 LYS HE2 H 1 2.99 0.02 . 1 . . . . 631 LYS HE2 . 6607 1 201 . 1 1 17 17 LYS HE3 H 1 2.99 0.02 . 1 . . . . 631 LYS HE3 . 6607 1 202 . 1 1 17 17 LYS C C 13 179.11 0.05 . 1 . . . . 631 LYS C . 6607 1 203 . 1 1 17 17 LYS CA C 13 59.35 0.3 . 1 . . . . 631 LYS CA . 6607 1 204 . 1 1 17 17 LYS CB C 13 31.95 0.3 . 1 . . . . 631 LYS CB . 6607 1 205 . 1 1 17 17 LYS CD C 13 24.62 0.3 . 1 . . . . 631 LYS CD . 6607 1 206 . 1 1 17 17 LYS CE C 13 42.19 0.3 . 1 . . . . 631 LYS CE . 6607 1 207 . 1 1 17 17 LYS N N 15 120.84 0.1 . 1 . . . . 631 LYS N . 6607 1 208 . 1 1 18 18 HIS H H 1 8.55 0.02 . 1 . . . . 632 HIS H . 6607 1 209 . 1 1 18 18 HIS HA H 1 4.40 0.02 . 1 . . . . 632 HIS HA . 6607 1 210 . 1 1 18 18 HIS HB2 H 1 3.33 0.02 . 2 . . . . 632 HIS HB2 . 6607 1 211 . 1 1 18 18 HIS HB3 H 1 3.43 0.02 . 2 . . . . 632 HIS HB3 . 6607 1 212 . 1 1 18 18 HIS C C 13 179.07 0.05 . 1 . . . . 632 HIS C . 6607 1 213 . 1 1 18 18 HIS CA C 13 60.24 0.3 . 1 . . . . 632 HIS CA . 6607 1 214 . 1 1 18 18 HIS CB C 13 30.25 0.3 . 1 . . . . 632 HIS CB . 6607 1 215 . 1 1 18 18 HIS N N 15 120.88 0.1 . 1 . . . . 632 HIS N . 6607 1 216 . 1 1 19 19 LEU H H 1 8.97 0.02 . 1 . . . . 633 LEU H . 6607 1 217 . 1 1 19 19 LEU HA H 1 3.80 0.02 . 1 . . . . 633 LEU HA . 6607 1 218 . 1 1 19 19 LEU HB2 H 1 1.53 0.02 . 2 . . . . 633 LEU HB2 . 6607 1 219 . 1 1 19 19 LEU HB3 H 1 1.96 0.02 . 2 . . . . 633 LEU HB3 . 6607 1 220 . 1 1 19 19 LEU HG H 1 1.03 0.02 . 1 . . . . 633 LEU HG . 6607 1 221 . 1 1 19 19 LEU HD11 H 1 1.13 0.02 . 2 . . . . 633 LEU HD1 . 6607 1 222 . 1 1 19 19 LEU HD12 H 1 1.13 0.02 . 2 . . . . 633 LEU HD1 . 6607 1 223 . 1 1 19 19 LEU HD13 H 1 1.13 0.02 . 2 . . . . 633 LEU HD1 . 6607 1 224 . 1 1 19 19 LEU HD21 H 1 0.94 0.02 . 2 . . . . 633 LEU HD2 . 6607 1 225 . 1 1 19 19 LEU HD22 H 1 0.94 0.02 . 2 . . . . 633 LEU HD2 . 6607 1 226 . 1 1 19 19 LEU HD23 H 1 0.94 0.02 . 2 . . . . 633 LEU HD2 . 6607 1 227 . 1 1 19 19 LEU C C 13 179.78 0.05 . 1 . . . . 633 LEU C . 6607 1 228 . 1 1 19 19 LEU CA C 13 58.46 0.3 . 1 . . . . 633 LEU CA . 6607 1 229 . 1 1 19 19 LEU CB C 13 40.76 0.3 . 1 . . . . 633 LEU CB . 6607 1 230 . 1 1 19 19 LEU CG C 13 27.08 0.3 . 1 . . . . 633 LEU CG . 6607 1 231 . 1 1 19 19 LEU CD1 C 13 22.76 0.3 . 2 . . . . 633 LEU CD1 . 6607 1 232 . 1 1 19 19 LEU N N 15 120.49 0.1 . 1 . . . . 633 LEU N . 6607 1 233 . 1 1 20 20 ARG H H 1 8.32 0.02 . 1 . . . . 634 ARG H . 6607 1 234 . 1 1 20 20 ARG HA H 1 4.08 0.02 . 1 . . . . 634 ARG HA . 6607 1 235 . 1 1 20 20 ARG HB2 H 1 2.01 0.02 . 1 . . . . 634 ARG HB2 . 6607 1 236 . 1 1 20 20 ARG HB3 H 1 2.01 0.02 . 1 . . . . 634 ARG HB3 . 6607 1 237 . 1 1 20 20 ARG HG2 H 1 1.70 0.02 . 2 . . . . 634 ARG HG2 . 6607 1 238 . 1 1 20 20 ARG HG3 H 1 1.80 0.02 . 2 . . . . 634 ARG HG3 . 6607 1 239 . 1 1 20 20 ARG HD2 H 1 3.22 0.02 . 1 . . . . 634 ARG HD2 . 6607 1 240 . 1 1 20 20 ARG HD3 H 1 3.22 0.02 . 1 . . . . 634 ARG HD3 . 6607 1 241 . 1 1 20 20 ARG C C 13 181.08 0.05 . 1 . . . . 634 ARG C . 6607 1 242 . 1 1 20 20 ARG CA C 13 59.44 0.3 . 1 . . . . 634 ARG CA . 6607 1 243 . 1 1 20 20 ARG CB C 13 29.84 0.3 . 1 . . . . 634 ARG CB . 6607 1 244 . 1 1 20 20 ARG CG C 13 27.47 0.3 . 1 . . . . 634 ARG CG . 6607 1 245 . 1 1 20 20 ARG CD C 13 43.51 0.3 . 1 . . . . 634 ARG CD . 6607 1 246 . 1 1 20 20 ARG N N 15 120.81 0.1 . 1 . . . . 634 ARG N . 6607 1 247 . 1 1 21 21 SER H H 1 7.92 0.02 . 1 . . . . 635 SER H . 6607 1 248 . 1 1 21 21 SER HA H 1 4.33 0.02 . 1 . . . . 635 SER HA . 6607 1 249 . 1 1 21 21 SER HB2 H 1 4.08 0.02 . 1 . . . . 635 SER HB2 . 6607 1 250 . 1 1 21 21 SER HB3 H 1 4.08 0.02 . 1 . . . . 635 SER HB3 . 6607 1 251 . 1 1 21 21 SER C C 13 174.85 0.05 . 1 . . . . 635 SER C . 6607 1 252 . 1 1 21 21 SER CA C 13 61.57 0.3 . 1 . . . . 635 SER CA . 6607 1 253 . 1 1 21 21 SER CB C 13 63.09 0.3 . 1 . . . . 635 SER CB . 6607 1 254 . 1 1 21 21 SER N N 15 117.56 0.1 . 1 . . . . 635 SER N . 6607 1 255 . 1 1 22 22 GLN H H 1 7.47 0.02 . 1 . . . . 636 GLN H . 6607 1 256 . 1 1 22 22 GLN HA H 1 4.37 0.02 . 1 . . . . 636 GLN HA . 6607 1 257 . 1 1 22 22 GLN HB2 H 1 2.34 0.02 . 1 . . . . 636 GLN HB2 . 6607 1 258 . 1 1 22 22 GLN HB3 H 1 2.34 0.02 . 1 . . . . 636 GLN HB3 . 6607 1 259 . 1 1 22 22 GLN HG2 H 1 1.97 0.02 . 2 . . . . 636 GLN HG2 . 6607 1 260 . 1 1 22 22 GLN HG3 H 1 2.33 0.02 . 2 . . . . 636 GLN HG3 . 6607 1 261 . 1 1 22 22 GLN HE21 H 1 6.76 0.02 . 2 . . . . 636 GLN HE21 . 6607 1 262 . 1 1 22 22 GLN HE22 H 1 6.95 0.02 . 2 . . . . 636 GLN HE22 . 6607 1 263 . 1 1 22 22 GLN C C 13 175.95 0.05 . 1 . . . . 636 GLN C . 6607 1 264 . 1 1 22 22 GLN CA C 13 54.61 0.3 . 1 . . . . 636 GLN CA . 6607 1 265 . 1 1 22 22 GLN CB C 13 29.58 0.3 . 1 . . . . 636 GLN CB . 6607 1 266 . 1 1 22 22 GLN CG C 13 33.44 0.3 . 1 . . . . 636 GLN CG . 6607 1 267 . 1 1 22 22 GLN N N 15 119.19 0.1 . 1 . . . . 636 GLN N . 6607 1 268 . 1 1 22 22 GLN NE2 N 15 113.15 0.1 . 1 . . . . 636 GLN NE2 . 6607 1 269 . 1 1 23 23 GLY H H 1 7.86 0.02 . 1 . . . . 637 GLY H . 6607 1 270 . 1 1 23 23 GLY HA2 H 1 3.76 0.02 . 2 . . . . 637 GLY HA2 . 6607 1 271 . 1 1 23 23 GLY HA3 H 1 4.15 0.02 . 2 . . . . 637 GLY HA3 . 6607 1 272 . 1 1 23 23 GLY C C 13 174.13 0.05 . 1 . . . . 637 GLY C . 6607 1 273 . 1 1 23 23 GLY CA C 13 45.73 0.3 . 1 . . . . 637 GLY CA . 6607 1 274 . 1 1 23 23 GLY N N 15 107.54 0.1 . 1 . . . . 637 GLY N . 6607 1 275 . 1 1 24 24 ILE H H 1 7.97 0.02 . 1 . . . . 638 ILE H . 6607 1 276 . 1 1 24 24 ILE HA H 1 4.25 0.02 . 1 . . . . 638 ILE HA . 6607 1 277 . 1 1 24 24 ILE HB H 1 1.70 0.02 . 1 . . . . 638 ILE HB . 6607 1 278 . 1 1 24 24 ILE HG12 H 1 1.03 0.02 . 2 . . . . 638 ILE HG12 . 6607 1 279 . 1 1 24 24 ILE HG13 H 1 1.40 0.02 . 2 . . . . 638 ILE HG13 . 6607 1 280 . 1 1 24 24 ILE HG21 H 1 0.93 0.02 . 1 . . . . 638 ILE HG2 . 6607 1 281 . 1 1 24 24 ILE HG22 H 1 0.93 0.02 . 1 . . . . 638 ILE HG2 . 6607 1 282 . 1 1 24 24 ILE HG23 H 1 0.93 0.02 . 1 . . . . 638 ILE HG2 . 6607 1 283 . 1 1 24 24 ILE HD11 H 1 0.86 0.02 . 1 . . . . 638 ILE HD1 . 6607 1 284 . 1 1 24 24 ILE HD12 H 1 0.86 0.02 . 1 . . . . 638 ILE HD1 . 6607 1 285 . 1 1 24 24 ILE HD13 H 1 0.86 0.02 . 1 . . . . 638 ILE HD1 . 6607 1 286 . 1 1 24 24 ILE C C 13 175.22 0.05 . 1 . . . . 638 ILE C . 6607 1 287 . 1 1 24 24 ILE CA C 13 60.45 0.3 . 1 . . . . 638 ILE CA . 6607 1 288 . 1 1 24 24 ILE CB C 13 39.11 0.3 . 1 . . . . 638 ILE CB . 6607 1 289 . 1 1 24 24 ILE CG1 C 13 27.23 0.3 . 1 . . . . 638 ILE CG1 . 6607 1 290 . 1 1 24 24 ILE CG2 C 13 17.27 0.3 . 1 . . . . 638 ILE CG2 . 6607 1 291 . 1 1 24 24 ILE CD1 C 13 13.43 0.3 . 1 . . . . 638 ILE CD1 . 6607 1 292 . 1 1 24 24 ILE N N 15 123.01 0.1 . 1 . . . . 638 ILE N . 6607 1 293 . 1 1 25 25 THR H H 1 8.62 0.02 . 1 . . . . 639 THR H . 6607 1 294 . 1 1 25 25 THR HA H 1 4.17 0.02 . 1 . . . . 639 THR HA . 6607 1 295 . 1 1 25 25 THR HB H 1 4.16 0.02 . 1 . . . . 639 THR HB . 6607 1 296 . 1 1 25 25 THR HG21 H 1 1.16 0.02 . 1 . . . . 639 THR HG2 . 6607 1 297 . 1 1 25 25 THR HG22 H 1 1.16 0.02 . 1 . . . . 639 THR HG2 . 6607 1 298 . 1 1 25 25 THR HG23 H 1 1.16 0.02 . 1 . . . . 639 THR HG2 . 6607 1 299 . 1 1 25 25 THR C C 13 173.84 0.05 . 1 . . . . 639 THR C . 6607 1 300 . 1 1 25 25 THR CA C 13 61.68 0.3 . 1 . . . . 639 THR CA . 6607 1 301 . 1 1 25 25 THR CB C 13 69.92 0.3 . 1 . . . . 639 THR CB . 6607 1 302 . 1 1 25 25 THR CG2 C 13 21.67 0.3 . 1 . . . . 639 THR CG2 . 6607 1 303 . 1 1 25 25 THR N N 15 121.94 0.1 . 1 . . . . 639 THR N . 6607 1 304 . 1 1 26 26 MET H H 1 8.60 0.02 . 1 . . . . 640 MET H . 6607 1 305 . 1 1 26 26 MET HA H 1 4.52 0.02 . 1 . . . . 640 MET HA . 6607 1 306 . 1 1 26 26 MET HB2 H 1 1.77 0.02 . 2 . . . . 640 MET HB2 . 6607 1 307 . 1 1 26 26 MET HB3 H 1 2.11 0.02 . 2 . . . . 640 MET HB3 . 6607 1 308 . 1 1 26 26 MET HG2 H 1 2.23 0.02 . 2 . . . . 640 MET HG2 . 6607 1 309 . 1 1 26 26 MET HG3 H 1 2.34 0.02 . 2 . . . . 640 MET HG3 . 6607 1 310 . 1 1 26 26 MET HE1 H 1 1.71 0.02 . 1 . . . . 640 MET HE . 6607 1 311 . 1 1 26 26 MET HE2 H 1 1.71 0.02 . 1 . . . . 640 MET HE . 6607 1 312 . 1 1 26 26 MET HE3 H 1 1.71 0.02 . 1 . . . . 640 MET HE . 6607 1 313 . 1 1 26 26 MET C C 13 174.57 0.05 . 1 . . . . 640 MET C . 6607 1 314 . 1 1 26 26 MET CA C 13 54.79 0.3 . 1 . . . . 640 MET CA . 6607 1 315 . 1 1 26 26 MET CB C 13 33.04 0.3 . 1 . . . . 640 MET CB . 6607 1 316 . 1 1 26 26 MET CG C 13 31.85 0.3 . 1 . . . . 640 MET CG . 6607 1 317 . 1 1 26 26 MET CE C 13 17.02 0.3 . 1 . . . . 640 MET CE . 6607 1 318 . 1 1 26 26 MET N N 15 125.02 0.1 . 1 . . . . 640 MET N . 6607 1 319 . 1 1 27 27 ASP H H 1 8.49 0.02 . 1 . . . . 641 ASP H . 6607 1 320 . 1 1 27 27 ASP HA H 1 4.52 0.02 . 1 . . . . 641 ASP HA . 6607 1 321 . 1 1 27 27 ASP HB2 H 1 2.52 0.02 . 2 . . . . 641 ASP HB2 . 6607 1 322 . 1 1 27 27 ASP HB3 H 1 2.71 0.02 . 2 . . . . 641 ASP HB3 . 6607 1 323 . 1 1 27 27 ASP C C 13 175.90 0.05 . 1 . . . . 641 ASP C . 6607 1 324 . 1 1 27 27 ASP CA C 13 56.02 0.3 . 1 . . . . 641 ASP CA . 6607 1 325 . 1 1 27 27 ASP CB C 13 41.26 0.3 . 1 . . . . 641 ASP CB . 6607 1 326 . 1 1 27 27 ASP N N 15 123.44 0.1 . 1 . . . . 641 ASP N . 6607 1 327 . 1 1 28 28 GLU H H 1 7.84 0.02 . 1 . . . . 642 GLU H . 6607 1 328 . 1 1 28 28 GLU HA H 1 4.42 0.02 . 1 . . . . 642 GLU HA . 6607 1 329 . 1 1 28 28 GLU HB2 H 1 1.82 0.02 . 2 . . . . 642 GLU HB2 . 6607 1 330 . 1 1 28 28 GLU HB3 H 1 2.08 0.02 . 2 . . . . 642 GLU HB3 . 6607 1 331 . 1 1 28 28 GLU HG2 H 1 2.17 0.02 . 1 . . . . 642 GLU HG2 . 6607 1 332 . 1 1 28 28 GLU HG3 H 1 2.17 0.02 . 1 . . . . 642 GLU HG3 . 6607 1 333 . 1 1 28 28 GLU C C 13 175.11 0.05 . 1 . . . . 642 GLU C . 6607 1 334 . 1 1 28 28 GLU CA C 13 54.75 0.3 . 1 . . . . 642 GLU CA . 6607 1 335 . 1 1 28 28 GLU CB C 13 31.09 0.3 . 1 . . . . 642 GLU CB . 6607 1 336 . 1 1 28 28 GLU CG C 13 35.91 0.3 . 1 . . . . 642 GLU CG . 6607 1 337 . 1 1 28 28 GLU N N 15 117.68 0.1 . 1 . . . . 642 GLU N . 6607 1 338 . 1 1 29 29 LEU H H 1 8.34 0.02 . 1 . . . . 643 LEU H . 6607 1 339 . 1 1 29 29 LEU HA H 1 4.35 0.02 . 1 . . . . 643 LEU HA . 6607 1 340 . 1 1 29 29 LEU HB2 H 1 1.51 0.02 . 1 . . . . 643 LEU HB2 . 6607 1 341 . 1 1 29 29 LEU HB3 H 1 1.51 0.02 . 1 . . . . 643 LEU HB3 . 6607 1 342 . 1 1 29 29 LEU HD11 H 1 0.86 0.02 . 2 . . . . 643 LEU HD1 . 6607 1 343 . 1 1 29 29 LEU HD12 H 1 0.86 0.02 . 2 . . . . 643 LEU HD1 . 6607 1 344 . 1 1 29 29 LEU HD13 H 1 0.86 0.02 . 2 . . . . 643 LEU HD1 . 6607 1 345 . 1 1 29 29 LEU HD21 H 1 0.92 0.02 . 2 . . . . 643 LEU HD2 . 6607 1 346 . 1 1 29 29 LEU HD22 H 1 0.92 0.02 . 2 . . . . 643 LEU HD2 . 6607 1 347 . 1 1 29 29 LEU HD23 H 1 0.92 0.02 . 2 . . . . 643 LEU HD2 . 6607 1 348 . 1 1 29 29 LEU C C 13 174.91 0.05 . 1 . . . . 643 LEU C . 6607 1 349 . 1 1 29 29 LEU CA C 13 53.54 0.3 . 1 . . . . 643 LEU CA . 6607 1 350 . 1 1 29 29 LEU CB C 13 40.55 0.3 . 1 . . . . 643 LEU CB . 6607 1 351 . 1 1 29 29 LEU CD1 C 13 25.46 0.3 . 2 . . . . 643 LEU CD1 . 6607 1 352 . 1 1 29 29 LEU CD2 C 13 23.32 0.3 . 2 . . . . 643 LEU CD2 . 6607 1 353 . 1 1 29 29 LEU N N 15 123.33 0.1 . 1 . . . . 643 LEU N . 6607 1 354 . 1 1 30 30 PRO HA H 1 4.41 0.02 . 1 . . . . 644 PRO HA . 6607 1 355 . 1 1 30 30 PRO HB2 H 1 1.78 0.02 . 1 . . . . 644 PRO HB2 . 6607 1 356 . 1 1 30 30 PRO HB3 H 1 1.78 0.02 . 1 . . . . 644 PRO HB3 . 6607 1 357 . 1 1 30 30 PRO HG2 H 1 1.63 0.02 . 1 . . . . 644 PRO HG2 . 6607 1 358 . 1 1 30 30 PRO HG3 H 1 1.63 0.02 . 1 . . . . 644 PRO HG3 . 6607 1 359 . 1 1 30 30 PRO HD2 H 1 3.56 0.02 . 2 . . . . 644 PRO HD2 . 6607 1 360 . 1 1 30 30 PRO HD3 H 1 3.67 0.02 . 2 . . . . 644 PRO HD3 . 6607 1 361 . 1 1 30 30 PRO C C 13 174.59 0.05 . 1 . . . . 644 PRO C . 6607 1 362 . 1 1 30 30 PRO CA C 13 62.60 0.3 . 1 . . . . 644 PRO CA . 6607 1 363 . 1 1 30 30 PRO CB C 13 31.79 0.3 . 1 . . . . 644 PRO CB . 6607 1 364 . 1 1 30 30 PRO CG C 13 27.75 0.3 . 1 . . . . 644 PRO CG . 6607 1 365 . 1 1 30 30 PRO CD C 13 49.95 0.3 . 1 . . . . 644 PRO CD . 6607 1 366 . 1 1 31 31 LEU H H 1 8.22 0.02 . 1 . . . . 645 LEU H . 6607 1 367 . 1 1 31 31 LEU HA H 1 4.94 0.02 . 1 . . . . 645 LEU HA . 6607 1 368 . 1 1 31 31 LEU HB2 H 1 0.98 0.02 . 2 . . . . 645 LEU HB2 . 6607 1 369 . 1 1 31 31 LEU HB3 H 1 1.63 0.02 . 2 . . . . 645 LEU HB3 . 6607 1 370 . 1 1 31 31 LEU HG H 1 1.54 0.02 . 1 . . . . 645 LEU HG . 6607 1 371 . 1 1 31 31 LEU HD11 H 1 0.79 0.02 . 2 . . . . 645 LEU HD1 . 6607 1 372 . 1 1 31 31 LEU HD12 H 1 0.79 0.02 . 2 . . . . 645 LEU HD1 . 6607 1 373 . 1 1 31 31 LEU HD13 H 1 0.79 0.02 . 2 . . . . 645 LEU HD1 . 6607 1 374 . 1 1 31 31 LEU HD21 H 1 0.60 0.02 . 2 . . . . 645 LEU HD2 . 6607 1 375 . 1 1 31 31 LEU HD22 H 1 0.60 0.02 . 2 . . . . 645 LEU HD2 . 6607 1 376 . 1 1 31 31 LEU HD23 H 1 0.60 0.02 . 2 . . . . 645 LEU HD2 . 6607 1 377 . 1 1 31 31 LEU C C 13 178.34 0.05 . 1 . . . . 645 LEU C . 6607 1 378 . 1 1 31 31 LEU CA C 13 53.63 0.3 . 1 . . . . 645 LEU CA . 6607 1 379 . 1 1 31 31 LEU CB C 13 45.14 0.3 . 1 . . . . 645 LEU CB . 6607 1 380 . 1 1 31 31 LEU CG C 13 27.28 0.3 . 1 . . . . 645 LEU CG . 6607 1 381 . 1 1 31 31 LEU CD1 C 13 25.52 0.3 . 2 . . . . 645 LEU CD1 . 6607 1 382 . 1 1 31 31 LEU CD2 C 13 23.73 0.3 . 2 . . . . 645 LEU CD2 . 6607 1 383 . 1 1 31 31 LEU N N 15 119.53 0.1 . 1 . . . . 645 LEU N . 6607 1 384 . 1 1 32 32 ILE H H 1 8.80 0.02 . 1 . . . . 646 ILE H . 6607 1 385 . 1 1 32 32 ILE HA H 1 4.19 0.02 . 1 . . . . 646 ILE HA . 6607 1 386 . 1 1 32 32 ILE HB H 1 1.66 0.02 . 1 . . . . 646 ILE HB . 6607 1 387 . 1 1 32 32 ILE HG12 H 1 1.00 0.02 . 2 . . . . 646 ILE HG12 . 6607 1 388 . 1 1 32 32 ILE HG13 H 1 1.43 0.02 . 2 . . . . 646 ILE HG13 . 6607 1 389 . 1 1 32 32 ILE HG21 H 1 0.73 0.02 . 1 . . . . 646 ILE HG2 . 6607 1 390 . 1 1 32 32 ILE HG22 H 1 0.73 0.02 . 1 . . . . 646 ILE HG2 . 6607 1 391 . 1 1 32 32 ILE HG23 H 1 0.73 0.02 . 1 . . . . 646 ILE HG2 . 6607 1 392 . 1 1 32 32 ILE HD11 H 1 0.710 0.02 . 1 . . . . 646 ILE HD1 . 6607 1 393 . 1 1 32 32 ILE HD12 H 1 0.710 0.02 . 1 . . . . 646 ILE HD1 . 6607 1 394 . 1 1 32 32 ILE HD13 H 1 0.710 0.02 . 1 . . . . 646 ILE HD1 . 6607 1 395 . 1 1 32 32 ILE C C 13 176.68 0.05 . 1 . . . . 646 ILE C . 6607 1 396 . 1 1 32 32 ILE CA C 13 61.12 0.3 . 1 . . . . 646 ILE CA . 6607 1 397 . 1 1 32 32 ILE CB C 13 39.99 0.3 . 1 . . . . 646 ILE CB . 6607 1 398 . 1 1 32 32 ILE CG1 C 13 27.02 0.3 . 1 . . . . 646 ILE CG1 . 6607 1 399 . 1 1 32 32 ILE CG2 C 13 17.63 0.3 . 1 . . . . 646 ILE CG2 . 6607 1 400 . 1 1 32 32 ILE CD1 C 13 13.85 0.3 . 1 . . . . 646 ILE CD1 . 6607 1 401 . 1 1 32 32 ILE N N 15 121.00 0.1 . 1 . . . . 646 ILE N . 6607 1 402 . 1 1 33 33 GLY H H 1 9.44 0.02 . 1 . . . . 647 GLY H . 6607 1 403 . 1 1 33 33 GLY HA2 H 1 3.63 0.02 . 2 . . . . 647 GLY HA2 . 6607 1 404 . 1 1 33 33 GLY HA3 H 1 3.97 0.02 . 2 . . . . 647 GLY HA3 . 6607 1 405 . 1 1 33 33 GLY C C 13 175.39 0.05 . 1 . . . . 647 GLY C . 6607 1 406 . 1 1 33 33 GLY CA C 13 47.56 0.3 . 1 . . . . 647 GLY CA . 6607 1 407 . 1 1 33 33 GLY N N 15 117.70 0.1 . 1 . . . . 647 GLY N . 6607 1 408 . 1 1 34 34 GLY H H 1 8.51 0.02 . 1 . . . . 648 GLY H . 6607 1 409 . 1 1 34 34 GLY HA2 H 1 3.54 0.02 . 2 . . . . 648 GLY HA2 . 6607 1 410 . 1 1 34 34 GLY HA3 H 1 4.18 0.02 . 2 . . . . 648 GLY HA3 . 6607 1 411 . 1 1 34 34 GLY C C 13 173.10 0.05 . 1 . . . . 648 GLY C . 6607 1 412 . 1 1 34 34 GLY CA C 13 45.00 0.3 . 1 . . . . 648 GLY CA . 6607 1 413 . 1 1 34 34 GLY N N 15 104.17 0.1 . 1 . . . . 648 GLY N . 6607 1 414 . 1 1 35 35 CYS H H 1 7.69 0.02 . 1 . . . . 649 CYS H . 6607 1 415 . 1 1 35 35 CYS HA H 1 4.65 0.02 . 1 . . . . 649 CYS HA . 6607 1 416 . 1 1 35 35 CYS HB2 H 1 2.80 0.02 . 2 . . . . 649 CYS HB2 . 6607 1 417 . 1 1 35 35 CYS HB3 H 1 3.08 0.02 . 2 . . . . 649 CYS HB3 . 6607 1 418 . 1 1 35 35 CYS C C 13 173.60 0.05 . 1 . . . . 649 CYS C . 6607 1 419 . 1 1 35 35 CYS CA C 13 57.55 0.3 . 1 . . . . 649 CYS CA . 6607 1 420 . 1 1 35 35 CYS CB C 13 29.40 0.3 . 1 . . . . 649 CYS CB . 6607 1 421 . 1 1 35 35 CYS N N 15 120.24 0.1 . 1 . . . . 649 CYS N . 6607 1 422 . 1 1 36 36 GLU H H 1 8.89 0.02 . 1 . . . . 650 GLU H . 6607 1 423 . 1 1 36 36 GLU HA H 1 4.20 0.02 . 1 . . . . 650 GLU HA . 6607 1 424 . 1 1 36 36 GLU HB2 H 1 1.82 0.02 . 2 . . . . 650 GLU HB2 . 6607 1 425 . 1 1 36 36 GLU HB3 H 1 1.88 0.02 . 2 . . . . 650 GLU HB3 . 6607 1 426 . 1 1 36 36 GLU HG2 H 1 2.02 0.02 . 2 . . . . 650 GLU HG2 . 6607 1 427 . 1 1 36 36 GLU HG3 H 1 2.17 0.02 . 2 . . . . 650 GLU HG3 . 6607 1 428 . 1 1 36 36 GLU C C 13 175.92 0.05 . 1 . . . . 650 GLU C . 6607 1 429 . 1 1 36 36 GLU CA C 13 57.35 0.3 . 1 . . . . 650 GLU CA . 6607 1 430 . 1 1 36 36 GLU CB C 13 30.58 0.3 . 1 . . . . 650 GLU CB . 6607 1 431 . 1 1 36 36 GLU CG C 13 37.37 0.3 . 1 . . . . 650 GLU CG . 6607 1 432 . 1 1 36 36 GLU N N 15 126.13 0.1 . 1 . . . . 650 GLU N . 6607 1 433 . 1 1 37 37 LEU H H 1 8.82 0.02 . 1 . . . . 651 LEU H . 6607 1 434 . 1 1 37 37 LEU HA H 1 4.25 0.02 . 1 . . . . 651 LEU HA . 6607 1 435 . 1 1 37 37 LEU HB2 H 1 1.01 0.02 . 2 . . . . 651 LEU HB2 . 6607 1 436 . 1 1 37 37 LEU HB3 H 1 1.78 0.02 . 2 . . . . 651 LEU HB3 . 6607 1 437 . 1 1 37 37 LEU HG H 1 1.22 0.02 . 1 . . . . 651 LEU HG . 6607 1 438 . 1 1 37 37 LEU HD11 H 1 0.73 0.02 . 2 . . . . 651 LEU HD1 . 6607 1 439 . 1 1 37 37 LEU HD12 H 1 0.73 0.02 . 2 . . . . 651 LEU HD1 . 6607 1 440 . 1 1 37 37 LEU HD13 H 1 0.73 0.02 . 2 . . . . 651 LEU HD1 . 6607 1 441 . 1 1 37 37 LEU HD21 H 1 0.61 0.02 . 2 . . . . 651 LEU HD2 . 6607 1 442 . 1 1 37 37 LEU HD22 H 1 0.61 0.02 . 2 . . . . 651 LEU HD2 . 6607 1 443 . 1 1 37 37 LEU HD23 H 1 0.61 0.02 . 2 . . . . 651 LEU HD2 . 6607 1 444 . 1 1 37 37 LEU C C 13 173.86 0.05 . 1 . . . . 651 LEU C . 6607 1 445 . 1 1 37 37 LEU CA C 13 53.69 0.3 . 1 . . . . 651 LEU CA . 6607 1 446 . 1 1 37 37 LEU CB C 13 43.12 0.3 . 1 . . . . 651 LEU CB . 6607 1 447 . 1 1 37 37 LEU CG C 13 27.50 0.3 . 1 . . . . 651 LEU CG . 6607 1 448 . 1 1 37 37 LEU CD1 C 13 26.30 0.3 . 2 . . . . 651 LEU CD1 . 6607 1 449 . 1 1 37 37 LEU CD2 C 13 23.73 0.3 . 2 . . . . 651 LEU CD2 . 6607 1 450 . 1 1 37 37 LEU N N 15 128.00 0.1 . 1 . . . . 651 LEU N . 6607 1 451 . 1 1 38 38 ASP H H 1 8.47 0.02 . 1 . . . . 652 ASP H . 6607 1 452 . 1 1 38 38 ASP HA H 1 4.59 0.02 . 1 . . . . 652 ASP HA . 6607 1 453 . 1 1 38 38 ASP HB2 H 1 2.59 0.02 . 2 . . . . 652 ASP HB2 . 6607 1 454 . 1 1 38 38 ASP HB3 H 1 2.94 0.02 . 2 . . . . 652 ASP HB3 . 6607 1 455 . 1 1 38 38 ASP C C 13 176.86 0.05 . 1 . . . . 652 ASP C . 6607 1 456 . 1 1 38 38 ASP CA C 13 52.98 0.3 . 1 . . . . 652 ASP CA . 6607 1 457 . 1 1 38 38 ASP CB C 13 40.21 0.3 . 1 . . . . 652 ASP CB . 6607 1 458 . 1 1 38 38 ASP N N 15 125.75 0.1 . 1 . . . . 652 ASP N . 6607 1 459 . 1 1 39 39 LEU H H 1 7.83 0.02 . 1 . . . . 653 LEU H . 6607 1 460 . 1 1 39 39 LEU HA H 1 4.10 0.02 . 1 . . . . 653 LEU HA . 6607 1 461 . 1 1 39 39 LEU HB2 H 1 1.38 0.02 . 1 . . . . 653 LEU HB2 . 6607 1 462 . 1 1 39 39 LEU HB3 H 1 1.38 0.02 . 1 . . . . 653 LEU HB3 . 6607 1 463 . 1 1 39 39 LEU HG H 1 1.70 0.02 . 1 . . . . 653 LEU HG . 6607 1 464 . 1 1 39 39 LEU HD11 H 1 0.68 0.02 . 2 . . . . 653 LEU HD1 . 6607 1 465 . 1 1 39 39 LEU HD12 H 1 0.68 0.02 . 2 . . . . 653 LEU HD1 . 6607 1 466 . 1 1 39 39 LEU HD13 H 1 0.68 0.02 . 2 . . . . 653 LEU HD1 . 6607 1 467 . 1 1 39 39 LEU HD21 H 1 0.83 0.02 . 2 . . . . 653 LEU HD2 . 6607 1 468 . 1 1 39 39 LEU HD22 H 1 0.83 0.02 . 2 . . . . 653 LEU HD2 . 6607 1 469 . 1 1 39 39 LEU HD23 H 1 0.83 0.02 . 2 . . . . 653 LEU HD2 . 6607 1 470 . 1 1 39 39 LEU C C 13 177.99 0.05 . 1 . . . . 653 LEU C . 6607 1 471 . 1 1 39 39 LEU CA C 13 57.96 0.3 . 1 . . . . 653 LEU CA . 6607 1 472 . 1 1 39 39 LEU CB C 13 43.27 0.3 . 1 . . . . 653 LEU CB . 6607 1 473 . 1 1 39 39 LEU CG C 13 26.86 0.3 . 1 . . . . 653 LEU CG . 6607 1 474 . 1 1 39 39 LEU CD1 C 13 25.86 0.3 . 2 . . . . 653 LEU CD1 . 6607 1 475 . 1 1 39 39 LEU CD2 C 13 22.79 0.3 . 2 . . . . 653 LEU CD2 . 6607 1 476 . 1 1 39 39 LEU N N 15 125.86 0.1 . 1 . . . . 653 LEU N . 6607 1 477 . 1 1 40 40 ALA H H 1 8.24 0.02 . 1 . . . . 654 ALA H . 6607 1 478 . 1 1 40 40 ALA HA H 1 3.97 0.02 . 1 . . . . 654 ALA HA . 6607 1 479 . 1 1 40 40 ALA HB1 H 1 1.50 0.02 . 1 . . . . 654 ALA HB . 6607 1 480 . 1 1 40 40 ALA HB2 H 1 1.50 0.02 . 1 . . . . 654 ALA HB . 6607 1 481 . 1 1 40 40 ALA HB3 H 1 1.50 0.02 . 1 . . . . 654 ALA HB . 6607 1 482 . 1 1 40 40 ALA C C 13 179.87 0.05 . 1 . . . . 654 ALA C . 6607 1 483 . 1 1 40 40 ALA CA C 13 55.69 0.3 . 1 . . . . 654 ALA CA . 6607 1 484 . 1 1 40 40 ALA CB C 13 18.97 0.3 . 1 . . . . 654 ALA CB . 6607 1 485 . 1 1 40 40 ALA N N 15 119.81 0.1 . 1 . . . . 654 ALA N . 6607 1 486 . 1 1 41 41 CYS H H 1 8.08 0.02 . 1 . . . . 655 CYS H . 6607 1 487 . 1 1 41 41 CYS HA H 1 4.14 0.02 . 1 . . . . 655 CYS HA . 6607 1 488 . 1 1 41 41 CYS HB2 H 1 2.79 0.02 . 2 . . . . 655 CYS HB2 . 6607 1 489 . 1 1 41 41 CYS HB3 H 1 2.92 0.02 . 2 . . . . 655 CYS HB3 . 6607 1 490 . 1 1 41 41 CYS C C 13 176.17 0.05 . 1 . . . . 655 CYS C . 6607 1 491 . 1 1 41 41 CYS CA C 13 62.18 0.3 . 1 . . . . 655 CYS CA . 6607 1 492 . 1 1 41 41 CYS CB C 13 26.55 0.3 . 1 . . . . 655 CYS CB . 6607 1 493 . 1 1 41 41 CYS N N 15 121.27 0.1 . 1 . . . . 655 CYS N . 6607 1 494 . 1 1 42 42 PHE H H 1 8.68 0.02 . 1 . . . . 656 PHE H . 6607 1 495 . 1 1 42 42 PHE HA H 1 4.52 0.02 . 1 . . . . 656 PHE HA . 6607 1 496 . 1 1 42 42 PHE HB2 H 1 3.30 0.02 . 2 . . . . 656 PHE HB2 . 6607 1 497 . 1 1 42 42 PHE HB3 H 1 3.59 0.02 . 2 . . . . 656 PHE HB3 . 6607 1 498 . 1 1 42 42 PHE HD1 H 1 7.33 0.02 . 1 . . . . 656 PHE HD1 . 6607 1 499 . 1 1 42 42 PHE HD2 H 1 7.33 0.02 . 1 . . . . 656 PHE HD2 . 6607 1 500 . 1 1 42 42 PHE C C 13 176.01 0.05 . 1 . . . . 656 PHE C . 6607 1 501 . 1 1 42 42 PHE CA C 13 57.92 0.3 . 1 . . . . 656 PHE CA . 6607 1 502 . 1 1 42 42 PHE CB C 13 38.84 0.3 . 1 . . . . 656 PHE CB . 6607 1 503 . 1 1 42 42 PHE CD1 C 13 130.62 0.3 . 1 . . . . 656 PHE CD1 . 6607 1 504 . 1 1 42 42 PHE CD2 C 13 130.62 0.3 . 1 . . . . 656 PHE CD2 . 6607 1 505 . 1 1 42 42 PHE N N 15 119.50 0.1 . 1 . . . . 656 PHE N . 6607 1 506 . 1 1 43 43 PHE H H 1 8.39 0.02 . 1 . . . . 657 PHE H . 6607 1 507 . 1 1 43 43 PHE HA H 1 3.88 0.02 . 1 . . . . 657 PHE HA . 6607 1 508 . 1 1 43 43 PHE HB2 H 1 3.20 0.02 . 2 . . . . 657 PHE HB2 . 6607 1 509 . 1 1 43 43 PHE HB3 H 1 3.27 0.02 . 2 . . . . 657 PHE HB3 . 6607 1 510 . 1 1 43 43 PHE HD1 H 1 7.14 0.02 . 1 . . . . 657 PHE HD1 . 6607 1 511 . 1 1 43 43 PHE HD2 H 1 7.14 0.02 . 1 . . . . 657 PHE HD2 . 6607 1 512 . 1 1 43 43 PHE HE1 H 1 7.46 0.02 . 1 . . . . 657 PHE HE1 . 6607 1 513 . 1 1 43 43 PHE HE2 H 1 7.46 0.02 . 1 . . . . 657 PHE HE2 . 6607 1 514 . 1 1 43 43 PHE C C 13 176.48 0.05 . 1 . . . . 657 PHE C . 6607 1 515 . 1 1 43 43 PHE CA C 13 61.96 0.3 . 1 . . . . 657 PHE CA . 6607 1 516 . 1 1 43 43 PHE CB C 13 39.36 0.3 . 1 . . . . 657 PHE CB . 6607 1 517 . 1 1 43 43 PHE CD1 C 13 130.80 0.3 . 1 . . . . 657 PHE CD1 . 6607 1 518 . 1 1 43 43 PHE CD2 C 13 130.80 0.3 . 1 . . . . 657 PHE CD2 . 6607 1 519 . 1 1 43 43 PHE CE1 C 13 132.46 0.3 . 1 . . . . 657 PHE CE1 . 6607 1 520 . 1 1 43 43 PHE CE2 C 13 132.46 0.3 . 1 . . . . 657 PHE CE2 . 6607 1 521 . 1 1 43 43 PHE N N 15 117.34 0.1 . 1 . . . . 657 PHE N . 6607 1 522 . 1 1 44 44 ARG H H 1 8.02 0.02 . 1 . . . . 658 ARG H . 6607 1 523 . 1 1 44 44 ARG HA H 1 3.83 0.02 . 1 . . . . 658 ARG HA . 6607 1 524 . 1 1 44 44 ARG HB2 H 1 2.01 0.02 . 1 . . . . 658 ARG HB2 . 6607 1 525 . 1 1 44 44 ARG HB3 H 1 2.01 0.02 . 1 . . . . 658 ARG HB3 . 6607 1 526 . 1 1 44 44 ARG C C 13 179.04 0.05 . 1 . . . . 658 ARG C . 6607 1 527 . 1 1 44 44 ARG CA C 13 59.45 0.3 . 1 . . . . 658 ARG CA . 6607 1 528 . 1 1 44 44 ARG CB C 13 29.93 0.3 . 1 . . . . 658 ARG CB . 6607 1 529 . 1 1 44 44 ARG N N 15 119.83 0.1 . 1 . . . . 658 ARG N . 6607 1 530 . 1 1 45 45 LEU H H 1 8.87 0.02 . 1 . . . . 659 LEU H . 6607 1 531 . 1 1 45 45 LEU HA H 1 3.94 0.02 . 1 . . . . 659 LEU HA . 6607 1 532 . 1 1 45 45 LEU HB2 H 1 1.25 0.02 . 2 . . . . 659 LEU HB2 . 6607 1 533 . 1 1 45 45 LEU HB3 H 1 1.91 0.02 . 2 . . . . 659 LEU HB3 . 6607 1 534 . 1 1 45 45 LEU HD11 H 1 0.83 0.02 . 2 . . . . 659 LEU HD1 . 6607 1 535 . 1 1 45 45 LEU HD12 H 1 0.83 0.02 . 2 . . . . 659 LEU HD1 . 6607 1 536 . 1 1 45 45 LEU HD13 H 1 0.83 0.02 . 2 . . . . 659 LEU HD1 . 6607 1 537 . 1 1 45 45 LEU HD21 H 1 0.76 0.02 . 2 . . . . 659 LEU HD2 . 6607 1 538 . 1 1 45 45 LEU HD22 H 1 0.76 0.02 . 2 . . . . 659 LEU HD2 . 6607 1 539 . 1 1 45 45 LEU HD23 H 1 0.76 0.02 . 2 . . . . 659 LEU HD2 . 6607 1 540 . 1 1 45 45 LEU C C 13 179.21 0.05 . 1 . . . . 659 LEU C . 6607 1 541 . 1 1 45 45 LEU CA C 13 57.98 0.3 . 1 . . . . 659 LEU CA . 6607 1 542 . 1 1 45 45 LEU CB C 13 43.02 0.3 . 1 . . . . 659 LEU CB . 6607 1 543 . 1 1 45 45 LEU CD1 C 13 26.85 0.3 . 2 . . . . 659 LEU CD1 . 6607 1 544 . 1 1 45 45 LEU N N 15 119.07 0.1 . 1 . . . . 659 LEU N . 6607 1 545 . 1 1 46 46 ILE H H 1 8.41 0.02 . 1 . . . . 660 ILE H . 6607 1 546 . 1 1 46 46 ILE HA H 1 3.39 0.02 . 1 . . . . 660 ILE HA . 6607 1 547 . 1 1 46 46 ILE HB H 1 1.65 0.02 . 1 . . . . 660 ILE HB . 6607 1 548 . 1 1 46 46 ILE HG12 H 1 0.64 0.02 . 2 . . . . 660 ILE HG12 . 6607 1 549 . 1 1 46 46 ILE HG13 H 1 1.20 0.02 . 2 . . . . 660 ILE HG13 . 6607 1 550 . 1 1 46 46 ILE HG21 H 1 0.67 0.02 . 1 . . . . 660 ILE HG2 . 6607 1 551 . 1 1 46 46 ILE HG22 H 1 0.67 0.02 . 1 . . . . 660 ILE HG2 . 6607 1 552 . 1 1 46 46 ILE HG23 H 1 0.67 0.02 . 1 . . . . 660 ILE HG2 . 6607 1 553 . 1 1 46 46 ILE HD11 H 1 0.20 0.02 . 1 . . . . 660 ILE HD1 . 6607 1 554 . 1 1 46 46 ILE HD12 H 1 0.20 0.02 . 1 . . . . 660 ILE HD1 . 6607 1 555 . 1 1 46 46 ILE HD13 H 1 0.20 0.02 . 1 . . . . 660 ILE HD1 . 6607 1 556 . 1 1 46 46 ILE C C 13 177.24 0.05 . 1 . . . . 660 ILE C . 6607 1 557 . 1 1 46 46 ILE CA C 13 65.18 0.3 . 1 . . . . 660 ILE CA . 6607 1 558 . 1 1 46 46 ILE CB C 13 37.42 0.3 . 1 . . . . 660 ILE CB . 6607 1 559 . 1 1 46 46 ILE CG1 C 13 29.70 0.3 . 1 . . . . 660 ILE CG1 . 6607 1 560 . 1 1 46 46 ILE CG2 C 13 16.68 0.3 . 1 . . . . 660 ILE CG2 . 6607 1 561 . 1 1 46 46 ILE CD1 C 13 14.22 0.3 . 1 . . . . 660 ILE CD1 . 6607 1 562 . 1 1 46 46 ILE N N 15 117.99 0.1 . 1 . . . . 660 ILE N . 6607 1 563 . 1 1 47 47 ASN H H 1 6.94 0.02 . 1 . . . . 661 ASN H . 6607 1 564 . 1 1 47 47 ASN HA H 1 4.22 0.02 . 1 . . . . 661 ASN HA . 6607 1 565 . 1 1 47 47 ASN HB2 H 1 2.38 0.02 . 2 . . . . 661 ASN HB2 . 6607 1 566 . 1 1 47 47 ASN HB3 H 1 2.44 0.02 . 2 . . . . 661 ASN HB3 . 6607 1 567 . 1 1 47 47 ASN C C 13 178.86 0.05 . 1 . . . . 661 ASN C . 6607 1 568 . 1 1 47 47 ASN CA C 13 57.27 0.3 . 1 . . . . 661 ASN CA . 6607 1 569 . 1 1 47 47 ASN CB C 13 39.10 0.3 . 1 . . . . 661 ASN CB . 6607 1 570 . 1 1 47 47 ASN N N 15 117.55 0.1 . 1 . . . . 661 ASN N . 6607 1 571 . 1 1 48 48 GLU H H 1 8.73 0.02 . 1 . . . . 662 GLU H . 6607 1 572 . 1 1 48 48 GLU HA H 1 4.01 0.02 . 1 . . . . 662 GLU HA . 6607 1 573 . 1 1 48 48 GLU HB2 H 1 2.02 0.02 . 2 . . . . 662 GLU HB2 . 6607 1 574 . 1 1 48 48 GLU HB3 H 1 2.12 0.02 . 2 . . . . 662 GLU HB3 . 6607 1 575 . 1 1 48 48 GLU HG2 H 1 2.25 0.02 . 2 . . . . 662 GLU HG2 . 6607 1 576 . 1 1 48 48 GLU HG3 H 1 2.44 0.02 . 2 . . . . 662 GLU HG3 . 6607 1 577 . 1 1 48 48 GLU C C 13 178.74 0.05 . 1 . . . . 662 GLU C . 6607 1 578 . 1 1 48 48 GLU CA C 13 59.81 0.3 . 1 . . . . 662 GLU CA . 6607 1 579 . 1 1 48 48 GLU CB C 13 29.62 0.3 . 1 . . . . 662 GLU CB . 6607 1 580 . 1 1 48 48 GLU CG C 13 36.80 0.3 . 1 . . . . 662 GLU CG . 6607 1 581 . 1 1 48 48 GLU N N 15 124.46 0.1 . 1 . . . . 662 GLU N . 6607 1 582 . 1 1 49 49 MET H H 1 7.59 0.02 . 1 . . . . 663 MET H . 6607 1 583 . 1 1 49 49 MET HA H 1 4.21 0.02 . 1 . . . . 663 MET HA . 6607 1 584 . 1 1 49 49 MET HG2 H 1 2.69 0.02 . 1 . . . . 663 MET HG2 . 6607 1 585 . 1 1 49 49 MET HG3 H 1 2.69 0.02 . 1 . . . . 663 MET HG3 . 6607 1 586 . 1 1 49 49 MET HE1 H 1 1.92 0.02 . 1 . . . . 663 MET HE . 6607 1 587 . 1 1 49 49 MET HE2 H 1 1.92 0.02 . 1 . . . . 663 MET HE . 6607 1 588 . 1 1 49 49 MET HE3 H 1 1.92 0.02 . 1 . . . . 663 MET HE . 6607 1 589 . 1 1 49 49 MET C C 13 174.75 0.05 . 1 . . . . 663 MET C . 6607 1 590 . 1 1 49 49 MET CA C 13 56.46 0.3 . 1 . . . . 663 MET CA . 6607 1 591 . 1 1 49 49 MET CB C 13 32.66 0.3 . 1 . . . . 663 MET CB . 6607 1 592 . 1 1 49 49 MET CG C 13 33.24 0.3 . 1 . . . . 663 MET CG . 6607 1 593 . 1 1 49 49 MET CE C 13 17.99 0.3 . 1 . . . . 663 MET CE . 6607 1 594 . 1 1 49 49 MET N N 15 115.74 0.1 . 1 . . . . 663 MET N . 6607 1 595 . 1 1 50 50 GLY H H 1 7.31 0.02 . 1 . . . . 664 GLY H . 6607 1 596 . 1 1 50 50 GLY HA2 H 1 3.60 0.02 . 2 . . . . 664 GLY HA2 . 6607 1 597 . 1 1 50 50 GLY HA3 H 1 4.34 0.02 . 2 . . . . 664 GLY HA3 . 6607 1 598 . 1 1 50 50 GLY C C 13 174.85 0.05 . 1 . . . . 664 GLY C . 6607 1 599 . 1 1 50 50 GLY CA C 13 44.73 0.3 . 1 . . . . 664 GLY CA . 6607 1 600 . 1 1 50 50 GLY N N 15 104.54 0.1 . 1 . . . . 664 GLY N . 6607 1 601 . 1 1 51 51 GLY H H 1 8.27 0.02 . 1 . . . . 665 GLY H . 6607 1 602 . 1 1 51 51 GLY HA2 H 1 3.45 0.02 . 2 . . . . 665 GLY HA2 . 6607 1 603 . 1 1 51 51 GLY HA3 H 1 4.45 0.02 . 2 . . . . 665 GLY HA3 . 6607 1 604 . 1 1 51 51 GLY C C 13 172.84 0.05 . 1 . . . . 665 GLY C . 6607 1 605 . 1 1 51 51 GLY CA C 13 43.62 0.3 . 1 . . . . 665 GLY CA . 6607 1 606 . 1 1 51 51 GLY N N 15 110.18 0.1 . 1 . . . . 665 GLY N . 6607 1 607 . 1 1 52 52 MET H H 1 8.64 0.02 . 1 . . . . 666 MET H . 6607 1 608 . 1 1 52 52 MET HA H 1 3.35 0.02 . 1 . . . . 666 MET HA . 6607 1 609 . 1 1 52 52 MET HB2 H 1 1.64 0.02 . 2 . . . . 666 MET HB2 . 6607 1 610 . 1 1 52 52 MET HB3 H 1 1.89 0.02 . 2 . . . . 666 MET HB3 . 6607 1 611 . 1 1 52 52 MET HG2 H 1 2.10 0.02 . 2 . . . . 666 MET HG2 . 6607 1 612 . 1 1 52 52 MET HG3 H 1 2.28 0.02 . 2 . . . . 666 MET HG3 . 6607 1 613 . 1 1 52 52 MET HE1 H 1 1.87 0.02 . 1 . . . . 666 MET HE . 6607 1 614 . 1 1 52 52 MET HE2 H 1 1.87 0.02 . 1 . . . . 666 MET HE . 6607 1 615 . 1 1 52 52 MET HE3 H 1 1.87 0.02 . 1 . . . . 666 MET HE . 6607 1 616 . 1 1 52 52 MET C C 13 177.63 0.05 . 1 . . . . 666 MET C . 6607 1 617 . 1 1 52 52 MET CA C 13 59.85 0.3 . 1 . . . . 666 MET CA . 6607 1 618 . 1 1 52 52 MET CG C 13 31.15 0.3 . 1 . . . . 666 MET CG . 6607 1 619 . 1 1 52 52 MET CE C 13 16.96 0.3 . 1 . . . . 666 MET CE . 6607 1 620 . 1 1 52 52 MET N N 15 118.98 0.1 . 1 . . . . 666 MET N . 6607 1 621 . 1 1 53 53 GLN H H 1 8.80 0.02 . 1 . . . . 667 GLN H . 6607 1 622 . 1 1 53 53 GLN HA H 1 3.86 0.02 . 1 . . . . 667 GLN HA . 6607 1 623 . 1 1 53 53 GLN HG2 H 1 2.38 0.02 . 2 . . . . 667 GLN HG2 . 6607 1 624 . 1 1 53 53 GLN HG3 H 1 2.44 0.02 . 2 . . . . 667 GLN HG3 . 6607 1 625 . 1 1 53 53 GLN CA C 13 59.22 0.3 . 1 . . . . 667 GLN CA . 6607 1 626 . 1 1 53 53 GLN CG C 13 33.81 0.3 . 1 . . . . 667 GLN CG . 6607 1 627 . 1 1 53 53 GLN N N 15 120.35 0.1 . 1 . . . . 667 GLN N . 6607 1 628 . 1 1 54 54 GLN HA H 1 4.08 0.02 . 1 . . . . 668 GLN HA . 6607 1 629 . 1 1 54 54 GLN HB2 H 1 1.91 0.02 . 1 . . . . 668 GLN HB2 . 6607 1 630 . 1 1 54 54 GLN HB3 H 1 1.91 0.02 . 1 . . . . 668 GLN HB3 . 6607 1 631 . 1 1 54 54 GLN HG2 H 1 2.30 0.02 . 2 . . . . 668 GLN HG2 . 6607 1 632 . 1 1 54 54 GLN HG3 H 1 2.42 0.02 . 2 . . . . 668 GLN HG3 . 6607 1 633 . 1 1 54 54 GLN HE21 H 1 6.90 0.02 . 2 . . . . 668 GLN HE21 . 6607 1 634 . 1 1 54 54 GLN HE22 H 1 7.56 0.02 . 2 . . . . 668 GLN HE22 . 6607 1 635 . 1 1 54 54 GLN CB C 13 28.88 0.3 . 1 . . . . 668 GLN CB . 6607 1 636 . 1 1 54 54 GLN CG C 13 34.70 0.3 . 1 . . . . 668 GLN CG . 6607 1 637 . 1 1 54 54 GLN NE2 N 15 112.46 0.1 . 1 . . . . 668 GLN NE2 . 6607 1 638 . 1 1 55 55 VAL H H 1 8.05 0.02 . 1 . . . . 669 VAL H . 6607 1 639 . 1 1 55 55 VAL HA H 1 3.05 0.02 . 1 . . . . 669 VAL HA . 6607 1 640 . 1 1 55 55 VAL HB H 1 1.52 0.02 . 1 . . . . 669 VAL HB . 6607 1 641 . 1 1 55 55 VAL HG11 H 1 -0.75 0.02 . 2 . . . . 669 VAL HG1 . 6607 1 642 . 1 1 55 55 VAL HG12 H 1 -0.75 0.02 . 2 . . . . 669 VAL HG1 . 6607 1 643 . 1 1 55 55 VAL HG13 H 1 -0.75 0.02 . 2 . . . . 669 VAL HG1 . 6607 1 644 . 1 1 55 55 VAL HG21 H 1 0.55 0.02 . 2 . . . . 669 VAL HG2 . 6607 1 645 . 1 1 55 55 VAL HG22 H 1 0.55 0.02 . 2 . . . . 669 VAL HG2 . 6607 1 646 . 1 1 55 55 VAL HG23 H 1 0.55 0.02 . 2 . . . . 669 VAL HG2 . 6607 1 647 . 1 1 55 55 VAL C C 13 177.75 0.05 . 1 . . . . 669 VAL C . 6607 1 648 . 1 1 55 55 VAL CA C 13 66.82 0.3 . 1 . . . . 669 VAL CA . 6607 1 649 . 1 1 55 55 VAL CB C 13 31.51 0.3 . 1 . . . . 669 VAL CB . 6607 1 650 . 1 1 55 55 VAL CG1 C 13 18.58 0.3 . 2 . . . . 669 VAL CG1 . 6607 1 651 . 1 1 55 55 VAL CG2 C 13 24.52 0.3 . 2 . . . . 669 VAL CG2 . 6607 1 652 . 1 1 55 55 VAL N N 15 119.86 0.1 . 1 . . . . 669 VAL N . 6607 1 653 . 1 1 56 56 THR H H 1 8.06 0.02 . 1 . . . . 670 THR H . 6607 1 654 . 1 1 56 56 THR HA H 1 4.22 0.02 . 1 . . . . 670 THR HA . 6607 1 655 . 1 1 56 56 THR HB H 1 4.47 0.02 . 1 . . . . 670 THR HB . 6607 1 656 . 1 1 56 56 THR HG21 H 1 1.40 0.02 . 1 . . . . 670 THR HG2 . 6607 1 657 . 1 1 56 56 THR HG22 H 1 1.40 0.02 . 1 . . . . 670 THR HG2 . 6607 1 658 . 1 1 56 56 THR HG23 H 1 1.40 0.02 . 1 . . . . 670 THR HG2 . 6607 1 659 . 1 1 56 56 THR C C 13 177.95 0.05 . 1 . . . . 670 THR C . 6607 1 660 . 1 1 56 56 THR CA C 13 66.97 0.3 . 1 . . . . 670 THR CA . 6607 1 661 . 1 1 56 56 THR CB C 13 69.44 0.3 . 1 . . . . 670 THR CB . 6607 1 662 . 1 1 56 56 THR CG2 C 13 21.37 0.3 . 1 . . . . 670 THR CG2 . 6607 1 663 . 1 1 56 56 THR N N 15 115.44 0.1 . 1 . . . . 670 THR N . 6607 1 664 . 1 1 57 57 ASP H H 1 9.32 0.02 . 1 . . . . 671 ASP H . 6607 1 665 . 1 1 57 57 ASP HA H 1 4.38 0.02 . 1 . . . . 671 ASP HA . 6607 1 666 . 1 1 57 57 ASP HB2 H 1 2.73 0.02 . 1 . . . . 671 ASP HB2 . 6607 1 667 . 1 1 57 57 ASP HB3 H 1 2.73 0.02 . 1 . . . . 671 ASP HB3 . 6607 1 668 . 1 1 57 57 ASP C C 13 178.19 0.05 . 1 . . . . 671 ASP C . 6607 1 669 . 1 1 57 57 ASP CA C 13 57.92 0.3 . 1 . . . . 671 ASP CA . 6607 1 670 . 1 1 57 57 ASP CB C 13 39.97 0.3 . 1 . . . . 671 ASP CB . 6607 1 671 . 1 1 57 57 ASP N N 15 125.60 0.1 . 1 . . . . 671 ASP N . 6607 1 672 . 1 1 58 58 LEU H H 1 8.36 0.02 . 1 . . . . 672 LEU H . 6607 1 673 . 1 1 58 58 LEU C C 13 175.85 0.05 . 1 . . . . 672 LEU C . 6607 1 674 . 1 1 58 58 LEU N N 15 116.46 0.1 . 1 . . . . 672 LEU N . 6607 1 675 . 1 1 59 59 LYS H H 1 7.75 0.02 . 1 . . . . 673 LYS H . 6607 1 676 . 1 1 59 59 LYS HA H 1 4.24 0.02 . 1 . . . . 673 LYS HA . 6607 1 677 . 1 1 59 59 LYS C C 13 177.66 0.05 . 1 . . . . 673 LYS C . 6607 1 678 . 1 1 59 59 LYS CA C 13 57.37 0.3 . 1 . . . . 673 LYS CA . 6607 1 679 . 1 1 59 59 LYS N N 15 117.42 0.1 . 1 . . . . 673 LYS N . 6607 1 680 . 1 1 60 60 LYS H H 1 8.97 0.02 . 1 . . . . 674 LYS H . 6607 1 681 . 1 1 60 60 LYS HA H 1 4.74 0.02 . 1 . . . . 674 LYS HA . 6607 1 682 . 1 1 60 60 LYS C C 13 176.46 0.05 . 1 . . . . 674 LYS C . 6607 1 683 . 1 1 60 60 LYS CA C 13 55.38 0.3 . 1 . . . . 674 LYS CA . 6607 1 684 . 1 1 60 60 LYS CB C 13 33.54 0.3 . 1 . . . . 674 LYS CB . 6607 1 685 . 1 1 60 60 LYS N N 15 116.71 0.1 . 1 . . . . 674 LYS N . 6607 1 686 . 1 1 61 61 TRP H H 1 7.76 0.02 . 1 . . . . 675 TRP H . 6607 1 687 . 1 1 61 61 TRP HA H 1 3.91 0.02 . 1 . . . . 675 TRP HA . 6607 1 688 . 1 1 61 61 TRP HB2 H 1 3.21 0.02 . 2 . . . . 675 TRP HB2 . 6607 1 689 . 1 1 61 61 TRP HB3 H 1 3.35 0.02 . 2 . . . . 675 TRP HB3 . 6607 1 690 . 1 1 61 61 TRP HD1 H 1 7.54 0.02 . 1 . . . . 675 TRP HD1 . 6607 1 691 . 1 1 61 61 TRP HE1 H 1 10.22 0.02 . 1 . . . . 675 TRP HE1 . 6607 1 692 . 1 1 61 61 TRP HZ2 H 1 7.24 0.02 . 1 . . . . 675 TRP HZ2 . 6607 1 693 . 1 1 61 61 TRP C C 13 177.56 0.05 . 1 . . . . 675 TRP C . 6607 1 694 . 1 1 61 61 TRP CA C 13 61.73 0.3 . 1 . . . . 675 TRP CA . 6607 1 695 . 1 1 61 61 TRP CB C 13 29.14 0.3 . 1 . . . . 675 TRP CB . 6607 1 696 . 1 1 61 61 TRP CD1 C 13 126.66 0.3 . 1 . . . . 675 TRP CD1 . 6607 1 697 . 1 1 61 61 TRP CZ2 C 13 114.77 0.3 . 1 . . . . 675 TRP CZ2 . 6607 1 698 . 1 1 61 61 TRP N N 15 119.53 0.1 . 1 . . . . 675 TRP N . 6607 1 699 . 1 1 61 61 TRP NE1 N 15 130.09 0.1 . 1 . . . . 675 TRP NE1 . 6607 1 700 . 1 1 62 62 ASN H H 1 8.68 0.02 . 1 . . . . 676 ASN H . 6607 1 701 . 1 1 62 62 ASN HA H 1 4.31 0.02 . 1 . . . . 676 ASN HA . 6607 1 702 . 1 1 62 62 ASN HB2 H 1 2.81 0.02 . 2 . . . . 676 ASN HB2 . 6607 1 703 . 1 1 62 62 ASN HB3 H 1 2.89 0.02 . 2 . . . . 676 ASN HB3 . 6607 1 704 . 1 1 62 62 ASN HD21 H 1 7.15 0.02 . 2 . . . . 676 ASN HD21 . 6607 1 705 . 1 1 62 62 ASN HD22 H 1 7.76 0.02 . 2 . . . . 676 ASN HD22 . 6607 1 706 . 1 1 62 62 ASN C C 13 176.20 0.05 . 1 . . . . 676 ASN C . 6607 1 707 . 1 1 62 62 ASN CA C 13 57.28 0.3 . 1 . . . . 676 ASN CA . 6607 1 708 . 1 1 62 62 ASN CB C 13 37.96 0.3 . 1 . . . . 676 ASN CB . 6607 1 709 . 1 1 62 62 ASN N N 15 117.26 0.1 . 1 . . . . 676 ASN N . 6607 1 710 . 1 1 62 62 ASN ND2 N 15 115.30 0.1 . 1 . . . . 676 ASN ND2 . 6607 1 711 . 1 1 63 63 LYS H H 1 7.61 0.02 . 1 . . . . 677 LYS H . 6607 1 712 . 1 1 63 63 LYS HA H 1 4.10 0.02 . 1 . . . . 677 LYS HA . 6607 1 713 . 1 1 63 63 LYS HB2 H 1 1.92 0.02 . 1 . . . . 677 LYS HB2 . 6607 1 714 . 1 1 63 63 LYS HB3 H 1 1.92 0.02 . 1 . . . . 677 LYS HB3 . 6607 1 715 . 1 1 63 63 LYS HE2 H 1 3.00 0.02 . 1 . . . . 677 LYS HE2 . 6607 1 716 . 1 1 63 63 LYS HE3 H 1 3.00 0.02 . 1 . . . . 677 LYS HE3 . 6607 1 717 . 1 1 63 63 LYS C C 13 178.77 0.05 . 1 . . . . 677 LYS C . 6607 1 718 . 1 1 63 63 LYS CA C 13 58.74 0.3 . 1 . . . . 677 LYS CA . 6607 1 719 . 1 1 63 63 LYS CB C 13 31.98 0.3 . 1 . . . . 677 LYS CB . 6607 1 720 . 1 1 63 63 LYS CG C 13 29.52 0.3 . 1 . . . . 677 LYS CG . 6607 1 721 . 1 1 63 63 LYS CD C 13 25.03 0.3 . 1 . . . . 677 LYS CD . 6607 1 722 . 1 1 63 63 LYS N N 15 120.53 0.1 . 1 . . . . 677 LYS N . 6607 1 723 . 1 1 64 64 LEU H H 1 7.87 0.02 . 1 . . . . 678 LEU H . 6607 1 724 . 1 1 64 64 LEU HA H 1 3.89 0.02 . 1 . . . . 678 LEU HA . 6607 1 725 . 1 1 64 64 LEU HB2 H 1 1.46 0.02 . 2 . . . . 678 LEU HB2 . 6607 1 726 . 1 1 64 64 LEU HB3 H 1 1.75 0.02 . 2 . . . . 678 LEU HB3 . 6607 1 727 . 1 1 64 64 LEU HG H 1 1.52 0.02 . 1 . . . . 678 LEU HG . 6607 1 728 . 1 1 64 64 LEU HD11 H 1 0.64 0.02 . 2 . . . . 678 LEU HD1 . 6607 1 729 . 1 1 64 64 LEU HD12 H 1 0.64 0.02 . 2 . . . . 678 LEU HD1 . 6607 1 730 . 1 1 64 64 LEU HD13 H 1 0.64 0.02 . 2 . . . . 678 LEU HD1 . 6607 1 731 . 1 1 64 64 LEU HD21 H 1 0.78 0.02 . 2 . . . . 678 LEU HD2 . 6607 1 732 . 1 1 64 64 LEU HD22 H 1 0.78 0.02 . 2 . . . . 678 LEU HD2 . 6607 1 733 . 1 1 64 64 LEU HD23 H 1 0.78 0.02 . 2 . . . . 678 LEU HD2 . 6607 1 734 . 1 1 64 64 LEU C C 13 177.76 0.05 . 1 . . . . 678 LEU C . 6607 1 735 . 1 1 64 64 LEU CA C 13 58.55 0.3 . 1 . . . . 678 LEU CA . 6607 1 736 . 1 1 64 64 LEU CB C 13 42.01 0.3 . 1 . . . . 678 LEU CB . 6607 1 737 . 1 1 64 64 LEU CG C 13 27.58 0.3 . 1 . . . . 678 LEU CG . 6607 1 738 . 1 1 64 64 LEU CD1 C 13 25.95 0.3 . 2 . . . . 678 LEU CD1 . 6607 1 739 . 1 1 64 64 LEU CD2 C 13 26.37 0.3 . 2 . . . . 678 LEU CD2 . 6607 1 740 . 1 1 64 64 LEU N N 15 120.08 0.1 . 1 . . . . 678 LEU N . 6607 1 741 . 1 1 65 65 ALA H H 1 8.45 0.02 . 1 . . . . 679 ALA H . 6607 1 742 . 1 1 65 65 ALA HA H 1 3.72 0.02 . 1 . . . . 679 ALA HA . 6607 1 743 . 1 1 65 65 ALA HB1 H 1 1.27 0.02 . 1 . . . . 679 ALA HB . 6607 1 744 . 1 1 65 65 ALA HB2 H 1 1.27 0.02 . 1 . . . . 679 ALA HB . 6607 1 745 . 1 1 65 65 ALA HB3 H 1 1.27 0.02 . 1 . . . . 679 ALA HB . 6607 1 746 . 1 1 65 65 ALA C C 13 178.99 0.05 . 1 . . . . 679 ALA C . 6607 1 747 . 1 1 65 65 ALA CA C 13 55.70 0.3 . 1 . . . . 679 ALA CA . 6607 1 748 . 1 1 65 65 ALA CB C 13 17.53 0.3 . 1 . . . . 679 ALA CB . 6607 1 749 . 1 1 65 65 ALA N N 15 120.05 0.1 . 1 . . . . 679 ALA N . 6607 1 750 . 1 1 66 66 ASP H H 1 8.19 0.02 . 1 . . . . 680 ASP H . 6607 1 751 . 1 1 66 66 ASP HA H 1 4.37 0.02 . 1 . . . . 680 ASP HA . 6607 1 752 . 1 1 66 66 ASP HB2 H 1 2.66 0.02 . 2 . . . . 680 ASP HB2 . 6607 1 753 . 1 1 66 66 ASP HB3 H 1 2.94 0.02 . 2 . . . . 680 ASP HB3 . 6607 1 754 . 1 1 66 66 ASP C C 13 181.36 0.05 . 1 . . . . 680 ASP C . 6607 1 755 . 1 1 66 66 ASP CA C 13 57.62 0.3 . 1 . . . . 680 ASP CA . 6607 1 756 . 1 1 66 66 ASP CB C 13 39.57 0.3 . 1 . . . . 680 ASP CB . 6607 1 757 . 1 1 66 66 ASP N N 15 117.46 0.1 . 1 . . . . 680 ASP N . 6607 1 758 . 1 1 67 67 MET H H 1 8.48 0.02 . 1 . . . . 681 MET H . 6607 1 759 . 1 1 67 67 MET HA H 1 4.14 0.02 . 1 . . . . 681 MET HA . 6607 1 760 . 1 1 67 67 MET HB2 H 1 2.07 0.02 . 1 . . . . 681 MET HB2 . 6607 1 761 . 1 1 67 67 MET HB3 H 1 2.07 0.02 . 1 . . . . 681 MET HB3 . 6607 1 762 . 1 1 67 67 MET HG2 H 1 2.53 0.02 . 2 . . . . 681 MET HG2 . 6607 1 763 . 1 1 67 67 MET HG3 H 1 2.87 0.02 . 2 . . . . 681 MET HG3 . 6607 1 764 . 1 1 67 67 MET HE1 H 1 2.06 0.02 . 1 . . . . 681 MET HE . 6607 1 765 . 1 1 67 67 MET HE2 H 1 2.06 0.02 . 1 . . . . 681 MET HE . 6607 1 766 . 1 1 67 67 MET HE3 H 1 2.06 0.02 . 1 . . . . 681 MET HE . 6607 1 767 . 1 1 67 67 MET C C 13 178.48 0.05 . 1 . . . . 681 MET C . 6607 1 768 . 1 1 67 67 MET CA C 13 58.91 0.3 . 1 . . . . 681 MET CA . 6607 1 769 . 1 1 67 67 MET CB C 13 33.42 0.3 . 1 . . . . 681 MET CB . 6607 1 770 . 1 1 67 67 MET CG C 13 32.69 0.3 . 1 . . . . 681 MET CG . 6607 1 771 . 1 1 67 67 MET CE C 13 17.26 0.3 . 1 . . . . 681 MET CE . 6607 1 772 . 1 1 67 67 MET N N 15 123.12 0.1 . 1 . . . . 681 MET N . 6607 1 773 . 1 1 68 68 LEU H H 1 7.73 0.02 . 1 . . . . 682 LEU H . 6607 1 774 . 1 1 68 68 LEU HA H 1 4.17 0.02 . 1 . . . . 682 LEU HA . 6607 1 775 . 1 1 68 68 LEU HB2 H 1 1.58 0.02 . 1 . . . . 682 LEU HB2 . 6607 1 776 . 1 1 68 68 LEU HB3 H 1 1.58 0.02 . 1 . . . . 682 LEU HB3 . 6607 1 777 . 1 1 68 68 LEU HG H 1 1.65 0.02 . 1 . . . . 682 LEU HG . 6607 1 778 . 1 1 68 68 LEU HD11 H 1 0.44 0.02 . 2 . . . . 682 LEU HD1 . 6607 1 779 . 1 1 68 68 LEU HD12 H 1 0.44 0.02 . 2 . . . . 682 LEU HD1 . 6607 1 780 . 1 1 68 68 LEU HD13 H 1 0.44 0.02 . 2 . . . . 682 LEU HD1 . 6607 1 781 . 1 1 68 68 LEU HD21 H 1 0.82 0.02 . 2 . . . . 682 LEU HD2 . 6607 1 782 . 1 1 68 68 LEU HD22 H 1 0.82 0.02 . 2 . . . . 682 LEU HD2 . 6607 1 783 . 1 1 68 68 LEU HD23 H 1 0.82 0.02 . 2 . . . . 682 LEU HD2 . 6607 1 784 . 1 1 68 68 LEU C C 13 174.91 0.05 . 1 . . . . 682 LEU C . 6607 1 785 . 1 1 68 68 LEU CA C 13 55.20 0.3 . 1 . . . . 682 LEU CA . 6607 1 786 . 1 1 68 68 LEU CB C 13 42.18 0.3 . 1 . . . . 682 LEU CB . 6607 1 787 . 1 1 68 68 LEU CG C 13 26.60 0.3 . 1 . . . . 682 LEU CG . 6607 1 788 . 1 1 68 68 LEU CD1 C 13 27.10 0.3 . 2 . . . . 682 LEU CD1 . 6607 1 789 . 1 1 68 68 LEU CD2 C 13 23.21 0.3 . 2 . . . . 682 LEU CD2 . 6607 1 790 . 1 1 68 68 LEU N N 15 119.16 0.1 . 1 . . . . 682 LEU N . 6607 1 791 . 1 1 69 69 ARG H H 1 7.81 0.02 . 1 . . . . 683 ARG H . 6607 1 792 . 1 1 69 69 ARG HA H 1 3.79 0.02 . 1 . . . . 683 ARG HA . 6607 1 793 . 1 1 69 69 ARG HB2 H 1 1.95 0.02 . 2 . . . . 683 ARG HB2 . 6607 1 794 . 1 1 69 69 ARG HB3 H 1 2.19 0.02 . 2 . . . . 683 ARG HB3 . 6607 1 795 . 1 1 69 69 ARG HG2 H 1 1.54 0.02 . 1 . . . . 683 ARG HG2 . 6607 1 796 . 1 1 69 69 ARG HG3 H 1 1.54 0.02 . 1 . . . . 683 ARG HG3 . 6607 1 797 . 1 1 69 69 ARG HD2 H 1 3.24 0.02 . 1 . . . . 683 ARG HD2 . 6607 1 798 . 1 1 69 69 ARG HD3 H 1 3.24 0.02 . 1 . . . . 683 ARG HD3 . 6607 1 799 . 1 1 69 69 ARG C C 13 175.68 0.05 . 1 . . . . 683 ARG C . 6607 1 800 . 1 1 69 69 ARG CA C 13 56.82 0.3 . 1 . . . . 683 ARG CA . 6607 1 801 . 1 1 69 69 ARG CB C 13 26.07 0.3 . 1 . . . . 683 ARG CB . 6607 1 802 . 1 1 69 69 ARG CG C 13 27.63 0.3 . 1 . . . . 683 ARG CG . 6607 1 803 . 1 1 69 69 ARG CD C 13 43.38 0.3 . 1 . . . . 683 ARG CD . 6607 1 804 . 1 1 69 69 ARG N N 15 112.76 0.1 . 1 . . . . 683 ARG N . 6607 1 805 . 1 1 70 70 ILE H H 1 7.81 0.02 . 1 . . . . 684 ILE H . 6607 1 806 . 1 1 70 70 ILE HA H 1 4.32 0.02 . 1 . . . . 684 ILE HA . 6607 1 807 . 1 1 70 70 ILE HB H 1 1.67 0.02 . 1 . . . . 684 ILE HB . 6607 1 808 . 1 1 70 70 ILE HG12 H 1 1.37 0.02 . 1 . . . . 684 ILE HG12 . 6607 1 809 . 1 1 70 70 ILE HG13 H 1 1.37 0.02 . 1 . . . . 684 ILE HG13 . 6607 1 810 . 1 1 70 70 ILE HG21 H 1 0.87 0.02 . 1 . . . . 684 ILE HG2 . 6607 1 811 . 1 1 70 70 ILE HG22 H 1 0.87 0.02 . 1 . . . . 684 ILE HG2 . 6607 1 812 . 1 1 70 70 ILE HG23 H 1 0.87 0.02 . 1 . . . . 684 ILE HG2 . 6607 1 813 . 1 1 70 70 ILE HD11 H 1 0.70 0.02 . 1 . . . . 684 ILE HD1 . 6607 1 814 . 1 1 70 70 ILE HD12 H 1 0.70 0.02 . 1 . . . . 684 ILE HD1 . 6607 1 815 . 1 1 70 70 ILE HD13 H 1 0.70 0.02 . 1 . . . . 684 ILE HD1 . 6607 1 816 . 1 1 70 70 ILE C C 13 175.70 0.05 . 1 . . . . 684 ILE C . 6607 1 817 . 1 1 70 70 ILE CA C 13 58.15 0.3 . 1 . . . . 684 ILE CA . 6607 1 818 . 1 1 70 70 ILE CB C 13 37.51 0.3 . 1 . . . . 684 ILE CB . 6607 1 819 . 1 1 70 70 ILE CG1 C 13 27.37 0.3 . 1 . . . . 684 ILE CG1 . 6607 1 820 . 1 1 70 70 ILE CG2 C 13 17.88 0.3 . 1 . . . . 684 ILE CG2 . 6607 1 821 . 1 1 70 70 ILE CD1 C 13 11.80 0.3 . 1 . . . . 684 ILE CD1 . 6607 1 822 . 1 1 70 70 ILE N N 15 120.24 0.1 . 1 . . . . 684 ILE N . 6607 1 823 . 1 1 71 71 PRO HA H 1 4.36 0.02 . 1 . . . . 685 PRO HA . 6607 1 824 . 1 1 71 71 PRO HB2 H 1 1.90 0.02 . 2 . . . . 685 PRO HB2 . 6607 1 825 . 1 1 71 71 PRO HB3 H 1 2.40 0.02 . 2 . . . . 685 PRO HB3 . 6607 1 826 . 1 1 71 71 PRO HG2 H 1 2.10 0.02 . 2 . . . . 685 PRO HG2 . 6607 1 827 . 1 1 71 71 PRO HG3 H 1 2.25 0.02 . 2 . . . . 685 PRO HG3 . 6607 1 828 . 1 1 71 71 PRO HD2 H 1 3.60 0.02 . 2 . . . . 685 PRO HD2 . 6607 1 829 . 1 1 71 71 PRO HD3 H 1 4.25 0.02 . 2 . . . . 685 PRO HD3 . 6607 1 830 . 1 1 71 71 PRO C C 13 177.88 0.05 . 1 . . . . 685 PRO C . 6607 1 831 . 1 1 71 71 PRO CA C 13 64.05 0.3 . 1 . . . . 685 PRO CA . 6607 1 832 . 1 1 71 71 PRO CB C 13 32.84 0.3 . 1 . . . . 685 PRO CB . 6607 1 833 . 1 1 71 71 PRO CG C 13 27.98 0.3 . 1 . . . . 685 PRO CG . 6607 1 834 . 1 1 71 71 PRO CD C 13 51.66 0.3 . 1 . . . . 685 PRO CD . 6607 1 835 . 1 1 72 72 LYS H H 1 8.97 0.02 . 1 . . . . 686 LYS H . 6607 1 836 . 1 1 72 72 LYS HA H 1 3.78 0.02 . 1 . . . . 686 LYS HA . 6607 1 837 . 1 1 72 72 LYS HB2 H 1 1.79 0.02 . 2 . . . . 686 LYS HB2 . 6607 1 838 . 1 1 72 72 LYS HB3 H 1 1.91 0.02 . 2 . . . . 686 LYS HB3 . 6607 1 839 . 1 1 72 72 LYS HG2 H 1 1.69 0.02 . 1 . . . . 686 LYS HG2 . 6607 1 840 . 1 1 72 72 LYS HG3 H 1 1.69 0.02 . 1 . . . . 686 LYS HG3 . 6607 1 841 . 1 1 72 72 LYS HD2 H 1 1.47 0.02 . 2 . . . . 686 LYS HD2 . 6607 1 842 . 1 1 72 72 LYS HD3 H 1 1.56 0.02 . 2 . . . . 686 LYS HD3 . 6607 1 843 . 1 1 72 72 LYS HE2 H 1 3.01 0.02 . 1 . . . . 686 LYS HE2 . 6607 1 844 . 1 1 72 72 LYS HE3 H 1 3.01 0.02 . 1 . . . . 686 LYS HE3 . 6607 1 845 . 1 1 72 72 LYS C C 13 177.09 0.05 . 1 . . . . 686 LYS C . 6607 1 846 . 1 1 72 72 LYS CA C 13 58.92 0.3 . 1 . . . . 686 LYS CA . 6607 1 847 . 1 1 72 72 LYS CB C 13 32.58 0.3 . 1 . . . . 686 LYS CB . 6607 1 848 . 1 1 72 72 LYS CG C 13 29.53 0.3 . 1 . . . . 686 LYS CG . 6607 1 849 . 1 1 72 72 LYS CD C 13 25.61 0.3 . 1 . . . . 686 LYS CD . 6607 1 850 . 1 1 72 72 LYS CE C 13 42.10 0.3 . 1 . . . . 686 LYS CE . 6607 1 851 . 1 1 72 72 LYS N N 15 123.29 0.1 . 1 . . . . 686 LYS N . 6607 1 852 . 1 1 73 73 THR H H 1 7.29 0.02 . 1 . . . . 687 THR H . 6607 1 853 . 1 1 73 73 THR HA H 1 4.12 0.02 . 1 . . . . 687 THR HA . 6607 1 854 . 1 1 73 73 THR HB H 1 4.47 0.02 . 1 . . . . 687 THR HB . 6607 1 855 . 1 1 73 73 THR HG21 H 1 1.21 0.02 . 1 . . . . 687 THR HG2 . 6607 1 856 . 1 1 73 73 THR HG22 H 1 1.21 0.02 . 1 . . . . 687 THR HG2 . 6607 1 857 . 1 1 73 73 THR HG23 H 1 1.21 0.02 . 1 . . . . 687 THR HG2 . 6607 1 858 . 1 1 73 73 THR C C 13 174.66 0.05 . 1 . . . . 687 THR C . 6607 1 859 . 1 1 73 73 THR CA C 13 61.39 0.3 . 1 . . . . 687 THR CA . 6607 1 860 . 1 1 73 73 THR CB C 13 69.06 0.3 . 1 . . . . 687 THR CB . 6607 1 861 . 1 1 73 73 THR CG2 C 13 21.90 0.3 . 1 . . . . 687 THR CG2 . 6607 1 862 . 1 1 73 73 THR N N 15 104.84 0.1 . 1 . . . . 687 THR N . 6607 1 863 . 1 1 74 74 ALA H H 1 7.26 0.02 . 1 . . . . 688 ALA H . 6607 1 864 . 1 1 74 74 ALA HA H 1 4.35 0.02 . 1 . . . . 688 ALA HA . 6607 1 865 . 1 1 74 74 ALA HB1 H 1 1.27 0.02 . 1 . . . . 688 ALA HB . 6607 1 866 . 1 1 74 74 ALA HB2 H 1 1.27 0.02 . 1 . . . . 688 ALA HB . 6607 1 867 . 1 1 74 74 ALA HB3 H 1 1.27 0.02 . 1 . . . . 688 ALA HB . 6607 1 868 . 1 1 74 74 ALA C C 13 177.19 0.05 . 1 . . . . 688 ALA C . 6607 1 869 . 1 1 74 74 ALA CA C 13 52.06 0.3 . 1 . . . . 688 ALA CA . 6607 1 870 . 1 1 74 74 ALA CB C 13 17.89 0.3 . 1 . . . . 688 ALA CB . 6607 1 871 . 1 1 74 74 ALA N N 15 124.61 0.1 . 1 . . . . 688 ALA N . 6607 1 872 . 1 1 75 75 GLN H H 1 8.72 0.02 . 1 . . . . 689 GLN H . 6607 1 873 . 1 1 75 75 GLN HA H 1 4.01 0.02 . 1 . . . . 689 GLN HA . 6607 1 874 . 1 1 75 75 GLN HB2 H 1 2.02 0.02 . 1 . . . . 689 GLN HB2 . 6607 1 875 . 1 1 75 75 GLN HB3 H 1 2.02 0.02 . 1 . . . . 689 GLN HB3 . 6607 1 876 . 1 1 75 75 GLN HG2 H 1 2.41 0.02 . 1 . . . . 689 GLN HG2 . 6607 1 877 . 1 1 75 75 GLN HG3 H 1 2.41 0.02 . 1 . . . . 689 GLN HG3 . 6607 1 878 . 1 1 75 75 GLN HE21 H 1 6.93 0.02 . 2 . . . . 689 GLN HE21 . 6607 1 879 . 1 1 75 75 GLN HE22 H 1 7.61 0.02 . 2 . . . . 689 GLN HE22 . 6607 1 880 . 1 1 75 75 GLN C C 13 176.53 0.05 . 1 . . . . 689 GLN C . 6607 1 881 . 1 1 75 75 GLN CA C 13 57.62 0.3 . 1 . . . . 689 GLN CA . 6607 1 882 . 1 1 75 75 GLN CB C 13 28.64 0.3 . 1 . . . . 689 GLN CB . 6607 1 883 . 1 1 75 75 GLN CG C 13 33.80 0.3 . 1 . . . . 689 GLN CG . 6607 1 884 . 1 1 75 75 GLN N N 15 126.10 0.1 . 1 . . . . 689 GLN N . 6607 1 885 . 1 1 75 75 GLN NE2 N 15 112.99 0.1 . 1 . . . . 689 GLN NE2 . 6607 1 886 . 1 1 76 76 ASP H H 1 8.98 0.02 . 1 . . . . 690 ASP H . 6607 1 887 . 1 1 76 76 ASP HA H 1 4.53 0.02 . 1 . . . . 690 ASP HA . 6607 1 888 . 1 1 76 76 ASP HB2 H 1 2.75 0.02 . 2 . . . . 690 ASP HB2 . 6607 1 889 . 1 1 76 76 ASP HB3 H 1 2.83 0.02 . 2 . . . . 690 ASP HB3 . 6607 1 890 . 1 1 76 76 ASP C C 13 176.43 0.05 . 1 . . . . 690 ASP C . 6607 1 891 . 1 1 76 76 ASP CA C 13 54.22 0.3 . 1 . . . . 690 ASP CA . 6607 1 892 . 1 1 76 76 ASP CB C 13 40.06 0.3 . 1 . . . . 690 ASP CB . 6607 1 893 . 1 1 76 76 ASP N N 15 120.78 0.1 . 1 . . . . 690 ASP N . 6607 1 894 . 1 1 77 77 ARG H H 1 7.29 0.02 . 1 . . . . 691 ARG H . 6607 1 895 . 1 1 77 77 ARG HA H 1 3.57 0.02 . 1 . . . . 691 ARG HA . 6607 1 896 . 1 1 77 77 ARG HB2 H 1 1.90 0.02 . 1 . . . . 691 ARG HB2 . 6607 1 897 . 1 1 77 77 ARG HB3 H 1 1.90 0.02 . 1 . . . . 691 ARG HB3 . 6607 1 898 . 1 1 77 77 ARG HG2 H 1 1.73 0.02 . 1 . . . . 691 ARG HG2 . 6607 1 899 . 1 1 77 77 ARG HG3 H 1 1.73 0.02 . 1 . . . . 691 ARG HG3 . 6607 1 900 . 1 1 77 77 ARG HD2 H 1 3.40 0.02 . 1 . . . . 691 ARG HD2 . 6607 1 901 . 1 1 77 77 ARG HD3 H 1 3.40 0.02 . 1 . . . . 691 ARG HD3 . 6607 1 902 . 1 1 77 77 ARG C C 13 176.36 0.05 . 1 . . . . 691 ARG C . 6607 1 903 . 1 1 77 77 ARG CA C 13 60.04 0.3 . 1 . . . . 691 ARG CA . 6607 1 904 . 1 1 77 77 ARG CB C 13 31.34 0.3 . 1 . . . . 691 ARG CB . 6607 1 905 . 1 1 77 77 ARG CG C 13 27.16 0.3 . 1 . . . . 691 ARG CG . 6607 1 906 . 1 1 77 77 ARG CD C 13 44.54 0.3 . 1 . . . . 691 ARG CD . 6607 1 907 . 1 1 77 77 ARG N N 15 115.43 0.1 . 1 . . . . 691 ARG N . 6607 1 908 . 1 1 78 78 LEU H H 1 8.07 0.02 . 1 . . . . 692 LEU H . 6607 1 909 . 1 1 78 78 LEU HA H 1 3.94 0.02 . 1 . . . . 692 LEU HA . 6607 1 910 . 1 1 78 78 LEU HB2 H 1 1.15 0.02 . 2 . . . . 692 LEU HB2 . 6607 1 911 . 1 1 78 78 LEU HB3 H 1 1.80 0.02 . 2 . . . . 692 LEU HB3 . 6607 1 912 . 1 1 78 78 LEU HD11 H 1 0.71 0.02 . 2 . . . . 692 LEU HD1 . 6607 1 913 . 1 1 78 78 LEU HD12 H 1 0.71 0.02 . 2 . . . . 692 LEU HD1 . 6607 1 914 . 1 1 78 78 LEU HD13 H 1 0.71 0.02 . 2 . . . . 692 LEU HD1 . 6607 1 915 . 1 1 78 78 LEU HD21 H 1 0.83 0.02 . 2 . . . . 692 LEU HD2 . 6607 1 916 . 1 1 78 78 LEU HD22 H 1 0.83 0.02 . 2 . . . . 692 LEU HD2 . 6607 1 917 . 1 1 78 78 LEU HD23 H 1 0.83 0.02 . 2 . . . . 692 LEU HD2 . 6607 1 918 . 1 1 78 78 LEU C C 13 178.96 0.05 . 1 . . . . 692 LEU C . 6607 1 919 . 1 1 78 78 LEU CA C 13 57.95 0.3 . 1 . . . . 692 LEU CA . 6607 1 920 . 1 1 78 78 LEU CB C 13 39.54 0.3 . 1 . . . . 692 LEU CB . 6607 1 921 . 1 1 78 78 LEU CD1 C 13 22.52 0.3 . 2 . . . . 692 LEU CD1 . 6607 1 922 . 1 1 78 78 LEU CD2 C 13 25.56 0.3 . 2 . . . . 692 LEU CD2 . 6607 1 923 . 1 1 78 78 LEU N N 15 116.29 0.1 . 1 . . . . 692 LEU N . 6607 1 924 . 1 1 79 79 ALA H H 1 7.93 0.02 . 1 . . . . 693 ALA H . 6607 1 925 . 1 1 79 79 ALA HA H 1 3.91 0.02 . 1 . . . . 693 ALA HA . 6607 1 926 . 1 1 79 79 ALA HB1 H 1 1.35 0.02 . 1 . . . . 693 ALA HB . 6607 1 927 . 1 1 79 79 ALA HB2 H 1 1.35 0.02 . 1 . . . . 693 ALA HB . 6607 1 928 . 1 1 79 79 ALA HB3 H 1 1.35 0.02 . 1 . . . . 693 ALA HB . 6607 1 929 . 1 1 79 79 ALA C C 13 181.42 0.05 . 1 . . . . 693 ALA C . 6607 1 930 . 1 1 79 79 ALA CA C 13 54.99 0.3 . 1 . . . . 693 ALA CA . 6607 1 931 . 1 1 79 79 ALA CB C 13 17.86 0.3 . 1 . . . . 693 ALA CB . 6607 1 932 . 1 1 79 79 ALA N N 15 123.52 0.1 . 1 . . . . 693 ALA N . 6607 1 933 . 1 1 80 80 LYS H H 1 8.40 0.02 . 1 . . . . 694 LYS H . 6607 1 934 . 1 1 80 80 LYS HA H 1 4.07 0.02 . 1 . . . . 694 LYS HA . 6607 1 935 . 1 1 80 80 LYS HB2 H 1 1.64 0.02 . 1 . . . . 694 LYS HB2 . 6607 1 936 . 1 1 80 80 LYS HB3 H 1 1.64 0.02 . 1 . . . . 694 LYS HB3 . 6607 1 937 . 1 1 80 80 LYS C C 13 180.26 0.05 . 1 . . . . 694 LYS C . 6607 1 938 . 1 1 80 80 LYS CA C 13 58.36 0.3 . 1 . . . . 694 LYS CA . 6607 1 939 . 1 1 80 80 LYS CB C 13 32.86 0.3 . 1 . . . . 694 LYS CB . 6607 1 940 . 1 1 80 80 LYS N N 15 116.14 0.1 . 1 . . . . 694 LYS N . 6607 1 941 . 1 1 81 81 LEU H H 1 8.08 0.02 . 1 . . . . 695 LEU H . 6607 1 942 . 1 1 81 81 LEU HA H 1 4.05 0.02 . 1 . . . . 695 LEU HA . 6607 1 943 . 1 1 81 81 LEU HB2 H 1 1.70 0.02 . 2 . . . . 695 LEU HB2 . 6607 1 944 . 1 1 81 81 LEU HB3 H 1 1.84 0.02 . 2 . . . . 695 LEU HB3 . 6607 1 945 . 1 1 81 81 LEU HG H 1 1.82 0.02 . 1 . . . . 695 LEU HG . 6607 1 946 . 1 1 81 81 LEU HD11 H 1 0.67 0.02 . 2 . . . . 695 LEU HD1 . 6607 1 947 . 1 1 81 81 LEU HD12 H 1 0.67 0.02 . 2 . . . . 695 LEU HD1 . 6607 1 948 . 1 1 81 81 LEU HD13 H 1 0.67 0.02 . 2 . . . . 695 LEU HD1 . 6607 1 949 . 1 1 81 81 LEU HD21 H 1 0.48 0.02 . 2 . . . . 695 LEU HD2 . 6607 1 950 . 1 1 81 81 LEU HD22 H 1 0.48 0.02 . 2 . . . . 695 LEU HD2 . 6607 1 951 . 1 1 81 81 LEU HD23 H 1 0.48 0.02 . 2 . . . . 695 LEU HD2 . 6607 1 952 . 1 1 81 81 LEU C C 13 178.44 0.05 . 1 . . . . 695 LEU C . 6607 1 953 . 1 1 81 81 LEU CA C 13 58.05 0.3 . 1 . . . . 695 LEU CA . 6607 1 954 . 1 1 81 81 LEU CB C 13 42.60 0.3 . 1 . . . . 695 LEU CB . 6607 1 955 . 1 1 81 81 LEU CG C 13 26.74 0.3 . 1 . . . . 695 LEU CG . 6607 1 956 . 1 1 81 81 LEU CD1 C 13 25.78 0.3 . 2 . . . . 695 LEU CD1 . 6607 1 957 . 1 1 81 81 LEU CD2 C 13 25.46 0.3 . 2 . . . . 695 LEU CD2 . 6607 1 958 . 1 1 81 81 LEU N N 15 123.32 0.1 . 1 . . . . 695 LEU N . 6607 1 959 . 1 1 82 82 GLN H H 1 7.91 0.02 . 1 . . . . 696 GLN H . 6607 1 960 . 1 1 82 82 GLN HA H 1 3.61 0.02 . 1 . . . . 696 GLN HA . 6607 1 961 . 1 1 82 82 GLN HB2 H 1 1.74 0.02 . 1 . . . . 696 GLN HB2 . 6607 1 962 . 1 1 82 82 GLN HB3 H 1 1.74 0.02 . 1 . . . . 696 GLN HB3 . 6607 1 963 . 1 1 82 82 GLN HG2 H 1 2.33 0.02 . 2 . . . . 696 GLN HG2 . 6607 1 964 . 1 1 82 82 GLN HG3 H 1 2.42 0.02 . 2 . . . . 696 GLN HG3 . 6607 1 965 . 1 1 82 82 GLN C C 13 179.09 0.05 . 1 . . . . 696 GLN C . 6607 1 966 . 1 1 82 82 GLN CA C 13 59.73 0.3 . 1 . . . . 696 GLN CA . 6607 1 967 . 1 1 82 82 GLN CB C 13 27.38 0.3 . 1 . . . . 696 GLN CB . 6607 1 968 . 1 1 82 82 GLN CG C 13 32.63 0.3 . 1 . . . . 696 GLN CG . 6607 1 969 . 1 1 82 82 GLN N N 15 119.92 0.1 . 1 . . . . 696 GLN N . 6607 1 970 . 1 1 83 83 GLU H H 1 8.37 0.02 . 1 . . . . 697 GLU H . 6607 1 971 . 1 1 83 83 GLU HA H 1 4.08 0.02 . 1 . . . . 697 GLU HA . 6607 1 972 . 1 1 83 83 GLU HB2 H 1 2.09 0.02 . 1 . . . . 697 GLU HB2 . 6607 1 973 . 1 1 83 83 GLU HB3 H 1 2.09 0.02 . 1 . . . . 697 GLU HB3 . 6607 1 974 . 1 1 83 83 GLU HG2 H 1 2.38 0.02 . 1 . . . . 697 GLU HG2 . 6607 1 975 . 1 1 83 83 GLU HG3 H 1 2.38 0.02 . 1 . . . . 697 GLU HG3 . 6607 1 976 . 1 1 83 83 GLU C C 13 178.81 0.05 . 1 . . . . 697 GLU C . 6607 1 977 . 1 1 83 83 GLU CA C 13 59.47 0.3 . 1 . . . . 697 GLU CA . 6607 1 978 . 1 1 83 83 GLU CB C 13 29.73 0.3 . 1 . . . . 697 GLU CB . 6607 1 979 . 1 1 83 83 GLU CG C 13 36.38 0.3 . 1 . . . . 697 GLU CG . 6607 1 980 . 1 1 83 83 GLU N N 15 120.84 0.1 . 1 . . . . 697 GLU N . 6607 1 981 . 1 1 84 84 ALA H H 1 8.27 0.02 . 1 . . . . 698 ALA H . 6607 1 982 . 1 1 84 84 ALA HA H 1 4.42 0.02 . 1 . . . . 698 ALA HA . 6607 1 983 . 1 1 84 84 ALA HB1 H 1 1.72 0.02 . 1 . . . . 698 ALA HB . 6607 1 984 . 1 1 84 84 ALA HB2 H 1 1.72 0.02 . 1 . . . . 698 ALA HB . 6607 1 985 . 1 1 84 84 ALA HB3 H 1 1.72 0.02 . 1 . . . . 698 ALA HB . 6607 1 986 . 1 1 84 84 ALA C C 13 180.35 0.05 . 1 . . . . 698 ALA C . 6607 1 987 . 1 1 84 84 ALA CA C 13 55.13 0.3 . 1 . . . . 698 ALA CA . 6607 1 988 . 1 1 84 84 ALA CB C 13 18.00 0.3 . 1 . . . . 698 ALA CB . 6607 1 989 . 1 1 84 84 ALA N N 15 121.72 0.1 . 1 . . . . 698 ALA N . 6607 1 990 . 1 1 85 85 TYR H H 1 8.70 0.02 . 1 . . . . 699 TYR H . 6607 1 991 . 1 1 85 85 TYR HA H 1 3.90 0.02 . 1 . . . . 699 TYR HA . 6607 1 992 . 1 1 85 85 TYR HB2 H 1 3.49 0.02 . 2 . . . . 699 TYR HB2 . 6607 1 993 . 1 1 85 85 TYR HB3 H 1 3.64 0.02 . 2 . . . . 699 TYR HB3 . 6607 1 994 . 1 1 85 85 TYR HD1 H 1 6.87 0.02 . 1 . . . . 699 TYR HD1 . 6607 1 995 . 1 1 85 85 TYR HD2 H 1 6.87 0.02 . 1 . . . . 699 TYR HD2 . 6607 1 996 . 1 1 85 85 TYR HE1 H 1 6.75 0.02 . 1 . . . . 699 TYR HE1 . 6607 1 997 . 1 1 85 85 TYR HE2 H 1 6.75 0.02 . 1 . . . . 699 TYR HE2 . 6607 1 998 . 1 1 85 85 TYR C C 13 177.89 0.05 . 1 . . . . 699 TYR C . 6607 1 999 . 1 1 85 85 TYR CA C 13 63.06 0.3 . 1 . . . . 699 TYR CA . 6607 1 1000 . 1 1 85 85 TYR CB C 13 37.82 0.3 . 1 . . . . 699 TYR CB . 6607 1 1001 . 1 1 85 85 TYR CD1 C 13 133.52 0.3 . 1 . . . . 699 TYR CD1 . 6607 1 1002 . 1 1 85 85 TYR CD2 C 13 133.52 0.3 . 1 . . . . 699 TYR CD2 . 6607 1 1003 . 1 1 85 85 TYR CE1 C 13 118.14 0.3 . 1 . . . . 699 TYR CE1 . 6607 1 1004 . 1 1 85 85 TYR CE2 C 13 118.14 0.3 . 1 . . . . 699 TYR CE2 . 6607 1 1005 . 1 1 85 85 TYR N N 15 118.89 0.1 . 1 . . . . 699 TYR N . 6607 1 1006 . 1 1 86 86 CYS H H 1 8.23 0.02 . 1 . . . . 700 CYS H . 6607 1 1007 . 1 1 86 86 CYS HA H 1 4.00 0.02 . 1 . . . . 700 CYS HA . 6607 1 1008 . 1 1 86 86 CYS HB2 H 1 3.01 0.02 . 2 . . . . 700 CYS HB2 . 6607 1 1009 . 1 1 86 86 CYS HB3 H 1 3.17 0.02 . 2 . . . . 700 CYS HB3 . 6607 1 1010 . 1 1 86 86 CYS C C 13 176.31 0.05 . 1 . . . . 700 CYS C . 6607 1 1011 . 1 1 86 86 CYS CA C 13 63.79 0.3 . 1 . . . . 700 CYS CA . 6607 1 1012 . 1 1 86 86 CYS CB C 13 26.59 0.3 . 1 . . . . 700 CYS CB . 6607 1 1013 . 1 1 86 86 CYS N N 15 119.04 0.1 . 1 . . . . 700 CYS N . 6607 1 1014 . 1 1 87 87 GLN H H 1 8.48 0.02 . 1 . . . . 701 GLN H . 6607 1 1015 . 1 1 87 87 GLN HA H 1 3.93 0.02 . 1 . . . . 701 GLN HA . 6607 1 1016 . 1 1 87 87 GLN HB2 H 1 1.27 0.02 . 1 . . . . 701 GLN HB2 . 6607 1 1017 . 1 1 87 87 GLN HB3 H 1 1.27 0.02 . 1 . . . . 701 GLN HB3 . 6607 1 1018 . 1 1 87 87 GLN HG2 H 1 1.67 0.02 . 2 . . . . 701 GLN HG2 . 6607 1 1019 . 1 1 87 87 GLN HG3 H 1 1.92 0.02 . 2 . . . . 701 GLN HG3 . 6607 1 1020 . 1 1 87 87 GLN HE21 H 1 6.71 0.02 . 2 . . . . 701 GLN HE21 . 6607 1 1021 . 1 1 87 87 GLN HE22 H 1 7.00 0.02 . 2 . . . . 701 GLN HE22 . 6607 1 1022 . 1 1 87 87 GLN C C 13 177.77 0.05 . 1 . . . . 701 GLN C . 6607 1 1023 . 1 1 87 87 GLN CA C 13 58.27 0.3 . 1 . . . . 701 GLN CA . 6607 1 1024 . 1 1 87 87 GLN CB C 13 29.12 0.3 . 1 . . . . 701 GLN CB . 6607 1 1025 . 1 1 87 87 GLN CG C 13 33.08 0.3 . 1 . . . . 701 GLN CG . 6607 1 1026 . 1 1 87 87 GLN N N 15 117.68 0.1 . 1 . . . . 701 GLN N . 6607 1 1027 . 1 1 87 87 GLN NE2 N 15 110.23 0.1 . 1 . . . . 701 GLN NE2 . 6607 1 1028 . 1 1 88 88 TYR H H 1 8.19 0.02 . 1 . . . . 702 TYR H . 6607 1 1029 . 1 1 88 88 TYR HA H 1 4.85 0.02 . 1 . . . . 702 TYR HA . 6607 1 1030 . 1 1 88 88 TYR HB2 H 1 2.75 0.02 . 2 . . . . 702 TYR HB2 . 6607 1 1031 . 1 1 88 88 TYR HB3 H 1 3.14 0.02 . 2 . . . . 702 TYR HB3 . 6607 1 1032 . 1 1 88 88 TYR HD1 H 1 7.21 0.02 . 1 . . . . 702 TYR HD1 . 6607 1 1033 . 1 1 88 88 TYR HD2 H 1 7.21 0.02 . 1 . . . . 702 TYR HD2 . 6607 1 1034 . 1 1 88 88 TYR HE1 H 1 6.82 0.02 . 1 . . . . 702 TYR HE1 . 6607 1 1035 . 1 1 88 88 TYR HE2 H 1 6.82 0.02 . 1 . . . . 702 TYR HE2 . 6607 1 1036 . 1 1 88 88 TYR C C 13 176.01 0.05 . 1 . . . . 702 TYR C . 6607 1 1037 . 1 1 88 88 TYR CA C 13 58.94 0.3 . 1 . . . . 702 TYR CA . 6607 1 1038 . 1 1 88 88 TYR CB C 13 41.54 0.3 . 1 . . . . 702 TYR CB . 6607 1 1039 . 1 1 88 88 TYR CD1 C 13 132.81 0.3 . 1 . . . . 702 TYR CD1 . 6607 1 1040 . 1 1 88 88 TYR CD2 C 13 132.81 0.3 . 1 . . . . 702 TYR CD2 . 6607 1 1041 . 1 1 88 88 TYR CE1 C 13 117.94 0.3 . 1 . . . . 702 TYR CE1 . 6607 1 1042 . 1 1 88 88 TYR CE2 C 13 117.94 0.3 . 1 . . . . 702 TYR CE2 . 6607 1 1043 . 1 1 88 88 TYR N N 15 111.84 0.1 . 1 . . . . 702 TYR N . 6607 1 1044 . 1 1 89 89 LEU H H 1 8.07 0.02 . 1 . . . . 703 LEU H . 6607 1 1045 . 1 1 89 89 LEU HA H 1 4.86 0.02 . 1 . . . . 703 LEU HA . 6607 1 1046 . 1 1 89 89 LEU HB2 H 1 1.28 0.02 . 2 . . . . 703 LEU HB2 . 6607 1 1047 . 1 1 89 89 LEU HB3 H 1 1.43 0.02 . 2 . . . . 703 LEU HB3 . 6607 1 1048 . 1 1 89 89 LEU HD11 H 1 0.92 0.02 . 2 . . . . 703 LEU HD1 . 6607 1 1049 . 1 1 89 89 LEU HD12 H 1 0.92 0.02 . 2 . . . . 703 LEU HD1 . 6607 1 1050 . 1 1 89 89 LEU HD13 H 1 0.92 0.02 . 2 . . . . 703 LEU HD1 . 6607 1 1051 . 1 1 89 89 LEU HD21 H 1 0.72 0.02 . 2 . . . . 703 LEU HD2 . 6607 1 1052 . 1 1 89 89 LEU HD22 H 1 0.72 0.02 . 2 . . . . 703 LEU HD2 . 6607 1 1053 . 1 1 89 89 LEU HD23 H 1 0.72 0.02 . 2 . . . . 703 LEU HD2 . 6607 1 1054 . 1 1 89 89 LEU C C 13 176.43 0.05 . 1 . . . . 703 LEU C . 6607 1 1055 . 1 1 89 89 LEU CA C 13 54.51 0.3 . 1 . . . . 703 LEU CA . 6607 1 1056 . 1 1 89 89 LEU CB C 13 46.75 0.3 . 1 . . . . 703 LEU CB . 6607 1 1057 . 1 1 89 89 LEU CD1 C 13 24.02 0.3 . 2 . . . . 703 LEU CD1 . 6607 1 1058 . 1 1 89 89 LEU CD2 C 13 22.59 0.3 . 2 . . . . 703 LEU CD2 . 6607 1 1059 . 1 1 89 89 LEU N N 15 115.99 0.1 . 1 . . . . 703 LEU N . 6607 1 1060 . 1 1 90 90 LEU H H 1 7.33 0.02 . 1 . . . . 704 LEU H . 6607 1 1061 . 1 1 90 90 LEU HA H 1 3.85 0.02 . 1 . . . . 704 LEU HA . 6607 1 1062 . 1 1 90 90 LEU HB2 H 1 1.49 0.02 . 2 . . . . 704 LEU HB2 . 6607 1 1063 . 1 1 90 90 LEU HB3 H 1 1.82 0.02 . 2 . . . . 704 LEU HB3 . 6607 1 1064 . 1 1 90 90 LEU HG H 1 1.63 0.02 . 1 . . . . 704 LEU HG . 6607 1 1065 . 1 1 90 90 LEU HD11 H 1 0.98 0.02 . 2 . . . . 704 LEU HD1 . 6607 1 1066 . 1 1 90 90 LEU HD12 H 1 0.98 0.02 . 2 . . . . 704 LEU HD1 . 6607 1 1067 . 1 1 90 90 LEU HD13 H 1 0.98 0.02 . 2 . . . . 704 LEU HD1 . 6607 1 1068 . 1 1 90 90 LEU HD21 H 1 1.15 0.02 . 2 . . . . 704 LEU HD2 . 6607 1 1069 . 1 1 90 90 LEU HD22 H 1 1.15 0.02 . 2 . . . . 704 LEU HD2 . 6607 1 1070 . 1 1 90 90 LEU HD23 H 1 1.15 0.02 . 2 . . . . 704 LEU HD2 . 6607 1 1071 . 1 1 90 90 LEU C C 13 178.86 0.05 . 1 . . . . 704 LEU C . 6607 1 1072 . 1 1 90 90 LEU CA C 13 59.75 0.3 . 1 . . . . 704 LEU CA . 6607 1 1073 . 1 1 90 90 LEU CB C 13 42.54 0.3 . 1 . . . . 704 LEU CB . 6607 1 1074 . 1 1 90 90 LEU CG C 13 27.44 0.3 . 1 . . . . 704 LEU CG . 6607 1 1075 . 1 1 90 90 LEU CD1 C 13 25.51 0.3 . 2 . . . . 704 LEU CD1 . 6607 1 1076 . 1 1 90 90 LEU CD2 C 13 24.54 0.3 . 2 . . . . 704 LEU CD2 . 6607 1 1077 . 1 1 90 90 LEU N N 15 123.01 0.1 . 1 . . . . 704 LEU N . 6607 1 1078 . 1 1 91 91 SER H H 1 8.61 0.02 . 1 . . . . 705 SER H . 6607 1 1079 . 1 1 91 91 SER HA H 1 4.07 0.02 . 1 . . . . 705 SER HA . 6607 1 1080 . 1 1 91 91 SER HB2 H 1 3.90 0.02 . 1 . . . . 705 SER HB2 . 6607 1 1081 . 1 1 91 91 SER HB3 H 1 3.90 0.02 . 1 . . . . 705 SER HB3 . 6607 1 1082 . 1 1 91 91 SER C C 13 177.97 0.05 . 1 . . . . 705 SER C . 6607 1 1083 . 1 1 91 91 SER CA C 13 61.69 0.3 . 1 . . . . 705 SER CA . 6607 1 1084 . 1 1 91 91 SER CB C 13 61.82 0.3 . 1 . . . . 705 SER CB . 6607 1 1085 . 1 1 91 91 SER N N 15 114.22 0.1 . 1 . . . . 705 SER N . 6607 1 1086 . 1 1 92 92 TYR H H 1 8.53 0.02 . 1 . . . . 706 TYR H . 6607 1 1087 . 1 1 92 92 TYR HA H 1 3.24 0.02 . 1 . . . . 706 TYR HA . 6607 1 1088 . 1 1 92 92 TYR HB2 H 1 2.91 0.02 . 2 . . . . 706 TYR HB2 . 6607 1 1089 . 1 1 92 92 TYR HB3 H 1 3.05 0.02 . 2 . . . . 706 TYR HB3 . 6607 1 1090 . 1 1 92 92 TYR HD1 H 1 6.50 0.02 . 1 . . . . 706 TYR HD1 . 6607 1 1091 . 1 1 92 92 TYR HD2 H 1 6.50 0.02 . 1 . . . . 706 TYR HD2 . 6607 1 1092 . 1 1 92 92 TYR HE1 H 1 5.79 0.02 . 1 . . . . 706 TYR HE1 . 6607 1 1093 . 1 1 92 92 TYR HE2 H 1 5.79 0.02 . 1 . . . . 706 TYR HE2 . 6607 1 1094 . 1 1 92 92 TYR C C 13 176.91 0.05 . 1 . . . . 706 TYR C . 6607 1 1095 . 1 1 92 92 TYR CA C 13 61.50 0.3 . 1 . . . . 706 TYR CA . 6607 1 1096 . 1 1 92 92 TYR CB C 13 38.54 0.3 . 1 . . . . 706 TYR CB . 6607 1 1097 . 1 1 92 92 TYR CD1 C 13 132.47 0.3 . 1 . . . . 706 TYR CD1 . 6607 1 1098 . 1 1 92 92 TYR CD2 C 13 132.47 0.3 . 1 . . . . 706 TYR CD2 . 6607 1 1099 . 1 1 92 92 TYR CE1 C 13 118.55 0.3 . 1 . . . . 706 TYR CE1 . 6607 1 1100 . 1 1 92 92 TYR CE2 C 13 118.55 0.3 . 1 . . . . 706 TYR CE2 . 6607 1 1101 . 1 1 92 92 TYR N N 15 125.77 0.1 . 1 . . . . 706 TYR N . 6607 1 1102 . 1 1 93 93 ASP H H 1 9.04 0.02 . 1 . . . . 707 ASP H . 6607 1 1103 . 1 1 93 93 ASP HA H 1 4.78 0.02 . 1 . . . . 707 ASP HA . 6607 1 1104 . 1 1 93 93 ASP HB2 H 1 2.96 0.02 . 1 . . . . 707 ASP HB2 . 6607 1 1105 . 1 1 93 93 ASP HB3 H 1 2.96 0.02 . 1 . . . . 707 ASP HB3 . 6607 1 1106 . 1 1 93 93 ASP C C 13 177.67 0.05 . 1 . . . . 707 ASP C . 6607 1 1107 . 1 1 93 93 ASP CA C 13 55.56 0.3 . 1 . . . . 707 ASP CA . 6607 1 1108 . 1 1 93 93 ASP CB C 13 41.48 0.3 . 1 . . . . 707 ASP CB . 6607 1 1109 . 1 1 93 93 ASP N N 15 117.51 0.1 . 1 . . . . 707 ASP N . 6607 1 1110 . 1 1 94 94 SER H H 1 7.58 0.02 . 1 . . . . 708 SER H . 6607 1 1111 . 1 1 94 94 SER HA H 1 4.53 0.02 . 1 . . . . 708 SER HA . 6607 1 1112 . 1 1 94 94 SER HB2 H 1 3.90 0.02 . 1 . . . . 708 SER HB2 . 6607 1 1113 . 1 1 94 94 SER HB3 H 1 3.90 0.02 . 1 . . . . 708 SER HB3 . 6607 1 1114 . 1 1 94 94 SER C C 13 174.08 0.05 . 1 . . . . 708 SER C . 6607 1 1115 . 1 1 94 94 SER CA C 13 58.56 0.3 . 1 . . . . 708 SER CA . 6607 1 1116 . 1 1 94 94 SER CB C 13 64.02 0.3 . 1 . . . . 708 SER CB . 6607 1 1117 . 1 1 94 94 SER N N 15 112.19 0.1 . 1 . . . . 708 SER N . 6607 1 1118 . 1 1 95 95 LEU H H 1 7.02 0.02 . 1 . . . . 709 LEU H . 6607 1 1119 . 1 1 95 95 LEU HA H 1 4.09 0.02 . 1 . . . . 709 LEU HA . 6607 1 1120 . 1 1 95 95 LEU HB2 H 1 0.77 0.02 . 2 . . . . 709 LEU HB2 . 6607 1 1121 . 1 1 95 95 LEU HB3 H 1 0.84 0.02 . 2 . . . . 709 LEU HB3 . 6607 1 1122 . 1 1 95 95 LEU HG H 1 1.63 0.02 . 1 . . . . 709 LEU HG . 6607 1 1123 . 1 1 95 95 LEU HD11 H 1 0.59 0.02 . 2 . . . . 709 LEU HD1 . 6607 1 1124 . 1 1 95 95 LEU HD12 H 1 0.59 0.02 . 2 . . . . 709 LEU HD1 . 6607 1 1125 . 1 1 95 95 LEU HD13 H 1 0.59 0.02 . 2 . . . . 709 LEU HD1 . 6607 1 1126 . 1 1 95 95 LEU HD21 H 1 0.04 0.02 . 2 . . . . 709 LEU HD2 . 6607 1 1127 . 1 1 95 95 LEU HD22 H 1 0.04 0.02 . 2 . . . . 709 LEU HD2 . 6607 1 1128 . 1 1 95 95 LEU HD23 H 1 0.04 0.02 . 2 . . . . 709 LEU HD2 . 6607 1 1129 . 1 1 95 95 LEU C C 13 176.85 0.05 . 1 . . . . 709 LEU C . 6607 1 1130 . 1 1 95 95 LEU CA C 13 54.83 0.3 . 1 . . . . 709 LEU CA . 6607 1 1131 . 1 1 95 95 LEU CB C 13 41.45 0.3 . 1 . . . . 709 LEU CB . 6607 1 1132 . 1 1 95 95 LEU CG C 13 25.10 0.3 . 1 . . . . 709 LEU CG . 6607 1 1133 . 1 1 95 95 LEU CD1 C 13 21.93 0.3 . 2 . . . . 709 LEU CD1 . 6607 1 1134 . 1 1 95 95 LEU CD2 C 13 25.49 0.3 . 2 . . . . 709 LEU CD2 . 6607 1 1135 . 1 1 95 95 LEU N N 15 122.57 0.1 . 1 . . . . 709 LEU N . 6607 1 1136 . 1 1 96 96 SER H H 1 8.84 0.02 . 1 . . . . 710 SER H . 6607 1 1137 . 1 1 96 96 SER HA H 1 4.68 0.02 . 1 . . . . 710 SER HA . 6607 1 1138 . 1 1 96 96 SER HB2 H 1 4.02 0.02 . 2 . . . . 710 SER HB2 . 6607 1 1139 . 1 1 96 96 SER HB3 H 1 4.43 0.02 . 2 . . . . 710 SER HB3 . 6607 1 1140 . 1 1 96 96 SER C C 13 173.26 0.05 . 1 . . . . 710 SER C . 6607 1 1141 . 1 1 96 96 SER CA C 13 56.67 0.3 . 1 . . . . 710 SER CA . 6607 1 1142 . 1 1 96 96 SER CB C 13 63.27 0.3 . 1 . . . . 710 SER CB . 6607 1 1143 . 1 1 96 96 SER N N 15 118.29 0.1 . 1 . . . . 710 SER N . 6607 1 1144 . 1 1 97 97 PRO HA H 1 4.36 0.02 . 1 . . . . 711 PRO HA . 6607 1 1145 . 1 1 97 97 PRO HB2 H 1 1.96 0.02 . 2 . . . . 711 PRO HB2 . 6607 1 1146 . 1 1 97 97 PRO HB3 H 1 2.44 0.02 . 2 . . . . 711 PRO HB3 . 6607 1 1147 . 1 1 97 97 PRO HG2 H 1 2.09 0.02 . 2 . . . . 711 PRO HG2 . 6607 1 1148 . 1 1 97 97 PRO HG3 H 1 2.26 0.02 . 2 . . . . 711 PRO HG3 . 6607 1 1149 . 1 1 97 97 PRO HD2 H 1 3.93 0.02 . 1 . . . . 711 PRO HD2 . 6607 1 1150 . 1 1 97 97 PRO HD3 H 1 3.93 0.02 . 1 . . . . 711 PRO HD3 . 6607 1 1151 . 1 1 97 97 PRO C C 13 179.68 0.05 . 1 . . . . 711 PRO C . 6607 1 1152 . 1 1 97 97 PRO CA C 13 66.06 0.3 . 1 . . . . 711 PRO CA . 6607 1 1153 . 1 1 97 97 PRO CB C 13 32.06 0.3 . 1 . . . . 711 PRO CB . 6607 1 1154 . 1 1 97 97 PRO CG C 13 28.30 0.3 . 1 . . . . 711 PRO CG . 6607 1 1155 . 1 1 97 97 PRO CD C 13 50.39 0.3 . 1 . . . . 711 PRO CD . 6607 1 1156 . 1 1 98 98 GLU H H 1 8.66 0.02 . 1 . . . . 712 GLU H . 6607 1 1157 . 1 1 98 98 GLU HA H 1 4.01 0.02 . 1 . . . . 712 GLU HA . 6607 1 1158 . 1 1 98 98 GLU HB2 H 1 1.91 0.02 . 2 . . . . 712 GLU HB2 . 6607 1 1159 . 1 1 98 98 GLU HB3 H 1 2.09 0.02 . 2 . . . . 712 GLU HB3 . 6607 1 1160 . 1 1 98 98 GLU HG2 H 1 2.25 0.02 . 2 . . . . 712 GLU HG2 . 6607 1 1161 . 1 1 98 98 GLU HG3 H 1 2.42 0.02 . 2 . . . . 712 GLU HG3 . 6607 1 1162 . 1 1 98 98 GLU C C 13 179.41 0.05 . 1 . . . . 712 GLU C . 6607 1 1163 . 1 1 98 98 GLU CA C 13 59.81 0.3 . 1 . . . . 712 GLU CA . 6607 1 1164 . 1 1 98 98 GLU CB C 13 28.97 0.3 . 1 . . . . 712 GLU CB . 6607 1 1165 . 1 1 98 98 GLU CG C 13 36.80 0.3 . 1 . . . . 712 GLU CG . 6607 1 1166 . 1 1 98 98 GLU N N 15 117.15 0.1 . 1 . . . . 712 GLU N . 6607 1 1167 . 1 1 99 99 GLU H H 1 7.89 0.02 . 1 . . . . 713 GLU H . 6607 1 1168 . 1 1 99 99 GLU HA H 1 4.09 0.02 . 1 . . . . 713 GLU HA . 6607 1 1169 . 1 1 99 99 GLU HB2 H 1 1.89 0.02 . 1 . . . . 713 GLU HB2 . 6607 1 1170 . 1 1 99 99 GLU HB3 H 1 1.89 0.02 . 1 . . . . 713 GLU HB3 . 6607 1 1171 . 1 1 99 99 GLU HG2 H 1 2.22 0.02 . 2 . . . . 713 GLU HG2 . 6607 1 1172 . 1 1 99 99 GLU HG3 H 1 2.32 0.02 . 2 . . . . 713 GLU HG3 . 6607 1 1173 . 1 1 99 99 GLU C C 13 179.90 0.05 . 1 . . . . 713 GLU C . 6607 1 1174 . 1 1 99 99 GLU CA C 13 58.89 0.3 . 1 . . . . 713 GLU CA . 6607 1 1175 . 1 1 99 99 GLU CB C 13 30.20 0.3 . 1 . . . . 713 GLU CB . 6607 1 1176 . 1 1 99 99 GLU CG C 13 37.44 0.3 . 1 . . . . 713 GLU CG . 6607 1 1177 . 1 1 99 99 GLU N N 15 122.25 0.1 . 1 . . . . 713 GLU N . 6607 1 1178 . 1 1 100 100 HIS H H 1 8.35 0.02 . 1 . . . . 714 HIS H . 6607 1 1179 . 1 1 100 100 HIS HA H 1 4.30 0.02 . 1 . . . . 714 HIS HA . 6607 1 1180 . 1 1 100 100 HIS HB2 H 1 2.98 0.02 . 2 . . . . 714 HIS HB2 . 6607 1 1181 . 1 1 100 100 HIS HB3 H 1 3.14 0.02 . 2 . . . . 714 HIS HB3 . 6607 1 1182 . 1 1 100 100 HIS HD2 H 1 6.38 0.02 . 1 . . . . 714 HIS HD2 . 6607 1 1183 . 1 1 100 100 HIS C C 13 178.50 0.05 . 1 . . . . 714 HIS C . 6607 1 1184 . 1 1 100 100 HIS CA C 13 60.76 0.3 . 1 . . . . 714 HIS CA . 6607 1 1185 . 1 1 100 100 HIS CB C 13 30.63 0.3 . 1 . . . . 714 HIS CB . 6607 1 1186 . 1 1 100 100 HIS CD2 C 13 117.61 0.3 . 1 . . . . 714 HIS CD2 . 6607 1 1187 . 1 1 100 100 HIS N N 15 119.75 0.1 . 1 . . . . 714 HIS N . 6607 1 1188 . 1 1 101 101 ARG H H 1 8.21 0.02 . 1 . . . . 715 ARG H . 6607 1 1189 . 1 1 101 101 ARG HA H 1 4.09 0.02 . 1 . . . . 715 ARG HA . 6607 1 1190 . 1 1 101 101 ARG HB2 H 1 1.90 0.02 . 2 . . . . 715 ARG HB2 . 6607 1 1191 . 1 1 101 101 ARG HB3 H 1 2.01 0.02 . 2 . . . . 715 ARG HB3 . 6607 1 1192 . 1 1 101 101 ARG HG2 H 1 1.70 0.02 . 2 . . . . 715 ARG HG2 . 6607 1 1193 . 1 1 101 101 ARG HG3 H 1 1.80 0.02 . 2 . . . . 715 ARG HG3 . 6607 1 1194 . 1 1 101 101 ARG HD2 H 1 3.24 0.02 . 1 . . . . 715 ARG HD2 . 6607 1 1195 . 1 1 101 101 ARG HD3 H 1 3.24 0.02 . 1 . . . . 715 ARG HD3 . 6607 1 1196 . 1 1 101 101 ARG C C 13 179.07 0.05 . 1 . . . . 715 ARG C . 6607 1 1197 . 1 1 101 101 ARG CA C 13 59.33 0.3 . 1 . . . . 715 ARG CA . 6607 1 1198 . 1 1 101 101 ARG CB C 13 30.33 0.3 . 1 . . . . 715 ARG CB . 6607 1 1199 . 1 1 101 101 ARG CG C 13 27.62 0.3 . 1 . . . . 715 ARG CG . 6607 1 1200 . 1 1 101 101 ARG CD C 13 43.51 0.3 . 1 . . . . 715 ARG CD . 6607 1 1201 . 1 1 101 101 ARG N N 15 118.90 0.1 . 1 . . . . 715 ARG N . 6607 1 1202 . 1 1 102 102 ARG H H 1 7.91 0.02 . 1 . . . . 716 ARG H . 6607 1 1203 . 1 1 102 102 ARG HA H 1 4.11 0.02 . 1 . . . . 716 ARG HA . 6607 1 1204 . 1 1 102 102 ARG HB2 H 1 2.04 0.02 . 2 . . . . 716 ARG HB2 . 6607 1 1205 . 1 1 102 102 ARG HB3 H 1 2.23 0.02 . 2 . . . . 716 ARG HB3 . 6607 1 1206 . 1 1 102 102 ARG HD2 H 1 3.19 0.02 . 1 . . . . 716 ARG HD2 . 6607 1 1207 . 1 1 102 102 ARG HD3 H 1 3.19 0.02 . 1 . . . . 716 ARG HD3 . 6607 1 1208 . 1 1 102 102 ARG C C 13 178.97 0.05 . 1 . . . . 716 ARG C . 6607 1 1209 . 1 1 102 102 ARG CA C 13 59.84 0.3 . 1 . . . . 716 ARG CA . 6607 1 1210 . 1 1 102 102 ARG CB C 13 30.00 0.3 . 1 . . . . 716 ARG CB . 6607 1 1211 . 1 1 102 102 ARG CD C 13 43.00 0.3 . 1 . . . . 716 ARG CD . 6607 1 1212 . 1 1 102 102 ARG N N 15 120.70 0.1 . 1 . . . . 716 ARG N . 6607 1 1213 . 1 1 103 103 LEU H H 1 7.93 0.02 . 1 . . . . 717 LEU H . 6607 1 1214 . 1 1 103 103 LEU HA H 1 4.09 0.02 . 1 . . . . 717 LEU HA . 6607 1 1215 . 1 1 103 103 LEU HB2 H 1 1.58 0.02 . 2 . . . . 717 LEU HB2 . 6607 1 1216 . 1 1 103 103 LEU HB3 H 1 2.14 0.02 . 2 . . . . 717 LEU HB3 . 6607 1 1217 . 1 1 103 103 LEU HG H 1 1.81 0.02 . 1 . . . . 717 LEU HG . 6607 1 1218 . 1 1 103 103 LEU HD11 H 1 1.08 0.02 . 2 . . . . 717 LEU HD1 . 6607 1 1219 . 1 1 103 103 LEU HD12 H 1 1.08 0.02 . 2 . . . . 717 LEU HD1 . 6607 1 1220 . 1 1 103 103 LEU HD13 H 1 1.08 0.02 . 2 . . . . 717 LEU HD1 . 6607 1 1221 . 1 1 103 103 LEU HD21 H 1 1.09 0.02 . 2 . . . . 717 LEU HD2 . 6607 1 1222 . 1 1 103 103 LEU HD22 H 1 1.09 0.02 . 2 . . . . 717 LEU HD2 . 6607 1 1223 . 1 1 103 103 LEU HD23 H 1 1.09 0.02 . 2 . . . . 717 LEU HD2 . 6607 1 1224 . 1 1 103 103 LEU C C 13 178.41 0.05 . 1 . . . . 717 LEU C . 6607 1 1225 . 1 1 103 103 LEU CA C 13 58.32 0.3 . 1 . . . . 717 LEU CA . 6607 1 1226 . 1 1 103 103 LEU CB C 13 42.77 0.3 . 1 . . . . 717 LEU CB . 6607 1 1227 . 1 1 103 103 LEU CG C 13 27.50 0.3 . 1 . . . . 717 LEU CG . 6607 1 1228 . 1 1 103 103 LEU CD1 C 13 26.33 0.3 . 2 . . . . 717 LEU CD1 . 6607 1 1229 . 1 1 103 103 LEU CD2 C 13 24.27 0.3 . 2 . . . . 717 LEU CD2 . 6607 1 1230 . 1 1 103 103 LEU N N 15 120.61 0.1 . 1 . . . . 717 LEU N . 6607 1 1231 . 1 1 104 104 GLU H H 1 8.26 0.02 . 1 . . . . 718 GLU H . 6607 1 1232 . 1 1 104 104 GLU HA H 1 3.83 0.02 . 1 . . . . 718 GLU HA . 6607 1 1233 . 1 1 104 104 GLU HB2 H 1 2.25 0.02 . 2 . . . . 718 GLU HB2 . 6607 1 1234 . 1 1 104 104 GLU HB3 H 1 2.01 0.02 . 2 . . . . 718 GLU HB3 . 6607 1 1235 . 1 1 104 104 GLU HG2 H 1 2.28 0.02 . 2 . . . . 718 GLU HG2 . 6607 1 1236 . 1 1 104 104 GLU HG3 H 1 2.50 0.02 . 2 . . . . 718 GLU HG3 . 6607 1 1237 . 1 1 104 104 GLU C C 13 178.68 0.05 . 1 . . . . 718 GLU C . 6607 1 1238 . 1 1 104 104 GLU CA C 13 59.90 0.3 . 1 . . . . 718 GLU CA . 6607 1 1239 . 1 1 104 104 GLU CB C 13 29.53 0.3 . 1 . . . . 718 GLU CB . 6607 1 1240 . 1 1 104 104 GLU CG C 13 37.50 0.3 . 1 . . . . 718 GLU CG . 6607 1 1241 . 1 1 104 104 GLU N N 15 117.78 0.1 . 1 . . . . 718 GLU N . 6607 1 1242 . 1 1 105 105 LYS H H 1 7.98 0.02 . 1 . . . . 719 LYS H . 6607 1 1243 . 1 1 105 105 LYS HA H 1 4.05 0.02 . 1 . . . . 719 LYS HA . 6607 1 1244 . 1 1 105 105 LYS HB2 H 1 2.00 0.02 . 1 . . . . 719 LYS HB2 . 6607 1 1245 . 1 1 105 105 LYS HB3 H 1 2.00 0.02 . 1 . . . . 719 LYS HB3 . 6607 1 1246 . 1 1 105 105 LYS HG2 H 1 1.70 0.02 . 1 . . . . 719 LYS HG2 . 6607 1 1247 . 1 1 105 105 LYS HG3 H 1 1.70 0.02 . 1 . . . . 719 LYS HG3 . 6607 1 1248 . 1 1 105 105 LYS HD2 H 1 1.45 0.02 . 2 . . . . 719 LYS HD2 . 6607 1 1249 . 1 1 105 105 LYS HD3 H 1 1.60 0.02 . 2 . . . . 719 LYS HD3 . 6607 1 1250 . 1 1 105 105 LYS HE2 H 1 2.98 0.02 . 1 . . . . 719 LYS HE2 . 6607 1 1251 . 1 1 105 105 LYS HE3 H 1 2.98 0.02 . 1 . . . . 719 LYS HE3 . 6607 1 1252 . 1 1 105 105 LYS C C 13 179.25 0.05 . 1 . . . . 719 LYS C . 6607 1 1253 . 1 1 105 105 LYS CA C 13 59.39 0.3 . 1 . . . . 719 LYS CA . 6607 1 1254 . 1 1 105 105 LYS CB C 13 32.24 0.3 . 1 . . . . 719 LYS CB . 6607 1 1255 . 1 1 105 105 LYS CG C 13 29.23 0.3 . 1 . . . . 719 LYS CG . 6607 1 1256 . 1 1 105 105 LYS CD C 13 25.14 0.3 . 1 . . . . 719 LYS CD . 6607 1 1257 . 1 1 105 105 LYS CE C 13 42.15 0.3 . 1 . . . . 719 LYS CE . 6607 1 1258 . 1 1 105 105 LYS N N 15 118.73 0.1 . 1 . . . . 719 LYS N . 6607 1 1259 . 1 1 106 106 GLU H H 1 8.17 0.02 . 1 . . . . 720 GLU H . 6607 1 1260 . 1 1 106 106 GLU HA H 1 4.06 0.02 . 1 . . . . 720 GLU HA . 6607 1 1261 . 1 1 106 106 GLU HB2 H 1 2.03 0.02 . 2 . . . . 720 GLU HB2 . 6607 1 1262 . 1 1 106 106 GLU HB3 H 1 2.29 0.02 . 2 . . . . 720 GLU HB3 . 6607 1 1263 . 1 1 106 106 GLU HG2 H 1 2.23 0.02 . 2 . . . . 720 GLU HG2 . 6607 1 1264 . 1 1 106 106 GLU HG3 H 1 2.61 0.02 . 2 . . . . 720 GLU HG3 . 6607 1 1265 . 1 1 106 106 GLU C C 13 179.87 0.05 . 1 . . . . 720 GLU C . 6607 1 1266 . 1 1 106 106 GLU CA C 13 59.74 0.3 . 1 . . . . 720 GLU CA . 6607 1 1267 . 1 1 106 106 GLU CB C 13 29.95 0.3 . 1 . . . . 720 GLU CB . 6607 1 1268 . 1 1 106 106 GLU CG C 13 36.83 0.3 . 1 . . . . 720 GLU CG . 6607 1 1269 . 1 1 106 106 GLU N N 15 119.52 0.1 . 1 . . . . 720 GLU N . 6607 1 1270 . 1 1 107 107 VAL H H 1 8.49 0.02 . 1 . . . . 721 VAL H . 6607 1 1271 . 1 1 107 107 VAL HA H 1 3.84 0.02 . 1 . . . . 721 VAL HA . 6607 1 1272 . 1 1 107 107 VAL HB H 1 2.34 0.02 . 1 . . . . 721 VAL HB . 6607 1 1273 . 1 1 107 107 VAL HG11 H 1 1.18 0.02 . 2 . . . . 721 VAL HG1 . 6607 1 1274 . 1 1 107 107 VAL HG12 H 1 1.18 0.02 . 2 . . . . 721 VAL HG1 . 6607 1 1275 . 1 1 107 107 VAL HG13 H 1 1.18 0.02 . 2 . . . . 721 VAL HG1 . 6607 1 1276 . 1 1 107 107 VAL HG21 H 1 1.08 0.02 . 2 . . . . 721 VAL HG2 . 6607 1 1277 . 1 1 107 107 VAL HG22 H 1 1.08 0.02 . 2 . . . . 721 VAL HG2 . 6607 1 1278 . 1 1 107 107 VAL HG23 H 1 1.08 0.02 . 2 . . . . 721 VAL HG2 . 6607 1 1279 . 1 1 107 107 VAL C C 13 178.79 0.05 . 1 . . . . 721 VAL C . 6607 1 1280 . 1 1 107 107 VAL CA C 13 66.07 0.3 . 1 . . . . 721 VAL CA . 6607 1 1281 . 1 1 107 107 VAL CB C 13 31.80 0.3 . 1 . . . . 721 VAL CB . 6607 1 1282 . 1 1 107 107 VAL CG1 C 13 23.34 0.3 . 2 . . . . 721 VAL CG1 . 6607 1 1283 . 1 1 107 107 VAL CG2 C 13 21.71 0.3 . 2 . . . . 721 VAL CG2 . 6607 1 1284 . 1 1 107 107 VAL N N 15 119.07 0.1 . 1 . . . . 721 VAL N . 6607 1 1285 . 1 1 108 108 LEU H H 1 8.15 0.02 . 1 . . . . 722 LEU H . 6607 1 1286 . 1 1 108 108 LEU HA H 1 4.06 0.02 . 1 . . . . 722 LEU HA . 6607 1 1287 . 1 1 108 108 LEU HB2 H 1 1.62 0.02 . 2 . . . . 722 LEU HB2 . 6607 1 1288 . 1 1 108 108 LEU HB3 H 1 1.86 0.02 . 2 . . . . 722 LEU HB3 . 6607 1 1289 . 1 1 108 108 LEU HG H 1 1.76 0.02 . 1 . . . . 722 LEU HG . 6607 1 1290 . 1 1 108 108 LEU HD11 H 1 0.67 0.02 . 2 . . . . 722 LEU HD1 . 6607 1 1291 . 1 1 108 108 LEU HD12 H 1 0.67 0.02 . 2 . . . . 722 LEU HD1 . 6607 1 1292 . 1 1 108 108 LEU HD13 H 1 0.67 0.02 . 2 . . . . 722 LEU HD1 . 6607 1 1293 . 1 1 108 108 LEU HD21 H 1 0.87 0.02 . 2 . . . . 722 LEU HD2 . 6607 1 1294 . 1 1 108 108 LEU HD22 H 1 0.87 0.02 . 2 . . . . 722 LEU HD2 . 6607 1 1295 . 1 1 108 108 LEU HD23 H 1 0.87 0.02 . 2 . . . . 722 LEU HD2 . 6607 1 1296 . 1 1 108 108 LEU C C 13 179.34 0.05 . 1 . . . . 722 LEU C . 6607 1 1297 . 1 1 108 108 LEU CA C 13 57.88 0.3 . 1 . . . . 722 LEU CA . 6607 1 1298 . 1 1 108 108 LEU CB C 13 41.80 0.3 . 1 . . . . 722 LEU CB . 6607 1 1299 . 1 1 108 108 LEU CG C 13 27.20 0.3 . 1 . . . . 722 LEU CG . 6607 1 1300 . 1 1 108 108 LEU CD1 C 13 25.79 0.3 . 2 . . . . 722 LEU CD1 . 6607 1 1301 . 1 1 108 108 LEU CD2 C 13 23.34 0.3 . 2 . . . . 722 LEU CD2 . 6607 1 1302 . 1 1 108 108 LEU N N 15 121.25 0.1 . 1 . . . . 722 LEU N . 6607 1 1303 . 1 1 109 109 MET H H 1 8.02 0.02 . 1 . . . . 723 MET H . 6607 1 1304 . 1 1 109 109 MET HA H 1 4.27 0.02 . 1 . . . . 723 MET HA . 6607 1 1305 . 1 1 109 109 MET HB2 H 1 2.20 0.02 . 2 . . . . 723 MET HB2 . 6607 1 1306 . 1 1 109 109 MET HG2 H 1 2.61 0.02 . 2 . . . . 723 MET HG2 . 6607 1 1307 . 1 1 109 109 MET HG3 H 1 2.75 0.02 . 2 . . . . 723 MET HG3 . 6607 1 1308 . 1 1 109 109 MET C C 13 178.22 0.05 . 1 . . . . 723 MET C . 6607 1 1309 . 1 1 109 109 MET CA C 13 57.81 0.3 . 1 . . . . 723 MET CA . 6607 1 1310 . 1 1 109 109 MET CB C 13 32.65 0.3 . 1 . . . . 723 MET CB . 6607 1 1311 . 1 1 109 109 MET CG C 13 31.99 0.3 . 1 . . . . 723 MET CG . 6607 1 1312 . 1 1 109 109 MET N N 15 118.33 0.1 . 1 . . . . 723 MET N . 6607 1 1313 . 1 1 110 110 GLU H H 1 7.89 0.02 . 1 . . . . 724 GLU H . 6607 1 1314 . 1 1 110 110 GLU HA H 1 4.10 0.02 . 1 . . . . 724 GLU HA . 6607 1 1315 . 1 1 110 110 GLU HB2 H 1 2.10 0.02 . 1 . . . . 724 GLU HB2 . 6607 1 1316 . 1 1 110 110 GLU HB3 H 1 2.10 0.02 . 1 . . . . 724 GLU HB3 . 6607 1 1317 . 1 1 110 110 GLU HG2 H 1 2.50 0.02 . 1 . . . . 724 GLU HG2 . 6607 1 1318 . 1 1 110 110 GLU HG3 H 1 2.50 0.02 . 1 . . . . 724 GLU HG3 . 6607 1 1319 . 1 1 110 110 GLU C C 13 177.86 0.05 . 1 . . . . 724 GLU C . 6607 1 1320 . 1 1 110 110 GLU CA C 13 58.35 0.3 . 1 . . . . 724 GLU CA . 6607 1 1321 . 1 1 110 110 GLU CB C 13 29.70 0.3 . 1 . . . . 724 GLU CB . 6607 1 1322 . 1 1 110 110 GLU CG C 13 36.80 0.3 . 1 . . . . 724 GLU CG . 6607 1 1323 . 1 1 110 110 GLU N N 15 119.53 0.1 . 1 . . . . 724 GLU N . 6607 1 1324 . 1 1 111 111 LYS H H 1 7.84 0.02 . 1 . . . . 725 LYS H . 6607 1 1325 . 1 1 111 111 LYS HA H 1 4.06 0.02 . 1 . . . . 725 LYS HA . 6607 1 1326 . 1 1 111 111 LYS HB2 H 1 1.65 0.02 . 2 . . . . 725 LYS HB2 . 6607 1 1327 . 1 1 111 111 LYS HB3 H 1 1.76 0.02 . 2 . . . . 725 LYS HB3 . 6607 1 1328 . 1 1 111 111 LYS HG2 H 1 1.08 0.02 . 2 . . . . 725 LYS HG2 . 6607 1 1329 . 1 1 111 111 LYS HG3 H 1 1.26 0.02 . 2 . . . . 725 LYS HG3 . 6607 1 1330 . 1 1 111 111 LYS HD2 H 1 1.15 0.02 . 1 . . . . 725 LYS HD2 . 6607 1 1331 . 1 1 111 111 LYS HD3 H 1 1.15 0.02 . 1 . . . . 725 LYS HD3 . 6607 1 1332 . 1 1 111 111 LYS HE2 H 1 2.55 0.02 . 2 . . . . 725 LYS HE2 . 6607 1 1333 . 1 1 111 111 LYS HE3 H 1 3.17 0.02 . 2 . . . . 725 LYS HE3 . 6607 1 1334 . 1 1 111 111 LYS C C 13 177.28 0.05 . 1 . . . . 725 LYS C . 6607 1 1335 . 1 1 111 111 LYS CA C 13 57.88 0.3 . 1 . . . . 725 LYS CA . 6607 1 1336 . 1 1 111 111 LYS CB C 13 32.80 0.3 . 1 . . . . 725 LYS CB . 6607 1 1337 . 1 1 111 111 LYS CG C 13 29.22 0.3 . 1 . . . . 725 LYS CG . 6607 1 1338 . 1 1 111 111 LYS CD C 13 24.33 0.3 . 1 . . . . 725 LYS CD . 6607 1 1339 . 1 1 111 111 LYS CE C 13 41.75 0.3 . 1 . . . . 725 LYS CE . 6607 1 1340 . 1 1 111 111 LYS N N 15 120.39 0.1 . 1 . . . . 725 LYS N . 6607 1 1341 . 1 1 112 112 GLU H H 1 8.04 0.02 . 1 . . . . 726 GLU H . 6607 1 1342 . 1 1 112 112 GLU HA H 1 4.10 0.02 . 1 . . . . 726 GLU HA . 6607 1 1343 . 1 1 112 112 GLU HB2 H 1 2.03 0.02 . 1 . . . . 726 GLU HB2 . 6607 1 1344 . 1 1 112 112 GLU HB3 H 1 2.03 0.02 . 1 . . . . 726 GLU HB3 . 6607 1 1345 . 1 1 112 112 GLU HG2 H 1 2.20 0.02 . 2 . . . . 726 GLU HG2 . 6607 1 1346 . 1 1 112 112 GLU HG3 H 1 2.33 0.02 . 2 . . . . 726 GLU HG3 . 6607 1 1347 . 1 1 112 112 GLU C C 13 177.65 0.05 . 1 . . . . 726 GLU C . 6607 1 1348 . 1 1 112 112 GLU CA C 13 57.82 0.3 . 1 . . . . 726 GLU CA . 6607 1 1349 . 1 1 112 112 GLU CB C 13 29.85 0.3 . 1 . . . . 726 GLU CB . 6607 1 1350 . 1 1 112 112 GLU CG C 13 36.46 0.3 . 1 . . . . 726 GLU CG . 6607 1 1351 . 1 1 112 112 GLU N N 15 119.26 0.1 . 1 . . . . 726 GLU N . 6607 1 1352 . 1 1 113 113 ILE H H 1 7.90 0.02 . 1 . . . . 727 ILE H . 6607 1 1353 . 1 1 113 113 ILE HA H 1 4.00 0.02 . 1 . . . . 727 ILE HA . 6607 1 1354 . 1 1 113 113 ILE HB H 1 1.90 0.02 . 1 . . . . 727 ILE HB . 6607 1 1355 . 1 1 113 113 ILE HG12 H 1 1.20 0.02 . 2 . . . . 727 ILE HG12 . 6607 1 1356 . 1 1 113 113 ILE HG13 H 1 1.55 0.02 . 2 . . . . 727 ILE HG13 . 6607 1 1357 . 1 1 113 113 ILE HG21 H 1 0.90 0.02 . 1 . . . . 727 ILE HG2 . 6607 1 1358 . 1 1 113 113 ILE HG22 H 1 0.90 0.02 . 1 . . . . 727 ILE HG2 . 6607 1 1359 . 1 1 113 113 ILE HG23 H 1 0.90 0.02 . 1 . . . . 727 ILE HG2 . 6607 1 1360 . 1 1 113 113 ILE HD11 H 1 0.84 0.02 . 1 . . . . 727 ILE HD1 . 6607 1 1361 . 1 1 113 113 ILE HD12 H 1 0.84 0.02 . 1 . . . . 727 ILE HD1 . 6607 1 1362 . 1 1 113 113 ILE HD13 H 1 0.84 0.02 . 1 . . . . 727 ILE HD1 . 6607 1 1363 . 1 1 113 113 ILE C C 13 176.89 0.05 . 1 . . . . 727 ILE C . 6607 1 1364 . 1 1 113 113 ILE CA C 13 62.38 0.3 . 1 . . . . 727 ILE CA . 6607 1 1365 . 1 1 113 113 ILE CB C 13 38.43 0.3 . 1 . . . . 727 ILE CB . 6607 1 1366 . 1 1 113 113 ILE CG1 C 13 28.00 0.3 . 1 . . . . 727 ILE CG1 . 6607 1 1367 . 1 1 113 113 ILE CG2 C 13 17.53 0.3 . 1 . . . . 727 ILE CG2 . 6607 1 1368 . 1 1 113 113 ILE CD1 C 13 13.01 0.3 . 1 . . . . 727 ILE CD1 . 6607 1 1369 . 1 1 113 113 ILE N N 15 120.20 0.1 . 1 . . . . 727 ILE N . 6607 1 1370 . 1 1 114 114 LEU H H 1 8.00 0.02 . 1 . . . . 728 LEU H . 6607 1 1371 . 1 1 114 114 LEU HA H 1 4.33 0.02 . 1 . . . . 728 LEU HA . 6607 1 1372 . 1 1 114 114 LEU HB2 H 1 1.59 0.02 . 2 . . . . 728 LEU HB2 . 6607 1 1373 . 1 1 114 114 LEU HB3 H 1 1.67 0.02 . 2 . . . . 728 LEU HB3 . 6607 1 1374 . 1 1 114 114 LEU HG H 1 1.65 0.02 . 1 . . . . 728 LEU HG . 6607 1 1375 . 1 1 114 114 LEU HD11 H 1 0.91 0.02 . 2 . . . . 728 LEU HD1 . 6607 1 1376 . 1 1 114 114 LEU HD12 H 1 0.91 0.02 . 2 . . . . 728 LEU HD1 . 6607 1 1377 . 1 1 114 114 LEU HD13 H 1 0.91 0.02 . 2 . . . . 728 LEU HD1 . 6607 1 1378 . 1 1 114 114 LEU HD21 H 1 0.87 0.02 . 2 . . . . 728 LEU HD2 . 6607 1 1379 . 1 1 114 114 LEU HD22 H 1 0.87 0.02 . 2 . . . . 728 LEU HD2 . 6607 1 1380 . 1 1 114 114 LEU HD23 H 1 0.87 0.02 . 2 . . . . 728 LEU HD2 . 6607 1 1381 . 1 1 114 114 LEU C C 13 177.67 0.05 . 1 . . . . 728 LEU C . 6607 1 1382 . 1 1 114 114 LEU CA C 13 55.67 0.3 . 1 . . . . 728 LEU CA . 6607 1 1383 . 1 1 114 114 LEU CB C 13 42.18 0.3 . 1 . . . . 728 LEU CB . 6607 1 1384 . 1 1 114 114 LEU CG C 13 27.00 0.3 . 1 . . . . 728 LEU CG . 6607 1 1385 . 1 1 114 114 LEU CD1 C 13 24.29 0.3 . 2 . . . . 728 LEU CD1 . 6607 1 1386 . 1 1 114 114 LEU CD2 C 13 23.35 0.3 . 2 . . . . 728 LEU CD2 . 6607 1 1387 . 1 1 114 114 LEU N N 15 123.64 0.1 . 1 . . . . 728 LEU N . 6607 1 1388 . 1 1 115 115 GLU H H 1 8.10 0.02 . 1 . . . . 729 GLU H . 6607 1 1389 . 1 1 115 115 GLU HA H 1 4.27 0.02 . 1 . . . . 729 GLU HA . 6607 1 1390 . 1 1 115 115 GLU HB2 H 1 1.94 0.02 . 2 . . . . 729 GLU HB2 . 6607 1 1391 . 1 1 115 115 GLU HB3 H 1 2.06 0.02 . 2 . . . . 729 GLU HB3 . 6607 1 1392 . 1 1 115 115 GLU HG2 H 1 2.22 0.02 . 2 . . . . 729 GLU HG2 . 6607 1 1393 . 1 1 115 115 GLU HG3 H 1 2.33 0.02 . 2 . . . . 729 GLU HG3 . 6607 1 1394 . 1 1 115 115 GLU C C 13 175.48 0.05 . 1 . . . . 729 GLU C . 6607 1 1395 . 1 1 115 115 GLU CA C 13 56.61 0.3 . 1 . . . . 729 GLU CA . 6607 1 1396 . 1 1 115 115 GLU CB C 13 30.06 0.3 . 1 . . . . 729 GLU CB . 6607 1 1397 . 1 1 115 115 GLU CG C 13 36.43 0.3 . 1 . . . . 729 GLU CG . 6607 1 1398 . 1 1 115 115 GLU N N 15 120.77 0.1 . 1 . . . . 729 GLU N . 6607 1 1399 . 1 1 116 116 LYS H H 1 7.76 0.02 . 1 . . . . 730 LYS H . 6607 1 1400 . 1 1 116 116 LYS HA H 1 4.11 0.02 . 1 . . . . 730 LYS HA . 6607 1 1401 . 1 1 116 116 LYS HB2 H 1 1.75 0.02 . 2 . . . . 730 LYS HB2 . 6607 1 1402 . 1 1 116 116 LYS HB3 H 1 1.82 0.02 . 2 . . . . 730 LYS HB3 . 6607 1 1403 . 1 1 116 116 LYS HG2 H 1 1.67 0.02 . 1 . . . . 730 LYS HG2 . 6607 1 1404 . 1 1 116 116 LYS HG3 H 1 1.67 0.02 . 1 . . . . 730 LYS HG3 . 6607 1 1405 . 1 1 116 116 LYS HD2 H 1 1.41 0.02 . 1 . . . . 730 LYS HD2 . 6607 1 1406 . 1 1 116 116 LYS HD3 H 1 1.41 0.02 . 1 . . . . 730 LYS HD3 . 6607 1 1407 . 1 1 116 116 LYS HE2 H 1 2.98 0.02 . 1 . . . . 730 LYS HE2 . 6607 1 1408 . 1 1 116 116 LYS HE3 H 1 2.98 0.02 . 1 . . . . 730 LYS HE3 . 6607 1 1409 . 1 1 116 116 LYS C C 13 181.44 0.05 . 1 . . . . 730 LYS C . 6607 1 1410 . 1 1 116 116 LYS CA C 13 57.94 0.3 . 1 . . . . 730 LYS CA . 6607 1 1411 . 1 1 116 116 LYS CB C 13 33.66 0.3 . 1 . . . . 730 LYS CB . 6607 1 1412 . 1 1 116 116 LYS CG C 13 29.28 0.3 . 1 . . . . 730 LYS CG . 6607 1 1413 . 1 1 116 116 LYS CD C 13 24.82 0.3 . 1 . . . . 730 LYS CD . 6607 1 1414 . 1 1 116 116 LYS CE C 13 42.21 0.3 . 1 . . . . 730 LYS CE . 6607 1 1415 . 1 1 116 116 LYS N N 15 127.01 0.1 . 1 . . . . 730 LYS N . 6607 1 stop_ save_