data_17585 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17585 _Entry.Title ; Rv0020c_Nter structure ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2011-04-11 _Entry.Accession_date 2011-04-11 _Entry.Last_release_date 2011-10-26 _Entry.Original_release_date 2011-10-26 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Philippe Barthe . P. . 17585 2 Martin Cohen-Gonsaud . M. . 17585 3 Christian Roumestand . C. . 17585 stop_ loop_ _SG_project.SG_project_ID _SG_project.Project_name _SG_project.Full_name_of_center _SG_project.Initial_of_center _SG_project.Entry_ID 1 'not applicable' 'not applicable' . 17585 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID PROTEIN . 17585 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17585 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 342 17585 '15N chemical shifts' 140 17585 '1H chemical shifts' 844 17585 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2011-10-26 2011-04-11 original author . 17585 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID BMRB 17586 'Rv0020c_FHA Structure' 17585 PDB 2LC0 'BMRB Entry Tracking System' 17585 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17585 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 22000520 _Citation.Full_citation . _Citation.Title 'Structural Insight into the Mycobacterium tuberculosis Rv0020c Protein and Its Interaction with the PknB Kinase.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev Structure _Citation.Journal_name_full 'Structure (London, England : 1993)' _Citation.Journal_volume 19 _Citation.Journal_issue 10 _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 1525 _Citation.Page_last 1534 _Citation.Year 2011 _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 Christian Roumestand . . . 17585 1 2 Jade Leiba . . . 17585 1 3 Nathalie Galophe . . . 17585 1 4 Emmanuel Margeat . . . 17585 1 5 Andre Padilla . . . 17585 1 6 Yannick Bessin . . . 17585 1 7 Philippe Barthe . . . 17585 1 8 Virginie Molle . . . 17585 1 9 Martin Cohen-Gonsaud . . . 17585 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17585 _Assembly.ID 1 _Assembly.Name Rv0020c_Nter _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 Rv0020c_Nter 1 $entity A . yes native no no . . . 17585 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity _Entity.Sf_category entity _Entity.Sf_framecode entity _Entity.Entry_ID 17585 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Rv0020c_Nter _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MGSQKRLVQRVERKLEQTVG DAFARIFGGSIVPQEVEALL RREAADGIQSLQGNRLLAPN EYIITLGVHDFEKLGADPEL KSTGFARDLADYIQEQGWQT YGDVVVRFEQSSNLHTGQFR ARGTVNPDVETH ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 132 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 14773.583 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 2LC0 . "Rv0020c_nter Structure" . . . . . 100.00 132 100.00 100.00 4.32e-90 . . . . 17585 1 2 no DBJ BAH24322 . "hypothetical protein JTY_0020 [Mycobacterium bovis BCG str. Tokyo 172]" . . . . . 100.00 521 100.00 100.00 6.50e-86 . . . . 17585 1 3 no DBJ BAL63843 . "hypothetical protein ERDMAN_0025 [Mycobacterium tuberculosis str. Erdman = ATCC 35801]" . . . . . 100.00 521 100.00 100.00 6.64e-86 . . . . 17585 1 4 no DBJ BAQ03850 . "hypothetical protein KURONO_0028 [Mycobacterium tuberculosis str. Kurono]" . . . . . 100.00 527 100.00 100.00 8.87e-86 . . . . 17585 1 5 no EMBL CAL70034 . "Conserved hypothetical protein TB39.8 [Mycobacterium bovis BCG str. Pasteur 1173P2]" . . . . . 100.00 521 100.00 100.00 6.50e-86 . . . . 17585 1 6 no EMBL CCC25094 . "putative uncharacterized protein [Mycobacterium africanum GM041182]" . . . . . 100.00 521 100.00 100.00 6.16e-86 . . . . 17585 1 7 no EMBL CCC42360 . "conserved hypothetical protein TB39.8 [Mycobacterium canettii CIPT 140010059]" . . . . . 100.00 521 100.00 100.00 6.03e-86 . . . . 17585 1 8 no EMBL CCC62613 . "conserved hypothetical protein TB39.8 [Mycobacterium bovis BCG str. Moreau RDJ]" . . . . . 100.00 521 100.00 100.00 6.50e-86 . . . . 17585 1 9 no EMBL CCE35563 . "TB39.8 [Mycobacterium tuberculosis UT205]" . . . . . 100.00 527 100.00 100.00 8.87e-86 . . . . 17585 1 10 no GB AAK44245 . "conserved hypothetical protein [Mycobacterium tuberculosis CDC1551]" . . . . . 100.00 521 100.00 100.00 6.64e-86 . . . . 17585 1 11 no GB ABQ71740 . "hypothetical protein MRA_0022 [Mycobacterium tuberculosis H37Ra]" . . . . . 100.00 527 100.00 100.00 8.87e-86 . . . . 17585 1 12 no GB ABR04363 . "conserved hypothetical protein TB39.8 [Mycobacterium tuberculosis F11]" . . . . . 100.00 527 100.00 100.00 8.87e-86 . . . . 17585 1 13 no GB ACT23041 . "conserved hypothetical protein [Mycobacterium tuberculosis KZN 1435]" . . . . . 100.00 527 100.00 100.00 8.87e-86 . . . . 17585 1 14 no GB AEB02149 . "conserved hypothetical protein [Mycobacterium tuberculosis KZN 4207]" . . . . . 100.00 527 100.00 100.00 8.87e-86 . . . . 17585 1 15 no REF NP_214534 . "FHA domain-containing protein FhaA [Mycobacterium tuberculosis H37Rv]" . . . . . 100.00 527 100.00 100.00 8.87e-86 . . . . 17585 1 16 no REF NP_853690 . "hypothetical protein Mb0020c [Mycobacterium bovis AF2122/97]" . . . . . 100.00 521 99.24 99.24 2.26e-84 . . . . 17585 1 17 no REF WP_003400376 . "MULTISPECIES: hypothetical protein [Mycobacterium tuberculosis complex]" . . . . . 100.00 521 100.00 100.00 6.16e-86 . . . . 17585 1 18 no REF WP_003899777 . "MULTISPECIES: hypothetical protein [Mycobacterium tuberculosis complex]" . . . . . 100.00 521 100.00 100.00 6.64e-86 . . . . 17585 1 19 no REF WP_003905210 . "hypothetical protein [Mycobacterium tuberculosis]" . . . . . 100.00 521 99.24 100.00 2.46e-85 . . . . 17585 1 20 no SP P71590 . "RecName: Full=FHA domain-containing protein FhaA" . . . . . 100.00 527 100.00 100.00 8.87e-86 . . . . 17585 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 . MET . 17585 1 2 . GLY . 17585 1 3 . SER . 17585 1 4 . GLN . 17585 1 5 . LYS . 17585 1 6 . ARG . 17585 1 7 . LEU . 17585 1 8 . VAL . 17585 1 9 . GLN . 17585 1 10 . ARG . 17585 1 11 . VAL . 17585 1 12 . GLU . 17585 1 13 . ARG . 17585 1 14 . LYS . 17585 1 15 . LEU . 17585 1 16 . GLU . 17585 1 17 . GLN . 17585 1 18 . THR . 17585 1 19 . VAL . 17585 1 20 . GLY . 17585 1 21 . ASP . 17585 1 22 . ALA . 17585 1 23 . PHE . 17585 1 24 . ALA . 17585 1 25 . ARG . 17585 1 26 . ILE . 17585 1 27 . PHE . 17585 1 28 . GLY . 17585 1 29 . GLY . 17585 1 30 . SER . 17585 1 31 . ILE . 17585 1 32 . VAL . 17585 1 33 . PRO . 17585 1 34 . GLN . 17585 1 35 . GLU . 17585 1 36 . VAL . 17585 1 37 . GLU . 17585 1 38 . ALA . 17585 1 39 . LEU . 17585 1 40 . LEU . 17585 1 41 . ARG . 17585 1 42 . ARG . 17585 1 43 . GLU . 17585 1 44 . ALA . 17585 1 45 . ALA . 17585 1 46 . ASP . 17585 1 47 . GLY . 17585 1 48 . ILE . 17585 1 49 . GLN . 17585 1 50 . SER . 17585 1 51 . LEU . 17585 1 52 . GLN . 17585 1 53 . GLY . 17585 1 54 . ASN . 17585 1 55 . ARG . 17585 1 56 . LEU . 17585 1 57 . LEU . 17585 1 58 . ALA . 17585 1 59 . PRO . 17585 1 60 . ASN . 17585 1 61 . GLU . 17585 1 62 . TYR . 17585 1 63 . ILE . 17585 1 64 . ILE . 17585 1 65 . THR . 17585 1 66 . LEU . 17585 1 67 . GLY . 17585 1 68 . VAL . 17585 1 69 . HIS . 17585 1 70 . ASP . 17585 1 71 . PHE . 17585 1 72 . GLU . 17585 1 73 . LYS . 17585 1 74 . LEU . 17585 1 75 . GLY . 17585 1 76 . ALA . 17585 1 77 . ASP . 17585 1 78 . PRO . 17585 1 79 . GLU . 17585 1 80 . LEU . 17585 1 81 . LYS . 17585 1 82 . SER . 17585 1 83 . THR . 17585 1 84 . GLY . 17585 1 85 . PHE . 17585 1 86 . ALA . 17585 1 87 . ARG . 17585 1 88 . ASP . 17585 1 89 . LEU . 17585 1 90 . ALA . 17585 1 91 . ASP . 17585 1 92 . TYR . 17585 1 93 . ILE . 17585 1 94 . GLN . 17585 1 95 . GLU . 17585 1 96 . GLN . 17585 1 97 . GLY . 17585 1 98 . TRP . 17585 1 99 . GLN . 17585 1 100 . THR . 17585 1 101 . TYR . 17585 1 102 . GLY . 17585 1 103 . ASP . 17585 1 104 . VAL . 17585 1 105 . VAL . 17585 1 106 . VAL . 17585 1 107 . ARG . 17585 1 108 . PHE . 17585 1 109 . GLU . 17585 1 110 . GLN . 17585 1 111 . SER . 17585 1 112 . SER . 17585 1 113 . ASN . 17585 1 114 . LEU . 17585 1 115 . HIS . 17585 1 116 . THR . 17585 1 117 . GLY . 17585 1 118 . GLN . 17585 1 119 . PHE . 17585 1 120 . ARG . 17585 1 121 . ALA . 17585 1 122 . ARG . 17585 1 123 . GLY . 17585 1 124 . THR . 17585 1 125 . VAL . 17585 1 126 . ASN . 17585 1 127 . PRO . 17585 1 128 . ASP . 17585 1 129 . VAL . 17585 1 130 . GLU . 17585 1 131 . THR . 17585 1 132 . HIS . 17585 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 . MET 1 1 17585 1 . GLY 2 2 17585 1 . SER 3 3 17585 1 . GLN 4 4 17585 1 . LYS 5 5 17585 1 . ARG 6 6 17585 1 . LEU 7 7 17585 1 . VAL 8 8 17585 1 . GLN 9 9 17585 1 . ARG 10 10 17585 1 . VAL 11 11 17585 1 . GLU 12 12 17585 1 . ARG 13 13 17585 1 . LYS 14 14 17585 1 . LEU 15 15 17585 1 . GLU 16 16 17585 1 . GLN 17 17 17585 1 . THR 18 18 17585 1 . VAL 19 19 17585 1 . GLY 20 20 17585 1 . ASP 21 21 17585 1 . ALA 22 22 17585 1 . PHE 23 23 17585 1 . ALA 24 24 17585 1 . ARG 25 25 17585 1 . ILE 26 26 17585 1 . PHE 27 27 17585 1 . GLY 28 28 17585 1 . GLY 29 29 17585 1 . SER 30 30 17585 1 . ILE 31 31 17585 1 . VAL 32 32 17585 1 . PRO 33 33 17585 1 . GLN 34 34 17585 1 . GLU 35 35 17585 1 . VAL 36 36 17585 1 . GLU 37 37 17585 1 . ALA 38 38 17585 1 . LEU 39 39 17585 1 . LEU 40 40 17585 1 . ARG 41 41 17585 1 . ARG 42 42 17585 1 . GLU 43 43 17585 1 . ALA 44 44 17585 1 . ALA 45 45 17585 1 . ASP 46 46 17585 1 . GLY 47 47 17585 1 . ILE 48 48 17585 1 . GLN 49 49 17585 1 . SER 50 50 17585 1 . LEU 51 51 17585 1 . GLN 52 52 17585 1 . GLY 53 53 17585 1 . ASN 54 54 17585 1 . ARG 55 55 17585 1 . LEU 56 56 17585 1 . LEU 57 57 17585 1 . ALA 58 58 17585 1 . PRO 59 59 17585 1 . ASN 60 60 17585 1 . GLU 61 61 17585 1 . TYR 62 62 17585 1 . ILE 63 63 17585 1 . ILE 64 64 17585 1 . THR 65 65 17585 1 . LEU 66 66 17585 1 . GLY 67 67 17585 1 . VAL 68 68 17585 1 . HIS 69 69 17585 1 . ASP 70 70 17585 1 . PHE 71 71 17585 1 . GLU 72 72 17585 1 . LYS 73 73 17585 1 . LEU 74 74 17585 1 . GLY 75 75 17585 1 . ALA 76 76 17585 1 . ASP 77 77 17585 1 . PRO 78 78 17585 1 . GLU 79 79 17585 1 . LEU 80 80 17585 1 . LYS 81 81 17585 1 . SER 82 82 17585 1 . THR 83 83 17585 1 . GLY 84 84 17585 1 . PHE 85 85 17585 1 . ALA 86 86 17585 1 . ARG 87 87 17585 1 . ASP 88 88 17585 1 . LEU 89 89 17585 1 . ALA 90 90 17585 1 . ASP 91 91 17585 1 . TYR 92 92 17585 1 . ILE 93 93 17585 1 . GLN 94 94 17585 1 . GLU 95 95 17585 1 . GLN 96 96 17585 1 . GLY 97 97 17585 1 . TRP 98 98 17585 1 . GLN 99 99 17585 1 . THR 100 100 17585 1 . TYR 101 101 17585 1 . GLY 102 102 17585 1 . ASP 103 103 17585 1 . VAL 104 104 17585 1 . VAL 105 105 17585 1 . VAL 106 106 17585 1 . ARG 107 107 17585 1 . PHE 108 108 17585 1 . GLU 109 109 17585 1 . GLN 110 110 17585 1 . SER 111 111 17585 1 . SER 112 112 17585 1 . ASN 113 113 17585 1 . LEU 114 114 17585 1 . HIS 115 115 17585 1 . THR 116 116 17585 1 . GLY 117 117 17585 1 . GLN 118 118 17585 1 . PHE 119 119 17585 1 . ARG 120 120 17585 1 . ALA 121 121 17585 1 . ARG 122 122 17585 1 . GLY 123 123 17585 1 . THR 124 124 17585 1 . VAL 125 125 17585 1 . ASN 126 126 17585 1 . PRO 127 127 17585 1 . ASP 128 128 17585 1 . VAL 129 129 17585 1 . GLU 130 130 17585 1 . THR 131 131 17585 1 . HIS 132 132 17585 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 17585 _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 $entity . 1773 organism . 'Mycobacterium tuberculosis' 'Mycobacterium tuberculosis' . . Bacteria . Mycobacterium tuberculosis H37rv . . . . . . . . . . . . . . . rv0020c . . . . 17585 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 17585 _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 $entity . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . pET15b-tev . . . . . . 17585 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_15N _Sample.Sf_category sample _Sample.Sf_framecode 15N _Sample.Entry_ID 17585 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details Rv0020c_Nter _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Rv0020c_Nter [U-15N] . . 1 $entity . . 0.5 . . mM 0.01 . . . 17585 1 stop_ save_ save_13C-15N _Sample.Sf_category sample _Sample.Sf_framecode 13C-15N _Sample.Entry_ID 17585 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details Rv0020c_Nter _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 Rv0020c_Nter '[U-13C; U-15N]' . . 1 $entity . . 0.5 . . mM 0.01 . . . 17585 2 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 17585 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 100 1 mM 17585 1 pH 6.8 0.1 pH 17585 1 pressure 1 . atm 17585 1 temperature 293 0.1 K 17585 1 stop_ save_ ############################ # Computer software used # ############################ save_GIFA _Software.Sf_category software _Software.Sf_framecode GIFA _Software.Entry_ID 17585 _Software.ID 1 _Software.Name GIFA _Software.Version 4.44 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Delsuc . . 17585 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 17585 1 stop_ save_ save_CYANA _Software.Sf_category software _Software.Sf_framecode CYANA _Software.Entry_ID 17585 _Software.ID 2 _Software.Name CYANA _Software.Version 2.1 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 17585 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'structure solution' 17585 2 stop_ save_ save_CNS _Software.Sf_category software _Software.Sf_framecode CNS _Software.Entry_ID 17585 _Software.ID 3 _Software.Name CNS _Software.Version 1.2 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Gros, Nilges and Read' . . 17585 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID refinement 17585 3 stop_ save_ save_TALOS+ _Software.Sf_category software _Software.Sf_framecode TALOS+ _Software.Entry_ID 17585 _Software.ID 4 _Software.Name TALOS+ _Software.Version 1.2009.0721.18 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Cornilescu, Delaglio and Bax' . . 17585 4 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'angle prediction' 17585 4 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_1 _NMR_spectrometer.Entry_ID 17585 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 17585 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 17585 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 700 . . . 17585 1 2 spectrometer_2 Bruker Avance . 500 . . . 17585 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 17585 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $15N isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17585 1 2 '3D 1H-15N TOCSY' no . . . . . . . . . . 1 $15N isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17585 1 3 '3D HNCA' no . . . . . . . . . . 2 $13C-15N isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17585 1 4 '3D CBCA(CO)NH' no . . . . . . . . . . 2 $13C-15N isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17585 1 5 '3D HNCACB' no . . . . . . . . . . 2 $13C-15N isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17585 1 6 '3D HNCO' no . . . . . . . . . . 2 $13C-15N isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17585 1 7 '3D HCACO' no . . . . . . . . . . 2 $13C-15N isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 17585 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 17585 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 17585 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17585 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 17585 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 17585 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-15N NOESY' . . . 17585 1 3 '3D HNCA' . . . 17585 1 6 '3D HNCO' . . . 17585 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 MET HA H 1 4.503 0.000 . 1 . . . A 1 MET HA . 17585 1 2 . 1 1 1 1 MET HB2 H 1 2.002 0.000 . 2 . . . A 1 MET HB2 . 17585 1 3 . 1 1 1 1 MET HB3 H 1 2.118 0.000 . 2 . . . A 1 MET HB3 . 17585 1 4 . 1 1 1 1 MET HG2 H 1 2.545 0.000 . 2 . . . A 1 MET HG2 . 17585 1 5 . 1 1 1 1 MET HG3 H 1 2.606 0.000 . 2 . . . A 1 MET HG3 . 17585 1 6 . 1 1 1 1 MET H H 1 8.457 0.000 . 1 . . . A 1 MET H1 . 17585 1 7 . 1 1 1 1 MET C C 13 176.680 0.000 . 1 . . . A 1 MET C . 17585 1 8 . 1 1 1 1 MET CA C 13 55.910 0.000 . 1 . . . A 1 MET CA . 17585 1 9 . 1 1 1 1 MET CB C 13 33.090 0.000 . 1 . . . A 1 MET CB . 17585 1 10 . 1 1 1 1 MET N N 15 122.030 0.000 . 1 . . . A 1 MET N . 17585 1 11 . 1 1 2 2 GLY H H 1 8.468 0.000 . 1 . . . A 2 GLY H . 17585 1 12 . 1 1 2 2 GLY HA2 H 1 4.041 0.000 . 2 . . . A 2 GLY HA2 . 17585 1 13 . 1 1 2 2 GLY HA3 H 1 4.041 0.000 . 2 . . . A 2 GLY HA3 . 17585 1 14 . 1 1 2 2 GLY C C 13 174.260 0.000 . 1 . . . A 2 GLY C . 17585 1 15 . 1 1 2 2 GLY CA C 13 45.460 0.000 . 1 . . . A 2 GLY CA . 17585 1 16 . 1 1 2 2 GLY N N 15 110.590 0.000 . 1 . . . A 2 GLY N . 17585 1 17 . 1 1 3 3 SER H H 1 8.235 0.000 . 1 . . . A 3 SER H . 17585 1 18 . 1 1 3 3 SER HA H 1 4.463 0.000 . 1 . . . A 3 SER HA . 17585 1 19 . 1 1 3 3 SER HB2 H 1 3.895 0.000 . 2 . . . A 3 SER HB2 . 17585 1 20 . 1 1 3 3 SER HB3 H 1 3.895 0.000 . 2 . . . A 3 SER HB3 . 17585 1 21 . 1 1 3 3 SER C C 13 174.820 0.000 . 1 . . . A 3 SER C . 17585 1 22 . 1 1 3 3 SER CA C 13 58.630 0.000 . 1 . . . A 3 SER CA . 17585 1 23 . 1 1 3 3 SER CB C 13 64.220 0.000 . 1 . . . A 3 SER CB . 17585 1 24 . 1 1 3 3 SER N N 15 115.520 0.000 . 1 . . . A 3 SER N . 17585 1 25 . 1 1 4 4 GLN H H 1 8.445 0.000 . 1 . . . A 4 GLN H . 17585 1 26 . 1 1 4 4 GLN HA H 1 4.373 0.000 . 1 . . . A 4 GLN HA . 17585 1 27 . 1 1 4 4 GLN HB2 H 1 2.011 0.000 . 2 . . . A 4 GLN HB2 . 17585 1 28 . 1 1 4 4 GLN HB3 H 1 2.146 0.000 . 2 . . . A 4 GLN HB3 . 17585 1 29 . 1 1 4 4 GLN HG2 H 1 2.389 0.000 . 2 . . . A 4 GLN HG2 . 17585 1 30 . 1 1 4 4 GLN HG3 H 1 2.389 0.000 . 2 . . . A 4 GLN HG3 . 17585 1 31 . 1 1 4 4 GLN C C 13 176.130 0.000 . 1 . . . A 4 GLN C . 17585 1 32 . 1 1 4 4 GLN CA C 13 56.150 0.000 . 1 . . . A 4 GLN CA . 17585 1 33 . 1 1 4 4 GLN CB C 13 29.740 0.000 . 1 . . . A 4 GLN CB . 17585 1 34 . 1 1 4 4 GLN N N 15 122.370 0.000 . 1 . . . A 4 GLN N . 17585 1 35 . 1 1 5 5 LYS H H 1 8.277 0.000 . 1 . . . A 5 LYS H . 17585 1 36 . 1 1 5 5 LYS HA H 1 4.344 0.000 . 1 . . . A 5 LYS HA . 17585 1 37 . 1 1 5 5 LYS HB3 H 1 1.830 0.000 . 2 . . . A 5 LYS HB3 . 17585 1 38 . 1 1 5 5 LYS HG3 H 1 1.619 0.000 . 2 . . . A 5 LYS HG3 . 17585 1 39 . 1 1 5 5 LYS HD3 H 1 1.756 0.000 . 2 . . . A 5 LYS HD3 . 17585 1 40 . 1 1 5 5 LYS HE3 H 1 3.214 0.000 . 2 . . . A 5 LYS HE3 . 17585 1 41 . 1 1 5 5 LYS CA C 13 56.620 0.000 . 1 . . . A 5 LYS CA . 17585 1 42 . 1 1 5 5 LYS CB C 13 30.980 0.000 . 1 . . . A 5 LYS CB . 17585 1 43 . 1 1 5 5 LYS N N 15 122.710 0.000 . 1 . . . A 5 LYS N . 17585 1 44 . 1 1 6 6 ARG H H 1 8.360 0.000 . 1 . . . A 6 ARG H . 17585 1 45 . 1 1 6 6 ARG HA H 1 4.325 0.000 . 1 . . . A 6 ARG HA . 17585 1 46 . 1 1 6 6 ARG HB2 H 1 1.756 0.000 . 2 . . . A 6 ARG HB2 . 17585 1 47 . 1 1 6 6 ARG HB3 H 1 1.840 0.000 . 2 . . . A 6 ARG HB3 . 17585 1 48 . 1 1 6 6 ARG HG2 H 1 1.626 0.000 . 2 . . . A 6 ARG HG2 . 17585 1 49 . 1 1 6 6 ARG HG3 H 1 1.626 0.000 . 2 . . . A 6 ARG HG3 . 17585 1 50 . 1 1 6 6 ARG HD2 H 1 3.207 0.000 . 2 . . . A 6 ARG HD2 . 17585 1 51 . 1 1 6 6 ARG HD3 H 1 3.207 0.000 . 2 . . . A 6 ARG HD3 . 17585 1 52 . 1 1 6 6 ARG C C 13 175.980 0.000 . 1 . . . A 6 ARG C . 17585 1 53 . 1 1 6 6 ARG CA C 13 56.200 0.000 . 1 . . . A 6 ARG CA . 17585 1 54 . 1 1 6 6 ARG CB C 13 31.120 0.000 . 1 . . . A 6 ARG CB . 17585 1 55 . 1 1 6 6 ARG N N 15 122.610 0.000 . 1 . . . A 6 ARG N . 17585 1 56 . 1 1 7 7 LEU H H 1 8.280 0.000 . 1 . . . A 7 LEU H . 17585 1 57 . 1 1 7 7 LEU HA H 1 4.394 0.000 . 1 . . . A 7 LEU HA . 17585 1 58 . 1 1 7 7 LEU HB2 H 1 1.618 0.000 . 2 . . . A 7 LEU HB2 . 17585 1 59 . 1 1 7 7 LEU HB3 H 1 1.618 0.000 . 2 . . . A 7 LEU HB3 . 17585 1 60 . 1 1 7 7 LEU HG H 1 1.618 0.000 . 1 . . . A 7 LEU HG . 17585 1 61 . 1 1 7 7 LEU HD11 H 1 0.891 0.000 . . . . . A 7 LEU HD11 . 17585 1 62 . 1 1 7 7 LEU HD12 H 1 0.891 0.000 . . . . . A 7 LEU HD12 . 17585 1 63 . 1 1 7 7 LEU HD13 H 1 0.891 0.000 . . . . . A 7 LEU HD13 . 17585 1 64 . 1 1 7 7 LEU HD21 H 1 0.891 0.000 . . . . . A 7 LEU HD21 . 17585 1 65 . 1 1 7 7 LEU HD22 H 1 0.891 0.000 . . . . . A 7 LEU HD22 . 17585 1 66 . 1 1 7 7 LEU HD23 H 1 0.891 0.000 . . . . . A 7 LEU HD23 . 17585 1 67 . 1 1 7 7 LEU C C 13 177.100 0.000 . 1 . . . A 7 LEU C . 17585 1 68 . 1 1 7 7 LEU CA C 13 55.340 0.000 . 1 . . . A 7 LEU CA . 17585 1 69 . 1 1 7 7 LEU CB C 13 42.540 0.000 . 1 . . . A 7 LEU CB . 17585 1 70 . 1 1 7 7 LEU N N 15 124.340 0.000 . 1 . . . A 7 LEU N . 17585 1 71 . 1 1 8 8 VAL H H 1 8.079 0.000 . 1 . . . A 8 VAL H . 17585 1 72 . 1 1 8 8 VAL HA H 1 4.104 0.000 . 1 . . . A 8 VAL HA . 17585 1 73 . 1 1 8 8 VAL HB H 1 2.055 0.000 . 1 . . . A 8 VAL HB . 17585 1 74 . 1 1 8 8 VAL HG11 H 1 0.933 0.000 . . . . . A 8 VAL HG11 . 17585 1 75 . 1 1 8 8 VAL HG12 H 1 0.933 0.000 . . . . . A 8 VAL HG12 . 17585 1 76 . 1 1 8 8 VAL HG13 H 1 0.933 0.000 . . . . . A 8 VAL HG13 . 17585 1 77 . 1 1 8 8 VAL HG21 H 1 0.933 0.000 . . . . . A 8 VAL HG21 . 17585 1 78 . 1 1 8 8 VAL HG22 H 1 0.933 0.000 . . . . . A 8 VAL HG22 . 17585 1 79 . 1 1 8 8 VAL HG23 H 1 0.933 0.000 . . . . . A 8 VAL HG23 . 17585 1 80 . 1 1 8 8 VAL C C 13 175.960 0.000 . 1 . . . A 8 VAL C . 17585 1 81 . 1 1 8 8 VAL CA C 13 62.460 0.000 . 1 . . . A 8 VAL CA . 17585 1 82 . 1 1 8 8 VAL CB C 13 33.090 0.000 . 1 . . . A 8 VAL CB . 17585 1 83 . 1 1 8 8 VAL N N 15 121.580 0.000 . 1 . . . A 8 VAL N . 17585 1 84 . 1 1 9 9 GLN H H 1 8.395 0.000 . 1 . . . A 9 GLN H . 17585 1 85 . 1 1 9 9 GLN HA H 1 4.368 0.000 . 1 . . . A 9 GLN HA . 17585 1 86 . 1 1 9 9 GLN HB2 H 1 1.975 0.000 . 2 . . . A 9 GLN HB2 . 17585 1 87 . 1 1 9 9 GLN HB3 H 1 2.075 0.000 . 2 . . . A 9 GLN HB3 . 17585 1 88 . 1 1 9 9 GLN HG2 H 1 2.345 0.000 . 2 . . . A 9 GLN HG2 . 17585 1 89 . 1 1 9 9 GLN HG3 H 1 2.345 0.000 . 2 . . . A 9 GLN HG3 . 17585 1 90 . 1 1 9 9 GLN CA C 13 55.890 0.000 . 1 . . . A 9 GLN CA . 17585 1 91 . 1 1 9 9 GLN N N 15 124.600 0.000 . 1 . . . A 9 GLN N . 17585 1 92 . 1 1 10 10 ARG H H 1 8.369 0.000 . 1 . . . A 10 ARG H . 17585 1 93 . 1 1 10 10 ARG HA H 1 4.363 0.000 . 1 . . . A 10 ARG HA . 17585 1 94 . 1 1 10 10 ARG HB2 H 1 1.759 0.000 . 2 . . . A 10 ARG HB2 . 17585 1 95 . 1 1 10 10 ARG HB3 H 1 1.832 0.000 . 2 . . . A 10 ARG HB3 . 17585 1 96 . 1 1 10 10 ARG HG2 H 1 1.584 0.000 . 2 . . . A 10 ARG HG2 . 17585 1 97 . 1 1 10 10 ARG HG3 H 1 1.619 0.000 . 2 . . . A 10 ARG HG3 . 17585 1 98 . 1 1 10 10 ARG HD2 H 1 3.209 0.000 . 2 . . . A 10 ARG HD2 . 17585 1 99 . 1 1 10 10 ARG HD3 H 1 3.209 0.000 . 2 . . . A 10 ARG HD3 . 17585 1 100 . 1 1 10 10 ARG HE H 1 7.240 0.000 . 1 . . . A 10 ARG HE . 17585 1 101 . 1 1 10 10 ARG C C 13 176.060 0.000 . 1 . . . A 10 ARG C . 17585 1 102 . 1 1 10 10 ARG CA C 13 56.670 0.000 . 1 . . . A 10 ARG CA . 17585 1 103 . 1 1 10 10 ARG CB C 13 31.200 0.000 . 1 . . . A 10 ARG CB . 17585 1 104 . 1 1 10 10 ARG N N 15 123.450 0.000 . 1 . . . A 10 ARG N . 17585 1 105 . 1 1 10 10 ARG NE N 15 84.990 0.000 . 1 . . . A 10 ARG NE . 17585 1 106 . 1 1 11 11 VAL H H 1 8.210 0.000 . 1 . . . A 11 VAL H . 17585 1 107 . 1 1 11 11 VAL HA H 1 4.115 0.000 . 1 . . . A 11 VAL HA . 17585 1 108 . 1 1 11 11 VAL HB H 1 2.051 0.000 . 1 . . . A 11 VAL HB . 17585 1 109 . 1 1 11 11 VAL HG11 H 1 0.933 0.000 . . . . . A 11 VAL HG11 . 17585 1 110 . 1 1 11 11 VAL HG12 H 1 0.933 0.000 . . . . . A 11 VAL HG12 . 17585 1 111 . 1 1 11 11 VAL HG13 H 1 0.933 0.000 . . . . . A 11 VAL HG13 . 17585 1 112 . 1 1 11 11 VAL HG21 H 1 0.933 0.000 . . . . . A 11 VAL HG21 . 17585 1 113 . 1 1 11 11 VAL HG22 H 1 0.933 0.000 . . . . . A 11 VAL HG22 . 17585 1 114 . 1 1 11 11 VAL HG23 H 1 0.933 0.000 . . . . . A 11 VAL HG23 . 17585 1 115 . 1 1 11 11 VAL C C 13 175.980 0.000 . 1 . . . A 11 VAL C . 17585 1 116 . 1 1 11 11 VAL CA C 13 62.510 0.000 . 1 . . . A 11 VAL CA . 17585 1 117 . 1 1 11 11 VAL CB C 13 33.090 0.000 . 1 . . . A 11 VAL CB . 17585 1 118 . 1 1 11 11 VAL N N 15 122.280 0.000 . 1 . . . A 11 VAL N . 17585 1 119 . 1 1 12 12 GLU H H 1 8.495 0.000 . 1 . . . A 12 GLU H . 17585 1 120 . 1 1 12 12 GLU HA H 1 4.330 0.000 . 1 . . . A 12 GLU HA . 17585 1 121 . 1 1 12 12 GLU HB2 H 1 1.940 0.000 . 2 . . . A 12 GLU HB2 . 17585 1 122 . 1 1 12 12 GLU HB3 H 1 2.045 0.000 . 2 . . . A 12 GLU HB3 . 17585 1 123 . 1 1 12 12 GLU HG2 H 1 2.202 0.000 . 2 . . . A 12 GLU HG2 . 17585 1 124 . 1 1 12 12 GLU HG3 H 1 2.285 0.000 . 2 . . . A 12 GLU HG3 . 17585 1 125 . 1 1 12 12 GLU CA C 13 56.400 0.000 . 1 . . . A 12 GLU CA . 17585 1 126 . 1 1 12 12 GLU N N 15 125.400 0.000 . 1 . . . A 12 GLU N . 17585 1 127 . 1 1 14 14 LYS C C 13 176.590 0.000 . 1 . . . A 14 LYS C . 17585 1 128 . 1 1 14 14 LYS CA C 13 56.650 0.000 . 1 . . . A 14 LYS CA . 17585 1 129 . 1 1 14 14 LYS CB C 13 33.200 0.000 . 1 . . . A 14 LYS CB . 17585 1 130 . 1 1 15 15 LEU H H 1 8.282 0.000 . 1 . . . A 15 LEU H . 17585 1 131 . 1 1 15 15 LEU HA H 1 4.335 0.000 . 1 . . . A 15 LEU HA . 17585 1 132 . 1 1 15 15 LEU HB2 H 1 1.622 0.000 . 2 . . . A 15 LEU HB2 . 17585 1 133 . 1 1 15 15 LEU HB3 H 1 1.622 0.000 . 2 . . . A 15 LEU HB3 . 17585 1 134 . 1 1 15 15 LEU HG H 1 1.622 0.000 . 1 . . . A 15 LEU HG . 17585 1 135 . 1 1 15 15 LEU HD11 H 1 0.887 0.000 . . . . . A 15 LEU HD11 . 17585 1 136 . 1 1 15 15 LEU HD12 H 1 0.887 0.000 . . . . . A 15 LEU HD12 . 17585 1 137 . 1 1 15 15 LEU HD13 H 1 0.887 0.000 . . . . . A 15 LEU HD13 . 17585 1 138 . 1 1 15 15 LEU HD21 H 1 0.887 0.000 . . . . . A 15 LEU HD21 . 17585 1 139 . 1 1 15 15 LEU HD22 H 1 0.887 0.000 . . . . . A 15 LEU HD22 . 17585 1 140 . 1 1 15 15 LEU HD23 H 1 0.887 0.000 . . . . . A 15 LEU HD23 . 17585 1 141 . 1 1 15 15 LEU C C 13 177.420 0.000 . 1 . . . A 15 LEU C . 17585 1 142 . 1 1 15 15 LEU CA C 13 55.550 0.000 . 1 . . . A 15 LEU CA . 17585 1 143 . 1 1 15 15 LEU CB C 13 42.540 0.000 . 1 . . . A 15 LEU CB . 17585 1 144 . 1 1 15 15 LEU N N 15 123.940 0.000 . 1 . . . A 15 LEU N . 17585 1 145 . 1 1 16 16 GLU H H 1 8.522 0.000 . 1 . . . A 16 GLU H . 17585 1 146 . 1 1 16 16 GLU HA H 1 4.291 0.000 . 1 . . . A 16 GLU HA . 17585 1 147 . 1 1 16 16 GLU HB2 H 1 1.947 0.000 . 2 . . . A 16 GLU HB2 . 17585 1 148 . 1 1 16 16 GLU HB3 H 1 2.067 0.000 . 2 . . . A 16 GLU HB3 . 17585 1 149 . 1 1 16 16 GLU HG2 H 1 2.306 0.000 . 2 . . . A 16 GLU HG2 . 17585 1 150 . 1 1 16 16 GLU HG3 H 1 2.306 0.000 . 2 . . . A 16 GLU HG3 . 17585 1 151 . 1 1 16 16 GLU C C 13 176.520 0.000 . 1 . . . A 16 GLU C . 17585 1 152 . 1 1 16 16 GLU CB C 13 30.320 0.000 . 1 . . . A 16 GLU CB . 17585 1 153 . 1 1 16 16 GLU N N 15 122.500 0.000 . 1 . . . A 16 GLU N . 17585 1 154 . 1 1 17 17 GLN H H 1 8.368 0.000 . 1 . . . A 17 GLN H . 17585 1 155 . 1 1 17 17 GLN HA H 1 4.390 0.000 . 1 . . . A 17 GLN HA . 17585 1 156 . 1 1 17 17 GLN HB2 H 1 2.029 0.000 . 2 . . . A 17 GLN HB2 . 17585 1 157 . 1 1 17 17 GLN HB3 H 1 2.128 0.000 . 2 . . . A 17 GLN HB3 . 17585 1 158 . 1 1 17 17 GLN HG2 H 1 2.375 0.000 . 2 . . . A 17 GLN HG2 . 17585 1 159 . 1 1 17 17 GLN HG3 H 1 2.375 0.000 . 2 . . . A 17 GLN HG3 . 17585 1 160 . 1 1 17 17 GLN C C 13 176.270 0.000 . 1 . . . A 17 GLN C . 17585 1 161 . 1 1 17 17 GLN CA C 13 56.400 0.000 . 1 . . . A 17 GLN CA . 17585 1 162 . 1 1 17 17 GLN CB C 13 30.250 0.000 . 1 . . . A 17 GLN CB . 17585 1 163 . 1 1 17 17 GLN N N 15 121.280 0.000 . 1 . . . A 17 GLN N . 17585 1 164 . 1 1 18 18 THR H H 1 8.255 0.000 . 1 . . . A 18 THR H . 17585 1 165 . 1 1 18 18 THR HA H 1 4.369 0.000 . 1 . . . A 18 THR HA . 17585 1 166 . 1 1 18 18 THR HB H 1 4.256 0.000 . 1 . . . A 18 THR HB . 17585 1 167 . 1 1 18 18 THR HG21 H 1 1.211 0.000 . . . . . A 18 THR HG21 . 17585 1 168 . 1 1 18 18 THR HG22 H 1 1.211 0.000 . . . . . A 18 THR HG22 . 17585 1 169 . 1 1 18 18 THR HG23 H 1 1.211 0.000 . . . . . A 18 THR HG23 . 17585 1 170 . 1 1 18 18 THR C C 13 175.020 0.000 . 1 . . . A 18 THR C . 17585 1 171 . 1 1 18 18 THR CA C 13 62.260 0.000 . 1 . . . A 18 THR CA . 17585 1 172 . 1 1 18 18 THR CB C 13 70.110 0.000 . 1 . . . A 18 THR CB . 17585 1 173 . 1 1 18 18 THR N N 15 115.050 0.000 . 1 . . . A 18 THR N . 17585 1 174 . 1 1 19 19 VAL H H 1 8.133 0.000 . 1 . . . A 19 VAL H . 17585 1 175 . 1 1 19 19 VAL HA H 1 4.103 0.000 . 1 . . . A 19 VAL HA . 17585 1 176 . 1 1 19 19 VAL HB H 1 2.078 0.000 . 1 . . . A 19 VAL HB . 17585 1 177 . 1 1 19 19 VAL HG11 H 1 0.896 0.000 . . . . . A 19 VAL HG11 . 17585 1 178 . 1 1 19 19 VAL HG12 H 1 0.896 0.000 . . . . . A 19 VAL HG12 . 17585 1 179 . 1 1 19 19 VAL HG13 H 1 0.896 0.000 . . . . . A 19 VAL HG13 . 17585 1 180 . 1 1 19 19 VAL HG21 H 1 0.896 0.000 . . . . . A 19 VAL HG21 . 17585 1 181 . 1 1 19 19 VAL HG22 H 1 0.896 0.000 . . . . . A 19 VAL HG22 . 17585 1 182 . 1 1 19 19 VAL HG23 H 1 0.896 0.000 . . . . . A 19 VAL HG23 . 17585 1 183 . 1 1 19 19 VAL C C 13 176.870 0.000 . 1 . . . A 19 VAL C . 17585 1 184 . 1 1 19 19 VAL CA C 13 63.310 0.000 . 1 . . . A 19 VAL CA . 17585 1 185 . 1 1 19 19 VAL CB C 13 32.720 0.000 . 1 . . . A 19 VAL CB . 17585 1 186 . 1 1 19 19 VAL N N 15 121.870 0.000 . 1 . . . A 19 VAL N . 17585 1 187 . 1 1 20 20 GLY H H 1 8.365 0.000 . 1 . . . A 20 GLY H . 17585 1 188 . 1 1 20 20 GLY HA2 H 1 3.949 0.000 . 2 . . . A 20 GLY HA2 . 17585 1 189 . 1 1 20 20 GLY HA3 H 1 3.949 0.000 . 2 . . . A 20 GLY HA3 . 17585 1 190 . 1 1 20 20 GLY C C 13 174.530 0.000 . 1 . . . A 20 GLY C . 17585 1 191 . 1 1 20 20 GLY CA C 13 45.950 0.000 . 1 . . . A 20 GLY CA . 17585 1 192 . 1 1 20 20 GLY N N 15 111.210 0.000 . 1 . . . A 20 GLY N . 17585 1 193 . 1 1 21 21 ASP H H 1 8.172 0.000 . 1 . . . A 21 ASP H . 17585 1 194 . 1 1 21 21 ASP HA H 1 4.583 0.000 . 1 . . . A 21 ASP HA . 17585 1 195 . 1 1 21 21 ASP HB2 H 1 2.727 0.000 . 2 . . . A 21 ASP HB2 . 17585 1 196 . 1 1 21 21 ASP HB3 H 1 2.727 0.000 . 2 . . . A 21 ASP HB3 . 17585 1 197 . 1 1 21 21 ASP C C 13 176.860 0.000 . 1 . . . A 21 ASP C . 17585 1 198 . 1 1 21 21 ASP CA C 13 55.120 0.000 . 1 . . . A 21 ASP CA . 17585 1 199 . 1 1 21 21 ASP CB C 13 41.600 0.000 . 1 . . . A 21 ASP CB . 17585 1 200 . 1 1 21 21 ASP N N 15 121.170 0.000 . 1 . . . A 21 ASP N . 17585 1 201 . 1 1 22 22 ALA H H 1 8.266 0.000 . 1 . . . A 22 ALA H . 17585 1 202 . 1 1 22 22 ALA HA H 1 4.106 0.000 . 1 . . . A 22 ALA HA . 17585 1 203 . 1 1 22 22 ALA HB1 H 1 1.374 0.000 . . . . . A 22 ALA HB1 . 17585 1 204 . 1 1 22 22 ALA HB2 H 1 1.374 0.000 . . . . . A 22 ALA HB2 . 17585 1 205 . 1 1 22 22 ALA HB3 H 1 1.374 0.000 . . . . . A 22 ALA HB3 . 17585 1 206 . 1 1 22 22 ALA C C 13 179.020 0.000 . 1 . . . A 22 ALA C . 17585 1 207 . 1 1 22 22 ALA CA C 13 54.640 0.000 . 1 . . . A 22 ALA CA . 17585 1 208 . 1 1 22 22 ALA CB C 13 19.270 0.000 . 1 . . . A 22 ALA CB . 17585 1 209 . 1 1 22 22 ALA N N 15 123.770 0.000 . 1 . . . A 22 ALA N . 17585 1 210 . 1 1 23 23 PHE H H 1 8.299 0.000 . 1 . . . A 23 PHE H . 17585 1 211 . 1 1 23 23 PHE HA H 1 4.288 0.000 . 1 . . . A 23 PHE HA . 17585 1 212 . 1 1 23 23 PHE HB2 H 1 3.207 0.000 . 2 . . . A 23 PHE HB2 . 17585 1 213 . 1 1 23 23 PHE HB3 H 1 3.207 0.000 . 2 . . . A 23 PHE HB3 . 17585 1 214 . 1 1 23 23 PHE HD1 H 1 7.211 0.000 . 3 . . . A 23 PHE HD1 . 17585 1 215 . 1 1 23 23 PHE HD2 H 1 7.211 0.000 . 3 . . . A 23 PHE HD2 . 17585 1 216 . 1 1 23 23 PHE HE1 H 1 7.086 0.000 . 3 . . . A 23 PHE HE1 . 17585 1 217 . 1 1 23 23 PHE HE2 H 1 7.086 0.000 . 3 . . . A 23 PHE HE2 . 17585 1 218 . 1 1 23 23 PHE CA C 13 60.350 0.000 . 1 . . . A 23 PHE CA . 17585 1 219 . 1 1 23 23 PHE CB C 13 39.630 0.000 . 1 . . . A 23 PHE CB . 17585 1 220 . 1 1 23 23 PHE N N 15 117.830 0.000 . 1 . . . A 23 PHE N . 17585 1 221 . 1 1 24 24 ALA H H 1 8.119 0.000 . 1 . . . A 24 ALA H . 17585 1 222 . 1 1 24 24 ALA HA H 1 4.266 0.000 . 1 . . . A 24 ALA HA . 17585 1 223 . 1 1 24 24 ALA HB1 H 1 1.531 0.000 . . . . . A 24 ALA HB1 . 17585 1 224 . 1 1 24 24 ALA HB2 H 1 1.531 0.000 . . . . . A 24 ALA HB2 . 17585 1 225 . 1 1 24 24 ALA HB3 H 1 1.531 0.000 . . . . . A 24 ALA HB3 . 17585 1 226 . 1 1 24 24 ALA C C 13 179.450 0.000 . 1 . . . A 24 ALA C . 17585 1 227 . 1 1 24 24 ALA CA C 13 54.390 0.000 . 1 . . . A 24 ALA CA . 17585 1 228 . 1 1 24 24 ALA CB C 13 19.270 0.000 . 1 . . . A 24 ALA CB . 17585 1 229 . 1 1 24 24 ALA N N 15 121.740 0.000 . 1 . . . A 24 ALA N . 17585 1 230 . 1 1 25 25 ARG H H 1 7.912 0.000 . 1 . . . A 25 ARG H . 17585 1 231 . 1 1 25 25 ARG HA H 1 4.207 0.000 . 1 . . . A 25 ARG HA . 17585 1 232 . 1 1 25 25 ARG HB2 H 1 1.829 0.000 . 2 . . . A 25 ARG HB2 . 17585 1 233 . 1 1 25 25 ARG HB3 H 1 1.909 0.000 . 2 . . . A 25 ARG HB3 . 17585 1 234 . 1 1 25 25 ARG HG2 H 1 1.607 0.000 . 2 . . . A 25 ARG HG2 . 17585 1 235 . 1 1 25 25 ARG HG3 H 1 1.708 0.000 . 2 . . . A 25 ARG HG3 . 17585 1 236 . 1 1 25 25 ARG HD2 H 1 3.204 0.000 . 2 . . . A 25 ARG HD2 . 17585 1 237 . 1 1 25 25 ARG HD3 H 1 3.204 0.000 . 2 . . . A 25 ARG HD3 . 17585 1 238 . 1 1 25 25 ARG HE H 1 7.291 0.000 . 1 . . . A 25 ARG HE . 17585 1 239 . 1 1 25 25 ARG C C 13 177.740 0.000 . 1 . . . A 25 ARG C . 17585 1 240 . 1 1 25 25 ARG CA C 13 57.550 0.000 . 1 . . . A 25 ARG CA . 17585 1 241 . 1 1 25 25 ARG CB C 13 30.760 0.000 . 1 . . . A 25 ARG CB . 17585 1 242 . 1 1 25 25 ARG N N 15 117.100 0.000 . 1 . . . A 25 ARG N . 17585 1 243 . 1 1 25 25 ARG NE N 15 84.630 0.000 . 1 . . . A 25 ARG NE . 17585 1 244 . 1 1 26 26 ILE H H 1 7.691 0.000 . 1 . . . A 26 ILE H . 17585 1 245 . 1 1 26 26 ILE HA H 1 3.820 0.000 . 1 . . . A 26 ILE HA . 17585 1 246 . 1 1 26 26 ILE HB H 1 1.451 0.000 . 1 . . . A 26 ILE HB . 17585 1 247 . 1 1 26 26 ILE HG13 H 1 0.930 0.000 . 2 . . . A 26 ILE HG13 . 17585 1 248 . 1 1 26 26 ILE HG21 H 1 0.181 0.000 . . . . . A 26 ILE HG21 . 17585 1 249 . 1 1 26 26 ILE HG22 H 1 0.181 0.000 . . . . . A 26 ILE HG22 . 17585 1 250 . 1 1 26 26 ILE HG23 H 1 0.181 0.000 . . . . . A 26 ILE HG23 . 17585 1 251 . 1 1 26 26 ILE HD11 H 1 0.623 0.000 . . . . . A 26 ILE HD11 . 17585 1 252 . 1 1 26 26 ILE HD12 H 1 0.623 0.000 . . . . . A 26 ILE HD12 . 17585 1 253 . 1 1 26 26 ILE HD13 H 1 0.623 0.000 . . . . . A 26 ILE HD13 . 17585 1 254 . 1 1 26 26 ILE CA C 13 63.340 0.000 . 1 . . . A 26 ILE CA . 17585 1 255 . 1 1 26 26 ILE N N 15 118.860 0.000 . 1 . . . A 26 ILE N . 17585 1 256 . 1 1 27 27 PHE H H 1 7.982 0.000 . 1 . . . A 27 PHE H . 17585 1 257 . 1 1 27 27 PHE HA H 1 4.646 0.000 . 1 . . . A 27 PHE HA . 17585 1 258 . 1 1 27 27 PHE HB2 H 1 2.827 0.000 . 2 . . . A 27 PHE HB2 . 17585 1 259 . 1 1 27 27 PHE HB3 H 1 3.329 0.000 . 2 . . . A 27 PHE HB3 . 17585 1 260 . 1 1 27 27 PHE HD1 H 1 6.989 0.000 . 3 . . . A 27 PHE HD1 . 17585 1 261 . 1 1 27 27 PHE HD2 H 1 6.989 0.000 . 3 . . . A 27 PHE HD2 . 17585 1 262 . 1 1 27 27 PHE HE1 H 1 6.880 0.000 . 3 . . . A 27 PHE HE1 . 17585 1 263 . 1 1 27 27 PHE HE2 H 1 6.880 0.000 . 3 . . . A 27 PHE HE2 . 17585 1 264 . 1 1 27 27 PHE C C 13 177.120 0.000 . 1 . . . A 27 PHE C . 17585 1 265 . 1 1 27 27 PHE CB C 13 39.850 0.000 . 1 . . . A 27 PHE CB . 17585 1 266 . 1 1 27 27 PHE N N 15 116.810 0.000 . 1 . . . A 27 PHE N . 17585 1 267 . 1 1 28 28 GLY H H 1 8.134 0.000 . 1 . . . A 28 GLY H . 17585 1 268 . 1 1 28 28 GLY HA2 H 1 4.000 0.000 . 2 . . . A 28 GLY HA2 . 17585 1 269 . 1 1 28 28 GLY HA3 H 1 4.020 0.000 . 2 . . . A 28 GLY HA3 . 17585 1 270 . 1 1 28 28 GLY C C 13 174.830 0.000 . 1 . . . A 28 GLY C . 17585 1 271 . 1 1 28 28 GLY CA C 13 46.830 0.000 . 1 . . . A 28 GLY CA . 17585 1 272 . 1 1 28 28 GLY N N 15 109.870 0.000 . 1 . . . A 28 GLY N . 17585 1 273 . 1 1 29 29 GLY H H 1 8.413 0.000 . 1 . . . A 29 GLY H . 17585 1 274 . 1 1 29 29 GLY HA2 H 1 3.897 0.000 . 2 . . . A 29 GLY HA2 . 17585 1 275 . 1 1 29 29 GLY HA3 H 1 4.207 0.000 . 2 . . . A 29 GLY HA3 . 17585 1 276 . 1 1 29 29 GLY C C 13 174.620 0.000 . 1 . . . A 29 GLY C . 17585 1 277 . 1 1 29 29 GLY CA C 13 45.330 0.000 . 1 . . . A 29 GLY CA . 17585 1 278 . 1 1 29 29 GLY N N 15 108.310 0.000 . 1 . . . A 29 GLY N . 17585 1 279 . 1 1 30 30 SER H H 1 8.026 0.000 . 1 . . . A 30 SER H . 17585 1 280 . 1 1 30 30 SER HA H 1 4.440 0.000 . 1 . . . A 30 SER HA . 17585 1 281 . 1 1 30 30 SER HB3 H 1 3.975 0.000 . 2 . . . A 30 SER HB3 . 17585 1 282 . 1 1 30 30 SER CA C 13 59.770 0.000 . 1 . . . A 30 SER CA . 17585 1 283 . 1 1 30 30 SER N N 15 115.290 0.000 . 1 . . . A 30 SER N . 17585 1 284 . 1 1 34 34 GLN HA H 1 4.072 0.000 . 1 . . . A 34 GLN HA . 17585 1 285 . 1 1 35 35 GLU HA H 1 4.193 0.000 . 1 . . . A 35 GLU HA . 17585 1 286 . 1 1 36 36 VAL HA H 1 3.332 0.000 . 1 . . . A 36 VAL HA . 17585 1 287 . 1 1 36 36 VAL HB H 1 1.834 0.000 . 1 . . . A 36 VAL HB . 17585 1 288 . 1 1 36 36 VAL HG11 H 1 0.101 0.000 . . . . . A 36 VAL HG11 . 17585 1 289 . 1 1 36 36 VAL HG12 H 1 0.101 0.000 . . . . . A 36 VAL HG12 . 17585 1 290 . 1 1 36 36 VAL HG13 H 1 0.101 0.000 . . . . . A 36 VAL HG13 . 17585 1 291 . 1 1 36 36 VAL HG21 H 1 -0.010 0.000 . . . . . A 36 VAL HG21 . 17585 1 292 . 1 1 36 36 VAL HG22 H 1 -0.010 0.000 . . . . . A 36 VAL HG22 . 17585 1 293 . 1 1 36 36 VAL HG23 H 1 -0.010 0.000 . . . . . A 36 VAL HG23 . 17585 1 294 . 1 1 36 36 VAL C C 13 177.720 0.000 . 1 . . . A 36 VAL C . 17585 1 295 . 1 1 36 36 VAL CA C 13 66.180 0.000 . 1 . . . A 36 VAL CA . 17585 1 296 . 1 1 36 36 VAL CB C 13 31.200 0.000 . 1 . . . A 36 VAL CB . 17585 1 297 . 1 1 37 37 GLU H H 1 8.179 0.000 . 1 . . . A 37 GLU H . 17585 1 298 . 1 1 37 37 GLU HA H 1 3.795 0.000 . 1 . . . A 37 GLU HA . 17585 1 299 . 1 1 37 37 GLU HB2 H 1 2.010 0.000 . 2 . . . A 37 GLU HB2 . 17585 1 300 . 1 1 37 37 GLU HB3 H 1 2.130 0.000 . 2 . . . A 37 GLU HB3 . 17585 1 301 . 1 1 37 37 GLU HG2 H 1 2.346 0.000 . 2 . . . A 37 GLU HG2 . 17585 1 302 . 1 1 37 37 GLU HG3 H 1 2.530 0.000 . 2 . . . A 37 GLU HG3 . 17585 1 303 . 1 1 37 37 GLU C C 13 178.760 0.000 . 1 . . . A 37 GLU C . 17585 1 304 . 1 1 37 37 GLU CA C 13 60.360 0.000 . 1 . . . A 37 GLU CA . 17585 1 305 . 1 1 37 37 GLU CB C 13 28.650 0.000 . 1 . . . A 37 GLU CB . 17585 1 306 . 1 1 37 37 GLU N N 15 117.300 0.000 . 1 . . . A 37 GLU N . 17585 1 307 . 1 1 38 38 ALA H H 1 7.796 0.000 . 1 . . . A 38 ALA H . 17585 1 308 . 1 1 38 38 ALA HA H 1 3.898 0.000 . 1 . . . A 38 ALA HA . 17585 1 309 . 1 1 38 38 ALA HB1 H 1 1.497 0.000 . . . . . A 38 ALA HB1 . 17585 1 310 . 1 1 38 38 ALA HB2 H 1 1.497 0.000 . . . . . A 38 ALA HB2 . 17585 1 311 . 1 1 38 38 ALA HB3 H 1 1.497 0.000 . . . . . A 38 ALA HB3 . 17585 1 312 . 1 1 38 38 ALA C C 13 180.370 0.000 . 1 . . . A 38 ALA C . 17585 1 313 . 1 1 38 38 ALA CA C 13 55.380 0.000 . 1 . . . A 38 ALA CA . 17585 1 314 . 1 1 38 38 ALA CB C 13 18.320 0.000 . 1 . . . A 38 ALA CB . 17585 1 315 . 1 1 38 38 ALA N N 15 120.320 0.000 . 1 . . . A 38 ALA N . 17585 1 316 . 1 1 39 39 LEU H H 1 7.596 0.000 . 1 . . . A 39 LEU H . 17585 1 317 . 1 1 39 39 LEU HA H 1 4.206 0.000 . 1 . . . A 39 LEU HA . 17585 1 318 . 1 1 39 39 LEU HB2 H 1 1.748 0.000 . 2 . . . A 39 LEU HB2 . 17585 1 319 . 1 1 39 39 LEU HB3 H 1 1.947 0.000 . 2 . . . A 39 LEU HB3 . 17585 1 320 . 1 1 39 39 LEU HG H 1 1.640 0.000 . 1 . . . A 39 LEU HG . 17585 1 321 . 1 1 39 39 LEU HD11 H 1 0.999 0.000 . . . . . A 39 LEU HD11 . 17585 1 322 . 1 1 39 39 LEU HD12 H 1 0.999 0.000 . . . . . A 39 LEU HD12 . 17585 1 323 . 1 1 39 39 LEU HD13 H 1 0.999 0.000 . . . . . A 39 LEU HD13 . 17585 1 324 . 1 1 39 39 LEU HD21 H 1 0.937 0.000 . . . . . A 39 LEU HD21 . 17585 1 325 . 1 1 39 39 LEU HD22 H 1 0.937 0.000 . . . . . A 39 LEU HD22 . 17585 1 326 . 1 1 39 39 LEU HD23 H 1 0.937 0.000 . . . . . A 39 LEU HD23 . 17585 1 327 . 1 1 39 39 LEU C C 13 178.990 0.000 . 1 . . . A 39 LEU C . 17585 1 328 . 1 1 39 39 LEU CA C 13 57.850 0.000 . 1 . . . A 39 LEU CA . 17585 1 329 . 1 1 39 39 LEU CB C 13 42.030 0.000 . 1 . . . A 39 LEU CB . 17585 1 330 . 1 1 39 39 LEU N N 15 120.470 0.000 . 1 . . . A 39 LEU N . 17585 1 331 . 1 1 40 40 LEU H H 1 8.124 0.000 . 1 . . . A 40 LEU H . 17585 1 332 . 1 1 40 40 LEU HA H 1 3.714 0.000 . 1 . . . A 40 LEU HA . 17585 1 333 . 1 1 40 40 LEU HB2 H 1 1.125 0.000 . 2 . . . A 40 LEU HB2 . 17585 1 334 . 1 1 40 40 LEU HB3 H 1 1.863 0.000 . 2 . . . A 40 LEU HB3 . 17585 1 335 . 1 1 40 40 LEU HG H 1 0.926 0.000 . 1 . . . A 40 LEU HG . 17585 1 336 . 1 1 40 40 LEU HD11 H 1 0.564 0.000 . . . . . A 40 LEU HD11 . 17585 1 337 . 1 1 40 40 LEU HD12 H 1 0.564 0.000 . . . . . A 40 LEU HD12 . 17585 1 338 . 1 1 40 40 LEU HD13 H 1 0.564 0.000 . . . . . A 40 LEU HD13 . 17585 1 339 . 1 1 40 40 LEU HD21 H 1 0.365 0.000 . . . . . A 40 LEU HD21 . 17585 1 340 . 1 1 40 40 LEU HD22 H 1 0.365 0.000 . . . . . A 40 LEU HD22 . 17585 1 341 . 1 1 40 40 LEU HD23 H 1 0.365 0.000 . . . . . A 40 LEU HD23 . 17585 1 342 . 1 1 40 40 LEU C C 13 178.160 0.000 . 1 . . . A 40 LEU C . 17585 1 343 . 1 1 40 40 LEU CA C 13 58.390 0.000 . 1 . . . A 40 LEU CA . 17585 1 344 . 1 1 40 40 LEU CB C 13 41.380 0.000 . 1 . . . A 40 LEU CB . 17585 1 345 . 1 1 40 40 LEU N N 15 119.170 0.000 . 1 . . . A 40 LEU N . 17585 1 346 . 1 1 41 41 ARG H H 1 7.855 0.000 . 1 . . . A 41 ARG H . 17585 1 347 . 1 1 41 41 ARG HA H 1 3.650 0.000 . 1 . . . A 41 ARG HA . 17585 1 348 . 1 1 41 41 ARG HB2 H 1 1.215 0.000 . 2 . . . A 41 ARG HB2 . 17585 1 349 . 1 1 41 41 ARG HB3 H 1 1.215 0.000 . 2 . . . A 41 ARG HB3 . 17585 1 350 . 1 1 41 41 ARG HG2 H 1 0.369 0.000 . 2 . . . A 41 ARG HG2 . 17585 1 351 . 1 1 41 41 ARG HG3 H 1 1.622 0.000 . 2 . . . A 41 ARG HG3 . 17585 1 352 . 1 1 41 41 ARG HD2 H 1 2.340 0.000 . 2 . . . A 41 ARG HD2 . 17585 1 353 . 1 1 41 41 ARG HD3 H 1 2.340 0.000 . 2 . . . A 41 ARG HD3 . 17585 1 354 . 1 1 41 41 ARG HE H 1 7.003 0.000 . 1 . . . A 41 ARG HE . 17585 1 355 . 1 1 41 41 ARG C C 13 179.120 0.000 . 1 . . . A 41 ARG C . 17585 1 356 . 1 1 41 41 ARG CA C 13 60.440 0.000 . 1 . . . A 41 ARG CA . 17585 1 357 . 1 1 41 41 ARG CB C 13 30.830 0.000 . 1 . . . A 41 ARG CB . 17585 1 358 . 1 1 41 41 ARG N N 15 116.080 0.000 . 1 . . . A 41 ARG N . 17585 1 359 . 1 1 41 41 ARG NE N 15 84.210 0.000 . 1 . . . A 41 ARG NE . 17585 1 360 . 1 1 42 42 ARG H H 1 7.646 0.000 . 1 . . . A 42 ARG H . 17585 1 361 . 1 1 42 42 ARG HA H 1 4.140 0.000 . 1 . . . A 42 ARG HA . 17585 1 362 . 1 1 42 42 ARG HB2 H 1 2.027 0.000 . 2 . . . A 42 ARG HB2 . 17585 1 363 . 1 1 42 42 ARG HB3 H 1 2.132 0.000 . 2 . . . A 42 ARG HB3 . 17585 1 364 . 1 1 42 42 ARG HG2 H 1 1.720 0.000 . 2 . . . A 42 ARG HG2 . 17585 1 365 . 1 1 42 42 ARG HG3 H 1 1.821 0.000 . 2 . . . A 42 ARG HG3 . 17585 1 366 . 1 1 42 42 ARG HD2 H 1 3.259 0.000 . 2 . . . A 42 ARG HD2 . 17585 1 367 . 1 1 42 42 ARG HD3 H 1 3.259 0.000 . 2 . . . A 42 ARG HD3 . 17585 1 368 . 1 1 42 42 ARG HE H 1 7.385 0.000 . 1 . . . A 42 ARG HE . 17585 1 369 . 1 1 42 42 ARG C C 13 178.230 0.000 . 1 . . . A 42 ARG C . 17585 1 370 . 1 1 42 42 ARG CA C 13 59.350 0.000 . 1 . . . A 42 ARG CA . 17585 1 371 . 1 1 42 42 ARG CB C 13 30.470 0.000 . 1 . . . A 42 ARG CB . 17585 1 372 . 1 1 42 42 ARG N N 15 120.230 0.000 . 1 . . . A 42 ARG N . 17585 1 373 . 1 1 42 42 ARG NE N 15 85.400 0.000 . 1 . . . A 42 ARG NE . 17585 1 374 . 1 1 43 43 GLU H H 1 8.419 0.000 . 1 . . . A 43 GLU H . 17585 1 375 . 1 1 43 43 GLU HA H 1 4.120 0.000 . 1 . . . A 43 GLU HA . 17585 1 376 . 1 1 43 43 GLU HB2 H 1 2.269 0.000 . 2 . . . A 43 GLU HB2 . 17585 1 377 . 1 1 43 43 GLU HB3 H 1 2.124 0.000 . 2 . . . A 43 GLU HB3 . 17585 1 378 . 1 1 43 43 GLU HG2 H 1 2.569 0.000 . 2 . . . A 43 GLU HG2 . 17585 1 379 . 1 1 43 43 GLU HG3 H 1 2.569 0.000 . 2 . . . A 43 GLU HG3 . 17585 1 380 . 1 1 43 43 GLU C C 13 179.380 0.000 . 1 . . . A 43 GLU C . 17585 1 381 . 1 1 43 43 GLU CA C 13 58.610 0.000 . 1 . . . A 43 GLU CA . 17585 1 382 . 1 1 43 43 GLU CB C 13 28.940 0.000 . 1 . . . A 43 GLU CB . 17585 1 383 . 1 1 43 43 GLU N N 15 118.470 0.000 . 1 . . . A 43 GLU N . 17585 1 384 . 1 1 44 44 ALA H H 1 8.398 0.000 . 1 . . . A 44 ALA H . 17585 1 385 . 1 1 44 44 ALA HA H 1 4.266 0.000 . 1 . . . A 44 ALA HA . 17585 1 386 . 1 1 44 44 ALA HB1 H 1 1.787 0.000 . . . . . A 44 ALA HB1 . 17585 1 387 . 1 1 44 44 ALA HB2 H 1 1.787 0.000 . . . . . A 44 ALA HB2 . 17585 1 388 . 1 1 44 44 ALA HB3 H 1 1.787 0.000 . . . . . A 44 ALA HB3 . 17585 1 389 . 1 1 44 44 ALA C C 13 177.730 0.000 . 1 . . . A 44 ALA C . 17585 1 390 . 1 1 44 44 ALA CA C 13 55.850 0.000 . 1 . . . A 44 ALA CA . 17585 1 391 . 1 1 44 44 ALA CB C 13 19.410 0.000 . 1 . . . A 44 ALA CB . 17585 1 392 . 1 1 44 44 ALA N N 15 122.740 0.000 . 1 . . . A 44 ALA N . 17585 1 393 . 1 1 45 45 ALA H H 1 7.722 0.000 . 1 . . . A 45 ALA H . 17585 1 394 . 1 1 45 45 ALA HA H 1 3.873 0.000 . 1 . . . A 45 ALA HA . 17585 1 395 . 1 1 45 45 ALA HB1 H 1 1.758 0.000 . . . . . A 45 ALA HB1 . 17585 1 396 . 1 1 45 45 ALA HB2 H 1 1.758 0.000 . . . . . A 45 ALA HB2 . 17585 1 397 . 1 1 45 45 ALA HB3 H 1 1.758 0.000 . . . . . A 45 ALA HB3 . 17585 1 398 . 1 1 45 45 ALA C C 13 181.020 0.000 . 1 . . . A 45 ALA C . 17585 1 399 . 1 1 45 45 ALA CA C 13 54.570 0.000 . 1 . . . A 45 ALA CA . 17585 1 400 . 1 1 45 45 ALA CB C 13 19.190 0.000 . 1 . . . A 45 ALA CB . 17585 1 401 . 1 1 45 45 ALA N N 15 116.270 0.000 . 1 . . . A 45 ALA N . 17585 1 402 . 1 1 46 46 ASP H H 1 8.613 0.000 . 1 . . . A 46 ASP H . 17585 1 403 . 1 1 46 46 ASP HA H 1 4.528 0.000 . 1 . . . A 46 ASP HA . 17585 1 404 . 1 1 46 46 ASP HB2 H 1 2.799 0.000 . 2 . . . A 46 ASP HB2 . 17585 1 405 . 1 1 46 46 ASP HB3 H 1 2.799 0.000 . 2 . . . A 46 ASP HB3 . 17585 1 406 . 1 1 46 46 ASP C C 13 177.380 0.000 . 1 . . . A 46 ASP C . 17585 1 407 . 1 1 46 46 ASP CA C 13 55.580 0.000 . 1 . . . A 46 ASP CA . 17585 1 408 . 1 1 46 46 ASP CB C 13 40.210 0.000 . 1 . . . A 46 ASP CB . 17585 1 409 . 1 1 46 46 ASP N N 15 116.420 0.000 . 1 . . . A 46 ASP N . 17585 1 410 . 1 1 47 47 GLY H H 1 7.626 0.000 . 1 . . . A 47 GLY H . 17585 1 411 . 1 1 47 47 GLY HA2 H 1 3.362 0.000 . 2 . . . A 47 GLY HA2 . 17585 1 412 . 1 1 47 47 GLY HA3 H 1 4.358 0.000 . 2 . . . A 47 GLY HA3 . 17585 1 413 . 1 1 47 47 GLY C C 13 173.770 0.000 . 1 . . . A 47 GLY C . 17585 1 414 . 1 1 47 47 GLY CA C 13 45.040 0.000 . 1 . . . A 47 GLY CA . 17585 1 415 . 1 1 47 47 GLY N N 15 106.700 0.000 . 1 . . . A 47 GLY N . 17585 1 416 . 1 1 48 48 ILE H H 1 6.677 0.000 . 1 . . . A 48 ILE H . 17585 1 417 . 1 1 48 48 ILE HA H 1 4.258 0.000 . 1 . . . A 48 ILE HA . 17585 1 418 . 1 1 48 48 ILE HB H 1 1.466 0.000 . 1 . . . A 48 ILE HB . 17585 1 419 . 1 1 48 48 ILE HG12 H 1 0.829 0.000 . 2 . . . A 48 ILE HG12 . 17585 1 420 . 1 1 48 48 ILE HG13 H 1 1.082 0.000 . 2 . . . A 48 ILE HG13 . 17585 1 421 . 1 1 48 48 ILE HG21 H 1 0.265 0.000 . . . . . A 48 ILE HG21 . 17585 1 422 . 1 1 48 48 ILE HG22 H 1 0.265 0.000 . . . . . A 48 ILE HG22 . 17585 1 423 . 1 1 48 48 ILE HG23 H 1 0.265 0.000 . . . . . A 48 ILE HG23 . 17585 1 424 . 1 1 48 48 ILE HD11 H 1 -0.310 0.000 . . . . . A 48 ILE HD11 . 17585 1 425 . 1 1 48 48 ILE HD12 H 1 -0.310 0.000 . . . . . A 48 ILE HD12 . 17585 1 426 . 1 1 48 48 ILE HD13 H 1 -0.310 0.000 . . . . . A 48 ILE HD13 . 17585 1 427 . 1 1 48 48 ILE C C 13 176.330 0.000 . 1 . . . A 48 ILE C . 17585 1 428 . 1 1 48 48 ILE CA C 13 60.710 0.000 . 1 . . . A 48 ILE CA . 17585 1 429 . 1 1 48 48 ILE CB C 13 38.250 0.000 . 1 . . . A 48 ILE CB . 17585 1 430 . 1 1 48 48 ILE N N 15 119.010 0.000 . 1 . . . A 48 ILE N . 17585 1 431 . 1 1 49 49 GLN H H 1 8.780 0.000 . 1 . . . A 49 GLN H . 17585 1 432 . 1 1 49 49 GLN HA H 1 4.620 0.000 . 1 . . . A 49 GLN HA . 17585 1 433 . 1 1 49 49 GLN HB2 H 1 1.801 0.000 . 2 . . . A 49 GLN HB2 . 17585 1 434 . 1 1 49 49 GLN HB3 H 1 2.032 0.000 . 2 . . . A 49 GLN HB3 . 17585 1 435 . 1 1 49 49 GLN HG2 H 1 2.051 0.000 . 2 . . . A 49 GLN HG2 . 17585 1 436 . 1 1 49 49 GLN HG3 H 1 2.314 0.000 . 2 . . . A 49 GLN HG3 . 17585 1 437 . 1 1 49 49 GLN HE21 H 1 6.752 0.000 . 2 . . . A 49 GLN HE21 . 17585 1 438 . 1 1 49 49 GLN HE22 H 1 7.531 0.000 . 2 . . . A 49 GLN HE22 . 17585 1 439 . 1 1 49 49 GLN C C 13 174.690 0.000 . 1 . . . A 49 GLN C . 17585 1 440 . 1 1 49 49 GLN CA C 13 53.870 0.000 . 1 . . . A 49 GLN CA . 17585 1 441 . 1 1 49 49 GLN N N 15 123.840 0.000 . 1 . . . A 49 GLN N . 17585 1 442 . 1 1 49 49 GLN NE2 N 15 111.580 0.000 . 1 . . . A 49 GLN NE2 . 17585 1 443 . 1 1 50 50 SER H H 1 8.603 0.000 . 1 . . . A 50 SER H . 17585 1 444 . 1 1 50 50 SER HA H 1 4.706 0.000 . 1 . . . A 50 SER HA . 17585 1 445 . 1 1 50 50 SER HB2 H 1 3.776 0.000 . 2 . . . A 50 SER HB2 . 17585 1 446 . 1 1 50 50 SER HB3 H 1 3.810 0.000 . 2 . . . A 50 SER HB3 . 17585 1 447 . 1 1 50 50 SER C C 13 174.210 0.000 . 1 . . . A 50 SER C . 17585 1 448 . 1 1 50 50 SER CA C 13 58.420 0.000 . 1 . . . A 50 SER CA . 17585 1 449 . 1 1 50 50 SER CB C 13 63.930 0.000 . 1 . . . A 50 SER CB . 17585 1 450 . 1 1 50 50 SER N N 15 117.830 0.000 . 1 . . . A 50 SER N . 17585 1 451 . 1 1 51 51 LEU H H 1 8.464 0.000 . 1 . . . A 51 LEU H . 17585 1 452 . 1 1 51 51 LEU HA H 1 4.654 0.000 . 1 . . . A 51 LEU HA . 17585 1 453 . 1 1 51 51 LEU HB2 H 1 1.544 0.000 . 2 . . . A 51 LEU HB2 . 17585 1 454 . 1 1 51 51 LEU HB3 H 1 1.610 0.000 . 2 . . . A 51 LEU HB3 . 17585 1 455 . 1 1 51 51 LEU HG H 1 1.491 0.000 . 1 . . . A 51 LEU HG . 17585 1 456 . 1 1 51 51 LEU HD11 H 1 1.037 0.000 . . . . . A 51 LEU HD11 . 17585 1 457 . 1 1 51 51 LEU HD12 H 1 1.037 0.000 . . . . . A 51 LEU HD12 . 17585 1 458 . 1 1 51 51 LEU HD13 H 1 1.037 0.000 . . . . . A 51 LEU HD13 . 17585 1 459 . 1 1 51 51 LEU HD21 H 1 0.835 0.000 . . . . . A 51 LEU HD21 . 17585 1 460 . 1 1 51 51 LEU HD22 H 1 0.835 0.000 . . . . . A 51 LEU HD22 . 17585 1 461 . 1 1 51 51 LEU HD23 H 1 0.835 0.000 . . . . . A 51 LEU HD23 . 17585 1 462 . 1 1 51 51 LEU C C 13 176.660 0.000 . 1 . . . A 51 LEU C . 17585 1 463 . 1 1 51 51 LEU CA C 13 53.570 0.000 . 1 . . . A 51 LEU CA . 17585 1 464 . 1 1 51 51 LEU CB C 13 44.580 0.000 . 1 . . . A 51 LEU CB . 17585 1 465 . 1 1 51 51 LEU N N 15 126.520 0.000 . 1 . . . A 51 LEU N . 17585 1 466 . 1 1 52 52 GLN H H 1 8.280 0.000 . 1 . . . A 52 GLN H . 17585 1 467 . 1 1 52 52 GLN HA H 1 4.178 0.000 . 1 . . . A 52 GLN HA . 17585 1 468 . 1 1 52 52 GLN HB3 H 1 2.104 0.000 . 2 . . . A 52 GLN HB3 . 17585 1 469 . 1 1 52 52 GLN HG3 H 1 2.446 0.000 . 2 . . . A 52 GLN HG3 . 17585 1 470 . 1 1 52 52 GLN C C 13 176.500 0.000 . 1 . . . A 52 GLN C . 17585 1 471 . 1 1 52 52 GLN CA C 13 57.240 0.000 . 1 . . . A 52 GLN CA . 17585 1 472 . 1 1 52 52 GLN CB C 13 29.090 0.000 . 1 . . . A 52 GLN CB . 17585 1 473 . 1 1 52 52 GLN N N 15 119.200 0.000 . 1 . . . A 52 GLN N . 17585 1 474 . 1 1 53 53 GLY H H 1 8.705 0.000 . 1 . . . A 53 GLY H . 17585 1 475 . 1 1 53 53 GLY HA2 H 1 3.765 0.000 . 2 . . . A 53 GLY HA2 . 17585 1 476 . 1 1 53 53 GLY HA3 H 1 4.052 0.000 . 2 . . . A 53 GLY HA3 . 17585 1 477 . 1 1 53 53 GLY C C 13 175.030 0.000 . 1 . . . A 53 GLY C . 17585 1 478 . 1 1 53 53 GLY CA C 13 46.190 0.000 . 1 . . . A 53 GLY CA . 17585 1 479 . 1 1 53 53 GLY N N 15 110.730 0.000 . 1 . . . A 53 GLY N . 17585 1 480 . 1 1 54 54 ASN H H 1 8.489 0.000 . 1 . . . A 54 ASN H . 17585 1 481 . 1 1 54 54 ASN HA H 1 4.575 0.000 . 1 . . . A 54 ASN HA . 17585 1 482 . 1 1 54 54 ASN HB2 H 1 2.893 0.000 . 2 . . . A 54 ASN HB2 . 17585 1 483 . 1 1 54 54 ASN HB3 H 1 3.051 0.000 . 2 . . . A 54 ASN HB3 . 17585 1 484 . 1 1 54 54 ASN HD21 H 1 6.880 0.000 . 2 . . . A 54 ASN HD21 . 17585 1 485 . 1 1 54 54 ASN HD22 H 1 7.551 0.000 . 2 . . . A 54 ASN HD22 . 17585 1 486 . 1 1 54 54 ASN C C 13 174.510 0.000 . 1 . . . A 54 ASN C . 17585 1 487 . 1 1 54 54 ASN CA C 13 53.990 0.000 . 1 . . . A 54 ASN CA . 17585 1 488 . 1 1 54 54 ASN CB C 13 40.430 0.000 . 1 . . . A 54 ASN CB . 17585 1 489 . 1 1 54 54 ASN N N 15 116.510 0.000 . 1 . . . A 54 ASN N . 17585 1 490 . 1 1 54 54 ASN ND2 N 15 112.490 0.000 . 1 . . . A 54 ASN ND2 . 17585 1 491 . 1 1 55 55 ARG H H 1 7.209 0.000 . 1 . . . A 55 ARG H . 17585 1 492 . 1 1 55 55 ARG HA H 1 4.559 0.000 . 1 . . . A 55 ARG HA . 17585 1 493 . 1 1 55 55 ARG HB2 H 1 1.746 0.000 . 2 . . . A 55 ARG HB2 . 17585 1 494 . 1 1 55 55 ARG HB3 H 1 1.746 0.000 . 2 . . . A 55 ARG HB3 . 17585 1 495 . 1 1 55 55 ARG HG2 H 1 1.676 0.000 . 2 . . . A 55 ARG HG2 . 17585 1 496 . 1 1 55 55 ARG HG3 H 1 1.676 0.000 . 2 . . . A 55 ARG HG3 . 17585 1 497 . 1 1 55 55 ARG HD2 H 1 3.220 0.000 . 2 . . . A 55 ARG HD2 . 17585 1 498 . 1 1 55 55 ARG HD3 H 1 3.275 0.000 . 2 . . . A 55 ARG HD3 . 17585 1 499 . 1 1 55 55 ARG HE H 1 7.046 0.000 . 1 . . . A 55 ARG HE . 17585 1 500 . 1 1 55 55 ARG C C 13 174.960 0.000 . 1 . . . A 55 ARG C . 17585 1 501 . 1 1 55 55 ARG CA C 13 55.520 0.000 . 1 . . . A 55 ARG CA . 17585 1 502 . 1 1 55 55 ARG CB C 13 32.800 0.000 . 1 . . . A 55 ARG CB . 17585 1 503 . 1 1 55 55 ARG N N 15 118.030 0.000 . 1 . . . A 55 ARG N . 17585 1 504 . 1 1 55 55 ARG NE N 15 84.840 0.000 . 1 . . . A 55 ARG NE . 17585 1 505 . 1 1 56 56 LEU H H 1 8.616 0.000 . 1 . . . A 56 LEU H . 17585 1 506 . 1 1 56 56 LEU HA H 1 4.842 0.000 . 1 . . . A 56 LEU HA . 17585 1 507 . 1 1 56 56 LEU HB2 H 1 1.075 0.000 . 2 . . . A 56 LEU HB2 . 17585 1 508 . 1 1 56 56 LEU HB3 H 1 1.896 0.000 . 2 . . . A 56 LEU HB3 . 17585 1 509 . 1 1 56 56 LEU HG H 1 1.629 0.000 . 1 . . . A 56 LEU HG . 17585 1 510 . 1 1 56 56 LEU HD11 H 1 1.039 0.000 . . . . . A 56 LEU HD11 . 17585 1 511 . 1 1 56 56 LEU HD12 H 1 1.039 0.000 . . . . . A 56 LEU HD12 . 17585 1 512 . 1 1 56 56 LEU HD13 H 1 1.039 0.000 . . . . . A 56 LEU HD13 . 17585 1 513 . 1 1 56 56 LEU HD21 H 1 0.792 0.000 . . . . . A 56 LEU HD21 . 17585 1 514 . 1 1 56 56 LEU HD22 H 1 0.792 0.000 . . . . . A 56 LEU HD22 . 17585 1 515 . 1 1 56 56 LEU HD23 H 1 0.792 0.000 . . . . . A 56 LEU HD23 . 17585 1 516 . 1 1 56 56 LEU C C 13 174.220 0.000 . 1 . . . A 56 LEU C . 17585 1 517 . 1 1 56 56 LEU CA C 13 54.330 0.000 . 1 . . . A 56 LEU CA . 17585 1 518 . 1 1 56 56 LEU CB C 13 44.780 0.000 . 1 . . . A 56 LEU CB . 17585 1 519 . 1 1 56 56 LEU N N 15 124.430 0.000 . 1 . . . A 56 LEU N . 17585 1 520 . 1 1 57 57 LEU H H 1 8.774 0.000 . 1 . . . A 57 LEU H . 17585 1 521 . 1 1 57 57 LEU HA H 1 4.618 0.000 . 1 . . . A 57 LEU HA . 17585 1 522 . 1 1 57 57 LEU HB2 H 1 1.034 0.000 . 2 . . . A 57 LEU HB2 . 17585 1 523 . 1 1 57 57 LEU HB3 H 1 1.570 0.000 . 2 . . . A 57 LEU HB3 . 17585 1 524 . 1 1 57 57 LEU HG H 1 1.098 0.000 . 1 . . . A 57 LEU HG . 17585 1 525 . 1 1 57 57 LEU HD11 H 1 0.230 0.000 . . . . . A 57 LEU HD11 . 17585 1 526 . 1 1 57 57 LEU HD12 H 1 0.230 0.000 . . . . . A 57 LEU HD12 . 17585 1 527 . 1 1 57 57 LEU HD13 H 1 0.230 0.000 . . . . . A 57 LEU HD13 . 17585 1 528 . 1 1 57 57 LEU HD21 H 1 0.492 0.000 . . . . . A 57 LEU HD21 . 17585 1 529 . 1 1 57 57 LEU HD22 H 1 0.492 0.000 . . . . . A 57 LEU HD22 . 17585 1 530 . 1 1 57 57 LEU HD23 H 1 0.492 0.000 . . . . . A 57 LEU HD23 . 17585 1 531 . 1 1 57 57 LEU C C 13 174.640 0.000 . 1 . . . A 57 LEU C . 17585 1 532 . 1 1 57 57 LEU CA C 13 53.000 0.000 . 1 . . . A 57 LEU CA . 17585 1 533 . 1 1 57 57 LEU CB C 13 45.480 0.000 . 1 . . . A 57 LEU CB . 17585 1 534 . 1 1 57 57 LEU N N 15 125.350 0.000 . 1 . . . A 57 LEU N . 17585 1 535 . 1 1 58 58 ALA H H 1 9.097 0.000 . 1 . . . A 58 ALA H . 17585 1 536 . 1 1 58 58 ALA HA H 1 4.716 0.000 . 1 . . . A 58 ALA HA . 17585 1 537 . 1 1 58 58 ALA HB1 H 1 1.267 0.000 . . . . . A 58 ALA HB1 . 17585 1 538 . 1 1 58 58 ALA HB2 H 1 1.267 0.000 . . . . . A 58 ALA HB2 . 17585 1 539 . 1 1 58 58 ALA HB3 H 1 1.267 0.000 . . . . . A 58 ALA HB3 . 17585 1 540 . 1 1 58 58 ALA CA C 13 48.510 0.000 . 1 . . . A 58 ALA CA . 17585 1 541 . 1 1 58 58 ALA N N 15 128.280 0.000 . 1 . . . A 58 ALA N . 17585 1 542 . 1 1 59 59 PRO HA H 1 3.895 0.000 . 1 . . . A 59 PRO HA . 17585 1 543 . 1 1 59 59 PRO HB2 H 1 1.680 0.000 . 2 . . . A 59 PRO HB2 . 17585 1 544 . 1 1 59 59 PRO HB3 H 1 1.337 0.000 . 2 . . . A 59 PRO HB3 . 17585 1 545 . 1 1 59 59 PRO HG2 H 1 1.225 0.000 . 2 . . . A 59 PRO HG2 . 17585 1 546 . 1 1 59 59 PRO HG3 H 1 1.783 0.000 . 2 . . . A 59 PRO HG3 . 17585 1 547 . 1 1 59 59 PRO HD2 H 1 3.320 0.000 . 2 . . . A 59 PRO HD2 . 17585 1 548 . 1 1 59 59 PRO HD3 H 1 3.468 0.000 . 2 . . . A 59 PRO HD3 . 17585 1 549 . 1 1 59 59 PRO C C 13 174.700 0.000 . 1 . . . A 59 PRO C . 17585 1 550 . 1 1 59 59 PRO CA C 13 63.340 0.000 . 1 . . . A 59 PRO CA . 17585 1 551 . 1 1 60 60 ASN H H 1 8.122 0.000 . 1 . . . A 60 ASN H . 17585 1 552 . 1 1 60 60 ASN HA H 1 5.285 0.000 . 1 . . . A 60 ASN HA . 17585 1 553 . 1 1 60 60 ASN HB2 H 1 2.564 0.000 . 2 . . . A 60 ASN HB2 . 17585 1 554 . 1 1 60 60 ASN HB3 H 1 3.029 0.000 . 2 . . . A 60 ASN HB3 . 17585 1 555 . 1 1 60 60 ASN HD21 H 1 7.850 0.000 . 2 . . . A 60 ASN HD21 . 17585 1 556 . 1 1 60 60 ASN HD22 H 1 8.130 0.000 . 2 . . . A 60 ASN HD22 . 17585 1 557 . 1 1 60 60 ASN C C 13 171.130 0.000 . 1 . . . A 60 ASN C . 17585 1 558 . 1 1 60 60 ASN CA C 13 53.640 0.000 . 1 . . . A 60 ASN CA . 17585 1 559 . 1 1 60 60 ASN CB C 13 40.130 0.000 . 1 . . . A 60 ASN CB . 17585 1 560 . 1 1 60 60 ASN N N 15 115.290 0.000 . 1 . . . A 60 ASN N . 17585 1 561 . 1 1 60 60 ASN ND2 N 15 118.260 0.000 . 1 . . . A 60 ASN ND2 . 17585 1 562 . 1 1 61 61 GLU H H 1 8.208 0.000 . 1 . . . A 61 GLU H . 17585 1 563 . 1 1 61 61 GLU HA H 1 5.085 0.000 . 1 . . . A 61 GLU HA . 17585 1 564 . 1 1 61 61 GLU HB2 H 1 1.540 0.000 . 2 . . . A 61 GLU HB2 . 17585 1 565 . 1 1 61 61 GLU HB3 H 1 1.895 0.000 . 2 . . . A 61 GLU HB3 . 17585 1 566 . 1 1 61 61 GLU HG2 H 1 1.980 0.000 . 2 . . . A 61 GLU HG2 . 17585 1 567 . 1 1 61 61 GLU HG3 H 1 2.141 0.000 . 2 . . . A 61 GLU HG3 . 17585 1 568 . 1 1 61 61 GLU C C 13 173.720 0.000 . 1 . . . A 61 GLU C . 17585 1 569 . 1 1 61 61 GLU CA C 13 55.060 0.000 . 1 . . . A 61 GLU CA . 17585 1 570 . 1 1 61 61 GLU CB C 13 31.250 0.000 . 1 . . . A 61 GLU CB . 17585 1 571 . 1 1 61 61 GLU N N 15 122.910 0.000 . 1 . . . A 61 GLU N . 17585 1 572 . 1 1 62 62 TYR H H 1 9.002 0.000 . 1 . . . A 62 TYR H . 17585 1 573 . 1 1 62 62 TYR HA H 1 5.289 0.000 . 1 . . . A 62 TYR HA . 17585 1 574 . 1 1 62 62 TYR HB2 H 1 2.458 0.000 . 2 . . . A 62 TYR HB2 . 17585 1 575 . 1 1 62 62 TYR HB3 H 1 2.898 0.000 . 2 . . . A 62 TYR HB3 . 17585 1 576 . 1 1 62 62 TYR HD1 H 1 6.841 0.000 . 3 . . . A 62 TYR HD1 . 17585 1 577 . 1 1 62 62 TYR HD2 H 1 6.841 0.000 . 3 . . . A 62 TYR HD2 . 17585 1 578 . 1 1 62 62 TYR HE1 H 1 6.435 0.000 . 3 . . . A 62 TYR HE1 . 17585 1 579 . 1 1 62 62 TYR HE2 H 1 6.435 0.000 . 3 . . . A 62 TYR HE2 . 17585 1 580 . 1 1 62 62 TYR C C 13 174.170 0.000 . 1 . . . A 62 TYR C . 17585 1 581 . 1 1 62 62 TYR CA C 13 56.630 0.000 . 1 . . . A 62 TYR CA . 17585 1 582 . 1 1 62 62 TYR CB C 13 41.250 0.000 . 1 . . . A 62 TYR CB . 17585 1 583 . 1 1 62 62 TYR N N 15 126.570 0.000 . 1 . . . A 62 TYR N . 17585 1 584 . 1 1 63 63 ILE H H 1 8.791 0.000 . 1 . . . A 63 ILE H . 17585 1 585 . 1 1 63 63 ILE HA H 1 4.777 0.000 . 1 . . . A 63 ILE HA . 17585 1 586 . 1 1 63 63 ILE HB H 1 1.536 0.000 . 1 . . . A 63 ILE HB . 17585 1 587 . 1 1 63 63 ILE HG12 H 1 0.986 0.000 . 2 . . . A 63 ILE HG12 . 17585 1 588 . 1 1 63 63 ILE HG13 H 1 1.274 0.000 . 2 . . . A 63 ILE HG13 . 17585 1 589 . 1 1 63 63 ILE HG21 H 1 0.622 0.000 . . . . . A 63 ILE HG21 . 17585 1 590 . 1 1 63 63 ILE HG22 H 1 0.622 0.000 . . . . . A 63 ILE HG22 . 17585 1 591 . 1 1 63 63 ILE HG23 H 1 0.622 0.000 . . . . . A 63 ILE HG23 . 17585 1 592 . 1 1 63 63 ILE HD11 H 1 0.660 0.000 . . . . . A 63 ILE HD11 . 17585 1 593 . 1 1 63 63 ILE HD12 H 1 0.660 0.000 . . . . . A 63 ILE HD12 . 17585 1 594 . 1 1 63 63 ILE HD13 H 1 0.660 0.000 . . . . . A 63 ILE HD13 . 17585 1 595 . 1 1 63 63 ILE C C 13 176.590 0.000 . 1 . . . A 63 ILE C . 17585 1 596 . 1 1 63 63 ILE CA C 13 59.760 0.000 . 1 . . . A 63 ILE CA . 17585 1 597 . 1 1 63 63 ILE CB C 13 40.760 0.000 . 1 . . . A 63 ILE CB . 17585 1 598 . 1 1 63 63 ILE N N 15 122.240 0.000 . 1 . . . A 63 ILE N . 17585 1 599 . 1 1 64 64 ILE H H 1 9.161 0.000 . 1 . . . A 64 ILE H . 17585 1 600 . 1 1 64 64 ILE HA H 1 4.951 0.000 . 1 . . . A 64 ILE HA . 17585 1 601 . 1 1 64 64 ILE HB H 1 1.756 0.000 . 1 . . . A 64 ILE HB . 17585 1 602 . 1 1 64 64 ILE HG12 H 1 1.257 0.000 . 2 . . . A 64 ILE HG12 . 17585 1 603 . 1 1 64 64 ILE HG13 H 1 1.584 0.000 . 2 . . . A 64 ILE HG13 . 17585 1 604 . 1 1 64 64 ILE HG21 H 1 0.961 0.000 . . . . . A 64 ILE HG21 . 17585 1 605 . 1 1 64 64 ILE HG22 H 1 0.961 0.000 . . . . . A 64 ILE HG22 . 17585 1 606 . 1 1 64 64 ILE HG23 H 1 0.961 0.000 . . . . . A 64 ILE HG23 . 17585 1 607 . 1 1 64 64 ILE HD11 H 1 0.669 0.000 . . . . . A 64 ILE HD11 . 17585 1 608 . 1 1 64 64 ILE HD12 H 1 0.669 0.000 . . . . . A 64 ILE HD12 . 17585 1 609 . 1 1 64 64 ILE HD13 H 1 0.669 0.000 . . . . . A 64 ILE HD13 . 17585 1 610 . 1 1 64 64 ILE C C 13 174.730 0.000 . 1 . . . A 64 ILE C . 17585 1 611 . 1 1 64 64 ILE CA C 13 59.490 0.000 . 1 . . . A 64 ILE CA . 17585 1 612 . 1 1 64 64 ILE CB C 13 39.070 0.000 . 1 . . . A 64 ILE CB . 17585 1 613 . 1 1 64 64 ILE N N 15 130.580 0.000 . 1 . . . A 64 ILE N . 17585 1 614 . 1 1 65 65 THR H H 1 9.230 0.000 . 1 . . . A 65 THR H . 17585 1 615 . 1 1 65 65 THR HA H 1 5.007 0.000 . 1 . . . A 65 THR HA . 17585 1 616 . 1 1 65 65 THR HB H 1 3.699 0.000 . 1 . . . A 65 THR HB . 17585 1 617 . 1 1 65 65 THR HG21 H 1 1.159 0.000 . . . . . A 65 THR HG21 . 17585 1 618 . 1 1 65 65 THR HG22 H 1 1.159 0.000 . . . . . A 65 THR HG22 . 17585 1 619 . 1 1 65 65 THR HG23 H 1 1.159 0.000 . . . . . A 65 THR HG23 . 17585 1 620 . 1 1 65 65 THR C C 13 172.730 0.000 . 1 . . . A 65 THR C . 17585 1 621 . 1 1 65 65 THR CA C 13 62.130 0.000 . 1 . . . A 65 THR CA . 17585 1 622 . 1 1 65 65 THR CB C 13 69.720 0.000 . 1 . . . A 65 THR CB . 17585 1 623 . 1 1 65 65 THR N N 15 125.550 0.000 . 1 . . . A 65 THR N . 17585 1 624 . 1 1 66 66 LEU H H 1 8.749 0.000 . 1 . . . A 66 LEU H . 17585 1 625 . 1 1 66 66 LEU HA H 1 5.126 0.000 . 1 . . . A 66 LEU HA . 17585 1 626 . 1 1 66 66 LEU HB2 H 1 1.883 0.000 . 2 . . . A 66 LEU HB2 . 17585 1 627 . 1 1 66 66 LEU HB3 H 1 2.056 0.000 . 2 . . . A 66 LEU HB3 . 17585 1 628 . 1 1 66 66 LEU HG H 1 1.477 0.000 . 1 . . . A 66 LEU HG . 17585 1 629 . 1 1 66 66 LEU HD11 H 1 0.965 0.000 . . . . . A 66 LEU HD11 . 17585 1 630 . 1 1 66 66 LEU HD12 H 1 0.965 0.000 . . . . . A 66 LEU HD12 . 17585 1 631 . 1 1 66 66 LEU HD13 H 1 0.965 0.000 . . . . . A 66 LEU HD13 . 17585 1 632 . 1 1 66 66 LEU HD21 H 1 0.673 0.000 . . . . . A 66 LEU HD21 . 17585 1 633 . 1 1 66 66 LEU HD22 H 1 0.673 0.000 . . . . . A 66 LEU HD22 . 17585 1 634 . 1 1 66 66 LEU HD23 H 1 0.673 0.000 . . . . . A 66 LEU HD23 . 17585 1 635 . 1 1 66 66 LEU C C 13 177.010 0.000 . 1 . . . A 66 LEU C . 17585 1 636 . 1 1 66 66 LEU CA C 13 53.070 0.000 . 1 . . . A 66 LEU CA . 17585 1 637 . 1 1 66 66 LEU N N 15 124.820 0.000 . 1 . . . A 66 LEU N . 17585 1 638 . 1 1 67 67 GLY H H 1 9.858 0.000 . 1 . . . A 67 GLY H . 17585 1 639 . 1 1 67 67 GLY HA2 H 1 3.587 0.000 . 2 . . . A 67 GLY HA2 . 17585 1 640 . 1 1 67 67 GLY HA3 H 1 4.978 0.000 . 2 . . . A 67 GLY HA3 . 17585 1 641 . 1 1 67 67 GLY C C 13 174.440 0.000 . 1 . . . A 67 GLY C . 17585 1 642 . 1 1 67 67 GLY CA C 13 44.820 0.000 . 1 . . . A 67 GLY CA . 17585 1 643 . 1 1 67 67 GLY N N 15 107.920 0.000 . 1 . . . A 67 GLY N . 17585 1 644 . 1 1 68 68 VAL H H 1 8.147 0.000 . 1 . . . A 68 VAL H . 17585 1 645 . 1 1 68 68 VAL HA H 1 3.689 0.000 . 1 . . . A 68 VAL HA . 17585 1 646 . 1 1 68 68 VAL HB H 1 1.908 0.000 . 1 . . . A 68 VAL HB . 17585 1 647 . 1 1 68 68 VAL HG11 H 1 0.941 0.000 . . . . . A 68 VAL HG11 . 17585 1 648 . 1 1 68 68 VAL HG12 H 1 0.941 0.000 . . . . . A 68 VAL HG12 . 17585 1 649 . 1 1 68 68 VAL HG13 H 1 0.941 0.000 . . . . . A 68 VAL HG13 . 17585 1 650 . 1 1 68 68 VAL HG21 H 1 0.864 0.000 . . . . . A 68 VAL HG21 . 17585 1 651 . 1 1 68 68 VAL HG22 H 1 0.864 0.000 . . . . . A 68 VAL HG22 . 17585 1 652 . 1 1 68 68 VAL HG23 H 1 0.864 0.000 . . . . . A 68 VAL HG23 . 17585 1 653 . 1 1 68 68 VAL C C 13 178.070 0.000 . 1 . . . A 68 VAL C . 17585 1 654 . 1 1 68 68 VAL CA C 13 66.680 0.000 . 1 . . . A 68 VAL CA . 17585 1 655 . 1 1 68 68 VAL CB C 13 32.370 0.000 . 1 . . . A 68 VAL CB . 17585 1 656 . 1 1 68 68 VAL N N 15 117.300 0.000 . 1 . . . A 68 VAL N . 17585 1 657 . 1 1 69 69 HIS H H 1 8.515 0.000 . 1 . . . A 69 HIS H . 17585 1 658 . 1 1 69 69 HIS HA H 1 4.456 0.000 . 1 . . . A 69 HIS HA . 17585 1 659 . 1 1 69 69 HIS HB2 H 1 3.261 0.000 . 2 . . . A 69 HIS HB2 . 17585 1 660 . 1 1 69 69 HIS HB3 H 1 3.331 0.000 . 2 . . . A 69 HIS HB3 . 17585 1 661 . 1 1 69 69 HIS C C 13 177.610 0.000 . 1 . . . A 69 HIS C . 17585 1 662 . 1 1 69 69 HIS CA C 13 59.190 0.000 . 1 . . . A 69 HIS CA . 17585 1 663 . 1 1 69 69 HIS CB C 13 28.500 0.000 . 1 . . . A 69 HIS CB . 17585 1 664 . 1 1 69 69 HIS N N 15 116.220 0.000 . 1 . . . A 69 HIS N . 17585 1 665 . 1 1 70 70 ASP H H 1 8.597 0.000 . 1 . . . A 70 ASP H . 17585 1 666 . 1 1 70 70 ASP HA H 1 4.615 0.000 . 1 . . . A 70 ASP HA . 17585 1 667 . 1 1 70 70 ASP HB2 H 1 2.609 0.000 . 2 . . . A 70 ASP HB2 . 17585 1 668 . 1 1 70 70 ASP HB3 H 1 2.743 0.000 . 2 . . . A 70 ASP HB3 . 17585 1 669 . 1 1 70 70 ASP C C 13 177.740 0.000 . 1 . . . A 70 ASP C . 17585 1 670 . 1 1 70 70 ASP CA C 13 57.390 0.000 . 1 . . . A 70 ASP CA . 17585 1 671 . 1 1 70 70 ASP CB C 13 40.760 0.000 . 1 . . . A 70 ASP CB . 17585 1 672 . 1 1 70 70 ASP N N 15 119.910 0.000 . 1 . . . A 70 ASP N . 17585 1 673 . 1 1 71 71 PHE H H 1 8.952 0.000 . 1 . . . A 71 PHE H . 17585 1 674 . 1 1 71 71 PHE HA H 1 3.893 0.000 . 1 . . . A 71 PHE HA . 17585 1 675 . 1 1 71 71 PHE HB2 H 1 3.061 0.000 . 2 . . . A 71 PHE HB2 . 17585 1 676 . 1 1 71 71 PHE HB3 H 1 3.220 0.000 . 2 . . . A 71 PHE HB3 . 17585 1 677 . 1 1 71 71 PHE HD1 H 1 6.991 0.000 . 3 . . . A 71 PHE HD1 . 17585 1 678 . 1 1 71 71 PHE HD2 H 1 6.991 0.000 . 3 . . . A 71 PHE HD2 . 17585 1 679 . 1 1 71 71 PHE HE1 H 1 7.169 0.000 . 3 . . . A 71 PHE HE1 . 17585 1 680 . 1 1 71 71 PHE HE2 H 1 7.169 0.000 . 3 . . . A 71 PHE HE2 . 17585 1 681 . 1 1 71 71 PHE HZ H 1 7.313 0.000 . 1 . . . A 71 PHE HZ . 17585 1 682 . 1 1 71 71 PHE C C 13 179.010 0.000 . 1 . . . A 71 PHE C . 17585 1 683 . 1 1 71 71 PHE CA C 13 62.170 0.000 . 1 . . . A 71 PHE CA . 17585 1 684 . 1 1 71 71 PHE CB C 13 40.130 0.000 . 1 . . . A 71 PHE CB . 17585 1 685 . 1 1 71 71 PHE N N 15 121.200 0.000 . 1 . . . A 71 PHE N . 17585 1 686 . 1 1 72 72 GLU H H 1 8.255 0.000 . 1 . . . A 72 GLU H . 17585 1 687 . 1 1 72 72 GLU HA H 1 4.020 0.000 . 1 . . . A 72 GLU HA . 17585 1 688 . 1 1 72 72 GLU HB2 H 1 2.103 0.000 . 2 . . . A 72 GLU HB2 . 17585 1 689 . 1 1 72 72 GLU HB3 H 1 2.266 0.000 . 2 . . . A 72 GLU HB3 . 17585 1 690 . 1 1 72 72 GLU HG2 H 1 2.458 0.000 . 2 . . . A 72 GLU HG2 . 17585 1 691 . 1 1 72 72 GLU HG3 H 1 2.739 0.000 . 2 . . . A 72 GLU HG3 . 17585 1 692 . 1 1 72 72 GLU C C 13 179.170 0.000 . 1 . . . A 72 GLU C . 17585 1 693 . 1 1 72 72 GLU CA C 13 58.920 0.000 . 1 . . . A 72 GLU CA . 17585 1 694 . 1 1 72 72 GLU CB C 13 29.200 0.000 . 1 . . . A 72 GLU CB . 17585 1 695 . 1 1 72 72 GLU N N 15 117.880 0.000 . 1 . . . A 72 GLU N . 17585 1 696 . 1 1 73 73 LYS H H 1 7.425 0.000 . 1 . . . A 73 LYS H . 17585 1 697 . 1 1 73 73 LYS HA H 1 3.988 0.000 . 1 . . . A 73 LYS HA . 17585 1 698 . 1 1 73 73 LYS HB2 H 1 1.750 0.000 . 2 . . . A 73 LYS HB2 . 17585 1 699 . 1 1 73 73 LYS HB3 H 1 1.940 0.000 . 2 . . . A 73 LYS HB3 . 17585 1 700 . 1 1 73 73 LYS HG3 H 1 1.415 0.000 . 2 . . . A 73 LYS HG3 . 17585 1 701 . 1 1 73 73 LYS HD3 H 1 1.630 0.000 . 2 . . . A 73 LYS HD3 . 17585 1 702 . 1 1 73 73 LYS C C 13 177.840 0.000 . 1 . . . A 73 LYS C . 17585 1 703 . 1 1 73 73 LYS CA C 13 57.730 0.000 . 1 . . . A 73 LYS CA . 17585 1 704 . 1 1 73 73 LYS CB C 13 32.520 0.000 . 1 . . . A 73 LYS CB . 17585 1 705 . 1 1 73 73 LYS N N 15 118.180 0.000 . 1 . . . A 73 LYS N . 17585 1 706 . 1 1 74 74 LEU H H 1 7.418 0.000 . 1 . . . A 74 LEU H . 17585 1 707 . 1 1 74 74 LEU HA H 1 3.784 0.000 . 1 . . . A 74 LEU HA . 17585 1 708 . 1 1 74 74 LEU HB2 H 1 1.102 0.000 . 2 . . . A 74 LEU HB2 . 17585 1 709 . 1 1 74 74 LEU HB3 H 1 1.453 0.000 . 2 . . . A 74 LEU HB3 . 17585 1 710 . 1 1 74 74 LEU HG H 1 0.870 0.000 . 1 . . . A 74 LEU HG . 17585 1 711 . 1 1 74 74 LEU HD11 H 1 0.249 0.000 . . . . . A 74 LEU HD11 . 17585 1 712 . 1 1 74 74 LEU HD12 H 1 0.249 0.000 . . . . . A 74 LEU HD12 . 17585 1 713 . 1 1 74 74 LEU HD13 H 1 0.249 0.000 . . . . . A 74 LEU HD13 . 17585 1 714 . 1 1 74 74 LEU HD21 H 1 0.089 0.000 . . . . . A 74 LEU HD21 . 17585 1 715 . 1 1 74 74 LEU HD22 H 1 0.089 0.000 . . . . . A 74 LEU HD22 . 17585 1 716 . 1 1 74 74 LEU HD23 H 1 0.089 0.000 . . . . . A 74 LEU HD23 . 17585 1 717 . 1 1 74 74 LEU C C 13 177.590 0.000 . 1 . . . A 74 LEU C . 17585 1 718 . 1 1 74 74 LEU CA C 13 56.740 0.000 . 1 . . . A 74 LEU CA . 17585 1 719 . 1 1 74 74 LEU CB C 13 42.240 0.000 . 1 . . . A 74 LEU CB . 17585 1 720 . 1 1 74 74 LEU N N 15 117.740 0.000 . 1 . . . A 74 LEU N . 17585 1 721 . 1 1 75 75 GLY H H 1 7.320 0.000 . 1 . . . A 75 GLY H . 17585 1 722 . 1 1 75 75 GLY HA2 H 1 3.688 0.000 . 2 . . . A 75 GLY HA2 . 17585 1 723 . 1 1 75 75 GLY HA3 H 1 3.871 0.000 . 2 . . . A 75 GLY HA3 . 17585 1 724 . 1 1 75 75 GLY C C 13 173.670 0.000 . 1 . . . A 75 GLY C . 17585 1 725 . 1 1 75 75 GLY CA C 13 45.080 0.000 . 1 . . . A 75 GLY CA . 17585 1 726 . 1 1 75 75 GLY N N 15 103.440 0.000 . 1 . . . A 75 GLY N . 17585 1 727 . 1 1 76 76 ALA H H 1 7.862 0.000 . 1 . . . A 76 ALA H . 17585 1 728 . 1 1 76 76 ALA HA H 1 4.199 0.000 . 1 . . . A 76 ALA HA . 17585 1 729 . 1 1 76 76 ALA HB1 H 1 1.395 0.000 . . . . . A 76 ALA HB1 . 17585 1 730 . 1 1 76 76 ALA HB2 H 1 1.395 0.000 . . . . . A 76 ALA HB2 . 17585 1 731 . 1 1 76 76 ALA HB3 H 1 1.395 0.000 . . . . . A 76 ALA HB3 . 17585 1 732 . 1 1 76 76 ALA C C 13 177.420 0.000 . 1 . . . A 76 ALA C . 17585 1 733 . 1 1 76 76 ALA CA C 13 53.110 0.000 . 1 . . . A 76 ALA CA . 17585 1 734 . 1 1 76 76 ALA CB C 13 19.620 0.000 . 1 . . . A 76 ALA CB . 17585 1 735 . 1 1 76 76 ALA N N 15 120.860 0.000 . 1 . . . A 76 ALA N . 17585 1 736 . 1 1 77 77 ASP H H 1 8.077 0.000 . 1 . . . A 77 ASP H . 17585 1 737 . 1 1 77 77 ASP HA H 1 5.038 0.000 . 1 . . . A 77 ASP HA . 17585 1 738 . 1 1 77 77 ASP HB2 H 1 2.885 0.000 . 2 . . . A 77 ASP HB2 . 17585 1 739 . 1 1 77 77 ASP HB3 H 1 2.594 0.000 . 2 . . . A 77 ASP HB3 . 17585 1 740 . 1 1 77 77 ASP CA C 13 51.770 0.000 . 1 . . . A 77 ASP CA . 17585 1 741 . 1 1 77 77 ASP N N 15 115.980 0.000 . 1 . . . A 77 ASP N . 17585 1 742 . 1 1 78 78 PRO HA H 1 4.148 0.000 . 1 . . . A 78 PRO HA . 17585 1 743 . 1 1 78 78 PRO HB2 H 1 2.344 0.000 . 2 . . . A 78 PRO HB2 . 17585 1 744 . 1 1 78 78 PRO HB3 H 1 2.107 0.000 . 2 . . . A 78 PRO HB3 . 17585 1 745 . 1 1 78 78 PRO HG2 H 1 2.107 0.000 . 2 . . . A 78 PRO HG2 . 17585 1 746 . 1 1 78 78 PRO HG3 H 1 2.344 0.000 . 2 . . . A 78 PRO HG3 . 17585 1 747 . 1 1 78 78 PRO HD2 H 1 3.699 0.000 . 2 . . . A 78 PRO HD2 . 17585 1 748 . 1 1 78 78 PRO HD3 H 1 3.899 0.000 . 2 . . . A 78 PRO HD3 . 17585 1 749 . 1 1 78 78 PRO C C 13 178.110 0.000 . 1 . . . A 78 PRO C . 17585 1 750 . 1 1 78 78 PRO CA C 13 65.160 0.000 . 1 . . . A 78 PRO CA . 17585 1 751 . 1 1 78 78 PRO CB C 13 32.590 0.000 . 1 . . . A 78 PRO CB . 17585 1 752 . 1 1 79 79 GLU H H 1 8.624 0.000 . 1 . . . A 79 GLU H . 17585 1 753 . 1 1 79 79 GLU HA H 1 4.430 0.000 . 1 . . . A 79 GLU HA . 17585 1 754 . 1 1 79 79 GLU HB2 H 1 2.185 0.000 . 2 . . . A 79 GLU HB2 . 17585 1 755 . 1 1 79 79 GLU HB3 H 1 2.185 0.000 . 2 . . . A 79 GLU HB3 . 17585 1 756 . 1 1 79 79 GLU HG2 H 1 2.498 0.000 . 2 . . . A 79 GLU HG2 . 17585 1 757 . 1 1 79 79 GLU HG3 H 1 2.498 0.000 . 2 . . . A 79 GLU HG3 . 17585 1 758 . 1 1 79 79 GLU C C 13 178.750 0.000 . 1 . . . A 79 GLU C . 17585 1 759 . 1 1 79 79 GLU CA C 13 58.530 0.000 . 1 . . . A 79 GLU CA . 17585 1 760 . 1 1 79 79 GLU CB C 13 28.710 0.000 . 1 . . . A 79 GLU CB . 17585 1 761 . 1 1 79 79 GLU N N 15 117.050 0.000 . 1 . . . A 79 GLU N . 17585 1 762 . 1 1 80 80 LEU H H 1 7.809 0.000 . 1 . . . A 80 LEU H . 17585 1 763 . 1 1 80 80 LEU HA H 1 4.279 0.000 . 1 . . . A 80 LEU HA . 17585 1 764 . 1 1 80 80 LEU HB2 H 1 1.669 0.000 . 2 . . . A 80 LEU HB2 . 17585 1 765 . 1 1 80 80 LEU HB3 H 1 1.792 0.000 . 2 . . . A 80 LEU HB3 . 17585 1 766 . 1 1 80 80 LEU HG H 1 1.403 0.000 . 1 . . . A 80 LEU HG . 17585 1 767 . 1 1 80 80 LEU HD11 H 1 0.929 0.000 . . . . . A 80 LEU HD11 . 17585 1 768 . 1 1 80 80 LEU HD12 H 1 0.929 0.000 . . . . . A 80 LEU HD12 . 17585 1 769 . 1 1 80 80 LEU HD13 H 1 0.929 0.000 . . . . . A 80 LEU HD13 . 17585 1 770 . 1 1 80 80 LEU HD21 H 1 0.848 0.000 . . . . . A 80 LEU HD21 . 17585 1 771 . 1 1 80 80 LEU HD22 H 1 0.848 0.000 . . . . . A 80 LEU HD22 . 17585 1 772 . 1 1 80 80 LEU HD23 H 1 0.848 0.000 . . . . . A 80 LEU HD23 . 17585 1 773 . 1 1 80 80 LEU C C 13 178.490 0.000 . 1 . . . A 80 LEU C . 17585 1 774 . 1 1 80 80 LEU CA C 13 56.930 0.000 . 1 . . . A 80 LEU CA . 17585 1 775 . 1 1 80 80 LEU CB C 13 42.030 0.000 . 1 . . . A 80 LEU CB . 17585 1 776 . 1 1 80 80 LEU N N 15 120.660 0.000 . 1 . . . A 80 LEU N . 17585 1 777 . 1 1 81 81 LYS H H 1 7.892 0.000 . 1 . . . A 81 LYS H . 17585 1 778 . 1 1 81 81 LYS HA H 1 4.452 0.000 . 1 . . . A 81 LYS HA . 17585 1 779 . 1 1 81 81 LYS HB3 H 1 2.023 0.000 . 2 . . . A 81 LYS HB3 . 17585 1 780 . 1 1 81 81 LYS HG3 H 1 1.480 0.000 . 2 . . . A 81 LYS HG3 . 17585 1 781 . 1 1 81 81 LYS HD3 H 1 1.650 0.000 . 2 . . . A 81 LYS HD3 . 17585 1 782 . 1 1 81 81 LYS C C 13 177.420 0.000 . 1 . . . A 81 LYS C . 17585 1 783 . 1 1 81 81 LYS CA C 13 57.420 0.000 . 1 . . . A 81 LYS CA . 17585 1 784 . 1 1 81 81 LYS CB C 13 33.010 0.000 . 1 . . . A 81 LYS CB . 17585 1 785 . 1 1 81 81 LYS N N 15 117.350 0.000 . 1 . . . A 81 LYS N . 17585 1 786 . 1 1 82 82 SER H H 1 8.255 0.000 . 1 . . . A 82 SER H . 17585 1 787 . 1 1 82 82 SER HA H 1 4.490 0.000 . 1 . . . A 82 SER HA . 17585 1 788 . 1 1 82 82 SER HB2 H 1 3.894 0.000 . 2 . . . A 82 SER HB2 . 17585 1 789 . 1 1 82 82 SER HB3 H 1 3.894 0.000 . 2 . . . A 82 SER HB3 . 17585 1 790 . 1 1 82 82 SER C C 13 175.940 0.000 . 1 . . . A 82 SER C . 17585 1 791 . 1 1 82 82 SER CA C 13 60.330 0.000 . 1 . . . A 82 SER CA . 17585 1 792 . 1 1 82 82 SER CB C 13 64.290 0.000 . 1 . . . A 82 SER CB . 17585 1 793 . 1 1 82 82 SER N N 15 114.260 0.000 . 1 . . . A 82 SER N . 17585 1 794 . 1 1 83 83 THR H H 1 7.703 0.000 . 1 . . . A 83 THR H . 17585 1 795 . 1 1 83 83 THR HA H 1 4.169 0.000 . 1 . . . A 83 THR HA . 17585 1 796 . 1 1 83 83 THR HB H 1 4.127 0.000 . 1 . . . A 83 THR HB . 17585 1 797 . 1 1 83 83 THR HG21 H 1 1.307 0.000 . . . . . A 83 THR HG21 . 17585 1 798 . 1 1 83 83 THR HG22 H 1 1.307 0.000 . . . . . A 83 THR HG22 . 17585 1 799 . 1 1 83 83 THR HG23 H 1 1.307 0.000 . . . . . A 83 THR HG23 . 17585 1 800 . 1 1 83 83 THR C C 13 176.400 0.000 . 1 . . . A 83 THR C . 17585 1 801 . 1 1 83 83 THR CA C 13 65.290 0.000 . 1 . . . A 83 THR CA . 17585 1 802 . 1 1 83 83 THR CB C 13 69.650 0.000 . 1 . . . A 83 THR CB . 17585 1 803 . 1 1 83 83 THR N N 15 115.490 0.000 . 1 . . . A 83 THR N . 17585 1 804 . 1 1 84 84 GLY H H 1 8.397 0.000 . 1 . . . A 84 GLY H . 17585 1 805 . 1 1 84 84 GLY HA2 H 1 3.670 0.000 . 2 . . . A 84 GLY HA2 . 17585 1 806 . 1 1 84 84 GLY HA3 H 1 3.829 0.000 . 2 . . . A 84 GLY HA3 . 17585 1 807 . 1 1 84 84 GLY C C 13 175.860 0.000 . 1 . . . A 84 GLY C . 17585 1 808 . 1 1 84 84 GLY CA C 13 47.290 0.000 . 1 . . . A 84 GLY CA . 17585 1 809 . 1 1 84 84 GLY N N 15 111.140 0.000 . 1 . . . A 84 GLY N . 17585 1 810 . 1 1 85 85 PHE H H 1 7.520 0.000 . 1 . . . A 85 PHE H . 17585 1 811 . 1 1 85 85 PHE HA H 1 4.457 0.000 . 1 . . . A 85 PHE HA . 17585 1 812 . 1 1 85 85 PHE HB2 H 1 2.940 0.000 . 2 . . . A 85 PHE HB2 . 17585 1 813 . 1 1 85 85 PHE HB3 H 1 2.940 0.000 . 2 . . . A 85 PHE HB3 . 17585 1 814 . 1 1 85 85 PHE HD1 H 1 7.283 0.000 . 3 . . . A 85 PHE HD1 . 17585 1 815 . 1 1 85 85 PHE HD2 H 1 7.283 0.000 . 3 . . . A 85 PHE HD2 . 17585 1 816 . 1 1 85 85 PHE HE1 H 1 7.126 0.000 . 3 . . . A 85 PHE HE1 . 17585 1 817 . 1 1 85 85 PHE HE2 H 1 7.126 0.000 . 3 . . . A 85 PHE HE2 . 17585 1 818 . 1 1 85 85 PHE HZ H 1 6.662 0.000 . 1 . . . A 85 PHE HZ . 17585 1 819 . 1 1 85 85 PHE C C 13 178.730 0.000 . 1 . . . A 85 PHE C . 17585 1 820 . 1 1 85 85 PHE CA C 13 59.940 0.000 . 1 . . . A 85 PHE CA . 17585 1 821 . 1 1 85 85 PHE CB C 13 39.070 0.000 . 1 . . . A 85 PHE CB . 17585 1 822 . 1 1 85 85 PHE N N 15 118.810 0.000 . 1 . . . A 85 PHE N . 17585 1 823 . 1 1 86 86 ALA H H 1 8.213 0.000 . 1 . . . A 86 ALA H . 17585 1 824 . 1 1 86 86 ALA HA H 1 3.870 0.000 . 1 . . . A 86 ALA HA . 17585 1 825 . 1 1 86 86 ALA HB1 H 1 1.573 0.000 . . . . . A 86 ALA HB1 . 17585 1 826 . 1 1 86 86 ALA HB2 H 1 1.573 0.000 . . . . . A 86 ALA HB2 . 17585 1 827 . 1 1 86 86 ALA HB3 H 1 1.573 0.000 . . . . . A 86 ALA HB3 . 17585 1 828 . 1 1 86 86 ALA C C 13 178.640 0.000 . 1 . . . A 86 ALA C . 17585 1 829 . 1 1 86 86 ALA CA C 13 55.680 0.000 . 1 . . . A 86 ALA CA . 17585 1 830 . 1 1 86 86 ALA CB C 13 18.920 0.000 . 1 . . . A 86 ALA CB . 17585 1 831 . 1 1 86 86 ALA N N 15 121.340 0.000 . 1 . . . A 86 ALA N . 17585 1 832 . 1 1 87 87 ARG H H 1 8.111 0.000 . 1 . . . A 87 ARG H . 17585 1 833 . 1 1 87 87 ARG HA H 1 4.088 0.000 . 1 . . . A 87 ARG HA . 17585 1 834 . 1 1 87 87 ARG HB2 H 1 1.965 0.000 . 2 . . . A 87 ARG HB2 . 17585 1 835 . 1 1 87 87 ARG HB3 H 1 1.965 0.000 . 2 . . . A 87 ARG HB3 . 17585 1 836 . 1 1 87 87 ARG HG2 H 1 1.760 0.000 . 2 . . . A 87 ARG HG2 . 17585 1 837 . 1 1 87 87 ARG HG3 H 1 1.760 0.000 . 2 . . . A 87 ARG HG3 . 17585 1 838 . 1 1 87 87 ARG HD2 H 1 3.249 0.000 . 2 . . . A 87 ARG HD2 . 17585 1 839 . 1 1 87 87 ARG HD3 H 1 3.249 0.000 . 2 . . . A 87 ARG HD3 . 17585 1 840 . 1 1 87 87 ARG HE H 1 7.246 0.000 . 1 . . . A 87 ARG HE . 17585 1 841 . 1 1 87 87 ARG C C 13 178.580 0.000 . 1 . . . A 87 ARG C . 17585 1 842 . 1 1 87 87 ARG CA C 13 59.150 0.000 . 1 . . . A 87 ARG CA . 17585 1 843 . 1 1 87 87 ARG CB C 13 30.330 0.000 . 1 . . . A 87 ARG CB . 17585 1 844 . 1 1 87 87 ARG N N 15 119.250 0.000 . 1 . . . A 87 ARG N . 17585 1 845 . 1 1 87 87 ARG NE N 15 85.340 0.000 . 1 . . . A 87 ARG NE . 17585 1 846 . 1 1 88 88 ASP H H 1 7.912 0.000 . 1 . . . A 88 ASP H . 17585 1 847 . 1 1 88 88 ASP HA H 1 4.420 0.000 . 1 . . . A 88 ASP HA . 17585 1 848 . 1 1 88 88 ASP HB2 H 1 2.760 0.000 . 2 . . . A 88 ASP HB2 . 17585 1 849 . 1 1 88 88 ASP HB3 H 1 2.760 0.000 . 2 . . . A 88 ASP HB3 . 17585 1 850 . 1 1 88 88 ASP C C 13 178.980 0.000 . 1 . . . A 88 ASP C . 17585 1 851 . 1 1 88 88 ASP CA C 13 56.930 0.000 . 1 . . . A 88 ASP CA . 17585 1 852 . 1 1 88 88 ASP CB C 13 39.910 0.000 . 1 . . . A 88 ASP CB . 17585 1 853 . 1 1 88 88 ASP N N 15 118.370 0.000 . 1 . . . A 88 ASP N . 17585 1 854 . 1 1 89 89 LEU H H 1 8.011 0.000 . 1 . . . A 89 LEU H . 17585 1 855 . 1 1 89 89 LEU HA H 1 4.181 0.000 . 1 . . . A 89 LEU HA . 17585 1 856 . 1 1 89 89 LEU HB2 H 1 1.467 0.000 . 2 . . . A 89 LEU HB2 . 17585 1 857 . 1 1 89 89 LEU HB3 H 1 1.682 0.000 . 2 . . . A 89 LEU HB3 . 17585 1 858 . 1 1 89 89 LEU HG H 1 1.415 0.000 . 1 . . . A 89 LEU HG . 17585 1 859 . 1 1 89 89 LEU HD11 H 1 0.576 0.000 . . . . . A 89 LEU HD11 . 17585 1 860 . 1 1 89 89 LEU HD12 H 1 0.576 0.000 . . . . . A 89 LEU HD12 . 17585 1 861 . 1 1 89 89 LEU HD13 H 1 0.576 0.000 . . . . . A 89 LEU HD13 . 17585 1 862 . 1 1 89 89 LEU HD21 H 1 -0.010 0.000 . . . . . A 89 LEU HD21 . 17585 1 863 . 1 1 89 89 LEU HD22 H 1 -0.010 0.000 . . . . . A 89 LEU HD22 . 17585 1 864 . 1 1 89 89 LEU HD23 H 1 -0.010 0.000 . . . . . A 89 LEU HD23 . 17585 1 865 . 1 1 89 89 LEU C C 13 178.120 0.000 . 1 . . . A 89 LEU C . 17585 1 866 . 1 1 89 89 LEU CA C 13 57.520 0.000 . 1 . . . A 89 LEU CA . 17585 1 867 . 1 1 89 89 LEU CB C 13 42.730 0.000 . 1 . . . A 89 LEU CB . 17585 1 868 . 1 1 89 89 LEU N N 15 123.080 0.000 . 1 . . . A 89 LEU N . 17585 1 869 . 1 1 90 90 ALA H H 1 8.770 0.000 . 1 . . . A 90 ALA H . 17585 1 870 . 1 1 90 90 ALA HA H 1 4.078 0.000 . 1 . . . A 90 ALA HA . 17585 1 871 . 1 1 90 90 ALA HB1 H 1 1.612 0.000 . . . . . A 90 ALA HB1 . 17585 1 872 . 1 1 90 90 ALA HB2 H 1 1.612 0.000 . . . . . A 90 ALA HB2 . 17585 1 873 . 1 1 90 90 ALA HB3 H 1 1.612 0.000 . . . . . A 90 ALA HB3 . 17585 1 874 . 1 1 90 90 ALA C C 13 180.680 0.000 . 1 . . . A 90 ALA C . 17585 1 875 . 1 1 90 90 ALA CA C 13 56.100 0.000 . 1 . . . A 90 ALA CA . 17585 1 876 . 1 1 90 90 ALA CB C 13 18.350 0.000 . 1 . . . A 90 ALA CB . 17585 1 877 . 1 1 90 90 ALA N N 15 122.190 0.000 . 1 . . . A 90 ALA N . 17585 1 878 . 1 1 91 91 ASP H H 1 8.134 0.000 . 1 . . . A 91 ASP H . 17585 1 879 . 1 1 91 91 ASP HA H 1 4.429 0.000 . 1 . . . A 91 ASP HA . 17585 1 880 . 1 1 91 91 ASP HB2 H 1 2.774 0.000 . 2 . . . A 91 ASP HB2 . 17585 1 881 . 1 1 91 91 ASP HB3 H 1 2.939 0.000 . 2 . . . A 91 ASP HB3 . 17585 1 882 . 1 1 91 91 ASP C C 13 177.630 0.000 . 1 . . . A 91 ASP C . 17585 1 883 . 1 1 91 91 ASP CA C 13 57.390 0.000 . 1 . . . A 91 ASP CA . 17585 1 884 . 1 1 91 91 ASP CB C 13 40.130 0.000 . 1 . . . A 91 ASP CB . 17585 1 885 . 1 1 91 91 ASP N N 15 118.180 0.000 . 1 . . . A 91 ASP N . 17585 1 886 . 1 1 92 92 TYR H H 1 7.778 0.000 . 1 . . . A 92 TYR H . 17585 1 887 . 1 1 92 92 TYR HA H 1 4.176 0.000 . 1 . . . A 92 TYR HA . 17585 1 888 . 1 1 92 92 TYR HB2 H 1 3.206 0.000 . 2 . . . A 92 TYR HB2 . 17585 1 889 . 1 1 92 92 TYR HB3 H 1 3.206 0.000 . 2 . . . A 92 TYR HB3 . 17585 1 890 . 1 1 92 92 TYR HD1 H 1 7.007 0.000 . 3 . . . A 92 TYR HD1 . 17585 1 891 . 1 1 92 92 TYR HD2 H 1 7.007 0.000 . 3 . . . A 92 TYR HD2 . 17585 1 892 . 1 1 92 92 TYR HE1 H 1 6.864 0.000 . 3 . . . A 92 TYR HE1 . 17585 1 893 . 1 1 92 92 TYR HE2 H 1 6.864 0.000 . 3 . . . A 92 TYR HE2 . 17585 1 894 . 1 1 92 92 TYR C C 13 176.630 0.000 . 1 . . . A 92 TYR C . 17585 1 895 . 1 1 92 92 TYR CA C 13 61.530 0.000 . 1 . . . A 92 TYR CA . 17585 1 896 . 1 1 92 92 TYR CB C 13 38.500 0.000 . 1 . . . A 92 TYR CB . 17585 1 897 . 1 1 92 92 TYR N N 15 122.350 0.000 . 1 . . . A 92 TYR N . 17585 1 898 . 1 1 93 93 ILE H H 1 8.629 0.000 . 1 . . . A 93 ILE H . 17585 1 899 . 1 1 93 93 ILE HA H 1 3.342 0.000 . 1 . . . A 93 ILE HA . 17585 1 900 . 1 1 93 93 ILE HB H 1 2.024 0.000 . 1 . . . A 93 ILE HB . 17585 1 901 . 1 1 93 93 ILE HG12 H 1 1.041 0.000 . 2 . . . A 93 ILE HG12 . 17585 1 902 . 1 1 93 93 ILE HG13 H 1 1.218 0.000 . 2 . . . A 93 ILE HG13 . 17585 1 903 . 1 1 93 93 ILE HG21 H 1 0.780 0.000 . . . . . A 93 ILE HG21 . 17585 1 904 . 1 1 93 93 ILE HG22 H 1 0.780 0.000 . . . . . A 93 ILE HG22 . 17585 1 905 . 1 1 93 93 ILE HG23 H 1 0.780 0.000 . . . . . A 93 ILE HG23 . 17585 1 906 . 1 1 93 93 ILE HD11 H 1 0.730 0.000 . . . . . A 93 ILE HD11 . 17585 1 907 . 1 1 93 93 ILE HD12 H 1 0.730 0.000 . . . . . A 93 ILE HD12 . 17585 1 908 . 1 1 93 93 ILE HD13 H 1 0.730 0.000 . . . . . A 93 ILE HD13 . 17585 1 909 . 1 1 93 93 ILE C C 13 177.710 0.000 . 1 . . . A 93 ILE C . 17585 1 910 . 1 1 93 93 ILE CA C 13 65.780 0.000 . 1 . . . A 93 ILE CA . 17585 1 911 . 1 1 93 93 ILE CB C 13 39.280 0.000 . 1 . . . A 93 ILE CB . 17585 1 912 . 1 1 93 93 ILE N N 15 119.940 0.000 . 1 . . . A 93 ILE N . 17585 1 913 . 1 1 94 94 GLN H H 1 7.938 0.000 . 1 . . . A 94 GLN H . 17585 1 914 . 1 1 94 94 GLN HA H 1 4.139 0.000 . 1 . . . A 94 GLN HA . 17585 1 915 . 1 1 94 94 GLN HB2 H 1 2.235 0.000 . 2 . . . A 94 GLN HB2 . 17585 1 916 . 1 1 94 94 GLN HB3 H 1 2.235 0.000 . 2 . . . A 94 GLN HB3 . 17585 1 917 . 1 1 94 94 GLN HG2 H 1 2.437 0.000 . 2 . . . A 94 GLN HG2 . 17585 1 918 . 1 1 94 94 GLN HG3 H 1 2.541 0.000 . 2 . . . A 94 GLN HG3 . 17585 1 919 . 1 1 94 94 GLN HE21 H 1 6.786 0.000 . 2 . . . A 94 GLN HE21 . 17585 1 920 . 1 1 94 94 GLN HE22 H 1 7.434 0.000 . 2 . . . A 94 GLN HE22 . 17585 1 921 . 1 1 94 94 GLN C C 13 180.530 0.000 . 1 . . . A 94 GLN C . 17585 1 922 . 1 1 94 94 GLN CA C 13 59.020 0.000 . 1 . . . A 94 GLN CA . 17585 1 923 . 1 1 94 94 GLN CB C 13 28.850 0.000 . 1 . . . A 94 GLN CB . 17585 1 924 . 1 1 94 94 GLN N N 15 117.350 0.000 . 1 . . . A 94 GLN N . 17585 1 925 . 1 1 94 94 GLN NE2 N 15 111.300 0.000 . 1 . . . A 94 GLN NE2 . 17585 1 926 . 1 1 95 95 GLU H H 1 8.321 0.000 . 1 . . . A 95 GLU H . 17585 1 927 . 1 1 95 95 GLU HA H 1 3.890 0.000 . 1 . . . A 95 GLU HA . 17585 1 928 . 1 1 95 95 GLU HB2 H 1 2.128 0.000 . 2 . . . A 95 GLU HB2 . 17585 1 929 . 1 1 95 95 GLU HB3 H 1 1.996 0.000 . 2 . . . A 95 GLU HB3 . 17585 1 930 . 1 1 95 95 GLU HG2 H 1 2.320 0.000 . 2 . . . A 95 GLU HG2 . 17585 1 931 . 1 1 95 95 GLU HG3 H 1 2.460 0.000 . 2 . . . A 95 GLU HG3 . 17585 1 932 . 1 1 95 95 GLU C C 13 178.120 0.000 . 1 . . . A 95 GLU C . 17585 1 933 . 1 1 95 95 GLU CA C 13 58.730 0.000 . 1 . . . A 95 GLU CA . 17585 1 934 . 1 1 95 95 GLU CB C 13 28.640 0.000 . 1 . . . A 95 GLU CB . 17585 1 935 . 1 1 95 95 GLU N N 15 121.930 0.000 . 1 . . . A 95 GLU N . 17585 1 936 . 1 1 96 96 GLN H H 1 7.222 0.000 . 1 . . . A 96 GLN H . 17585 1 937 . 1 1 96 96 GLN HA H 1 3.534 0.000 . 1 . . . A 96 GLN HA . 17585 1 938 . 1 1 96 96 GLN HB2 H 1 -0.110 0.000 . 2 . . . A 96 GLN HB2 . 17585 1 939 . 1 1 96 96 GLN HB3 H 1 0.428 0.000 . 2 . . . A 96 GLN HB3 . 17585 1 940 . 1 1 96 96 GLN HG2 H 1 0.300 0.000 . 2 . . . A 96 GLN HG2 . 17585 1 941 . 1 1 96 96 GLN HG3 H 1 1.182 0.000 . 2 . . . A 96 GLN HG3 . 17585 1 942 . 1 1 96 96 GLN HE21 H 1 5.947 0.000 . 2 . . . A 96 GLN HE21 . 17585 1 943 . 1 1 96 96 GLN HE22 H 1 6.594 0.000 . 2 . . . A 96 GLN HE22 . 17585 1 944 . 1 1 96 96 GLN C C 13 176.070 0.000 . 1 . . . A 96 GLN C . 17585 1 945 . 1 1 96 96 GLN CA C 13 54.930 0.000 . 1 . . . A 96 GLN CA . 17585 1 946 . 1 1 96 96 GLN CB C 13 26.950 0.000 . 1 . . . A 96 GLN CB . 17585 1 947 . 1 1 96 96 GLN N N 15 115.150 0.000 . 1 . . . A 96 GLN N . 17585 1 948 . 1 1 96 96 GLN NE2 N 15 114.070 0.000 . 1 . . . A 96 GLN NE2 . 17585 1 949 . 1 1 97 97 GLY H H 1 7.541 0.000 . 1 . . . A 97 GLY H . 17585 1 950 . 1 1 97 97 GLY HA2 H 1 3.747 0.000 . 2 . . . A 97 GLY HA2 . 17585 1 951 . 1 1 97 97 GLY HA3 H 1 4.031 0.000 . 2 . . . A 97 GLY HA3 . 17585 1 952 . 1 1 97 97 GLY C C 13 174.830 0.000 . 1 . . . A 97 GLY C . 17585 1 953 . 1 1 97 97 GLY CA C 13 45.240 0.000 . 1 . . . A 97 GLY CA . 17585 1 954 . 1 1 97 97 GLY N N 15 105.180 0.000 . 1 . . . A 97 GLY N . 17585 1 955 . 1 1 98 98 TRP H H 1 7.171 0.000 . 1 . . . A 98 TRP H . 17585 1 956 . 1 1 98 98 TRP HA H 1 5.136 0.000 . 1 . . . A 98 TRP HA . 17585 1 957 . 1 1 98 98 TRP HB2 H 1 2.985 0.000 . 2 . . . A 98 TRP HB2 . 17585 1 958 . 1 1 98 98 TRP HB3 H 1 3.313 0.000 . 2 . . . A 98 TRP HB3 . 17585 1 959 . 1 1 98 98 TRP HD1 H 1 6.875 0.000 . 1 . . . A 98 TRP HD1 . 17585 1 960 . 1 1 98 98 TRP HE1 H 1 10.180 0.000 . 1 . . . A 98 TRP HE1 . 17585 1 961 . 1 1 98 98 TRP HE3 H 1 7.255 0.000 . 1 . . . A 98 TRP HE3 . 17585 1 962 . 1 1 98 98 TRP HZ2 H 1 7.485 0.000 . 1 . . . A 98 TRP HZ2 . 17585 1 963 . 1 1 98 98 TRP HZ3 H 1 6.766 0.000 . 1 . . . A 98 TRP HZ3 . 17585 1 964 . 1 1 98 98 TRP HH2 H 1 7.135 0.000 . 1 . . . A 98 TRP HH2 . 17585 1 965 . 1 1 98 98 TRP C C 13 175.220 0.000 . 1 . . . A 98 TRP C . 17585 1 966 . 1 1 98 98 TRP CA C 13 54.180 0.000 . 1 . . . A 98 TRP CA . 17585 1 967 . 1 1 98 98 TRP CB C 13 30.750 0.000 . 1 . . . A 98 TRP CB . 17585 1 968 . 1 1 98 98 TRP N N 15 121.500 0.000 . 1 . . . A 98 TRP N . 17585 1 969 . 1 1 98 98 TRP NE1 N 15 129.010 0.000 . 1 . . . A 98 TRP NE1 . 17585 1 970 . 1 1 99 99 GLN H H 1 9.085 0.000 . 1 . . . A 99 GLN H . 17585 1 971 . 1 1 99 99 GLN HA H 1 4.803 0.000 . 1 . . . A 99 GLN HA . 17585 1 972 . 1 1 99 99 GLN HB2 H 1 1.962 0.000 . 2 . . . A 99 GLN HB2 . 17585 1 973 . 1 1 99 99 GLN HB3 H 1 2.128 0.000 . 2 . . . A 99 GLN HB3 . 17585 1 974 . 1 1 99 99 GLN HG2 H 1 2.313 0.000 . 2 . . . A 99 GLN HG2 . 17585 1 975 . 1 1 99 99 GLN HG3 H 1 2.440 0.000 . 2 . . . A 99 GLN HG3 . 17585 1 976 . 1 1 99 99 GLN HE21 H 1 6.864 0.000 . 2 . . . A 99 GLN HE21 . 17585 1 977 . 1 1 99 99 GLN HE22 H 1 7.337 0.000 . 2 . . . A 99 GLN HE22 . 17585 1 978 . 1 1 99 99 GLN C C 13 174.470 0.000 . 1 . . . A 99 GLN C . 17585 1 979 . 1 1 99 99 GLN CA C 13 54.430 0.000 . 1 . . . A 99 GLN CA . 17585 1 980 . 1 1 99 99 GLN CB C 13 31.950 0.000 . 1 . . . A 99 GLN CB . 17585 1 981 . 1 1 99 99 GLN N N 15 120.080 0.000 . 1 . . . A 99 GLN N . 17585 1 982 . 1 1 99 99 GLN NE2 N 15 111.090 0.000 . 1 . . . A 99 GLN NE2 . 17585 1 983 . 1 1 100 100 THR H H 1 8.267 0.000 . 1 . . . A 100 THR H . 17585 1 984 . 1 1 100 100 THR HA H 1 4.803 0.000 . 1 . . . A 100 THR HA . 17585 1 985 . 1 1 100 100 THR HB H 1 4.683 0.000 . 1 . . . A 100 THR HB . 17585 1 986 . 1 1 100 100 THR HG21 H 1 1.227 0.000 . . . . . A 100 THR HG21 . 17585 1 987 . 1 1 100 100 THR HG22 H 1 1.227 0.000 . . . . . A 100 THR HG22 . 17585 1 988 . 1 1 100 100 THR HG23 H 1 1.227 0.000 . . . . . A 100 THR HG23 . 17585 1 989 . 1 1 100 100 THR C C 13 174.950 0.000 . 1 . . . A 100 THR C . 17585 1 990 . 1 1 100 100 THR CA C 13 60.150 0.000 . 1 . . . A 100 THR CA . 17585 1 991 . 1 1 100 100 THR CB C 13 73.030 0.000 . 1 . . . A 100 THR CB . 17585 1 992 . 1 1 100 100 THR N N 15 108.600 0.000 . 1 . . . A 100 THR N . 17585 1 993 . 1 1 101 101 TYR H H 1 9.351 0.000 . 1 . . . A 101 TYR H . 17585 1 994 . 1 1 101 101 TYR HA H 1 5.019 0.000 . 1 . . . A 101 TYR HA . 17585 1 995 . 1 1 101 101 TYR HB2 H 1 2.666 0.000 . 2 . . . A 101 TYR HB2 . 17585 1 996 . 1 1 101 101 TYR HB3 H 1 3.255 0.000 . 2 . . . A 101 TYR HB3 . 17585 1 997 . 1 1 101 101 TYR HD1 H 1 6.996 0.000 . 3 . . . A 101 TYR HD1 . 17585 1 998 . 1 1 101 101 TYR HD2 H 1 6.996 0.000 . 3 . . . A 101 TYR HD2 . 17585 1 999 . 1 1 101 101 TYR HE1 H 1 6.750 0.000 . 3 . . . A 101 TYR HE1 . 17585 1 1000 . 1 1 101 101 TYR HE2 H 1 6.750 0.000 . 3 . . . A 101 TYR HE2 . 17585 1 1001 . 1 1 101 101 TYR C C 13 175.250 0.000 . 1 . . . A 101 TYR C . 17585 1 1002 . 1 1 101 101 TYR CA C 13 54.840 0.000 . 1 . . . A 101 TYR CA . 17585 1 1003 . 1 1 101 101 TYR CB C 13 38.430 0.000 . 1 . . . A 101 TYR CB . 17585 1 1004 . 1 1 101 101 TYR N N 15 121.500 0.000 . 1 . . . A 101 TYR N . 17585 1 1005 . 1 1 102 102 GLY H H 1 7.425 0.000 . 1 . . . A 102 GLY H . 17585 1 1006 . 1 1 102 102 GLY HA2 H 1 4.039 0.000 . 2 . . . A 102 GLY HA2 . 17585 1 1007 . 1 1 102 102 GLY HA3 H 1 4.039 0.000 . 2 . . . A 102 GLY HA3 . 17585 1 1008 . 1 1 102 102 GLY C C 13 172.470 0.000 . 1 . . . A 102 GLY C . 17585 1 1009 . 1 1 102 102 GLY CA C 13 44.610 0.000 . 1 . . . A 102 GLY CA . 17585 1 1010 . 1 1 102 102 GLY N N 15 105.490 0.000 . 1 . . . A 102 GLY N . 17585 1 1011 . 1 1 103 103 ASP H H 1 8.261 0.000 . 1 . . . A 103 ASP H . 17585 1 1012 . 1 1 103 103 ASP HA H 1 4.610 0.000 . 1 . . . A 103 ASP HA . 17585 1 1013 . 1 1 103 103 ASP HB2 H 1 2.423 0.000 . 2 . . . A 103 ASP HB2 . 17585 1 1014 . 1 1 103 103 ASP HB3 H 1 2.623 0.000 . 2 . . . A 103 ASP HB3 . 17585 1 1015 . 1 1 103 103 ASP C C 13 175.980 0.000 . 1 . . . A 103 ASP C . 17585 1 1016 . 1 1 103 103 ASP CA C 13 54.510 0.000 . 1 . . . A 103 ASP CA . 17585 1 1017 . 1 1 103 103 ASP CB C 13 41.390 0.000 . 1 . . . A 103 ASP CB . 17585 1 1018 . 1 1 103 103 ASP N N 15 119.640 0.000 . 1 . . . A 103 ASP N . 17585 1 1019 . 1 1 104 104 VAL H H 1 8.424 0.000 . 1 . . . A 104 VAL H . 17585 1 1020 . 1 1 104 104 VAL HA H 1 5.051 0.000 . 1 . . . A 104 VAL HA . 17585 1 1021 . 1 1 104 104 VAL HB H 1 2.083 0.000 . 1 . . . A 104 VAL HB . 17585 1 1022 . 1 1 104 104 VAL HG11 H 1 1.234 0.000 . . . . . A 104 VAL HG11 . 17585 1 1023 . 1 1 104 104 VAL HG12 H 1 1.234 0.000 . . . . . A 104 VAL HG12 . 17585 1 1024 . 1 1 104 104 VAL HG13 H 1 1.234 0.000 . . . . . A 104 VAL HG13 . 17585 1 1025 . 1 1 104 104 VAL HG21 H 1 1.033 0.000 . . . . . A 104 VAL HG21 . 17585 1 1026 . 1 1 104 104 VAL HG22 H 1 1.033 0.000 . . . . . A 104 VAL HG22 . 17585 1 1027 . 1 1 104 104 VAL HG23 H 1 1.033 0.000 . . . . . A 104 VAL HG23 . 17585 1 1028 . 1 1 104 104 VAL C C 13 175.900 0.000 . 1 . . . A 104 VAL C . 17585 1 1029 . 1 1 104 104 VAL CA C 13 62.860 0.000 . 1 . . . A 104 VAL CA . 17585 1 1030 . 1 1 104 104 VAL CB C 13 31.530 0.000 . 1 . . . A 104 VAL CB . 17585 1 1031 . 1 1 104 104 VAL N N 15 121.690 0.000 . 1 . . . A 104 VAL N . 17585 1 1032 . 1 1 105 105 VAL H H 1 9.002 0.000 . 1 . . . A 105 VAL H . 17585 1 1033 . 1 1 105 105 VAL HA H 1 4.513 0.000 . 1 . . . A 105 VAL HA . 17585 1 1034 . 1 1 105 105 VAL HB H 1 1.989 0.000 . 1 . . . A 105 VAL HB . 17585 1 1035 . 1 1 105 105 VAL HG11 H 1 0.957 0.000 . . . . . A 105 VAL HG11 . 17585 1 1036 . 1 1 105 105 VAL HG12 H 1 0.957 0.000 . . . . . A 105 VAL HG12 . 17585 1 1037 . 1 1 105 105 VAL HG13 H 1 0.957 0.000 . . . . . A 105 VAL HG13 . 17585 1 1038 . 1 1 105 105 VAL HG21 H 1 0.957 0.000 . . . . . A 105 VAL HG21 . 17585 1 1039 . 1 1 105 105 VAL HG22 H 1 0.957 0.000 . . . . . A 105 VAL HG22 . 17585 1 1040 . 1 1 105 105 VAL HG23 H 1 0.957 0.000 . . . . . A 105 VAL HG23 . 17585 1 1041 . 1 1 105 105 VAL C C 13 173.730 0.000 . 1 . . . A 105 VAL C . 17585 1 1042 . 1 1 105 105 VAL CA C 13 60.420 0.000 . 1 . . . A 105 VAL CA . 17585 1 1043 . 1 1 105 105 VAL CB C 13 36.600 0.000 . 1 . . . A 105 VAL CB . 17585 1 1044 . 1 1 105 105 VAL N N 15 126.230 0.000 . 1 . . . A 105 VAL N . 17585 1 1045 . 1 1 106 106 VAL H H 1 8.590 0.000 . 1 . . . A 106 VAL H . 17585 1 1046 . 1 1 106 106 VAL HA H 1 5.028 0.000 . 1 . . . A 106 VAL HA . 17585 1 1047 . 1 1 106 106 VAL HB H 1 1.890 0.000 . 1 . . . A 106 VAL HB . 17585 1 1048 . 1 1 106 106 VAL HG11 H 1 0.475 0.000 . . . . . A 106 VAL HG11 . 17585 1 1049 . 1 1 106 106 VAL HG12 H 1 0.475 0.000 . . . . . A 106 VAL HG12 . 17585 1 1050 . 1 1 106 106 VAL HG13 H 1 0.475 0.000 . . . . . A 106 VAL HG13 . 17585 1 1051 . 1 1 106 106 VAL HG21 H 1 0.696 0.000 . . . . . A 106 VAL HG21 . 17585 1 1052 . 1 1 106 106 VAL HG22 H 1 0.696 0.000 . . . . . A 106 VAL HG22 . 17585 1 1053 . 1 1 106 106 VAL HG23 H 1 0.696 0.000 . . . . . A 106 VAL HG23 . 17585 1 1054 . 1 1 106 106 VAL C C 13 174.360 0.000 . 1 . . . A 106 VAL C . 17585 1 1055 . 1 1 106 106 VAL CA C 13 60.660 0.000 . 1 . . . A 106 VAL CA . 17585 1 1056 . 1 1 106 106 VAL CB C 13 34.420 0.000 . 1 . . . A 106 VAL CB . 17585 1 1057 . 1 1 106 106 VAL N N 15 125.060 0.000 . 1 . . . A 106 VAL N . 17585 1 1058 . 1 1 107 107 ARG H H 1 8.983 0.000 . 1 . . . A 107 ARG H . 17585 1 1059 . 1 1 107 107 ARG HA H 1 4.817 0.000 . 1 . . . A 107 ARG HA . 17585 1 1060 . 1 1 107 107 ARG HB2 H 1 1.749 0.000 . 2 . . . A 107 ARG HB2 . 17585 1 1061 . 1 1 107 107 ARG HB3 H 1 1.903 0.000 . 2 . . . A 107 ARG HB3 . 17585 1 1062 . 1 1 107 107 ARG HG2 H 1 1.568 0.000 . 2 . . . A 107 ARG HG2 . 17585 1 1063 . 1 1 107 107 ARG HG3 H 1 1.568 0.000 . 2 . . . A 107 ARG HG3 . 17585 1 1064 . 1 1 107 107 ARG HD2 H 1 3.167 0.000 . 2 . . . A 107 ARG HD2 . 17585 1 1065 . 1 1 107 107 ARG HD3 H 1 3.167 0.000 . 2 . . . A 107 ARG HD3 . 17585 1 1066 . 1 1 107 107 ARG HE H 1 7.677 0.000 . 1 . . . A 107 ARG HE . 17585 1 1067 . 1 1 107 107 ARG C C 13 173.980 0.000 . 1 . . . A 107 ARG C . 17585 1 1068 . 1 1 107 107 ARG CA C 13 53.860 0.000 . 1 . . . A 107 ARG CA . 17585 1 1069 . 1 1 107 107 ARG CB C 13 34.280 0.000 . 1 . . . A 107 ARG CB . 17585 1 1070 . 1 1 107 107 ARG N N 15 125.740 0.000 . 1 . . . A 107 ARG N . 17585 1 1071 . 1 1 107 107 ARG NE N 15 85.140 0.000 . 1 . . . A 107 ARG NE . 17585 1 1072 . 1 1 108 108 PHE H H 1 8.780 0.000 . 1 . . . A 108 PHE H . 17585 1 1073 . 1 1 108 108 PHE HA H 1 5.907 0.000 . 1 . . . A 108 PHE HA . 17585 1 1074 . 1 1 108 108 PHE HB2 H 1 2.944 0.000 . 2 . . . A 108 PHE HB2 . 17585 1 1075 . 1 1 108 108 PHE HB3 H 1 3.078 0.000 . 2 . . . A 108 PHE HB3 . 17585 1 1076 . 1 1 108 108 PHE HD1 H 1 7.264 0.000 . 3 . . . A 108 PHE HD1 . 17585 1 1077 . 1 1 108 108 PHE HD2 H 1 7.264 0.000 . 3 . . . A 108 PHE HD2 . 17585 1 1078 . 1 1 108 108 PHE HE1 H 1 7.098 0.000 . 3 . . . A 108 PHE HE1 . 17585 1 1079 . 1 1 108 108 PHE HE2 H 1 7.098 0.000 . 3 . . . A 108 PHE HE2 . 17585 1 1080 . 1 1 108 108 PHE HZ H 1 6.909 0.000 . 1 . . . A 108 PHE HZ . 17585 1 1081 . 1 1 108 108 PHE C C 13 175.900 0.000 . 1 . . . A 108 PHE C . 17585 1 1082 . 1 1 108 108 PHE CA C 13 56.860 0.000 . 1 . . . A 108 PHE CA . 17585 1 1083 . 1 1 108 108 PHE CB C 13 43.010 0.000 . 1 . . . A 108 PHE CB . 17585 1 1084 . 1 1 108 108 PHE N N 15 118.470 0.000 . 1 . . . A 108 PHE N . 17585 1 1085 . 1 1 109 109 GLU H H 1 9.332 0.000 . 1 . . . A 109 GLU H . 17585 1 1086 . 1 1 109 109 GLU HA H 1 4.678 0.000 . 1 . . . A 109 GLU HA . 17585 1 1087 . 1 1 109 109 GLU HB2 H 1 1.923 0.000 . 2 . . . A 109 GLU HB2 . 17585 1 1088 . 1 1 109 109 GLU HB3 H 1 1.812 0.000 . 2 . . . A 109 GLU HB3 . 17585 1 1089 . 1 1 109 109 GLU HG2 H 1 2.100 0.000 . 2 . . . A 109 GLU HG2 . 17585 1 1090 . 1 1 109 109 GLU HG3 H 1 2.219 0.000 . 2 . . . A 109 GLU HG3 . 17585 1 1091 . 1 1 109 109 GLU C C 13 173.200 0.000 . 1 . . . A 109 GLU C . 17585 1 1092 . 1 1 109 109 GLU CA C 13 54.610 0.000 . 1 . . . A 109 GLU CA . 17585 1 1093 . 1 1 109 109 GLU CB C 13 34.070 0.000 . 1 . . . A 109 GLU CB . 17585 1 1094 . 1 1 109 109 GLU N N 15 122.230 0.000 . 1 . . . A 109 GLU N . 17585 1 1095 . 1 1 110 110 GLN H H 1 8.217 0.000 . 1 . . . A 110 GLN H . 17585 1 1096 . 1 1 110 110 GLN HA H 1 5.255 0.000 . 1 . . . A 110 GLN HA . 17585 1 1097 . 1 1 110 110 GLN HB2 H 1 0.970 0.000 . 2 . . . A 110 GLN HB2 . 17585 1 1098 . 1 1 110 110 GLN HB3 H 1 1.176 0.000 . 2 . . . A 110 GLN HB3 . 17585 1 1099 . 1 1 110 110 GLN HG2 H 1 1.650 0.000 . 2 . . . A 110 GLN HG2 . 17585 1 1100 . 1 1 110 110 GLN HG3 H 1 1.730 0.000 . 2 . . . A 110 GLN HG3 . 17585 1 1101 . 1 1 110 110 GLN HE21 H 1 6.524 0.000 . 2 . . . A 110 GLN HE21 . 17585 1 1102 . 1 1 110 110 GLN HE22 H 1 6.818 0.000 . 2 . . . A 110 GLN HE22 . 17585 1 1103 . 1 1 110 110 GLN C C 13 176.140 0.000 . 1 . . . A 110 GLN C . 17585 1 1104 . 1 1 110 110 GLN CA C 13 53.620 0.000 . 1 . . . A 110 GLN CA . 17585 1 1105 . 1 1 110 110 GLN CB C 13 31.810 0.000 . 1 . . . A 110 GLN CB . 17585 1 1106 . 1 1 110 110 GLN N N 15 120.320 0.000 . 1 . . . A 110 GLN N . 17585 1 1107 . 1 1 110 110 GLN NE2 N 15 109.820 0.000 . 1 . . . A 110 GLN NE2 . 17585 1 1108 . 1 1 111 111 SER H H 1 8.815 0.000 . 1 . . . A 111 SER H . 17585 1 1109 . 1 1 111 111 SER HA H 1 4.709 0.000 . 1 . . . A 111 SER HA . 17585 1 1110 . 1 1 111 111 SER HB2 H 1 3.267 0.000 . 2 . . . A 111 SER HB2 . 17585 1 1111 . 1 1 111 111 SER HB3 H 1 3.697 0.000 . 2 . . . A 111 SER HB3 . 17585 1 1112 . 1 1 111 111 SER C C 13 175.540 0.000 . 1 . . . A 111 SER C . 17585 1 1113 . 1 1 111 111 SER CA C 13 56.470 0.000 . 1 . . . A 111 SER CA . 17585 1 1114 . 1 1 111 111 SER CB C 13 65.770 0.000 . 1 . . . A 111 SER CB . 17585 1 1115 . 1 1 111 111 SER N N 15 116.400 0.000 . 1 . . . A 111 SER N . 17585 1 1116 . 1 1 112 112 SER H H 1 8.901 0.000 . 1 . . . A 112 SER H . 17585 1 1117 . 1 1 112 112 SER HA H 1 4.536 0.000 . 1 . . . A 112 SER HA . 17585 1 1118 . 1 1 112 112 SER HB2 H 1 3.882 0.000 . 2 . . . A 112 SER HB2 . 17585 1 1119 . 1 1 112 112 SER HB3 H 1 4.051 0.000 . 2 . . . A 112 SER HB3 . 17585 1 1120 . 1 1 112 112 SER C C 13 174.240 0.000 . 1 . . . A 112 SER C . 17585 1 1121 . 1 1 112 112 SER CA C 13 60.150 0.000 . 1 . . . A 112 SER CA . 17585 1 1122 . 1 1 112 112 SER CB C 13 63.250 0.000 . 1 . . . A 112 SER CB . 17585 1 1123 . 1 1 112 112 SER N N 15 122.470 0.000 . 1 . . . A 112 SER N . 17585 1 1124 . 1 1 113 113 ASN H H 1 8.115 0.000 . 1 . . . A 113 ASN H . 17585 1 1125 . 1 1 113 113 ASN HA H 1 4.702 0.000 . 1 . . . A 113 ASN HA . 17585 1 1126 . 1 1 113 113 ASN HB2 H 1 2.594 0.000 . 2 . . . A 113 ASN HB2 . 17585 1 1127 . 1 1 113 113 ASN HB3 H 1 2.816 0.000 . 2 . . . A 113 ASN HB3 . 17585 1 1128 . 1 1 113 113 ASN HD21 H 1 6.886 0.000 . 2 . . . A 113 ASN HD21 . 17585 1 1129 . 1 1 113 113 ASN HD22 H 1 7.455 0.000 . 2 . . . A 113 ASN HD22 . 17585 1 1130 . 1 1 113 113 ASN C C 13 174.950 0.000 . 1 . . . A 113 ASN C . 17585 1 1131 . 1 1 113 113 ASN CA C 13 53.860 0.000 . 1 . . . A 113 ASN CA . 17585 1 1132 . 1 1 113 113 ASN CB C 13 39.540 0.000 . 1 . . . A 113 ASN CB . 17585 1 1133 . 1 1 113 113 ASN N N 15 117.590 0.000 . 1 . . . A 113 ASN N . 17585 1 1134 . 1 1 113 113 ASN ND2 N 15 112.610 0.000 . 1 . . . A 113 ASN ND2 . 17585 1 1135 . 1 1 114 114 LEU H H 1 6.873 0.000 . 1 . . . A 114 LEU H . 17585 1 1136 . 1 1 114 114 LEU HA H 1 4.442 0.000 . 1 . . . A 114 LEU HA . 17585 1 1137 . 1 1 114 114 LEU HB2 H 1 1.478 0.000 . 2 . . . A 114 LEU HB2 . 17585 1 1138 . 1 1 114 114 LEU HB3 H 1 1.518 0.000 . 2 . . . A 114 LEU HB3 . 17585 1 1139 . 1 1 114 114 LEU HG H 1 1.438 0.000 . 1 . . . A 114 LEU HG . 17585 1 1140 . 1 1 114 114 LEU HD11 H 1 0.649 0.000 . . . . . A 114 LEU HD11 . 17585 1 1141 . 1 1 114 114 LEU HD12 H 1 0.649 0.000 . . . . . A 114 LEU HD12 . 17585 1 1142 . 1 1 114 114 LEU HD13 H 1 0.649 0.000 . . . . . A 114 LEU HD13 . 17585 1 1143 . 1 1 114 114 LEU HD21 H 1 0.649 0.000 . . . . . A 114 LEU HD21 . 17585 1 1144 . 1 1 114 114 LEU HD22 H 1 0.649 0.000 . . . . . A 114 LEU HD22 . 17585 1 1145 . 1 1 114 114 LEU HD23 H 1 0.649 0.000 . . . . . A 114 LEU HD23 . 17585 1 1146 . 1 1 114 114 LEU C C 13 175.800 0.000 . 1 . . . A 114 LEU C . 17585 1 1147 . 1 1 114 114 LEU CA C 13 54.170 0.000 . 1 . . . A 114 LEU CA . 17585 1 1148 . 1 1 114 114 LEU CB C 13 43.660 0.000 . 1 . . . A 114 LEU CB . 17585 1 1149 . 1 1 114 114 LEU N N 15 119.010 0.000 . 1 . . . A 114 LEU N . 17585 1 1150 . 1 1 115 115 HIS H H 1 8.502 0.000 . 1 . . . A 115 HIS H . 17585 1 1151 . 1 1 115 115 HIS HA H 1 5.032 0.000 . 1 . . . A 115 HIS HA . 17585 1 1152 . 1 1 115 115 HIS HB2 H 1 3.118 0.000 . 2 . . . A 115 HIS HB2 . 17585 1 1153 . 1 1 115 115 HIS HB3 H 1 3.397 0.000 . 2 . . . A 115 HIS HB3 . 17585 1 1154 . 1 1 115 115 HIS C C 13 173.440 0.000 . 1 . . . A 115 HIS C . 17585 1 1155 . 1 1 115 115 HIS CA C 13 53.580 0.000 . 1 . . . A 115 HIS CA . 17585 1 1156 . 1 1 115 115 HIS CB C 13 30.890 0.000 . 1 . . . A 115 HIS CB . 17585 1 1157 . 1 1 115 115 HIS N N 15 119.010 0.000 . 1 . . . A 115 HIS N . 17585 1 1158 . 1 1 116 116 THR H H 1 8.172 0.000 . 1 . . . A 116 THR H . 17585 1 1159 . 1 1 116 116 THR HA H 1 4.348 0.000 . 1 . . . A 116 THR HA . 17585 1 1160 . 1 1 116 116 THR HB H 1 4.050 0.000 . 1 . . . A 116 THR HB . 17585 1 1161 . 1 1 116 116 THR HG21 H 1 1.272 0.000 . . . . . A 116 THR HG21 . 17585 1 1162 . 1 1 116 116 THR HG22 H 1 1.272 0.000 . . . . . A 116 THR HG22 . 17585 1 1163 . 1 1 116 116 THR HG23 H 1 1.272 0.000 . . . . . A 116 THR HG23 . 17585 1 1164 . 1 1 116 116 THR C C 13 175.880 0.000 . 1 . . . A 116 THR C . 17585 1 1165 . 1 1 116 116 THR CA C 13 64.460 0.000 . 1 . . . A 116 THR CA . 17585 1 1166 . 1 1 116 116 THR CB C 13 69.470 0.000 . 1 . . . A 116 THR CB . 17585 1 1167 . 1 1 116 116 THR N N 15 115.150 0.000 . 1 . . . A 116 THR N . 17585 1 1168 . 1 1 117 117 GLY H H 1 10.180 0.000 . 1 . . . A 117 GLY H . 17585 1 1169 . 1 1 117 117 GLY HA2 H 1 3.669 0.000 . 2 . . . A 117 GLY HA2 . 17585 1 1170 . 1 1 117 117 GLY HA3 H 1 4.348 0.000 . 2 . . . A 117 GLY HA3 . 17585 1 1171 . 1 1 117 117 GLY C C 13 173.460 0.000 . 1 . . . A 117 GLY C . 17585 1 1172 . 1 1 117 117 GLY CA C 13 45.350 0.000 . 1 . . . A 117 GLY CA . 17585 1 1173 . 1 1 117 117 GLY N N 15 117.540 0.000 . 1 . . . A 117 GLY N . 17585 1 1174 . 1 1 118 118 GLN H H 1 8.160 0.000 . 1 . . . A 118 GLN H . 17585 1 1175 . 1 1 118 118 GLN HA H 1 4.659 0.000 . 1 . . . A 118 GLN HA . 17585 1 1176 . 1 1 118 118 GLN HB2 H 1 1.919 0.000 . 2 . . . A 118 GLN HB2 . 17585 1 1177 . 1 1 118 118 GLN HB3 H 1 2.279 0.000 . 2 . . . A 118 GLN HB3 . 17585 1 1178 . 1 1 118 118 GLN HG2 H 1 2.180 0.000 . 2 . . . A 118 GLN HG2 . 17585 1 1179 . 1 1 118 118 GLN HG3 H 1 2.180 0.000 . 2 . . . A 118 GLN HG3 . 17585 1 1180 . 1 1 118 118 GLN HE21 H 1 6.797 0.000 . 2 . . . A 118 GLN HE21 . 17585 1 1181 . 1 1 118 118 GLN HE22 H 1 7.527 0.000 . 2 . . . A 118 GLN HE22 . 17585 1 1182 . 1 1 118 118 GLN C C 13 174.340 0.000 . 1 . . . A 118 GLN C . 17585 1 1183 . 1 1 118 118 GLN CA C 13 54.960 0.000 . 1 . . . A 118 GLN CA . 17585 1 1184 . 1 1 118 118 GLN CB C 13 31.970 0.000 . 1 . . . A 118 GLN CB . 17585 1 1185 . 1 1 118 118 GLN N N 15 118.370 0.000 . 1 . . . A 118 GLN N . 17585 1 1186 . 1 1 118 118 GLN NE2 N 15 112.280 0.000 . 1 . . . A 118 GLN NE2 . 17585 1 1187 . 1 1 119 119 PHE H H 1 7.868 0.000 . 1 . . . A 119 PHE H . 17585 1 1188 . 1 1 119 119 PHE HA H 1 5.633 0.000 . 1 . . . A 119 PHE HA . 17585 1 1189 . 1 1 119 119 PHE HB2 H 1 2.905 0.000 . 2 . . . A 119 PHE HB2 . 17585 1 1190 . 1 1 119 119 PHE HB3 H 1 3.121 0.000 . 2 . . . A 119 PHE HB3 . 17585 1 1191 . 1 1 119 119 PHE HD1 H 1 6.890 0.000 . 3 . . . A 119 PHE HD1 . 17585 1 1192 . 1 1 119 119 PHE HD2 H 1 6.890 0.000 . 3 . . . A 119 PHE HD2 . 17585 1 1193 . 1 1 119 119 PHE HE1 H 1 7.255 0.000 . 3 . . . A 119 PHE HE1 . 17585 1 1194 . 1 1 119 119 PHE HE2 H 1 7.255 0.000 . 3 . . . A 119 PHE HE2 . 17585 1 1195 . 1 1 119 119 PHE C C 13 174.510 0.000 . 1 . . . A 119 PHE C . 17585 1 1196 . 1 1 119 119 PHE CA C 13 55.800 0.000 . 1 . . . A 119 PHE CA . 17585 1 1197 . 1 1 119 119 PHE CB C 13 43.750 0.000 . 1 . . . A 119 PHE CB . 17585 1 1198 . 1 1 119 119 PHE N N 15 115.150 0.000 . 1 . . . A 119 PHE N . 17585 1 1199 . 1 1 120 120 ARG H H 1 8.594 0.000 . 1 . . . A 120 ARG H . 17585 1 1200 . 1 1 120 120 ARG HA H 1 4.664 0.000 . 1 . . . A 120 ARG HA . 17585 1 1201 . 1 1 120 120 ARG HB2 H 1 1.620 0.000 . 2 . . . A 120 ARG HB2 . 17585 1 1202 . 1 1 120 120 ARG HB3 H 1 1.970 0.000 . 2 . . . A 120 ARG HB3 . 17585 1 1203 . 1 1 120 120 ARG HG2 H 1 1.516 0.000 . 2 . . . A 120 ARG HG2 . 17585 1 1204 . 1 1 120 120 ARG HG3 H 1 1.595 0.000 . 2 . . . A 120 ARG HG3 . 17585 1 1205 . 1 1 120 120 ARG C C 13 174.050 0.000 . 1 . . . A 120 ARG C . 17585 1 1206 . 1 1 120 120 ARG CA C 13 54.290 0.000 . 1 . . . A 120 ARG CA . 17585 1 1207 . 1 1 120 120 ARG CB C 13 34.730 0.000 . 1 . . . A 120 ARG CB . 17585 1 1208 . 1 1 120 120 ARG N N 15 118.520 0.000 . 1 . . . A 120 ARG N . 17585 1 1209 . 1 1 121 121 ALA H H 1 8.730 0.000 . 1 . . . A 121 ALA H . 17585 1 1210 . 1 1 121 121 ALA HA H 1 5.703 0.000 . 1 . . . A 121 ALA HA . 17585 1 1211 . 1 1 121 121 ALA HB1 H 1 1.254 0.000 . . . . . A 121 ALA HB1 . 17585 1 1212 . 1 1 121 121 ALA HB2 H 1 1.254 0.000 . . . . . A 121 ALA HB2 . 17585 1 1213 . 1 1 121 121 ALA HB3 H 1 1.254 0.000 . . . . . A 121 ALA HB3 . 17585 1 1214 . 1 1 121 121 ALA C C 13 175.490 0.000 . 1 . . . A 121 ALA C . 17585 1 1215 . 1 1 121 121 ALA CA C 13 51.250 0.000 . 1 . . . A 121 ALA CA . 17585 1 1216 . 1 1 121 121 ALA CB C 13 23.610 0.000 . 1 . . . A 121 ALA CB . 17585 1 1217 . 1 1 121 121 ALA N N 15 121.830 0.000 . 1 . . . A 121 ALA N . 17585 1 1218 . 1 1 122 122 ARG H H 1 8.318 0.000 . 1 . . . A 122 ARG H . 17585 1 1219 . 1 1 122 122 ARG HA H 1 4.758 0.000 . 1 . . . A 122 ARG HA . 17585 1 1220 . 1 1 122 122 ARG HB2 H 1 1.730 0.000 . 2 . . . A 122 ARG HB2 . 17585 1 1221 . 1 1 122 122 ARG HB3 H 1 1.766 0.000 . 2 . . . A 122 ARG HB3 . 17585 1 1222 . 1 1 122 122 ARG HG2 H 1 1.352 0.000 . 2 . . . A 122 ARG HG2 . 17585 1 1223 . 1 1 122 122 ARG HG3 H 1 1.559 0.000 . 2 . . . A 122 ARG HG3 . 17585 1 1224 . 1 1 122 122 ARG HD2 H 1 3.093 0.000 . 2 . . . A 122 ARG HD2 . 17585 1 1225 . 1 1 122 122 ARG HD3 H 1 3.093 0.000 . 2 . . . A 122 ARG HD3 . 17585 1 1226 . 1 1 122 122 ARG HE H 1 7.247 0.000 . 1 . . . A 122 ARG HE . 17585 1 1227 . 1 1 122 122 ARG C C 13 174.190 0.000 . 1 . . . A 122 ARG C . 17585 1 1228 . 1 1 122 122 ARG CA C 13 55.000 0.000 . 1 . . . A 122 ARG CA . 17585 1 1229 . 1 1 122 122 ARG CB C 13 33.870 0.000 . 1 . . . A 122 ARG CB . 17585 1 1230 . 1 1 122 122 ARG N N 15 117.540 0.000 . 1 . . . A 122 ARG N . 17585 1 1231 . 1 1 122 122 ARG NE N 15 85.180 0.000 . 1 . . . A 122 ARG NE . 17585 1 1232 . 1 1 123 123 GLY H H 1 8.859 0.000 . 1 . . . A 123 GLY H . 17585 1 1233 . 1 1 123 123 GLY HA2 H 1 2.765 0.000 . 2 . . . A 123 GLY HA2 . 17585 1 1234 . 1 1 123 123 GLY HA3 H 1 4.898 0.000 . 2 . . . A 123 GLY HA3 . 17585 1 1235 . 1 1 123 123 GLY C C 13 172.680 0.000 . 1 . . . A 123 GLY C . 17585 1 1236 . 1 1 123 123 GLY CA C 13 44.680 0.000 . 1 . . . A 123 GLY CA . 17585 1 1237 . 1 1 123 123 GLY N N 15 110.020 0.000 . 1 . . . A 123 GLY N . 17585 1 1238 . 1 1 124 124 THR H H 1 8.905 0.000 . 1 . . . A 124 THR H . 17585 1 1239 . 1 1 124 124 THR HA H 1 4.629 0.000 . 1 . . . A 124 THR HA . 17585 1 1240 . 1 1 124 124 THR HB H 1 3.973 0.000 . 1 . . . A 124 THR HB . 17585 1 1241 . 1 1 124 124 THR HG21 H 1 1.034 0.000 . . . . . A 124 THR HG21 . 17585 1 1242 . 1 1 124 124 THR HG22 H 1 1.034 0.000 . . . . . A 124 THR HG22 . 17585 1 1243 . 1 1 124 124 THR HG23 H 1 1.034 0.000 . . . . . A 124 THR HG23 . 17585 1 1244 . 1 1 124 124 THR C C 13 173.150 0.000 . 1 . . . A 124 THR C . 17585 1 1245 . 1 1 124 124 THR CA C 13 60.190 0.000 . 1 . . . A 124 THR CA . 17585 1 1246 . 1 1 124 124 THR CB C 13 71.880 0.000 . 1 . . . A 124 THR CB . 17585 1 1247 . 1 1 124 124 THR N N 15 116.320 0.000 . 1 . . . A 124 THR N . 17585 1 1248 . 1 1 125 125 VAL H H 1 8.527 0.000 . 1 . . . A 125 VAL H . 17585 1 1249 . 1 1 125 125 VAL HA H 1 4.138 0.000 . 1 . . . A 125 VAL HA . 17585 1 1250 . 1 1 125 125 VAL HB H 1 2.069 0.000 . 1 . . . A 125 VAL HB . 17585 1 1251 . 1 1 125 125 VAL HG11 H 1 1.017 0.000 . . . . . A 125 VAL HG11 . 17585 1 1252 . 1 1 125 125 VAL HG12 H 1 1.017 0.000 . . . . . A 125 VAL HG12 . 17585 1 1253 . 1 1 125 125 VAL HG13 H 1 1.017 0.000 . . . . . A 125 VAL HG13 . 17585 1 1254 . 1 1 125 125 VAL HG21 H 1 0.830 0.000 . . . . . A 125 VAL HG21 . 17585 1 1255 . 1 1 125 125 VAL HG22 H 1 0.830 0.000 . . . . . A 125 VAL HG22 . 17585 1 1256 . 1 1 125 125 VAL HG23 H 1 0.830 0.000 . . . . . A 125 VAL HG23 . 17585 1 1257 . 1 1 125 125 VAL C C 13 175.300 0.000 . 1 . . . A 125 VAL C . 17585 1 1258 . 1 1 125 125 VAL CA C 13 62.960 0.000 . 1 . . . A 125 VAL CA . 17585 1 1259 . 1 1 125 125 VAL CB C 13 32.070 0.000 . 1 . . . A 125 VAL CB . 17585 1 1260 . 1 1 125 125 VAL N N 15 125.650 0.000 . 1 . . . A 125 VAL N . 17585 1 1261 . 1 1 126 126 ASN H H 1 9.490 0.000 . 1 . . . A 126 ASN H . 17585 1 1262 . 1 1 126 126 ASN HA H 1 5.194 0.000 . 1 . . . A 126 ASN HA . 17585 1 1263 . 1 1 126 126 ASN HB2 H 1 2.641 0.000 . 2 . . . A 126 ASN HB2 . 17585 1 1264 . 1 1 126 126 ASN HB3 H 1 2.833 0.000 . 2 . . . A 126 ASN HB3 . 17585 1 1265 . 1 1 126 126 ASN HD21 H 1 6.796 0.000 . 2 . . . A 126 ASN HD21 . 17585 1 1266 . 1 1 126 126 ASN HD22 H 1 7.900 0.000 . 2 . . . A 126 ASN HD22 . 17585 1 1267 . 1 1 126 126 ASN CA C 13 49.980 0.000 . 1 . . . A 126 ASN CA . 17585 1 1268 . 1 1 126 126 ASN N N 15 124.720 0.000 . 1 . . . A 126 ASN N . 17585 1 1269 . 1 1 126 126 ASN ND2 N 15 111.790 0.000 . 1 . . . A 126 ASN ND2 . 17585 1 1270 . 1 1 127 127 PRO HA H 1 4.383 0.000 . 1 . . . A 127 PRO HA . 17585 1 1271 . 1 1 127 127 PRO HB2 H 1 2.066 0.000 . 2 . . . A 127 PRO HB2 . 17585 1 1272 . 1 1 127 127 PRO HB3 H 1 1.866 0.000 . 2 . . . A 127 PRO HB3 . 17585 1 1273 . 1 1 127 127 PRO HG2 H 1 1.980 0.000 . 2 . . . A 127 PRO HG2 . 17585 1 1274 . 1 1 127 127 PRO HG3 H 1 2.000 0.000 . 2 . . . A 127 PRO HG3 . 17585 1 1275 . 1 1 127 127 PRO HD2 H 1 3.617 0.000 . 2 . . . A 127 PRO HD2 . 17585 1 1276 . 1 1 127 127 PRO HD3 H 1 3.942 0.000 . 2 . . . A 127 PRO HD3 . 17585 1 1277 . 1 1 127 127 PRO C C 13 176.320 0.000 . 1 . . . A 127 PRO C . 17585 1 1278 . 1 1 127 127 PRO CA C 13 63.640 0.000 . 1 . . . A 127 PRO CA . 17585 1 1279 . 1 1 127 127 PRO CB C 13 32.690 0.000 . 1 . . . A 127 PRO CB . 17585 1 1280 . 1 1 128 128 ASP H H 1 7.786 0.000 . 1 . . . A 128 ASP H . 17585 1 1281 . 1 1 128 128 ASP HA H 1 4.816 0.000 . 1 . . . A 128 ASP HA . 17585 1 1282 . 1 1 128 128 ASP HB2 H 1 2.592 0.000 . 2 . . . A 128 ASP HB2 . 17585 1 1283 . 1 1 128 128 ASP HB3 H 1 2.882 0.000 . 2 . . . A 128 ASP HB3 . 17585 1 1284 . 1 1 128 128 ASP C C 13 175.490 0.000 . 1 . . . A 128 ASP C . 17585 1 1285 . 1 1 128 128 ASP CA C 13 53.740 0.000 . 1 . . . A 128 ASP CA . 17585 1 1286 . 1 1 128 128 ASP CB C 13 40.470 0.000 . 1 . . . A 128 ASP CB . 17585 1 1287 . 1 1 128 128 ASP N N 15 118.180 0.000 . 1 . . . A 128 ASP N . 17585 1 1288 . 1 1 129 129 VAL H H 1 7.209 0.000 . 1 . . . A 129 VAL H . 17585 1 1289 . 1 1 129 129 VAL HA H 1 4.018 0.000 . 1 . . . A 129 VAL HA . 17585 1 1290 . 1 1 129 129 VAL HB H 1 2.080 0.000 . 1 . . . A 129 VAL HB . 17585 1 1291 . 1 1 129 129 VAL HG11 H 1 0.925 0.000 . . . . . A 129 VAL HG11 . 17585 1 1292 . 1 1 129 129 VAL HG12 H 1 0.925 0.000 . . . . . A 129 VAL HG12 . 17585 1 1293 . 1 1 129 129 VAL HG13 H 1 0.925 0.000 . . . . . A 129 VAL HG13 . 17585 1 1294 . 1 1 129 129 VAL HG21 H 1 0.925 0.000 . . . . . A 129 VAL HG21 . 17585 1 1295 . 1 1 129 129 VAL HG22 H 1 0.925 0.000 . . . . . A 129 VAL HG22 . 17585 1 1296 . 1 1 129 129 VAL HG23 H 1 0.925 0.000 . . . . . A 129 VAL HG23 . 17585 1 1297 . 1 1 129 129 VAL C C 13 175.360 0.000 . 1 . . . A 129 VAL C . 17585 1 1298 . 1 1 129 129 VAL CA C 13 62.520 0.000 . 1 . . . A 129 VAL CA . 17585 1 1299 . 1 1 129 129 VAL CB C 13 32.770 0.000 . 1 . . . A 129 VAL CB . 17585 1 1300 . 1 1 129 129 VAL N N 15 117.590 0.000 . 1 . . . A 129 VAL N . 17585 1 1301 . 1 1 130 130 GLU H H 1 8.335 0.000 . 1 . . . A 130 GLU H . 17585 1 1302 . 1 1 130 130 GLU HA H 1 4.495 0.000 . 1 . . . A 130 GLU HA . 17585 1 1303 . 1 1 130 130 GLU HB2 H 1 1.955 0.000 . 2 . . . A 130 GLU HB2 . 17585 1 1304 . 1 1 130 130 GLU HB3 H 1 2.084 0.000 . 2 . . . A 130 GLU HB3 . 17585 1 1305 . 1 1 130 130 GLU HG2 H 1 2.325 0.000 . 2 . . . A 130 GLU HG2 . 17585 1 1306 . 1 1 130 130 GLU HG3 H 1 2.378 0.000 . 2 . . . A 130 GLU HG3 . 17585 1 1307 . 1 1 130 130 GLU C C 13 176.080 0.000 . 1 . . . A 130 GLU C . 17585 1 1308 . 1 1 130 130 GLU CA C 13 55.950 0.000 . 1 . . . A 130 GLU CA . 17585 1 1309 . 1 1 130 130 GLU CB C 13 30.670 0.000 . 1 . . . A 130 GLU CB . 17585 1 1310 . 1 1 130 130 GLU N N 15 123.510 0.000 . 1 . . . A 130 GLU N . 17585 1 1311 . 1 1 131 131 THR H H 1 8.248 0.000 . 1 . . . A 131 THR H . 17585 1 1312 . 1 1 131 131 THR HA H 1 4.325 0.000 . 1 . . . A 131 THR HA . 17585 1 1313 . 1 1 131 131 THR HB H 1 4.201 0.000 . 1 . . . A 131 THR HB . 17585 1 1314 . 1 1 131 131 THR HG21 H 1 1.175 0.000 . . . . . A 131 THR HG21 . 17585 1 1315 . 1 1 131 131 THR HG22 H 1 1.175 0.000 . . . . . A 131 THR HG22 . 17585 1 1316 . 1 1 131 131 THR HG23 H 1 1.175 0.000 . . . . . A 131 THR HG23 . 17585 1 1317 . 1 1 131 131 THR C C 13 173.710 0.000 . 1 . . . A 131 THR C . 17585 1 1318 . 1 1 131 131 THR CA C 13 61.930 0.000 . 1 . . . A 131 THR CA . 17585 1 1319 . 1 1 131 131 THR CB C 13 70.170 0.000 . 1 . . . A 131 THR CB . 17585 1 1320 . 1 1 131 131 THR N N 15 115.680 0.000 . 1 . . . A 131 THR N . 17585 1 1321 . 1 1 132 132 HIS H H 1 8.058 0.000 . 1 . . . A 132 HIS H . 17585 1 1322 . 1 1 132 132 HIS HA H 1 4.522 0.000 . 1 . . . A 132 HIS HA . 17585 1 1323 . 1 1 132 132 HIS HB2 H 1 3.122 0.000 . 2 . . . A 132 HIS HB2 . 17585 1 1324 . 1 1 132 132 HIS HB3 H 1 3.305 0.000 . 2 . . . A 132 HIS HB3 . 17585 1 1325 . 1 1 132 132 HIS CA C 13 56.940 0.000 . 1 . . . A 132 HIS CA . 17585 1 1326 . 1 1 132 132 HIS N N 15 125.210 0.000 . 1 . . . A 132 HIS N . 17585 1 stop_ save_