data_6986 save_study_list _Study_list.Sf_category study_list _Study_list.Sf_framecode study_list _Study_list.Entry_ID 6986 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 'NMR STRUCTURAL AND BINDING STUDIES OF THE PTB DOMAIN OF TENSIN' 'Structure analysis' . 6986 1 stop_ loop_ _Study_keyword.Study_ID _Study_keyword.Keyword _Study_keyword.Entry_ID _Study_keyword.Study_list_ID 1 'protein structure, protein-ligand interactions' 6986 1 stop_ save_ ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 6986 _Entry.Title ; NMR ASSIGNMENT OF THE PHOSPHOTYROSINE BINDING(PTB) DOMAIN OF TENSIN ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2006-02-14 _Entry.Accession_date 2006-02-14 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version . _Entry.Experimental_method NMR _Entry.Experimental_method_subtype . _Entry.Details 'Chemical Shift Assignments: Backbone 1H, 13C and 15N; carbon beta 13C; side-chains 1H' _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 Marilisa Leone . . . 6986 2 Maurizio Pellecchia . . . 6986 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 6986 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 385 6986 '15N chemical shifts' 135 6986 '1H chemical shifts' 887 6986 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2007-02-08 2006-02-14 update BMRB 'complete entry citation' 6986 1 . . 2006-06-28 2006-02-14 original author 'original release' 6986 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2GJY 'BMRB Entry Tracking System' 6986 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 6986 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 16705357 _Citation.Full_citation . _Citation.Title 'NMR assignment of the phosphotyrosine binding (PTB) domain of tensin' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Biomol. NMR' _Citation.Journal_name_full . _Citation.Journal_volume 36 _Citation.Journal_issue 'Suppl. 5' _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 40 _Citation.Page_last 40 _Citation.Year 2006 _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 Marilisa Leone . . . 6986 1 2 Eric Yu . C.W. . 6986 1 3 Robert Liddington . . . 6986 1 4 Maurizio Pellecchia . . . 6986 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'NMR ASSIGNMENT' 6986 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 6986 _Assembly.ID 1 _Assembly.Name 'Phosphotyrosine binding domain of chicken tensin 1' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites no _Assembly.Molecules_in_chemical_exchange no _Assembly.Paramagnetic no _Assembly.Thiol_state 'all free' _Assembly.Molecular_mass 15650 _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Assembly_type.Type _Assembly_type.Entry_ID _Assembly_type.Assembly_ID protein 6986 1 stop_ loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Phosphotyrosine binding domain of chicken tensin 1' 1 $PTB_domain_of_tensin_1 . . no native no no . . . 6986 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'Phosphotyrosine binding' 6986 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_PTB_domain_of_tensin_1 _Entity.Sf_category entity _Entity.Sf_framecode PTB_domain_of_tensin_1 _Entity.Entry_ID 6986 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name 'Phosphotyrosine Binding Domain of tensin' _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GSHMGAACNVLFINSVEMES LTGPQAISKAVAETLVADPT PTATIVHFKVSAQGITLTDN QRKLFFRRHYPLNTVTFCDL DPQERKWTKTDGSGPAKLFG FVARKQGSTTDNVCHLFAEL DPDQPAAAIVNFVSRVMLGS GQKR ; _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 144 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-01-28 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1WVH . "Crystal Structure Of Tensin1 Ptb Domain" . . . . . 93.06 134 100.00 100.00 1.16e-93 . . . . 6986 1 2 no PDB 2GJY . "Nmr Solution Structure Of Tensin1 Ptb Domain" . . . . . 100.00 144 100.00 100.00 5.19e-102 . . . . 6986 1 3 no EMBL CAA46992 . "tensin, partial [Gallus gallus]" . . . . . 97.22 276 100.00 100.00 1.09e-96 . . . . 6986 1 4 no EMBL CAA79215 . "tensin, partial [Gallus gallus]" . . . . . 97.22 1792 99.29 100.00 3.92e-89 . . . . 6986 1 5 no GB AAA49087 . "tensin [Gallus gallus]" . . . . . 97.22 1733 100.00 100.00 8.95e-90 . . . . 6986 1 6 no GB AAA59053 . "cardiac muscle tensin [Gallus gallus]" . . . . . 97.22 1744 100.00 100.00 8.23e-90 . . . . 6986 1 7 no GB AAA73949 . "tensin, partial [Gallus gallus]" . . . . . 97.22 1792 99.29 100.00 3.92e-89 . . . . 6986 1 8 no GB KFM04647 . "Tensin, partial [Aptenodytes forsteri]" . . . . . 97.22 1733 98.57 100.00 4.73e-89 . . . . 6986 1 9 no GB KFO55064 . "Tensin, partial [Corvus brachyrhynchos]" . . . . . 97.22 1640 99.29 100.00 9.71e-90 . . . . 6986 1 10 no REF NP_990786 . "tensin [Gallus gallus]" . . . . . 97.22 1733 100.00 100.00 8.95e-90 . . . . 6986 1 11 no REF XP_004176788 . "PREDICTED: LOW QUALITY PROTEIN: tensin-like [Taeniopygia guttata]" . . . . . 97.22 1909 99.29 100.00 6.29e-89 . . . . 6986 1 12 no REF XP_005010958 . "PREDICTED: LOW QUALITY PROTEIN: tensin-like [Anas platyrhynchos]" . . . . . 97.22 1086 99.29 100.00 3.57e-89 . . . . 6986 1 13 no REF XP_005049507 . "PREDICTED: tensin-like isoform X1 [Ficedula albicollis]" . . . . . 97.22 1900 100.00 100.00 1.59e-89 . . . . 6986 1 14 no REF XP_005049508 . "PREDICTED: tensin-like isoform X2 [Ficedula albicollis]" . . . . . 97.22 1888 100.00 100.00 1.89e-89 . . . . 6986 1 15 no SP Q04205 . "RecName: Full=Tensin [Gallus gallus]" . . . . . 97.22 1744 100.00 100.00 8.23e-90 . . . . 6986 1 stop_ loop_ _Entity_keyword.Keyword _Entity_keyword.Entry_ID _Entity_keyword.Entity_ID 'PTB domain' 6986 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 . GLY . 6986 1 2 . SER . 6986 1 3 . HIS . 6986 1 4 . MET . 6986 1 5 . GLY . 6986 1 6 . ALA . 6986 1 7 . ALA . 6986 1 8 . CYS . 6986 1 9 . ASN . 6986 1 10 . VAL . 6986 1 11 . LEU . 6986 1 12 . PHE . 6986 1 13 . ILE . 6986 1 14 . ASN . 6986 1 15 . SER . 6986 1 16 . VAL . 6986 1 17 . GLU . 6986 1 18 . MET . 6986 1 19 . GLU . 6986 1 20 . SER . 6986 1 21 . LEU . 6986 1 22 . THR . 6986 1 23 . GLY . 6986 1 24 . PRO . 6986 1 25 . GLN . 6986 1 26 . ALA . 6986 1 27 . ILE . 6986 1 28 . SER . 6986 1 29 . LYS . 6986 1 30 . ALA . 6986 1 31 . VAL . 6986 1 32 . ALA . 6986 1 33 . GLU . 6986 1 34 . THR . 6986 1 35 . LEU . 6986 1 36 . VAL . 6986 1 37 . ALA . 6986 1 38 . ASP . 6986 1 39 . PRO . 6986 1 40 . THR . 6986 1 41 . PRO . 6986 1 42 . THR . 6986 1 43 . ALA . 6986 1 44 . THR . 6986 1 45 . ILE . 6986 1 46 . VAL . 6986 1 47 . HIS . 6986 1 48 . PHE . 6986 1 49 . LYS . 6986 1 50 . VAL . 6986 1 51 . SER . 6986 1 52 . ALA . 6986 1 53 . GLN . 6986 1 54 . GLY . 6986 1 55 . ILE . 6986 1 56 . THR . 6986 1 57 . LEU . 6986 1 58 . THR . 6986 1 59 . ASP . 6986 1 60 . ASN . 6986 1 61 . GLN . 6986 1 62 . ARG . 6986 1 63 . LYS . 6986 1 64 . LEU . 6986 1 65 . PHE . 6986 1 66 . PHE . 6986 1 67 . ARG . 6986 1 68 . ARG . 6986 1 69 . HIS . 6986 1 70 . TYR . 6986 1 71 . PRO . 6986 1 72 . LEU . 6986 1 73 . ASN . 6986 1 74 . THR . 6986 1 75 . VAL . 6986 1 76 . THR . 6986 1 77 . PHE . 6986 1 78 . CYS . 6986 1 79 . ASP . 6986 1 80 . LEU . 6986 1 81 . ASP . 6986 1 82 . PRO . 6986 1 83 . GLN . 6986 1 84 . GLU . 6986 1 85 . ARG . 6986 1 86 . LYS . 6986 1 87 . TRP . 6986 1 88 . THR . 6986 1 89 . LYS . 6986 1 90 . THR . 6986 1 91 . ASP . 6986 1 92 . GLY . 6986 1 93 . SER . 6986 1 94 . GLY . 6986 1 95 . PRO . 6986 1 96 . ALA . 6986 1 97 . LYS . 6986 1 98 . LEU . 6986 1 99 . PHE . 6986 1 100 . GLY . 6986 1 101 . PHE . 6986 1 102 . VAL . 6986 1 103 . ALA . 6986 1 104 . ARG . 6986 1 105 . LYS . 6986 1 106 . GLN . 6986 1 107 . GLY . 6986 1 108 . SER . 6986 1 109 . THR . 6986 1 110 . THR . 6986 1 111 . ASP . 6986 1 112 . ASN . 6986 1 113 . VAL . 6986 1 114 . CYS . 6986 1 115 . HIS . 6986 1 116 . LEU . 6986 1 117 . PHE . 6986 1 118 . ALA . 6986 1 119 . GLU . 6986 1 120 . LEU . 6986 1 121 . ASP . 6986 1 122 . PRO . 6986 1 123 . ASP . 6986 1 124 . GLN . 6986 1 125 . PRO . 6986 1 126 . ALA . 6986 1 127 . ALA . 6986 1 128 . ALA . 6986 1 129 . ILE . 6986 1 130 . VAL . 6986 1 131 . ASN . 6986 1 132 . PHE . 6986 1 133 . VAL . 6986 1 134 . SER . 6986 1 135 . ARG . 6986 1 136 . VAL . 6986 1 137 . MET . 6986 1 138 . LEU . 6986 1 139 . GLY . 6986 1 140 . SER . 6986 1 141 . GLY . 6986 1 142 . GLN . 6986 1 143 . LYS . 6986 1 144 . ARG . 6986 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 6986 1 . SER 2 2 6986 1 . HIS 3 3 6986 1 . MET 4 4 6986 1 . GLY 5 5 6986 1 . ALA 6 6 6986 1 . ALA 7 7 6986 1 . CYS 8 8 6986 1 . ASN 9 9 6986 1 . VAL 10 10 6986 1 . LEU 11 11 6986 1 . PHE 12 12 6986 1 . ILE 13 13 6986 1 . ASN 14 14 6986 1 . SER 15 15 6986 1 . VAL 16 16 6986 1 . GLU 17 17 6986 1 . MET 18 18 6986 1 . GLU 19 19 6986 1 . SER 20 20 6986 1 . LEU 21 21 6986 1 . THR 22 22 6986 1 . GLY 23 23 6986 1 . PRO 24 24 6986 1 . GLN 25 25 6986 1 . ALA 26 26 6986 1 . ILE 27 27 6986 1 . SER 28 28 6986 1 . LYS 29 29 6986 1 . ALA 30 30 6986 1 . VAL 31 31 6986 1 . ALA 32 32 6986 1 . GLU 33 33 6986 1 . THR 34 34 6986 1 . LEU 35 35 6986 1 . VAL 36 36 6986 1 . ALA 37 37 6986 1 . ASP 38 38 6986 1 . PRO 39 39 6986 1 . THR 40 40 6986 1 . PRO 41 41 6986 1 . THR 42 42 6986 1 . ALA 43 43 6986 1 . THR 44 44 6986 1 . ILE 45 45 6986 1 . VAL 46 46 6986 1 . HIS 47 47 6986 1 . PHE 48 48 6986 1 . LYS 49 49 6986 1 . VAL 50 50 6986 1 . SER 51 51 6986 1 . ALA 52 52 6986 1 . GLN 53 53 6986 1 . GLY 54 54 6986 1 . ILE 55 55 6986 1 . THR 56 56 6986 1 . LEU 57 57 6986 1 . THR 58 58 6986 1 . ASP 59 59 6986 1 . ASN 60 60 6986 1 . GLN 61 61 6986 1 . ARG 62 62 6986 1 . LYS 63 63 6986 1 . LEU 64 64 6986 1 . PHE 65 65 6986 1 . PHE 66 66 6986 1 . ARG 67 67 6986 1 . ARG 68 68 6986 1 . HIS 69 69 6986 1 . TYR 70 70 6986 1 . PRO 71 71 6986 1 . LEU 72 72 6986 1 . ASN 73 73 6986 1 . THR 74 74 6986 1 . VAL 75 75 6986 1 . THR 76 76 6986 1 . PHE 77 77 6986 1 . CYS 78 78 6986 1 . ASP 79 79 6986 1 . LEU 80 80 6986 1 . ASP 81 81 6986 1 . PRO 82 82 6986 1 . GLN 83 83 6986 1 . GLU 84 84 6986 1 . ARG 85 85 6986 1 . LYS 86 86 6986 1 . TRP 87 87 6986 1 . THR 88 88 6986 1 . LYS 89 89 6986 1 . THR 90 90 6986 1 . ASP 91 91 6986 1 . GLY 92 92 6986 1 . SER 93 93 6986 1 . GLY 94 94 6986 1 . PRO 95 95 6986 1 . ALA 96 96 6986 1 . LYS 97 97 6986 1 . LEU 98 98 6986 1 . PHE 99 99 6986 1 . GLY 100 100 6986 1 . PHE 101 101 6986 1 . VAL 102 102 6986 1 . ALA 103 103 6986 1 . ARG 104 104 6986 1 . LYS 105 105 6986 1 . GLN 106 106 6986 1 . GLY 107 107 6986 1 . SER 108 108 6986 1 . THR 109 109 6986 1 . THR 110 110 6986 1 . ASP 111 111 6986 1 . ASN 112 112 6986 1 . VAL 113 113 6986 1 . CYS 114 114 6986 1 . HIS 115 115 6986 1 . LEU 116 116 6986 1 . PHE 117 117 6986 1 . ALA 118 118 6986 1 . GLU 119 119 6986 1 . LEU 120 120 6986 1 . ASP 121 121 6986 1 . PRO 122 122 6986 1 . ASP 123 123 6986 1 . GLN 124 124 6986 1 . PRO 125 125 6986 1 . ALA 126 126 6986 1 . ALA 127 127 6986 1 . ALA 128 128 6986 1 . ILE 129 129 6986 1 . VAL 130 130 6986 1 . ASN 131 131 6986 1 . PHE 132 132 6986 1 . VAL 133 133 6986 1 . SER 134 134 6986 1 . ARG 135 135 6986 1 . VAL 136 136 6986 1 . MET 137 137 6986 1 . LEU 138 138 6986 1 . GLY 139 139 6986 1 . SER 140 140 6986 1 . GLY 141 141 6986 1 . GLN 142 142 6986 1 . LYS 143 143 6986 1 . ARG 144 144 6986 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 6986 _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 $PTB_domain_of_tensin_1 . 9031 organism . 'Gallus gallus' Chicken . . Eukaryota Metazoa Gallus gallus . . . . . . . . . . . . . . . . . . . . . 6986 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 6986 _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 $PTB_domain_of_tensin_1 . 'recombinant technology' . 'E. coli' . . . . . . . . . . . . . . . . . . . . . . . . . . . 6986 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 6986 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Phosphotyrosine Binding Domain of tensin' '[U- 13C; U- 15N]' . . 1 $PTB_domain_of_tensin_1 . protein 1 . . mM . . . . 6986 1 2 'potassium phosphate' . . . . . . buffer 50 . . mM . . . . 6986 1 3 NaCl . . . . . . salt 150 . . mM . . . . 6986 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 6986 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system . _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Phosphotyrosine Binding Domain of tensin' [U-15N] . . 1 $PTB_domain_of_tensin_1 . protein 1 . . mM . . . . 6986 2 2 'Potassium phosphate' . . . . . . buffer 50 . . mM . . . . 6986 2 3 NaCl . . . . . . salt 150 . . mM . . . . 6986 2 stop_ save_ ####################### # Sample conditions # ####################### save_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode conditions_1 _Sample_condition_list.Entry_ID 6986 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID pH 7.0 0.1 pH 6986 1 temperature 298.0 0.1 K 6986 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 6986 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'DATA PROCESSING' 6986 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 6986 _Software.ID 2 _Software.Name XEASY _Software.Version 1.3.13 _Software.Details . loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'DATA ANALYSIS' 6986 2 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 6986 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ ############################# # NMR applied experiments # ############################# save_NMR_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode NMR_experiment_list _Experiment_list.Entry_ID 6986 _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 '1H-15N HSQC' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6986 1 2 '1H-13C HSQC' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6986 1 3 '1H-1H-15N NOESY' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6986 1 4 '1H-1H-15N TOCSY' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6986 1 5 '1H-1H NOESY' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6986 1 6 HNCA no . . . . . . . . . . 1 $sample_1 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6986 1 7 HNCACB no . . . . . . . . . . 2 $sample_2 . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6986 1 8 'HCCH TOCSY' no . . . . . . . . . . . . . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6986 1 9 HNCO no . . . . . . . . . . . . . . . 1 $conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 6986 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_referencing _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_referencing _Chem_shift_reference.Entry_ID 6986 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.251449530 . . . 1 $entry_citation . . 1 $entry_citation 6986 1 H 1 DSS 'methyl protons' . . . . ppm 0.0 internal direct 1.0 . . . 1 $entry_citation . . 1 $entry_citation 6986 1 N 15 DSS 'methyl protons' . . . . ppm 0.0 . indirect 0.101329118 . . . 1 $entry_citation . . 1 $entry_citation 6986 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6986 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _Assigned_chem_shift_list.Chem_shift_1H_err . _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 '1H-15N HSQC' . . . 6986 1 2 '1H-13C HSQC' . . . 6986 1 3 '1H-1H-15N NOESY' . . . 6986 1 4 '1H-1H-15N TOCSY' . . . 6986 1 5 '1H-1H NOESY' . . . 6986 1 6 HNCA . . . 6986 1 7 HNCACB . . . 6986 1 8 'HCCH TOCSY' . . . 6986 1 9 HNCO . . . 6986 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 HIS HA H 1 4.10 0.01 . 1 . . . . 3 HIS HA . 6986 1 2 . 1 1 3 3 HIS HB2 H 1 3.06 0.01 . 1 . . . . 3 HIS HB2 . 6986 1 3 . 1 1 3 3 HIS HB3 H 1 3.06 0.01 . 1 . . . . 3 HIS HB3 . 6986 1 4 . 1 1 3 3 HIS C C 13 174.8 1.00 . 1 . . . . 3 HIS C . 6986 1 5 . 1 1 4 4 MET H H 1 8.39 0.01 . 1 . . . . 4 MET HN . 6986 1 6 . 1 1 4 4 MET HA H 1 4.34 0.01 . 1 . . . . 4 MET HA . 6986 1 7 . 1 1 4 4 MET HB2 H 1 2.00 0.01 . 2 . . . . 4 MET HB2 . 6986 1 8 . 1 1 4 4 MET HB3 H 1 2.30 0.01 . 2 . . . . 4 MET HB3 . 6986 1 9 . 1 1 4 4 MET HG2 H 1 2.80 0.01 . 1 . . . . 4 MET HG2 . 6986 1 10 . 1 1 4 4 MET HG3 H 1 2.80 0.01 . 1 . . . . 4 MET HG3 . 6986 1 11 . 1 1 4 4 MET HE1 H 1 2.09 0.01 . 1 . . . . 4 MET HE . 6986 1 12 . 1 1 4 4 MET HE2 H 1 2.09 0.01 . 1 . . . . 4 MET HE . 6986 1 13 . 1 1 4 4 MET HE3 H 1 2.09 0.01 . 1 . . . . 4 MET HE . 6986 1 14 . 1 1 4 4 MET C C 13 173.3 1.00 . 1 . . . . 4 MET C . 6986 1 15 . 1 1 4 4 MET CA C 13 52.4 0.90 . 1 . . . . 4 MET CA . 6986 1 16 . 1 1 4 4 MET CB C 13 29.5 0.90 . 1 . . . . 4 MET CB . 6986 1 17 . 1 1 4 4 MET N N 15 120.8 0.20 . 1 . . . . 4 MET N . 6986 1 18 . 1 1 5 5 GLY H H 1 7.95 0.01 . 1 . . . . 5 GLY HN . 6986 1 19 . 1 1 5 5 GLY HA2 H 1 3.63 0.01 . 2 . . . . 5 GLY HA1 . 6986 1 20 . 1 1 5 5 GLY HA3 H 1 3.83 0.01 . 2 . . . . 5 GLY HA2 . 6986 1 21 . 1 1 5 5 GLY C C 13 174.4 1.00 . 1 . . . . 5 GLY C . 6986 1 22 . 1 1 5 5 GLY CA C 13 42.5 0.90 . 1 . . . . 5 GLY CA . 6986 1 23 . 1 1 5 5 GLY N N 15 109.3 0.20 . 1 . . . . 5 GLY N . 6986 1 24 . 1 1 6 6 ALA H H 1 7.78 0.01 . 1 . . . . 6 ALA HN . 6986 1 25 . 1 1 6 6 ALA HA H 1 4.06 0.01 . 1 . . . . 6 ALA HA . 6986 1 26 . 1 1 6 6 ALA HB1 H 1 0.54 0.01 . 1 . . . . 6 ALA HB . 6986 1 27 . 1 1 6 6 ALA HB2 H 1 0.54 0.01 . 1 . . . . 6 ALA HB . 6986 1 28 . 1 1 6 6 ALA HB3 H 1 0.54 0.01 . 1 . . . . 6 ALA HB . 6986 1 29 . 1 1 6 6 ALA C C 13 172.7 1.00 . 1 . . . . 6 ALA C . 6986 1 30 . 1 1 6 6 ALA CA C 13 49.0 0.90 . 1 . . . . 6 ALA CA . 6986 1 31 . 1 1 6 6 ALA CB C 13 18.1 0.90 . 1 . . . . 6 ALA CB . 6986 1 32 . 1 1 6 6 ALA N N 15 121.3 0.20 . 1 . . . . 6 ALA N . 6986 1 33 . 1 1 7 7 ALA H H 1 7.87 0.01 . 1 . . . . 7 ALA HN . 6986 1 34 . 1 1 7 7 ALA HA H 1 5.27 0.01 . 1 . . . . 7 ALA HA . 6986 1 35 . 1 1 7 7 ALA HB1 H 1 1.18 0.01 . 1 . . . . 7 ALA HB . 6986 1 36 . 1 1 7 7 ALA HB2 H 1 1.18 0.01 . 1 . . . . 7 ALA HB . 6986 1 37 . 1 1 7 7 ALA HB3 H 1 1.18 0.01 . 1 . . . . 7 ALA HB . 6986 1 38 . 1 1 7 7 ALA C C 13 173.5 1.00 . 1 . . . . 7 ALA C . 6986 1 39 . 1 1 7 7 ALA CA C 13 48.7 0.90 . 1 . . . . 7 ALA CA . 6986 1 40 . 1 1 7 7 ALA CB C 13 19.3 0.90 . 1 . . . . 7 ALA CB . 6986 1 41 . 1 1 7 7 ALA N N 15 120.7 0.20 . 1 . . . . 7 ALA N . 6986 1 42 . 1 1 8 8 CYS H H 1 8.53 0.01 . 1 . . . . 8 CYS HN . 6986 1 43 . 1 1 8 8 CYS HA H 1 4.71 0.01 . 1 . . . . 8 CYS HA . 6986 1 44 . 1 1 8 8 CYS HB2 H 1 3.04 0.01 . 2 . . . . 8 CYS HB2 . 6986 1 45 . 1 1 8 8 CYS HB3 H 1 2.89 0.01 . 2 . . . . 8 CYS HB3 . 6986 1 46 . 1 1 8 8 CYS C C 13 172.0 1.00 . 1 . . . . 8 CYS C . 6986 1 47 . 1 1 8 8 CYS CA C 13 53.6 0.90 . 1 . . . . 8 CYS CA . 6986 1 48 . 1 1 8 8 CYS CB C 13 27.7 0.90 . 1 . . . . 8 CYS CB . 6986 1 49 . 1 1 8 8 CYS N N 15 116.1 0.20 . 1 . . . . 8 CYS N . 6986 1 50 . 1 1 9 9 ASN H H 1 8.70 0.01 . 1 . . . . 9 ASN HN . 6986 1 51 . 1 1 9 9 ASN HA H 1 5.88 0.01 . 1 . . . . 9 ASN HA . 6986 1 52 . 1 1 9 9 ASN HB2 H 1 2.32 0.01 . 2 . . . . 9 ASN HB2 . 6986 1 53 . 1 1 9 9 ASN HB3 H 1 2.77 0.01 . 2 . . . . 9 ASN HB3 . 6986 1 54 . 1 1 9 9 ASN HD21 H 1 7.48 0.01 . 2 . . . . 9 ASN HD21 . 6986 1 55 . 1 1 9 9 ASN HD22 H 1 6.77 0.01 . 2 . . . . 9 ASN HD22 . 6986 1 56 . 1 1 9 9 ASN C C 13 172.0 1.00 . 1 . . . . 9 ASN C . 6986 1 57 . 1 1 9 9 ASN CA C 13 50.0 0.90 . 1 . . . . 9 ASN CA . 6986 1 58 . 1 1 9 9 ASN CB C 13 37.0 0.90 . 1 . . . . 9 ASN CB . 6986 1 59 . 1 1 9 9 ASN N N 15 119.7 0.20 . 1 . . . . 9 ASN N . 6986 1 60 . 1 1 9 9 ASN ND2 N 15 111.9 0.20 . 1 . . . . 9 ASN ND2 . 6986 1 61 . 1 1 10 10 VAL H H 1 9.10 0.01 . 1 . . . . 10 VAL HN . 6986 1 62 . 1 1 10 10 VAL HA H 1 4.76 0.01 . 1 . . . . 10 VAL HA . 6986 1 63 . 1 1 10 10 VAL HB H 1 2.36 0.01 . 1 . . . . 10 VAL HB . 6986 1 64 . 1 1 10 10 VAL HG11 H 1 1.08 0.01 . 2 . . . . 10 VAL HG1 . 6986 1 65 . 1 1 10 10 VAL HG12 H 1 1.08 0.01 . 2 . . . . 10 VAL HG1 . 6986 1 66 . 1 1 10 10 VAL HG13 H 1 1.08 0.01 . 2 . . . . 10 VAL HG1 . 6986 1 67 . 1 1 10 10 VAL HG21 H 1 0.85 0.01 . 2 . . . . 10 VAL HG2 . 6986 1 68 . 1 1 10 10 VAL HG22 H 1 0.85 0.01 . 2 . . . . 10 VAL HG2 . 6986 1 69 . 1 1 10 10 VAL HG23 H 1 0.85 0.01 . 2 . . . . 10 VAL HG2 . 6986 1 70 . 1 1 10 10 VAL C C 13 171.5 1.00 . 1 . . . . 10 VAL C . 6986 1 71 . 1 1 10 10 VAL CA C 13 56.9 0.90 . 1 . . . . 10 VAL CA . 6986 1 72 . 1 1 10 10 VAL CB C 13 33.7 0.90 . 1 . . . . 10 VAL CB . 6986 1 73 . 1 1 10 10 VAL N N 15 113.8 0.20 . 1 . . . . 10 VAL N . 6986 1 74 . 1 1 11 11 LEU H H 1 8.63 0.01 . 1 . . . . 11 LEU HN . 6986 1 75 . 1 1 11 11 LEU HA H 1 4.92 0.01 . 1 . . . . 11 LEU HA . 6986 1 76 . 1 1 11 11 LEU HB2 H 1 1.47 0.01 . 1 . . . . 11 LEU HB2 . 6986 1 77 . 1 1 11 11 LEU HB3 H 1 1.47 0.01 . 1 . . . . 11 LEU HB3 . 6986 1 78 . 1 1 11 11 LEU HG H 1 1.69 0.01 . 1 . . . . 11 LEU HG . 6986 1 79 . 1 1 11 11 LEU HD11 H 1 1.07 0.01 . 2 . . . . 11 LEU HD1 . 6986 1 80 . 1 1 11 11 LEU HD12 H 1 1.07 0.01 . 2 . . . . 11 LEU HD1 . 6986 1 81 . 1 1 11 11 LEU HD13 H 1 1.07 0.01 . 2 . . . . 11 LEU HD1 . 6986 1 82 . 1 1 11 11 LEU HD21 H 1 0.67 0.01 . 2 . . . . 11 LEU HD2 . 6986 1 83 . 1 1 11 11 LEU HD22 H 1 0.67 0.01 . 2 . . . . 11 LEU HD2 . 6986 1 84 . 1 1 11 11 LEU HD23 H 1 0.67 0.01 . 2 . . . . 11 LEU HD2 . 6986 1 85 . 1 1 11 11 LEU C C 13 174.2 1.00 . 1 . . . . 11 LEU C . 6986 1 86 . 1 1 11 11 LEU CA C 13 51.2 0.90 . 1 . . . . 11 LEU CA . 6986 1 87 . 1 1 11 11 LEU CB C 13 40.8 0.90 . 1 . . . . 11 LEU CB . 6986 1 88 . 1 1 11 11 LEU N N 15 118.9 0.20 . 1 . . . . 11 LEU N . 6986 1 89 . 1 1 12 12 PHE H H 1 9.68 0.01 . 1 . . . . 12 PHE HN . 6986 1 90 . 1 1 12 12 PHE HA H 1 4.46 0.01 . 1 . . . . 12 PHE HA . 6986 1 91 . 1 1 12 12 PHE HB2 H 1 3.06 0.01 . 2 . . . . 12 PHE HB2 . 6986 1 92 . 1 1 12 12 PHE HB3 H 1 2.92 0.01 . 2 . . . . 12 PHE HB3 . 6986 1 93 . 1 1 12 12 PHE HD1 H 1 6.63 0.01 . 1 . . . . 12 PHE HD1 . 6986 1 94 . 1 1 12 12 PHE HD2 H 1 6.63 0.01 . 1 . . . . 12 PHE HD2 . 6986 1 95 . 1 1 12 12 PHE HE1 H 1 6.92 0.01 . 1 . . . . 12 PHE HE1 . 6986 1 96 . 1 1 12 12 PHE HE2 H 1 6.92 0.01 . 1 . . . . 12 PHE HE2 . 6986 1 97 . 1 1 12 12 PHE HZ H 1 7.30 0.01 . 1 . . . . 12 PHE HZ . 6986 1 98 . 1 1 12 12 PHE C C 13 171.1 1.00 . 1 . . . . 12 PHE C . 6986 1 99 . 1 1 12 12 PHE CA C 13 55.1 0.90 . 1 . . . . 12 PHE CA . 6986 1 100 . 1 1 12 12 PHE CB C 13 37.8 0.90 . 1 . . . . 12 PHE CB . 6986 1 101 . 1 1 12 12 PHE N N 15 124.9 0.20 . 1 . . . . 12 PHE N . 6986 1 102 . 1 1 13 13 ILE H H 1 7.68 0.01 . 1 . . . . 13 ILE HN . 6986 1 103 . 1 1 13 13 ILE HA H 1 3.28 0.01 . 1 . . . . 13 ILE HA . 6986 1 104 . 1 1 13 13 ILE HB H 1 1.79 0.01 . 1 . . . . 13 ILE HB . 6986 1 105 . 1 1 13 13 ILE HG12 H 1 0.52 0.01 . 1 . . . . 13 ILE HG12 . 6986 1 106 . 1 1 13 13 ILE HG13 H 1 0.52 0.01 . 1 . . . . 13 ILE HG13 . 6986 1 107 . 1 1 13 13 ILE HG21 H 1 -0.48 0.01 . 1 . . . . 13 ILE HG2 . 6986 1 108 . 1 1 13 13 ILE HG22 H 1 -0.48 0.01 . 1 . . . . 13 ILE HG2 . 6986 1 109 . 1 1 13 13 ILE HG23 H 1 -0.48 0.01 . 1 . . . . 13 ILE HG2 . 6986 1 110 . 1 1 13 13 ILE HD11 H 1 -0.75 0.01 . 1 . . . . 13 ILE HD1 . 6986 1 111 . 1 1 13 13 ILE HD12 H 1 -0.75 0.01 . 1 . . . . 13 ILE HD1 . 6986 1 112 . 1 1 13 13 ILE HD13 H 1 -0.75 0.01 . 1 . . . . 13 ILE HD1 . 6986 1 113 . 1 1 13 13 ILE C C 13 170.7 1.00 . 1 . . . . 13 ILE C . 6986 1 114 . 1 1 13 13 ILE CA C 13 57.6 0.90 . 1 . . . . 13 ILE CA . 6986 1 115 . 1 1 13 13 ILE CB C 13 35.0 0.90 . 1 . . . . 13 ILE CB . 6986 1 116 . 1 1 13 13 ILE N N 15 126.1 0.20 . 1 . . . . 13 ILE N . 6986 1 117 . 1 1 14 14 ASN H H 1 6.09 0.01 . 1 . . . . 14 ASN HN . 6986 1 118 . 1 1 14 14 ASN HA H 1 4.33 0.01 . 1 . . . . 14 ASN HA . 6986 1 119 . 1 1 14 14 ASN HB2 H 1 2.39 0.01 . 1 . . . . 14 ASN HB2 . 6986 1 120 . 1 1 14 14 ASN HB3 H 1 2.39 0.01 . 1 . . . . 14 ASN HB3 . 6986 1 121 . 1 1 14 14 ASN HD21 H 1 7.24 0.01 . 2 . . . . 14 ASN HD21 . 6986 1 122 . 1 1 14 14 ASN HD22 H 1 7.12 0.01 . 2 . . . . 14 ASN HD22 . 6986 1 123 . 1 1 14 14 ASN C C 13 169.9 1.00 . 1 . . . . 14 ASN C . 6986 1 124 . 1 1 14 14 ASN CA C 13 49.2 0.90 . 1 . . . . 14 ASN CA . 6986 1 125 . 1 1 14 14 ASN CB C 13 38.8 0.90 . 1 . . . . 14 ASN CB . 6986 1 126 . 1 1 14 14 ASN N N 15 109.1 0.20 . 1 . . . . 14 ASN N . 6986 1 127 . 1 1 14 14 ASN ND2 N 15 111.9 0.20 . 1 . . . . 14 ASN ND2 . 6986 1 128 . 1 1 15 15 SER H H 1 7.42 0.01 . 1 . . . . 15 SER HN . 6986 1 129 . 1 1 15 15 SER HA H 1 5.17 0.01 . 1 . . . . 15 SER HA . 6986 1 130 . 1 1 15 15 SER HB2 H 1 3.38 0.01 . 1 . . . . 15 SER HB2 . 6986 1 131 . 1 1 15 15 SER HB3 H 1 3.38 0.01 . 1 . . . . 15 SER HB3 . 6986 1 132 . 1 1 15 15 SER C C 13 170.2 1.00 . 1 . . . . 15 SER C . 6986 1 133 . 1 1 15 15 SER CA C 13 55.4 0.90 . 1 . . . . 15 SER CA . 6986 1 134 . 1 1 15 15 SER CB C 13 61.1 0.90 . 1 . . . . 15 SER CB . 6986 1 135 . 1 1 15 15 SER N N 15 117.5 0.20 . 1 . . . . 15 SER N . 6986 1 136 . 1 1 16 16 VAL H H 1 8.81 0.01 . 1 . . . . 16 VAL HN . 6986 1 137 . 1 1 16 16 VAL HA H 1 4.12 0.01 . 1 . . . . 16 VAL HA . 6986 1 138 . 1 1 16 16 VAL HB H 1 1.79 0.01 . 1 . . . . 16 VAL HB . 6986 1 139 . 1 1 16 16 VAL HG11 H 1 0.81 0.01 . 2 . . . . 16 VAL HG1 . 6986 1 140 . 1 1 16 16 VAL HG12 H 1 0.81 0.01 . 2 . . . . 16 VAL HG1 . 6986 1 141 . 1 1 16 16 VAL HG13 H 1 0.81 0.01 . 2 . . . . 16 VAL HG1 . 6986 1 142 . 1 1 16 16 VAL HG21 H 1 0.60 0.01 . 2 . . . . 16 VAL HG2 . 6986 1 143 . 1 1 16 16 VAL HG22 H 1 0.60 0.01 . 2 . . . . 16 VAL HG2 . 6986 1 144 . 1 1 16 16 VAL HG23 H 1 0.60 0.01 . 2 . . . . 16 VAL HG2 . 6986 1 145 . 1 1 16 16 VAL C C 13 172.5 1.00 . 1 . . . . 16 VAL C . 6986 1 146 . 1 1 16 16 VAL CA C 13 58.1 0.90 . 1 . . . . 16 VAL CA . 6986 1 147 . 1 1 16 16 VAL CB C 13 32.6 0.90 . 1 . . . . 16 VAL CB . 6986 1 148 . 1 1 16 16 VAL N N 15 124.1 0.20 . 1 . . . . 16 VAL N . 6986 1 149 . 1 1 17 17 GLU H H 1 8.94 0.01 . 1 . . . . 17 GLU HN . 6986 1 150 . 1 1 17 17 GLU HA H 1 3.97 0.01 . 1 . . . . 17 GLU HA . 6986 1 151 . 1 1 17 17 GLU HB2 H 1 2.17 0.01 . 2 . . . . 17 GLU HB2 . 6986 1 152 . 1 1 17 17 GLU HB3 H 1 1.89 0.01 . 2 . . . . 17 GLU HB3 . 6986 1 153 . 1 1 17 17 GLU HG2 H 1 2.36 0.01 . 1 . . . . 17 GLU HG2 . 6986 1 154 . 1 1 17 17 GLU HG3 H 1 2.36 0.01 . 1 . . . . 17 GLU HG3 . 6986 1 155 . 1 1 17 17 GLU C C 13 173.9 1.00 . 1 . . . . 17 GLU C . 6986 1 156 . 1 1 17 17 GLU CA C 13 55.9 0.90 . 1 . . . . 17 GLU CA . 6986 1 157 . 1 1 17 17 GLU CB C 13 26.6 0.90 . 1 . . . . 17 GLU CB . 6986 1 158 . 1 1 17 17 GLU N N 15 129.3 0.20 . 1 . . . . 17 GLU N . 6986 1 159 . 1 1 18 18 MET H H 1 8.12 0.01 . 1 . . . . 18 MET HN . 6986 1 160 . 1 1 18 18 MET HA H 1 4.70 0.01 . 1 . . . . 18 MET HA . 6986 1 161 . 1 1 18 18 MET HB2 H 1 2.19 0.01 . 1 . . . . 18 MET HB2 . 6986 1 162 . 1 1 18 18 MET HB3 H 1 2.19 0.01 . 1 . . . . 18 MET HB3 . 6986 1 163 . 1 1 18 18 MET HG2 H 1 2.75 0.01 . 1 . . . . 18 MET HG2 . 6986 1 164 . 1 1 18 18 MET HG3 H 1 2.75 0.01 . 1 . . . . 18 MET HG3 . 6986 1 165 . 1 1 18 18 MET C C 13 174.3 1.00 . 1 . . . . 18 MET C . 6986 1 166 . 1 1 18 18 MET CA C 13 50.3 0.90 . 1 . . . . 18 MET CA . 6986 1 167 . 1 1 18 18 MET CB C 13 31.9 0.90 . 1 . . . . 18 MET CB . 6986 1 168 . 1 1 18 18 MET N N 15 120.1 0.20 . 1 . . . . 18 MET N . 6986 1 169 . 1 1 19 19 GLU H H 1 8.92 0.01 . 1 . . . . 19 GLU HN . 6986 1 170 . 1 1 19 19 GLU HA H 1 3.90 0.01 . 1 . . . . 19 GLU HA . 6986 1 171 . 1 1 19 19 GLU HB2 H 1 2.15 0.01 . 1 . . . . 19 GLU HB2 . 6986 1 172 . 1 1 19 19 GLU HB3 H 1 2.15 0.01 . 1 . . . . 19 GLU HB3 . 6986 1 173 . 1 1 19 19 GLU HG2 H 1 2.33 0.01 . 1 . . . . 19 GLU HG2 . 6986 1 174 . 1 1 19 19 GLU HG3 H 1 2.33 0.01 . 1 . . . . 19 GLU HG3 . 6986 1 175 . 1 1 19 19 GLU C C 13 173.4 1.00 . 1 . . . . 19 GLU C . 6986 1 176 . 1 1 19 19 GLU CA C 13 56.3 0.90 . 1 . . . . 19 GLU CA . 6986 1 177 . 1 1 19 19 GLU CB C 13 25.1 0.90 . 1 . . . . 19 GLU CB . 6986 1 178 . 1 1 19 19 GLU N N 15 121.6 0.20 . 1 . . . . 19 GLU N . 6986 1 179 . 1 1 20 20 SER H H 1 8.04 0.01 . 1 . . . . 20 SER HN . 6986 1 180 . 1 1 20 20 SER HA H 1 4.65 0.01 . 1 . . . . 20 SER HA . 6986 1 181 . 1 1 20 20 SER HB2 H 1 3.87 0.01 . 1 . . . . 20 SER HB2 . 6986 1 182 . 1 1 20 20 SER HB3 H 1 3.87 0.01 . 1 . . . . 20 SER HB3 . 6986 1 183 . 1 1 20 20 SER C C 13 172.0 1.00 . 1 . . . . 20 SER C . 6986 1 184 . 1 1 20 20 SER CA C 13 56.1 0.90 . 1 . . . . 20 SER CA . 6986 1 185 . 1 1 20 20 SER CB C 13 61.1 0.90 . 1 . . . . 20 SER CB . 6986 1 186 . 1 1 20 20 SER N N 15 116.3 0.20 . 1 . . . . 20 SER N . 6986 1 187 . 1 1 21 21 LEU H H 1 7.74 0.01 . 1 . . . . 21 LEU HN . 6986 1 188 . 1 1 21 21 LEU HA H 1 4.07 0.01 . 1 . . . . 21 LEU HA . 6986 1 189 . 1 1 21 21 LEU HB2 H 1 1.52 0.01 . 1 . . . . 21 LEU HB2 . 6986 1 190 . 1 1 21 21 LEU HB3 H 1 1.52 0.01 . 1 . . . . 21 LEU HB3 . 6986 1 191 . 1 1 21 21 LEU HG H 1 1.45 0.01 . 1 . . . . 21 LEU HG . 6986 1 192 . 1 1 21 21 LEU HD11 H 1 0.77 0.01 . 2 . . . . 21 LEU HD1 . 6986 1 193 . 1 1 21 21 LEU HD12 H 1 0.77 0.01 . 2 . . . . 21 LEU HD1 . 6986 1 194 . 1 1 21 21 LEU HD13 H 1 0.77 0.01 . 2 . . . . 21 LEU HD1 . 6986 1 195 . 1 1 21 21 LEU HD21 H 1 0.77 0.01 . 2 . . . . 21 LEU HD2 . 6986 1 196 . 1 1 21 21 LEU HD22 H 1 0.77 0.01 . 2 . . . . 21 LEU HD2 . 6986 1 197 . 1 1 21 21 LEU HD23 H 1 0.77 0.01 . 2 . . . . 21 LEU HD2 . 6986 1 198 . 1 1 21 21 LEU C C 13 172.6 1.00 . 1 . . . . 21 LEU C . 6986 1 199 . 1 1 21 21 LEU CA C 13 53.7 0.90 . 1 . . . . 21 LEU CA . 6986 1 200 . 1 1 21 21 LEU CB C 13 36.9 0.90 . 1 . . . . 21 LEU CB . 6986 1 201 . 1 1 21 21 LEU N N 15 124.9 0.20 . 1 . . . . 21 LEU N . 6986 1 202 . 1 1 22 22 THR H H 1 7.57 0.01 . 1 . . . . 22 THR HN . 6986 1 203 . 1 1 22 22 THR HA H 1 4.19 0.01 . 1 . . . . 22 THR HA . 6986 1 204 . 1 1 22 22 THR HB H 1 3.85 0.01 . 1 . . . . 22 THR HB . 6986 1 205 . 1 1 22 22 THR HG21 H 1 1.03 0.01 . 1 . . . . 22 THR HG2 . 6986 1 206 . 1 1 22 22 THR HG22 H 1 1.03 0.01 . 1 . . . . 22 THR HG2 . 6986 1 207 . 1 1 22 22 THR HG23 H 1 1.03 0.01 . 1 . . . . 22 THR HG2 . 6986 1 208 . 1 1 22 22 THR C C 13 171.1 1.00 . 1 . . . . 22 THR C . 6986 1 209 . 1 1 22 22 THR CA C 13 56.6 0.90 . 1 . . . . 22 THR CA . 6986 1 210 . 1 1 22 22 THR CB C 13 67.6 0.90 . 1 . . . . 22 THR CB . 6986 1 211 . 1 1 22 22 THR N N 15 113.4 0.20 . 1 . . . . 22 THR N . 6986 1 212 . 1 1 23 23 GLY H H 1 7.30 0.01 . 1 . . . . 23 GLY HN . 6986 1 213 . 1 1 23 23 GLY HA2 H 1 3.77 0.01 . 1 . . . . 23 GLY HA1 . 6986 1 214 . 1 1 23 23 GLY HA3 H 1 3.77 0.01 . 1 . . . . 23 GLY HA2 . 6986 1 215 . 1 1 23 23 GLY CA C 13 42.0 0.90 . 1 . . . . 23 GLY CA . 6986 1 216 . 1 1 23 23 GLY N N 15 106.4 0.20 . 1 . . . . 23 GLY N . 6986 1 217 . 1 1 24 24 PRO HA H 1 4.68 0.01 . 1 . . . . 24 PRO HA . 6986 1 218 . 1 1 24 24 PRO HB2 H 1 2.29 0.01 . 2 . . . . 24 PRO HB2 . 6986 1 219 . 1 1 24 24 PRO HB3 H 1 2.37 0.01 . 2 . . . . 24 PRO HB3 . 6986 1 220 . 1 1 24 24 PRO HG2 H 1 2.01 0.01 . 1 . . . . 24 PRO HG2 . 6986 1 221 . 1 1 24 24 PRO HG3 H 1 2.01 0.01 . 1 . . . . 24 PRO HG3 . 6986 1 222 . 1 1 24 24 PRO HD2 H 1 3.51 0.01 . 2 . . . . 24 PRO HD2 . 6986 1 223 . 1 1 24 24 PRO HD3 H 1 3.60 0.01 . 2 . . . . 24 PRO HD3 . 6986 1 224 . 1 1 24 24 PRO C C 13 176.0 1.00 . 1 . . . . 24 PRO C . 6986 1 225 . 1 1 24 24 PRO CA C 13 62.9 0.90 . 1 . . . . 24 PRO CA . 6986 1 226 . 1 1 24 24 PRO CB C 13 29.1 0.90 . 1 . . . . 24 PRO CB . 6986 1 227 . 1 1 25 25 GLN H H 1 8.47 0.01 . 1 . . . . 25 GLN HN . 6986 1 228 . 1 1 25 25 GLN HA H 1 3.94 0.01 . 1 . . . . 25 GLN HA . 6986 1 229 . 1 1 25 25 GLN HB2 H 1 1.98 0.01 . 1 . . . . 25 GLN HB2 . 6986 1 230 . 1 1 25 25 GLN HB3 H 1 1.98 0.01 . 1 . . . . 25 GLN HB3 . 6986 1 231 . 1 1 25 25 GLN HG2 H 1 2.37 0.01 . 1 . . . . 25 GLN HG2 . 6986 1 232 . 1 1 25 25 GLN HG3 H 1 2.37 0.01 . 1 . . . . 25 GLN HG3 . 6986 1 233 . 1 1 25 25 GLN C C 13 176.0 1.00 . 1 . . . . 25 GLN C . 6986 1 234 . 1 1 25 25 GLN CA C 13 55.8 0.90 . 1 . . . . 25 GLN CA . 6986 1 235 . 1 1 25 25 GLN CB C 13 25.6 0.90 . 1 . . . . 25 GLN CB . 6986 1 236 . 1 1 25 25 GLN N N 15 114.4 0.20 . 1 . . . . 25 GLN N . 6986 1 237 . 1 1 26 26 ALA H H 1 7.18 0.01 . 1 . . . . 26 ALA HN . 6986 1 238 . 1 1 26 26 ALA HA H 1 3.99 0.01 . 1 . . . . 26 ALA HA . 6986 1 239 . 1 1 26 26 ALA HB1 H 1 1.15 0.01 . 1 . . . . 26 ALA HB . 6986 1 240 . 1 1 26 26 ALA HB2 H 1 1.15 0.01 . 1 . . . . 26 ALA HB . 6986 1 241 . 1 1 26 26 ALA HB3 H 1 1.15 0.01 . 1 . . . . 26 ALA HB . 6986 1 242 . 1 1 26 26 ALA C C 13 175.6 1.00 . 1 . . . . 26 ALA C . 6986 1 243 . 1 1 26 26 ALA CA C 13 51.8 0.90 . 1 . . . . 26 ALA CA . 6986 1 244 . 1 1 26 26 ALA CB C 13 15.9 0.90 . 1 . . . . 26 ALA CB . 6986 1 245 . 1 1 26 26 ALA N N 15 121.4 0.20 . 1 . . . . 26 ALA N . 6986 1 246 . 1 1 27 27 ILE H H 1 7.01 0.01 . 1 . . . . 27 ILE HN . 6986 1 247 . 1 1 27 27 ILE HA H 1 3.70 0.01 . 1 . . . . 27 ILE HA . 6986 1 248 . 1 1 27 27 ILE HB H 1 1.95 0.01 . 1 . . . . 27 ILE HB . 6986 1 249 . 1 1 27 27 ILE HG12 H 1 1.54 0.01 . 2 . . . . 27 ILE HG12 . 6986 1 250 . 1 1 27 27 ILE HG13 H 1 1.21 0.01 . 2 . . . . 27 ILE HG13 . 6986 1 251 . 1 1 27 27 ILE HG21 H 1 0.80 0.01 . 1 . . . . 27 ILE HG2 . 6986 1 252 . 1 1 27 27 ILE HG22 H 1 0.80 0.01 . 1 . . . . 27 ILE HG2 . 6986 1 253 . 1 1 27 27 ILE HG23 H 1 0.80 0.01 . 1 . . . . 27 ILE HG2 . 6986 1 254 . 1 1 27 27 ILE HD11 H 1 0.71 0.01 . 1 . . . . 27 ILE HD1 . 6986 1 255 . 1 1 27 27 ILE HD12 H 1 0.71 0.01 . 1 . . . . 27 ILE HD1 . 6986 1 256 . 1 1 27 27 ILE HD13 H 1 0.71 0.01 . 1 . . . . 27 ILE HD1 . 6986 1 257 . 1 1 27 27 ILE C C 13 175.2 1.00 . 1 . . . . 27 ILE C . 6986 1 258 . 1 1 27 27 ILE CA C 13 61.6 0.90 . 1 . . . . 27 ILE CA . 6986 1 259 . 1 1 27 27 ILE CB C 13 33.9 0.90 . 1 . . . . 27 ILE CB . 6986 1 260 . 1 1 27 27 ILE N N 15 115.3 0.20 . 1 . . . . 27 ILE N . 6986 1 261 . 1 1 28 28 SER H H 1 8.27 0.01 . 1 . . . . 28 SER HN . 6986 1 262 . 1 1 28 28 SER HA H 1 3.82 0.01 . 1 . . . . 28 SER HA . 6986 1 263 . 1 1 28 28 SER HB2 H 1 3.71 0.01 . 1 . . . . 28 SER HB2 . 6986 1 264 . 1 1 28 28 SER HB3 H 1 3.71 0.01 . 1 . . . . 28 SER HB3 . 6986 1 265 . 1 1 28 28 SER C C 13 174.3 1.00 . 1 . . . . 28 SER C . 6986 1 266 . 1 1 28 28 SER CA C 13 58.7 0.90 . 1 . . . . 28 SER CA . 6986 1 267 . 1 1 28 28 SER CB C 13 60.3 0.90 . 1 . . . . 28 SER CB . 6986 1 268 . 1 1 28 28 SER N N 15 111.8 0.20 . 1 . . . . 28 SER N . 6986 1 269 . 1 1 29 29 LYS H H 1 7.79 0.01 . 1 . . . . 29 LYS HN . 6986 1 270 . 1 1 29 29 LYS HA H 1 4.00 0.01 . 1 . . . . 29 LYS HA . 6986 1 271 . 1 1 29 29 LYS HB2 H 1 1.74 0.01 . 1 . . . . 29 LYS HB2 . 6986 1 272 . 1 1 29 29 LYS HB3 H 1 1.74 0.01 . 1 . . . . 29 LYS HB3 . 6986 1 273 . 1 1 29 29 LYS HG2 H 1 1.42 0.01 . 1 . . . . 29 LYS HG2 . 6986 1 274 . 1 1 29 29 LYS HG3 H 1 1.42 0.01 . 1 . . . . 29 LYS HG3 . 6986 1 275 . 1 1 29 29 LYS HE2 H 1 2.95 0.01 . 1 . . . . 29 LYS HE2 . 6986 1 276 . 1 1 29 29 LYS HE3 H 1 2.95 0.01 . 1 . . . . 29 LYS HE3 . 6986 1 277 . 1 1 29 29 LYS C C 13 174.3 1.00 . 1 . . . . 29 LYS C . 6986 1 278 . 1 1 29 29 LYS CA C 13 56.3 0.90 . 1 . . . . 29 LYS CA . 6986 1 279 . 1 1 29 29 LYS CB C 13 30.1 0.90 . 1 . . . . 29 LYS CB . 6986 1 280 . 1 1 29 29 LYS N N 15 120.6 0.20 . 1 . . . . 29 LYS N . 6986 1 281 . 1 1 30 30 ALA H H 1 8.21 0.01 . 1 . . . . 30 ALA HN . 6986 1 282 . 1 1 30 30 ALA HA H 1 3.74 0.01 . 1 . . . . 30 ALA HA . 6986 1 283 . 1 1 30 30 ALA HB1 H 1 1.30 0.01 . 1 . . . . 30 ALA HB . 6986 1 284 . 1 1 30 30 ALA HB2 H 1 1.30 0.01 . 1 . . . . 30 ALA HB . 6986 1 285 . 1 1 30 30 ALA HB3 H 1 1.30 0.01 . 1 . . . . 30 ALA HB . 6986 1 286 . 1 1 30 30 ALA C C 13 178.2 1.00 . 1 . . . . 30 ALA C . 6986 1 287 . 1 1 30 30 ALA CA C 13 52.5 0.90 . 1 . . . . 30 ALA CA . 6986 1 288 . 1 1 30 30 ALA CB C 13 16.3 0.90 . 1 . . . . 30 ALA CB . 6986 1 289 . 1 1 30 30 ALA N N 15 120.4 0.20 . 1 . . . . 30 ALA N . 6986 1 290 . 1 1 31 31 VAL H H 1 8.55 0.01 . 1 . . . . 31 VAL HN . 6986 1 291 . 1 1 31 31 VAL HA H 1 4.04 0.01 . 1 . . . . 31 VAL HA . 6986 1 292 . 1 1 31 31 VAL HB H 1 2.11 0.01 . 1 . . . . 31 VAL HB . 6986 1 293 . 1 1 31 31 VAL HG11 H 1 0.90 0.01 . 2 . . . . 31 VAL HG1 . 6986 1 294 . 1 1 31 31 VAL HG12 H 1 0.90 0.01 . 2 . . . . 31 VAL HG1 . 6986 1 295 . 1 1 31 31 VAL HG13 H 1 0.90 0.01 . 2 . . . . 31 VAL HG1 . 6986 1 296 . 1 1 31 31 VAL HG21 H 1 0.90 0.01 . 2 . . . . 31 VAL HG2 . 6986 1 297 . 1 1 31 31 VAL HG22 H 1 0.90 0.01 . 2 . . . . 31 VAL HG2 . 6986 1 298 . 1 1 31 31 VAL HG23 H 1 0.90 0.01 . 2 . . . . 31 VAL HG2 . 6986 1 299 . 1 1 31 31 VAL C C 13 174.2 1.00 . 1 . . . . 31 VAL C . 6986 1 300 . 1 1 31 31 VAL CA C 13 64.8 0.90 . 1 . . . . 31 VAL CA . 6986 1 301 . 1 1 31 31 VAL CB C 13 29.5 0.90 . 1 . . . . 31 VAL CB . 6986 1 302 . 1 1 31 31 VAL N N 15 121.2 0.20 . 1 . . . . 31 VAL N . 6986 1 303 . 1 1 32 32 ALA H H 1 8.07 0.01 . 1 . . . . 32 ALA HN . 6986 1 304 . 1 1 32 32 ALA HA H 1 3.75 0.01 . 1 . . . . 32 ALA HA . 6986 1 305 . 1 1 32 32 ALA HB1 H 1 1.49 0.01 . 1 . . . . 32 ALA HB . 6986 1 306 . 1 1 32 32 ALA HB2 H 1 1.49 0.01 . 1 . . . . 32 ALA HB . 6986 1 307 . 1 1 32 32 ALA HB3 H 1 1.49 0.01 . 1 . . . . 32 ALA HB . 6986 1 308 . 1 1 32 32 ALA C C 13 178.4 1.00 . 1 . . . . 32 ALA C . 6986 1 309 . 1 1 32 32 ALA CA C 13 53.3 0.90 . 1 . . . . 32 ALA CA . 6986 1 310 . 1 1 32 32 ALA CB C 13 15.5 0.90 . 1 . . . . 32 ALA CB . 6986 1 311 . 1 1 32 32 ALA N N 15 121.8 0.20 . 1 . . . . 32 ALA N . 6986 1 312 . 1 1 33 33 GLU H H 1 8.19 0.01 . 1 . . . . 33 GLU HN . 6986 1 313 . 1 1 33 33 GLU HA H 1 3.86 0.01 . 1 . . . . 33 GLU HA . 6986 1 314 . 1 1 33 33 GLU HB2 H 1 1.86 0.01 . 1 . . . . 33 GLU HB2 . 6986 1 315 . 1 1 33 33 GLU HB3 H 1 1.86 0.01 . 1 . . . . 33 GLU HB3 . 6986 1 316 . 1 1 33 33 GLU HG2 H 1 2.28 0.01 . 2 . . . . 33 GLU HG2 . 6986 1 317 . 1 1 33 33 GLU HG3 H 1 2.14 0.01 . 2 . . . . 33 GLU HG3 . 6986 1 318 . 1 1 33 33 GLU C C 13 176.7 1.00 . 1 . . . . 33 GLU C . 6986 1 319 . 1 1 33 33 GLU CA C 13 55.6 0.90 . 1 . . . . 33 GLU CA . 6986 1 320 . 1 1 33 33 GLU CB C 13 26.8 0.90 . 1 . . . . 33 GLU CB . 6986 1 321 . 1 1 33 33 GLU N N 15 114.2 0.20 . 1 . . . . 33 GLU N . 6986 1 322 . 1 1 34 34 THR H H 1 7.72 0.01 . 1 . . . . 34 THR HN . 6986 1 323 . 1 1 34 34 THR HA H 1 4.78 0.01 . 1 . . . . 34 THR HA . 6986 1 324 . 1 1 34 34 THR HB H 1 4.11 0.01 . 1 . . . . 34 THR HB . 6986 1 325 . 1 1 34 34 THR HG21 H 1 0.92 0.01 . 1 . . . . 34 THR HG2 . 6986 1 326 . 1 1 34 34 THR HG22 H 1 0.92 0.01 . 1 . . . . 34 THR HG2 . 6986 1 327 . 1 1 34 34 THR HG23 H 1 0.92 0.01 . 1 . . . . 34 THR HG2 . 6986 1 328 . 1 1 34 34 THR C C 13 173.1 1.00 . 1 . . . . 34 THR C . 6986 1 329 . 1 1 34 34 THR CA C 13 64.3 0.90 . 1 . . . . 34 THR CA . 6986 1 330 . 1 1 34 34 THR CB C 13 65.6 0.90 . 1 . . . . 34 THR CB . 6986 1 331 . 1 1 34 34 THR N N 15 117.5 0.20 . 1 . . . . 34 THR N . 6986 1 332 . 1 1 35 35 LEU H H 1 8.20 0.01 . 1 . . . . 35 LEU HN . 6986 1 333 . 1 1 35 35 LEU HA H 1 4.14 0.01 . 1 . . . . 35 LEU HA . 6986 1 334 . 1 1 35 35 LEU HB2 H 1 1.51 0.01 . 2 . . . . 35 LEU HB2 . 6986 1 335 . 1 1 35 35 LEU HB3 H 1 1.82 0.01 . 2 . . . . 35 LEU HB3 . 6986 1 336 . 1 1 35 35 LEU HG H 1 1.48 0.01 . 1 . . . . 35 LEU HG . 6986 1 337 . 1 1 35 35 LEU HD11 H 1 0.89 0.01 . 2 . . . . 35 LEU HD1 . 6986 1 338 . 1 1 35 35 LEU HD12 H 1 0.89 0.01 . 2 . . . . 35 LEU HD1 . 6986 1 339 . 1 1 35 35 LEU HD13 H 1 0.89 0.01 . 2 . . . . 35 LEU HD1 . 6986 1 340 . 1 1 35 35 LEU HD21 H 1 0.68 0.01 . 2 . . . . 35 LEU HD2 . 6986 1 341 . 1 1 35 35 LEU HD22 H 1 0.68 0.01 . 2 . . . . 35 LEU HD2 . 6986 1 342 . 1 1 35 35 LEU HD23 H 1 0.68 0.01 . 2 . . . . 35 LEU HD2 . 6986 1 343 . 1 1 35 35 LEU C C 13 175.3 1.00 . 1 . . . . 35 LEU C . 6986 1 344 . 1 1 35 35 LEU CA C 13 54.8 0.90 . 1 . . . . 35 LEU CA . 6986 1 345 . 1 1 35 35 LEU CB C 13 38.8 0.90 . 1 . . . . 35 LEU CB . 6986 1 346 . 1 1 35 35 LEU N N 15 119.2 0.20 . 1 . . . . 35 LEU N . 6986 1 347 . 1 1 36 36 VAL H H 1 6.81 0.01 . 1 . . . . 36 VAL HN . 6986 1 348 . 1 1 36 36 VAL HA H 1 4.45 0.01 . 1 . . . . 36 VAL HA . 6986 1 349 . 1 1 36 36 VAL HB H 1 2.30 0.01 . 1 . . . . 36 VAL HB . 6986 1 350 . 1 1 36 36 VAL HG11 H 1 0.85 0.01 . 2 . . . . 36 VAL HG1 . 6986 1 351 . 1 1 36 36 VAL HG12 H 1 0.85 0.01 . 2 . . . . 36 VAL HG1 . 6986 1 352 . 1 1 36 36 VAL HG13 H 1 0.85 0.01 . 2 . . . . 36 VAL HG1 . 6986 1 353 . 1 1 36 36 VAL HG21 H 1 0.85 0.01 . 2 . . . . 36 VAL HG2 . 6986 1 354 . 1 1 36 36 VAL HG22 H 1 0.85 0.01 . 2 . . . . 36 VAL HG2 . 6986 1 355 . 1 1 36 36 VAL HG23 H 1 0.85 0.01 . 2 . . . . 36 VAL HG2 . 6986 1 356 . 1 1 36 36 VAL C C 13 173.0 1.00 . 1 . . . . 36 VAL C . 6986 1 357 . 1 1 36 36 VAL CA C 13 57.6 0.90 . 1 . . . . 36 VAL CA . 6986 1 358 . 1 1 36 36 VAL CB C 13 27.2 0.90 . 1 . . . . 36 VAL CB . 6986 1 359 . 1 1 36 36 VAL N N 15 108.3 0.20 . 1 . . . . 36 VAL N . 6986 1 360 . 1 1 37 37 ALA H H 1 6.95 0.01 . 1 . . . . 37 ALA HN . 6986 1 361 . 1 1 37 37 ALA HA H 1 4.02 0.01 . 1 . . . . 37 ALA HA . 6986 1 362 . 1 1 37 37 ALA HB1 H 1 1.38 0.01 . 1 . . . . 37 ALA HB . 6986 1 363 . 1 1 37 37 ALA HB2 H 1 1.38 0.01 . 1 . . . . 37 ALA HB . 6986 1 364 . 1 1 37 37 ALA HB3 H 1 1.38 0.01 . 1 . . . . 37 ALA HB . 6986 1 365 . 1 1 37 37 ALA C C 13 173.3 1.00 . 1 . . . . 37 ALA C . 6986 1 366 . 1 1 37 37 ALA CA C 13 50.7 0.90 . 1 . . . . 37 ALA CA . 6986 1 367 . 1 1 37 37 ALA CB C 13 16.2 0.90 . 1 . . . . 37 ALA CB . 6986 1 368 . 1 1 37 37 ALA N N 15 126.6 0.20 . 1 . . . . 37 ALA N . 6986 1 369 . 1 1 38 38 ASP H H 1 8.03 0.01 . 1 . . . . 38 ASP HN . 6986 1 370 . 1 1 38 38 ASP HA H 1 4.67 0.01 . 1 . . . . 38 ASP HA . 6986 1 371 . 1 1 38 38 ASP HB2 H 1 2.64 0.01 . 2 . . . . 38 ASP HB2 . 6986 1 372 . 1 1 38 38 ASP HB3 H 1 2.38 0.01 . 2 . . . . 38 ASP HB3 . 6986 1 373 . 1 1 38 38 ASP CA C 13 48.1 0.90 . 1 . . . . 38 ASP CA . 6986 1 374 . 1 1 38 38 ASP CB C 13 40.9 0.90 . 1 . . . . 38 ASP CB . 6986 1 375 . 1 1 38 38 ASP N N 15 120.8 0.20 . 1 . . . . 38 ASP N . 6986 1 376 . 1 1 39 39 PRO HA H 1 4.92 0.01 . 1 . . . . 39 PRO HA . 6986 1 377 . 1 1 39 39 PRO HB2 H 1 2.32 0.01 . 2 . . . . 39 PRO HB2 . 6986 1 378 . 1 1 39 39 PRO HB3 H 1 1.96 0.01 . 2 . . . . 39 PRO HB3 . 6986 1 379 . 1 1 39 39 PRO HG2 H 1 1.55 0.01 . 2 . . . . 39 PRO HG2 . 6986 1 380 . 1 1 39 39 PRO HG3 H 1 1.46 0.01 . 2 . . . . 39 PRO HG3 . 6986 1 381 . 1 1 39 39 PRO HD2 H 1 3.46 0.01 . 1 . . . . 39 PRO HD2 . 6986 1 382 . 1 1 39 39 PRO HD3 H 1 3.46 0.01 . 1 . . . . 39 PRO HD3 . 6986 1 383 . 1 1 39 39 PRO C C 13 173.5 1.00 . 1 . . . . 39 PRO C . 6986 1 384 . 1 1 39 39 PRO CA C 13 60.2 0.90 . 1 . . . . 39 PRO CA . 6986 1 385 . 1 1 39 39 PRO CB C 13 31.7 0.90 . 1 . . . . 39 PRO CB . 6986 1 386 . 1 1 40 40 THR H H 1 8.43 0.01 . 1 . . . . 40 THR HN . 6986 1 387 . 1 1 40 40 THR HA H 1 4.30 0.01 . 1 . . . . 40 THR HA . 6986 1 388 . 1 1 40 40 THR HB H 1 3.93 0.01 . 1 . . . . 40 THR HB . 6986 1 389 . 1 1 40 40 THR HG21 H 1 1.40 0.01 . 1 . . . . 40 THR HG2 . 6986 1 390 . 1 1 40 40 THR HG22 H 1 1.40 0.01 . 1 . . . . 40 THR HG2 . 6986 1 391 . 1 1 40 40 THR HG23 H 1 1.40 0.01 . 1 . . . . 40 THR HG2 . 6986 1 392 . 1 1 40 40 THR CA C 13 58.8 0.90 . 1 . . . . 40 THR CA . 6986 1 393 . 1 1 40 40 THR CB C 13 67.4 0.90 . 1 . . . . 40 THR CB . 6986 1 394 . 1 1 40 40 THR N N 15 118.3 0.20 . 1 . . . . 40 THR N . 6986 1 395 . 1 1 41 41 PRO HA H 1 4.67 0.01 . 1 . . . . 41 PRO HA . 6986 1 396 . 1 1 41 41 PRO HB2 H 1 2.20 0.01 . 1 . . . . 41 PRO HB2 . 6986 1 397 . 1 1 41 41 PRO HB3 H 1 2.20 0.01 . 1 . . . . 41 PRO HB3 . 6986 1 398 . 1 1 41 41 PRO HG2 H 1 1.75 0.01 . 1 . . . . 41 PRO HG2 . 6986 1 399 . 1 1 41 41 PRO HG3 H 1 1.75 0.01 . 1 . . . . 41 PRO HG3 . 6986 1 400 . 1 1 41 41 PRO HD2 H 1 3.54 0.01 . 1 . . . . 41 PRO HD2 . 6986 1 401 . 1 1 41 41 PRO HD3 H 1 3.54 0.01 . 1 . . . . 41 PRO HD3 . 6986 1 402 . 1 1 41 41 PRO C C 13 172.5 1.00 . 1 . . . . 41 PRO C . 6986 1 403 . 1 1 41 41 PRO CA C 13 59.6 0.90 . 1 . . . . 41 PRO CA . 6986 1 404 . 1 1 41 41 PRO CB C 13 29.6 0.90 . 1 . . . . 41 PRO CB . 6986 1 405 . 1 1 42 42 THR H H 1 8.37 0.01 . 1 . . . . 42 THR HN . 6986 1 406 . 1 1 42 42 THR HA H 1 4.21 0.01 . 1 . . . . 42 THR HA . 6986 1 407 . 1 1 42 42 THR HB H 1 4.00 0.01 . 1 . . . . 42 THR HB . 6986 1 408 . 1 1 42 42 THR HG21 H 1 1.17 0.01 . 1 . . . . 42 THR HG2 . 6986 1 409 . 1 1 42 42 THR HG22 H 1 1.17 0.01 . 1 . . . . 42 THR HG2 . 6986 1 410 . 1 1 42 42 THR HG23 H 1 1.17 0.01 . 1 . . . . 42 THR HG2 . 6986 1 411 . 1 1 42 42 THR C C 13 170.6 1.00 . 1 . . . . 42 THR C . 6986 1 412 . 1 1 42 42 THR CA C 13 59.3 0.90 . 1 . . . . 42 THR CA . 6986 1 413 . 1 1 42 42 THR CB C 13 67.2 0.90 . 1 . . . . 42 THR CB . 6986 1 414 . 1 1 42 42 THR N N 15 118.0 0.20 . 1 . . . . 42 THR N . 6986 1 415 . 1 1 43 43 ALA H H 1 8.49 0.01 . 1 . . . . 43 ALA HN . 6986 1 416 . 1 1 43 43 ALA HA H 1 4.63 0.01 . 1 . . . . 43 ALA HA . 6986 1 417 . 1 1 43 43 ALA HB1 H 1 1.18 0.01 . 1 . . . . 43 ALA HB . 6986 1 418 . 1 1 43 43 ALA HB2 H 1 1.18 0.01 . 1 . . . . 43 ALA HB . 6986 1 419 . 1 1 43 43 ALA HB3 H 1 1.18 0.01 . 1 . . . . 43 ALA HB . 6986 1 420 . 1 1 43 43 ALA C C 13 174.7 1.00 . 1 . . . . 43 ALA C . 6986 1 421 . 1 1 43 43 ALA CA C 13 48.8 0.90 . 1 . . . . 43 ALA CA . 6986 1 422 . 1 1 43 43 ALA CB C 13 18.7 0.90 . 1 . . . . 43 ALA CB . 6986 1 423 . 1 1 43 43 ALA N N 15 129.8 0.20 . 1 . . . . 43 ALA N . 6986 1 424 . 1 1 44 44 THR H H 1 8.37 0.01 . 1 . . . . 44 THR HN . 6986 1 425 . 1 1 44 44 THR HA H 1 4.61 0.01 . 1 . . . . 44 THR HA . 6986 1 426 . 1 1 44 44 THR HB H 1 3.79 0.01 . 1 . . . . 44 THR HB . 6986 1 427 . 1 1 44 44 THR HG21 H 1 1.11 0.01 . 1 . . . . 44 THR HG2 . 6986 1 428 . 1 1 44 44 THR HG22 H 1 1.11 0.01 . 1 . . . . 44 THR HG2 . 6986 1 429 . 1 1 44 44 THR HG23 H 1 1.11 0.01 . 1 . . . . 44 THR HG2 . 6986 1 430 . 1 1 44 44 THR C C 13 170.3 1.00 . 1 . . . . 44 THR C . 6986 1 431 . 1 1 44 44 THR CA C 13 58.3 0.90 . 1 . . . . 44 THR CA . 6986 1 432 . 1 1 44 44 THR CB C 13 69.2 0.90 . 1 . . . . 44 THR CB . 6986 1 433 . 1 1 44 44 THR N N 15 115.9 0.20 . 1 . . . . 44 THR N . 6986 1 434 . 1 1 45 45 ILE H H 1 8.51 0.01 . 1 . . . . 45 ILE HN . 6986 1 435 . 1 1 45 45 ILE HA H 1 4.48 0.01 . 1 . . . . 45 ILE HA . 6986 1 436 . 1 1 45 45 ILE HB H 1 1.65 0.01 . 1 . . . . 45 ILE HB . 6986 1 437 . 1 1 45 45 ILE HG12 H 1 1.15 0.01 . 1 . . . . 45 ILE HG12 . 6986 1 438 . 1 1 45 45 ILE HG13 H 1 1.15 0.01 . 1 . . . . 45 ILE HG13 . 6986 1 439 . 1 1 45 45 ILE HG21 H 1 0.85 0.01 . 1 . . . . 45 ILE HG2 . 6986 1 440 . 1 1 45 45 ILE HG22 H 1 0.85 0.01 . 1 . . . . 45 ILE HG2 . 6986 1 441 . 1 1 45 45 ILE HG23 H 1 0.85 0.01 . 1 . . . . 45 ILE HG2 . 6986 1 442 . 1 1 45 45 ILE HD11 H 1 0.83 0.01 . 1 . . . . 45 ILE HD1 . 6986 1 443 . 1 1 45 45 ILE HD12 H 1 0.83 0.01 . 1 . . . . 45 ILE HD1 . 6986 1 444 . 1 1 45 45 ILE HD13 H 1 0.83 0.01 . 1 . . . . 45 ILE HD1 . 6986 1 445 . 1 1 45 45 ILE C C 13 173.5 1.00 . 1 . . . . 45 ILE C . 6986 1 446 . 1 1 45 45 ILE CA C 13 60.6 0.90 . 1 . . . . 45 ILE CA . 6986 1 447 . 1 1 45 45 ILE CB C 13 35.5 0.90 . 1 . . . . 45 ILE CB . 6986 1 448 . 1 1 45 45 ILE N N 15 128.3 0.20 . 1 . . . . 45 ILE N . 6986 1 449 . 1 1 46 46 VAL H H 1 9.34 0.01 . 1 . . . . 46 VAL HN . 6986 1 450 . 1 1 46 46 VAL HA H 1 5.16 0.01 . 1 . . . . 46 VAL HA . 6986 1 451 . 1 1 46 46 VAL HB H 1 2.08 0.01 . 1 . . . . 46 VAL HB . 6986 1 452 . 1 1 46 46 VAL HG11 H 1 1.11 0.01 . 2 . . . . 46 VAL HG1 . 6986 1 453 . 1 1 46 46 VAL HG12 H 1 1.11 0.01 . 2 . . . . 46 VAL HG1 . 6986 1 454 . 1 1 46 46 VAL HG13 H 1 1.11 0.01 . 2 . . . . 46 VAL HG1 . 6986 1 455 . 1 1 46 46 VAL HG21 H 1 1.11 0.01 . 2 . . . . 46 VAL HG2 . 6986 1 456 . 1 1 46 46 VAL HG22 H 1 1.11 0.01 . 2 . . . . 46 VAL HG2 . 6986 1 457 . 1 1 46 46 VAL HG23 H 1 1.11 0.01 . 2 . . . . 46 VAL HG2 . 6986 1 458 . 1 1 46 46 VAL C C 13 170.8 1.00 . 1 . . . . 46 VAL C . 6986 1 459 . 1 1 46 46 VAL CA C 13 55.7 0.90 . 1 . . . . 46 VAL CA . 6986 1 460 . 1 1 46 46 VAL CB C 13 33.0 0.90 . 1 . . . . 46 VAL CB . 6986 1 461 . 1 1 46 46 VAL N N 15 121.7 0.20 . 1 . . . . 46 VAL N . 6986 1 462 . 1 1 47 47 HIS H H 1 9.18 0.01 . 1 . . . . 47 HIS HN . 6986 1 463 . 1 1 47 47 HIS HA H 1 5.02 0.01 . 1 . . . . 47 HIS HA . 6986 1 464 . 1 1 47 47 HIS HB2 H 1 3.12 0.01 . 1 . . . . 47 HIS HB2 . 6986 1 465 . 1 1 47 47 HIS HB3 H 1 3.12 0.01 . 1 . . . . 47 HIS HB3 . 6986 1 466 . 1 1 47 47 HIS HD2 H 1 6.60 0.01 . 1 . . . . 47 HIS HD2 . 6986 1 467 . 1 1 47 47 HIS HE1 H 1 6.88 0.01 . 1 . . . . 47 HIS HE1 . 6986 1 468 . 1 1 47 47 HIS C C 13 170.8 1.00 . 1 . . . . 47 HIS C . 6986 1 469 . 1 1 47 47 HIS CA C 13 54.4 0.90 . 1 . . . . 47 HIS CA . 6986 1 470 . 1 1 47 47 HIS CB C 13 29.2 0.90 . 1 . . . . 47 HIS CB . 6986 1 471 . 1 1 47 47 HIS N N 15 123.7 0.20 . 1 . . . . 47 HIS N . 6986 1 472 . 1 1 48 48 PHE H H 1 9.09 0.01 . 1 . . . . 48 PHE HN . 6986 1 473 . 1 1 48 48 PHE HA H 1 4.53 0.01 . 1 . . . . 48 PHE HA . 6986 1 474 . 1 1 48 48 PHE HB2 H 1 3.11 0.01 . 1 . . . . 48 PHE HB2 . 6986 1 475 . 1 1 48 48 PHE HB3 H 1 3.11 0.01 . 1 . . . . 48 PHE HB3 . 6986 1 476 . 1 1 48 48 PHE HD1 H 1 6.91 0.01 . 1 . . . . 48 PHE HD1 . 6986 1 477 . 1 1 48 48 PHE HD2 H 1 6.91 0.01 . 1 . . . . 48 PHE HD2 . 6986 1 478 . 1 1 48 48 PHE HE1 H 1 6.52 0.01 . 1 . . . . 48 PHE HE1 . 6986 1 479 . 1 1 48 48 PHE HE2 H 1 6.52 0.01 . 1 . . . . 48 PHE HE2 . 6986 1 480 . 1 1 48 48 PHE HZ H 1 7.29 0.01 . 1 . . . . 48 PHE HZ . 6986 1 481 . 1 1 48 48 PHE C C 13 170.0 1.00 . 1 . . . . 48 PHE C . 6986 1 482 . 1 1 48 48 PHE CA C 13 53.7 0.90 . 1 . . . . 48 PHE CA . 6986 1 483 . 1 1 48 48 PHE CB C 13 39.7 0.90 . 1 . . . . 48 PHE CB . 6986 1 484 . 1 1 48 48 PHE N N 15 133.5 0.20 . 1 . . . . 48 PHE N . 6986 1 485 . 1 1 49 49 LYS H H 1 8.41 0.01 . 1 . . . . 49 LYS HN . 6986 1 486 . 1 1 49 49 LYS HA H 1 5.02 0.01 . 1 . . . . 49 LYS HA . 6986 1 487 . 1 1 49 49 LYS HB2 H 1 1.79 0.01 . 1 . . . . 49 LYS HB2 . 6986 1 488 . 1 1 49 49 LYS HB3 H 1 1.79 0.01 . 1 . . . . 49 LYS HB3 . 6986 1 489 . 1 1 49 49 LYS HG2 H 1 1.23 0.01 . 1 . . . . 49 LYS HG2 . 6986 1 490 . 1 1 49 49 LYS HG3 H 1 1.23 0.01 . 1 . . . . 49 LYS HG3 . 6986 1 491 . 1 1 49 49 LYS HD2 H 1 1.50 0.01 . 1 . . . . 49 LYS HD2 . 6986 1 492 . 1 1 49 49 LYS HD3 H 1 1.50 0.01 . 1 . . . . 49 LYS HD3 . 6986 1 493 . 1 1 49 49 LYS C C 13 171.7 1.00 . 1 . . . . 49 LYS C . 6986 1 494 . 1 1 49 49 LYS CA C 13 51.8 0.90 . 1 . . . . 49 LYS CA . 6986 1 495 . 1 1 49 49 LYS CB C 13 33.5 0.90 . 1 . . . . 49 LYS CB . 6986 1 496 . 1 1 49 49 LYS N N 15 127.5 0.20 . 1 . . . . 49 LYS N . 6986 1 497 . 1 1 50 50 VAL H H 1 8.94 0.01 . 1 . . . . 50 VAL HN . 6986 1 498 . 1 1 50 50 VAL HA H 1 4.85 0.01 . 1 . . . . 50 VAL HA . 6986 1 499 . 1 1 50 50 VAL HB H 1 1.84 0.01 . 1 . . . . 50 VAL HB . 6986 1 500 . 1 1 50 50 VAL HG11 H 1 0.89 0.01 . 2 . . . . 50 VAL HG1 . 6986 1 501 . 1 1 50 50 VAL HG12 H 1 0.89 0.01 . 2 . . . . 50 VAL HG1 . 6986 1 502 . 1 1 50 50 VAL HG13 H 1 0.89 0.01 . 2 . . . . 50 VAL HG1 . 6986 1 503 . 1 1 50 50 VAL HG21 H 1 0.89 0.01 . 2 . . . . 50 VAL HG2 . 6986 1 504 . 1 1 50 50 VAL HG22 H 1 0.89 0.01 . 2 . . . . 50 VAL HG2 . 6986 1 505 . 1 1 50 50 VAL HG23 H 1 0.89 0.01 . 2 . . . . 50 VAL HG2 . 6986 1 506 . 1 1 50 50 VAL C C 13 170.7 1.00 . 1 . . . . 50 VAL C . 6986 1 507 . 1 1 50 50 VAL CA C 13 57.3 0.90 . 1 . . . . 50 VAL CA . 6986 1 508 . 1 1 50 50 VAL CB C 13 31.5 0.90 . 1 . . . . 50 VAL CB . 6986 1 509 . 1 1 50 50 VAL N N 15 124.4 0.20 . 1 . . . . 50 VAL N . 6986 1 510 . 1 1 51 51 SER H H 1 8.69 0.01 . 1 . . . . 51 SER HN . 6986 1 511 . 1 1 51 51 SER HA H 1 4.81 0.01 . 1 . . . . 51 SER HA . 6986 1 512 . 1 1 51 51 SER HB2 H 1 3.84 0.01 . 1 . . . . 51 SER HB2 . 6986 1 513 . 1 1 51 51 SER HB3 H 1 3.84 0.01 . 1 . . . . 51 SER HB3 . 6986 1 514 . 1 1 51 51 SER C C 13 171.2 1.00 . 1 . . . . 51 SER C . 6986 1 515 . 1 1 51 51 SER CA C 13 54.0 0.90 . 1 . . . . 51 SER CA . 6986 1 516 . 1 1 51 51 SER CB C 13 64.7 0.90 . 1 . . . . 51 SER CB . 6986 1 517 . 1 1 51 51 SER N N 15 121.9 0.20 . 1 . . . . 51 SER N . 6986 1 518 . 1 1 52 52 ALA H H 1 8.94 0.01 . 1 . . . . 52 ALA HN . 6986 1 519 . 1 1 52 52 ALA HA H 1 4.67 0.01 . 1 . . . . 52 ALA HA . 6986 1 520 . 1 1 52 52 ALA HB1 H 1 1.40 0.01 . 1 . . . . 52 ALA HB . 6986 1 521 . 1 1 52 52 ALA HB2 H 1 1.40 0.01 . 1 . . . . 52 ALA HB . 6986 1 522 . 1 1 52 52 ALA HB3 H 1 1.40 0.01 . 1 . . . . 52 ALA HB . 6986 1 523 . 1 1 52 52 ALA C C 13 175.3 1.00 . 1 . . . . 52 ALA C . 6986 1 524 . 1 1 52 52 ALA CA C 13 51.8 0.90 . 1 . . . . 52 ALA CA . 6986 1 525 . 1 1 52 52 ALA CB C 13 15.5 0.90 . 1 . . . . 52 ALA CB . 6986 1 526 . 1 1 52 52 ALA N N 15 120.4 0.20 . 1 . . . . 52 ALA N . 6986 1 527 . 1 1 53 53 GLN H H 1 7.90 0.01 . 1 . . . . 53 GLN HN . 6986 1 528 . 1 1 53 53 GLN HA H 1 4.28 0.01 . 1 . . . . 53 GLN HA . 6986 1 529 . 1 1 53 53 GLN HB2 H 1 1.75 0.01 . 1 . . . . 53 GLN HB2 . 6986 1 530 . 1 1 53 53 GLN HB3 H 1 1.75 0.01 . 1 . . . . 53 GLN HB3 . 6986 1 531 . 1 1 53 53 GLN HG2 H 1 2.29 0.01 . 2 . . . . 53 GLN HG2 . 6986 1 532 . 1 1 53 53 GLN HG3 H 1 2.11 0.01 . 2 . . . . 53 GLN HG3 . 6986 1 533 . 1 1 53 53 GLN C C 13 174.8 1.00 . 1 . . . . 53 GLN C . 6986 1 534 . 1 1 53 53 GLN CA C 13 54.3 0.90 . 1 . . . . 53 GLN CA . 6986 1 535 . 1 1 53 53 GLN CB C 13 26.7 0.90 . 1 . . . . 53 GLN CB . 6986 1 536 . 1 1 53 53 GLN N N 15 112.0 0.20 . 1 . . . . 53 GLN N . 6986 1 537 . 1 1 54 54 GLY H H 1 7.80 0.01 . 1 . . . . 54 GLY HN . 6986 1 538 . 1 1 54 54 GLY HA2 H 1 4.67 0.01 . 1 . . . . 54 GLY HA1 . 6986 1 539 . 1 1 54 54 GLY HA3 H 1 4.67 0.01 . 1 . . . . 54 GLY HA2 . 6986 1 540 . 1 1 54 54 GLY C C 13 171.9 1.00 . 1 . . . . 54 GLY C . 6986 1 541 . 1 1 54 54 GLY CA C 13 42.0 0.90 . 1 . . . . 54 GLY CA . 6986 1 542 . 1 1 54 54 GLY N N 15 107.1 0.20 . 1 . . . . 54 GLY N . 6986 1 543 . 1 1 55 55 ILE H H 1 8.08 0.01 . 1 . . . . 55 ILE HN . 6986 1 544 . 1 1 55 55 ILE HA H 1 4.70 0.01 . 1 . . . . 55 ILE HA . 6986 1 545 . 1 1 55 55 ILE HB H 1 1.81 0.01 . 1 . . . . 55 ILE HB . 6986 1 546 . 1 1 55 55 ILE HG12 H 1 1.13 0.01 . 1 . . . . 55 ILE HG12 . 6986 1 547 . 1 1 55 55 ILE HG13 H 1 1.13 0.01 . 1 . . . . 55 ILE HG13 . 6986 1 548 . 1 1 55 55 ILE HG21 H 1 -0.22 0.01 . 1 . . . . 55 ILE HG2 . 6986 1 549 . 1 1 55 55 ILE HG22 H 1 -0.22 0.01 . 1 . . . . 55 ILE HG2 . 6986 1 550 . 1 1 55 55 ILE HG23 H 1 -0.22 0.01 . 1 . . . . 55 ILE HG2 . 6986 1 551 . 1 1 55 55 ILE HD11 H 1 -0.26 0.01 . 1 . . . . 55 ILE HD1 . 6986 1 552 . 1 1 55 55 ILE HD12 H 1 -0.26 0.01 . 1 . . . . 55 ILE HD1 . 6986 1 553 . 1 1 55 55 ILE HD13 H 1 -0.26 0.01 . 1 . . . . 55 ILE HD1 . 6986 1 554 . 1 1 55 55 ILE C C 13 172.0 1.00 . 1 . . . . 55 ILE C . 6986 1 555 . 1 1 55 55 ILE CA C 13 57.1 0.90 . 1 . . . . 55 ILE CA . 6986 1 556 . 1 1 55 55 ILE CB C 13 37.9 0.90 . 1 . . . . 55 ILE CB . 6986 1 557 . 1 1 55 55 ILE N N 15 121.8 0.20 . 1 . . . . 55 ILE N . 6986 1 558 . 1 1 56 56 THR H H 1 9.26 0.01 . 1 . . . . 56 THR HN . 6986 1 559 . 1 1 56 56 THR HA H 1 5.08 0.01 . 1 . . . . 56 THR HA . 6986 1 560 . 1 1 56 56 THR HB H 1 3.68 0.01 . 1 . . . . 56 THR HB . 6986 1 561 . 1 1 56 56 THR HG21 H 1 0.96 0.01 . 1 . . . . 56 THR HG2 . 6986 1 562 . 1 1 56 56 THR HG22 H 1 0.96 0.01 . 1 . . . . 56 THR HG2 . 6986 1 563 . 1 1 56 56 THR HG23 H 1 0.96 0.01 . 1 . . . . 56 THR HG2 . 6986 1 564 . 1 1 56 56 THR C C 13 170.7 1.00 . 1 . . . . 56 THR C . 6986 1 565 . 1 1 56 56 THR CA C 13 58.8 0.90 . 1 . . . . 56 THR CA . 6986 1 566 . 1 1 56 56 THR CB C 13 68.1 0.90 . 1 . . . . 56 THR CB . 6986 1 567 . 1 1 56 56 THR N N 15 123.8 0.20 . 1 . . . . 56 THR N . 6986 1 568 . 1 1 57 57 LEU H H 1 9.40 0.01 . 1 . . . . 57 LEU HN . 6986 1 569 . 1 1 57 57 LEU HA H 1 5.57 0.01 . 1 . . . . 57 LEU HA . 6986 1 570 . 1 1 57 57 LEU HB2 H 1 1.65 0.01 . 1 . . . . 57 LEU HB2 . 6986 1 571 . 1 1 57 57 LEU HB3 H 1 1.65 0.01 . 1 . . . . 57 LEU HB3 . 6986 1 572 . 1 1 57 57 LEU HG H 1 1.58 0.01 . 1 . . . . 57 LEU HG . 6986 1 573 . 1 1 57 57 LEU HD11 H 1 0.50 0.01 . 2 . . . . 57 LEU HD1 . 6986 1 574 . 1 1 57 57 LEU HD12 H 1 0.50 0.01 . 2 . . . . 57 LEU HD1 . 6986 1 575 . 1 1 57 57 LEU HD13 H 1 0.50 0.01 . 2 . . . . 57 LEU HD1 . 6986 1 576 . 1 1 57 57 LEU HD21 H 1 0.93 0.01 . 2 . . . . 57 LEU HD2 . 6986 1 577 . 1 1 57 57 LEU HD22 H 1 0.93 0.01 . 2 . . . . 57 LEU HD2 . 6986 1 578 . 1 1 57 57 LEU HD23 H 1 0.93 0.01 . 2 . . . . 57 LEU HD2 . 6986 1 579 . 1 1 57 57 LEU C C 13 173.8 1.00 . 1 . . . . 57 LEU C . 6986 1 580 . 1 1 57 57 LEU CA C 13 49.5 0.90 . 1 . . . . 57 LEU CA . 6986 1 581 . 1 1 57 57 LEU CB C 13 42.2 0.90 . 1 . . . . 57 LEU CB . 6986 1 582 . 1 1 57 57 LEU N N 15 127.4 0.20 . 1 . . . . 57 LEU N . 6986 1 583 . 1 1 58 58 THR H H 1 9.02 0.01 . 1 . . . . 58 THR HN . 6986 1 584 . 1 1 58 58 THR HA H 1 5.17 0.01 . 1 . . . . 58 THR HA . 6986 1 585 . 1 1 58 58 THR HB H 1 4.04 0.01 . 1 . . . . 58 THR HB . 6986 1 586 . 1 1 58 58 THR HG21 H 1 0.95 0.01 . 1 . . . . 58 THR HG2 . 6986 1 587 . 1 1 58 58 THR HG22 H 1 0.95 0.01 . 1 . . . . 58 THR HG2 . 6986 1 588 . 1 1 58 58 THR HG23 H 1 0.95 0.01 . 1 . . . . 58 THR HG2 . 6986 1 589 . 1 1 58 58 THR C C 13 170.8 1.00 . 1 . . . . 58 THR C . 6986 1 590 . 1 1 58 58 THR CA C 13 58.8 0.90 . 1 . . . . 58 THR CA . 6986 1 591 . 1 1 58 58 THR CB C 13 68.4 0.90 . 1 . . . . 58 THR CB . 6986 1 592 . 1 1 58 58 THR N N 15 118.0 0.20 . 1 . . . . 58 THR N . 6986 1 593 . 1 1 59 59 ASP H H 1 8.69 0.01 . 1 . . . . 59 ASP HN . 6986 1 594 . 1 1 59 59 ASP HA H 1 4.66 0.01 . 1 . . . . 59 ASP HA . 6986 1 595 . 1 1 59 59 ASP HB2 H 1 2.94 0.01 . 1 . . . . 59 ASP HB2 . 6986 1 596 . 1 1 59 59 ASP HB3 H 1 2.94 0.01 . 1 . . . . 59 ASP HB3 . 6986 1 597 . 1 1 59 59 ASP C C 13 174.5 1.00 . 1 . . . . 59 ASP C . 6986 1 598 . 1 1 59 59 ASP CA C 13 49.9 0.90 . 1 . . . . 59 ASP CA . 6986 1 599 . 1 1 59 59 ASP CB C 13 37.5 0.90 . 1 . . . . 59 ASP CB . 6986 1 600 . 1 1 59 59 ASP N N 15 126.9 0.20 . 1 . . . . 59 ASP N . 6986 1 601 . 1 1 60 60 ASN H H 1 8.72 0.01 . 1 . . . . 60 ASN HN . 6986 1 602 . 1 1 60 60 ASN HA H 1 5.53 0.01 . 1 . . . . 60 ASN HA . 6986 1 603 . 1 1 60 60 ASN HB2 H 1 2.70 0.01 . 1 . . . . 60 ASN HB2 . 6986 1 604 . 1 1 60 60 ASN HB3 H 1 2.70 0.01 . 1 . . . . 60 ASN HB3 . 6986 1 605 . 1 1 60 60 ASN C C 13 174.2 1.00 . 1 . . . . 60 ASN C . 6986 1 606 . 1 1 60 60 ASN CA C 13 53.4 0.90 . 1 . . . . 60 ASN CA . 6986 1 607 . 1 1 60 60 ASN CB C 13 35.8 0.90 . 1 . . . . 60 ASN CB . 6986 1 608 . 1 1 60 60 ASN N N 15 124.2 0.20 . 1 . . . . 60 ASN N . 6986 1 609 . 1 1 61 61 GLN H H 1 8.38 0.01 . 1 . . . . 61 GLN HN . 6986 1 610 . 1 1 61 61 GLN HA H 1 4.26 0.01 . 1 . . . . 61 GLN HA . 6986 1 611 . 1 1 61 61 GLN HB2 H 1 2.09 0.01 . 1 . . . . 61 GLN HB2 . 6986 1 612 . 1 1 61 61 GLN HB3 H 1 2.09 0.01 . 1 . . . . 61 GLN HB3 . 6986 1 613 . 1 1 61 61 GLN HG2 H 1 2.31 0.01 . 1 . . . . 61 GLN HG2 . 6986 1 614 . 1 1 61 61 GLN HG3 H 1 2.31 0.01 . 1 . . . . 61 GLN HG3 . 6986 1 615 . 1 1 61 61 GLN HE21 H 1 7.62 0.01 . 2 . . . . 61 GLN HE21 . 6986 1 616 . 1 1 61 61 GLN HE22 H 1 6.79 0.01 . 2 . . . . 61 GLN HE22 . 6986 1 617 . 1 1 61 61 GLN C C 13 172.7 1.00 . 1 . . . . 61 GLN C . 6986 1 618 . 1 1 61 61 GLN CA C 13 53.5 0.90 . 1 . . . . 61 GLN CA . 6986 1 619 . 1 1 61 61 GLN CB C 13 26.6 0.90 . 1 . . . . 61 GLN CB . 6986 1 620 . 1 1 61 61 GLN N N 15 116.2 0.20 . 1 . . . . 61 GLN N . 6986 1 621 . 1 1 61 61 GLN NE2 N 15 112.2 0.20 . 1 . . . . 61 GLN NE2 . 6986 1 622 . 1 1 62 62 ARG H H 1 7.86 0.01 . 1 . . . . 62 ARG HN . 6986 1 623 . 1 1 62 62 ARG HA H 1 4.04 0.01 . 1 . . . . 62 ARG HA . 6986 1 624 . 1 1 62 62 ARG HB2 H 1 1.67 0.01 . 1 . . . . 62 ARG HB2 . 6986 1 625 . 1 1 62 62 ARG HB3 H 1 1.67 0.01 . 1 . . . . 62 ARG HB3 . 6986 1 626 . 1 1 62 62 ARG HG2 H 1 1.48 0.01 . 1 . . . . 62 ARG HG2 . 6986 1 627 . 1 1 62 62 ARG HG3 H 1 1.48 0.01 . 1 . . . . 62 ARG HG3 . 6986 1 628 . 1 1 62 62 ARG HD2 H 1 2.95 0.01 . 2 . . . . 62 ARG HD2 . 6986 1 629 . 1 1 62 62 ARG C C 13 173.3 1.00 . 1 . . . . 62 ARG C . 6986 1 630 . 1 1 62 62 ARG CA C 13 53.5 0.90 . 1 . . . . 62 ARG CA . 6986 1 631 . 1 1 62 62 ARG CB C 13 24.6 0.90 . 1 . . . . 62 ARG CB . 6986 1 632 . 1 1 62 62 ARG N N 15 117.7 0.20 . 1 . . . . 62 ARG N . 6986 1 633 . 1 1 63 63 LYS H H 1 8.03 0.01 . 1 . . . . 63 LYS HN . 6986 1 634 . 1 1 63 63 LYS HA H 1 3.99 0.01 . 1 . . . . 63 LYS HA . 6986 1 635 . 1 1 63 63 LYS HB2 H 1 1.72 0.01 . 1 . . . . 63 LYS HB2 . 6986 1 636 . 1 1 63 63 LYS HB3 H 1 1.72 0.01 . 1 . . . . 63 LYS HB3 . 6986 1 637 . 1 1 63 63 LYS HG2 H 1 1.36 0.01 . 1 . . . . 63 LYS HG2 . 6986 1 638 . 1 1 63 63 LYS HG3 H 1 1.36 0.01 . 1 . . . . 63 LYS HG3 . 6986 1 639 . 1 1 63 63 LYS CA C 13 56.4 0.90 . 1 . . . . 63 LYS CA . 6986 1 640 . 1 1 63 63 LYS CB C 13 30.1 0.90 . 1 . . . . 63 LYS CB . 6986 1 641 . 1 1 63 63 LYS N N 15 119.9 0.20 . 1 . . . . 63 LYS N . 6986 1 642 . 1 1 66 66 PHE HB2 H 1 3.08 0.01 . 1 . . . . 66 PHE HB2 . 6986 1 643 . 1 1 66 66 PHE HB3 H 1 3.08 0.01 . 1 . . . . 66 PHE HB3 . 6986 1 644 . 1 1 66 66 PHE C C 13 176.1 1.00 . 1 . . . . 66 PHE C . 6986 1 645 . 1 1 67 67 ARG H H 1 7.76 0.01 . 1 . . . . 67 ARG HN . 6986 1 646 . 1 1 67 67 ARG HA H 1 5.45 0.01 . 1 . . . . 67 ARG HA . 6986 1 647 . 1 1 67 67 ARG C C 13 173.0 1.00 . 1 . . . . 67 ARG C . 6986 1 648 . 1 1 67 67 ARG CA C 13 51.9 0.90 . 1 . . . . 67 ARG CA . 6986 1 649 . 1 1 67 67 ARG CB C 13 30.9 0.90 . 1 . . . . 67 ARG CB . 6986 1 650 . 1 1 67 67 ARG N N 15 118.6 0.20 . 1 . . . . 67 ARG N . 6986 1 651 . 1 1 68 68 ARG H H 1 8.86 0.01 . 1 . . . . 68 ARG HN . 6986 1 652 . 1 1 68 68 ARG HA H 1 4.28 0.01 . 1 . . . . 68 ARG HA . 6986 1 653 . 1 1 68 68 ARG HB2 H 1 1.87 0.01 . 1 . . . . 68 ARG HB2 . 6986 1 654 . 1 1 68 68 ARG HB3 H 1 1.87 0.01 . 1 . . . . 68 ARG HB3 . 6986 1 655 . 1 1 68 68 ARG C C 13 170.5 1.00 . 1 . . . . 68 ARG C . 6986 1 656 . 1 1 68 68 ARG CA C 13 52.2 0.90 . 1 . . . . 68 ARG CA . 6986 1 657 . 1 1 68 68 ARG CB C 13 32.2 0.90 . 1 . . . . 68 ARG CB . 6986 1 658 . 1 1 68 68 ARG N N 15 124.6 0.20 . 1 . . . . 68 ARG N . 6986 1 659 . 1 1 69 69 HIS H H 1 8.22 0.01 . 1 . . . . 69 HIS HN . 6986 1 660 . 1 1 69 69 HIS HA H 1 5.16 0.01 . 1 . . . . 69 HIS HA . 6986 1 661 . 1 1 69 69 HIS HB2 H 1 2.69 0.01 . 2 . . . . 69 HIS HB2 . 6986 1 662 . 1 1 69 69 HIS HB3 H 1 2.57 0.01 . 2 . . . . 69 HIS HB3 . 6986 1 663 . 1 1 69 69 HIS HD2 H 1 6.59 0.01 . 1 . . . . 69 HIS HD2 . 6986 1 664 . 1 1 69 69 HIS C C 13 170.3 1.00 . 1 . . . . 69 HIS C . 6986 1 665 . 1 1 69 69 HIS CA C 13 52.4 0.90 . 1 . . . . 69 HIS CA . 6986 1 666 . 1 1 69 69 HIS CB C 13 30.5 0.90 . 1 . . . . 69 HIS CB . 6986 1 667 . 1 1 69 69 HIS N N 15 121.7 0.20 . 1 . . . . 69 HIS N . 6986 1 668 . 1 1 70 70 TYR H H 1 8.52 0.01 . 1 . . . . 70 TYR HN . 6986 1 669 . 1 1 70 70 TYR HA H 1 4.41 0.01 . 1 . . . . 70 TYR HA . 6986 1 670 . 1 1 70 70 TYR HB2 H 1 2.40 0.01 . 1 . . . . 70 TYR HB2 . 6986 1 671 . 1 1 70 70 TYR HB3 H 1 2.40 0.01 . 1 . . . . 70 TYR HB3 . 6986 1 672 . 1 1 70 70 TYR HD1 H 1 6.87 0.01 . 1 . . . . 70 TYR HD1 . 6986 1 673 . 1 1 70 70 TYR HD2 H 1 6.87 0.01 . 1 . . . . 70 TYR HD2 . 6986 1 674 . 1 1 70 70 TYR HE1 H 1 6.30 0.01 . 1 . . . . 70 TYR HE1 . 6986 1 675 . 1 1 70 70 TYR HE2 H 1 6.30 0.01 . 1 . . . . 70 TYR HE2 . 6986 1 676 . 1 1 70 70 TYR CA C 13 51.3 0.90 . 1 . . . . 70 TYR CA . 6986 1 677 . 1 1 70 70 TYR CB C 13 35.9 0.90 . 1 . . . . 70 TYR CB . 6986 1 678 . 1 1 70 70 TYR N N 15 126.1 0.20 . 1 . . . . 70 TYR N . 6986 1 679 . 1 1 71 71 PRO HA H 1 4.48 0.01 . 1 . . . . 71 PRO HA . 6986 1 680 . 1 1 71 71 PRO HB2 H 1 2.15 0.01 . 1 . . . . 71 PRO HB2 . 6986 1 681 . 1 1 71 71 PRO HB3 H 1 2.15 0.01 . 1 . . . . 71 PRO HB3 . 6986 1 682 . 1 1 71 71 PRO HG2 H 1 1.96 0.01 . 1 . . . . 71 PRO HG2 . 6986 1 683 . 1 1 71 71 PRO HG3 H 1 1.96 0.01 . 1 . . . . 71 PRO HG3 . 6986 1 684 . 1 1 71 71 PRO HD2 H 1 3.56 0.01 . 1 . . . . 71 PRO HD2 . 6986 1 685 . 1 1 71 71 PRO HD3 H 1 3.56 0.01 . 1 . . . . 71 PRO HD3 . 6986 1 686 . 1 1 71 71 PRO C C 13 176.6 1.00 . 1 . . . . 71 PRO C . 6986 1 687 . 1 1 71 71 PRO CA C 13 60.6 0.90 . 1 . . . . 71 PRO CA . 6986 1 688 . 1 1 71 71 PRO CB C 13 29.6 0.90 . 1 . . . . 71 PRO CB . 6986 1 689 . 1 1 72 72 LEU H H 1 8.37 0.01 . 1 . . . . 72 LEU HN . 6986 1 690 . 1 1 72 72 LEU HA H 1 4.67 0.01 . 1 . . . . 72 LEU HA . 6986 1 691 . 1 1 72 72 LEU HB2 H 1 1.68 0.01 . 1 . . . . 72 LEU HB2 . 6986 1 692 . 1 1 72 72 LEU HB3 H 1 1.68 0.01 . 1 . . . . 72 LEU HB3 . 6986 1 693 . 1 1 72 72 LEU HG H 1 1.65 0.01 . 1 . . . . 72 LEU HG . 6986 1 694 . 1 1 72 72 LEU HD11 H 1 0.72 0.01 . 2 . . . . 72 LEU HD1 . 6986 1 695 . 1 1 72 72 LEU HD12 H 1 0.72 0.01 . 2 . . . . 72 LEU HD1 . 6986 1 696 . 1 1 72 72 LEU HD13 H 1 0.72 0.01 . 2 . . . . 72 LEU HD1 . 6986 1 697 . 1 1 72 72 LEU HD21 H 1 1.13 0.01 . 2 . . . . 72 LEU HD2 . 6986 1 698 . 1 1 72 72 LEU HD22 H 1 1.13 0.01 . 2 . . . . 72 LEU HD2 . 6986 1 699 . 1 1 72 72 LEU HD23 H 1 1.13 0.01 . 2 . . . . 72 LEU HD2 . 6986 1 700 . 1 1 72 72 LEU C C 13 175.2 1.00 . 1 . . . . 72 LEU C . 6986 1 701 . 1 1 72 72 LEU CA C 13 55.6 0.90 . 1 . . . . 72 LEU CA . 6986 1 702 . 1 1 72 72 LEU CB C 13 38.6 0.90 . 1 . . . . 72 LEU CB . 6986 1 703 . 1 1 72 72 LEU N N 15 127.0 0.20 . 1 . . . . 72 LEU N . 6986 1 704 . 1 1 73 73 ASN H H 1 8.53 0.01 . 1 . . . . 73 ASN HN . 6986 1 705 . 1 1 73 73 ASN HA H 1 4.69 0.01 . 1 . . . . 73 ASN HA . 6986 1 706 . 1 1 73 73 ASN HB2 H 1 2.75 0.01 . 2 . . . . 73 ASN HB2 . 6986 1 707 . 1 1 73 73 ASN HB3 H 1 2.97 0.01 . 2 . . . . 73 ASN HB3 . 6986 1 708 . 1 1 73 73 ASN HD21 H 1 7.52 0.01 . 2 . . . . 73 ASN HD21 . 6986 1 709 . 1 1 73 73 ASN HD22 H 1 6.63 0.01 . 2 . . . . 73 ASN HD22 . 6986 1 710 . 1 1 73 73 ASN C C 13 173.4 1.00 . 1 . . . . 73 ASN C . 6986 1 711 . 1 1 73 73 ASN CA C 13 52.4 0.90 . 1 . . . . 73 ASN CA . 6986 1 712 . 1 1 73 73 ASN CB C 13 34.2 0.90 . 1 . . . . 73 ASN CB . 6986 1 713 . 1 1 73 73 ASN N N 15 112.8 0.20 . 1 . . . . 73 ASN N . 6986 1 714 . 1 1 73 73 ASN ND2 N 15 111.0 0.20 . 1 . . . . 73 ASN ND2 . 6986 1 715 . 1 1 74 74 THR H H 1 8.14 0.01 . 1 . . . . 74 THR HN . 6986 1 716 . 1 1 74 74 THR HA H 1 4.49 0.01 . 1 . . . . 74 THR HA . 6986 1 717 . 1 1 74 74 THR HB H 1 3.73 0.01 . 1 . . . . 74 THR HB . 6986 1 718 . 1 1 74 74 THR HG21 H 1 1.25 0.01 . 1 . . . . 74 THR HG2 . 6986 1 719 . 1 1 74 74 THR HG22 H 1 1.25 0.01 . 1 . . . . 74 THR HG2 . 6986 1 720 . 1 1 74 74 THR HG23 H 1 1.25 0.01 . 1 . . . . 74 THR HG2 . 6986 1 721 . 1 1 74 74 THR C C 13 171.1 1.00 . 1 . . . . 74 THR C . 6986 1 722 . 1 1 74 74 THR CA C 13 59.2 0.90 . 1 . . . . 74 THR CA . 6986 1 723 . 1 1 74 74 THR CB C 13 68.2 0.90 . 1 . . . . 74 THR CB . 6986 1 724 . 1 1 74 74 THR N N 15 109.1 0.20 . 1 . . . . 74 THR N . 6986 1 725 . 1 1 75 75 VAL H H 1 7.63 0.01 . 1 . . . . 75 VAL HN . 6986 1 726 . 1 1 75 75 VAL HA H 1 4.48 0.01 . 1 . . . . 75 VAL HA . 6986 1 727 . 1 1 75 75 VAL HB H 1 2.19 0.01 . 1 . . . . 75 VAL HB . 6986 1 728 . 1 1 75 75 VAL HG11 H 1 0.72 0.01 . 2 . . . . 75 VAL HG1 . 6986 1 729 . 1 1 75 75 VAL HG12 H 1 0.72 0.01 . 2 . . . . 75 VAL HG1 . 6986 1 730 . 1 1 75 75 VAL HG13 H 1 0.72 0.01 . 2 . . . . 75 VAL HG1 . 6986 1 731 . 1 1 75 75 VAL HG21 H 1 0.72 0.01 . 2 . . . . 75 VAL HG2 . 6986 1 732 . 1 1 75 75 VAL HG22 H 1 0.72 0.01 . 2 . . . . 75 VAL HG2 . 6986 1 733 . 1 1 75 75 VAL HG23 H 1 0.72 0.01 . 2 . . . . 75 VAL HG2 . 6986 1 734 . 1 1 75 75 VAL C C 13 173.3 1.00 . 1 . . . . 75 VAL C . 6986 1 735 . 1 1 75 75 VAL CA C 13 60.0 0.90 . 1 . . . . 75 VAL CA . 6986 1 736 . 1 1 75 75 VAL CB C 13 29.2 0.90 . 1 . . . . 75 VAL CB . 6986 1 737 . 1 1 75 75 VAL N N 15 125.3 0.20 . 1 . . . . 75 VAL N . 6986 1 738 . 1 1 76 76 THR H H 1 8.69 0.01 . 1 . . . . 76 THR HN . 6986 1 739 . 1 1 76 76 THR HA H 1 4.53 0.01 . 1 . . . . 76 THR HA . 6986 1 740 . 1 1 76 76 THR HB H 1 4.23 0.01 . 1 . . . . 76 THR HB . 6986 1 741 . 1 1 76 76 THR HG21 H 1 1.09 0.01 . 1 . . . . 76 THR HG2 . 6986 1 742 . 1 1 76 76 THR HG22 H 1 1.09 0.01 . 1 . . . . 76 THR HG2 . 6986 1 743 . 1 1 76 76 THR HG23 H 1 1.09 0.01 . 1 . . . . 76 THR HG2 . 6986 1 744 . 1 1 76 76 THR C C 13 173.3 1.00 . 1 . . . . 76 THR C . 6986 1 745 . 1 1 76 76 THR CA C 13 59.0 0.90 . 1 . . . . 76 THR CA . 6986 1 746 . 1 1 76 76 THR CB C 13 67.4 0.90 . 1 . . . . 76 THR CB . 6986 1 747 . 1 1 76 76 THR N N 15 114.6 0.20 . 1 . . . . 76 THR N . 6986 1 748 . 1 1 77 77 PHE H H 1 7.41 0.01 . 1 . . . . 77 PHE HN . 6986 1 749 . 1 1 77 77 PHE HA H 1 4.54 0.01 . 1 . . . . 77 PHE HA . 6986 1 750 . 1 1 77 77 PHE HB2 H 1 2.66 0.01 . 1 . . . . 77 PHE HB2 . 6986 1 751 . 1 1 77 77 PHE HB3 H 1 2.66 0.01 . 1 . . . . 77 PHE HB3 . 6986 1 752 . 1 1 77 77 PHE HD1 H 1 7.09 0.01 . 1 . . . . 77 PHE HD1 . 6986 1 753 . 1 1 77 77 PHE HD2 H 1 7.09 0.01 . 1 . . . . 77 PHE HD2 . 6986 1 754 . 1 1 77 77 PHE HE1 H 1 7.30 0.01 . 1 . . . . 77 PHE HE1 . 6986 1 755 . 1 1 77 77 PHE HE2 H 1 7.30 0.01 . 1 . . . . 77 PHE HE2 . 6986 1 756 . 1 1 77 77 PHE HZ H 1 7.47 0.01 . 1 . . . . 77 PHE HZ . 6986 1 757 . 1 1 77 77 PHE C C 13 170.8 1.00 . 1 . . . . 77 PHE C . 6986 1 758 . 1 1 77 77 PHE CA C 13 56.8 0.90 . 1 . . . . 77 PHE CA . 6986 1 759 . 1 1 77 77 PHE CB C 13 40.6 0.90 . 1 . . . . 77 PHE CB . 6986 1 760 . 1 1 77 77 PHE N N 15 120.2 0.20 . 1 . . . . 77 PHE N . 6986 1 761 . 1 1 78 78 CYS H H 1 8.07 0.01 . 1 . . . . 78 CYS HN . 6986 1 762 . 1 1 78 78 CYS HA H 1 5.07 0.01 . 1 . . . . 78 CYS HA . 6986 1 763 . 1 1 78 78 CYS HB2 H 1 2.66 0.01 . 1 . . . . 78 CYS HB2 . 6986 1 764 . 1 1 78 78 CYS HB3 H 1 2.66 0.01 . 1 . . . . 78 CYS HB3 . 6986 1 765 . 1 1 78 78 CYS C C 13 170.0 1.00 . 1 . . . . 78 CYS C . 6986 1 766 . 1 1 78 78 CYS CA C 13 55.1 0.90 . 1 . . . . 78 CYS CA . 6986 1 767 . 1 1 78 78 CYS CB C 13 25.6 0.90 . 1 . . . . 78 CYS CB . 6986 1 768 . 1 1 78 78 CYS N N 15 128.2 0.20 . 1 . . . . 78 CYS N . 6986 1 769 . 1 1 79 79 ASP H H 1 8.49 0.01 . 1 . . . . 79 ASP HN . 6986 1 770 . 1 1 79 79 ASP HA H 1 4.68 0.01 . 1 . . . . 79 ASP HA . 6986 1 771 . 1 1 79 79 ASP HB2 H 1 2.74 0.01 . 1 . . . . 79 ASP HB2 . 6986 1 772 . 1 1 79 79 ASP HB3 H 1 2.74 0.01 . 1 . . . . 79 ASP HB3 . 6986 1 773 . 1 1 79 79 ASP C C 13 173.0 1.00 . 1 . . . . 79 ASP C . 6986 1 774 . 1 1 79 79 ASP CA C 13 50.7 0.90 . 1 . . . . 79 ASP CA . 6986 1 775 . 1 1 79 79 ASP CB C 13 42.2 0.90 . 1 . . . . 79 ASP CB . 6986 1 776 . 1 1 79 79 ASP N N 15 124.2 0.20 . 1 . . . . 79 ASP N . 6986 1 777 . 1 1 80 80 LEU H H 1 9.65 0.01 . 1 . . . . 80 LEU HN . 6986 1 778 . 1 1 80 80 LEU HA H 1 4.37 0.01 . 1 . . . . 80 LEU HA . 6986 1 779 . 1 1 80 80 LEU HB2 H 1 1.70 0.01 . 1 . . . . 80 LEU HB2 . 6986 1 780 . 1 1 80 80 LEU HB3 H 1 1.70 0.01 . 1 . . . . 80 LEU HB3 . 6986 1 781 . 1 1 80 80 LEU HG H 1 1.52 0.01 . 1 . . . . 80 LEU HG . 6986 1 782 . 1 1 80 80 LEU HD11 H 1 0.79 0.01 . 2 . . . . 80 LEU HD1 . 6986 1 783 . 1 1 80 80 LEU HD12 H 1 0.79 0.01 . 2 . . . . 80 LEU HD1 . 6986 1 784 . 1 1 80 80 LEU HD13 H 1 0.79 0.01 . 2 . . . . 80 LEU HD1 . 6986 1 785 . 1 1 80 80 LEU HD21 H 1 0.62 0.01 . 2 . . . . 80 LEU HD2 . 6986 1 786 . 1 1 80 80 LEU HD22 H 1 0.62 0.01 . 2 . . . . 80 LEU HD2 . 6986 1 787 . 1 1 80 80 LEU HD23 H 1 0.62 0.01 . 2 . . . . 80 LEU HD2 . 6986 1 788 . 1 1 80 80 LEU C C 13 174.2 1.00 . 1 . . . . 80 LEU C . 6986 1 789 . 1 1 80 80 LEU CA C 13 52.4 0.90 . 1 . . . . 80 LEU CA . 6986 1 790 . 1 1 80 80 LEU CB C 13 40.9 0.90 . 1 . . . . 80 LEU CB . 6986 1 791 . 1 1 80 80 LEU N N 15 119.2 0.20 . 1 . . . . 80 LEU N . 6986 1 792 . 1 1 81 81 ASP H H 1 7.21 0.01 . 1 . . . . 81 ASP HN . 6986 1 793 . 1 1 81 81 ASP HA H 1 4.97 0.01 . 1 . . . . 81 ASP HA . 6986 1 794 . 1 1 81 81 ASP HB2 H 1 2.80 0.01 . 1 . . . . 81 ASP HB2 . 6986 1 795 . 1 1 81 81 ASP HB3 H 1 2.80 0.01 . 1 . . . . 81 ASP HB3 . 6986 1 796 . 1 1 81 81 ASP CA C 13 49.7 0.90 . 1 . . . . 81 ASP CA . 6986 1 797 . 1 1 81 81 ASP CB C 13 40.5 0.90 . 1 . . . . 81 ASP CB . 6986 1 798 . 1 1 81 81 ASP N N 15 118.0 0.20 . 1 . . . . 81 ASP N . 6986 1 799 . 1 1 82 82 PRO C C 13 174.9 1.00 . 1 . . . . 82 PRO C . 6986 1 800 . 1 1 82 82 PRO CA C 13 62.2 0.90 . 1 . . . . 82 PRO CA . 6986 1 801 . 1 1 82 82 PRO CB C 13 29.6 0.90 . 1 . . . . 82 PRO CB . 6986 1 802 . 1 1 83 83 GLN H H 1 7.19 0.01 . 1 . . . . 83 GLN HN . 6986 1 803 . 1 1 83 83 GLN HA H 1 4.33 0.01 . 1 . . . . 83 GLN HA . 6986 1 804 . 1 1 83 83 GLN HB2 H 1 1.84 0.01 . 1 . . . . 83 GLN HB2 . 6986 1 805 . 1 1 83 83 GLN HB3 H 1 1.84 0.01 . 1 . . . . 83 GLN HB3 . 6986 1 806 . 1 1 83 83 GLN HG2 H 1 2.25 0.01 . 1 . . . . 83 GLN HG2 . 6986 1 807 . 1 1 83 83 GLN HG3 H 1 2.25 0.01 . 1 . . . . 83 GLN HG3 . 6986 1 808 . 1 1 83 83 GLN HE21 H 1 7.30 0.01 . 2 . . . . 83 GLN HE21 . 6986 1 809 . 1 1 83 83 GLN HE22 H 1 6.66 0.01 . 2 . . . . 83 GLN HE22 . 6986 1 810 . 1 1 83 83 GLN C C 13 172.3 1.00 . 1 . . . . 83 GLN C . 6986 1 811 . 1 1 83 83 GLN CA C 13 52.8 0.90 . 1 . . . . 83 GLN CA . 6986 1 812 . 1 1 83 83 GLN CB C 13 25.9 0.90 . 1 . . . . 83 GLN CB . 6986 1 813 . 1 1 83 83 GLN N N 15 113.4 0.20 . 1 . . . . 83 GLN N . 6986 1 814 . 1 1 83 83 GLN NE2 N 15 111.0 0.20 . 1 . . . . 83 GLN NE2 . 6986 1 815 . 1 1 84 84 GLU H H 1 8.01 0.01 . 1 . . . . 84 GLU HN . 6986 1 816 . 1 1 84 84 GLU HA H 1 4.17 0.01 . 1 . . . . 84 GLU HA . 6986 1 817 . 1 1 84 84 GLU HB2 H 1 2.08 0.01 . 1 . . . . 84 GLU HB2 . 6986 1 818 . 1 1 84 84 GLU HB3 H 1 2.08 0.01 . 1 . . . . 84 GLU HB3 . 6986 1 819 . 1 1 84 84 GLU HG2 H 1 2.36 0.01 . 1 . . . . 84 GLU HG2 . 6986 1 820 . 1 1 84 84 GLU HG3 H 1 2.36 0.01 . 1 . . . . 84 GLU HG3 . 6986 1 821 . 1 1 84 84 GLU C C 13 173.2 1.00 . 1 . . . . 84 GLU C . 6986 1 822 . 1 1 84 84 GLU CA C 13 54.8 0.90 . 1 . . . . 84 GLU CA . 6986 1 823 . 1 1 84 84 GLU CB C 13 24.7 0.90 . 1 . . . . 84 GLU CB . 6986 1 824 . 1 1 84 84 GLU N N 15 115.1 0.20 . 1 . . . . 84 GLU N . 6986 1 825 . 1 1 85 85 ARG H H 1 9.08 0.01 . 1 . . . . 85 ARG HN . 6986 1 826 . 1 1 85 85 ARG HA H 1 4.22 0.01 . 1 . . . . 85 ARG HA . 6986 1 827 . 1 1 85 85 ARG HB2 H 1 1.89 0.01 . 2 . . . . 85 ARG HB2 . 6986 1 828 . 1 1 85 85 ARG HB3 H 1 1.74 0.01 . 2 . . . . 85 ARG HB3 . 6986 1 829 . 1 1 85 85 ARG HG2 H 1 1.42 0.01 . 1 . . . . 85 ARG HG2 . 6986 1 830 . 1 1 85 85 ARG HG3 H 1 1.42 0.01 . 1 . . . . 85 ARG HG3 . 6986 1 831 . 1 1 85 85 ARG HD2 H 1 3.11 0.01 . 1 . . . . 85 ARG HD2 . 6986 1 832 . 1 1 85 85 ARG HD3 H 1 3.11 0.01 . 1 . . . . 85 ARG HD3 . 6986 1 833 . 1 1 85 85 ARG C C 13 173.7 1.00 . 1 . . . . 85 ARG C . 6986 1 834 . 1 1 85 85 ARG CA C 13 54.5 0.90 . 1 . . . . 85 ARG CA . 6986 1 835 . 1 1 85 85 ARG CB C 13 27.8 0.90 . 1 . . . . 85 ARG CB . 6986 1 836 . 1 1 85 85 ARG N N 15 118.4 0.20 . 1 . . . . 85 ARG N . 6986 1 837 . 1 1 86 86 LYS H H 1 8.29 0.01 . 1 . . . . 86 LYS HN . 6986 1 838 . 1 1 86 86 LYS HA H 1 4.90 0.01 . 1 . . . . 86 LYS HA . 6986 1 839 . 1 1 86 86 LYS HB2 H 1 1.86 0.01 . 1 . . . . 86 LYS HB2 . 6986 1 840 . 1 1 86 86 LYS HB3 H 1 1.86 0.01 . 1 . . . . 86 LYS HB3 . 6986 1 841 . 1 1 86 86 LYS HG2 H 1 1.53 0.01 . 1 . . . . 86 LYS HG2 . 6986 1 842 . 1 1 86 86 LYS HG3 H 1 1.53 0.01 . 1 . . . . 86 LYS HG3 . 6986 1 843 . 1 1 86 86 LYS HD2 H 1 1.59 0.01 . 1 . . . . 86 LYS HD2 . 6986 1 844 . 1 1 86 86 LYS HD3 H 1 1.59 0.01 . 1 . . . . 86 LYS HD3 . 6986 1 845 . 1 1 86 86 LYS HE2 H 1 3.12 0.01 . 1 . . . . 86 LYS HE . 6986 1 846 . 1 1 86 86 LYS HE3 H 1 3.12 0.01 . 1 . . . . 86 LYS HE . 6986 1 847 . 1 1 86 86 LYS C C 13 172.5 1.00 . 1 . . . . 86 LYS C . 6986 1 848 . 1 1 86 86 LYS CA C 13 51.9 0.90 . 1 . . . . 86 LYS CA . 6986 1 849 . 1 1 86 86 LYS CB C 13 33.2 0.90 . 1 . . . . 86 LYS CB . 6986 1 850 . 1 1 86 86 LYS N N 15 117.3 0.20 . 1 . . . . 86 LYS N . 6986 1 851 . 1 1 87 87 TRP H H 1 9.49 0.01 . 1 . . . . 87 TRP HN . 6986 1 852 . 1 1 87 87 TRP HA H 1 4.68 0.01 . 1 . . . . 87 TRP HA . 6986 1 853 . 1 1 87 87 TRP HB2 H 1 3.01 0.01 . 2 . . . . 87 TRP HB2 . 6986 1 854 . 1 1 87 87 TRP HB3 H 1 2.97 0.01 . 2 . . . . 87 TRP HB3 . 6986 1 855 . 1 1 87 87 TRP HD1 H 1 6.63 0.01 . 1 . . . . 87 TRP HD1 . 6986 1 856 . 1 1 87 87 TRP HE1 H 1 10.25 0.01 . 1 . . . . 87 TRP HE1 . 6986 1 857 . 1 1 87 87 TRP HZ2 H 1 7.38 0.01 . 1 . . . . 87 TRP HZ2 . 6986 1 858 . 1 1 87 87 TRP CA C 13 52.7 0.90 . 1 . . . . 87 TRP CA . 6986 1 859 . 1 1 87 87 TRP CB C 13 29.3 0.90 . 1 . . . . 87 TRP CB . 6986 1 860 . 1 1 87 87 TRP N N 15 122.7 0.20 . 1 . . . . 87 TRP N . 6986 1 861 . 1 1 87 87 TRP NE1 N 15 129.6 0.20 . 1 . . . . 87 TRP NE1 . 6986 1 862 . 1 1 88 88 THR C C 13 173.6 1.00 . 1 . . . . 88 THR C . 6986 1 863 . 1 1 89 89 LYS H H 1 7.73 0.01 . 1 . . . . 89 LYS HN . 6986 1 864 . 1 1 89 89 LYS HA H 1 3.89 0.01 . 1 . . . . 89 LYS HA . 6986 1 865 . 1 1 89 89 LYS HB2 H 1 1.72 0.01 . 1 . . . . 89 LYS HB2 . 6986 1 866 . 1 1 89 89 LYS HB3 H 1 1.72 0.01 . 1 . . . . 89 LYS HB3 . 6986 1 867 . 1 1 89 89 LYS HG2 H 1 1.47 0.01 . 1 . . . . 89 LYS HG2 . 6986 1 868 . 1 1 89 89 LYS HG3 H 1 1.47 0.01 . 1 . . . . 89 LYS HG3 . 6986 1 869 . 1 1 89 89 LYS HE2 H 1 2.99 0.01 . 1 . . . . 89 LYS HE . 6986 1 870 . 1 1 89 89 LYS HE3 H 1 2.99 0.01 . 1 . . . . 89 LYS HE . 6986 1 871 . 1 1 89 89 LYS CA C 13 56.4 0.90 . 1 . . . . 89 LYS CA . 6986 1 872 . 1 1 89 89 LYS CB C 13 27.3 0.90 . 1 . . . . 89 LYS CB . 6986 1 873 . 1 1 89 89 LYS N N 15 120.1 0.20 . 1 . . . . 89 LYS N . 6986 1 874 . 1 1 90 90 THR HA H 1 4.48 0.01 . 1 . . . . 90 THR HA . 6986 1 875 . 1 1 90 90 THR HB H 1 4.16 0.01 . 1 . . . . 90 THR HB . 6986 1 876 . 1 1 90 90 THR C C 13 171.9 1.00 . 1 . . . . 90 THR C . 6986 1 877 . 1 1 91 91 ASP H H 1 8.08 0.01 . 1 . . . . 91 ASP HN . 6986 1 878 . 1 1 91 91 ASP HA H 1 4.70 0.01 . 1 . . . . 91 ASP HA . 6986 1 879 . 1 1 91 91 ASP HB2 H 1 2.62 0.01 . 1 . . . . 91 ASP HB2 . 6986 1 880 . 1 1 91 91 ASP HB3 H 1 2.62 0.01 . 1 . . . . 91 ASP HB3 . 6986 1 881 . 1 1 91 91 ASP C C 13 174.6 1.00 . 1 . . . . 91 ASP C . 6986 1 882 . 1 1 91 91 ASP CA C 13 51.4 0.90 . 1 . . . . 91 ASP CA . 6986 1 883 . 1 1 91 91 ASP CB C 13 37.9 0.90 . 1 . . . . 91 ASP CB . 6986 1 884 . 1 1 91 91 ASP N N 15 121.7 0.20 . 1 . . . . 91 ASP N . 6986 1 885 . 1 1 92 92 GLY H H 1 8.05 0.01 . 1 . . . . 92 GLY HN . 6986 1 886 . 1 1 92 92 GLY HA2 H 1 3.75 0.01 . 1 . . . . 92 GLY HA1 . 6986 1 887 . 1 1 92 92 GLY HA3 H 1 3.75 0.01 . 1 . . . . 92 GLY HA2 . 6986 1 888 . 1 1 92 92 GLY C C 13 172.4 1.00 . 1 . . . . 92 GLY C . 6986 1 889 . 1 1 92 92 GLY CA C 13 42.9 0.90 . 1 . . . . 92 GLY CA . 6986 1 890 . 1 1 92 92 GLY N N 15 108.6 0.20 . 1 . . . . 92 GLY N . 6986 1 891 . 1 1 93 93 SER H H 1 7.91 0.01 . 1 . . . . 93 SER HN . 6986 1 892 . 1 1 93 93 SER HA H 1 4.36 0.01 . 1 . . . . 93 SER HA . 6986 1 893 . 1 1 93 93 SER HB2 H 1 3.96 0.01 . 1 . . . . 93 SER HB2 . 6986 1 894 . 1 1 93 93 SER HB3 H 1 3.96 0.01 . 1 . . . . 93 SER HB3 . 6986 1 895 . 1 1 93 93 SER C C 13 172.2 1.00 . 1 . . . . 93 SER C . 6986 1 896 . 1 1 93 93 SER CA C 13 56.4 0.90 . 1 . . . . 93 SER CA . 6986 1 897 . 1 1 93 93 SER CB C 13 61.4 0.90 . 1 . . . . 93 SER CB . 6986 1 898 . 1 1 93 93 SER N N 15 114.8 0.20 . 1 . . . . 93 SER N . 6986 1 899 . 1 1 94 94 GLY H H 1 8.48 0.01 . 1 . . . . 94 GLY HN . 6986 1 900 . 1 1 94 94 GLY HA2 H 1 4.67 0.01 . 2 . . . . 94 GLY HA1 . 6986 1 901 . 1 1 94 94 GLY HA3 H 1 4.21 0.01 . 2 . . . . 94 GLY HA2 . 6986 1 902 . 1 1 94 94 GLY CA C 13 42.2 0.90 . 1 . . . . 94 GLY CA . 6986 1 903 . 1 1 94 94 GLY N N 15 111.2 0.20 . 1 . . . . 94 GLY N . 6986 1 904 . 1 1 95 95 PRO HA H 1 4.66 0.01 . 1 . . . . 95 PRO HA . 6986 1 905 . 1 1 95 95 PRO HB2 H 1 2.23 0.01 . 1 . . . . 95 PRO HB2 . 6986 1 906 . 1 1 95 95 PRO HB3 H 1 2.23 0.01 . 1 . . . . 95 PRO HB3 . 6986 1 907 . 1 1 95 95 PRO HG2 H 1 1.99 0.01 . 1 . . . . 95 PRO HG2 . 6986 1 908 . 1 1 95 95 PRO HG3 H 1 1.99 0.01 . 1 . . . . 95 PRO HG3 . 6986 1 909 . 1 1 95 95 PRO HD2 H 1 3.56 0.01 . 1 . . . . 95 PRO HD2 . 6986 1 910 . 1 1 95 95 PRO HD3 H 1 3.56 0.01 . 1 . . . . 95 PRO HD3 . 6986 1 911 . 1 1 95 95 PRO C C 13 174.4 1.00 . 1 . . . . 95 PRO C . 6986 1 912 . 1 1 95 95 PRO CA C 13 60.2 0.90 . 1 . . . . 95 PRO CA . 6986 1 913 . 1 1 95 95 PRO CB C 13 30.0 0.90 . 1 . . . . 95 PRO CB . 6986 1 914 . 1 1 96 96 ALA H H 1 8.81 0.01 . 1 . . . . 96 ALA HN . 6986 1 915 . 1 1 96 96 ALA HA H 1 4.90 0.01 . 1 . . . . 96 ALA HA . 6986 1 916 . 1 1 96 96 ALA HB1 H 1 1.66 0.01 . 1 . . . . 96 ALA HB . 6986 1 917 . 1 1 96 96 ALA HB2 H 1 1.66 0.01 . 1 . . . . 96 ALA HB . 6986 1 918 . 1 1 96 96 ALA HB3 H 1 1.66 0.01 . 1 . . . . 96 ALA HB . 6986 1 919 . 1 1 96 96 ALA C C 13 174.3 1.00 . 1 . . . . 96 ALA C . 6986 1 920 . 1 1 96 96 ALA CA C 13 48.2 0.90 . 1 . . . . 96 ALA CA . 6986 1 921 . 1 1 96 96 ALA CB C 13 20.9 0.90 . 1 . . . . 96 ALA CB . 6986 1 922 . 1 1 96 96 ALA N N 15 126.3 0.20 . 1 . . . . 96 ALA N . 6986 1 923 . 1 1 97 97 LYS H H 1 8.82 0.01 . 1 . . . . 97 LYS HN . 6986 1 924 . 1 1 97 97 LYS HA H 1 4.04 0.01 . 1 . . . . 97 LYS HA . 6986 1 925 . 1 1 97 97 LYS HB2 H 1 1.77 0.01 . 1 . . . . 97 LYS HB2 . 6986 1 926 . 1 1 97 97 LYS HB3 H 1 1.77 0.01 . 1 . . . . 97 LYS HB3 . 6986 1 927 . 1 1 97 97 LYS HG2 H 1 1.40 0.01 . 1 . . . . 97 LYS HG2 . 6986 1 928 . 1 1 97 97 LYS HG3 H 1 1.40 0.01 . 1 . . . . 97 LYS HG3 . 6986 1 929 . 1 1 97 97 LYS HD2 H 1 1.63 0.01 . 1 . . . . 97 LYS HD2 . 6986 1 930 . 1 1 97 97 LYS HD3 H 1 1.63 0.01 . 1 . . . . 97 LYS HD3 . 6986 1 931 . 1 1 97 97 LYS HE2 H 1 2.94 0.01 . 1 . . . . 97 LYS HE2 . 6986 1 932 . 1 1 97 97 LYS HE3 H 1 2.94 0.01 . 1 . . . . 97 LYS HE3 . 6986 1 933 . 1 1 97 97 LYS C C 13 173.4 1.00 . 1 . . . . 97 LYS C . 6986 1 934 . 1 1 97 97 LYS CA C 13 56.6 0.90 . 1 . . . . 97 LYS CA . 6986 1 935 . 1 1 97 97 LYS CB C 13 30.8 0.90 . 1 . . . . 97 LYS CB . 6986 1 936 . 1 1 97 97 LYS N N 15 123.0 0.20 . 1 . . . . 97 LYS N . 6986 1 937 . 1 1 98 98 LEU H H 1 7.49 0.01 . 1 . . . . 98 LEU HN . 6986 1 938 . 1 1 98 98 LEU HA H 1 5.28 0.01 . 1 . . . . 98 LEU HA . 6986 1 939 . 1 1 98 98 LEU HB2 H 1 1.79 0.01 . 1 . . . . 98 LEU HB2 . 6986 1 940 . 1 1 98 98 LEU HB3 H 1 1.79 0.01 . 1 . . . . 98 LEU HB3 . 6986 1 941 . 1 1 98 98 LEU HG H 1 1.62 0.01 . 1 . . . . 98 LEU HG . 6986 1 942 . 1 1 98 98 LEU HD11 H 1 1.18 0.01 . 2 . . . . 98 LEU HD1 . 6986 1 943 . 1 1 98 98 LEU HD12 H 1 1.18 0.01 . 2 . . . . 98 LEU HD1 . 6986 1 944 . 1 1 98 98 LEU HD13 H 1 1.18 0.01 . 2 . . . . 98 LEU HD1 . 6986 1 945 . 1 1 98 98 LEU HD21 H 1 0.76 0.01 . 2 . . . . 98 LEU HD2 . 6986 1 946 . 1 1 98 98 LEU HD22 H 1 0.76 0.01 . 2 . . . . 98 LEU HD2 . 6986 1 947 . 1 1 98 98 LEU HD23 H 1 0.76 0.01 . 2 . . . . 98 LEU HD2 . 6986 1 948 . 1 1 98 98 LEU C C 13 174.7 1.00 . 1 . . . . 98 LEU C . 6986 1 949 . 1 1 98 98 LEU CA C 13 51.6 0.90 . 1 . . . . 98 LEU CA . 6986 1 950 . 1 1 98 98 LEU CB C 13 43.1 0.90 . 1 . . . . 98 LEU CB . 6986 1 951 . 1 1 98 98 LEU N N 15 121.1 0.20 . 1 . . . . 98 LEU N . 6986 1 952 . 1 1 99 99 PHE H H 1 9.15 0.01 . 1 . . . . 99 PHE HN . 6986 1 953 . 1 1 99 99 PHE HA H 1 4.92 0.01 . 1 . . . . 99 PHE HA . 6986 1 954 . 1 1 99 99 PHE HB2 H 1 2.82 0.01 . 1 . . . . 99 PHE HB2 . 6986 1 955 . 1 1 99 99 PHE HB3 H 1 2.82 0.01 . 1 . . . . 99 PHE HB3 . 6986 1 956 . 1 1 99 99 PHE HD1 H 1 7.22 0.01 . 1 . . . . 99 PHE HD1 . 6986 1 957 . 1 1 99 99 PHE HD2 H 1 7.24 0.01 . 1 . . . . 99 PHE HD2 . 6986 1 958 . 1 1 99 99 PHE HE1 H 1 6.40 0.01 . 1 . . . . 99 PHE HE1 . 6986 1 959 . 1 1 99 99 PHE HE2 H 1 6.40 0.01 . 1 . . . . 99 PHE HE2 . 6986 1 960 . 1 1 99 99 PHE HZ H 1 6.16 0.01 . 1 . . . . 99 PHE HZ . 6986 1 961 . 1 1 99 99 PHE C C 13 170.0 1.00 . 1 . . . . 99 PHE C . 6986 1 962 . 1 1 99 99 PHE CA C 13 53.0 0.90 . 1 . . . . 99 PHE CA . 6986 1 963 . 1 1 99 99 PHE CB C 13 40.0 0.90 . 1 . . . . 99 PHE CB . 6986 1 964 . 1 1 99 99 PHE N N 15 117.9 0.20 . 1 . . . . 99 PHE N . 6986 1 965 . 1 1 100 100 GLY H H 1 8.83 0.01 . 1 . . . . 100 GLY HN . 6986 1 966 . 1 1 100 100 GLY HA2 H 1 3.94 0.01 . 2 . . . . 100 GLY HA1 . 6986 1 967 . 1 1 100 100 GLY HA3 H 1 5.11 0.01 . 2 . . . . 100 GLY HA2 . 6986 1 968 . 1 1 100 100 GLY C C 13 169.3 1.00 . 1 . . . . 100 GLY C . 6986 1 969 . 1 1 100 100 GLY CA C 13 43.9 0.90 . 1 . . . . 100 GLY CA . 6986 1 970 . 1 1 100 100 GLY N N 15 104.4 0.20 . 1 . . . . 100 GLY N . 6986 1 971 . 1 1 101 101 PHE HA H 1 5.73 0.01 . 1 . . . . 101 PHE HA . 6986 1 972 . 1 1 101 101 PHE HB2 H 1 3.36 0.01 . 2 . . . . 101 PHE HB2 . 6986 1 973 . 1 1 101 101 PHE HB3 H 1 3.08 0.01 . 2 . . . . 101 PHE HB3 . 6986 1 974 . 1 1 101 101 PHE HD1 H 1 6.92 0.01 . 1 . . . . 101 PHE HD1 . 6986 1 975 . 1 1 101 101 PHE HD2 H 1 6.92 0.01 . 1 . . . . 101 PHE HD2 . 6986 1 976 . 1 1 101 101 PHE HE1 H 1 6.62 0.01 . 1 . . . . 101 PHE HE1 . 6986 1 977 . 1 1 101 101 PHE HE2 H 1 6.62 0.01 . 1 . . . . 101 PHE HE2 . 6986 1 978 . 1 1 101 101 PHE HZ H 1 6.56 0.01 . 1 . . . . 101 PHE HZ . 6986 1 979 . 1 1 101 101 PHE C C 13 171.1 1.00 . 1 . . . . 101 PHE C . 6986 1 980 . 1 1 101 101 PHE CA C 13 53.3 0.90 . 1 . . . . 101 PHE CA . 6986 1 981 . 1 1 101 101 PHE CB C 13 39.8 0.90 . 1 . . . . 101 PHE CB . 6986 1 982 . 1 1 101 101 PHE N N 15 112.4 0.20 . 1 . . . . 101 PHE N . 6986 1 983 . 1 1 102 102 VAL H H 1 9.05 0.01 . 1 . . . . 102 VAL HN . 6986 1 984 . 1 1 102 102 VAL HA H 1 4.67 0.01 . 1 . . . . 102 VAL HA . 6986 1 985 . 1 1 102 102 VAL HB H 1 2.14 0.01 . 1 . . . . 102 VAL HB . 6986 1 986 . 1 1 102 102 VAL HG11 H 1 0.88 0.01 . 2 . . . . 102 VAL HG1 . 6986 1 987 . 1 1 102 102 VAL HG12 H 1 0.88 0.01 . 2 . . . . 102 VAL HG1 . 6986 1 988 . 1 1 102 102 VAL HG13 H 1 0.88 0.01 . 2 . . . . 102 VAL HG1 . 6986 1 989 . 1 1 102 102 VAL HG21 H 1 0.88 0.01 . 2 . . . . 102 VAL HG2 . 6986 1 990 . 1 1 102 102 VAL HG22 H 1 0.88 0.01 . 2 . . . . 102 VAL HG2 . 6986 1 991 . 1 1 102 102 VAL HG23 H 1 0.88 0.01 . 2 . . . . 102 VAL HG2 . 6986 1 992 . 1 1 102 102 VAL C C 13 171.7 1.00 . 1 . . . . 102 VAL C . 6986 1 993 . 1 1 102 102 VAL CA C 13 58.2 0.90 . 1 . . . . 102 VAL CA . 6986 1 994 . 1 1 102 102 VAL CB C 13 30.2 0.90 . 1 . . . . 102 VAL CB . 6986 1 995 . 1 1 102 102 VAL N N 15 122.7 0.20 . 1 . . . . 102 VAL N . 6986 1 996 . 1 1 103 103 ALA H H 1 9.09 0.01 . 1 . . . . 103 ALA HN . 6986 1 997 . 1 1 103 103 ALA HA H 1 5.73 0.01 . 1 . . . . 103 ALA HA . 6986 1 998 . 1 1 103 103 ALA HB1 H 1 1.52 0.01 . 1 . . . . 103 ALA HB . 6986 1 999 . 1 1 103 103 ALA HB2 H 1 1.52 0.01 . 1 . . . . 103 ALA HB . 6986 1 1000 . 1 1 103 103 ALA HB3 H 1 1.52 0.01 . 1 . . . . 103 ALA HB . 6986 1 1001 . 1 1 103 103 ALA C C 13 174.2 1.00 . 1 . . . . 103 ALA C . 6986 1 1002 . 1 1 103 103 ALA CA C 13 50.0 0.90 . 1 . . . . 103 ALA CA . 6986 1 1003 . 1 1 103 103 ALA CB C 13 20.5 0.90 . 1 . . . . 103 ALA CB . 6986 1 1004 . 1 1 103 103 ALA N N 15 128.7 0.20 . 1 . . . . 103 ALA N . 6986 1 1005 . 1 1 104 104 ARG H H 1 8.71 0.01 . 1 . . . . 104 ARG HN . 6986 1 1006 . 1 1 104 104 ARG HA H 1 5.30 0.01 . 1 . . . . 104 ARG HA . 6986 1 1007 . 1 1 104 104 ARG HB2 H 1 1.94 0.01 . 2 . . . . 104 ARG HB2 . 6986 1 1008 . 1 1 104 104 ARG HB3 H 1 1.74 0.01 . 2 . . . . 104 ARG HB3 . 6986 1 1009 . 1 1 104 104 ARG HG2 H 1 1.47 0.01 . 1 . . . . 104 ARG HG2 . 6986 1 1010 . 1 1 104 104 ARG HG3 H 1 1.47 0.01 . 1 . . . . 104 ARG HG3 . 6986 1 1011 . 1 1 104 104 ARG HD2 H 1 3.24 0.01 . 2 . . . . 104 ARG HD2 . 6986 1 1012 . 1 1 104 104 ARG HD3 H 1 2.89 0.01 . 2 . . . . 104 ARG HD3 . 6986 1 1013 . 1 1 104 104 ARG C C 13 174.6 1.00 . 1 . . . . 104 ARG C . 6986 1 1014 . 1 1 104 104 ARG CA C 13 53.2 0.90 . 1 . . . . 104 ARG CA . 6986 1 1015 . 1 1 104 104 ARG CB C 13 28.1 0.90 . 1 . . . . 104 ARG CB . 6986 1 1016 . 1 1 104 104 ARG N N 15 122.0 0.20 . 1 . . . . 104 ARG N . 6986 1 1017 . 1 1 105 105 LYS H H 1 8.78 0.01 . 1 . . . . 105 LYS HN . 6986 1 1018 . 1 1 105 105 LYS HA H 1 4.68 0.01 . 1 . . . . 105 LYS HA . 6986 1 1019 . 1 1 105 105 LYS HB2 H 1 1.95 0.01 . 1 . . . . 105 LYS HB2 . 6986 1 1020 . 1 1 105 105 LYS HB3 H 1 1.95 0.01 . 1 . . . . 105 LYS HB3 . 6986 1 1021 . 1 1 105 105 LYS HG2 H 1 1.37 0.01 . 1 . . . . 105 LYS HG2 . 6986 1 1022 . 1 1 105 105 LYS HG3 H 1 1.37 0.01 . 1 . . . . 105 LYS HG3 . 6986 1 1023 . 1 1 105 105 LYS HD2 H 1 1.67 0.01 . 1 . . . . 105 LYS HD2 . 6986 1 1024 . 1 1 105 105 LYS HD3 H 1 1.67 0.01 . 1 . . . . 105 LYS HD3 . 6986 1 1025 . 1 1 105 105 LYS C C 13 173.6 1.00 . 1 . . . . 105 LYS C . 6986 1 1026 . 1 1 105 105 LYS CA C 13 53.9 0.90 . 1 . . . . 105 LYS CA . 6986 1 1027 . 1 1 105 105 LYS CB C 13 31.0 0.90 . 1 . . . . 105 LYS CB . 6986 1 1028 . 1 1 105 105 LYS N N 15 126.0 0.20 . 1 . . . . 105 LYS N . 6986 1 1029 . 1 1 106 106 GLN H H 1 8.57 0.01 . 1 . . . . 106 GLN HN . 6986 1 1030 . 1 1 106 106 GLN HA H 1 4.12 0.01 . 1 . . . . 106 GLN HA . 6986 1 1031 . 1 1 106 106 GLN HB2 H 1 2.35 0.01 . 1 . . . . 106 GLN HB2 . 6986 1 1032 . 1 1 106 106 GLN HB3 H 1 2.35 0.01 . 1 . . . . 106 GLN HB3 . 6986 1 1033 . 1 1 106 106 GLN HG2 H 1 2.01 0.01 . 1 . . . . 106 GLN HG2 . 6986 1 1034 . 1 1 106 106 GLN HG3 H 1 2.01 0.01 . 1 . . . . 106 GLN HG3 . 6986 1 1035 . 1 1 106 106 GLN HE21 H 1 7.44 0.01 . 2 . . . . 106 GLN HE21 . 6986 1 1036 . 1 1 106 106 GLN HE22 H 1 6.78 0.01 . 2 . . . . 106 GLN HE22 . 6986 1 1037 . 1 1 106 106 GLN CA C 13 55.2 0.90 . 1 . . . . 106 GLN CA . 6986 1 1038 . 1 1 106 106 GLN CB C 13 25.7 0.90 . 1 . . . . 106 GLN CB . 6986 1 1039 . 1 1 106 106 GLN N N 15 125.4 0.20 . 1 . . . . 106 GLN N . 6986 1 1040 . 1 1 106 106 GLN NE2 N 15 111.5 0.20 . 1 . . . . 106 GLN NE2 . 6986 1 1041 . 1 1 107 107 GLY C C 13 174.9 1.00 . 1 . . . . 107 GLY C . 6986 1 1042 . 1 1 108 108 SER H H 1 8.07 0.01 . 1 . . . . 108 SER HN . 6986 1 1043 . 1 1 108 108 SER HA H 1 4.68 0.01 . 1 . . . . 108 SER HA . 6986 1 1044 . 1 1 108 108 SER HB2 H 1 3.89 0.01 . 1 . . . . 108 SER HB2 . 6986 1 1045 . 1 1 108 108 SER HB3 H 1 3.89 0.01 . 1 . . . . 108 SER HB3 . 6986 1 1046 . 1 1 108 108 SER CA C 13 53.9 0.90 . 1 . . . . 108 SER CA . 6986 1 1047 . 1 1 108 108 SER CB C 13 62.4 0.90 . 1 . . . . 108 SER CB . 6986 1 1048 . 1 1 108 108 SER N N 15 114.1 0.20 . 1 . . . . 108 SER N . 6986 1 1049 . 1 1 109 109 THR C C 13 172.4 1.00 . 1 . . . . 109 THR C . 6986 1 1050 . 1 1 110 110 THR H H 1 8.03 0.01 . 1 . . . . 110 THR HN . 6986 1 1051 . 1 1 110 110 THR HA H 1 4.37 0.01 . 1 . . . . 110 THR HA . 6986 1 1052 . 1 1 110 110 THR HB H 1 4.17 0.01 . 1 . . . . 110 THR HB . 6986 1 1053 . 1 1 110 110 THR HG21 H 1 1.03 0.01 . 1 . . . . 110 THR HG2 . 6986 1 1054 . 1 1 110 110 THR HG22 H 1 1.03 0.01 . 1 . . . . 110 THR HG2 . 6986 1 1055 . 1 1 110 110 THR HG23 H 1 1.03 0.01 . 1 . . . . 110 THR HG2 . 6986 1 1056 . 1 1 110 110 THR C C 13 171.1 1.00 . 1 . . . . 110 THR C . 6986 1 1057 . 1 1 110 110 THR CA C 13 59.2 0.90 . 1 . . . . 110 THR CA . 6986 1 1058 . 1 1 110 110 THR CB C 13 68.0 0.90 . 1 . . . . 110 THR CB . 6986 1 1059 . 1 1 110 110 THR N N 15 110.3 0.20 . 1 . . . . 110 THR N . 6986 1 1060 . 1 1 111 111 ASP H H 1 7.89 0.01 . 1 . . . . 111 ASP HN . 6986 1 1061 . 1 1 111 111 ASP HA H 1 4.68 0.01 . 1 . . . . 111 ASP HA . 6986 1 1062 . 1 1 111 111 ASP HB2 H 1 2.62 0.01 . 2 . . . . 111 ASP HB2 . 6986 1 1063 . 1 1 111 111 ASP HB3 H 1 2.38 0.01 . 2 . . . . 111 ASP HB3 . 6986 1 1064 . 1 1 111 111 ASP C C 13 172.1 1.00 . 1 . . . . 111 ASP C . 6986 1 1065 . 1 1 111 111 ASP CA C 13 51.5 0.90 . 1 . . . . 111 ASP CA . 6986 1 1066 . 1 1 111 111 ASP CB C 13 39.4 0.90 . 1 . . . . 111 ASP CB . 6986 1 1067 . 1 1 111 111 ASP N N 15 122.4 0.20 . 1 . . . . 111 ASP N . 6986 1 1068 . 1 1 112 112 ASN H H 1 8.95 0.01 . 1 . . . . 112 ASN HN . 6986 1 1069 . 1 1 112 112 ASN HA H 1 5.31 0.01 . 1 . . . . 112 ASN HA . 6986 1 1070 . 1 1 112 112 ASN HB2 H 1 2.13 0.01 . 2 . . . . 112 ASN HB2 . 6986 1 1071 . 1 1 112 112 ASN HB3 H 1 2.54 0.01 . 2 . . . . 112 ASN HB3 . 6986 1 1072 . 1 1 112 112 ASN HD21 H 1 6.48 0.01 . 2 . . . . 112 ASN HD21 . 6986 1 1073 . 1 1 112 112 ASN HD22 H 1 6.71 0.01 . 2 . . . . 112 ASN HD22 . 6986 1 1074 . 1 1 112 112 ASN C C 13 172.3 1.00 . 1 . . . . 112 ASN C . 6986 1 1075 . 1 1 112 112 ASN CA C 13 49.4 0.90 . 1 . . . . 112 ASN CA . 6986 1 1076 . 1 1 112 112 ASN CB C 13 39.3 0.90 . 1 . . . . 112 ASN CB . 6986 1 1077 . 1 1 112 112 ASN N N 15 118.4 0.20 . 1 . . . . 112 ASN N . 6986 1 1078 . 1 1 112 112 ASN ND2 N 15 111.2 0.20 . 1 . . . . 112 ASN ND2 . 6986 1 1079 . 1 1 113 113 VAL H H 1 9.07 0.01 . 1 . . . . 113 VAL HN . 6986 1 1080 . 1 1 113 113 VAL HA H 1 4.16 0.01 . 1 . . . . 113 VAL HA . 6986 1 1081 . 1 1 113 113 VAL HB H 1 1.57 0.01 . 1 . . . . 113 VAL HB . 6986 1 1082 . 1 1 113 113 VAL HG11 H 1 0.74 0.01 . 2 . . . . 113 VAL HG1 . 6986 1 1083 . 1 1 113 113 VAL HG12 H 1 0.74 0.01 . 2 . . . . 113 VAL HG1 . 6986 1 1084 . 1 1 113 113 VAL HG13 H 1 0.74 0.01 . 2 . . . . 113 VAL HG1 . 6986 1 1085 . 1 1 113 113 VAL HG21 H 1 0.20 0.01 . 2 . . . . 113 VAL HG2 . 6986 1 1086 . 1 1 113 113 VAL HG22 H 1 0.20 0.01 . 2 . . . . 113 VAL HG2 . 6986 1 1087 . 1 1 113 113 VAL HG23 H 1 0.20 0.01 . 2 . . . . 113 VAL HG2 . 6986 1 1088 . 1 1 113 113 VAL C C 13 170.6 1.00 . 1 . . . . 113 VAL C . 6986 1 1089 . 1 1 113 113 VAL CA C 13 58.3 0.90 . 1 . . . . 113 VAL CA . 6986 1 1090 . 1 1 113 113 VAL CB C 13 32.6 0.90 . 1 . . . . 113 VAL CB . 6986 1 1091 . 1 1 113 113 VAL N N 15 121.3 0.20 . 1 . . . . 113 VAL N . 6986 1 1092 . 1 1 114 114 CYS H H 1 8.68 0.01 . 1 . . . . 114 CYS HN . 6986 1 1093 . 1 1 114 114 CYS HA H 1 4.80 0.01 . 1 . . . . 114 CYS HA . 6986 1 1094 . 1 1 114 114 CYS HB2 H 1 2.37 0.01 . 2 . . . . 114 CYS HB2 . 6986 1 1095 . 1 1 114 114 CYS HB3 H 1 2.16 0.01 . 2 . . . . 114 CYS HB3 . 6986 1 1096 . 1 1 114 114 CYS C C 13 169.3 1.00 . 1 . . . . 114 CYS C . 6986 1 1097 . 1 1 114 114 CYS CA C 13 53.4 0.90 . 1 . . . . 114 CYS CA . 6986 1 1098 . 1 1 114 114 CYS CB C 13 26.4 0.90 . 1 . . . . 114 CYS CB . 6986 1 1099 . 1 1 114 114 CYS N N 15 124.9 0.20 . 1 . . . . 114 CYS N . 6986 1 1100 . 1 1 115 115 HIS H H 1 8.58 0.01 . 1 . . . . 115 HIS HN . 6986 1 1101 . 1 1 115 115 HIS HA H 1 4.59 0.01 . 1 . . . . 115 HIS HA . 6986 1 1102 . 1 1 115 115 HIS HB2 H 1 2.85 0.01 . 1 . . . . 115 HIS HB2 . 6986 1 1103 . 1 1 115 115 HIS HB3 H 1 2.85 0.01 . 1 . . . . 115 HIS HB3 . 6986 1 1104 . 1 1 115 115 HIS HD2 H 1 6.68 0.01 . 1 . . . . 115 HIS HD2 . 6986 1 1105 . 1 1 115 115 HIS HE1 H 1 7.46 0.01 . 1 . . . . 115 HIS HE1 . 6986 1 1106 . 1 1 115 115 HIS C C 13 170.0 1.00 . 1 . . . . 115 HIS C . 6986 1 1107 . 1 1 115 115 HIS CA C 13 52.6 0.90 . 1 . . . . 115 HIS CA . 6986 1 1108 . 1 1 115 115 HIS CB C 13 29.5 0.90 . 1 . . . . 115 HIS CB . 6986 1 1109 . 1 1 115 115 HIS N N 15 131.4 0.20 . 1 . . . . 115 HIS N . 6986 1 1110 . 1 1 116 116 LEU H H 1 8.51 0.01 . 1 . . . . 116 LEU HN . 6986 1 1111 . 1 1 116 116 LEU HA H 1 4.61 0.01 . 1 . . . . 116 LEU HA . 6986 1 1112 . 1 1 116 116 LEU HB2 H 1 1.57 0.01 . 1 . . . . 116 LEU HB2 . 6986 1 1113 . 1 1 116 116 LEU HB3 H 1 1.57 0.01 . 1 . . . . 116 LEU HB3 . 6986 1 1114 . 1 1 116 116 LEU HD11 H 1 0.98 0.01 . 2 . . . . 116 LEU HD1 . 6986 1 1115 . 1 1 116 116 LEU HD12 H 1 0.98 0.01 . 2 . . . . 116 LEU HD1 . 6986 1 1116 . 1 1 116 116 LEU HD13 H 1 0.98 0.01 . 2 . . . . 116 LEU HD1 . 6986 1 1117 . 1 1 116 116 LEU HD21 H 1 0.51 0.01 . 2 . . . . 116 LEU HD2 . 6986 1 1118 . 1 1 116 116 LEU HD22 H 1 0.51 0.01 . 2 . . . . 116 LEU HD2 . 6986 1 1119 . 1 1 116 116 LEU HD23 H 1 0.51 0.01 . 2 . . . . 116 LEU HD2 . 6986 1 1120 . 1 1 116 116 LEU C C 13 171.3 1.00 . 1 . . . . 116 LEU C . 6986 1 1121 . 1 1 116 116 LEU CA C 13 50.6 0.90 . 1 . . . . 116 LEU CA . 6986 1 1122 . 1 1 116 116 LEU CB C 13 43.7 0.90 . 1 . . . . 116 LEU CB . 6986 1 1123 . 1 1 116 116 LEU N N 15 123.3 0.20 . 1 . . . . 116 LEU N . 6986 1 1124 . 1 1 117 117 PHE H H 1 8.67 0.01 . 1 . . . . 117 PHE HN . 6986 1 1125 . 1 1 117 117 PHE HA H 1 4.98 0.01 . 1 . . . . 117 PHE HA . 6986 1 1126 . 1 1 117 117 PHE HB2 H 1 2.89 0.01 . 1 . . . . 117 PHE HB2 . 6986 1 1127 . 1 1 117 117 PHE HB3 H 1 2.89 0.01 . 1 . . . . 117 PHE HB3 . 6986 1 1128 . 1 1 117 117 PHE C C 13 170.2 1.00 . 1 . . . . 117 PHE C . 6986 1 1129 . 1 1 117 117 PHE CA C 13 52.8 0.90 . 1 . . . . 117 PHE CA . 6986 1 1130 . 1 1 117 117 PHE CB C 13 41.9 0.90 . 1 . . . . 117 PHE CB . 6986 1 1131 . 1 1 117 117 PHE N N 15 119.9 0.20 . 1 . . . . 117 PHE N . 6986 1 1132 . 1 1 118 118 ALA H H 1 9.11 0.01 . 1 . . . . 118 ALA HN . 6986 1 1133 . 1 1 118 118 ALA HA H 1 5.53 0.01 . 1 . . . . 118 ALA HA . 6986 1 1134 . 1 1 118 118 ALA HB1 H 1 1.09 0.01 . 1 . . . . 118 ALA HB . 6986 1 1135 . 1 1 118 118 ALA HB2 H 1 1.09 0.01 . 1 . . . . 118 ALA HB . 6986 1 1136 . 1 1 118 118 ALA HB3 H 1 1.09 0.01 . 1 . . . . 118 ALA HB . 6986 1 1137 . 1 1 118 118 ALA C C 13 173.9 1.00 . 1 . . . . 118 ALA C . 6986 1 1138 . 1 1 118 118 ALA CA C 13 46.9 0.90 . 1 . . . . 118 ALA CA . 6986 1 1139 . 1 1 118 118 ALA CB C 13 20.5 0.90 . 1 . . . . 118 ALA CB . 6986 1 1140 . 1 1 118 118 ALA N N 15 118.5 0.20 . 1 . . . . 118 ALA N . 6986 1 1141 . 1 1 119 119 GLU H H 1 7.93 0.01 . 1 . . . . 119 GLU HN . 6986 1 1142 . 1 1 119 119 GLU HA H 1 4.17 0.01 . 1 . . . . 119 GLU HA . 6986 1 1143 . 1 1 119 119 GLU HB2 H 1 2.14 0.01 . 1 . . . . 119 GLU HB2 . 6986 1 1144 . 1 1 119 119 GLU HB3 H 1 2.14 0.01 . 1 . . . . 119 GLU HB3 . 6986 1 1145 . 1 1 119 119 GLU HG2 H 1 2.30 0.01 . 1 . . . . 119 GLU HG2 . 6986 1 1146 . 1 1 119 119 GLU HG3 H 1 2.30 0.01 . 1 . . . . 119 GLU HG3 . 6986 1 1147 . 1 1 119 119 GLU C C 13 171.3 1.00 . 1 . . . . 119 GLU C . 6986 1 1148 . 1 1 119 119 GLU CA C 13 54.3 0.90 . 1 . . . . 119 GLU CA . 6986 1 1149 . 1 1 119 119 GLU CB C 13 29.4 0.90 . 1 . . . . 119 GLU CB . 6986 1 1150 . 1 1 119 119 GLU N N 15 119.5 0.20 . 1 . . . . 119 GLU N . 6986 1 1151 . 1 1 120 120 LEU H H 1 9.09 0.01 . 1 . . . . 120 LEU HN . 6986 1 1152 . 1 1 120 120 LEU HA H 1 4.41 0.01 . 1 . . . . 120 LEU HA . 6986 1 1153 . 1 1 120 120 LEU HB2 H 1 1.71 0.01 . 1 . . . . 120 LEU HB2 . 6986 1 1154 . 1 1 120 120 LEU HB3 H 1 1.71 0.01 . 1 . . . . 120 LEU HB3 . 6986 1 1155 . 1 1 120 120 LEU HG H 1 1.52 0.01 . 1 . . . . 120 LEU HG . 6986 1 1156 . 1 1 120 120 LEU HD11 H 1 0.80 0.01 . 2 . . . . 120 LEU HD1 . 6986 1 1157 . 1 1 120 120 LEU HD12 H 1 0.80 0.01 . 2 . . . . 120 LEU HD1 . 6986 1 1158 . 1 1 120 120 LEU HD13 H 1 0.80 0.01 . 2 . . . . 120 LEU HD1 . 6986 1 1159 . 1 1 120 120 LEU HD21 H 1 0.80 0.01 . 2 . . . . 120 LEU HD2 . 6986 1 1160 . 1 1 120 120 LEU HD22 H 1 0.80 0.01 . 2 . . . . 120 LEU HD2 . 6986 1 1161 . 1 1 120 120 LEU HD23 H 1 0.80 0.01 . 2 . . . . 120 LEU HD2 . 6986 1 1162 . 1 1 120 120 LEU C C 13 173.9 1.00 . 1 . . . . 120 LEU C . 6986 1 1163 . 1 1 120 120 LEU CA C 13 53.2 0.90 . 1 . . . . 120 LEU CA . 6986 1 1164 . 1 1 120 120 LEU CB C 13 43.5 0.90 . 1 . . . . 120 LEU CB . 6986 1 1165 . 1 1 120 120 LEU N N 15 123.6 0.20 . 1 . . . . 120 LEU N . 6986 1 1166 . 1 1 121 121 ASP H H 1 8.11 0.01 . 1 . . . . 121 ASP HN . 6986 1 1167 . 1 1 121 121 ASP HA H 1 4.89 0.01 . 1 . . . . 121 ASP HA . 6986 1 1168 . 1 1 121 121 ASP HB2 H 1 2.77 0.01 . 2 . . . . 121 ASP HB2 . 6986 1 1169 . 1 1 121 121 ASP HB3 H 1 2.60 0.01 . 2 . . . . 121 ASP HB3 . 6986 1 1170 . 1 1 121 121 ASP CA C 13 48.7 0.90 . 1 . . . . 121 ASP CA . 6986 1 1171 . 1 1 121 121 ASP CB C 13 40.6 0.90 . 1 . . . . 121 ASP CB . 6986 1 1172 . 1 1 121 121 ASP N N 15 120.4 0.20 . 1 . . . . 121 ASP N . 6986 1 1173 . 1 1 122 122 PRO HA H 1 4.23 0.01 . 1 . . . . 122 PRO HA . 6986 1 1174 . 1 1 122 122 PRO HB2 H 1 2.28 0.01 . 2 . . . . 122 PRO HB2 . 6986 1 1175 . 1 1 122 122 PRO HB3 H 1 2.13 0.01 . 2 . . . . 122 PRO HB3 . 6986 1 1176 . 1 1 122 122 PRO HG2 H 1 1.92 0.01 . 1 . . . . 122 PRO HG2 . 6986 1 1177 . 1 1 122 122 PRO HG3 H 1 1.92 0.01 . 1 . . . . 122 PRO HG3 . 6986 1 1178 . 1 1 122 122 PRO HD2 H 1 3.86 0.01 . 1 . . . . 122 PRO HD2 . 6986 1 1179 . 1 1 122 122 PRO HD3 H 1 3.86 0.01 . 1 . . . . 122 PRO HD3 . 6986 1 1180 . 1 1 122 122 PRO C C 13 176.7 1.00 . 1 . . . . 122 PRO C . 6986 1 1181 . 1 1 122 122 PRO CA C 13 61.5 0.90 . 1 . . . . 122 PRO CA . 6986 1 1182 . 1 1 122 122 PRO CB C 13 29.4 0.90 . 1 . . . . 122 PRO CB . 6986 1 1183 . 1 1 123 123 ASP H H 1 8.53 0.01 . 1 . . . . 123 ASP HN . 6986 1 1184 . 1 1 123 123 ASP HA H 1 4.62 0.01 . 1 . . . . 123 ASP HA . 6986 1 1185 . 1 1 123 123 ASP HB2 H 1 2.63 0.01 . 1 . . . . 123 ASP HB2 . 6986 1 1186 . 1 1 123 123 ASP HB3 H 1 2.63 0.01 . 1 . . . . 123 ASP HB3 . 6986 1 1187 . 1 1 123 123 ASP C C 13 173.4 1.00 . 1 . . . . 123 ASP C . 6986 1 1188 . 1 1 123 123 ASP CA C 13 52.0 0.90 . 1 . . . . 123 ASP CA . 6986 1 1189 . 1 1 123 123 ASP CB C 13 38.1 0.90 . 1 . . . . 123 ASP CB . 6986 1 1190 . 1 1 123 123 ASP N N 15 116.2 0.20 . 1 . . . . 123 ASP N . 6986 1 1191 . 1 1 124 124 GLN H H 1 7.80 0.01 . 1 . . . . 124 GLN HN . 6986 1 1192 . 1 1 124 124 GLN HA H 1 4.68 0.01 . 1 . . . . 124 GLN HA . 6986 1 1193 . 1 1 124 124 GLN HB2 H 1 1.94 0.01 . 1 . . . . 124 GLN HB2 . 6986 1 1194 . 1 1 124 124 GLN HB3 H 1 1.94 0.01 . 1 . . . . 124 GLN HB3 . 6986 1 1195 . 1 1 124 124 GLN HG2 H 1 2.21 0.01 . 1 . . . . 124 GLN HG2 . 6986 1 1196 . 1 1 124 124 GLN HG3 H 1 2.21 0.01 . 1 . . . . 124 GLN HG3 . 6986 1 1197 . 1 1 124 124 GLN CA C 13 50.6 0.90 . 1 . . . . 124 GLN CA . 6986 1 1198 . 1 1 124 124 GLN CB C 13 27.1 0.90 . 1 . . . . 124 GLN CB . 6986 1 1199 . 1 1 124 124 GLN N N 15 120.3 0.20 . 1 . . . . 124 GLN N . 6986 1 1200 . 1 1 124 124 GLN HE21 H 1 7.60 0.01 . 2 . . . . 124 ASN HD21 . 6986 1 1201 . 1 1 124 124 GLN HE22 H 1 6.64 0.01 . 2 . . . . 124 ASN HD22 . 6986 1 1202 . 1 1 124 124 GLN NE2 N 15 110.7 0.20 . 1 . . . . 124 ASN ND2 . 6986 1 1203 . 1 1 125 125 PRO HA H 1 4.32 0.01 . 1 . . . . 125 PRO HA . 6986 1 1204 . 1 1 125 125 PRO HB2 H 1 2.25 0.01 . 1 . . . . 125 PRO HB2 . 6986 1 1205 . 1 1 125 125 PRO HB3 H 1 2.25 0.01 . 1 . . . . 125 PRO HB3 . 6986 1 1206 . 1 1 125 125 PRO HG2 H 1 1.98 0.01 . 1 . . . . 125 PRO HG2 . 6986 1 1207 . 1 1 125 125 PRO HG3 H 1 1.98 0.01 . 1 . . . . 125 PRO HG3 . 6986 1 1208 . 1 1 125 125 PRO HD2 H 1 3.33 0.01 . 2 . . . . 125 PRO HD2 . 6986 1 1209 . 1 1 125 125 PRO HD3 H 1 3.13 0.01 . 2 . . . . 125 PRO HD3 . 6986 1 1210 . 1 1 125 125 PRO C C 13 175.6 1.00 . 1 . . . . 125 PRO C . 6986 1 1211 . 1 1 125 125 PRO CA C 13 60.0 0.90 . 1 . . . . 125 PRO CA . 6986 1 1212 . 1 1 125 125 PRO CB C 13 30.0 0.90 . 1 . . . . 125 PRO CB . 6986 1 1213 . 1 1 126 126 ALA H H 1 10.07 0.01 . 1 . . . . 126 ALA HN . 6986 1 1214 . 1 1 126 126 ALA HA H 1 4.37 0.01 . 1 . . . . 126 ALA HA . 6986 1 1215 . 1 1 126 126 ALA HB1 H 1 0.88 0.01 . 1 . . . . 126 ALA HB . 6986 1 1216 . 1 1 126 126 ALA HB2 H 1 0.88 0.01 . 1 . . . . 126 ALA HB . 6986 1 1217 . 1 1 126 126 ALA HB3 H 1 0.88 0.01 . 1 . . . . 126 ALA HB . 6986 1 1218 . 1 1 126 126 ALA C C 13 175.6 1.00 . 1 . . . . 126 ALA C . 6986 1 1219 . 1 1 126 126 ALA CA C 13 52.0 0.90 . 1 . . . . 126 ALA CA . 6986 1 1220 . 1 1 126 126 ALA CB C 13 16.4 0.90 . 1 . . . . 126 ALA CB . 6986 1 1221 . 1 1 126 126 ALA N N 15 125.1 0.20 . 1 . . . . 126 ALA N . 6986 1 1222 . 1 1 127 127 ALA H H 1 8.81 0.01 . 1 . . . . 127 ALA HN . 6986 1 1223 . 1 1 127 127 ALA HA H 1 3.63 0.01 . 1 . . . . 127 ALA HA . 6986 1 1224 . 1 1 127 127 ALA HB1 H 1 1.24 0.01 . 1 . . . . 127 ALA HB . 6986 1 1225 . 1 1 127 127 ALA HB2 H 1 1.24 0.01 . 1 . . . . 127 ALA HB . 6986 1 1226 . 1 1 127 127 ALA HB3 H 1 1.24 0.01 . 1 . . . . 127 ALA HB . 6986 1 1227 . 1 1 127 127 ALA C C 13 176.5 1.00 . 1 . . . . 127 ALA C . 6986 1 1228 . 1 1 127 127 ALA CA C 13 52.5 0.90 . 1 . . . . 127 ALA CA . 6986 1 1229 . 1 1 127 127 ALA CB C 13 15.5 0.90 . 1 . . . . 127 ALA CB . 6986 1 1230 . 1 1 127 127 ALA N N 15 116.3 0.20 . 1 . . . . 127 ALA N . 6986 1 1231 . 1 1 128 128 ALA H H 1 6.82 0.01 . 1 . . . . 128 ALA HN . 6986 1 1232 . 1 1 128 128 ALA HA H 1 3.95 0.01 . 1 . . . . 128 ALA HA . 6986 1 1233 . 1 1 128 128 ALA HB1 H 1 1.28 0.01 . 1 . . . . 128 ALA HB . 6986 1 1234 . 1 1 128 128 ALA HB2 H 1 1.28 0.01 . 1 . . . . 128 ALA HB . 6986 1 1235 . 1 1 128 128 ALA HB3 H 1 1.28 0.01 . 1 . . . . 128 ALA HB . 6986 1 1236 . 1 1 128 128 ALA CA C 13 51.6 0.90 . 1 . . . . 128 ALA CA . 6986 1 1237 . 1 1 128 128 ALA CB C 13 15.5 0.90 . 1 . . . . 128 ALA CB . 6986 1 1238 . 1 1 128 128 ALA N N 15 117.7 0.20 . 1 . . . . 128 ALA N . 6986 1 1239 . 1 1 129 129 ILE H H 1 6.92 0.01 . 1 . . . . 129 ILE HN . 6986 1 1240 . 1 1 129 129 ILE HA H 1 3.31 0.01 . 1 . . . . 129 ILE HA . 6986 1 1241 . 1 1 129 129 ILE HB H 1 1.77 0.01 . 1 . . . . 129 ILE HB . 6986 1 1242 . 1 1 129 129 ILE HG12 H 1 1.25 0.01 . 1 . . . . 129 ILE HG12 . 6986 1 1243 . 1 1 129 129 ILE HG13 H 1 1.25 0.01 . 1 . . . . 129 ILE HG13 . 6986 1 1244 . 1 1 129 129 ILE HG21 H 1 0.15 0.01 . 1 . . . . 129 ILE HG2 . 6986 1 1245 . 1 1 129 129 ILE HG22 H 1 0.15 0.01 . 1 . . . . 129 ILE HG2 . 6986 1 1246 . 1 1 129 129 ILE HG23 H 1 0.15 0.01 . 1 . . . . 129 ILE HG2 . 6986 1 1247 . 1 1 129 129 ILE HD11 H 1 0.00 0.01 . 1 . . . . 129 ILE HD1 . 6986 1 1248 . 1 1 129 129 ILE HD12 H 1 0.00 0.01 . 1 . . . . 129 ILE HD1 . 6986 1 1249 . 1 1 129 129 ILE HD13 H 1 0.00 0.01 . 1 . . . . 129 ILE HD1 . 6986 1 1250 . 1 1 129 129 ILE C C 13 174.8 1.00 . 1 . . . . 129 ILE C . 6986 1 1251 . 1 1 129 129 ILE CA C 13 61.3 0.90 . 1 . . . . 129 ILE CA . 6986 1 1252 . 1 1 129 129 ILE CB C 13 35.0 0.90 . 1 . . . . 129 ILE CB . 6986 1 1253 . 1 1 129 129 ILE N N 15 119.9 0.20 . 1 . . . . 129 ILE N . 6986 1 1254 . 1 1 130 130 VAL H H 1 7.68 0.01 . 1 . . . . 130 VAL HN . 6986 1 1255 . 1 1 130 130 VAL HA H 1 3.27 0.01 . 1 . . . . 130 VAL HA . 6986 1 1256 . 1 1 130 130 VAL HB H 1 1.81 0.01 . 1 . . . . 130 VAL HB . 6986 1 1257 . 1 1 130 130 VAL HG11 H 1 0.74 0.01 . 2 . . . . 130 VAL HG1 . 6986 1 1258 . 1 1 130 130 VAL HG12 H 1 0.74 0.01 . 2 . . . . 130 VAL HG1 . 6986 1 1259 . 1 1 130 130 VAL HG13 H 1 0.74 0.01 . 2 . . . . 130 VAL HG1 . 6986 1 1260 . 1 1 130 130 VAL HG21 H 1 0.59 0.01 . 2 . . . . 130 VAL HG2 . 6986 1 1261 . 1 1 130 130 VAL HG22 H 1 0.59 0.01 . 2 . . . . 130 VAL HG2 . 6986 1 1262 . 1 1 130 130 VAL HG23 H 1 0.59 0.01 . 2 . . . . 130 VAL HG2 . 6986 1 1263 . 1 1 130 130 VAL C C 13 176.1 1.00 . 1 . . . . 130 VAL C . 6986 1 1264 . 1 1 130 130 VAL CA C 13 63.3 0.90 . 1 . . . . 130 VAL CA . 6986 1 1265 . 1 1 130 130 VAL CB C 13 28.8 0.90 . 1 . . . . 130 VAL CB . 6986 1 1266 . 1 1 130 130 VAL N N 15 117.5 0.20 . 1 . . . . 130 VAL N . 6986 1 1267 . 1 1 131 131 ASN H H 1 7.77 0.01 . 1 . . . . 131 ASN HN . 6986 1 1268 . 1 1 131 131 ASN HA H 1 4.33 0.01 . 1 . . . . 131 ASN HA . 6986 1 1269 . 1 1 131 131 ASN HB2 H 1 2.74 0.01 . 2 . . . . 131 ASN HB2 . 6986 1 1270 . 1 1 131 131 ASN HB3 H 1 2.63 0.01 . 2 . . . . 131 ASN HB3 . 6986 1 1271 . 1 1 131 131 ASN C C 13 174.6 1.00 . 1 . . . . 131 ASN C . 6986 1 1272 . 1 1 131 131 ASN CA C 13 53.5 0.90 . 1 . . . . 131 ASN CA . 6986 1 1273 . 1 1 131 131 ASN CB C 13 35.7 0.90 . 1 . . . . 131 ASN CB . 6986 1 1274 . 1 1 131 131 ASN N N 15 118.2 0.20 . 1 . . . . 131 ASN N . 6986 1 1275 . 1 1 132 132 PHE H H 1 7.83 0.01 . 1 . . . . 132 PHE HN . 6986 1 1276 . 1 1 132 132 PHE HA H 1 4.12 0.01 . 1 . . . . 132 PHE HA . 6986 1 1277 . 1 1 132 132 PHE HB2 H 1 3.13 0.01 . 2 . . . . 132 PHE HB2 . 6986 1 1278 . 1 1 132 132 PHE HB3 H 1 2.92 0.01 . 2 . . . . 132 PHE HB3 . 6986 1 1279 . 1 1 132 132 PHE HD1 H 1 6.89 0.01 . 1 . . . . 132 PHE HD1 . 6986 1 1280 . 1 1 132 132 PHE HD2 H 1 6.89 0.01 . 1 . . . . 132 PHE HD2 . 6986 1 1281 . 1 1 132 132 PHE HE1 H 1 6.84 0.01 . 1 . . . . 132 PHE HE1 . 6986 1 1282 . 1 1 132 132 PHE HE2 H 1 6.84 0.01 . 1 . . . . 132 PHE HE2 . 6986 1 1283 . 1 1 132 132 PHE HZ H 1 6.56 0.01 . 1 . . . . 132 PHE HZ . 6986 1 1284 . 1 1 132 132 PHE C C 13 175.2 1.00 . 1 . . . . 132 PHE C . 6986 1 1285 . 1 1 132 132 PHE CA C 13 58.9 0.90 . 1 . . . . 132 PHE CA . 6986 1 1286 . 1 1 132 132 PHE CB C 13 36.0 0.90 . 1 . . . . 132 PHE CB . 6986 1 1287 . 1 1 132 132 PHE N N 15 121.2 0.20 . 1 . . . . 132 PHE N . 6986 1 1288 . 1 1 133 133 VAL H H 1 8.34 0.01 . 1 . . . . 133 VAL HN . 6986 1 1289 . 1 1 133 133 VAL HA H 1 3.30 0.01 . 1 . . . . 133 VAL HA . 6986 1 1290 . 1 1 133 133 VAL HB H 1 1.99 0.01 . 1 . . . . 133 VAL HB . 6986 1 1291 . 1 1 133 133 VAL HG11 H 1 0.99 0.01 . 2 . . . . 133 VAL HG1 . 6986 1 1292 . 1 1 133 133 VAL HG12 H 1 0.99 0.01 . 2 . . . . 133 VAL HG1 . 6986 1 1293 . 1 1 133 133 VAL HG13 H 1 0.99 0.01 . 2 . . . . 133 VAL HG1 . 6986 1 1294 . 1 1 133 133 VAL HG21 H 1 0.71 0.01 . 2 . . . . 133 VAL HG2 . 6986 1 1295 . 1 1 133 133 VAL HG22 H 1 0.71 0.01 . 2 . . . . 133 VAL HG2 . 6986 1 1296 . 1 1 133 133 VAL HG23 H 1 0.71 0.01 . 2 . . . . 133 VAL HG2 . 6986 1 1297 . 1 1 133 133 VAL C C 13 174.8 1.00 . 1 . . . . 133 VAL C . 6986 1 1298 . 1 1 133 133 VAL CA C 13 64.1 0.90 . 1 . . . . 133 VAL CA . 6986 1 1299 . 1 1 133 133 VAL CB C 13 28.8 0.90 . 1 . . . . 133 VAL CB . 6986 1 1300 . 1 1 133 133 VAL N N 15 118.4 0.20 . 1 . . . . 133 VAL N . 6986 1 1301 . 1 1 134 134 SER H H 1 8.07 0.01 . 1 . . . . 134 SER HN . 6986 1 1302 . 1 1 134 134 SER HA H 1 4.02 0.01 . 1 . . . . 134 SER HA . 6986 1 1303 . 1 1 134 134 SER HB2 H 1 3.87 0.01 . 1 . . . . 134 SER HB2 . 6986 1 1304 . 1 1 134 134 SER HB3 H 1 3.87 0.01 . 1 . . . . 134 SER HB3 . 6986 1 1305 . 1 1 134 134 SER C C 13 173.6 1.00 . 1 . . . . 134 SER C . 6986 1 1306 . 1 1 134 134 SER CA C 13 59.0 0.90 . 1 . . . . 134 SER CA . 6986 1 1307 . 1 1 134 134 SER CB C 13 60.0 0.90 . 1 . . . . 134 SER CB . 6986 1 1308 . 1 1 134 134 SER N N 15 113.6 0.20 . 1 . . . . 134 SER N . 6986 1 1309 . 1 1 135 135 ARG H H 1 7.73 0.01 . 1 . . . . 135 ARG HN . 6986 1 1310 . 1 1 135 135 ARG HA H 1 3.92 0.01 . 1 . . . . 135 ARG HA . 6986 1 1311 . 1 1 135 135 ARG HB2 H 1 1.67 0.01 . 1 . . . . 135 ARG HB2 . 6986 1 1312 . 1 1 135 135 ARG HB3 H 1 1.67 0.01 . 1 . . . . 135 ARG HB3 . 6986 1 1313 . 1 1 135 135 ARG HG2 H 1 1.48 0.01 . 1 . . . . 135 ARG HG2 . 6986 1 1314 . 1 1 135 135 ARG HG3 H 1 1.48 0.01 . 1 . . . . 135 ARG HG3 . 6986 1 1315 . 1 1 135 135 ARG HD2 H 1 3.28 0.01 . 1 . . . . 135 ARG HD2 . 6986 1 1316 . 1 1 135 135 ARG HD3 H 1 3.28 0.01 . 1 . . . . 135 ARG HD3 . 6986 1 1317 . 1 1 135 135 ARG C C 13 176.7 1.00 . 1 . . . . 135 ARG C . 6986 1 1318 . 1 1 135 135 ARG CA C 13 56.6 0.90 . 1 . . . . 135 ARG CA . 6986 1 1319 . 1 1 135 135 ARG CB C 13 27.2 0.90 . 1 . . . . 135 ARG CB . 6986 1 1320 . 1 1 135 135 ARG N N 15 119.8 0.20 . 1 . . . . 135 ARG N . 6986 1 1321 . 1 1 136 136 VAL H H 1 7.65 0.01 . 1 . . . . 136 VAL HN . 6986 1 1322 . 1 1 136 136 VAL HA H 1 3.80 0.01 . 1 . . . . 136 VAL HA . 6986 1 1323 . 1 1 136 136 VAL HB H 1 2.01 0.01 . 1 . . . . 136 VAL HB . 6986 1 1324 . 1 1 136 136 VAL HG11 H 1 0.67 0.01 . 2 . . . . 136 VAL HG1 . 6986 1 1325 . 1 1 136 136 VAL HG12 H 1 0.67 0.01 . 2 . . . . 136 VAL HG1 . 6986 1 1326 . 1 1 136 136 VAL HG13 H 1 0.67 0.01 . 2 . . . . 136 VAL HG1 . 6986 1 1327 . 1 1 136 136 VAL HG21 H 1 0.67 0.01 . 2 . . . . 136 VAL HG2 . 6986 1 1328 . 1 1 136 136 VAL HG22 H 1 0.67 0.01 . 2 . . . . 136 VAL HG2 . 6986 1 1329 . 1 1 136 136 VAL HG23 H 1 0.67 0.01 . 2 . . . . 136 VAL HG2 . 6986 1 1330 . 1 1 136 136 VAL C C 13 175.8 1.00 . 1 . . . . 136 VAL C . 6986 1 1331 . 1 1 136 136 VAL CA C 13 62.2 0.90 . 1 . . . . 136 VAL CA . 6986 1 1332 . 1 1 136 136 VAL CB C 13 28.7 0.90 . 1 . . . . 136 VAL CB . 6986 1 1333 . 1 1 136 136 VAL N N 15 116.9 0.20 . 1 . . . . 136 VAL N . 6986 1 1334 . 1 1 137 137 MET H H 1 8.10 0.01 . 1 . . . . 137 MET HN . 6986 1 1335 . 1 1 137 137 MET HA H 1 3.91 0.01 . 1 . . . . 137 MET HA . 6986 1 1336 . 1 1 137 137 MET HB2 H 1 2.04 0.01 . 1 . . . . 137 MET HB2 . 6986 1 1337 . 1 1 137 137 MET HB3 H 1 2.04 0.01 . 1 . . . . 137 MET HB3 . 6986 1 1338 . 1 1 137 137 MET HG2 H 1 2.52 0.01 . 1 . . . . 137 MET HG2 . 6986 1 1339 . 1 1 137 137 MET HG3 H 1 2.52 0.01 . 1 . . . . 137 MET HG3 . 6986 1 1340 . 1 1 137 137 MET C C 13 175.3 1.00 . 1 . . . . 137 MET C . 6986 1 1341 . 1 1 137 137 MET CA C 13 56.3 0.90 . 1 . . . . 137 MET CA . 6986 1 1342 . 1 1 137 137 MET CB C 13 30.6 0.90 . 1 . . . . 137 MET CB . 6986 1 1343 . 1 1 137 137 MET N N 15 119.8 0.20 . 1 . . . . 137 MET N . 6986 1 1344 . 1 1 138 138 LEU H H 1 7.86 0.01 . 1 . . . . 138 LEU HN . 6986 1 1345 . 1 1 138 138 LEU HA H 1 4.65 0.01 . 1 . . . . 138 LEU HA . 6986 1 1346 . 1 1 138 138 LEU HB2 H 1 1.71 0.01 . 1 . . . . 138 LEU HB2 . 6986 1 1347 . 1 1 138 138 LEU HB3 H 1 1.71 0.01 . 1 . . . . 138 LEU HB3 . 6986 1 1348 . 1 1 138 138 LEU HG H 1 1.55 0.01 . 1 . . . . 138 LEU HG . 6986 1 1349 . 1 1 138 138 LEU HD11 H 1 0.76 0.01 . 2 . . . . 138 LEU HD1 . 6986 1 1350 . 1 1 138 138 LEU HD12 H 1 0.76 0.01 . 2 . . . . 138 LEU HD1 . 6986 1 1351 . 1 1 138 138 LEU HD13 H 1 0.76 0.01 . 2 . . . . 138 LEU HD1 . 6986 1 1352 . 1 1 138 138 LEU HD21 H 1 0.76 0.01 . 2 . . . . 138 LEU HD2 . 6986 1 1353 . 1 1 138 138 LEU HD22 H 1 0.76 0.01 . 2 . . . . 138 LEU HD2 . 6986 1 1354 . 1 1 138 138 LEU HD23 H 1 0.76 0.01 . 2 . . . . 138 LEU HD2 . 6986 1 1355 . 1 1 138 138 LEU C C 13 176.3 1.00 . 1 . . . . 138 LEU C . 6986 1 1356 . 1 1 138 138 LEU CA C 13 53.8 0.90 . 1 . . . . 138 LEU CA . 6986 1 1357 . 1 1 138 138 LEU CB C 13 39.3 0.90 . 1 . . . . 138 LEU CB . 6986 1 1358 . 1 1 138 138 LEU N N 15 119.2 0.20 . 1 . . . . 138 LEU N . 6986 1 1359 . 1 1 139 139 GLY H H 1 7.78 0.01 . 1 . . . . 139 GLY HN . 6986 1 1360 . 1 1 139 139 GLY HA2 H 1 3.92 0.01 . 1 . . . . 139 GLY HA1 . 6986 1 1361 . 1 1 139 139 GLY HA3 H 1 3.92 0.01 . 1 . . . . 139 GLY HA2 . 6986 1 1362 . 1 1 139 139 GLY C C 13 172.2 1.00 . 1 . . . . 139 GLY C . 6986 1 1363 . 1 1 139 139 GLY CA C 13 43.1 0.90 . 1 . . . . 139 GLY CA . 6986 1 1364 . 1 1 139 139 GLY N N 15 107.0 0.20 . 1 . . . . 139 GLY N . 6986 1 1365 . 1 1 140 140 SER H H 1 7.91 0.01 . 1 . . . . 140 SER HN . 6986 1 1366 . 1 1 140 140 SER HA H 1 4.39 0.01 . 1 . . . . 140 SER HA . 6986 1 1367 . 1 1 140 140 SER HB2 H 1 3.91 0.01 . 1 . . . . 140 SER HB2 . 6986 1 1368 . 1 1 140 140 SER HB3 H 1 3.91 0.01 . 1 . . . . 140 SER HB3 . 6986 1 1369 . 1 1 140 140 SER C C 13 172.6 1.00 . 1 . . . . 140 SER C . 6986 1 1370 . 1 1 140 140 SER CA C 13 56.3 0.90 . 1 . . . . 140 SER CA . 6986 1 1371 . 1 1 140 140 SER CB C 13 61.2 0.90 . 1 . . . . 140 SER CB . 6986 1 1372 . 1 1 140 140 SER N N 15 115.3 0.20 . 1 . . . . 140 SER N . 6986 1 1373 . 1 1 141 141 GLY H H 1 8.24 0.01 . 1 . . . . 141 GLY HN . 6986 1 1374 . 1 1 141 141 GLY HA2 H 1 4.67 0.01 . 1 . . . . 141 GLY HA1 . 6986 1 1375 . 1 1 141 141 GLY HA3 H 1 4.67 0.01 . 1 . . . . 141 GLY HA2 . 6986 1 1376 . 1 1 141 141 GLY C C 13 171.5 1.00 . 1 . . . . 141 GLY C . 6986 1 1377 . 1 1 141 141 GLY CA C 13 42.8 0.90 . 1 . . . . 141 GLY CA . 6986 1 1378 . 1 1 141 141 GLY N N 15 110.4 0.20 . 1 . . . . 141 GLY N . 6986 1 1379 . 1 1 142 142 GLN H H 1 8.00 0.01 . 1 . . . . 142 GLN HN . 6986 1 1380 . 1 1 142 142 GLN HA H 1 4.26 0.01 . 1 . . . . 142 GLN HA . 6986 1 1381 . 1 1 142 142 GLN HB2 H 1 1.85 0.01 . 1 . . . . 142 GLN HB2 . 6986 1 1382 . 1 1 142 142 GLN HB3 H 1 1.85 0.01 . 1 . . . . 142 GLN HB3 . 6986 1 1383 . 1 1 142 142 GLN HG2 H 1 2.20 0.01 . 1 . . . . 142 GLN HG2 . 6986 1 1384 . 1 1 142 142 GLN HG3 H 1 2.20 0.01 . 1 . . . . 142 GLN HG3 . 6986 1 1385 . 1 1 142 142 GLN C C 13 173.0 1.00 . 1 . . . . 142 GLN C . 6986 1 1386 . 1 1 142 142 GLN CA C 13 53.1 0.90 . 1 . . . . 142 GLN CA . 6986 1 1387 . 1 1 142 142 GLN CB C 13 26.8 0.90 . 1 . . . . 142 GLN CB . 6986 1 1388 . 1 1 142 142 GLN N N 15 119.4 0.20 . 1 . . . . 142 GLN N . 6986 1 1389 . 1 1 143 143 LYS H H 1 8.25 0.01 . 1 . . . . 143 LYS HN . 6986 1 1390 . 1 1 143 143 LYS HA H 1 4.21 0.01 . 1 . . . . 143 LYS HA . 6986 1 1391 . 1 1 143 143 LYS HB2 H 1 1.72 0.01 . 1 . . . . 143 LYS HB2 . 6986 1 1392 . 1 1 143 143 LYS HB3 H 1 1.72 0.01 . 1 . . . . 143 LYS HB3 . 6986 1 1393 . 1 1 143 143 LYS HG2 H 1 1.37 0.01 . 1 . . . . 143 LYS HG2 . 6986 1 1394 . 1 1 143 143 LYS HG3 H 1 1.37 0.01 . 1 . . . . 143 LYS HG3 . 6986 1 1395 . 1 1 143 143 LYS C C 13 172.8 1.00 . 1 . . . . 143 LYS C . 6986 1 1396 . 1 1 143 143 LYS CA C 13 53.7 0.90 . 1 . . . . 143 LYS CA . 6986 1 1397 . 1 1 143 143 LYS CB C 13 30.3 0.90 . 1 . . . . 143 LYS CB . 6986 1 1398 . 1 1 143 143 LYS N N 15 123.3 0.20 . 1 . . . . 143 LYS N . 6986 1 1399 . 1 1 144 144 ARG H H 1 7.96 0.01 . 1 . . . . 144 ARG HN . 6986 1 1400 . 1 1 144 144 ARG HA H 1 4.07 0.01 . 1 . . . . 144 ARG HA . 6986 1 1401 . 1 1 144 144 ARG HB2 H 1 1.81 0.01 . 1 . . . . 144 ARG HB2 . 6986 1 1402 . 1 1 144 144 ARG HB3 H 1 1.81 0.01 . 1 . . . . 144 ARG HB3 . 6986 1 1403 . 1 1 144 144 ARG HG2 H 1 1.62 0.01 . 1 . . . . 144 ARG HG2 . 6986 1 1404 . 1 1 144 144 ARG HG3 H 1 1.62 0.01 . 1 . . . . 144 ARG HG3 . 6986 1 1405 . 1 1 144 144 ARG CA C 13 54.6 0.90 . 1 . . . . 144 ARG CA . 6986 1 1406 . 1 1 144 144 ARG CB C 13 28.8 0.90 . 1 . . . . 144 ARG CB . 6986 1 1407 . 1 1 144 144 ARG N N 15 128.3 0.20 . 1 . . . . 144 ARG N . 6986 1 stop_ save_