data_15653 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 15653 _Entry.Title ; Backbone 1H, 13C, and 15N NMR Assignments of the Tail Domain of Vinculin ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2008-02-04 _Entry.Accession_date 2008-02-04 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.8.112 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Sean Palmer . M. . 15653 2 Sharon Campbell . L. . 15653 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Campbell Lab, UNC-CH' . 15653 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 15653 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 486 15653 '15N chemical shifts' 155 15653 '1H chemical shifts' 155 15653 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2009-08-13 2008-01-28 update BMRB 'added PubMed ID' 15653 1 . . 2008-05-28 2008-02-04 original author 'original release' 15653 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 15653 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 19636928 _Citation.Full_citation . _Citation.Title 'Backbone 1H, 13C, and 15N NMR assignments of the tail domain of vinculin' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full . _Citation.Journal_volume 2 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN . _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 69 _Citation.Page_last 71 _Citation.Year 2008 _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 Sean Palmer . M. . 15653 1 2 Sharon Campbell . L. . 15653 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID NMR 15653 1 Vinculin 15653 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 15653 _Assembly.ID 1 _Assembly.Name 'Vinculin Tail' _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass 21587 _Assembly.Enzyme_commission_number . _Assembly.Details 'The tail domain of vinculin, comprising residues 879-1066.' _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 'Vinculin Tail' 1 $Vinculin_Tail A . yes native yes no . . . 15653 1 stop_ loop_ _Assembly_db_link.Author_supplied _Assembly_db_link.Database_code _Assembly_db_link.Accession_code _Assembly_db_link.Entry_mol_code _Assembly_db_link.Entry_mol_name _Assembly_db_link.Entry_experimental_method _Assembly_db_link.Entry_structure_resolution _Assembly_db_link.Entry_relation_type _Assembly_db_link.Entry_details _Assembly_db_link.Entry_ID _Assembly_db_link.Assembly_ID yes PDB 1qkr . . X-ray 1.8 . . 15653 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'actin binding' 15653 1 'cytoskeltal protein' 15653 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_Vinculin_Tail _Entity.Sf_category entity _Entity.Sf_framecode Vinculin_Tail _Entity.Entry_ID 15653 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name Vinculin_Tail _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 ; GSHMEEKDEEFPEQKAGEAI NQPMMMAARQLHDEARKWSS KGNDIIAAAKRMALLMAEMS RLVRGGSGNKRALIQCAKDI AKASDEVTRLAKEVAKQCTD KRIRTNLLQVCERIPTISTQ LKILSTVKATMLGRTNISDE ESEQATEMLVHNAQNLMQSV KETVREAEAASIKIRTDAGF TLRWVRKTPWYQ ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 1-4 are non-native. Residues 5-192 represent residues 879-1066 of chicken vinculin, commonly refered to as vinculin tail (Vt). Chicken Vt shares 98.9% identity with human Vt.' _Entity.Ambiguous_conformational_states yes _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 192 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'Vinculin Tail (Vt)' _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-26 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 yes GB NP_990772 . Vinculin . . . . . . . . . . . . . . 15653 1 2 yes PDB 1qkr . "Vinculin Tail" . . . . . . . . . . . . . . 15653 1 3 no PDB 1RKE . "Human Vinculin Head (1-258) In Complex With Human Vinculin Tail (879-1066)" . . . . . 96.35 185 98.92 98.92 6.54e-130 . . . . 15653 1 4 no PDB 1ST6 . "Crystal Structure Of A Cytoskeletal Protein" . . . . . 97.92 1069 100.00 100.00 8.39e-124 . . . . 15653 1 5 no PDB 3H2U . "Human Raver1 Rrm1, Rrm2, And Rrm3 Domains In Complex With Human Vinculin Tail Domain Vt" . . . . . 97.92 188 98.94 98.94 4.81e-132 . . . . 15653 1 6 no PDB 3H2V . "Human Raver1 Rrm1 Domain In Complex With Human Vinculin Tail Domain Vt" . . . . . 97.92 188 98.94 98.94 4.81e-132 . . . . 15653 1 7 no PDB 4PR9 . "Human Vinculin (residues 891-1066) In Complex With Pip" . . . . . 91.67 176 98.30 98.30 2.90e-121 . . . . 15653 1 8 no DBJ BAC28973 . "unnamed protein product [Mus musculus]" . . . . . 97.92 439 98.94 98.94 2.60e-129 . . . . 15653 1 9 no DBJ BAC37033 . "unnamed protein product [Mus musculus]" . . . . . 97.92 1066 98.40 98.40 9.29e-122 . . . . 15653 1 10 no DBJ BAG11028 . "vinculin [synthetic construct]" . . . . . 97.92 1066 98.94 98.94 2.69e-122 . . . . 15653 1 11 no DBJ BAG54414 . "unnamed protein product [Homo sapiens]" . . . . . 79.69 1006 98.69 98.69 3.32e-93 . . . . 15653 1 12 no DBJ BAG59141 . "unnamed protein product [Homo sapiens]" . . . . . 97.92 491 98.94 98.94 6.75e-129 . . . . 15653 1 13 no GB AAA49136 . "vinculin [Gallus gallus]" . . . . . 97.92 1066 100.00 100.00 9.20e-124 . . . . 15653 1 14 no GB AAA61283 . "vinculin [Homo sapiens]" . . . . . 97.92 1066 98.94 98.94 2.69e-122 . . . . 15653 1 15 no GB AAB21657 . "vinculin, partial [Homo sapiens]" . . . . . 54.69 130 98.10 98.10 2.88e-66 . . . . 15653 1 16 no GB AAB96843 . "vinculin [Mus musculus]" . . . . . 97.92 1066 98.94 98.94 2.63e-122 . . . . 15653 1 17 no GB AAH08520 . "Vinculin [Mus musculus]" . . . . . 97.92 1066 98.94 98.94 2.66e-122 . . . . 15653 1 18 no PRF 1805212A . vinculin . . . . . 97.92 293 98.94 98.94 1.61e-131 . . . . 15653 1 19 no REF NP_001100718 . "vinculin [Rattus norvegicus]" . . . . . 97.92 1066 98.94 98.94 2.86e-122 . . . . 15653 1 20 no REF NP_003364 . "vinculin isoform VCL [Homo sapiens]" . . . . . 97.92 1066 98.94 98.94 2.69e-122 . . . . 15653 1 21 no REF NP_033528 . "vinculin [Mus musculus]" . . . . . 97.92 1066 98.94 98.94 2.66e-122 . . . . 15653 1 22 no REF NP_990772 . "vinculin [Gallus gallus]" . . . . . 97.92 1066 100.00 100.00 9.20e-124 . . . . 15653 1 23 no REF NP_999099 . "vinculin [Sus scrofa]" . . . . . 97.92 1067 98.94 98.94 2.44e-122 . . . . 15653 1 24 no SP P85972 . "RecName: Full=Vinculin; AltName: Full=Metavinculin" . . . . . 97.92 1066 98.94 98.94 2.86e-122 . . . . 15653 1 25 no SP Q64727 . "RecName: Full=Vinculin; AltName: Full=Metavinculin" . . . . . 97.92 1066 98.94 98.94 2.66e-122 . . . . 15653 1 26 no TPG DAA14174 . "TPA: vinculin isoform 2 [Bos taurus]" . . . . . 97.92 1066 98.94 98.94 2.66e-122 . . . . 15653 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'cytoskeletal protein' 15653 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 . 15653 1 2 . SER . 15653 1 3 . HIS . 15653 1 4 . MET . 15653 1 5 . GLU . 15653 1 6 . GLU . 15653 1 7 . LYS . 15653 1 8 . ASP . 15653 1 9 . GLU . 15653 1 10 . GLU . 15653 1 11 . PHE . 15653 1 12 . PRO . 15653 1 13 . GLU . 15653 1 14 . GLN . 15653 1 15 . LYS . 15653 1 16 . ALA . 15653 1 17 . GLY . 15653 1 18 . GLU . 15653 1 19 . ALA . 15653 1 20 . ILE . 15653 1 21 . ASN . 15653 1 22 . GLN . 15653 1 23 . PRO . 15653 1 24 . MET . 15653 1 25 . MET . 15653 1 26 . MET . 15653 1 27 . ALA . 15653 1 28 . ALA . 15653 1 29 . ARG . 15653 1 30 . GLN . 15653 1 31 . LEU . 15653 1 32 . HIS . 15653 1 33 . ASP . 15653 1 34 . GLU . 15653 1 35 . ALA . 15653 1 36 . ARG . 15653 1 37 . LYS . 15653 1 38 . TRP . 15653 1 39 . SER . 15653 1 40 . SER . 15653 1 41 . LYS . 15653 1 42 . GLY . 15653 1 43 . ASN . 15653 1 44 . ASP . 15653 1 45 . ILE . 15653 1 46 . ILE . 15653 1 47 . ALA . 15653 1 48 . ALA . 15653 1 49 . ALA . 15653 1 50 . LYS . 15653 1 51 . ARG . 15653 1 52 . MET . 15653 1 53 . ALA . 15653 1 54 . LEU . 15653 1 55 . LEU . 15653 1 56 . MET . 15653 1 57 . ALA . 15653 1 58 . GLU . 15653 1 59 . MET . 15653 1 60 . SER . 15653 1 61 . ARG . 15653 1 62 . LEU . 15653 1 63 . VAL . 15653 1 64 . ARG . 15653 1 65 . GLY . 15653 1 66 . GLY . 15653 1 67 . SER . 15653 1 68 . GLY . 15653 1 69 . ASN . 15653 1 70 . LYS . 15653 1 71 . ARG . 15653 1 72 . ALA . 15653 1 73 . LEU . 15653 1 74 . ILE . 15653 1 75 . GLN . 15653 1 76 . CYS . 15653 1 77 . ALA . 15653 1 78 . LYS . 15653 1 79 . ASP . 15653 1 80 . ILE . 15653 1 81 . ALA . 15653 1 82 . LYS . 15653 1 83 . ALA . 15653 1 84 . SER . 15653 1 85 . ASP . 15653 1 86 . GLU . 15653 1 87 . VAL . 15653 1 88 . THR . 15653 1 89 . ARG . 15653 1 90 . LEU . 15653 1 91 . ALA . 15653 1 92 . LYS . 15653 1 93 . GLU . 15653 1 94 . VAL . 15653 1 95 . ALA . 15653 1 96 . LYS . 15653 1 97 . GLN . 15653 1 98 . CYS . 15653 1 99 . THR . 15653 1 100 . ASP . 15653 1 101 . LYS . 15653 1 102 . ARG . 15653 1 103 . ILE . 15653 1 104 . ARG . 15653 1 105 . THR . 15653 1 106 . ASN . 15653 1 107 . LEU . 15653 1 108 . LEU . 15653 1 109 . GLN . 15653 1 110 . VAL . 15653 1 111 . CYS . 15653 1 112 . GLU . 15653 1 113 . ARG . 15653 1 114 . ILE . 15653 1 115 . PRO . 15653 1 116 . THR . 15653 1 117 . ILE . 15653 1 118 . SER . 15653 1 119 . THR . 15653 1 120 . GLN . 15653 1 121 . LEU . 15653 1 122 . LYS . 15653 1 123 . ILE . 15653 1 124 . LEU . 15653 1 125 . SER . 15653 1 126 . THR . 15653 1 127 . VAL . 15653 1 128 . LYS . 15653 1 129 . ALA . 15653 1 130 . THR . 15653 1 131 . MET . 15653 1 132 . LEU . 15653 1 133 . GLY . 15653 1 134 . ARG . 15653 1 135 . THR . 15653 1 136 . ASN . 15653 1 137 . ILE . 15653 1 138 . SER . 15653 1 139 . ASP . 15653 1 140 . GLU . 15653 1 141 . GLU . 15653 1 142 . SER . 15653 1 143 . GLU . 15653 1 144 . GLN . 15653 1 145 . ALA . 15653 1 146 . THR . 15653 1 147 . GLU . 15653 1 148 . MET . 15653 1 149 . LEU . 15653 1 150 . VAL . 15653 1 151 . HIS . 15653 1 152 . ASN . 15653 1 153 . ALA . 15653 1 154 . GLN . 15653 1 155 . ASN . 15653 1 156 . LEU . 15653 1 157 . MET . 15653 1 158 . GLN . 15653 1 159 . SER . 15653 1 160 . VAL . 15653 1 161 . LYS . 15653 1 162 . GLU . 15653 1 163 . THR . 15653 1 164 . VAL . 15653 1 165 . ARG . 15653 1 166 . GLU . 15653 1 167 . ALA . 15653 1 168 . GLU . 15653 1 169 . ALA . 15653 1 170 . ALA . 15653 1 171 . SER . 15653 1 172 . ILE . 15653 1 173 . LYS . 15653 1 174 . ILE . 15653 1 175 . ARG . 15653 1 176 . THR . 15653 1 177 . ASP . 15653 1 178 . ALA . 15653 1 179 . GLY . 15653 1 180 . PHE . 15653 1 181 . THR . 15653 1 182 . LEU . 15653 1 183 . ARG . 15653 1 184 . TRP . 15653 1 185 . VAL . 15653 1 186 . ARG . 15653 1 187 . LYS . 15653 1 188 . THR . 15653 1 189 . PRO . 15653 1 190 . TRP . 15653 1 191 . TYR . 15653 1 192 . GLN . 15653 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 15653 1 . SER 2 2 15653 1 . HIS 3 3 15653 1 . MET 4 4 15653 1 . GLU 5 5 15653 1 . GLU 6 6 15653 1 . LYS 7 7 15653 1 . ASP 8 8 15653 1 . GLU 9 9 15653 1 . GLU 10 10 15653 1 . PHE 11 11 15653 1 . PRO 12 12 15653 1 . GLU 13 13 15653 1 . GLN 14 14 15653 1 . LYS 15 15 15653 1 . ALA 16 16 15653 1 . GLY 17 17 15653 1 . GLU 18 18 15653 1 . ALA 19 19 15653 1 . ILE 20 20 15653 1 . ASN 21 21 15653 1 . GLN 22 22 15653 1 . PRO 23 23 15653 1 . MET 24 24 15653 1 . MET 25 25 15653 1 . MET 26 26 15653 1 . ALA 27 27 15653 1 . ALA 28 28 15653 1 . ARG 29 29 15653 1 . GLN 30 30 15653 1 . LEU 31 31 15653 1 . HIS 32 32 15653 1 . ASP 33 33 15653 1 . GLU 34 34 15653 1 . ALA 35 35 15653 1 . ARG 36 36 15653 1 . LYS 37 37 15653 1 . TRP 38 38 15653 1 . SER 39 39 15653 1 . SER 40 40 15653 1 . LYS 41 41 15653 1 . GLY 42 42 15653 1 . ASN 43 43 15653 1 . ASP 44 44 15653 1 . ILE 45 45 15653 1 . ILE 46 46 15653 1 . ALA 47 47 15653 1 . ALA 48 48 15653 1 . ALA 49 49 15653 1 . LYS 50 50 15653 1 . ARG 51 51 15653 1 . MET 52 52 15653 1 . ALA 53 53 15653 1 . LEU 54 54 15653 1 . LEU 55 55 15653 1 . MET 56 56 15653 1 . ALA 57 57 15653 1 . GLU 58 58 15653 1 . MET 59 59 15653 1 . SER 60 60 15653 1 . ARG 61 61 15653 1 . LEU 62 62 15653 1 . VAL 63 63 15653 1 . ARG 64 64 15653 1 . GLY 65 65 15653 1 . GLY 66 66 15653 1 . SER 67 67 15653 1 . GLY 68 68 15653 1 . ASN 69 69 15653 1 . LYS 70 70 15653 1 . ARG 71 71 15653 1 . ALA 72 72 15653 1 . LEU 73 73 15653 1 . ILE 74 74 15653 1 . GLN 75 75 15653 1 . CYS 76 76 15653 1 . ALA 77 77 15653 1 . LYS 78 78 15653 1 . ASP 79 79 15653 1 . ILE 80 80 15653 1 . ALA 81 81 15653 1 . LYS 82 82 15653 1 . ALA 83 83 15653 1 . SER 84 84 15653 1 . ASP 85 85 15653 1 . GLU 86 86 15653 1 . VAL 87 87 15653 1 . THR 88 88 15653 1 . ARG 89 89 15653 1 . LEU 90 90 15653 1 . ALA 91 91 15653 1 . LYS 92 92 15653 1 . GLU 93 93 15653 1 . VAL 94 94 15653 1 . ALA 95 95 15653 1 . LYS 96 96 15653 1 . GLN 97 97 15653 1 . CYS 98 98 15653 1 . THR 99 99 15653 1 . ASP 100 100 15653 1 . LYS 101 101 15653 1 . ARG 102 102 15653 1 . ILE 103 103 15653 1 . ARG 104 104 15653 1 . THR 105 105 15653 1 . ASN 106 106 15653 1 . LEU 107 107 15653 1 . LEU 108 108 15653 1 . GLN 109 109 15653 1 . VAL 110 110 15653 1 . CYS 111 111 15653 1 . GLU 112 112 15653 1 . ARG 113 113 15653 1 . ILE 114 114 15653 1 . PRO 115 115 15653 1 . THR 116 116 15653 1 . ILE 117 117 15653 1 . SER 118 118 15653 1 . THR 119 119 15653 1 . GLN 120 120 15653 1 . LEU 121 121 15653 1 . LYS 122 122 15653 1 . ILE 123 123 15653 1 . LEU 124 124 15653 1 . SER 125 125 15653 1 . THR 126 126 15653 1 . VAL 127 127 15653 1 . LYS 128 128 15653 1 . ALA 129 129 15653 1 . THR 130 130 15653 1 . MET 131 131 15653 1 . LEU 132 132 15653 1 . GLY 133 133 15653 1 . ARG 134 134 15653 1 . THR 135 135 15653 1 . ASN 136 136 15653 1 . ILE 137 137 15653 1 . SER 138 138 15653 1 . ASP 139 139 15653 1 . GLU 140 140 15653 1 . GLU 141 141 15653 1 . SER 142 142 15653 1 . GLU 143 143 15653 1 . GLN 144 144 15653 1 . ALA 145 145 15653 1 . THR 146 146 15653 1 . GLU 147 147 15653 1 . MET 148 148 15653 1 . LEU 149 149 15653 1 . VAL 150 150 15653 1 . HIS 151 151 15653 1 . ASN 152 152 15653 1 . ALA 153 153 15653 1 . GLN 154 154 15653 1 . ASN 155 155 15653 1 . LEU 156 156 15653 1 . MET 157 157 15653 1 . GLN 158 158 15653 1 . SER 159 159 15653 1 . VAL 160 160 15653 1 . LYS 161 161 15653 1 . GLU 162 162 15653 1 . THR 163 163 15653 1 . VAL 164 164 15653 1 . ARG 165 165 15653 1 . GLU 166 166 15653 1 . ALA 167 167 15653 1 . GLU 168 168 15653 1 . ALA 169 169 15653 1 . ALA 170 170 15653 1 . SER 171 171 15653 1 . ILE 172 172 15653 1 . LYS 173 173 15653 1 . ILE 174 174 15653 1 . ARG 175 175 15653 1 . THR 176 176 15653 1 . ASP 177 177 15653 1 . ALA 178 178 15653 1 . GLY 179 179 15653 1 . PHE 180 180 15653 1 . THR 181 181 15653 1 . LEU 182 182 15653 1 . ARG 183 183 15653 1 . TRP 184 184 15653 1 . VAL 185 185 15653 1 . ARG 186 186 15653 1 . LYS 187 187 15653 1 . THR 188 188 15653 1 . PRO 189 189 15653 1 . TRP 190 190 15653 1 . TYR 191 191 15653 1 . GLN 192 192 15653 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 15653 _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 $Vinculin_Tail . 9031 organism . 'Gallus gallus' chicken . . Eukaryota Metazoa Gallus gallus . . . . . . . . . . . . . . . . vinculin . . . . 15653 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 15653 _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 $Vinculin_Tail . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli 'BL21 DE3' . . . . . . . . . . . . . . . 'pET 15b' . . . . . . 15653 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 15653 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Vinculin tail was uniformly 13C, 15N, and 2H labeled. Exchangeable protons were back exchanged to 1H by denaturation in H2O.' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Vinculin Tail' '[U-13C; U-15N; U-2H]' . . 1 $Vinculin_Tail . . 0.3 . . mM . . . . 15653 1 2 'potassium phosphate' 'natural abundance' . . . . . . 10 . . mM . . . . 15653 1 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 15653 1 4 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 15653 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 15653 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Vinculin Tail' '[U-13C; U-15N]' . . 1 $Vinculin_Tail . . 0.3 . . mM . . . . 15653 2 2 'potassium phosphate' 'natural abundance' . . . . . . 10 . . mM . . . . 15653 2 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 15653 2 4 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 15653 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 15653 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details '15N isotopic labeling for Leu only. All other amino acids at natural abundance.' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Vinculin Tail' [U-15N]-Leu . . 1 $Vinculin_Tail . . 0.3 . . mM . . . . 15653 3 2 'potassium phosphate' 'natural abundance' . . . . . . 10 . . mM . . . . 15653 3 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 15653 3 4 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 15653 3 stop_ save_ save_sample_4 _Sample.Sf_category sample _Sample.Sf_framecode sample_4 _Sample.Entry_ID 15653 _Sample.ID 4 _Sample.Type solution _Sample.Sub_type . _Sample.Details '15N isotopic labeling for Met only. All other amino acids at natural abundance.' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Vinculin Tail' [U-15N]-Met . . 1 $Vinculin_Tail . . 0.3 . . mM . . . . 15653 4 2 'potassium phosphate' 'natural abundance' . . . . . . 10 . . mM . . . . 15653 4 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 15653 4 4 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 15653 4 stop_ save_ save_sample_5 _Sample.Sf_category sample _Sample.Sf_framecode sample_5 _Sample.Entry_ID 15653 _Sample.ID 5 _Sample.Type solution _Sample.Sub_type . _Sample.Details 'Uniform 15N isotopic labeling except Lys at natural abundance.' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Vinculin Tail' '[U-15N; NA-Lys]' . . 1 $Vinculin_Tail . . 0.3 . . mM . . . . 15653 5 2 'potassium phosphate' 'natural abundance' . . . . . . 10 . . mM . . . . 15653 5 3 'sodium chloride' 'natural abundance' . . . . . . 50 . . mM . . . . 15653 5 4 DTT 'natural abundance' . . . . . . 2 . . mM . . . . 15653 5 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 15653 _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 5.5 . pH 15653 1 pressure 1 . atm 15653 1 temperature 310 . K 15653 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRView _Software.Sf_category software _Software.Sf_framecode NMRView _Software.Entry_ID 15653 _Software.ID 1 _Software.Name NMRView _Software.Version 5.2.2.01 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Johnson, One Moon Scientific' . . 15653 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 15653 1 'peak picking' 15653 1 stop_ save_ save_NMRPipe_NMRDraw _Software.Sf_category software _Software.Sf_framecode NMRPipe_NMRDraw _Software.Entry_ID 15653 _Software.ID 2 _Software.Name NMRPipe/NMRDraw _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 15653 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID processing 15653 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 15653 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 500 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 15653 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_3 _NMR_spectrometer.Entry_ID 15653 _NMR_spectrometer.ID 3 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_4 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_4 _NMR_spectrometer.Entry_ID 15653 _NMR_spectrometer.ID 4 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Varian _NMR_spectrometer.Model INOVA _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 800 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 15653 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Varian INOVA . 500 . . . 15653 1 2 spectrometer_2 Varian INOVA . 600 . . . 15653 1 3 spectrometer_3 Varian INOVA . 700 . . . 15653 1 4 spectrometer_4 Varian INOVA . 800 . . . 15653 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 15653 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 15653 1 2 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 15653 1 3 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $spectrometer_4 . . . . . . . . . . . . . . . . 15653 1 4 '3D HN(CO)CA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 15653 1 5 '3D HN(CO)CACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 15653 1 6 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 3 $spectrometer_3 . . . . . . . . . . . . . . . . 15653 1 7 '3D HN(CA)CB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 4 $spectrometer_4 . . . . . . . . . . . . . . . . 15653 1 8 '2D 1H-15N HSQC' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15653 1 9 '2D 1H-15N HSQC' no . . . . . . . . . . 4 $sample_4 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 15653 1 10 '2D 1H-15N HSQC' no . . . . . . . . . . 5 $sample_5 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 15653 1 11 '3D 1H-15N NOESY' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 4 $spectrometer_4 . . . . . . . . . . . . . . . . 15653 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chemical_shift_reference_1 _Chem_shift_reference.Entry_ID 15653 _Chem_shift_reference.ID 1 _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Indirect_shift_ratio_cit_ID _Chem_shift_ref.Indirect_shift_ratio_cit_label _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Correction_val_cit_ID _Chem_shift_ref.Correction_val_cit_label _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.251449530 . . . . . . . . . 15653 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 15653 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 . indirect 0.101329118 . . . . . . . . . 15653 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15653 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 15653 1 2 '3D HNCO' . . . 15653 1 3 '3D HNCACB' . . . 15653 1 4 '3D HN(CO)CA' . . . 15653 1 5 '3D HN(CO)CACB' . . . 15653 1 6 '3D HN(CA)CO' . . . 15653 1 7 '3D HN(CA)CB' . . . 15653 1 8 '2D 1H-15N HSQC' . . . 15653 1 9 '2D 1H-15N HSQC' . . . 15653 1 10 '2D 1H-15N HSQC' . . . 15653 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $NMRView . . 15653 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 6 6 GLU CA C 13 56.445 0.2 . 1 . . . . 6 GLU CA . 15653 1 2 . 1 1 6 6 GLU CB C 13 30.248 0.2 . 1 . . . . 6 GLU CB . 15653 1 3 . 1 1 7 7 LYS H H 1 8.243 0.02 . 1 . . . . 7 LYS HN . 15653 1 4 . 1 1 7 7 LYS C C 13 176.365 0.2 . 1 . . . . 7 LYS C . 15653 1 5 . 1 1 7 7 LYS CA C 13 56.535 0.2 . 1 . . . . 7 LYS CA . 15653 1 6 . 1 1 7 7 LYS CB C 13 33.051 0.2 . 1 . . . . 7 LYS CB . 15653 1 7 . 1 1 7 7 LYS N N 15 123.381 0.1 . 1 . . . . 7 LYS N . 15653 1 8 . 1 1 8 8 ASP H H 1 8.386 0.02 . 1 . . . . 8 ASP HN . 15653 1 9 . 1 1 8 8 ASP C C 13 175.989 0.2 . 1 . . . . 8 ASP C . 15653 1 10 . 1 1 8 8 ASP CA C 13 55.036 0.2 . 1 . . . . 8 ASP CA . 15653 1 11 . 1 1 8 8 ASP CB C 13 40.793 0.2 . 1 . . . . 8 ASP CB . 15653 1 12 . 1 1 8 8 ASP N N 15 121.584 0.1 . 1 . . . . 8 ASP N . 15653 1 13 . 1 1 9 9 GLU H H 1 8.145 0.02 . 1 . . . . 9 GLU HN . 15653 1 14 . 1 1 9 9 GLU C C 13 176.523 0.2 . 1 . . . . 9 GLU C . 15653 1 15 . 1 1 9 9 GLU CA C 13 57.020 0.2 . 1 . . . . 9 GLU CA . 15653 1 16 . 1 1 9 9 GLU CB C 13 30.245 0.2 . 1 . . . . 9 GLU CB . 15653 1 17 . 1 1 9 9 GLU N N 15 120.177 0.1 . 1 . . . . 9 GLU N . 15653 1 18 . 1 1 10 10 GLU H H 1 8.128 0.02 . 1 . . . . 10 GLU HN . 15653 1 19 . 1 1 10 10 GLU C C 13 175.108 0.2 . 1 . . . . 10 GLU C . 15653 1 20 . 1 1 10 10 GLU CA C 13 55.735 0.2 . 1 . . . . 10 GLU CA . 15653 1 21 . 1 1 10 10 GLU CB C 13 30.389 0.2 . 1 . . . . 10 GLU CB . 15653 1 22 . 1 1 10 10 GLU N N 15 121.522 0.1 . 1 . . . . 10 GLU N . 15653 1 23 . 1 1 11 11 PHE H H 1 8.574 0.02 . 1 . . . . 11 PHE HN . 15653 1 24 . 1 1 11 11 PHE C C 13 174.315 0.2 . 1 . . . . 11 PHE C . 15653 1 25 . 1 1 11 11 PHE CA C 13 56.178 0.2 . 1 . . . . 11 PHE CA . 15653 1 26 . 1 1 11 11 PHE CB C 13 39.837 0.2 . 1 . . . . 11 PHE CB . 15653 1 27 . 1 1 11 11 PHE N N 15 126.961 0.1 . 1 . . . . 11 PHE N . 15653 1 28 . 1 1 12 12 PRO C C 13 175.423 0.2 . 1 . . . . 12 PRO C . 15653 1 29 . 1 1 12 12 PRO CA C 13 62.551 0.2 . 1 . . . . 12 PRO CA . 15653 1 30 . 1 1 12 12 PRO CB C 13 30.260 0.2 . 1 . . . . 12 PRO CB . 15653 1 31 . 1 1 13 13 GLU H H 1 7.967 0.02 . 1 . . . . 13 GLU HN . 15653 1 32 . 1 1 13 13 GLU C C 13 176.236 0.2 . 1 . . . . 13 GLU C . 15653 1 33 . 1 1 13 13 GLU CA C 13 56.077 0.2 . 1 . . . . 13 GLU CA . 15653 1 34 . 1 1 13 13 GLU CB C 13 30.531 0.2 . 1 . . . . 13 GLU CB . 15653 1 35 . 1 1 13 13 GLU N N 15 124.276 0.1 . 1 . . . . 13 GLU N . 15653 1 36 . 1 1 14 14 GLN H H 1 8.588 0.02 . 1 . . . . 14 GLN HN . 15653 1 37 . 1 1 14 14 GLN C C 13 175.669 0.2 . 1 . . . . 14 GLN C . 15653 1 38 . 1 1 14 14 GLN CA C 13 56.258 0.2 . 1 . . . . 14 GLN CA . 15653 1 39 . 1 1 14 14 GLN CB C 13 29.057 0.2 . 1 . . . . 14 GLN CB . 15653 1 40 . 1 1 14 14 GLN N N 15 123.236 0.1 . 1 . . . . 14 GLN N . 15653 1 41 . 1 1 15 15 LYS H H 1 8.849 0.02 . 1 . . . . 15 LYS HN . 15653 1 42 . 1 1 15 15 LYS C C 13 176.804 0.2 . 1 . . . . 15 LYS C . 15653 1 43 . 1 1 15 15 LYS CA C 13 55.257 0.2 . 1 . . . . 15 LYS CA . 15653 1 44 . 1 1 15 15 LYS CB C 13 33.452 0.2 . 1 . . . . 15 LYS CB . 15653 1 45 . 1 1 15 15 LYS N N 15 127.286 0.1 . 1 . . . . 15 LYS N . 15653 1 46 . 1 1 16 16 ALA H H 1 8.413 0.02 . 1 . . . . 16 ALA HN . 15653 1 47 . 1 1 16 16 ALA C C 13 179.053 0.2 . 1 . . . . 16 ALA C . 15653 1 48 . 1 1 16 16 ALA CA C 13 53.870 0.2 . 1 . . . . 16 ALA CA . 15653 1 49 . 1 1 16 16 ALA CB C 13 17.872 0.2 . 1 . . . . 16 ALA CB . 15653 1 50 . 1 1 16 16 ALA N N 15 126.210 0.1 . 1 . . . . 16 ALA N . 15653 1 51 . 1 1 17 17 GLY H H 1 8.593 0.02 . 1 . . . . 17 GLY HN . 15653 1 52 . 1 1 17 17 GLY C C 13 174.391 0.2 . 1 . . . . 17 GLY C . 15653 1 53 . 1 1 17 17 GLY CA C 13 45.708 0.2 . 1 . . . . 17 GLY CA . 15653 1 54 . 1 1 17 17 GLY N N 15 111.206 0.1 . 1 . . . . 17 GLY N . 15653 1 55 . 1 1 18 18 GLU H H 1 7.595 0.02 . 1 . . . . 18 GLU HN . 15653 1 56 . 1 1 18 18 GLU C C 13 175.732 0.2 . 1 . . . . 18 GLU C . 15653 1 57 . 1 1 18 18 GLU CA C 13 56.556 0.2 . 1 . . . . 18 GLU CA . 15653 1 58 . 1 1 18 18 GLU CB C 13 31.070 0.2 . 1 . . . . 18 GLU CB . 15653 1 59 . 1 1 18 18 GLU N N 15 121.345 0.1 . 1 . . . . 18 GLU N . 15653 1 60 . 1 1 19 19 ALA H H 1 8.494 0.02 . 1 . . . . 19 ALA HN . 15653 1 61 . 1 1 19 19 ALA C C 13 175.808 0.2 . 1 . . . . 19 ALA C . 15653 1 62 . 1 1 19 19 ALA CA C 13 52.266 0.2 . 1 . . . . 19 ALA CA . 15653 1 63 . 1 1 19 19 ALA CB C 13 18.386 0.2 . 1 . . . . 19 ALA CB . 15653 1 64 . 1 1 19 19 ALA N N 15 129.320 0.1 . 1 . . . . 19 ALA N . 15653 1 65 . 1 1 20 20 ILE H H 1 7.813 0.02 . 1 . . . . 20 ILE HN . 15653 1 66 . 1 1 20 20 ILE C C 13 175.489 0.2 . 1 . . . . 20 ILE C . 15653 1 67 . 1 1 20 20 ILE CA C 13 59.429 0.2 . 1 . . . . 20 ILE CA . 15653 1 68 . 1 1 20 20 ILE CB C 13 42.448 0.2 . 1 . . . . 20 ILE CB . 15653 1 69 . 1 1 20 20 ILE N N 15 117.908 0.1 . 1 . . . . 20 ILE N . 15653 1 70 . 1 1 21 21 ASN H H 1 8.343 0.02 . 1 . . . . 21 ASN HN . 15653 1 71 . 1 1 21 21 ASN C C 13 173.882 0.2 . 1 . . . . 21 ASN C . 15653 1 72 . 1 1 21 21 ASN CA C 13 54.436 0.2 . 1 . . . . 21 ASN CA . 15653 1 73 . 1 1 21 21 ASN CB C 13 39.843 0.2 . 1 . . . . 21 ASN CB . 15653 1 74 . 1 1 21 21 ASN N N 15 123.336 0.1 . 1 . . . . 21 ASN N . 15653 1 75 . 1 1 22 22 GLN H H 1 9.138 0.02 . 1 . . . . 22 GLN HN . 15653 1 76 . 1 1 22 22 GLN CA C 13 60.708 0.2 . 1 . . . . 22 GLN CA . 15653 1 77 . 1 1 22 22 GLN CB C 13 25.752 0.2 . 1 . . . . 22 GLN CB . 15653 1 78 . 1 1 22 22 GLN N N 15 129.547 0.1 . 1 . . . . 22 GLN N . 15653 1 79 . 1 1 25 25 MET C C 13 178.364 0.2 . 1 . . . . 25 MET C . 15653 1 80 . 1 1 25 25 MET CA C 13 58.372 0.2 . 1 . . . . 25 MET CA . 15653 1 81 . 1 1 25 25 MET CB C 13 31.614 0.2 . 1 . . . . 25 MET CB . 15653 1 82 . 1 1 26 26 MET H H 1 8.784 0.02 . 1 . . . . 26 MET HN . 15653 1 83 . 1 1 26 26 MET C C 13 178.719 0.2 . 1 . . . . 26 MET C . 15653 1 84 . 1 1 26 26 MET CA C 13 58.396 0.2 . 1 . . . . 26 MET CA . 15653 1 85 . 1 1 26 26 MET N N 15 118.760 0.1 . 1 . . . . 26 MET N . 15653 1 86 . 1 1 27 27 ALA H H 1 7.688 0.02 . 1 . . . . 27 ALA HN . 15653 1 87 . 1 1 27 27 ALA C C 13 179.530 0.2 . 1 . . . . 27 ALA C . 15653 1 88 . 1 1 27 27 ALA CA C 13 54.996 0.2 . 1 . . . . 27 ALA CA . 15653 1 89 . 1 1 27 27 ALA CB C 13 17.710 0.2 . 1 . . . . 27 ALA CB . 15653 1 90 . 1 1 27 27 ALA N N 15 122.639 0.1 . 1 . . . . 27 ALA N . 15653 1 91 . 1 1 28 28 ALA H H 1 8.030 0.02 . 1 . . . . 28 ALA HN . 15653 1 92 . 1 1 28 28 ALA C C 13 179.349 0.2 . 1 . . . . 28 ALA C . 15653 1 93 . 1 1 28 28 ALA CA C 13 55.520 0.2 . 1 . . . . 28 ALA CA . 15653 1 94 . 1 1 28 28 ALA CB C 13 17.867 0.2 . 1 . . . . 28 ALA CB . 15653 1 95 . 1 1 28 28 ALA N N 15 122.156 0.1 . 1 . . . . 28 ALA N . 15653 1 96 . 1 1 29 29 ARG H H 1 8.608 0.02 . 1 . . . . 29 ARG HN . 15653 1 97 . 1 1 29 29 ARG C C 13 177.901 0.2 . 1 . . . . 29 ARG C . 15653 1 98 . 1 1 29 29 ARG CA C 13 58.943 0.2 . 1 . . . . 29 ARG CA . 15653 1 99 . 1 1 29 29 ARG N N 15 120.389 0.1 . 1 . . . . 29 ARG N . 15653 1 100 . 1 1 40 40 SER C C 13 175.014 0.2 . 1 . . . . 40 SER C . 15653 1 101 . 1 1 40 40 SER CA C 13 59.369 0.2 . 1 . . . . 40 SER CA . 15653 1 102 . 1 1 40 40 SER CB C 13 64.550 0.2 . 1 . . . . 40 SER CB . 15653 1 103 . 1 1 41 41 LYS H H 1 8.206 0.02 . 1 . . . . 41 LYS HN . 15653 1 104 . 1 1 41 41 LYS C C 13 177.023 0.2 . 1 . . . . 41 LYS C . 15653 1 105 . 1 1 41 41 LYS CA C 13 57.844 0.2 . 1 . . . . 41 LYS CA . 15653 1 106 . 1 1 41 41 LYS CB C 13 30.621 0.2 . 1 . . . . 41 LYS CB . 15653 1 107 . 1 1 41 41 LYS N N 15 125.786 0.1 . 1 . . . . 41 LYS N . 15653 1 108 . 1 1 42 42 GLY H H 1 8.780 0.02 . 1 . . . . 42 GLY HN . 15653 1 109 . 1 1 42 42 GLY C C 13 174.655 0.2 . 1 . . . . 42 GLY C . 15653 1 110 . 1 1 42 42 GLY CA C 13 46.408 0.2 . 1 . . . . 42 GLY CA . 15653 1 111 . 1 1 42 42 GLY N N 15 115.005 0.1 . 1 . . . . 42 GLY N . 15653 1 112 . 1 1 43 43 ASN H H 1 7.714 0.02 . 1 . . . . 43 ASN HN . 15653 1 113 . 1 1 43 43 ASN C C 13 173.944 0.2 . 1 . . . . 43 ASN C . 15653 1 114 . 1 1 43 43 ASN CA C 13 52.374 0.2 . 1 . . . . 43 ASN CA . 15653 1 115 . 1 1 43 43 ASN CB C 13 37.272 0.2 . 1 . . . . 43 ASN CB . 15653 1 116 . 1 1 43 43 ASN N N 15 118.325 0.1 . 1 . . . . 43 ASN N . 15653 1 117 . 1 1 45 45 ILE C C 13 176.524 0.2 . 1 . . . . 45 ILE C . 15653 1 118 . 1 1 45 45 ILE CA C 13 66.602 0.2 . 1 . . . . 45 ILE CA . 15653 1 119 . 1 1 45 45 ILE CB C 13 36.939 0.2 . 1 . . . . 45 ILE CB . 15653 1 120 . 1 1 46 46 ILE H H 1 7.273 0.02 . 1 . . . . 46 ILE HN . 15653 1 121 . 1 1 46 46 ILE C C 13 176.412 0.2 . 1 . . . . 46 ILE C . 15653 1 122 . 1 1 46 46 ILE CA C 13 61.024 0.2 . 1 . . . . 46 ILE CA . 15653 1 123 . 1 1 46 46 ILE CB C 13 35.069 0.2 . 1 . . . . 46 ILE CB . 15653 1 124 . 1 1 46 46 ILE N N 15 121.868 0.1 . 1 . . . . 46 ILE N . 15653 1 125 . 1 1 47 47 ALA H H 1 7.912 0.02 . 1 . . . . 47 ALA HN . 15653 1 126 . 1 1 47 47 ALA C C 13 180.653 0.2 . 1 . . . . 47 ALA C . 15653 1 127 . 1 1 47 47 ALA CA C 13 55.999 0.2 . 1 . . . . 47 ALA CA . 15653 1 128 . 1 1 47 47 ALA CB C 13 18.681 0.2 . 1 . . . . 47 ALA CB . 15653 1 129 . 1 1 47 47 ALA N N 15 121.343 0.1 . 1 . . . . 47 ALA N . 15653 1 130 . 1 1 48 48 ALA H H 1 7.762 0.02 . 1 . . . . 48 ALA HN . 15653 1 131 . 1 1 48 48 ALA C C 13 179.342 0.2 . 1 . . . . 48 ALA C . 15653 1 132 . 1 1 48 48 ALA CA C 13 55.405 0.2 . 1 . . . . 48 ALA CA . 15653 1 133 . 1 1 48 48 ALA CB C 13 18.297 0.2 . 1 . . . . 48 ALA CB . 15653 1 134 . 1 1 48 48 ALA N N 15 121.213 0.1 . 1 . . . . 48 ALA N . 15653 1 135 . 1 1 49 49 ALA C C 13 179.356 0.2 . 1 . . . . 49 ALA C . 15653 1 136 . 1 1 49 49 ALA CA C 13 55.683 0.2 . 1 . . . . 49 ALA CA . 15653 1 137 . 1 1 49 49 ALA CB C 13 18.056 0.2 . 1 . . . . 49 ALA CB . 15653 1 138 . 1 1 50 50 LYS H H 1 8.319 0.02 . 1 . . . . 50 LYS HN . 15653 1 139 . 1 1 50 50 LYS C C 13 178.741 0.2 . 1 . . . . 50 LYS C . 15653 1 140 . 1 1 50 50 LYS CA C 13 61.067 0.2 . 1 . . . . 50 LYS CA . 15653 1 141 . 1 1 50 50 LYS CB C 13 32.924 0.2 . 1 . . . . 50 LYS CB . 15653 1 142 . 1 1 50 50 LYS N N 15 116.989 0.1 . 1 . . . . 50 LYS N . 15653 1 143 . 1 1 51 51 ARG H H 1 7.594 0.02 . 1 . . . . 51 ARG HN . 15653 1 144 . 1 1 51 51 ARG C C 13 178.803 0.2 . 1 . . . . 51 ARG C . 15653 1 145 . 1 1 51 51 ARG CA C 13 59.543 0.2 . 1 . . . . 51 ARG CA . 15653 1 146 . 1 1 51 51 ARG CB C 13 30.267 0.2 . 1 . . . . 51 ARG CB . 15653 1 147 . 1 1 51 51 ARG N N 15 119.096 0.1 . 1 . . . . 51 ARG N . 15653 1 148 . 1 1 52 52 MET H H 1 8.767 0.02 . 1 . . . . 52 MET HN . 15653 1 149 . 1 1 52 52 MET C C 13 177.605 0.2 . 1 . . . . 52 MET C . 15653 1 150 . 1 1 52 52 MET CA C 13 59.920 0.2 . 1 . . . . 52 MET CA . 15653 1 151 . 1 1 52 52 MET CB C 13 33.681 0.2 . 1 . . . . 52 MET CB . 15653 1 152 . 1 1 52 52 MET N N 15 118.147 0.1 . 1 . . . . 52 MET N . 15653 1 153 . 1 1 53 53 ALA H H 1 8.161 0.02 . 1 . . . . 53 ALA HN . 15653 1 154 . 1 1 53 53 ALA C C 13 179.202 0.2 . 1 . . . . 53 ALA C . 15653 1 155 . 1 1 53 53 ALA CA C 13 55.916 0.2 . 1 . . . . 53 ALA CA . 15653 1 156 . 1 1 53 53 ALA CB C 13 18.389 0.2 . 1 . . . . 53 ALA CB . 15653 1 157 . 1 1 53 53 ALA N N 15 121.593 0.1 . 1 . . . . 53 ALA N . 15653 1 158 . 1 1 54 54 LEU H H 1 7.687 0.02 . 1 . . . . 54 LEU HN . 15653 1 159 . 1 1 54 54 LEU C C 13 180.904 0.2 . 1 . . . . 54 LEU C . 15653 1 160 . 1 1 54 54 LEU CA C 13 58.514 0.2 . 1 . . . . 54 LEU CA . 15653 1 161 . 1 1 54 54 LEU CB C 13 40.470 0.2 . 1 . . . . 54 LEU CB . 15653 1 162 . 1 1 54 54 LEU N N 15 118.811 0.1 . 1 . . . . 54 LEU N . 15653 1 163 . 1 1 55 55 LEU H H 1 8.400 0.02 . 1 . . . . 55 LEU HN . 15653 1 164 . 1 1 55 55 LEU C C 13 179.203 0.2 . 1 . . . . 55 LEU C . 15653 1 165 . 1 1 55 55 LEU CA C 13 58.105 0.2 . 1 . . . . 55 LEU CA . 15653 1 166 . 1 1 55 55 LEU CB C 13 42.629 0.2 . 1 . . . . 55 LEU CB . 15653 1 167 . 1 1 55 55 LEU N N 15 122.485 0.1 . 1 . . . . 55 LEU N . 15653 1 168 . 1 1 56 56 MET H H 1 8.491 0.02 . 1 . . . . 56 MET HN . 15653 1 169 . 1 1 56 56 MET C C 13 178.104 0.2 . 1 . . . . 56 MET C . 15653 1 170 . 1 1 56 56 MET CA C 13 56.913 0.2 . 1 . . . . 56 MET CA . 15653 1 171 . 1 1 56 56 MET CB C 13 30.546 0.2 . 1 . . . . 56 MET CB . 15653 1 172 . 1 1 56 56 MET N N 15 120.726 0.1 . 1 . . . . 56 MET N . 15653 1 173 . 1 1 57 57 ALA H H 1 8.026 0.02 . 1 . . . . 57 ALA HN . 15653 1 174 . 1 1 57 57 ALA C C 13 180.682 0.2 . 1 . . . . 57 ALA C . 15653 1 175 . 1 1 57 57 ALA CA C 13 55.215 0.2 . 1 . . . . 57 ALA CA . 15653 1 176 . 1 1 57 57 ALA CB C 13 17.924 0.2 . 1 . . . . 57 ALA CB . 15653 1 177 . 1 1 57 57 ALA N N 15 124.267 0.1 . 1 . . . . 57 ALA N . 15653 1 178 . 1 1 58 58 GLU H H 1 7.592 0.02 . 1 . . . . 58 GLU HN . 15653 1 179 . 1 1 58 58 GLU C C 13 179.610 0.2 . 1 . . . . 58 GLU C . 15653 1 180 . 1 1 58 58 GLU CA C 13 59.244 0.2 . 1 . . . . 58 GLU CA . 15653 1 181 . 1 1 58 58 GLU CB C 13 28.117 0.2 . 1 . . . . 58 GLU CB . 15653 1 182 . 1 1 58 58 GLU N N 15 121.131 0.1 . 1 . . . . 58 GLU N . 15653 1 183 . 1 1 59 59 MET H H 1 8.865 0.02 . 1 . . . . 59 MET HN . 15653 1 184 . 1 1 59 59 MET C C 13 177.479 0.2 . 1 . . . . 59 MET C . 15653 1 185 . 1 1 59 59 MET CA C 13 60.700 0.2 . 1 . . . . 59 MET CA . 15653 1 186 . 1 1 59 59 MET CB C 13 32.449 0.2 . 1 . . . . 59 MET CB . 15653 1 187 . 1 1 59 59 MET N N 15 123.795 0.1 . 1 . . . . 59 MET N . 15653 1 188 . 1 1 60 60 SER H H 1 8.014 0.02 . 1 . . . . 60 SER HN . 15653 1 189 . 1 1 60 60 SER C C 13 175.221 0.2 . 1 . . . . 60 SER C . 15653 1 190 . 1 1 60 60 SER CA C 13 62.343 0.2 . 1 . . . . 60 SER CA . 15653 1 191 . 1 1 60 60 SER CB C 13 63.030 0.2 . 1 . . . . 60 SER CB . 15653 1 192 . 1 1 60 60 SER N N 15 113.871 0.1 . 1 . . . . 60 SER N . 15653 1 193 . 1 1 61 61 ARG H H 1 7.233 0.02 . 1 . . . . 61 ARG HN . 15653 1 194 . 1 1 61 61 ARG C C 13 179.380 0.2 . 1 . . . . 61 ARG C . 15653 1 195 . 1 1 61 61 ARG CA C 13 58.244 0.2 . 1 . . . . 61 ARG CA . 15653 1 196 . 1 1 61 61 ARG CB C 13 30.919 0.2 . 1 . . . . 61 ARG CB . 15653 1 197 . 1 1 61 61 ARG N N 15 120.533 0.1 . 1 . . . . 61 ARG N . 15653 1 198 . 1 1 62 62 LEU H H 1 8.356 0.02 . 1 . . . . 62 LEU HN . 15653 1 199 . 1 1 62 62 LEU C C 13 180.310 0.2 . 1 . . . . 62 LEU C . 15653 1 200 . 1 1 62 62 LEU CA C 13 57.487 0.2 . 1 . . . . 62 LEU CA . 15653 1 201 . 1 1 62 62 LEU CB C 13 43.980 0.2 . 1 . . . . 62 LEU CB . 15653 1 202 . 1 1 62 62 LEU N N 15 121.590 0.1 . 1 . . . . 62 LEU N . 15653 1 203 . 1 1 63 63 VAL H H 1 7.919 0.02 . 1 . . . . 63 VAL HN . 15653 1 204 . 1 1 63 63 VAL C C 13 175.223 0.2 . 1 . . . . 63 VAL C . 15653 1 205 . 1 1 63 63 VAL CA C 13 64.156 0.2 . 1 . . . . 63 VAL CA . 15653 1 206 . 1 1 63 63 VAL CB C 13 31.580 0.2 . 1 . . . . 63 VAL CB . 15653 1 207 . 1 1 63 63 VAL N N 15 110.299 0.1 . 1 . . . . 63 VAL N . 15653 1 208 . 1 1 64 64 ARG H H 1 7.172 0.02 . 1 . . . . 64 ARG HN . 15653 1 209 . 1 1 64 64 ARG C C 13 176.401 0.2 . 1 . . . . 64 ARG C . 15653 1 210 . 1 1 64 64 ARG CA C 13 54.508 0.2 . 1 . . . . 64 ARG CA . 15653 1 211 . 1 1 64 64 ARG CB C 13 29.282 0.2 . 1 . . . . 64 ARG CB . 15653 1 212 . 1 1 64 64 ARG N N 15 118.565 0.1 . 1 . . . . 64 ARG N . 15653 1 213 . 1 1 65 65 GLY H H 1 7.426 0.02 . 1 . . . . 65 GLY HN . 15653 1 214 . 1 1 65 65 GLY C C 13 173.064 0.2 . 1 . . . . 65 GLY C . 15653 1 215 . 1 1 65 65 GLY CA C 13 44.889 0.2 . 1 . . . . 65 GLY CA . 15653 1 216 . 1 1 65 65 GLY N N 15 107.408 0.1 . 1 . . . . 65 GLY N . 15653 1 217 . 1 1 66 66 GLY H H 1 8.002 0.02 . 1 . . . . 66 GLY HN . 15653 1 218 . 1 1 66 66 GLY C C 13 175.176 0.2 . 1 . . . . 66 GLY C . 15653 1 219 . 1 1 66 66 GLY CA C 13 44.472 0.2 . 1 . . . . 66 GLY CA . 15653 1 220 . 1 1 66 66 GLY N N 15 106.150 0.1 . 1 . . . . 66 GLY N . 15653 1 221 . 1 1 67 67 SER H H 1 8.657 0.02 . 1 . . . . 67 SER HN . 15653 1 222 . 1 1 67 67 SER C C 13 176.751 0.2 . 1 . . . . 67 SER C . 15653 1 223 . 1 1 67 67 SER CA C 13 61.224 0.2 . 1 . . . . 67 SER CA . 15653 1 224 . 1 1 67 67 SER CB C 13 63.043 0.2 . 1 . . . . 67 SER CB . 15653 1 225 . 1 1 67 67 SER N N 15 115.471 0.1 . 1 . . . . 67 SER N . 15653 1 226 . 1 1 68 68 GLY H H 1 8.815 0.02 . 1 . . . . 68 GLY HN . 15653 1 227 . 1 1 68 68 GLY C C 13 174.998 0.2 . 1 . . . . 68 GLY C . 15653 1 228 . 1 1 68 68 GLY CA C 13 46.312 0.2 . 1 . . . . 68 GLY CA . 15653 1 229 . 1 1 68 68 GLY N N 15 111.012 0.1 . 1 . . . . 68 GLY N . 15653 1 230 . 1 1 69 69 ASN H H 1 7.989 0.02 . 1 . . . . 69 ASN HN . 15653 1 231 . 1 1 69 69 ASN C C 13 174.975 0.2 . 1 . . . . 69 ASN C . 15653 1 232 . 1 1 69 69 ASN CA C 13 53.174 0.2 . 1 . . . . 69 ASN CA . 15653 1 233 . 1 1 69 69 ASN CB C 13 39.193 0.2 . 1 . . . . 69 ASN CB . 15653 1 234 . 1 1 69 69 ASN N N 15 118.556 0.1 . 1 . . . . 69 ASN N . 15653 1 235 . 1 1 70 70 LYS H H 1 7.478 0.02 . 1 . . . . 70 LYS HN . 15653 1 236 . 1 1 70 70 LYS C C 13 176.861 0.2 . 1 . . . . 70 LYS C . 15653 1 237 . 1 1 70 70 LYS CA C 13 61.358 0.2 . 1 . . . . 70 LYS CA . 15653 1 238 . 1 1 70 70 LYS CB C 13 32.507 0.2 . 1 . . . . 70 LYS CB . 15653 1 239 . 1 1 70 70 LYS N N 15 121.827 0.1 . 1 . . . . 70 LYS N . 15653 1 240 . 1 1 71 71 ARG H H 1 8.185 0.02 . 1 . . . . 71 ARG HN . 15653 1 241 . 1 1 71 71 ARG C C 13 179.193 0.2 . 1 . . . . 71 ARG C . 15653 1 242 . 1 1 71 71 ARG CA C 13 59.525 0.2 . 1 . . . . 71 ARG CA . 15653 1 243 . 1 1 71 71 ARG CB C 13 29.069 0.2 . 1 . . . . 71 ARG CB . 15653 1 244 . 1 1 71 71 ARG N N 15 117.731 0.1 . 1 . . . . 71 ARG N . 15653 1 245 . 1 1 72 72 ALA H H 1 8.269 0.02 . 1 . . . . 72 ALA HN . 15653 1 246 . 1 1 72 72 ALA C C 13 180.147 0.2 . 1 . . . . 72 ALA C . 15653 1 247 . 1 1 72 72 ALA CA C 13 54.762 0.2 . 1 . . . . 72 ALA CA . 15653 1 248 . 1 1 72 72 ALA CB C 13 18.632 0.2 . 1 . . . . 72 ALA CB . 15653 1 249 . 1 1 72 72 ALA N N 15 122.672 0.1 . 1 . . . . 72 ALA N . 15653 1 250 . 1 1 73 73 LEU H H 1 8.282 0.02 . 1 . . . . 73 LEU HN . 15653 1 251 . 1 1 73 73 LEU C C 13 177.588 0.2 . 1 . . . . 73 LEU C . 15653 1 252 . 1 1 73 73 LEU CA C 13 58.899 0.2 . 1 . . . . 73 LEU CA . 15653 1 253 . 1 1 73 73 LEU CB C 13 41.232 0.2 . 1 . . . . 73 LEU CB . 15653 1 254 . 1 1 73 73 LEU N N 15 121.574 0.1 . 1 . . . . 73 LEU N . 15653 1 255 . 1 1 74 74 ILE H H 1 7.380 0.02 . 1 . . . . 74 ILE HN . 15653 1 256 . 1 1 74 74 ILE C C 13 178.546 0.2 . 1 . . . . 74 ILE C . 15653 1 257 . 1 1 74 74 ILE CA C 13 65.442 0.2 . 1 . . . . 74 ILE CA . 15653 1 258 . 1 1 74 74 ILE CB C 13 37.957 0.2 . 1 . . . . 74 ILE CB . 15653 1 259 . 1 1 74 74 ILE N N 15 119.178 0.1 . 1 . . . . 74 ILE N . 15653 1 260 . 1 1 75 75 GLN H H 1 8.187 0.02 . 1 . . . . 75 GLN HN . 15653 1 261 . 1 1 75 75 GLN C C 13 176.999 0.2 . 1 . . . . 75 GLN C . 15653 1 262 . 1 1 75 75 GLN CA C 13 58.527 0.2 . 1 . . . . 75 GLN CA . 15653 1 263 . 1 1 75 75 GLN CB C 13 28.194 0.2 . 1 . . . . 75 GLN CB . 15653 1 264 . 1 1 75 75 GLN N N 15 119.905 0.1 . 1 . . . . 75 GLN N . 15653 1 265 . 1 1 76 76 CYS H H 1 8.300 0.02 . 1 . . . . 76 CYS HN . 15653 1 266 . 1 1 76 76 CYS C C 13 176.765 0.2 . 1 . . . . 76 CYS C . 15653 1 267 . 1 1 76 76 CYS CA C 13 63.070 0.2 . 1 . . . . 76 CYS CA . 15653 1 268 . 1 1 76 76 CYS CB C 13 26.910 0.2 . 1 . . . . 76 CYS CB . 15653 1 269 . 1 1 76 76 CYS N N 15 120.416 0.1 . 1 . . . . 76 CYS N . 15653 1 270 . 1 1 77 77 ALA H H 1 7.672 0.02 . 1 . . . . 77 ALA HN . 15653 1 271 . 1 1 77 77 ALA C C 13 179.831 0.2 . 1 . . . . 77 ALA C . 15653 1 272 . 1 1 77 77 ALA CA C 13 55.710 0.2 . 1 . . . . 77 ALA CA . 15653 1 273 . 1 1 77 77 ALA CB C 13 18.319 0.2 . 1 . . . . 77 ALA CB . 15653 1 274 . 1 1 77 77 ALA N N 15 119.884 0.1 . 1 . . . . 77 ALA N . 15653 1 275 . 1 1 78 78 LYS H H 1 7.963 0.02 . 1 . . . . 78 LYS HN . 15653 1 276 . 1 1 78 78 LYS C C 13 179.597 0.2 . 1 . . . . 78 LYS C . 15653 1 277 . 1 1 78 78 LYS CA C 13 60.647 0.2 . 1 . . . . 78 LYS CA . 15653 1 278 . 1 1 78 78 LYS CB C 13 31.862 0.2 . 1 . . . . 78 LYS CB . 15653 1 279 . 1 1 78 78 LYS N N 15 119.354 0.1 . 1 . . . . 78 LYS N . 15653 1 280 . 1 1 79 79 ASP H H 1 8.651 0.02 . 1 . . . . 79 ASP HN . 15653 1 281 . 1 1 79 79 ASP C C 13 180.311 0.2 . 1 . . . . 79 ASP C . 15653 1 282 . 1 1 79 79 ASP CA C 13 58.047 0.2 . 1 . . . . 79 ASP CA . 15653 1 283 . 1 1 79 79 ASP CB C 13 40.456 0.2 . 1 . . . . 79 ASP CB . 15653 1 284 . 1 1 79 79 ASP N N 15 123.662 0.1 . 1 . . . . 79 ASP N . 15653 1 285 . 1 1 80 80 ILE H H 1 8.836 0.02 . 1 . . . . 80 ILE HN . 15653 1 286 . 1 1 80 80 ILE C C 13 178.157 0.2 . 1 . . . . 80 ILE C . 15653 1 287 . 1 1 80 80 ILE CA C 13 66.654 0.2 . 1 . . . . 80 ILE CA . 15653 1 288 . 1 1 80 80 ILE CB C 13 37.516 0.2 . 1 . . . . 80 ILE CB . 15653 1 289 . 1 1 80 80 ILE N N 15 125.481 0.1 . 1 . . . . 80 ILE N . 15653 1 290 . 1 1 81 81 ALA H H 1 8.295 0.02 . 1 . . . . 81 ALA HN . 15653 1 291 . 1 1 81 81 ALA C C 13 179.683 0.2 . 1 . . . . 81 ALA C . 15653 1 292 . 1 1 81 81 ALA CA C 13 55.339 0.2 . 1 . . . . 81 ALA CA . 15653 1 293 . 1 1 81 81 ALA CB C 13 17.421 0.2 . 1 . . . . 81 ALA CB . 15653 1 294 . 1 1 81 81 ALA N N 15 125.252 0.1 . 1 . . . . 81 ALA N . 15653 1 295 . 1 1 82 82 LYS H H 1 8.035 0.02 . 1 . . . . 82 LYS HN . 15653 1 296 . 1 1 82 82 LYS C C 13 179.424 0.2 . 1 . . . . 82 LYS C . 15653 1 297 . 1 1 82 82 LYS CA C 13 59.735 0.2 . 1 . . . . 82 LYS CA . 15653 1 298 . 1 1 82 82 LYS CB C 13 32.053 0.2 . 1 . . . . 82 LYS CB . 15653 1 299 . 1 1 82 82 LYS N N 15 120.735 0.1 . 1 . . . . 82 LYS N . 15653 1 300 . 1 1 83 83 ALA H H 1 7.674 0.02 . 1 . . . . 83 ALA HN . 15653 1 301 . 1 1 83 83 ALA C C 13 179.667 0.2 . 1 . . . . 83 ALA C . 15653 1 302 . 1 1 83 83 ALA CA C 13 55.249 0.2 . 1 . . . . 83 ALA CA . 15653 1 303 . 1 1 83 83 ALA CB C 13 17.290 0.2 . 1 . . . . 83 ALA CB . 15653 1 304 . 1 1 83 83 ALA N N 15 122.879 0.1 . 1 . . . . 83 ALA N . 15653 1 305 . 1 1 84 84 SER H H 1 8.643 0.02 . 1 . . . . 84 SER HN . 15653 1 306 . 1 1 84 84 SER C C 13 176.510 0.2 . 1 . . . . 84 SER C . 15653 1 307 . 1 1 84 84 SER CA C 13 62.970 0.2 . 1 . . . . 84 SER CA . 15653 1 308 . 1 1 84 84 SER CB C 13 62.581 0.2 . 1 . . . . 84 SER CB . 15653 1 309 . 1 1 84 84 SER N N 15 116.639 0.1 . 1 . . . . 84 SER N . 15653 1 310 . 1 1 85 85 ASP H H 1 8.114 0.02 . 1 . . . . 85 ASP HN . 15653 1 311 . 1 1 85 85 ASP C C 13 178.481 0.2 . 1 . . . . 85 ASP C . 15653 1 312 . 1 1 85 85 ASP CA C 13 57.651 0.2 . 1 . . . . 85 ASP CA . 15653 1 313 . 1 1 85 85 ASP CB C 13 40.764 0.2 . 1 . . . . 85 ASP CB . 15653 1 314 . 1 1 85 85 ASP N N 15 126.135 0.1 . 1 . . . . 85 ASP N . 15653 1 315 . 1 1 86 86 GLU H H 1 7.507 0.02 . 1 . . . . 86 GLU HN . 15653 1 316 . 1 1 86 86 GLU C C 13 178.339 0.2 . 1 . . . . 86 GLU C . 15653 1 317 . 1 1 86 86 GLU CA C 13 59.575 0.2 . 1 . . . . 86 GLU CA . 15653 1 318 . 1 1 86 86 GLU CB C 13 29.201 0.2 . 1 . . . . 86 GLU CB . 15653 1 319 . 1 1 86 86 GLU N N 15 121.592 0.1 . 1 . . . . 86 GLU N . 15653 1 320 . 1 1 87 87 VAL H H 1 7.981 0.02 . 1 . . . . 87 VAL HN . 15653 1 321 . 1 1 87 87 VAL C C 13 177.129 0.2 . 1 . . . . 87 VAL C . 15653 1 322 . 1 1 87 87 VAL CA C 13 67.726 0.2 . 1 . . . . 87 VAL CA . 15653 1 323 . 1 1 87 87 VAL CB C 13 31.454 0.2 . 1 . . . . 87 VAL CB . 15653 1 324 . 1 1 87 87 VAL N N 15 118.013 0.1 . 1 . . . . 87 VAL N . 15653 1 325 . 1 1 88 88 THR H H 1 8.079 0.02 . 1 . . . . 88 THR HN . 15653 1 326 . 1 1 88 88 THR C C 13 175.813 0.2 . 1 . . . . 88 THR C . 15653 1 327 . 1 1 88 88 THR CA C 13 67.894 0.2 . 1 . . . . 88 THR CA . 15653 1 328 . 1 1 88 88 THR CB C 13 68.782 0.2 . 1 . . . . 88 THR CB . 15653 1 329 . 1 1 88 88 THR N N 15 114.701 0.1 . 1 . . . . 88 THR N . 15653 1 330 . 1 1 89 89 ARG H H 1 8.073 0.02 . 1 . . . . 89 ARG HN . 15653 1 331 . 1 1 89 89 ARG C C 13 179.711 0.2 . 1 . . . . 89 ARG C . 15653 1 332 . 1 1 89 89 ARG CA C 13 60.124 0.2 . 1 . . . . 89 ARG CA . 15653 1 333 . 1 1 89 89 ARG CB C 13 30.015 0.2 . 1 . . . . 89 ARG CB . 15653 1 334 . 1 1 89 89 ARG N N 15 121.538 0.1 . 1 . . . . 89 ARG N . 15653 1 335 . 1 1 90 90 LEU H H 1 7.927 0.02 . 1 . . . . 90 LEU HN . 15653 1 336 . 1 1 90 90 LEU C C 13 179.132 0.2 . 1 . . . . 90 LEU C . 15653 1 337 . 1 1 90 90 LEU CA C 13 57.732 0.2 . 1 . . . . 90 LEU CA . 15653 1 338 . 1 1 90 90 LEU CB C 13 42.500 0.2 . 1 . . . . 90 LEU CB . 15653 1 339 . 1 1 90 90 LEU N N 15 119.342 0.1 . 1 . . . . 90 LEU N . 15653 1 340 . 1 1 91 91 ALA H H 1 8.712 0.02 . 1 . . . . 91 ALA HN . 15653 1 341 . 1 1 91 91 ALA C C 13 179.407 0.2 . 1 . . . . 91 ALA C . 15653 1 342 . 1 1 91 91 ALA CA C 13 55.741 0.2 . 1 . . . . 91 ALA CA . 15653 1 343 . 1 1 91 91 ALA CB C 13 18.847 0.2 . 1 . . . . 91 ALA CB . 15653 1 344 . 1 1 91 91 ALA N N 15 122.560 0.1 . 1 . . . . 91 ALA N . 15653 1 345 . 1 1 92 92 LYS H H 1 8.159 0.02 . 1 . . . . 92 LYS HN . 15653 1 346 . 1 1 92 92 LYS C C 13 179.297 0.2 . 1 . . . . 92 LYS C . 15653 1 347 . 1 1 92 92 LYS CA C 13 60.509 0.2 . 1 . . . . 92 LYS CA . 15653 1 348 . 1 1 92 92 LYS CB C 13 32.026 0.2 . 1 . . . . 92 LYS CB . 15653 1 349 . 1 1 92 92 LYS N N 15 118.050 0.1 . 1 . . . . 92 LYS N . 15653 1 350 . 1 1 93 93 GLU H H 1 7.346 0.02 . 1 . . . . 93 GLU HN . 15653 1 351 . 1 1 93 93 GLU C C 13 179.360 0.2 . 1 . . . . 93 GLU C . 15653 1 352 . 1 1 93 93 GLU CA C 13 59.139 0.2 . 1 . . . . 93 GLU CA . 15653 1 353 . 1 1 93 93 GLU CB C 13 28.705 0.2 . 1 . . . . 93 GLU CB . 15653 1 354 . 1 1 93 93 GLU N N 15 120.175 0.1 . 1 . . . . 93 GLU N . 15653 1 355 . 1 1 94 94 VAL H H 1 7.953 0.02 . 1 . . . . 94 VAL HN . 15653 1 356 . 1 1 94 94 VAL C C 13 178.732 0.2 . 1 . . . . 94 VAL C . 15653 1 357 . 1 1 94 94 VAL CA C 13 66.384 0.2 . 1 . . . . 94 VAL CA . 15653 1 358 . 1 1 94 94 VAL CB C 13 31.243 0.2 . 1 . . . . 94 VAL CB . 15653 1 359 . 1 1 94 94 VAL N N 15 120.541 0.1 . 1 . . . . 94 VAL N . 15653 1 360 . 1 1 95 95 ALA H H 1 8.316 0.02 . 1 . . . . 95 ALA HN . 15653 1 361 . 1 1 95 95 ALA C C 13 179.307 0.2 . 1 . . . . 95 ALA C . 15653 1 362 . 1 1 95 95 ALA CA C 13 55.984 0.2 . 1 . . . . 95 ALA CA . 15653 1 363 . 1 1 95 95 ALA CB C 13 17.781 0.2 . 1 . . . . 95 ALA CB . 15653 1 364 . 1 1 95 95 ALA N N 15 121.657 0.1 . 1 . . . . 95 ALA N . 15653 1 365 . 1 1 96 96 LYS H H 1 7.581 0.02 . 1 . . . . 96 LYS HN . 15653 1 366 . 1 1 96 96 LYS C C 13 178.163 0.2 . 1 . . . . 96 LYS C . 15653 1 367 . 1 1 96 96 LYS CA C 13 59.240 0.2 . 1 . . . . 96 LYS CA . 15653 1 368 . 1 1 96 96 LYS CB C 13 32.361 0.2 . 1 . . . . 96 LYS CB . 15653 1 369 . 1 1 96 96 LYS N N 15 115.132 0.1 . 1 . . . . 96 LYS N . 15653 1 370 . 1 1 97 97 GLN H H 1 7.295 0.02 . 1 . . . . 97 GLN HN . 15653 1 371 . 1 1 97 97 GLN C C 13 174.844 0.2 . 1 . . . . 97 GLN C . 15653 1 372 . 1 1 97 97 GLN CA C 13 55.209 0.2 . 1 . . . . 97 GLN CA . 15653 1 373 . 1 1 97 97 GLN CB C 13 29.360 0.2 . 1 . . . . 97 GLN CB . 15653 1 374 . 1 1 97 97 GLN N N 15 115.263 0.1 . 1 . . . . 97 GLN N . 15653 1 375 . 1 1 98 98 CYS H H 1 7.530 0.02 . 1 . . . . 98 CYS HN . 15653 1 376 . 1 1 98 98 CYS C C 13 176.000 0.2 . 1 . . . . 98 CYS C . 15653 1 377 . 1 1 98 98 CYS CA C 13 59.262 0.2 . 1 . . . . 98 CYS CA . 15653 1 378 . 1 1 98 98 CYS CB C 13 28.076 0.2 . 1 . . . . 98 CYS CB . 15653 1 379 . 1 1 98 98 CYS N N 15 120.802 0.1 . 1 . . . . 98 CYS N . 15653 1 380 . 1 1 99 99 THR H H 1 8.751 0.02 . 1 . . . . 99 THR HN . 15653 1 381 . 1 1 99 99 THR C C 13 173.928 0.2 . 1 . . . . 99 THR C . 15653 1 382 . 1 1 99 99 THR CA C 13 63.232 0.2 . 1 . . . . 99 THR CA . 15653 1 383 . 1 1 99 99 THR CB C 13 69.194 0.2 . 1 . . . . 99 THR CB . 15653 1 384 . 1 1 99 99 THR N N 15 120.588 0.1 . 1 . . . . 99 THR N . 15653 1 385 . 1 1 100 100 ASP H H 1 7.653 0.02 . 1 . . . . 100 ASP HN . 15653 1 386 . 1 1 100 100 ASP C C 13 175.431 0.2 . 1 . . . . 100 ASP C . 15653 1 387 . 1 1 100 100 ASP CA C 13 53.762 0.2 . 1 . . . . 100 ASP CA . 15653 1 388 . 1 1 100 100 ASP CB C 13 43.723 0.2 . 1 . . . . 100 ASP CB . 15653 1 389 . 1 1 100 100 ASP N N 15 125.040 0.1 . 1 . . . . 100 ASP N . 15653 1 390 . 1 1 101 101 LYS H H 1 8.778 0.02 . 1 . . . . 101 LYS HN . 15653 1 391 . 1 1 101 101 LYS C C 13 178.300 0.2 . 1 . . . . 101 LYS C . 15653 1 392 . 1 1 101 101 LYS CA C 13 60.199 0.2 . 1 . . . . 101 LYS CA . 15653 1 393 . 1 1 101 101 LYS CB C 13 32.405 0.2 . 1 . . . . 101 LYS CB . 15653 1 394 . 1 1 101 101 LYS N N 15 128.118 0.1 . 1 . . . . 101 LYS N . 15653 1 395 . 1 1 102 102 ARG H H 1 8.114 0.02 . 1 . . . . 102 ARG HN . 15653 1 396 . 1 1 102 102 ARG C C 13 178.340 0.2 . 1 . . . . 102 ARG C . 15653 1 397 . 1 1 102 102 ARG CA C 13 59.651 0.2 . 1 . . . . 102 ARG CA . 15653 1 398 . 1 1 102 102 ARG CB C 13 29.876 0.2 . 1 . . . . 102 ARG CB . 15653 1 399 . 1 1 102 102 ARG N N 15 122.417 0.1 . 1 . . . . 102 ARG N . 15653 1 400 . 1 1 103 103 ILE H H 1 7.894 0.02 . 1 . . . . 103 ILE HN . 15653 1 401 . 1 1 103 103 ILE C C 13 178.102 0.2 . 1 . . . . 103 ILE C . 15653 1 402 . 1 1 103 103 ILE CA C 13 64.901 0.2 . 1 . . . . 103 ILE CA . 15653 1 403 . 1 1 103 103 ILE CB C 13 37.854 0.2 . 1 . . . . 103 ILE CB . 15653 1 404 . 1 1 103 103 ILE N N 15 120.976 0.1 . 1 . . . . 103 ILE N . 15653 1 405 . 1 1 104 104 ARG H H 1 8.343 0.02 . 1 . . . . 104 ARG HN . 15653 1 406 . 1 1 104 104 ARG C C 13 177.400 0.2 . 1 . . . . 104 ARG C . 15653 1 407 . 1 1 104 104 ARG CA C 13 60.751 0.2 . 1 . . . . 104 ARG CA . 15653 1 408 . 1 1 104 104 ARG CB C 13 30.787 0.2 . 1 . . . . 104 ARG CB . 15653 1 409 . 1 1 104 104 ARG N N 15 119.793 0.1 . 1 . . . . 104 ARG N . 15653 1 410 . 1 1 105 105 THR H H 1 7.892 0.02 . 1 . . . . 105 THR HN . 15653 1 411 . 1 1 105 105 THR C C 13 176.351 0.2 . 1 . . . . 105 THR C . 15653 1 412 . 1 1 105 105 THR CA C 13 67.013 0.2 . 1 . . . . 105 THR CA . 15653 1 413 . 1 1 105 105 THR CB C 13 69.043 0.2 . 1 . . . . 105 THR CB . 15653 1 414 . 1 1 105 105 THR N N 15 114.065 0.1 . 1 . . . . 105 THR N . 15653 1 415 . 1 1 106 106 ASN H H 1 8.003 0.02 . 1 . . . . 106 ASN HN . 15653 1 416 . 1 1 106 106 ASN C C 13 177.838 0.2 . 1 . . . . 106 ASN C . 15653 1 417 . 1 1 106 106 ASN CA C 13 56.435 0.2 . 1 . . . . 106 ASN CA . 15653 1 418 . 1 1 106 106 ASN CB C 13 37.888 0.2 . 1 . . . . 106 ASN CB . 15653 1 419 . 1 1 106 106 ASN N N 15 122.132 0.1 . 1 . . . . 106 ASN N . 15653 1 420 . 1 1 107 107 LEU H H 1 8.467 0.02 . 1 . . . . 107 LEU HN . 15653 1 421 . 1 1 107 107 LEU C C 13 177.802 0.2 . 1 . . . . 107 LEU C . 15653 1 422 . 1 1 107 107 LEU CA C 13 57.944 0.2 . 1 . . . . 107 LEU CA . 15653 1 423 . 1 1 107 107 LEU CB C 13 41.634 0.2 . 1 . . . . 107 LEU CB . 15653 1 424 . 1 1 107 107 LEU N N 15 121.369 0.1 . 1 . . . . 107 LEU N . 15653 1 425 . 1 1 108 108 LEU H H 1 8.214 0.02 . 1 . . . . 108 LEU HN . 15653 1 426 . 1 1 108 108 LEU C C 13 179.331 0.2 . 1 . . . . 108 LEU C . 15653 1 427 . 1 1 108 108 LEU CA C 13 58.367 0.2 . 1 . . . . 108 LEU CA . 15653 1 428 . 1 1 108 108 LEU CB C 13 40.905 0.2 . 1 . . . . 108 LEU CB . 15653 1 429 . 1 1 108 108 LEU N N 15 119.168 0.1 . 1 . . . . 108 LEU N . 15653 1 430 . 1 1 109 109 GLN H H 1 8.034 0.02 . 1 . . . . 109 GLN HN . 15653 1 431 . 1 1 109 109 GLN C C 13 179.242 0.2 . 1 . . . . 109 GLN C . 15653 1 432 . 1 1 109 109 GLN CA C 13 59.314 0.2 . 1 . . . . 109 GLN CA . 15653 1 433 . 1 1 109 109 GLN CB C 13 28.396 0.2 . 1 . . . . 109 GLN CB . 15653 1 434 . 1 1 109 109 GLN N N 15 117.795 0.1 . 1 . . . . 109 GLN N . 15653 1 435 . 1 1 110 110 VAL H H 1 7.720 0.02 . 1 . . . . 110 VAL HN . 15653 1 436 . 1 1 110 110 VAL C C 13 178.179 0.2 . 1 . . . . 110 VAL C . 15653 1 437 . 1 1 110 110 VAL CA C 13 65.352 0.2 . 1 . . . . 110 VAL CA . 15653 1 438 . 1 1 110 110 VAL CB C 13 31.605 0.2 . 1 . . . . 110 VAL CB . 15653 1 439 . 1 1 110 110 VAL N N 15 117.269 0.1 . 1 . . . . 110 VAL N . 15653 1 440 . 1 1 111 111 CYS H H 1 8.142 0.02 . 1 . . . . 111 CYS HN . 15653 1 441 . 1 1 111 111 CYS C C 13 176.841 0.2 . 1 . . . . 111 CYS C . 15653 1 442 . 1 1 111 111 CYS CA C 13 62.036 0.2 . 1 . . . . 111 CYS CA . 15653 1 443 . 1 1 111 111 CYS CB C 13 27.469 0.2 . 1 . . . . 111 CYS CB . 15653 1 444 . 1 1 111 111 CYS N N 15 118.078 0.1 . 1 . . . . 111 CYS N . 15653 1 445 . 1 1 112 112 GLU H H 1 7.779 0.02 . 1 . . . . 112 GLU HN . 15653 1 446 . 1 1 112 112 GLU C C 13 178.001 0.2 . 1 . . . . 112 GLU C . 15653 1 447 . 1 1 112 112 GLU CA C 13 58.610 0.2 . 1 . . . . 112 GLU CA . 15653 1 448 . 1 1 112 112 GLU CB C 13 29.357 0.2 . 1 . . . . 112 GLU CB . 15653 1 449 . 1 1 112 112 GLU N N 15 119.840 0.1 . 1 . . . . 112 GLU N . 15653 1 450 . 1 1 113 113 ARG H H 1 7.400 0.02 . 1 . . . . 113 ARG HN . 15653 1 451 . 1 1 113 113 ARG C C 13 177.966 0.2 . 1 . . . . 113 ARG C . 15653 1 452 . 1 1 113 113 ARG CA C 13 57.769 0.2 . 1 . . . . 113 ARG CA . 15653 1 453 . 1 1 113 113 ARG CB C 13 30.896 0.2 . 1 . . . . 113 ARG CB . 15653 1 454 . 1 1 113 113 ARG N N 15 116.933 0.1 . 1 . . . . 113 ARG N . 15653 1 455 . 1 1 114 114 ILE H H 1 7.563 0.02 . 1 . . . . 114 ILE HN . 15653 1 456 . 1 1 114 114 ILE C C 13 174.868 0.2 . 1 . . . . 114 ILE C . 15653 1 457 . 1 1 114 114 ILE CA C 13 68.461 0.2 . 1 . . . . 114 ILE CA . 15653 1 458 . 1 1 114 114 ILE CB C 13 35.185 0.2 . 1 . . . . 114 ILE CB . 15653 1 459 . 1 1 114 114 ILE N N 15 119.118 0.1 . 1 . . . . 114 ILE N . 15653 1 460 . 1 1 115 115 PRO C C 13 179.482 0.2 . 1 . . . . 115 PRO C . 15653 1 461 . 1 1 115 115 PRO CA C 13 66.248 0.2 . 1 . . . . 115 PRO CA . 15653 1 462 . 1 1 115 115 PRO CB C 13 30.875 0.2 . 1 . . . . 115 PRO CB . 15653 1 463 . 1 1 116 116 THR H H 1 7.111 0.02 . 1 . . . . 116 THR HN . 15653 1 464 . 1 1 116 116 THR C C 13 176.425 0.2 . 1 . . . . 116 THR C . 15653 1 465 . 1 1 116 116 THR CA C 13 66.404 0.2 . 1 . . . . 116 THR CA . 15653 1 466 . 1 1 116 116 THR CB C 13 68.837 0.2 . 1 . . . . 116 THR CB . 15653 1 467 . 1 1 116 116 THR N N 15 114.362 0.1 . 1 . . . . 116 THR N . 15653 1 468 . 1 1 117 117 ILE H H 1 7.892 0.02 . 1 . . . . 117 ILE HN . 15653 1 469 . 1 1 117 117 ILE C C 13 179.316 0.2 . 1 . . . . 117 ILE C . 15653 1 470 . 1 1 117 117 ILE CA C 13 65.409 0.2 . 1 . . . . 117 ILE CA . 15653 1 471 . 1 1 117 117 ILE CB C 13 38.079 0.2 . 1 . . . . 117 ILE CB . 15653 1 472 . 1 1 117 117 ILE N N 15 122.935 0.1 . 1 . . . . 117 ILE N . 15653 1 473 . 1 1 118 118 SER H H 1 8.867 0.02 . 1 . . . . 118 SER HN . 15653 1 474 . 1 1 118 118 SER C C 13 176.942 0.2 . 1 . . . . 118 SER C . 15653 1 475 . 1 1 118 118 SER CA C 13 62.558 0.2 . 1 . . . . 118 SER CA . 15653 1 476 . 1 1 118 118 SER N N 15 116.640 0.1 . 1 . . . . 118 SER N . 15653 1 477 . 1 1 119 119 THR H H 1 8.162 0.02 . 1 . . . . 119 THR HN . 15653 1 478 . 1 1 119 119 THR CA C 13 67.727 0.2 . 1 . . . . 119 THR CA . 15653 1 479 . 1 1 119 119 THR CB C 13 68.343 0.2 . 1 . . . . 119 THR CB . 15653 1 480 . 1 1 119 119 THR N N 15 121.182 0.1 . 1 . . . . 119 THR N . 15653 1 481 . 1 1 121 121 LEU C C 13 180.157 0.2 . 1 . . . . 121 LEU C . 15653 1 482 . 1 1 121 121 LEU CA C 13 58.985 0.2 . 1 . . . . 121 LEU CA . 15653 1 483 . 1 1 121 121 LEU CB C 13 40.777 0.2 . 1 . . . . 121 LEU CB . 15653 1 484 . 1 1 122 122 LYS H H 1 7.877 0.02 . 1 . . . . 122 LYS HN . 15653 1 485 . 1 1 122 122 LYS C C 13 179.309 0.2 . 1 . . . . 122 LYS C . 15653 1 486 . 1 1 122 122 LYS CA C 13 61.210 0.2 . 1 . . . . 122 LYS CA . 15653 1 487 . 1 1 122 122 LYS CB C 13 31.611 0.2 . 1 . . . . 122 LYS CB . 15653 1 488 . 1 1 122 122 LYS N N 15 121.865 0.1 . 1 . . . . 122 LYS N . 15653 1 489 . 1 1 123 123 ILE H H 1 7.866 0.02 . 1 . . . . 123 ILE HN . 15653 1 490 . 1 1 123 123 ILE C C 13 179.089 0.2 . 1 . . . . 123 ILE C . 15653 1 491 . 1 1 123 123 ILE CA C 13 65.495 0.2 . 1 . . . . 123 ILE CA . 15653 1 492 . 1 1 123 123 ILE CB C 13 38.370 0.2 . 1 . . . . 123 ILE CB . 15653 1 493 . 1 1 123 123 ILE N N 15 122.180 0.1 . 1 . . . . 123 ILE N . 15653 1 494 . 1 1 124 124 LEU H H 1 8.833 0.02 . 1 . . . . 124 LEU HN . 15653 1 495 . 1 1 124 124 LEU C C 13 180.093 0.2 . 1 . . . . 124 LEU C . 15653 1 496 . 1 1 124 124 LEU CA C 13 57.465 0.2 . 1 . . . . 124 LEU CA . 15653 1 497 . 1 1 124 124 LEU CB C 13 41.905 0.2 . 1 . . . . 124 LEU CB . 15653 1 498 . 1 1 124 124 LEU N N 15 120.169 0.1 . 1 . . . . 124 LEU N . 15653 1 499 . 1 1 125 125 SER H H 1 8.631 0.02 . 1 . . . . 125 SER HN . 15653 1 500 . 1 1 125 125 SER CA C 13 63.630 0.2 . 1 . . . . 125 SER CA . 15653 1 501 . 1 1 125 125 SER CB C 13 62.782 0.2 . 1 . . . . 125 SER CB . 15653 1 502 . 1 1 125 125 SER N N 15 118.179 0.1 . 1 . . . . 125 SER N . 15653 1 503 . 1 1 128 128 LYS C C 13 177.941 0.2 . 1 . . . . 128 LYS C . 15653 1 504 . 1 1 128 128 LYS CA C 13 57.856 0.2 . 1 . . . . 128 LYS CA . 15653 1 505 . 1 1 128 128 LYS CB C 13 31.059 0.2 . 1 . . . . 128 LYS CB . 15653 1 506 . 1 1 129 129 ALA H H 1 8.439 0.02 . 1 . . . . 129 ALA HN . 15653 1 507 . 1 1 129 129 ALA C C 13 179.283 0.2 . 1 . . . . 129 ALA C . 15653 1 508 . 1 1 129 129 ALA CA C 13 55.354 0.2 . 1 . . . . 129 ALA CA . 15653 1 509 . 1 1 129 129 ALA CB C 13 18.753 0.2 . 1 . . . . 129 ALA CB . 15653 1 510 . 1 1 129 129 ALA N N 15 120.670 0.1 . 1 . . . . 129 ALA N . 15653 1 511 . 1 1 130 130 THR H H 1 7.664 0.02 . 1 . . . . 130 THR HN . 15653 1 512 . 1 1 130 130 THR C C 13 175.369 0.2 . 1 . . . . 130 THR C . 15653 1 513 . 1 1 130 130 THR CA C 13 65.017 0.2 . 1 . . . . 130 THR CA . 15653 1 514 . 1 1 130 130 THR CB C 13 69.743 0.2 . 1 . . . . 130 THR CB . 15653 1 515 . 1 1 130 130 THR N N 15 109.543 0.1 . 1 . . . . 130 THR N . 15653 1 516 . 1 1 131 131 MET H H 1 7.635 0.02 . 1 . . . . 131 MET HN . 15653 1 517 . 1 1 131 131 MET C C 13 176.974 0.2 . 1 . . . . 131 MET C . 15653 1 518 . 1 1 131 131 MET CA C 13 57.243 0.2 . 1 . . . . 131 MET CA . 15653 1 519 . 1 1 131 131 MET CB C 13 33.414 0.2 . 1 . . . . 131 MET CB . 15653 1 520 . 1 1 131 131 MET N N 15 119.913 0.1 . 1 . . . . 131 MET N . 15653 1 521 . 1 1 132 132 LEU H H 1 7.278 0.02 . 1 . . . . 132 LEU HN . 15653 1 522 . 1 1 132 132 LEU C C 13 178.303 0.2 . 1 . . . . 132 LEU C . 15653 1 523 . 1 1 132 132 LEU CA C 13 56.678 0.2 . 1 . . . . 132 LEU CA . 15653 1 524 . 1 1 132 132 LEU CB C 13 41.433 0.2 . 1 . . . . 132 LEU CB . 15653 1 525 . 1 1 132 132 LEU N N 15 120.610 0.1 . 1 . . . . 132 LEU N . 15653 1 526 . 1 1 133 133 GLY H H 1 8.601 0.02 . 1 . . . . 133 GLY HN . 15653 1 527 . 1 1 133 133 GLY C C 13 174.206 0.2 . 1 . . . . 133 GLY C . 15653 1 528 . 1 1 133 133 GLY CA C 13 45.791 0.2 . 1 . . . . 133 GLY CA . 15653 1 529 . 1 1 133 133 GLY N N 15 109.347 0.1 . 1 . . . . 133 GLY N . 15653 1 530 . 1 1 134 134 ARG H H 1 7.674 0.02 . 1 . . . . 134 ARG HN . 15653 1 531 . 1 1 134 134 ARG C C 13 176.876 0.2 . 1 . . . . 134 ARG C . 15653 1 532 . 1 1 134 134 ARG CA C 13 56.228 0.2 . 1 . . . . 134 ARG CA . 15653 1 533 . 1 1 134 134 ARG CB C 13 30.590 0.2 . 1 . . . . 134 ARG CB . 15653 1 534 . 1 1 134 134 ARG N N 15 120.831 0.1 . 1 . . . . 134 ARG N . 15653 1 535 . 1 1 135 135 THR H H 1 8.294 0.02 . 1 . . . . 135 THR HN . 15653 1 536 . 1 1 135 135 THR C C 13 174.628 0.2 . 1 . . . . 135 THR C . 15653 1 537 . 1 1 135 135 THR CA C 13 62.277 0.2 . 1 . . . . 135 THR CA . 15653 1 538 . 1 1 135 135 THR CB C 13 69.722 0.2 . 1 . . . . 135 THR CB . 15653 1 539 . 1 1 135 135 THR N N 15 114.361 0.1 . 1 . . . . 135 THR N . 15653 1 540 . 1 1 136 136 ASN H H 1 8.313 0.02 . 1 . . . . 136 ASN HN . 15653 1 541 . 1 1 136 136 ASN C C 13 174.802 0.2 . 1 . . . . 136 ASN C . 15653 1 542 . 1 1 136 136 ASN CA C 13 53.561 0.2 . 1 . . . . 136 ASN CA . 15653 1 543 . 1 1 136 136 ASN CB C 13 37.955 0.2 . 1 . . . . 136 ASN CB . 15653 1 544 . 1 1 136 136 ASN N N 15 119.850 0.1 . 1 . . . . 136 ASN N . 15653 1 545 . 1 1 137 137 ILE H H 1 7.565 0.02 . 1 . . . . 137 ILE HN . 15653 1 546 . 1 1 137 137 ILE C C 13 175.855 0.2 . 1 . . . . 137 ILE C . 15653 1 547 . 1 1 137 137 ILE CA C 13 60.348 0.2 . 1 . . . . 137 ILE CA . 15653 1 548 . 1 1 137 137 ILE CB C 13 38.744 0.2 . 1 . . . . 137 ILE CB . 15653 1 549 . 1 1 137 137 ILE N N 15 120.206 0.1 . 1 . . . . 137 ILE N . 15653 1 550 . 1 1 138 138 SER H H 1 8.495 0.02 . 1 . . . . 138 SER HN . 15653 1 551 . 1 1 138 138 SER C C 13 174.819 0.2 . 1 . . . . 138 SER C . 15653 1 552 . 1 1 138 138 SER CA C 13 58.244 0.2 . 1 . . . . 138 SER CA . 15653 1 553 . 1 1 138 138 SER CB C 13 64.204 0.2 . 1 . . . . 138 SER CB . 15653 1 554 . 1 1 138 138 SER N N 15 121.817 0.1 . 1 . . . . 138 SER N . 15653 1 555 . 1 1 139 139 ASP H H 1 8.572 0.02 . 1 . . . . 139 ASP HN . 15653 1 556 . 1 1 139 139 ASP C C 13 177.724 0.2 . 1 . . . . 139 ASP C . 15653 1 557 . 1 1 139 139 ASP CA C 13 56.621 0.2 . 1 . . . . 139 ASP CA . 15653 1 558 . 1 1 139 139 ASP CB C 13 40.749 0.2 . 1 . . . . 139 ASP CB . 15653 1 559 . 1 1 139 139 ASP N N 15 124.726 0.1 . 1 . . . . 139 ASP N . 15653 1 560 . 1 1 140 140 GLU H H 1 8.649 0.02 . 1 . . . . 140 GLU HN . 15653 1 561 . 1 1 140 140 GLU C C 13 178.977 0.2 . 1 . . . . 140 GLU C . 15653 1 562 . 1 1 140 140 GLU CA C 13 59.888 0.2 . 1 . . . . 140 GLU CA . 15653 1 563 . 1 1 140 140 GLU CB C 13 29.128 0.2 . 1 . . . . 140 GLU CB . 15653 1 564 . 1 1 140 140 GLU N N 15 120.714 0.1 . 1 . . . . 140 GLU N . 15653 1 565 . 1 1 141 141 GLU H H 1 7.889 0.02 . 1 . . . . 141 GLU HN . 15653 1 566 . 1 1 141 141 GLU C C 13 178.547 0.2 . 1 . . . . 141 GLU C . 15653 1 567 . 1 1 141 141 GLU CA C 13 59.739 0.2 . 1 . . . . 141 GLU CA . 15653 1 568 . 1 1 141 141 GLU CB C 13 29.543 0.2 . 1 . . . . 141 GLU CB . 15653 1 569 . 1 1 141 141 GLU N N 15 120.605 0.1 . 1 . . . . 141 GLU N . 15653 1 570 . 1 1 142 142 SER H H 1 8.031 0.02 . 1 . . . . 142 SER HN . 15653 1 571 . 1 1 142 142 SER C C 13 178.368 0.2 . 1 . . . . 142 SER C . 15653 1 572 . 1 1 142 142 SER CA C 13 61.022 0.2 . 1 . . . . 142 SER CA . 15653 1 573 . 1 1 142 142 SER CB C 13 63.225 0.2 . 1 . . . . 142 SER CB . 15653 1 574 . 1 1 142 142 SER N N 15 114.936 0.1 . 1 . . . . 142 SER N . 15653 1 575 . 1 1 143 143 GLU H H 1 8.523 0.02 . 1 . . . . 143 GLU HN . 15653 1 576 . 1 1 143 143 GLU C C 13 179.362 0.2 . 1 . . . . 143 GLU C . 15653 1 577 . 1 1 143 143 GLU CA C 13 59.188 0.2 . 1 . . . . 143 GLU CA . 15653 1 578 . 1 1 143 143 GLU CB C 13 28.970 0.2 . 1 . . . . 143 GLU CB . 15653 1 579 . 1 1 143 143 GLU N N 15 121.922 0.1 . 1 . . . . 143 GLU N . 15653 1 580 . 1 1 144 144 GLN H H 1 8.144 0.02 . 1 . . . . 144 GLN HN . 15653 1 581 . 1 1 144 144 GLN CA C 13 58.778 0.2 . 1 . . . . 144 GLN CA . 15653 1 582 . 1 1 144 144 GLN CB C 13 28.165 0.2 . 1 . . . . 144 GLN CB . 15653 1 583 . 1 1 144 144 GLN N N 15 119.771 0.1 . 1 . . . . 144 GLN N . 15653 1 584 . 1 1 148 148 MET C C 13 179.437 0.2 . 1 . . . . 148 MET C . 15653 1 585 . 1 1 148 148 MET CA C 13 59.381 0.2 . 1 . . . . 148 MET CA . 15653 1 586 . 1 1 148 148 MET CB C 13 33.942 0.2 . 1 . . . . 148 MET CB . 15653 1 587 . 1 1 149 149 LEU H H 1 7.742 0.02 . 1 . . . . 149 LEU HN . 15653 1 588 . 1 1 149 149 LEU C C 13 177.869 0.2 . 1 . . . . 149 LEU C . 15653 1 589 . 1 1 149 149 LEU CA C 13 59.259 0.2 . 1 . . . . 149 LEU CA . 15653 1 590 . 1 1 149 149 LEU CB C 13 42.006 0.2 . 1 . . . . 149 LEU CB . 15653 1 591 . 1 1 149 149 LEU N N 15 123.470 0.1 . 1 . . . . 149 LEU N . 15653 1 592 . 1 1 150 150 VAL H H 1 8.798 0.02 . 1 . . . . 150 VAL HN . 15653 1 593 . 1 1 150 150 VAL C C 13 178.127 0.2 . 1 . . . . 150 VAL C . 15653 1 594 . 1 1 150 150 VAL CA C 13 67.255 0.2 . 1 . . . . 150 VAL CA . 15653 1 595 . 1 1 150 150 VAL CB C 13 31.408 0.2 . 1 . . . . 150 VAL CB . 15653 1 596 . 1 1 150 150 VAL N N 15 120.985 0.1 . 1 . . . . 150 VAL N . 15653 1 597 . 1 1 151 151 HIS H H 1 8.246 0.02 . 1 . . . . 151 HIS HN . 15653 1 598 . 1 1 151 151 HIS C C 13 177.855 0.2 . 1 . . . . 151 HIS C . 15653 1 599 . 1 1 151 151 HIS CA C 13 58.666 0.2 . 1 . . . . 151 HIS CA . 15653 1 600 . 1 1 151 151 HIS CB C 13 28.638 0.2 . 1 . . . . 151 HIS CB . 15653 1 601 . 1 1 151 151 HIS N N 15 117.385 0.1 . 1 . . . . 151 HIS N . 15653 1 602 . 1 1 152 152 ASN H H 1 7.774 0.02 . 1 . . . . 152 ASN HN . 15653 1 603 . 1 1 152 152 ASN C C 13 176.551 0.2 . 1 . . . . 152 ASN C . 15653 1 604 . 1 1 152 152 ASN CA C 13 57.923 0.2 . 1 . . . . 152 ASN CA . 15653 1 605 . 1 1 152 152 ASN CB C 13 40.356 0.2 . 1 . . . . 152 ASN CB . 15653 1 606 . 1 1 152 152 ASN N N 15 119.055 0.1 . 1 . . . . 152 ASN N . 15653 1 607 . 1 1 153 153 ALA H H 1 8.828 0.02 . 1 . . . . 153 ALA HN . 15653 1 608 . 1 1 153 153 ALA C C 13 179.903 0.2 . 1 . . . . 153 ALA C . 15653 1 609 . 1 1 153 153 ALA CA C 13 56.314 0.2 . 1 . . . . 153 ALA CA . 15653 1 610 . 1 1 153 153 ALA CB C 13 18.993 0.2 . 1 . . . . 153 ALA CB . 15653 1 611 . 1 1 153 153 ALA N N 15 123.550 0.1 . 1 . . . . 153 ALA N . 15653 1 612 . 1 1 154 154 GLN H H 1 8.663 0.02 . 1 . . . . 154 GLN HN . 15653 1 613 . 1 1 154 154 GLN C C 13 178.851 0.2 . 1 . . . . 154 GLN C . 15653 1 614 . 1 1 154 154 GLN CA C 13 59.879 0.2 . 1 . . . . 154 GLN CA . 15653 1 615 . 1 1 154 154 GLN CB C 13 28.521 0.2 . 1 . . . . 154 GLN CB . 15653 1 616 . 1 1 154 154 GLN N N 15 116.914 0.1 . 1 . . . . 154 GLN N . 15653 1 617 . 1 1 155 155 ASN H H 1 7.966 0.02 . 1 . . . . 155 ASN HN . 15653 1 618 . 1 1 155 155 ASN C C 13 178.647 0.2 . 1 . . . . 155 ASN C . 15653 1 619 . 1 1 155 155 ASN CA C 13 55.927 0.2 . 1 . . . . 155 ASN CA . 15653 1 620 . 1 1 155 155 ASN CB C 13 37.972 0.2 . 1 . . . . 155 ASN CB . 15653 1 621 . 1 1 155 155 ASN N N 15 119.257 0.1 . 1 . . . . 155 ASN N . 15653 1 622 . 1 1 156 156 LEU H H 1 8.895 0.02 . 1 . . . . 156 LEU HN . 15653 1 623 . 1 1 156 156 LEU C C 13 178.165 0.2 . 1 . . . . 156 LEU C . 15653 1 624 . 1 1 156 156 LEU CA C 13 58.666 0.2 . 1 . . . . 156 LEU CA . 15653 1 625 . 1 1 156 156 LEU CB C 13 40.944 0.2 . 1 . . . . 156 LEU CB . 15653 1 626 . 1 1 156 156 LEU N N 15 124.134 0.1 . 1 . . . . 156 LEU N . 15653 1 627 . 1 1 157 157 MET H H 1 8.271 0.02 . 1 . . . . 157 MET HN . 15653 1 628 . 1 1 157 157 MET C C 13 178.382 0.2 . 1 . . . . 157 MET C . 15653 1 629 . 1 1 157 157 MET CA C 13 59.018 0.2 . 1 . . . . 157 MET CA . 15653 1 630 . 1 1 157 157 MET CB C 13 34.498 0.2 . 1 . . . . 157 MET CB . 15653 1 631 . 1 1 157 157 MET N N 15 116.811 0.1 . 1 . . . . 157 MET N . 15653 1 632 . 1 1 158 158 GLN H H 1 8.202 0.02 . 1 . . . . 158 GLN HN . 15653 1 633 . 1 1 158 158 GLN C C 13 178.746 0.2 . 1 . . . . 158 GLN C . 15653 1 634 . 1 1 158 158 GLN CA C 13 59.262 0.2 . 1 . . . . 158 GLN CA . 15653 1 635 . 1 1 158 158 GLN CB C 13 27.885 0.2 . 1 . . . . 158 GLN CB . 15653 1 636 . 1 1 158 158 GLN N N 15 119.022 0.1 . 1 . . . . 158 GLN N . 15653 1 637 . 1 1 159 159 SER H H 1 8.257 0.02 . 1 . . . . 159 SER HN . 15653 1 638 . 1 1 159 159 SER C C 13 177.353 0.2 . 1 . . . . 159 SER C . 15653 1 639 . 1 1 159 159 SER CA C 13 63.139 0.2 . 1 . . . . 159 SER CA . 15653 1 640 . 1 1 159 159 SER N N 15 116.491 0.1 . 1 . . . . 159 SER N . 15653 1 641 . 1 1 160 160 VAL H H 1 8.523 0.02 . 1 . . . . 160 VAL HN . 15653 1 642 . 1 1 160 160 VAL C C 13 176.900 0.2 . 1 . . . . 160 VAL C . 15653 1 643 . 1 1 160 160 VAL CA C 13 67.622 0.2 . 1 . . . . 160 VAL CA . 15653 1 644 . 1 1 160 160 VAL CB C 13 30.842 0.2 . 1 . . . . 160 VAL CB . 15653 1 645 . 1 1 160 160 VAL N N 15 125.293 0.1 . 1 . . . . 160 VAL N . 15653 1 646 . 1 1 161 161 LYS H H 1 8.402 0.02 . 1 . . . . 161 LYS HN . 15653 1 647 . 1 1 161 161 LYS C C 13 178.107 0.2 . 1 . . . . 161 LYS C . 15653 1 648 . 1 1 161 161 LYS CA C 13 61.439 0.2 . 1 . . . . 161 LYS CA . 15653 1 649 . 1 1 161 161 LYS CB C 13 31.861 0.2 . 1 . . . . 161 LYS CB . 15653 1 650 . 1 1 161 161 LYS N N 15 123.405 0.1 . 1 . . . . 161 LYS N . 15653 1 651 . 1 1 162 162 GLU C C 13 178.496 0.2 . 1 . . . . 162 GLU C . 15653 1 652 . 1 1 162 162 GLU CA C 13 59.271 0.2 . 1 . . . . 162 GLU CA . 15653 1 653 . 1 1 162 162 GLU CB C 13 29.176 0.2 . 1 . . . . 162 GLU CB . 15653 1 654 . 1 1 163 163 THR H H 1 7.856 0.02 . 1 . . . . 163 THR HN . 15653 1 655 . 1 1 163 163 THR C C 13 175.824 0.2 . 1 . . . . 163 THR C . 15653 1 656 . 1 1 163 163 THR CA C 13 68.550 0.2 . 1 . . . . 163 THR CA . 15653 1 657 . 1 1 163 163 THR CB C 13 67.529 0.2 . 1 . . . . 163 THR CB . 15653 1 658 . 1 1 163 163 THR N N 15 118.354 0.1 . 1 . . . . 163 THR N . 15653 1 659 . 1 1 164 164 VAL H H 1 8.226 0.02 . 1 . . . . 164 VAL HN . 15653 1 660 . 1 1 164 164 VAL C C 13 176.705 0.2 . 1 . . . . 164 VAL C . 15653 1 661 . 1 1 164 164 VAL CA C 13 68.098 0.2 . 1 . . . . 164 VAL CA . 15653 1 662 . 1 1 164 164 VAL CB C 13 31.123 0.2 . 1 . . . . 164 VAL CB . 15653 1 663 . 1 1 164 164 VAL N N 15 121.801 0.1 . 1 . . . . 164 VAL N . 15653 1 664 . 1 1 165 165 ARG H H 1 7.476 0.02 . 1 . . . . 165 ARG HN . 15653 1 665 . 1 1 165 165 ARG C C 13 180.219 0.2 . 1 . . . . 165 ARG C . 15653 1 666 . 1 1 165 165 ARG CA C 13 59.573 0.2 . 1 . . . . 165 ARG CA . 15653 1 667 . 1 1 165 165 ARG CB C 13 30.065 0.2 . 1 . . . . 165 ARG CB . 15653 1 668 . 1 1 165 165 ARG N N 15 117.294 0.1 . 1 . . . . 165 ARG N . 15653 1 669 . 1 1 166 166 GLU H H 1 8.525 0.02 . 1 . . . . 166 GLU HN . 15653 1 670 . 1 1 166 166 GLU C C 13 178.206 0.2 . 1 . . . . 166 GLU C . 15653 1 671 . 1 1 166 166 GLU CA C 13 58.131 0.2 . 1 . . . . 166 GLU CA . 15653 1 672 . 1 1 166 166 GLU CB C 13 28.966 0.2 . 1 . . . . 166 GLU CB . 15653 1 673 . 1 1 166 166 GLU N N 15 119.531 0.1 . 1 . . . . 166 GLU N . 15653 1 674 . 1 1 167 167 ALA H H 1 8.880 0.02 . 1 . . . . 167 ALA HN . 15653 1 675 . 1 1 167 167 ALA C C 13 179.333 0.2 . 1 . . . . 167 ALA C . 15653 1 676 . 1 1 167 167 ALA CA C 13 55.137 0.2 . 1 . . . . 167 ALA CA . 15653 1 677 . 1 1 167 167 ALA CB C 13 16.886 0.2 . 1 . . . . 167 ALA CB . 15653 1 678 . 1 1 167 167 ALA N N 15 122.554 0.1 . 1 . . . . 167 ALA N . 15653 1 679 . 1 1 168 168 GLU H H 1 7.311 0.02 . 1 . . . . 168 GLU HN . 15653 1 680 . 1 1 168 168 GLU C C 13 178.759 0.2 . 1 . . . . 168 GLU C . 15653 1 681 . 1 1 168 168 GLU CA C 13 59.766 0.2 . 1 . . . . 168 GLU CA . 15653 1 682 . 1 1 168 168 GLU CB C 13 26.153 0.2 . 1 . . . . 168 GLU CB . 15653 1 683 . 1 1 168 168 GLU N N 15 122.725 0.1 . 1 . . . . 168 GLU N . 15653 1 684 . 1 1 169 169 ALA H H 1 7.108 0.02 . 1 . . . . 169 ALA HN . 15653 1 685 . 1 1 169 169 ALA C C 13 180.211 0.2 . 1 . . . . 169 ALA C . 15653 1 686 . 1 1 169 169 ALA CA C 13 54.987 0.2 . 1 . . . . 169 ALA CA . 15653 1 687 . 1 1 169 169 ALA CB C 13 17.603 0.2 . 1 . . . . 169 ALA CB . 15653 1 688 . 1 1 169 169 ALA N N 15 122.747 0.1 . 1 . . . . 169 ALA N . 15653 1 689 . 1 1 170 170 ALA H H 1 8.158 0.02 . 1 . . . . 170 ALA HN . 15653 1 690 . 1 1 170 170 ALA C C 13 179.132 0.2 . 1 . . . . 170 ALA C . 15653 1 691 . 1 1 170 170 ALA CA C 13 54.026 0.2 . 1 . . . . 170 ALA CA . 15653 1 692 . 1 1 170 170 ALA CB C 13 19.508 0.2 . 1 . . . . 170 ALA CB . 15653 1 693 . 1 1 170 170 ALA N N 15 118.657 0.1 . 1 . . . . 170 ALA N . 15653 1 694 . 1 1 171 171 SER H H 1 7.374 0.02 . 1 . . . . 171 SER HN . 15653 1 695 . 1 1 171 171 SER C C 13 174.988 0.2 . 1 . . . . 171 SER C . 15653 1 696 . 1 1 171 171 SER CA C 13 61.562 0.2 . 1 . . . . 171 SER CA . 15653 1 697 . 1 1 171 171 SER CB C 13 63.550 0.2 . 1 . . . . 171 SER CB . 15653 1 698 . 1 1 171 171 SER N N 15 112.921 0.1 . 1 . . . . 171 SER N . 15653 1 699 . 1 1 172 172 ILE H H 1 7.004 0.02 . 1 . . . . 172 ILE HN . 15653 1 700 . 1 1 172 172 ILE C C 13 176.837 0.2 . 1 . . . . 172 ILE C . 15653 1 701 . 1 1 172 172 ILE CA C 13 62.651 0.2 . 1 . . . . 172 ILE CA . 15653 1 702 . 1 1 172 172 ILE CB C 13 37.720 0.2 . 1 . . . . 172 ILE CB . 15653 1 703 . 1 1 172 172 ILE N N 15 119.412 0.1 . 1 . . . . 172 ILE N . 15653 1 704 . 1 1 173 173 LYS H H 1 7.580 0.02 . 1 . . . . 173 LYS HN . 15653 1 705 . 1 1 173 173 LYS C C 13 175.274 0.2 . 1 . . . . 173 LYS C . 15653 1 706 . 1 1 173 173 LYS CA C 13 54.593 0.2 . 1 . . . . 173 LYS CA . 15653 1 707 . 1 1 173 173 LYS CB C 13 31.909 0.2 . 1 . . . . 173 LYS CB . 15653 1 708 . 1 1 173 173 LYS N N 15 121.804 0.1 . 1 . . . . 173 LYS N . 15653 1 709 . 1 1 174 174 ILE H H 1 7.277 0.02 . 1 . . . . 174 ILE HN . 15653 1 710 . 1 1 174 174 ILE C C 13 176.767 0.2 . 1 . . . . 174 ILE C . 15653 1 711 . 1 1 174 174 ILE CA C 13 60.773 0.2 . 1 . . . . 174 ILE CA . 15653 1 712 . 1 1 174 174 ILE CB C 13 39.759 0.2 . 1 . . . . 174 ILE CB . 15653 1 713 . 1 1 174 174 ILE N N 15 120.223 0.1 . 1 . . . . 174 ILE N . 15653 1 714 . 1 1 175 175 ARG H H 1 8.417 0.02 . 1 . . . . 175 ARG HN . 15653 1 715 . 1 1 175 175 ARG C C 13 177.176 0.2 . 1 . . . . 175 ARG C . 15653 1 716 . 1 1 175 175 ARG CA C 13 56.781 0.2 . 1 . . . . 175 ARG CA . 15653 1 717 . 1 1 175 175 ARG CB C 13 31.021 0.2 . 1 . . . . 175 ARG CB . 15653 1 718 . 1 1 175 175 ARG N N 15 125.870 0.1 . 1 . . . . 175 ARG N . 15653 1 719 . 1 1 176 176 THR H H 1 8.240 0.02 . 1 . . . . 176 THR HN . 15653 1 720 . 1 1 176 176 THR C C 13 174.671 0.2 . 1 . . . . 176 THR C . 15653 1 721 . 1 1 176 176 THR CA C 13 63.464 0.2 . 1 . . . . 176 THR CA . 15653 1 722 . 1 1 176 176 THR CB C 13 69.368 0.2 . 1 . . . . 176 THR CB . 15653 1 723 . 1 1 176 176 THR N N 15 115.430 0.1 . 1 . . . . 176 THR N . 15653 1 724 . 1 1 177 177 ASP H H 1 8.312 0.02 . 1 . . . . 177 ASP HN . 15653 1 725 . 1 1 177 177 ASP C C 13 175.970 0.2 . 1 . . . . 177 ASP C . 15653 1 726 . 1 1 177 177 ASP CA C 13 53.966 0.2 . 1 . . . . 177 ASP CA . 15653 1 727 . 1 1 177 177 ASP CB C 13 40.140 0.2 . 1 . . . . 177 ASP CB . 15653 1 728 . 1 1 177 177 ASP N N 15 121.132 0.1 . 1 . . . . 177 ASP N . 15653 1 729 . 1 1 178 178 ALA H H 1 7.575 0.02 . 1 . . . . 178 ALA HN . 15653 1 730 . 1 1 178 178 ALA C C 13 178.276 0.2 . 1 . . . . 178 ALA C . 15653 1 731 . 1 1 178 178 ALA CA C 13 53.250 0.2 . 1 . . . . 178 ALA CA . 15653 1 732 . 1 1 178 178 ALA CB C 13 19.430 0.2 . 1 . . . . 178 ALA CB . 15653 1 733 . 1 1 178 178 ALA N N 15 122.707 0.1 . 1 . . . . 178 ALA N . 15653 1 734 . 1 1 179 179 GLY H H 1 8.171 0.02 . 1 . . . . 179 GLY HN . 15653 1 735 . 1 1 179 179 GLY C C 13 173.485 0.2 . 1 . . . . 179 GLY C . 15653 1 736 . 1 1 179 179 GLY CA C 13 45.640 0.2 . 1 . . . . 179 GLY CA . 15653 1 737 . 1 1 179 179 GLY N N 15 108.095 0.1 . 1 . . . . 179 GLY N . 15653 1 738 . 1 1 180 180 PHE H H 1 7.598 0.02 . 1 . . . . 180 PHE HN . 15653 1 739 . 1 1 180 180 PHE C C 13 174.646 0.2 . 1 . . . . 180 PHE C . 15653 1 740 . 1 1 180 180 PHE CA C 13 58.046 0.2 . 1 . . . . 180 PHE CA . 15653 1 741 . 1 1 180 180 PHE CB C 13 40.279 0.2 . 1 . . . . 180 PHE CB . 15653 1 742 . 1 1 180 180 PHE N N 15 120.872 0.1 . 1 . . . . 180 PHE N . 15653 1 743 . 1 1 181 181 THR H H 1 7.744 0.02 . 1 . . . . 181 THR HN . 15653 1 744 . 1 1 181 181 THR C C 13 172.866 0.2 . 1 . . . . 181 THR C . 15653 1 745 . 1 1 181 181 THR CA C 13 61.001 0.2 . 1 . . . . 181 THR CA . 15653 1 746 . 1 1 181 181 THR CB C 13 71.095 0.2 . 1 . . . . 181 THR CB . 15653 1 747 . 1 1 181 181 THR N N 15 118.358 0.1 . 1 . . . . 181 THR N . 15653 1 748 . 1 1 182 182 LEU H H 1 7.863 0.02 . 1 . . . . 182 LEU HN . 15653 1 749 . 1 1 182 182 LEU C C 13 175.163 0.2 . 1 . . . . 182 LEU C . 15653 1 750 . 1 1 182 182 LEU CA C 13 54.440 0.2 . 1 . . . . 182 LEU CA . 15653 1 751 . 1 1 182 182 LEU CB C 13 43.624 0.2 . 1 . . . . 182 LEU CB . 15653 1 752 . 1 1 182 182 LEU N N 15 123.186 0.1 . 1 . . . . 182 LEU N . 15653 1 753 . 1 1 183 183 ARG H H 1 7.281 0.02 . 1 . . . . 183 ARG HN . 15653 1 754 . 1 1 183 183 ARG C C 13 176.031 0.2 . 1 . . . . 183 ARG C . 15653 1 755 . 1 1 183 183 ARG CA C 13 55.265 0.2 . 1 . . . . 183 ARG CA . 15653 1 756 . 1 1 183 183 ARG CB C 13 31.360 0.2 . 1 . . . . 183 ARG CB . 15653 1 757 . 1 1 183 183 ARG N N 15 121.549 0.1 . 1 . . . . 183 ARG N . 15653 1 758 . 1 1 184 184 TRP C C 13 174.913 0.2 . 1 . . . . 184 TRP C . 15653 1 759 . 1 1 184 184 TRP CA C 13 55.504 0.2 . 1 . . . . 184 TRP CA . 15653 1 760 . 1 1 184 184 TRP CB C 13 26.647 0.2 . 1 . . . . 184 TRP CB . 15653 1 761 . 1 1 185 185 VAL H H 1 8.470 0.02 . 1 . . . . 185 VAL HN . 15653 1 762 . 1 1 185 185 VAL C C 13 176.215 0.2 . 1 . . . . 185 VAL C . 15653 1 763 . 1 1 185 185 VAL CA C 13 56.876 0.2 . 1 . . . . 185 VAL CA . 15653 1 764 . 1 1 185 185 VAL CB C 13 30.215 0.2 . 1 . . . . 185 VAL CB . 15653 1 765 . 1 1 185 185 VAL N N 15 123.105 0.1 . 1 . . . . 185 VAL N . 15653 1 766 . 1 1 186 186 ARG H H 1 8.361 0.02 . 1 . . . . 186 ARG HN . 15653 1 767 . 1 1 186 186 ARG C C 13 176.266 0.2 . 1 . . . . 186 ARG C . 15653 1 768 . 1 1 186 186 ARG CA C 13 56.721 0.2 . 1 . . . . 186 ARG CA . 15653 1 769 . 1 1 186 186 ARG CB C 13 30.224 0.2 . 1 . . . . 186 ARG CB . 15653 1 770 . 1 1 186 186 ARG N N 15 122.857 0.1 . 1 . . . . 186 ARG N . 15653 1 771 . 1 1 187 187 LYS H H 1 8.295 0.02 . 1 . . . . 187 LYS HN . 15653 1 772 . 1 1 187 187 LYS C C 13 176.385 0.2 . 1 . . . . 187 LYS C . 15653 1 773 . 1 1 187 187 LYS CA C 13 56.470 0.2 . 1 . . . . 187 LYS CA . 15653 1 774 . 1 1 187 187 LYS CB C 13 32.670 0.2 . 1 . . . . 187 LYS CB . 15653 1 775 . 1 1 187 187 LYS N N 15 122.756 0.1 . 1 . . . . 187 LYS N . 15653 1 776 . 1 1 188 188 THR H H 1 7.957 0.02 . 1 . . . . 188 THR HN . 15653 1 777 . 1 1 188 188 THR C C 13 172.959 0.2 . 1 . . . . 188 THR C . 15653 1 778 . 1 1 188 188 THR CA C 13 59.436 0.2 . 1 . . . . 188 THR CA . 15653 1 779 . 1 1 188 188 THR CB C 13 69.676 0.2 . 1 . . . . 188 THR CB . 15653 1 780 . 1 1 188 188 THR N N 15 117.319 0.1 . 1 . . . . 188 THR N . 15653 1 781 . 1 1 189 189 PRO C C 13 174.967 0.2 . 1 . . . . 189 PRO C . 15653 1 782 . 1 1 190 190 TRP H H 1 10.037 0.02 . 1 . . . . 190 TRP HN . 15653 1 783 . 1 1 190 190 TRP C C 13 175.359 0.2 . 1 . . . . 190 TRP C . 15653 1 784 . 1 1 190 190 TRP CA C 13 57.393 0.2 . 1 . . . . 190 TRP CA . 15653 1 785 . 1 1 190 190 TRP CB C 13 29.471 0.2 . 1 . . . . 190 TRP CB . 15653 1 786 . 1 1 190 190 TRP N N 15 130.270 0.1 . 1 . . . . 190 TRP N . 15653 1 787 . 1 1 191 191 TYR H H 1 7.387 0.02 . 1 . . . . 191 TYR HN . 15653 1 788 . 1 1 191 191 TYR C C 13 174.137 0.2 . 1 . . . . 191 TYR C . 15653 1 789 . 1 1 191 191 TYR CA C 13 57.607 0.2 . 1 . . . . 191 TYR CA . 15653 1 790 . 1 1 191 191 TYR CB C 13 38.660 0.2 . 1 . . . . 191 TYR CB . 15653 1 791 . 1 1 191 191 TYR N N 15 122.089 0.1 . 1 . . . . 191 TYR N . 15653 1 792 . 1 1 192 192 GLN H H 1 7.455 0.02 . 1 . . . . 192 GLN HN . 15653 1 793 . 1 1 192 192 GLN C C 13 180.065 0.2 . 1 . . . . 192 GLN C . 15653 1 794 . 1 1 192 192 GLN CA C 13 57.575 0.2 . 1 . . . . 192 GLN CA . 15653 1 795 . 1 1 192 192 GLN CB C 13 30.458 0.2 . 1 . . . . 192 GLN CB . 15653 1 796 . 1 1 192 192 GLN N N 15 126.913 0.1 . 1 . . . . 192 GLN N . 15653 1 stop_ save_