data_19271 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 19271 _Entry.Title ; Backbone 1H, 13C, and 15N Chemical Shift Assignments for CRABPI ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2013-05-28 _Entry.Accession_date 2013-05-28 _Entry.Last_release_date 2014-02-13 _Entry.Original_release_date 2014-02-13 _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.Entry_ID 1 Ivan Budyak . L. . 19271 2 Anastasia Zhuravleva . . . 19271 3 Lila Gierasch . M. . 19271 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'University of Massachusetts at Amherst' . 19271 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 19271 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 401 19271 '15N chemical shifts' 130 19271 '1H chemical shifts' 130 19271 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2014-02-13 2013-05-28 original author . 19271 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 19271 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 23810905 _Citation.Full_citation . _Citation.Title 'The Role of Aromatic-Aromatic Interactions in Strand-Strand Stabilization of -Sheets.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'J. Mol. Biol.' _Citation.Journal_name_full 'Journal of molecular biology' _Citation.Journal_volume 425 _Citation.Journal_issue 18 _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 3522 _Citation.Page_last 3535 _Citation.Year 2013 _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 Ivan Budyak . L. . 19271 1 2 Anastasia Zhuravleva . . . 19271 1 3 Lila Gierasch . M. . 19271 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID aggregation 19271 1 '-barrel protein' 19271 1 'chemical shift perturbations' 19271 1 folding 19271 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 19271 _Assembly.ID 1 _Assembly.Name 'CRABP1 apo' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 CRABP1 1 $CRABP1 A . yes native no no . . . 19271 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_CRABP1 _Entity.Sf_category entity _Entity.Sf_framecode CRABP1 _Entity.Entry_ID 19271 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name CRABP1 _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 ; MGHHHHHHHHHHSSGHIEGR HMPNFAGTWKMRSSENFDEL LKALGVNAMLRKVAVAAASK PHVEIRQDGDQFYIKTSTTV RTTEINFKVGEGFEEETVDG RKCRSLPTWENENKIHCTQT LLEGDGPKTYWTRELANDEL ILTFGADDVVCTQIYVRE ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'Residues 1-22 represent a non-native affinity tag (His-tag)' _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 158 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment 'cellular retinoic acid binding protein 1' _Entity.Mutation R131Q _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 18090 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date 2015-11-25 loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 no PDB 1CBI . "Apo-Cellular Retinoic Acid Binding Protein I" . . . . . 86.08 136 99.26 100.00 2.05e-95 . . . . 19271 1 2 no PDB 1CBR . "Crystal Structure Of Cellular Retinoic-Acid-Binding Proteins I And Ii In Complex With All-Trans-Retinoic Acid And A Synthetic R" . . . . . 86.08 136 99.26 100.00 2.05e-95 . . . . 19271 1 3 no PDB 2CBR . "Cellular Retinoic Acid Binding Protein I In Complex With A Retinobenzoic Acid (Am80)" . . . . . 86.08 136 99.26 100.00 2.05e-95 . . . . 19271 1 4 no DBJ BAC32295 . "unnamed protein product [Mus musculus]" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 5 no DBJ BAE25869 . "unnamed protein product [Mus musculus]" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 6 no DBJ BAJ84031 . "cellular retinoic acid-binding protein 1 [Homo sapiens]" . . . . . 86.71 137 98.54 99.27 2.26e-95 . . . . 19271 1 7 no EMBL CAA30317 . "cellular retinoic-acid-binding protein [Bos taurus]" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 8 no EMBL CAA33509 . "unnamed protein product [Mus sp.]" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 9 no EMBL CAA33790 . "cellular reinoid acid binding protein [Mus musculus]" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 10 no EMBL CAA36011 . "cellular retinoic acid binding protein [Mus musculus]" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 11 no EMBL CAG33298 . "CRABP1 [Homo sapiens]" . . . . . 86.71 137 97.81 99.27 8.30e-95 . . . . 19271 1 12 no GB AAA30469 . "retinoic acid-binding protein [Bos taurus]" . . . . . 87.34 138 98.55 99.28 1.36e-94 . . . . 19271 1 13 no GB AAA30470 . "retinoic acid-binding protein [Bos taurus]" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 14 no GB AAA40027 . "retinoic acid binding protein II [Mus musculus]" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 15 no GB AAB20773 . "cellular retinoic acid-binding protein [Homo sapiens]" . . . . . 86.71 137 98.54 99.27 2.26e-95 . . . . 19271 1 16 no GB AAH22069 . "CRABP1 protein [Homo sapiens]" . . . . . 86.71 137 97.81 98.54 1.78e-94 . . . . 19271 1 17 no PRF 1207174A . "acid binding protein" . . . . . 86.08 136 99.26 100.00 2.05e-95 . . . . 19271 1 18 no REF NP_001099186 . "cellular retinoic acid-binding protein 1 [Rattus norvegicus]" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 19 no REF NP_001121964 . "cellular retinoic acid-binding protein 1 [Sus scrofa]" . . . . . 86.71 137 98.54 99.27 2.26e-95 . . . . 19271 1 20 no REF NP_001268580 . "cellular retinoic acid-binding protein 1 [Mesocricetus auratus]" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 21 no REF NP_004369 . "cellular retinoic acid-binding protein 1 [Homo sapiens]" . . . . . 86.71 137 98.54 99.27 2.26e-95 . . . . 19271 1 22 no REF NP_038524 . "cellular retinoic acid-binding protein 1 isoform 1 [Mus musculus]" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 23 no SP P29762 . "RecName: Full=Cellular retinoic acid-binding protein 1; AltName: Full=Cellular retinoic acid-binding protein I; Short=CRABP-I" . . . . . 86.71 137 98.54 99.27 2.26e-95 . . . . 19271 1 24 no SP P62964 . "RecName: Full=Cellular retinoic acid-binding protein 1; AltName: Full=Cellular retinoic acid-binding protein I; Short=CRABP-I" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 25 no SP P62965 . "RecName: Full=Cellular retinoic acid-binding protein 1; AltName: Full=Cellular retinoic acid-binding protein I; Short=CRABP-I" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 26 no SP P62966 . "RecName: Full=Cellular retinoic acid-binding protein 1; AltName: Full=Cellular retinoic acid-binding protein I; Short=CRABP-I" . . . . . 86.71 137 99.27 100.00 1.79e-96 . . . . 19271 1 27 no TPG DAA17503 . "TPA: cellular retinoic acid-binding protein 1 [Bos taurus]" . . . . . 86.71 137 98.54 99.27 5.99e-94 . . . . 19271 1 stop_ loop_ _Entity_biological_function.Biological_function _Entity_biological_function.Entry_ID _Entity_biological_function.Entity_ID 'retinoic acid binding and transport' 19271 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 19271 1 2 . GLY . 19271 1 3 . HIS . 19271 1 4 . HIS . 19271 1 5 . HIS . 19271 1 6 . HIS . 19271 1 7 . HIS . 19271 1 8 . HIS . 19271 1 9 . HIS . 19271 1 10 . HIS . 19271 1 11 . HIS . 19271 1 12 . HIS . 19271 1 13 . SER . 19271 1 14 . SER . 19271 1 15 . GLY . 19271 1 16 . HIS . 19271 1 17 . ILE . 19271 1 18 . GLU . 19271 1 19 . GLY . 19271 1 20 . ARG . 19271 1 21 . HIS . 19271 1 22 . MET . 19271 1 23 . PRO . 19271 1 24 . ASN . 19271 1 25 . PHE . 19271 1 26 . ALA . 19271 1 27 . GLY . 19271 1 28 . THR . 19271 1 29 . TRP . 19271 1 30 . LYS . 19271 1 31 . MET . 19271 1 32 . ARG . 19271 1 33 . SER . 19271 1 34 . SER . 19271 1 35 . GLU . 19271 1 36 . ASN . 19271 1 37 . PHE . 19271 1 38 . ASP . 19271 1 39 . GLU . 19271 1 40 . LEU . 19271 1 41 . LEU . 19271 1 42 . LYS . 19271 1 43 . ALA . 19271 1 44 . LEU . 19271 1 45 . GLY . 19271 1 46 . VAL . 19271 1 47 . ASN . 19271 1 48 . ALA . 19271 1 49 . MET . 19271 1 50 . LEU . 19271 1 51 . ARG . 19271 1 52 . LYS . 19271 1 53 . VAL . 19271 1 54 . ALA . 19271 1 55 . VAL . 19271 1 56 . ALA . 19271 1 57 . ALA . 19271 1 58 . ALA . 19271 1 59 . SER . 19271 1 60 . LYS . 19271 1 61 . PRO . 19271 1 62 . HIS . 19271 1 63 . VAL . 19271 1 64 . GLU . 19271 1 65 . ILE . 19271 1 66 . ARG . 19271 1 67 . GLN . 19271 1 68 . ASP . 19271 1 69 . GLY . 19271 1 70 . ASP . 19271 1 71 . GLN . 19271 1 72 . PHE . 19271 1 73 . TYR . 19271 1 74 . ILE . 19271 1 75 . LYS . 19271 1 76 . THR . 19271 1 77 . SER . 19271 1 78 . THR . 19271 1 79 . THR . 19271 1 80 . VAL . 19271 1 81 . ARG . 19271 1 82 . THR . 19271 1 83 . THR . 19271 1 84 . GLU . 19271 1 85 . ILE . 19271 1 86 . ASN . 19271 1 87 . PHE . 19271 1 88 . LYS . 19271 1 89 . VAL . 19271 1 90 . GLY . 19271 1 91 . GLU . 19271 1 92 . GLY . 19271 1 93 . PHE . 19271 1 94 . GLU . 19271 1 95 . GLU . 19271 1 96 . GLU . 19271 1 97 . THR . 19271 1 98 . VAL . 19271 1 99 . ASP . 19271 1 100 . GLY . 19271 1 101 . ARG . 19271 1 102 . LYS . 19271 1 103 . CYS . 19271 1 104 . ARG . 19271 1 105 . SER . 19271 1 106 . LEU . 19271 1 107 . PRO . 19271 1 108 . THR . 19271 1 109 . TRP . 19271 1 110 . GLU . 19271 1 111 . ASN . 19271 1 112 . GLU . 19271 1 113 . ASN . 19271 1 114 . LYS . 19271 1 115 . ILE . 19271 1 116 . HIS . 19271 1 117 . CYS . 19271 1 118 . THR . 19271 1 119 . GLN . 19271 1 120 . THR . 19271 1 121 . LEU . 19271 1 122 . LEU . 19271 1 123 . GLU . 19271 1 124 . GLY . 19271 1 125 . ASP . 19271 1 126 . GLY . 19271 1 127 . PRO . 19271 1 128 . LYS . 19271 1 129 . THR . 19271 1 130 . TYR . 19271 1 131 . TRP . 19271 1 132 . THR . 19271 1 133 . ARG . 19271 1 134 . GLU . 19271 1 135 . LEU . 19271 1 136 . ALA . 19271 1 137 . ASN . 19271 1 138 . ASP . 19271 1 139 . GLU . 19271 1 140 . LEU . 19271 1 141 . ILE . 19271 1 142 . LEU . 19271 1 143 . THR . 19271 1 144 . PHE . 19271 1 145 . GLY . 19271 1 146 . ALA . 19271 1 147 . ASP . 19271 1 148 . ASP . 19271 1 149 . VAL . 19271 1 150 . VAL . 19271 1 151 . CYS . 19271 1 152 . THR . 19271 1 153 . GLN . 19271 1 154 . ILE . 19271 1 155 . TYR . 19271 1 156 . VAL . 19271 1 157 . ARG . 19271 1 158 . GLU . 19271 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 19271 1 . GLY 2 2 19271 1 . HIS 3 3 19271 1 . HIS 4 4 19271 1 . HIS 5 5 19271 1 . HIS 6 6 19271 1 . HIS 7 7 19271 1 . HIS 8 8 19271 1 . HIS 9 9 19271 1 . HIS 10 10 19271 1 . HIS 11 11 19271 1 . HIS 12 12 19271 1 . SER 13 13 19271 1 . SER 14 14 19271 1 . GLY 15 15 19271 1 . HIS 16 16 19271 1 . ILE 17 17 19271 1 . GLU 18 18 19271 1 . GLY 19 19 19271 1 . ARG 20 20 19271 1 . HIS 21 21 19271 1 . MET 22 22 19271 1 . PRO 23 23 19271 1 . ASN 24 24 19271 1 . PHE 25 25 19271 1 . ALA 26 26 19271 1 . GLY 27 27 19271 1 . THR 28 28 19271 1 . TRP 29 29 19271 1 . LYS 30 30 19271 1 . MET 31 31 19271 1 . ARG 32 32 19271 1 . SER 33 33 19271 1 . SER 34 34 19271 1 . GLU 35 35 19271 1 . ASN 36 36 19271 1 . PHE 37 37 19271 1 . ASP 38 38 19271 1 . GLU 39 39 19271 1 . LEU 40 40 19271 1 . LEU 41 41 19271 1 . LYS 42 42 19271 1 . ALA 43 43 19271 1 . LEU 44 44 19271 1 . GLY 45 45 19271 1 . VAL 46 46 19271 1 . ASN 47 47 19271 1 . ALA 48 48 19271 1 . MET 49 49 19271 1 . LEU 50 50 19271 1 . ARG 51 51 19271 1 . LYS 52 52 19271 1 . VAL 53 53 19271 1 . ALA 54 54 19271 1 . VAL 55 55 19271 1 . ALA 56 56 19271 1 . ALA 57 57 19271 1 . ALA 58 58 19271 1 . SER 59 59 19271 1 . LYS 60 60 19271 1 . PRO 61 61 19271 1 . HIS 62 62 19271 1 . VAL 63 63 19271 1 . GLU 64 64 19271 1 . ILE 65 65 19271 1 . ARG 66 66 19271 1 . GLN 67 67 19271 1 . ASP 68 68 19271 1 . GLY 69 69 19271 1 . ASP 70 70 19271 1 . GLN 71 71 19271 1 . PHE 72 72 19271 1 . TYR 73 73 19271 1 . ILE 74 74 19271 1 . LYS 75 75 19271 1 . THR 76 76 19271 1 . SER 77 77 19271 1 . THR 78 78 19271 1 . THR 79 79 19271 1 . VAL 80 80 19271 1 . ARG 81 81 19271 1 . THR 82 82 19271 1 . THR 83 83 19271 1 . GLU 84 84 19271 1 . ILE 85 85 19271 1 . ASN 86 86 19271 1 . PHE 87 87 19271 1 . LYS 88 88 19271 1 . VAL 89 89 19271 1 . GLY 90 90 19271 1 . GLU 91 91 19271 1 . GLY 92 92 19271 1 . PHE 93 93 19271 1 . GLU 94 94 19271 1 . GLU 95 95 19271 1 . GLU 96 96 19271 1 . THR 97 97 19271 1 . VAL 98 98 19271 1 . ASP 99 99 19271 1 . GLY 100 100 19271 1 . ARG 101 101 19271 1 . LYS 102 102 19271 1 . CYS 103 103 19271 1 . ARG 104 104 19271 1 . SER 105 105 19271 1 . LEU 106 106 19271 1 . PRO 107 107 19271 1 . THR 108 108 19271 1 . TRP 109 109 19271 1 . GLU 110 110 19271 1 . ASN 111 111 19271 1 . GLU 112 112 19271 1 . ASN 113 113 19271 1 . LYS 114 114 19271 1 . ILE 115 115 19271 1 . HIS 116 116 19271 1 . CYS 117 117 19271 1 . THR 118 118 19271 1 . GLN 119 119 19271 1 . THR 120 120 19271 1 . LEU 121 121 19271 1 . LEU 122 122 19271 1 . GLU 123 123 19271 1 . GLY 124 124 19271 1 . ASP 125 125 19271 1 . GLY 126 126 19271 1 . PRO 127 127 19271 1 . LYS 128 128 19271 1 . THR 129 129 19271 1 . TYR 130 130 19271 1 . TRP 131 131 19271 1 . THR 132 132 19271 1 . ARG 133 133 19271 1 . GLU 134 134 19271 1 . LEU 135 135 19271 1 . ALA 136 136 19271 1 . ASN 137 137 19271 1 . ASP 138 138 19271 1 . GLU 139 139 19271 1 . LEU 140 140 19271 1 . ILE 141 141 19271 1 . LEU 142 142 19271 1 . THR 143 143 19271 1 . PHE 144 144 19271 1 . GLY 145 145 19271 1 . ALA 146 146 19271 1 . ASP 147 147 19271 1 . ASP 148 148 19271 1 . VAL 149 149 19271 1 . VAL 150 150 19271 1 . CYS 151 151 19271 1 . THR 152 152 19271 1 . GLN 153 153 19271 1 . ILE 154 154 19271 1 . TYR 155 155 19271 1 . VAL 156 156 19271 1 . ARG 157 157 19271 1 . GLU 158 158 19271 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 19271 _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 $CRABP1 . 10090 organism . 'Mus musculus' 'House Mouse' . . Eukaryota Metazoa Mus musculus . . . . . . . . . . . . . . . . . . . . . 19271 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 19271 _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 $CRABP1 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21(DE3) . . . . . . . . . . . . . . . pET-16b . . . . . . 19271 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 19271 _Sample.ID 1 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 CRABP1 '[U-99% 13C; U-99% 15N]' . . 1 $CRABP1 . . 500 . . uM 10 . . . 19271 1 2 TRIS [U-2H] . . . . . . 10 . . mM 1 . . . 19271 1 3 H2O 'natural abundance' . . . . . . 95 . . % . . . . 19271 1 4 D2O 'natural abundance' . . . . . . 5 . . % . . . . 19271 1 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 19271 _Sample_condition_list.ID 1 _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 10 1 mM 19271 1 pH 8.0 0.05 pH 19271 1 pressure 1 . atm 19271 1 temperature 273 . K 19271 1 stop_ save_ ############################ # Computer software used # ############################ save_NMRPipe _Software.Sf_category software _Software.Sf_framecode NMRPipe _Software.Entry_ID 19271 _Software.ID 1 _Software.Name NMRPipe _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' . . 19271 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'peak picking' 19271 1 processing 19271 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 19271 _Software.ID 2 _Software.Name CARA _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Keller and Wuthrich' . . 19271 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19271 2 refinement 19271 2 stop_ save_ save_AutoAssign _Software.Sf_category software _Software.Sf_framecode AutoAssign _Software.Entry_ID 19271 _Software.ID 3 _Software.Name AutoAssign _Software.Version . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Zimmerman, Moseley, Kulikowski and Montelione' . . 19271 3 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 19271 3 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 19271 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details 'equipped with a cryogenically cooled triple-resonance probe' _NMR_spectrometer.Manufacturer Agilent _NMR_spectrometer.Model 7700CS _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode spectrometer_2 _NMR_spectrometer.Entry_ID 19271 _NMR_spectrometer.ID 2 _NMR_spectrometer.Details 'equipped with TXI cryoprobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 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 19271 _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 Agilent 7700CS . 700 'equipped with a cryogenically cooled triple-resonance probe' . . 19271 1 2 spectrometer_2 Bruker Avance . 600 'equipped with TXI cryoprobe' . . 19271 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 19271 _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 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19271 1 2 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19271 1 3 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19271 1 4 '3D HNCACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19271 1 5 '3D HNCA' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19271 1 6 '3D HN(CO)CACB' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $spectrometer_2 . . . . . . . . . . . . . . . . 19271 1 7 '3D HN(CA)CO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 19271 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 19271 _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 na indirect 0.251449530 'separate tube (no insert) similar to the experimental sample tube' cylindrical parallel . . . . . . 19271 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 'separate tube (no insert) similar to the experimental sample tube' cylindrical parallel . . . . . . 19271 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 'separate tube (no insert) similar to the experimental sample tube' cylindrical parallel . . . . . . 19271 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 19271 _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 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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' . . . 19271 1 3 '3D HNCO' . . . 19271 1 4 '3D HNCACB' . . . 19271 1 5 '3D HNCA' . . . 19271 1 6 '3D HN(CO)CACB' . . . 19271 1 7 '3D HN(CA)CO' . . . 19271 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 16 16 HIS C C 13 175.150 0.3 . 1 . . . . 16 HIS C . 19271 1 2 . 1 1 16 16 HIS CA C 13 56.407 0.3 . 1 . . . . 16 HIS CA . 19271 1 3 . 1 1 16 16 HIS CB C 13 30.648 0.3 . 1 . . . . 16 HIS CB . 19271 1 4 . 1 1 17 17 ILE H H 1 7.971 0.020 . 1 . . . . 17 ILE H . 19271 1 5 . 1 1 17 17 ILE C C 13 175.691 0.3 . 1 . . . . 17 ILE C . 19271 1 6 . 1 1 17 17 ILE CA C 13 60.832 0.3 . 1 . . . . 17 ILE CA . 19271 1 7 . 1 1 17 17 ILE CB C 13 38.513 0.3 . 1 . . . . 17 ILE CB . 19271 1 8 . 1 1 17 17 ILE N N 15 122.702 0.3 . 1 . . . . 17 ILE N . 19271 1 9 . 1 1 18 18 GLU H H 1 8.477 0.020 . 1 . . . . 18 GLU H . 19271 1 10 . 1 1 18 18 GLU C C 13 176.786 0.3 . 1 . . . . 18 GLU C . 19271 1 11 . 1 1 18 18 GLU CA C 13 56.801 0.3 . 1 . . . . 18 GLU CA . 19271 1 12 . 1 1 18 18 GLU CB C 13 29.960 0.3 . 1 . . . . 18 GLU CB . 19271 1 13 . 1 1 18 18 GLU N N 15 125.012 0.3 . 1 . . . . 18 GLU N . 19271 1 14 . 1 1 19 19 GLY H H 1 8.454 0.020 . 1 . . . . 19 GLY H . 19271 1 15 . 1 1 19 19 GLY C C 13 173.711 0.3 . 1 . . . . 19 GLY C . 19271 1 16 . 1 1 19 19 GLY CA C 13 45.310 0.3 . 1 . . . . 19 GLY CA . 19271 1 17 . 1 1 19 19 GLY N N 15 110.588 0.3 . 1 . . . . 19 GLY N . 19271 1 18 . 1 1 20 20 ARG H H 1 7.975 0.020 . 1 . . . . 20 ARG H . 19271 1 19 . 1 1 20 20 ARG C C 13 175.616 0.3 . 1 . . . . 20 ARG C . 19271 1 20 . 1 1 20 20 ARG CA C 13 55.638 0.3 . 1 . . . . 20 ARG CA . 19271 1 21 . 1 1 20 20 ARG CB C 13 30.724 0.3 . 1 . . . . 20 ARG CB . 19271 1 22 . 1 1 20 20 ARG N N 15 120.088 0.3 . 1 . . . . 20 ARG N . 19271 1 23 . 1 1 21 21 HIS H H 1 8.549 0.020 . 1 . . . . 21 HIS H . 19271 1 24 . 1 1 21 21 HIS CA C 13 55.903 0.3 . 1 . . . . 21 HIS CA . 19271 1 25 . 1 1 21 21 HIS N N 15 122.226 0.3 . 1 . . . . 21 HIS N . 19271 1 26 . 1 1 23 23 PRO C C 13 175.489 0.3 . 1 . . . . 23 PRO C . 19271 1 27 . 1 1 23 23 PRO CA C 13 62.705 0.3 . 1 . . . . 23 PRO CA . 19271 1 28 . 1 1 23 23 PRO CB C 13 31.609 0.3 . 1 . . . . 23 PRO CB . 19271 1 29 . 1 1 24 24 ASN H H 1 8.493 0.020 . 1 . . . . 24 ASN H . 19271 1 30 . 1 1 24 24 ASN C C 13 174.723 0.3 . 1 . . . . 24 ASN C . 19271 1 31 . 1 1 24 24 ASN CA C 13 51.971 0.3 . 1 . . . . 24 ASN CA . 19271 1 32 . 1 1 24 24 ASN CB C 13 38.098 0.3 . 1 . . . . 24 ASN CB . 19271 1 33 . 1 1 24 24 ASN N N 15 120.020 0.3 . 1 . . . . 24 ASN N . 19271 1 34 . 1 1 25 25 PHE H H 1 9.543 0.020 . 1 . . . . 25 PHE H . 19271 1 35 . 1 1 25 25 PHE C C 13 175.337 0.3 . 1 . . . . 25 PHE C . 19271 1 36 . 1 1 25 25 PHE CA C 13 60.121 0.3 . 1 . . . . 25 PHE CA . 19271 1 37 . 1 1 25 25 PHE CB C 13 40.676 0.3 . 1 . . . . 25 PHE CB . 19271 1 38 . 1 1 25 25 PHE N N 15 121.083 0.3 . 1 . . . . 25 PHE N . 19271 1 39 . 1 1 26 26 ALA H H 1 7.831 0.020 . 1 . . . . 26 ALA H . 19271 1 40 . 1 1 26 26 ALA C C 13 177.740 0.3 . 1 . . . . 26 ALA C . 19271 1 41 . 1 1 26 26 ALA CA C 13 53.208 0.3 . 1 . . . . 26 ALA CA . 19271 1 42 . 1 1 26 26 ALA CB C 13 20.128 0.3 . 1 . . . . 26 ALA CB . 19271 1 43 . 1 1 26 26 ALA N N 15 118.067 0.3 . 1 . . . . 26 ALA N . 19271 1 44 . 1 1 27 27 GLY H H 1 8.988 0.020 . 1 . . . . 27 GLY H . 19271 1 45 . 1 1 27 27 GLY C C 13 171.795 0.3 . 1 . . . . 27 GLY C . 19271 1 46 . 1 1 27 27 GLY CA C 13 44.019 0.3 . 1 . . . . 27 GLY CA . 19271 1 47 . 1 1 27 27 GLY N N 15 108.611 0.3 . 1 . . . . 27 GLY N . 19271 1 48 . 1 1 28 28 THR H H 1 7.998 0.020 . 1 . . . . 28 THR H . 19271 1 49 . 1 1 28 28 THR C C 13 173.798 0.3 . 1 . . . . 28 THR C . 19271 1 50 . 1 1 28 28 THR CA C 13 61.028 0.3 . 1 . . . . 28 THR CA . 19271 1 51 . 1 1 28 28 THR CB C 13 69.680 0.3 . 1 . . . . 28 THR CB . 19271 1 52 . 1 1 28 28 THR N N 15 114.273 0.3 . 1 . . . . 28 THR N . 19271 1 53 . 1 1 29 29 TRP H H 1 9.364 0.020 . 1 . . . . 29 TRP H . 19271 1 54 . 1 1 29 29 TRP C C 13 174.831 0.3 . 1 . . . . 29 TRP C . 19271 1 55 . 1 1 29 29 TRP CA C 13 56.234 0.3 . 1 . . . . 29 TRP CA . 19271 1 56 . 1 1 29 29 TRP CB C 13 32.713 0.3 . 1 . . . . 29 TRP CB . 19271 1 57 . 1 1 29 29 TRP N N 15 125.436 0.3 . 1 . . . . 29 TRP N . 19271 1 58 . 1 1 30 30 LYS H H 1 9.865 0.020 . 1 . . . . 30 LYS H . 19271 1 59 . 1 1 30 30 LYS C C 13 175.250 0.3 . 1 . . . . 30 LYS C . 19271 1 60 . 1 1 30 30 LYS CA C 13 53.760 0.3 . 1 . . . . 30 LYS CA . 19271 1 61 . 1 1 30 30 LYS CB C 13 35.466 0.3 . 1 . . . . 30 LYS CB . 19271 1 62 . 1 1 30 30 LYS N N 15 121.460 0.3 . 1 . . . . 30 LYS N . 19271 1 63 . 1 1 31 31 MET H H 1 9.096 0.020 . 1 . . . . 31 MET H . 19271 1 64 . 1 1 31 31 MET C C 13 175.904 0.3 . 1 . . . . 31 MET C . 19271 1 65 . 1 1 31 31 MET CA C 13 57.391 0.3 . 1 . . . . 31 MET CA . 19271 1 66 . 1 1 31 31 MET CB C 13 34.679 0.3 . 1 . . . . 31 MET CB . 19271 1 67 . 1 1 31 31 MET N N 15 125.830 0.3 . 1 . . . . 31 MET N . 19271 1 68 . 1 1 32 32 ARG H H 1 9.900 0.020 . 1 . . . . 32 ARG H . 19271 1 69 . 1 1 32 32 ARG C C 13 175.523 0.3 . 1 . . . . 32 ARG C . 19271 1 70 . 1 1 32 32 ARG CA C 13 56.543 0.3 . 1 . . . . 32 ARG CA . 19271 1 71 . 1 1 32 32 ARG CB C 13 31.926 0.3 . 1 . . . . 32 ARG CB . 19271 1 72 . 1 1 32 32 ARG N N 15 127.042 0.3 . 1 . . . . 32 ARG N . 19271 1 73 . 1 1 33 33 SER H H 1 7.658 0.020 . 1 . . . . 33 SER H . 19271 1 74 . 1 1 33 33 SER C C 13 171.893 0.3 . 1 . . . . 33 SER C . 19271 1 75 . 1 1 33 33 SER CA C 13 57.587 0.3 . 1 . . . . 33 SER CA . 19271 1 76 . 1 1 33 33 SER CB C 13 65.256 0.3 . 1 . . . . 33 SER CB . 19271 1 77 . 1 1 33 33 SER N N 15 113.319 0.3 . 1 . . . . 33 SER N . 19271 1 78 . 1 1 34 34 SER H H 1 8.348 0.020 . 1 . . . . 34 SER H . 19271 1 79 . 1 1 34 34 SER C C 13 173.226 0.3 . 1 . . . . 34 SER C . 19271 1 80 . 1 1 34 34 SER CA C 13 57.007 0.3 . 1 . . . . 34 SER CA . 19271 1 81 . 1 1 34 34 SER CB C 13 63.978 0.3 . 1 . . . . 34 SER CB . 19271 1 82 . 1 1 34 34 SER N N 15 116.214 0.3 . 1 . . . . 34 SER N . 19271 1 83 . 1 1 35 35 GLU H H 1 8.782 0.020 . 1 . . . . 35 GLU H . 19271 1 84 . 1 1 35 35 GLU C C 13 175.947 0.3 . 1 . . . . 35 GLU C . 19271 1 85 . 1 1 35 35 GLU CA C 13 55.228 0.3 . 1 . . . . 35 GLU CA . 19271 1 86 . 1 1 35 35 GLU CB C 13 33.106 0.3 . 1 . . . . 35 GLU CB . 19271 1 87 . 1 1 35 35 GLU N N 15 126.746 0.3 . 1 . . . . 35 GLU N . 19271 1 88 . 1 1 36 36 ASN H H 1 9.275 0.020 . 1 . . . . 36 ASN H . 19271 1 89 . 1 1 36 36 ASN C C 13 175.829 0.3 . 1 . . . . 36 ASN C . 19271 1 90 . 1 1 36 36 ASN CA C 13 53.949 0.3 . 1 . . . . 36 ASN CA . 19271 1 91 . 1 1 36 36 ASN CB C 13 37.825 0.3 . 1 . . . . 36 ASN CB . 19271 1 92 . 1 1 36 36 ASN N N 15 118.965 0.3 . 1 . . . . 36 ASN N . 19271 1 93 . 1 1 37 37 PHE H H 1 8.736 0.020 . 1 . . . . 37 PHE H . 19271 1 94 . 1 1 37 37 PHE C C 13 176.700 0.3 . 1 . . . . 37 PHE C . 19271 1 95 . 1 1 37 37 PHE CA C 13 61.815 0.3 . 1 . . . . 37 PHE CA . 19271 1 96 . 1 1 37 37 PHE CB C 13 39.103 0.3 . 1 . . . . 37 PHE CB . 19271 1 97 . 1 1 37 37 PHE N N 15 121.777 0.3 . 1 . . . . 37 PHE N . 19271 1 98 . 1 1 38 38 ASP H H 1 8.583 0.020 . 1 . . . . 38 ASP H . 19271 1 99 . 1 1 38 38 ASP C C 13 177.702 0.3 . 1 . . . . 38 ASP C . 19271 1 100 . 1 1 38 38 ASP CA C 13 58.079 0.3 . 1 . . . . 38 ASP CA . 19271 1 101 . 1 1 38 38 ASP CB C 13 41.856 0.3 . 1 . . . . 38 ASP CB . 19271 1 102 . 1 1 38 38 ASP N N 15 117.769 0.3 . 1 . . . . 38 ASP N . 19271 1 103 . 1 1 39 39 GLU H H 1 8.548 0.020 . 1 . . . . 39 GLU H . 19271 1 104 . 1 1 39 39 GLU C C 13 179.143 0.3 . 1 . . . . 39 GLU C . 19271 1 105 . 1 1 39 39 GLU CA C 13 60.242 0.3 . 1 . . . . 39 GLU CA . 19271 1 106 . 1 1 39 39 GLU CB C 13 28.190 0.3 . 1 . . . . 39 GLU CB . 19271 1 107 . 1 1 39 39 GLU N N 15 117.863 0.3 . 1 . . . . 39 GLU N . 19271 1 108 . 1 1 40 40 LEU H H 1 7.940 0.020 . 1 . . . . 40 LEU H . 19271 1 109 . 1 1 40 40 LEU C C 13 177.481 0.3 . 1 . . . . 40 LEU C . 19271 1 110 . 1 1 40 40 LEU CA C 13 58.200 0.3 . 1 . . . . 40 LEU CA . 19271 1 111 . 1 1 40 40 LEU CB C 13 41.365 0.3 . 1 . . . . 40 LEU CB . 19271 1 112 . 1 1 40 40 LEU N N 15 123.276 0.3 . 1 . . . . 40 LEU N . 19271 1 113 . 1 1 41 41 LEU H H 1 7.703 0.020 . 1 . . . . 41 LEU H . 19271 1 114 . 1 1 41 41 LEU C C 13 179.300 0.3 . 1 . . . . 41 LEU C . 19271 1 115 . 1 1 41 41 LEU CA C 13 57.625 0.3 . 1 . . . . 41 LEU CA . 19271 1 116 . 1 1 41 41 LEU CB C 13 40.676 0.3 . 1 . . . . 41 LEU CB . 19271 1 117 . 1 1 41 41 LEU N N 15 116.318 0.3 . 1 . . . . 41 LEU N . 19271 1 118 . 1 1 42 42 LYS H H 1 8.465 0.020 . 1 . . . . 42 LYS H . 19271 1 119 . 1 1 42 42 LYS C C 13 180.456 0.3 . 1 . . . . 42 LYS C . 19271 1 120 . 1 1 42 42 LYS CA C 13 60.144 0.3 . 1 . . . . 42 LYS CA . 19271 1 121 . 1 1 42 42 LYS CB C 13 32.221 0.3 . 1 . . . . 42 LYS CB . 19271 1 122 . 1 1 42 42 LYS N N 15 120.636 0.3 . 1 . . . . 42 LYS N . 19271 1 123 . 1 1 43 43 ALA H H 1 8.058 0.020 . 1 . . . . 43 ALA H . 19271 1 124 . 1 1 43 43 ALA C C 13 179.113 0.3 . 1 . . . . 43 ALA C . 19271 1 125 . 1 1 43 43 ALA CA C 13 54.666 0.3 . 1 . . . . 43 ALA CA . 19271 1 126 . 1 1 43 43 ALA CB C 13 17.670 0.3 . 1 . . . . 43 ALA CB . 19271 1 127 . 1 1 43 43 ALA N N 15 124.782 0.3 . 1 . . . . 43 ALA N . 19271 1 128 . 1 1 44 44 LEU H H 1 7.401 0.020 . 1 . . . . 44 LEU H . 19271 1 129 . 1 1 44 44 LEU C C 13 176.278 0.3 . 1 . . . . 44 LEU C . 19271 1 130 . 1 1 44 44 LEU CA C 13 54.732 0.3 . 1 . . . . 44 LEU CA . 19271 1 131 . 1 1 44 44 LEU CB C 13 41.561 0.3 . 1 . . . . 44 LEU CB . 19271 1 132 . 1 1 44 44 LEU N N 15 116.248 0.3 . 1 . . . . 44 LEU N . 19271 1 133 . 1 1 45 45 GLY H H 1 7.815 0.020 . 1 . . . . 45 GLY H . 19271 1 134 . 1 1 45 45 GLY C C 13 174.505 0.3 . 1 . . . . 45 GLY C . 19271 1 135 . 1 1 45 45 GLY CA C 13 45.297 0.3 . 1 . . . . 45 GLY CA . 19271 1 136 . 1 1 45 45 GLY N N 15 107.293 0.3 . 1 . . . . 45 GLY N . 19271 1 137 . 1 1 46 46 VAL H H 1 7.685 0.020 . 1 . . . . 46 VAL H . 19271 1 138 . 1 1 46 46 VAL C C 13 176.588 0.3 . 1 . . . . 46 VAL C . 19271 1 139 . 1 1 46 46 VAL CA C 13 62.904 0.3 . 1 . . . . 46 VAL CA . 19271 1 140 . 1 1 46 46 VAL CB C 13 31.140 0.3 . 1 . . . . 46 VAL CB . 19271 1 141 . 1 1 46 46 VAL N N 15 122.096 0.3 . 1 . . . . 46 VAL N . 19271 1 142 . 1 1 47 47 ASN H H 1 8.601 0.020 . 1 . . . . 47 ASN H . 19271 1 143 . 1 1 47 47 ASN C C 13 174.770 0.3 . 1 . . . . 47 ASN C . 19271 1 144 . 1 1 47 47 ASN CA C 13 53.805 0.3 . 1 . . . . 47 ASN CA . 19271 1 145 . 1 1 47 47 ASN CB C 13 38.513 0.3 . 1 . . . . 47 ASN CB . 19271 1 146 . 1 1 47 47 ASN N N 15 127.503 0.3 . 1 . . . . 47 ASN N . 19271 1 147 . 1 1 49 49 MET C C 13 178.682 0.3 . 1 . . . . 49 MET C . 19271 1 148 . 1 1 49 49 MET CA C 13 54.533 0.3 . 1 . . . . 49 MET CA . 19271 1 149 . 1 1 50 50 LEU H H 1 8.010 0.020 . 1 . . . . 50 LEU H . 19271 1 150 . 1 1 50 50 LEU C C 13 180.478 0.3 . 1 . . . . 50 LEU C . 19271 1 151 . 1 1 50 50 LEU CA C 13 56.830 0.3 . 1 . . . . 50 LEU CA . 19271 1 152 . 1 1 50 50 LEU CB C 13 41.365 0.3 . 1 . . . . 50 LEU CB . 19271 1 153 . 1 1 50 50 LEU N N 15 120.235 0.3 . 1 . . . . 50 LEU N . 19271 1 154 . 1 1 51 51 ARG H H 1 8.739 0.020 . 1 . . . . 51 ARG H . 19271 1 155 . 1 1 51 51 ARG C C 13 177.304 0.3 . 1 . . . . 51 ARG C . 19271 1 156 . 1 1 51 51 ARG CA C 13 60.761 0.3 . 1 . . . . 51 ARG CA . 19271 1 157 . 1 1 51 51 ARG CB C 13 29.960 0.3 . 1 . . . . 51 ARG CB . 19271 1 158 . 1 1 51 51 ARG N N 15 120.732 0.3 . 1 . . . . 51 ARG N . 19271 1 159 . 1 1 52 52 LYS H H 1 7.446 0.020 . 1 . . . . 52 LYS H . 19271 1 160 . 1 1 52 52 LYS C C 13 179.653 0.3 . 1 . . . . 52 LYS C . 19271 1 161 . 1 1 52 52 LYS CA C 13 59.554 0.3 . 1 . . . . 52 LYS CA . 19271 1 162 . 1 1 52 52 LYS CB C 13 32.123 0.3 . 1 . . . . 52 LYS CB . 19271 1 163 . 1 1 52 52 LYS N N 15 117.205 0.3 . 1 . . . . 52 LYS N . 19271 1 164 . 1 1 53 53 VAL H H 1 7.031 0.020 . 1 . . . . 53 VAL H . 19271 1 165 . 1 1 53 53 VAL C C 13 177.927 0.3 . 1 . . . . 53 VAL C . 19271 1 166 . 1 1 53 53 VAL CA C 13 65.354 0.3 . 1 . . . . 53 VAL CA . 19271 1 167 . 1 1 53 53 VAL CB C 13 31.828 0.3 . 1 . . . . 53 VAL CB . 19271 1 168 . 1 1 53 53 VAL N N 15 117.704 0.3 . 1 . . . . 53 VAL N . 19271 1 169 . 1 1 54 54 ALA H H 1 8.101 0.020 . 1 . . . . 54 ALA H . 19271 1 170 . 1 1 54 54 ALA C C 13 180.562 0.3 . 1 . . . . 54 ALA C . 19271 1 171 . 1 1 54 54 ALA CA C 13 55.031 0.3 . 1 . . . . 54 ALA CA . 19271 1 172 . 1 1 54 54 ALA CB C 13 18.555 0.3 . 1 . . . . 54 ALA CB . 19271 1 173 . 1 1 54 54 ALA N N 15 123.395 0.3 . 1 . . . . 54 ALA N . 19271 1 174 . 1 1 55 55 VAL H H 1 8.778 0.020 . 1 . . . . 55 VAL H . 19271 1 175 . 1 1 55 55 VAL C C 13 178.444 0.3 . 1 . . . . 55 VAL C . 19271 1 176 . 1 1 55 55 VAL CA C 13 65.944 0.3 . 1 . . . . 55 VAL CA . 19271 1 177 . 1 1 55 55 VAL CB C 13 31.533 0.3 . 1 . . . . 55 VAL CB . 19271 1 178 . 1 1 55 55 VAL N N 15 117.542 0.3 . 1 . . . . 55 VAL N . 19271 1 179 . 1 1 56 56 ALA H H 1 7.333 0.020 . 1 . . . . 56 ALA H . 19271 1 180 . 1 1 56 56 ALA C C 13 180.429 0.3 . 1 . . . . 56 ALA C . 19271 1 181 . 1 1 56 56 ALA CA C 13 54.638 0.3 . 1 . . . . 56 ALA CA . 19271 1 182 . 1 1 56 56 ALA CB C 13 17.965 0.3 . 1 . . . . 56 ALA CB . 19271 1 183 . 1 1 56 56 ALA N N 15 121.875 0.3 . 1 . . . . 56 ALA N . 19271 1 184 . 1 1 57 57 ALA H H 1 8.149 0.020 . 1 . . . . 57 ALA H . 19271 1 185 . 1 1 57 57 ALA C C 13 178.679 0.3 . 1 . . . . 57 ALA C . 19271 1 186 . 1 1 57 57 ALA CA C 13 54.070 0.3 . 1 . . . . 57 ALA CA . 19271 1 187 . 1 1 57 57 ALA CB C 13 18.850 0.3 . 1 . . . . 57 ALA CB . 19271 1 188 . 1 1 57 57 ALA N N 15 120.595 0.3 . 1 . . . . 57 ALA N . 19271 1 189 . 1 1 58 58 ALA H H 1 7.773 0.020 . 1 . . . . 58 ALA H . 19271 1 190 . 1 1 58 58 ALA C C 13 176.868 0.3 . 1 . . . . 58 ALA C . 19271 1 191 . 1 1 58 58 ALA CA C 13 51.983 0.3 . 1 . . . . 58 ALA CA . 19271 1 192 . 1 1 58 58 ALA CB C 13 18.555 0.3 . 1 . . . . 58 ALA CB . 19271 1 193 . 1 1 58 58 ALA N N 15 119.269 0.3 . 1 . . . . 58 ALA N . 19271 1 194 . 1 1 59 59 SER H H 1 7.327 0.020 . 1 . . . . 59 SER H . 19271 1 195 . 1 1 59 59 SER C C 13 174.034 0.3 . 1 . . . . 59 SER C . 19271 1 196 . 1 1 59 59 SER CA C 13 60.077 0.3 . 1 . . . . 59 SER CA . 19271 1 197 . 1 1 59 59 SER CB C 13 63.781 0.3 . 1 . . . . 59 SER CB . 19271 1 198 . 1 1 59 59 SER N N 15 112.859 0.3 . 1 . . . . 59 SER N . 19271 1 199 . 1 1 60 60 LYS H H 1 8.031 0.020 . 1 . . . . 60 LYS H . 19271 1 200 . 1 1 60 60 LYS C C 13 172.447 0.3 . 1 . . . . 60 LYS C . 19271 1 201 . 1 1 60 60 LYS CA C 13 54.622 0.3 . 1 . . . . 60 LYS CA . 19271 1 202 . 1 1 60 60 LYS CB C 13 32.614 0.3 . 1 . . . . 60 LYS CB . 19271 1 203 . 1 1 60 60 LYS N N 15 120.343 0.3 . 1 . . . . 60 LYS N . 19271 1 204 . 1 1 61 61 PRO C C 13 176.057 0.3 . 1 . . . . 61 PRO C . 19271 1 205 . 1 1 61 61 PRO CA C 13 62.995 0.3 . 1 . . . . 61 PRO CA . 19271 1 206 . 1 1 61 61 PRO CB C 13 32.221 0.3 . 1 . . . . 61 PRO CB . 19271 1 207 . 1 1 62 62 HIS H H 1 8.864 0.020 . 1 . . . . 62 HIS H . 19271 1 208 . 1 1 62 62 HIS C C 13 174.570 0.3 . 1 . . . . 62 HIS C . 19271 1 209 . 1 1 62 62 HIS CA C 13 56.035 0.3 . 1 . . . . 62 HIS CA . 19271 1 210 . 1 1 62 62 HIS CB C 13 32.909 0.3 . 1 . . . . 62 HIS CB . 19271 1 211 . 1 1 62 62 HIS N N 15 121.557 0.3 . 1 . . . . 62 HIS N . 19271 1 212 . 1 1 63 63 VAL H H 1 8.230 0.020 . 1 . . . . 63 VAL H . 19271 1 213 . 1 1 63 63 VAL C C 13 173.777 0.3 . 1 . . . . 63 VAL C . 19271 1 214 . 1 1 63 63 VAL CA C 13 60.629 0.3 . 1 . . . . 63 VAL CA . 19271 1 215 . 1 1 63 63 VAL CB C 13 35.367 0.3 . 1 . . . . 63 VAL CB . 19271 1 216 . 1 1 63 63 VAL N N 15 126.762 0.3 . 1 . . . . 63 VAL N . 19271 1 217 . 1 1 64 64 GLU H H 1 9.238 0.020 . 1 . . . . 64 GLU H . 19271 1 218 . 1 1 64 64 GLU C C 13 174.657 0.3 . 1 . . . . 64 GLU C . 19271 1 219 . 1 1 64 64 GLU CA C 13 54.666 0.3 . 1 . . . . 64 GLU CA . 19271 1 220 . 1 1 64 64 GLU CB C 13 33.204 0.3 . 1 . . . . 64 GLU CB . 19271 1 221 . 1 1 64 64 GLU N N 15 128.180 0.3 . 1 . . . . 64 GLU N . 19271 1 222 . 1 1 65 65 ILE H H 1 9.436 0.020 . 1 . . . . 65 ILE H . 19271 1 223 . 1 1 65 65 ILE C C 13 176.956 0.3 . 1 . . . . 65 ILE C . 19271 1 224 . 1 1 65 65 ILE CA C 13 60.055 0.3 . 1 . . . . 65 ILE CA . 19271 1 225 . 1 1 65 65 ILE CB C 13 40.382 0.3 . 1 . . . . 65 ILE CB . 19271 1 226 . 1 1 65 65 ILE N N 15 123.834 0.3 . 1 . . . . 65 ILE N . 19271 1 227 . 1 1 66 66 ARG H H 1 9.566 0.020 . 1 . . . . 66 ARG H . 19271 1 228 . 1 1 66 66 ARG C C 13 173.527 0.3 . 1 . . . . 66 ARG C . 19271 1 229 . 1 1 66 66 ARG CA C 13 55.351 0.3 . 1 . . . . 66 ARG CA . 19271 1 230 . 1 1 66 66 ARG CB C 13 32.614 0.3 . 1 . . . . 66 ARG CB . 19271 1 231 . 1 1 66 66 ARG N N 15 128.364 0.3 . 1 . . . . 66 ARG N . 19271 1 232 . 1 1 67 67 GLN H H 1 8.422 0.020 . 1 . . . . 67 GLN H . 19271 1 233 . 1 1 67 67 GLN C C 13 173.706 0.3 . 1 . . . . 67 GLN C . 19271 1 234 . 1 1 67 67 GLN CA C 13 53.949 0.3 . 1 . . . . 67 GLN CA . 19271 1 235 . 1 1 67 67 GLN CB C 13 31.993 0.3 . 1 . . . . 67 GLN CB . 19271 1 236 . 1 1 67 67 GLN N N 15 124.899 0.3 . 1 . . . . 67 GLN N . 19271 1 237 . 1 1 68 68 ASP H H 1 8.677 0.020 . 1 . . . . 68 ASP H . 19271 1 238 . 1 1 68 68 ASP C C 13 176.325 0.3 . 1 . . . . 68 ASP C . 19271 1 239 . 1 1 68 68 ASP CA C 13 52.573 0.3 . 1 . . . . 68 ASP CA . 19271 1 240 . 1 1 68 68 ASP CB C 13 41.463 0.3 . 1 . . . . 68 ASP CB . 19271 1 241 . 1 1 68 68 ASP N N 15 127.685 0.3 . 1 . . . . 68 ASP N . 19271 1 242 . 1 1 69 69 GLY H H 1 9.168 0.020 . 1 . . . . 69 GLY H . 19271 1 243 . 1 1 69 69 GLY C C 13 172.863 0.3 . 1 . . . . 69 GLY C . 19271 1 244 . 1 1 69 69 GLY CA C 13 47.657 0.3 . 1 . . . . 69 GLY CA . 19271 1 245 . 1 1 69 69 GLY N N 15 116.368 0.3 . 1 . . . . 69 GLY N . 19271 1 246 . 1 1 70 70 ASP H H 1 8.608 0.020 . 1 . . . . 70 ASP H . 19271 1 247 . 1 1 70 70 ASP C C 13 174.841 0.3 . 1 . . . . 70 ASP C . 19271 1 248 . 1 1 70 70 ASP CA C 13 54.539 0.3 . 1 . . . . 70 ASP CA . 19271 1 249 . 1 1 70 70 ASP CB C 13 41.660 0.3 . 1 . . . . 70 ASP CB . 19271 1 250 . 1 1 70 70 ASP N N 15 125.574 0.3 . 1 . . . . 70 ASP N . 19271 1 251 . 1 1 71 71 GLN H H 1 8.015 0.020 . 1 . . . . 71 GLN H . 19271 1 252 . 1 1 71 71 GLN C C 13 174.401 0.3 . 1 . . . . 71 GLN C . 19271 1 253 . 1 1 71 71 GLN CA C 13 55.424 0.3 . 1 . . . . 71 GLN CA . 19271 1 254 . 1 1 71 71 GLN CB C 13 29.665 0.3 . 1 . . . . 71 GLN CB . 19271 1 255 . 1 1 71 71 GLN N N 15 120.285 0.3 . 1 . . . . 71 GLN N . 19271 1 256 . 1 1 72 72 PHE H H 1 9.243 0.020 . 1 . . . . 72 PHE H . 19271 1 257 . 1 1 72 72 PHE C C 13 174.182 0.3 . 1 . . . . 72 PHE C . 19271 1 258 . 1 1 72 72 PHE CA C 13 57.391 0.3 . 1 . . . . 72 PHE CA . 19271 1 259 . 1 1 72 72 PHE CB C 13 43.626 0.3 . 1 . . . . 72 PHE CB . 19271 1 260 . 1 1 72 72 PHE N N 15 125.277 0.3 . 1 . . . . 72 PHE N . 19271 1 261 . 1 1 73 73 TYR H H 1 8.571 0.020 . 1 . . . . 73 TYR H . 19271 1 262 . 1 1 73 73 TYR C C 13 174.639 0.3 . 1 . . . . 73 TYR C . 19271 1 263 . 1 1 73 73 TYR CA C 13 56.101 0.3 . 1 . . . . 73 TYR CA . 19271 1 264 . 1 1 73 73 TYR CB C 13 40.971 0.3 . 1 . . . . 73 TYR CB . 19271 1 265 . 1 1 73 73 TYR N N 15 122.611 0.3 . 1 . . . . 73 TYR N . 19271 1 266 . 1 1 74 74 ILE H H 1 8.464 0.020 . 1 . . . . 74 ILE H . 19271 1 267 . 1 1 74 74 ILE C C 13 174.396 0.3 . 1 . . . . 74 ILE C . 19271 1 268 . 1 1 74 74 ILE CA C 13 60.651 0.3 . 1 . . . . 74 ILE CA . 19271 1 269 . 1 1 74 74 ILE CB C 13 39.497 0.3 . 1 . . . . 74 ILE CB . 19271 1 270 . 1 1 74 74 ILE N N 15 123.341 0.3 . 1 . . . . 74 ILE N . 19271 1 271 . 1 1 75 75 LYS H H 1 9.360 0.020 . 1 . . . . 75 LYS H . 19271 1 272 . 1 1 75 75 LYS C C 13 174.906 0.3 . 1 . . . . 75 LYS C . 19271 1 273 . 1 1 75 75 LYS CA C 13 54.343 0.3 . 1 . . . . 75 LYS CA . 19271 1 274 . 1 1 75 75 LYS CB C 13 34.384 0.3 . 1 . . . . 75 LYS CB . 19271 1 275 . 1 1 75 75 LYS N N 15 133.474 0.3 . 1 . . . . 75 LYS N . 19271 1 276 . 1 1 76 76 THR H H 1 9.020 0.020 . 1 . . . . 76 THR H . 19271 1 277 . 1 1 76 76 THR C C 13 174.308 0.3 . 1 . . . . 76 THR C . 19271 1 278 . 1 1 76 76 THR CA C 13 62.110 0.3 . 1 . . . . 76 THR CA . 19271 1 279 . 1 1 76 76 THR CB C 13 69.582 0.3 . 1 . . . . 76 THR CB . 19271 1 280 . 1 1 76 76 THR N N 15 125.401 0.3 . 1 . . . . 76 THR N . 19271 1 281 . 1 1 77 77 SER H H 1 9.710 0.020 . 1 . . . . 77 SER H . 19271 1 282 . 1 1 77 77 SER C C 13 173.658 0.3 . 1 . . . . 77 SER C . 19271 1 283 . 1 1 77 77 SER CA C 13 57.784 0.3 . 1 . . . . 77 SER CA . 19271 1 284 . 1 1 77 77 SER CB C 13 65.158 0.3 . 1 . . . . 77 SER CB . 19271 1 285 . 1 1 77 77 SER N N 15 123.917 0.3 . 1 . . . . 77 SER N . 19271 1 286 . 1 1 78 78 THR H H 1 8.548 0.020 . 1 . . . . 78 THR H . 19271 1 287 . 1 1 78 78 THR C C 13 174.680 0.3 . 1 . . . . 78 THR C . 19271 1 288 . 1 1 78 78 THR CA C 13 59.525 0.3 . 1 . . . . 78 THR CA . 19271 1 289 . 1 1 78 78 THR CB C 13 71.843 0.3 . 1 . . . . 78 THR CB . 19271 1 290 . 1 1 78 78 THR N N 15 116.029 0.3 . 1 . . . . 78 THR N . 19271 1 291 . 1 1 82 82 THR C C 13 173.607 0.3 . 1 . . . . 82 THR C . 19271 1 292 . 1 1 82 82 THR CA C 13 61.799 0.3 . 1 . . . . 82 THR CA . 19271 1 293 . 1 1 82 82 THR CB C 13 70.543 0.3 . 1 . . . . 82 THR CB . 19271 1 294 . 1 1 83 83 THR H H 1 9.043 0.020 . 1 . . . . 83 THR H . 19271 1 295 . 1 1 83 83 THR C C 13 173.080 0.3 . 1 . . . . 83 THR C . 19271 1 296 . 1 1 83 83 THR CA C 13 59.924 0.3 . 1 . . . . 83 THR CA . 19271 1 297 . 1 1 83 83 THR CB C 13 71.624 0.3 . 1 . . . . 83 THR CB . 19271 1 298 . 1 1 83 83 THR N N 15 119.598 0.3 . 1 . . . . 83 THR N . 19271 1 299 . 1 1 84 84 GLU H H 1 8.836 0.020 . 1 . . . . 84 GLU H . 19271 1 300 . 1 1 84 84 GLU C C 13 174.961 0.3 . 1 . . . . 84 GLU C . 19271 1 301 . 1 1 84 84 GLU CA C 13 55.130 0.3 . 1 . . . . 84 GLU CA . 19271 1 302 . 1 1 84 84 GLU CB C 13 33.598 0.3 . 1 . . . . 84 GLU CB . 19271 1 303 . 1 1 84 84 GLU N N 15 123.364 0.3 . 1 . . . . 84 GLU N . 19271 1 304 . 1 1 85 85 ILE H H 1 8.351 0.020 . 1 . . . . 85 ILE H . 19271 1 305 . 1 1 85 85 ILE C C 13 173.200 0.3 . 1 . . . . 85 ILE C . 19271 1 306 . 1 1 85 85 ILE CA C 13 59.259 0.3 . 1 . . . . 85 ILE CA . 19271 1 307 . 1 1 85 85 ILE CB C 13 41.955 0.3 . 1 . . . . 85 ILE CB . 19271 1 308 . 1 1 85 85 ILE N N 15 116.970 0.3 . 1 . . . . 85 ILE N . 19271 1 309 . 1 1 86 86 ASN H H 1 8.158 0.020 . 1 . . . . 86 ASN H . 19271 1 310 . 1 1 86 86 ASN C C 13 173.125 0.3 . 1 . . . . 86 ASN C . 19271 1 311 . 1 1 86 86 ASN CA C 13 52.170 0.3 . 1 . . . . 86 ASN CA . 19271 1 312 . 1 1 86 86 ASN CB C 13 42.719 0.3 . 1 . . . . 86 ASN CB . 19271 1 313 . 1 1 86 86 ASN N N 15 119.904 0.3 . 1 . . . . 86 ASN N . 19271 1 314 . 1 1 87 87 PHE H H 1 8.354 0.020 . 1 . . . . 87 PHE H . 19271 1 315 . 1 1 87 87 PHE C C 13 171.291 0.3 . 1 . . . . 87 PHE C . 19271 1 316 . 1 1 87 87 PHE CA C 13 55.814 0.3 . 1 . . . . 87 PHE CA . 19271 1 317 . 1 1 87 87 PHE CB C 13 40.676 0.3 . 1 . . . . 87 PHE CB . 19271 1 318 . 1 1 87 87 PHE N N 15 116.719 0.3 . 1 . . . . 87 PHE N . 19271 1 319 . 1 1 88 88 LYS H H 1 9.591 0.020 . 1 . . . . 88 LYS H . 19271 1 320 . 1 1 88 88 LYS C C 13 176.018 0.3 . 1 . . . . 88 LYS C . 19271 1 321 . 1 1 88 88 LYS CA C 13 53.655 0.3 . 1 . . . . 88 LYS CA . 19271 1 322 . 1 1 88 88 LYS CB C 13 34.974 0.3 . 1 . . . . 88 LYS CB . 19271 1 323 . 1 1 88 88 LYS N N 15 123.775 0.3 . 1 . . . . 88 LYS N . 19271 1 324 . 1 1 89 89 VAL H H 1 8.938 0.020 . 1 . . . . 89 VAL H . 19271 1 325 . 1 1 89 89 VAL C C 13 176.107 0.3 . 1 . . . . 89 VAL C . 19271 1 326 . 1 1 89 89 VAL CA C 13 67.517 0.3 . 1 . . . . 89 VAL CA . 19271 1 327 . 1 1 89 89 VAL CB C 13 30.943 0.3 . 1 . . . . 89 VAL CB . 19271 1 328 . 1 1 89 89 VAL N N 15 125.064 0.3 . 1 . . . . 89 VAL N . 19271 1 329 . 1 1 90 90 GLY H H 1 8.659 0.020 . 1 . . . . 90 GLY H . 19271 1 330 . 1 1 90 90 GLY C C 13 173.660 0.3 . 1 . . . . 90 GLY C . 19271 1 331 . 1 1 90 90 GLY CA C 13 44.314 0.3 . 1 . . . . 90 GLY CA . 19271 1 332 . 1 1 90 90 GLY N N 15 115.746 0.3 . 1 . . . . 90 GLY N . 19271 1 333 . 1 1 91 91 GLU H H 1 8.684 0.020 . 1 . . . . 91 GLU H . 19271 1 334 . 1 1 91 91 GLU C C 13 175.770 0.3 . 1 . . . . 91 GLU C . 19271 1 335 . 1 1 91 91 GLU CA C 13 54.754 0.3 . 1 . . . . 91 GLU CA . 19271 1 336 . 1 1 91 91 GLU CB C 13 32.319 0.3 . 1 . . . . 91 GLU CB . 19271 1 337 . 1 1 91 91 GLU N N 15 121.633 0.3 . 1 . . . . 91 GLU N . 19271 1 338 . 1 1 92 92 GLY H H 1 8.715 0.020 . 1 . . . . 92 GLY H . 19271 1 339 . 1 1 92 92 GLY C C 13 173.507 0.3 . 1 . . . . 92 GLY C . 19271 1 340 . 1 1 92 92 GLY CA C 13 45.396 0.3 . 1 . . . . 92 GLY CA . 19271 1 341 . 1 1 92 92 GLY N N 15 110.186 0.3 . 1 . . . . 92 GLY N . 19271 1 342 . 1 1 93 93 PHE H H 1 9.037 0.020 . 1 . . . . 93 PHE H . 19271 1 343 . 1 1 93 93 PHE C C 13 172.080 0.3 . 1 . . . . 93 PHE C . 19271 1 344 . 1 1 93 93 PHE CA C 13 55.969 0.3 . 1 . . . . 93 PHE CA . 19271 1 345 . 1 1 93 93 PHE CB C 13 40.873 0.3 . 1 . . . . 93 PHE CB . 19271 1 346 . 1 1 93 93 PHE N N 15 119.551 0.3 . 1 . . . . 93 PHE N . 19271 1 347 . 1 1 94 94 GLU H H 1 8.770 0.020 . 1 . . . . 94 GLU H . 19271 1 348 . 1 1 94 94 GLU C C 13 175.256 0.3 . 1 . . . . 94 GLU C . 19271 1 349 . 1 1 94 94 GLU CA C 13 55.439 0.3 . 1 . . . . 94 GLU CA . 19271 1 350 . 1 1 94 94 GLU CB C 13 31.828 0.3 . 1 . . . . 94 GLU CB . 19271 1 351 . 1 1 94 94 GLU N N 15 120.844 0.3 . 1 . . . . 94 GLU N . 19271 1 352 . 1 1 95 95 GLU H H 1 8.344 0.020 . 1 . . . . 95 GLU H . 19271 1 353 . 1 1 95 95 GLU C C 13 173.498 0.3 . 1 . . . . 95 GLU C . 19271 1 354 . 1 1 95 95 GLU CA C 13 55.108 0.3 . 1 . . . . 95 GLU CA . 19271 1 355 . 1 1 95 95 GLU CB C 13 28.780 0.3 . 1 . . . . 95 GLU CB . 19271 1 356 . 1 1 95 95 GLU N N 15 121.006 0.3 . 1 . . . . 95 GLU N . 19271 1 357 . 1 1 96 96 GLU H H 1 7.492 0.020 . 1 . . . . 96 GLU H . 19271 1 358 . 1 1 96 96 GLU C C 13 177.380 0.3 . 1 . . . . 96 GLU C . 19271 1 359 . 1 1 96 96 GLU CA C 13 53.949 0.3 . 1 . . . . 96 GLU CA . 19271 1 360 . 1 1 96 96 GLU CB C 13 33.696 0.3 . 1 . . . . 96 GLU CB . 19271 1 361 . 1 1 96 96 GLU N N 15 117.605 0.3 . 1 . . . . 96 GLU N . 19271 1 362 . 1 1 97 97 THR H H 1 9.365 0.020 . 1 . . . . 97 THR H . 19271 1 363 . 1 1 97 97 THR C C 13 177.842 0.3 . 1 . . . . 97 THR C . 19271 1 364 . 1 1 97 97 THR CA C 13 61.717 0.3 . 1 . . . . 97 THR CA . 19271 1 365 . 1 1 97 97 THR CB C 13 71.155 0.3 . 1 . . . . 97 THR CB . 19271 1 366 . 1 1 97 97 THR N N 15 112.212 0.3 . 1 . . . . 97 THR N . 19271 1 367 . 1 1 98 98 VAL H H 1 9.037 0.020 . 1 . . . . 98 VAL H . 19271 1 368 . 1 1 98 98 VAL C C 13 175.503 0.3 . 1 . . . . 98 VAL C . 19271 1 369 . 1 1 98 98 VAL CA C 13 65.256 0.3 . 1 . . . . 98 VAL CA . 19271 1 370 . 1 1 98 98 VAL CB C 13 31.533 0.3 . 1 . . . . 98 VAL CB . 19271 1 371 . 1 1 98 98 VAL N N 15 121.009 0.3 . 1 . . . . 98 VAL N . 19271 1 372 . 1 1 99 99 ASP H H 1 8.692 0.020 . 1 . . . . 99 ASP H . 19271 1 373 . 1 1 99 99 ASP C C 13 175.394 0.3 . 1 . . . . 99 ASP C . 19271 1 374 . 1 1 99 99 ASP CA C 13 53.076 0.3 . 1 . . . . 99 ASP CA . 19271 1 375 . 1 1 99 99 ASP CB C 13 40.087 0.3 . 1 . . . . 99 ASP CB . 19271 1 376 . 1 1 99 99 ASP N N 15 112.799 0.3 . 1 . . . . 99 ASP N . 19271 1 377 . 1 1 100 100 GLY H H 1 7.877 0.020 . 1 . . . . 100 GLY H . 19271 1 378 . 1 1 100 100 GLY C C 13 173.985 0.3 . 1 . . . . 100 GLY C . 19271 1 379 . 1 1 100 100 GLY CA C 13 45.887 0.3 . 1 . . . . 100 GLY CA . 19271 1 380 . 1 1 100 100 GLY N N 15 108.408 0.3 . 1 . . . . 100 GLY N . 19271 1 381 . 1 1 101 101 ARG H H 1 7.792 0.020 . 1 . . . . 101 ARG H . 19271 1 382 . 1 1 101 101 ARG C C 13 176.304 0.3 . 1 . . . . 101 ARG C . 19271 1 383 . 1 1 101 101 ARG CA C 13 54.910 0.3 . 1 . . . . 101 ARG CA . 19271 1 384 . 1 1 101 101 ARG CB C 13 31.019 0.3 . 1 . . . . 101 ARG CB . 19271 1 385 . 1 1 101 101 ARG N N 15 120.200 0.3 . 1 . . . . 101 ARG N . 19271 1 386 . 1 1 102 102 LYS H H 1 8.767 0.020 . 1 . . . . 102 LYS H . 19271 1 387 . 1 1 102 102 LYS C C 13 176.709 0.3 . 1 . . . . 102 LYS C . 19271 1 388 . 1 1 102 102 LYS CA C 13 57.784 0.3 . 1 . . . . 102 LYS CA . 19271 1 389 . 1 1 102 102 LYS CB C 13 33.008 0.3 . 1 . . . . 102 LYS CB . 19271 1 390 . 1 1 102 102 LYS N N 15 122.131 0.3 . 1 . . . . 102 LYS N . 19271 1 391 . 1 1 103 103 CYS H H 1 8.966 0.020 . 1 . . . . 103 CYS H . 19271 1 392 . 1 1 103 103 CYS C C 13 170.983 0.3 . 1 . . . . 103 CYS C . 19271 1 393 . 1 1 103 103 CYS CA C 13 55.424 0.3 . 1 . . . . 103 CYS CA . 19271 1 394 . 1 1 103 103 CYS CB C 13 31.631 0.3 . 1 . . . . 103 CYS CB . 19271 1 395 . 1 1 103 103 CYS N N 15 118.424 0.3 . 1 . . . . 103 CYS N . 19271 1 396 . 1 1 104 104 ARG H H 1 8.883 0.020 . 1 . . . . 104 ARG H . 19271 1 397 . 1 1 104 104 ARG C C 13 175.276 0.3 . 1 . . . . 104 ARG C . 19271 1 398 . 1 1 104 104 ARG CA C 13 54.713 0.3 . 1 . . . . 104 ARG CA . 19271 1 399 . 1 1 104 104 ARG CB C 13 31.019 0.3 . 1 . . . . 104 ARG CB . 19271 1 400 . 1 1 104 104 ARG N N 15 119.986 0.3 . 1 . . . . 104 ARG N . 19271 1 401 . 1 1 105 105 SER H H 1 9.238 0.020 . 1 . . . . 105 SER H . 19271 1 402 . 1 1 105 105 SER C C 13 172.578 0.3 . 1 . . . . 105 SER C . 19271 1 403 . 1 1 105 105 SER CA C 13 57.489 0.3 . 1 . . . . 105 SER CA . 19271 1 404 . 1 1 105 105 SER CB C 13 67.124 0.3 . 1 . . . . 105 SER CB . 19271 1 405 . 1 1 105 105 SER N N 15 127.031 0.3 . 1 . . . . 105 SER N . 19271 1 406 . 1 1 106 106 LEU H H 1 8.013 0.020 . 1 . . . . 106 LEU H . 19271 1 407 . 1 1 106 106 LEU C C 13 172.483 0.3 . 1 . . . . 106 LEU C . 19271 1 408 . 1 1 106 106 LEU CA C 13 51.044 0.3 . 1 . . . . 106 LEU CA . 19271 1 409 . 1 1 106 106 LEU CB C 13 43.331 0.3 . 1 . . . . 106 LEU CB . 19271 1 410 . 1 1 106 106 LEU N N 15 122.865 0.3 . 1 . . . . 106 LEU N . 19271 1 411 . 1 1 107 107 PRO C C 13 175.755 0.3 . 1 . . . . 107 PRO C . 19271 1 412 . 1 1 107 107 PRO CA C 13 60.607 0.3 . 1 . . . . 107 PRO CA . 19271 1 413 . 1 1 107 107 PRO CB C 13 31.140 0.3 . 1 . . . . 107 PRO CB . 19271 1 414 . 1 1 108 108 THR H H 1 9.300 0.020 . 1 . . . . 108 THR H . 19271 1 415 . 1 1 108 108 THR C C 13 173.348 0.3 . 1 . . . . 108 THR C . 19271 1 416 . 1 1 108 108 THR CA C 13 59.947 0.3 . 1 . . . . 108 THR CA . 19271 1 417 . 1 1 108 108 THR CB C 13 72.925 0.3 . 1 . . . . 108 THR CB . 19271 1 418 . 1 1 108 108 THR N N 15 115.117 0.3 . 1 . . . . 108 THR N . 19271 1 419 . 1 1 109 109 TRP H H 1 8.601 0.020 . 1 . . . . 109 TRP H . 19271 1 420 . 1 1 109 109 TRP C C 13 176.925 0.3 . 1 . . . . 109 TRP C . 19271 1 421 . 1 1 109 109 TRP CA C 13 56.407 0.3 . 1 . . . . 109 TRP CA . 19271 1 422 . 1 1 109 109 TRP CB C 13 28.682 0.3 . 1 . . . . 109 TRP CB . 19271 1 423 . 1 1 109 109 TRP N N 15 120.870 0.3 . 1 . . . . 109 TRP N . 19271 1 424 . 1 1 110 110 GLU H H 1 9.252 0.020 . 1 . . . . 110 GLU H . 19271 1 425 . 1 1 110 110 GLU C C 13 177.318 0.3 . 1 . . . . 110 GLU C . 19271 1 426 . 1 1 110 110 GLU CA C 13 58.376 0.3 . 1 . . . . 110 GLU CA . 19271 1 427 . 1 1 110 110 GLU CB C 13 31.041 0.3 . 1 . . . . 110 GLU CB . 19271 1 428 . 1 1 110 110 GLU N N 15 130.515 0.3 . 1 . . . . 110 GLU N . 19271 1 429 . 1 1 111 111 ASN H H 1 8.645 0.020 . 1 . . . . 111 ASN H . 19271 1 430 . 1 1 111 111 ASN C C 13 174.342 0.3 . 1 . . . . 111 ASN C . 19271 1 431 . 1 1 111 111 ASN CA C 13 52.475 0.3 . 1 . . . . 111 ASN CA . 19271 1 432 . 1 1 111 111 ASN CB C 13 38.808 0.3 . 1 . . . . 111 ASN CB . 19271 1 433 . 1 1 111 111 ASN N N 15 112.387 0.3 . 1 . . . . 111 ASN N . 19271 1 434 . 1 1 112 112 GLU H H 1 9.115 0.020 . 1 . . . . 112 GLU H . 19271 1 435 . 1 1 112 112 GLU C C 13 175.336 0.3 . 1 . . . . 112 GLU C . 19271 1 436 . 1 1 112 112 GLU CA C 13 59.160 0.3 . 1 . . . . 112 GLU CA . 19271 1 437 . 1 1 112 112 GLU CB C 13 29.173 0.3 . 1 . . . . 112 GLU CB . 19271 1 438 . 1 1 112 112 GLU N N 15 116.181 0.3 . 1 . . . . 112 GLU N . 19271 1 439 . 1 1 113 113 ASN H H 1 8.754 0.020 . 1 . . . . 113 ASN H . 19271 1 440 . 1 1 113 113 ASN C C 13 174.375 0.3 . 1 . . . . 113 ASN C . 19271 1 441 . 1 1 113 113 ASN CA C 13 52.789 0.3 . 1 . . . . 113 ASN CA . 19271 1 442 . 1 1 113 113 ASN CB C 13 41.266 0.3 . 1 . . . . 113 ASN CB . 19271 1 443 . 1 1 113 113 ASN N N 15 112.799 0.3 . 1 . . . . 113 ASN N . 19271 1 444 . 1 1 114 114 LYS H H 1 7.911 0.020 . 1 . . . . 114 LYS H . 19271 1 445 . 1 1 114 114 LYS C C 13 173.698 0.3 . 1 . . . . 114 LYS C . 19271 1 446 . 1 1 114 114 LYS CA C 13 56.604 0.3 . 1 . . . . 114 LYS CA . 19271 1 447 . 1 1 114 114 LYS CB C 13 38.513 0.3 . 1 . . . . 114 LYS CB . 19271 1 448 . 1 1 114 114 LYS N N 15 120.704 0.3 . 1 . . . . 114 LYS N . 19271 1 449 . 1 1 115 115 ILE H H 1 9.373 0.020 . 1 . . . . 115 ILE H . 19271 1 450 . 1 1 115 115 ILE C C 13 174.964 0.3 . 1 . . . . 115 ILE C . 19271 1 451 . 1 1 115 115 ILE CA C 13 59.613 0.3 . 1 . . . . 115 ILE CA . 19271 1 452 . 1 1 115 115 ILE CB C 13 41.365 0.3 . 1 . . . . 115 ILE CB . 19271 1 453 . 1 1 115 115 ILE N N 15 129.092 0.3 . 1 . . . . 115 ILE N . 19271 1 454 . 1 1 116 116 HIS H H 1 9.237 0.020 . 1 . . . . 116 HIS H . 19271 1 455 . 1 1 116 116 HIS C C 13 172.906 0.3 . 1 . . . . 116 HIS C . 19271 1 456 . 1 1 116 116 HIS CA C 13 55.328 0.3 . 1 . . . . 116 HIS CA . 19271 1 457 . 1 1 116 116 HIS CB C 13 33.499 0.3 . 1 . . . . 116 HIS CB . 19271 1 458 . 1 1 116 116 HIS N N 15 127.210 0.3 . 1 . . . . 116 HIS N . 19271 1 459 . 1 1 117 117 CYS H H 1 8.384 0.020 . 1 . . . . 117 CYS H . 19271 1 460 . 1 1 117 117 CYS C C 13 173.450 0.3 . 1 . . . . 117 CYS C . 19271 1 461 . 1 1 117 117 CYS CA C 13 56.212 0.3 . 1 . . . . 117 CYS CA . 19271 1 462 . 1 1 117 117 CYS CB C 13 26.027 0.3 . 1 . . . . 117 CYS CB . 19271 1 463 . 1 1 117 117 CYS N N 15 128.866 0.3 . 1 . . . . 117 CYS N . 19271 1 464 . 1 1 118 118 THR H H 1 7.245 0.020 . 1 . . . . 118 THR H . 19271 1 465 . 1 1 118 118 THR C C 13 173.824 0.3 . 1 . . . . 118 THR C . 19271 1 466 . 1 1 118 118 THR CA C 13 61.799 0.3 . 1 . . . . 118 THR CA . 19271 1 467 . 1 1 118 118 THR CB C 13 69.779 0.3 . 1 . . . . 118 THR CB . 19271 1 468 . 1 1 118 118 THR N N 15 121.370 0.3 . 1 . . . . 118 THR N . 19271 1 469 . 1 1 119 119 GLN H H 1 7.602 0.020 . 1 . . . . 119 GLN H . 19271 1 470 . 1 1 119 119 GLN C C 13 175.508 0.3 . 1 . . . . 119 GLN C . 19271 1 471 . 1 1 119 119 GLN CA C 13 54.843 0.3 . 1 . . . . 119 GLN CA . 19271 1 472 . 1 1 119 119 GLN CB C 13 30.550 0.3 . 1 . . . . 119 GLN CB . 19271 1 473 . 1 1 119 119 GLN N N 15 121.669 0.3 . 1 . . . . 119 GLN N . 19271 1 474 . 1 1 120 120 THR H H 1 9.070 0.020 . 1 . . . . 120 THR H . 19271 1 475 . 1 1 120 120 THR C C 13 173.817 0.3 . 1 . . . . 120 THR C . 19271 1 476 . 1 1 120 120 THR CA C 13 61.026 0.3 . 1 . . . . 120 THR CA . 19271 1 477 . 1 1 120 120 THR CB C 13 70.739 0.3 . 1 . . . . 120 THR CB . 19271 1 478 . 1 1 120 120 THR N N 15 119.375 0.3 . 1 . . . . 120 THR N . 19271 1 479 . 1 1 121 121 LEU H H 1 9.098 0.020 . 1 . . . . 121 LEU H . 19271 1 480 . 1 1 121 121 LEU C C 13 177.847 0.3 . 1 . . . . 121 LEU C . 19271 1 481 . 1 1 121 121 LEU CA C 13 55.947 0.3 . 1 . . . . 121 LEU CA . 19271 1 482 . 1 1 121 121 LEU CB C 13 41.758 0.3 . 1 . . . . 121 LEU CB . 19271 1 483 . 1 1 121 121 LEU N N 15 128.482 0.3 . 1 . . . . 121 LEU N . 19271 1 484 . 1 1 122 122 LEU H H 1 7.758 0.020 . 1 . . . . 122 LEU H . 19271 1 485 . 1 1 122 122 LEU C C 13 177.287 0.3 . 1 . . . . 122 LEU C . 19271 1 486 . 1 1 122 122 LEU CA C 13 56.609 0.3 . 1 . . . . 122 LEU CA . 19271 1 487 . 1 1 122 122 LEU CB C 13 41.955 0.3 . 1 . . . . 122 LEU CB . 19271 1 488 . 1 1 122 122 LEU N N 15 121.177 0.3 . 1 . . . . 122 LEU N . 19271 1 489 . 1 1 123 123 GLU H H 1 8.042 0.020 . 1 . . . . 123 GLU H . 19271 1 490 . 1 1 123 123 GLU C C 13 174.928 0.3 . 1 . . . . 123 GLU C . 19271 1 491 . 1 1 123 123 GLU CA C 13 55.218 0.3 . 1 . . . . 123 GLU CA . 19271 1 492 . 1 1 123 123 GLU CB C 13 32.223 0.3 . 1 . . . . 123 GLU CB . 19271 1 493 . 1 1 123 123 GLU N N 15 117.150 0.3 . 1 . . . . 123 GLU N . 19271 1 494 . 1 1 124 124 GLY H H 1 8.250 0.020 . 1 . . . . 124 GLY H . 19271 1 495 . 1 1 124 124 GLY C C 13 171.995 0.3 . 1 . . . . 124 GLY C . 19271 1 496 . 1 1 124 124 GLY CA C 13 44.609 0.3 . 1 . . . . 124 GLY CA . 19271 1 497 . 1 1 124 124 GLY N N 15 108.972 0.3 . 1 . . . . 124 GLY N . 19271 1 498 . 1 1 125 125 ASP H H 1 8.246 0.020 . 1 . . . . 125 ASP H . 19271 1 499 . 1 1 125 125 ASP C C 13 175.296 0.3 . 1 . . . . 125 ASP C . 19271 1 500 . 1 1 125 125 ASP CA C 13 52.770 0.3 . 1 . . . . 125 ASP CA . 19271 1 501 . 1 1 125 125 ASP CB C 13 43.626 0.3 . 1 . . . . 125 ASP CB . 19271 1 502 . 1 1 125 125 ASP N N 15 117.951 0.3 . 1 . . . . 125 ASP N . 19271 1 503 . 1 1 126 126 GLY H H 1 8.218 0.020 . 1 . . . . 126 GLY H . 19271 1 504 . 1 1 126 126 GLY C C 13 169.970 0.3 . 1 . . . . 126 GLY C . 19271 1 505 . 1 1 126 126 GLY CA C 13 45.297 0.3 . 1 . . . . 126 GLY CA . 19271 1 506 . 1 1 126 126 GLY N N 15 108.394 0.3 . 1 . . . . 126 GLY N . 19271 1 507 . 1 1 127 127 PRO C C 13 175.438 0.3 . 1 . . . . 127 PRO C . 19271 1 508 . 1 1 127 127 PRO CA C 13 62.440 0.3 . 1 . . . . 127 PRO CA . 19271 1 509 . 1 1 127 127 PRO CB C 13 32.319 0.3 . 1 . . . . 127 PRO CB . 19271 1 510 . 1 1 128 128 LYS H H 1 8.584 0.020 . 1 . . . . 128 LYS H . 19271 1 511 . 1 1 128 128 LYS C C 13 177.747 0.3 . 1 . . . . 128 LYS C . 19271 1 512 . 1 1 128 128 LYS CA C 13 56.411 0.3 . 1 . . . . 128 LYS CA . 19271 1 513 . 1 1 128 128 LYS CB C 13 31.828 0.3 . 1 . . . . 128 LYS CB . 19271 1 514 . 1 1 128 128 LYS N N 15 122.805 0.3 . 1 . . . . 128 LYS N . 19271 1 515 . 1 1 129 129 THR H H 1 8.917 0.020 . 1 . . . . 129 THR H . 19271 1 516 . 1 1 129 129 THR C C 13 173.736 0.3 . 1 . . . . 129 THR C . 19271 1 517 . 1 1 129 129 THR CA C 13 59.988 0.3 . 1 . . . . 129 THR CA . 19271 1 518 . 1 1 129 129 THR CB C 13 72.138 0.3 . 1 . . . . 129 THR CB . 19271 1 519 . 1 1 129 129 THR N N 15 118.323 0.3 . 1 . . . . 129 THR N . 19271 1 520 . 1 1 130 130 TYR H H 1 7.444 0.020 . 1 . . . . 130 TYR H . 19271 1 521 . 1 1 130 130 TYR C C 13 174.375 0.3 . 1 . . . . 130 TYR C . 19271 1 522 . 1 1 130 130 TYR CA C 13 56.014 0.3 . 1 . . . . 130 TYR CA . 19271 1 523 . 1 1 130 130 TYR CB C 13 40.775 0.3 . 1 . . . . 130 TYR CB . 19271 1 524 . 1 1 130 130 TYR N N 15 114.396 0.3 . 1 . . . . 130 TYR N . 19271 1 525 . 1 1 131 131 TRP H H 1 8.466 0.020 . 1 . . . . 131 TRP H . 19271 1 526 . 1 1 131 131 TRP C C 13 174.833 0.3 . 1 . . . . 131 TRP C . 19271 1 527 . 1 1 131 131 TRP CA C 13 54.997 0.3 . 1 . . . . 131 TRP CA . 19271 1 528 . 1 1 131 131 TRP CB C 13 33.696 0.3 . 1 . . . . 131 TRP CB . 19271 1 529 . 1 1 131 131 TRP N N 15 116.946 0.3 . 1 . . . . 131 TRP N . 19271 1 530 . 1 1 132 132 THR H H 1 9.535 0.020 . 1 . . . . 132 THR H . 19271 1 531 . 1 1 132 132 THR C C 13 174.391 0.3 . 1 . . . . 132 THR C . 19271 1 532 . 1 1 132 132 THR CA C 13 60.340 0.3 . 1 . . . . 132 THR CA . 19271 1 533 . 1 1 132 132 THR CB C 13 71.745 0.3 . 1 . . . . 132 THR CB . 19271 1 534 . 1 1 132 132 THR N N 15 110.239 0.3 . 1 . . . . 132 THR N . 19271 1 535 . 1 1 133 133 ARG H H 1 9.029 0.020 . 1 . . . . 133 ARG H . 19271 1 536 . 1 1 133 133 ARG C C 13 173.217 0.3 . 1 . . . . 133 ARG C . 19271 1 537 . 1 1 133 133 ARG CA C 13 55.549 0.3 . 1 . . . . 133 ARG CA . 19271 1 538 . 1 1 133 133 ARG CB C 13 34.876 0.3 . 1 . . . . 133 ARG CB . 19271 1 539 . 1 1 133 133 ARG N N 15 120.682 0.3 . 1 . . . . 133 ARG N . 19271 1 540 . 1 1 134 134 GLU H H 1 9.108 0.020 . 1 . . . . 134 GLU H . 19271 1 541 . 1 1 134 134 GLU C C 13 173.023 0.3 . 1 . . . . 134 GLU C . 19271 1 542 . 1 1 134 134 GLU CA C 13 53.655 0.3 . 1 . . . . 134 GLU CA . 19271 1 543 . 1 1 134 134 GLU CB C 13 34.384 0.3 . 1 . . . . 134 GLU CB . 19271 1 544 . 1 1 134 134 GLU N N 15 124.344 0.3 . 1 . . . . 134 GLU N . 19271 1 545 . 1 1 135 135 LEU H H 1 8.273 0.020 . 1 . . . . 135 LEU H . 19271 1 546 . 1 1 135 135 LEU C C 13 176.069 0.3 . 1 . . . . 135 LEU C . 19271 1 547 . 1 1 135 135 LEU CA C 13 53.032 0.3 . 1 . . . . 135 LEU CA . 19271 1 548 . 1 1 135 135 LEU CB C 13 42.643 0.3 . 1 . . . . 135 LEU CB . 19271 1 549 . 1 1 135 135 LEU N N 15 127.323 0.3 . 1 . . . . 135 LEU N . 19271 1 550 . 1 1 136 136 ALA H H 1 9.142 0.020 . 1 . . . . 136 ALA H . 19271 1 551 . 1 1 136 136 ALA C C 13 176.914 0.3 . 1 . . . . 136 ALA C . 19271 1 552 . 1 1 136 136 ALA CA C 13 51.197 0.3 . 1 . . . . 136 ALA CA . 19271 1 553 . 1 1 136 136 ALA CB C 13 20.423 0.3 . 1 . . . . 136 ALA CB . 19271 1 554 . 1 1 136 136 ALA N N 15 130.776 0.3 . 1 . . . . 136 ALA N . 19271 1 555 . 1 1 137 137 ASN C C 13 173.743 0.3 . 1 . . . . 137 ASN C . 19271 1 556 . 1 1 137 137 ASN CA C 13 54.933 0.3 . 1 . . . . 137 ASN CA . 19271 1 557 . 1 1 137 137 ASN CB C 13 37.202 0.3 . 1 . . . . 137 ASN CB . 19271 1 558 . 1 1 138 138 ASP H H 1 8.784 0.020 . 1 . . . . 138 ASP H . 19271 1 559 . 1 1 138 138 ASP C C 13 173.851 0.3 . 1 . . . . 138 ASP C . 19271 1 560 . 1 1 138 138 ASP CA C 13 55.881 0.3 . 1 . . . . 138 ASP CA . 19271 1 561 . 1 1 138 138 ASP CB C 13 41.266 0.3 . 1 . . . . 138 ASP CB . 19271 1 562 . 1 1 138 138 ASP N N 15 115.067 0.3 . 1 . . . . 138 ASP N . 19271 1 563 . 1 1 139 139 GLU H H 1 7.924 0.020 . 1 . . . . 139 GLU H . 19271 1 564 . 1 1 139 139 GLU C C 13 173.371 0.3 . 1 . . . . 139 GLU C . 19271 1 565 . 1 1 139 139 GLU CA C 13 55.129 0.3 . 1 . . . . 139 GLU CA . 19271 1 566 . 1 1 139 139 GLU CB C 13 32.221 0.3 . 1 . . . . 139 GLU CB . 19271 1 567 . 1 1 139 139 GLU N N 15 117.640 0.3 . 1 . . . . 139 GLU N . 19271 1 568 . 1 1 140 140 LEU H H 1 8.373 0.020 . 1 . . . . 140 LEU H . 19271 1 569 . 1 1 140 140 LEU C C 13 174.835 0.3 . 1 . . . . 140 LEU C . 19271 1 570 . 1 1 140 140 LEU CA C 13 53.407 0.3 . 1 . . . . 140 LEU CA . 19271 1 571 . 1 1 140 140 LEU CB C 13 42.446 0.3 . 1 . . . . 140 LEU CB . 19271 1 572 . 1 1 140 140 LEU N N 15 124.258 0.3 . 1 . . . . 140 LEU N . 19271 1 573 . 1 1 141 141 ILE H H 1 9.575 0.020 . 1 . . . . 141 ILE H . 19271 1 574 . 1 1 141 141 ILE C C 13 175.774 0.3 . 1 . . . . 141 ILE C . 19271 1 575 . 1 1 141 141 ILE CA C 13 60.832 0.3 . 1 . . . . 141 ILE CA . 19271 1 576 . 1 1 141 141 ILE CB C 13 38.808 0.3 . 1 . . . . 141 ILE CB . 19271 1 577 . 1 1 141 141 ILE N N 15 127.160 0.3 . 1 . . . . 141 ILE N . 19271 1 578 . 1 1 142 142 LEU H H 1 9.881 0.020 . 1 . . . . 142 LEU H . 19271 1 579 . 1 1 142 142 LEU C C 13 174.266 0.3 . 1 . . . . 142 LEU C . 19271 1 580 . 1 1 142 142 LEU CA C 13 53.208 0.3 . 1 . . . . 142 LEU CA . 19271 1 581 . 1 1 142 142 LEU CB C 13 45.199 0.3 . 1 . . . . 142 LEU CB . 19271 1 582 . 1 1 142 142 LEU N N 15 136.968 0.3 . 1 . . . . 142 LEU N . 19271 1 583 . 1 1 143 143 THR H H 1 8.877 0.020 . 1 . . . . 143 THR H . 19271 1 584 . 1 1 143 143 THR C C 13 173.059 0.3 . 1 . . . . 143 THR C . 19271 1 585 . 1 1 143 143 THR CA C 13 60.023 0.3 . 1 . . . . 143 THR CA . 19271 1 586 . 1 1 143 143 THR CB C 13 70.543 0.3 . 1 . . . . 143 THR CB . 19271 1 587 . 1 1 143 143 THR N N 15 119.817 0.3 . 1 . . . . 143 THR N . 19271 1 588 . 1 1 144 144 PHE H H 1 9.036 0.020 . 1 . . . . 144 PHE H . 19271 1 589 . 1 1 144 144 PHE C C 13 174.373 0.3 . 1 . . . . 144 PHE C . 19271 1 590 . 1 1 144 144 PHE CA C 13 55.893 0.3 . 1 . . . . 144 PHE CA . 19271 1 591 . 1 1 144 144 PHE CB C 13 43.702 0.3 . 1 . . . . 144 PHE CB . 19271 1 592 . 1 1 144 144 PHE N N 15 119.612 0.3 . 1 . . . . 144 PHE N . 19271 1 593 . 1 1 145 145 GLY H H 1 7.375 0.020 . 1 . . . . 145 GLY H . 19271 1 594 . 1 1 145 145 GLY C C 13 173.839 0.3 . 1 . . . . 145 GLY C . 19271 1 595 . 1 1 145 145 GLY CA C 13 43.331 0.3 . 1 . . . . 145 GLY CA . 19271 1 596 . 1 1 145 145 GLY N N 15 106.560 0.3 . 1 . . . . 145 GLY N . 19271 1 597 . 1 1 146 146 ALA H H 1 8.370 0.020 . 1 . . . . 146 ALA H . 19271 1 598 . 1 1 146 146 ALA C C 13 175.604 0.3 . 1 . . . . 146 ALA C . 19271 1 599 . 1 1 146 146 ALA CA C 13 51.265 0.3 . 1 . . . . 146 ALA CA . 19271 1 600 . 1 1 146 146 ALA CB C 13 20.718 0.3 . 1 . . . . 146 ALA CB . 19271 1 601 . 1 1 146 146 ALA N N 15 124.111 0.3 . 1 . . . . 146 ALA N . 19271 1 602 . 1 1 147 147 ASP H H 1 9.485 0.020 . 1 . . . . 147 ASP H . 19271 1 603 . 1 1 147 147 ASP C C 13 175.829 0.3 . 1 . . . . 147 ASP C . 19271 1 604 . 1 1 147 147 ASP CA C 13 57.292 0.3 . 1 . . . . 147 ASP CA . 19271 1 605 . 1 1 147 147 ASP CB C 13 39.005 0.3 . 1 . . . . 147 ASP CB . 19271 1 606 . 1 1 147 147 ASP N N 15 122.919 0.3 . 1 . . . . 147 ASP N . 19271 1 607 . 1 1 148 148 ASP H H 1 8.732 0.020 . 1 . . . . 148 ASP H . 19271 1 608 . 1 1 148 148 ASP C C 13 175.269 0.3 . 1 . . . . 148 ASP C . 19271 1 609 . 1 1 148 148 ASP CA C 13 54.736 0.3 . 1 . . . . 148 ASP CA . 19271 1 610 . 1 1 148 148 ASP CB C 13 40.382 0.3 . 1 . . . . 148 ASP CB . 19271 1 611 . 1 1 148 148 ASP N N 15 122.781 0.3 . 1 . . . . 148 ASP N . 19271 1 612 . 1 1 149 149 VAL H H 1 8.417 0.020 . 1 . . . . 149 VAL H . 19271 1 613 . 1 1 149 149 VAL C C 13 174.828 0.3 . 1 . . . . 149 VAL C . 19271 1 614 . 1 1 149 149 VAL CA C 13 63.257 0.3 . 1 . . . . 149 VAL CA . 19271 1 615 . 1 1 149 149 VAL CB C 13 32.221 0.3 . 1 . . . . 149 VAL CB . 19271 1 616 . 1 1 149 149 VAL N N 15 123.754 0.3 . 1 . . . . 149 VAL N . 19271 1 617 . 1 1 150 150 VAL H H 1 8.512 0.020 . 1 . . . . 150 VAL H . 19271 1 618 . 1 1 150 150 VAL C C 13 175.428 0.3 . 1 . . . . 150 VAL C . 19271 1 619 . 1 1 150 150 VAL CA C 13 60.832 0.3 . 1 . . . . 150 VAL CA . 19271 1 620 . 1 1 150 150 VAL CB C 13 35.171 0.3 . 1 . . . . 150 VAL CB . 19271 1 621 . 1 1 150 150 VAL N N 15 125.801 0.3 . 1 . . . . 150 VAL N . 19271 1 622 . 1 1 151 151 CYS H H 1 9.399 0.020 . 1 . . . . 151 CYS H . 19271 1 623 . 1 1 151 151 CYS C C 13 173.216 0.3 . 1 . . . . 151 CYS C . 19271 1 624 . 1 1 151 151 CYS CA C 13 55.916 0.3 . 1 . . . . 151 CYS CA . 19271 1 625 . 1 1 151 151 CYS CB C 13 30.353 0.3 . 1 . . . . 151 CYS CB . 19271 1 626 . 1 1 151 151 CYS N N 15 127.965 0.3 . 1 . . . . 151 CYS N . 19271 1 627 . 1 1 152 152 THR H H 1 7.964 0.020 . 1 . . . . 152 THR H . 19271 1 628 . 1 1 152 152 THR C C 13 174.347 0.3 . 1 . . . . 152 THR C . 19271 1 629 . 1 1 152 152 THR CA C 13 61.910 0.3 . 1 . . . . 152 THR CA . 19271 1 630 . 1 1 152 152 THR CB C 13 70.762 0.3 . 1 . . . . 152 THR CB . 19271 1 631 . 1 1 152 152 THR N N 15 123.734 0.3 . 1 . . . . 152 THR N . 19271 1 632 . 1 1 153 153 GLN H H 1 10.029 0.020 . 1 . . . . 153 GLN H . 19271 1 633 . 1 1 153 153 GLN C C 13 173.468 0.3 . 1 . . . . 153 GLN C . 19271 1 634 . 1 1 153 153 GLN CA C 13 54.136 0.3 . 1 . . . . 153 GLN CA . 19271 1 635 . 1 1 153 153 GLN CB C 13 32.811 0.3 . 1 . . . . 153 GLN CB . 19271 1 636 . 1 1 153 153 GLN N N 15 128.529 0.3 . 1 . . . . 153 GLN N . 19271 1 637 . 1 1 154 154 ILE H H 1 8.442 0.020 . 1 . . . . 154 ILE H . 19271 1 638 . 1 1 154 154 ILE C C 13 174.790 0.3 . 1 . . . . 154 ILE C . 19271 1 639 . 1 1 154 154 ILE CA C 13 60.828 0.3 . 1 . . . . 154 ILE CA . 19271 1 640 . 1 1 154 154 ILE CB C 13 39.497 0.3 . 1 . . . . 154 ILE CB . 19271 1 641 . 1 1 154 154 ILE N N 15 121.834 0.3 . 1 . . . . 154 ILE N . 19271 1 642 . 1 1 155 155 TYR H H 1 9.965 0.020 . 1 . . . . 155 TYR H . 19271 1 643 . 1 1 155 155 TYR C C 13 174.387 0.3 . 1 . . . . 155 TYR C . 19271 1 644 . 1 1 155 155 TYR CA C 13 56.309 0.3 . 1 . . . . 155 TYR CA . 19271 1 645 . 1 1 155 155 TYR CB C 13 41.758 0.3 . 1 . . . . 155 TYR CB . 19271 1 646 . 1 1 155 155 TYR N N 15 128.091 0.3 . 1 . . . . 155 TYR N . 19271 1 647 . 1 1 156 156 VAL H H 1 9.509 0.020 . 1 . . . . 156 VAL H . 19271 1 648 . 1 1 156 156 VAL C C 13 175.492 0.3 . 1 . . . . 156 VAL C . 19271 1 649 . 1 1 156 156 VAL CA C 13 58.862 0.3 . 1 . . . . 156 VAL CA . 19271 1 650 . 1 1 156 156 VAL CB C 13 35.072 0.3 . 1 . . . . 156 VAL CB . 19271 1 651 . 1 1 156 156 VAL N N 15 113.325 0.3 . 1 . . . . 156 VAL N . 19271 1 652 . 1 1 157 157 ARG H H 1 8.785 0.020 . 1 . . . . 157 ARG H . 19271 1 653 . 1 1 157 157 ARG C C 13 177.035 0.3 . 1 . . . . 157 ARG C . 19271 1 654 . 1 1 157 157 ARG CA C 13 57.382 0.3 . 1 . . . . 157 ARG CA . 19271 1 655 . 1 1 157 157 ARG CB C 13 29.861 0.3 . 1 . . . . 157 ARG CB . 19271 1 656 . 1 1 157 157 ARG N N 15 124.629 0.3 . 1 . . . . 157 ARG N . 19271 1 657 . 1 1 158 158 GLU H H 1 7.962 0.020 . 1 . . . . 158 GLU H . 19271 1 658 . 1 1 158 158 GLU C C 13 181.040 0.3 . 1 . . . . 158 GLU C . 19271 1 659 . 1 1 158 158 GLU CA C 13 58.553 0.3 . 1 . . . . 158 GLU CA . 19271 1 660 . 1 1 158 158 GLU CB C 13 31.140 0.3 . 1 . . . . 158 GLU CB . 19271 1 661 . 1 1 158 158 GLU N N 15 127.816 0.3 . 1 . . . . 158 GLU N . 19271 1 stop_ save_