data_17160 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 17160 _Entry.Title ; 1H, 13C, 15N resonance assignment of the chitin-binding protein CBP21 from Serratia marcescens ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2010-08-31 _Entry.Accession_date 2010-08-31 _Entry.Last_release_date . _Entry.Original_release_date . _Entry.Origination author _Entry.NMR_STAR_version 3.1.1.61 _Entry.Original_NMR_STAR_version 3.0.9.13 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype solution _Entry.Details 'chitin-binding protein CBP21' _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 Gustav Vaaje-Kolstad . . . 17160 2 Vincent Eijsink . 'G. H.' . 17160 3 Finn Aachmann . L. . 17160 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 17160 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 652 17160 '15N chemical shifts' 179 17160 '1H chemical shifts' 1032 17160 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 . . 2011-03-24 2010-08-31 update BMRB 'update entry citation' 17160 1 . . 2010-11-09 2010-08-31 original author 'original release' 17160 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 2LHS 'BMRB Entry Tracking System' 17160 stop_ save_ ############### # Citations # ############### save_entry_citation _Citation.Sf_category citations _Citation.Sf_framecode entry_citation _Citation.Entry_ID 17160 _Citation.ID 1 _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 21052875 _Citation.Full_citation . _Citation.Title '(1)H, (13)C, (15)N resonance assignment of the chitin-binding protein CBP21 from Serratia marcescens.' _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Biomol. NMR Assignments' _Citation.Journal_name_full 'Biomolecular NMR assignments' _Citation.Journal_volume 5 _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 117 _Citation.Page_last 119 _Citation.Year 2011 _Citation.Details . loop_ _Citation_author.Ordinal _Citation_author.Given_name _Citation_author.Family_name _Citation_author.First_initial _Citation_author.Middle_initials _Citation_author.Family_title _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Finn Aachmann . L. . 17160 1 2 Vincent Eijsink . G.H. . 17160 1 3 Gustav Vaaje-Kolstad . . . 17160 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID 'carbohydrate-binding module (CBM)' 17160 1 CBM33 17160 1 Chitin 17160 1 'Chitin-binding protein (CBP)' 17160 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 17160 _Assembly.ID 1 _Assembly.Name CBP21 _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 18794 _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 CBP21 1 $CBP21 A . yes native no no . . . 17160 1 stop_ loop_ _Bond.ID _Bond.Type _Bond.Value_order _Bond.Assembly_atom_ID_1 _Bond.Entity_assembly_ID_1 _Bond.Entity_assembly_name_1 _Bond.Entity_ID_1 _Bond.Comp_ID_1 _Bond.Comp_index_ID_1 _Bond.Seq_ID_1 _Bond.Atom_ID_1 _Bond.Assembly_atom_ID_2 _Bond.Entity_assembly_ID_2 _Bond.Entity_assembly_name_2 _Bond.Entity_ID_2 _Bond.Comp_ID_2 _Bond.Comp_index_ID_2 _Bond.Seq_ID_2 _Bond.Atom_ID_2 _Bond.Auth_entity_assembly_ID_1 _Bond.Auth_entity_assembly_name_1 _Bond.Auth_seq_ID_1 _Bond.Auth_comp_ID_1 _Bond.Auth_atom_ID_1 _Bond.Auth_entity_assembly_ID_2 _Bond.Auth_entity_assembly_name_2 _Bond.Auth_seq_ID_2 _Bond.Auth_comp_ID_2 _Bond.Auth_atom_ID_2 _Bond.Entry_ID _Bond.Assembly_ID 1 disulfide single . 1 . 1 CYS 14 14 SG . 1 . 1 CYS 22 22 SG . . . . . . . . . . 17160 1 2 disulfide single . 1 . 1 CYS 118 118 SG . 1 . 1 CYS 135 135 SG . . . . . . . . . . 17160 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 GenBank AY665558 . . . . . . 17160 1 stop_ loop_ _Assembly_bio_function.Biological_function _Assembly_bio_function.Entry_ID _Assembly_bio_function.Assembly_ID 'Chitin-Binding protein' 17160 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_CBP21 _Entity.Sf_category entity _Entity.Sf_framecode CBP21 _Entity.Entry_ID 17160 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name CBP21 _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 ; HGYVESPASRAYQCKLQLNT QCGSVQYEPQSVEGLKGFPQ AGPADGHIASADKSTFFELD QQTPTRWNKLNLKTGPNSFT WKLTARHSTTSWRYFITKPN WDASQPLTRASFDLTPFCQF NDGGAIPAAQVTHQCNIPAD RSGSHVILAVWDIADTANAF YQAIDVNLSK ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details 'CBP21 carrying an N-terminal leader sequence, which is cleaved of during translocation to the periplasmic space resulting in CBP21 (AA: 28-197)' _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 170 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all disulfide bound' _Entity.Src_method . _Entity.Parent_entity_ID . _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 18794 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'CAZy database: CBM33. Carbohydrate-Binding Module Family 33.' _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 2BEM . "Crystal Structure Of The Serratia Marcescens Chitin-Binding Protein Cbp21" . . . . . 100.00 170 100.00 100.00 1.04e-122 . . . . 17160 1 2 no PDB 2BEN . "Crystal Structure Of The Serratia Marcescens Chitin-Binding Protein Cbp21 Y54a Mutant" . . . . . 100.00 170 99.41 99.41 1.90e-121 . . . . 17160 1 3 no PDB 2LHS . "Structure Of The Chitin Binding Protein 21 (cbp21)" . . . . . 100.00 170 100.00 100.00 1.04e-122 . . . . 17160 1 4 no DBJ BAA31569 . "CBP21 precursor [Serratia marcescens]" . . . . . 100.00 197 100.00 100.00 1.32e-123 . . . . 17160 1 5 no DBJ BAO35063 . "chitin-binding protein [Serratia marcescens SM39]" . . . . . 100.00 197 99.41 100.00 2.33e-123 . . . . 17160 1 6 no EMBL CDG13442 . "chitin-binding protein [Serratia marcescens subsp. marcescens Db11]" . . . . . 100.00 197 99.41 99.41 5.72e-123 . . . . 17160 1 7 no GB AAU88202 . "chitin-binding protein precursor [Serratia marcescens]" . . . . . 100.00 197 100.00 100.00 1.32e-123 . . . . 17160 1 8 no GB AGO05942 . "chitin-binding protein, partial [Serratia marcescens]" . . . . . 100.00 170 98.82 99.41 1.35e-121 . . . . 17160 1 9 no GB AIA47583 . "chitin-binding domain-containing protein [Serratia sp. FS14]" . . . . . 100.00 197 100.00 100.00 1.32e-123 . . . . 17160 1 10 no GB AIM23065 . "chitin-binding domain-containing protein [Serratia sp. SCBI]" . . . . . 99.41 197 98.82 99.41 1.87e-121 . . . . 17160 1 11 no GB AKL42792 . "chitin-binding protein [Serratia marcescens]" . . . . . 100.00 197 99.41 100.00 4.91e-123 . . . . 17160 1 12 no REF WP_004936574 . "MULTISPECIES: chitin-binding protein [Serratia]" . . . . . 100.00 197 100.00 100.00 1.32e-123 . . . . 17160 1 13 no REF WP_019453872 . "chitin-binding protein [Serratia marcescens]" . . . . . 99.41 197 98.82 99.41 1.50e-121 . . . . 17160 1 14 no REF WP_025303806 . "chitin-binding protein [Serratia marcescens]" . . . . . 100.00 197 99.41 99.41 5.72e-123 . . . . 17160 1 15 no REF WP_033635482 . "MULTISPECIES: chitin-binding protein [Enterobacteriaceae]" . . . . . 100.00 197 100.00 100.00 1.57e-123 . . . . 17160 1 16 no REF WP_033643984 . "MULTISPECIES: chitin-binding protein [Serratia]" . . . . . 99.41 197 98.82 99.41 1.87e-121 . . . . 17160 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 . HIS . 17160 1 2 . GLY . 17160 1 3 . TYR . 17160 1 4 . VAL . 17160 1 5 . GLU . 17160 1 6 . SER . 17160 1 7 . PRO . 17160 1 8 . ALA . 17160 1 9 . SER . 17160 1 10 . ARG . 17160 1 11 . ALA . 17160 1 12 . TYR . 17160 1 13 . GLN . 17160 1 14 . CYS . 17160 1 15 . LYS . 17160 1 16 . LEU . 17160 1 17 . GLN . 17160 1 18 . LEU . 17160 1 19 . ASN . 17160 1 20 . THR . 17160 1 21 . GLN . 17160 1 22 . CYS . 17160 1 23 . GLY . 17160 1 24 . SER . 17160 1 25 . VAL . 17160 1 26 . GLN . 17160 1 27 . TYR . 17160 1 28 . GLU . 17160 1 29 . PRO . 17160 1 30 . GLN . 17160 1 31 . SER . 17160 1 32 . VAL . 17160 1 33 . GLU . 17160 1 34 . GLY . 17160 1 35 . LEU . 17160 1 36 . LYS . 17160 1 37 . GLY . 17160 1 38 . PHE . 17160 1 39 . PRO . 17160 1 40 . GLN . 17160 1 41 . ALA . 17160 1 42 . GLY . 17160 1 43 . PRO . 17160 1 44 . ALA . 17160 1 45 . ASP . 17160 1 46 . GLY . 17160 1 47 . HIS . 17160 1 48 . ILE . 17160 1 49 . ALA . 17160 1 50 . SER . 17160 1 51 . ALA . 17160 1 52 . ASP . 17160 1 53 . LYS . 17160 1 54 . SER . 17160 1 55 . THR . 17160 1 56 . PHE . 17160 1 57 . PHE . 17160 1 58 . GLU . 17160 1 59 . LEU . 17160 1 60 . ASP . 17160 1 61 . GLN . 17160 1 62 . GLN . 17160 1 63 . THR . 17160 1 64 . PRO . 17160 1 65 . THR . 17160 1 66 . ARG . 17160 1 67 . TRP . 17160 1 68 . ASN . 17160 1 69 . LYS . 17160 1 70 . LEU . 17160 1 71 . ASN . 17160 1 72 . LEU . 17160 1 73 . LYS . 17160 1 74 . THR . 17160 1 75 . GLY . 17160 1 76 . PRO . 17160 1 77 . ASN . 17160 1 78 . SER . 17160 1 79 . PHE . 17160 1 80 . THR . 17160 1 81 . TRP . 17160 1 82 . LYS . 17160 1 83 . LEU . 17160 1 84 . THR . 17160 1 85 . ALA . 17160 1 86 . ARG . 17160 1 87 . HIS . 17160 1 88 . SER . 17160 1 89 . THR . 17160 1 90 . THR . 17160 1 91 . SER . 17160 1 92 . TRP . 17160 1 93 . ARG . 17160 1 94 . TYR . 17160 1 95 . PHE . 17160 1 96 . ILE . 17160 1 97 . THR . 17160 1 98 . LYS . 17160 1 99 . PRO . 17160 1 100 . ASN . 17160 1 101 . TRP . 17160 1 102 . ASP . 17160 1 103 . ALA . 17160 1 104 . SER . 17160 1 105 . GLN . 17160 1 106 . PRO . 17160 1 107 . LEU . 17160 1 108 . THR . 17160 1 109 . ARG . 17160 1 110 . ALA . 17160 1 111 . SER . 17160 1 112 . PHE . 17160 1 113 . ASP . 17160 1 114 . LEU . 17160 1 115 . THR . 17160 1 116 . PRO . 17160 1 117 . PHE . 17160 1 118 . CYS . 17160 1 119 . GLN . 17160 1 120 . PHE . 17160 1 121 . ASN . 17160 1 122 . ASP . 17160 1 123 . GLY . 17160 1 124 . GLY . 17160 1 125 . ALA . 17160 1 126 . ILE . 17160 1 127 . PRO . 17160 1 128 . ALA . 17160 1 129 . ALA . 17160 1 130 . GLN . 17160 1 131 . VAL . 17160 1 132 . THR . 17160 1 133 . HIS . 17160 1 134 . GLN . 17160 1 135 . CYS . 17160 1 136 . ASN . 17160 1 137 . ILE . 17160 1 138 . PRO . 17160 1 139 . ALA . 17160 1 140 . ASP . 17160 1 141 . ARG . 17160 1 142 . SER . 17160 1 143 . GLY . 17160 1 144 . SER . 17160 1 145 . HIS . 17160 1 146 . VAL . 17160 1 147 . ILE . 17160 1 148 . LEU . 17160 1 149 . ALA . 17160 1 150 . VAL . 17160 1 151 . TRP . 17160 1 152 . ASP . 17160 1 153 . ILE . 17160 1 154 . ALA . 17160 1 155 . ASP . 17160 1 156 . THR . 17160 1 157 . ALA . 17160 1 158 . ASN . 17160 1 159 . ALA . 17160 1 160 . PHE . 17160 1 161 . TYR . 17160 1 162 . GLN . 17160 1 163 . ALA . 17160 1 164 . ILE . 17160 1 165 . ASP . 17160 1 166 . VAL . 17160 1 167 . ASN . 17160 1 168 . LEU . 17160 1 169 . SER . 17160 1 170 . LYS . 17160 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 . HIS 1 1 17160 1 . GLY 2 2 17160 1 . TYR 3 3 17160 1 . VAL 4 4 17160 1 . GLU 5 5 17160 1 . SER 6 6 17160 1 . PRO 7 7 17160 1 . ALA 8 8 17160 1 . SER 9 9 17160 1 . ARG 10 10 17160 1 . ALA 11 11 17160 1 . TYR 12 12 17160 1 . GLN 13 13 17160 1 . CYS 14 14 17160 1 . LYS 15 15 17160 1 . LEU 16 16 17160 1 . GLN 17 17 17160 1 . LEU 18 18 17160 1 . ASN 19 19 17160 1 . THR 20 20 17160 1 . GLN 21 21 17160 1 . CYS 22 22 17160 1 . GLY 23 23 17160 1 . SER 24 24 17160 1 . VAL 25 25 17160 1 . GLN 26 26 17160 1 . TYR 27 27 17160 1 . GLU 28 28 17160 1 . PRO 29 29 17160 1 . GLN 30 30 17160 1 . SER 31 31 17160 1 . VAL 32 32 17160 1 . GLU 33 33 17160 1 . GLY 34 34 17160 1 . LEU 35 35 17160 1 . LYS 36 36 17160 1 . GLY 37 37 17160 1 . PHE 38 38 17160 1 . PRO 39 39 17160 1 . GLN 40 40 17160 1 . ALA 41 41 17160 1 . GLY 42 42 17160 1 . PRO 43 43 17160 1 . ALA 44 44 17160 1 . ASP 45 45 17160 1 . GLY 46 46 17160 1 . HIS 47 47 17160 1 . ILE 48 48 17160 1 . ALA 49 49 17160 1 . SER 50 50 17160 1 . ALA 51 51 17160 1 . ASP 52 52 17160 1 . LYS 53 53 17160 1 . SER 54 54 17160 1 . THR 55 55 17160 1 . PHE 56 56 17160 1 . PHE 57 57 17160 1 . GLU 58 58 17160 1 . LEU 59 59 17160 1 . ASP 60 60 17160 1 . GLN 61 61 17160 1 . GLN 62 62 17160 1 . THR 63 63 17160 1 . PRO 64 64 17160 1 . THR 65 65 17160 1 . ARG 66 66 17160 1 . TRP 67 67 17160 1 . ASN 68 68 17160 1 . LYS 69 69 17160 1 . LEU 70 70 17160 1 . ASN 71 71 17160 1 . LEU 72 72 17160 1 . LYS 73 73 17160 1 . THR 74 74 17160 1 . GLY 75 75 17160 1 . PRO 76 76 17160 1 . ASN 77 77 17160 1 . SER 78 78 17160 1 . PHE 79 79 17160 1 . THR 80 80 17160 1 . TRP 81 81 17160 1 . LYS 82 82 17160 1 . LEU 83 83 17160 1 . THR 84 84 17160 1 . ALA 85 85 17160 1 . ARG 86 86 17160 1 . HIS 87 87 17160 1 . SER 88 88 17160 1 . THR 89 89 17160 1 . THR 90 90 17160 1 . SER 91 91 17160 1 . TRP 92 92 17160 1 . ARG 93 93 17160 1 . TYR 94 94 17160 1 . PHE 95 95 17160 1 . ILE 96 96 17160 1 . THR 97 97 17160 1 . LYS 98 98 17160 1 . PRO 99 99 17160 1 . ASN 100 100 17160 1 . TRP 101 101 17160 1 . ASP 102 102 17160 1 . ALA 103 103 17160 1 . SER 104 104 17160 1 . GLN 105 105 17160 1 . PRO 106 106 17160 1 . LEU 107 107 17160 1 . THR 108 108 17160 1 . ARG 109 109 17160 1 . ALA 110 110 17160 1 . SER 111 111 17160 1 . PHE 112 112 17160 1 . ASP 113 113 17160 1 . LEU 114 114 17160 1 . THR 115 115 17160 1 . PRO 116 116 17160 1 . PHE 117 117 17160 1 . CYS 118 118 17160 1 . GLN 119 119 17160 1 . PHE 120 120 17160 1 . ASN 121 121 17160 1 . ASP 122 122 17160 1 . GLY 123 123 17160 1 . GLY 124 124 17160 1 . ALA 125 125 17160 1 . ILE 126 126 17160 1 . PRO 127 127 17160 1 . ALA 128 128 17160 1 . ALA 129 129 17160 1 . GLN 130 130 17160 1 . VAL 131 131 17160 1 . THR 132 132 17160 1 . HIS 133 133 17160 1 . GLN 134 134 17160 1 . CYS 135 135 17160 1 . ASN 136 136 17160 1 . ILE 137 137 17160 1 . PRO 138 138 17160 1 . ALA 139 139 17160 1 . ASP 140 140 17160 1 . ARG 141 141 17160 1 . SER 142 142 17160 1 . GLY 143 143 17160 1 . SER 144 144 17160 1 . HIS 145 145 17160 1 . VAL 146 146 17160 1 . ILE 147 147 17160 1 . LEU 148 148 17160 1 . ALA 149 149 17160 1 . VAL 150 150 17160 1 . TRP 151 151 17160 1 . ASP 152 152 17160 1 . ILE 153 153 17160 1 . ALA 154 154 17160 1 . ASP 155 155 17160 1 . THR 156 156 17160 1 . ALA 157 157 17160 1 . ASN 158 158 17160 1 . ALA 159 159 17160 1 . PHE 160 160 17160 1 . TYR 161 161 17160 1 . GLN 162 162 17160 1 . ALA 163 163 17160 1 . ILE 164 164 17160 1 . ASP 165 165 17160 1 . VAL 166 166 17160 1 . ASN 167 167 17160 1 . LEU 168 168 17160 1 . SER 169 169 17160 1 . LYS 170 170 17160 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 17160 _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 $CBP21 . 615 organism . 'Serratia marcescens' 'Serratia marcescens' . . Bacteria . Serratia marcescens BJL200 . . . . . . . . . . . . . . . cbp . 'EMBL-Bank: AB015998.1' . . 17160 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 17160 _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 $CBP21 . 'recombinant technology' 'Escherichia coli' . . . Escherichia coli BL21 DE3 . . . . . . . . . . . . . . pRSETB_cbp21 . . . 'pRSETB expression vector with cbp21 gene' . . 17160 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_label_H2O _Sample.Sf_category sample _Sample.Sf_framecode label_H2O _Sample.Entry_ID 17160 _Sample.ID 1 _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 CBP21 '[U-98% 13C; U-98% 15N]' . . 1 $CBP21 . . . 1.0 1.6 mM 0.1 . . . 17160 1 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM 0.1 . . . 17160 1 3 'sodium chloride' 'natural abundance' . . . . . . 10 . . mM 0.1 . . . 17160 1 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17160 1 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17160 1 stop_ save_ save_label_D2O _Sample.Sf_category sample _Sample.Sf_framecode label_D2O _Sample.Entry_ID 17160 _Sample.ID 2 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 CBP21 '[U-98% 13C; U-98% 15N]' . . 1 $CBP21 . . . 1.2 1.4 mM 0.1 . . . 17160 2 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM 0.1 . . . 17160 2 3 'sodium chloride' 'natural abundance' . . . . . . 10 . . mM 0.1 . . . 17160 2 4 D2O 'natural abundance' . . . . . . 100 . . % . . . . 17160 2 stop_ save_ save_non_D2O _Sample.Sf_category sample _Sample.Sf_framecode non_D2O _Sample.Entry_ID 17160 _Sample.ID 3 _Sample.Type solution _Sample.Sub_type . _Sample.Details . _Sample.Aggregate_sample_number . _Sample.Solvent_system '100% 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 CBP21 'natural abundance' . . 1 $CBP21 . . . 1.2 1.4 mM 0.1 . . . 17160 3 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM 0.1 . . . 17160 3 3 'sodium chloride' 'natural abundance' . . . . . . 10 . . mM 0.1 . . . 17160 3 4 D2O 'natural abundance' . . . . . . 100 . . % . . . . 17160 3 stop_ save_ save_non_H2O _Sample.Sf_category sample _Sample.Sf_framecode non_H2O _Sample.Entry_ID 17160 _Sample.ID 4 _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 CBP21 'natural abundance' . . 1 $CBP21 . . . 1.2 1.4 mM 0.1 . . . 17160 4 2 'sodium phosphate' 'natural abundance' . . . . . . 20 . . mM 0.1 . . . 17160 4 3 'sodium chloride' 'natural abundance' . . . . . . 10 . . mM 0.1 . . . 17160 4 4 H2O 'natural abundance' . . . . . . 90 . . % . . . . 17160 4 5 D2O 'natural abundance' . . . . . . 10 . . % . . . . 17160 4 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 17160 _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' 0.06 0.01 M 17160 1 pH 5.5 0.1 pH 17160 1 pressure 1 . atm 17160 1 temperature 298 0.1 K 17160 1 stop_ save_ ############################ # Computer software used # ############################ save_xwinnmr _Software.Sf_category software _Software.Sf_framecode xwinnmr _Software.Entry_ID 17160 _Software.ID 1 _Software.Name xwinnmr _Software.Version 3.5 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 17160 1 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID collection 17160 1 stop_ save_ save_CARA _Software.Sf_category software _Software.Sf_framecode CARA _Software.Entry_ID 17160 _Software.ID 2 _Software.Name CARA _Software.Version 1.5.1/1.8.4 _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CARA . . 17160 2 stop_ loop_ _Task.Task _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' 17160 2 'data analysis' 17160 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 17160 _NMR_spectrometer.ID 1 _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model Avance _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ 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 17160 _NMR_spectrometer_list.ID 1 loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 spectrometer_1 Bruker Avance . 600 . . . 17160 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 17160 _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 $label_H2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 2 '2D 1H-13C HSQC' no . . . . . . . . . . 2 $label_D2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 3 '2D 1H-1H TOCSY' no . . . . . . . . . . 3 $non_D2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 4 '2D 1H-1H TOCSY' no . . . . . . . . . . 4 $non_H2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 5 '2D 1H-1H COSY' no . . . . . . . . . . 3 $non_D2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 6 '2D 1H-1H COSY' no . . . . . . . . . . 4 $non_H2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 7 '2D 1H-1H NOESY' no . . . . . . . . . . 3 $non_D2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 8 '2D 1H-1H NOESY' no . . . . . . . . . . 4 $non_H2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 9 '3D CBCA(CO)NH' no . . . . . . . . . . 1 $label_H2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 10 '3D HNCO' no . . . . . . . . . . 1 $label_H2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 11 '3D HNCA' no . . . . . . . . . . 1 $label_H2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 12 '3D HNCACB' no . . . . . . . . . . 1 $label_H2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 13 '3D HN(CO)CA' no . . . . . . . . . . 1 $label_H2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 14 '3D HCCH-TOCSY' no . . . . . . . . . . 2 $label_D2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 15 '3D HCCH-COSY' no . . . . . . . . . . 2 $label_D2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 16 '3D HBHANH' no . . . . . . . . . . 1 $label_H2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 17 '3D HN(CA)CO' no . . . . . . . . . . 1 $label_H2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 1 18 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $label_H2O isotropic . . 1 $sample_conditions_1 . . . 1 $spectrometer_1 . . . . . . . . . . . . . . . . 17160 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 17160 _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 . . . . . . . . . 17160 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . . . . . 17160 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . . . . . 17160 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 17160 _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' . . . 17160 1 2 '2D 1H-13C HSQC' . . . 17160 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 $xwinnmr . . 17160 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 HIS HD2 H 1 6.92 0.02 . 1 . . . . 1 HIS HD2 . 17160 1 2 . 1 1 1 1 HIS HE1 H 1 8.83 0.02 . 1 . . . . 1 HIS HE1 . 17160 1 3 . 1 1 1 1 HIS C C 13 179.4 0.3 . 1 . . . . 1 HIS C . 17160 1 4 . 1 1 1 1 HIS CE1 C 13 136.7 0.3 . 1 . . . . 1 HIS CE1 . 17160 1 5 . 1 1 2 2 GLY H H 1 8.00 0.02 . 1 . . . . 2 GLY H . 17160 1 6 . 1 1 2 2 GLY HA2 H 1 4.61 0.02 . 2 . . . . 2 GLY HA2 . 17160 1 7 . 1 1 2 2 GLY HA3 H 1 4.48 0.02 . 2 . . . . 2 GLY HA3 . 17160 1 8 . 1 1 2 2 GLY C C 13 169.7 0.3 . 1 . . . . 2 GLY C . 17160 1 9 . 1 1 2 2 GLY CA C 13 46.3 0.3 . 1 . . . . 2 GLY CA . 17160 1 10 . 1 1 2 2 GLY N N 15 109.6 0.3 . 1 . . . . 2 GLY N . 17160 1 11 . 1 1 3 3 TYR H H 1 8.42 0.02 . 1 . . . . 3 TYR H . 17160 1 12 . 1 1 3 3 TYR HA H 1 4.67 0.02 . 1 . . . . 3 TYR HA . 17160 1 13 . 1 1 3 3 TYR HB2 H 1 2.88 0.02 . 2 . . . . 3 TYR HB2 . 17160 1 14 . 1 1 3 3 TYR HB3 H 1 2.85 0.02 . 2 . . . . 3 TYR HB3 . 17160 1 15 . 1 1 3 3 TYR HD1 H 1 6.26 0.02 . 1 . . . . 3 TYR HD1 . 17160 1 16 . 1 1 3 3 TYR HE1 H 1 5.89 0.02 . 1 . . . . 3 TYR HE1 . 17160 1 17 . 1 1 3 3 TYR C C 13 172.5 0.3 . 1 . . . . 3 TYR C . 17160 1 18 . 1 1 3 3 TYR CA C 13 55.2 0.3 . 1 . . . . 3 TYR CA . 17160 1 19 . 1 1 3 3 TYR CB C 13 40.2 0.3 . 1 . . . . 3 TYR CB . 17160 1 20 . 1 1 3 3 TYR N N 15 114.8 0.3 . 1 . . . . 3 TYR N . 17160 1 21 . 1 1 4 4 VAL H H 1 7.45 0.02 . 1 . . . . 4 VAL H . 17160 1 22 . 1 1 4 4 VAL HA H 1 3.53 0.02 . 1 . . . . 4 VAL HA . 17160 1 23 . 1 1 4 4 VAL HB H 1 1.63 0.02 . 1 . . . . 4 VAL HB . 17160 1 24 . 1 1 4 4 VAL HG11 H 1 0.72 0.02 . 1 . . . . 4 VAL HG1 . 17160 1 25 . 1 1 4 4 VAL HG12 H 1 0.72 0.02 . 1 . . . . 4 VAL HG1 . 17160 1 26 . 1 1 4 4 VAL HG13 H 1 0.72 0.02 . 1 . . . . 4 VAL HG1 . 17160 1 27 . 1 1 4 4 VAL HG21 H 1 -0.66 0.02 . 1 . . . . 4 VAL HG2 . 17160 1 28 . 1 1 4 4 VAL HG22 H 1 -0.66 0.02 . 1 . . . . 4 VAL HG2 . 17160 1 29 . 1 1 4 4 VAL HG23 H 1 -0.66 0.02 . 1 . . . . 4 VAL HG2 . 17160 1 30 . 1 1 4 4 VAL C C 13 173.4 0.3 . 1 . . . . 4 VAL C . 17160 1 31 . 1 1 4 4 VAL CA C 13 63.1 0.3 . 1 . . . . 4 VAL CA . 17160 1 32 . 1 1 4 4 VAL CB C 13 30.6 0.3 . 1 . . . . 4 VAL CB . 17160 1 33 . 1 1 4 4 VAL CG1 C 13 21.6 0.3 . 1 . . . . 4 VAL CG1 . 17160 1 34 . 1 1 4 4 VAL CG2 C 13 19.4 0.3 . 1 . . . . 4 VAL CG2 . 17160 1 35 . 1 1 4 4 VAL N N 15 120.1 0.3 . 1 . . . . 4 VAL N . 17160 1 36 . 1 1 5 5 GLU H H 1 8.57 0.02 . 1 . . . . 5 GLU H . 17160 1 37 . 1 1 5 5 GLU HA H 1 4.22 0.02 . 1 . . . . 5 GLU HA . 17160 1 38 . 1 1 5 5 GLU HB2 H 1 1.67 0.02 . 2 . . . . 5 GLU HB2 . 17160 1 39 . 1 1 5 5 GLU HB3 H 1 1.65 0.02 . 2 . . . . 5 GLU HB3 . 17160 1 40 . 1 1 5 5 GLU HG2 H 1 2.07 0.02 . 1 . . . . 5 GLU HG2 . 17160 1 41 . 1 1 5 5 GLU C C 13 175.8 0.3 . 1 . . . . 5 GLU C . 17160 1 42 . 1 1 5 5 GLU CA C 13 56.2 0.3 . 1 . . . . 5 GLU CA . 17160 1 43 . 1 1 5 5 GLU CB C 13 32.5 0.3 . 1 . . . . 5 GLU CB . 17160 1 44 . 1 1 5 5 GLU CG C 13 36.4 0.3 . 1 . . . . 5 GLU CG . 17160 1 45 . 1 1 5 5 GLU N N 15 131.5 0.3 . 1 . . . . 5 GLU N . 17160 1 46 . 1 1 6 6 SER H H 1 7.08 0.02 . 1 . . . . 6 SER H . 17160 1 47 . 1 1 6 6 SER HA H 1 4.78 0.02 . 1 . . . . 6 SER HA . 17160 1 48 . 1 1 6 6 SER HB2 H 1 3.64 0.02 . 2 . . . . 6 SER HB2 . 17160 1 49 . 1 1 6 6 SER HB3 H 1 3.62 0.02 . 2 . . . . 6 SER HB3 . 17160 1 50 . 1 1 6 6 SER C C 13 171.6 0.3 . 1 . . . . 6 SER C . 17160 1 51 . 1 1 6 6 SER CA C 13 54.5 0.3 . 1 . . . . 6 SER CA . 17160 1 52 . 1 1 6 6 SER CB C 13 64.8 0.3 . 1 . . . . 6 SER CB . 17160 1 53 . 1 1 6 6 SER N N 15 111.6 0.3 . 1 . . . . 6 SER N . 17160 1 54 . 1 1 7 7 PRO HA H 1 4.54 0.02 . 1 . . . . 7 PRO HA . 17160 1 55 . 1 1 7 7 PRO HB2 H 1 2.27 0.02 . 2 . . . . 7 PRO HB2 . 17160 1 56 . 1 1 7 7 PRO HB3 H 1 1.84 0.02 . 2 . . . . 7 PRO HB3 . 17160 1 57 . 1 1 7 7 PRO HD2 H 1 3.49 0.02 . 2 . . . . 7 PRO HD2 . 17160 1 58 . 1 1 7 7 PRO HD3 H 1 2.64 0.02 . 2 . . . . 7 PRO HD3 . 17160 1 59 . 1 1 7 7 PRO HG2 H 1 1.78 0.02 . 2 . . . . 7 PRO HG2 . 17160 1 60 . 1 1 7 7 PRO HG3 H 1 1.61 0.02 . 2 . . . . 7 PRO HG3 . 17160 1 61 . 1 1 7 7 PRO C C 13 174.1 0.3 . 1 . . . . 7 PRO C . 17160 1 62 . 1 1 7 7 PRO CA C 13 62.1 0.3 . 1 . . . . 7 PRO CA . 17160 1 63 . 1 1 7 7 PRO CB C 13 33.0 0.3 . 1 . . . . 7 PRO CB . 17160 1 64 . 1 1 7 7 PRO CD C 13 51.0 0.3 . 1 . . . . 7 PRO CD . 17160 1 65 . 1 1 7 7 PRO CG C 13 25.2 0.3 . 1 . . . . 7 PRO CG . 17160 1 66 . 1 1 8 8 ALA H H 1 8.09 0.02 . 1 . . . . 8 ALA H . 17160 1 67 . 1 1 8 8 ALA HA H 1 4.16 0.02 . 1 . . . . 8 ALA HA . 17160 1 68 . 1 1 8 8 ALA HB1 H 1 1.45 0.02 . 1 . . . . 8 ALA HB . 17160 1 69 . 1 1 8 8 ALA HB2 H 1 1.45 0.02 . 1 . . . . 8 ALA HB . 17160 1 70 . 1 1 8 8 ALA HB3 H 1 1.45 0.02 . 1 . . . . 8 ALA HB . 17160 1 71 . 1 1 8 8 ALA C C 13 178.6 0.3 . 1 . . . . 8 ALA C . 17160 1 72 . 1 1 8 8 ALA CA C 13 53.5 0.3 . 1 . . . . 8 ALA CA . 17160 1 73 . 1 1 8 8 ALA CB C 13 19.1 0.3 . 1 . . . . 8 ALA CB . 17160 1 74 . 1 1 8 8 ALA N N 15 124.7 0.3 . 1 . . . . 8 ALA N . 17160 1 75 . 1 1 9 9 SER H H 1 8.59 0.02 . 1 . . . . 9 SER H . 17160 1 76 . 1 1 9 9 SER HA H 1 4.34 0.02 . 1 . . . . 9 SER HA . 17160 1 77 . 1 1 9 9 SER HB2 H 1 4.33 0.02 . 2 . . . . 9 SER HB2 . 17160 1 78 . 1 1 9 9 SER HB3 H 1 4.26 0.02 . 2 . . . . 9 SER HB3 . 17160 1 79 . 1 1 9 9 SER C C 13 172.7 0.3 . 1 . . . . 9 SER C . 17160 1 80 . 1 1 9 9 SER CA C 13 57.2 0.3 . 1 . . . . 9 SER CA . 17160 1 81 . 1 1 9 9 SER CB C 13 66.3 0.3 . 1 . . . . 9 SER CB . 17160 1 82 . 1 1 9 9 SER N N 15 120.6 0.3 . 1 . . . . 9 SER N . 17160 1 83 . 1 1 10 10 ARG H H 1 9.17 0.02 . 1 . . . . 10 ARG H . 17160 1 84 . 1 1 10 10 ARG HA H 1 3.74 0.02 . 1 . . . . 10 ARG HA . 17160 1 85 . 1 1 10 10 ARG HB2 H 1 2.02 0.02 . 2 . . . . 10 ARG HB2 . 17160 1 86 . 1 1 10 10 ARG HB3 H 1 1.48 0.02 . 2 . . . . 10 ARG HB3 . 17160 1 87 . 1 1 10 10 ARG HD2 H 1 2.85 0.02 . 1 . . . . 10 ARG HD2 . 17160 1 88 . 1 1 10 10 ARG HG2 H 1 0.66 0.02 . 1 . . . . 10 ARG HG2 . 17160 1 89 . 1 1 10 10 ARG C C 13 179.1 0.3 . 1 . . . . 10 ARG C . 17160 1 90 . 1 1 10 10 ARG CA C 13 59.8 0.3 . 1 . . . . 10 ARG CA . 17160 1 91 . 1 1 10 10 ARG CB C 13 32.0 0.3 . 1 . . . . 10 ARG CB . 17160 1 92 . 1 1 10 10 ARG CD C 13 42.5 0.3 . 1 . . . . 10 ARG CD . 17160 1 93 . 1 1 10 10 ARG CG C 13 23.7 0.3 . 1 . . . . 10 ARG CG . 17160 1 94 . 1 1 10 10 ARG N N 15 125.9 0.3 . 1 . . . . 10 ARG N . 17160 1 95 . 1 1 11 11 ALA H H 1 9.44 0.02 . 1 . . . . 11 ALA H . 17160 1 96 . 1 1 11 11 ALA HA H 1 3.74 0.02 . 1 . . . . 11 ALA HA . 17160 1 97 . 1 1 11 11 ALA HB1 H 1 1.36 0.02 . 1 . . . . 11 ALA HB . 17160 1 98 . 1 1 11 11 ALA HB2 H 1 1.36 0.02 . 1 . . . . 11 ALA HB . 17160 1 99 . 1 1 11 11 ALA HB3 H 1 1.36 0.02 . 1 . . . . 11 ALA HB . 17160 1 100 . 1 1 11 11 ALA C C 13 179.4 0.3 . 1 . . . . 11 ALA C . 17160 1 101 . 1 1 11 11 ALA CA C 13 55.0 0.3 . 1 . . . . 11 ALA CA . 17160 1 102 . 1 1 11 11 ALA CB C 13 18.8 0.3 . 1 . . . . 11 ALA CB . 17160 1 103 . 1 1 11 11 ALA N N 15 120.0 0.3 . 1 . . . . 11 ALA N . 17160 1 104 . 1 1 12 12 TYR HA H 1 4.19 0.02 . 1 . . . . 12 TYR HA . 17160 1 105 . 1 1 12 12 TYR HB2 H 1 3.13 0.02 . 2 . . . . 12 TYR HB2 . 17160 1 106 . 1 1 12 12 TYR HB3 H 1 2.76 0.02 . 2 . . . . 12 TYR HB3 . 17160 1 107 . 1 1 12 12 TYR HD1 H 1 6.91 0.02 . 1 . . . . 12 TYR HD1 . 17160 1 108 . 1 1 12 12 TYR HE1 H 1 6.70 0.02 . 1 . . . . 12 TYR HE1 . 17160 1 109 . 1 1 12 12 TYR C C 13 177.9 0.3 . 1 . . . . 12 TYR C . 17160 1 110 . 1 1 12 12 TYR CA C 13 59.1 0.3 . 1 . . . . 12 TYR CA . 17160 1 111 . 1 1 12 12 TYR CB C 13 38.3 0.3 . 1 . . . . 12 TYR CB . 17160 1 112 . 1 1 13 13 GLN H H 1 9.65 0.02 . 1 . . . . 13 GLN H . 17160 1 113 . 1 1 13 13 GLN HA H 1 3.72 0.02 . 1 . . . . 13 GLN HA . 17160 1 114 . 1 1 13 13 GLN HB2 H 1 2.23 0.02 . 2 . . . . 13 GLN HB2 . 17160 1 115 . 1 1 13 13 GLN HB3 H 1 1.72 0.02 . 2 . . . . 13 GLN HB3 . 17160 1 116 . 1 1 13 13 GLN HE21 H 1 7.54 0.02 . 1 . . . . 13 GLN HE21 . 17160 1 117 . 1 1 13 13 GLN HE22 H 1 6.86 0.02 . 1 . . . . 13 GLN HE22 . 17160 1 118 . 1 1 13 13 GLN HG2 H 1 2.71 0.02 . 2 . . . . 13 GLN HG2 . 17160 1 119 . 1 1 13 13 GLN HG3 H 1 2.28 0.02 . 2 . . . . 13 GLN HG3 . 17160 1 120 . 1 1 13 13 GLN C C 13 180.3 0.3 . 1 . . . . 13 GLN C . 17160 1 121 . 1 1 13 13 GLN CA C 13 61.1 0.3 . 1 . . . . 13 GLN CA . 17160 1 122 . 1 1 13 13 GLN CB C 13 30.1 0.3 . 1 . . . . 13 GLN CB . 17160 1 123 . 1 1 13 13 GLN CG C 13 36.7 0.3 . 1 . . . . 13 GLN CG . 17160 1 124 . 1 1 13 13 GLN N N 15 118.7 0.3 . 1 . . . . 13 GLN N . 17160 1 125 . 1 1 13 13 GLN NE2 N 15 113.1 0.3 . 1 . . . . 13 GLN NE2 . 17160 1 126 . 1 1 14 14 CYS H H 1 7.97 0.02 . 1 . . . . 14 CYS H . 17160 1 127 . 1 1 14 14 CYS HA H 1 4.57 0.02 . 1 . . . . 14 CYS HA . 17160 1 128 . 1 1 14 14 CYS HB2 H 1 4.04 0.02 . 2 . . . . 14 CYS HB2 . 17160 1 129 . 1 1 14 14 CYS HB3 H 1 2.42 0.02 . 2 . . . . 14 CYS HB3 . 17160 1 130 . 1 1 14 14 CYS C C 13 177.2 0.3 . 1 . . . . 14 CYS C . 17160 1 131 . 1 1 14 14 CYS CA C 13 59.4 0.3 . 1 . . . . 14 CYS CA . 17160 1 132 . 1 1 14 14 CYS CB C 13 39.0 0.3 . 1 . . . . 14 CYS CB . 17160 1 133 . 1 1 14 14 CYS N N 15 119.9 0.3 . 1 . . . . 14 CYS N . 17160 1 134 . 1 1 15 15 LYS H H 1 7.37 0.02 . 1 . . . . 15 LYS H . 17160 1 135 . 1 1 15 15 LYS HA H 1 4.40 0.02 . 1 . . . . 15 LYS HA . 17160 1 136 . 1 1 15 15 LYS HB2 H 1 2.27 0.02 . 2 . . . . 15 LYS HB2 . 17160 1 137 . 1 1 15 15 LYS HB3 H 1 1.90 0.02 . 2 . . . . 15 LYS HB3 . 17160 1 138 . 1 1 15 15 LYS HD2 H 1 1.65 0.02 . 1 . . . . 15 LYS HD2 . 17160 1 139 . 1 1 15 15 LYS HE2 H 1 3.10 0.02 . 1 . . . . 15 LYS HE2 . 17160 1 140 . 1 1 15 15 LYS HG2 H 1 1.42 0.02 . 1 . . . . 15 LYS HG2 . 17160 1 141 . 1 1 15 15 LYS C C 13 178.6 0.3 . 1 . . . . 15 LYS C . 17160 1 142 . 1 1 15 15 LYS CA C 13 60.2 0.3 . 1 . . . . 15 LYS CA . 17160 1 143 . 1 1 15 15 LYS CB C 13 31.6 0.3 . 1 . . . . 15 LYS CB . 17160 1 144 . 1 1 15 15 LYS CD C 13 24.8 0.3 . 1 . . . . 15 LYS CD . 17160 1 145 . 1 1 15 15 LYS CE C 13 42.0 0.3 . 1 . . . . 15 LYS CE . 17160 1 146 . 1 1 15 15 LYS CG C 13 25.83 0.3 . 1 . . . . 15 LYS CG . 17160 1 147 . 1 1 15 15 LYS N N 15 126.3 0.3 . 1 . . . . 15 LYS N . 17160 1 148 . 1 1 16 16 LEU H H 1 7.95 0.02 . 1 . . . . 16 LEU H . 17160 1 149 . 1 1 16 16 LEU HA H 1 4.05 0.02 . 1 . . . . 16 LEU HA . 17160 1 150 . 1 1 16 16 LEU HB2 H 1 1.53 0.02 . 2 . . . . 16 LEU HB2 . 17160 1 151 . 1 1 16 16 LEU HB3 H 1 1.51 0.02 . 2 . . . . 16 LEU HB3 . 17160 1 152 . 1 1 16 16 LEU HD11 H 1 0.69 0.02 . 1 . . . . 16 LEU HD1 . 17160 1 153 . 1 1 16 16 LEU HD12 H 1 0.69 0.02 . 1 . . . . 16 LEU HD1 . 17160 1 154 . 1 1 16 16 LEU HD13 H 1 0.69 0.02 . 1 . . . . 16 LEU HD1 . 17160 1 155 . 1 1 16 16 LEU HD21 H 1 0.35 0.02 . 1 . . . . 16 LEU HD2 . 17160 1 156 . 1 1 16 16 LEU HD22 H 1 0.35 0.02 . 1 . . . . 16 LEU HD2 . 17160 1 157 . 1 1 16 16 LEU HD23 H 1 0.35 0.02 . 1 . . . . 16 LEU HD2 . 17160 1 158 . 1 1 16 16 LEU HG H 1 0.95 0.02 . 1 . . . . 16 LEU HG . 17160 1 159 . 1 1 16 16 LEU C C 13 175.5 0.3 . 1 . . . . 16 LEU C . 17160 1 160 . 1 1 16 16 LEU CA C 13 55.3 0.3 . 1 . . . . 16 LEU CA . 17160 1 161 . 1 1 16 16 LEU CB C 13 43.1 0.3 . 1 . . . . 16 LEU CB . 17160 1 162 . 1 1 16 16 LEU CD1 C 13 20.9 0.3 . 1 . . . . 16 LEU CD1 . 17160 1 163 . 1 1 16 16 LEU CD2 C 13 25.0 0.3 . 1 . . . . 16 LEU CD2 . 17160 1 164 . 1 1 16 16 LEU CG C 13 25.4 0.3 . 1 . . . . 16 LEU CG . 17160 1 165 . 1 1 16 16 LEU N N 15 117.6 0.3 . 1 . . . . 16 LEU N . 17160 1 166 . 1 1 17 17 GLN H H 1 7.52 0.02 . 1 . . . . 17 GLN H . 17160 1 167 . 1 1 17 17 GLN HA H 1 3.95 0.02 . 1 . . . . 17 GLN HA . 17160 1 168 . 1 1 17 17 GLN HB2 H 1 2.48 0.02 . 2 . . . . 17 GLN HB2 . 17160 1 169 . 1 1 17 17 GLN HB3 H 1 2.32 0.02 . 2 . . . . 17 GLN HB3 . 17160 1 170 . 1 1 17 17 GLN HE21 H 1 7.36 0.02 . 1 . . . . 17 GLN HE21 . 17160 1 171 . 1 1 17 17 GLN HE22 H 1 6.84 0.02 . 1 . . . . 17 GLN HE22 . 17160 1 172 . 1 1 17 17 GLN HG2 H 1 2.24 0.02 . 1 . . . . 17 GLN HG2 . 17160 1 173 . 1 1 17 17 GLN C C 13 174.7 0.3 . 1 . . . . 17 GLN C . 17160 1 174 . 1 1 17 17 GLN CA C 13 57.5 0.3 . 1 . . . . 17 GLN CA . 17160 1 175 . 1 1 17 17 GLN CB C 13 25.3 0.3 . 1 . . . . 17 GLN CB . 17160 1 176 . 1 1 17 17 GLN CG C 13 34.2 0.3 . 1 . . . . 17 GLN CG . 17160 1 177 . 1 1 17 17 GLN N N 15 110.7 0.3 . 1 . . . . 17 GLN N . 17160 1 178 . 1 1 17 17 GLN NE2 N 15 112.9 0.3 . 1 . . . . 17 GLN NE2 . 17160 1 179 . 1 1 18 18 LEU H H 1 7.96 0.02 . 1 . . . . 18 LEU H . 17160 1 180 . 1 1 18 18 LEU HA H 1 4.27 0.02 . 1 . . . . 18 LEU HA . 17160 1 181 . 1 1 18 18 LEU HB2 H 1 1.65 0.02 . 2 . . . . 18 LEU HB2 . 17160 1 182 . 1 1 18 18 LEU HB3 H 1 1.59 0.02 . 2 . . . . 18 LEU HB3 . 17160 1 183 . 1 1 18 18 LEU HD11 H 1 0.79 0.02 . 1 . . . . 18 LEU HD1 . 17160 1 184 . 1 1 18 18 LEU HD12 H 1 0.79 0.02 . 1 . . . . 18 LEU HD1 . 17160 1 185 . 1 1 18 18 LEU HD13 H 1 0.79 0.02 . 1 . . . . 18 LEU HD1 . 17160 1 186 . 1 1 18 18 LEU HD21 H 1 0.81 0.02 . 1 . . . . 18 LEU HD2 . 17160 1 187 . 1 1 18 18 LEU HD22 H 1 0.81 0.02 . 1 . . . . 18 LEU HD2 . 17160 1 188 . 1 1 18 18 LEU HD23 H 1 0.81 0.02 . 1 . . . . 18 LEU HD2 . 17160 1 189 . 1 1 18 18 LEU HG H 1 1.48 0.02 . 1 . . . . 18 LEU HG . 17160 1 190 . 1 1 18 18 LEU C C 13 178.6 0.3 . 1 . . . . 18 LEU C . 17160 1 191 . 1 1 18 18 LEU CA C 13 56.2 0.3 . 1 . . . . 18 LEU CA . 17160 1 192 . 1 1 18 18 LEU CB C 13 43.2 0.3 . 1 . . . . 18 LEU CB . 17160 1 193 . 1 1 18 18 LEU CD1 C 13 25.2 0.3 . 1 . . . . 18 LEU CD1 . 17160 1 194 . 1 1 18 18 LEU CD2 C 13 22.3 0.3 . 1 . . . . 18 LEU CD2 . 17160 1 195 . 1 1 18 18 LEU CG C 13 27.0 0.3 . 1 . . . . 18 LEU CG . 17160 1 196 . 1 1 18 18 LEU N N 15 119.0 0.3 . 1 . . . . 18 LEU N . 17160 1 197 . 1 1 19 19 ASN H H 1 6.75 0.02 . 1 . . . . 19 ASN H . 17160 1 198 . 1 1 19 19 ASN HA H 1 5.41 0.02 . 1 . . . . 19 ASN HA . 17160 1 199 . 1 1 19 19 ASN HB2 H 1 2.77 0.02 . 2 . . . . 19 ASN HB2 . 17160 1 200 . 1 1 19 19 ASN HB3 H 1 2.40 0.02 . 2 . . . . 19 ASN HB3 . 17160 1 201 . 1 1 19 19 ASN HD21 H 1 7.39 0.02 . 1 . . . . 19 ASN HD21 . 17160 1 202 . 1 1 19 19 ASN HD22 H 1 6.74 0.02 . 1 . . . . 19 ASN HD22 . 17160 1 203 . 1 1 19 19 ASN C C 13 174.8 0.3 . 1 . . . . 19 ASN C . 17160 1 204 . 1 1 19 19 ASN CA C 13 51.0 0.3 . 1 . . . . 19 ASN CA . 17160 1 205 . 1 1 19 19 ASN CB C 13 42.9 0.3 . 1 . . . . 19 ASN CB . 17160 1 206 . 1 1 19 19 ASN N N 15 113.4 0.3 . 1 . . . . 19 ASN N . 17160 1 207 . 1 1 19 19 ASN ND2 N 15 113.1 0.3 . 1 . . . . 19 ASN ND2 . 17160 1 208 . 1 1 20 20 THR H H 1 8.75 0.02 . 1 . . . . 20 THR H . 17160 1 209 . 1 1 20 20 THR HA H 1 4.57 0.02 . 1 . . . . 20 THR HA . 17160 1 210 . 1 1 20 20 THR HB H 1 4.31 0.02 . 1 . . . . 20 THR HB . 17160 1 211 . 1 1 20 20 THR HG21 H 1 1.09 0.02 . 1 . . . . 20 THR HG2 . 17160 1 212 . 1 1 20 20 THR HG22 H 1 1.09 0.02 . 1 . . . . 20 THR HG2 . 17160 1 213 . 1 1 20 20 THR HG23 H 1 1.09 0.02 . 1 . . . . 20 THR HG2 . 17160 1 214 . 1 1 20 20 THR C C 13 173.1 0.3 . 1 . . . . 20 THR C . 17160 1 215 . 1 1 20 20 THR CA C 13 59.6 0.3 . 1 . . . . 20 THR CA . 17160 1 216 . 1 1 20 20 THR CB C 13 71.4 0.3 . 1 . . . . 20 THR CB . 17160 1 217 . 1 1 20 20 THR CG2 C 13 21.4 0.3 . 1 . . . . 20 THR CG2 . 17160 1 218 . 1 1 20 20 THR N N 15 111.1 0.3 . 1 . . . . 20 THR N . 17160 1 219 . 1 1 21 21 GLN H H 1 9.10 0.02 . 1 . . . . 21 GLN H . 17160 1 220 . 1 1 21 21 GLN HA H 1 3.98 0.02 . 1 . . . . 21 GLN HA . 17160 1 221 . 1 1 21 21 GLN HB2 H 1 2.17 0.02 . 2 . . . . 21 GLN HB2 . 17160 1 222 . 1 1 21 21 GLN HB3 H 1 2.02 0.02 . 2 . . . . 21 GLN HB3 . 17160 1 223 . 1 1 21 21 GLN HE21 H 1 7.46 0.02 . 1 . . . . 21 GLN HE21 . 17160 1 224 . 1 1 21 21 GLN HE22 H 1 6.91 0.02 . 1 . . . . 21 GLN HE22 . 17160 1 225 . 1 1 21 21 GLN HG2 H 1 2.31 0.02 . 1 . . . . 21 GLN HG2 . 17160 1 226 . 1 1 21 21 GLN C C 13 175.8 0.3 . 1 . . . . 21 GLN C . 17160 1 227 . 1 1 21 21 GLN CA C 13 56.2 0.3 . 1 . . . . 21 GLN CA . 17160 1 228 . 1 1 21 21 GLN CB C 13 26.0 0.3 . 1 . . . . 21 GLN CB . 17160 1 229 . 1 1 21 21 GLN CG C 13 34.1 0.3 . 1 . . . . 21 GLN CG . 17160 1 230 . 1 1 21 21 GLN N N 15 117.0 0.3 . 1 . . . . 21 GLN N . 17160 1 231 . 1 1 21 21 GLN NE2 N 15 113.5 0.3 . 1 . . . . 21 GLN NE2 . 17160 1 232 . 1 1 22 22 CYS H H 1 9.15 0.02 . 1 . . . . 22 CYS H . 17160 1 233 . 1 1 22 22 CYS HA H 1 4.44 0.02 . 1 . . . . 22 CYS HA . 17160 1 234 . 1 1 22 22 CYS HB2 H 1 3.66 0.02 . 2 . . . . 22 CYS HB2 . 17160 1 235 . 1 1 22 22 CYS HB3 H 1 3.02 0.02 . 2 . . . . 22 CYS HB3 . 17160 1 236 . 1 1 22 22 CYS C C 13 173.8 0.3 . 1 . . . . 22 CYS C . 17160 1 237 . 1 1 22 22 CYS CA C 13 57.7 0.3 . 1 . . . . 22 CYS CA . 17160 1 238 . 1 1 22 22 CYS CB C 13 46.2 0.3 . 1 . . . . 22 CYS CB . 17160 1 239 . 1 1 22 22 CYS N N 15 113.3 0.3 . 1 . . . . 22 CYS N . 17160 1 240 . 1 1 23 23 GLY H H 1 8.38 0.02 . 1 . . . . 23 GLY H . 17160 1 241 . 1 1 23 23 GLY HA2 H 1 4.29 0.02 . 2 . . . . 23 GLY HA2 . 17160 1 242 . 1 1 23 23 GLY HA3 H 1 3.75 0.02 . 2 . . . . 23 GLY HA3 . 17160 1 243 . 1 1 23 23 GLY C C 13 175.7 0.3 . 1 . . . . 23 GLY C . 17160 1 244 . 1 1 23 23 GLY CA C 13 44.8 0.3 . 1 . . . . 23 GLY CA . 17160 1 245 . 1 1 23 23 GLY N N 15 106.5 0.3 . 1 . . . . 23 GLY N . 17160 1 246 . 1 1 24 24 SER H H 1 9.39 0.02 . 1 . . . . 24 SER H . 17160 1 247 . 1 1 24 24 SER HA H 1 4.32 0.02 . 1 . . . . 24 SER HA . 17160 1 248 . 1 1 24 24 SER HB2 H 1 4.24 0.02 . 1 . . . . 24 SER HB2 . 17160 1 249 . 1 1 24 24 SER C C 13 176.8 0.3 . 1 . . . . 24 SER C . 17160 1 250 . 1 1 24 24 SER CA C 13 62.5 0.3 . 1 . . . . 24 SER CA . 17160 1 251 . 1 1 24 24 SER CB C 13 63.1 0.3 . 1 . . . . 24 SER CB . 17160 1 252 . 1 1 24 24 SER N N 15 121.3 0.3 . 1 . . . . 24 SER N . 17160 1 253 . 1 1 25 25 VAL H H 1 9.75 0.02 . 1 . . . . 25 VAL H . 17160 1 254 . 1 1 25 25 VAL HA H 1 3.33 0.02 . 1 . . . . 25 VAL HA . 17160 1 255 . 1 1 25 25 VAL HB H 1 1.66 0.02 . 1 . . . . 25 VAL HB . 17160 1 256 . 1 1 25 25 VAL HG11 H 1 0.67 0.02 . 1 . . . . 25 VAL HG1 . 17160 1 257 . 1 1 25 25 VAL HG12 H 1 0.67 0.02 . 1 . . . . 25 VAL HG1 . 17160 1 258 . 1 1 25 25 VAL HG13 H 1 0.67 0.02 . 1 . . . . 25 VAL HG1 . 17160 1 259 . 1 1 25 25 VAL HG21 H 1 0.27 0.02 . 1 . . . . 25 VAL HG2 . 17160 1 260 . 1 1 25 25 VAL HG22 H 1 0.27 0.02 . 1 . . . . 25 VAL HG2 . 17160 1 261 . 1 1 25 25 VAL HG23 H 1 0.27 0.02 . 1 . . . . 25 VAL HG2 . 17160 1 262 . 1 1 25 25 VAL C C 13 175.7 0.3 . 1 . . . . 25 VAL C . 17160 1 263 . 1 1 25 25 VAL CA C 13 64.1 0.3 . 1 . . . . 25 VAL CA . 17160 1 264 . 1 1 25 25 VAL CB C 13 29.8 0.3 . 1 . . . . 25 VAL CB . 17160 1 265 . 1 1 25 25 VAL CG1 C 13 20.1 0.3 . 1 . . . . 25 VAL CG1 . 17160 1 266 . 1 1 25 25 VAL CG2 C 13 22.9 0.3 . 1 . . . . 25 VAL CG2 . 17160 1 267 . 1 1 25 25 VAL N N 15 125.6 0.3 . 1 . . . . 25 VAL N . 17160 1 268 . 1 1 26 26 GLN H H 1 7.49 0.02 . 1 . . . . 26 GLN H . 17160 1 269 . 1 1 26 26 GLN HA H 1 3.52 0.02 . 1 . . . . 26 GLN HA . 17160 1 270 . 1 1 26 26 GLN HB2 H 1 1.88 0.02 . 2 . . . . 26 GLN HB2 . 17160 1 271 . 1 1 26 26 GLN HB3 H 1 1.31 0.02 . 2 . . . . 26 GLN HB3 . 17160 1 272 . 1 1 26 26 GLN HE21 H 1 7.20 0.02 . 1 . . . . 26 GLN HE21 . 17160 1 273 . 1 1 26 26 GLN HG2 H 1 1.75 0.02 . 2 . . . . 26 GLN HG2 . 17160 1 274 . 1 1 26 26 GLN HG3 H 1 1.04 0.02 . 2 . . . . 26 GLN HG3 . 17160 1 275 . 1 1 26 26 GLN C C 13 174.3 0.3 . 1 . . . . 26 GLN C . 17160 1 276 . 1 1 26 26 GLN CA C 13 57.9 0.3 . 1 . . . . 26 GLN CA . 17160 1 277 . 1 1 26 26 GLN CB C 13 28.7 0.3 . 1 . . . . 26 GLN CB . 17160 1 278 . 1 1 26 26 GLN CG C 13 32.1 0.3 . 1 . . . . 26 GLN CG . 17160 1 279 . 1 1 26 26 GLN N N 15 117.8 0.3 . 1 . . . . 26 GLN N . 17160 1 280 . 1 1 26 26 GLN NE2 N 15 111.6 0.3 . 1 . . . . 26 GLN NE2 . 17160 1 281 . 1 1 27 27 TYR H H 1 7.27 0.02 . 1 . . . . 27 TYR H . 17160 1 282 . 1 1 27 27 TYR HA H 1 4.71 0.02 . 1 . . . . 27 TYR HA . 17160 1 283 . 1 1 27 27 TYR HB2 H 1 3.53 0.02 . 2 . . . . 27 TYR HB2 . 17160 1 284 . 1 1 27 27 TYR HB3 H 1 2.92 0.02 . 2 . . . . 27 TYR HB3 . 17160 1 285 . 1 1 27 27 TYR HD1 H 1 6.84 0.02 . 1 . . . . 27 TYR HD1 . 17160 1 286 . 1 1 27 27 TYR C C 13 176.7 0.3 . 1 . . . . 27 TYR C . 17160 1 287 . 1 1 27 27 TYR CA C 13 57.2 0.3 . 1 . . . . 27 TYR CA . 17160 1 288 . 1 1 27 27 TYR CB C 13 38.6 0.3 . 1 . . . . 27 TYR CB . 17160 1 289 . 1 1 27 27 TYR N N 15 114.5 0.3 . 1 . . . . 27 TYR N . 17160 1 290 . 1 1 28 28 GLU H H 1 7.68 0.02 . 1 . . . . 28 GLU H . 17160 1 291 . 1 1 28 28 GLU HA H 1 4.96 0.02 . 1 . . . . 28 GLU HA . 17160 1 292 . 1 1 28 28 GLU HB2 H 1 2.28 0.02 . 2 . . . . 28 GLU HB2 . 17160 1 293 . 1 1 28 28 GLU HB3 H 1 2.07 0.02 . 2 . . . . 28 GLU HB3 . 17160 1 294 . 1 1 28 28 GLU HG2 H 1 2.59 0.02 . 2 . . . . 28 GLU HG2 . 17160 1 295 . 1 1 28 28 GLU HG3 H 1 2.57 0.02 . 2 . . . . 28 GLU HG3 . 17160 1 296 . 1 1 28 28 GLU C C 13 175.7 0.3 . 1 . . . . 28 GLU C . 17160 1 297 . 1 1 28 28 GLU CA C 13 53.9 0.3 . 1 . . . . 28 GLU CA . 17160 1 298 . 1 1 28 28 GLU CB C 13 30.1 0.3 . 1 . . . . 28 GLU CB . 17160 1 299 . 1 1 28 28 GLU CG C 13 35.6 0.3 . 1 . . . . 28 GLU CG . 17160 1 300 . 1 1 28 28 GLU N N 15 117.8 0.3 . 1 . . . . 28 GLU N . 17160 1 301 . 1 1 29 29 PRO HA H 1 4.10 0.02 . 1 . . . . 29 PRO HA . 17160 1 302 . 1 1 29 29 PRO HB2 H 1 1.85 0.02 . 2 . . . . 29 PRO HB2 . 17160 1 303 . 1 1 29 29 PRO HB3 H 1 1.32 0.02 . 2 . . . . 29 PRO HB3 . 17160 1 304 . 1 1 29 29 PRO HD2 H 1 3.08 0.02 . 2 . . . . 29 PRO HD2 . 17160 1 305 . 1 1 29 29 PRO HD3 H 1 3.00 0.02 . 2 . . . . 29 PRO HD3 . 17160 1 306 . 1 1 29 29 PRO HG2 H 1 1.38 0.02 . 1 . . . . 29 PRO HG2 . 17160 1 307 . 1 1 29 29 PRO C C 13 175.7 0.3 . 1 . . . . 29 PRO C . 17160 1 308 . 1 1 29 29 PRO CA C 13 64.4 0.3 . 1 . . . . 29 PRO CA . 17160 1 309 . 1 1 29 29 PRO CB C 13 29.7 0.3 . 1 . . . . 29 PRO CB . 17160 1 310 . 1 1 29 29 PRO CD C 13 44.3 0.3 . 1 . . . . 29 PRO CD . 17160 1 311 . 1 1 29 29 PRO CG C 13 29.1 0.3 . 1 . . . . 29 PRO CG . 17160 1 312 . 1 1 30 30 GLN H H 1 9.63 0.02 . 1 . . . . 30 GLN H . 17160 1 313 . 1 1 30 30 GLN HA H 1 4.67 0.02 . 1 . . . . 30 GLN HA . 17160 1 314 . 1 1 30 30 GLN HB2 H 1 1.78 0.02 . 2 . . . . 30 GLN HB2 . 17160 1 315 . 1 1 30 30 GLN HB3 H 1 0.94 0.02 . 2 . . . . 30 GLN HB3 . 17160 1 316 . 1 1 30 30 GLN HE21 H 1 7.15 0.02 . 1 . . . . 30 GLN HE21 . 17160 1 317 . 1 1 30 30 GLN HE22 H 1 5.56 0.02 . 1 . . . . 30 GLN HE22 . 17160 1 318 . 1 1 30 30 GLN HG2 H 1 1.49 0.02 . 2 . . . . 30 GLN HG2 . 17160 1 319 . 1 1 30 30 GLN HG3 H 1 1.67 0.02 . 2 . . . . 30 GLN HG3 . 17160 1 320 . 1 1 30 30 GLN C C 13 176.2 0.3 . 1 . . . . 30 GLN C . 17160 1 321 . 1 1 30 30 GLN CA C 13 56.2 0.3 . 1 . . . . 30 GLN CA . 17160 1 322 . 1 1 30 30 GLN CB C 13 27.2 0.3 . 1 . . . . 30 GLN CB . 17160 1 323 . 1 1 30 30 GLN CG C 13 42.8 0.3 . 1 . . . . 30 GLN CG . 17160 1 324 . 1 1 30 30 GLN N N 15 117.8 0.3 . 1 . . . . 30 GLN N . 17160 1 325 . 1 1 30 30 GLN NE2 N 15 108.6 0.3 . 1 . . . . 30 GLN NE2 . 17160 1 326 . 1 1 31 31 SER H H 1 7.82 0.02 . 1 . . . . 31 SER H . 17160 1 327 . 1 1 31 31 SER HA H 1 5.23 0.02 . 1 . . . . 31 SER HA . 17160 1 328 . 1 1 31 31 SER HB2 H 1 4.17 0.02 . 1 . . . . 31 SER HB2 . 17160 1 329 . 1 1 31 31 SER C C 13 175.1 0.3 . 1 . . . . 31 SER C . 17160 1 330 . 1 1 31 31 SER CA C 13 57.3 0.3 . 1 . . . . 31 SER CA . 17160 1 331 . 1 1 31 31 SER CB C 13 62.8 0.3 . 1 . . . . 31 SER CB . 17160 1 332 . 1 1 31 31 SER N N 15 118.1 0.3 . 1 . . . . 31 SER N . 17160 1 333 . 1 1 32 32 VAL H H 1 9.20 0.02 . 1 . . . . 32 VAL H . 17160 1 334 . 1 1 32 32 VAL HA H 1 4.18 0.02 . 1 . . . . 32 VAL HA . 17160 1 335 . 1 1 32 32 VAL HB H 1 2.99 0.02 . 1 . . . . 32 VAL HB . 17160 1 336 . 1 1 32 32 VAL HG11 H 1 1.31 0.02 . 1 . . . . 32 VAL HG1 . 17160 1 337 . 1 1 32 32 VAL HG12 H 1 1.31 0.02 . 1 . . . . 32 VAL HG1 . 17160 1 338 . 1 1 32 32 VAL HG13 H 1 1.31 0.02 . 1 . . . . 32 VAL HG1 . 17160 1 339 . 1 1 32 32 VAL HG21 H 1 0.86 0.02 . 1 . . . . 32 VAL HG2 . 17160 1 340 . 1 1 32 32 VAL HG22 H 1 0.86 0.02 . 1 . . . . 32 VAL HG2 . 17160 1 341 . 1 1 32 32 VAL HG23 H 1 0.86 0.02 . 1 . . . . 32 VAL HG2 . 17160 1 342 . 1 1 32 32 VAL C C 13 172.7 0.3 . 1 . . . . 32 VAL C . 17160 1 343 . 1 1 32 32 VAL CA C 13 63.4 0.3 . 1 . . . . 32 VAL CA . 17160 1 344 . 1 1 32 32 VAL CB C 13 28.1 0.3 . 1 . . . . 32 VAL CB . 17160 1 345 . 1 1 32 32 VAL CG1 C 13 24.5 0.3 . 1 . . . . 32 VAL CG1 . 17160 1 346 . 1 1 32 32 VAL CG2 C 13 20.2 0.3 . 1 . . . . 32 VAL CG2 . 17160 1 347 . 1 1 32 32 VAL N N 15 127.9 0.3 . 1 . . . . 32 VAL N . 17160 1 348 . 1 1 33 33 GLU H H 1 7.47 0.02 . 1 . . . . 33 GLU H . 17160 1 349 . 1 1 33 33 GLU HA H 1 4.40 0.02 . 1 . . . . 33 GLU HA . 17160 1 350 . 1 1 33 33 GLU HB2 H 1 1.58 0.02 . 2 . . . . 33 GLU HB2 . 17160 1 351 . 1 1 33 33 GLU HB3 H 1 1.31 0.02 . 2 . . . . 33 GLU HB3 . 17160 1 352 . 1 1 33 33 GLU C C 13 174.8 0.3 . 1 . . . . 33 GLU C . 17160 1 353 . 1 1 33 33 GLU CA C 13 54.0 0.3 . 1 . . . . 33 GLU CA . 17160 1 354 . 1 1 33 33 GLU CB C 13 33.4 0.3 . 1 . . . . 33 GLU CB . 17160 1 355 . 1 1 33 33 GLU N N 15 129.8 0.3 . 1 . . . . 33 GLU N . 17160 1 356 . 1 1 34 34 GLY H H 1 8.91 0.02 . 1 . . . . 34 GLY H . 17160 1 357 . 1 1 34 34 GLY HA2 H 1 4.64 0.02 . 2 . . . . 34 GLY HA2 . 17160 1 358 . 1 1 34 34 GLY HA3 H 1 3.86 0.02 . 2 . . . . 34 GLY HA3 . 17160 1 359 . 1 1 34 34 GLY C C 13 172.1 0.3 . 1 . . . . 34 GLY C . 17160 1 360 . 1 1 34 34 GLY CA C 13 44.5 0.3 . 1 . . . . 34 GLY CA . 17160 1 361 . 1 1 34 34 GLY N N 15 113.9 0.3 . 1 . . . . 34 GLY N . 17160 1 362 . 1 1 35 35 LEU HA H 1 4.65 0.02 . 1 . . . . 35 LEU HA . 17160 1 363 . 1 1 35 35 LEU HB2 H 1 1.67 0.02 . 2 . . . . 35 LEU HB2 . 17160 1 364 . 1 1 35 35 LEU HB3 H 1 1.47 0.02 . 2 . . . . 35 LEU HB3 . 17160 1 365 . 1 1 35 35 LEU HD11 H 1 0.95 0.02 . 1 . . . . 35 LEU HD1 . 17160 1 366 . 1 1 35 35 LEU HD12 H 1 0.95 0.02 . 1 . . . . 35 LEU HD1 . 17160 1 367 . 1 1 35 35 LEU HD13 H 1 0.95 0.02 . 1 . . . . 35 LEU HD1 . 17160 1 368 . 1 1 35 35 LEU HG H 1 1.77 0.02 . 1 . . . . 35 LEU HG . 17160 1 369 . 1 1 35 35 LEU C C 13 178.2 0.3 . 1 . . . . 35 LEU C . 17160 1 370 . 1 1 35 35 LEU CA C 13 55.8 0.3 . 1 . . . . 35 LEU CA . 17160 1 371 . 1 1 35 35 LEU CB C 13 43.1 0.3 . 1 . . . . 35 LEU CB . 17160 1 372 . 1 1 35 35 LEU CD1 C 13 25.2 0.3 . 1 . . . . 35 LEU CD1 . 17160 1 373 . 1 1 35 35 LEU CG C 13 27.7 0.3 . 1 . . . . 35 LEU CG . 17160 1 374 . 1 1 36 36 LYS H H 1 8.33 0.02 . 1 . . . . 36 LYS H . 17160 1 375 . 1 1 36 36 LYS HA H 1 4.55 0.02 . 1 . . . . 36 LYS HA . 17160 1 376 . 1 1 36 36 LYS HB2 H 1 1.86 0.02 . 2 . . . . 36 LYS HB2 . 17160 1 377 . 1 1 36 36 LYS HB3 H 1 1.46 0.02 . 2 . . . . 36 LYS HB3 . 17160 1 378 . 1 1 36 36 LYS HD2 H 1 0.95 0.02 . 1 . . . . 36 LYS HD2 . 17160 1 379 . 1 1 36 36 LYS HE2 H 1 2.77 0.02 . 2 . . . . 36 LYS HE2 . 17160 1 380 . 1 1 36 36 LYS HE3 H 1 2.86 0.02 . 2 . . . . 36 LYS HE3 . 17160 1 381 . 1 1 36 36 LYS HG2 H 1 1.16 0.02 . 2 . . . . 36 LYS HG2 . 17160 1 382 . 1 1 36 36 LYS HG3 H 1 1.00 0.02 . 2 . . . . 36 LYS HG3 . 17160 1 383 . 1 1 36 36 LYS C C 13 173.7 0.3 . 1 . . . . 36 LYS C . 17160 1 384 . 1 1 36 36 LYS CA C 13 55.1 0.3 . 1 . . . . 36 LYS CA . 17160 1 385 . 1 1 36 36 LYS CB C 13 32.2 0.3 . 1 . . . . 36 LYS CB . 17160 1 386 . 1 1 36 36 LYS CD C 13 24.1 0.3 . 1 . . . . 36 LYS CD . 17160 1 387 . 1 1 36 36 LYS CE C 13 41.8 0.3 . 1 . . . . 36 LYS CE . 17160 1 388 . 1 1 36 36 LYS CG C 13 23.1 0.3 . 1 . . . . 36 LYS CG . 17160 1 389 . 1 1 36 36 LYS N N 15 121.3 0.3 . 1 . . . . 36 LYS N . 17160 1 390 . 1 1 37 37 GLY H H 1 8.19 0.02 . 1 . . . . 37 GLY H . 17160 1 391 . 1 1 37 37 GLY HA2 H 1 4.20 0.02 . 2 . . . . 37 GLY HA2 . 17160 1 392 . 1 1 37 37 GLY HA3 H 1 3.65 0.02 . 2 . . . . 37 GLY HA3 . 17160 1 393 . 1 1 37 37 GLY C C 13 175.4 0.3 . 1 . . . . 37 GLY C . 17160 1 394 . 1 1 37 37 GLY CA C 13 44.5 0.3 . 1 . . . . 37 GLY CA . 17160 1 395 . 1 1 37 37 GLY N N 15 107.2 0.3 . 1 . . . . 37 GLY N . 17160 1 396 . 1 1 38 38 PHE H H 1 8.35 0.02 . 1 . . . . 38 PHE H . 17160 1 397 . 1 1 38 38 PHE HA H 1 4.80 0.02 . 1 . . . . 38 PHE HA . 17160 1 398 . 1 1 38 38 PHE HB2 H 1 3.51 0.02 . 2 . . . . 38 PHE HB2 . 17160 1 399 . 1 1 38 38 PHE HB3 H 1 3.05 0.02 . 2 . . . . 38 PHE HB3 . 17160 1 400 . 1 1 38 38 PHE C C 13 180.4 0.3 . 1 . . . . 38 PHE C . 17160 1 401 . 1 1 38 38 PHE CA C 13 56.2 0.3 . 1 . . . . 38 PHE CA . 17160 1 402 . 1 1 38 38 PHE CB C 13 41.4 0.3 . 1 . . . . 38 PHE CB . 17160 1 403 . 1 1 38 38 PHE N N 15 125.3 0.3 . 1 . . . . 38 PHE N . 17160 1 404 . 1 1 39 39 PRO HA H 1 3.27 0.02 . 1 . . . . 39 PRO HA . 17160 1 405 . 1 1 39 39 PRO HB2 H 1 1.67 0.02 . 2 . . . . 39 PRO HB2 . 17160 1 406 . 1 1 39 39 PRO HB3 H 1 0.62 0.02 . 2 . . . . 39 PRO HB3 . 17160 1 407 . 1 1 39 39 PRO HD2 H 1 3.90 0.02 . 1 . . . . 39 PRO HD2 . 17160 1 408 . 1 1 39 39 PRO HG2 H 1 2.04 0.02 . 1 . . . . 39 PRO HG2 . 17160 1 409 . 1 1 39 39 PRO C C 13 175.9 0.3 . 1 . . . . 39 PRO C . 17160 1 410 . 1 1 39 39 PRO CA C 13 63.2 0.3 . 1 . . . . 39 PRO CA . 17160 1 411 . 1 1 39 39 PRO CB C 13 34.4 0.3 . 1 . . . . 39 PRO CB . 17160 1 412 . 1 1 39 39 PRO CD C 13 50.1 0.3 . 1 . . . . 39 PRO CD . 17160 1 413 . 1 1 39 39 PRO CG C 13 27.2 0.3 . 1 . . . . 39 PRO CG . 17160 1 414 . 1 1 40 40 GLN H H 1 8.76 0.02 . 1 . . . . 40 GLN H . 17160 1 415 . 1 1 40 40 GLN HA H 1 3.90 0.02 . 1 . . . . 40 GLN HA . 17160 1 416 . 1 1 40 40 GLN HB2 H 1 2.16 0.02 . 2 . . . . 40 GLN HB2 . 17160 1 417 . 1 1 40 40 GLN HB3 H 1 2.03 0.02 . 2 . . . . 40 GLN HB3 . 17160 1 418 . 1 1 40 40 GLN HE21 H 1 7.51 0.02 . 1 . . . . 40 GLN HE21 . 17160 1 419 . 1 1 40 40 GLN HE22 H 1 6.81 0.02 . 1 . . . . 40 GLN HE22 . 17160 1 420 . 1 1 40 40 GLN HG2 H 1 2.39 0.02 . 2 . . . . 40 GLN HG2 . 17160 1 421 . 1 1 40 40 GLN HG3 H 1 2.54 0.02 . 2 . . . . 40 GLN HG3 . 17160 1 422 . 1 1 40 40 GLN C C 13 175.5 0.3 . 1 . . . . 40 GLN C . 17160 1 423 . 1 1 40 40 GLN CA C 13 60.3 0.3 . 1 . . . . 40 GLN CA . 17160 1 424 . 1 1 40 40 GLN CB C 13 27.3 0.3 . 1 . . . . 40 GLN CB . 17160 1 425 . 1 1 40 40 GLN CG C 13 33.9 0.3 . 1 . . . . 40 GLN CG . 17160 1 426 . 1 1 40 40 GLN N N 15 129.0 0.3 . 1 . . . . 40 GLN N . 17160 1 427 . 1 1 40 40 GLN NE2 N 15 111.9 0.3 . 1 . . . . 40 GLN NE2 . 17160 1 428 . 1 1 41 41 ALA H H 1 8.21 0.02 . 1 . . . . 41 ALA H . 17160 1 429 . 1 1 41 41 ALA HA H 1 4.49 0.02 . 1 . . . . 41 ALA HA . 17160 1 430 . 1 1 41 41 ALA HB1 H 1 1.41 0.02 . 1 . . . . 41 ALA HB . 17160 1 431 . 1 1 41 41 ALA HB2 H 1 1.41 0.02 . 1 . . . . 41 ALA HB . 17160 1 432 . 1 1 41 41 ALA HB3 H 1 1.41 0.02 . 1 . . . . 41 ALA HB . 17160 1 433 . 1 1 41 41 ALA C C 13 175.9 0.3 . 1 . . . . 41 ALA C . 17160 1 434 . 1 1 41 41 ALA CA C 13 49.8 0.3 . 1 . . . . 41 ALA CA . 17160 1 435 . 1 1 41 41 ALA CB C 13 19.6 0.3 . 1 . . . . 41 ALA CB . 17160 1 436 . 1 1 41 41 ALA N N 15 124.8 0.3 . 1 . . . . 41 ALA N . 17160 1 437 . 1 1 42 42 GLY H H 1 8.20 0.02 . 1 . . . . 42 GLY H . 17160 1 438 . 1 1 42 42 GLY HA2 H 1 4.23 0.02 . 2 . . . . 42 GLY HA2 . 17160 1 439 . 1 1 42 42 GLY HA3 H 1 3.46 0.02 . 2 . . . . 42 GLY HA3 . 17160 1 440 . 1 1 42 42 GLY C C 13 171.3 0.3 . 1 . . . . 42 GLY C . 17160 1 441 . 1 1 42 42 GLY CA C 13 44.2 0.3 . 1 . . . . 42 GLY CA . 17160 1 442 . 1 1 42 42 GLY N N 15 108.3 0.3 . 1 . . . . 42 GLY N . 17160 1 443 . 1 1 43 43 PRO HA H 1 4.25 0.02 . 1 . . . . 43 PRO HA . 17160 1 444 . 1 1 43 43 PRO HB2 H 1 1.97 0.02 . 2 . . . . 43 PRO HB2 . 17160 1 445 . 1 1 43 43 PRO HB3 H 1 1.54 0.02 . 2 . . . . 43 PRO HB3 . 17160 1 446 . 1 1 43 43 PRO HD2 H 1 3.62 0.02 . 1 . . . . 43 PRO HD2 . 17160 1 447 . 1 1 43 43 PRO HG2 H 1 0.79 0.02 . 2 . . . . 43 PRO HG2 . 17160 1 448 . 1 1 43 43 PRO HG3 H 1 1.01 0.02 . 2 . . . . 43 PRO HG3 . 17160 1 449 . 1 1 43 43 PRO C C 13 175.1 0.3 . 1 . . . . 43 PRO C . 17160 1 450 . 1 1 43 43 PRO CA C 13 62.8 0.3 . 1 . . . . 43 PRO CA . 17160 1 451 . 1 1 43 43 PRO CB C 13 33.0 0.3 . 1 . . . . 43 PRO CB . 17160 1 452 . 1 1 43 43 PRO CD C 13 50.3 0.3 . 1 . . . . 43 PRO CD . 17160 1 453 . 1 1 43 43 PRO CG C 13 25.3 0.3 . 1 . . . . 43 PRO CG . 17160 1 454 . 1 1 44 44 ALA H H 1 8.30 0.02 . 1 . . . . 44 ALA H . 17160 1 455 . 1 1 44 44 ALA HA H 1 4.06 0.02 . 1 . . . . 44 ALA HA . 17160 1 456 . 1 1 44 44 ALA HB1 H 1 1.45 0.02 . 1 . . . . 44 ALA HB . 17160 1 457 . 1 1 44 44 ALA HB2 H 1 1.45 0.02 . 1 . . . . 44 ALA HB . 17160 1 458 . 1 1 44 44 ALA HB3 H 1 1.45 0.02 . 1 . . . . 44 ALA HB . 17160 1 459 . 1 1 44 44 ALA C C 13 176.7 0.3 . 1 . . . . 44 ALA C . 17160 1 460 . 1 1 44 44 ALA CA C 13 52.0 0.3 . 1 . . . . 44 ALA CA . 17160 1 461 . 1 1 44 44 ALA CB C 13 18.7 0.3 . 1 . . . . 44 ALA CB . 17160 1 462 . 1 1 44 44 ALA N N 15 126.9 0.3 . 1 . . . . 44 ALA N . 17160 1 463 . 1 1 45 45 ASP H H 1 8.61 0.02 . 1 . . . . 45 ASP H . 17160 1 464 . 1 1 45 45 ASP HA H 1 4.40 0.02 . 1 . . . . 45 ASP HA . 17160 1 465 . 1 1 45 45 ASP HB2 H 1 2.64 0.02 . 2 . . . . 45 ASP HB2 . 17160 1 466 . 1 1 45 45 ASP HB3 H 1 2.55 0.02 . 2 . . . . 45 ASP HB3 . 17160 1 467 . 1 1 45 45 ASP C C 13 176.0 0.3 . 1 . . . . 45 ASP C . 17160 1 468 . 1 1 45 45 ASP CA C 13 56.4 0.3 . 1 . . . . 45 ASP CA . 17160 1 469 . 1 1 45 45 ASP CB C 13 40.5 0.3 . 1 . . . . 45 ASP CB . 17160 1 470 . 1 1 45 45 ASP N N 15 120.5 0.3 . 1 . . . . 45 ASP N . 17160 1 471 . 1 1 46 46 GLY H H 1 8.31 0.02 . 1 . . . . 46 GLY H . 17160 1 472 . 1 1 46 46 GLY HA2 H 1 3.89 0.02 . 2 . . . . 46 GLY HA2 . 17160 1 473 . 1 1 46 46 GLY HA3 H 1 3.32 0.02 . 2 . . . . 46 GLY HA3 . 17160 1 474 . 1 1 46 46 GLY C C 13 172.5 0.3 . 1 . . . . 46 GLY C . 17160 1 475 . 1 1 46 46 GLY CA C 13 45.0 0.3 . 1 . . . . 46 GLY CA . 17160 1 476 . 1 1 46 46 GLY N N 15 112.7 0.3 . 1 . . . . 46 GLY N . 17160 1 477 . 1 1 47 47 HIS H H 1 8.35 0.02 . 1 . . . . 47 HIS H . 17160 1 478 . 1 1 47 47 HIS HA H 1 5.29 0.02 . 1 . . . . 47 HIS HA . 17160 1 479 . 1 1 47 47 HIS HB2 H 1 3.16 0.02 . 2 . . . . 47 HIS HB2 . 17160 1 480 . 1 1 47 47 HIS HB3 H 1 2.56 0.02 . 2 . . . . 47 HIS HB3 . 17160 1 481 . 1 1 47 47 HIS HD2 H 1 6.78 0.02 . 1 . . . . 47 HIS HD2 . 17160 1 482 . 1 1 47 47 HIS HE1 H 1 7.69 0.02 . 1 . . . . 47 HIS HE1 . 17160 1 483 . 1 1 47 47 HIS C C 13 173.0 0.3 . 1 . . . . 47 HIS C . 17160 1 484 . 1 1 47 47 HIS CA C 13 53.1 0.3 . 1 . . . . 47 HIS CA . 17160 1 485 . 1 1 47 47 HIS CB C 13 29.0 0.3 . 1 . . . . 47 HIS CB . 17160 1 486 . 1 1 47 47 HIS CE1 C 13 134.3 0.3 . 1 . . . . 47 HIS CE1 . 17160 1 487 . 1 1 47 47 HIS N N 15 119.3 0.3 . 1 . . . . 47 HIS N . 17160 1 488 . 1 1 48 48 ILE H H 1 7.75 0.02 . 1 . . . . 48 ILE H . 17160 1 489 . 1 1 48 48 ILE HA H 1 3.26 0.02 . 1 . . . . 48 ILE HA . 17160 1 490 . 1 1 48 48 ILE HB H 1 1.35 0.02 . 1 . . . . 48 ILE HB . 17160 1 491 . 1 1 48 48 ILE HD11 H 1 0.88 0.02 . 1 . . . . 48 ILE HD1 . 17160 1 492 . 1 1 48 48 ILE HD12 H 1 0.88 0.02 . 1 . . . . 48 ILE HD1 . 17160 1 493 . 1 1 48 48 ILE HD13 H 1 0.88 0.02 . 1 . . . . 48 ILE HD1 . 17160 1 494 . 1 1 48 48 ILE HG12 H 1 0.64 0.02 . 2 . . . . 48 ILE HG12 . 17160 1 495 . 1 1 48 48 ILE HG13 H 1 0.62 0.02 . 2 . . . . 48 ILE HG13 . 17160 1 496 . 1 1 48 48 ILE HG21 H 1 0.33 0.02 . 1 . . . . 48 ILE HG2 . 17160 1 497 . 1 1 48 48 ILE HG22 H 1 0.33 0.02 . 1 . . . . 48 ILE HG2 . 17160 1 498 . 1 1 48 48 ILE HG23 H 1 0.33 0.02 . 1 . . . . 48 ILE HG2 . 17160 1 499 . 1 1 48 48 ILE C C 13 177.3 0.3 . 1 . . . . 48 ILE C . 17160 1 500 . 1 1 48 48 ILE CA C 13 64.3 0.3 . 1 . . . . 48 ILE CA . 17160 1 501 . 1 1 48 48 ILE CB C 13 39.8 0.3 . 1 . . . . 48 ILE CB . 17160 1 502 . 1 1 48 48 ILE CD1 C 13 13.2 0.3 . 1 . . . . 48 ILE CD1 . 17160 1 503 . 1 1 48 48 ILE CG1 C 13 24.8 0.3 . 1 . . . . 48 ILE CG1 . 17160 1 504 . 1 1 48 48 ILE CG2 C 13 18.1 0.3 . 1 . . . . 48 ILE CG2 . 17160 1 505 . 1 1 48 48 ILE N N 15 119.5 0.3 . 1 . . . . 48 ILE N . 17160 1 506 . 1 1 49 49 ALA H H 1 8.26 0.02 . 1 . . . . 49 ALA H . 17160 1 507 . 1 1 49 49 ALA HA H 1 3.73 0.02 . 1 . . . . 49 ALA HA . 17160 1 508 . 1 1 49 49 ALA HB1 H 1 1.26 0.02 . 1 . . . . 49 ALA HB . 17160 1 509 . 1 1 49 49 ALA HB2 H 1 1.26 0.02 . 1 . . . . 49 ALA HB . 17160 1 510 . 1 1 49 49 ALA HB3 H 1 1.26 0.02 . 1 . . . . 49 ALA HB . 17160 1 511 . 1 1 49 49 ALA C C 13 177.1 0.3 . 1 . . . . 49 ALA C . 17160 1 512 . 1 1 49 49 ALA CA C 13 54.8 0.3 . 1 . . . . 49 ALA CA . 17160 1 513 . 1 1 49 49 ALA CB C 13 19.0 0.3 . 1 . . . . 49 ALA CB . 17160 1 514 . 1 1 49 49 ALA N N 15 119.8 0.3 . 1 . . . . 49 ALA N . 17160 1 515 . 1 1 50 50 SER H H 1 8.16 0.02 . 1 . . . . 50 SER H . 17160 1 516 . 1 1 50 50 SER HA H 1 4.20 0.02 . 1 . . . . 50 SER HA . 17160 1 517 . 1 1 50 50 SER HB2 H 1 4.45 0.02 . 2 . . . . 50 SER HB2 . 17160 1 518 . 1 1 50 50 SER HB3 H 1 3.83 0.02 . 2 . . . . 50 SER HB3 . 17160 1 519 . 1 1 50 50 SER C C 13 175.4 0.3 . 1 . . . . 50 SER C . 17160 1 520 . 1 1 50 50 SER CA C 13 59.2 0.3 . 1 . . . . 50 SER CA . 17160 1 521 . 1 1 50 50 SER CB C 13 65.2 0.3 . 1 . . . . 50 SER CB . 17160 1 522 . 1 1 50 50 SER N N 15 109.3 0.3 . 1 . . . . 50 SER N . 17160 1 523 . 1 1 51 51 ALA H H 1 7.79 0.02 . 1 . . . . 51 ALA H . 17160 1 524 . 1 1 51 51 ALA HA H 1 3.14 0.02 . 1 . . . . 51 ALA HA . 17160 1 525 . 1 1 51 51 ALA HB1 H 1 1.36 0.02 . 1 . . . . 51 ALA HB . 17160 1 526 . 1 1 51 51 ALA HB2 H 1 1.36 0.02 . 1 . . . . 51 ALA HB . 17160 1 527 . 1 1 51 51 ALA HB3 H 1 1.36 0.02 . 1 . . . . 51 ALA HB . 17160 1 528 . 1 1 51 51 ALA C C 13 175.8 0.3 . 1 . . . . 51 ALA C . 17160 1 529 . 1 1 51 51 ALA CA C 13 52.9 0.3 . 1 . . . . 51 ALA CA . 17160 1 530 . 1 1 51 51 ALA CB C 13 18.5 0.3 . 1 . . . . 51 ALA CB . 17160 1 531 . 1 1 51 51 ALA N N 15 121.2 0.3 . 1 . . . . 51 ALA N . 17160 1 532 . 1 1 52 52 ASP HA H 1 4.52 0.02 . 1 . . . . 52 ASP HA . 17160 1 533 . 1 1 52 52 ASP HB2 H 1 3.33 0.02 . 2 . . . . 52 ASP HB2 . 17160 1 534 . 1 1 52 52 ASP HB3 H 1 2.32 0.02 . 2 . . . . 52 ASP HB3 . 17160 1 535 . 1 1 52 52 ASP C C 13 175.0 0.3 . 1 . . . . 52 ASP C . 17160 1 536 . 1 1 52 52 ASP CA C 13 55.1 0.3 . 1 . . . . 52 ASP CA . 17160 1 537 . 1 1 52 52 ASP CB C 13 41.7 0.3 . 1 . . . . 52 ASP CB . 17160 1 538 . 1 1 53 53 LYS H H 1 7.66 0.02 . 1 . . . . 53 LYS H . 17160 1 539 . 1 1 53 53 LYS HA H 1 4.32 0.02 . 1 . . . . 53 LYS HA . 17160 1 540 . 1 1 53 53 LYS HB3 H 1 1.82 0.02 . 1 . . . . 53 LYS HB3 . 17160 1 541 . 1 1 53 53 LYS HD2 H 1 1.70 0.02 . 1 . . . . 53 LYS HD2 . 17160 1 542 . 1 1 53 53 LYS HE2 H 1 3.01 0.02 . 1 . . . . 53 LYS HE2 . 17160 1 543 . 1 1 53 53 LYS HG2 H 1 1.43 0.02 . 1 . . . . 53 LYS HG2 . 17160 1 544 . 1 1 53 53 LYS C C 13 176.9 0.3 . 1 . . . . 53 LYS C . 17160 1 545 . 1 1 53 53 LYS CA C 13 55.6 0.3 . 1 . . . . 53 LYS CA . 17160 1 546 . 1 1 53 53 LYS CB C 13 32.2 0.3 . 1 . . . . 53 LYS CB . 17160 1 547 . 1 1 53 53 LYS CD C 13 29.4 0.3 . 1 . . . . 53 LYS CD . 17160 1 548 . 1 1 53 53 LYS CE C 13 42.7 0.3 . 1 . . . . 53 LYS CE . 17160 1 549 . 1 1 53 53 LYS CG C 13 25.0 0.3 . 1 . . . . 53 LYS CG . 17160 1 550 . 1 1 53 53 LYS N N 15 122.3 0.3 . 1 . . . . 53 LYS N . 17160 1 551 . 1 1 54 54 SER H H 1 8.44 0.02 . 1 . . . . 54 SER H . 17160 1 552 . 1 1 54 54 SER HA H 1 1.58 0.02 . 1 . . . . 54 SER HA . 17160 1 553 . 1 1 54 54 SER HB2 H 1 3.35 0.02 . 1 . . . . 54 SER HB2 . 17160 1 554 . 1 1 54 54 SER C C 13 176.8 0.3 . 1 . . . . 54 SER C . 17160 1 555 . 1 1 54 54 SER CA C 13 60.0 0.3 . 1 . . . . 54 SER CA . 17160 1 556 . 1 1 54 54 SER CB C 13 61.7 0.3 . 1 . . . . 54 SER CB . 17160 1 557 . 1 1 54 54 SER N N 15 124.2 0.3 . 1 . . . . 54 SER N . 17160 1 558 . 1 1 55 55 THR H H 1 7.20 0.02 . 1 . . . . 55 THR H . 17160 1 559 . 1 1 55 55 THR HA H 1 4.18 0.02 . 1 . . . . 55 THR HA . 17160 1 560 . 1 1 55 55 THR HB H 1 4.06 0.02 . 1 . . . . 55 THR HB . 17160 1 561 . 1 1 55 55 THR HG21 H 1 1.16 0.02 . 1 . . . . 55 THR HG2 . 17160 1 562 . 1 1 55 55 THR HG22 H 1 1.16 0.02 . 1 . . . . 55 THR HG2 . 17160 1 563 . 1 1 55 55 THR HG23 H 1 1.16 0.02 . 1 . . . . 55 THR HG2 . 17160 1 564 . 1 1 55 55 THR C C 13 174.5 0.3 . 1 . . . . 55 THR C . 17160 1 565 . 1 1 55 55 THR CA C 13 63.3 0.3 . 1 . . . . 55 THR CA . 17160 1 566 . 1 1 55 55 THR CB C 13 68.6 0.3 . 1 . . . . 55 THR CB . 17160 1 567 . 1 1 55 55 THR CG2 C 13 22.5 0.3 . 1 . . . . 55 THR CG2 . 17160 1 568 . 1 1 55 55 THR N N 15 113.2 0.3 . 1 . . . . 55 THR N . 17160 1 569 . 1 1 56 56 PHE H H 1 8.32 0.02 . 1 . . . . 56 PHE H . 17160 1 570 . 1 1 56 56 PHE HA H 1 6.15 0.02 . 1 . . . . 56 PHE HA . 17160 1 571 . 1 1 56 56 PHE HB2 H 1 3.82 0.02 . 2 . . . . 56 PHE HB2 . 17160 1 572 . 1 1 56 56 PHE HB3 H 1 3.51 0.02 . 2 . . . . 56 PHE HB3 . 17160 1 573 . 1 1 56 56 PHE HD1 H 1 7.37 0.02 . 1 . . . . 56 PHE HD1 . 17160 1 574 . 1 1 56 56 PHE HE1 H 1 7.23 0.02 . 1 . . . . 56 PHE HE1 . 17160 1 575 . 1 1 56 56 PHE HZ H 1 7.31 0.02 . 1 . . . . 56 PHE HZ . 17160 1 576 . 1 1 56 56 PHE C C 13 177.1 0.3 . 1 . . . . 56 PHE C . 17160 1 577 . 1 1 56 56 PHE CA C 13 53.0 0.3 . 1 . . . . 56 PHE CA . 17160 1 578 . 1 1 56 56 PHE CB C 13 38.4 0.3 . 1 . . . . 56 PHE CB . 17160 1 579 . 1 1 56 56 PHE N N 15 120.1 0.3 . 1 . . . . 56 PHE N . 17160 1 580 . 1 1 57 57 PHE H H 1 7.47 0.02 . 1 . . . . 57 PHE H . 17160 1 581 . 1 1 57 57 PHE HA H 1 5.13 0.02 . 1 . . . . 57 PHE HA . 17160 1 582 . 1 1 57 57 PHE HB2 H 1 3.59 0.02 . 2 . . . . 57 PHE HB2 . 17160 1 583 . 1 1 57 57 PHE HB3 H 1 3.43 0.02 . 2 . . . . 57 PHE HB3 . 17160 1 584 . 1 1 57 57 PHE C C 13 178.8 0.3 . 1 . . . . 57 PHE C . 17160 1 585 . 1 1 57 57 PHE CA C 13 57.0 0.3 . 1 . . . . 57 PHE CA . 17160 1 586 . 1 1 57 57 PHE CB C 13 36.7 0.3 . 1 . . . . 57 PHE CB . 17160 1 587 . 1 1 57 57 PHE N N 15 119.2 0.3 . 1 . . . . 57 PHE N . 17160 1 588 . 1 1 58 58 GLU H H 1 11.40 0.02 . 1 . . . . 58 GLU H . 17160 1 589 . 1 1 58 58 GLU HA H 1 4.18 0.02 . 1 . . . . 58 GLU HA . 17160 1 590 . 1 1 58 58 GLU HB2 H 1 2.30 0.02 . 2 . . . . 58 GLU HB2 . 17160 1 591 . 1 1 58 58 GLU HB3 H 1 2.04 0.02 . 2 . . . . 58 GLU HB3 . 17160 1 592 . 1 1 58 58 GLU HG2 H 1 2.48 0.02 . 2 . . . . 58 GLU HG2 . 17160 1 593 . 1 1 58 58 GLU HG3 H 1 2.35 0.02 . 2 . . . . 58 GLU HG3 . 17160 1 594 . 1 1 58 58 GLU C C 13 180.3 0.3 . 1 . . . . 58 GLU C . 17160 1 595 . 1 1 58 58 GLU CA C 13 63.1 0.3 . 1 . . . . 58 GLU CA . 17160 1 596 . 1 1 58 58 GLU CB C 13 27.1 0.3 . 1 . . . . 58 GLU CB . 17160 1 597 . 1 1 58 58 GLU CG C 13 37.8 0.3 . 1 . . . . 58 GLU CG . 17160 1 598 . 1 1 58 58 GLU N N 15 130.1 0.3 . 1 . . . . 58 GLU N . 17160 1 599 . 1 1 59 59 LEU H H 1 8.43 0.02 . 1 . . . . 59 LEU H . 17160 1 600 . 1 1 59 59 LEU HA H 1 4.29 0.02 . 1 . . . . 59 LEU HA . 17160 1 601 . 1 1 59 59 LEU HB2 H 1 1.86 0.02 . 2 . . . . 59 LEU HB2 . 17160 1 602 . 1 1 59 59 LEU HB3 H 1 1.12 0.02 . 2 . . . . 59 LEU HB3 . 17160 1 603 . 1 1 59 59 LEU HD11 H 1 0.53 0.02 . 1 . . . . 59 LEU HD1 . 17160 1 604 . 1 1 59 59 LEU HD12 H 1 0.53 0.02 . 1 . . . . 59 LEU HD1 . 17160 1 605 . 1 1 59 59 LEU HD13 H 1 0.53 0.02 . 1 . . . . 59 LEU HD1 . 17160 1 606 . 1 1 59 59 LEU HG H 1 0.96 0.02 . 1 . . . . 59 LEU HG . 17160 1 607 . 1 1 59 59 LEU C C 13 175.9 0.3 . 1 . . . . 59 LEU C . 17160 1 608 . 1 1 59 59 LEU CA C 13 56.3 0.3 . 1 . . . . 59 LEU CA . 17160 1 609 . 1 1 59 59 LEU CB C 13 42.3 0.3 . 1 . . . . 59 LEU CB . 17160 1 610 . 1 1 59 59 LEU CD1 C 13 22.4 0.3 . 1 . . . . 59 LEU CD1 . 17160 1 611 . 1 1 59 59 LEU CG C 13 26.9 0.3 . 1 . . . . 59 LEU CG . 17160 1 612 . 1 1 59 59 LEU N N 15 112.7 0.3 . 1 . . . . 59 LEU N . 17160 1 613 . 1 1 60 60 ASP H H 1 8.13 0.02 . 1 . . . . 60 ASP H . 17160 1 614 . 1 1 60 60 ASP HA H 1 4.81 0.02 . 1 . . . . 60 ASP HA . 17160 1 615 . 1 1 60 60 ASP HB2 H 1 3.12 0.02 . 2 . . . . 60 ASP HB2 . 17160 1 616 . 1 1 60 60 ASP HB3 H 1 2.86 0.02 . 2 . . . . 60 ASP HB3 . 17160 1 617 . 1 1 60 60 ASP C C 13 179.7 0.3 . 1 . . . . 60 ASP C . 17160 1 618 . 1 1 60 60 ASP CA C 13 54.6 0.3 . 1 . . . . 60 ASP CA . 17160 1 619 . 1 1 60 60 ASP CB C 13 42.0 0.3 . 1 . . . . 60 ASP CB . 17160 1 620 . 1 1 60 60 ASP N N 15 114.0 0.3 . 1 . . . . 60 ASP N . 17160 1 621 . 1 1 61 61 GLN H H 1 7.75 0.02 . 1 . . . . 61 GLN H . 17160 1 622 . 1 1 61 61 GLN HA H 1 4.21 0.02 . 1 . . . . 61 GLN HA . 17160 1 623 . 1 1 61 61 GLN HB2 H 1 2.26 0.02 . 2 . . . . 61 GLN HB2 . 17160 1 624 . 1 1 61 61 GLN HB3 H 1 1.95 0.02 . 2 . . . . 61 GLN HB3 . 17160 1 625 . 1 1 61 61 GLN HE21 H 1 7.75 0.02 . 1 . . . . 61 GLN HE21 . 17160 1 626 . 1 1 61 61 GLN HG2 H 1 2.79 0.02 . 2 . . . . 61 GLN HG2 . 17160 1 627 . 1 1 61 61 GLN HG3 H 1 2.50 0.02 . 2 . . . . 61 GLN HG3 . 17160 1 628 . 1 1 61 61 GLN C C 13 176.8 0.3 . 1 . . . . 61 GLN C . 17160 1 629 . 1 1 61 61 GLN CA C 13 57.3 0.3 . 1 . . . . 61 GLN CA . 17160 1 630 . 1 1 61 61 GLN CB C 13 28.3 0.3 . 1 . . . . 61 GLN CB . 17160 1 631 . 1 1 61 61 GLN CG C 13 33.7 0.3 . 1 . . . . 61 GLN CG . 17160 1 632 . 1 1 61 61 GLN N N 15 123.5 0.3 . 1 . . . . 61 GLN N . 17160 1 633 . 1 1 61 61 GLN NE2 N 15 111.6 0.3 . 1 . . . . 61 GLN NE2 . 17160 1 634 . 1 1 62 62 GLN H H 1 9.26 0.02 . 1 . . . . 62 GLN H . 17160 1 635 . 1 1 62 62 GLN HA H 1 4.25 0.02 . 1 . . . . 62 GLN HA . 17160 1 636 . 1 1 62 62 GLN HB2 H 1 2.15 0.02 . 2 . . . . 62 GLN HB2 . 17160 1 637 . 1 1 62 62 GLN HB3 H 1 1.70 0.02 . 2 . . . . 62 GLN HB3 . 17160 1 638 . 1 1 62 62 GLN HE21 H 1 7.33 0.02 . 1 . . . . 62 GLN HE21 . 17160 1 639 . 1 1 62 62 GLN HG2 H 1 2.71 0.02 . 2 . . . . 62 GLN HG2 . 17160 1 640 . 1 1 62 62 GLN HG3 H 1 2.48 0.02 . 2 . . . . 62 GLN HG3 . 17160 1 641 . 1 1 62 62 GLN C C 13 171.9 0.3 . 1 . . . . 62 GLN C . 17160 1 642 . 1 1 62 62 GLN CA C 13 57.6 0.3 . 1 . . . . 62 GLN CA . 17160 1 643 . 1 1 62 62 GLN CB C 13 30.9 0.3 . 1 . . . . 62 GLN CB . 17160 1 644 . 1 1 62 62 GLN CG C 13 32.8 0.3 . 1 . . . . 62 GLN CG . 17160 1 645 . 1 1 62 62 GLN N N 15 126.4 0.3 . 1 . . . . 62 GLN N . 17160 1 646 . 1 1 62 62 GLN NE2 N 15 111.6 0.3 . 1 . . . . 62 GLN NE2 . 17160 1 647 . 1 1 63 63 THR H H 1 6.96 0.02 . 1 . . . . 63 THR H . 17160 1 648 . 1 1 63 63 THR HA H 1 4.94 0.02 . 1 . . . . 63 THR HA . 17160 1 649 . 1 1 63 63 THR HB H 1 4.59 0.02 . 1 . . . . 63 THR HB . 17160 1 650 . 1 1 63 63 THR HG21 H 1 1.10 0.02 . 1 . . . . 63 THR HG2 . 17160 1 651 . 1 1 63 63 THR HG22 H 1 1.10 0.02 . 1 . . . . 63 THR HG2 . 17160 1 652 . 1 1 63 63 THR HG23 H 1 1.10 0.02 . 1 . . . . 63 THR HG2 . 17160 1 653 . 1 1 63 63 THR C C 13 173.6 0.3 . 1 . . . . 63 THR C . 17160 1 654 . 1 1 63 63 THR CA C 13 59.1 0.3 . 1 . . . . 63 THR CA . 17160 1 655 . 1 1 63 63 THR CB C 13 68.9 0.3 . 1 . . . . 63 THR CB . 17160 1 656 . 1 1 63 63 THR CG2 C 13 21.2 0.3 . 1 . . . . 63 THR CG2 . 17160 1 657 . 1 1 63 63 THR N N 15 117.2 0.3 . 1 . . . . 63 THR N . 17160 1 658 . 1 1 64 64 PRO HA H 1 4.28 0.02 . 1 . . . . 64 PRO HA . 17160 1 659 . 1 1 64 64 PRO HB2 H 1 2.42 0.02 . 2 . . . . 64 PRO HB2 . 17160 1 660 . 1 1 64 64 PRO HB3 H 1 1.89 0.02 . 2 . . . . 64 PRO HB3 . 17160 1 661 . 1 1 64 64 PRO HD2 H 1 3.83 0.02 . 2 . . . . 64 PRO HD2 . 17160 1 662 . 1 1 64 64 PRO HD3 H 1 3.68 0.02 . 2 . . . . 64 PRO HD3 . 17160 1 663 . 1 1 64 64 PRO HG2 H 1 1.56 0.02 . 2 . . . . 64 PRO HG2 . 17160 1 664 . 1 1 64 64 PRO HG3 H 1 2.09 0.02 . 2 . . . . 64 PRO HG3 . 17160 1 665 . 1 1 64 64 PRO C C 13 177.5 0.3 . 1 . . . . 64 PRO C . 17160 1 666 . 1 1 64 64 PRO CA C 13 64.9 0.3 . 1 . . . . 64 PRO CA . 17160 1 667 . 1 1 64 64 PRO CB C 13 32.3 0.3 . 1 . . . . 64 PRO CB . 17160 1 668 . 1 1 64 64 PRO CD C 13 50.7 0.3 . 1 . . . . 64 PRO CD . 17160 1 669 . 1 1 65 65 THR H H 1 7.42 0.02 . 1 . . . . 65 THR H . 17160 1 670 . 1 1 65 65 THR HA H 1 4.50 0.02 . 1 . . . . 65 THR HA . 17160 1 671 . 1 1 65 65 THR HB H 1 4.43 0.02 . 1 . . . . 65 THR HB . 17160 1 672 . 1 1 65 65 THR HG21 H 1 1.06 0.02 . 1 . . . . 65 THR HG2 . 17160 1 673 . 1 1 65 65 THR HG22 H 1 1.06 0.02 . 1 . . . . 65 THR HG2 . 17160 1 674 . 1 1 65 65 THR HG23 H 1 1.06 0.02 . 1 . . . . 65 THR HG2 . 17160 1 675 . 1 1 65 65 THR C C 13 174.6 0.3 . 1 . . . . 65 THR C . 17160 1 676 . 1 1 65 65 THR CA C 13 59.8 0.3 . 1 . . . . 65 THR CA . 17160 1 677 . 1 1 65 65 THR CB C 13 69.3 0.3 . 1 . . . . 65 THR CB . 17160 1 678 . 1 1 65 65 THR CG2 C 13 21.2 0.3 . 1 . . . . 65 THR CG2 . 17160 1 679 . 1 1 65 65 THR N N 15 103.1 0.3 . 1 . . . . 65 THR N . 17160 1 680 . 1 1 66 66 ARG H H 1 6.97 0.02 . 1 . . . . 66 ARG H . 17160 1 681 . 1 1 66 66 ARG HA H 1 3.56 0.02 . 1 . . . . 66 ARG HA . 17160 1 682 . 1 1 66 66 ARG HB2 H 1 1.92 0.02 . 2 . . . . 66 ARG HB2 . 17160 1 683 . 1 1 66 66 ARG HB3 H 1 0.90 0.02 . 2 . . . . 66 ARG HB3 . 17160 1 684 . 1 1 66 66 ARG HD2 H 1 2.65 0.02 . 2 . . . . 66 ARG HD2 . 17160 1 685 . 1 1 66 66 ARG HD3 H 1 2.48 0.02 . 2 . . . . 66 ARG HD3 . 17160 1 686 . 1 1 66 66 ARG HG2 H 1 1.44 0.02 . 1 . . . . 66 ARG HG2 . 17160 1 687 . 1 1 66 66 ARG C C 13 175.1 0.3 . 1 . . . . 66 ARG C . 17160 1 688 . 1 1 66 66 ARG CA C 13 57.2 0.3 . 1 . . . . 66 ARG CA . 17160 1 689 . 1 1 66 66 ARG CB C 13 30.4 0.3 . 1 . . . . 66 ARG CB . 17160 1 690 . 1 1 66 66 ARG CD C 13 40.1 0.3 . 1 . . . . 66 ARG CD . 17160 1 691 . 1 1 66 66 ARG CG C 13 29.2 0.3 . 1 . . . . 66 ARG CG . 17160 1 692 . 1 1 66 66 ARG N N 15 124.3 0.3 . 1 . . . . 66 ARG N . 17160 1 693 . 1 1 67 67 TRP H H 1 8.11 0.02 . 1 . . . . 67 TRP H . 17160 1 694 . 1 1 67 67 TRP HA H 1 5.07 0.02 . 1 . . . . 67 TRP HA . 17160 1 695 . 1 1 67 67 TRP HB2 H 1 3.52 0.02 . 2 . . . . 67 TRP HB2 . 17160 1 696 . 1 1 67 67 TRP HB3 H 1 2.72 0.02 . 2 . . . . 67 TRP HB3 . 17160 1 697 . 1 1 67 67 TRP HD1 H 1 7.03 0.02 . 1 . . . . 67 TRP HD1 . 17160 1 698 . 1 1 67 67 TRP HE1 H 1 9.93 0.02 . 1 . . . . 67 TRP HE1 . 17160 1 699 . 1 1 67 67 TRP HZ2 H 1 6.47 0.02 . 1 . . . . 67 TRP HZ2 . 17160 1 700 . 1 1 67 67 TRP C C 13 175.6 0.3 . 1 . . . . 67 TRP C . 17160 1 701 . 1 1 67 67 TRP CA C 13 53.5 0.3 . 1 . . . . 67 TRP CA . 17160 1 702 . 1 1 67 67 TRP CB C 13 32.4 0.3 . 1 . . . . 67 TRP CB . 17160 1 703 . 1 1 67 67 TRP N N 15 116.5 0.3 . 1 . . . . 67 TRP N . 17160 1 704 . 1 1 67 67 TRP NE1 N 15 132.7 0.3 . 1 . . . . 67 TRP NE1 . 17160 1 705 . 1 1 68 68 ASN H H 1 9.63 0.02 . 1 . . . . 68 ASN H . 17160 1 706 . 1 1 68 68 ASN HA H 1 4.56 0.02 . 1 . . . . 68 ASN HA . 17160 1 707 . 1 1 68 68 ASN HB2 H 1 3.13 0.02 . 2 . . . . 68 ASN HB2 . 17160 1 708 . 1 1 68 68 ASN HB3 H 1 2.52 0.02 . 2 . . . . 68 ASN HB3 . 17160 1 709 . 1 1 68 68 ASN HD21 H 1 8.61 0.02 . 1 . . . . 68 ASN HD21 . 17160 1 710 . 1 1 68 68 ASN HD22 H 1 7.21 0.02 . 1 . . . . 68 ASN HD22 . 17160 1 711 . 1 1 68 68 ASN C C 13 174.9 0.3 . 1 . . . . 68 ASN C . 17160 1 712 . 1 1 68 68 ASN CA C 13 54.9 0.3 . 1 . . . . 68 ASN CA . 17160 1 713 . 1 1 68 68 ASN CB C 13 38.6 0.3 . 1 . . . . 68 ASN CB . 17160 1 714 . 1 1 68 68 ASN N N 15 124.2 0.3 . 1 . . . . 68 ASN N . 17160 1 715 . 1 1 68 68 ASN ND2 N 15 117.6 0.3 . 1 . . . . 68 ASN ND2 . 17160 1 716 . 1 1 69 69 LYS H H 1 8.48 0.02 . 1 . . . . 69 LYS H . 17160 1 717 . 1 1 69 69 LYS HA H 1 4.51 0.02 . 1 . . . . 69 LYS HA . 17160 1 718 . 1 1 69 69 LYS HB2 H 1 1.61 0.02 . 2 . . . . 69 LYS HB2 . 17160 1 719 . 1 1 69 69 LYS HB3 H 1 1.39 0.02 . 2 . . . . 69 LYS HB3 . 17160 1 720 . 1 1 69 69 LYS HD2 H 1 1.89 0.02 . 1 . . . . 69 LYS HD2 . 17160 1 721 . 1 1 69 69 LYS HE2 H 1 3.34 0.02 . 2 . . . . 69 LYS HE2 . 17160 1 722 . 1 1 69 69 LYS HE3 H 1 3.13 0.02 . 2 . . . . 69 LYS HE3 . 17160 1 723 . 1 1 69 69 LYS HG2 H 1 1.65 0.02 . 1 . . . . 69 LYS HG2 . 17160 1 724 . 1 1 69 69 LYS C C 13 176.7 0.3 . 1 . . . . 69 LYS C . 17160 1 725 . 1 1 69 69 LYS CA C 13 54.7 0.3 . 1 . . . . 69 LYS CA . 17160 1 726 . 1 1 69 69 LYS CB C 13 34.1 0.3 . 1 . . . . 69 LYS CB . 17160 1 727 . 1 1 69 69 LYS CD C 13 32.0 0.3 . 1 . . . . 69 LYS CD . 17160 1 728 . 1 1 69 69 LYS CE C 13 42.2 0.3 . 1 . . . . 69 LYS CE . 17160 1 729 . 1 1 69 69 LYS CG C 13 25.0 0.3 . 1 . . . . 69 LYS CG . 17160 1 730 . 1 1 69 69 LYS N N 15 126.7 0.3 . 1 . . . . 69 LYS N . 17160 1 731 . 1 1 70 70 LEU H H 1 8.33 0.02 . 1 . . . . 70 LEU H . 17160 1 732 . 1 1 70 70 LEU HA H 1 4.56 0.02 . 1 . . . . 70 LEU HA . 17160 1 733 . 1 1 70 70 LEU HB2 H 1 1.61 0.02 . 2 . . . . 70 LEU HB2 . 17160 1 734 . 1 1 70 70 LEU HB3 H 1 1.48 0.02 . 2 . . . . 70 LEU HB3 . 17160 1 735 . 1 1 70 70 LEU HD11 H 1 1.05 0.02 . 1 . . . . 70 LEU HD1 . 17160 1 736 . 1 1 70 70 LEU HD12 H 1 1.05 0.02 . 1 . . . . 70 LEU HD1 . 17160 1 737 . 1 1 70 70 LEU HD13 H 1 1.05 0.02 . 1 . . . . 70 LEU HD1 . 17160 1 738 . 1 1 70 70 LEU HD21 H 1 0.95 0.02 . 1 . . . . 70 LEU HD2 . 17160 1 739 . 1 1 70 70 LEU HD22 H 1 0.95 0.02 . 1 . . . . 70 LEU HD2 . 17160 1 740 . 1 1 70 70 LEU HD23 H 1 0.95 0.02 . 1 . . . . 70 LEU HD2 . 17160 1 741 . 1 1 70 70 LEU HG H 1 1.73 0.02 . 1 . . . . 70 LEU HG . 17160 1 742 . 1 1 70 70 LEU C C 13 176.3 0.3 . 1 . . . . 70 LEU C . 17160 1 743 . 1 1 70 70 LEU CA C 13 53.4 0.3 . 1 . . . . 70 LEU CA . 17160 1 744 . 1 1 70 70 LEU CB C 13 41.8 0.3 . 1 . . . . 70 LEU CB . 17160 1 745 . 1 1 70 70 LEU CD1 C 13 26.7 0.3 . 1 . . . . 70 LEU CD1 . 17160 1 746 . 1 1 70 70 LEU CD2 C 13 23.3 0.3 . 1 . . . . 70 LEU CD2 . 17160 1 747 . 1 1 70 70 LEU CG C 13 27.7 0.3 . 1 . . . . 70 LEU CG . 17160 1 748 . 1 1 70 70 LEU N N 15 124.2 0.3 . 1 . . . . 70 LEU N . 17160 1 749 . 1 1 71 71 ASN H H 1 8.89 0.02 . 1 . . . . 71 ASN H . 17160 1 750 . 1 1 71 71 ASN HA H 1 5.46 0.02 . 1 . . . . 71 ASN HA . 17160 1 751 . 1 1 71 71 ASN HB2 H 1 2.80 0.02 . 2 . . . . 71 ASN HB2 . 17160 1 752 . 1 1 71 71 ASN HB3 H 1 2.77 0.02 . 2 . . . . 71 ASN HB3 . 17160 1 753 . 1 1 71 71 ASN HD21 H 1 7.62 0.02 . 1 . . . . 71 ASN HD21 . 17160 1 754 . 1 1 71 71 ASN HD22 H 1 7.02 0.02 . 1 . . . . 71 ASN HD22 . 17160 1 755 . 1 1 71 71 ASN C C 13 172.1 0.3 . 1 . . . . 71 ASN C . 17160 1 756 . 1 1 71 71 ASN CA C 13 53.1 0.3 . 1 . . . . 71 ASN CA . 17160 1 757 . 1 1 71 71 ASN CB C 13 38.1 0.3 . 1 . . . . 71 ASN CB . 17160 1 758 . 1 1 71 71 ASN N N 15 123.0 0.3 . 1 . . . . 71 ASN N . 17160 1 759 . 1 1 71 71 ASN ND2 N 15 114.8 0.3 . 1 . . . . 71 ASN ND2 . 17160 1 760 . 1 1 72 72 LEU H H 1 8.30 0.02 . 1 . . . . 72 LEU H . 17160 1 761 . 1 1 72 72 LEU HA H 1 4.76 0.02 . 1 . . . . 72 LEU HA . 17160 1 762 . 1 1 72 72 LEU HB2 H 1 1.63 0.02 . 2 . . . . 72 LEU HB2 . 17160 1 763 . 1 1 72 72 LEU HB3 H 1 1.27 0.02 . 2 . . . . 72 LEU HB3 . 17160 1 764 . 1 1 72 72 LEU HD11 H 1 0.82 0.02 . 1 . . . . 72 LEU HD1 . 17160 1 765 . 1 1 72 72 LEU HD12 H 1 0.82 0.02 . 1 . . . . 72 LEU HD1 . 17160 1 766 . 1 1 72 72 LEU HD13 H 1 0.82 0.02 . 1 . . . . 72 LEU HD1 . 17160 1 767 . 1 1 72 72 LEU HD21 H 1 0.66 0.02 . 1 . . . . 72 LEU HD2 . 17160 1 768 . 1 1 72 72 LEU HD22 H 1 0.66 0.02 . 1 . . . . 72 LEU HD2 . 17160 1 769 . 1 1 72 72 LEU HD23 H 1 0.66 0.02 . 1 . . . . 72 LEU HD2 . 17160 1 770 . 1 1 72 72 LEU HG H 1 1.51 0.02 . 1 . . . . 72 LEU HG . 17160 1 771 . 1 1 72 72 LEU C C 13 175.5 0.3 . 1 . . . . 72 LEU C . 17160 1 772 . 1 1 72 72 LEU CA C 13 53.2 0.3 . 1 . . . . 72 LEU CA . 17160 1 773 . 1 1 72 72 LEU CB C 13 46.5 0.3 . 1 . . . . 72 LEU CB . 17160 1 774 . 1 1 72 72 LEU CD1 C 13 23.0 0.3 . 1 . . . . 72 LEU CD1 . 17160 1 775 . 1 1 72 72 LEU CD2 C 13 25.7 0.3 . 1 . . . . 72 LEU CD2 . 17160 1 776 . 1 1 72 72 LEU CG C 13 27.3 0.3 . 1 . . . . 72 LEU CG . 17160 1 777 . 1 1 72 72 LEU N N 15 126.8 0.3 . 1 . . . . 72 LEU N . 17160 1 778 . 1 1 73 73 LYS H H 1 8.68 0.02 . 1 . . . . 73 LYS H . 17160 1 779 . 1 1 73 73 LYS HA H 1 5.26 0.02 . 1 . . . . 73 LYS HA . 17160 1 780 . 1 1 73 73 LYS HB2 H 1 1.94 0.02 . 2 . . . . 73 LYS HB2 . 17160 1 781 . 1 1 73 73 LYS HB3 H 1 1.71 0.02 . 2 . . . . 73 LYS HB3 . 17160 1 782 . 1 1 73 73 LYS HD2 H 1 2.29 0.02 . 1 . . . . 73 LYS HD2 . 17160 1 783 . 1 1 73 73 LYS HE2 H 1 2.95 0.02 . 1 . . . . 73 LYS HE2 . 17160 1 784 . 1 1 73 73 LYS HG2 H 1 1.45 0.02 . 1 . . . . 73 LYS HG2 . 17160 1 785 . 1 1 73 73 LYS C C 13 177.7 0.3 . 1 . . . . 73 LYS C . 17160 1 786 . 1 1 73 73 LYS CA C 13 53.4 0.3 . 1 . . . . 73 LYS CA . 17160 1 787 . 1 1 73 73 LYS CB C 13 34.2 0.3 . 1 . . . . 73 LYS CB . 17160 1 788 . 1 1 73 73 LYS CD C 13 30.4 0.3 . 1 . . . . 73 LYS CD . 17160 1 789 . 1 1 73 73 LYS CE C 13 39.8 0.3 . 1 . . . . 73 LYS CE . 17160 1 790 . 1 1 73 73 LYS CG C 13 24.5 0.3 . 1 . . . . 73 LYS CG . 17160 1 791 . 1 1 73 73 LYS N N 15 121.2 0.3 . 1 . . . . 73 LYS N . 17160 1 792 . 1 1 74 74 THR H H 1 8.02 0.02 . 1 . . . . 74 THR H . 17160 1 793 . 1 1 74 74 THR HA H 1 3.83 0.02 . 1 . . . . 74 THR HA . 17160 1 794 . 1 1 74 74 THR HB H 1 4.18 0.02 . 1 . . . . 74 THR HB . 17160 1 795 . 1 1 74 74 THR HG21 H 1 1.28 0.02 . 1 . . . . 74 THR HG2 . 17160 1 796 . 1 1 74 74 THR HG22 H 1 1.28 0.02 . 1 . . . . 74 THR HG2 . 17160 1 797 . 1 1 74 74 THR HG23 H 1 1.28 0.02 . 1 . . . . 74 THR HG2 . 17160 1 798 . 1 1 74 74 THR C C 13 174.0 0.3 . 1 . . . . 74 THR C . 17160 1 799 . 1 1 74 74 THR CA C 13 62.4 0.3 . 1 . . . . 74 THR CA . 17160 1 800 . 1 1 74 74 THR CB C 13 69.3 0.3 . 1 . . . . 74 THR CB . 17160 1 801 . 1 1 74 74 THR CG2 C 13 23.2 0.3 . 1 . . . . 74 THR CG2 . 17160 1 802 . 1 1 74 74 THR N N 15 109.0 0.3 . 1 . . . . 74 THR N . 17160 1 803 . 1 1 75 75 GLY H H 1 8.75 0.02 . 1 . . . . 75 GLY H . 17160 1 804 . 1 1 75 75 GLY HA2 H 1 4.62 0.02 . 2 . . . . 75 GLY HA2 . 17160 1 805 . 1 1 75 75 GLY HA3 H 1 3.84 0.02 . 2 . . . . 75 GLY HA3 . 17160 1 806 . 1 1 75 75 GLY C C 13 178.8 0.3 . 1 . . . . 75 GLY C . 17160 1 807 . 1 1 75 75 GLY CA C 13 44.3 0.3 . 1 . . . . 75 GLY CA . 17160 1 808 . 1 1 75 75 GLY N N 15 108.7 0.3 . 1 . . . . 75 GLY N . 17160 1 809 . 1 1 76 76 PRO HA H 1 4.79 0.02 . 1 . . . . 76 PRO HA . 17160 1 810 . 1 1 76 76 PRO HB2 H 1 2.23 0.02 . 2 . . . . 76 PRO HB2 . 17160 1 811 . 1 1 76 76 PRO HB3 H 1 1.92 0.02 . 2 . . . . 76 PRO HB3 . 17160 1 812 . 1 1 76 76 PRO HD2 H 1 3.82 0.02 . 2 . . . . 76 PRO HD2 . 17160 1 813 . 1 1 76 76 PRO HD3 H 1 3.69 0.02 . 2 . . . . 76 PRO HD3 . 17160 1 814 . 1 1 76 76 PRO HG2 H 1 2.15 0.02 . 2 . . . . 76 PRO HG2 . 17160 1 815 . 1 1 76 76 PRO HG3 H 1 2.03 0.02 . 2 . . . . 76 PRO HG3 . 17160 1 816 . 1 1 76 76 PRO C C 13 177.1 0.3 . 1 . . . . 76 PRO C . 17160 1 817 . 1 1 76 76 PRO CA C 13 64.2 0.3 . 1 . . . . 76 PRO CA . 17160 1 818 . 1 1 76 76 PRO CB C 13 31.8 0.3 . 1 . . . . 76 PRO CB . 17160 1 819 . 1 1 76 76 PRO CD C 13 50.3 0.3 . 1 . . . . 76 PRO CD . 17160 1 820 . 1 1 76 76 PRO CG C 13 27.5 0.3 . 1 . . . . 76 PRO CG . 17160 1 821 . 1 1 77 77 ASN H H 1 9.40 0.02 . 1 . . . . 77 ASN H . 17160 1 822 . 1 1 77 77 ASN HA H 1 4.83 0.02 . 1 . . . . 77 ASN HA . 17160 1 823 . 1 1 77 77 ASN HB2 H 1 2.35 0.02 . 2 . . . . 77 ASN HB2 . 17160 1 824 . 1 1 77 77 ASN HB3 H 1 2.02 0.02 . 2 . . . . 77 ASN HB3 . 17160 1 825 . 1 1 77 77 ASN HD21 H 1 7.62 0.02 . 1 . . . . 77 ASN HD21 . 17160 1 826 . 1 1 77 77 ASN HD22 H 1 6.97 0.02 . 1 . . . . 77 ASN HD22 . 17160 1 827 . 1 1 77 77 ASN C C 13 172.7 0.3 . 1 . . . . 77 ASN C . 17160 1 828 . 1 1 77 77 ASN CA C 13 53.2 0.3 . 1 . . . . 77 ASN CA . 17160 1 829 . 1 1 77 77 ASN CB C 13 46.4 0.3 . 1 . . . . 77 ASN CB . 17160 1 830 . 1 1 77 77 ASN N N 15 126.7 0.3 . 1 . . . . 77 ASN N . 17160 1 831 . 1 1 77 77 ASN ND2 N 15 115.9 0.3 . 1 . . . . 77 ASN ND2 . 17160 1 832 . 1 1 78 78 SER H H 1 8.45 0.02 . 1 . . . . 78 SER H . 17160 1 833 . 1 1 78 78 SER HA H 1 5.31 0.02 . 1 . . . . 78 SER HA . 17160 1 834 . 1 1 78 78 SER HB2 H 1 3.49 0.02 . 1 . . . . 78 SER HB2 . 17160 1 835 . 1 1 78 78 SER C C 13 173.0 0.3 . 1 . . . . 78 SER C . 17160 1 836 . 1 1 78 78 SER CA C 13 56.9 0.3 . 1 . . . . 78 SER CA . 17160 1 837 . 1 1 78 78 SER CB C 13 64.4 0.3 . 1 . . . . 78 SER CB . 17160 1 838 . 1 1 78 78 SER N N 15 116.5 0.3 . 1 . . . . 78 SER N . 17160 1 839 . 1 1 79 79 PHE H H 1 9.11 0.02 . 1 . . . . 79 PHE H . 17160 1 840 . 1 1 79 79 PHE HA H 1 5.13 0.02 . 1 . . . . 79 PHE HA . 17160 1 841 . 1 1 79 79 PHE HB2 H 1 3.11 0.02 . 2 . . . . 79 PHE HB2 . 17160 1 842 . 1 1 79 79 PHE HB3 H 1 2.85 0.02 . 2 . . . . 79 PHE HB3 . 17160 1 843 . 1 1 79 79 PHE HD1 H 1 6.89 0.02 . 1 . . . . 79 PHE HD1 . 17160 1 844 . 1 1 79 79 PHE HE1 H 1 7.25 0.02 . 1 . . . . 79 PHE HE1 . 17160 1 845 . 1 1 79 79 PHE HZ H 1 7.47 0.02 . 1 . . . . 79 PHE HZ . 17160 1 846 . 1 1 79 79 PHE C C 13 174.5 0.3 . 1 . . . . 79 PHE C . 17160 1 847 . 1 1 79 79 PHE CA C 13 55.8 0.3 . 1 . . . . 79 PHE CA . 17160 1 848 . 1 1 79 79 PHE CB C 13 42.3 0.3 . 1 . . . . 79 PHE CB . 17160 1 849 . 1 1 79 79 PHE N N 15 125.0 0.3 . 1 . . . . 79 PHE N . 17160 1 850 . 1 1 80 80 THR H H 1 9.39 0.02 . 1 . . . . 80 THR H . 17160 1 851 . 1 1 80 80 THR HA H 1 5.46 0.02 . 1 . . . . 80 THR HA . 17160 1 852 . 1 1 80 80 THR HB H 1 3.78 0.02 . 1 . . . . 80 THR HB . 17160 1 853 . 1 1 80 80 THR HG21 H 1 0.93 0.02 . 1 . . . . 80 THR HG2 . 17160 1 854 . 1 1 80 80 THR HG22 H 1 0.93 0.02 . 1 . . . . 80 THR HG2 . 17160 1 855 . 1 1 80 80 THR HG23 H 1 0.93 0.02 . 1 . . . . 80 THR HG2 . 17160 1 856 . 1 1 80 80 THR C C 13 174.2 0.3 . 1 . . . . 80 THR C . 17160 1 857 . 1 1 80 80 THR CA C 13 61.1 0.3 . 1 . . . . 80 THR CA . 17160 1 858 . 1 1 80 80 THR CB C 13 71.3 0.3 . 1 . . . . 80 THR CB . 17160 1 859 . 1 1 80 80 THR CG2 C 13 21.4 0.3 . 1 . . . . 80 THR CG2 . 17160 1 860 . 1 1 80 80 THR N N 15 119.7 0.3 . 1 . . . . 80 THR N . 17160 1 861 . 1 1 81 81 TRP H H 1 9.53 0.02 . 1 . . . . 81 TRP H . 17160 1 862 . 1 1 81 81 TRP HA H 1 4.85 0.02 . 1 . . . . 81 TRP HA . 17160 1 863 . 1 1 81 81 TRP HB2 H 1 2.60 0.02 . 2 . . . . 81 TRP HB2 . 17160 1 864 . 1 1 81 81 TRP HB3 H 1 2.28 0.02 . 2 . . . . 81 TRP HB3 . 17160 1 865 . 1 1 81 81 TRP HD1 H 1 6.60 0.02 . 1 . . . . 81 TRP HD1 . 17160 1 866 . 1 1 81 81 TRP HE1 H 1 10.87 0.02 . 1 . . . . 81 TRP HE1 . 17160 1 867 . 1 1 81 81 TRP HE3 H 1 8.42 0.02 . 1 . . . . 81 TRP HE3 . 17160 1 868 . 1 1 81 81 TRP HH2 H 1 7.61 0.02 . 1 . . . . 81 TRP HH2 . 17160 1 869 . 1 1 81 81 TRP HZ2 H 1 7.98 0.02 . 1 . . . . 81 TRP HZ2 . 17160 1 870 . 1 1 81 81 TRP C C 13 175.3 0.3 . 1 . . . . 81 TRP C . 17160 1 871 . 1 1 81 81 TRP CA C 13 56.6 0.3 . 1 . . . . 81 TRP CA . 17160 1 872 . 1 1 81 81 TRP CB C 13 30.5 0.3 . 1 . . . . 81 TRP CB . 17160 1 873 . 1 1 81 81 TRP N N 15 129.1 0.3 . 1 . . . . 81 TRP N . 17160 1 874 . 1 1 81 81 TRP NE1 N 15 129.0 0.3 . 1 . . . . 81 TRP NE1 . 17160 1 875 . 1 1 82 82 LYS H H 1 8.53 0.02 . 1 . . . . 82 LYS H . 17160 1 876 . 1 1 82 82 LYS HA H 1 4.49 0.02 . 1 . . . . 82 LYS HA . 17160 1 877 . 1 1 82 82 LYS HB2 H 1 1.07 0.02 . 2 . . . . 82 LYS HB2 . 17160 1 878 . 1 1 82 82 LYS HB3 H 1 0.89 0.02 . 2 . . . . 82 LYS HB3 . 17160 1 879 . 1 1 82 82 LYS HD2 H 1 1.50 0.02 . 1 . . . . 82 LYS HD2 . 17160 1 880 . 1 1 82 82 LYS HE2 H 1 2.87 0.02 . 2 . . . . 82 LYS HE2 . 17160 1 881 . 1 1 82 82 LYS HE3 H 1 2.78 0.02 . 2 . . . . 82 LYS HE3 . 17160 1 882 . 1 1 82 82 LYS HG2 H 1 0.95 0.02 . 1 . . . . 82 LYS HG2 . 17160 1 883 . 1 1 82 82 LYS C C 13 174.0 0.3 . 1 . . . . 82 LYS C . 17160 1 884 . 1 1 82 82 LYS CA C 13 54.3 0.3 . 1 . . . . 82 LYS CA . 17160 1 885 . 1 1 82 82 LYS CB C 13 33.7 0.3 . 1 . . . . 82 LYS CB . 17160 1 886 . 1 1 82 82 LYS CD C 13 28.0 0.3 . 1 . . . . 82 LYS CD . 17160 1 887 . 1 1 82 82 LYS CE C 13 41.5 0.3 . 1 . . . . 82 LYS CE . 17160 1 888 . 1 1 82 82 LYS CG C 13 24.2 0.3 . 1 . . . . 82 LYS CG . 17160 1 889 . 1 1 82 82 LYS N N 15 122.6 0.3 . 1 . . . . 82 LYS N . 17160 1 890 . 1 1 83 83 LEU H H 1 8.69 0.02 . 1 . . . . 83 LEU H . 17160 1 891 . 1 1 83 83 LEU HA H 1 5.06 0.02 . 1 . . . . 83 LEU HA . 17160 1 892 . 1 1 83 83 LEU HB2 H 1 1.70 0.02 . 2 . . . . 83 LEU HB2 . 17160 1 893 . 1 1 83 83 LEU HB3 H 1 1.29 0.02 . 2 . . . . 83 LEU HB3 . 17160 1 894 . 1 1 83 83 LEU HD11 H 1 0.62 0.02 . 1 . . . . 83 LEU HD1 . 17160 1 895 . 1 1 83 83 LEU HD12 H 1 0.62 0.02 . 1 . . . . 83 LEU HD1 . 17160 1 896 . 1 1 83 83 LEU HD13 H 1 0.62 0.02 . 1 . . . . 83 LEU HD1 . 17160 1 897 . 1 1 83 83 LEU HD21 H 1 0.28 0.02 . 1 . . . . 83 LEU HD2 . 17160 1 898 . 1 1 83 83 LEU HD22 H 1 0.28 0.02 . 1 . . . . 83 LEU HD2 . 17160 1 899 . 1 1 83 83 LEU HD23 H 1 0.28 0.02 . 1 . . . . 83 LEU HD2 . 17160 1 900 . 1 1 83 83 LEU HG H 1 1.31 0.02 . 1 . . . . 83 LEU HG . 17160 1 901 . 1 1 83 83 LEU C C 13 177.6 0.3 . 1 . . . . 83 LEU C . 17160 1 902 . 1 1 83 83 LEU CA C 13 53.6 0.3 . 1 . . . . 83 LEU CA . 17160 1 903 . 1 1 83 83 LEU CB C 13 41.9 0.3 . 1 . . . . 83 LEU CB . 17160 1 904 . 1 1 83 83 LEU CD1 C 13 25.6 0.3 . 1 . . . . 83 LEU CD1 . 17160 1 905 . 1 1 83 83 LEU CD2 C 13 24.0 0.3 . 1 . . . . 83 LEU CD2 . 17160 1 906 . 1 1 83 83 LEU CG C 13 27.7 0.3 . 1 . . . . 83 LEU CG . 17160 1 907 . 1 1 83 83 LEU N N 15 125.3 0.3 . 1 . . . . 83 LEU N . 17160 1 908 . 1 1 84 84 THR H H 1 8.69 0.02 . 1 . . . . 84 THR H . 17160 1 909 . 1 1 84 84 THR HA H 1 4.24 0.02 . 1 . . . . 84 THR HA . 17160 1 910 . 1 1 84 84 THR HB H 1 4.32 0.02 . 1 . . . . 84 THR HB . 17160 1 911 . 1 1 84 84 THR HG21 H 1 1.05 0.02 . 1 . . . . 84 THR HG2 . 17160 1 912 . 1 1 84 84 THR HG22 H 1 1.05 0.02 . 1 . . . . 84 THR HG2 . 17160 1 913 . 1 1 84 84 THR HG23 H 1 1.05 0.02 . 1 . . . . 84 THR HG2 . 17160 1 914 . 1 1 84 84 THR C C 13 175.4 0.3 . 1 . . . . 84 THR C . 17160 1 915 . 1 1 84 84 THR CA C 13 62.7 0.3 . 1 . . . . 84 THR CA . 17160 1 916 . 1 1 84 84 THR CB C 13 67.7 0.3 . 1 . . . . 84 THR CB . 17160 1 917 . 1 1 84 84 THR CG2 C 13 21.3 0.3 . 1 . . . . 84 THR CG2 . 17160 1 918 . 1 1 84 84 THR N N 15 116.4 0.3 . 1 . . . . 84 THR N . 17160 1 919 . 1 1 85 85 ALA H H 1 8.07 0.02 . 1 . . . . 85 ALA H . 17160 1 920 . 1 1 85 85 ALA HA H 1 4.54 0.02 . 1 . . . . 85 ALA HA . 17160 1 921 . 1 1 85 85 ALA HB1 H 1 1.34 0.02 . 1 . . . . 85 ALA HB . 17160 1 922 . 1 1 85 85 ALA HB2 H 1 1.34 0.02 . 1 . . . . 85 ALA HB . 17160 1 923 . 1 1 85 85 ALA HB3 H 1 1.34 0.02 . 1 . . . . 85 ALA HB . 17160 1 924 . 1 1 85 85 ALA C C 13 174.9 0.3 . 1 . . . . 85 ALA C . 17160 1 925 . 1 1 85 85 ALA CA C 13 52.4 0.3 . 1 . . . . 85 ALA CA . 17160 1 926 . 1 1 85 85 ALA CB C 13 21.0 0.3 . 1 . . . . 85 ALA CB . 17160 1 927 . 1 1 85 85 ALA N N 15 126.3 0.3 . 1 . . . . 85 ALA N . 17160 1 928 . 1 1 86 86 ARG HA H 1 4.10 0.02 . 1 . . . . 86 ARG HA . 17160 1 929 . 1 1 86 86 ARG HB2 H 1 1.87 0.02 . 2 . . . . 86 ARG HB2 . 17160 1 930 . 1 1 86 86 ARG HB3 H 1 1.48 0.02 . 2 . . . . 86 ARG HB3 . 17160 1 931 . 1 1 86 86 ARG HD2 H 1 3.09 0.02 . 1 . . . . 86 ARG HD2 . 17160 1 932 . 1 1 86 86 ARG HG2 H 1 1.16 0.02 . 1 . . . . 86 ARG HG2 . 17160 1 933 . 1 1 86 86 ARG C C 13 174.9 0.3 . 1 . . . . 86 ARG C . 17160 1 934 . 1 1 86 86 ARG CA C 13 55.7 0.3 . 1 . . . . 86 ARG CA . 17160 1 935 . 1 1 86 86 ARG CB C 13 29.6 0.3 . 1 . . . . 86 ARG CB . 17160 1 936 . 1 1 86 86 ARG CD C 13 44.4 0.3 . 1 . . . . 86 ARG CD . 17160 1 937 . 1 1 86 86 ARG CG C 13 27.5 0.3 . 1 . . . . 86 ARG CG . 17160 1 938 . 1 1 87 87 HIS H H 1 6.62 0.02 . 1 . . . . 87 HIS H . 17160 1 939 . 1 1 87 87 HIS HA H 1 4.80 0.02 . 1 . . . . 87 HIS HA . 17160 1 940 . 1 1 87 87 HIS HB2 H 1 3.34 0.02 . 2 . . . . 87 HIS HB2 . 17160 1 941 . 1 1 87 87 HIS HB3 H 1 2.66 0.02 . 2 . . . . 87 HIS HB3 . 17160 1 942 . 1 1 87 87 HIS HD2 H 1 7.03 0.02 . 1 . . . . 87 HIS HD2 . 17160 1 943 . 1 1 87 87 HIS HE1 H 1 7.98 0.02 . 1 . . . . 87 HIS HE1 . 17160 1 944 . 1 1 87 87 HIS C C 13 174.0 0.3 . 1 . . . . 87 HIS C . 17160 1 945 . 1 1 87 87 HIS CA C 13 54.4 0.3 . 1 . . . . 87 HIS CA . 17160 1 946 . 1 1 87 87 HIS CB C 13 32.7 0.3 . 1 . . . . 87 HIS CB . 17160 1 947 . 1 1 87 87 HIS CE1 C 13 137.2 0.3 . 1 . . . . 87 HIS CE1 . 17160 1 948 . 1 1 87 87 HIS N N 15 118.5 0.3 . 1 . . . . 87 HIS N . 17160 1 949 . 1 1 88 88 SER H H 1 9.05 0.02 . 1 . . . . 88 SER H . 17160 1 950 . 1 1 88 88 SER HA H 1 3.92 0.02 . 1 . . . . 88 SER HA . 17160 1 951 . 1 1 88 88 SER HB2 H 1 3.72 0.02 . 1 . . . . 88 SER HB2 . 17160 1 952 . 1 1 88 88 SER C C 13 175.3 0.3 . 1 . . . . 88 SER C . 17160 1 953 . 1 1 88 88 SER CA C 13 59.4 0.3 . 1 . . . . 88 SER CA . 17160 1 954 . 1 1 88 88 SER CB C 13 62.9 0.3 . 1 . . . . 88 SER CB . 17160 1 955 . 1 1 88 88 SER N N 15 117.8 0.3 . 1 . . . . 88 SER N . 17160 1 956 . 1 1 89 89 THR H H 1 8.18 0.02 . 1 . . . . 89 THR H . 17160 1 957 . 1 1 89 89 THR HA H 1 4.38 0.02 . 1 . . . . 89 THR HA . 17160 1 958 . 1 1 89 89 THR HB H 1 4.21 0.02 . 1 . . . . 89 THR HB . 17160 1 959 . 1 1 89 89 THR HG21 H 1 0.76 0.02 . 1 . . . . 89 THR HG2 . 17160 1 960 . 1 1 89 89 THR HG22 H 1 0.76 0.02 . 1 . . . . 89 THR HG2 . 17160 1 961 . 1 1 89 89 THR HG23 H 1 0.76 0.02 . 1 . . . . 89 THR HG2 . 17160 1 962 . 1 1 89 89 THR C C 13 173.2 0.3 . 1 . . . . 89 THR C . 17160 1 963 . 1 1 89 89 THR CA C 13 65.0 0.3 . 1 . . . . 89 THR CA . 17160 1 964 . 1 1 89 89 THR CB C 13 72.5 0.3 . 1 . . . . 89 THR CB . 17160 1 965 . 1 1 89 89 THR CG2 C 13 20.4 0.3 . 1 . . . . 89 THR CG2 . 17160 1 966 . 1 1 89 89 THR N N 15 125.4 0.3 . 1 . . . . 89 THR N . 17160 1 967 . 1 1 90 90 THR H H 1 8.68 0.02 . 1 . . . . 90 THR H . 17160 1 968 . 1 1 90 90 THR HA H 1 4.27 0.02 . 1 . . . . 90 THR HA . 17160 1 969 . 1 1 90 90 THR HB H 1 3.63 0.02 . 1 . . . . 90 THR HB . 17160 1 970 . 1 1 90 90 THR HG21 H 1 1.23 0.02 . 1 . . . . 90 THR HG2 . 17160 1 971 . 1 1 90 90 THR HG22 H 1 1.23 0.02 . 1 . . . . 90 THR HG2 . 17160 1 972 . 1 1 90 90 THR HG23 H 1 1.23 0.02 . 1 . . . . 90 THR HG2 . 17160 1 973 . 1 1 90 90 THR C C 13 174.1 0.3 . 1 . . . . 90 THR C . 17160 1 974 . 1 1 90 90 THR CA C 13 65.2 0.3 . 1 . . . . 90 THR CA . 17160 1 975 . 1 1 90 90 THR CB C 13 69.1 0.3 . 1 . . . . 90 THR CB . 17160 1 976 . 1 1 90 90 THR CG2 C 13 22.0 0.3 . 1 . . . . 90 THR CG2 . 17160 1 977 . 1 1 90 90 THR N N 15 125.3 0.3 . 1 . . . . 90 THR N . 17160 1 978 . 1 1 91 91 SER H H 1 7.51 0.02 . 1 . . . . 91 SER H . 17160 1 979 . 1 1 91 91 SER HA H 1 5.40 0.02 . 1 . . . . 91 SER HA . 17160 1 980 . 1 1 91 91 SER HB2 H 1 4.11 0.02 . 2 . . . . 91 SER HB2 . 17160 1 981 . 1 1 91 91 SER HB3 H 1 3.90 0.02 . 2 . . . . 91 SER HB3 . 17160 1 982 . 1 1 91 91 SER C C 13 170.4 0.3 . 1 . . . . 91 SER C . 17160 1 983 . 1 1 91 91 SER CA C 13 56.9 0.3 . 1 . . . . 91 SER CA . 17160 1 984 . 1 1 91 91 SER CB C 13 66.4 0.3 . 1 . . . . 91 SER CB . 17160 1 985 . 1 1 91 91 SER N N 15 113.0 0.3 . 1 . . . . 91 SER N . 17160 1 986 . 1 1 92 92 TRP H H 1 8.92 0.02 . 1 . . . . 92 TRP H . 17160 1 987 . 1 1 92 92 TRP HA H 1 5.29 0.02 . 1 . . . . 92 TRP HA . 17160 1 988 . 1 1 92 92 TRP HB2 H 1 3.03 0.02 . 2 . . . . 92 TRP HB2 . 17160 1 989 . 1 1 92 92 TRP HB3 H 1 2.75 0.02 . 2 . . . . 92 TRP HB3 . 17160 1 990 . 1 1 92 92 TRP HD1 H 1 6.92 0.02 . 1 . . . . 92 TRP HD1 . 17160 1 991 . 1 1 92 92 TRP HE1 H 1 10.86 0.02 . 1 . . . . 92 TRP HE1 . 17160 1 992 . 1 1 92 92 TRP HZ2 H 1 6.47 0.02 . 1 . . . . 92 TRP HZ2 . 17160 1 993 . 1 1 92 92 TRP C C 13 176.0 0.3 . 1 . . . . 92 TRP C . 17160 1 994 . 1 1 92 92 TRP CA C 13 54.6 0.3 . 1 . . . . 92 TRP CA . 17160 1 995 . 1 1 92 92 TRP CB C 13 30.8 0.3 . 1 . . . . 92 TRP CB . 17160 1 996 . 1 1 92 92 TRP N N 15 122.4 0.3 . 1 . . . . 92 TRP N . 17160 1 997 . 1 1 92 92 TRP NE1 N 15 134.7 0.3 . 1 . . . . 92 TRP NE1 . 17160 1 998 . 1 1 93 93 ARG H H 1 9.01 0.02 . 1 . . . . 93 ARG H . 17160 1 999 . 1 1 93 93 ARG HA H 1 4.97 0.02 . 1 . . . . 93 ARG HA . 17160 1 1000 . 1 1 93 93 ARG HB2 H 1 1.71 0.02 . 2 . . . . 93 ARG HB2 . 17160 1 1001 . 1 1 93 93 ARG HB3 H 1 1.13 0.02 . 2 . . . . 93 ARG HB3 . 17160 1 1002 . 1 1 93 93 ARG HD2 H 1 3.30 0.02 . 1 . . . . 93 ARG HD2 . 17160 1 1003 . 1 1 93 93 ARG HG2 H 1 1.57 0.02 . 1 . . . . 93 ARG HG2 . 17160 1 1004 . 1 1 93 93 ARG C C 13 173.1 0.3 . 1 . . . . 93 ARG C . 17160 1 1005 . 1 1 93 93 ARG CA C 13 54.7 0.3 . 1 . . . . 93 ARG CA . 17160 1 1006 . 1 1 93 93 ARG CB C 13 36.5 0.3 . 1 . . . . 93 ARG CB . 17160 1 1007 . 1 1 93 93 ARG CD C 13 43.3 0.3 . 1 . . . . 93 ARG CD . 17160 1 1008 . 1 1 93 93 ARG CG C 13 27.2 0.3 . 1 . . . . 93 ARG CG . 17160 1 1009 . 1 1 93 93 ARG N N 15 122.1 0.3 . 1 . . . . 93 ARG N . 17160 1 1010 . 1 1 94 94 TYR H H 1 8.00 0.02 . 1 . . . . 94 TYR H . 17160 1 1011 . 1 1 94 94 TYR HA H 1 5.18 0.02 . 1 . . . . 94 TYR HA . 17160 1 1012 . 1 1 94 94 TYR HB2 H 1 1.91 0.02 . 2 . . . . 94 TYR HB2 . 17160 1 1013 . 1 1 94 94 TYR HB3 H 1 1.57 0.02 . 2 . . . . 94 TYR HB3 . 17160 1 1014 . 1 1 94 94 TYR HD1 H 1 6.30 0.02 . 1 . . . . 94 TYR HD1 . 17160 1 1015 . 1 1 94 94 TYR C C 13 176.2 0.3 . 1 . . . . 94 TYR C . 17160 1 1016 . 1 1 94 94 TYR CA C 13 56.3 0.3 . 1 . . . . 94 TYR CA . 17160 1 1017 . 1 1 94 94 TYR CB C 13 40.3 0.3 . 1 . . . . 94 TYR CB . 17160 1 1018 . 1 1 94 94 TYR N N 15 119.7 0.3 . 1 . . . . 94 TYR N . 17160 1 1019 . 1 1 95 95 PHE H H 1 9.25 0.02 . 1 . . . . 95 PHE H . 17160 1 1020 . 1 1 95 95 PHE HA H 1 5.73 0.02 . 1 . . . . 95 PHE HA . 17160 1 1021 . 1 1 95 95 PHE HB2 H 1 3.24 0.02 . 2 . . . . 95 PHE HB2 . 17160 1 1022 . 1 1 95 95 PHE HB3 H 1 2.75 0.02 . 2 . . . . 95 PHE HB3 . 17160 1 1023 . 1 1 95 95 PHE C C 13 175.6 0.3 . 1 . . . . 95 PHE C . 17160 1 1024 . 1 1 95 95 PHE CA C 13 55.4 0.3 . 1 . . . . 95 PHE CA . 17160 1 1025 . 1 1 95 95 PHE CB C 13 42.3 0.3 . 1 . . . . 95 PHE CB . 17160 1 1026 . 1 1 95 95 PHE N N 15 122.1 0.3 . 1 . . . . 95 PHE N . 17160 1 1027 . 1 1 96 96 ILE H H 1 9.87 0.02 . 1 . . . . 96 ILE H . 17160 1 1028 . 1 1 96 96 ILE HA H 1 5.95 0.02 . 1 . . . . 96 ILE HA . 17160 1 1029 . 1 1 96 96 ILE HB H 1 1.70 0.02 . 1 . . . . 96 ILE HB . 17160 1 1030 . 1 1 96 96 ILE HD11 H 1 0.33 0.02 . 1 . . . . 96 ILE HD1 . 17160 1 1031 . 1 1 96 96 ILE HD12 H 1 0.33 0.02 . 1 . . . . 96 ILE HD1 . 17160 1 1032 . 1 1 96 96 ILE HD13 H 1 0.33 0.02 . 1 . . . . 96 ILE HD1 . 17160 1 1033 . 1 1 96 96 ILE HG12 H 1 1.69 0.02 . 2 . . . . 96 ILE HG12 . 17160 1 1034 . 1 1 96 96 ILE HG13 H 1 1.53 0.02 . 2 . . . . 96 ILE HG13 . 17160 1 1035 . 1 1 96 96 ILE HG21 H 1 0.80 0.02 . 1 . . . . 96 ILE HG2 . 17160 1 1036 . 1 1 96 96 ILE HG22 H 1 0.80 0.02 . 1 . . . . 96 ILE HG2 . 17160 1 1037 . 1 1 96 96 ILE HG23 H 1 0.80 0.02 . 1 . . . . 96 ILE HG2 . 17160 1 1038 . 1 1 96 96 ILE C C 13 173.1 0.3 . 1 . . . . 96 ILE C . 17160 1 1039 . 1 1 96 96 ILE CA C 13 59.2 0.3 . 1 . . . . 96 ILE CA . 17160 1 1040 . 1 1 96 96 ILE CB C 13 42.2 0.3 . 1 . . . . 96 ILE CB . 17160 1 1041 . 1 1 96 96 ILE CD1 C 13 15.0 0.3 . 1 . . . . 96 ILE CD1 . 17160 1 1042 . 1 1 96 96 ILE CG1 C 13 28.9 0.3 . 1 . . . . 96 ILE CG1 . 17160 1 1043 . 1 1 96 96 ILE CG2 C 13 14.5 0.3 . 1 . . . . 96 ILE CG2 . 17160 1 1044 . 1 1 96 96 ILE N N 15 122.7 0.3 . 1 . . . . 96 ILE N . 17160 1 1045 . 1 1 97 97 THR H H 1 7.92 0.02 . 1 . . . . 97 THR H . 17160 1 1046 . 1 1 97 97 THR HA H 1 4.04 0.02 . 1 . . . . 97 THR HA . 17160 1 1047 . 1 1 97 97 THR HB H 1 3.51 0.02 . 1 . . . . 97 THR HB . 17160 1 1048 . 1 1 97 97 THR HG21 H 1 -0.43 0.02 . 1 . . . . 97 THR HG2 . 17160 1 1049 . 1 1 97 97 THR HG22 H 1 -0.43 0.02 . 1 . . . . 97 THR HG2 . 17160 1 1050 . 1 1 97 97 THR HG23 H 1 -0.43 0.02 . 1 . . . . 97 THR HG2 . 17160 1 1051 . 1 1 97 97 THR C C 13 175.9 0.3 . 1 . . . . 97 THR C . 17160 1 1052 . 1 1 97 97 THR CA C 13 61.2 0.3 . 1 . . . . 97 THR CA . 17160 1 1053 . 1 1 97 97 THR CB C 13 68.8 0.3 . 1 . . . . 97 THR CB . 17160 1 1054 . 1 1 97 97 THR CG2 C 13 23.0 0.3 . 1 . . . . 97 THR CG2 . 17160 1 1055 . 1 1 97 97 THR N N 15 119.0 0.3 . 1 . . . . 97 THR N . 17160 1 1056 . 1 1 98 98 LYS H H 1 8.21 0.02 . 1 . . . . 98 LYS H . 17160 1 1057 . 1 1 98 98 LYS HA H 1 4.30 0.02 . 1 . . . . 98 LYS HA . 17160 1 1058 . 1 1 98 98 LYS HB2 H 1 2.04 0.02 . 2 . . . . 98 LYS HB2 . 17160 1 1059 . 1 1 98 98 LYS HB3 H 1 1.64 0.02 . 2 . . . . 98 LYS HB3 . 17160 1 1060 . 1 1 98 98 LYS HD2 H 1 1.70 0.02 . 1 . . . . 98 LYS HD2 . 17160 1 1061 . 1 1 98 98 LYS HE2 H 1 3.01 0.02 . 1 . . . . 98 LYS HE2 . 17160 1 1062 . 1 1 98 98 LYS HG2 H 1 1.46 0.02 . 1 . . . . 98 LYS HG2 . 17160 1 1063 . 1 1 98 98 LYS C C 13 174.5 0.3 . 1 . . . . 98 LYS C . 17160 1 1064 . 1 1 98 98 LYS CA C 13 56.1 0.3 . 1 . . . . 98 LYS CA . 17160 1 1065 . 1 1 98 98 LYS CB C 13 32.4 0.3 . 1 . . . . 98 LYS CB . 17160 1 1066 . 1 1 98 98 LYS CD C 13 29.4 0.3 . 1 . . . . 98 LYS CD . 17160 1 1067 . 1 1 98 98 LYS CE C 13 41.7 0.3 . 1 . . . . 98 LYS CE . 17160 1 1068 . 1 1 98 98 LYS CG C 13 24.6 0.3 . 1 . . . . 98 LYS CG . 17160 1 1069 . 1 1 98 98 LYS N N 15 121.5 0.3 . 1 . . . . 98 LYS N . 17160 1 1070 . 1 1 99 99 PRO HA H 1 4.58 0.02 . 1 . . . . 99 PRO HA . 17160 1 1071 . 1 1 99 99 PRO HB2 H 1 2.58 0.02 . 2 . . . . 99 PRO HB2 . 17160 1 1072 . 1 1 99 99 PRO HB3 H 1 2.01 0.02 . 2 . . . . 99 PRO HB3 . 17160 1 1073 . 1 1 99 99 PRO HD2 H 1 3.76 0.02 . 2 . . . . 99 PRO HD2 . 17160 1 1074 . 1 1 99 99 PRO HD3 H 1 3.71 0.02 . 2 . . . . 99 PRO HD3 . 17160 1 1075 . 1 1 99 99 PRO HG2 H 1 2.25 0.02 . 2 . . . . 99 PRO HG2 . 17160 1 1076 . 1 1 99 99 PRO HG3 H 1 1.87 0.02 . 2 . . . . 99 PRO HG3 . 17160 1 1077 . 1 1 99 99 PRO CA C 13 65.4 0.3 . 1 . . . . 99 PRO CA . 17160 1 1078 . 1 1 99 99 PRO CB C 13 31.9 0.3 . 1 . . . . 99 PRO CB . 17160 1 1079 . 1 1 99 99 PRO CD C 13 49.4 0.3 . 1 . . . . 99 PRO CD . 17160 1 1080 . 1 1 99 99 PRO CG C 13 28.5 0.3 . 1 . . . . 99 PRO CG . 17160 1 1081 . 1 1 100 100 ASN H H 1 8.55 0.02 . 1 . . . . 100 ASN H . 17160 1 1082 . 1 1 100 100 ASN HA H 1 4.90 0.02 . 1 . . . . 100 ASN HA . 17160 1 1083 . 1 1 100 100 ASN HB2 H 1 3.01 0.02 . 2 . . . . 100 ASN HB2 . 17160 1 1084 . 1 1 100 100 ASN HB3 H 1 2.92 0.02 . 2 . . . . 100 ASN HB3 . 17160 1 1085 . 1 1 100 100 ASN HD21 H 1 7.66 0.02 . 1 . . . . 100 ASN HD21 . 17160 1 1086 . 1 1 100 100 ASN C C 13 175.1 0.3 . 1 . . . . 100 ASN C . 17160 1 1087 . 1 1 100 100 ASN CA C 13 52.5 0.3 . 1 . . . . 100 ASN CA . 17160 1 1088 . 1 1 100 100 ASN CB C 13 37.3 0.3 . 1 . . . . 100 ASN CB . 17160 1 1089 . 1 1 100 100 ASN N N 15 113.8 0.3 . 1 . . . . 100 ASN N . 17160 1 1090 . 1 1 100 100 ASN ND2 N 15 113.6 0.3 . 1 . . . . 100 ASN ND2 . 17160 1 1091 . 1 1 101 101 TRP H H 1 7.86 0.02 . 1 . . . . 101 TRP H . 17160 1 1092 . 1 1 101 101 TRP HA H 1 4.50 0.02 . 1 . . . . 101 TRP HA . 17160 1 1093 . 1 1 101 101 TRP HB2 H 1 3.51 0.02 . 2 . . . . 101 TRP HB2 . 17160 1 1094 . 1 1 101 101 TRP HB3 H 1 3.47 0.02 . 2 . . . . 101 TRP HB3 . 17160 1 1095 . 1 1 101 101 TRP HD1 H 1 7.61 0.02 . 1 . . . . 101 TRP HD1 . 17160 1 1096 . 1 1 101 101 TRP HE1 H 1 10.12 0.02 . 1 . . . . 101 TRP HE1 . 17160 1 1097 . 1 1 101 101 TRP HE3 H 1 6.90 0.02 . 1 . . . . 101 TRP HE3 . 17160 1 1098 . 1 1 101 101 TRP HH2 H 1 7.26 0.02 . 1 . . . . 101 TRP HH2 . 17160 1 1099 . 1 1 101 101 TRP HZ2 H 1 7.07 0.02 . 1 . . . . 101 TRP HZ2 . 17160 1 1100 . 1 1 101 101 TRP HZ3 H 1 7.46 0.02 . 1 . . . . 101 TRP HZ3 . 17160 1 1101 . 1 1 101 101 TRP C C 13 173.0 0.3 . 1 . . . . 101 TRP C . 17160 1 1102 . 1 1 101 101 TRP CA C 13 57.5 0.3 . 1 . . . . 101 TRP CA . 17160 1 1103 . 1 1 101 101 TRP CB C 13 27.3 0.3 . 1 . . . . 101 TRP CB . 17160 1 1104 . 1 1 101 101 TRP N N 15 121.5 0.3 . 1 . . . . 101 TRP N . 17160 1 1105 . 1 1 101 101 TRP NE1 N 15 132.3 0.3 . 1 . . . . 101 TRP NE1 . 17160 1 1106 . 1 1 102 102 ASP H H 1 8.85 0.02 . 1 . . . . 102 ASP H . 17160 1 1107 . 1 1 102 102 ASP HA H 1 4.32 0.02 . 1 . . . . 102 ASP HA . 17160 1 1108 . 1 1 102 102 ASP HB2 H 1 2.91 0.02 . 2 . . . . 102 ASP HB2 . 17160 1 1109 . 1 1 102 102 ASP HB3 H 1 2.35 0.02 . 2 . . . . 102 ASP HB3 . 17160 1 1110 . 1 1 102 102 ASP C C 13 174.8 0.3 . 1 . . . . 102 ASP C . 17160 1 1111 . 1 1 102 102 ASP CA C 13 52.0 0.3 . 1 . . . . 102 ASP CA . 17160 1 1112 . 1 1 102 102 ASP CB C 13 41.4 0.3 . 1 . . . . 102 ASP CB . 17160 1 1113 . 1 1 102 102 ASP N N 15 120.3 0.3 . 1 . . . . 102 ASP N . 17160 1 1114 . 1 1 103 103 ALA H H 1 7.46 0.02 . 1 . . . . 103 ALA H . 17160 1 1115 . 1 1 103 103 ALA HA H 1 3.43 0.02 . 1 . . . . 103 ALA HA . 17160 1 1116 . 1 1 103 103 ALA HB1 H 1 0.57 0.02 . 1 . . . . 103 ALA HB . 17160 1 1117 . 1 1 103 103 ALA HB2 H 1 0.57 0.02 . 1 . . . . 103 ALA HB . 17160 1 1118 . 1 1 103 103 ALA HB3 H 1 0.57 0.02 . 1 . . . . 103 ALA HB . 17160 1 1119 . 1 1 103 103 ALA C C 13 176.0 0.3 . 1 . . . . 103 ALA C . 17160 1 1120 . 1 1 103 103 ALA CA C 13 52.3 0.3 . 1 . . . . 103 ALA CA . 17160 1 1121 . 1 1 103 103 ALA CB C 13 18.6 0.3 . 1 . . . . 103 ALA CB . 17160 1 1122 . 1 1 103 103 ALA N N 15 128.6 0.3 . 1 . . . . 103 ALA N . 17160 1 1123 . 1 1 104 104 SER H H 1 8.42 0.02 . 1 . . . . 104 SER H . 17160 1 1124 . 1 1 104 104 SER HA H 1 4.50 0.02 . 1 . . . . 104 SER HA . 17160 1 1125 . 1 1 104 104 SER HB2 H 1 4.06 0.02 . 2 . . . . 104 SER HB2 . 17160 1 1126 . 1 1 104 104 SER HB3 H 1 3.77 0.02 . 2 . . . . 104 SER HB3 . 17160 1 1127 . 1 1 104 104 SER C C 13 173.1 0.3 . 1 . . . . 104 SER C . 17160 1 1128 . 1 1 104 104 SER CA C 13 57.9 0.3 . 1 . . . . 104 SER CA . 17160 1 1129 . 1 1 104 104 SER CB C 13 64.3 0.3 . 1 . . . . 104 SER CB . 17160 1 1130 . 1 1 104 104 SER N N 15 112.2 0.3 . 1 . . . . 104 SER N . 17160 1 1131 . 1 1 105 105 GLN H H 1 7.28 0.02 . 1 . . . . 105 GLN H . 17160 1 1132 . 1 1 105 105 GLN HA H 1 4.90 0.02 . 1 . . . . 105 GLN HA . 17160 1 1133 . 1 1 105 105 GLN HB2 H 1 2.12 0.02 . 2 . . . . 105 GLN HB2 . 17160 1 1134 . 1 1 105 105 GLN HB3 H 1 1.74 0.02 . 2 . . . . 105 GLN HB3 . 17160 1 1135 . 1 1 105 105 GLN HE21 H 1 7.43 0.02 . 1 . . . . 105 GLN HE21 . 17160 1 1136 . 1 1 105 105 GLN HE22 H 1 6.76 0.02 . 1 . . . . 105 GLN HE22 . 17160 1 1137 . 1 1 105 105 GLN HG2 H 1 3.02 0.02 . 1 . . . . 105 GLN HG2 . 17160 1 1138 . 1 1 105 105 GLN C C 13 178.3 0.3 . 1 . . . . 105 GLN C . 17160 1 1139 . 1 1 105 105 GLN CA C 13 52.3 0.3 . 1 . . . . 105 GLN CA . 17160 1 1140 . 1 1 105 105 GLN CB C 13 30.0 0.3 . 1 . . . . 105 GLN CB . 17160 1 1141 . 1 1 105 105 GLN CG C 13 38.2 0.3 . 1 . . . . 105 GLN CG . 17160 1 1142 . 1 1 105 105 GLN N N 15 121.8 0.3 . 1 . . . . 105 GLN N . 17160 1 1143 . 1 1 105 105 GLN NE2 N 15 112.4 0.3 . 1 . . . . 105 GLN NE2 . 17160 1 1144 . 1 1 106 106 PRO HA H 1 4.34 0.02 . 1 . . . . 106 PRO HA . 17160 1 1145 . 1 1 106 106 PRO HB2 H 1 2.34 0.02 . 2 . . . . 106 PRO HB2 . 17160 1 1146 . 1 1 106 106 PRO HB3 H 1 1.65 0.02 . 2 . . . . 106 PRO HB3 . 17160 1 1147 . 1 1 106 106 PRO HD2 H 1 3.92 0.02 . 2 . . . . 106 PRO HD2 . 17160 1 1148 . 1 1 106 106 PRO HD3 H 1 3.60 0.02 . 2 . . . . 106 PRO HD3 . 17160 1 1149 . 1 1 106 106 PRO HG2 H 1 2.05 0.02 . 1 . . . . 106 PRO HG2 . 17160 1 1150 . 1 1 106 106 PRO C C 13 173.1 0.3 . 1 . . . . 106 PRO C . 17160 1 1151 . 1 1 106 106 PRO CA C 13 62.4 0.3 . 1 . . . . 106 PRO CA . 17160 1 1152 . 1 1 106 106 PRO CB C 13 32.6 0.3 . 1 . . . . 106 PRO CB . 17160 1 1153 . 1 1 106 106 PRO CD C 13 50.0 0.3 . 1 . . . . 106 PRO CD . 17160 1 1154 . 1 1 106 106 PRO CG C 13 27.5 0.3 . 1 . . . . 106 PRO CG . 17160 1 1155 . 1 1 107 107 LEU H H 1 9.27 0.02 . 1 . . . . 107 LEU H . 17160 1 1156 . 1 1 107 107 LEU HA H 1 4.37 0.02 . 1 . . . . 107 LEU HA . 17160 1 1157 . 1 1 107 107 LEU HB2 H 1 2.09 0.02 . 2 . . . . 107 LEU HB2 . 17160 1 1158 . 1 1 107 107 LEU HB3 H 1 1.28 0.02 . 2 . . . . 107 LEU HB3 . 17160 1 1159 . 1 1 107 107 LEU HD11 H 1 1.04 0.02 . 1 . . . . 107 LEU HD1 . 17160 1 1160 . 1 1 107 107 LEU HD12 H 1 1.04 0.02 . 1 . . . . 107 LEU HD1 . 17160 1 1161 . 1 1 107 107 LEU HD13 H 1 1.04 0.02 . 1 . . . . 107 LEU HD1 . 17160 1 1162 . 1 1 107 107 LEU HD21 H 1 0.81 0.02 . 1 . . . . 107 LEU HD2 . 17160 1 1163 . 1 1 107 107 LEU HD22 H 1 0.81 0.02 . 1 . . . . 107 LEU HD2 . 17160 1 1164 . 1 1 107 107 LEU HD23 H 1 0.81 0.02 . 1 . . . . 107 LEU HD2 . 17160 1 1165 . 1 1 107 107 LEU HG H 1 1.88 0.02 . 1 . . . . 107 LEU HG . 17160 1 1166 . 1 1 107 107 LEU C C 13 176.0 0.3 . 1 . . . . 107 LEU C . 17160 1 1167 . 1 1 107 107 LEU CA C 13 55.3 0.3 . 1 . . . . 107 LEU CA . 17160 1 1168 . 1 1 107 107 LEU CB C 13 42.1 0.3 . 1 . . . . 107 LEU CB . 17160 1 1169 . 1 1 107 107 LEU CD1 C 13 25.9 0.3 . 1 . . . . 107 LEU CD1 . 17160 1 1170 . 1 1 107 107 LEU CD2 C 13 22.5 0.3 . 1 . . . . 107 LEU CD2 . 17160 1 1171 . 1 1 107 107 LEU CG C 13 26.7 0.3 . 1 . . . . 107 LEU CG . 17160 1 1172 . 1 1 107 107 LEU N N 15 122.1 0.3 . 1 . . . . 107 LEU N . 17160 1 1173 . 1 1 108 108 THR H H 1 8.52 0.02 . 1 . . . . 108 THR H . 17160 1 1174 . 1 1 108 108 THR HA H 1 4.63 0.02 . 1 . . . . 108 THR HA . 17160 1 1175 . 1 1 108 108 THR HB H 1 4.36 0.02 . 1 . . . . 108 THR HB . 17160 1 1176 . 1 1 108 108 THR HG21 H 1 1.19 0.02 . 1 . . . . 108 THR HG2 . 17160 1 1177 . 1 1 108 108 THR HG22 H 1 1.19 0.02 . 1 . . . . 108 THR HG2 . 17160 1 1178 . 1 1 108 108 THR HG23 H 1 1.19 0.02 . 1 . . . . 108 THR HG2 . 17160 1 1179 . 1 1 108 108 THR C C 13 175.9 0.3 . 1 . . . . 108 THR C . 17160 1 1180 . 1 1 108 108 THR CA C 13 59.5 0.3 . 1 . . . . 108 THR CA . 17160 1 1181 . 1 1 108 108 THR CB C 13 72.9 0.3 . 1 . . . . 108 THR CB . 17160 1 1182 . 1 1 108 108 THR CG2 C 13 21.6 0.3 . 1 . . . . 108 THR CG2 . 17160 1 1183 . 1 1 108 108 THR N N 15 112.5 0.3 . 1 . . . . 108 THR N . 17160 1 1184 . 1 1 109 109 ARG H H 1 9.49 0.02 . 1 . . . . 109 ARG H . 17160 1 1185 . 1 1 109 109 ARG HA H 1 3.90 0.02 . 1 . . . . 109 ARG HA . 17160 1 1186 . 1 1 109 109 ARG HB2 H 1 2.06 0.02 . 2 . . . . 109 ARG HB2 . 17160 1 1187 . 1 1 109 109 ARG HB3 H 1 1.76 0.02 . 2 . . . . 109 ARG HB3 . 17160 1 1188 . 1 1 109 109 ARG HD2 H 1 2.86 0.02 . 2 . . . . 109 ARG HD2 . 17160 1 1189 . 1 1 109 109 ARG HD3 H 1 2.79 0.02 . 2 . . . . 109 ARG HD3 . 17160 1 1190 . 1 1 109 109 ARG HG2 H 1 1.04 0.02 . 2 . . . . 109 ARG HG2 . 17160 1 1191 . 1 1 109 109 ARG HG3 H 1 0.94 0.02 . 2 . . . . 109 ARG HG3 . 17160 1 1192 . 1 1 109 109 ARG C C 13 177.2 0.3 . 1 . . . . 109 ARG C . 17160 1 1193 . 1 1 109 109 ARG CA C 13 62.2 0.3 . 1 . . . . 109 ARG CA . 17160 1 1194 . 1 1 109 109 ARG CB C 13 28.7 0.3 . 1 . . . . 109 ARG CB . 17160 1 1195 . 1 1 109 109 ARG CD C 13 41.7 0.3 . 1 . . . . 109 ARG CD . 17160 1 1196 . 1 1 109 109 ARG CG C 13 24.0 0.3 . 1 . . . . 109 ARG CG . 17160 1 1197 . 1 1 109 109 ARG N N 15 122.7 0.3 . 1 . . . . 109 ARG N . 17160 1 1198 . 1 1 110 110 ALA H H 1 7.97 0.02 . 1 . . . . 110 ALA H . 17160 1 1199 . 1 1 110 110 ALA HA H 1 4.29 0.02 . 1 . . . . 110 ALA HA . 17160 1 1200 . 1 1 110 110 ALA HB1 H 1 1.42 0.02 . 1 . . . . 110 ALA HB . 17160 1 1201 . 1 1 110 110 ALA HB2 H 1 1.42 0.02 . 1 . . . . 110 ALA HB . 17160 1 1202 . 1 1 110 110 ALA HB3 H 1 1.42 0.02 . 1 . . . . 110 ALA HB . 17160 1 1203 . 1 1 110 110 ALA C C 13 179.7 0.3 . 1 . . . . 110 ALA C . 17160 1 1204 . 1 1 110 110 ALA CA C 13 53.6 0.3 . 1 . . . . 110 ALA CA . 17160 1 1205 . 1 1 110 110 ALA CB C 13 18.0 0.3 . 1 . . . . 110 ALA CB . 17160 1 1206 . 1 1 110 110 ALA N N 15 118.5 0.3 . 1 . . . . 110 ALA N . 17160 1 1207 . 1 1 111 111 SER H H 1 8.16 0.02 . 1 . . . . 111 SER H . 17160 1 1208 . 1 1 111 111 SER HA H 1 4.47 0.02 . 1 . . . . 111 SER HA . 17160 1 1209 . 1 1 111 111 SER HB2 H 1 3.85 0.02 . 2 . . . . 111 SER HB2 . 17160 1 1210 . 1 1 111 111 SER HB3 H 1 3.81 0.02 . 2 . . . . 111 SER HB3 . 17160 1 1211 . 1 1 111 111 SER C C 13 173.6 0.3 . 1 . . . . 111 SER C . 17160 1 1212 . 1 1 111 111 SER CA C 13 60.7 0.3 . 1 . . . . 111 SER CA . 17160 1 1213 . 1 1 111 111 SER CB C 13 63.6 0.3 . 1 . . . . 111 SER CB . 17160 1 1214 . 1 1 111 111 SER N N 15 114.9 0.3 . 1 . . . . 111 SER N . 17160 1 1215 . 1 1 112 112 PHE H H 1 7.55 0.02 . 1 . . . . 112 PHE H . 17160 1 1216 . 1 1 112 112 PHE HA H 1 4.48 0.02 . 1 . . . . 112 PHE HA . 17160 1 1217 . 1 1 112 112 PHE HB2 H 1 2.91 0.02 . 2 . . . . 112 PHE HB2 . 17160 1 1218 . 1 1 112 112 PHE HB3 H 1 2.68 0.02 . 2 . . . . 112 PHE HB3 . 17160 1 1219 . 1 1 112 112 PHE HD1 H 1 7.16 0.02 . 1 . . . . 112 PHE HD1 . 17160 1 1220 . 1 1 112 112 PHE HE1 H 1 7.04 0.02 . 1 . . . . 112 PHE HE1 . 17160 1 1221 . 1 1 112 112 PHE HZ H 1 6.78 0.02 . 1 . . . . 112 PHE HZ . 17160 1 1222 . 1 1 112 112 PHE C C 13 174.6 0.3 . 1 . . . . 112 PHE C . 17160 1 1223 . 1 1 112 112 PHE CA C 13 59.0 0.3 . 1 . . . . 112 PHE CA . 17160 1 1224 . 1 1 112 112 PHE CB C 13 42.2 0.3 . 1 . . . . 112 PHE CB . 17160 1 1225 . 1 1 112 112 PHE N N 15 114.7 0.3 . 1 . . . . 112 PHE N . 17160 1 1226 . 1 1 113 113 ASP H H 1 8.15 0.02 . 1 . . . . 113 ASP H . 17160 1 1227 . 1 1 113 113 ASP HA H 1 4.80 0.02 . 1 . . . . 113 ASP HA . 17160 1 1228 . 1 1 113 113 ASP HB2 H 1 3.41 0.02 . 2 . . . . 113 ASP HB2 . 17160 1 1229 . 1 1 113 113 ASP HB3 H 1 2.53 0.02 . 2 . . . . 113 ASP HB3 . 17160 1 1230 . 1 1 113 113 ASP C C 13 177.7 0.3 . 1 . . . . 113 ASP C . 17160 1 1231 . 1 1 113 113 ASP CA C 13 53.6 0.3 . 1 . . . . 113 ASP CA . 17160 1 1232 . 1 1 113 113 ASP CB C 13 40.6 0.3 . 1 . . . . 113 ASP CB . 17160 1 1233 . 1 1 113 113 ASP N N 15 119.4 0.3 . 1 . . . . 113 ASP N . 17160 1 1234 . 1 1 114 114 LEU H H 1 8.82 0.02 . 1 . . . . 114 LEU H . 17160 1 1235 . 1 1 114 114 LEU HA H 1 4.49 0.02 . 1 . . . . 114 LEU HA . 17160 1 1236 . 1 1 114 114 LEU HB2 H 1 1.83 0.02 . 2 . . . . 114 LEU HB2 . 17160 1 1237 . 1 1 114 114 LEU HB3 H 1 1.67 0.02 . 2 . . . . 114 LEU HB3 . 17160 1 1238 . 1 1 114 114 LEU HD11 H 1 0.85 0.02 . 1 . . . . 114 LEU HD1 . 17160 1 1239 . 1 1 114 114 LEU HD12 H 1 0.85 0.02 . 1 . . . . 114 LEU HD1 . 17160 1 1240 . 1 1 114 114 LEU HD13 H 1 0.85 0.02 . 1 . . . . 114 LEU HD1 . 17160 1 1241 . 1 1 114 114 LEU HD21 H 1 0.58 0.02 . 1 . . . . 114 LEU HD2 . 17160 1 1242 . 1 1 114 114 LEU HD22 H 1 0.58 0.02 . 1 . . . . 114 LEU HD2 . 17160 1 1243 . 1 1 114 114 LEU HD23 H 1 0.58 0.02 . 1 . . . . 114 LEU HD2 . 17160 1 1244 . 1 1 114 114 LEU HG H 1 1.95 0.02 . 1 . . . . 114 LEU HG . 17160 1 1245 . 1 1 114 114 LEU C C 13 174.5 0.3 . 1 . . . . 114 LEU C . 17160 1 1246 . 1 1 114 114 LEU CA C 13 55.6 0.3 . 1 . . . . 114 LEU CA . 17160 1 1247 . 1 1 114 114 LEU CB C 13 40.0 0.3 . 1 . . . . 114 LEU CB . 17160 1 1248 . 1 1 114 114 LEU CD1 C 13 25.5 0.3 . 1 . . . . 114 LEU CD1 . 17160 1 1249 . 1 1 114 114 LEU CD2 C 13 21.9 0.3 . 1 . . . . 114 LEU CD2 . 17160 1 1250 . 1 1 114 114 LEU CG C 13 25.6 0.3 . 1 . . . . 114 LEU CG . 17160 1 1251 . 1 1 114 114 LEU N N 15 126.5 0.3 . 1 . . . . 114 LEU N . 17160 1 1252 . 1 1 115 115 THR H H 1 8.26 0.02 . 1 . . . . 115 THR H . 17160 1 1253 . 1 1 115 115 THR HA H 1 4.78 0.02 . 1 . . . . 115 THR HA . 17160 1 1254 . 1 1 115 115 THR HB H 1 4.23 0.02 . 1 . . . . 115 THR HB . 17160 1 1255 . 1 1 115 115 THR HG21 H 1 1.23 0.02 . 1 . . . . 115 THR HG2 . 17160 1 1256 . 1 1 115 115 THR HG22 H 1 1.23 0.02 . 1 . . . . 115 THR HG2 . 17160 1 1257 . 1 1 115 115 THR HG23 H 1 1.23 0.02 . 1 . . . . 115 THR HG2 . 17160 1 1258 . 1 1 115 115 THR C C 13 172.4 0.3 . 1 . . . . 115 THR C . 17160 1 1259 . 1 1 115 115 THR CA C 13 59.8 0.3 . 1 . . . . 115 THR CA . 17160 1 1260 . 1 1 115 115 THR CB C 13 68.8 0.3 . 1 . . . . 115 THR CB . 17160 1 1261 . 1 1 115 115 THR CG2 C 13 20.8 0.3 . 1 . . . . 115 THR CG2 . 17160 1 1262 . 1 1 115 115 THR N N 15 120.6 0.3 . 1 . . . . 115 THR N . 17160 1 1263 . 1 1 116 116 PRO HA H 1 3.98 0.02 . 1 . . . . 116 PRO HA . 17160 1 1264 . 1 1 116 116 PRO HB2 H 1 1.43 0.02 . 2 . . . . 116 PRO HB2 . 17160 1 1265 . 1 1 116 116 PRO HB3 H 1 1.01 0.02 . 2 . . . . 116 PRO HB3 . 17160 1 1266 . 1 1 116 116 PRO HD2 H 1 3.83 0.02 . 2 . . . . 116 PRO HD2 . 17160 1 1267 . 1 1 116 116 PRO HD3 H 1 4.02 0.02 . 2 . . . . 116 PRO HD3 . 17160 1 1268 . 1 1 116 116 PRO HG2 H 1 1.88 0.02 . 1 . . . . 116 PRO HG2 . 17160 1 1269 . 1 1 116 116 PRO CA C 13 63.3 0.3 . 1 . . . . 116 PRO CA . 17160 1 1270 . 1 1 116 116 PRO CB C 13 31.4 0.3 . 1 . . . . 116 PRO CB . 17160 1 1271 . 1 1 116 116 PRO CD C 13 50.9 0.3 . 1 . . . . 116 PRO CD . 17160 1 1272 . 1 1 116 116 PRO CG C 13 26.9 0.3 . 1 . . . . 116 PRO CG . 17160 1 1273 . 1 1 117 117 PHE HA H 1 4.85 0.02 . 1 . . . . 117 PHE HA . 17160 1 1274 . 1 1 117 117 PHE HB2 H 1 3.51 0.02 . 2 . . . . 117 PHE HB2 . 17160 1 1275 . 1 1 117 117 PHE HB3 H 1 3.12 0.02 . 2 . . . . 117 PHE HB3 . 17160 1 1276 . 1 1 117 117 PHE HD1 H 1 7.28 0.02 . 1 . . . . 117 PHE HD1 . 17160 1 1277 . 1 1 117 117 PHE C C 13 174.3 0.3 . 1 . . . . 117 PHE C . 17160 1 1278 . 1 1 117 117 PHE CA C 13 56.5 0.3 . 1 . . . . 117 PHE CA . 17160 1 1279 . 1 1 117 117 PHE CB C 13 38.3 0.3 . 1 . . . . 117 PHE CB . 17160 1 1280 . 1 1 118 118 CYS H H 1 6.99 0.02 . 1 . . . . 118 CYS H . 17160 1 1281 . 1 1 118 118 CYS HA H 1 4.39 0.02 . 1 . . . . 118 CYS HA . 17160 1 1282 . 1 1 118 118 CYS HB2 H 1 2.77 0.02 . 2 . . . . 118 CYS HB2 . 17160 1 1283 . 1 1 118 118 CYS HB3 H 1 2.24 0.02 . 2 . . . . 118 CYS HB3 . 17160 1 1284 . 1 1 118 118 CYS C C 13 171.5 0.3 . 1 . . . . 118 CYS C . 17160 1 1285 . 1 1 118 118 CYS CA C 13 53.5 0.3 . 1 . . . . 118 CYS CA . 17160 1 1286 . 1 1 118 118 CYS CB C 13 41.7 0.3 . 1 . . . . 118 CYS CB . 17160 1 1287 . 1 1 118 118 CYS N N 15 122.2 0.3 . 1 . . . . 118 CYS N . 17160 1 1288 . 1 1 119 119 GLN H H 1 8.48 0.02 . 1 . . . . 119 GLN H . 17160 1 1289 . 1 1 119 119 GLN HA H 1 5.34 0.02 . 1 . . . . 119 GLN HA . 17160 1 1290 . 1 1 119 119 GLN HB2 H 1 2.04 0.02 . 2 . . . . 119 GLN HB2 . 17160 1 1291 . 1 1 119 119 GLN HB3 H 1 1.64 0.02 . 2 . . . . 119 GLN HB3 . 17160 1 1292 . 1 1 119 119 GLN HE21 H 1 7.91 0.02 . 1 . . . . 119 GLN HE21 . 17160 1 1293 . 1 1 119 119 GLN HE22 H 1 6.69 0.02 . 1 . . . . 119 GLN HE22 . 17160 1 1294 . 1 1 119 119 GLN HG2 H 1 2.11 0.02 . 2 . . . . 119 GLN HG2 . 17160 1 1295 . 1 1 119 119 GLN HG3 H 1 2.08 0.02 . 2 . . . . 119 GLN HG3 . 17160 1 1296 . 1 1 119 119 GLN C C 13 172.3 0.3 . 1 . . . . 119 GLN C . 17160 1 1297 . 1 1 119 119 GLN CA C 13 55.0 0.3 . 1 . . . . 119 GLN CA . 17160 1 1298 . 1 1 119 119 GLN CB C 13 30.2 0.3 . 1 . . . . 119 GLN CB . 17160 1 1299 . 1 1 119 119 GLN CG C 13 32.0 0.3 . 1 . . . . 119 GLN CG . 17160 1 1300 . 1 1 119 119 GLN N N 15 126.3 0.3 . 1 . . . . 119 GLN N . 17160 1 1301 . 1 1 119 119 GLN NE2 N 15 111.3 0.3 . 1 . . . . 119 GLN NE2 . 17160 1 1302 . 1 1 120 120 PHE H H 1 9.05 0.02 . 1 . . . . 120 PHE H . 17160 1 1303 . 1 1 120 120 PHE HA H 1 4.56 0.02 . 1 . . . . 120 PHE HA . 17160 1 1304 . 1 1 120 120 PHE HB2 H 1 3.26 0.02 . 2 . . . . 120 PHE HB2 . 17160 1 1305 . 1 1 120 120 PHE HB3 H 1 2.51 0.02 . 2 . . . . 120 PHE HB3 . 17160 1 1306 . 1 1 120 120 PHE HD1 H 1 6.88 0.02 . 1 . . . . 120 PHE HD1 . 17160 1 1307 . 1 1 120 120 PHE HE1 H 1 7.28 0.02 . 1 . . . . 120 PHE HE1 . 17160 1 1308 . 1 1 120 120 PHE C C 13 173.8 0.3 . 1 . . . . 120 PHE C . 17160 1 1309 . 1 1 120 120 PHE CA C 13 57.5 0.3 . 1 . . . . 120 PHE CA . 17160 1 1310 . 1 1 120 120 PHE CB C 13 42.5 0.3 . 1 . . . . 120 PHE CB . 17160 1 1311 . 1 1 120 120 PHE N N 15 123.0 0.3 . 1 . . . . 120 PHE N . 17160 1 1312 . 1 1 121 121 ASN H H 1 9.16 0.02 . 1 . . . . 121 ASN H . 17160 1 1313 . 1 1 121 121 ASN HA H 1 5.30 0.02 . 1 . . . . 121 ASN HA . 17160 1 1314 . 1 1 121 121 ASN HB2 H 1 2.94 0.02 . 2 . . . . 121 ASN HB2 . 17160 1 1315 . 1 1 121 121 ASN HB3 H 1 2.78 0.02 . 2 . . . . 121 ASN HB3 . 17160 1 1316 . 1 1 121 121 ASN HD21 H 1 7.65 0.02 . 1 . . . . 121 ASN HD21 . 17160 1 1317 . 1 1 121 121 ASN HD22 H 1 6.84 0.02 . 1 . . . . 121 ASN HD22 . 17160 1 1318 . 1 1 121 121 ASN C C 13 174.8 0.3 . 1 . . . . 121 ASN C . 17160 1 1319 . 1 1 121 121 ASN CA C 13 52.4 0.3 . 1 . . . . 121 ASN CA . 17160 1 1320 . 1 1 121 121 ASN CB C 13 40.0 0.3 . 1 . . . . 121 ASN CB . 17160 1 1321 . 1 1 121 121 ASN N N 15 123.2 0.3 . 1 . . . . 121 ASN N . 17160 1 1322 . 1 1 121 121 ASN ND2 N 15 114.1 0.3 . 1 . . . . 121 ASN ND2 . 17160 1 1323 . 1 1 122 122 ASP H H 1 7.64 0.02 . 1 . . . . 122 ASP H . 17160 1 1324 . 1 1 122 122 ASP HA H 1 5.00 0.02 . 1 . . . . 122 ASP HA . 17160 1 1325 . 1 1 122 122 ASP HB2 H 1 2.33 0.02 . 1 . . . . 122 ASP HB2 . 17160 1 1326 . 1 1 122 122 ASP C C 13 179.6 0.3 . 1 . . . . 122 ASP C . 17160 1 1327 . 1 1 122 122 ASP CA C 13 54.2 0.3 . 1 . . . . 122 ASP CA . 17160 1 1328 . 1 1 122 122 ASP CB C 13 42.0 0.3 . 1 . . . . 122 ASP CB . 17160 1 1329 . 1 1 122 122 ASP N N 15 124.4 0.3 . 1 . . . . 122 ASP N . 17160 1 1330 . 1 1 123 123 GLY H H 1 8.81 0.02 . 1 . . . . 123 GLY H . 17160 1 1331 . 1 1 123 123 GLY HA2 H 1 4.04 0.02 . 2 . . . . 123 GLY HA2 . 17160 1 1332 . 1 1 123 123 GLY HA3 H 1 3.92 0.02 . 2 . . . . 123 GLY HA3 . 17160 1 1333 . 1 1 123 123 GLY C C 13 174.5 0.3 . 1 . . . . 123 GLY C . 17160 1 1334 . 1 1 123 123 GLY CA C 13 47.2 0.3 . 1 . . . . 123 GLY CA . 17160 1 1335 . 1 1 123 123 GLY N N 15 110.7 0.3 . 1 . . . . 123 GLY N . 17160 1 1336 . 1 1 124 124 GLY H H 1 8.33 0.02 . 1 . . . . 124 GLY H . 17160 1 1337 . 1 1 124 124 GLY HA2 H 1 4.25 0.02 . 2 . . . . 124 GLY HA2 . 17160 1 1338 . 1 1 124 124 GLY HA3 H 1 3.13 0.02 . 2 . . . . 124 GLY HA3 . 17160 1 1339 . 1 1 124 124 GLY C C 13 175.1 0.3 . 1 . . . . 124 GLY C . 17160 1 1340 . 1 1 124 124 GLY CA C 13 44.3 0.3 . 1 . . . . 124 GLY CA . 17160 1 1341 . 1 1 124 124 GLY N N 15 106.7 0.3 . 1 . . . . 124 GLY N . 17160 1 1342 . 1 1 125 125 ALA H H 1 7.48 0.02 . 1 . . . . 125 ALA H . 17160 1 1343 . 1 1 125 125 ALA HA H 1 4.32 0.02 . 1 . . . . 125 ALA HA . 17160 1 1344 . 1 1 125 125 ALA HB1 H 1 1.55 0.02 . 1 . . . . 125 ALA HB . 17160 1 1345 . 1 1 125 125 ALA HB2 H 1 1.55 0.02 . 1 . . . . 125 ALA HB . 17160 1 1346 . 1 1 125 125 ALA HB3 H 1 1.55 0.02 . 1 . . . . 125 ALA HB . 17160 1 1347 . 1 1 125 125 ALA C C 13 177.7 0.3 . 1 . . . . 125 ALA C . 17160 1 1348 . 1 1 125 125 ALA CA C 13 52.4 0.3 . 1 . . . . 125 ALA CA . 17160 1 1349 . 1 1 125 125 ALA CB C 13 19.3 0.3 . 1 . . . . 125 ALA CB . 17160 1 1350 . 1 1 125 125 ALA N N 15 125.2 0.3 . 1 . . . . 125 ALA N . 17160 1 1351 . 1 1 126 126 ILE H H 1 8.85 0.02 . 1 . . . . 126 ILE H . 17160 1 1352 . 1 1 126 126 ILE HA H 1 4.43 0.02 . 1 . . . . 126 ILE HA . 17160 1 1353 . 1 1 126 126 ILE HB H 1 1.85 0.02 . 1 . . . . 126 ILE HB . 17160 1 1354 . 1 1 126 126 ILE HD11 H 1 0.93 0.02 . 1 . . . . 126 ILE HD1 . 17160 1 1355 . 1 1 126 126 ILE HD12 H 1 0.93 0.02 . 1 . . . . 126 ILE HD1 . 17160 1 1356 . 1 1 126 126 ILE HD13 H 1 0.93 0.02 . 1 . . . . 126 ILE HD1 . 17160 1 1357 . 1 1 126 126 ILE HG13 H 1 1.71 0.02 . 1 . . . . 126 ILE HG13 . 17160 1 1358 . 1 1 126 126 ILE HG21 H 1 0.89 0.02 . 1 . . . . 126 ILE HG2 . 17160 1 1359 . 1 1 126 126 ILE HG22 H 1 0.89 0.02 . 1 . . . . 126 ILE HG2 . 17160 1 1360 . 1 1 126 126 ILE HG23 H 1 0.89 0.02 . 1 . . . . 126 ILE HG2 . 17160 1 1361 . 1 1 126 126 ILE C C 13 174.5 0.3 . 1 . . . . 126 ILE C . 17160 1 1362 . 1 1 126 126 ILE CA C 13 58.6 0.3 . 1 . . . . 126 ILE CA . 17160 1 1363 . 1 1 126 126 ILE CB C 13 37.9 0.3 . 1 . . . . 126 ILE CB . 17160 1 1364 . 1 1 126 126 ILE CD1 C 13 16.9 0.3 . 1 . . . . 126 ILE CD1 . 17160 1 1365 . 1 1 126 126 ILE CG1 C 13 27.5 0.3 . 1 . . . . 126 ILE CG1 . 17160 1 1366 . 1 1 126 126 ILE CG2 C 13 11.9 0.3 . 1 . . . . 126 ILE CG2 . 17160 1 1367 . 1 1 126 126 ILE N N 15 126.2 0.3 . 1 . . . . 126 ILE N . 17160 1 1368 . 1 1 127 127 PRO HA H 1 4.65 0.02 . 1 . . . . 127 PRO HA . 17160 1 1369 . 1 1 127 127 PRO HB2 H 1 2.46 0.02 . 2 . . . . 127 PRO HB2 . 17160 1 1370 . 1 1 127 127 PRO HB3 H 1 2.25 0.02 . 2 . . . . 127 PRO HB3 . 17160 1 1371 . 1 1 127 127 PRO HG2 H 1 1.98 0.02 . 1 . . . . 127 PRO HG2 . 17160 1 1372 . 1 1 127 127 PRO C C 13 176.0 0.3 . 1 . . . . 127 PRO C . 17160 1 1373 . 1 1 127 127 PRO CA C 13 62.5 0.3 . 1 . . . . 127 PRO CA . 17160 1 1374 . 1 1 127 127 PRO CB C 13 32.9 0.3 . 1 . . . . 127 PRO CB . 17160 1 1375 . 1 1 127 127 PRO CG C 13 28.9 0.3 . 1 . . . . 127 PRO CG . 17160 1 1376 . 1 1 128 128 ALA H H 1 7.90 0.02 . 1 . . . . 128 ALA H . 17160 1 1377 . 1 1 128 128 ALA HA H 1 4.17 0.02 . 1 . . . . 128 ALA HA . 17160 1 1378 . 1 1 128 128 ALA HB1 H 1 1.45 0.02 . 1 . . . . 128 ALA HB . 17160 1 1379 . 1 1 128 128 ALA HB2 H 1 1.45 0.02 . 1 . . . . 128 ALA HB . 17160 1 1380 . 1 1 128 128 ALA HB3 H 1 1.45 0.02 . 1 . . . . 128 ALA HB . 17160 1 1381 . 1 1 128 128 ALA C C 13 173.8 0.3 . 1 . . . . 128 ALA C . 17160 1 1382 . 1 1 128 128 ALA CA C 13 51.1 0.3 . 1 . . . . 128 ALA CA . 17160 1 1383 . 1 1 128 128 ALA CB C 13 19.5 0.3 . 1 . . . . 128 ALA CB . 17160 1 1384 . 1 1 128 128 ALA N N 15 121.4 0.3 . 1 . . . . 128 ALA N . 17160 1 1385 . 1 1 129 129 ALA H H 1 7.95 0.02 . 1 . . . . 129 ALA H . 17160 1 1386 . 1 1 129 129 ALA HA H 1 3.86 0.02 . 1 . . . . 129 ALA HA . 17160 1 1387 . 1 1 129 129 ALA HB1 H 1 1.35 0.02 . 1 . . . . 129 ALA HB . 17160 1 1388 . 1 1 129 129 ALA HB2 H 1 1.35 0.02 . 1 . . . . 129 ALA HB . 17160 1 1389 . 1 1 129 129 ALA HB3 H 1 1.35 0.02 . 1 . . . . 129 ALA HB . 17160 1 1390 . 1 1 129 129 ALA C C 13 176.3 0.3 . 1 . . . . 129 ALA C . 17160 1 1391 . 1 1 129 129 ALA CA C 13 53.9 0.3 . 1 . . . . 129 ALA CA . 17160 1 1392 . 1 1 129 129 ALA CB C 13 18.7 0.3 . 1 . . . . 129 ALA CB . 17160 1 1393 . 1 1 129 129 ALA N N 15 115.3 0.3 . 1 . . . . 129 ALA N . 17160 1 1394 . 1 1 130 130 GLN H H 1 6.99 0.02 . 1 . . . . 130 GLN H . 17160 1 1395 . 1 1 130 130 GLN HA H 1 4.98 0.02 . 1 . . . . 130 GLN HA . 17160 1 1396 . 1 1 130 130 GLN HB3 H 1 1.77 0.02 . 1 . . . . 130 GLN HB3 . 17160 1 1397 . 1 1 130 130 GLN HE21 H 1 6.96 0.02 . 1 . . . . 130 GLN HE21 . 17160 1 1398 . 1 1 130 130 GLN HG2 H 1 2.08 0.02 . 2 . . . . 130 GLN HG2 . 17160 1 1399 . 1 1 130 130 GLN HG3 H 1 1.98 0.02 . 2 . . . . 130 GLN HG3 . 17160 1 1400 . 1 1 130 130 GLN C C 13 174.2 0.3 . 1 . . . . 130 GLN C . 17160 1 1401 . 1 1 130 130 GLN CA C 13 54.0 0.3 . 1 . . . . 130 GLN CA . 17160 1 1402 . 1 1 130 130 GLN CB C 13 31.6 0.3 . 1 . . . . 130 GLN CB . 17160 1 1403 . 1 1 130 130 GLN CG C 13 34.0 0.3 . 1 . . . . 130 GLN CG . 17160 1 1404 . 1 1 130 130 GLN N N 15 113.9 0.3 . 1 . . . . 130 GLN N . 17160 1 1405 . 1 1 130 130 GLN NE2 N 15 113.6 0.3 . 1 . . . . 130 GLN NE2 . 17160 1 1406 . 1 1 131 131 VAL H H 1 7.91 0.02 . 1 . . . . 131 VAL H . 17160 1 1407 . 1 1 131 131 VAL HA H 1 3.80 0.02 . 1 . . . . 131 VAL HA . 17160 1 1408 . 1 1 131 131 VAL HB H 1 0.84 0.02 . 1 . . . . 131 VAL HB . 17160 1 1409 . 1 1 131 131 VAL HG11 H 1 0.33 0.02 . 1 . . . . 131 VAL HG1 . 17160 1 1410 . 1 1 131 131 VAL HG12 H 1 0.33 0.02 . 1 . . . . 131 VAL HG1 . 17160 1 1411 . 1 1 131 131 VAL HG13 H 1 0.33 0.02 . 1 . . . . 131 VAL HG1 . 17160 1 1412 . 1 1 131 131 VAL HG21 H 1 -0.52 0.02 . 1 . . . . 131 VAL HG2 . 17160 1 1413 . 1 1 131 131 VAL HG22 H 1 -0.52 0.02 . 1 . . . . 131 VAL HG2 . 17160 1 1414 . 1 1 131 131 VAL HG23 H 1 -0.52 0.02 . 1 . . . . 131 VAL HG2 . 17160 1 1415 . 1 1 131 131 VAL C C 13 173.4 0.3 . 1 . . . . 131 VAL C . 17160 1 1416 . 1 1 131 131 VAL CA C 13 60.7 0.3 . 1 . . . . 131 VAL CA . 17160 1 1417 . 1 1 131 131 VAL CB C 13 35.1 0.3 . 1 . . . . 131 VAL CB . 17160 1 1418 . 1 1 131 131 VAL CG1 C 13 21.0 0.3 . 1 . . . . 131 VAL CG1 . 17160 1 1419 . 1 1 131 131 VAL CG2 C 13 19.8 0.3 . 1 . . . . 131 VAL CG2 . 17160 1 1420 . 1 1 131 131 VAL N N 15 125.5 0.3 . 1 . . . . 131 VAL N . 17160 1 1421 . 1 1 132 132 THR H H 1 8.18 0.02 . 1 . . . . 132 THR H . 17160 1 1422 . 1 1 132 132 THR HA H 1 5.16 0.02 . 1 . . . . 132 THR HA . 17160 1 1423 . 1 1 132 132 THR HB H 1 3.51 0.02 . 1 . . . . 132 THR HB . 17160 1 1424 . 1 1 132 132 THR HG21 H 1 0.90 0.02 . 1 . . . . 132 THR HG2 . 17160 1 1425 . 1 1 132 132 THR HG22 H 1 0.90 0.02 . 1 . . . . 132 THR HG2 . 17160 1 1426 . 1 1 132 132 THR HG23 H 1 0.90 0.02 . 1 . . . . 132 THR HG2 . 17160 1 1427 . 1 1 132 132 THR C C 13 173.2 0.3 . 1 . . . . 132 THR C . 17160 1 1428 . 1 1 132 132 THR CA C 13 60.8 0.3 . 1 . . . . 132 THR CA . 17160 1 1429 . 1 1 132 132 THR CB C 13 70.5 0.3 . 1 . . . . 132 THR CB . 17160 1 1430 . 1 1 132 132 THR CG2 C 13 21.4 0.3 . 1 . . . . 132 THR CG2 . 17160 1 1431 . 1 1 132 132 THR N N 15 123.1 0.3 . 1 . . . . 132 THR N . 17160 1 1432 . 1 1 133 133 HIS H H 1 9.42 0.02 . 1 . . . . 133 HIS H . 17160 1 1433 . 1 1 133 133 HIS HA H 1 4.32 0.02 . 1 . . . . 133 HIS HA . 17160 1 1434 . 1 1 133 133 HIS HB2 H 1 2.80 0.02 . 2 . . . . 133 HIS HB2 . 17160 1 1435 . 1 1 133 133 HIS HB3 H 1 2.72 0.02 . 2 . . . . 133 HIS HB3 . 17160 1 1436 . 1 1 133 133 HIS HD2 H 1 7.41 0.02 . 1 . . . . 133 HIS HD2 . 17160 1 1437 . 1 1 133 133 HIS HE1 H 1 8.45 0.02 . 1 . . . . 133 HIS HE1 . 17160 1 1438 . 1 1 133 133 HIS C C 13 174.1 0.3 . 1 . . . . 133 HIS C . 17160 1 1439 . 1 1 133 133 HIS CA C 13 54.5 0.3 . 1 . . . . 133 HIS CA . 17160 1 1440 . 1 1 133 133 HIS CB C 13 34.8 0.3 . 1 . . . . 133 HIS CB . 17160 1 1441 . 1 1 133 133 HIS CE1 C 13 136.9 0.3 . 1 . . . . 133 HIS CE1 . 17160 1 1442 . 1 1 133 133 HIS N N 15 128.9 0.3 . 1 . . . . 133 HIS N . 17160 1 1443 . 1 1 134 134 GLN H H 1 8.29 0.02 . 1 . . . . 134 GLN H . 17160 1 1444 . 1 1 134 134 GLN HA H 1 4.90 0.02 . 1 . . . . 134 GLN HA . 17160 1 1445 . 1 1 134 134 GLN HB2 H 1 2.11 0.02 . 2 . . . . 134 GLN HB2 . 17160 1 1446 . 1 1 134 134 GLN HB3 H 1 1.99 0.02 . 2 . . . . 134 GLN HB3 . 17160 1 1447 . 1 1 134 134 GLN HE21 H 1 7.85 0.02 . 1 . . . . 134 GLN HE21 . 17160 1 1448 . 1 1 134 134 GLN HE22 H 1 7.02 0.02 . 1 . . . . 134 GLN HE22 . 17160 1 1449 . 1 1 134 134 GLN HG2 H 1 2.27 0.02 . 1 . . . . 134 GLN HG2 . 17160 1 1450 . 1 1 134 134 GLN C C 13 175.2 0.3 . 1 . . . . 134 GLN C . 17160 1 1451 . 1 1 134 134 GLN CA C 13 54.8 0.3 . 1 . . . . 134 GLN CA . 17160 1 1452 . 1 1 134 134 GLN CB C 13 28.4 0.3 . 1 . . . . 134 GLN CB . 17160 1 1453 . 1 1 134 134 GLN CG C 13 33.3 0.3 . 1 . . . . 134 GLN CG . 17160 1 1454 . 1 1 134 134 GLN N N 15 123.2 0.3 . 1 . . . . 134 GLN N . 17160 1 1455 . 1 1 134 134 GLN NE2 N 15 114.3 0.3 . 1 . . . . 134 GLN NE2 . 17160 1 1456 . 1 1 135 135 CYS H H 1 8.75 0.02 . 1 . . . . 135 CYS H . 17160 1 1457 . 1 1 135 135 CYS HA H 1 5.19 0.02 . 1 . . . . 135 CYS HA . 17160 1 1458 . 1 1 135 135 CYS HB2 H 1 2.98 0.02 . 2 . . . . 135 CYS HB2 . 17160 1 1459 . 1 1 135 135 CYS HB3 H 1 2.43 0.02 . 2 . . . . 135 CYS HB3 . 17160 1 1460 . 1 1 135 135 CYS C C 13 173.0 0.3 . 1 . . . . 135 CYS C . 17160 1 1461 . 1 1 135 135 CYS CA C 13 51.9 0.3 . 1 . . . . 135 CYS CA . 17160 1 1462 . 1 1 135 135 CYS CB C 13 42.8 0.3 . 1 . . . . 135 CYS CB . 17160 1 1463 . 1 1 135 135 CYS N N 15 122.7 0.3 . 1 . . . . 135 CYS N . 17160 1 1464 . 1 1 136 136 ASN H H 1 9.73 0.02 . 1 . . . . 136 ASN H . 17160 1 1465 . 1 1 136 136 ASN HA H 1 4.95 0.02 . 1 . . . . 136 ASN HA . 17160 1 1466 . 1 1 136 136 ASN HB2 H 1 2.74 0.02 . 2 . . . . 136 ASN HB2 . 17160 1 1467 . 1 1 136 136 ASN HB3 H 1 2.73 0.02 . 2 . . . . 136 ASN HB3 . 17160 1 1468 . 1 1 136 136 ASN HD21 H 1 7.53 0.02 . 1 . . . . 136 ASN HD21 . 17160 1 1469 . 1 1 136 136 ASN C C 13 175.0 0.3 . 1 . . . . 136 ASN C . 17160 1 1470 . 1 1 136 136 ASN CA C 13 51.6 0.3 . 1 . . . . 136 ASN CA . 17160 1 1471 . 1 1 136 136 ASN CB C 13 38.9 0.3 . 1 . . . . 136 ASN CB . 17160 1 1472 . 1 1 136 136 ASN N N 15 123.2 0.3 . 1 . . . . 136 ASN N . 17160 1 1473 . 1 1 136 136 ASN ND2 N 15 112.9 0.3 . 1 . . . . 136 ASN ND2 . 17160 1 1474 . 1 1 137 137 ILE H H 1 8.62 0.02 . 1 . . . . 137 ILE H . 17160 1 1475 . 1 1 137 137 ILE HA H 1 3.58 0.02 . 1 . . . . 137 ILE HA . 17160 1 1476 . 1 1 137 137 ILE HB H 1 1.70 0.02 . 1 . . . . 137 ILE HB . 17160 1 1477 . 1 1 137 137 ILE HD11 H 1 0.85 0.02 . 1 . . . . 137 ILE HD1 . 17160 1 1478 . 1 1 137 137 ILE HD12 H 1 0.85 0.02 . 1 . . . . 137 ILE HD1 . 17160 1 1479 . 1 1 137 137 ILE HD13 H 1 0.85 0.02 . 1 . . . . 137 ILE HD1 . 17160 1 1480 . 1 1 137 137 ILE HG12 H 1 0.85 0.02 . 2 . . . . 137 ILE HG12 . 17160 1 1481 . 1 1 137 137 ILE HG13 H 1 0.81 0.02 . 2 . . . . 137 ILE HG13 . 17160 1 1482 . 1 1 137 137 ILE HG21 H 1 0.61 0.02 . 1 . . . . 137 ILE HG2 . 17160 1 1483 . 1 1 137 137 ILE HG22 H 1 0.61 0.02 . 1 . . . . 137 ILE HG2 . 17160 1 1484 . 1 1 137 137 ILE HG23 H 1 0.61 0.02 . 1 . . . . 137 ILE HG2 . 17160 1 1485 . 1 1 137 137 ILE C C 13 174.7 0.3 . 1 . . . . 137 ILE C . 17160 1 1486 . 1 1 137 137 ILE CA C 13 60.4 0.3 . 1 . . . . 137 ILE CA . 17160 1 1487 . 1 1 137 137 ILE CB C 13 38.8 0.3 . 1 . . . . 137 ILE CB . 17160 1 1488 . 1 1 137 137 ILE CD1 C 13 14.2 0.3 . 1 . . . . 137 ILE CD1 . 17160 1 1489 . 1 1 137 137 ILE CG1 C 13 29.0 0.3 . 1 . . . . 137 ILE CG1 . 17160 1 1490 . 1 1 137 137 ILE CG2 C 13 16.2 0.3 . 1 . . . . 137 ILE CG2 . 17160 1 1491 . 1 1 137 137 ILE N N 15 127.4 0.3 . 1 . . . . 137 ILE N . 17160 1 1492 . 1 1 138 138 PRO HA H 1 4.18 0.02 . 1 . . . . 138 PRO HA . 17160 1 1493 . 1 1 138 138 PRO HB2 H 1 2.41 0.02 . 2 . . . . 138 PRO HB2 . 17160 1 1494 . 1 1 138 138 PRO HB3 H 1 1.97 0.02 . 2 . . . . 138 PRO HB3 . 17160 1 1495 . 1 1 138 138 PRO HD2 H 1 3.26 0.02 . 1 . . . . 138 PRO HD2 . 17160 1 1496 . 1 1 138 138 PRO HG2 H 1 1.82 0.02 . 1 . . . . 138 PRO HG2 . 17160 1 1497 . 1 1 138 138 PRO C C 13 175.6 0.3 . 1 . . . . 138 PRO C . 17160 1 1498 . 1 1 138 138 PRO CA C 13 63.7 0.3 . 1 . . . . 138 PRO CA . 17160 1 1499 . 1 1 138 138 PRO CB C 13 33.1 0.3 . 1 . . . . 138 PRO CB . 17160 1 1500 . 1 1 138 138 PRO CD C 13 50.5 0.3 . 1 . . . . 138 PRO CD . 17160 1 1501 . 1 1 138 138 PRO CG C 13 27.5 0.3 . 1 . . . . 138 PRO CG . 17160 1 1502 . 1 1 139 139 ALA H H 1 8.20 0.02 . 1 . . . . 139 ALA H . 17160 1 1503 . 1 1 139 139 ALA HA H 1 4.06 0.02 . 1 . . . . 139 ALA HA . 17160 1 1504 . 1 1 139 139 ALA HB1 H 1 1.44 0.02 . 1 . . . . 139 ALA HB . 17160 1 1505 . 1 1 139 139 ALA HB2 H 1 1.44 0.02 . 1 . . . . 139 ALA HB . 17160 1 1506 . 1 1 139 139 ALA HB3 H 1 1.44 0.02 . 1 . . . . 139 ALA HB . 17160 1 1507 . 1 1 139 139 ALA C C 13 177.4 0.3 . 1 . . . . 139 ALA C . 17160 1 1508 . 1 1 139 139 ALA CA C 13 53.1 0.3 . 1 . . . . 139 ALA CA . 17160 1 1509 . 1 1 139 139 ALA CB C 13 18.6 0.3 . 1 . . . . 139 ALA CB . 17160 1 1510 . 1 1 139 139 ALA N N 15 122.5 0.3 . 1 . . . . 139 ALA N . 17160 1 1511 . 1 1 140 140 ASP H H 1 8.13 0.02 . 1 . . . . 140 ASP H . 17160 1 1512 . 1 1 140 140 ASP HA H 1 4.41 0.02 . 1 . . . . 140 ASP HA . 17160 1 1513 . 1 1 140 140 ASP HB2 H 1 2.95 0.02 . 2 . . . . 140 ASP HB2 . 17160 1 1514 . 1 1 140 140 ASP HB3 H 1 2.52 0.02 . 2 . . . . 140 ASP HB3 . 17160 1 1515 . 1 1 140 140 ASP C C 13 175.7 0.3 . 1 . . . . 140 ASP C . 17160 1 1516 . 1 1 140 140 ASP CA C 13 53.3 0.3 . 1 . . . . 140 ASP CA . 17160 1 1517 . 1 1 140 140 ASP CB C 13 38.9 0.3 . 1 . . . . 140 ASP CB . 17160 1 1518 . 1 1 140 140 ASP N N 15 116.1 0.3 . 1 . . . . 140 ASP N . 17160 1 1519 . 1 1 141 141 ARG H H 1 7.06 0.02 . 1 . . . . 141 ARG H . 17160 1 1520 . 1 1 141 141 ARG HA H 1 4.29 0.02 . 1 . . . . 141 ARG HA . 17160 1 1521 . 1 1 141 141 ARG HB2 H 1 1.54 0.02 . 2 . . . . 141 ARG HB2 . 17160 1 1522 . 1 1 141 141 ARG HB3 H 1 0.86 0.02 . 2 . . . . 141 ARG HB3 . 17160 1 1523 . 1 1 141 141 ARG HD2 H 1 2.85 0.02 . 2 . . . . 141 ARG HD2 . 17160 1 1524 . 1 1 141 141 ARG HD3 H 1 2.50 0.02 . 2 . . . . 141 ARG HD3 . 17160 1 1525 . 1 1 141 141 ARG HG2 H 1 1.50 0.02 . 2 . . . . 141 ARG HG2 . 17160 1 1526 . 1 1 141 141 ARG HG3 H 1 0.66 0.02 . 2 . . . . 141 ARG HG3 . 17160 1 1527 . 1 1 141 141 ARG C C 13 173.6 0.3 . 1 . . . . 141 ARG C . 17160 1 1528 . 1 1 141 141 ARG CA C 13 53.8 0.3 . 1 . . . . 141 ARG CA . 17160 1 1529 . 1 1 141 141 ARG CB C 13 32.0 0.3 . 1 . . . . 141 ARG CB . 17160 1 1530 . 1 1 141 141 ARG CD C 13 42.8 0.3 . 1 . . . . 141 ARG CD . 17160 1 1531 . 1 1 141 141 ARG CG C 13 27.7 0.3 . 1 . . . . 141 ARG CG . 17160 1 1532 . 1 1 141 141 ARG N N 15 119.2 0.3 . 1 . . . . 141 ARG N . 17160 1 1533 . 1 1 142 142 SER H H 1 8.40 0.02 . 1 . . . . 142 SER H . 17160 1 1534 . 1 1 142 142 SER HA H 1 4.50 0.02 . 1 . . . . 142 SER HA . 17160 1 1535 . 1 1 142 142 SER HB2 H 1 3.78 0.02 . 1 . . . . 142 SER HB2 . 17160 1 1536 . 1 1 142 142 SER C C 13 174.4 0.3 . 1 . . . . 142 SER C . 17160 1 1537 . 1 1 142 142 SER CA C 13 56.7 0.3 . 1 . . . . 142 SER CA . 17160 1 1538 . 1 1 142 142 SER CB C 13 65.6 0.3 . 1 . . . . 142 SER CB . 17160 1 1539 . 1 1 142 142 SER N N 15 113.8 0.3 . 1 . . . . 142 SER N . 17160 1 1540 . 1 1 143 143 GLY H H 1 9.50 0.02 . 1 . . . . 143 GLY H . 17160 1 1541 . 1 1 143 143 GLY HA2 H 1 4.27 0.02 . 2 . . . . 143 GLY HA2 . 17160 1 1542 . 1 1 143 143 GLY HA3 H 1 3.93 0.02 . 2 . . . . 143 GLY HA3 . 17160 1 1543 . 1 1 143 143 GLY C C 13 175.4 0.3 . 1 . . . . 143 GLY C . 17160 1 1544 . 1 1 143 143 GLY CA C 13 44.9 0.3 . 1 . . . . 143 GLY CA . 17160 1 1545 . 1 1 143 143 GLY N N 15 112.7 0.3 . 1 . . . . 143 GLY N . 17160 1 1546 . 1 1 144 144 SER H H 1 8.41 0.02 . 1 . . . . 144 SER H . 17160 1 1547 . 1 1 144 144 SER HA H 1 5.24 0.02 . 1 . . . . 144 SER HA . 17160 1 1548 . 1 1 144 144 SER HB2 H 1 3.94 0.02 . 2 . . . . 144 SER HB2 . 17160 1 1549 . 1 1 144 144 SER HB3 H 1 3.86 0.02 . 2 . . . . 144 SER HB3 . 17160 1 1550 . 1 1 144 144 SER C C 13 175.5 0.3 . 1 . . . . 144 SER C . 17160 1 1551 . 1 1 144 144 SER CA C 13 57.6 0.3 . 1 . . . . 144 SER CA . 17160 1 1552 . 1 1 144 144 SER CB C 13 63.4 0.3 . 1 . . . . 144 SER CB . 17160 1 1553 . 1 1 144 144 SER N N 15 118.2 0.3 . 1 . . . . 144 SER N . 17160 1 1554 . 1 1 145 145 HIS H H 1 9.56 0.02 . 1 . . . . 145 HIS H . 17160 1 1555 . 1 1 145 145 HIS HA H 1 4.82 0.02 . 1 . . . . 145 HIS HA . 17160 1 1556 . 1 1 145 145 HIS HB2 H 1 2.79 0.02 . 2 . . . . 145 HIS HB2 . 17160 1 1557 . 1 1 145 145 HIS HB3 H 1 2.49 0.02 . 2 . . . . 145 HIS HB3 . 17160 1 1558 . 1 1 145 145 HIS HD2 H 1 6.88 0.02 . 1 . . . . 145 HIS HD2 . 17160 1 1559 . 1 1 145 145 HIS HE1 H 1 8.73 0.02 . 1 . . . . 145 HIS HE1 . 17160 1 1560 . 1 1 145 145 HIS C C 13 174.5 0.3 . 1 . . . . 145 HIS C . 17160 1 1561 . 1 1 145 145 HIS CA C 13 57.8 0.3 . 1 . . . . 145 HIS CA . 17160 1 1562 . 1 1 145 145 HIS CB C 13 38.3 0.3 . 1 . . . . 145 HIS CB . 17160 1 1563 . 1 1 145 145 HIS CE1 C 13 136.7 0.3 . 1 . . . . 145 HIS CE1 . 17160 1 1564 . 1 1 145 145 HIS N N 15 128.7 0.3 . 1 . . . . 145 HIS N . 17160 1 1565 . 1 1 146 146 VAL H H 1 8.77 0.02 . 1 . . . . 146 VAL H . 17160 1 1566 . 1 1 146 146 VAL HA H 1 5.07 0.02 . 1 . . . . 146 VAL HA . 17160 1 1567 . 1 1 146 146 VAL HB H 1 1.41 0.02 . 1 . . . . 146 VAL HB . 17160 1 1568 . 1 1 146 146 VAL HG11 H 1 0.92 0.02 . 1 . . . . 146 VAL HG1 . 17160 1 1569 . 1 1 146 146 VAL HG12 H 1 0.92 0.02 . 1 . . . . 146 VAL HG1 . 17160 1 1570 . 1 1 146 146 VAL HG13 H 1 0.92 0.02 . 1 . . . . 146 VAL HG1 . 17160 1 1571 . 1 1 146 146 VAL HG21 H 1 0.83 0.02 . 1 . . . . 146 VAL HG2 . 17160 1 1572 . 1 1 146 146 VAL HG22 H 1 0.83 0.02 . 1 . . . . 146 VAL HG2 . 17160 1 1573 . 1 1 146 146 VAL HG23 H 1 0.83 0.02 . 1 . . . . 146 VAL HG2 . 17160 1 1574 . 1 1 146 146 VAL C C 13 175.4 0.3 . 1 . . . . 146 VAL C . 17160 1 1575 . 1 1 146 146 VAL CA C 13 61.6 0.3 . 1 . . . . 146 VAL CA . 17160 1 1576 . 1 1 146 146 VAL CB C 13 34.9 0.3 . 1 . . . . 146 VAL CB . 17160 1 1577 . 1 1 146 146 VAL CG1 C 13 22.6 0.3 . 1 . . . . 146 VAL CG1 . 17160 1 1578 . 1 1 146 146 VAL CG2 C 13 20.7 0.3 . 1 . . . . 146 VAL CG2 . 17160 1 1579 . 1 1 146 146 VAL N N 15 124.4 0.3 . 1 . . . . 146 VAL N . 17160 1 1580 . 1 1 147 147 ILE H H 1 9.55 0.02 . 1 . . . . 147 ILE H . 17160 1 1581 . 1 1 147 147 ILE HA H 1 5.38 0.02 . 1 . . . . 147 ILE HA . 17160 1 1582 . 1 1 147 147 ILE HB H 1 1.84 0.02 . 1 . . . . 147 ILE HB . 17160 1 1583 . 1 1 147 147 ILE HD11 H 1 1.08 0.02 . 1 . . . . 147 ILE HD1 . 17160 1 1584 . 1 1 147 147 ILE HD12 H 1 1.08 0.02 . 1 . . . . 147 ILE HD1 . 17160 1 1585 . 1 1 147 147 ILE HD13 H 1 1.08 0.02 . 1 . . . . 147 ILE HD1 . 17160 1 1586 . 1 1 147 147 ILE HG12 H 1 1.13 0.02 . 2 . . . . 147 ILE HG12 . 17160 1 1587 . 1 1 147 147 ILE HG13 H 1 1.08 0.02 . 2 . . . . 147 ILE HG13 . 17160 1 1588 . 1 1 147 147 ILE HG21 H 1 1.23 0.02 . 1 . . . . 147 ILE HG2 . 17160 1 1589 . 1 1 147 147 ILE HG22 H 1 1.23 0.02 . 1 . . . . 147 ILE HG2 . 17160 1 1590 . 1 1 147 147 ILE HG23 H 1 1.23 0.02 . 1 . . . . 147 ILE HG2 . 17160 1 1591 . 1 1 147 147 ILE C C 13 174.2 0.3 . 1 . . . . 147 ILE C . 17160 1 1592 . 1 1 147 147 ILE CA C 13 58.8 0.3 . 1 . . . . 147 ILE CA . 17160 1 1593 . 1 1 147 147 ILE CB C 13 41.1 0.3 . 1 . . . . 147 ILE CB . 17160 1 1594 . 1 1 147 147 ILE CD1 C 13 15.0 0.3 . 1 . . . . 147 ILE CD1 . 17160 1 1595 . 1 1 147 147 ILE CG1 C 13 28.7 0.3 . 1 . . . . 147 ILE CG1 . 17160 1 1596 . 1 1 147 147 ILE CG2 C 13 16.1 0.3 . 1 . . . . 147 ILE CG2 . 17160 1 1597 . 1 1 147 147 ILE N N 15 126.0 0.3 . 1 . . . . 147 ILE N . 17160 1 1598 . 1 1 148 148 LEU H H 1 9.77 0.02 . 1 . . . . 148 LEU H . 17160 1 1599 . 1 1 148 148 LEU HA H 1 4.83 0.02 . 1 . . . . 148 LEU HA . 17160 1 1600 . 1 1 148 148 LEU HB2 H 1 1.52 0.02 . 2 . . . . 148 LEU HB2 . 17160 1 1601 . 1 1 148 148 LEU HB3 H 1 0.81 0.02 . 2 . . . . 148 LEU HB3 . 17160 1 1602 . 1 1 148 148 LEU HD11 H 1 0.56 0.02 . 1 . . . . 148 LEU HD1 . 17160 1 1603 . 1 1 148 148 LEU HD12 H 1 0.56 0.02 . 1 . . . . 148 LEU HD1 . 17160 1 1604 . 1 1 148 148 LEU HD13 H 1 0.56 0.02 . 1 . . . . 148 LEU HD1 . 17160 1 1605 . 1 1 148 148 LEU HD21 H 1 -0.39 0.02 . 1 . . . . 148 LEU HD2 . 17160 1 1606 . 1 1 148 148 LEU HD22 H 1 -0.39 0.02 . 1 . . . . 148 LEU HD2 . 17160 1 1607 . 1 1 148 148 LEU HD23 H 1 -0.39 0.02 . 1 . . . . 148 LEU HD2 . 17160 1 1608 . 1 1 148 148 LEU HG H 1 1.04 0.02 . 1 . . . . 148 LEU HG . 17160 1 1609 . 1 1 148 148 LEU C C 13 173.5 0.3 . 1 . . . . 148 LEU C . 17160 1 1610 . 1 1 148 148 LEU CA C 13 52.9 0.3 . 1 . . . . 148 LEU CA . 17160 1 1611 . 1 1 148 148 LEU CB C 13 45.6 0.3 . 1 . . . . 148 LEU CB . 17160 1 1612 . 1 1 148 148 LEU CD1 C 13 22.1 0.3 . 1 . . . . 148 LEU CD1 . 17160 1 1613 . 1 1 148 148 LEU CD2 C 13 25.5 0.3 . 1 . . . . 148 LEU CD2 . 17160 1 1614 . 1 1 148 148 LEU CG C 13 26.3 0.3 . 1 . . . . 148 LEU CG . 17160 1 1615 . 1 1 148 148 LEU N N 15 130.3 0.3 . 1 . . . . 148 LEU N . 17160 1 1616 . 1 1 149 149 ALA H H 1 8.58 0.02 . 1 . . . . 149 ALA H . 17160 1 1617 . 1 1 149 149 ALA HA H 1 4.90 0.02 . 1 . . . . 149 ALA HA . 17160 1 1618 . 1 1 149 149 ALA HB1 H 1 1.48 0.02 . 1 . . . . 149 ALA HB . 17160 1 1619 . 1 1 149 149 ALA HB2 H 1 1.48 0.02 . 1 . . . . 149 ALA HB . 17160 1 1620 . 1 1 149 149 ALA HB3 H 1 1.48 0.02 . 1 . . . . 149 ALA HB . 17160 1 1621 . 1 1 149 149 ALA C C 13 175.8 0.3 . 1 . . . . 149 ALA C . 17160 1 1622 . 1 1 149 149 ALA CA C 13 50.2 0.3 . 1 . . . . 149 ALA CA . 17160 1 1623 . 1 1 149 149 ALA CB C 13 22.3 0.3 . 1 . . . . 149 ALA CB . 17160 1 1624 . 1 1 149 149 ALA N N 15 133.8 0.3 . 1 . . . . 149 ALA N . 17160 1 1625 . 1 1 150 150 VAL H H 1 9.37 0.02 . 1 . . . . 150 VAL H . 17160 1 1626 . 1 1 150 150 VAL HA H 1 4.93 0.02 . 1 . . . . 150 VAL HA . 17160 1 1627 . 1 1 150 150 VAL HB H 1 1.91 0.02 . 1 . . . . 150 VAL HB . 17160 1 1628 . 1 1 150 150 VAL HG11 H 1 0.68 0.02 . 1 . . . . 150 VAL HG1 . 17160 1 1629 . 1 1 150 150 VAL HG12 H 1 0.68 0.02 . 1 . . . . 150 VAL HG1 . 17160 1 1630 . 1 1 150 150 VAL HG13 H 1 0.68 0.02 . 1 . . . . 150 VAL HG1 . 17160 1 1631 . 1 1 150 150 VAL HG21 H 1 0.51 0.02 . 1 . . . . 150 VAL HG2 . 17160 1 1632 . 1 1 150 150 VAL HG22 H 1 0.51 0.02 . 1 . . . . 150 VAL HG2 . 17160 1 1633 . 1 1 150 150 VAL HG23 H 1 0.51 0.02 . 1 . . . . 150 VAL HG2 . 17160 1 1634 . 1 1 150 150 VAL C C 13 174.7 0.3 . 1 . . . . 150 VAL C . 17160 1 1635 . 1 1 150 150 VAL CA C 13 61.3 0.3 . 1 . . . . 150 VAL CA . 17160 1 1636 . 1 1 150 150 VAL CB C 13 35.0 0.3 . 1 . . . . 150 VAL CB . 17160 1 1637 . 1 1 150 150 VAL CG1 C 13 22.0 0.3 . 1 . . . . 150 VAL CG1 . 17160 1 1638 . 1 1 150 150 VAL CG2 C 13 21.8 0.3 . 1 . . . . 150 VAL CG2 . 17160 1 1639 . 1 1 150 150 VAL N N 15 124.1 0.3 . 1 . . . . 150 VAL N . 17160 1 1640 . 1 1 151 151 TRP H H 1 8.90 0.02 . 1 . . . . 151 TRP H . 17160 1 1641 . 1 1 151 151 TRP HA H 1 4.77 0.02 . 1 . . . . 151 TRP HA . 17160 1 1642 . 1 1 151 151 TRP HB2 H 1 2.92 0.02 . 2 . . . . 151 TRP HB2 . 17160 1 1643 . 1 1 151 151 TRP HB3 H 1 2.11 0.02 . 2 . . . . 151 TRP HB3 . 17160 1 1644 . 1 1 151 151 TRP HD1 H 1 7.16 0.02 . 1 . . . . 151 TRP HD1 . 17160 1 1645 . 1 1 151 151 TRP HE1 H 1 9.74 0.02 . 1 . . . . 151 TRP HE1 . 17160 1 1646 . 1 1 151 151 TRP HH2 H 1 6.91 0.02 . 1 . . . . 151 TRP HH2 . 17160 1 1647 . 1 1 151 151 TRP HZ2 H 1 7.74 0.02 . 1 . . . . 151 TRP HZ2 . 17160 1 1648 . 1 1 151 151 TRP HZ3 H 1 6.82 0.02 . 1 . . . . 151 TRP HZ3 . 17160 1 1649 . 1 1 151 151 TRP C C 13 173.9 0.3 . 1 . . . . 151 TRP C . 17160 1 1650 . 1 1 151 151 TRP CA C 13 53.2 0.3 . 1 . . . . 151 TRP CA . 17160 1 1651 . 1 1 151 151 TRP CB C 13 32.2 0.3 . 1 . . . . 151 TRP CB . 17160 1 1652 . 1 1 151 151 TRP N N 15 134.2 0.3 . 1 . . . . 151 TRP N . 17160 1 1653 . 1 1 151 151 TRP NE1 N 15 128.5 0.3 . 1 . . . . 151 TRP NE1 . 17160 1 1654 . 1 1 152 152 ASP H H 1 8.54 0.02 . 1 . . . . 152 ASP H . 17160 1 1655 . 1 1 152 152 ASP HA H 1 4.55 0.02 . 1 . . . . 152 ASP HA . 17160 1 1656 . 1 1 152 152 ASP HB2 H 1 2.15 0.02 . 2 . . . . 152 ASP HB2 . 17160 1 1657 . 1 1 152 152 ASP HB3 H 1 2.11 0.02 . 2 . . . . 152 ASP HB3 . 17160 1 1658 . 1 1 152 152 ASP C C 13 174.4 0.3 . 1 . . . . 152 ASP C . 17160 1 1659 . 1 1 152 152 ASP CA C 13 54.0 0.3 . 1 . . . . 152 ASP CA . 17160 1 1660 . 1 1 152 152 ASP CB C 13 42.2 0.3 . 1 . . . . 152 ASP CB . 17160 1 1661 . 1 1 152 152 ASP N N 15 126.6 0.3 . 1 . . . . 152 ASP N . 17160 1 1662 . 1 1 153 153 ILE H H 1 7.31 0.02 . 1 . . . . 153 ILE H . 17160 1 1663 . 1 1 153 153 ILE HA H 1 3.81 0.02 . 1 . . . . 153 ILE HA . 17160 1 1664 . 1 1 153 153 ILE HB H 1 2.03 0.02 . 1 . . . . 153 ILE HB . 17160 1 1665 . 1 1 153 153 ILE HD11 H 1 -0.74 0.02 . 1 . . . . 153 ILE HD1 . 17160 1 1666 . 1 1 153 153 ILE HD12 H 1 -0.74 0.02 . 1 . . . . 153 ILE HD1 . 17160 1 1667 . 1 1 153 153 ILE HD13 H 1 -0.74 0.02 . 1 . . . . 153 ILE HD1 . 17160 1 1668 . 1 1 153 153 ILE HG12 H 1 0.74 0.02 . 2 . . . . 153 ILE HG12 . 17160 1 1669 . 1 1 153 153 ILE HG13 H 1 0.61 0.02 . 2 . . . . 153 ILE HG13 . 17160 1 1670 . 1 1 153 153 ILE HG21 H 1 0.79 0.02 . 1 . . . . 153 ILE HG2 . 17160 1 1671 . 1 1 153 153 ILE HG22 H 1 0.79 0.02 . 1 . . . . 153 ILE HG2 . 17160 1 1672 . 1 1 153 153 ILE HG23 H 1 0.79 0.02 . 1 . . . . 153 ILE HG2 . 17160 1 1673 . 1 1 153 153 ILE C C 13 179.3 0.3 . 1 . . . . 153 ILE C . 17160 1 1674 . 1 1 153 153 ILE CA C 13 59.5 0.3 . 1 . . . . 153 ILE CA . 17160 1 1675 . 1 1 153 153 ILE CB C 13 35.1 0.3 . 1 . . . . 153 ILE CB . 17160 1 1676 . 1 1 153 153 ILE CD1 C 13 8.4 0.3 . 1 . . . . 153 ILE CD1 . 17160 1 1677 . 1 1 153 153 ILE CG1 C 13 26.4 0.3 . 1 . . . . 153 ILE CG1 . 17160 1 1678 . 1 1 153 153 ILE CG2 C 13 17.2 0.3 . 1 . . . . 153 ILE CG2 . 17160 1 1679 . 1 1 153 153 ILE N N 15 126.0 0.3 . 1 . . . . 153 ILE N . 17160 1 1680 . 1 1 154 154 ALA H H 1 8.49 0.02 . 1 . . . . 154 ALA H . 17160 1 1681 . 1 1 154 154 ALA HA H 1 4.13 0.02 . 1 . . . . 154 ALA HA . 17160 1 1682 . 1 1 154 154 ALA HB1 H 1 1.13 0.02 . 1 . . . . 154 ALA HB . 17160 1 1683 . 1 1 154 154 ALA HB2 H 1 1.13 0.02 . 1 . . . . 154 ALA HB . 17160 1 1684 . 1 1 154 154 ALA HB3 H 1 1.13 0.02 . 1 . . . . 154 ALA HB . 17160 1 1685 . 1 1 154 154 ALA C C 13 179.3 0.3 . 1 . . . . 154 ALA C . 17160 1 1686 . 1 1 154 154 ALA CA C 13 54.2 0.3 . 1 . . . . 154 ALA CA . 17160 1 1687 . 1 1 154 154 ALA CB C 13 19.2 0.3 . 1 . . . . 154 ALA CB . 17160 1 1688 . 1 1 154 154 ALA N N 15 125.0 0.3 . 1 . . . . 154 ALA N . 17160 1 1689 . 1 1 155 155 ASP H H 1 8.12 0.02 . 1 . . . . 155 ASP H . 17160 1 1690 . 1 1 155 155 ASP HA H 1 4.55 0.02 . 1 . . . . 155 ASP HA . 17160 1 1691 . 1 1 155 155 ASP HB2 H 1 2.95 0.02 . 2 . . . . 155 ASP HB2 . 17160 1 1692 . 1 1 155 155 ASP HB3 H 1 2.56 0.02 . 2 . . . . 155 ASP HB3 . 17160 1 1693 . 1 1 155 155 ASP C C 13 175.5 0.3 . 1 . . . . 155 ASP C . 17160 1 1694 . 1 1 155 155 ASP CA C 13 53.6 0.3 . 1 . . . . 155 ASP CA . 17160 1 1695 . 1 1 155 155 ASP CB C 13 40.2 0.3 . 1 . . . . 155 ASP CB . 17160 1 1696 . 1 1 155 155 ASP N N 15 114.5 0.3 . 1 . . . . 155 ASP N . 17160 1 1697 . 1 1 156 156 THR H H 1 7.16 0.02 . 1 . . . . 156 THR H . 17160 1 1698 . 1 1 156 156 THR HA H 1 4.56 0.02 . 1 . . . . 156 THR HA . 17160 1 1699 . 1 1 156 156 THR HB H 1 4.28 0.02 . 1 . . . . 156 THR HB . 17160 1 1700 . 1 1 156 156 THR HG21 H 1 1.12 0.02 . 1 . . . . 156 THR HG2 . 17160 1 1701 . 1 1 156 156 THR HG22 H 1 1.12 0.02 . 1 . . . . 156 THR HG2 . 17160 1 1702 . 1 1 156 156 THR HG23 H 1 1.12 0.02 . 1 . . . . 156 THR HG2 . 17160 1 1703 . 1 1 156 156 THR C C 13 172.4 0.3 . 1 . . . . 156 THR C . 17160 1 1704 . 1 1 156 156 THR CA C 13 59.2 0.3 . 1 . . . . 156 THR CA . 17160 1 1705 . 1 1 156 156 THR CB C 13 71.4 0.3 . 1 . . . . 156 THR CB . 17160 1 1706 . 1 1 156 156 THR CG2 C 13 21.1 0.3 . 1 . . . . 156 THR CG2 . 17160 1 1707 . 1 1 156 156 THR N N 15 110.2 0.3 . 1 . . . . 156 THR N . 17160 1 1708 . 1 1 157 157 ALA H H 1 8.15 0.02 . 1 . . . . 157 ALA H . 17160 1 1709 . 1 1 157 157 ALA HA H 1 4.30 0.02 . 1 . . . . 157 ALA HA . 17160 1 1710 . 1 1 157 157 ALA HB1 H 1 1.32 0.02 . 1 . . . . 157 ALA HB . 17160 1 1711 . 1 1 157 157 ALA HB2 H 1 1.32 0.02 . 1 . . . . 157 ALA HB . 17160 1 1712 . 1 1 157 157 ALA HB3 H 1 1.32 0.02 . 1 . . . . 157 ALA HB . 17160 1 1713 . 1 1 157 157 ALA C C 13 177.3 0.3 . 1 . . . . 157 ALA C . 17160 1 1714 . 1 1 157 157 ALA CA C 13 51.6 0.3 . 1 . . . . 157 ALA CA . 17160 1 1715 . 1 1 157 157 ALA CB C 13 18.7 0.3 . 1 . . . . 157 ALA CB . 17160 1 1716 . 1 1 157 157 ALA N N 15 120.4 0.3 . 1 . . . . 157 ALA N . 17160 1 1717 . 1 1 158 158 ASN H H 1 7.76 0.02 . 1 . . . . 158 ASN H . 17160 1 1718 . 1 1 158 158 ASN HA H 1 5.38 0.02 . 1 . . . . 158 ASN HA . 17160 1 1719 . 1 1 158 158 ASN HB2 H 1 2.57 0.02 . 2 . . . . 158 ASN HB2 . 17160 1 1720 . 1 1 158 158 ASN HB3 H 1 2.16 0.02 . 2 . . . . 158 ASN HB3 . 17160 1 1721 . 1 1 158 158 ASN HD21 H 1 6.77 0.02 . 1 . . . . 158 ASN HD21 . 17160 1 1722 . 1 1 158 158 ASN C C 13 171.9 0.3 . 1 . . . . 158 ASN C . 17160 1 1723 . 1 1 158 158 ASN CA C 13 53.2 0.3 . 1 . . . . 158 ASN CA . 17160 1 1724 . 1 1 158 158 ASN CB C 13 42.5 0.3 . 1 . . . . 158 ASN CB . 17160 1 1725 . 1 1 158 158 ASN N N 15 118.0 0.3 . 1 . . . . 158 ASN N . 17160 1 1726 . 1 1 158 158 ASN ND2 N 15 111.7 0.3 . 1 . . . . 158 ASN ND2 . 17160 1 1727 . 1 1 159 159 ALA H H 1 8.56 0.02 . 1 . . . . 159 ALA H . 17160 1 1728 . 1 1 159 159 ALA HA H 1 4.81 0.02 . 1 . . . . 159 ALA HA . 17160 1 1729 . 1 1 159 159 ALA HB1 H 1 0.94 0.02 . 1 . . . . 159 ALA HB . 17160 1 1730 . 1 1 159 159 ALA HB2 H 1 0.94 0.02 . 1 . . . . 159 ALA HB . 17160 1 1731 . 1 1 159 159 ALA HB3 H 1 0.94 0.02 . 1 . . . . 159 ALA HB . 17160 1 1732 . 1 1 159 159 ALA C C 13 174.5 0.3 . 1 . . . . 159 ALA C . 17160 1 1733 . 1 1 159 159 ALA CA C 13 49.9 0.3 . 1 . . . . 159 ALA CA . 17160 1 1734 . 1 1 159 159 ALA CB C 13 24.1 0.3 . 1 . . . . 159 ALA CB . 17160 1 1735 . 1 1 159 159 ALA N N 15 118.1 0.3 . 1 . . . . 159 ALA N . 17160 1 1736 . 1 1 160 160 PHE H H 1 8.72 0.02 . 1 . . . . 160 PHE H . 17160 1 1737 . 1 1 160 160 PHE HA H 1 5.35 0.02 . 1 . . . . 160 PHE HA . 17160 1 1738 . 1 1 160 160 PHE HB3 H 1 3.29 0.02 . 1 . . . . 160 PHE HB3 . 17160 1 1739 . 1 1 160 160 PHE HD1 H 1 6.88 0.02 . 1 . . . . 160 PHE HD1 . 17160 1 1740 . 1 1 160 160 PHE HE1 H 1 7.36 0.02 . 1 . . . . 160 PHE HE1 . 17160 1 1741 . 1 1 160 160 PHE C C 13 174.3 0.3 . 1 . . . . 160 PHE C . 17160 1 1742 . 1 1 160 160 PHE CA C 13 56.8 0.3 . 1 . . . . 160 PHE CA . 17160 1 1743 . 1 1 160 160 PHE CB C 13 42.1 0.3 . 1 . . . . 160 PHE CB . 17160 1 1744 . 1 1 160 160 PHE N N 15 117.9 0.3 . 1 . . . . 160 PHE N . 17160 1 1745 . 1 1 161 161 TYR HA H 1 4.81 0.02 . 1 . . . . 161 TYR HA . 17160 1 1746 . 1 1 161 161 TYR HB2 H 1 2.88 0.02 . 2 . . . . 161 TYR HB2 . 17160 1 1747 . 1 1 161 161 TYR HB3 H 1 2.65 0.02 . 2 . . . . 161 TYR HB3 . 17160 1 1748 . 1 1 161 161 TYR HD1 H 1 7.08 0.02 . 1 . . . . 161 TYR HD1 . 17160 1 1749 . 1 1 161 161 TYR C C 13 176.8 0.3 . 1 . . . . 161 TYR C . 17160 1 1750 . 1 1 161 161 TYR CA C 13 58.1 0.3 . 1 . . . . 161 TYR CA . 17160 1 1751 . 1 1 161 161 TYR CB C 13 40.6 0.3 . 1 . . . . 161 TYR CB . 17160 1 1752 . 1 1 162 162 GLN H H 1 9.77 0.02 . 1 . . . . 162 GLN H . 17160 1 1753 . 1 1 162 162 GLN HA H 1 4.78 0.02 . 1 . . . . 162 GLN HA . 17160 1 1754 . 1 1 162 162 GLN HB2 H 1 2.24 0.02 . 2 . . . . 162 GLN HB2 . 17160 1 1755 . 1 1 162 162 GLN HB3 H 1 1.87 0.02 . 2 . . . . 162 GLN HB3 . 17160 1 1756 . 1 1 162 162 GLN HE21 H 1 7.55 0.02 . 1 . . . . 162 GLN HE21 . 17160 1 1757 . 1 1 162 162 GLN HE22 H 1 6.78 0.02 . 1 . . . . 162 GLN HE22 . 17160 1 1758 . 1 1 162 162 GLN C C 13 174.3 0.3 . 1 . . . . 162 GLN C . 17160 1 1759 . 1 1 162 162 GLN CA C 13 52.5 0.3 . 1 . . . . 162 GLN CA . 17160 1 1760 . 1 1 162 162 GLN CB C 13 31.8 0.3 . 1 . . . . 162 GLN CB . 17160 1 1761 . 1 1 162 162 GLN N N 15 125.4 0.3 . 1 . . . . 162 GLN N . 17160 1 1762 . 1 1 162 162 GLN NE2 N 15 114.0 0.3 . 1 . . . . 162 GLN NE2 . 17160 1 1763 . 1 1 163 163 ALA H H 1 8.50 0.02 . 1 . . . . 163 ALA H . 17160 1 1764 . 1 1 163 163 ALA HA H 1 4.96 0.02 . 1 . . . . 163 ALA HA . 17160 1 1765 . 1 1 163 163 ALA HB1 H 1 1.08 0.02 . 1 . . . . 163 ALA HB . 17160 1 1766 . 1 1 163 163 ALA HB2 H 1 1.08 0.02 . 1 . . . . 163 ALA HB . 17160 1 1767 . 1 1 163 163 ALA HB3 H 1 1.08 0.02 . 1 . . . . 163 ALA HB . 17160 1 1768 . 1 1 163 163 ALA C C 13 177.2 0.3 . 1 . . . . 163 ALA C . 17160 1 1769 . 1 1 163 163 ALA CA C 13 52.1 0.3 . 1 . . . . 163 ALA CA . 17160 1 1770 . 1 1 163 163 ALA CB C 13 17.3 0.3 . 1 . . . . 163 ALA CB . 17160 1 1771 . 1 1 163 163 ALA N N 15 128.2 0.3 . 1 . . . . 163 ALA N . 17160 1 1772 . 1 1 164 164 ILE H H 1 10.00 0.02 . 1 . . . . 164 ILE H . 17160 1 1773 . 1 1 164 164 ILE HA H 1 4.33 0.02 . 1 . . . . 164 ILE HA . 17160 1 1774 . 1 1 164 164 ILE HB H 1 2.35 0.02 . 1 . . . . 164 ILE HB . 17160 1 1775 . 1 1 164 164 ILE HD11 H 1 1.67 0.02 . 1 . . . . 164 ILE HD1 . 17160 1 1776 . 1 1 164 164 ILE HD12 H 1 1.67 0.02 . 1 . . . . 164 ILE HD1 . 17160 1 1777 . 1 1 164 164 ILE HD13 H 1 1.67 0.02 . 1 . . . . 164 ILE HD1 . 17160 1 1778 . 1 1 164 164 ILE HG13 H 1 2.06 0.02 . 1 . . . . 164 ILE HG13 . 17160 1 1779 . 1 1 164 164 ILE HG21 H 1 1.06 0.02 . 1 . . . . 164 ILE HG2 . 17160 1 1780 . 1 1 164 164 ILE HG22 H 1 1.06 0.02 . 1 . . . . 164 ILE HG2 . 17160 1 1781 . 1 1 164 164 ILE HG23 H 1 1.06 0.02 . 1 . . . . 164 ILE HG2 . 17160 1 1782 . 1 1 164 164 ILE C C 13 173.6 0.3 . 1 . . . . 164 ILE C . 17160 1 1783 . 1 1 164 164 ILE CA C 13 62.3 0.3 . 1 . . . . 164 ILE CA . 17160 1 1784 . 1 1 164 164 ILE CB C 13 40.9 0.3 . 1 . . . . 164 ILE CB . 17160 1 1785 . 1 1 164 164 ILE CD1 C 13 28.6 0.3 . 1 . . . . 164 ILE CD1 . 17160 1 1786 . 1 1 164 164 ILE CG1 C 13 27.7 0.3 . 1 . . . . 164 ILE CG1 . 17160 1 1787 . 1 1 164 164 ILE CG2 C 13 20.8 0.3 . 1 . . . . 164 ILE CG2 . 17160 1 1788 . 1 1 164 164 ILE N N 15 126.8 0.3 . 1 . . . . 164 ILE N . 17160 1 1789 . 1 1 165 165 ASP H H 1 9.99 0.02 . 1 . . . . 165 ASP H . 17160 1 1790 . 1 1 165 165 ASP HA H 1 5.15 0.02 . 1 . . . . 165 ASP HA . 17160 1 1791 . 1 1 165 165 ASP HB2 H 1 2.87 0.02 . 2 . . . . 165 ASP HB2 . 17160 1 1792 . 1 1 165 165 ASP HB3 H 1 2.45 0.02 . 2 . . . . 165 ASP HB3 . 17160 1 1793 . 1 1 165 165 ASP C C 13 174.9 0.3 . 1 . . . . 165 ASP C . 17160 1 1794 . 1 1 165 165 ASP CA C 13 55.4 0.3 . 1 . . . . 165 ASP CA . 17160 1 1795 . 1 1 165 165 ASP CB C 13 43.1 0.3 . 1 . . . . 165 ASP CB . 17160 1 1796 . 1 1 165 165 ASP N N 15 130.6 0.3 . 1 . . . . 165 ASP N . 17160 1 1797 . 1 1 166 166 VAL H H 1 8.63 0.02 . 1 . . . . 166 VAL H . 17160 1 1798 . 1 1 166 166 VAL HA H 1 5.52 0.02 . 1 . . . . 166 VAL HA . 17160 1 1799 . 1 1 166 166 VAL HB H 1 2.05 0.02 . 1 . . . . 166 VAL HB . 17160 1 1800 . 1 1 166 166 VAL HG11 H 1 0.90 0.02 . 1 . . . . 166 VAL HG1 . 17160 1 1801 . 1 1 166 166 VAL HG12 H 1 0.90 0.02 . 1 . . . . 166 VAL HG1 . 17160 1 1802 . 1 1 166 166 VAL HG13 H 1 0.90 0.02 . 1 . . . . 166 VAL HG1 . 17160 1 1803 . 1 1 166 166 VAL HG21 H 1 0.80 0.02 . 1 . . . . 166 VAL HG2 . 17160 1 1804 . 1 1 166 166 VAL HG22 H 1 0.80 0.02 . 1 . . . . 166 VAL HG2 . 17160 1 1805 . 1 1 166 166 VAL HG23 H 1 0.80 0.02 . 1 . . . . 166 VAL HG2 . 17160 1 1806 . 1 1 166 166 VAL C C 13 173.0 0.3 . 1 . . . . 166 VAL C . 17160 1 1807 . 1 1 166 166 VAL CA C 13 58.4 0.3 . 1 . . . . 166 VAL CA . 17160 1 1808 . 1 1 166 166 VAL CB C 13 36.3 0.3 . 1 . . . . 166 VAL CB . 17160 1 1809 . 1 1 166 166 VAL CG1 C 13 22.6 0.3 . 1 . . . . 166 VAL CG1 . 17160 1 1810 . 1 1 166 166 VAL CG2 C 13 18.9 0.3 . 1 . . . . 166 VAL CG2 . 17160 1 1811 . 1 1 166 166 VAL N N 15 114.2 0.3 . 1 . . . . 166 VAL N . 17160 1 1812 . 1 1 167 167 ASN H H 1 8.90 0.02 . 1 . . . . 167 ASN H . 17160 1 1813 . 1 1 167 167 ASN HA H 1 5.23 0.02 . 1 . . . . 167 ASN HA . 17160 1 1814 . 1 1 167 167 ASN HB2 H 1 2.96 0.02 . 2 . . . . 167 ASN HB2 . 17160 1 1815 . 1 1 167 167 ASN HB3 H 1 2.30 0.02 . 2 . . . . 167 ASN HB3 . 17160 1 1816 . 1 1 167 167 ASN HD21 H 1 7.10 0.02 . 1 . . . . 167 ASN HD21 . 17160 1 1817 . 1 1 167 167 ASN HD22 H 1 6.41 0.02 . 1 . . . . 167 ASN HD22 . 17160 1 1818 . 1 1 167 167 ASN C C 13 175.5 0.3 . 1 . . . . 167 ASN C . 17160 1 1819 . 1 1 167 167 ASN CA C 13 51.8 0.3 . 1 . . . . 167 ASN CA . 17160 1 1820 . 1 1 167 167 ASN CB C 13 40.5 0.3 . 1 . . . . 167 ASN CB . 17160 1 1821 . 1 1 167 167 ASN N N 15 121.1 0.3 . 1 . . . . 167 ASN N . 17160 1 1822 . 1 1 167 167 ASN ND2 N 15 109.5 0.3 . 1 . . . . 167 ASN ND2 . 17160 1 1823 . 1 1 168 168 LEU H H 1 9.20 0.02 . 1 . . . . 168 LEU H . 17160 1 1824 . 1 1 168 168 LEU HA H 1 5.29 0.02 . 1 . . . . 168 LEU HA . 17160 1 1825 . 1 1 168 168 LEU HB2 H 1 1.70 0.02 . 2 . . . . 168 LEU HB2 . 17160 1 1826 . 1 1 168 168 LEU HB3 H 1 1.30 0.02 . 2 . . . . 168 LEU HB3 . 17160 1 1827 . 1 1 168 168 LEU HD11 H 1 0.66 0.02 . 1 . . . . 168 LEU HD1 . 17160 1 1828 . 1 1 168 168 LEU HD12 H 1 0.66 0.02 . 1 . . . . 168 LEU HD1 . 17160 1 1829 . 1 1 168 168 LEU HD13 H 1 0.66 0.02 . 1 . . . . 168 LEU HD1 . 17160 1 1830 . 1 1 168 168 LEU HD21 H 1 0.59 0.02 . 1 . . . . 168 LEU HD2 . 17160 1 1831 . 1 1 168 168 LEU HD22 H 1 0.59 0.02 . 1 . . . . 168 LEU HD2 . 17160 1 1832 . 1 1 168 168 LEU HD23 H 1 0.59 0.02 . 1 . . . . 168 LEU HD2 . 17160 1 1833 . 1 1 168 168 LEU HG H 1 1.46 0.02 . 1 . . . . 168 LEU HG . 17160 1 1834 . 1 1 168 168 LEU C C 13 177.4 0.3 . 1 . . . . 168 LEU C . 17160 1 1835 . 1 1 168 168 LEU CA C 13 53.8 0.3 . 1 . . . . 168 LEU CA . 17160 1 1836 . 1 1 168 168 LEU CB C 13 44.1 0.3 . 1 . . . . 168 LEU CB . 17160 1 1837 . 1 1 168 168 LEU CD1 C 13 24.6 0.3 . 1 . . . . 168 LEU CD1 . 17160 1 1838 . 1 1 168 168 LEU CD2 C 13 26.9 0.3 . 1 . . . . 168 LEU CD2 . 17160 1 1839 . 1 1 168 168 LEU CG C 13 24.7 0.3 . 1 . . . . 168 LEU CG . 17160 1 1840 . 1 1 168 168 LEU N N 15 126.5 0.3 . 1 . . . . 168 LEU N . 17160 1 1841 . 1 1 169 169 SER H H 1 8.48 0.02 . 1 . . . . 169 SER H . 17160 1 1842 . 1 1 169 169 SER HA H 1 4.80 0.02 . 1 . . . . 169 SER HA . 17160 1 1843 . 1 1 169 169 SER HB2 H 1 3.96 0.02 . 2 . . . . 169 SER HB2 . 17160 1 1844 . 1 1 169 169 SER HB3 H 1 3.89 0.02 . 2 . . . . 169 SER HB3 . 17160 1 1845 . 1 1 169 169 SER C C 13 172.1 0.3 . 1 . . . . 169 SER C . 17160 1 1846 . 1 1 169 169 SER CA C 13 57.0 0.3 . 1 . . . . 169 SER CA . 17160 1 1847 . 1 1 169 169 SER CB C 13 65.5 0.3 . 1 . . . . 169 SER CB . 17160 1 1848 . 1 1 169 169 SER N N 15 119.1 0.3 . 1 . . . . 169 SER N . 17160 1 1849 . 1 1 170 170 LYS H H 1 8.03 0.02 . 1 . . . . 170 LYS H . 17160 1 1850 . 1 1 170 170 LYS HA H 1 4.32 0.02 . 1 . . . . 170 LYS HA . 17160 1 1851 . 1 1 170 170 LYS HB2 H 1 1.80 0.02 . 2 . . . . 170 LYS HB2 . 17160 1 1852 . 1 1 170 170 LYS HB3 H 1 1.78 0.02 . 2 . . . . 170 LYS HB3 . 17160 1 1853 . 1 1 170 170 LYS HD2 H 1 1.71 0.02 . 1 . . . . 170 LYS HD2 . 17160 1 1854 . 1 1 170 170 LYS HE2 H 1 3.00 0.02 . 1 . . . . 170 LYS HE2 . 17160 1 1855 . 1 1 170 170 LYS HG2 H 1 1.47 0.02 . 2 . . . . 170 LYS HG2 . 17160 1 1856 . 1 1 170 170 LYS HG3 H 1 1.44 0.02 . 2 . . . . 170 LYS HG3 . 17160 1 1857 . 1 1 170 170 LYS C C 13 182.1 0.3 . 1 . . . . 170 LYS C . 17160 1 1858 . 1 1 170 170 LYS CA C 13 58.0 0.3 . 1 . . . . 170 LYS CA . 17160 1 1859 . 1 1 170 170 LYS CB C 13 33.3 0.3 . 1 . . . . 170 LYS CB . 17160 1 1860 . 1 1 170 170 LYS CD C 13 29.1 0.3 . 1 . . . . 170 LYS CD . 17160 1 1861 . 1 1 170 170 LYS CE C 13 41.9 0.3 . 1 . . . . 170 LYS CE . 17160 1 1862 . 1 1 170 170 LYS CG C 13 24.7 0.3 . 1 . . . . 170 LYS CG . 17160 1 1863 . 1 1 170 170 LYS N N 15 125.5 0.3 . 1 . . . . 170 LYS N . 17160 1 stop_ save_