data_34201 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34201 _Entry.Title ; Rtt109 peptide bound to Asf1 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2017-11-21 _Entry.Accession_date 2017-11-21 _Entry.Last_release_date 2017-12-18 _Entry.Original_release_date 2017-12-18 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.1.32 _Entry.NMR_STAR_dict_location . _Entry.Original_NMR_STAR_version 3.1 _Entry.Experimental_method NMR _Entry.Experimental_method_subtype SOLUTION _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 L. Lercher L. . . . 34201 2 J. Kirkpatrick J. P. . . 34201 3 T. Carlomagno T. . . . 34201 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'acetyl transferase' . 34201 'histone chaperone' . 34201 transferase . 34201 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 2 34201 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 750 34201 '15N chemical shifts' 176 34201 '1H chemical shifts' 1494 34201 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 . . 2019-08-14 2017-11-21 update BMRB 'update entry citation' 34201 1 . . 2017-12-21 2017-11-21 original author 'original release' 34201 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 6F0Y 'BMRB Entry Tracking System' 34201 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34201 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.DOI . _Citation.PubMed_ID 29300933 _Citation.Full_citation . _Citation.Title ; Structural characterization of the Asf1-Rtt109 interaction and its role in histone acetylation ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nucleic Acids Res.' _Citation.Journal_name_full 'Nucleic acids research' _Citation.Journal_volume 46 _Citation.Journal_issue 5 _Citation.Journal_ASTM . _Citation.Journal_ISSN 1362-4962 _Citation.Journal_CSD 0353 _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 2279 _Citation.Page_last 2289 _Citation.Year 2018 _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.ORCID _Citation_author.Entry_ID _Citation_author.Citation_ID 1 Lukas Lercher L. . . . 34201 1 2 Nataliya Danilenko N. . . . 34201 1 3 John Kirkpatrick J. . . . 34201 1 4 Teresa Carlomagno T. . . . 34201 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34201 _Assembly.ID 1 _Assembly.Name 'Histone chaperone ASF1, histone acetyltransferase Rtt109 C-terminus (E.C.2.3.1.48)' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 entity_1 1 $entity_1 A A yes . . . . . . 34201 1 2 entity_2 2 $entity_2 B B yes . . . . . . 34201 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34201 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; GAMGSIVSLLGIKVLNNPAK FTDPYEFEITFECLESLKHD LEWKLTYVGSSRSLDHDQEL DSILVGPVPVGVNKFVFSAD PPSAELIPASELVSVTVILL SCSYDGREFVRVGYYVNNEY DEEELRENPPAKVQVDHIVR NILAEKPRVTRFNIVWDNEN EGDLYPPEQPGV ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 172 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 19327.652 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Anti-silencing function protein 1' na 34201 1 yASF1 na 34201 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 -2 GLY . 34201 1 2 -1 ALA . 34201 1 3 0 MET . 34201 1 4 1 GLY . 34201 1 5 2 SER . 34201 1 6 3 ILE . 34201 1 7 4 VAL . 34201 1 8 5 SER . 34201 1 9 6 LEU . 34201 1 10 7 LEU . 34201 1 11 8 GLY . 34201 1 12 9 ILE . 34201 1 13 10 LYS . 34201 1 14 11 VAL . 34201 1 15 12 LEU . 34201 1 16 13 ASN . 34201 1 17 14 ASN . 34201 1 18 15 PRO . 34201 1 19 16 ALA . 34201 1 20 17 LYS . 34201 1 21 18 PHE . 34201 1 22 19 THR . 34201 1 23 20 ASP . 34201 1 24 21 PRO . 34201 1 25 22 TYR . 34201 1 26 23 GLU . 34201 1 27 24 PHE . 34201 1 28 25 GLU . 34201 1 29 26 ILE . 34201 1 30 27 THR . 34201 1 31 28 PHE . 34201 1 32 29 GLU . 34201 1 33 30 CYS . 34201 1 34 31 LEU . 34201 1 35 32 GLU . 34201 1 36 33 SER . 34201 1 37 34 LEU . 34201 1 38 35 LYS . 34201 1 39 36 HIS . 34201 1 40 37 ASP . 34201 1 41 38 LEU . 34201 1 42 39 GLU . 34201 1 43 40 TRP . 34201 1 44 41 LYS . 34201 1 45 42 LEU . 34201 1 46 43 THR . 34201 1 47 44 TYR . 34201 1 48 45 VAL . 34201 1 49 46 GLY . 34201 1 50 47 SER . 34201 1 51 48 SER . 34201 1 52 49 ARG . 34201 1 53 50 SER . 34201 1 54 51 LEU . 34201 1 55 52 ASP . 34201 1 56 53 HIS . 34201 1 57 54 ASP . 34201 1 58 55 GLN . 34201 1 59 56 GLU . 34201 1 60 57 LEU . 34201 1 61 58 ASP . 34201 1 62 59 SER . 34201 1 63 60 ILE . 34201 1 64 61 LEU . 34201 1 65 62 VAL . 34201 1 66 63 GLY . 34201 1 67 64 PRO . 34201 1 68 65 VAL . 34201 1 69 66 PRO . 34201 1 70 67 VAL . 34201 1 71 68 GLY . 34201 1 72 69 VAL . 34201 1 73 70 ASN . 34201 1 74 71 LYS . 34201 1 75 72 PHE . 34201 1 76 73 VAL . 34201 1 77 74 PHE . 34201 1 78 75 SER . 34201 1 79 76 ALA . 34201 1 80 77 ASP . 34201 1 81 78 PRO . 34201 1 82 79 PRO . 34201 1 83 80 SER . 34201 1 84 81 ALA . 34201 1 85 82 GLU . 34201 1 86 83 LEU . 34201 1 87 84 ILE . 34201 1 88 85 PRO . 34201 1 89 86 ALA . 34201 1 90 87 SER . 34201 1 91 88 GLU . 34201 1 92 89 LEU . 34201 1 93 90 VAL . 34201 1 94 91 SER . 34201 1 95 92 VAL . 34201 1 96 93 THR . 34201 1 97 94 VAL . 34201 1 98 95 ILE . 34201 1 99 96 LEU . 34201 1 100 97 LEU . 34201 1 101 98 SER . 34201 1 102 99 CYS . 34201 1 103 100 SER . 34201 1 104 101 TYR . 34201 1 105 102 ASP . 34201 1 106 103 GLY . 34201 1 107 104 ARG . 34201 1 108 105 GLU . 34201 1 109 106 PHE . 34201 1 110 107 VAL . 34201 1 111 108 ARG . 34201 1 112 109 VAL . 34201 1 113 110 GLY . 34201 1 114 111 TYR . 34201 1 115 112 TYR . 34201 1 116 113 VAL . 34201 1 117 114 ASN . 34201 1 118 115 ASN . 34201 1 119 116 GLU . 34201 1 120 117 TYR . 34201 1 121 118 ASP . 34201 1 122 119 GLU . 34201 1 123 120 GLU . 34201 1 124 121 GLU . 34201 1 125 122 LEU . 34201 1 126 123 ARG . 34201 1 127 124 GLU . 34201 1 128 125 ASN . 34201 1 129 126 PRO . 34201 1 130 127 PRO . 34201 1 131 128 ALA . 34201 1 132 129 LYS . 34201 1 133 130 VAL . 34201 1 134 131 GLN . 34201 1 135 132 VAL . 34201 1 136 133 ASP . 34201 1 137 134 HIS . 34201 1 138 135 ILE . 34201 1 139 136 VAL . 34201 1 140 137 ARG . 34201 1 141 138 ASN . 34201 1 142 139 ILE . 34201 1 143 140 LEU . 34201 1 144 141 ALA . 34201 1 145 142 GLU . 34201 1 146 143 LYS . 34201 1 147 144 PRO . 34201 1 148 145 ARG . 34201 1 149 146 VAL . 34201 1 150 147 THR . 34201 1 151 148 ARG . 34201 1 152 149 PHE . 34201 1 153 150 ASN . 34201 1 154 151 ILE . 34201 1 155 152 VAL . 34201 1 156 153 TRP . 34201 1 157 154 ASP . 34201 1 158 155 ASN . 34201 1 159 156 GLU . 34201 1 160 157 ASN . 34201 1 161 158 GLU . 34201 1 162 159 GLY . 34201 1 163 160 ASP . 34201 1 164 161 LEU . 34201 1 165 162 TYR . 34201 1 166 163 PRO . 34201 1 167 164 PRO . 34201 1 168 165 GLU . 34201 1 169 166 GLN . 34201 1 170 167 PRO . 34201 1 171 168 GLY . 34201 1 172 169 VAL . 34201 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . GLY 1 1 34201 1 . ALA 2 2 34201 1 . MET 3 3 34201 1 . GLY 4 4 34201 1 . SER 5 5 34201 1 . ILE 6 6 34201 1 . VAL 7 7 34201 1 . SER 8 8 34201 1 . LEU 9 9 34201 1 . LEU 10 10 34201 1 . GLY 11 11 34201 1 . ILE 12 12 34201 1 . LYS 13 13 34201 1 . VAL 14 14 34201 1 . LEU 15 15 34201 1 . ASN 16 16 34201 1 . ASN 17 17 34201 1 . PRO 18 18 34201 1 . ALA 19 19 34201 1 . LYS 20 20 34201 1 . PHE 21 21 34201 1 . THR 22 22 34201 1 . ASP 23 23 34201 1 . PRO 24 24 34201 1 . TYR 25 25 34201 1 . GLU 26 26 34201 1 . PHE 27 27 34201 1 . GLU 28 28 34201 1 . ILE 29 29 34201 1 . THR 30 30 34201 1 . PHE 31 31 34201 1 . GLU 32 32 34201 1 . CYS 33 33 34201 1 . LEU 34 34 34201 1 . GLU 35 35 34201 1 . SER 36 36 34201 1 . LEU 37 37 34201 1 . LYS 38 38 34201 1 . HIS 39 39 34201 1 . ASP 40 40 34201 1 . LEU 41 41 34201 1 . GLU 42 42 34201 1 . TRP 43 43 34201 1 . LYS 44 44 34201 1 . LEU 45 45 34201 1 . THR 46 46 34201 1 . TYR 47 47 34201 1 . VAL 48 48 34201 1 . GLY 49 49 34201 1 . SER 50 50 34201 1 . SER 51 51 34201 1 . ARG 52 52 34201 1 . SER 53 53 34201 1 . LEU 54 54 34201 1 . ASP 55 55 34201 1 . HIS 56 56 34201 1 . ASP 57 57 34201 1 . GLN 58 58 34201 1 . GLU 59 59 34201 1 . LEU 60 60 34201 1 . ASP 61 61 34201 1 . SER 62 62 34201 1 . ILE 63 63 34201 1 . LEU 64 64 34201 1 . VAL 65 65 34201 1 . GLY 66 66 34201 1 . PRO 67 67 34201 1 . VAL 68 68 34201 1 . PRO 69 69 34201 1 . VAL 70 70 34201 1 . GLY 71 71 34201 1 . VAL 72 72 34201 1 . ASN 73 73 34201 1 . LYS 74 74 34201 1 . PHE 75 75 34201 1 . VAL 76 76 34201 1 . PHE 77 77 34201 1 . SER 78 78 34201 1 . ALA 79 79 34201 1 . ASP 80 80 34201 1 . PRO 81 81 34201 1 . PRO 82 82 34201 1 . SER 83 83 34201 1 . ALA 84 84 34201 1 . GLU 85 85 34201 1 . LEU 86 86 34201 1 . ILE 87 87 34201 1 . PRO 88 88 34201 1 . ALA 89 89 34201 1 . SER 90 90 34201 1 . GLU 91 91 34201 1 . LEU 92 92 34201 1 . VAL 93 93 34201 1 . SER 94 94 34201 1 . VAL 95 95 34201 1 . THR 96 96 34201 1 . VAL 97 97 34201 1 . ILE 98 98 34201 1 . LEU 99 99 34201 1 . LEU 100 100 34201 1 . SER 101 101 34201 1 . CYS 102 102 34201 1 . SER 103 103 34201 1 . TYR 104 104 34201 1 . ASP 105 105 34201 1 . GLY 106 106 34201 1 . ARG 107 107 34201 1 . GLU 108 108 34201 1 . PHE 109 109 34201 1 . VAL 110 110 34201 1 . ARG 111 111 34201 1 . VAL 112 112 34201 1 . GLY 113 113 34201 1 . TYR 114 114 34201 1 . TYR 115 115 34201 1 . VAL 116 116 34201 1 . ASN 117 117 34201 1 . ASN 118 118 34201 1 . GLU 119 119 34201 1 . TYR 120 120 34201 1 . ASP 121 121 34201 1 . GLU 122 122 34201 1 . GLU 123 123 34201 1 . GLU 124 124 34201 1 . LEU 125 125 34201 1 . ARG 126 126 34201 1 . GLU 127 127 34201 1 . ASN 128 128 34201 1 . PRO 129 129 34201 1 . PRO 130 130 34201 1 . ALA 131 131 34201 1 . LYS 132 132 34201 1 . VAL 133 133 34201 1 . GLN 134 134 34201 1 . VAL 135 135 34201 1 . ASP 136 136 34201 1 . HIS 137 137 34201 1 . ILE 138 138 34201 1 . VAL 139 139 34201 1 . ARG 140 140 34201 1 . ASN 141 141 34201 1 . ILE 142 142 34201 1 . LEU 143 143 34201 1 . ALA 144 144 34201 1 . GLU 145 145 34201 1 . LYS 146 146 34201 1 . PRO 147 147 34201 1 . ARG 148 148 34201 1 . VAL 149 149 34201 1 . THR 150 150 34201 1 . ARG 151 151 34201 1 . PHE 152 152 34201 1 . ASN 153 153 34201 1 . ILE 154 154 34201 1 . VAL 155 155 34201 1 . TRP 156 156 34201 1 . ASP 157 157 34201 1 . ASN 158 158 34201 1 . GLU 159 159 34201 1 . ASN 160 160 34201 1 . GLU 161 161 34201 1 . GLY 162 162 34201 1 . ASP 163 163 34201 1 . LEU 164 164 34201 1 . TYR 165 165 34201 1 . PRO 166 166 34201 1 . PRO 167 167 34201 1 . GLU 168 168 34201 1 . GLN 169 169 34201 1 . PRO 170 170 34201 1 . GLY 171 171 34201 1 . VAL 172 172 34201 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 34201 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; LAITMLKPRKKAKAL ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 15 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method syn _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number 2.3.1.48 _Entity.Calc_isoelectric_point . _Entity.Formula_weight 1687.207 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . 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 1 419 LEU . 34201 2 2 420 ALA . 34201 2 3 421 ILE . 34201 2 4 422 THR . 34201 2 5 423 MET . 34201 2 6 424 LEU . 34201 2 7 425 LYS . 34201 2 8 426 PRO . 34201 2 9 427 ARG . 34201 2 10 428 LYS . 34201 2 11 429 LYS . 34201 2 12 430 ALA . 34201 2 13 431 LYS . 34201 2 14 432 ALA . 34201 2 15 433 LEU . 34201 2 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 . LEU 1 1 34201 2 . ALA 2 2 34201 2 . ILE 3 3 34201 2 . THR 4 4 34201 2 . MET 5 5 34201 2 . LEU 6 6 34201 2 . LYS 7 7 34201 2 . PRO 8 8 34201 2 . ARG 9 9 34201 2 . LYS 10 10 34201 2 . LYS 11 11 34201 2 . ALA 12 12 34201 2 . LYS 13 13 34201 2 . ALA 14 14 34201 2 . LEU 15 15 34201 2 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 34201 _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.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.Secretion _Entity_natural_src.Plasmid _Entity_natural_src.Gene_mnemonic _Entity_natural_src.Details _Entity_natural_src.Entry_ID _Entity_natural_src.Entity_natural_src_list_ID 1 1 $entity_1 . 559292 organism . 'Saccharomyces cerevisiae (strain ATCC 204508 / S288c)' "Baker's yeast" . . Eukaryota Fungi Saccharomyces cerevisiae 'ATCC 204508 / S288c' . . . . . . 204508 . . . 'ASF1, CIA1, YJL115W, J0755' . 34201 1 2 2 $entity_2 . 559292 organism . 'Saccharomyces cerevisiae S288c' "Baker's yeast" . . Eukaryota Fungi Saccharomyces cerevisiae . . . . . . . . . . . . . 34201 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 34201 _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_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.Details _Entity_experimental_src.Entry_ID _Entity_experimental_src.Entity_experimental_src_list_ID 1 1 $entity_1 . 'recombinant technology' 'Escherichia coli' . . 562 Escherichia coli BL21(DE3) . . Plasmid . . pETM11 . . . 34201 1 2 2 $entity_2 . 'chemical synthesis' . . . . . . . . . . . . . . . . 34201 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34201 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.5 mM [U-99% 13C; U-99% 15N] Histone chaperone Asf1, 3 mM histone acetyltransferase Rtt109 C-terminus, 90% H2O/10% D2O' _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 'Histone chaperone Asf1' '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 0.5 . . mM . . . . 34201 1 2 'histone acetyltransferase Rtt109 C-terminus' 'natural abundance' . . 2 $entity_2 . . 3 . . mM . . . . 34201 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 34201 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.15 mM [U-99% 13C; U-99% 15N] Histone chaperone Asf1, 0.5 mM histone acetyltransferase Rtt109 C-terminus, 100% D2O' _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 'Histone chaperone Asf1' '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 0.15 . . mM . . . . 34201 2 2 'histone acetyltransferase Rtt109 C-terminus' 'natural abundance' . . 2 $entity_2 . . 0.5 . . mM . . . . 34201 2 stop_ save_ save_sample_3 _Sample.Sf_category sample _Sample.Sf_framecode sample_3 _Sample.Entry_ID 34201 _Sample.ID 3 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details ; 0.5 mM [U-99% 13C; U-99% 15N; U-99% 2D] Histone chaperone ASF1, 0.15 mM histone acetyltransferase Rtt109 C-terminus, 90% H2O/10% D2O ; _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 'histone acetyltransferase Rtt109 C-terminus' 'natural abundance' . . 2 $entity_2 . . 0.15 . . mM . . . . 34201 3 2 'Histone chaperone ASF1' '[U-99% 13C; U-99% 15N; U-99% 2D]' . . 1 $entity_1 . . 0.5 . . mM . . . . 34201 3 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 34201 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _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' 150 . mM 34201 1 pH 6.2 . pH 34201 1 pressure 1 . atm 34201 1 temperature 298 . K 34201 1 stop_ save_ save_sample_conditions_2 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_2 _Sample_condition_list.Entry_ID 34201 _Sample_condition_list.ID 2 _Sample_condition_list.Name . _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' 150 . mM 34201 2 pH 6.2 . pH 34201 2 pressure 1 . atm 34201 2 temperature 298 . K 34201 2 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34201 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.2 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Bruker Biospin' . . 34201 1 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . collection 34201 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34201 _Software.ID 2 _Software.Type . _Software.Name NMRPipe _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . 34201 2 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . processing 34201 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34201 _Software.ID 3 _Software.Type . _Software.Name Analysis _Software.Version 2.4.2 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID CCPN . . 34201 3 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'chemical shift assignment' 34201 3 . 'peak picking' 34201 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 34201 _Software.ID 4 _Software.Type . _Software.Name CNS _Software.Version 1.21 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Brunger, Adams, Clore, Delano, Gros, Grosse-Kunstleve, Jiang, Kuszewski, Nilges, Pannu, Read, Rice, Simonson, Warren' . . 34201 4 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'structure calculation' 34201 4 stop_ save_ save_software_5 _Software.Sf_category software _Software.Sf_framecode software_5 _Software.Entry_ID 34201 _Software.ID 5 _Software.Type . _Software.Name ARIA _Software.Version 2.3 _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'W. Rieping, M. Habeck, B. Bardiaux, A. Bernard, T.E. Malliavin, M. Nilges' . . 34201 5 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'structure calculation' 34201 5 stop_ save_ save_software_6 _Software.Sf_category software _Software.Sf_framecode software_6 _Software.Entry_ID 34201 _Software.ID 6 _Software.Type . _Software.Name PALES _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'M. Zweckstetter' . . 34201 6 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'data analysis' 34201 6 stop_ save_ save_software_7 _Software.Sf_category software _Software.Sf_framecode software_7 _Software.Entry_ID 34201 _Software.ID 7 _Software.Type . _Software.Name TALOS-N _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Y. Shen, A. Bax' . . 34201 7 stop_ loop_ _Task.Software_module _Task.Task _Task.Entry_ID _Task.Software_ID . 'data analysis' 34201 7 stop_ save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_1 _NMR_spectrometer.Entry_ID 34201 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance III HD' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 850 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 34201 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'Avance III HD' _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 34201 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . 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 NMR_spectrometer_1 Bruker 'Avance III HD' . 850 . . . 34201 1 2 NMR_spectrometer_2 Bruker 'Avance III HD' . 600 . . . 34201 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 34201 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NMR_spec_expt_ID _Experiment.NMR_spec_expt_label _Experiment.MS_expt_ID _Experiment.MS_expt_label _Experiment.SAXS_expt_ID _Experiment.SAXS_expt_label _Experiment.FRET_expt_ID _Experiment.FRET_expt_label _Experiment.EMR_expt_ID _Experiment.EMR_expt_label _Experiment.Sample_ID _Experiment.Sample_label _Experiment.Sample_state _Experiment.Sample_volume _Experiment.Sample_volume_units _Experiment.Sample_condition_list_ID _Experiment.Sample_condition_list_label _Experiment.Sample_spinning_rate _Experiment.Sample_angle _Experiment.NMR_tube_type _Experiment.NMR_spectrometer_ID _Experiment.NMR_spectrometer_label _Experiment.NMR_spectrometer_probe_ID _Experiment.NMR_spectrometer_probe_label _Experiment.NMR_spectral_processing_ID _Experiment.NMR_spectral_processing_label _Experiment.Mass_spectrometer_ID _Experiment.Mass_spectrometer_label _Experiment.Xray_instrument_ID _Experiment.Xray_instrument_label _Experiment.Fluorescence_instrument_ID _Experiment.Fluorescence_instrument_label _Experiment.EMR_instrument_ID _Experiment.EMR_instrument_label _Experiment.Chromatographic_system_ID _Experiment.Chromatographic_system_label _Experiment.Chromatographic_column_ID _Experiment.Chromatographic_column_label _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '3D HNCO' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34201 1 2 '3D HCCH-TOCSY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34201 1 3 (HB)CB(CGCD)HD no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34201 1 4 '3D 1H-15N NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34201 1 5 '3D 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34201 1 6 '3D 13C,15N filtered 1H-13C NOESY' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34201 1 7 '2D 1H-15N HSQC' no . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34201 1 8 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 anisotropic . . 2 $sample_conditions_2 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34201 1 9 '2D 1H-15N HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34201 1 10 '2D 1H-15N TROSY-HSQC' no . . . . . . . . . . 1 $sample_1 anisotropic . . 2 $sample_conditions_2 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34201 1 11 '2D 1H-15N TROSY-HSQC' no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . 34201 1 12 '2D 1H-1H TOCSY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34201 1 13 '2D 1H-1H NOESY' no . . . . . . . . . . 3 $sample_3 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . 34201 1 stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Chem_shift_reference.Sf_category chem_shift_reference _Chem_shift_reference.Sf_framecode chem_shift_reference_1 _Chem_shift_reference.Entry_ID 34201 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _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.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm 4.78 internal indirect 0.25144953 . . . . . 34201 1 H 1 water protons . . . . ppm 4.78 internal direct 1 . . . . . 34201 1 N 15 water protons . . . . ppm 4.78 internal indirect 0.101329118 . . . . . 34201 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 34201 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCO' . . . 34201 1 2 '3D HCCH-TOCSY' . . . 34201 1 3 (HB)CB(CGCD)HD . . . 34201 1 4 '3D 1H-15N NOESY' . . . 34201 1 5 '3D 1H-13C NOESY' . . . 34201 1 6 '3D 13C,15N filtered 1H-13C NOESY' . . . 34201 1 7 '2D 1H-15N HSQC' . . . 34201 1 8 '2D 1H-15N HSQC' . . . 34201 1 9 '2D 1H-15N HSQC' . . . 34201 1 10 '2D 1H-15N TROSY-HSQC' . . . 34201 1 11 '2D 1H-15N TROSY-HSQC' . . . 34201 1 12 '2D 1H-1H TOCSY' . . . 34201 1 13 '2D 1H-1H NOESY' . . . 34201 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.Ambiguity_set_ID _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 . 2 2 1 1 LEU H H 1 8.132 0.002 . 1 . . 1760 . B 419 LEU H1 . 34201 1 2 . 2 2 1 1 LEU HA H 1 4.271 0.005 . 1 . . 1362 . B 419 LEU HA . 34201 1 3 . 2 2 1 1 LEU HB2 H 1 1.553 . . 2 . . 1820 . B 419 LEU HB2 . 34201 1 4 . 2 2 1 1 LEU HB3 H 1 1.520 0.002 . 2 . . 1821 . B 419 LEU HB3 . 34201 1 5 . 2 2 1 1 LEU HG H 1 1.611 0.001 . 1 . . 1819 . B 419 LEU HG . 34201 1 6 . 2 2 1 1 LEU HD11 H 1 0.913 0.008 . 2 . . 1761 . B 419 LEU HD11 . 34201 1 7 . 2 2 1 1 LEU HD12 H 1 0.913 0.008 . 2 . . 1761 . B 419 LEU HD12 . 34201 1 8 . 2 2 1 1 LEU HD13 H 1 0.913 0.008 . 2 . . 1761 . B 419 LEU HD13 . 34201 1 9 . 2 2 1 1 LEU HD21 H 1 0.870 0.009 . 2 . . 1762 . B 419 LEU HD21 . 34201 1 10 . 2 2 1 1 LEU HD22 H 1 0.870 0.009 . 2 . . 1762 . B 419 LEU HD22 . 34201 1 11 . 2 2 1 1 LEU HD23 H 1 0.870 0.009 . 2 . . 1762 . B 419 LEU HD23 . 34201 1 12 . 2 2 2 2 ALA H H 1 8.320 0.006 . 1 . . 1363 . B 420 ALA H . 34201 1 13 . 2 2 2 2 ALA HA H 1 4.365 0.002 . 1 . . 1750 . B 420 ALA HA . 34201 1 14 . 2 2 2 2 ALA HB1 H 1 1.345 0.006 . 1 . . 1753 . B 420 ALA HB1 . 34201 1 15 . 2 2 2 2 ALA HB2 H 1 1.345 0.006 . 1 . . 1753 . B 420 ALA HB2 . 34201 1 16 . 2 2 2 2 ALA HB3 H 1 1.345 0.006 . 1 . . 1753 . B 420 ALA HB3 . 34201 1 17 . 2 2 3 3 ILE H H 1 8.006 0.003 . 1 . . 1749 . B 421 ILE H . 34201 1 18 . 2 2 3 3 ILE HA H 1 4.277 0.006 . 1 . . 1751 . B 421 ILE HA . 34201 1 19 . 2 2 3 3 ILE HB H 1 1.613 0.003 . 1 . . 1374 . B 421 ILE HB . 34201 1 20 . 2 2 3 3 ILE HG12 H 1 1.457 0.004 . 2 . . 1752 . B 421 ILE HG12 . 34201 1 21 . 2 2 3 3 ILE HG13 H 1 0.760 0.008 . 2 . . 1754 . B 421 ILE HG13 . 34201 1 22 . 2 2 3 3 ILE HG21 H 1 0.678 0.003 . 1 . . 1373 . B 421 ILE HG21 . 34201 1 23 . 2 2 3 3 ILE HG22 H 1 0.678 0.003 . 1 . . 1373 . B 421 ILE HG22 . 34201 1 24 . 2 2 3 3 ILE HG23 H 1 0.678 0.003 . 1 . . 1373 . B 421 ILE HG23 . 34201 1 25 . 2 2 3 3 ILE HD11 H 1 0.857 0.008 . 1 . . 1755 . B 421 ILE HD11 . 34201 1 26 . 2 2 3 3 ILE HD12 H 1 0.857 0.008 . 1 . . 1755 . B 421 ILE HD12 . 34201 1 27 . 2 2 3 3 ILE HD13 H 1 0.857 0.008 . 1 . . 1755 . B 421 ILE HD13 . 34201 1 28 . 2 2 4 4 THR H H 1 8.439 0.005 . 1 . . 1364 . B 422 THR H . 34201 1 29 . 2 2 4 4 THR HA H 1 4.262 0.005 . 1 . . 1370 . B 422 THR HA . 34201 1 30 . 2 2 4 4 THR HB H 1 4.354 0.007 . 1 . . 1365 . B 422 THR HB . 34201 1 31 . 2 2 4 4 THR HG21 H 1 1.155 0.002 . 1 . . 1369 . B 422 THR HG21 . 34201 1 32 . 2 2 4 4 THR HG22 H 1 1.155 0.002 . 1 . . 1369 . B 422 THR HG22 . 34201 1 33 . 2 2 4 4 THR HG23 H 1 1.155 0.002 . 1 . . 1369 . B 422 THR HG23 . 34201 1 34 . 2 2 5 5 MET H H 1 8.670 0.002 . 1 . . 1743 . B 423 MET H . 34201 1 35 . 2 2 5 5 MET HA H 1 5.145 0.004 . 1 . . 1759 . B 423 MET HA . 34201 1 36 . 2 2 5 5 MET HB2 H 1 2.143 0.004 . 2 . . 1372 . B 423 MET HB2 . 34201 1 37 . 2 2 5 5 MET HB3 H 1 2.014 0.008 . 2 . . 1758 . B 423 MET HB3 . 34201 1 38 . 2 2 5 5 MET HG2 H 1 2.579 0.003 . 2 . . 1371 . B 423 MET HG2 . 34201 1 39 . 2 2 5 5 MET HG3 H 1 2.648 0.006 . 2 . . 1756 . B 423 MET HG3 . 34201 1 40 . 2 2 5 5 MET HE1 H 1 2.072 0.003 . 1 . . 1757 . B 423 MET HE1 . 34201 1 41 . 2 2 5 5 MET HE2 H 1 2.072 0.003 . 1 . . 1757 . B 423 MET HE2 . 34201 1 42 . 2 2 5 5 MET HE3 H 1 2.072 0.003 . 1 . . 1757 . B 423 MET HE3 . 34201 1 43 . 2 2 6 6 LEU H H 1 8.901 0.007 . 1 . . 1958 . B 424 LEU H . 34201 1 44 . 2 2 6 6 LEU HA H 1 4.262 0.012 . 1 . . 1366 . B 424 LEU HA . 34201 1 45 . 2 2 6 6 LEU HB2 H 1 1.483 0.014 . 2 . . 1822 . B 424 LEU HB2 . 34201 1 46 . 2 2 6 6 LEU HB3 H 1 1.578 0.016 . 2 . . 1955 . B 424 LEU HB3 . 34201 1 47 . 2 2 6 6 LEU HG H 1 1.812 0.004 . 1 . . 1765 . B 424 LEU HG . 34201 1 48 . 2 2 6 6 LEU HD11 H 1 0.907 0.007 . 2 . . 1763 . B 424 LEU HD11 . 34201 1 49 . 2 2 6 6 LEU HD12 H 1 0.907 0.007 . 2 . . 1763 . B 424 LEU HD12 . 34201 1 50 . 2 2 6 6 LEU HD13 H 1 0.907 0.007 . 2 . . 1763 . B 424 LEU HD13 . 34201 1 51 . 2 2 6 6 LEU HD21 H 1 0.946 0.007 . 2 . . 1764 . B 424 LEU HD21 . 34201 1 52 . 2 2 6 6 LEU HD22 H 1 0.946 0.007 . 2 . . 1764 . B 424 LEU HD22 . 34201 1 53 . 2 2 6 6 LEU HD23 H 1 0.946 0.007 . 2 . . 1764 . B 424 LEU HD23 . 34201 1 54 . 2 2 7 7 LYS H H 1 8.524 0.014 . 1 . . 1377 . B 425 LYS H . 34201 1 55 . 2 2 7 7 LYS HA H 1 5.007 0.003 . 1 . . 1378 . B 425 LYS HA . 34201 1 56 . 2 2 7 7 LYS HB2 H 1 1.912 0.007 . 2 . . 1984 . B 425 LYS HB2 . 34201 1 57 . 2 2 7 7 LYS HB3 H 1 1.829 0.002 . 2 . . 1991 . B 425 LYS HB3 . 34201 1 58 . 2 2 7 7 LYS HG2 H 1 1.462 0.007 . 2 . . 1988 . B 425 LYS HG2 . 34201 1 59 . 2 2 7 7 LYS HG3 H 1 1.462 0.007 . 2 . . 1990 . B 425 LYS HG3 . 34201 1 60 . 2 2 7 7 LYS HD2 H 1 1.560 0.004 . 1 . . 1987 . B 425 LYS HD2 . 34201 1 61 . 2 2 7 7 LYS HD3 H 1 1.560 0.004 . 1 . . 1989 . B 425 LYS HD3 . 34201 1 62 . 2 2 7 7 LYS HE2 H 1 3.075 0.005 . 1 . . 1998 . B 425 LYS HE2 . 34201 1 63 . 2 2 7 7 LYS HE3 H 1 3.075 0.005 . 1 . . 1999 . B 425 LYS HE3 . 34201 1 64 . 2 2 8 8 PRO HA H 1 4.656 0.006 . 1 . . 1376 . B 426 PRO HA . 34201 1 65 . 2 2 8 8 PRO HB2 H 1 2.304 0.007 . 2 . . 1389 . B 426 PRO HB2 . 34201 1 66 . 2 2 8 8 PRO HB3 H 1 2.195 0.004 . 2 . . 1390 . B 426 PRO HB3 . 34201 1 67 . 2 2 8 8 PRO HG2 H 1 1.780 0.0 . 2 . . 1949 . B 426 PRO HG2 . 34201 1 68 . 2 2 8 8 PRO HG3 H 1 1.913 0.004 . 2 . . 1950 . B 426 PRO HG3 . 34201 1 69 . 2 2 8 8 PRO HD2 H 1 4.126 0.003 . 2 . . 1387 . B 426 PRO HD2 . 34201 1 70 . 2 2 8 8 PRO HD3 H 1 4.045 0.006 . 2 . . 1388 . B 426 PRO HD3 . 34201 1 71 . 2 2 9 9 ARG H H 1 8.884 0.007 . 1 . . 1375 . B 427 ARG H . 34201 1 72 . 2 2 9 9 ARG HB2 H 1 1.816 0.0 . 2 . . 1825 . B 427 ARG HB2 . 34201 1 73 . 2 2 9 9 ARG HB3 H 1 1.799 0.008 . 2 . . 1826 . B 427 ARG HB3 . 34201 1 74 . 2 2 9 9 ARG HG2 H 1 1.706 0.006 . 2 . . 1827 . B 427 ARG HG2 . 34201 1 75 . 2 2 9 9 ARG HG3 H 1 1.599 0.003 . 2 . . 1959 . B 427 ARG HG3 . 34201 1 76 . 2 2 9 9 ARG HD2 H 1 3.213 0.003 . 2 . . 1952 . B 427 ARG HD2 . 34201 1 77 . 2 2 9 9 ARG HD3 H 1 3.333 0.002 . 2 . . 1953 . B 427 ARG HD3 . 34201 1 78 . 2 2 10 10 LYS H H 1 8.802 0.003 . 1 . . 1957 . B 428 LYS H . 34201 1 79 . 2 2 10 10 LYS HA H 1 4.551 0.005 . 1 . . 1379 . B 428 LYS HA . 34201 1 80 . 2 2 10 10 LYS HB2 H 1 1.898 0.003 . 2 . . 1985 . B 428 LYS HB2 . 34201 1 81 . 2 2 10 10 LYS HB3 H 1 1.819 0.005 . 2 . . 1986 . B 428 LYS HB3 . 34201 1 82 . 2 2 10 10 LYS HG2 H 1 1.665 0.002 . 1 . . 1992 . B 428 LYS HG2 . 34201 1 83 . 2 2 10 10 LYS HG3 H 1 1.665 0.002 . 1 . . 1993 . B 428 LYS HG3 . 34201 1 84 . 2 2 10 10 LYS HD2 H 1 1.569 0.004 . 1 . . 1994 . B 428 LYS HD2 . 34201 1 85 . 2 2 10 10 LYS HD3 H 1 1.569 0.004 . 1 . . 1995 . B 428 LYS HD3 . 34201 1 86 . 2 2 10 10 LYS HE2 H 1 3.132 0.0 . 2 . . 1996 . B 428 LYS HE2 . 34201 1 87 . 2 2 10 10 LYS HE3 H 1 3.067 0.005 . 2 . . 1997 . B 428 LYS HE3 . 34201 1 88 . 2 2 11 11 LYS H H 1 8.514 0.003 . 1 . . 1824 . B 429 LYS H . 34201 1 89 . 2 2 11 11 LYS HA H 1 4.186 0.004 . 1 . . 1381 . B 429 LYS HA . 34201 1 90 . 2 2 11 11 LYS HB2 H 1 1.532 0.002 . 2 . . 1972 . B 429 LYS HB2 . 34201 1 91 . 2 2 11 11 LYS HB3 H 1 1.826 0.003 . 2 . . 1973 . B 429 LYS HB3 . 34201 1 92 . 2 2 11 11 LYS HG2 H 1 1.438 0.007 . 1 . . 1974 . B 429 LYS HG2 . 34201 1 93 . 2 2 11 11 LYS HG3 H 1 1.438 0.007 . 1 . . 1975 . B 429 LYS HG3 . 34201 1 94 . 2 2 11 11 LYS HD2 H 1 1.621 0.007 . 2 . . 1970 . B 429 LYS HD2 . 34201 1 95 . 2 2 11 11 LYS HD3 H 1 1.622 0.007 . 2 . . 1971 . B 429 LYS HD3 . 34201 1 96 . 2 2 11 11 LYS HE2 H 1 2.967 0.005 . 2 . . 1968 . B 429 LYS HE2 . 34201 1 97 . 2 2 11 11 LYS HE3 H 1 2.910 0.003 . 2 . . 1969 . B 429 LYS HE3 . 34201 1 98 . 2 2 12 12 ALA H H 1 8.545 0.003 . 1 . . 1384 . B 430 ALA H . 34201 1 99 . 2 2 12 12 ALA HA H 1 4.298 0.007 . 1 . . 1383 . B 430 ALA HA . 34201 1 100 . 2 2 12 12 ALA HB1 H 1 1.415 0.005 . 1 . . 1386 . B 430 ALA HB1 . 34201 1 101 . 2 2 12 12 ALA HB2 H 1 1.415 0.005 . 1 . . 1386 . B 430 ALA HB2 . 34201 1 102 . 2 2 12 12 ALA HB3 H 1 1.415 0.005 . 1 . . 1386 . B 430 ALA HB3 . 34201 1 103 . 2 2 13 13 LYS H H 1 8.390 0.004 . 1 . . 1385 . B 431 LYS H . 34201 1 104 . 2 2 13 13 LYS HA H 1 4.323 0.011 . 1 . . 1382 . B 431 LYS HA . 34201 1 105 . 2 2 13 13 LYS HB2 H 1 1.859 0.002 . 2 . . 1976 . B 431 LYS HB2 . 34201 1 106 . 2 2 13 13 LYS HB3 H 1 1.776 0.003 . 2 . . 1977 . B 431 LYS HB3 . 34201 1 107 . 2 2 13 13 LYS HG2 H 1 1.516 0.005 . 2 . . 1982 . B 431 LYS HG2 . 34201 1 108 . 2 2 13 13 LYS HG3 H 1 1.511 . . 2 . . 1983 . B 431 LYS HG3 . 34201 1 109 . 2 2 13 13 LYS HD2 H 1 1.774 . . 1 . . 1978 . B 431 LYS HD2 . 34201 1 110 . 2 2 13 13 LYS HD3 H 1 1.774 . . 1 . . 1979 . B 431 LYS HD3 . 34201 1 111 . 2 2 13 13 LYS HE2 H 1 3.077 0.009 . 2 . . 1980 . B 431 LYS HE2 . 34201 1 112 . 2 2 13 13 LYS HE3 H 1 3.077 0.009 . 2 . . 1981 . B 431 LYS HE3 . 34201 1 113 . 2 2 14 14 ALA H H 1 8.383 0.004 . 1 . . 1380 . B 432 ALA H . 34201 1 114 . 2 2 14 14 ALA HA H 1 4.333 0.005 . 1 . . 1360 . B 432 ALA HA . 34201 1 115 . 2 2 14 14 ALA HB1 H 1 1.368 0.002 . 1 . . 1391 . B 432 ALA HB1 . 34201 1 116 . 2 2 14 14 ALA HB2 H 1 1.368 0.002 . 1 . . 1391 . B 432 ALA HB2 . 34201 1 117 . 2 2 14 14 ALA HB3 H 1 1.368 0.002 . 1 . . 1391 . B 432 ALA HB3 . 34201 1 118 . 2 2 15 15 LEU H H 1 8.296 0.001 . 1 . . 1358 . B 433 LEU H . 34201 1 119 . 2 2 15 15 LEU HA H 1 4.622 0.003 . 1 . . 1359 . B 433 LEU HA . 34201 1 120 . 2 2 15 15 LEU HB2 H 1 1.724 0.003 . 2 . . 1367 . B 433 LEU HB2 . 34201 1 121 . 2 2 15 15 LEU HB3 H 1 1.619 . . 2 . . 1956 . B 433 LEU HB3 . 34201 1 122 . 2 2 15 15 LEU HG H 1 1.596 0.006 . 1 . . 1368 . B 433 LEU HG . 34201 1 123 . 2 2 15 15 LEU HD11 H 1 0.948 0.002 . 2 . . 1650 . B 433 LEU HD11 . 34201 1 124 . 2 2 15 15 LEU HD12 H 1 0.948 0.002 . 2 . . 1650 . B 433 LEU HD12 . 34201 1 125 . 2 2 15 15 LEU HD13 H 1 0.948 0.002 . 2 . . 1650 . B 433 LEU HD13 . 34201 1 126 . 2 2 15 15 LEU HD21 H 1 0.960 0.012 . 2 . . 1823 . B 433 LEU HD21 . 34201 1 127 . 2 2 15 15 LEU HD22 H 1 0.960 0.012 . 2 . . 1823 . B 433 LEU HD22 . 34201 1 128 . 2 2 15 15 LEU HD23 H 1 0.960 0.012 . 2 . . 1823 . B 433 LEU HD23 . 34201 1 129 . 1 1 1 1 GLY HA2 H 1 3.854 0.0 . 2 . . 1901 . A -2 GLY HA2 . 34201 1 130 . 1 1 1 1 GLY HA3 H 1 3.854 0.0 . 2 . . 1704 . A -2 GLY HA3 . 34201 1 131 . 1 1 1 1 GLY C C 13 169.983 . . 1 . . 2126 . A -2 GLY C . 34201 1 132 . 1 1 1 1 GLY CA C 13 43.357 0.003 . 1 . . 1705 . A -2 GLY CA . 34201 1 133 . 1 1 2 2 ALA H H 1 8.701 0.001 . 1 . . 943 . A -1 ALA H . 34201 1 134 . 1 1 2 2 ALA HA H 1 4.363 0.001 . 1 . . 1700 . A -1 ALA HA . 34201 1 135 . 1 1 2 2 ALA HB1 H 1 1.371 0.003 . 1 . . 1701 . A -1 ALA HB1 . 34201 1 136 . 1 1 2 2 ALA HB2 H 1 1.371 0.003 . 1 . . 1701 . A -1 ALA HB2 . 34201 1 137 . 1 1 2 2 ALA HB3 H 1 1.371 0.003 . 1 . . 1701 . A -1 ALA HB3 . 34201 1 138 . 1 1 2 2 ALA C C 13 177.750 . . 1 . . 2073 . A -1 ALA C . 34201 1 139 . 1 1 2 2 ALA CA C 13 52.595 0.021 . 1 . . 1702 . A -1 ALA CA . 34201 1 140 . 1 1 2 2 ALA CB C 13 19.452 0.015 . 1 . . 1703 . A -1 ALA CB . 34201 1 141 . 1 1 2 2 ALA N N 15 123.981 0.007 . 1 . . 944 . A -1 ALA N . 34201 1 142 . 1 1 3 3 MET H H 1 8.548 0.001 . 1 . . 2 . A 0 MET H . 34201 1 143 . 1 1 3 3 MET HA H 1 4.493 0.002 . 1 . . 1690 . A 0 MET HA . 34201 1 144 . 1 1 3 3 MET HB2 H 1 2.007 0.001 . 2 . . 1695 . A 0 MET HB2 . 34201 1 145 . 1 1 3 3 MET HB3 H 1 2.084 0.001 . 2 . . 1697 . A 0 MET HB3 . 34201 1 146 . 1 1 3 3 MET HG2 H 1 2.585 0.001 . 2 . . 1693 . A 0 MET HG2 . 34201 1 147 . 1 1 3 3 MET HG3 H 1 2.521 0.001 . 2 . . 1694 . A 0 MET HG3 . 34201 1 148 . 1 1 3 3 MET HE1 H 1 2.054 0.001 . 1 . . 1699 . A 0 MET HE1 . 34201 1 149 . 1 1 3 3 MET HE2 H 1 2.054 0.001 . 1 . . 1699 . A 0 MET HE2 . 34201 1 150 . 1 1 3 3 MET HE3 H 1 2.054 0.001 . 1 . . 1699 . A 0 MET HE3 . 34201 1 151 . 1 1 3 3 MET C C 13 176.475 . . 1 . . 2019 . A 0 MET C . 34201 1 152 . 1 1 3 3 MET CA C 13 55.523 0.026 . 1 . . 1691 . A 0 MET CA . 34201 1 153 . 1 1 3 3 MET CB C 13 32.990 0.019 . 1 . . 1696 . A 0 MET CB . 34201 1 154 . 1 1 3 3 MET CG C 13 32.140 0.03 . 1 . . 1692 . A 0 MET CG . 34201 1 155 . 1 1 3 3 MET CE C 13 17.025 0.009 . 1 . . 1698 . A 0 MET CE . 34201 1 156 . 1 1 3 3 MET N N 15 119.813 0.014 . 1 . . 3 . A 0 MET N . 34201 1 157 . 1 1 4 4 GLY H H 1 8.317 0.002 . 1 . . 9 . A 1 GLY H . 34201 1 158 . 1 1 4 4 GLY HA2 H 1 3.952 0.009 . 2 . . 1687 . A 1 GLY HA2 . 34201 1 159 . 1 1 4 4 GLY HA3 H 1 4.014 0.007 . 2 . . 1689 . A 1 GLY HA3 . 34201 1 160 . 1 1 4 4 GLY C C 13 173.740 . . 1 . . 2033 . A 1 GLY C . 34201 1 161 . 1 1 4 4 GLY CA C 13 45.093 0.041 . 1 . . 1688 . A 1 GLY CA . 34201 1 162 . 1 1 4 4 GLY N N 15 109.774 0.011 . 1 . . 10 . A 1 GLY N . 34201 1 163 . 1 1 5 5 SER H H 1 8.162 0.002 . 1 . . 442 . A 2 SER H . 34201 1 164 . 1 1 5 5 SER HA H 1 4.448 0.004 . 1 . . 1107 . A 2 SER HA . 34201 1 165 . 1 1 5 5 SER HB2 H 1 3.907 0.003 . 2 . . 1109 . A 2 SER HB2 . 34201 1 166 . 1 1 5 5 SER HB3 H 1 3.907 0.003 . 2 . . 1902 . A 2 SER HB3 . 34201 1 167 . 1 1 5 5 SER C C 13 174.608 . . 1 . . 2163 . A 2 SER C . 34201 1 168 . 1 1 5 5 SER CA C 13 58.252 0.054 . 1 . . 1108 . A 2 SER CA . 34201 1 169 . 1 1 5 5 SER CB C 13 63.915 0.026 . 1 . . 1110 . A 2 SER CB . 34201 1 170 . 1 1 5 5 SER N N 15 115.279 0.012 . 1 . . 441 . A 2 SER N . 34201 1 171 . 1 1 6 6 ILE H H 1 5.576 0.004 . 1 . . 1501 . A 3 ILE H . 34201 1 172 . 1 1 6 6 ILE HA H 1 3.378 0.005 . 1 . . 116 . A 3 ILE HA . 34201 1 173 . 1 1 6 6 ILE HB H 1 -0.028 0.011 . 1 . . 113 . A 3 ILE HB . 34201 1 174 . 1 1 6 6 ILE HG12 H 1 0.643 0.002 . 2 . . 114 . A 3 ILE HG12 . 34201 1 175 . 1 1 6 6 ILE HG13 H 1 0.353 0.004 . 2 . . 1748 . A 3 ILE HG13 . 34201 1 176 . 1 1 6 6 ILE HG21 H 1 0.509 0.002 . 1 . . 115 . A 3 ILE HG21 . 34201 1 177 . 1 1 6 6 ILE HG22 H 1 0.509 0.002 . 1 . . 115 . A 3 ILE HG22 . 34201 1 178 . 1 1 6 6 ILE HG23 H 1 0.509 0.002 . 1 . . 115 . A 3 ILE HG23 . 34201 1 179 . 1 1 6 6 ILE HD11 H 1 0.312 0.001 . 1 . . 112 . A 3 ILE HD11 . 34201 1 180 . 1 1 6 6 ILE HD12 H 1 0.312 0.001 . 1 . . 112 . A 3 ILE HD12 . 34201 1 181 . 1 1 6 6 ILE HD13 H 1 0.312 0.001 . 1 . . 112 . A 3 ILE HD13 . 34201 1 182 . 1 1 6 6 ILE C C 13 174.485 . . 1 . . 2037 . A 3 ILE C . 34201 1 183 . 1 1 6 6 ILE CA C 13 61.749 0.03 . 1 . . 673 . A 3 ILE CA . 34201 1 184 . 1 1 6 6 ILE CB C 13 36.409 0.049 . 1 . . 670 . A 3 ILE CB . 34201 1 185 . 1 1 6 6 ILE CG1 C 13 27.386 0.047 . 1 . . 1747 . A 3 ILE CG1 . 34201 1 186 . 1 1 6 6 ILE CG2 C 13 19.286 0.019 . 1 . . 369 . A 3 ILE CG2 . 34201 1 187 . 1 1 6 6 ILE CD1 C 13 10.719 0.012 . 1 . . 414 . A 3 ILE CD1 . 34201 1 188 . 1 1 6 6 ILE N N 15 121.758 0.034 . 1 . . 1502 . A 3 ILE N . 34201 1 189 . 1 1 7 7 VAL H H 1 6.000 0.003 . 1 . . 462 . A 4 VAL H . 34201 1 190 . 1 1 7 7 VAL HA H 1 5.082 0.003 . 1 . . 195 . A 4 VAL HA . 34201 1 191 . 1 1 7 7 VAL HB H 1 1.664 0.004 . 1 . . 196 . A 4 VAL HB . 34201 1 192 . 1 1 7 7 VAL HG11 H 1 0.987 0.003 . 2 . . 197 . A 4 VAL HG11 . 34201 1 193 . 1 1 7 7 VAL HG12 H 1 0.987 0.003 . 2 . . 197 . A 4 VAL HG12 . 34201 1 194 . 1 1 7 7 VAL HG13 H 1 0.987 0.003 . 2 . . 197 . A 4 VAL HG13 . 34201 1 195 . 1 1 7 7 VAL HG21 H 1 0.707 0.002 . 2 . . 198 . A 4 VAL HG21 . 34201 1 196 . 1 1 7 7 VAL HG22 H 1 0.707 0.002 . 2 . . 198 . A 4 VAL HG22 . 34201 1 197 . 1 1 7 7 VAL HG23 H 1 0.707 0.002 . 2 . . 198 . A 4 VAL HG23 . 34201 1 198 . 1 1 7 7 VAL C C 13 175.186 . . 1 . . 2083 . A 4 VAL C . 34201 1 199 . 1 1 7 7 VAL CA C 13 60.230 0.024 . 1 . . 674 . A 4 VAL CA . 34201 1 200 . 1 1 7 7 VAL CB C 13 33.614 0.04 . 1 . . 1500 . A 4 VAL CB . 34201 1 201 . 1 1 7 7 VAL CG1 C 13 21.343 0.03 . 2 . . 675 . A 4 VAL CG1 . 34201 1 202 . 1 1 7 7 VAL CG2 C 13 22.752 0.044 . 2 . . 892 . A 4 VAL CG2 . 34201 1 203 . 1 1 7 7 VAL N N 15 115.922 0.01 . 1 . . 461 . A 4 VAL N . 34201 1 204 . 1 1 8 8 SER H H 1 8.801 0.003 . 1 . . 518 . A 5 SER H . 34201 1 205 . 1 1 8 8 SER HA H 1 4.968 0.005 . 1 . . 98 . A 5 SER HA . 34201 1 206 . 1 1 8 8 SER HB2 H 1 3.856 0.002 . 2 . . 99 . A 5 SER HB2 . 34201 1 207 . 1 1 8 8 SER HB3 H 1 3.719 0.003 . 2 . . 100 . A 5 SER HB3 . 34201 1 208 . 1 1 8 8 SER C C 13 173.911 . . 1 . . 2149 . A 5 SER C . 34201 1 209 . 1 1 8 8 SER CA C 13 56.476 0.042 . 1 . . 677 . A 5 SER CA . 34201 1 210 . 1 1 8 8 SER CB C 13 65.285 0.027 . 1 . . 676 . A 5 SER CB . 34201 1 211 . 1 1 8 8 SER N N 15 120.700 0.014 . 1 . . 517 . A 5 SER N . 34201 1 212 . 1 1 9 9 LEU H H 1 9.543 0.002 . 1 . . 1015 . A 6 LEU H . 34201 1 213 . 1 1 9 9 LEU HA H 1 4.444 0.005 . 1 . . 1018 . A 6 LEU HA . 34201 1 214 . 1 1 9 9 LEU HB2 H 1 1.818 0.003 . 2 . . 1021 . A 6 LEU HB2 . 34201 1 215 . 1 1 9 9 LEU HB3 H 1 1.711 0.005 . 2 . . 1023 . A 6 LEU HB3 . 34201 1 216 . 1 1 9 9 LEU HG H 1 1.781 0.005 . 1 . . 1024 . A 6 LEU HG . 34201 1 217 . 1 1 9 9 LEU HD11 H 1 1.122 0.001 . 2 . . 1017 . A 6 LEU HD11 . 34201 1 218 . 1 1 9 9 LEU HD12 H 1 1.122 0.001 . 2 . . 1017 . A 6 LEU HD12 . 34201 1 219 . 1 1 9 9 LEU HD13 H 1 1.122 0.001 . 2 . . 1017 . A 6 LEU HD13 . 34201 1 220 . 1 1 9 9 LEU HD21 H 1 1.024 0.001 . 2 . . 1020 . A 6 LEU HD21 . 34201 1 221 . 1 1 9 9 LEU HD22 H 1 1.024 0.001 . 2 . . 1020 . A 6 LEU HD22 . 34201 1 222 . 1 1 9 9 LEU HD23 H 1 1.024 0.001 . 2 . . 1020 . A 6 LEU HD23 . 34201 1 223 . 1 1 9 9 LEU C C 13 175.796 . . 1 . . 2135 . A 6 LEU C . 34201 1 224 . 1 1 9 9 LEU CA C 13 56.158 0.037 . 1 . . 1019 . A 6 LEU CA . 34201 1 225 . 1 1 9 9 LEU CB C 13 42.914 0.066 . 1 . . 1022 . A 6 LEU CB . 34201 1 226 . 1 1 9 9 LEU CG C 13 27.502 0.043 . 1 . . 1025 . A 6 LEU CG . 34201 1 227 . 1 1 9 9 LEU CD1 C 13 24.977 0.018 . 2 . . 1027 . A 6 LEU CD1 . 34201 1 228 . 1 1 9 9 LEU CD2 C 13 25.436 0.024 . 2 . . 1026 . A 6 LEU CD2 . 34201 1 229 . 1 1 9 9 LEU N N 15 127.686 0.012 . 1 . . 1016 . A 6 LEU N . 34201 1 230 . 1 1 10 10 LEU H H 1 8.951 0.005 . 1 . . 424 . A 7 LEU H . 34201 1 231 . 1 1 10 10 LEU HA H 1 4.680 0.002 . 1 . . 271 . A 7 LEU HA . 34201 1 232 . 1 1 10 10 LEU HB2 H 1 1.567 0.003 . 2 . . 273 . A 7 LEU HB2 . 34201 1 233 . 1 1 10 10 LEU HB3 H 1 1.393 0.002 . 2 . . 274 . A 7 LEU HB3 . 34201 1 234 . 1 1 10 10 LEU HG H 1 1.671 0.006 . 1 . . 272 . A 7 LEU HG . 34201 1 235 . 1 1 10 10 LEU HD11 H 1 0.870 0.002 . 2 . . 270 . A 7 LEU HD11 . 34201 1 236 . 1 1 10 10 LEU HD12 H 1 0.870 0.002 . 2 . . 270 . A 7 LEU HD12 . 34201 1 237 . 1 1 10 10 LEU HD13 H 1 0.870 0.002 . 2 . . 270 . A 7 LEU HD13 . 34201 1 238 . 1 1 10 10 LEU HD21 H 1 0.886 0.001 . 2 . . 275 . A 7 LEU HD21 . 34201 1 239 . 1 1 10 10 LEU HD22 H 1 0.886 0.001 . 2 . . 275 . A 7 LEU HD22 . 34201 1 240 . 1 1 10 10 LEU HD23 H 1 0.886 0.001 . 2 . . 275 . A 7 LEU HD23 . 34201 1 241 . 1 1 10 10 LEU C C 13 177.745 . . 1 . . 2015 . A 7 LEU C . 34201 1 242 . 1 1 10 10 LEU CA C 13 55.493 0.071 . 1 . . 678 . A 7 LEU CA . 34201 1 243 . 1 1 10 10 LEU CB C 13 42.981 0.052 . 1 . . 1830 . A 7 LEU CB . 34201 1 244 . 1 1 10 10 LEU CG C 13 27.540 0.073 . 1 . . 1831 . A 7 LEU CG . 34201 1 245 . 1 1 10 10 LEU CD1 C 13 22.592 0.038 . 2 . . 680 . A 7 LEU CD1 . 34201 1 246 . 1 1 10 10 LEU CD2 C 13 26.600 0.015 . 2 . . 679 . A 7 LEU CD2 . 34201 1 247 . 1 1 10 10 LEU N N 15 125.605 0.022 . 1 . . 423 . A 7 LEU N . 34201 1 248 . 1 1 11 11 GLY H H 1 7.867 0.002 . 1 . . 485 . A 8 GLY H . 34201 1 249 . 1 1 11 11 GLY HA2 H 1 4.164 0.007 . 2 . . 682 . A 8 GLY HA2 . 34201 1 250 . 1 1 11 11 GLY HA3 H 1 4.068 0.004 . 2 . . 683 . A 8 GLY HA3 . 34201 1 251 . 1 1 11 11 GLY C C 13 170.701 . . 1 . . 2080 . A 8 GLY C . 34201 1 252 . 1 1 11 11 GLY CA C 13 46.584 0.048 . 1 . . 681 . A 8 GLY CA . 34201 1 253 . 1 1 11 11 GLY N N 15 106.105 0.015 . 1 . . 484 . A 8 GLY N . 34201 1 254 . 1 1 12 12 ILE H H 1 8.326 0.003 . 1 . . 505 . A 9 ILE H . 34201 1 255 . 1 1 12 12 ILE HA H 1 4.785 0.0 . 1 . . 337 . A 9 ILE HA . 34201 1 256 . 1 1 12 12 ILE HB H 1 1.812 0.004 . 1 . . 109 . A 9 ILE HB . 34201 1 257 . 1 1 12 12 ILE HG12 H 1 1.688 0.002 . 2 . . 147 . A 9 ILE HG12 . 34201 1 258 . 1 1 12 12 ILE HG13 H 1 1.036 0.003 . 2 . . 148 . A 9 ILE HG13 . 34201 1 259 . 1 1 12 12 ILE HG21 H 1 0.827 0.002 . 1 . . 149 . A 9 ILE HG21 . 34201 1 260 . 1 1 12 12 ILE HG22 H 1 0.827 0.002 . 1 . . 149 . A 9 ILE HG22 . 34201 1 261 . 1 1 12 12 ILE HG23 H 1 0.827 0.002 . 1 . . 149 . A 9 ILE HG23 . 34201 1 262 . 1 1 12 12 ILE HD11 H 1 0.948 0.003 . 1 . . 1347 . A 9 ILE HD11 . 34201 1 263 . 1 1 12 12 ILE HD12 H 1 0.948 0.003 . 1 . . 1347 . A 9 ILE HD12 . 34201 1 264 . 1 1 12 12 ILE HD13 H 1 0.948 0.003 . 1 . . 1347 . A 9 ILE HD13 . 34201 1 265 . 1 1 12 12 ILE C C 13 174.857 . . 1 . . 2151 . A 9 ILE C . 34201 1 266 . 1 1 12 12 ILE CA C 13 61.131 . . 1 . . 2164 . A 9 ILE CA . 34201 1 267 . 1 1 12 12 ILE CB C 13 41.345 0.032 . 1 . . 686 . A 9 ILE CB . 34201 1 268 . 1 1 12 12 ILE CG1 C 13 28.334 0.038 . 1 . . 685 . A 9 ILE CG1 . 34201 1 269 . 1 1 12 12 ILE CG2 C 13 17.990 0.029 . 1 . . 684 . A 9 ILE CG2 . 34201 1 270 . 1 1 12 12 ILE CD1 C 13 14.919 0.023 . 1 . . 1403 . A 9 ILE CD1 . 34201 1 271 . 1 1 12 12 ILE N N 15 120.334 0.015 . 1 . . 504 . A 9 ILE N . 34201 1 272 . 1 1 13 13 LYS H H 1 9.066 0.002 . 1 . . 386 . A 10 LYS H . 34201 1 273 . 1 1 13 13 LYS HA H 1 4.790 0.0 . 1 . . 1398 . A 10 LYS HA . 34201 1 274 . 1 1 13 13 LYS HB2 H 1 1.790 0.004 . 2 . . 1392 . A 10 LYS HB2 . 34201 1 275 . 1 1 13 13 LYS HB3 H 1 1.642 0.003 . 2 . . 1395 . A 10 LYS HB3 . 34201 1 276 . 1 1 13 13 LYS HG2 H 1 1.200 0.001 . 2 . . 1393 . A 10 LYS HG2 . 34201 1 277 . 1 1 13 13 LYS HG3 H 1 1.415 0.004 . 2 . . 1396 . A 10 LYS HG3 . 34201 1 278 . 1 1 13 13 LYS HD2 H 1 1.622 0.002 . 2 . . 1400 . A 10 LYS HD2 . 34201 1 279 . 1 1 13 13 LYS HD3 H 1 1.622 0.002 . 2 . . 1903 . A 10 LYS HD3 . 34201 1 280 . 1 1 13 13 LYS HE2 H 1 2.922 0.001 . 2 . . 1397 . A 10 LYS HE2 . 34201 1 281 . 1 1 13 13 LYS HE3 H 1 2.922 0.001 . 2 . . 1904 . A 10 LYS HE3 . 34201 1 282 . 1 1 13 13 LYS C C 13 175.339 . . 1 . . 2146 . A 10 LYS C . 34201 1 283 . 1 1 13 13 LYS CA C 13 53.946 . . 1 . . 2165 . A 10 LYS CA . 34201 1 284 . 1 1 13 13 LYS CB C 13 35.546 0.026 . 1 . . 1394 . A 10 LYS CB . 34201 1 285 . 1 1 13 13 LYS CG C 13 24.900 0.013 . 1 . . 1399 . A 10 LYS CG . 34201 1 286 . 1 1 13 13 LYS CD C 13 29.399 0.019 . 1 . . 1401 . A 10 LYS CD . 34201 1 287 . 1 1 13 13 LYS CE C 13 42.093 0.015 . 1 . . 1402 . A 10 LYS CE . 34201 1 288 . 1 1 13 13 LYS N N 15 128.209 0.018 . 1 . . 385 . A 10 LYS N . 34201 1 289 . 1 1 14 14 VAL H H 1 9.018 0.002 . 1 . . 444 . A 11 VAL H . 34201 1 290 . 1 1 14 14 VAL HA H 1 3.965 0.009 . 1 . . 170 . A 11 VAL HA . 34201 1 291 . 1 1 14 14 VAL HB H 1 1.867 0.002 . 1 . . 172 . A 11 VAL HB . 34201 1 292 . 1 1 14 14 VAL HG11 H 1 0.613 0.002 . 2 . . 171 . A 11 VAL HG11 . 34201 1 293 . 1 1 14 14 VAL HG12 H 1 0.613 0.002 . 2 . . 171 . A 11 VAL HG12 . 34201 1 294 . 1 1 14 14 VAL HG13 H 1 0.613 0.002 . 2 . . 171 . A 11 VAL HG13 . 34201 1 295 . 1 1 14 14 VAL HG21 H 1 0.607 0.002 . 2 . . 173 . A 11 VAL HG21 . 34201 1 296 . 1 1 14 14 VAL HG22 H 1 0.607 0.002 . 2 . . 173 . A 11 VAL HG22 . 34201 1 297 . 1 1 14 14 VAL HG23 H 1 0.607 0.002 . 2 . . 173 . A 11 VAL HG23 . 34201 1 298 . 1 1 14 14 VAL C C 13 175.966 . . 1 . . 2145 . A 11 VAL C . 34201 1 299 . 1 1 14 14 VAL CA C 13 62.361 0.041 . 1 . . 687 . A 11 VAL CA . 34201 1 300 . 1 1 14 14 VAL CB C 13 30.876 0.049 . 1 . . 688 . A 11 VAL CB . 34201 1 301 . 1 1 14 14 VAL CG1 C 13 22.532 0.025 . 2 . . 690 . A 11 VAL CG1 . 34201 1 302 . 1 1 14 14 VAL CG2 C 13 20.881 0.04 . 2 . . 689 . A 11 VAL CG2 . 34201 1 303 . 1 1 14 14 VAL N N 15 127.321 0.016 . 1 . . 443 . A 11 VAL N . 34201 1 304 . 1 1 15 15 LEU H H 1 8.301 0.003 . 1 . . 493 . A 12 LEU H . 34201 1 305 . 1 1 15 15 LEU HA H 1 4.199 0.005 . 1 . . 295 . A 12 LEU HA . 34201 1 306 . 1 1 15 15 LEU HB2 H 1 1.594 0.0 . 2 . . 296 . A 12 LEU HB2 . 34201 1 307 . 1 1 15 15 LEU HB3 H 1 1.353 0.002 . 2 . . 298 . A 12 LEU HB3 . 34201 1 308 . 1 1 15 15 LEU HD11 H 1 0.712 0.005 . 2 . . 294 . A 12 LEU HD11 . 34201 1 309 . 1 1 15 15 LEU HD12 H 1 0.712 0.005 . 2 . . 294 . A 12 LEU HD12 . 34201 1 310 . 1 1 15 15 LEU HD13 H 1 0.712 0.005 . 2 . . 294 . A 12 LEU HD13 . 34201 1 311 . 1 1 15 15 LEU HD21 H 1 0.769 0.002 . 2 . . 297 . A 12 LEU HD21 . 34201 1 312 . 1 1 15 15 LEU HD22 H 1 0.769 0.002 . 2 . . 297 . A 12 LEU HD22 . 34201 1 313 . 1 1 15 15 LEU HD23 H 1 0.769 0.002 . 2 . . 297 . A 12 LEU HD23 . 34201 1 314 . 1 1 15 15 LEU C C 13 176.342 . . 1 . . 2043 . A 12 LEU C . 34201 1 315 . 1 1 15 15 LEU CA C 13 55.670 0.071 . 1 . . 691 . A 12 LEU CA . 34201 1 316 . 1 1 15 15 LEU CB C 13 41.591 0.055 . 1 . . 692 . A 12 LEU CB . 34201 1 317 . 1 1 15 15 LEU CD1 C 13 22.302 0.034 . 2 . . 1349 . A 12 LEU CD1 . 34201 1 318 . 1 1 15 15 LEU CD2 C 13 25.697 0.029 . 2 . . 1348 . A 12 LEU CD2 . 34201 1 319 . 1 1 15 15 LEU N N 15 127.696 0.019 . 1 . . 492 . A 12 LEU N . 34201 1 320 . 1 1 16 16 ASN H H 1 8.443 0.002 . 1 . . 549 . A 13 ASN H . 34201 1 321 . 1 1 16 16 ASN HA H 1 4.591 0.006 . 1 . . 699 . A 13 ASN HA . 34201 1 322 . 1 1 16 16 ASN HB2 H 1 2.564 0.011 . 2 . . 701 . A 13 ASN HB2 . 34201 1 323 . 1 1 16 16 ASN HB3 H 1 2.602 0.003 . 2 . . 702 . A 13 ASN HB3 . 34201 1 324 . 1 1 16 16 ASN HD21 H 1 7.715 0.005 . 1 . . 1414 . A 13 ASN HD21 . 34201 1 325 . 1 1 16 16 ASN HD22 H 1 7.173 0.004 . 1 . . 1416 . A 13 ASN HD22 . 34201 1 326 . 1 1 16 16 ASN C C 13 172.185 . . 1 . . 2068 . A 13 ASN C . 34201 1 327 . 1 1 16 16 ASN CA C 13 52.300 0.031 . 1 . . 700 . A 13 ASN CA . 34201 1 328 . 1 1 16 16 ASN CB C 13 36.630 0.065 . 1 . . 703 . A 13 ASN CB . 34201 1 329 . 1 1 16 16 ASN N N 15 116.263 0.017 . 1 . . 548 . A 13 ASN N . 34201 1 330 . 1 1 16 16 ASN ND2 N 15 113.313 0.018 . 1 . . 1415 . A 13 ASN ND2 . 34201 1 331 . 1 1 17 17 ASN H H 1 8.169 0.002 . 1 . . 577 . A 14 ASN H . 34201 1 332 . 1 1 17 17 ASN HA H 1 4.748 0.0 . 1 . . 1089 . A 14 ASN HA . 34201 1 333 . 1 1 17 17 ASN HB2 H 1 2.190 0.001 . 2 . . 1087 . A 14 ASN HB2 . 34201 1 334 . 1 1 17 17 ASN HB3 H 1 2.719 0.007 . 2 . . 1088 . A 14 ASN HB3 . 34201 1 335 . 1 1 17 17 ASN HD21 H 1 8.104 0.004 . 1 . . 1878 . A 14 ASN HD21 . 34201 1 336 . 1 1 17 17 ASN HD22 H 1 8.271 0.007 . 1 . . 1879 . A 14 ASN HD22 . 34201 1 337 . 1 1 17 17 ASN CA C 13 50.704 . . 1 . . 1503 . A 14 ASN CA . 34201 1 338 . 1 1 17 17 ASN CB C 13 42.751 0.052 . 1 . . 1086 . A 14 ASN CB . 34201 1 339 . 1 1 17 17 ASN N N 15 119.677 0.026 . 1 . . 576 . A 14 ASN N . 34201 1 340 . 1 1 17 17 ASN ND2 N 15 117.817 0.013 . 1 . . 1880 . A 14 ASN ND2 . 34201 1 341 . 1 1 18 18 PRO HA H 1 5.151 0.003 . 1 . . 1305 . A 15 PRO HA . 34201 1 342 . 1 1 18 18 PRO HB2 H 1 2.422 0.003 . 2 . . 1304 . A 15 PRO HB2 . 34201 1 343 . 1 1 18 18 PRO HB3 H 1 1.978 0.006 . 2 . . 1307 . A 15 PRO HB3 . 34201 1 344 . 1 1 18 18 PRO HG2 H 1 1.810 0.002 . 2 . . 1309 . A 15 PRO HG2 . 34201 1 345 . 1 1 18 18 PRO HG3 H 1 1.781 0.003 . 2 . . 1311 . A 15 PRO HG3 . 34201 1 346 . 1 1 18 18 PRO HD2 H 1 3.554 0.0 . 2 . . 1312 . A 15 PRO HD2 . 34201 1 347 . 1 1 18 18 PRO HD3 H 1 3.526 0.005 . 2 . . 1314 . A 15 PRO HD3 . 34201 1 348 . 1 1 18 18 PRO C C 13 174.921 . . 1 . . 2096 . A 15 PRO C . 34201 1 349 . 1 1 18 18 PRO CA C 13 63.963 0.071 . 1 . . 1308 . A 15 PRO CA . 34201 1 350 . 1 1 18 18 PRO CB C 13 35.610 0.023 . 1 . . 1306 . A 15 PRO CB . 34201 1 351 . 1 1 18 18 PRO CG C 13 25.248 0.021 . 1 . . 1310 . A 15 PRO CG . 34201 1 352 . 1 1 18 18 PRO CD C 13 50.535 0.043 . 1 . . 1313 . A 15 PRO CD . 34201 1 353 . 1 1 19 19 ALA H H 1 8.712 0.002 . 1 . . 503 . A 16 ALA H . 34201 1 354 . 1 1 19 19 ALA HA H 1 4.673 0.005 . 1 . . 158 . A 16 ALA HA . 34201 1 355 . 1 1 19 19 ALA HB1 H 1 1.514 0.002 . 1 . . 159 . A 16 ALA HB1 . 34201 1 356 . 1 1 19 19 ALA HB2 H 1 1.514 0.002 . 1 . . 159 . A 16 ALA HB2 . 34201 1 357 . 1 1 19 19 ALA HB3 H 1 1.514 0.002 . 1 . . 159 . A 16 ALA HB3 . 34201 1 358 . 1 1 19 19 ALA C C 13 176.209 . . 1 . . 2055 . A 16 ALA C . 34201 1 359 . 1 1 19 19 ALA CA C 13 51.455 0.03 . 1 . . 693 . A 16 ALA CA . 34201 1 360 . 1 1 19 19 ALA CB C 13 22.297 0.02 . 1 . . 694 . A 16 ALA CB . 34201 1 361 . 1 1 19 19 ALA N N 15 121.703 0.026 . 1 . . 502 . A 16 ALA N . 34201 1 362 . 1 1 20 20 LYS H H 1 8.301 0.002 . 1 . . 640 . A 17 LYS H . 34201 1 363 . 1 1 20 20 LYS HA H 1 4.632 0.008 . 1 . . 314 . A 17 LYS HA . 34201 1 364 . 1 1 20 20 LYS HB2 H 1 1.543 0.0 . 2 . . 311 . A 17 LYS HB2 . 34201 1 365 . 1 1 20 20 LYS HB3 H 1 2.147 0.001 . 2 . . 313 . A 17 LYS HB3 . 34201 1 366 . 1 1 20 20 LYS HG2 H 1 1.626 0.003 . 2 . . 317 . A 17 LYS HG2 . 34201 1 367 . 1 1 20 20 LYS HG3 H 1 1.495 0.006 . 2 . . 318 . A 17 LYS HG3 . 34201 1 368 . 1 1 20 20 LYS HD2 H 1 1.687 0.003 . 2 . . 316 . A 17 LYS HD2 . 34201 1 369 . 1 1 20 20 LYS HD3 H 1 1.687 0.003 . 2 . . 1905 . A 17 LYS HD3 . 34201 1 370 . 1 1 20 20 LYS HE2 H 1 3.024 0.011 . 2 . . 310 . A 17 LYS HE2 . 34201 1 371 . 1 1 20 20 LYS HE3 H 1 2.986 0.011 . 2 . . 312 . A 17 LYS HE3 . 34201 1 372 . 1 1 20 20 LYS C C 13 178.086 . . 1 . . 2091 . A 17 LYS C . 34201 1 373 . 1 1 20 20 LYS CA C 13 56.488 0.053 . 1 . . 696 . A 17 LYS CA . 34201 1 374 . 1 1 20 20 LYS CB C 13 31.963 0.015 . 1 . . 695 . A 17 LYS CB . 34201 1 375 . 1 1 20 20 LYS CG C 13 24.595 0.014 . 1 . . 319 . A 17 LYS CG . 34201 1 376 . 1 1 20 20 LYS CD C 13 28.387 0.028 . 1 . . 698 . A 17 LYS CD . 34201 1 377 . 1 1 20 20 LYS CE C 13 41.574 0.025 . 1 . . 697 . A 17 LYS CE . 34201 1 378 . 1 1 20 20 LYS N N 15 118.377 0.011 . 1 . . 639 . A 17 LYS N . 34201 1 379 . 1 1 21 21 PHE H H 1 8.401 0.003 . 1 . . 422 . A 18 PHE H . 34201 1 380 . 1 1 21 21 PHE HA H 1 3.692 0.0 . 1 . . 1838 . A 18 PHE HA . 34201 1 381 . 1 1 21 21 PHE HB2 H 1 3.121 0.0 . 2 . . 1836 . A 18 PHE HB2 . 34201 1 382 . 1 1 21 21 PHE HB3 H 1 2.915 . . 2 . . 1837 . A 18 PHE HB3 . 34201 1 383 . 1 1 21 21 PHE HD1 H 1 6.991 0.004 . 1 . . 1669 . A 18 PHE HD1 . 34201 1 384 . 1 1 21 21 PHE HD2 H 1 6.991 0.004 . 1 . . 1669 . A 18 PHE HD2 . 34201 1 385 . 1 1 21 21 PHE HE1 H 1 7.189 0.004 . 1 . . 1670 . A 18 PHE HE1 . 34201 1 386 . 1 1 21 21 PHE HE2 H 1 7.189 0.004 . 1 . . 1670 . A 18 PHE HE2 . 34201 1 387 . 1 1 21 21 PHE HZ H 1 6.908 0.001 . 1 . . 1672 . A 18 PHE HZ . 34201 1 388 . 1 1 21 21 PHE C C 13 175.387 . . 1 . . 2130 . A 18 PHE C . 34201 1 389 . 1 1 21 21 PHE CA C 13 61.926 0.0 . 1 . . 1839 . A 18 PHE CA . 34201 1 390 . 1 1 21 21 PHE CB C 13 40.555 . . 1 . . 1840 . A 18 PHE CB . 34201 1 391 . 1 1 21 21 PHE CD1 C 13 132.494 0.044 . 1 . . 1671 . A 18 PHE CD1 . 34201 1 392 . 1 1 21 21 PHE CD2 C 13 132.494 0.044 . 1 . . 1671 . A 18 PHE CD2 . 34201 1 393 . 1 1 21 21 PHE CE1 C 13 131.121 0.028 . 1 . . 1675 . A 18 PHE CE1 . 34201 1 394 . 1 1 21 21 PHE CE2 C 13 131.121 0.028 . 1 . . 1675 . A 18 PHE CE2 . 34201 1 395 . 1 1 21 21 PHE CZ C 13 129.783 0.02 . 1 . . 1673 . A 18 PHE CZ . 34201 1 396 . 1 1 21 21 PHE N N 15 121.379 0.025 . 1 . . 421 . A 18 PHE N . 34201 1 397 . 1 1 22 22 THR H H 1 7.292 0.002 . 1 . . 483 . A 19 THR H . 34201 1 398 . 1 1 22 22 THR HA H 1 4.024 0.004 . 1 . . 84 . A 19 THR HA . 34201 1 399 . 1 1 22 22 THR HB H 1 4.642 0.003 . 1 . . 83 . A 19 THR HB . 34201 1 400 . 1 1 22 22 THR HG21 H 1 1.348 0.002 . 1 . . 85 . A 19 THR HG21 . 34201 1 401 . 1 1 22 22 THR HG22 H 1 1.348 0.002 . 1 . . 85 . A 19 THR HG22 . 34201 1 402 . 1 1 22 22 THR HG23 H 1 1.348 0.002 . 1 . . 85 . A 19 THR HG23 . 34201 1 403 . 1 1 22 22 THR C C 13 174.405 . . 1 . . 2124 . A 19 THR C . 34201 1 404 . 1 1 22 22 THR CA C 13 61.191 0.045 . 1 . . 704 . A 19 THR CA . 34201 1 405 . 1 1 22 22 THR CB C 13 68.952 0.038 . 1 . . 705 . A 19 THR CB . 34201 1 406 . 1 1 22 22 THR CG2 C 13 22.003 0.036 . 1 . . 1686 . A 19 THR CG2 . 34201 1 407 . 1 1 22 22 THR N N 15 98.710 0.024 . 1 . . 1090 . A 19 THR N . 34201 1 408 . 1 1 23 23 ASP H H 1 7.455 0.002 . 1 . . 524 . A 20 ASP H . 34201 1 409 . 1 1 23 23 ASP HA H 1 4.835 0.009 . 1 . . 1091 . A 20 ASP HA . 34201 1 410 . 1 1 23 23 ASP HB2 H 1 2.799 0.004 . 2 . . 1092 . A 20 ASP HB2 . 34201 1 411 . 1 1 23 23 ASP HB3 H 1 2.379 0.01 . 2 . . 1093 . A 20 ASP HB3 . 34201 1 412 . 1 1 23 23 ASP CA C 13 53.006 0.01 . 1 . . 1095 . A 20 ASP CA . 34201 1 413 . 1 1 23 23 ASP CB C 13 39.595 0.038 . 1 . . 1094 . A 20 ASP CB . 34201 1 414 . 1 1 23 23 ASP N N 15 123.522 0.016 . 1 . . 523 . A 20 ASP N . 34201 1 415 . 1 1 24 24 PRO HA H 1 4.483 0.003 . 1 . . 1315 . A 21 PRO HA . 34201 1 416 . 1 1 24 24 PRO HB2 H 1 1.695 0.004 . 2 . . 1317 . A 21 PRO HB2 . 34201 1 417 . 1 1 24 24 PRO HB3 H 1 2.259 0.004 . 2 . . 1318 . A 21 PRO HB3 . 34201 1 418 . 1 1 24 24 PRO HG2 H 1 1.897 0.004 . 2 . . 1322 . A 21 PRO HG2 . 34201 1 419 . 1 1 24 24 PRO HG3 H 1 1.966 0.005 . 2 . . 1323 . A 21 PRO HG3 . 34201 1 420 . 1 1 24 24 PRO HD2 H 1 3.834 0.006 . 2 . . 1320 . A 21 PRO HD2 . 34201 1 421 . 1 1 24 24 PRO HD3 H 1 3.532 0.001 . 2 . . 1324 . A 21 PRO HD3 . 34201 1 422 . 1 1 24 24 PRO C C 13 176.874 . . 1 . . 2110 . A 21 PRO C . 34201 1 423 . 1 1 24 24 PRO CA C 13 62.894 0.06 . 1 . . 1316 . A 21 PRO CA . 34201 1 424 . 1 1 24 24 PRO CB C 13 32.035 0.034 . 1 . . 1319 . A 21 PRO CB . 34201 1 425 . 1 1 24 24 PRO CG C 13 27.374 0.051 . 1 . . 1321 . A 21 PRO CG . 34201 1 426 . 1 1 24 24 PRO CD C 13 50.256 0.053 . 1 . . 1325 . A 21 PRO CD . 34201 1 427 . 1 1 25 25 TYR H H 1 9.180 0.003 . 1 . . 586 . A 22 TYR H . 34201 1 428 . 1 1 25 25 TYR HA H 1 4.184 0.006 . 1 . . 1300 . A 22 TYR HA . 34201 1 429 . 1 1 25 25 TYR HB2 H 1 2.604 0.0 . 2 . . 1301 . A 22 TYR HB2 . 34201 1 430 . 1 1 25 25 TYR HB3 H 1 2.507 0.0 . 2 . . 1302 . A 22 TYR HB3 . 34201 1 431 . 1 1 25 25 TYR HD1 H 1 6.776 0.005 . 1 . . 1484 . A 22 TYR HD1 . 34201 1 432 . 1 1 25 25 TYR HD2 H 1 6.776 0.005 . 1 . . 1484 . A 22 TYR HD2 . 34201 1 433 . 1 1 25 25 TYR HE1 H 1 6.551 0.004 . 1 . . 1486 . A 22 TYR HE1 . 34201 1 434 . 1 1 25 25 TYR HE2 H 1 6.551 0.004 . 1 . . 1486 . A 22 TYR HE2 . 34201 1 435 . 1 1 25 25 TYR C C 13 175.396 . . 1 . . 2076 . A 22 TYR C . 34201 1 436 . 1 1 25 25 TYR CA C 13 57.263 0.019 . 1 . . 1299 . A 22 TYR CA . 34201 1 437 . 1 1 25 25 TYR CB C 13 40.558 0.019 . 1 . . 1303 . A 22 TYR CB . 34201 1 438 . 1 1 25 25 TYR CD1 C 13 132.978 0.079 . 1 . . 1485 . A 22 TYR CD1 . 34201 1 439 . 1 1 25 25 TYR CD2 C 13 132.978 0.079 . 1 . . 1485 . A 22 TYR CD2 . 34201 1 440 . 1 1 25 25 TYR CE1 C 13 118.227 0.086 . 1 . . 1487 . A 22 TYR CE1 . 34201 1 441 . 1 1 25 25 TYR CE2 C 13 118.227 0.086 . 1 . . 1487 . A 22 TYR CE2 . 34201 1 442 . 1 1 25 25 TYR N N 15 122.582 0.013 . 1 . . 585 . A 22 TYR N . 34201 1 443 . 1 1 26 26 GLU H H 1 7.788 0.004 . 1 . . 633 . A 23 GLU H . 34201 1 444 . 1 1 26 26 GLU HA H 1 5.114 0.007 . 1 . . 1294 . A 23 GLU HA . 34201 1 445 . 1 1 26 26 GLU HB2 H 1 1.885 . . 2 . . 1295 . A 23 GLU HB2 . 34201 1 446 . 1 1 26 26 GLU HB3 H 1 1.886 . . 2 . . 1906 . A 23 GLU HB3 . 34201 1 447 . 1 1 26 26 GLU HG2 H 1 1.902 0.003 . 2 . . 1297 . A 23 GLU HG2 . 34201 1 448 . 1 1 26 26 GLU HG3 H 1 1.902 0.003 . 2 . . 1907 . A 23 GLU HG3 . 34201 1 449 . 1 1 26 26 GLU C C 13 174.496 . . 1 . . 2084 . A 23 GLU C . 34201 1 450 . 1 1 26 26 GLU CA C 13 55.135 0.05 . 1 . . 1296 . A 23 GLU CA . 34201 1 451 . 1 1 26 26 GLU CG C 13 35.742 0.024 . 1 . . 1298 . A 23 GLU CG . 34201 1 452 . 1 1 26 26 GLU N N 15 120.076 0.024 . 1 . . 632 . A 23 GLU N . 34201 1 453 . 1 1 27 27 PHE H H 1 8.765 0.003 . 1 . . 652 . A 24 PHE H . 34201 1 454 . 1 1 27 27 PHE HA H 1 5.281 0.004 . 1 . . 1096 . A 24 PHE HA . 34201 1 455 . 1 1 27 27 PHE HB2 H 1 2.687 0.008 . 2 . . 1097 . A 24 PHE HB2 . 34201 1 456 . 1 1 27 27 PHE HB3 H 1 2.687 0.008 . 2 . . 1908 . A 24 PHE HB3 . 34201 1 457 . 1 1 27 27 PHE HD1 H 1 6.888 0.004 . 1 . . 1659 . A 24 PHE HD1 . 34201 1 458 . 1 1 27 27 PHE HD2 H 1 6.888 0.004 . 1 . . 1659 . A 24 PHE HD2 . 34201 1 459 . 1 1 27 27 PHE HE1 H 1 6.818 0.003 . 1 . . 1661 . A 24 PHE HE1 . 34201 1 460 . 1 1 27 27 PHE HE2 H 1 6.818 0.003 . 1 . . 1661 . A 24 PHE HE2 . 34201 1 461 . 1 1 27 27 PHE HZ H 1 6.770 0.003 . 1 . . 1680 . A 24 PHE HZ . 34201 1 462 . 1 1 27 27 PHE C C 13 174.489 . . 1 . . 2119 . A 24 PHE C . 34201 1 463 . 1 1 27 27 PHE CA C 13 55.216 0.046 . 1 . . 1098 . A 24 PHE CA . 34201 1 464 . 1 1 27 27 PHE CB C 13 43.006 0.045 . 1 . . 1658 . A 24 PHE CB . 34201 1 465 . 1 1 27 27 PHE CD1 C 13 131.722 0.078 . 1 . . 1660 . A 24 PHE CD1 . 34201 1 466 . 1 1 27 27 PHE CD2 C 13 131.722 0.078 . 1 . . 1660 . A 24 PHE CD2 . 34201 1 467 . 1 1 27 27 PHE CE1 C 13 130.898 0.03 . 1 . . 1662 . A 24 PHE CE1 . 34201 1 468 . 1 1 27 27 PHE CE2 C 13 130.898 0.03 . 1 . . 1662 . A 24 PHE CE2 . 34201 1 469 . 1 1 27 27 PHE CZ C 13 127.933 0.065 . 1 . . 1681 . A 24 PHE CZ . 34201 1 470 . 1 1 27 27 PHE N N 15 120.968 0.027 . 1 . . 651 . A 24 PHE N . 34201 1 471 . 1 1 28 28 GLU H H 1 9.416 0.003 . 1 . . 418 . A 25 GLU H . 34201 1 472 . 1 1 28 28 GLU HA H 1 4.849 0.0 . 1 . . 1841 . A 25 GLU HA . 34201 1 473 . 1 1 28 28 GLU HB2 H 1 2.086 0.0 . 2 . . 1846 . A 25 GLU HB2 . 34201 1 474 . 1 1 28 28 GLU HB3 H 1 2.086 0.0 . 2 . . 1909 . A 25 GLU HB3 . 34201 1 475 . 1 1 28 28 GLU HG2 H 1 1.894 0.009 . 2 . . 1842 . A 25 GLU HG2 . 34201 1 476 . 1 1 28 28 GLU HG3 H 1 1.683 0.01 . 2 . . 1844 . A 25 GLU HG3 . 34201 1 477 . 1 1 28 28 GLU C C 13 175.557 . . 1 . . 2016 . A 25 GLU C . 34201 1 478 . 1 1 28 28 GLU CA C 13 55.418 0.0 . 1 . . 1843 . A 25 GLU CA . 34201 1 479 . 1 1 28 28 GLU CB C 13 32.471 . . 1 . . 1847 . A 25 GLU CB . 34201 1 480 . 1 1 28 28 GLU CG C 13 37.221 0.047 . 1 . . 1845 . A 25 GLU CG . 34201 1 481 . 1 1 28 28 GLU N N 15 123.217 0.016 . 1 . . 417 . A 25 GLU N . 34201 1 482 . 1 1 29 29 ILE H H 1 8.884 0.003 . 1 . . 459 . A 26 ILE H . 34201 1 483 . 1 1 29 29 ILE HA H 1 4.384 0.004 . 1 . . 131 . A 26 ILE HA . 34201 1 484 . 1 1 29 29 ILE HB H 1 0.509 0.009 . 1 . . 134 . A 26 ILE HB . 34201 1 485 . 1 1 29 29 ILE HG12 H 1 0.605 0.0 . 2 . . 132 . A 26 ILE HG12 . 34201 1 486 . 1 1 29 29 ILE HG13 H 1 1.042 0.004 . 2 . . 133 . A 26 ILE HG13 . 34201 1 487 . 1 1 29 29 ILE HG21 H 1 0.435 0.002 . 1 . . 130 . A 26 ILE HG21 . 34201 1 488 . 1 1 29 29 ILE HG22 H 1 0.435 0.002 . 1 . . 130 . A 26 ILE HG22 . 34201 1 489 . 1 1 29 29 ILE HG23 H 1 0.435 0.002 . 1 . . 130 . A 26 ILE HG23 . 34201 1 490 . 1 1 29 29 ILE HD11 H 1 0.182 0.003 . 1 . . 458 . A 26 ILE HD11 . 34201 1 491 . 1 1 29 29 ILE HD12 H 1 0.182 0.003 . 1 . . 458 . A 26 ILE HD12 . 34201 1 492 . 1 1 29 29 ILE HD13 H 1 0.182 0.003 . 1 . . 458 . A 26 ILE HD13 . 34201 1 493 . 1 1 29 29 ILE C C 13 173.665 . . 1 . . 2099 . A 26 ILE C . 34201 1 494 . 1 1 29 29 ILE CA C 13 61.471 0.045 . 1 . . 709 . A 26 ILE CA . 34201 1 495 . 1 1 29 29 ILE CB C 13 39.116 0.011 . 1 . . 708 . A 26 ILE CB . 34201 1 496 . 1 1 29 29 ILE CG1 C 13 28.185 0.031 . 1 . . 1832 . A 26 ILE CG1 . 34201 1 497 . 1 1 29 29 ILE CG2 C 13 17.895 0.027 . 1 . . 707 . A 26 ILE CG2 . 34201 1 498 . 1 1 29 29 ILE CD1 C 13 14.310 0.018 . 1 . . 706 . A 26 ILE CD1 . 34201 1 499 . 1 1 29 29 ILE N N 15 133.355 0.011 . 1 . . 457 . A 26 ILE N . 34201 1 500 . 1 1 30 30 THR H H 1 8.835 0.003 . 1 . . 520 . A 27 THR H . 34201 1 501 . 1 1 30 30 THR HA H 1 5.435 0.006 . 1 . . 81 . A 27 THR HA . 34201 1 502 . 1 1 30 30 THR HB H 1 3.859 0.007 . 1 . . 80 . A 27 THR HB . 34201 1 503 . 1 1 30 30 THR HG21 H 1 1.123 0.002 . 1 . . 82 . A 27 THR HG21 . 34201 1 504 . 1 1 30 30 THR HG22 H 1 1.123 0.002 . 1 . . 82 . A 27 THR HG22 . 34201 1 505 . 1 1 30 30 THR HG23 H 1 1.123 0.002 . 1 . . 82 . A 27 THR HG23 . 34201 1 506 . 1 1 30 30 THR C C 13 174.734 . . 1 . . 2125 . A 27 THR C . 34201 1 507 . 1 1 30 30 THR CA C 13 61.324 0.063 . 1 . . 711 . A 27 THR CA . 34201 1 508 . 1 1 30 30 THR CB C 13 69.687 0.054 . 1 . . 710 . A 27 THR CB . 34201 1 509 . 1 1 30 30 THR CG2 C 13 21.536 0.018 . 1 . . 712 . A 27 THR CG2 . 34201 1 510 . 1 1 30 30 THR N N 15 121.745 0.019 . 1 . . 519 . A 27 THR N . 34201 1 511 . 1 1 31 31 PHE H H 1 9.712 0.004 . 1 . . 495 . A 28 PHE H . 34201 1 512 . 1 1 31 31 PHE HA H 1 5.508 0.013 . 1 . . 1101 . A 28 PHE HA . 34201 1 513 . 1 1 31 31 PHE HB2 H 1 3.416 . . 2 . . 1099 . A 28 PHE HB2 . 34201 1 514 . 1 1 31 31 PHE HB3 H 1 3.047 0.0 . 2 . . 1100 . A 28 PHE HB3 . 34201 1 515 . 1 1 31 31 PHE HD1 H 1 7.156 0.004 . 1 . . 2011 . A 28 PHE HD1 . 34201 1 516 . 1 1 31 31 PHE HD2 H 1 7.156 0.004 . 1 . . 2011 . A 28 PHE HD2 . 34201 1 517 . 1 1 31 31 PHE HE1 H 1 7.245 0.007 . 1 . . 1512 . A 28 PHE HE1 . 34201 1 518 . 1 1 31 31 PHE HE2 H 1 7.245 0.007 . 1 . . 1512 . A 28 PHE HE2 . 34201 1 519 . 1 1 31 31 PHE HZ H 1 7.327 0.003 . 1 . . 1514 . A 28 PHE HZ . 34201 1 520 . 1 1 31 31 PHE C C 13 170.328 . . 1 . . 2104 . A 28 PHE C . 34201 1 521 . 1 1 31 31 PHE CA C 13 56.102 0.028 . 1 . . 1102 . A 28 PHE CA . 34201 1 522 . 1 1 31 31 PHE CB C 13 42.110 0.012 . 1 . . 1665 . A 28 PHE CB . 34201 1 523 . 1 1 31 31 PHE CE1 C 13 133.217 0.041 . 1 . . 1513 . A 28 PHE CE1 . 34201 1 524 . 1 1 31 31 PHE CE2 C 13 133.217 0.041 . 1 . . 1513 . A 28 PHE CE2 . 34201 1 525 . 1 1 31 31 PHE CZ C 13 130.062 0.073 . 1 . . 1515 . A 28 PHE CZ . 34201 1 526 . 1 1 31 31 PHE N N 15 124.185 0.022 . 1 . . 494 . A 28 PHE N . 34201 1 527 . 1 1 32 32 GLU H H 1 9.605 0.004 . 1 . . 491 . A 29 GLU H . 34201 1 528 . 1 1 32 32 GLU HA H 1 5.277 0.006 . 1 . . 743 . A 29 GLU HA . 34201 1 529 . 1 1 32 32 GLU HB2 H 1 1.910 0.011 . 2 . . 748 . A 29 GLU HB2 . 34201 1 530 . 1 1 32 32 GLU HB3 H 1 2.024 0.011 . 2 . . 749 . A 29 GLU HB3 . 34201 1 531 . 1 1 32 32 GLU HG2 H 1 1.999 0.002 . 2 . . 745 . A 29 GLU HG2 . 34201 1 532 . 1 1 32 32 GLU HG3 H 1 1.999 0.002 . 2 . . 1910 . A 29 GLU HG3 . 34201 1 533 . 1 1 32 32 GLU C C 13 174.731 . . 1 . . 2133 . A 29 GLU C . 34201 1 534 . 1 1 32 32 GLU CA C 13 53.876 0.041 . 1 . . 744 . A 29 GLU CA . 34201 1 535 . 1 1 32 32 GLU CB C 13 33.167 0.058 . 1 . . 747 . A 29 GLU CB . 34201 1 536 . 1 1 32 32 GLU CG C 13 36.231 0.021 . 1 . . 746 . A 29 GLU CG . 34201 1 537 . 1 1 32 32 GLU N N 15 121.967 0.017 . 1 . . 490 . A 29 GLU N . 34201 1 538 . 1 1 33 33 CYS H H 1 9.066 0.004 . 1 . . 408 . A 30 CYS H . 34201 1 539 . 1 1 33 33 CYS HA H 1 5.368 0.007 . 1 . . 363 . A 30 CYS HA . 34201 1 540 . 1 1 33 33 CYS HB2 H 1 2.439 0.004 . 2 . . 364 . A 30 CYS HB2 . 34201 1 541 . 1 1 33 33 CYS HB3 H 1 3.277 0.009 . 2 . . 365 . A 30 CYS HB3 . 34201 1 542 . 1 1 33 33 CYS HG H 1 1.751 . . 1 . . 2009 . A 30 CYS HG . 34201 1 543 . 1 1 33 33 CYS C C 13 175.696 . . 1 . . 2148 . A 30 CYS C . 34201 1 544 . 1 1 33 33 CYS CA C 13 57.001 0.043 . 1 . . 728 . A 30 CYS CA . 34201 1 545 . 1 1 33 33 CYS CB C 13 28.907 0.053 . 1 . . 729 . A 30 CYS CB . 34201 1 546 . 1 1 33 33 CYS N N 15 125.795 0.02 . 1 . . 407 . A 30 CYS N . 34201 1 547 . 1 1 34 34 LEU H H 1 9.169 0.004 . 1 . . 656 . A 31 LEU H . 34201 1 548 . 1 1 34 34 LEU HA H 1 4.315 0.004 . 1 . . 265 . A 31 LEU HA . 34201 1 549 . 1 1 34 34 LEU HB2 H 1 1.666 0.013 . 2 . . 267 . A 31 LEU HB2 . 34201 1 550 . 1 1 34 34 LEU HB3 H 1 1.597 0.006 . 2 . . 268 . A 31 LEU HB3 . 34201 1 551 . 1 1 34 34 LEU HG H 1 1.615 0.004 . 1 . . 269 . A 31 LEU HG . 34201 1 552 . 1 1 34 34 LEU HD11 H 1 0.755 0.002 . 2 . . 264 . A 31 LEU HD11 . 34201 1 553 . 1 1 34 34 LEU HD12 H 1 0.755 0.002 . 2 . . 264 . A 31 LEU HD12 . 34201 1 554 . 1 1 34 34 LEU HD13 H 1 0.755 0.002 . 2 . . 264 . A 31 LEU HD13 . 34201 1 555 . 1 1 34 34 LEU HD21 H 1 0.810 0.001 . 2 . . 266 . A 31 LEU HD21 . 34201 1 556 . 1 1 34 34 LEU HD22 H 1 0.810 0.001 . 2 . . 266 . A 31 LEU HD22 . 34201 1 557 . 1 1 34 34 LEU HD23 H 1 0.810 0.001 . 2 . . 266 . A 31 LEU HD23 . 34201 1 558 . 1 1 34 34 LEU C C 13 176.271 . . 1 . . 2042 . A 31 LEU C . 34201 1 559 . 1 1 34 34 LEU CA C 13 56.813 0.044 . 1 . . 714 . A 31 LEU CA . 34201 1 560 . 1 1 34 34 LEU CB C 13 43.481 0.052 . 1 . . 713 . A 31 LEU CB . 34201 1 561 . 1 1 34 34 LEU CG C 13 27.862 0.023 . 1 . . 715 . A 31 LEU CG . 34201 1 562 . 1 1 34 34 LEU CD1 C 13 22.527 0.032 . 2 . . 717 . A 31 LEU CD1 . 34201 1 563 . 1 1 34 34 LEU CD2 C 13 25.117 0.012 . 2 . . 716 . A 31 LEU CD2 . 34201 1 564 . 1 1 34 34 LEU N N 15 127.536 0.022 . 1 . . 655 . A 31 LEU N . 34201 1 565 . 1 1 35 35 GLU H H 1 7.314 0.002 . 1 . . 406 . A 32 GLU H . 34201 1 566 . 1 1 35 35 GLU HA H 1 4.406 0.003 . 1 . . 738 . A 32 GLU HA . 34201 1 567 . 1 1 35 35 GLU HB2 H 1 1.944 0.003 . 2 . . 736 . A 32 GLU HB2 . 34201 1 568 . 1 1 35 35 GLU HB3 H 1 1.611 0.003 . 2 . . 737 . A 32 GLU HB3 . 34201 1 569 . 1 1 35 35 GLU HG2 H 1 2.150 0.003 . 2 . . 741 . A 32 GLU HG2 . 34201 1 570 . 1 1 35 35 GLU HG3 H 1 2.053 0.002 . 2 . . 742 . A 32 GLU HG3 . 34201 1 571 . 1 1 35 35 GLU C C 13 173.075 . . 1 . . 2032 . A 32 GLU C . 34201 1 572 . 1 1 35 35 GLU CA C 13 54.570 0.018 . 1 . . 739 . A 32 GLU CA . 34201 1 573 . 1 1 35 35 GLU CB C 13 33.790 0.035 . 1 . . 735 . A 32 GLU CB . 34201 1 574 . 1 1 35 35 GLU CG C 13 35.739 0.017 . 1 . . 740 . A 32 GLU CG . 34201 1 575 . 1 1 35 35 GLU N N 15 116.265 0.013 . 1 . . 405 . A 32 GLU N . 34201 1 576 . 1 1 36 36 SER H H 1 8.308 0.002 . 1 . . 440 . A 33 SER H . 34201 1 577 . 1 1 36 36 SER HA H 1 4.237 0.002 . 1 . . 730 . A 33 SER HA . 34201 1 578 . 1 1 36 36 SER HB2 H 1 3.783 0.004 . 2 . . 732 . A 33 SER HB2 . 34201 1 579 . 1 1 36 36 SER HB3 H 1 3.852 0.003 . 2 . . 734 . A 33 SER HB3 . 34201 1 580 . 1 1 36 36 SER C C 13 174.037 . . 1 . . 2137 . A 33 SER C . 34201 1 581 . 1 1 36 36 SER CA C 13 59.224 0.016 . 1 . . 731 . A 33 SER CA . 34201 1 582 . 1 1 36 36 SER CB C 13 63.225 0.023 . 1 . . 733 . A 33 SER CB . 34201 1 583 . 1 1 36 36 SER N N 15 115.225 0.008 . 1 . . 439 . A 33 SER N . 34201 1 584 . 1 1 37 37 LEU H H 1 8.343 0.001 . 1 . . 476 . A 34 LEU H . 34201 1 585 . 1 1 37 37 LEU HA H 1 4.717 0.007 . 1 . . 259 . A 34 LEU HA . 34201 1 586 . 1 1 37 37 LEU HB2 H 1 2.078 0.005 . 2 . . 261 . A 34 LEU HB2 . 34201 1 587 . 1 1 37 37 LEU HB3 H 1 1.825 0.0 . 2 . . 262 . A 34 LEU HB3 . 34201 1 588 . 1 1 37 37 LEU HG H 1 1.632 0.007 . 1 . . 263 . A 34 LEU HG . 34201 1 589 . 1 1 37 37 LEU HD11 H 1 0.597 0.002 . 2 . . 258 . A 34 LEU HD11 . 34201 1 590 . 1 1 37 37 LEU HD12 H 1 0.597 0.002 . 2 . . 258 . A 34 LEU HD12 . 34201 1 591 . 1 1 37 37 LEU HD13 H 1 0.597 0.002 . 2 . . 258 . A 34 LEU HD13 . 34201 1 592 . 1 1 37 37 LEU HD21 H 1 0.690 0.005 . 2 . . 260 . A 34 LEU HD21 . 34201 1 593 . 1 1 37 37 LEU HD22 H 1 0.690 0.005 . 2 . . 260 . A 34 LEU HD22 . 34201 1 594 . 1 1 37 37 LEU HD23 H 1 0.690 0.005 . 2 . . 260 . A 34 LEU HD23 . 34201 1 595 . 1 1 37 37 LEU C C 13 178.583 . . 1 . . 2113 . A 34 LEU C . 34201 1 596 . 1 1 37 37 LEU CA C 13 53.620 0.026 . 1 . . 720 . A 34 LEU CA . 34201 1 597 . 1 1 37 37 LEU CB C 13 44.135 0.046 . 1 . . 718 . A 34 LEU CB . 34201 1 598 . 1 1 37 37 LEU CG C 13 26.188 0.02 . 1 . . 719 . A 34 LEU CG . 34201 1 599 . 1 1 37 37 LEU CD1 C 13 22.769 0.023 . 2 . . 721 . A 34 LEU CD1 . 34201 1 600 . 1 1 37 37 LEU CD2 C 13 25.860 0.069 . 2 . . 1522 . A 34 LEU CD2 . 34201 1 601 . 1 1 37 37 LEU N N 15 126.050 0.011 . 1 . . 475 . A 34 LEU N . 34201 1 602 . 1 1 38 38 LYS H H 1 9.397 0.003 . 1 . . 535 . A 35 LYS H . 34201 1 603 . 1 1 38 38 LYS HA H 1 4.077 0.002 . 1 . . 339 . A 35 LYS HA . 34201 1 604 . 1 1 38 38 LYS HB2 H 1 1.453 0.005 . 2 . . 341 . A 35 LYS HB2 . 34201 1 605 . 1 1 38 38 LYS HB3 H 1 1.400 0.005 . 2 . . 342 . A 35 LYS HB3 . 34201 1 606 . 1 1 38 38 LYS HG2 H 1 1.239 0.002 . 2 . . 724 . A 35 LYS HG2 . 34201 1 607 . 1 1 38 38 LYS HG3 H 1 1.342 0.001 . 2 . . 726 . A 35 LYS HG3 . 34201 1 608 . 1 1 38 38 LYS HD2 H 1 1.559 0.004 . 2 . . 343 . A 35 LYS HD2 . 34201 1 609 . 1 1 38 38 LYS HD3 H 1 1.545 0.013 . 2 . . 344 . A 35 LYS HD3 . 34201 1 610 . 1 1 38 38 LYS HE3 H 1 2.920 0.001 . 1 . . 340 . A 35 LYS HE3 . 34201 1 611 . 1 1 38 38 LYS C C 13 177.655 . . 1 . . 2040 . A 35 LYS C . 34201 1 612 . 1 1 38 38 LYS CA C 13 58.514 0.07 . 1 . . 722 . A 35 LYS CA . 34201 1 613 . 1 1 38 38 LYS CB C 13 33.446 0.043 . 1 . . 727 . A 35 LYS CB . 34201 1 614 . 1 1 38 38 LYS CG C 13 25.549 0.031 . 1 . . 725 . A 35 LYS CG . 34201 1 615 . 1 1 38 38 LYS CD C 13 29.206 0.011 . 1 . . 723 . A 35 LYS CD . 34201 1 616 . 1 1 38 38 LYS CE C 13 42.124 0.023 . 1 . . 1833 . A 35 LYS CE . 34201 1 617 . 1 1 38 38 LYS N N 15 122.719 0.03 . 1 . . 534 . A 35 LYS N . 34201 1 618 . 1 1 39 39 HIS H H 1 8.473 0.002 . 1 . . 420 . A 36 HIS H . 34201 1 619 . 1 1 39 39 HIS HA H 1 5.110 0.002 . 1 . . 1455 . A 36 HIS HA . 34201 1 620 . 1 1 39 39 HIS HB2 H 1 3.256 0.001 . 2 . . 1103 . A 36 HIS HB2 . 34201 1 621 . 1 1 39 39 HIS HB3 H 1 2.824 0.002 . 2 . . 1104 . A 36 HIS HB3 . 34201 1 622 . 1 1 39 39 HIS HD2 H 1 7.050 0.004 . 1 . . 1457 . A 36 HIS HD2 . 34201 1 623 . 1 1 39 39 HIS C C 13 173.731 . . 1 . . 2053 . A 36 HIS C . 34201 1 624 . 1 1 39 39 HIS CA C 13 53.359 0.024 . 1 . . 1456 . A 36 HIS CA . 34201 1 625 . 1 1 39 39 HIS CB C 13 30.696 0.078 . 1 . . 1105 . A 36 HIS CB . 34201 1 626 . 1 1 39 39 HIS CD2 C 13 119.465 0.081 . 1 . . 1458 . A 36 HIS CD2 . 34201 1 627 . 1 1 39 39 HIS N N 15 115.998 0.015 . 1 . . 419 . A 36 HIS N . 34201 1 628 . 1 1 40 40 ASP H H 1 8.053 0.006 . 1 . . 468 . A 37 ASP H . 34201 1 629 . 1 1 40 40 ASP HA H 1 4.912 0.003 . 1 . . 757 . A 37 ASP HA . 34201 1 630 . 1 1 40 40 ASP HB2 H 1 2.341 0.006 . 2 . . 754 . A 37 ASP HB2 . 34201 1 631 . 1 1 40 40 ASP HB3 H 1 2.561 0.007 . 2 . . 756 . A 37 ASP HB3 . 34201 1 632 . 1 1 40 40 ASP C C 13 176.552 . . 1 . . 2045 . A 37 ASP C . 34201 1 633 . 1 1 40 40 ASP CA C 13 54.737 0.078 . 1 . . 758 . A 37 ASP CA . 34201 1 634 . 1 1 40 40 ASP CB C 13 42.755 0.056 . 1 . . 755 . A 37 ASP CB . 34201 1 635 . 1 1 40 40 ASP N N 15 118.356 0.02 . 1 . . 467 . A 37 ASP N . 34201 1 636 . 1 1 41 41 LEU H H 1 8.611 0.002 . 1 . . 509 . A 38 LEU H . 34201 1 637 . 1 1 41 41 LEU HA H 1 4.932 0.0 . 1 . . 251 . A 38 LEU HA . 34201 1 638 . 1 1 41 41 LEU HB2 H 1 1.745 0.01 . 2 . . 249 . A 38 LEU HB2 . 34201 1 639 . 1 1 41 41 LEU HB3 H 1 1.082 0.0 . 2 . . 250 . A 38 LEU HB3 . 34201 1 640 . 1 1 41 41 LEU HG H 1 1.996 0.001 . 1 . . 248 . A 38 LEU HG . 34201 1 641 . 1 1 41 41 LEU HD11 H 1 0.820 0.002 . 2 . . 246 . A 38 LEU HD11 . 34201 1 642 . 1 1 41 41 LEU HD12 H 1 0.820 0.002 . 2 . . 246 . A 38 LEU HD12 . 34201 1 643 . 1 1 41 41 LEU HD13 H 1 0.820 0.002 . 2 . . 246 . A 38 LEU HD13 . 34201 1 644 . 1 1 41 41 LEU HD21 H 1 1.203 0.001 . 2 . . 247 . A 38 LEU HD21 . 34201 1 645 . 1 1 41 41 LEU HD22 H 1 1.203 0.001 . 2 . . 247 . A 38 LEU HD22 . 34201 1 646 . 1 1 41 41 LEU HD23 H 1 1.203 0.001 . 2 . . 247 . A 38 LEU HD23 . 34201 1 647 . 1 1 41 41 LEU C C 13 175.437 . . 1 . . 2106 . A 38 LEU C . 34201 1 648 . 1 1 41 41 LEU CA C 13 53.938 . . 1 . . 2166 . A 38 LEU CA . 34201 1 649 . 1 1 41 41 LEU CB C 13 44.713 0.021 . 1 . . 751 . A 38 LEU CB . 34201 1 650 . 1 1 41 41 LEU CG C 13 26.665 0.0 . 1 . . 752 . A 38 LEU CG . 34201 1 651 . 1 1 41 41 LEU CD1 C 13 27.719 0.027 . 2 . . 750 . A 38 LEU CD1 . 34201 1 652 . 1 1 41 41 LEU CD2 C 13 23.456 0.029 . 2 . . 753 . A 38 LEU CD2 . 34201 1 653 . 1 1 41 41 LEU N N 15 116.457 0.019 . 1 . . 508 . A 38 LEU N . 34201 1 654 . 1 1 42 42 GLU H H 1 8.311 0.001 . 1 . . 392 . A 39 GLU H . 34201 1 655 . 1 1 42 42 GLU HA H 1 5.294 0.007 . 1 . . 1443 . A 39 GLU HA . 34201 1 656 . 1 1 42 42 GLU HB2 H 1 1.942 0.0 . 2 . . 1446 . A 39 GLU HB2 . 34201 1 657 . 1 1 42 42 GLU HB3 H 1 1.636 0.0 . 2 . . 1447 . A 39 GLU HB3 . 34201 1 658 . 1 1 42 42 GLU HG2 H 1 1.844 0.008 . 2 . . 1448 . A 39 GLU HG2 . 34201 1 659 . 1 1 42 42 GLU HG3 H 1 2.039 0.001 . 2 . . 1450 . A 39 GLU HG3 . 34201 1 660 . 1 1 42 42 GLU C C 13 175.217 . . 1 . . 2160 . A 39 GLU C . 34201 1 661 . 1 1 42 42 GLU CA C 13 54.427 0.041 . 1 . . 1444 . A 39 GLU CA . 34201 1 662 . 1 1 42 42 GLU CB C 13 32.195 0.01 . 1 . . 1445 . A 39 GLU CB . 34201 1 663 . 1 1 42 42 GLU CG C 13 36.304 0.061 . 1 . . 1449 . A 39 GLU CG . 34201 1 664 . 1 1 42 42 GLU N N 15 122.621 0.015 . 1 . . 391 . A 39 GLU N . 34201 1 665 . 1 1 43 43 TRP H H 1 9.351 0.003 . 1 . . 428 . A 40 TRP H . 34201 1 666 . 1 1 43 43 TRP HA H 1 5.511 0.009 . 1 . . 759 . A 40 TRP HA . 34201 1 667 . 1 1 43 43 TRP HB2 H 1 3.052 0.0 . 2 . . 366 . A 40 TRP HB2 . 34201 1 668 . 1 1 43 43 TRP HB3 H 1 2.854 0.0 . 2 . . 367 . A 40 TRP HB3 . 34201 1 669 . 1 1 43 43 TRP HD1 H 1 6.686 0.002 . 1 . . 1518 . A 40 TRP HD1 . 34201 1 670 . 1 1 43 43 TRP HE1 H 1 7.217 0.003 . 1 . . 671 . A 40 TRP HE1 . 34201 1 671 . 1 1 43 43 TRP HE3 H 1 7.364 . . 1 . . 2004 . A 40 TRP HE3 . 34201 1 672 . 1 1 43 43 TRP HZ2 H 1 6.448 0.004 . 1 . . 1516 . A 40 TRP HZ2 . 34201 1 673 . 1 1 43 43 TRP HZ3 H 1 6.683 . . 1 . . 1944 . A 40 TRP HZ3 . 34201 1 674 . 1 1 43 43 TRP HH2 H 1 6.821 0.005 . 1 . . 1520 . A 40 TRP HH2 . 34201 1 675 . 1 1 43 43 TRP C C 13 174.600 . . 1 . . 2102 . A 40 TRP C . 34201 1 676 . 1 1 43 43 TRP CA C 13 55.250 0.055 . 1 . . 760 . A 40 TRP CA . 34201 1 677 . 1 1 43 43 TRP CB C 13 29.889 . . 1 . . 2167 . A 40 TRP CB . 34201 1 678 . 1 1 43 43 TRP CD1 C 13 125.806 0.03 . 1 . . 1519 . A 40 TRP CD1 . 34201 1 679 . 1 1 43 43 TRP CZ2 C 13 114.099 0.062 . 1 . . 1517 . A 40 TRP CZ2 . 34201 1 680 . 1 1 43 43 TRP CH2 C 13 124.530 0.025 . 1 . . 1521 . A 40 TRP CH2 . 34201 1 681 . 1 1 43 43 TRP N N 15 129.583 0.018 . 1 . . 427 . A 40 TRP N . 34201 1 682 . 1 1 43 43 TRP NE1 N 15 123.871 0.059 . 1 . . 672 . A 40 TRP NE1 . 34201 1 683 . 1 1 44 44 LYS H H 1 9.162 0.004 . 1 . . 501 . A 41 LYS H . 34201 1 684 . 1 1 44 44 LYS HA H 1 5.417 0.007 . 1 . . 329 . A 41 LYS HA . 34201 1 685 . 1 1 44 44 LYS HB2 H 1 1.704 0.004 . 2 . . 330 . A 41 LYS HB2 . 34201 1 686 . 1 1 44 44 LYS HB3 H 1 1.704 0.004 . 2 . . 1911 . A 41 LYS HB3 . 34201 1 687 . 1 1 44 44 LYS HG2 H 1 1.349 0.003 . 2 . . 335 . A 41 LYS HG2 . 34201 1 688 . 1 1 44 44 LYS HG3 H 1 1.437 0.002 . 2 . . 336 . A 41 LYS HG3 . 34201 1 689 . 1 1 44 44 LYS HD2 H 1 1.477 0.006 . 2 . . 334 . A 41 LYS HD2 . 34201 1 690 . 1 1 44 44 LYS HD3 H 1 1.477 0.006 . 2 . . 1912 . A 41 LYS HD3 . 34201 1 691 . 1 1 44 44 LYS HE2 H 1 2.735 0.003 . 2 . . 331 . A 41 LYS HE2 . 34201 1 692 . 1 1 44 44 LYS HE3 H 1 2.735 0.003 . 2 . . 1913 . A 41 LYS HE3 . 34201 1 693 . 1 1 44 44 LYS C C 13 174.113 . . 1 . . 2129 . A 41 LYS C . 34201 1 694 . 1 1 44 44 LYS CA C 13 55.314 0.04 . 1 . . 761 . A 41 LYS CA . 34201 1 695 . 1 1 44 44 LYS CB C 13 37.102 0.03 . 1 . . 332 . A 41 LYS CB . 34201 1 696 . 1 1 44 44 LYS CG C 13 24.518 0.015 . 1 . . 763 . A 41 LYS CG . 34201 1 697 . 1 1 44 44 LYS CD C 13 29.507 0.037 . 1 . . 762 . A 41 LYS CD . 34201 1 698 . 1 1 44 44 LYS CE C 13 41.582 0.039 . 1 . . 333 . A 41 LYS CE . 34201 1 699 . 1 1 44 44 LYS N N 15 122.195 0.023 . 1 . . 500 . A 41 LYS N . 34201 1 700 . 1 1 45 45 LEU H H 1 8.338 0.004 . 1 . . 396 . A 42 LEU H . 34201 1 701 . 1 1 45 45 LEU HA H 1 5.530 0.002 . 1 . . 239 . A 42 LEU HA . 34201 1 702 . 1 1 45 45 LEU HB2 H 1 1.680 0.015 . 2 . . 236 . A 42 LEU HB2 . 34201 1 703 . 1 1 45 45 LEU HB3 H 1 1.162 0.011 . 2 . . 238 . A 42 LEU HB3 . 34201 1 704 . 1 1 45 45 LEU HG H 1 1.193 0.001 . 1 . . 240 . A 42 LEU HG . 34201 1 705 . 1 1 45 45 LEU HD11 H 1 0.581 0.001 . 2 . . 235 . A 42 LEU HD11 . 34201 1 706 . 1 1 45 45 LEU HD12 H 1 0.581 0.001 . 2 . . 235 . A 42 LEU HD12 . 34201 1 707 . 1 1 45 45 LEU HD13 H 1 0.581 0.001 . 2 . . 235 . A 42 LEU HD13 . 34201 1 708 . 1 1 45 45 LEU HD21 H 1 0.351 0.003 . 2 . . 237 . A 42 LEU HD21 . 34201 1 709 . 1 1 45 45 LEU HD22 H 1 0.351 0.003 . 2 . . 237 . A 42 LEU HD22 . 34201 1 710 . 1 1 45 45 LEU HD23 H 1 0.351 0.003 . 2 . . 237 . A 42 LEU HD23 . 34201 1 711 . 1 1 45 45 LEU C C 13 175.169 . . 1 . . 2122 . A 42 LEU C . 34201 1 712 . 1 1 45 45 LEU CA C 13 53.150 0.054 . 1 . . 764 . A 42 LEU CA . 34201 1 713 . 1 1 45 45 LEU CB C 13 46.180 0.032 . 1 . . 765 . A 42 LEU CB . 34201 1 714 . 1 1 45 45 LEU CG C 13 27.341 0.001 . 1 . . 766 . A 42 LEU CG . 34201 1 715 . 1 1 45 45 LEU CD1 C 13 24.241 0.045 . 2 . . 768 . A 42 LEU CD1 . 34201 1 716 . 1 1 45 45 LEU CD2 C 13 27.340 0.043 . 2 . . 767 . A 42 LEU CD2 . 34201 1 717 . 1 1 45 45 LEU N N 15 124.762 0.028 . 1 . . 395 . A 42 LEU N . 34201 1 718 . 1 1 46 46 THR H H 1 9.310 0.004 . 1 . . 528 . A 43 THR H . 34201 1 719 . 1 1 46 46 THR HA H 1 4.869 0.003 . 1 . . 87 . A 43 THR HA . 34201 1 720 . 1 1 46 46 THR HB H 1 3.862 0.007 . 1 . . 86 . A 43 THR HB . 34201 1 721 . 1 1 46 46 THR HG21 H 1 1.053 0.002 . 1 . . 88 . A 43 THR HG21 . 34201 1 722 . 1 1 46 46 THR HG22 H 1 1.053 0.002 . 1 . . 88 . A 43 THR HG22 . 34201 1 723 . 1 1 46 46 THR HG23 H 1 1.053 0.002 . 1 . . 88 . A 43 THR HG23 . 34201 1 724 . 1 1 46 46 THR C C 13 172.120 . . 1 . . 2152 . A 43 THR C . 34201 1 725 . 1 1 46 46 THR CA C 13 62.043 0.055 . 1 . . 771 . A 43 THR CA . 34201 1 726 . 1 1 46 46 THR CB C 13 71.410 0.027 . 1 . . 770 . A 43 THR CB . 34201 1 727 . 1 1 46 46 THR CG2 C 13 21.424 0.024 . 1 . . 772 . A 43 THR CG2 . 34201 1 728 . 1 1 46 46 THR N N 15 123.513 0.014 . 1 . . 527 . A 43 THR N . 34201 1 729 . 1 1 47 47 TYR H H 1 9.328 0.004 . 1 . . 489 . A 44 TYR H . 34201 1 730 . 1 1 47 47 TYR HA H 1 4.679 . . 1 . . 2005 . A 44 TYR HA . 34201 1 731 . 1 1 47 47 TYR HB2 H 1 2.785 0.0 . 2 . . 1967 . A 44 TYR HB2 . 34201 1 732 . 1 1 47 47 TYR HB3 H 1 3.119 . . 2 . . 2013 . A 44 TYR HB3 . 34201 1 733 . 1 1 47 47 TYR HD1 H 1 6.998 0.005 . 1 . . 1676 . A 44 TYR HD1 . 34201 1 734 . 1 1 47 47 TYR HD2 H 1 6.998 0.005 . 1 . . 1676 . A 44 TYR HD2 . 34201 1 735 . 1 1 47 47 TYR HE1 H 1 6.894 0.008 . 1 . . 1678 . A 44 TYR HE1 . 34201 1 736 . 1 1 47 47 TYR HE2 H 1 6.894 0.008 . 1 . . 1678 . A 44 TYR HE2 . 34201 1 737 . 1 1 47 47 TYR C C 13 173.641 . . 1 . . 2156 . A 44 TYR C . 34201 1 738 . 1 1 47 47 TYR CD1 C 13 133.173 0.117 . 1 . . 1677 . A 44 TYR CD1 . 34201 1 739 . 1 1 47 47 TYR CD2 C 13 133.173 0.117 . 1 . . 1677 . A 44 TYR CD2 . 34201 1 740 . 1 1 47 47 TYR CE1 C 13 118.224 0.033 . 1 . . 1679 . A 44 TYR CE1 . 34201 1 741 . 1 1 47 47 TYR CE2 C 13 118.224 0.033 . 1 . . 1679 . A 44 TYR CE2 . 34201 1 742 . 1 1 47 47 TYR N N 15 128.152 0.04 . 1 . . 486 . A 44 TYR N . 34201 1 743 . 1 1 48 48 VAL H H 1 8.171 0.004 . 1 . . 377 . A 45 VAL H . 34201 1 744 . 1 1 48 48 VAL HA H 1 4.194 0.013 . 1 . . 206 . A 45 VAL HA . 34201 1 745 . 1 1 48 48 VAL HB H 1 1.913 0.014 . 1 . . 207 . A 45 VAL HB . 34201 1 746 . 1 1 48 48 VAL HG11 H 1 0.875 0.002 . 2 . . 208 . A 45 VAL HG11 . 34201 1 747 . 1 1 48 48 VAL HG12 H 1 0.875 0.002 . 2 . . 208 . A 45 VAL HG12 . 34201 1 748 . 1 1 48 48 VAL HG13 H 1 0.875 0.002 . 2 . . 208 . A 45 VAL HG13 . 34201 1 749 . 1 1 48 48 VAL HG21 H 1 0.690 0.002 . 2 . . 209 . A 45 VAL HG21 . 34201 1 750 . 1 1 48 48 VAL HG22 H 1 0.690 0.002 . 2 . . 209 . A 45 VAL HG22 . 34201 1 751 . 1 1 48 48 VAL HG23 H 1 0.690 0.002 . 2 . . 209 . A 45 VAL HG23 . 34201 1 752 . 1 1 48 48 VAL CA C 13 61.927 0.033 . 1 . . 773 . A 45 VAL CA . 34201 1 753 . 1 1 48 48 VAL CB C 13 32.126 0.03 . 1 . . 776 . A 45 VAL CB . 34201 1 754 . 1 1 48 48 VAL CG1 C 13 21.057 0.025 . 2 . . 775 . A 45 VAL CG1 . 34201 1 755 . 1 1 48 48 VAL CG2 C 13 20.984 0.039 . 2 . . 774 . A 45 VAL CG2 . 34201 1 756 . 1 1 48 48 VAL N N 15 129.372 0.03 . 1 . . 376 . A 45 VAL N . 34201 1 757 . 1 1 49 49 GLY HA2 H 1 3.983 0.0 . 2 . . 1745 . A 46 GLY HA2 . 34201 1 758 . 1 1 49 49 GLY HA3 H 1 3.983 0.0 . 2 . . 1914 . A 46 GLY HA3 . 34201 1 759 . 1 1 49 49 GLY C C 13 173.604 . . 1 . . 2024 . A 46 GLY C . 34201 1 760 . 1 1 49 49 GLY CA C 13 45.476 0.0 . 1 . . 1744 . A 46 GLY CA . 34201 1 761 . 1 1 50 50 SER H H 1 8.202 0.004 . 1 . . 70 . A 47 SER H . 34201 1 762 . 1 1 50 50 SER HA H 1 4.672 0.003 . 1 . . 1711 . A 47 SER HA . 34201 1 763 . 1 1 50 50 SER HB2 H 1 3.994 0.004 . 2 . . 1713 . A 47 SER HB2 . 34201 1 764 . 1 1 50 50 SER HB3 H 1 3.897 0.006 . 2 . . 1714 . A 47 SER HB3 . 34201 1 765 . 1 1 50 50 SER C C 13 174.810 . . 1 . . 2051 . A 47 SER C . 34201 1 766 . 1 1 50 50 SER CA C 13 57.849 0.058 . 1 . . 1712 . A 47 SER CA . 34201 1 767 . 1 1 50 50 SER CB C 13 64.534 0.058 . 1 . . 1715 . A 47 SER CB . 34201 1 768 . 1 1 50 50 SER N N 15 113.660 0.032 . 1 . . 71 . A 47 SER N . 34201 1 769 . 1 1 51 51 SER H H 1 8.702 0.003 . 1 . . 1143 . A 48 SER H . 34201 1 770 . 1 1 51 51 SER HA H 1 4.420 0.003 . 1 . . 1707 . A 48 SER HA . 34201 1 771 . 1 1 51 51 SER HB2 H 1 4.041 0.0 . 2 . . 1708 . A 48 SER HB2 . 34201 1 772 . 1 1 51 51 SER HB3 H 1 3.882 0.0 . 2 . . 1709 . A 48 SER HB3 . 34201 1 773 . 1 1 51 51 SER C C 13 174.907 . . 1 . . 2086 . A 48 SER C . 34201 1 774 . 1 1 51 51 SER CA C 13 59.289 0.044 . 1 . . 1706 . A 48 SER CA . 34201 1 775 . 1 1 51 51 SER CB C 13 63.666 0.007 . 1 . . 1710 . A 48 SER CB . 34201 1 776 . 1 1 51 51 SER N N 15 117.963 0.014 . 1 . . 1144 . A 48 SER N . 34201 1 777 . 1 1 52 52 ARG H H 1 8.371 0.002 . 1 . . 794 . A 49 ARG H . 34201 1 778 . 1 1 52 52 ARG HA H 1 4.371 0.003 . 1 . . 787 . A 49 ARG HA . 34201 1 779 . 1 1 52 52 ARG HB2 H 1 1.944 0.002 . 2 . . 788 . A 49 ARG HB2 . 34201 1 780 . 1 1 52 52 ARG HB3 H 1 1.769 0.001 . 2 . . 790 . A 49 ARG HB3 . 34201 1 781 . 1 1 52 52 ARG HG2 H 1 1.680 0.001 . 2 . . 792 . A 49 ARG HG2 . 34201 1 782 . 1 1 52 52 ARG HG3 H 1 1.628 0.006 . 2 . . 793 . A 49 ARG HG3 . 34201 1 783 . 1 1 52 52 ARG HD2 H 1 3.208 0.002 . 2 . . 791 . A 49 ARG HD2 . 34201 1 784 . 1 1 52 52 ARG HD3 H 1 3.208 0.002 . 2 . . 1915 . A 49 ARG HD3 . 34201 1 785 . 1 1 52 52 ARG HE H 1 7.280 0.001 . 1 . . 1736 . A 49 ARG HE . 34201 1 786 . 1 1 52 52 ARG C C 13 176.246 . . 1 . . 2026 . A 49 ARG C . 34201 1 787 . 1 1 52 52 ARG CA C 13 56.615 0.057 . 1 . . 786 . A 49 ARG CA . 34201 1 788 . 1 1 52 52 ARG CB C 13 30.613 0.012 . 1 . . 789 . A 49 ARG CB . 34201 1 789 . 1 1 52 52 ARG CG C 13 27.230 0.034 . 1 . . 796 . A 49 ARG CG . 34201 1 790 . 1 1 52 52 ARG CD C 13 43.272 0.028 . 1 . . 795 . A 49 ARG CD . 34201 1 791 . 1 1 52 52 ARG N N 15 120.987 0.031 . 1 . . 6 . A 49 ARG N . 34201 1 792 . 1 1 52 52 ARG NE N 15 84.689 0.012 . 1 . . 1735 . A 49 ARG NE . 34201 1 793 . 1 1 53 53 SER H H 1 7.934 0.001 . 1 . . 564 . A 50 SER H . 34201 1 794 . 1 1 53 53 SER HA H 1 4.481 0.003 . 1 . . 785 . A 50 SER HA . 34201 1 795 . 1 1 53 53 SER HB2 H 1 3.900 0.003 . 2 . . 781 . A 50 SER HB2 . 34201 1 796 . 1 1 53 53 SER HB3 H 1 3.817 0.002 . 2 . . 783 . A 50 SER HB3 . 34201 1 797 . 1 1 53 53 SER C C 13 174.195 . . 1 . . 2107 . A 50 SER C . 34201 1 798 . 1 1 53 53 SER CA C 13 58.222 0.022 . 1 . . 784 . A 50 SER CA . 34201 1 799 . 1 1 53 53 SER CB C 13 63.965 0.041 . 1 . . 782 . A 50 SER CB . 34201 1 800 . 1 1 53 53 SER N N 15 114.390 0.008 . 1 . . 563 . A 50 SER N . 34201 1 801 . 1 1 54 54 LEU H H 1 8.277 0.001 . 1 . . 596 . A 51 LEU H . 34201 1 802 . 1 1 54 54 LEU HA H 1 4.362 0.004 . 1 . . 299 . A 51 LEU HA . 34201 1 803 . 1 1 54 54 LEU HB2 H 1 1.656 0.007 . 2 . . 300 . A 51 LEU HB2 . 34201 1 804 . 1 1 54 54 LEU HB3 H 1 1.623 0.014 . 2 . . 303 . A 51 LEU HB3 . 34201 1 805 . 1 1 54 54 LEU HG H 1 1.598 0.008 . 1 . . 1916 . A 51 LEU HG . 34201 1 806 . 1 1 54 54 LEU HD11 H 1 0.901 0.002 . 2 . . 301 . A 51 LEU HD11 . 34201 1 807 . 1 1 54 54 LEU HD12 H 1 0.901 0.002 . 2 . . 301 . A 51 LEU HD12 . 34201 1 808 . 1 1 54 54 LEU HD13 H 1 0.901 0.002 . 2 . . 301 . A 51 LEU HD13 . 34201 1 809 . 1 1 54 54 LEU HD21 H 1 0.858 0.001 . 2 . . 302 . A 51 LEU HD21 . 34201 1 810 . 1 1 54 54 LEU HD22 H 1 0.858 0.001 . 2 . . 302 . A 51 LEU HD22 . 34201 1 811 . 1 1 54 54 LEU HD23 H 1 0.858 0.001 . 2 . . 302 . A 51 LEU HD23 . 34201 1 812 . 1 1 54 54 LEU C C 13 176.975 . . 1 . . 2056 . A 51 LEU C . 34201 1 813 . 1 1 54 54 LEU CA C 13 55.419 0.032 . 1 . . 778 . A 51 LEU CA . 34201 1 814 . 1 1 54 54 LEU CB C 13 41.605 0.016 . 1 . . 777 . A 51 LEU CB . 34201 1 815 . 1 1 54 54 LEU CG C 13 27.079 0.016 . 1 . . 1917 . A 51 LEU CG . 34201 1 816 . 1 1 54 54 LEU CD1 C 13 25.182 0.03 . 2 . . 780 . A 51 LEU CD1 . 34201 1 817 . 1 1 54 54 LEU CD2 C 13 23.518 0.014 . 2 . . 779 . A 51 LEU CD2 . 34201 1 818 . 1 1 54 54 LEU N N 15 122.357 0.009 . 1 . . 595 . A 51 LEU N . 34201 1 819 . 1 1 55 55 ASP H H 1 8.169 0.007 . 1 . . 537 . A 52 ASP H . 34201 1 820 . 1 1 55 55 ASP HA H 1 4.568 0.002 . 1 . . 1111 . A 52 ASP HA . 34201 1 821 . 1 1 55 55 ASP HB2 H 1 2.564 0.003 . 2 . . 1112 . A 52 ASP HB2 . 34201 1 822 . 1 1 55 55 ASP HB3 H 1 2.623 0.01 . 2 . . 1114 . A 52 ASP HB3 . 34201 1 823 . 1 1 55 55 ASP C C 13 175.812 . . 1 . . 2049 . A 52 ASP C . 34201 1 824 . 1 1 55 55 ASP CA C 13 54.438 0.042 . 1 . . 1113 . A 52 ASP CA . 34201 1 825 . 1 1 55 55 ASP CB C 13 41.054 0.075 . 1 . . 1115 . A 52 ASP CB . 34201 1 826 . 1 1 55 55 ASP N N 15 118.529 0.038 . 1 . . 536 . A 52 ASP N . 34201 1 827 . 1 1 56 56 HIS H H 1 8.345 0.003 . 1 . . 666 . A 53 HIS H . 34201 1 828 . 1 1 56 56 HIS HA H 1 4.855 0.0 . 1 . . 1119 . A 53 HIS HA . 34201 1 829 . 1 1 56 56 HIS HB2 H 1 3.406 0.004 . 2 . . 1116 . A 53 HIS HB2 . 34201 1 830 . 1 1 56 56 HIS HB3 H 1 3.172 0.001 . 2 . . 1117 . A 53 HIS HB3 . 34201 1 831 . 1 1 56 56 HIS HD2 H 1 7.284 0.003 . 1 . . 1656 . A 53 HIS HD2 . 34201 1 832 . 1 1 56 56 HIS HE1 H 1 8.496 0.0 . 1 . . 1934 . A 53 HIS HE1 . 34201 1 833 . 1 1 56 56 HIS C C 13 174.197 . . 1 . . 2103 . A 53 HIS C . 34201 1 834 . 1 1 56 56 HIS CA C 13 55.241 . . 1 . . 2168 . A 53 HIS CA . 34201 1 835 . 1 1 56 56 HIS CB C 13 29.112 0.059 . 1 . . 1118 . A 53 HIS CB . 34201 1 836 . 1 1 56 56 HIS CD2 C 13 120.578 0.044 . 1 . . 1657 . A 53 HIS CD2 . 34201 1 837 . 1 1 56 56 HIS CE1 C 13 136.838 . . 1 . . 1935 . A 53 HIS CE1 . 34201 1 838 . 1 1 56 56 HIS N N 15 117.060 0.021 . 1 . . 665 . A 53 HIS N . 34201 1 839 . 1 1 57 57 ASP H H 1 8.481 0.005 . 1 . . 566 . A 54 ASP H . 34201 1 840 . 1 1 57 57 ASP HA H 1 5.084 0.004 . 1 . . 1121 . A 54 ASP HA . 34201 1 841 . 1 1 57 57 ASP HB2 H 1 2.515 0.007 . 2 . . 1120 . A 54 ASP HB2 . 34201 1 842 . 1 1 57 57 ASP HB3 H 1 2.594 0.005 . 2 . . 1123 . A 54 ASP HB3 . 34201 1 843 . 1 1 57 57 ASP C C 13 176.279 . . 1 . . 2064 . A 54 ASP C . 34201 1 844 . 1 1 57 57 ASP CA C 13 54.141 0.071 . 1 . . 1124 . A 54 ASP CA . 34201 1 845 . 1 1 57 57 ASP CB C 13 41.105 0.041 . 1 . . 1122 . A 54 ASP CB . 34201 1 846 . 1 1 57 57 ASP N N 15 122.093 0.019 . 1 . . 565 . A 54 ASP N . 34201 1 847 . 1 1 58 58 GLN H H 1 8.948 0.003 . 1 . . 604 . A 55 GLN H . 34201 1 848 . 1 1 58 58 GLN HA H 1 4.717 0.003 . 1 . . 1128 . A 55 GLN HA . 34201 1 849 . 1 1 58 58 GLN HB2 H 1 2.038 0.003 . 2 . . 1125 . A 55 GLN HB2 . 34201 1 850 . 1 1 58 58 GLN HB3 H 1 2.158 0.002 . 2 . . 1126 . A 55 GLN HB3 . 34201 1 851 . 1 1 58 58 GLN HG2 H 1 2.392 0.004 . 2 . . 1127 . A 55 GLN HG2 . 34201 1 852 . 1 1 58 58 GLN HG3 H 1 2.392 0.004 . 2 . . 1918 . A 55 GLN HG3 . 34201 1 853 . 1 1 58 58 GLN HE21 H 1 7.893 0.002 . 1 . . 1435 . A 55 GLN HE21 . 34201 1 854 . 1 1 58 58 GLN HE22 H 1 6.717 0.002 . 1 . . 1436 . A 55 GLN HE22 . 34201 1 855 . 1 1 58 58 GLN C C 13 174.641 . . 1 . . 2147 . A 55 GLN C . 34201 1 856 . 1 1 58 58 GLN CA C 13 54.689 0.047 . 1 . . 1129 . A 55 GLN CA . 34201 1 857 . 1 1 58 58 GLN CB C 13 31.985 0.037 . 1 . . 1131 . A 55 GLN CB . 34201 1 858 . 1 1 58 58 GLN CG C 13 33.706 0.05 . 1 . . 1130 . A 55 GLN CG . 34201 1 859 . 1 1 58 58 GLN N N 15 119.240 0.011 . 1 . . 603 . A 55 GLN N . 34201 1 860 . 1 1 58 58 GLN NE2 N 15 111.982 0.021 . 1 . . 1434 . A 55 GLN NE2 . 34201 1 861 . 1 1 59 59 GLU H H 1 9.059 0.001 . 1 . . 642 . A 56 GLU H . 34201 1 862 . 1 1 59 59 GLU HA H 1 4.381 0.012 . 1 . . 1132 . A 56 GLU HA . 34201 1 863 . 1 1 59 59 GLU HB2 H 1 2.053 0.007 . 2 . . 1136 . A 56 GLU HB2 . 34201 1 864 . 1 1 59 59 GLU HB3 H 1 2.041 0.014 . 2 . . 1137 . A 56 GLU HB3 . 34201 1 865 . 1 1 59 59 GLU HG2 H 1 2.063 0.005 . 2 . . 1133 . A 56 GLU HG2 . 34201 1 866 . 1 1 59 59 GLU HG3 H 1 2.176 0.004 . 2 . . 1135 . A 56 GLU HG3 . 34201 1 867 . 1 1 59 59 GLU C C 13 176.145 . . 1 . . 2155 . A 56 GLU C . 34201 1 868 . 1 1 59 59 GLU CA C 13 57.391 0.021 . 1 . . 1134 . A 56 GLU CA . 34201 1 869 . 1 1 59 59 GLU CB C 13 29.716 0.055 . 1 . . 1139 . A 56 GLU CB . 34201 1 870 . 1 1 59 59 GLU CG C 13 36.759 0.041 . 1 . . 1138 . A 56 GLU CG . 34201 1 871 . 1 1 59 59 GLU N N 15 127.616 0.014 . 1 . . 641 . A 56 GLU N . 34201 1 872 . 1 1 60 60 LEU H H 1 9.269 0.01 . 1 . . 542 . A 57 LEU H . 34201 1 873 . 1 1 60 60 LEU HA H 1 4.442 0.004 . 1 . . 283 . A 57 LEU HA . 34201 1 874 . 1 1 60 60 LEU HB2 H 1 1.963 0.0 . 2 . . 285 . A 57 LEU HB2 . 34201 1 875 . 1 1 60 60 LEU HB3 H 1 1.565 . . 2 . . 286 . A 57 LEU HB3 . 34201 1 876 . 1 1 60 60 LEU HG H 1 1.733 0.0 . 1 . . 287 . A 57 LEU HG . 34201 1 877 . 1 1 60 60 LEU HD11 H 1 0.695 0.002 . 2 . . 282 . A 57 LEU HD11 . 34201 1 878 . 1 1 60 60 LEU HD12 H 1 0.695 0.002 . 2 . . 282 . A 57 LEU HD12 . 34201 1 879 . 1 1 60 60 LEU HD13 H 1 0.695 0.002 . 2 . . 282 . A 57 LEU HD13 . 34201 1 880 . 1 1 60 60 LEU HD21 H 1 0.790 0.004 . 2 . . 284 . A 57 LEU HD21 . 34201 1 881 . 1 1 60 60 LEU HD22 H 1 0.790 0.004 . 2 . . 284 . A 57 LEU HD22 . 34201 1 882 . 1 1 60 60 LEU HD23 H 1 0.790 0.004 . 2 . . 284 . A 57 LEU HD23 . 34201 1 883 . 1 1 60 60 LEU C C 13 177.206 . . 1 . . 2027 . A 57 LEU C . 34201 1 884 . 1 1 60 60 LEU CA C 13 55.997 0.047 . 1 . . 797 . A 57 LEU CA . 34201 1 885 . 1 1 60 60 LEU CB C 13 40.761 0.0 . 1 . . 1460 . A 57 LEU CB . 34201 1 886 . 1 1 60 60 LEU CG C 13 26.784 0.0 . 1 . . 1462 . A 57 LEU CG . 34201 1 887 . 1 1 60 60 LEU CD1 C 13 22.130 0.064 . 2 . . 1463 . A 57 LEU CD1 . 34201 1 888 . 1 1 60 60 LEU CD2 C 13 25.904 0.041 . 2 . . 1461 . A 57 LEU CD2 . 34201 1 889 . 1 1 60 60 LEU N N 15 128.707 0.023 . 1 . . 541 . A 57 LEU N . 34201 1 890 . 1 1 61 61 ASP H H 1 7.689 0.004 . 1 . . 584 . A 58 ASP H . 34201 1 891 . 1 1 61 61 ASP HA H 1 4.885 0.005 . 1 . . 801 . A 58 ASP HA . 34201 1 892 . 1 1 61 61 ASP HB2 H 1 2.671 0.014 . 2 . . 802 . A 58 ASP HB2 . 34201 1 893 . 1 1 61 61 ASP HB3 H 1 2.738 0.008 . 2 . . 803 . A 58 ASP HB3 . 34201 1 894 . 1 1 61 61 ASP C C 13 175.015 . . 1 . . 2023 . A 58 ASP C . 34201 1 895 . 1 1 61 61 ASP CA C 13 54.492 0.068 . 1 . . 800 . A 58 ASP CA . 34201 1 896 . 1 1 61 61 ASP CB C 13 46.222 0.04 . 1 . . 583 . A 58 ASP CB . 34201 1 897 . 1 1 61 61 ASP N N 15 114.657 0.019 . 1 . . 582 . A 58 ASP N . 34201 1 898 . 1 1 62 62 SER H H 1 8.990 0.002 . 1 . . 606 . A 59 SER H . 34201 1 899 . 1 1 62 62 SER HA H 1 5.690 0.013 . 1 . . 95 . A 59 SER HA . 34201 1 900 . 1 1 62 62 SER HB2 H 1 3.805 0.009 . 2 . . 96 . A 59 SER HB2 . 34201 1 901 . 1 1 62 62 SER HB3 H 1 3.777 0.003 . 2 . . 97 . A 59 SER HB3 . 34201 1 902 . 1 1 62 62 SER C C 13 173.154 . . 1 . . 2067 . A 59 SER C . 34201 1 903 . 1 1 62 62 SER CA C 13 57.918 0.044 . 1 . . 798 . A 59 SER CA . 34201 1 904 . 1 1 62 62 SER CB C 13 65.994 0.025 . 1 . . 799 . A 59 SER CB . 34201 1 905 . 1 1 62 62 SER N N 15 113.695 0.012 . 1 . . 605 . A 59 SER N . 34201 1 906 . 1 1 63 63 ILE H H 1 9.335 0.005 . 1 . . 466 . A 60 ILE H . 34201 1 907 . 1 1 63 63 ILE HA H 1 4.994 0.007 . 1 . . 136 . A 60 ILE HA . 34201 1 908 . 1 1 63 63 ILE HB H 1 1.688 0.004 . 1 . . 137 . A 60 ILE HB . 34201 1 909 . 1 1 63 63 ILE HG12 H 1 1.101 0.003 . 2 . . 139 . A 60 ILE HG12 . 34201 1 910 . 1 1 63 63 ILE HG13 H 1 0.528 0.005 . 2 . . 140 . A 60 ILE HG13 . 34201 1 911 . 1 1 63 63 ILE HG21 H 1 0.820 0.002 . 1 . . 138 . A 60 ILE HG21 . 34201 1 912 . 1 1 63 63 ILE HG22 H 1 0.820 0.002 . 1 . . 138 . A 60 ILE HG22 . 34201 1 913 . 1 1 63 63 ILE HG23 H 1 0.820 0.002 . 1 . . 138 . A 60 ILE HG23 . 34201 1 914 . 1 1 63 63 ILE HD11 H 1 0.406 0.002 . 1 . . 125 . A 60 ILE HD11 . 34201 1 915 . 1 1 63 63 ILE HD12 H 1 0.406 0.002 . 1 . . 125 . A 60 ILE HD12 . 34201 1 916 . 1 1 63 63 ILE HD13 H 1 0.406 0.002 . 1 . . 125 . A 60 ILE HD13 . 34201 1 917 . 1 1 63 63 ILE C C 13 174.128 . . 1 . . 2120 . A 60 ILE C . 34201 1 918 . 1 1 63 63 ILE CA C 13 58.729 0.053 . 1 . . 805 . A 60 ILE CA . 34201 1 919 . 1 1 63 63 ILE CB C 13 43.006 0.078 . 1 . . 806 . A 60 ILE CB . 34201 1 920 . 1 1 63 63 ILE CG1 C 13 27.173 0.044 . 1 . . 808 . A 60 ILE CG1 . 34201 1 921 . 1 1 63 63 ILE CG2 C 13 19.526 0.035 . 1 . . 804 . A 60 ILE CG2 . 34201 1 922 . 1 1 63 63 ILE CD1 C 13 14.862 0.021 . 1 . . 807 . A 60 ILE CD1 . 34201 1 923 . 1 1 63 63 ILE N N 15 119.483 0.024 . 1 . . 465 . A 60 ILE N . 34201 1 924 . 1 1 64 64 LEU H H 1 9.102 0.004 . 1 . . 1459 . A 61 LEU H . 34201 1 925 . 1 1 64 64 LEU HA H 1 5.528 0.005 . 1 . . 252 . A 61 LEU HA . 34201 1 926 . 1 1 64 64 LEU HB2 H 1 1.645 0.007 . 2 . . 253 . A 61 LEU HB2 . 34201 1 927 . 1 1 64 64 LEU HB3 H 1 1.319 0.011 . 2 . . 254 . A 61 LEU HB3 . 34201 1 928 . 1 1 64 64 LEU HG H 1 1.577 0.002 . 1 . . 257 . A 61 LEU HG . 34201 1 929 . 1 1 64 64 LEU HD11 H 1 0.904 0.002 . 2 . . 255 . A 61 LEU HD11 . 34201 1 930 . 1 1 64 64 LEU HD12 H 1 0.904 0.002 . 2 . . 255 . A 61 LEU HD12 . 34201 1 931 . 1 1 64 64 LEU HD13 H 1 0.904 0.002 . 2 . . 255 . A 61 LEU HD13 . 34201 1 932 . 1 1 64 64 LEU HD21 H 1 0.878 0.001 . 2 . . 256 . A 61 LEU HD21 . 34201 1 933 . 1 1 64 64 LEU HD22 H 1 0.878 0.001 . 2 . . 256 . A 61 LEU HD22 . 34201 1 934 . 1 1 64 64 LEU HD23 H 1 0.878 0.001 . 2 . . 256 . A 61 LEU HD23 . 34201 1 935 . 1 1 64 64 LEU C C 13 177.256 . . 1 . . 2031 . A 61 LEU C . 34201 1 936 . 1 1 64 64 LEU CA C 13 53.229 0.052 . 1 . . 809 . A 61 LEU CA . 34201 1 937 . 1 1 64 64 LEU CB C 13 44.616 0.034 . 1 . . 811 . A 61 LEU CB . 34201 1 938 . 1 1 64 64 LEU CG C 13 27.519 0.028 . 1 . . 813 . A 61 LEU CG . 34201 1 939 . 1 1 64 64 LEU CD1 C 13 25.466 0.034 . 2 . . 812 . A 61 LEU CD1 . 34201 1 940 . 1 1 64 64 LEU CD2 C 13 23.552 0.018 . 2 . . 810 . A 61 LEU CD2 . 34201 1 941 . 1 1 64 64 LEU N N 15 123.248 0.023 . 1 . . 460 . A 61 LEU N . 34201 1 942 . 1 1 65 65 VAL H H 1 8.720 0.004 . 1 . . 592 . A 62 VAL H . 34201 1 943 . 1 1 65 65 VAL HA H 1 4.518 0.006 . 1 . . 166 . A 62 VAL HA . 34201 1 944 . 1 1 65 65 VAL HB H 1 1.752 0.005 . 1 . . 169 . A 62 VAL HB . 34201 1 945 . 1 1 65 65 VAL HG11 H 1 0.344 0.002 . 2 . . 167 . A 62 VAL HG11 . 34201 1 946 . 1 1 65 65 VAL HG12 H 1 0.344 0.002 . 2 . . 167 . A 62 VAL HG12 . 34201 1 947 . 1 1 65 65 VAL HG13 H 1 0.344 0.002 . 2 . . 167 . A 62 VAL HG13 . 34201 1 948 . 1 1 65 65 VAL HG21 H 1 0.412 0.002 . 2 . . 168 . A 62 VAL HG21 . 34201 1 949 . 1 1 65 65 VAL HG22 H 1 0.412 0.002 . 2 . . 168 . A 62 VAL HG22 . 34201 1 950 . 1 1 65 65 VAL HG23 H 1 0.412 0.002 . 2 . . 168 . A 62 VAL HG23 . 34201 1 951 . 1 1 65 65 VAL C C 13 173.822 . . 1 . . 2021 . A 62 VAL C . 34201 1 952 . 1 1 65 65 VAL CA C 13 59.875 0.043 . 1 . . 815 . A 62 VAL CA . 34201 1 953 . 1 1 65 65 VAL CB C 13 35.304 0.051 . 1 . . 817 . A 62 VAL CB . 34201 1 954 . 1 1 65 65 VAL CG1 C 13 21.569 0.023 . 2 . . 816 . A 62 VAL CG1 . 34201 1 955 . 1 1 65 65 VAL CG2 C 13 20.385 0.023 . 2 . . 814 . A 62 VAL CG2 . 34201 1 956 . 1 1 65 65 VAL N N 15 115.051 0.028 . 1 . . 591 . A 62 VAL N . 34201 1 957 . 1 1 66 66 GLY H H 1 8.520 0.004 . 1 . . 626 . A 63 GLY H . 34201 1 958 . 1 1 66 66 GLY HA2 H 1 4.897 0.008 . 2 . . 1140 . A 63 GLY HA2 . 34201 1 959 . 1 1 66 66 GLY HA3 H 1 3.546 0.006 . 2 . . 1142 . A 63 GLY HA3 . 34201 1 960 . 1 1 66 66 GLY CA C 13 44.908 0.047 . 1 . . 1141 . A 63 GLY CA . 34201 1 961 . 1 1 66 66 GLY N N 15 111.357 0.039 . 1 . . 624 . A 63 GLY N . 34201 1 962 . 1 1 67 67 PRO HA H 1 4.664 0.004 . 1 . . 1330 . A 64 PRO HA . 34201 1 963 . 1 1 67 67 PRO HB2 H 1 2.470 0.005 . 2 . . 1327 . A 64 PRO HB2 . 34201 1 964 . 1 1 67 67 PRO HB3 H 1 2.028 0.002 . 2 . . 1328 . A 64 PRO HB3 . 34201 1 965 . 1 1 67 67 PRO HG2 H 1 1.962 0.003 . 2 . . 1331 . A 64 PRO HG2 . 34201 1 966 . 1 1 67 67 PRO HG3 H 1 1.962 0.003 . 2 . . 1919 . A 64 PRO HG3 . 34201 1 967 . 1 1 67 67 PRO HD2 H 1 3.696 0.004 . 2 . . 1333 . A 64 PRO HD2 . 34201 1 968 . 1 1 67 67 PRO HD3 H 1 3.663 0.007 . 2 . . 1920 . A 64 PRO HD3 . 34201 1 969 . 1 1 67 67 PRO C C 13 176.966 . . 1 . . 2136 . A 64 PRO C . 34201 1 970 . 1 1 67 67 PRO CA C 13 61.940 0.063 . 1 . . 1329 . A 64 PRO CA . 34201 1 971 . 1 1 67 67 PRO CB C 13 34.088 0.019 . 1 . . 1326 . A 64 PRO CB . 34201 1 972 . 1 1 67 67 PRO CG C 13 25.438 0.029 . 1 . . 1332 . A 64 PRO CG . 34201 1 973 . 1 1 67 67 PRO CD C 13 50.669 0.022 . 1 . . 1334 . A 64 PRO CD . 34201 1 974 . 1 1 68 68 VAL H H 1 9.202 0.003 . 1 . . 545 . A 65 VAL H . 34201 1 975 . 1 1 68 68 VAL HA H 1 4.354 0.008 . 1 . . 203 . A 65 VAL HA . 34201 1 976 . 1 1 68 68 VAL HB H 1 2.418 0.004 . 1 . . 204 . A 65 VAL HB . 34201 1 977 . 1 1 68 68 VAL HG11 H 1 1.236 0.001 . 2 . . 205 . A 65 VAL HG11 . 34201 1 978 . 1 1 68 68 VAL HG12 H 1 1.236 0.001 . 2 . . 205 . A 65 VAL HG12 . 34201 1 979 . 1 1 68 68 VAL HG13 H 1 1.236 0.001 . 2 . . 205 . A 65 VAL HG13 . 34201 1 980 . 1 1 68 68 VAL HG21 H 1 1.259 0.001 . 2 . . 1510 . A 65 VAL HG21 . 34201 1 981 . 1 1 68 68 VAL HG22 H 1 1.259 0.001 . 2 . . 1510 . A 65 VAL HG22 . 34201 1 982 . 1 1 68 68 VAL HG23 H 1 1.259 0.001 . 2 . . 1510 . A 65 VAL HG23 . 34201 1 983 . 1 1 68 68 VAL CA C 13 60.681 0.035 . 1 . . 818 . A 65 VAL CA . 34201 1 984 . 1 1 68 68 VAL CB C 13 33.269 0.059 . 1 . . 819 . A 65 VAL CB . 34201 1 985 . 1 1 68 68 VAL CG1 C 13 22.682 0.03 . 2 . . 820 . A 65 VAL CG1 . 34201 1 986 . 1 1 68 68 VAL CG2 C 13 24.192 0.032 . 2 . . 1511 . A 65 VAL CG2 . 34201 1 987 . 1 1 68 68 VAL N N 15 125.999 0.015 . 1 . . 543 . A 65 VAL N . 34201 1 988 . 1 1 69 69 PRO HA H 1 4.656 0.002 . 1 . . 1336 . A 66 PRO HA . 34201 1 989 . 1 1 69 69 PRO HB2 H 1 2.238 0.003 . 2 . . 1335 . A 66 PRO HB2 . 34201 1 990 . 1 1 69 69 PRO HB3 H 1 1.994 0.003 . 2 . . 1338 . A 66 PRO HB3 . 34201 1 991 . 1 1 69 69 PRO HG2 H 1 2.112 0.002 . 2 . . 1481 . A 66 PRO HG2 . 34201 1 992 . 1 1 69 69 PRO HG3 H 1 1.957 0.004 . 2 . . 1483 . A 66 PRO HG3 . 34201 1 993 . 1 1 69 69 PRO HD2 H 1 3.874 0.006 . 2 . . 1440 . A 66 PRO HD2 . 34201 1 994 . 1 1 69 69 PRO HD3 H 1 4.191 0.007 . 2 . . 1441 . A 66 PRO HD3 . 34201 1 995 . 1 1 69 69 PRO C C 13 175.852 . . 1 . . 2063 . A 66 PRO C . 34201 1 996 . 1 1 69 69 PRO CA C 13 61.910 0.029 . 1 . . 1339 . A 66 PRO CA . 34201 1 997 . 1 1 69 69 PRO CB C 13 32.172 0.036 . 1 . . 1337 . A 66 PRO CB . 34201 1 998 . 1 1 69 69 PRO CG C 13 26.865 0.03 . 1 . . 1482 . A 66 PRO CG . 34201 1 999 . 1 1 69 69 PRO CD C 13 51.177 0.015 . 1 . . 1442 . A 66 PRO CD . 34201 1 1000 . 1 1 70 70 VAL H H 1 7.938 0.002 . 1 . . 610 . A 67 VAL H . 34201 1 1001 . 1 1 70 70 VAL HA H 1 3.595 0.004 . 1 . . 218 . A 67 VAL HA . 34201 1 1002 . 1 1 70 70 VAL HB H 1 1.859 0.002 . 1 . . 219 . A 67 VAL HB . 34201 1 1003 . 1 1 70 70 VAL HG11 H 1 0.849 0.002 . 2 . . 220 . A 67 VAL HG11 . 34201 1 1004 . 1 1 70 70 VAL HG12 H 1 0.849 0.002 . 2 . . 220 . A 67 VAL HG12 . 34201 1 1005 . 1 1 70 70 VAL HG13 H 1 0.849 0.002 . 2 . . 220 . A 67 VAL HG13 . 34201 1 1006 . 1 1 70 70 VAL HG21 H 1 0.824 0.006 . 2 . . 221 . A 67 VAL HG21 . 34201 1 1007 . 1 1 70 70 VAL HG22 H 1 0.824 0.006 . 2 . . 221 . A 67 VAL HG22 . 34201 1 1008 . 1 1 70 70 VAL HG23 H 1 0.824 0.006 . 2 . . 221 . A 67 VAL HG23 . 34201 1 1009 . 1 1 70 70 VAL C C 13 176.249 . . 1 . . 2035 . A 67 VAL C . 34201 1 1010 . 1 1 70 70 VAL CA C 13 63.608 0.045 . 1 . . 821 . A 67 VAL CA . 34201 1 1011 . 1 1 70 70 VAL CB C 13 31.830 0.017 . 1 . . 822 . A 67 VAL CB . 34201 1 1012 . 1 1 70 70 VAL CG1 C 13 20.876 0.025 . 2 . . 1877 . A 67 VAL CG1 . 34201 1 1013 . 1 1 70 70 VAL CG2 C 13 21.999 0.066 . 2 . . 823 . A 67 VAL CG2 . 34201 1 1014 . 1 1 70 70 VAL N N 15 119.139 0.015 . 1 . . 609 . A 67 VAL N . 34201 1 1015 . 1 1 71 71 GLY H H 1 8.805 0.002 . 1 . . 650 . A 68 GLY H . 34201 1 1016 . 1 1 71 71 GLY HA2 H 1 4.557 0.006 . 2 . . 828 . A 68 GLY HA2 . 34201 1 1017 . 1 1 71 71 GLY HA3 H 1 3.850 0.004 . 2 . . 829 . A 68 GLY HA3 . 34201 1 1018 . 1 1 71 71 GLY C C 13 172.589 . . 1 . . 2108 . A 68 GLY C . 34201 1 1019 . 1 1 71 71 GLY CA C 13 43.590 0.038 . 1 . . 827 . A 68 GLY CA . 34201 1 1020 . 1 1 71 71 GLY N N 15 115.558 0.016 . 1 . . 649 . A 68 GLY N . 34201 1 1021 . 1 1 72 72 VAL H H 1 8.599 0.002 . 1 . . 662 . A 69 VAL H . 34201 1 1022 . 1 1 72 72 VAL HA H 1 4.274 0.006 . 1 . . 223 . A 69 VAL HA . 34201 1 1023 . 1 1 72 72 VAL HB H 1 1.952 0.006 . 1 . . 225 . A 69 VAL HB . 34201 1 1024 . 1 1 72 72 VAL HG11 H 1 0.872 0.004 . 2 . . 222 . A 69 VAL HG11 . 34201 1 1025 . 1 1 72 72 VAL HG12 H 1 0.872 0.004 . 2 . . 222 . A 69 VAL HG12 . 34201 1 1026 . 1 1 72 72 VAL HG13 H 1 0.872 0.004 . 2 . . 222 . A 69 VAL HG13 . 34201 1 1027 . 1 1 72 72 VAL HG21 H 1 0.723 0.006 . 2 . . 224 . A 69 VAL HG21 . 34201 1 1028 . 1 1 72 72 VAL HG22 H 1 0.723 0.006 . 2 . . 224 . A 69 VAL HG22 . 34201 1 1029 . 1 1 72 72 VAL HG23 H 1 0.723 0.006 . 2 . . 224 . A 69 VAL HG23 . 34201 1 1030 . 1 1 72 72 VAL C C 13 174.437 . . 1 . . 2138 . A 69 VAL C . 34201 1 1031 . 1 1 72 72 VAL CA C 13 63.195 0.023 . 1 . . 1357 . A 69 VAL CA . 34201 1 1032 . 1 1 72 72 VAL CB C 13 31.470 0.038 . 1 . . 826 . A 69 VAL CB . 34201 1 1033 . 1 1 72 72 VAL CG1 C 13 21.867 0.048 . 2 . . 825 . A 69 VAL CG1 . 34201 1 1034 . 1 1 72 72 VAL CG2 C 13 22.434 0.057 . 2 . . 824 . A 69 VAL CG2 . 34201 1 1035 . 1 1 72 72 VAL N N 15 122.375 0.015 . 1 . . 661 . A 69 VAL N . 34201 1 1036 . 1 1 73 73 ASN H H 1 9.006 0.004 . 1 . . 581 . A 70 ASN H . 34201 1 1037 . 1 1 73 73 ASN HA H 1 5.561 0.007 . 1 . . 830 . A 70 ASN HA . 34201 1 1038 . 1 1 73 73 ASN HB2 H 1 1.956 0.012 . 2 . . 831 . A 70 ASN HB2 . 34201 1 1039 . 1 1 73 73 ASN HB3 H 1 0.922 0.005 . 2 . . 832 . A 70 ASN HB3 . 34201 1 1040 . 1 1 73 73 ASN HD21 H 1 6.760 0.005 . 1 . . 1870 . A 70 ASN HD21 . 34201 1 1041 . 1 1 73 73 ASN HD22 H 1 4.949 . . 1 . . 1884 . A 70 ASN HD22 . 34201 1 1042 . 1 1 73 73 ASN C C 13 172.861 . . 1 . . 2061 . A 70 ASN C . 34201 1 1043 . 1 1 73 73 ASN CA C 13 51.966 0.052 . 1 . . 16 . A 70 ASN CA . 34201 1 1044 . 1 1 73 73 ASN CB C 13 45.026 0.053 . 1 . . 833 . A 70 ASN CB . 34201 1 1045 . 1 1 73 73 ASN N N 15 126.314 0.023 . 1 . . 580 . A 70 ASN N . 34201 1 1046 . 1 1 73 73 ASN ND2 N 15 109.482 0.023 . 1 . . 1871 . A 70 ASN ND2 . 34201 1 1047 . 1 1 74 74 LYS H H 1 8.811 0.004 . 1 . . 1341 . A 71 LYS H . 34201 1 1048 . 1 1 74 74 LYS HA H 1 5.880 0.004 . 1 . . 320 . A 71 LYS HA . 34201 1 1049 . 1 1 74 74 LYS HB2 H 1 1.553 0.004 . 2 . . 321 . A 71 LYS HB2 . 34201 1 1050 . 1 1 74 74 LYS HB3 H 1 1.640 0.003 . 2 . . 322 . A 71 LYS HB3 . 34201 1 1051 . 1 1 74 74 LYS HG2 H 1 1.222 0.005 . 2 . . 325 . A 71 LYS HG2 . 34201 1 1052 . 1 1 74 74 LYS HG3 H 1 1.288 0.003 . 2 . . 326 . A 71 LYS HG3 . 34201 1 1053 . 1 1 74 74 LYS HD2 H 1 1.467 0.003 . 2 . . 327 . A 71 LYS HD2 . 34201 1 1054 . 1 1 74 74 LYS HD3 H 1 1.435 0.003 . 2 . . 328 . A 71 LYS HD3 . 34201 1 1055 . 1 1 74 74 LYS HE2 H 1 2.726 0.002 . 2 . . 323 . A 71 LYS HE2 . 34201 1 1056 . 1 1 74 74 LYS HE3 H 1 2.726 0.002 . 2 . . 1921 . A 71 LYS HE3 . 34201 1 1057 . 1 1 74 74 LYS C C 13 174.307 . . 1 . . 2044 . A 71 LYS C . 34201 1 1058 . 1 1 74 74 LYS CA C 13 54.373 0.031 . 1 . . 15 . A 71 LYS CA . 34201 1 1059 . 1 1 74 74 LYS CB C 13 37.849 0.032 . 1 . . 834 . A 71 LYS CB . 34201 1 1060 . 1 1 74 74 LYS CG C 13 24.425 0.042 . 1 . . 835 . A 71 LYS CG . 34201 1 1061 . 1 1 74 74 LYS CD C 13 29.827 0.06 . 1 . . 836 . A 71 LYS CD . 34201 1 1062 . 1 1 74 74 LYS CE C 13 41.831 0.057 . 1 . . 324 . A 71 LYS CE . 34201 1 1063 . 1 1 74 74 LYS N N 15 118.989 0.02 . 1 . . 438 . A 71 LYS N . 34201 1 1064 . 1 1 75 75 PHE H H 1 8.519 0.003 . 1 . . 1340 . A 72 PHE H . 34201 1 1065 . 1 1 75 75 PHE HA H 1 5.074 0.003 . 1 . . 1106 . A 72 PHE HA . 34201 1 1066 . 1 1 75 75 PHE HB2 H 1 2.881 0.0 . 2 . . 1452 . A 72 PHE HB2 . 34201 1 1067 . 1 1 75 75 PHE HB3 H 1 3.355 0.0 . 2 . . 1453 . A 72 PHE HB3 . 34201 1 1068 . 1 1 75 75 PHE HD1 H 1 6.873 0.004 . 1 . . 1488 . A 72 PHE HD1 . 34201 1 1069 . 1 1 75 75 PHE HD2 H 1 6.873 0.004 . 1 . . 1488 . A 72 PHE HD2 . 34201 1 1070 . 1 1 75 75 PHE HE1 H 1 6.868 0.002 . 1 . . 1964 . A 72 PHE HE1 . 34201 1 1071 . 1 1 75 75 PHE HE2 H 1 6.868 0.002 . 1 . . 1964 . A 72 PHE HE2 . 34201 1 1072 . 1 1 75 75 PHE HZ H 1 6.544 0.007 . 1 . . 1489 . A 72 PHE HZ . 34201 1 1073 . 1 1 75 75 PHE C C 13 171.628 . . 1 . . 2069 . A 72 PHE C . 34201 1 1074 . 1 1 75 75 PHE CA C 13 56.344 0.031 . 1 . . 1451 . A 72 PHE CA . 34201 1 1075 . 1 1 75 75 PHE CB C 13 41.927 0.039 . 1 . . 1454 . A 72 PHE CB . 34201 1 1076 . 1 1 75 75 PHE CD1 C 13 131.511 0.13 . 1 . . 1495 . A 72 PHE CD1 . 34201 1 1077 . 1 1 75 75 PHE CD2 C 13 131.511 0.13 . 1 . . 1495 . A 72 PHE CD2 . 34201 1 1078 . 1 1 75 75 PHE CE1 C 13 131.255 0.005 . 1 . . 1965 . A 72 PHE CE1 . 34201 1 1079 . 1 1 75 75 PHE CE2 C 13 131.255 0.005 . 1 . . 1965 . A 72 PHE CE2 . 34201 1 1080 . 1 1 75 75 PHE CZ C 13 129.738 0.122 . 1 . . 1490 . A 72 PHE CZ . 34201 1 1081 . 1 1 75 75 PHE N N 15 116.572 0.014 . 1 . . 538 . A 72 PHE N . 34201 1 1082 . 1 1 76 76 VAL H H 1 8.742 0.004 . 1 . . 547 . A 73 VAL H . 34201 1 1083 . 1 1 76 76 VAL HA H 1 4.820 0.0 . 1 . . 187 . A 73 VAL HA . 34201 1 1084 . 1 1 76 76 VAL HB H 1 1.939 0.007 . 1 . . 190 . A 73 VAL HB . 34201 1 1085 . 1 1 76 76 VAL HG11 H 1 0.883 0.003 . 2 . . 186 . A 73 VAL HG11 . 34201 1 1086 . 1 1 76 76 VAL HG12 H 1 0.883 0.003 . 2 . . 186 . A 73 VAL HG12 . 34201 1 1087 . 1 1 76 76 VAL HG13 H 1 0.883 0.003 . 2 . . 186 . A 73 VAL HG13 . 34201 1 1088 . 1 1 76 76 VAL HG21 H 1 0.749 0.002 . 2 . . 188 . A 73 VAL HG21 . 34201 1 1089 . 1 1 76 76 VAL HG22 H 1 0.749 0.002 . 2 . . 188 . A 73 VAL HG22 . 34201 1 1090 . 1 1 76 76 VAL HG23 H 1 0.749 0.002 . 2 . . 188 . A 73 VAL HG23 . 34201 1 1091 . 1 1 76 76 VAL C C 13 175.143 . . 1 . . 2159 . A 73 VAL C . 34201 1 1092 . 1 1 76 76 VAL CA C 13 61.118 0.0 . 1 . . 839 . A 73 VAL CA . 34201 1 1093 . 1 1 76 76 VAL CB C 13 33.324 0.022 . 1 . . 838 . A 73 VAL CB . 34201 1 1094 . 1 1 76 76 VAL CG1 C 13 21.644 0.022 . 2 . . 840 . A 73 VAL CG1 . 34201 1 1095 . 1 1 76 76 VAL CG2 C 13 20.555 0.021 . 2 . . 837 . A 73 VAL CG2 . 34201 1 1096 . 1 1 76 76 VAL N N 15 119.945 0.016 . 1 . . 546 . A 73 VAL N . 34201 1 1097 . 1 1 77 77 PHE H H 1 9.220 0.006 . 1 . . 437 . A 74 PHE H . 34201 1 1098 . 1 1 77 77 PHE HA H 1 4.965 . . 1 . . 1149 . A 74 PHE HA . 34201 1 1099 . 1 1 77 77 PHE HB2 H 1 2.817 0.009 . 2 . . 1147 . A 74 PHE HB2 . 34201 1 1100 . 1 1 77 77 PHE HB3 H 1 3.331 . . 2 . . 1148 . A 74 PHE HB3 . 34201 1 1101 . 1 1 77 77 PHE HD1 H 1 7.046 0.008 . 1 . . 1493 . A 74 PHE HD1 . 34201 1 1102 . 1 1 77 77 PHE HD2 H 1 7.046 0.008 . 1 . . 1493 . A 74 PHE HD2 . 34201 1 1103 . 1 1 77 77 PHE HE1 H 1 7.108 0.003 . 1 . . 1491 . A 74 PHE HE1 . 34201 1 1104 . 1 1 77 77 PHE HE2 H 1 7.108 0.003 . 1 . . 1491 . A 74 PHE HE2 . 34201 1 1105 . 1 1 77 77 PHE HZ H 1 7.057 0.008 . 1 . . 1814 . A 74 PHE HZ . 34201 1 1106 . 1 1 77 77 PHE C C 13 173.345 . . 1 . . 2114 . A 74 PHE C . 34201 1 1107 . 1 1 77 77 PHE CB C 13 40.869 0.0 . 1 . . 1668 . A 74 PHE CB . 34201 1 1108 . 1 1 77 77 PHE CD1 C 13 130.126 0.087 . 1 . . 1494 . A 74 PHE CD1 . 34201 1 1109 . 1 1 77 77 PHE CD2 C 13 130.126 0.087 . 1 . . 1494 . A 74 PHE CD2 . 34201 1 1110 . 1 1 77 77 PHE CE1 C 13 131.252 0.05 . 1 . . 1492 . A 74 PHE CE1 . 34201 1 1111 . 1 1 77 77 PHE CE2 C 13 131.252 0.05 . 1 . . 1492 . A 74 PHE CE2 . 34201 1 1112 . 1 1 77 77 PHE CZ C 13 128.957 0.074 . 1 . . 1815 . A 74 PHE CZ . 34201 1 1113 . 1 1 77 77 PHE N N 15 129.576 0.018 . 1 . . 435 . A 74 PHE N . 34201 1 1114 . 1 1 78 78 SER H H 1 8.572 0.003 . 1 . . 664 . A 75 SER H . 34201 1 1115 . 1 1 78 78 SER HA H 1 5.547 0.005 . 1 . . 75 . A 75 SER HA . 34201 1 1116 . 1 1 78 78 SER HB2 H 1 3.765 0.001 . 2 . . 72 . A 75 SER HB2 . 34201 1 1117 . 1 1 78 78 SER HB3 H 1 3.637 0.002 . 2 . . 73 . A 75 SER HB3 . 34201 1 1118 . 1 1 78 78 SER C C 13 173.186 . . 1 . . 2150 . A 75 SER C . 34201 1 1119 . 1 1 78 78 SER CA C 13 56.024 0.009 . 1 . . 76 . A 75 SER CA . 34201 1 1120 . 1 1 78 78 SER CB C 13 63.796 0.019 . 1 . . 74 . A 75 SER CB . 34201 1 1121 . 1 1 78 78 SER N N 15 122.805 0.015 . 1 . . 663 . A 75 SER N . 34201 1 1122 . 1 1 79 79 ALA H H 1 8.876 0.004 . 1 . . 533 . A 76 ALA H . 34201 1 1123 . 1 1 79 79 ALA HA H 1 4.980 0.003 . 1 . . 844 . A 76 ALA HA . 34201 1 1124 . 1 1 79 79 ALA HB1 H 1 1.161 0.003 . 1 . . 841 . A 76 ALA HB1 . 34201 1 1125 . 1 1 79 79 ALA HB2 H 1 1.161 0.003 . 1 . . 841 . A 76 ALA HB2 . 34201 1 1126 . 1 1 79 79 ALA HB3 H 1 1.161 0.003 . 1 . . 841 . A 76 ALA HB3 . 34201 1 1127 . 1 1 79 79 ALA C C 13 175.597 . . 1 . . 2115 . A 76 ALA C . 34201 1 1128 . 1 1 79 79 ALA CA C 13 49.722 0.022 . 1 . . 843 . A 76 ALA CA . 34201 1 1129 . 1 1 79 79 ALA CB C 13 24.060 0.035 . 1 . . 842 . A 76 ALA CB . 34201 1 1130 . 1 1 79 79 ALA N N 15 128.020 0.027 . 1 . . 532 . A 76 ALA N . 34201 1 1131 . 1 1 80 80 ASP H H 1 8.950 0.002 . 1 . . 553 . A 77 ASP H . 34201 1 1132 . 1 1 80 80 ASP HA H 1 4.684 0.007 . 1 . . 1152 . A 77 ASP HA . 34201 1 1133 . 1 1 80 80 ASP HB2 H 1 2.565 . . 2 . . 1150 . A 77 ASP HB2 . 34201 1 1134 . 1 1 80 80 ASP HB3 H 1 2.729 0.0 . 2 . . 1151 . A 77 ASP HB3 . 34201 1 1135 . 1 1 80 80 ASP CA C 13 53.206 0.035 . 1 . . 1154 . A 77 ASP CA . 34201 1 1136 . 1 1 80 80 ASP CB C 13 40.184 0.0 . 1 . . 1153 . A 77 ASP CB . 34201 1 1137 . 1 1 80 80 ASP N N 15 122.927 0.011 . 1 . . 552 . A 77 ASP N . 34201 1 1138 . 1 1 81 81 PRO HA H 1 4.664 0.003 . 1 . . 1947 . A 78 PRO HA . 34201 1 1139 . 1 1 81 81 PRO HG2 H 1 1.665 0.0 . 2 . . 1888 . A 78 PRO HG2 . 34201 1 1140 . 1 1 81 81 PRO HG3 H 1 1.900 0.0 . 2 . . 1889 . A 78 PRO HG3 . 34201 1 1141 . 1 1 81 81 PRO HD2 H 1 3.312 0.002 . 2 . . 1885 . A 78 PRO HD2 . 34201 1 1142 . 1 1 81 81 PRO HD3 H 1 3.549 0.0 . 2 . . 1886 . A 78 PRO HD3 . 34201 1 1143 . 1 1 81 81 PRO CA C 13 60.930 0.016 . 1 . . 1948 . A 78 PRO CA . 34201 1 1144 . 1 1 81 81 PRO CG C 13 26.594 0.011 . 1 . . 1946 . A 78 PRO CG . 34201 1 1145 . 1 1 81 81 PRO CD C 13 49.940 0.019 . 1 . . 1887 . A 78 PRO CD . 34201 1 1146 . 1 1 82 82 PRO HA H 1 4.175 0.013 . 1 . . 1890 . A 79 PRO HA . 34201 1 1147 . 1 1 82 82 PRO HB2 H 1 1.538 0.008 . 2 . . 1893 . A 79 PRO HB2 . 34201 1 1148 . 1 1 82 82 PRO HB3 H 1 1.405 0.008 . 2 . . 1894 . A 79 PRO HB3 . 34201 1 1149 . 1 1 82 82 PRO HG2 H 1 1.224 . . 2 . . 1898 . A 79 PRO HG2 . 34201 1 1150 . 1 1 82 82 PRO HG3 H 1 1.131 0.001 . 2 . . 1899 . A 79 PRO HG3 . 34201 1 1151 . 1 1 82 82 PRO HD2 H 1 3.197 0.014 . 2 . . 1896 . A 79 PRO HD2 . 34201 1 1152 . 1 1 82 82 PRO HD3 H 1 3.439 0.0 . 2 . . 1897 . A 79 PRO HD3 . 34201 1 1153 . 1 1 82 82 PRO C C 13 175.455 . . 1 . . 2025 . A 79 PRO C . 34201 1 1154 . 1 1 82 82 PRO CA C 13 61.946 0.049 . 1 . . 1891 . A 79 PRO CA . 34201 1 1155 . 1 1 82 82 PRO CB C 13 31.751 0.026 . 1 . . 1892 . A 79 PRO CB . 34201 1 1156 . 1 1 82 82 PRO CG C 13 26.845 0.074 . 1 . . 1900 . A 79 PRO CG . 34201 1 1157 . 1 1 82 82 PRO CD C 13 50.175 0.046 . 1 . . 1895 . A 79 PRO CD . 34201 1 1158 . 1 1 83 83 SER H H 1 8.394 0.007 . 1 . . 522 . A 80 SER H . 34201 1 1159 . 1 1 83 83 SER HA H 1 4.525 0.003 . 1 . . 101 . A 80 SER HA . 34201 1 1160 . 1 1 83 83 SER HB2 H 1 3.989 0.002 . 2 . . 103 . A 80 SER HB2 . 34201 1 1161 . 1 1 83 83 SER HB3 H 1 3.836 0.003 . 2 . . 104 . A 80 SER HB3 . 34201 1 1162 . 1 1 83 83 SER CA C 13 57.292 0.037 . 1 . . 845 . A 80 SER CA . 34201 1 1163 . 1 1 83 83 SER CB C 13 63.726 0.027 . 1 . . 846 . A 80 SER CB . 34201 1 1164 . 1 1 83 83 SER N N 15 113.762 0.024 . 1 . . 521 . A 80 SER N . 34201 1 1165 . 1 1 84 84 ALA H H 1 9.063 0.003 . 1 . . 540 . A 81 ALA H . 34201 1 1166 . 1 1 84 84 ALA HA H 1 3.988 0.005 . 1 . . 155 . A 81 ALA HA . 34201 1 1167 . 1 1 84 84 ALA HB1 H 1 1.385 0.001 . 1 . . 154 . A 81 ALA HB1 . 34201 1 1168 . 1 1 84 84 ALA HB2 H 1 1.385 0.001 . 1 . . 154 . A 81 ALA HB2 . 34201 1 1169 . 1 1 84 84 ALA HB3 H 1 1.385 0.001 . 1 . . 154 . A 81 ALA HB3 . 34201 1 1170 . 1 1 84 84 ALA C C 13 178.500 . . 1 . . 2028 . A 81 ALA C . 34201 1 1171 . 1 1 84 84 ALA CA C 13 54.609 0.024 . 1 . . 848 . A 81 ALA CA . 34201 1 1172 . 1 1 84 84 ALA CB C 13 18.891 0.023 . 1 . . 847 . A 81 ALA CB . 34201 1 1173 . 1 1 84 84 ALA N N 15 129.194 0.027 . 1 . . 539 . A 81 ALA N . 34201 1 1174 . 1 1 85 85 GLU H H 1 8.454 0.004 . 1 . . 561 . A 82 GLU H . 34201 1 1175 . 1 1 85 85 GLU HA H 1 4.141 0.003 . 1 . . 849 . A 82 GLU HA . 34201 1 1176 . 1 1 85 85 GLU HB2 H 1 1.945 0.003 . 2 . . 852 . A 82 GLU HB2 . 34201 1 1177 . 1 1 85 85 GLU HB3 H 1 2.076 0.016 . 2 . . 853 . A 82 GLU HB3 . 34201 1 1178 . 1 1 85 85 GLU HG2 H 1 2.294 0.002 . 2 . . 854 . A 82 GLU HG2 . 34201 1 1179 . 1 1 85 85 GLU HG3 H 1 2.295 0.002 . 2 . . 1922 . A 82 GLU HG3 . 34201 1 1180 . 1 1 85 85 GLU C C 13 177.232 . . 1 . . 2047 . A 82 GLU C . 34201 1 1181 . 1 1 85 85 GLU CA C 13 58.115 0.051 . 1 . . 850 . A 82 GLU CA . 34201 1 1182 . 1 1 85 85 GLU CB C 13 29.247 0.032 . 1 . . 851 . A 82 GLU CB . 34201 1 1183 . 1 1 85 85 GLU CG C 13 36.331 0.027 . 1 . . 855 . A 82 GLU CG . 34201 1 1184 . 1 1 85 85 GLU N N 15 114.827 0.017 . 1 . . 560 . A 82 GLU N . 34201 1 1185 . 1 1 86 86 LEU H H 1 7.362 0.002 . 1 . . 594 . A 83 LEU H . 34201 1 1186 . 1 1 86 86 LEU HA H 1 4.413 0.002 . 1 . . 857 . A 83 LEU HA . 34201 1 1187 . 1 1 86 86 LEU HB2 H 1 1.766 0.006 . 2 . . 860 . A 83 LEU HB2 . 34201 1 1188 . 1 1 86 86 LEU HB3 H 1 1.693 0.002 . 2 . . 862 . A 83 LEU HB3 . 34201 1 1189 . 1 1 86 86 LEU HG H 1 1.571 0.001 . 1 . . 864 . A 83 LEU HG . 34201 1 1190 . 1 1 86 86 LEU HD11 H 1 0.919 0.002 . 2 . . 856 . A 83 LEU HD11 . 34201 1 1191 . 1 1 86 86 LEU HD12 H 1 0.919 0.002 . 2 . . 856 . A 83 LEU HD12 . 34201 1 1192 . 1 1 86 86 LEU HD13 H 1 0.919 0.002 . 2 . . 856 . A 83 LEU HD13 . 34201 1 1193 . 1 1 86 86 LEU HD21 H 1 0.834 0.027 . 2 . . 859 . A 83 LEU HD21 . 34201 1 1194 . 1 1 86 86 LEU HD22 H 1 0.834 0.027 . 2 . . 859 . A 83 LEU HD22 . 34201 1 1195 . 1 1 86 86 LEU HD23 H 1 0.834 0.027 . 2 . . 859 . A 83 LEU HD23 . 34201 1 1196 . 1 1 86 86 LEU CA C 13 54.605 0.027 . 1 . . 858 . A 83 LEU CA . 34201 1 1197 . 1 1 86 86 LEU CB C 13 42.763 0.04 . 1 . . 861 . A 83 LEU CB . 34201 1 1198 . 1 1 86 86 LEU CG C 13 27.127 0.026 . 1 . . 863 . A 83 LEU CG . 34201 1 1199 . 1 1 86 86 LEU CD1 C 13 25.251 0.013 . 2 . . 865 . A 83 LEU CD1 . 34201 1 1200 . 1 1 86 86 LEU CD2 C 13 22.580 0.061 . 2 . . 866 . A 83 LEU CD2 . 34201 1 1201 . 1 1 86 86 LEU N N 15 117.039 0.015 . 1 . . 593 . A 83 LEU N . 34201 1 1202 . 1 1 87 87 ILE H H 1 7.277 0.003 . 1 . . 636 . A 84 ILE H . 34201 1 1203 . 1 1 87 87 ILE HA H 1 4.546 0.004 . 1 . . 123 . A 84 ILE HA . 34201 1 1204 . 1 1 87 87 ILE HB H 1 1.920 0.007 . 1 . . 119 . A 84 ILE HB . 34201 1 1205 . 1 1 87 87 ILE HG12 H 1 1.122 0.002 . 2 . . 121 . A 84 ILE HG12 . 34201 1 1206 . 1 1 87 87 ILE HG13 H 1 1.400 0.003 . 2 . . 122 . A 84 ILE HG13 . 34201 1 1207 . 1 1 87 87 ILE HG21 H 1 1.024 0.002 . 1 . . 120 . A 84 ILE HG21 . 34201 1 1208 . 1 1 87 87 ILE HG22 H 1 1.024 0.002 . 1 . . 120 . A 84 ILE HG22 . 34201 1 1209 . 1 1 87 87 ILE HG23 H 1 1.024 0.002 . 1 . . 120 . A 84 ILE HG23 . 34201 1 1210 . 1 1 87 87 ILE HD11 H 1 0.663 0.003 . 1 . . 868 . A 84 ILE HD11 . 34201 1 1211 . 1 1 87 87 ILE HD12 H 1 0.663 0.003 . 1 . . 868 . A 84 ILE HD12 . 34201 1 1212 . 1 1 87 87 ILE HD13 H 1 0.663 0.003 . 1 . . 868 . A 84 ILE HD13 . 34201 1 1213 . 1 1 87 87 ILE CA C 13 58.456 0.054 . 1 . . 870 . A 84 ILE CA . 34201 1 1214 . 1 1 87 87 ILE CB C 13 39.234 0.078 . 1 . . 871 . A 84 ILE CB . 34201 1 1215 . 1 1 87 87 ILE CG1 C 13 26.676 0.074 . 1 . . 872 . A 84 ILE CG1 . 34201 1 1216 . 1 1 87 87 ILE CG2 C 13 17.241 0.016 . 1 . . 867 . A 84 ILE CG2 . 34201 1 1217 . 1 1 87 87 ILE CD1 C 13 13.319 0.031 . 1 . . 869 . A 84 ILE CD1 . 34201 1 1218 . 1 1 87 87 ILE N N 15 119.950 0.035 . 1 . . 635 . A 84 ILE N . 34201 1 1219 . 1 1 88 88 PRO HA H 1 4.347 0.012 . 1 . . 1717 . A 85 PRO HA . 34201 1 1220 . 1 1 88 88 PRO HB2 H 1 2.404 0.0 . 2 . . 1718 . A 85 PRO HB2 . 34201 1 1221 . 1 1 88 88 PRO HB3 H 1 1.920 0.002 . 2 . . 1720 . A 85 PRO HB3 . 34201 1 1222 . 1 1 88 88 PRO HG2 H 1 1.970 0.0 . 2 . . 1722 . A 85 PRO HG2 . 34201 1 1223 . 1 1 88 88 PRO HG3 H 1 1.819 0.005 . 2 . . 1723 . A 85 PRO HG3 . 34201 1 1224 . 1 1 88 88 PRO HD2 H 1 3.803 . . 2 . . 1724 . A 85 PRO HD2 . 34201 1 1225 . 1 1 88 88 PRO HD3 H 1 3.620 . . 2 . . 1725 . A 85 PRO HD3 . 34201 1 1226 . 1 1 88 88 PRO C C 13 177.665 . . 1 . . 2132 . A 85 PRO C . 34201 1 1227 . 1 1 88 88 PRO CA C 13 63.194 0.051 . 1 . . 1716 . A 85 PRO CA . 34201 1 1228 . 1 1 88 88 PRO CB C 13 32.129 0.041 . 1 . . 1719 . A 85 PRO CB . 34201 1 1229 . 1 1 88 88 PRO CG C 13 27.843 0.027 . 1 . . 1721 . A 85 PRO CG . 34201 1 1230 . 1 1 89 89 ALA H H 1 8.612 0.002 . 1 . . 572 . A 86 ALA H . 34201 1 1231 . 1 1 89 89 ALA HA H 1 4.088 0.004 . 1 . . 156 . A 86 ALA HA . 34201 1 1232 . 1 1 89 89 ALA HB1 H 1 1.492 0.002 . 1 . . 157 . A 86 ALA HB1 . 34201 1 1233 . 1 1 89 89 ALA HB2 H 1 1.492 0.002 . 1 . . 157 . A 86 ALA HB2 . 34201 1 1234 . 1 1 89 89 ALA HB3 H 1 1.492 0.002 . 1 . . 157 . A 86 ALA HB3 . 34201 1 1235 . 1 1 89 89 ALA C C 13 179.638 . . 1 . . 2018 . A 86 ALA C . 34201 1 1236 . 1 1 89 89 ALA CA C 13 54.958 0.023 . 1 . . 874 . A 86 ALA CA . 34201 1 1237 . 1 1 89 89 ALA CB C 13 18.896 0.03 . 1 . . 873 . A 86 ALA CB . 34201 1 1238 . 1 1 89 89 ALA N N 15 125.730 0.017 . 1 . . 571 . A 86 ALA N . 34201 1 1239 . 1 1 90 90 SER H H 1 8.247 0.003 . 1 . . 600 . A 87 SER H . 34201 1 1240 . 1 1 90 90 SER HA H 1 4.301 0.003 . 1 . . 1156 . A 87 SER HA . 34201 1 1241 . 1 1 90 90 SER HB2 H 1 4.000 0.002 . 2 . . 1155 . A 87 SER HB2 . 34201 1 1242 . 1 1 90 90 SER HB3 H 1 3.901 0.002 . 2 . . 1158 . A 87 SER HB3 . 34201 1 1243 . 1 1 90 90 SER C C 13 175.337 . . 1 . . 2075 . A 87 SER C . 34201 1 1244 . 1 1 90 90 SER CA C 13 59.811 0.029 . 1 . . 1159 . A 87 SER CA . 34201 1 1245 . 1 1 90 90 SER CB C 13 63.074 0.017 . 1 . . 1157 . A 87 SER CB . 34201 1 1246 . 1 1 90 90 SER N N 15 109.680 0.016 . 1 . . 599 . A 87 SER N . 34201 1 1247 . 1 1 91 91 GLU H H 1 7.660 0.009 . 1 . . 623 . A 88 GLU H . 34201 1 1248 . 1 1 91 91 GLU HA H 1 4.309 0.005 . 1 . . 1938 . A 88 GLU HA . 34201 1 1249 . 1 1 91 91 GLU HB2 H 1 2.194 0.004 . 2 . . 1936 . A 88 GLU HB2 . 34201 1 1250 . 1 1 91 91 GLU HB3 H 1 1.937 0.0 . 2 . . 1937 . A 88 GLU HB3 . 34201 1 1251 . 1 1 91 91 GLU HG2 H 1 2.201 0.0 . 2 . . 1940 . A 88 GLU HG2 . 34201 1 1252 . 1 1 91 91 GLU HG3 H 1 2.259 0.0 . 2 . . 1943 . A 88 GLU HG3 . 34201 1 1253 . 1 1 91 91 GLU CA C 13 56.257 0.029 . 1 . . 1941 . A 88 GLU CA . 34201 1 1254 . 1 1 91 91 GLU CB C 13 30.717 0.023 . 1 . . 1939 . A 88 GLU CB . 34201 1 1255 . 1 1 91 91 GLU CG C 13 36.486 0.027 . 1 . . 1942 . A 88 GLU CG . 34201 1 1256 . 1 1 91 91 GLU N N 15 119.939 0.075 . 1 . . 621 . A 88 GLU N . 34201 1 1257 . 1 1 92 92 LEU HA H 1 4.022 0.007 . 1 . . 308 . A 89 LEU HA . 34201 1 1258 . 1 1 92 92 LEU HB2 H 1 1.497 0.01 . 2 . . 305 . A 89 LEU HB2 . 34201 1 1259 . 1 1 92 92 LEU HB3 H 1 1.387 0.005 . 2 . . 306 . A 89 LEU HB3 . 34201 1 1260 . 1 1 92 92 LEU HG H 1 1.318 0.007 . 1 . . 309 . A 89 LEU HG . 34201 1 1261 . 1 1 92 92 LEU HD11 H 1 0.358 0.003 . 2 . . 304 . A 89 LEU HD11 . 34201 1 1262 . 1 1 92 92 LEU HD12 H 1 0.358 0.003 . 2 . . 304 . A 89 LEU HD12 . 34201 1 1263 . 1 1 92 92 LEU HD13 H 1 0.358 0.003 . 2 . . 304 . A 89 LEU HD13 . 34201 1 1264 . 1 1 92 92 LEU HD21 H 1 0.592 0.003 . 2 . . 307 . A 89 LEU HD21 . 34201 1 1265 . 1 1 92 92 LEU HD22 H 1 0.592 0.003 . 2 . . 307 . A 89 LEU HD22 . 34201 1 1266 . 1 1 92 92 LEU HD23 H 1 0.592 0.003 . 2 . . 307 . A 89 LEU HD23 . 34201 1 1267 . 1 1 92 92 LEU CA C 13 56.988 0.041 . 1 . . 875 . A 89 LEU CA . 34201 1 1268 . 1 1 92 92 LEU CB C 13 42.474 0.021 . 1 . . 879 . A 89 LEU CB . 34201 1 1269 . 1 1 92 92 LEU CG C 13 27.396 0.046 . 1 . . 876 . A 89 LEU CG . 34201 1 1270 . 1 1 92 92 LEU CD1 C 13 24.812 0.016 . 2 . . 877 . A 89 LEU CD1 . 34201 1 1271 . 1 1 92 92 LEU CD2 C 13 25.659 0.041 . 2 . . 878 . A 89 LEU CD2 . 34201 1 1272 . 1 1 93 93 VAL HA H 1 4.115 0.0 . 1 . . 1861 . A 90 VAL HA . 34201 1 1273 . 1 1 93 93 VAL HB H 1 2.147 0.006 . 1 . . 1864 . A 90 VAL HB . 34201 1 1274 . 1 1 93 93 VAL HG11 H 1 0.695 0.001 . 2 . . 1862 . A 90 VAL HG11 . 34201 1 1275 . 1 1 93 93 VAL HG12 H 1 0.695 0.001 . 2 . . 1862 . A 90 VAL HG12 . 34201 1 1276 . 1 1 93 93 VAL HG13 H 1 0.695 0.001 . 2 . . 1862 . A 90 VAL HG13 . 34201 1 1277 . 1 1 93 93 VAL HG21 H 1 0.722 0.002 . 2 . . 1868 . A 90 VAL HG21 . 34201 1 1278 . 1 1 93 93 VAL HG22 H 1 0.722 0.002 . 2 . . 1868 . A 90 VAL HG22 . 34201 1 1279 . 1 1 93 93 VAL HG23 H 1 0.722 0.002 . 2 . . 1868 . A 90 VAL HG23 . 34201 1 1280 . 1 1 93 93 VAL CA C 13 61.051 0.001 . 1 . . 1863 . A 90 VAL CA . 34201 1 1281 . 1 1 93 93 VAL CB C 13 30.238 0.013 . 1 . . 1865 . A 90 VAL CB . 34201 1 1282 . 1 1 93 93 VAL CG1 C 13 22.380 0.047 . 2 . . 1866 . A 90 VAL CG1 . 34201 1 1283 . 1 1 93 93 VAL CG2 C 13 20.137 0.012 . 2 . . 1867 . A 90 VAL CG2 . 34201 1 1284 . 1 1 94 94 SER HB2 H 1 3.970 0.008 . 2 . . 1932 . A 91 SER HB2 . 34201 1 1285 . 1 1 94 94 SER HB3 H 1 3.970 0.008 . 2 . . 1933 . A 91 SER HB3 . 34201 1 1286 . 1 1 94 94 SER C C 13 173.624 . . 1 . . 2089 . A 91 SER C . 34201 1 1287 . 1 1 94 94 SER CB C 13 64.727 0.04 . 1 . . 1931 . A 91 SER CB . 34201 1 1288 . 1 1 95 95 VAL H H 1 8.061 0.005 . 1 . . 388 . A 92 VAL H . 34201 1 1289 . 1 1 95 95 VAL HA H 1 5.273 0.004 . 1 . . 213 . A 92 VAL HA . 34201 1 1290 . 1 1 95 95 VAL HB H 1 2.033 0.005 . 1 . . 211 . A 92 VAL HB . 34201 1 1291 . 1 1 95 95 VAL HG11 H 1 1.074 0.001 . 2 . . 210 . A 92 VAL HG11 . 34201 1 1292 . 1 1 95 95 VAL HG12 H 1 1.074 0.001 . 2 . . 210 . A 92 VAL HG12 . 34201 1 1293 . 1 1 95 95 VAL HG13 H 1 1.074 0.001 . 2 . . 210 . A 92 VAL HG13 . 34201 1 1294 . 1 1 95 95 VAL HG21 H 1 1.032 0.006 . 2 . . 212 . A 92 VAL HG21 . 34201 1 1295 . 1 1 95 95 VAL HG22 H 1 1.032 0.006 . 2 . . 212 . A 92 VAL HG22 . 34201 1 1296 . 1 1 95 95 VAL HG23 H 1 1.032 0.006 . 2 . . 212 . A 92 VAL HG23 . 34201 1 1297 . 1 1 95 95 VAL C C 13 176.933 . . 1 . . 2087 . A 92 VAL C . 34201 1 1298 . 1 1 95 95 VAL CA C 13 62.041 0.029 . 1 . . 880 . A 92 VAL CA . 34201 1 1299 . 1 1 95 95 VAL CB C 13 32.532 0.046 . 1 . . 881 . A 92 VAL CB . 34201 1 1300 . 1 1 95 95 VAL CG1 C 13 21.520 0.011 . 2 . . 882 . A 92 VAL CG1 . 34201 1 1301 . 1 1 95 95 VAL CG2 C 13 21.521 0.011 . 2 . . 883 . A 92 VAL CG2 . 34201 1 1302 . 1 1 95 95 VAL N N 15 121.163 0.023 . 1 . . 387 . A 92 VAL N . 34201 1 1303 . 1 1 96 96 THR H H 1 9.201 0.003 . 1 . . 638 . A 93 THR H . 34201 1 1304 . 1 1 96 96 THR HA H 1 4.725 0.007 . 1 . . 887 . A 93 THR HA . 34201 1 1305 . 1 1 96 96 THR HB H 1 4.389 0.006 . 1 . . 884 . A 93 THR HB . 34201 1 1306 . 1 1 96 96 THR HG1 H 1 5.183 0.001 . 1 . . 2010 . A 93 THR HG1 . 34201 1 1307 . 1 1 96 96 THR HG21 H 1 1.271 0.004 . 1 . . 886 . A 93 THR HG21 . 34201 1 1308 . 1 1 96 96 THR HG22 H 1 1.271 0.004 . 1 . . 886 . A 93 THR HG22 . 34201 1 1309 . 1 1 96 96 THR HG23 H 1 1.271 0.004 . 1 . . 886 . A 93 THR HG23 . 34201 1 1310 . 1 1 96 96 THR C C 13 172.038 . . 1 . . 2059 . A 93 THR C . 34201 1 1311 . 1 1 96 96 THR CA C 13 59.746 0.012 . 1 . . 888 . A 93 THR CA . 34201 1 1312 . 1 1 96 96 THR CB C 13 71.127 0.022 . 1 . . 885 . A 93 THR CB . 34201 1 1313 . 1 1 96 96 THR CG2 C 13 22.217 0.022 . 1 . . 889 . A 93 THR CG2 . 34201 1 1314 . 1 1 96 96 THR N N 15 120.792 0.024 . 1 . . 637 . A 93 THR N . 34201 1 1315 . 1 1 97 97 VAL H H 1 8.021 0.006 . 1 . . 402 . A 94 VAL H . 34201 1 1316 . 1 1 97 97 VAL HA H 1 5.265 0.003 . 1 . . 175 . A 94 VAL HA . 34201 1 1317 . 1 1 97 97 VAL HB H 1 1.648 0.0 . 1 . . 177 . A 94 VAL HB . 34201 1 1318 . 1 1 97 97 VAL HG11 H 1 0.606 0.002 . 2 . . 174 . A 94 VAL HG11 . 34201 1 1319 . 1 1 97 97 VAL HG12 H 1 0.606 0.002 . 2 . . 174 . A 94 VAL HG12 . 34201 1 1320 . 1 1 97 97 VAL HG13 H 1 0.606 0.002 . 2 . . 174 . A 94 VAL HG13 . 34201 1 1321 . 1 1 97 97 VAL HG21 H 1 0.706 0.001 . 2 . . 176 . A 94 VAL HG21 . 34201 1 1322 . 1 1 97 97 VAL HG22 H 1 0.706 0.001 . 2 . . 176 . A 94 VAL HG22 . 34201 1 1323 . 1 1 97 97 VAL HG23 H 1 0.706 0.001 . 2 . . 176 . A 94 VAL HG23 . 34201 1 1324 . 1 1 97 97 VAL C C 13 176.241 . . 1 . . 2093 . A 94 VAL C . 34201 1 1325 . 1 1 97 97 VAL CA C 13 60.567 0.032 . 1 . . 1746 . A 94 VAL CA . 34201 1 1326 . 1 1 97 97 VAL CB C 13 36.657 . . 1 . . 2169 . A 94 VAL CB . 34201 1 1327 . 1 1 97 97 VAL CG1 C 13 21.365 0.037 . 2 . . 890 . A 94 VAL CG1 . 34201 1 1328 . 1 1 97 97 VAL CG2 C 13 22.895 0.064 . 2 . . 891 . A 94 VAL CG2 . 34201 1 1329 . 1 1 97 97 VAL N N 15 118.724 0.025 . 1 . . 401 . A 94 VAL N . 34201 1 1330 . 1 1 98 98 ILE H H 1 8.631 0.005 . 1 . . 900 . A 95 ILE H . 34201 1 1331 . 1 1 98 98 ILE HA H 1 5.152 0.005 . 1 . . 128 . A 95 ILE HA . 34201 1 1332 . 1 1 98 98 ILE HB H 1 1.625 0.002 . 1 . . 129 . A 95 ILE HB . 34201 1 1333 . 1 1 98 98 ILE HG12 H 1 1.111 0.006 . 2 . . 127 . A 95 ILE HG12 . 34201 1 1334 . 1 1 98 98 ILE HG13 H 1 1.605 0.001 . 2 . . 899 . A 95 ILE HG13 . 34201 1 1335 . 1 1 98 98 ILE HG21 H 1 0.897 0.001 . 1 . . 126 . A 95 ILE HG21 . 34201 1 1336 . 1 1 98 98 ILE HG22 H 1 0.897 0.001 . 1 . . 126 . A 95 ILE HG22 . 34201 1 1337 . 1 1 98 98 ILE HG23 H 1 0.897 0.001 . 1 . . 126 . A 95 ILE HG23 . 34201 1 1338 . 1 1 98 98 ILE HD11 H 1 0.720 0.002 . 1 . . 124 . A 95 ILE HD11 . 34201 1 1339 . 1 1 98 98 ILE HD12 H 1 0.720 0.002 . 1 . . 124 . A 95 ILE HD12 . 34201 1 1340 . 1 1 98 98 ILE HD13 H 1 0.720 0.002 . 1 . . 124 . A 95 ILE HD13 . 34201 1 1341 . 1 1 98 98 ILE C C 13 173.661 . . 1 . . 2100 . A 95 ILE C . 34201 1 1342 . 1 1 98 98 ILE CA C 13 58.568 0.047 . 1 . . 896 . A 95 ILE CA . 34201 1 1343 . 1 1 98 98 ILE CB C 13 41.807 0.037 . 1 . . 897 . A 95 ILE CB . 34201 1 1344 . 1 1 98 98 ILE CG1 C 13 26.764 0.036 . 1 . . 898 . A 95 ILE CG1 . 34201 1 1345 . 1 1 98 98 ILE CG2 C 13 18.322 0.016 . 1 . . 894 . A 95 ILE CG2 . 34201 1 1346 . 1 1 98 98 ILE CD1 C 13 14.127 0.02 . 1 . . 893 . A 95 ILE CD1 . 34201 1 1347 . 1 1 98 98 ILE N N 15 121.639 0.017 . 1 . . 901 . A 95 ILE N . 34201 1 1348 . 1 1 99 99 LEU H H 1 8.805 0.005 . 1 . . 66 . A 96 LEU H . 34201 1 1349 . 1 1 99 99 LEU HA H 1 5.282 0.006 . 1 . . 905 . A 96 LEU HA . 34201 1 1350 . 1 1 99 99 LEU HB2 H 1 1.157 0.008 . 2 . . 907 . A 96 LEU HB2 . 34201 1 1351 . 1 1 99 99 LEU HB3 H 1 1.568 0.003 . 2 . . 909 . A 96 LEU HB3 . 34201 1 1352 . 1 1 99 99 LEU HG H 1 1.350 0.003 . 1 . . 910 . A 96 LEU HG . 34201 1 1353 . 1 1 99 99 LEU HD11 H 1 0.702 0.002 . 2 . . 911 . A 96 LEU HD11 . 34201 1 1354 . 1 1 99 99 LEU HD12 H 1 0.702 0.002 . 2 . . 911 . A 96 LEU HD12 . 34201 1 1355 . 1 1 99 99 LEU HD13 H 1 0.702 0.002 . 2 . . 911 . A 96 LEU HD13 . 34201 1 1356 . 1 1 99 99 LEU HD21 H 1 0.672 0.001 . 2 . . 912 . A 96 LEU HD21 . 34201 1 1357 . 1 1 99 99 LEU HD22 H 1 0.672 0.001 . 2 . . 912 . A 96 LEU HD22 . 34201 1 1358 . 1 1 99 99 LEU HD23 H 1 0.672 0.001 . 2 . . 912 . A 96 LEU HD23 . 34201 1 1359 . 1 1 99 99 LEU C C 13 175.864 . . 1 . . 2162 . A 96 LEU C . 34201 1 1360 . 1 1 99 99 LEU CA C 13 52.972 0.067 . 1 . . 906 . A 96 LEU CA . 34201 1 1361 . 1 1 99 99 LEU CB C 13 45.602 0.035 . 1 . . 908 . A 96 LEU CB . 34201 1 1362 . 1 1 99 99 LEU CG C 13 26.380 0.068 . 1 . . 913 . A 96 LEU CG . 34201 1 1363 . 1 1 99 99 LEU CD1 C 13 25.742 0.02 . 2 . . 914 . A 96 LEU CD1 . 34201 1 1364 . 1 1 99 99 LEU CD2 C 13 24.126 0.023 . 2 . . 915 . A 96 LEU CD2 . 34201 1 1365 . 1 1 99 99 LEU N N 15 121.695 0.026 . 1 . . 67 . A 96 LEU N . 34201 1 1366 . 1 1 100 100 LEU H H 1 9.760 0.004 . 1 . . 903 . A 97 LEU H . 34201 1 1367 . 1 1 100 100 LEU HA H 1 5.447 0.006 . 1 . . 245 . A 97 LEU HA . 34201 1 1368 . 1 1 100 100 LEU HB2 H 1 1.839 0.003 . 2 . . 242 . A 97 LEU HB2 . 34201 1 1369 . 1 1 100 100 LEU HB3 H 1 1.163 0.004 . 2 . . 244 . A 97 LEU HB3 . 34201 1 1370 . 1 1 100 100 LEU HG H 1 1.473 0.001 . 1 . . 243 . A 97 LEU HG . 34201 1 1371 . 1 1 100 100 LEU HD11 H 1 0.583 0.001 . 2 . . 241 . A 97 LEU HD11 . 34201 1 1372 . 1 1 100 100 LEU HD12 H 1 0.583 0.001 . 2 . . 241 . A 97 LEU HD12 . 34201 1 1373 . 1 1 100 100 LEU HD13 H 1 0.583 0.001 . 2 . . 241 . A 97 LEU HD13 . 34201 1 1374 . 1 1 100 100 LEU HD21 H 1 0.598 0.002 . 2 . . 1350 . A 97 LEU HD21 . 34201 1 1375 . 1 1 100 100 LEU HD22 H 1 0.598 0.002 . 2 . . 1350 . A 97 LEU HD22 . 34201 1 1376 . 1 1 100 100 LEU HD23 H 1 0.598 0.002 . 2 . . 1350 . A 97 LEU HD23 . 34201 1 1377 . 1 1 100 100 LEU C C 13 174.984 . . 1 . . 2072 . A 97 LEU C . 34201 1 1378 . 1 1 100 100 LEU CA C 13 53.509 0.037 . 1 . . 895 . A 97 LEU CA . 34201 1 1379 . 1 1 100 100 LEU CB C 13 44.676 0.027 . 1 . . 902 . A 97 LEU CB . 34201 1 1380 . 1 1 100 100 LEU CG C 13 27.943 0.034 . 1 . . 916 . A 97 LEU CG . 34201 1 1381 . 1 1 100 100 LEU CD1 C 13 24.212 0.038 . 2 . . 769 . A 97 LEU CD1 . 34201 1 1382 . 1 1 100 100 LEU CD2 C 13 25.809 0.02 . 2 . . 1351 . A 97 LEU CD2 . 34201 1 1383 . 1 1 100 100 LEU N N 15 130.252 0.023 . 1 . . 904 . A 97 LEU N . 34201 1 1384 . 1 1 101 101 SER H H 1 9.387 0.003 . 1 . . 474 . A 98 SER H . 34201 1 1385 . 1 1 101 101 SER HA H 1 5.405 0.003 . 1 . . 90 . A 98 SER HA . 34201 1 1386 . 1 1 101 101 SER HB2 H 1 3.862 0.003 . 2 . . 89 . A 98 SER HB2 . 34201 1 1387 . 1 1 101 101 SER HB3 H 1 3.545 0.004 . 2 . . 91 . A 98 SER HB3 . 34201 1 1388 . 1 1 101 101 SER C C 13 172.850 . . 1 . . 2088 . A 98 SER C . 34201 1 1389 . 1 1 101 101 SER CA C 13 56.310 0.021 . 1 . . 918 . A 98 SER CA . 34201 1 1390 . 1 1 101 101 SER CB C 13 67.052 0.048 . 1 . . 917 . A 98 SER CB . 34201 1 1391 . 1 1 101 101 SER N N 15 119.894 0.026 . 1 . . 473 . A 98 SER N . 34201 1 1392 . 1 1 102 102 CYS H H 1 8.080 0.004 . 1 . . 616 . A 99 CYS H . 34201 1 1393 . 1 1 102 102 CYS HA H 1 4.790 . . 1 . . 1851 . A 99 CYS HA . 34201 1 1394 . 1 1 102 102 CYS HB2 H 1 0.998 0.015 . 2 . . 1848 . A 99 CYS HB2 . 34201 1 1395 . 1 1 102 102 CYS HB3 H 1 0.476 0.007 . 2 . . 1849 . A 99 CYS HB3 . 34201 1 1396 . 1 1 102 102 CYS HG H 1 -0.179 . . 1 . . 1869 . A 99 CYS HG . 34201 1 1397 . 1 1 102 102 CYS C C 13 172.026 . . 1 . . 2112 . A 99 CYS C . 34201 1 1398 . 1 1 102 102 CYS CA C 13 56.977 0.0 . 1 . . 1852 . A 99 CYS CA . 34201 1 1399 . 1 1 102 102 CYS CB C 13 29.285 0.031 . 1 . . 1850 . A 99 CYS CB . 34201 1 1400 . 1 1 102 102 CYS N N 15 121.171 0.024 . 1 . . 615 . A 99 CYS N . 34201 1 1401 . 1 1 103 103 SER H H 1 8.796 0.003 . 1 . . 470 . A 100 SER H . 34201 1 1402 . 1 1 103 103 SER HA H 1 5.300 0.005 . 1 . . 92 . A 100 SER HA . 34201 1 1403 . 1 1 103 103 SER HB2 H 1 3.385 0.008 . 2 . . 93 . A 100 SER HB2 . 34201 1 1404 . 1 1 103 103 SER HB3 H 1 3.239 0.006 . 2 . . 94 . A 100 SER HB3 . 34201 1 1405 . 1 1 103 103 SER C C 13 171.446 . . 1 . . 2109 . A 100 SER C . 34201 1 1406 . 1 1 103 103 SER CA C 13 56.607 0.048 . 1 . . 920 . A 100 SER CA . 34201 1 1407 . 1 1 103 103 SER CB C 13 66.674 0.019 . 1 . . 919 . A 100 SER CB . 34201 1 1408 . 1 1 103 103 SER N N 15 122.810 0.016 . 1 . . 469 . A 100 SER N . 34201 1 1409 . 1 1 104 104 TYR H H 1 8.618 0.004 . 1 . . 381 . A 101 TYR H . 34201 1 1410 . 1 1 104 104 TYR HA H 1 4.730 0.0 . 1 . . 1504 . A 101 TYR HA . 34201 1 1411 . 1 1 104 104 TYR HB2 H 1 2.445 0.011 . 2 . . 1505 . A 101 TYR HB2 . 34201 1 1412 . 1 1 104 104 TYR HB3 H 1 2.568 . . 2 . . 1507 . A 101 TYR HB3 . 34201 1 1413 . 1 1 104 104 TYR HD1 H 1 7.022 0.02 . 1 . . 1684 . A 101 TYR HD1 . 34201 1 1414 . 1 1 104 104 TYR HD2 H 1 7.022 0.02 . 1 . . 1684 . A 101 TYR HD2 . 34201 1 1415 . 1 1 104 104 TYR HE1 H 1 6.937 0.004 . 1 . . 1682 . A 101 TYR HE1 . 34201 1 1416 . 1 1 104 104 TYR HE2 H 1 6.937 0.004 . 1 . . 1682 . A 101 TYR HE2 . 34201 1 1417 . 1 1 104 104 TYR C C 13 174.731 . . 1 . . 2158 . A 101 TYR C . 34201 1 1418 . 1 1 104 104 TYR CA C 13 57.135 0.0 . 1 . . 1506 . A 101 TYR CA . 34201 1 1419 . 1 1 104 104 TYR CB C 13 41.500 0.0 . 1 . . 382 . A 101 TYR CB . 34201 1 1420 . 1 1 104 104 TYR CD1 C 13 133.449 0.046 . 1 . . 1685 . A 101 TYR CD1 . 34201 1 1421 . 1 1 104 104 TYR CD2 C 13 133.449 0.046 . 1 . . 1685 . A 101 TYR CD2 . 34201 1 1422 . 1 1 104 104 TYR CE1 C 13 117.514 0.099 . 1 . . 1683 . A 101 TYR CE1 . 34201 1 1423 . 1 1 104 104 TYR CE2 C 13 117.514 0.099 . 1 . . 1683 . A 101 TYR CE2 . 34201 1 1424 . 1 1 104 104 TYR N N 15 122.472 0.031 . 1 . . 380 . A 101 TYR N . 34201 1 1425 . 1 1 105 105 ASP H H 1 8.889 0.003 . 1 . . 398 . A 102 ASP H . 34201 1 1426 . 1 1 105 105 ASP HA H 1 3.765 0.003 . 1 . . 1164 . A 102 ASP HA . 34201 1 1427 . 1 1 105 105 ASP HB2 H 1 2.762 0.004 . 2 . . 1165 . A 102 ASP HB2 . 34201 1 1428 . 1 1 105 105 ASP HB3 H 1 1.400 0.004 . 2 . . 1167 . A 102 ASP HB3 . 34201 1 1429 . 1 1 105 105 ASP C C 13 175.460 . . 1 . . 2014 . A 102 ASP C . 34201 1 1430 . 1 1 105 105 ASP CA C 13 54.269 0.039 . 1 . . 1163 . A 102 ASP CA . 34201 1 1431 . 1 1 105 105 ASP CB C 13 39.342 0.035 . 1 . . 1166 . A 102 ASP CB . 34201 1 1432 . 1 1 105 105 ASP N N 15 129.284 0.03 . 1 . . 397 . A 102 ASP N . 34201 1 1433 . 1 1 106 106 GLY H H 1 8.695 0.002 . 1 . . 590 . A 103 GLY H . 34201 1 1434 . 1 1 106 106 GLY HA2 H 1 3.494 0.006 . 2 . . 1160 . A 103 GLY HA2 . 34201 1 1435 . 1 1 106 106 GLY HA3 H 1 3.991 0.007 . 2 . . 1161 . A 103 GLY HA3 . 34201 1 1436 . 1 1 106 106 GLY C C 13 174.589 . . 1 . . 2090 . A 103 GLY C . 34201 1 1437 . 1 1 106 106 GLY CA C 13 44.864 0.019 . 1 . . 1162 . A 103 GLY CA . 34201 1 1438 . 1 1 106 106 GLY N N 15 101.547 0.016 . 1 . . 589 . A 103 GLY N . 34201 1 1439 . 1 1 107 107 ARG H H 1 7.748 0.003 . 1 . . 628 . A 104 ARG H . 34201 1 1440 . 1 1 107 107 ARG HA H 1 4.477 0.011 . 1 . . 1508 . A 104 ARG HA . 34201 1 1441 . 1 1 107 107 ARG HB2 H 1 2.236 . . 2 . . 1960 . A 104 ARG HB2 . 34201 1 1442 . 1 1 107 107 ARG HB3 H 1 1.609 . . 2 . . 1961 . A 104 ARG HB3 . 34201 1 1443 . 1 1 107 107 ARG HD2 H 1 3.223 . . 2 . . 1962 . A 104 ARG HD2 . 34201 1 1444 . 1 1 107 107 ARG HD3 H 1 3.390 . . 2 . . 1963 . A 104 ARG HD3 . 34201 1 1445 . 1 1 107 107 ARG HE H 1 7.334 0.002 . 1 . . 1834 . A 104 ARG HE . 34201 1 1446 . 1 1 107 107 ARG C C 13 174.734 . . 1 . . 2153 . A 104 ARG C . 34201 1 1447 . 1 1 107 107 ARG CA C 13 55.490 0.03 . 1 . . 1509 . A 104 ARG CA . 34201 1 1448 . 1 1 107 107 ARG N N 15 121.296 0.017 . 1 . . 627 . A 104 ARG N . 34201 1 1449 . 1 1 107 107 ARG NE N 15 81.282 0.047 . 1 . . 1835 . A 104 ARG NE . 34201 1 1450 . 1 1 108 108 GLU H H 1 8.390 0.003 . 1 . . 454 . A 105 GLU H . 34201 1 1451 . 1 1 108 108 GLU HA H 1 4.299 . . 1 . . 1853 . A 105 GLU HA . 34201 1 1452 . 1 1 108 108 GLU HB2 H 1 1.618 0.0 . 2 . . 1857 . A 105 GLU HB2 . 34201 1 1453 . 1 1 108 108 GLU HB3 H 1 1.594 0.0 . 2 . . 1859 . A 105 GLU HB3 . 34201 1 1454 . 1 1 108 108 GLU HG2 H 1 1.972 0.008 . 2 . . 1854 . A 105 GLU HG2 . 34201 1 1455 . 1 1 108 108 GLU HG3 H 1 1.724 0.011 . 2 . . 1856 . A 105 GLU HG3 . 34201 1 1456 . 1 1 108 108 GLU C C 13 175.475 . . 1 . . 2066 . A 105 GLU C . 34201 1 1457 . 1 1 108 108 GLU CB C 13 30.563 0.003 . 1 . . 1858 . A 105 GLU CB . 34201 1 1458 . 1 1 108 108 GLU CG C 13 36.162 0.038 . 1 . . 1855 . A 105 GLU CG . 34201 1 1459 . 1 1 108 108 GLU N N 15 128.864 0.021 . 1 . . 452 . A 105 GLU N . 34201 1 1460 . 1 1 109 109 PHE H H 1 8.424 0.006 . 1 . . 373 . A 106 PHE H . 34201 1 1461 . 1 1 109 109 PHE HA H 1 5.625 0.006 . 1 . . 1727 . A 106 PHE HA . 34201 1 1462 . 1 1 109 109 PHE HB2 H 1 2.652 0.0 . 2 . . 1728 . A 106 PHE HB2 . 34201 1 1463 . 1 1 109 109 PHE HB3 H 1 3.748 0.0 . 2 . . 1730 . A 106 PHE HB3 . 34201 1 1464 . 1 1 109 109 PHE HD1 H 1 7.260 0.006 . 1 . . 1816 . A 106 PHE HD1 . 34201 1 1465 . 1 1 109 109 PHE HD2 H 1 7.260 0.006 . 1 . . 1816 . A 106 PHE HD2 . 34201 1 1466 . 1 1 109 109 PHE HE1 H 1 7.029 0.005 . 1 . . 1817 . A 106 PHE HE1 . 34201 1 1467 . 1 1 109 109 PHE HE2 H 1 7.029 0.005 . 1 . . 1817 . A 106 PHE HE2 . 34201 1 1468 . 1 1 109 109 PHE HZ H 1 7.011 . . 1 . . 1945 . A 106 PHE HZ . 34201 1 1469 . 1 1 109 109 PHE C C 13 175.480 . . 1 . . 2121 . A 106 PHE C . 34201 1 1470 . 1 1 109 109 PHE CA C 13 56.450 0.05 . 1 . . 1726 . A 106 PHE CA . 34201 1 1471 . 1 1 109 109 PHE CB C 13 40.848 0.015 . 1 . . 1729 . A 106 PHE CB . 34201 1 1472 . 1 1 109 109 PHE CD1 C 13 133.146 0.056 . 1 . . 1876 . A 106 PHE CD1 . 34201 1 1473 . 1 1 109 109 PHE CD2 C 13 133.146 0.056 . 1 . . 1876 . A 106 PHE CD2 . 34201 1 1474 . 1 1 109 109 PHE CE1 C 13 130.932 0.045 . 1 . . 1818 . A 106 PHE CE1 . 34201 1 1475 . 1 1 109 109 PHE CE2 C 13 130.932 0.045 . 1 . . 1818 . A 106 PHE CE2 . 34201 1 1476 . 1 1 109 109 PHE N N 15 119.537 0.024 . 1 . . 372 . A 106 PHE N . 34201 1 1477 . 1 1 110 110 VAL H H 1 7.242 0.004 . 1 . . 497 . A 107 VAL H . 34201 1 1478 . 1 1 110 110 VAL HA H 1 5.110 0.009 . 1 . . 165 . A 107 VAL HA . 34201 1 1479 . 1 1 110 110 VAL HB H 1 2.232 0.007 . 1 . . 164 . A 107 VAL HB . 34201 1 1480 . 1 1 110 110 VAL HG11 H 1 0.308 0.002 . 2 . . 498 . A 107 VAL HG11 . 34201 1 1481 . 1 1 110 110 VAL HG12 H 1 0.308 0.002 . 2 . . 498 . A 107 VAL HG12 . 34201 1 1482 . 1 1 110 110 VAL HG13 H 1 0.308 0.002 . 2 . . 498 . A 107 VAL HG13 . 34201 1 1483 . 1 1 110 110 VAL HG21 H 1 0.939 0.003 . 2 . . 499 . A 107 VAL HG21 . 34201 1 1484 . 1 1 110 110 VAL HG22 H 1 0.939 0.003 . 2 . . 499 . A 107 VAL HG22 . 34201 1 1485 . 1 1 110 110 VAL HG23 H 1 0.939 0.003 . 2 . . 499 . A 107 VAL HG23 . 34201 1 1486 . 1 1 110 110 VAL C C 13 170.218 . . 1 . . 2142 . A 107 VAL C . 34201 1 1487 . 1 1 110 110 VAL CA C 13 61.130 0.061 . 1 . . 921 . A 107 VAL CA . 34201 1 1488 . 1 1 110 110 VAL CB C 13 33.626 0.058 . 1 . . 922 . A 107 VAL CB . 34201 1 1489 . 1 1 110 110 VAL CG1 C 13 19.627 0.025 . 2 . . 368 . A 107 VAL CG1 . 34201 1 1490 . 1 1 110 110 VAL CG2 C 13 22.107 0.028 . 2 . . 923 . A 107 VAL CG2 . 34201 1 1491 . 1 1 110 110 VAL N N 15 123.393 0.026 . 1 . . 496 . A 107 VAL N . 34201 1 1492 . 1 1 111 111 ARG H H 1 8.726 0.005 . 1 . . 507 . A 108 ARG H . 34201 1 1493 . 1 1 111 111 ARG HA H 1 4.973 0.011 . 1 . . 1168 . A 108 ARG HA . 34201 1 1494 . 1 1 111 111 ARG HB2 H 1 1.700 0.005 . 2 . . 1175 . A 108 ARG HB2 . 34201 1 1495 . 1 1 111 111 ARG HB3 H 1 1.980 0.003 . 2 . . 1176 . A 108 ARG HB3 . 34201 1 1496 . 1 1 111 111 ARG HG2 H 1 1.507 0.0 . 2 . . 1173 . A 108 ARG HG2 . 34201 1 1497 . 1 1 111 111 ARG HG3 H 1 1.396 0.014 . 2 . . 1174 . A 108 ARG HG3 . 34201 1 1498 . 1 1 111 111 ARG HD2 H 1 3.183 0.005 . 2 . . 1169 . A 108 ARG HD2 . 34201 1 1499 . 1 1 111 111 ARG HD3 H 1 3.043 0.007 . 2 . . 1170 . A 108 ARG HD3 . 34201 1 1500 . 1 1 111 111 ARG HE H 1 8.292 0.003 . 1 . . 1737 . A 108 ARG HE . 34201 1 1501 . 1 1 111 111 ARG C C 13 173.858 . . 1 . . 2141 . A 108 ARG C . 34201 1 1502 . 1 1 111 111 ARG CA C 13 54.851 0.06 . 1 . . 1178 . A 108 ARG CA . 34201 1 1503 . 1 1 111 111 ARG CB C 13 35.050 0.052 . 1 . . 1177 . A 108 ARG CB . 34201 1 1504 . 1 1 111 111 ARG CG C 13 26.255 0.033 . 1 . . 1172 . A 108 ARG CG . 34201 1 1505 . 1 1 111 111 ARG CD C 13 44.378 0.037 . 1 . . 1171 . A 108 ARG CD . 34201 1 1506 . 1 1 111 111 ARG N N 15 126.674 0.015 . 1 . . 506 . A 108 ARG N . 34201 1 1507 . 1 1 111 111 ARG NE N 15 83.689 0.012 . 1 . . 1738 . A 108 ARG NE . 34201 1 1508 . 1 1 112 112 VAL H H 1 9.684 0.004 . 1 . . 413 . A 109 VAL H . 34201 1 1509 . 1 1 112 112 VAL HA H 1 4.679 0.005 . 1 . . 185 . A 109 VAL HA . 34201 1 1510 . 1 1 112 112 VAL HB H 1 2.008 0.006 . 1 . . 184 . A 109 VAL HB . 34201 1 1511 . 1 1 112 112 VAL HG11 H 1 0.496 0.002 . 2 . . 182 . A 109 VAL HG11 . 34201 1 1512 . 1 1 112 112 VAL HG12 H 1 0.496 0.002 . 2 . . 182 . A 109 VAL HG12 . 34201 1 1513 . 1 1 112 112 VAL HG13 H 1 0.496 0.002 . 2 . . 182 . A 109 VAL HG13 . 34201 1 1514 . 1 1 112 112 VAL HG21 H 1 0.833 0.003 . 2 . . 183 . A 109 VAL HG21 . 34201 1 1515 . 1 1 112 112 VAL HG22 H 1 0.833 0.003 . 2 . . 183 . A 109 VAL HG22 . 34201 1 1516 . 1 1 112 112 VAL HG23 H 1 0.833 0.003 . 2 . . 183 . A 109 VAL HG23 . 34201 1 1517 . 1 1 112 112 VAL C C 13 174.530 . . 1 . . 2022 . A 109 VAL C . 34201 1 1518 . 1 1 112 112 VAL CA C 13 61.108 0.037 . 1 . . 927 . A 109 VAL CA . 34201 1 1519 . 1 1 112 112 VAL CB C 13 33.981 0.053 . 1 . . 925 . A 109 VAL CB . 34201 1 1520 . 1 1 112 112 VAL CG1 C 13 21.555 0.019 . 2 . . 924 . A 109 VAL CG1 . 34201 1 1521 . 1 1 112 112 VAL CG2 C 13 20.792 0.03 . 2 . . 926 . A 109 VAL CG2 . 34201 1 1522 . 1 1 112 112 VAL N N 15 126.983 0.03 . 1 . . 412 . A 109 VAL N . 34201 1 1523 . 1 1 113 113 GLY H H 1 9.140 0.003 . 1 . . 472 . A 110 GLY H . 34201 1 1524 . 1 1 113 113 GLY HA2 H 1 3.196 0.001 . 2 . . 928 . A 110 GLY HA2 . 34201 1 1525 . 1 1 113 113 GLY HA3 H 1 5.266 0.005 . 2 . . 930 . A 110 GLY HA3 . 34201 1 1526 . 1 1 113 113 GLY C C 13 172.560 . . 1 . . 2070 . A 110 GLY C . 34201 1 1527 . 1 1 113 113 GLY CA C 13 44.122 0.024 . 1 . . 929 . A 110 GLY CA . 34201 1 1528 . 1 1 113 113 GLY N N 15 113.386 0.018 . 1 . . 471 . A 110 GLY N . 34201 1 1529 . 1 1 114 114 TYR H H 1 8.780 0.003 . 1 . . 375 . A 111 TYR H . 34201 1 1530 . 1 1 114 114 TYR HA H 1 4.966 0.015 . 1 . . 932 . A 111 TYR HA . 34201 1 1531 . 1 1 114 114 TYR HB2 H 1 2.469 0.0 . 2 . . 931 . A 111 TYR HB2 . 34201 1 1532 . 1 1 114 114 TYR HB3 H 1 2.918 0.0 . 2 . . 934 . A 111 TYR HB3 . 34201 1 1533 . 1 1 114 114 TYR HD1 H 1 6.850 0.006 . 1 . . 1498 . A 111 TYR HD1 . 34201 1 1534 . 1 1 114 114 TYR HD2 H 1 6.850 0.006 . 1 . . 1498 . A 111 TYR HD2 . 34201 1 1535 . 1 1 114 114 TYR HE1 H 1 6.485 0.005 . 1 . . 1496 . A 111 TYR HE1 . 34201 1 1536 . 1 1 114 114 TYR HE2 H 1 6.485 0.005 . 1 . . 1496 . A 111 TYR HE2 . 34201 1 1537 . 1 1 114 114 TYR HH H 1 8.705 . . 1 . . 2006 . A 111 TYR HH . 34201 1 1538 . 1 1 114 114 TYR C C 13 176.241 . . 1 . . 2078 . A 111 TYR C . 34201 1 1539 . 1 1 114 114 TYR CA C 13 56.734 0.015 . 1 . . 933 . A 111 TYR CA . 34201 1 1540 . 1 1 114 114 TYR CB C 13 42.132 0.0 . 1 . . 935 . A 111 TYR CB . 34201 1 1541 . 1 1 114 114 TYR CD1 C 13 132.886 0.079 . 1 . . 1499 . A 111 TYR CD1 . 34201 1 1542 . 1 1 114 114 TYR CD2 C 13 132.886 0.079 . 1 . . 1499 . A 111 TYR CD2 . 34201 1 1543 . 1 1 114 114 TYR CE1 C 13 117.503 0.061 . 1 . . 1497 . A 111 TYR CE1 . 34201 1 1544 . 1 1 114 114 TYR CE2 C 13 117.503 0.061 . 1 . . 1497 . A 111 TYR CE2 . 34201 1 1545 . 1 1 114 114 TYR N N 15 119.604 0.021 . 1 . . 374 . A 111 TYR N . 34201 1 1546 . 1 1 115 115 TYR H H 1 9.189 0.004 . 1 . . 646 . A 112 TYR H . 34201 1 1547 . 1 1 115 115 TYR HA H 1 5.139 0.002 . 1 . . 936 . A 112 TYR HA . 34201 1 1548 . 1 1 115 115 TYR HB2 H 1 2.939 0.016 . 2 . . 1923 . A 112 TYR HB2 . 34201 1 1549 . 1 1 115 115 TYR HB3 H 1 3.146 . . 2 . . 2008 . A 112 TYR HB3 . 34201 1 1550 . 1 1 115 115 TYR HD1 H 1 7.188 0.002 . 1 . . 1663 . A 112 TYR HD1 . 34201 1 1551 . 1 1 115 115 TYR HD2 H 1 7.188 0.002 . 1 . . 1663 . A 112 TYR HD2 . 34201 1 1552 . 1 1 115 115 TYR HE1 H 1 6.768 0.002 . 1 . . 1405 . A 112 TYR HE1 . 34201 1 1553 . 1 1 115 115 TYR HE2 H 1 6.768 0.002 . 1 . . 1405 . A 112 TYR HE2 . 34201 1 1554 . 1 1 115 115 TYR C C 13 175.432 . . 1 . . 2092 . A 112 TYR C . 34201 1 1555 . 1 1 115 115 TYR CA C 13 58.424 0.039 . 1 . . 937 . A 112 TYR CA . 34201 1 1556 . 1 1 115 115 TYR CB C 13 40.052 0.045 . 1 . . 938 . A 112 TYR CB . 34201 1 1557 . 1 1 115 115 TYR CD1 C 13 133.165 0.03 . 1 . . 1664 . A 112 TYR CD1 . 34201 1 1558 . 1 1 115 115 TYR CD2 C 13 133.165 0.03 . 1 . . 1664 . A 112 TYR CD2 . 34201 1 1559 . 1 1 115 115 TYR CE1 C 13 118.201 0.045 . 1 . . 1404 . A 112 TYR CE1 . 34201 1 1560 . 1 1 115 115 TYR CE2 C 13 118.201 0.045 . 1 . . 1404 . A 112 TYR CE2 . 34201 1 1561 . 1 1 115 115 TYR N N 15 120.141 0.017 . 1 . . 645 . A 112 TYR N . 34201 1 1562 . 1 1 116 116 VAL H H 1 9.222 0.002 . 1 . . 648 . A 113 VAL H . 34201 1 1563 . 1 1 116 116 VAL HA H 1 4.520 0.003 . 1 . . 179 . A 113 VAL HA . 34201 1 1564 . 1 1 116 116 VAL HB H 1 2.140 0.0 . 1 . . 178 . A 113 VAL HB . 34201 1 1565 . 1 1 116 116 VAL HG11 H 1 0.946 0.002 . 2 . . 180 . A 113 VAL HG11 . 34201 1 1566 . 1 1 116 116 VAL HG12 H 1 0.946 0.002 . 2 . . 180 . A 113 VAL HG12 . 34201 1 1567 . 1 1 116 116 VAL HG13 H 1 0.946 0.002 . 2 . . 180 . A 113 VAL HG13 . 34201 1 1568 . 1 1 116 116 VAL HG21 H 1 0.876 0.002 . 2 . . 181 . A 113 VAL HG21 . 34201 1 1569 . 1 1 116 116 VAL HG22 H 1 0.876 0.002 . 2 . . 181 . A 113 VAL HG22 . 34201 1 1570 . 1 1 116 116 VAL HG23 H 1 0.876 0.002 . 2 . . 181 . A 113 VAL HG23 . 34201 1 1571 . 1 1 116 116 VAL C C 13 174.620 . . 1 . . 2128 . A 113 VAL C . 34201 1 1572 . 1 1 116 116 VAL CA C 13 61.379 0.049 . 1 . . 942 . A 113 VAL CA . 34201 1 1573 . 1 1 116 116 VAL CB C 13 34.276 . . 1 . . 941 . A 113 VAL CB . 34201 1 1574 . 1 1 116 116 VAL CG1 C 13 22.080 0.027 . 2 . . 939 . A 113 VAL CG1 . 34201 1 1575 . 1 1 116 116 VAL CG2 C 13 22.243 0.036 . 2 . . 940 . A 113 VAL CG2 . 34201 1 1576 . 1 1 116 116 VAL N N 15 121.562 0.018 . 1 . . 647 . A 113 VAL N . 34201 1 1577 . 1 1 117 117 ASN H H 1 8.797 0.004 . 1 . . 434 . A 114 ASN H . 34201 1 1578 . 1 1 117 117 ASN HA H 1 5.241 0.0 . 1 . . 1180 . A 114 ASN HA . 34201 1 1579 . 1 1 117 117 ASN HB2 H 1 2.915 0.006 . 2 . . 1179 . A 114 ASN HB2 . 34201 1 1580 . 1 1 117 117 ASN HB3 H 1 2.713 0.003 . 2 . . 1181 . A 114 ASN HB3 . 34201 1 1581 . 1 1 117 117 ASN HD21 H 1 6.825 0.011 . 1 . . 1417 . A 114 ASN HD21 . 34201 1 1582 . 1 1 117 117 ASN HD22 H 1 7.538 0.002 . 1 . . 1419 . A 114 ASN HD22 . 34201 1 1583 . 1 1 117 117 ASN CA C 13 52.524 . . 1 . . 2170 . A 114 ASN CA . 34201 1 1584 . 1 1 117 117 ASN CB C 13 40.636 0.022 . 1 . . 1182 . A 114 ASN CB . 34201 1 1585 . 1 1 117 117 ASN N N 15 124.559 0.021 . 1 . . 433 . A 114 ASN N . 34201 1 1586 . 1 1 117 117 ASN ND2 N 15 111.242 0.012 . 1 . . 1418 . A 114 ASN ND2 . 34201 1 1587 . 1 1 118 118 ASN H H 1 8.758 0.003 . 1 . . 1645 . A 115 ASN H . 34201 1 1588 . 1 1 118 118 ASN HA H 1 5.715 0.003 . 1 . . 1643 . A 115 ASN HA . 34201 1 1589 . 1 1 118 118 ASN HB2 H 1 2.281 0.0 . 2 . . 1647 . A 115 ASN HB2 . 34201 1 1590 . 1 1 118 118 ASN HB3 H 1 2.966 0.0 . 2 . . 1649 . A 115 ASN HB3 . 34201 1 1591 . 1 1 118 118 ASN HD21 H 1 5.950 0.008 . 1 . . 1872 . A 115 ASN HD21 . 34201 1 1592 . 1 1 118 118 ASN C C 13 173.549 . . 1 . . 2062 . A 115 ASN C . 34201 1 1593 . 1 1 118 118 ASN CA C 13 53.184 0.02 . 1 . . 1644 . A 115 ASN CA . 34201 1 1594 . 1 1 118 118 ASN CB C 13 42.517 0.0 . 1 . . 1648 . A 115 ASN CB . 34201 1 1595 . 1 1 118 118 ASN N N 15 121.614 0.013 . 1 . . 1646 . A 115 ASN N . 34201 1 1596 . 1 1 118 118 ASN ND2 N 15 112.603 0.008 . 1 . . 1873 . A 115 ASN ND2 . 34201 1 1597 . 1 1 119 119 GLU H H 1 8.702 0.003 . 1 . . 394 . A 116 GLU H . 34201 1 1598 . 1 1 119 119 GLU HA H 1 4.674 0.002 . 1 . . 1187 . A 116 GLU HA . 34201 1 1599 . 1 1 119 119 GLU HB2 H 1 1.903 0.003 . 2 . . 1186 . A 116 GLU HB2 . 34201 1 1600 . 1 1 119 119 GLU HB3 H 1 2.049 0.001 . 2 . . 1189 . A 116 GLU HB3 . 34201 1 1601 . 1 1 119 119 GLU HG2 H 1 2.275 0.005 . 2 . . 1183 . A 116 GLU HG2 . 34201 1 1602 . 1 1 119 119 GLU HG3 H 1 2.188 0.003 . 2 . . 1184 . A 116 GLU HG3 . 34201 1 1603 . 1 1 119 119 GLU C C 13 174.795 . . 1 . . 2071 . A 116 GLU C . 34201 1 1604 . 1 1 119 119 GLU CA C 13 54.258 0.025 . 1 . . 1190 . A 116 GLU CA . 34201 1 1605 . 1 1 119 119 GLU CB C 13 34.307 0.02 . 1 . . 1188 . A 116 GLU CB . 34201 1 1606 . 1 1 119 119 GLU CG C 13 35.174 0.038 . 1 . . 1185 . A 116 GLU CG . 34201 1 1607 . 1 1 119 119 GLU N N 15 119.279 0.017 . 1 . . 393 . A 116 GLU N . 34201 1 1608 . 1 1 120 120 TYR H H 1 8.909 0.003 . 1 . . 448 . A 117 TYR H . 34201 1 1609 . 1 1 120 120 TYR HA H 1 5.329 0.009 . 1 . . 945 . A 117 TYR HA . 34201 1 1610 . 1 1 120 120 TYR HB2 H 1 3.028 0.0 . 2 . . 947 . A 117 TYR HB2 . 34201 1 1611 . 1 1 120 120 TYR HB3 H 1 2.689 0.0 . 2 . . 948 . A 117 TYR HB3 . 34201 1 1612 . 1 1 120 120 TYR HD1 H 1 7.025 0.018 . 1 . . 1412 . A 117 TYR HD1 . 34201 1 1613 . 1 1 120 120 TYR HD2 H 1 7.025 0.018 . 1 . . 1412 . A 117 TYR HD2 . 34201 1 1614 . 1 1 120 120 TYR HE1 H 1 6.949 0.004 . 1 . . 1410 . A 117 TYR HE1 . 34201 1 1615 . 1 1 120 120 TYR HE2 H 1 6.949 0.004 . 1 . . 1410 . A 117 TYR HE2 . 34201 1 1616 . 1 1 120 120 TYR C C 13 178.127 . . 1 . . 2065 . A 117 TYR C . 34201 1 1617 . 1 1 120 120 TYR CA C 13 59.142 0.002 . 1 . . 946 . A 117 TYR CA . 34201 1 1618 . 1 1 120 120 TYR CB C 13 41.017 . . 1 . . 2171 . A 117 TYR CB . 34201 1 1619 . 1 1 120 120 TYR CD1 C 13 132.975 0.035 . 1 . . 1413 . A 117 TYR CD1 . 34201 1 1620 . 1 1 120 120 TYR CD2 C 13 132.975 0.035 . 1 . . 1413 . A 117 TYR CD2 . 34201 1 1621 . 1 1 120 120 TYR CE1 C 13 117.537 0.049 . 1 . . 1411 . A 117 TYR CE1 . 34201 1 1622 . 1 1 120 120 TYR CE2 C 13 117.537 0.049 . 1 . . 1411 . A 117 TYR CE2 . 34201 1 1623 . 1 1 120 120 TYR N N 15 119.886 0.031 . 1 . . 447 . A 117 TYR N . 34201 1 1624 . 1 1 121 121 ASP H H 1 9.131 0.003 . 1 . . 513 . A 118 ASP H . 34201 1 1625 . 1 1 121 121 ASP HA H 1 4.346 0.001 . 1 . . 950 . A 118 ASP HA . 34201 1 1626 . 1 1 121 121 ASP HB2 H 1 3.103 0.007 . 2 . . 949 . A 118 ASP HB2 . 34201 1 1627 . 1 1 121 121 ASP HB3 H 1 2.697 0.007 . 2 . . 952 . A 118 ASP HB3 . 34201 1 1628 . 1 1 121 121 ASP C C 13 176.142 . . 1 . . 2052 . A 118 ASP C . 34201 1 1629 . 1 1 121 121 ASP CA C 13 54.735 0.041 . 1 . . 953 . A 118 ASP CA . 34201 1 1630 . 1 1 121 121 ASP CB C 13 40.404 0.048 . 1 . . 951 . A 118 ASP CB . 34201 1 1631 . 1 1 121 121 ASP N N 15 119.371 0.026 . 1 . . 512 . A 118 ASP N . 34201 1 1632 . 1 1 122 122 GLU H H 1 7.255 0.002 . 1 . . 426 . A 119 GLU H . 34201 1 1633 . 1 1 122 122 GLU HA H 1 4.717 0.002 . 1 . . 957 . A 119 GLU HA . 34201 1 1634 . 1 1 122 122 GLU HB2 H 1 2.189 0.005 . 2 . . 954 . A 119 GLU HB2 . 34201 1 1635 . 1 1 122 122 GLU HB3 H 1 1.671 0.006 . 2 . . 956 . A 119 GLU HB3 . 34201 1 1636 . 1 1 122 122 GLU HG2 H 1 2.401 0.002 . 2 . . 959 . A 119 GLU HG2 . 34201 1 1637 . 1 1 122 122 GLU HG3 H 1 2.456 0.003 . 2 . . 960 . A 119 GLU HG3 . 34201 1 1638 . 1 1 122 122 GLU C C 13 176.873 . . 1 . . 2143 . A 119 GLU C . 34201 1 1639 . 1 1 122 122 GLU CA C 13 54.514 0.047 . 1 . . 958 . A 119 GLU CA . 34201 1 1640 . 1 1 122 122 GLU CB C 13 32.838 0.028 . 1 . . 955 . A 119 GLU CB . 34201 1 1641 . 1 1 122 122 GLU CG C 13 35.332 0.044 . 1 . . 961 . A 119 GLU CG . 34201 1 1642 . 1 1 122 122 GLU N N 15 118.382 0.019 . 1 . . 425 . A 119 GLU N . 34201 1 1643 . 1 1 123 123 GLU H H 1 9.181 0.002 . 1 . . 614 . A 120 GLU H . 34201 1 1644 . 1 1 123 123 GLU HA H 1 3.804 0.005 . 1 . . 962 . A 120 GLU HA . 34201 1 1645 . 1 1 123 123 GLU HB2 H 1 2.121 0.001 . 2 . . 964 . A 120 GLU HB2 . 34201 1 1646 . 1 1 123 123 GLU HB3 H 1 2.009 0.003 . 2 . . 965 . A 120 GLU HB3 . 34201 1 1647 . 1 1 123 123 GLU HG2 H 1 2.309 0.002 . 2 . . 966 . A 120 GLU HG2 . 34201 1 1648 . 1 1 123 123 GLU HG3 H 1 2.309 0.002 . 2 . . 1924 . A 120 GLU HG3 . 34201 1 1649 . 1 1 123 123 GLU C C 13 177.797 . . 1 . . 2050 . A 120 GLU C . 34201 1 1650 . 1 1 123 123 GLU CA C 13 60.141 0.046 . 1 . . 963 . A 120 GLU CA . 34201 1 1651 . 1 1 123 123 GLU CB C 13 29.471 0.024 . 1 . . 968 . A 120 GLU CB . 34201 1 1652 . 1 1 123 123 GLU CG C 13 35.644 0.015 . 1 . . 967 . A 120 GLU CG . 34201 1 1653 . 1 1 123 123 GLU N N 15 126.582 0.009 . 1 . . 613 . A 120 GLU N . 34201 1 1654 . 1 1 124 124 GLU H H 1 9.165 0.003 . 1 . . 608 . A 121 GLU H . 34201 1 1655 . 1 1 124 124 GLU HA H 1 4.018 0.003 . 1 . . 969 . A 121 GLU HA . 34201 1 1656 . 1 1 124 124 GLU HB2 H 1 1.867 0.002 . 2 . . 972 . A 121 GLU HB2 . 34201 1 1657 . 1 1 124 124 GLU HB3 H 1 2.040 0.005 . 2 . . 973 . A 121 GLU HB3 . 34201 1 1658 . 1 1 124 124 GLU HG2 H 1 2.252 0.004 . 2 . . 975 . A 121 GLU HG2 . 34201 1 1659 . 1 1 124 124 GLU HG3 H 1 2.295 0.003 . 2 . . 976 . A 121 GLU HG3 . 34201 1 1660 . 1 1 124 124 GLU C C 13 178.507 . . 1 . . 2041 . A 121 GLU C . 34201 1 1661 . 1 1 124 124 GLU CA C 13 59.746 0.004 . 1 . . 970 . A 121 GLU CA . 34201 1 1662 . 1 1 124 124 GLU CB C 13 29.175 0.016 . 1 . . 971 . A 121 GLU CB . 34201 1 1663 . 1 1 124 124 GLU CG C 13 36.118 0.02 . 1 . . 974 . A 121 GLU CG . 34201 1 1664 . 1 1 124 124 GLU N N 15 117.373 0.02 . 1 . . 607 . A 121 GLU N . 34201 1 1665 . 1 1 125 125 LEU H H 1 6.564 0.004 . 1 . . 526 . A 122 LEU H . 34201 1 1666 . 1 1 125 125 LEU HA H 1 3.912 0.007 . 1 . . 289 . A 122 LEU HA . 34201 1 1667 . 1 1 125 125 LEU HB2 H 1 0.627 0.013 . 2 . . 291 . A 122 LEU HB2 . 34201 1 1668 . 1 1 125 125 LEU HB3 H 1 1.513 0.005 . 2 . . 293 . A 122 LEU HB3 . 34201 1 1669 . 1 1 125 125 LEU HG H 1 1.366 0.01 . 1 . . 292 . A 122 LEU HG . 34201 1 1670 . 1 1 125 125 LEU HD11 H 1 0.331 0.001 . 2 . . 288 . A 122 LEU HD11 . 34201 1 1671 . 1 1 125 125 LEU HD12 H 1 0.331 0.001 . 2 . . 288 . A 122 LEU HD12 . 34201 1 1672 . 1 1 125 125 LEU HD13 H 1 0.331 0.001 . 2 . . 288 . A 122 LEU HD13 . 34201 1 1673 . 1 1 125 125 LEU HD21 H 1 0.396 0.001 . 2 . . 290 . A 122 LEU HD21 . 34201 1 1674 . 1 1 125 125 LEU HD22 H 1 0.396 0.001 . 2 . . 290 . A 122 LEU HD22 . 34201 1 1675 . 1 1 125 125 LEU HD23 H 1 0.396 0.001 . 2 . . 290 . A 122 LEU HD23 . 34201 1 1676 . 1 1 125 125 LEU C C 13 176.845 . . 1 . . 2029 . A 122 LEU C . 34201 1 1677 . 1 1 125 125 LEU CA C 13 56.116 0.031 . 1 . . 977 . A 122 LEU CA . 34201 1 1678 . 1 1 125 125 LEU CB C 13 41.324 0.038 . 1 . . 978 . A 122 LEU CB . 34201 1 1679 . 1 1 125 125 LEU CG C 13 26.729 0.029 . 1 . . 979 . A 122 LEU CG . 34201 1 1680 . 1 1 125 125 LEU CD1 C 13 25.379 0.017 . 2 . . 1406 . A 122 LEU CD1 . 34201 1 1681 . 1 1 125 125 LEU CD2 C 13 22.376 0.019 . 2 . . 1407 . A 122 LEU CD2 . 34201 1 1682 . 1 1 125 125 LEU N N 15 116.198 0.015 . 1 . . 525 . A 122 LEU N . 34201 1 1683 . 1 1 126 126 ARG H H 1 7.473 0.003 . 1 . . 570 . A 123 ARG H . 34201 1 1684 . 1 1 126 126 ARG HA H 1 4.208 0.002 . 1 . . 980 . A 123 ARG HA . 34201 1 1685 . 1 1 126 126 ARG HB2 H 1 2.054 0.0 . 2 . . 984 . A 123 ARG HB2 . 34201 1 1686 . 1 1 126 126 ARG HB3 H 1 1.897 0.0 . 2 . . 985 . A 123 ARG HB3 . 34201 1 1687 . 1 1 126 126 ARG HG2 H 1 1.832 0.005 . 2 . . 988 . A 123 ARG HG2 . 34201 1 1688 . 1 1 126 126 ARG HG3 H 1 1.832 0.005 . 2 . . 1926 . A 123 ARG HG3 . 34201 1 1689 . 1 1 126 126 ARG HD2 H 1 3.190 0.005 . 2 . . 981 . A 123 ARG HD2 . 34201 1 1690 . 1 1 126 126 ARG HD3 H 1 3.471 0.006 . 2 . . 983 . A 123 ARG HD3 . 34201 1 1691 . 1 1 126 126 ARG HE H 1 7.409 0.002 . 1 . . 1732 . A 123 ARG HE . 34201 1 1692 . 1 1 126 126 ARG C C 13 179.343 . . 1 . . 2034 . A 123 ARG C . 34201 1 1693 . 1 1 126 126 ARG CA C 13 59.499 0.035 . 1 . . 982 . A 123 ARG CA . 34201 1 1694 . 1 1 126 126 ARG CB C 13 31.203 0.007 . 1 . . 1925 . A 123 ARG CB . 34201 1 1695 . 1 1 126 126 ARG CG C 13 29.435 0.018 . 1 . . 987 . A 123 ARG CG . 34201 1 1696 . 1 1 126 126 ARG CD C 13 44.045 0.019 . 1 . . 986 . A 123 ARG CD . 34201 1 1697 . 1 1 126 126 ARG N N 15 114.959 0.018 . 1 . . 569 . A 123 ARG N . 34201 1 1698 . 1 1 126 126 ARG NE N 15 83.667 0.01 . 1 . . 1731 . A 123 ARG NE . 34201 1 1699 . 1 1 127 127 GLU H H 1 7.986 0.006 . 1 . . 579 . A 124 GLU H . 34201 1 1700 . 1 1 127 127 GLU HA H 1 4.122 0.002 . 1 . . 989 . A 124 GLU HA . 34201 1 1701 . 1 1 127 127 GLU HB2 H 1 1.952 0.004 . 2 . . 993 . A 124 GLU HB2 . 34201 1 1702 . 1 1 127 127 GLU HB3 H 1 2.033 0.002 . 2 . . 994 . A 124 GLU HB3 . 34201 1 1703 . 1 1 127 127 GLU HG2 H 1 2.419 0.001 . 2 . . 991 . A 124 GLU HG2 . 34201 1 1704 . 1 1 127 127 GLU HG3 H 1 2.307 0.001 . 2 . . 992 . A 124 GLU HG3 . 34201 1 1705 . 1 1 127 127 GLU C C 13 176.414 . . 1 . . 2038 . A 124 GLU C . 34201 1 1706 . 1 1 127 127 GLU CA C 13 57.793 0.028 . 1 . . 990 . A 124 GLU CA . 34201 1 1707 . 1 1 127 127 GLU CB C 13 30.319 0.031 . 1 . . 995 . A 124 GLU CB . 34201 1 1708 . 1 1 127 127 GLU CG C 13 35.960 0.027 . 1 . . 996 . A 124 GLU CG . 34201 1 1709 . 1 1 127 127 GLU N N 15 115.417 0.017 . 1 . . 578 . A 124 GLU N . 34201 1 1710 . 1 1 128 128 ASN H H 1 7.412 0.001 . 1 . . 451 . A 125 ASN H . 34201 1 1711 . 1 1 128 128 ASN HA H 1 5.080 0.001 . 1 . . 1191 . A 125 ASN HA . 34201 1 1712 . 1 1 128 128 ASN HB2 H 1 2.588 0.002 . 2 . . 1193 . A 125 ASN HB2 . 34201 1 1713 . 1 1 128 128 ASN HB3 H 1 2.692 0.002 . 2 . . 1194 . A 125 ASN HB3 . 34201 1 1714 . 1 1 128 128 ASN HD21 H 1 6.913 0.001 . 1 . . 1423 . A 125 ASN HD21 . 34201 1 1715 . 1 1 128 128 ASN HD22 H 1 7.671 0.001 . 1 . . 1425 . A 125 ASN HD22 . 34201 1 1716 . 1 1 128 128 ASN CA C 13 50.545 0.015 . 1 . . 1192 . A 125 ASN CA . 34201 1 1717 . 1 1 128 128 ASN CB C 13 39.432 0.023 . 1 . . 450 . A 125 ASN CB . 34201 1 1718 . 1 1 128 128 ASN N N 15 115.898 0.01 . 1 . . 449 . A 125 ASN N . 34201 1 1719 . 1 1 128 128 ASN ND2 N 15 115.029 0.01 . 1 . . 1424 . A 125 ASN ND2 . 34201 1 1720 . 1 1 129 129 PRO HA H 1 4.856 0.003 . 1 . . 1632 . A 126 PRO HA . 34201 1 1721 . 1 1 129 129 PRO HB2 H 1 2.506 0.002 . 2 . . 1634 . A 126 PRO HB2 . 34201 1 1722 . 1 1 129 129 PRO HB3 H 1 2.015 0.002 . 2 . . 1636 . A 126 PRO HB3 . 34201 1 1723 . 1 1 129 129 PRO HG2 H 1 2.147 0.002 . 2 . . 1637 . A 126 PRO HG2 . 34201 1 1724 . 1 1 129 129 PRO HG3 H 1 2.126 0.003 . 2 . . 1639 . A 126 PRO HG3 . 34201 1 1725 . 1 1 129 129 PRO HD2 H 1 3.594 0.005 . 2 . . 1640 . A 126 PRO HD2 . 34201 1 1726 . 1 1 129 129 PRO HD3 H 1 3.410 0.003 . 2 . . 1642 . A 126 PRO HD3 . 34201 1 1727 . 1 1 129 129 PRO CA C 13 61.455 0.01 . 1 . . 1633 . A 126 PRO CA . 34201 1 1728 . 1 1 129 129 PRO CB C 13 31.411 0.029 . 1 . . 1635 . A 126 PRO CB . 34201 1 1729 . 1 1 129 129 PRO CG C 13 27.724 0.015 . 1 . . 1638 . A 126 PRO CG . 34201 1 1730 . 1 1 129 129 PRO CD C 13 50.029 0.032 . 1 . . 1641 . A 126 PRO CD . 34201 1 1731 . 1 1 130 130 PRO HA H 1 4.445 0.003 . 1 . . 1624 . A 127 PRO HA . 34201 1 1732 . 1 1 130 130 PRO HB2 H 1 2.217 0.006 . 2 . . 1625 . A 127 PRO HB2 . 34201 1 1733 . 1 1 130 130 PRO HB3 H 1 2.217 0.006 . 2 . . 1927 . A 127 PRO HB3 . 34201 1 1734 . 1 1 130 130 PRO HG2 H 1 1.762 0.001 . 2 . . 1628 . A 127 PRO HG2 . 34201 1 1735 . 1 1 130 130 PRO HG3 H 1 1.968 0.0 . 2 . . 1629 . A 127 PRO HG3 . 34201 1 1736 . 1 1 130 130 PRO HD2 H 1 3.523 0.008 . 2 . . 1627 . A 127 PRO HD2 . 34201 1 1737 . 1 1 130 130 PRO HD3 H 1 3.530 0.005 . 2 . . 1928 . A 127 PRO HD3 . 34201 1 1738 . 1 1 130 130 PRO C C 13 176.769 . . 1 . . 2118 . A 127 PRO C . 34201 1 1739 . 1 1 130 130 PRO CA C 13 61.934 0.025 . 1 . . 1623 . A 127 PRO CA . 34201 1 1740 . 1 1 130 130 PRO CB C 13 32.228 0.011 . 1 . . 1626 . A 127 PRO CB . 34201 1 1741 . 1 1 130 130 PRO CG C 13 27.167 0.053 . 1 . . 1630 . A 127 PRO CG . 34201 1 1742 . 1 1 130 130 PRO CD C 13 50.651 0.05 . 1 . . 1631 . A 127 PRO CD . 34201 1 1743 . 1 1 131 131 ALA H H 1 8.491 0.006 . 1 . . 430 . A 128 ALA H . 34201 1 1744 . 1 1 131 131 ALA HA H 1 4.031 0.0 . 1 . . 153 . A 128 ALA HA . 34201 1 1745 . 1 1 131 131 ALA HB1 H 1 1.424 0.001 . 1 . . 152 . A 128 ALA HB1 . 34201 1 1746 . 1 1 131 131 ALA HB2 H 1 1.424 0.001 . 1 . . 152 . A 128 ALA HB2 . 34201 1 1747 . 1 1 131 131 ALA HB3 H 1 1.424 0.001 . 1 . . 152 . A 128 ALA HB3 . 34201 1 1748 . 1 1 131 131 ALA C C 13 178.060 . . 1 . . 2039 . A 128 ALA C . 34201 1 1749 . 1 1 131 131 ALA CA C 13 54.566 0.009 . 1 . . 998 . A 128 ALA CA . 34201 1 1750 . 1 1 131 131 ALA CB C 13 18.634 0.021 . 1 . . 997 . A 128 ALA CB . 34201 1 1751 . 1 1 131 131 ALA N N 15 123.242 0.011 . 1 . . 429 . A 128 ALA N . 34201 1 1752 . 1 1 132 132 LYS H H 1 7.526 0.002 . 1 . . 644 . A 129 LYS H . 34201 1 1753 . 1 1 132 132 LYS HA H 1 4.596 0.003 . 1 . . 346 . A 129 LYS HA . 34201 1 1754 . 1 1 132 132 LYS HB2 H 1 1.629 0.002 . 2 . . 348 . A 129 LYS HB2 . 34201 1 1755 . 1 1 132 132 LYS HB3 H 1 1.748 0.002 . 2 . . 349 . A 129 LYS HB3 . 34201 1 1756 . 1 1 132 132 LYS HG2 H 1 1.345 0.002 . 2 . . 351 . A 129 LYS HG2 . 34201 1 1757 . 1 1 132 132 LYS HG3 H 1 1.424 0.001 . 2 . . 352 . A 129 LYS HG3 . 34201 1 1758 . 1 1 132 132 LYS HD2 H 1 1.690 0.001 . 2 . . 350 . A 129 LYS HD2 . 34201 1 1759 . 1 1 132 132 LYS HD3 H 1 1.691 0.001 . 2 . . 353 . A 129 LYS HD3 . 34201 1 1760 . 1 1 132 132 LYS HE2 H 1 3.008 0.001 . 2 . . 345 . A 129 LYS HE2 . 34201 1 1761 . 1 1 132 132 LYS HE3 H 1 3.009 0.001 . 2 . . 347 . A 129 LYS HE3 . 34201 1 1762 . 1 1 132 132 LYS C C 13 175.573 . . 1 . . 2123 . A 129 LYS C . 34201 1 1763 . 1 1 132 132 LYS CA C 13 54.032 0.028 . 1 . . 1003 . A 129 LYS CA . 34201 1 1764 . 1 1 132 132 LYS CB C 13 33.397 0.017 . 1 . . 999 . A 129 LYS CB . 34201 1 1765 . 1 1 132 132 LYS CG C 13 24.723 0.013 . 1 . . 1002 . A 129 LYS CG . 34201 1 1766 . 1 1 132 132 LYS CD C 13 29.134 0.012 . 1 . . 1001 . A 129 LYS CD . 34201 1 1767 . 1 1 132 132 LYS CE C 13 42.254 0.007 . 1 . . 1000 . A 129 LYS CE . 34201 1 1768 . 1 1 132 132 LYS N N 15 116.007 0.014 . 1 . . 643 . A 129 LYS N . 34201 1 1769 . 1 1 133 133 VAL H H 1 8.243 0.003 . 1 . . 660 . A 130 VAL H . 34201 1 1770 . 1 1 133 133 VAL HA H 1 3.745 0.002 . 1 . . 1028 . A 130 VAL HA . 34201 1 1771 . 1 1 133 133 VAL HB H 1 1.826 0.003 . 1 . . 1030 . A 130 VAL HB . 34201 1 1772 . 1 1 133 133 VAL HG11 H 1 0.915 0.004 . 2 . . 1032 . A 130 VAL HG11 . 34201 1 1773 . 1 1 133 133 VAL HG12 H 1 0.915 0.004 . 2 . . 1032 . A 130 VAL HG12 . 34201 1 1774 . 1 1 133 133 VAL HG13 H 1 0.915 0.004 . 2 . . 1032 . A 130 VAL HG13 . 34201 1 1775 . 1 1 133 133 VAL HG21 H 1 0.798 0.001 . 2 . . 1033 . A 130 VAL HG21 . 34201 1 1776 . 1 1 133 133 VAL HG22 H 1 0.798 0.001 . 2 . . 1033 . A 130 VAL HG22 . 34201 1 1777 . 1 1 133 133 VAL HG23 H 1 0.798 0.001 . 2 . . 1033 . A 130 VAL HG23 . 34201 1 1778 . 1 1 133 133 VAL C C 13 176.458 . . 1 . . 2131 . A 130 VAL C . 34201 1 1779 . 1 1 133 133 VAL CA C 13 63.205 0.025 . 1 . . 1029 . A 130 VAL CA . 34201 1 1780 . 1 1 133 133 VAL CB C 13 32.112 0.026 . 1 . . 1031 . A 130 VAL CB . 34201 1 1781 . 1 1 133 133 VAL CG1 C 13 21.600 0.042 . 2 . . 1035 . A 130 VAL CG1 . 34201 1 1782 . 1 1 133 133 VAL CG2 C 13 21.208 0.03 . 2 . . 1034 . A 130 VAL CG2 . 34201 1 1783 . 1 1 133 133 VAL N N 15 123.594 0.019 . 1 . . 659 . A 130 VAL N . 34201 1 1784 . 1 1 134 134 GLN H H 1 7.637 0.005 . 1 . . 411 . A 131 GLN H . 34201 1 1785 . 1 1 134 134 GLN HA H 1 4.703 0.003 . 1 . . 1011 . A 131 GLN HA . 34201 1 1786 . 1 1 134 134 GLN HB2 H 1 2.324 0.005 . 2 . . 1012 . A 131 GLN HB2 . 34201 1 1787 . 1 1 134 134 GLN HB3 H 1 1.993 0.009 . 2 . . 1013 . A 131 GLN HB3 . 34201 1 1788 . 1 1 134 134 GLN HG2 H 1 2.478 0.005 . 2 . . 1008 . A 131 GLN HG2 . 34201 1 1789 . 1 1 134 134 GLN HG3 H 1 2.435 0.004 . 2 . . 1010 . A 131 GLN HG3 . 34201 1 1790 . 1 1 134 134 GLN HE21 H 1 7.511 0.001 . 1 . . 1438 . A 131 GLN HE21 . 34201 1 1791 . 1 1 134 134 GLN HE22 H 1 6.712 0.002 . 1 . . 1439 . A 131 GLN HE22 . 34201 1 1792 . 1 1 134 134 GLN C C 13 176.556 . . 1 . . 2117 . A 131 GLN C . 34201 1 1793 . 1 1 134 134 GLN CA C 13 53.501 0.028 . 1 . . 1014 . A 131 GLN CA . 34201 1 1794 . 1 1 134 134 GLN CB C 13 28.499 0.043 . 1 . . 410 . A 131 GLN CB . 34201 1 1795 . 1 1 134 134 GLN CG C 13 33.081 0.027 . 1 . . 1009 . A 131 GLN CG . 34201 1 1796 . 1 1 134 134 GLN N N 15 125.759 0.016 . 1 . . 409 . A 131 GLN N . 34201 1 1797 . 1 1 134 134 GLN NE2 N 15 111.271 0.017 . 1 . . 1437 . A 131 GLN NE2 . 34201 1 1798 . 1 1 135 135 VAL H H 1 8.343 0.003 . 1 . . 456 . A 132 VAL H . 34201 1 1799 . 1 1 135 135 VAL HA H 1 3.440 0.005 . 1 . . 214 . A 132 VAL HA . 34201 1 1800 . 1 1 135 135 VAL HB H 1 1.939 0.002 . 1 . . 215 . A 132 VAL HB . 34201 1 1801 . 1 1 135 135 VAL HG11 H 1 0.824 0.003 . 2 . . 216 . A 132 VAL HG11 . 34201 1 1802 . 1 1 135 135 VAL HG12 H 1 0.824 0.003 . 2 . . 216 . A 132 VAL HG12 . 34201 1 1803 . 1 1 135 135 VAL HG13 H 1 0.824 0.003 . 2 . . 216 . A 132 VAL HG13 . 34201 1 1804 . 1 1 135 135 VAL HG21 H 1 0.738 0.002 . 2 . . 217 . A 132 VAL HG21 . 34201 1 1805 . 1 1 135 135 VAL HG22 H 1 0.738 0.002 . 2 . . 217 . A 132 VAL HG22 . 34201 1 1806 . 1 1 135 135 VAL HG23 H 1 0.738 0.002 . 2 . . 217 . A 132 VAL HG23 . 34201 1 1807 . 1 1 135 135 VAL C C 13 176.972 . . 1 . . 2046 . A 132 VAL C . 34201 1 1808 . 1 1 135 135 VAL CA C 13 65.766 0.037 . 1 . . 1004 . A 132 VAL CA . 34201 1 1809 . 1 1 135 135 VAL CB C 13 31.689 0.044 . 1 . . 1005 . A 132 VAL CB . 34201 1 1810 . 1 1 135 135 VAL CG1 C 13 21.755 0.033 . 2 . . 1006 . A 132 VAL CG1 . 34201 1 1811 . 1 1 135 135 VAL CG2 C 13 21.462 0.015 . 2 . . 1007 . A 132 VAL CG2 . 34201 1 1812 . 1 1 135 135 VAL N N 15 123.118 0.014 . 1 . . 455 . A 132 VAL N . 34201 1 1813 . 1 1 136 136 ASP H H 1 8.961 0.005 . 1 . . 568 . A 133 ASP H . 34201 1 1814 . 1 1 136 136 ASP HA H 1 4.493 0.002 . 1 . . 1043 . A 133 ASP HA . 34201 1 1815 . 1 1 136 136 ASP HB2 H 1 2.547 0.002 . 2 . . 1040 . A 133 ASP HB2 . 34201 1 1816 . 1 1 136 136 ASP HB3 H 1 2.611 0.004 . 2 . . 1042 . A 133 ASP HB3 . 34201 1 1817 . 1 1 136 136 ASP C C 13 176.214 . . 1 . . 2030 . A 133 ASP C . 34201 1 1818 . 1 1 136 136 ASP CA C 13 55.472 0.035 . 1 . . 1044 . A 133 ASP CA . 34201 1 1819 . 1 1 136 136 ASP CB C 13 39.455 0.02 . 1 . . 1041 . A 133 ASP CB . 34201 1 1820 . 1 1 136 136 ASP N N 15 116.790 0.026 . 1 . . 567 . A 133 ASP N . 34201 1 1821 . 1 1 137 137 HIS H H 1 8.011 0.003 . 1 . . 404 . A 134 HIS H . 34201 1 1822 . 1 1 137 137 HIS HA H 1 4.787 0.0 . 1 . . 1196 . A 134 HIS HA . 34201 1 1823 . 1 1 137 137 HIS HB2 H 1 2.922 . . 2 . . 1195 . A 134 HIS HB2 . 34201 1 1824 . 1 1 137 137 HIS HB3 H 1 3.993 0.0 . 2 . . 1198 . A 134 HIS HB3 . 34201 1 1825 . 1 1 137 137 HIS HD2 H 1 7.265 0.008 . 1 . . 1408 . A 134 HIS HD2 . 34201 1 1826 . 1 1 137 137 HIS C C 13 172.888 . . 1 . . 2085 . A 134 HIS C . 34201 1 1827 . 1 1 137 137 HIS CA C 13 55.800 . . 1 . . 2172 . A 134 HIS CA . 34201 1 1828 . 1 1 137 137 HIS CB C 13 30.774 0.0 . 1 . . 1197 . A 134 HIS CB . 34201 1 1829 . 1 1 137 137 HIS CD2 C 13 119.466 0.081 . 1 . . 1409 . A 134 HIS CD2 . 34201 1 1830 . 1 1 137 137 HIS N N 15 115.226 0.025 . 1 . . 403 . A 134 HIS N . 34201 1 1831 . 1 1 138 138 ILE H H 1 7.504 0.005 . 1 . . 669 . A 135 ILE H . 34201 1 1832 . 1 1 138 138 ILE HA H 1 4.335 0.008 . 1 . . 111 . A 135 ILE HA . 34201 1 1833 . 1 1 138 138 ILE HB H 1 1.829 0.007 . 1 . . 108 . A 135 ILE HB . 34201 1 1834 . 1 1 138 138 ILE HG12 H 1 0.456 0.004 . 2 . . 117 . A 135 ILE HG12 . 34201 1 1835 . 1 1 138 138 ILE HG13 H 1 1.545 0.0 . 2 . . 118 . A 135 ILE HG13 . 34201 1 1836 . 1 1 138 138 ILE HG21 H 1 0.779 0.003 . 1 . . 110 . A 135 ILE HG21 . 34201 1 1837 . 1 1 138 138 ILE HG22 H 1 0.779 0.003 . 1 . . 110 . A 135 ILE HG22 . 34201 1 1838 . 1 1 138 138 ILE HG23 H 1 0.779 0.003 . 1 . . 110 . A 135 ILE HG23 . 34201 1 1839 . 1 1 138 138 ILE HD11 H 1 0.112 0.003 . 1 . . 668 . A 135 ILE HD11 . 34201 1 1840 . 1 1 138 138 ILE HD12 H 1 0.112 0.003 . 1 . . 668 . A 135 ILE HD12 . 34201 1 1841 . 1 1 138 138 ILE HD13 H 1 0.112 0.003 . 1 . . 668 . A 135 ILE HD13 . 34201 1 1842 . 1 1 138 138 ILE C C 13 175.488 . . 1 . . 2161 . A 135 ILE C . 34201 1 1843 . 1 1 138 138 ILE CA C 13 61.503 0.064 . 1 . . 1037 . A 135 ILE CA . 34201 1 1844 . 1 1 138 138 ILE CB C 13 37.885 0.062 . 1 . . 1038 . A 135 ILE CB . 34201 1 1845 . 1 1 138 138 ILE CG1 C 13 27.141 0.025 . 1 . . 1860 . A 135 ILE CG1 . 34201 1 1846 . 1 1 138 138 ILE CG2 C 13 18.327 0.02 . 1 . . 1036 . A 135 ILE CG2 . 34201 1 1847 . 1 1 138 138 ILE CD1 C 13 13.189 0.021 . 1 . . 1039 . A 135 ILE CD1 . 34201 1 1848 . 1 1 138 138 ILE N N 15 120.995 0.024 . 1 . . 667 . A 135 ILE N . 34201 1 1849 . 1 1 139 139 VAL H H 1 9.478 0.003 . 1 . . 618 . A 136 VAL H . 34201 1 1850 . 1 1 139 139 VAL HA H 1 4.581 0.005 . 1 . . 226 . A 136 VAL HA . 34201 1 1851 . 1 1 139 139 VAL HB H 1 2.018 0.002 . 1 . . 227 . A 136 VAL HB . 34201 1 1852 . 1 1 139 139 VAL HG11 H 1 0.908 0.002 . 2 . . 228 . A 136 VAL HG11 . 34201 1 1853 . 1 1 139 139 VAL HG12 H 1 0.908 0.002 . 2 . . 228 . A 136 VAL HG12 . 34201 1 1854 . 1 1 139 139 VAL HG13 H 1 0.908 0.002 . 2 . . 228 . A 136 VAL HG13 . 34201 1 1855 . 1 1 139 139 VAL HG21 H 1 0.953 0.001 . 2 . . 229 . A 136 VAL HG21 . 34201 1 1856 . 1 1 139 139 VAL HG22 H 1 0.953 0.001 . 2 . . 229 . A 136 VAL HG22 . 34201 1 1857 . 1 1 139 139 VAL HG23 H 1 0.953 0.001 . 2 . . 229 . A 136 VAL HG23 . 34201 1 1858 . 1 1 139 139 VAL C C 13 174.496 . . 1 . . 2140 . A 136 VAL C . 34201 1 1859 . 1 1 139 139 VAL CA C 13 61.086 0.054 . 1 . . 1045 . A 136 VAL CA . 34201 1 1860 . 1 1 139 139 VAL CB C 13 34.118 0.017 . 1 . . 1046 . A 136 VAL CB . 34201 1 1861 . 1 1 139 139 VAL CG1 C 13 21.514 0.017 . 2 . . 1048 . A 136 VAL CG1 . 34201 1 1862 . 1 1 139 139 VAL CG2 C 13 21.380 0.019 . 2 . . 1047 . A 136 VAL CG2 . 34201 1 1863 . 1 1 139 139 VAL N N 15 129.877 0.019 . 1 . . 617 . A 136 VAL N . 34201 1 1864 . 1 1 140 140 ARG H H 1 9.503 0.003 . 1 . . 598 . A 137 ARG H . 34201 1 1865 . 1 1 140 140 ARG HA H 1 5.389 0.009 . 1 . . 1201 . A 137 ARG HA . 34201 1 1866 . 1 1 140 140 ARG HB2 H 1 1.690 0.0 . 2 . . 1199 . A 137 ARG HB2 . 34201 1 1867 . 1 1 140 140 ARG HB3 H 1 1.365 0.0 . 2 . . 1200 . A 137 ARG HB3 . 34201 1 1868 . 1 1 140 140 ARG HG2 H 1 1.625 0.0 . 2 . . 1202 . A 137 ARG HG2 . 34201 1 1869 . 1 1 140 140 ARG HG3 H 1 1.282 0.0 . 2 . . 1203 . A 137 ARG HG3 . 34201 1 1870 . 1 1 140 140 ARG HD2 H 1 3.368 0.024 . 2 . . 1466 . A 137 ARG HD2 . 34201 1 1871 . 1 1 140 140 ARG HD3 H 1 3.254 0.0 . 2 . . 1469 . A 137 ARG HD3 . 34201 1 1872 . 1 1 140 140 ARG HE H 1 7.334 0.001 . 1 . . 1733 . A 137 ARG HE . 34201 1 1873 . 1 1 140 140 ARG HH11 H 1 6.826 0.0 . 1 . . 2012 . A 137 ARG HH11 . 34201 1 1874 . 1 1 140 140 ARG HH22 H 1 6.826 0.0 . 1 . . 2012 . A 137 ARG HH22 . 34201 1 1875 . 1 1 140 140 ARG CA C 13 53.623 0.007 . 1 . . 1464 . A 137 ARG CA . 34201 1 1876 . 1 1 140 140 ARG CB C 13 33.586 0.0 . 1 . . 1465 . A 137 ARG CB . 34201 1 1877 . 1 1 140 140 ARG CG C 13 27.279 0.0 . 1 . . 1467 . A 137 ARG CG . 34201 1 1878 . 1 1 140 140 ARG CD C 13 43.545 0.019 . 1 . . 1468 . A 137 ARG CD . 34201 1 1879 . 1 1 140 140 ARG N N 15 126.950 0.026 . 1 . . 597 . A 137 ARG N . 34201 1 1880 . 1 1 140 140 ARG NE N 15 81.260 0.005 . 1 . . 1734 . A 137 ARG NE . 34201 1 1881 . 1 1 141 141 ASN H H 1 8.771 0.009 . 1 . . 658 . A 138 ASN H . 34201 1 1882 . 1 1 141 141 ASN HA H 1 5.139 0.006 . 1 . . 1427 . A 138 ASN HA . 34201 1 1883 . 1 1 141 141 ASN HB2 H 1 2.906 0.003 . 2 . . 1428 . A 138 ASN HB2 . 34201 1 1884 . 1 1 141 141 ASN HB3 H 1 2.646 0.007 . 2 . . 1430 . A 138 ASN HB3 . 34201 1 1885 . 1 1 141 141 ASN HD21 H 1 6.526 0.002 . 1 . . 1420 . A 138 ASN HD21 . 34201 1 1886 . 1 1 141 141 ASN HD22 H 1 7.442 0.003 . 1 . . 1422 . A 138 ASN HD22 . 34201 1 1887 . 1 1 141 141 ASN C C 13 175.137 . . 1 . . 2139 . A 138 ASN C . 34201 1 1888 . 1 1 141 141 ASN CA C 13 51.568 0.037 . 1 . . 1426 . A 138 ASN CA . 34201 1 1889 . 1 1 141 141 ASN CB C 13 40.617 0.051 . 1 . . 1429 . A 138 ASN CB . 34201 1 1890 . 1 1 141 141 ASN N N 15 121.658 0.028 . 1 . . 657 . A 138 ASN N . 34201 1 1891 . 1 1 141 141 ASN ND2 N 15 109.387 0.008 . 1 . . 1421 . A 138 ASN ND2 . 34201 1 1892 . 1 1 142 142 ILE H H 1 9.730 0.004 . 1 . . 575 . A 139 ILE H . 34201 1 1893 . 1 1 142 142 ILE HA H 1 4.166 0.009 . 1 . . 146 . A 139 ILE HA . 34201 1 1894 . 1 1 142 142 ILE HB H 1 1.507 0.002 . 1 . . 142 . A 139 ILE HB . 34201 1 1895 . 1 1 142 142 ILE HG12 H 1 1.760 0.0 . 2 . . 143 . A 139 ILE HG12 . 34201 1 1896 . 1 1 142 142 ILE HG13 H 1 1.078 0.009 . 2 . . 144 . A 139 ILE HG13 . 34201 1 1897 . 1 1 142 142 ILE HG21 H 1 0.518 0.002 . 1 . . 145 . A 139 ILE HG21 . 34201 1 1898 . 1 1 142 142 ILE HG22 H 1 0.518 0.002 . 1 . . 145 . A 139 ILE HG22 . 34201 1 1899 . 1 1 142 142 ILE HG23 H 1 0.518 0.002 . 1 . . 145 . A 139 ILE HG23 . 34201 1 1900 . 1 1 142 142 ILE HD11 H 1 0.857 0.003 . 1 . . 574 . A 139 ILE HD11 . 34201 1 1901 . 1 1 142 142 ILE HD12 H 1 0.857 0.003 . 1 . . 574 . A 139 ILE HD12 . 34201 1 1902 . 1 1 142 142 ILE HD13 H 1 0.857 0.003 . 1 . . 574 . A 139 ILE HD13 . 34201 1 1903 . 1 1 142 142 ILE CA C 13 62.498 0.037 . 1 . . 1051 . A 139 ILE CA . 34201 1 1904 . 1 1 142 142 ILE CB C 13 38.672 0.05 . 1 . . 1052 . A 139 ILE CB . 34201 1 1905 . 1 1 142 142 ILE CG1 C 13 28.546 0.036 . 1 . . 1053 . A 139 ILE CG1 . 34201 1 1906 . 1 1 142 142 ILE CG2 C 13 16.959 0.016 . 1 . . 1049 . A 139 ILE CG2 . 34201 1 1907 . 1 1 142 142 ILE CD1 C 13 14.808 0.025 . 1 . . 1050 . A 139 ILE CD1 . 34201 1 1908 . 1 1 142 142 ILE N N 15 126.803 0.03 . 1 . . 573 . A 139 ILE N . 34201 1 1909 . 1 1 143 143 LEU H H 1 9.167 0.006 . 1 . . 654 . A 140 LEU H . 34201 1 1910 . 1 1 143 143 LEU HA H 1 4.760 0.0 . 1 . . 234 . A 140 LEU HA . 34201 1 1911 . 1 1 143 143 LEU HB2 H 1 2.056 0.005 . 2 . . 231 . A 140 LEU HB2 . 34201 1 1912 . 1 1 143 143 LEU HB3 H 1 1.759 0.002 . 2 . . 233 . A 140 LEU HB3 . 34201 1 1913 . 1 1 143 143 LEU HG H 1 1.768 0.004 . 1 . . 1057 . A 140 LEU HG . 34201 1 1914 . 1 1 143 143 LEU HD11 H 1 0.912 0.002 . 2 . . 230 . A 140 LEU HD11 . 34201 1 1915 . 1 1 143 143 LEU HD12 H 1 0.912 0.002 . 2 . . 230 . A 140 LEU HD12 . 34201 1 1916 . 1 1 143 143 LEU HD13 H 1 0.912 0.002 . 2 . . 230 . A 140 LEU HD13 . 34201 1 1917 . 1 1 143 143 LEU HD21 H 1 0.986 0.001 . 2 . . 232 . A 140 LEU HD21 . 34201 1 1918 . 1 1 143 143 LEU HD22 H 1 0.986 0.001 . 2 . . 232 . A 140 LEU HD22 . 34201 1 1919 . 1 1 143 143 LEU HD23 H 1 0.986 0.001 . 2 . . 232 . A 140 LEU HD23 . 34201 1 1920 . 1 1 143 143 LEU C C 13 178.249 . . 1 . . 2144 . A 140 LEU C . 34201 1 1921 . 1 1 143 143 LEU CA C 13 54.700 0.001 . 1 . . 1056 . A 140 LEU CA . 34201 1 1922 . 1 1 143 143 LEU CB C 13 37.772 0.021 . 1 . . 1055 . A 140 LEU CB . 34201 1 1923 . 1 1 143 143 LEU CG C 13 27.371 0.034 . 1 . . 1058 . A 140 LEU CG . 34201 1 1924 . 1 1 143 143 LEU CD1 C 13 23.658 0.011 . 2 . . 1881 . A 140 LEU CD1 . 34201 1 1925 . 1 1 143 143 LEU CD2 C 13 24.972 0.012 . 2 . . 1054 . A 140 LEU CD2 . 34201 1 1926 . 1 1 143 143 LEU N N 15 131.367 0.024 . 1 . . 653 . A 140 LEU N . 34201 1 1927 . 1 1 144 144 ALA H H 1 8.187 0.002 . 1 . . 557 . A 141 ALA H . 34201 1 1928 . 1 1 144 144 ALA HA H 1 4.220 0.008 . 1 . . 150 . A 141 ALA HA . 34201 1 1929 . 1 1 144 144 ALA HB1 H 1 1.357 0.003 . 1 . . 151 . A 141 ALA HB1 . 34201 1 1930 . 1 1 144 144 ALA HB2 H 1 1.357 0.003 . 1 . . 151 . A 141 ALA HB2 . 34201 1 1931 . 1 1 144 144 ALA HB3 H 1 1.357 0.003 . 1 . . 151 . A 141 ALA HB3 . 34201 1 1932 . 1 1 144 144 ALA C C 13 177.378 . . 1 . . 2036 . A 141 ALA C . 34201 1 1933 . 1 1 144 144 ALA CA C 13 53.662 0.036 . 1 . . 1060 . A 141 ALA CA . 34201 1 1934 . 1 1 144 144 ALA CB C 13 19.560 0.022 . 1 . . 1059 . A 141 ALA CB . 34201 1 1935 . 1 1 144 144 ALA N N 15 127.063 0.024 . 1 . . 556 . A 141 ALA N . 34201 1 1936 . 1 1 145 145 GLU H H 1 9.068 0.003 . 1 . . 620 . A 142 GLU H . 34201 1 1937 . 1 1 145 145 GLU HA H 1 4.398 0.005 . 1 . . 1207 . A 142 GLU HA . 34201 1 1938 . 1 1 145 145 GLU HB2 H 1 2.243 0.001 . 2 . . 1205 . A 142 GLU HB2 . 34201 1 1939 . 1 1 145 145 GLU HB3 H 1 2.117 0.003 . 2 . . 1206 . A 142 GLU HB3 . 34201 1 1940 . 1 1 145 145 GLU HG2 H 1 2.429 0.002 . 2 . . 1209 . A 142 GLU HG2 . 34201 1 1941 . 1 1 145 145 GLU HG3 H 1 2.368 0.003 . 2 . . 1210 . A 142 GLU HG3 . 34201 1 1942 . 1 1 145 145 GLU C C 13 176.451 . . 1 . . 2048 . A 142 GLU C . 34201 1 1943 . 1 1 145 145 GLU CA C 13 57.447 0.039 . 1 . . 1208 . A 142 GLU CA . 34201 1 1944 . 1 1 145 145 GLU CB C 13 29.674 0.022 . 1 . . 1204 . A 142 GLU CB . 34201 1 1945 . 1 1 145 145 GLU CG C 13 36.641 0.021 . 1 . . 1211 . A 142 GLU CG . 34201 1 1946 . 1 1 145 145 GLU N N 15 115.762 0.012 . 1 . . 619 . A 142 GLU N . 34201 1 1947 . 1 1 146 146 LYS H H 1 7.501 0.004 . 1 . . 612 . A 143 LYS H . 34201 1 1948 . 1 1 146 146 LYS HA H 1 5.003 0.006 . 1 . . 355 . A 143 LYS HA . 34201 1 1949 . 1 1 146 146 LYS HB2 H 1 2.035 0.001 . 2 . . 357 . A 143 LYS HB2 . 34201 1 1950 . 1 1 146 146 LYS HB3 H 1 1.756 0.003 . 2 . . 358 . A 143 LYS HB3 . 34201 1 1951 . 1 1 146 146 LYS HG2 H 1 1.386 0.002 . 2 . . 361 . A 143 LYS HG2 . 34201 1 1952 . 1 1 146 146 LYS HG3 H 1 1.474 0.002 . 2 . . 362 . A 143 LYS HG3 . 34201 1 1953 . 1 1 146 146 LYS HD2 H 1 1.807 0.003 . 2 . . 359 . A 143 LYS HD2 . 34201 1 1954 . 1 1 146 146 LYS HD3 H 1 1.748 0.002 . 2 . . 360 . A 143 LYS HD3 . 34201 1 1955 . 1 1 146 146 LYS HE2 H 1 3.041 0.001 . 2 . . 354 . A 143 LYS HE2 . 34201 1 1956 . 1 1 146 146 LYS HE3 H 1 3.041 0.001 . 2 . . 356 . A 143 LYS HE3 . 34201 1 1957 . 1 1 146 146 LYS CA C 13 53.423 0.031 . 1 . . 1061 . A 143 LYS CA . 34201 1 1958 . 1 1 146 146 LYS CB C 13 33.211 0.025 . 1 . . 1062 . A 143 LYS CB . 34201 1 1959 . 1 1 146 146 LYS CG C 13 24.568 0.041 . 1 . . 1065 . A 143 LYS CG . 34201 1 1960 . 1 1 146 146 LYS CD C 13 29.399 0.025 . 1 . . 1064 . A 143 LYS CD . 34201 1 1961 . 1 1 146 146 LYS CE C 13 42.327 0.028 . 1 . . 1063 . A 143 LYS CE . 34201 1 1962 . 1 1 146 146 LYS N N 15 117.429 0.019 . 1 . . 611 . A 143 LYS N . 34201 1 1963 . 1 1 147 147 PRO HA H 1 4.343 0.005 . 1 . . 1470 . A 144 PRO HA . 34201 1 1964 . 1 1 147 147 PRO HB2 H 1 1.705 0.007 . 2 . . 1472 . A 144 PRO HB2 . 34201 1 1965 . 1 1 147 147 PRO HB3 H 1 1.318 0.006 . 2 . . 1473 . A 144 PRO HB3 . 34201 1 1966 . 1 1 147 147 PRO HG2 H 1 1.940 0.0 . 2 . . 1475 . A 144 PRO HG2 . 34201 1 1967 . 1 1 147 147 PRO HG3 H 1 2.004 0.012 . 2 . . 1476 . A 144 PRO HG3 . 34201 1 1968 . 1 1 147 147 PRO HD2 H 1 3.622 0.0 . 2 . . 1478 . A 144 PRO HD2 . 34201 1 1969 . 1 1 147 147 PRO HD3 H 1 3.595 0.0 . 2 . . 1480 . A 144 PRO HD3 . 34201 1 1970 . 1 1 147 147 PRO C C 13 176.983 . . 1 . . 2101 . A 144 PRO C . 34201 1 1971 . 1 1 147 147 PRO CA C 13 63.155 0.041 . 1 . . 1471 . A 144 PRO CA . 34201 1 1972 . 1 1 147 147 PRO CB C 13 31.989 0.048 . 1 . . 1474 . A 144 PRO CB . 34201 1 1973 . 1 1 147 147 PRO CG C 13 26.475 0.026 . 1 . . 1477 . A 144 PRO CG . 34201 1 1974 . 1 1 147 147 PRO CD C 13 50.189 0.005 . 1 . . 1479 . A 144 PRO CD . 34201 1 1975 . 1 1 148 148 ARG H H 1 8.710 0.003 . 1 . . 602 . A 145 ARG H . 34201 1 1976 . 1 1 148 148 ARG HA H 1 4.572 0.003 . 1 . . 1219 . A 145 ARG HA . 34201 1 1977 . 1 1 148 148 ARG HB2 H 1 1.632 0.003 . 2 . . 1220 . A 145 ARG HB2 . 34201 1 1978 . 1 1 148 148 ARG HB3 H 1 1.666 0.0 . 2 . . 1222 . A 145 ARG HB3 . 34201 1 1979 . 1 1 148 148 ARG HG2 H 1 1.488 0.002 . 2 . . 1216 . A 145 ARG HG2 . 34201 1 1980 . 1 1 148 148 ARG HG3 H 1 1.594 0.003 . 2 . . 1221 . A 145 ARG HG3 . 34201 1 1981 . 1 1 148 148 ARG HD2 H 1 3.131 0.003 . 2 . . 1212 . A 145 ARG HD2 . 34201 1 1982 . 1 1 148 148 ARG HD3 H 1 3.131 0.003 . 2 . . 1214 . A 145 ARG HD3 . 34201 1 1983 . 1 1 148 148 ARG HE H 1 7.170 0.001 . 1 . . 1739 . A 145 ARG HE . 34201 1 1984 . 1 1 148 148 ARG C C 13 175.481 . . 1 . . 2154 . A 145 ARG C . 34201 1 1985 . 1 1 148 148 ARG CA C 13 54.822 0.064 . 1 . . 1218 . A 145 ARG CA . 34201 1 1986 . 1 1 148 148 ARG CB C 13 30.690 0.014 . 1 . . 1217 . A 145 ARG CB . 34201 1 1987 . 1 1 148 148 ARG CG C 13 26.986 0.043 . 1 . . 1215 . A 145 ARG CG . 34201 1 1988 . 1 1 148 148 ARG CD C 13 43.269 0.017 . 1 . . 1213 . A 145 ARG CD . 34201 1 1989 . 1 1 148 148 ARG N N 15 122.109 0.014 . 1 . . 601 . A 145 ARG N . 34201 1 1990 . 1 1 148 148 ARG NE N 15 85.003 0.016 . 1 . . 1740 . A 145 ARG NE . 34201 1 1991 . 1 1 149 149 VAL H H 1 8.858 0.003 . 1 . . 464 . A 146 VAL H . 34201 1 1992 . 1 1 149 149 VAL HA H 1 4.675 0.0 . 1 . . 191 . A 146 VAL HA . 34201 1 1993 . 1 1 149 149 VAL HB H 1 1.969 0.003 . 1 . . 193 . A 146 VAL HB . 34201 1 1994 . 1 1 149 149 VAL HG11 H 1 0.798 0.002 . 2 . . 192 . A 146 VAL HG11 . 34201 1 1995 . 1 1 149 149 VAL HG12 H 1 0.798 0.002 . 2 . . 192 . A 146 VAL HG12 . 34201 1 1996 . 1 1 149 149 VAL HG13 H 1 0.798 0.002 . 2 . . 192 . A 146 VAL HG13 . 34201 1 1997 . 1 1 149 149 VAL HG21 H 1 0.864 0.002 . 2 . . 194 . A 146 VAL HG21 . 34201 1 1998 . 1 1 149 149 VAL HG22 H 1 0.864 0.002 . 2 . . 194 . A 146 VAL HG22 . 34201 1 1999 . 1 1 149 149 VAL HG23 H 1 0.864 0.002 . 2 . . 194 . A 146 VAL HG23 . 34201 1 2000 . 1 1 149 149 VAL C C 13 175.823 . . 1 . . 2134 . A 146 VAL C . 34201 1 2001 . 1 1 149 149 VAL CA C 13 62.079 0.0 . 1 . . 1067 . A 146 VAL CA . 34201 1 2002 . 1 1 149 149 VAL CB C 13 33.410 0.0 . 1 . . 1068 . A 146 VAL CB . 34201 1 2003 . 1 1 149 149 VAL CG1 C 13 20.911 0.037 . 2 . . 1066 . A 146 VAL CG1 . 34201 1 2004 . 1 1 149 149 VAL CG2 C 13 21.252 0.062 . 2 . . 1069 . A 146 VAL CG2 . 34201 1 2005 . 1 1 149 149 VAL N N 15 128.766 0.021 . 1 . . 463 . A 146 VAL N . 34201 1 2006 . 1 1 150 150 THR H H 1 9.223 0.004 . 1 . . 482 . A 147 THR H . 34201 1 2007 . 1 1 150 150 THR HA H 1 4.331 0.005 . 1 . . 78 . A 147 THR HA . 34201 1 2008 . 1 1 150 150 THR HB H 1 3.603 0.003 . 1 . . 77 . A 147 THR HB . 34201 1 2009 . 1 1 150 150 THR HG21 H 1 0.683 0.002 . 1 . . 79 . A 147 THR HG21 . 34201 1 2010 . 1 1 150 150 THR HG22 H 1 0.683 0.002 . 1 . . 79 . A 147 THR HG22 . 34201 1 2011 . 1 1 150 150 THR HG23 H 1 0.683 0.002 . 1 . . 79 . A 147 THR HG23 . 34201 1 2012 . 1 1 150 150 THR C C 13 171.783 . . 1 . . 2127 . A 147 THR C . 34201 1 2013 . 1 1 150 150 THR CA C 13 61.859 0.054 . 1 . . 1071 . A 147 THR CA . 34201 1 2014 . 1 1 150 150 THR CB C 13 70.569 0.032 . 1 . . 1070 . A 147 THR CB . 34201 1 2015 . 1 1 150 150 THR CG2 C 13 22.335 0.031 . 1 . . 1072 . A 147 THR CG2 . 34201 1 2016 . 1 1 150 150 THR N N 15 125.586 0.029 . 1 . . 481 . A 147 THR N . 34201 1 2017 . 1 1 151 151 ARG H H 1 8.311 0.003 . 1 . . 384 . A 148 ARG H . 34201 1 2018 . 1 1 151 151 ARG HA H 1 4.774 0.0 . 1 . . 1231 . A 148 ARG HA . 34201 1 2019 . 1 1 151 151 ARG HB2 H 1 1.983 0.0 . 2 . . 1227 . A 148 ARG HB2 . 34201 1 2020 . 1 1 151 151 ARG HB3 H 1 1.624 0.0 . 2 . . 1228 . A 148 ARG HB3 . 34201 1 2021 . 1 1 151 151 ARG HG2 H 1 1.625 0.001 . 2 . . 1225 . A 148 ARG HG2 . 34201 1 2022 . 1 1 151 151 ARG HG3 H 1 1.625 0.001 . 2 . . 1233 . A 148 ARG HG3 . 34201 1 2023 . 1 1 151 151 ARG HD2 H 1 3.339 0.002 . 2 . . 1223 . A 148 ARG HD2 . 34201 1 2024 . 1 1 151 151 ARG HD3 H 1 3.270 0.004 . 2 . . 1232 . A 148 ARG HD3 . 34201 1 2025 . 1 1 151 151 ARG HE H 1 7.336 0.003 . 1 . . 1741 . A 148 ARG HE . 34201 1 2026 . 1 1 151 151 ARG C C 13 174.626 . . 1 . . 2074 . A 148 ARG C . 34201 1 2027 . 1 1 151 151 ARG CA C 13 54.645 0.0 . 1 . . 1230 . A 148 ARG CA . 34201 1 2028 . 1 1 151 151 ARG CB C 13 32.998 0.023 . 1 . . 1229 . A 148 ARG CB . 34201 1 2029 . 1 1 151 151 ARG CG C 13 28.194 0.004 . 1 . . 1226 . A 148 ARG CG . 34201 1 2030 . 1 1 151 151 ARG CD C 13 43.473 0.026 . 1 . . 1224 . A 148 ARG CD . 34201 1 2031 . 1 1 151 151 ARG N N 15 124.471 0.008 . 1 . . 383 . A 148 ARG N . 34201 1 2032 . 1 1 151 151 ARG NE N 15 84.951 0.006 . 1 . . 1742 . A 148 ARG NE . 34201 1 2033 . 1 1 152 152 PHE H H 1 8.248 0.003 . 1 . . 446 . A 149 PHE H . 34201 1 2034 . 1 1 152 152 PHE HA H 1 4.857 0.007 . 1 . . 1235 . A 149 PHE HA . 34201 1 2035 . 1 1 152 152 PHE HB2 H 1 3.152 0.006 . 2 . . 1236 . A 149 PHE HB2 . 34201 1 2036 . 1 1 152 152 PHE HB3 H 1 3.017 0.016 . 2 . . 1238 . A 149 PHE HB3 . 34201 1 2037 . 1 1 152 152 PHE HD1 H 1 6.864 0.003 . 1 . . 1342 . A 149 PHE HD1 . 34201 1 2038 . 1 1 152 152 PHE HD2 H 1 6.864 0.003 . 1 . . 1342 . A 149 PHE HD2 . 34201 1 2039 . 1 1 152 152 PHE HE1 H 1 7.015 0.004 . 1 . . 1345 . A 149 PHE HE1 . 34201 1 2040 . 1 1 152 152 PHE HE2 H 1 7.015 0.004 . 1 . . 1345 . A 149 PHE HE2 . 34201 1 2041 . 1 1 152 152 PHE HZ H 1 6.899 0.002 . 1 . . 1674 . A 149 PHE HZ . 34201 1 2042 . 1 1 152 152 PHE C C 13 175.071 . . 1 . . 2098 . A 149 PHE C . 34201 1 2043 . 1 1 152 152 PHE CA C 13 55.525 0.023 . 1 . . 1234 . A 149 PHE CA . 34201 1 2044 . 1 1 152 152 PHE CB C 13 41.231 0.023 . 1 . . 1237 . A 149 PHE CB . 34201 1 2045 . 1 1 152 152 PHE CD1 C 13 132.032 0.044 . 1 . . 1343 . A 149 PHE CD1 . 34201 1 2046 . 1 1 152 152 PHE CD2 C 13 132.032 0.044 . 1 . . 1343 . A 149 PHE CD2 . 34201 1 2047 . 1 1 152 152 PHE CE1 C 13 130.597 0.028 . 1 . . 1344 . A 149 PHE CE1 . 34201 1 2048 . 1 1 152 152 PHE CE2 C 13 130.597 0.028 . 1 . . 1344 . A 149 PHE CE2 . 34201 1 2049 . 1 1 152 152 PHE CZ C 13 129.290 0.03 . 1 . . 1346 . A 149 PHE CZ . 34201 1 2050 . 1 1 152 152 PHE N N 15 119.908 0.019 . 1 . . 445 . A 149 PHE N . 34201 1 2051 . 1 1 153 153 ASN H H 1 8.938 0.003 . 1 . . 511 . A 150 ASN H . 34201 1 2052 . 1 1 153 153 ASN HA H 1 5.005 0.001 . 1 . . 1081 . A 150 ASN HA . 34201 1 2053 . 1 1 153 153 ASN HB2 H 1 2.842 0.002 . 2 . . 1077 . A 150 ASN HB2 . 34201 1 2054 . 1 1 153 153 ASN HB3 H 1 2.785 0.002 . 2 . . 1079 . A 150 ASN HB3 . 34201 1 2055 . 1 1 153 153 ASN HD21 H 1 7.685 0.001 . 1 . . 1431 . A 150 ASN HD21 . 34201 1 2056 . 1 1 153 153 ASN HD22 H 1 7.023 0.003 . 1 . . 1433 . A 150 ASN HD22 . 34201 1 2057 . 1 1 153 153 ASN C C 13 175.169 . . 1 . . 2054 . A 150 ASN C . 34201 1 2058 . 1 1 153 153 ASN CA C 13 53.389 0.034 . 1 . . 1080 . A 150 ASN CA . 34201 1 2059 . 1 1 153 153 ASN CB C 13 38.884 0.051 . 1 . . 1078 . A 150 ASN CB . 34201 1 2060 . 1 1 153 153 ASN N N 15 121.708 0.019 . 1 . . 510 . A 150 ASN N . 34201 1 2061 . 1 1 153 153 ASN ND2 N 15 113.935 0.021 . 1 . . 1432 . A 150 ASN ND2 . 34201 1 2062 . 1 1 154 154 ILE H H 1 8.138 0.003 . 1 . . 516 . A 151 ILE H . 34201 1 2063 . 1 1 154 154 ILE HA H 1 4.717 0.0 . 1 . . 105 . A 151 ILE HA . 34201 1 2064 . 1 1 154 154 ILE HB H 1 1.429 0.008 . 1 . . 106 . A 151 ILE HB . 34201 1 2065 . 1 1 154 154 ILE HG12 H 1 0.356 0.002 . 2 . . 135 . A 151 ILE HG12 . 34201 1 2066 . 1 1 154 154 ILE HG13 H 1 -0.204 0.0 . 2 . . 1882 . A 151 ILE HG13 . 34201 1 2067 . 1 1 154 154 ILE HG21 H 1 0.669 0.003 . 1 . . 107 . A 151 ILE HG21 . 34201 1 2068 . 1 1 154 154 ILE HG22 H 1 0.669 0.003 . 1 . . 107 . A 151 ILE HG22 . 34201 1 2069 . 1 1 154 154 ILE HG23 H 1 0.669 0.003 . 1 . . 107 . A 151 ILE HG23 . 34201 1 2070 . 1 1 154 154 ILE HD11 H 1 -0.267 0.003 . 1 . . 515 . A 151 ILE HD11 . 34201 1 2071 . 1 1 154 154 ILE HD12 H 1 -0.267 0.003 . 1 . . 515 . A 151 ILE HD12 . 34201 1 2072 . 1 1 154 154 ILE HD13 H 1 -0.267 0.003 . 1 . . 515 . A 151 ILE HD13 . 34201 1 2073 . 1 1 154 154 ILE C C 13 175.239 . . 1 . . 2058 . A 151 ILE C . 34201 1 2074 . 1 1 154 154 ILE CA C 13 59.536 0.002 . 1 . . 1074 . A 151 ILE CA . 34201 1 2075 . 1 1 154 154 ILE CB C 13 42.825 0.045 . 1 . . 1076 . A 151 ILE CB . 34201 1 2076 . 1 1 154 154 ILE CG1 C 13 24.833 0.035 . 1 . . 1883 . A 151 ILE CG1 . 34201 1 2077 . 1 1 154 154 ILE CG2 C 13 18.367 0.038 . 1 . . 1073 . A 151 ILE CG2 . 34201 1 2078 . 1 1 154 154 ILE CD1 C 13 13.975 0.02 . 1 . . 1075 . A 151 ILE CD1 . 34201 1 2079 . 1 1 154 154 ILE N N 15 118.334 0.029 . 1 . . 514 . A 151 ILE N . 34201 1 2080 . 1 1 155 155 VAL H H 1 7.585 0.003 . 1 . . 478 . A 152 VAL H . 34201 1 2081 . 1 1 155 155 VAL HA H 1 4.146 0.006 . 1 . . 199 . A 152 VAL HA . 34201 1 2082 . 1 1 155 155 VAL HB H 1 1.862 0.002 . 1 . . 200 . A 152 VAL HB . 34201 1 2083 . 1 1 155 155 VAL HG11 H 1 0.908 0.001 . 2 . . 201 . A 152 VAL HG11 . 34201 1 2084 . 1 1 155 155 VAL HG12 H 1 0.908 0.001 . 2 . . 201 . A 152 VAL HG12 . 34201 1 2085 . 1 1 155 155 VAL HG13 H 1 0.908 0.001 . 2 . . 201 . A 152 VAL HG13 . 34201 1 2086 . 1 1 155 155 VAL HG21 H 1 0.955 0.002 . 2 . . 202 . A 152 VAL HG21 . 34201 1 2087 . 1 1 155 155 VAL HG22 H 1 0.955 0.002 . 2 . . 202 . A 152 VAL HG22 . 34201 1 2088 . 1 1 155 155 VAL HG23 H 1 0.955 0.002 . 2 . . 202 . A 152 VAL HG23 . 34201 1 2089 . 1 1 155 155 VAL C C 13 176.078 . . 1 . . 2157 . A 152 VAL C . 34201 1 2090 . 1 1 155 155 VAL CA C 13 62.098 0.014 . 1 . . 1085 . A 152 VAL CA . 34201 1 2091 . 1 1 155 155 VAL CB C 13 32.956 0.033 . 1 . . 1082 . A 152 VAL CB . 34201 1 2092 . 1 1 155 155 VAL CG1 C 13 21.232 0.04 . 2 . . 1084 . A 152 VAL CG1 . 34201 1 2093 . 1 1 155 155 VAL CG2 C 13 21.336 0.032 . 2 . . 1083 . A 152 VAL CG2 . 34201 1 2094 . 1 1 155 155 VAL N N 15 118.681 0.014 . 1 . . 477 . A 152 VAL N . 34201 1 2095 . 1 1 156 156 TRP H H 1 8.706 0.005 . 1 . . 559 . A 153 TRP H . 34201 1 2096 . 1 1 156 156 TRP HA H 1 4.508 0.0 . 1 . . 1240 . A 153 TRP HA . 34201 1 2097 . 1 1 156 156 TRP HB2 H 1 2.912 . . 2 . . 1239 . A 153 TRP HB2 . 34201 1 2098 . 1 1 156 156 TRP HB3 H 1 3.090 . . 2 . . 1242 . A 153 TRP HB3 . 34201 1 2099 . 1 1 156 156 TRP HD1 H 1 7.218 0.01 . 1 . . 1653 . A 153 TRP HD1 . 34201 1 2100 . 1 1 156 156 TRP HE1 H 1 10.085 0.003 . 1 . . 11 . A 153 TRP HE1 . 34201 1 2101 . 1 1 156 156 TRP HE3 H 1 6.382 0.0 . 1 . . 1828 . A 153 TRP HE3 . 34201 1 2102 . 1 1 156 156 TRP HZ2 H 1 6.912 0.005 . 1 . . 1655 . A 153 TRP HZ2 . 34201 1 2103 . 1 1 156 156 TRP HZ3 H 1 5.877 0.0 . 1 . . 1874 . A 153 TRP HZ3 . 34201 1 2104 . 1 1 156 156 TRP HH2 H 1 6.931 0.0 . 1 . . 1523 . A 153 TRP HH2 . 34201 1 2105 . 1 1 156 156 TRP C C 13 175.104 . . 1 . . 2079 . A 153 TRP C . 34201 1 2106 . 1 1 156 156 TRP CA C 13 56.951 0.0 . 1 . . 1243 . A 153 TRP CA . 34201 1 2107 . 1 1 156 156 TRP CB C 13 27.265 . . 1 . . 1241 . A 153 TRP CB . 34201 1 2108 . 1 1 156 156 TRP CD1 C 13 128.763 0.088 . 1 . . 1652 . A 153 TRP CD1 . 34201 1 2109 . 1 1 156 156 TRP CE3 C 13 120.775 . . 1 . . 1829 . A 153 TRP CE3 . 34201 1 2110 . 1 1 156 156 TRP CZ2 C 13 112.487 0.031 . 1 . . 1654 . A 153 TRP CZ2 . 34201 1 2111 . 1 1 156 156 TRP CZ3 C 13 121.749 . . 1 . . 1875 . A 153 TRP CZ3 . 34201 1 2112 . 1 1 156 156 TRP CH2 C 13 125.009 0.071 . 1 . . 1524 . A 153 TRP CH2 . 34201 1 2113 . 1 1 156 156 TRP N N 15 129.031 0.018 . 1 . . 558 . A 153 TRP N . 34201 1 2114 . 1 1 156 156 TRP NE1 N 15 128.205 0.016 . 1 . . 12 . A 153 TRP NE1 . 34201 1 2115 . 1 1 157 157 ASP H H 1 8.451 0.002 . 1 . . 379 . A 154 ASP H . 34201 1 2116 . 1 1 157 157 ASP HA H 1 5.139 0.004 . 1 . . 1249 . A 154 ASP HA . 34201 1 2117 . 1 1 157 157 ASP HB2 H 1 2.856 0.003 . 2 . . 1251 . A 154 ASP HB2 . 34201 1 2118 . 1 1 157 157 ASP HB3 H 1 2.742 0.003 . 2 . . 1253 . A 154 ASP HB3 . 34201 1 2119 . 1 1 157 157 ASP C C 13 175.981 . . 1 . . 2057 . A 154 ASP C . 34201 1 2120 . 1 1 157 157 ASP CA C 13 54.464 0.021 . 1 . . 1250 . A 154 ASP CA . 34201 1 2121 . 1 1 157 157 ASP CB C 13 41.157 0.017 . 1 . . 1252 . A 154 ASP CB . 34201 1 2122 . 1 1 157 157 ASP N N 15 120.189 0.019 . 1 . . 378 . A 154 ASP N . 34201 1 2123 . 1 1 158 158 ASN H H 1 8.518 0.002 . 1 . . 555 . A 155 ASN H . 34201 1 2124 . 1 1 158 158 ASN HA H 1 4.748 0.0 . 1 . . 1244 . A 155 ASN HA . 34201 1 2125 . 1 1 158 158 ASN HB2 H 1 2.857 0.006 . 2 . . 1247 . A 155 ASN HB2 . 34201 1 2126 . 1 1 158 158 ASN HB3 H 1 2.774 0.004 . 2 . . 1248 . A 155 ASN HB3 . 34201 1 2127 . 1 1 158 158 ASN HD21 H 1 7.027 0.001 . 1 . . 1532 . A 155 ASN HD21 . 34201 1 2128 . 1 1 158 158 ASN HD22 H 1 7.722 0.002 . 1 . . 1534 . A 155 ASN HD22 . 34201 1 2129 . 1 1 158 158 ASN C C 13 175.150 . . 1 . . 2097 . A 155 ASN C . 34201 1 2130 . 1 1 158 158 ASN CA C 13 53.302 0.009 . 1 . . 1245 . A 155 ASN CA . 34201 1 2131 . 1 1 158 158 ASN CB C 13 39.180 0.025 . 1 . . 1246 . A 155 ASN CB . 34201 1 2132 . 1 1 158 158 ASN N N 15 118.705 0.013 . 1 . . 554 . A 155 ASN N . 34201 1 2133 . 1 1 158 158 ASN ND2 N 15 113.835 0.016 . 1 . . 1533 . A 155 ASN ND2 . 34201 1 2134 . 1 1 159 159 GLU H H 1 8.696 0.002 . 1 . . 400 . A 156 GLU H . 34201 1 2135 . 1 1 159 159 GLU HA H 1 4.278 0.004 . 1 . . 1254 . A 156 GLU HA . 34201 1 2136 . 1 1 159 159 GLU HB2 H 1 2.102 0.004 . 2 . . 1257 . A 156 GLU HB2 . 34201 1 2137 . 1 1 159 159 GLU HB3 H 1 1.977 0.002 . 2 . . 1258 . A 156 GLU HB3 . 34201 1 2138 . 1 1 159 159 GLU HG2 H 1 2.304 0.001 . 2 . . 1260 . A 156 GLU HG2 . 34201 1 2139 . 1 1 159 159 GLU HG3 H 1 2.274 0.003 . 2 . . 1261 . A 156 GLU HG3 . 34201 1 2140 . 1 1 159 159 GLU C C 13 176.194 . . 1 . . 2060 . A 156 GLU C . 34201 1 2141 . 1 1 159 159 GLU CA C 13 57.062 0.017 . 1 . . 1255 . A 156 GLU CA . 34201 1 2142 . 1 1 159 159 GLU CB C 13 30.155 0.027 . 1 . . 1256 . A 156 GLU CB . 34201 1 2143 . 1 1 159 159 GLU CG C 13 36.195 0.009 . 1 . . 1259 . A 156 GLU CG . 34201 1 2144 . 1 1 159 159 GLU N N 15 121.832 0.018 . 1 . . 399 . A 156 GLU N . 34201 1 2145 . 1 1 160 160 ASN H H 1 8.510 0.002 . 1 . . 631 . A 157 ASN H . 34201 1 2146 . 1 1 160 160 ASN HA H 1 4.760 0.0 . 1 . . 1529 . A 157 ASN HA . 34201 1 2147 . 1 1 160 160 ASN HB2 H 1 2.868 0.002 . 2 . . 1525 . A 157 ASN HB2 . 34201 1 2148 . 1 1 160 160 ASN HB3 H 1 2.768 0.001 . 2 . . 1527 . A 157 ASN HB3 . 34201 1 2149 . 1 1 160 160 ASN HD21 H 1 6.953 0.002 . 1 . . 1531 . A 157 ASN HD21 . 34201 1 2150 . 1 1 160 160 ASN HD22 H 1 7.666 0.0 . 1 . . 1535 . A 157 ASN HD22 . 34201 1 2151 . 1 1 160 160 ASN C C 13 175.259 . . 1 . . 2095 . A 157 ASN C . 34201 1 2152 . 1 1 160 160 ASN CA C 13 53.356 0.0 . 1 . . 1528 . A 157 ASN CA . 34201 1 2153 . 1 1 160 160 ASN CB C 13 39.192 0.023 . 1 . . 1526 . A 157 ASN CB . 34201 1 2154 . 1 1 160 160 ASN N N 15 119.018 0.006 . 1 . . 630 . A 157 ASN N . 34201 1 2155 . 1 1 160 160 ASN ND2 N 15 113.500 0.012 . 1 . . 1530 . A 157 ASN ND2 . 34201 1 2156 . 1 1 161 161 GLU H H 1 8.428 0.007 . 1 . . 371 . A 158 GLU H . 34201 1 2157 . 1 1 161 161 GLU HA H 1 4.281 0.001 . 1 . . 1536 . A 158 GLU HA . 34201 1 2158 . 1 1 161 161 GLU HB2 H 1 1.985 0.004 . 2 . . 1541 . A 158 GLU HB2 . 34201 1 2159 . 1 1 161 161 GLU HB3 H 1 2.109 0.007 . 2 . . 1543 . A 158 GLU HB3 . 34201 1 2160 . 1 1 161 161 GLU HG2 H 1 2.284 . . 2 . . 1538 . A 158 GLU HG2 . 34201 1 2161 . 1 1 161 161 GLU HG3 H 1 2.285 . . 2 . . 1540 . A 158 GLU HG3 . 34201 1 2162 . 1 1 161 161 GLU C C 13 176.910 . . 1 . . 2017 . A 158 GLU C . 34201 1 2163 . 1 1 161 161 GLU CA C 13 57.117 0.031 . 1 . . 1537 . A 158 GLU CA . 34201 1 2164 . 1 1 161 161 GLU CB C 13 30.181 0.003 . 1 . . 1542 . A 158 GLU CB . 34201 1 2165 . 1 1 161 161 GLU CG C 13 36.166 . . 1 . . 1539 . A 158 GLU CG . 34201 1 2166 . 1 1 161 161 GLU N N 15 121.724 0.044 . 1 . . 370 . A 158 GLU N . 34201 1 2167 . 1 1 162 162 GLY H H 1 8.397 0.002 . 1 . . 416 . A 159 GLY H . 34201 1 2168 . 1 1 162 162 GLY HA2 H 1 3.942 0.002 . 2 . . 1544 . A 159 GLY HA2 . 34201 1 2169 . 1 1 162 162 GLY HA3 H 1 3.942 0.002 . 2 . . 1929 . A 159 GLY HA3 . 34201 1 2170 . 1 1 162 162 GLY C C 13 173.890 . . 1 . . 2077 . A 159 GLY C . 34201 1 2171 . 1 1 162 162 GLY CA C 13 45.358 0.031 . 1 . . 1545 . A 159 GLY CA . 34201 1 2172 . 1 1 162 162 GLY N N 15 109.247 0.014 . 1 . . 415 . A 159 GLY N . 34201 1 2173 . 1 1 163 163 ASP H H 1 8.130 0.002 . 1 . . 432 . A 160 ASP H . 34201 1 2174 . 1 1 163 163 ASP HA H 1 4.575 0.003 . 1 . . 1551 . A 160 ASP HA . 34201 1 2175 . 1 1 163 163 ASP HB2 H 1 2.644 0.004 . 2 . . 1547 . A 160 ASP HB2 . 34201 1 2176 . 1 1 163 163 ASP HB3 H 1 2.561 0.007 . 2 . . 1549 . A 160 ASP HB3 . 34201 1 2177 . 1 1 163 163 ASP C C 13 176.030 . . 1 . . 2094 . A 160 ASP C . 34201 1 2178 . 1 1 163 163 ASP CA C 13 54.415 0.01 . 1 . . 1550 . A 160 ASP CA . 34201 1 2179 . 1 1 163 163 ASP CB C 13 41.144 0.026 . 1 . . 1548 . A 160 ASP CB . 34201 1 2180 . 1 1 163 163 ASP N N 15 120.156 0.018 . 1 . . 431 . A 160 ASP N . 34201 1 2181 . 1 1 164 164 LEU H H 1 8.011 0.001 . 1 . . 1546 . A 161 LEU H . 34201 1 2182 . 1 1 164 164 LEU HA H 1 4.194 0.0 . 1 . . 276 . A 161 LEU HA . 34201 1 2183 . 1 1 164 164 LEU HB2 H 1 1.455 0.006 . 2 . . 277 . A 161 LEU HB2 . 34201 1 2184 . 1 1 164 164 LEU HB3 H 1 1.306 0.001 . 2 . . 278 . A 161 LEU HB3 . 34201 1 2185 . 1 1 164 164 LEU HG H 1 1.453 0.002 . 1 . . 281 . A 161 LEU HG . 34201 1 2186 . 1 1 164 164 LEU HD11 H 1 0.852 0.001 . 2 . . 279 . A 161 LEU HD11 . 34201 1 2187 . 1 1 164 164 LEU HD12 H 1 0.852 0.001 . 2 . . 279 . A 161 LEU HD12 . 34201 1 2188 . 1 1 164 164 LEU HD13 H 1 0.852 0.001 . 2 . . 279 . A 161 LEU HD13 . 34201 1 2189 . 1 1 164 164 LEU HD21 H 1 0.779 0.004 . 2 . . 280 . A 161 LEU HD21 . 34201 1 2190 . 1 1 164 164 LEU HD22 H 1 0.779 0.004 . 2 . . 280 . A 161 LEU HD22 . 34201 1 2191 . 1 1 164 164 LEU HD23 H 1 0.779 0.004 . 2 . . 280 . A 161 LEU HD23 . 34201 1 2192 . 1 1 164 164 LEU C C 13 176.612 . . 1 . . 2081 . A 161 LEU C . 34201 1 2193 . 1 1 164 164 LEU CA C 13 55.366 0.007 . 1 . . 1562 . A 161 LEU CA . 34201 1 2194 . 1 1 164 164 LEU CB C 13 42.594 0.021 . 1 . . 1561 . A 161 LEU CB . 34201 1 2195 . 1 1 164 164 LEU CG C 13 26.894 0.028 . 1 . . 1563 . A 161 LEU CG . 34201 1 2196 . 1 1 164 164 LEU CD1 C 13 24.885 0.025 . 2 . . 1564 . A 161 LEU CD1 . 34201 1 2197 . 1 1 164 164 LEU CD2 C 13 23.503 0.003 . 2 . . 1565 . A 161 LEU CD2 . 34201 1 2198 . 1 1 164 164 LEU N N 15 121.638 0.006 . 1 . . 562 . A 161 LEU N . 34201 1 2199 . 1 1 165 165 TYR H H 1 8.053 0.001 . 1 . . 530 . A 162 TYR H . 34201 1 2200 . 1 1 165 165 TYR HA H 1 4.853 0.0 . 1 . . 1558 . A 162 TYR HA . 34201 1 2201 . 1 1 165 165 TYR HB2 H 1 3.075 0.002 . 2 . . 1554 . A 162 TYR HB2 . 34201 1 2202 . 1 1 165 165 TYR HB3 H 1 2.808 0.004 . 2 . . 1556 . A 162 TYR HB3 . 34201 1 2203 . 1 1 165 165 TYR HD1 H 1 7.149 0.005 . 1 . . 1552 . A 162 TYR HD1 . 34201 1 2204 . 1 1 165 165 TYR HD2 H 1 7.149 0.005 . 1 . . 1552 . A 162 TYR HD2 . 34201 1 2205 . 1 1 165 165 TYR HE1 H 1 6.824 0.005 . 1 . . 1560 . A 162 TYR HE1 . 34201 1 2206 . 1 1 165 165 TYR HE2 H 1 6.824 0.005 . 1 . . 1560 . A 162 TYR HE2 . 34201 1 2207 . 1 1 165 165 TYR CA C 13 55.302 0.014 . 1 . . 1557 . A 162 TYR CA . 34201 1 2208 . 1 1 165 165 TYR CB C 13 38.224 0.019 . 1 . . 1555 . A 162 TYR CB . 34201 1 2209 . 1 1 165 165 TYR CD1 C 13 133.491 0.02 . 1 . . 1553 . A 162 TYR CD1 . 34201 1 2210 . 1 1 165 165 TYR CD2 C 13 133.491 0.02 . 1 . . 1553 . A 162 TYR CD2 . 34201 1 2211 . 1 1 165 165 TYR CE1 C 13 118.201 0.043 . 1 . . 1559 . A 162 TYR CE1 . 34201 1 2212 . 1 1 165 165 TYR CE2 C 13 118.201 0.043 . 1 . . 1559 . A 162 TYR CE2 . 34201 1 2213 . 1 1 165 165 TYR N N 15 120.507 0.013 . 1 . . 529 . A 162 TYR N . 34201 1 2214 . 1 1 166 166 PRO HA H 1 4.711 0.0 . 1 . . 1606 . A 163 PRO HA . 34201 1 2215 . 1 1 166 166 PRO HB2 H 1 2.340 0.001 . 2 . . 1616 . A 163 PRO HB2 . 34201 1 2216 . 1 1 166 166 PRO HB3 H 1 1.940 0.002 . 2 . . 1617 . A 163 PRO HB3 . 34201 1 2217 . 1 1 166 166 PRO HG2 H 1 2.042 0.0 . 2 . . 1618 . A 163 PRO HG2 . 34201 1 2218 . 1 1 166 166 PRO HG3 H 1 2.012 0.0 . 2 . . 1619 . A 163 PRO HG3 . 34201 1 2219 . 1 1 166 166 PRO HD2 H 1 3.590 0.001 . 2 . . 1612 . A 163 PRO HD2 . 34201 1 2220 . 1 1 166 166 PRO HD3 H 1 3.755 0.003 . 2 . . 1614 . A 163 PRO HD3 . 34201 1 2221 . 1 1 166 166 PRO CA C 13 61.515 0.003 . 1 . . 1615 . A 163 PRO CA . 34201 1 2222 . 1 1 166 166 PRO CB C 13 30.907 0.012 . 1 . . 1620 . A 163 PRO CB . 34201 1 2223 . 1 1 166 166 PRO CG C 13 27.377 0.007 . 1 . . 1621 . A 163 PRO CG . 34201 1 2224 . 1 1 166 166 PRO CD C 13 50.516 0.017 . 1 . . 1613 . A 163 PRO CD . 34201 1 2225 . 1 1 167 167 PRO HA H 1 4.463 0.001 . 1 . . 1601 . A 164 PRO HA . 34201 1 2226 . 1 1 167 167 PRO HB2 H 1 1.923 0.001 . 2 . . 1609 . A 164 PRO HB2 . 34201 1 2227 . 1 1 167 167 PRO HB3 H 1 2.316 0.001 . 2 . . 1610 . A 164 PRO HB3 . 34201 1 2228 . 1 1 167 167 PRO HG2 H 1 2.049 0.0 . 2 . . 1607 . A 164 PRO HG2 . 34201 1 2229 . 1 1 167 167 PRO HG3 H 1 2.029 0.0 . 2 . . 1608 . A 164 PRO HG3 . 34201 1 2230 . 1 1 167 167 PRO HD2 H 1 3.841 0.001 . 2 . . 1602 . A 164 PRO HD2 . 34201 1 2231 . 1 1 167 167 PRO HD3 H 1 3.652 0.001 . 2 . . 1604 . A 164 PRO HD3 . 34201 1 2232 . 1 1 167 167 PRO C C 13 177.034 . . 1 . . 2082 . A 164 PRO C . 34201 1 2233 . 1 1 167 167 PRO CA C 13 63.012 0.036 . 1 . . 1603 . A 164 PRO CA . 34201 1 2234 . 1 1 167 167 PRO CB C 13 32.113 0.021 . 1 . . 1611 . A 164 PRO CB . 34201 1 2235 . 1 1 167 167 PRO CG C 13 27.402 . . 1 . . 1622 . A 164 PRO CG . 34201 1 2236 . 1 1 167 167 PRO CD C 13 50.459 0.014 . 1 . . 1605 . A 164 PRO CD . 34201 1 2237 . 1 1 168 168 GLU H H 1 8.468 0.001 . 1 . . 551 . A 165 GLU H . 34201 1 2238 . 1 1 168 168 GLU HA H 1 4.250 0.003 . 1 . . 1569 . A 165 GLU HA . 34201 1 2239 . 1 1 168 168 GLU HB2 H 1 2.026 0.001 . 2 . . 1566 . A 165 GLU HB2 . 34201 1 2240 . 1 1 168 168 GLU HB3 H 1 1.948 0.0 . 2 . . 1568 . A 165 GLU HB3 . 34201 1 2241 . 1 1 168 168 GLU HG2 H 1 2.309 0.0 . 2 . . 1571 . A 165 GLU HG2 . 34201 1 2242 . 1 1 168 168 GLU HG3 H 1 2.264 0.0 . 2 . . 1572 . A 165 GLU HG3 . 34201 1 2243 . 1 1 168 168 GLU C C 13 176.312 . . 1 . . 2105 . A 165 GLU C . 34201 1 2244 . 1 1 168 168 GLU CA C 13 56.555 0.03 . 1 . . 1570 . A 165 GLU CA . 34201 1 2245 . 1 1 168 168 GLU CB C 13 30.380 0.031 . 1 . . 1567 . A 165 GLU CB . 34201 1 2246 . 1 1 168 168 GLU CG C 13 36.125 0.0 . 1 . . 1573 . A 165 GLU CG . 34201 1 2247 . 1 1 168 168 GLU N N 15 120.745 0.009 . 1 . . 550 . A 165 GLU N . 34201 1 2248 . 1 1 169 169 GLN H H 1 8.436 0.001 . 1 . . 480 . A 166 GLN H . 34201 1 2249 . 1 1 169 169 GLN HA H 1 4.661 0.001 . 1 . . 1577 . A 166 GLN HA . 34201 1 2250 . 1 1 169 169 GLN HB2 H 1 1.947 0.002 . 2 . . 1578 . A 166 GLN HB2 . 34201 1 2251 . 1 1 169 169 GLN HB3 H 1 2.104 0.0 . 2 . . 1580 . A 166 GLN HB3 . 34201 1 2252 . 1 1 169 169 GLN HG2 H 1 2.381 0.001 . 2 . . 1581 . A 166 GLN HG2 . 34201 1 2253 . 1 1 169 169 GLN HG3 H 1 2.381 0.001 . 2 . . 1930 . A 166 GLN HG3 . 34201 1 2254 . 1 1 169 169 GLN HE21 H 1 7.563 0.001 . 1 . . 1574 . A 166 GLN HE21 . 34201 1 2255 . 1 1 169 169 GLN HE22 H 1 6.869 0.002 . 1 . . 1576 . A 166 GLN HE22 . 34201 1 2256 . 1 1 169 169 GLN CA C 13 53.414 0.02 . 1 . . 1291 . A 166 GLN CA . 34201 1 2257 . 1 1 169 169 GLN CB C 13 29.193 0.01 . 1 . . 1579 . A 166 GLN CB . 34201 1 2258 . 1 1 169 169 GLN CG C 13 33.476 0.038 . 1 . . 1582 . A 166 GLN CG . 34201 1 2259 . 1 1 169 169 GLN N N 15 122.390 0.008 . 1 . . 479 . A 166 GLN N . 34201 1 2260 . 1 1 169 169 GLN NE2 N 15 112.505 0.012 . 1 . . 1575 . A 166 GLN NE2 . 34201 1 2261 . 1 1 170 170 PRO HA H 1 4.450 0.003 . 1 . . 1591 . A 167 PRO HA . 34201 1 2262 . 1 1 170 170 PRO HB2 H 1 1.975 0.002 . 2 . . 1594 . A 167 PRO HB2 . 34201 1 2263 . 1 1 170 170 PRO HB3 H 1 2.310 0.004 . 2 . . 1596 . A 167 PRO HB3 . 34201 1 2264 . 1 1 170 170 PRO HG2 H 1 2.026 0.0 . 2 . . 1599 . A 167 PRO HG2 . 34201 1 2265 . 1 1 170 170 PRO HG3 H 1 2.051 0.006 . 2 . . 1600 . A 167 PRO HG3 . 34201 1 2266 . 1 1 170 170 PRO HD2 H 1 3.786 0.001 . 2 . . 1592 . A 167 PRO HD2 . 34201 1 2267 . 1 1 170 170 PRO HD3 H 1 3.699 0.002 . 2 . . 1593 . A 167 PRO HD3 . 34201 1 2268 . 1 1 170 170 PRO C C 13 177.522 . . 1 . . 2020 . A 167 PRO C . 34201 1 2269 . 1 1 170 170 PRO CA C 13 63.400 0.027 . 1 . . 1590 . A 167 PRO CA . 34201 1 2270 . 1 1 170 170 PRO CB C 13 32.210 0.025 . 1 . . 1595 . A 167 PRO CB . 34201 1 2271 . 1 1 170 170 PRO CG C 13 27.389 0.023 . 1 . . 1598 . A 167 PRO CG . 34201 1 2272 . 1 1 170 170 PRO CD C 13 50.664 0.024 . 1 . . 1597 . A 167 PRO CD . 34201 1 2273 . 1 1 171 171 GLY H H 1 8.469 0.014 . 1 . . 390 . A 168 GLY H . 34201 1 2274 . 1 1 171 171 GLY HA2 H 1 4.003 0.001 . 2 . . 1587 . A 168 GLY HA2 . 34201 1 2275 . 1 1 171 171 GLY HA3 H 1 3.899 0.002 . 2 . . 1589 . A 168 GLY HA3 . 34201 1 2276 . 1 1 171 171 GLY C C 13 173.368 . . 1 . . 2116 . A 168 GLY C . 34201 1 2277 . 1 1 171 171 GLY CA C 13 45.455 0.011 . 1 . . 1588 . A 168 GLY CA . 34201 1 2278 . 1 1 171 171 GLY N N 15 109.695 0.007 . 1 . . 389 . A 168 GLY N . 34201 1 2279 . 1 1 172 172 VAL H H 1 7.559 0.014 . 1 . . 588 . A 169 VAL H . 34201 1 2280 . 1 1 172 172 VAL HA H 1 4.075 0.001 . 1 . . 163 . A 169 VAL HA . 34201 1 2281 . 1 1 172 172 VAL HB H 1 2.113 0.001 . 1 . . 162 . A 169 VAL HB . 34201 1 2282 . 1 1 172 172 VAL HG11 H 1 0.873 0.001 . 2 . . 160 . A 169 VAL HG11 . 34201 1 2283 . 1 1 172 172 VAL HG12 H 1 0.873 0.001 . 2 . . 160 . A 169 VAL HG12 . 34201 1 2284 . 1 1 172 172 VAL HG13 H 1 0.873 0.001 . 2 . . 160 . A 169 VAL HG13 . 34201 1 2285 . 1 1 172 172 VAL HG21 H 1 0.910 0.0 . 2 . . 161 . A 169 VAL HG21 . 34201 1 2286 . 1 1 172 172 VAL HG22 H 1 0.910 0.0 . 2 . . 161 . A 169 VAL HG22 . 34201 1 2287 . 1 1 172 172 VAL HG23 H 1 0.910 0.0 . 2 . . 161 . A 169 VAL HG23 . 34201 1 2288 . 1 1 172 172 VAL CA C 13 63.502 0.009 . 1 . . 1583 . A 169 VAL CA . 34201 1 2289 . 1 1 172 172 VAL CB C 13 33.138 0.02 . 1 . . 1584 . A 169 VAL CB . 34201 1 2290 . 1 1 172 172 VAL CG1 C 13 20.064 0.014 . 2 . . 1585 . A 169 VAL CG1 . 34201 1 2291 . 1 1 172 172 VAL CG2 C 13 21.317 0.018 . 2 . . 1586 . A 169 VAL CG2 . 34201 1 2292 . 1 1 172 172 VAL N N 15 122.924 0.013 . 1 . . 587 . A 169 VAL N . 34201 1 stop_ save_ save_assigned_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 34201 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name . _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 $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D HNCO' . . . 34201 2 2 '3D HCCH-TOCSY' . . . 34201 2 3 (HB)CB(CGCD)HD . . . 34201 2 4 '3D 1H-15N NOESY' . . . 34201 2 5 '3D 1H-13C NOESY' . . . 34201 2 6 '3D 13C,15N filtered 1H-13C NOESY' . . . 34201 2 7 '2D 1H-15N HSQC' . . . 34201 2 8 '2D 1H-15N HSQC' . . . 34201 2 9 '2D 1H-15N HSQC' . . . 34201 2 10 '2D 1H-15N TROSY-HSQC' . . . 34201 2 11 '2D 1H-15N TROSY-HSQC' . . . 34201 2 12 '2D 1H-1H TOCSY' . . . 34201 2 13 '2D 1H-1H NOESY' . . . 34201 2 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.Ambiguity_set_ID _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 . 2 2 1 1 LEU H H 1 8.183 0.003 . 1 . . 1760 . B 419 LEU H1 . 34201 2 2 . 2 2 1 1 LEU HA H 1 4.286 0.003 . 1 . . 1362 . B 419 LEU HA . 34201 2 3 . 2 2 1 1 LEU HB2 H 1 1.604 0.002 . 2 . . 1820 . B 419 LEU HB2 . 34201 2 4 . 2 2 1 1 LEU HB3 H 1 1.643 0.008 . 2 . . 1821 . B 419 LEU HB3 . 34201 2 5 . 2 2 1 1 LEU HG H 1 1.565 0.004 . 1 . . 1819 . B 419 LEU HG . 34201 2 6 . 2 2 1 1 LEU HD11 H 1 0.932 . . 2 . . 1761 . B 419 LEU HD11 . 34201 2 7 . 2 2 1 1 LEU HD12 H 1 0.932 . . 2 . . 1761 . B 419 LEU HD12 . 34201 2 8 . 2 2 1 1 LEU HD13 H 1 0.932 . . 2 . . 1761 . B 419 LEU HD13 . 34201 2 9 . 2 2 1 1 LEU HD21 H 1 0.884 . . 2 . . 1762 . B 419 LEU HD21 . 34201 2 10 . 2 2 1 1 LEU HD22 H 1 0.884 . . 2 . . 1762 . B 419 LEU HD22 . 34201 2 11 . 2 2 1 1 LEU HD23 H 1 0.884 . . 2 . . 1762 . B 419 LEU HD23 . 34201 2 12 . 2 2 2 2 ALA H H 1 8.343 0.002 . 1 . . 1363 . B 420 ALA H . 34201 2 13 . 2 2 2 2 ALA HA H 1 4.350 0.001 . 1 . . 1750 . B 420 ALA HA . 34201 2 14 . 2 2 2 2 ALA HB1 H 1 1.379 0.004 . 1 . . 1753 . B 420 ALA HB1 . 34201 2 15 . 2 2 2 2 ALA HB2 H 1 1.379 0.004 . 1 . . 1753 . B 420 ALA HB2 . 34201 2 16 . 2 2 2 2 ALA HB3 H 1 1.379 0.004 . 1 . . 1753 . B 420 ALA HB3 . 34201 2 17 . 2 2 3 3 ILE H H 1 8.078 0.003 . 1 . . 1749 . B 421 ILE H . 34201 2 18 . 2 2 3 3 ILE HA H 1 4.206 0.007 . 1 . . 1751 . B 421 ILE HA . 34201 2 19 . 2 2 3 3 ILE HB H 1 1.887 0.002 . 1 . . 1374 . B 421 ILE HB . 34201 2 20 . 2 2 3 3 ILE HG12 H 1 1.200 0.005 . 2 . . 1752 . B 421 ILE HG12 . 34201 2 21 . 2 2 3 3 ILE HG13 H 1 1.480 0.002 . 2 . . 1754 . B 421 ILE HG13 . 34201 2 22 . 2 2 3 3 ILE HG21 H 1 0.916 0.012 . 1 . . 1373 . B 421 ILE HG21 . 34201 2 23 . 2 2 3 3 ILE HG22 H 1 0.916 0.012 . 1 . . 1373 . B 421 ILE HG22 . 34201 2 24 . 2 2 3 3 ILE HG23 H 1 0.916 0.012 . 1 . . 1373 . B 421 ILE HG23 . 34201 2 25 . 2 2 3 3 ILE HD11 H 1 0.883 0.004 . 1 . . 1755 . B 421 ILE HD11 . 34201 2 26 . 2 2 3 3 ILE HD12 H 1 0.883 0.004 . 1 . . 1755 . B 421 ILE HD12 . 34201 2 27 . 2 2 3 3 ILE HD13 H 1 0.883 0.004 . 1 . . 1755 . B 421 ILE HD13 . 34201 2 28 . 2 2 4 4 THR H H 1 8.139 0.009 . 1 . . 1364 . B 422 THR H . 34201 2 29 . 2 2 4 4 THR HA H 1 4.307 0.001 . 1 . . 1370 . B 422 THR HA . 34201 2 30 . 2 2 4 4 THR HB H 1 4.219 0.007 . 1 . . 1365 . B 422 THR HB . 34201 2 31 . 2 2 4 4 THR HG21 H 1 1.207 0.003 . 1 . . 1369 . B 422 THR HG21 . 34201 2 32 . 2 2 4 4 THR HG22 H 1 1.207 0.003 . 1 . . 1369 . B 422 THR HG22 . 34201 2 33 . 2 2 4 4 THR HG23 H 1 1.207 0.003 . 1 . . 1369 . B 422 THR HG23 . 34201 2 34 . 2 2 5 5 MET H H 1 8.299 0.001 . 1 . . 1743 . B 423 MET H . 34201 2 35 . 2 2 5 5 MET HA H 1 4.529 0.006 . 1 . . 1759 . B 423 MET HA . 34201 2 36 . 2 2 5 5 MET HB2 H 1 2.021 0.001 . 2 . . 1372 . B 423 MET HB2 . 34201 2 37 . 2 2 5 5 MET HB3 H 1 2.098 0.005 . 2 . . 1758 . B 423 MET HB3 . 34201 2 38 . 2 2 5 5 MET HG2 H 1 2.609 0.0 . 2 . . 1371 . B 423 MET HG2 . 34201 2 39 . 2 2 5 5 MET HG3 H 1 2.540 . . 2 . . 1756 . B 423 MET HG3 . 34201 2 40 . 2 2 5 5 MET HE1 H 1 2.098 0.003 . 1 . . 1757 . B 423 MET HE1 . 34201 2 41 . 2 2 5 5 MET HE2 H 1 2.098 0.003 . 1 . . 1757 . B 423 MET HE2 . 34201 2 42 . 2 2 5 5 MET HE3 H 1 2.098 0.003 . 1 . . 1757 . B 423 MET HE3 . 34201 2 43 . 2 2 6 6 LEU H H 1 8.258 . . 1 . . 1958 . B 424 LEU H . 34201 2 44 . 2 2 6 6 LEU HA H 1 4.371 0.003 . 1 . . 1366 . B 424 LEU HA . 34201 2 45 . 2 2 6 6 LEU HB2 H 1 1.646 0.003 . 2 . . 1822 . B 424 LEU HB2 . 34201 2 46 . 2 2 6 6 LEU HB3 H 1 1.649 0.003 . 2 . . 1955 . B 424 LEU HB3 . 34201 2 47 . 2 2 6 6 LEU HG H 1 1.553 0.005 . 1 . . 1765 . B 424 LEU HG . 34201 2 48 . 2 2 6 6 LEU HD11 H 1 0.925 0.014 . 2 . . 1763 . B 424 LEU HD11 . 34201 2 49 . 2 2 6 6 LEU HD12 H 1 0.925 0.014 . 2 . . 1763 . B 424 LEU HD12 . 34201 2 50 . 2 2 6 6 LEU HD13 H 1 0.925 0.014 . 2 . . 1763 . B 424 LEU HD13 . 34201 2 51 . 2 2 6 6 LEU HD21 H 1 0.887 0.019 . 2 . . 1764 . B 424 LEU HD21 . 34201 2 52 . 2 2 6 6 LEU HD22 H 1 0.887 0.019 . 2 . . 1764 . B 424 LEU HD22 . 34201 2 53 . 2 2 6 6 LEU HD23 H 1 0.887 0.019 . 2 . . 1764 . B 424 LEU HD23 . 34201 2 54 . 2 2 7 7 LYS H H 1 8.258 0.002 . 1 . . 1377 . B 425 LYS H . 34201 2 55 . 2 2 7 7 LYS HA H 1 4.638 0.001 . 1 . . 1378 . B 425 LYS HA . 34201 2 56 . 2 2 7 7 LYS HB2 H 1 1.738 0.001 . 2 . . 1984 . B 425 LYS HB2 . 34201 2 57 . 2 2 7 7 LYS HB3 H 1 1.832 0.0 . 2 . . 1991 . B 425 LYS HB3 . 34201 2 58 . 2 2 7 7 LYS HG2 H 1 1.447 0.005 . 2 . . 1988 . B 425 LYS HG2 . 34201 2 59 . 2 2 7 7 LYS HG3 H 1 1.449 0.006 . 2 . . 1990 . B 425 LYS HG3 . 34201 2 60 . 2 2 7 7 LYS HD2 H 1 1.687 0.004 . 1 . . 1987 . B 425 LYS HD2 . 34201 2 61 . 2 2 7 7 LYS HE2 H 1 3.019 0.005 . 2 . . 1998 . B 425 LYS HE2 . 34201 2 62 . 2 2 7 7 LYS HE3 H 1 3.023 . . 2 . . 1999 . B 425 LYS HE3 . 34201 2 63 . 2 2 8 8 PRO HA H 1 4.448 0.01 . 1 . . 1376 . B 426 PRO HA . 34201 2 64 . 2 2 8 8 PRO HB2 H 1 1.889 0.003 . 2 . . 1389 . B 426 PRO HB2 . 34201 2 65 . 2 2 8 8 PRO HB3 H 1 2.263 0.015 . 2 . . 1390 . B 426 PRO HB3 . 34201 2 66 . 2 2 8 8 PRO HG2 H 1 2.057 0.005 . 2 . . 1949 . B 426 PRO HG2 . 34201 2 67 . 2 2 8 8 PRO HG3 H 1 2.043 0.008 . 2 . . 1950 . B 426 PRO HG3 . 34201 2 68 . 2 2 8 8 PRO HD2 H 1 3.682 0.012 . 2 . . 1387 . B 426 PRO HD2 . 34201 2 69 . 2 2 8 8 PRO HD3 H 1 3.840 0.01 . 2 . . 1388 . B 426 PRO HD3 . 34201 2 70 . 2 2 9 9 ARG H H 1 8.483 0.002 . 1 . . 1375 . B 427 ARG H . 34201 2 71 . 2 2 9 9 ARG HA H 1 4.342 . . 1 . . 1951 . B 427 ARG HA . 34201 2 72 . 2 2 9 9 ARG HB2 H 1 1.769 0.005 . 2 . . 1825 . B 427 ARG HB2 . 34201 2 73 . 2 2 9 9 ARG HB3 H 1 1.850 0.005 . 2 . . 1826 . B 427 ARG HB3 . 34201 2 74 . 2 2 9 9 ARG HG2 H 1 1.687 0.003 . 2 . . 1827 . B 427 ARG HG2 . 34201 2 75 . 2 2 9 9 ARG HG3 H 1 1.688 . . 2 . . 1959 . B 427 ARG HG3 . 34201 2 76 . 2 2 9 9 ARG HD2 H 1 3.241 0.009 . 1 . . 1952 . B 427 ARG HD2 . 34201 2 77 . 2 2 9 9 ARG HD3 H 1 3.241 0.009 . 1 . . 1953 . B 427 ARG HD3 . 34201 2 78 . 2 2 9 9 ARG HE H 1 7.216 0.004 . 1 . . 1651 . B 427 ARG HE . 34201 2 79 . 2 2 10 10 LYS H H 1 8.416 0.009 . 1 . . 1957 . B 428 LYS H . 34201 2 80 . 2 2 10 10 LYS HA H 1 4.317 . . 1 . . 1379 . B 428 LYS HA . 34201 2 81 . 2 2 10 10 LYS HB2 H 1 1.750 . . 2 . . 1985 . B 428 LYS HB2 . 34201 2 82 . 2 2 10 10 LYS HB3 H 1 1.813 . . 2 . . 1986 . B 428 LYS HB3 . 34201 2 83 . 2 2 10 10 LYS HG2 H 1 1.461 0.008 . 2 . . 1992 . B 428 LYS HG2 . 34201 2 84 . 2 2 10 10 LYS HG3 H 1 1.468 0.005 . 2 . . 1993 . B 428 LYS HG3 . 34201 2 85 . 2 2 10 10 LYS HD2 H 1 1.687 0.004 . 1 . . 1994 . B 428 LYS HD2 . 34201 2 86 . 2 2 10 10 LYS HE2 H 1 3.023 . . 2 . . 1996 . B 428 LYS HE2 . 34201 2 87 . 2 2 10 10 LYS HE3 H 1 3.019 0.005 . 2 . . 1997 . B 428 LYS HE3 . 34201 2 88 . 2 2 11 11 LYS H H 1 8.403 0.008 . 1 . . 1824 . B 429 LYS H . 34201 2 89 . 2 2 11 11 LYS HA H 1 4.282 0.0 . 1 . . 1381 . B 429 LYS HA . 34201 2 90 . 2 2 11 11 LYS HB2 H 1 1.736 . . 2 . . 1972 . B 429 LYS HB2 . 34201 2 91 . 2 2 11 11 LYS HB3 H 1 1.822 . . 2 . . 1973 . B 429 LYS HB3 . 34201 2 92 . 2 2 11 11 LYS HG2 H 1 1.459 . . 2 . . 1974 . B 429 LYS HG2 . 34201 2 93 . 2 2 11 11 LYS HG3 H 1 1.455 0.005 . 2 . . 1975 . B 429 LYS HG3 . 34201 2 94 . 2 2 11 11 LYS HD2 H 1 1.693 . . 2 . . 1970 . B 429 LYS HD2 . 34201 2 95 . 2 2 11 11 LYS HD3 H 1 1.687 0.004 . 2 . . 1971 . B 429 LYS HD3 . 34201 2 96 . 2 2 11 11 LYS HE2 H 1 3.023 . . 2 . . 1968 . B 429 LYS HE2 . 34201 2 97 . 2 2 11 11 LYS HE3 H 1 3.019 0.005 . 2 . . 1969 . B 429 LYS HE3 . 34201 2 98 . 2 2 12 12 ALA H H 1 8.368 0.001 . 1 . . 1384 . B 430 ALA H . 34201 2 99 . 2 2 12 12 ALA HA H 1 4.302 0.0 . 1 . . 1383 . B 430 ALA HA . 34201 2 100 . 2 2 12 12 ALA HB1 H 1 1.397 0.001 . 1 . . 1386 . B 430 ALA HB1 . 34201 2 101 . 2 2 12 12 ALA HB2 H 1 1.397 0.001 . 1 . . 1386 . B 430 ALA HB2 . 34201 2 102 . 2 2 12 12 ALA HB3 H 1 1.397 0.001 . 1 . . 1386 . B 430 ALA HB3 . 34201 2 103 . 2 2 13 13 LYS H H 1 8.318 0.001 . 1 . . 1385 . B 431 LYS H . 34201 2 104 . 2 2 13 13 LYS HA H 1 4.255 . . 1 . . 1382 . B 431 LYS HA . 34201 2 105 . 2 2 13 13 LYS HB2 H 1 1.773 . . 2 . . 1976 . B 431 LYS HB2 . 34201 2 106 . 2 2 13 13 LYS HB3 H 1 1.819 . . 2 . . 1977 . B 431 LYS HB3 . 34201 2 107 . 2 2 13 13 LYS HG2 H 1 1.460 0.01 . 2 . . 1982 . B 431 LYS HG2 . 34201 2 108 . 2 2 13 13 LYS HG3 H 1 1.473 . . 2 . . 1983 . B 431 LYS HG3 . 34201 2 109 . 2 2 13 13 LYS HD2 H 1 1.687 0.004 . 2 . . 1978 . B 431 LYS HD2 . 34201 2 110 . 2 2 13 13 LYS HD3 H 1 1.693 . . 2 . . 1979 . B 431 LYS HD3 . 34201 2 111 . 2 2 13 13 LYS HE2 H 1 3.018 0.005 . 2 . . 1980 . B 431 LYS HE2 . 34201 2 112 . 2 2 13 13 LYS HE3 H 1 3.023 . . 2 . . 1981 . B 431 LYS HE3 . 34201 2 113 . 2 2 14 14 ALA H H 1 8.344 0.0 . 1 . . 1380 . B 432 ALA H . 34201 2 114 . 2 2 14 14 ALA HA H 1 4.315 0.001 . 1 . . 1360 . B 432 ALA HA . 34201 2 115 . 2 2 14 14 ALA HB1 H 1 1.398 0.0 . 1 . . 1391 . B 432 ALA HB1 . 34201 2 116 . 2 2 14 14 ALA HB2 H 1 1.398 0.0 . 1 . . 1391 . B 432 ALA HB2 . 34201 2 117 . 2 2 14 14 ALA HB3 H 1 1.398 0.0 . 1 . . 1391 . B 432 ALA HB3 . 34201 2 118 . 2 2 15 15 LEU H H 1 8.230 0.0 . 1 . . 1358 . B 433 LEU H . 34201 2 119 . 2 2 15 15 LEU HA H 1 4.293 0.001 . 1 . . 1359 . B 433 LEU HA . 34201 2 120 . 2 2 15 15 LEU HB2 H 1 1.685 0.002 . 2 . . 1367 . B 433 LEU HB2 . 34201 2 121 . 2 2 15 15 LEU HB3 H 1 1.684 . . 2 . . 1956 . B 433 LEU HB3 . 34201 2 122 . 2 2 15 15 LEU HG H 1 1.606 . . 1 . . 1368 . B 433 LEU HG . 34201 2 123 . 2 2 15 15 LEU HD11 H 1 0.892 0.0 . 2 . . 1650 . B 433 LEU HD11 . 34201 2 124 . 2 2 15 15 LEU HD12 H 1 0.892 0.0 . 2 . . 1650 . B 433 LEU HD12 . 34201 2 125 . 2 2 15 15 LEU HD13 H 1 0.892 0.0 . 2 . . 1650 . B 433 LEU HD13 . 34201 2 126 . 2 2 15 15 LEU HD21 H 1 0.942 . . 2 . . 1823 . B 433 LEU HD21 . 34201 2 127 . 2 2 15 15 LEU HD22 H 1 0.942 . . 2 . . 1823 . B 433 LEU HD22 . 34201 2 128 . 2 2 15 15 LEU HD23 H 1 0.942 . . 2 . . 1823 . B 433 LEU HD23 . 34201 2 stop_ save_