data_51711 ####################### # Entry information # ####################### save_entry_information_1 _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information_1 _Entry.ID 51711 _Entry.Title ; 1H, 13C, 15N backbone chemical shift assignments for DDX4 1-236 ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2022-11-28 _Entry.Accession_date 2022-11-28 _Entry.Last_release_date 2022-11-28 _Entry.Original_release_date 2022-11-28 _Entry.Origination author _Entry.Format_name . _Entry.NMR_STAR_version 3.2.14.0 _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 'Backbone chemical shift assignments for the DDX4 1-236 protein.' _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 Michael Crabtree . . . 0000-0003-1466-4011 51711 2 Christina Redfield . . . 0000-0001-7297-7708 51711 3 Tim Nott . . . 0000-0002-5210-4931 51711 stop_ loop_ _Entry_src.ID _Entry_src.Project_name _Entry_src.Organization_full_name _Entry_src.Organization_initials _Entry_src.Entry_ID 1 . 'Department of Biochemistry, University of Oxford' . 51711 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 51711 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 511 51711 '15N chemical shifts' 185 51711 '1H chemical shifts' 185 51711 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 1 . . 2023-11-20 . original BMRB . 51711 stop_ save_ ############### # Citations # ############### save_citations_1 _Citation.Sf_category citations _Citation.Sf_framecode citations_1 _Citation.Entry_ID 51711 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 37980572 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; Ion binding with charge inversion combined with screening modulates DEAD box helicase phase transitions ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Cell Rep.' _Citation.Journal_name_full 'Cell reports' _Citation.Journal_volume 42 _Citation.Journal_issue 11 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2211-1247 _Citation.Journal_CSD . _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 113375 _Citation.Page_last 113375 _Citation.Year 2023 _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 Michael Crabtree M. D. . . 51711 1 2 Jack Holland J. . . . 51711 1 3 Arvind Pillai A. S. . . 51711 1 4 Purnima Kompella P. S. . . 51711 1 5 Leon Babl L. . . . 51711 1 6 Noah Turner N. N. . . 51711 1 7 James Eaton J. T. . . 51711 1 8 Georg Hochberg . . . . 51711 1 9 Dirk Aarts . . . . 51711 1 10 Christina Redfield C. . . . 51711 1 11 Andrew Baldwin A. J. . . 51711 1 12 Timothy Nott T. J. . . 51711 1 stop_ loop_ _Citation_keyword.Keyword _Citation_keyword.Entry_ID _Citation_keyword.Citation_ID DDX4 51711 1 'NMR assignments' 51711 1 'intrinsically disordered' 51711 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly_1 _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly_1 _Assembly.Entry_ID 51711 _Assembly.ID 1 _Assembly.Name DDX4 _Assembly.BMRB_code . _Assembly.Number_of_components 1 _Assembly.Organic_ligands 0 _Assembly.Metal_ions 0 _Assembly.Non_standard_bonds no _Assembly.Ambiguous_conformational_states no _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange no _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 DDX4 1 $entity_1 . . yes native no no . . . 51711 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 51711 _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 . _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MGDEDWEAEINPHMSSYVPI FEKDRYSGENGDNFNRTPAS SSEMDDGPSRRDHFMKSGFA SGRNFGNRDAGECNKRDNTS TMGGFGVGKSFGNRGFSNSR FEDGDSSGFWRESSNDCEDN PTRNRGFSKRGGYRDGNNSE ASGPYRRGGRGSFRGCRGGF GLGSPNNDLDPDECMQRTGG LFGSRRPVLSGTGNGDTSQS RSGSGSERGGYKGLNEEVIT GSGKNSWKSEAEGGES ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states no _Entity.Ambiguous_chem_comp_sites no _Entity.Nstd_monomer no _Entity.Nstd_chirality no _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 236 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'all free' _Entity.Src_method . _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight . _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_db_link.Ordinal _Entity_db_link.Author_supplied _Entity_db_link.Database_code _Entity_db_link.Accession_code _Entity_db_link.Entry_mol_code _Entity_db_link.Entry_mol_name _Entity_db_link.Entry_experimental_method _Entity_db_link.Entry_structure_resolution _Entity_db_link.Entry_relation_type _Entity_db_link.Entry_details _Entity_db_link.Chimera_segment_ID _Entity_db_link.Seq_query_to_submitted_percent _Entity_db_link.Seq_subject_length _Entity_db_link.Seq_identity _Entity_db_link.Seq_positive _Entity_db_link.Seq_homology_expectation_val _Entity_db_link.Seq_align_begin _Entity_db_link.Seq_align_end _Entity_db_link.Seq_difference_details _Entity_db_link.Seq_alignment_details _Entity_db_link.Entry_ID _Entity_db_link.Entity_ID 1 yes UNP 'DDX4_HUMAN (Q9NQ10)' . . . . . . . . . . . . . . . . 51711 1 stop_ loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 . MET . 51711 1 2 . GLY . 51711 1 3 . ASP . 51711 1 4 . GLU . 51711 1 5 . ASP . 51711 1 6 . TRP . 51711 1 7 . GLU . 51711 1 8 . ALA . 51711 1 9 . GLU . 51711 1 10 . ILE . 51711 1 11 . ASN . 51711 1 12 . PRO . 51711 1 13 . HIS . 51711 1 14 . MET . 51711 1 15 . SER . 51711 1 16 . SER . 51711 1 17 . TYR . 51711 1 18 . VAL . 51711 1 19 . PRO . 51711 1 20 . ILE . 51711 1 21 . PHE . 51711 1 22 . GLU . 51711 1 23 . LYS . 51711 1 24 . ASP . 51711 1 25 . ARG . 51711 1 26 . TYR . 51711 1 27 . SER . 51711 1 28 . GLY . 51711 1 29 . GLU . 51711 1 30 . ASN . 51711 1 31 . GLY . 51711 1 32 . ASP . 51711 1 33 . ASN . 51711 1 34 . PHE . 51711 1 35 . ASN . 51711 1 36 . ARG . 51711 1 37 . THR . 51711 1 38 . PRO . 51711 1 39 . ALA . 51711 1 40 . SER . 51711 1 41 . SER . 51711 1 42 . SER . 51711 1 43 . GLU . 51711 1 44 . MET . 51711 1 45 . ASP . 51711 1 46 . ASP . 51711 1 47 . GLY . 51711 1 48 . PRO . 51711 1 49 . SER . 51711 1 50 . ARG . 51711 1 51 . ARG . 51711 1 52 . ASP . 51711 1 53 . HIS . 51711 1 54 . PHE . 51711 1 55 . MET . 51711 1 56 . LYS . 51711 1 57 . SER . 51711 1 58 . GLY . 51711 1 59 . PHE . 51711 1 60 . ALA . 51711 1 61 . SER . 51711 1 62 . GLY . 51711 1 63 . ARG . 51711 1 64 . ASN . 51711 1 65 . PHE . 51711 1 66 . GLY . 51711 1 67 . ASN . 51711 1 68 . ARG . 51711 1 69 . ASP . 51711 1 70 . ALA . 51711 1 71 . GLY . 51711 1 72 . GLU . 51711 1 73 . CYS . 51711 1 74 . ASN . 51711 1 75 . LYS . 51711 1 76 . ARG . 51711 1 77 . ASP . 51711 1 78 . ASN . 51711 1 79 . THR . 51711 1 80 . SER . 51711 1 81 . THR . 51711 1 82 . MET . 51711 1 83 . GLY . 51711 1 84 . GLY . 51711 1 85 . PHE . 51711 1 86 . GLY . 51711 1 87 . VAL . 51711 1 88 . GLY . 51711 1 89 . LYS . 51711 1 90 . SER . 51711 1 91 . PHE . 51711 1 92 . GLY . 51711 1 93 . ASN . 51711 1 94 . ARG . 51711 1 95 . GLY . 51711 1 96 . PHE . 51711 1 97 . SER . 51711 1 98 . ASN . 51711 1 99 . SER . 51711 1 100 . ARG . 51711 1 101 . PHE . 51711 1 102 . GLU . 51711 1 103 . ASP . 51711 1 104 . GLY . 51711 1 105 . ASP . 51711 1 106 . SER . 51711 1 107 . SER . 51711 1 108 . GLY . 51711 1 109 . PHE . 51711 1 110 . TRP . 51711 1 111 . ARG . 51711 1 112 . GLU . 51711 1 113 . SER . 51711 1 114 . SER . 51711 1 115 . ASN . 51711 1 116 . ASP . 51711 1 117 . CYS . 51711 1 118 . GLU . 51711 1 119 . ASP . 51711 1 120 . ASN . 51711 1 121 . PRO . 51711 1 122 . THR . 51711 1 123 . ARG . 51711 1 124 . ASN . 51711 1 125 . ARG . 51711 1 126 . GLY . 51711 1 127 . PHE . 51711 1 128 . SER . 51711 1 129 . LYS . 51711 1 130 . ARG . 51711 1 131 . GLY . 51711 1 132 . GLY . 51711 1 133 . TYR . 51711 1 134 . ARG . 51711 1 135 . ASP . 51711 1 136 . GLY . 51711 1 137 . ASN . 51711 1 138 . ASN . 51711 1 139 . SER . 51711 1 140 . GLU . 51711 1 141 . ALA . 51711 1 142 . SER . 51711 1 143 . GLY . 51711 1 144 . PRO . 51711 1 145 . TYR . 51711 1 146 . ARG . 51711 1 147 . ARG . 51711 1 148 . GLY . 51711 1 149 . GLY . 51711 1 150 . ARG . 51711 1 151 . GLY . 51711 1 152 . SER . 51711 1 153 . PHE . 51711 1 154 . ARG . 51711 1 155 . GLY . 51711 1 156 . CYS . 51711 1 157 . ARG . 51711 1 158 . GLY . 51711 1 159 . GLY . 51711 1 160 . PHE . 51711 1 161 . GLY . 51711 1 162 . LEU . 51711 1 163 . GLY . 51711 1 164 . SER . 51711 1 165 . PRO . 51711 1 166 . ASN . 51711 1 167 . ASN . 51711 1 168 . ASP . 51711 1 169 . LEU . 51711 1 170 . ASP . 51711 1 171 . PRO . 51711 1 172 . ASP . 51711 1 173 . GLU . 51711 1 174 . CYS . 51711 1 175 . MET . 51711 1 176 . GLN . 51711 1 177 . ARG . 51711 1 178 . THR . 51711 1 179 . GLY . 51711 1 180 . GLY . 51711 1 181 . LEU . 51711 1 182 . PHE . 51711 1 183 . GLY . 51711 1 184 . SER . 51711 1 185 . ARG . 51711 1 186 . ARG . 51711 1 187 . PRO . 51711 1 188 . VAL . 51711 1 189 . LEU . 51711 1 190 . SER . 51711 1 191 . GLY . 51711 1 192 . THR . 51711 1 193 . GLY . 51711 1 194 . ASN . 51711 1 195 . GLY . 51711 1 196 . ASP . 51711 1 197 . THR . 51711 1 198 . SER . 51711 1 199 . GLN . 51711 1 200 . SER . 51711 1 201 . ARG . 51711 1 202 . SER . 51711 1 203 . GLY . 51711 1 204 . SER . 51711 1 205 . GLY . 51711 1 206 . SER . 51711 1 207 . GLU . 51711 1 208 . ARG . 51711 1 209 . GLY . 51711 1 210 . GLY . 51711 1 211 . TYR . 51711 1 212 . LYS . 51711 1 213 . GLY . 51711 1 214 . LEU . 51711 1 215 . ASN . 51711 1 216 . GLU . 51711 1 217 . GLU . 51711 1 218 . VAL . 51711 1 219 . ILE . 51711 1 220 . THR . 51711 1 221 . GLY . 51711 1 222 . SER . 51711 1 223 . GLY . 51711 1 224 . LYS . 51711 1 225 . ASN . 51711 1 226 . SER . 51711 1 227 . TRP . 51711 1 228 . LYS . 51711 1 229 . SER . 51711 1 230 . GLU . 51711 1 231 . ALA . 51711 1 232 . GLU . 51711 1 233 . GLY . 51711 1 234 . GLY . 51711 1 235 . GLU . 51711 1 236 . SER . 51711 1 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 51711 1 . GLY 2 2 51711 1 . ASP 3 3 51711 1 . GLU 4 4 51711 1 . ASP 5 5 51711 1 . TRP 6 6 51711 1 . GLU 7 7 51711 1 . ALA 8 8 51711 1 . GLU 9 9 51711 1 . ILE 10 10 51711 1 . ASN 11 11 51711 1 . PRO 12 12 51711 1 . HIS 13 13 51711 1 . MET 14 14 51711 1 . SER 15 15 51711 1 . SER 16 16 51711 1 . TYR 17 17 51711 1 . VAL 18 18 51711 1 . PRO 19 19 51711 1 . ILE 20 20 51711 1 . PHE 21 21 51711 1 . GLU 22 22 51711 1 . LYS 23 23 51711 1 . ASP 24 24 51711 1 . ARG 25 25 51711 1 . TYR 26 26 51711 1 . SER 27 27 51711 1 . GLY 28 28 51711 1 . GLU 29 29 51711 1 . ASN 30 30 51711 1 . GLY 31 31 51711 1 . ASP 32 32 51711 1 . ASN 33 33 51711 1 . PHE 34 34 51711 1 . ASN 35 35 51711 1 . ARG 36 36 51711 1 . THR 37 37 51711 1 . PRO 38 38 51711 1 . ALA 39 39 51711 1 . SER 40 40 51711 1 . SER 41 41 51711 1 . SER 42 42 51711 1 . GLU 43 43 51711 1 . MET 44 44 51711 1 . ASP 45 45 51711 1 . ASP 46 46 51711 1 . GLY 47 47 51711 1 . PRO 48 48 51711 1 . SER 49 49 51711 1 . ARG 50 50 51711 1 . ARG 51 51 51711 1 . ASP 52 52 51711 1 . HIS 53 53 51711 1 . PHE 54 54 51711 1 . MET 55 55 51711 1 . LYS 56 56 51711 1 . SER 57 57 51711 1 . GLY 58 58 51711 1 . PHE 59 59 51711 1 . ALA 60 60 51711 1 . SER 61 61 51711 1 . GLY 62 62 51711 1 . ARG 63 63 51711 1 . ASN 64 64 51711 1 . PHE 65 65 51711 1 . GLY 66 66 51711 1 . ASN 67 67 51711 1 . ARG 68 68 51711 1 . ASP 69 69 51711 1 . ALA 70 70 51711 1 . GLY 71 71 51711 1 . GLU 72 72 51711 1 . CYS 73 73 51711 1 . ASN 74 74 51711 1 . LYS 75 75 51711 1 . ARG 76 76 51711 1 . ASP 77 77 51711 1 . ASN 78 78 51711 1 . THR 79 79 51711 1 . SER 80 80 51711 1 . THR 81 81 51711 1 . MET 82 82 51711 1 . GLY 83 83 51711 1 . GLY 84 84 51711 1 . PHE 85 85 51711 1 . GLY 86 86 51711 1 . VAL 87 87 51711 1 . GLY 88 88 51711 1 . LYS 89 89 51711 1 . SER 90 90 51711 1 . PHE 91 91 51711 1 . GLY 92 92 51711 1 . ASN 93 93 51711 1 . ARG 94 94 51711 1 . GLY 95 95 51711 1 . PHE 96 96 51711 1 . SER 97 97 51711 1 . ASN 98 98 51711 1 . SER 99 99 51711 1 . ARG 100 100 51711 1 . PHE 101 101 51711 1 . GLU 102 102 51711 1 . ASP 103 103 51711 1 . GLY 104 104 51711 1 . ASP 105 105 51711 1 . SER 106 106 51711 1 . SER 107 107 51711 1 . GLY 108 108 51711 1 . PHE 109 109 51711 1 . TRP 110 110 51711 1 . ARG 111 111 51711 1 . GLU 112 112 51711 1 . SER 113 113 51711 1 . SER 114 114 51711 1 . ASN 115 115 51711 1 . ASP 116 116 51711 1 . CYS 117 117 51711 1 . GLU 118 118 51711 1 . ASP 119 119 51711 1 . ASN 120 120 51711 1 . PRO 121 121 51711 1 . THR 122 122 51711 1 . ARG 123 123 51711 1 . ASN 124 124 51711 1 . ARG 125 125 51711 1 . GLY 126 126 51711 1 . PHE 127 127 51711 1 . SER 128 128 51711 1 . LYS 129 129 51711 1 . ARG 130 130 51711 1 . GLY 131 131 51711 1 . GLY 132 132 51711 1 . TYR 133 133 51711 1 . ARG 134 134 51711 1 . ASP 135 135 51711 1 . GLY 136 136 51711 1 . ASN 137 137 51711 1 . ASN 138 138 51711 1 . SER 139 139 51711 1 . GLU 140 140 51711 1 . ALA 141 141 51711 1 . SER 142 142 51711 1 . GLY 143 143 51711 1 . PRO 144 144 51711 1 . TYR 145 145 51711 1 . ARG 146 146 51711 1 . ARG 147 147 51711 1 . GLY 148 148 51711 1 . GLY 149 149 51711 1 . ARG 150 150 51711 1 . GLY 151 151 51711 1 . SER 152 152 51711 1 . PHE 153 153 51711 1 . ARG 154 154 51711 1 . GLY 155 155 51711 1 . CYS 156 156 51711 1 . ARG 157 157 51711 1 . GLY 158 158 51711 1 . GLY 159 159 51711 1 . PHE 160 160 51711 1 . GLY 161 161 51711 1 . LEU 162 162 51711 1 . GLY 163 163 51711 1 . SER 164 164 51711 1 . PRO 165 165 51711 1 . ASN 166 166 51711 1 . ASN 167 167 51711 1 . ASP 168 168 51711 1 . LEU 169 169 51711 1 . ASP 170 170 51711 1 . PRO 171 171 51711 1 . ASP 172 172 51711 1 . GLU 173 173 51711 1 . CYS 174 174 51711 1 . MET 175 175 51711 1 . GLN 176 176 51711 1 . ARG 177 177 51711 1 . THR 178 178 51711 1 . GLY 179 179 51711 1 . GLY 180 180 51711 1 . LEU 181 181 51711 1 . PHE 182 182 51711 1 . GLY 183 183 51711 1 . SER 184 184 51711 1 . ARG 185 185 51711 1 . ARG 186 186 51711 1 . PRO 187 187 51711 1 . VAL 188 188 51711 1 . LEU 189 189 51711 1 . SER 190 190 51711 1 . GLY 191 191 51711 1 . THR 192 192 51711 1 . GLY 193 193 51711 1 . ASN 194 194 51711 1 . GLY 195 195 51711 1 . ASP 196 196 51711 1 . THR 197 197 51711 1 . SER 198 198 51711 1 . GLN 199 199 51711 1 . SER 200 200 51711 1 . ARG 201 201 51711 1 . SER 202 202 51711 1 . GLY 203 203 51711 1 . SER 204 204 51711 1 . GLY 205 205 51711 1 . SER 206 206 51711 1 . GLU 207 207 51711 1 . ARG 208 208 51711 1 . GLY 209 209 51711 1 . GLY 210 210 51711 1 . TYR 211 211 51711 1 . LYS 212 212 51711 1 . GLY 213 213 51711 1 . LEU 214 214 51711 1 . ASN 215 215 51711 1 . GLU 216 216 51711 1 . GLU 217 217 51711 1 . VAL 218 218 51711 1 . ILE 219 219 51711 1 . THR 220 220 51711 1 . GLY 221 221 51711 1 . SER 222 222 51711 1 . GLY 223 223 51711 1 . LYS 224 224 51711 1 . ASN 225 225 51711 1 . SER 226 226 51711 1 . TRP 227 227 51711 1 . LYS 228 228 51711 1 . SER 229 229 51711 1 . GLU 230 230 51711 1 . ALA 231 231 51711 1 . GLU 232 232 51711 1 . GLY 233 233 51711 1 . GLY 234 234 51711 1 . GLU 235 235 51711 1 . SER 236 236 51711 1 stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source_1 _Entity_natural_src_list.Entry_ID 51711 _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 . 9606 organism . 'Homo sapiens' Human . . Eukaryota Metazoa Homo sapiens . . . . . . . . . . . . . 51711 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source_1 _Entity_experimental_src_list.Entry_ID 51711 _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' . . . Escherichia coli BL21(DE3) . . plasmid . . 'modified pETM-30 containing pGEX-2T-TEV site and pProEx multiple cloning sites' . . . 51711 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 51711 _Sample.ID 1 _Sample.Name '13C/15N DDX4' _Sample.Type solution _Sample.Sub_type . _Sample.Details 'double-labelled DDX4 1-236 pH 6.5 in PIPES buffer' _Sample.Aggregate_sample_number 1 _Sample.Solvent_system '95% H2O/5% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 DDX4 '[U-99% 13C; U-99% 15N]' . . 1 $entity_1 . . 44.6 . . uM . . . . 51711 1 2 TCEP 'natural abundance' . . . . . . 5 . . mM . . . . 51711 1 3 PIPES 'natural abundance' . . . . . . 20 . . mM . . . . 51711 1 4 'sodium chloride' 'natural abundance' . . . . . . 138.5 . . mM . . . . 51711 1 5 D2O '[U-99% 2H]' . . . . . . 5 . . % . . . . 51711 1 stop_ save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Sample_condition_list.Sf_category sample_conditions _Sample_condition_list.Sf_framecode sample_conditions_1 _Sample_condition_list.Entry_ID 51711 _Sample_condition_list.ID 1 _Sample_condition_list.Name 'sample condition 1' _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 0.15 . M 51711 1 pH 6.5 . pH 51711 1 pressure 1 . atm 51711 1 temperature 303 . K 51711 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 51711 _Software.ID 1 _Software.Type . _Software.Name TOPSPIN _Software.Version 3.2 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID collection . 51711 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 51711 _Software.ID 2 _Software.Type . _Software.Name CcpNMR _Software.Version 2.5 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 51711 2 'data analysis' . 51711 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 51711 _Software.ID 3 _Software.Type . _Software.Name NMRPipe _Software.Version 9.7 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51711 3 stop_ save_ save_software_4 _Software.Sf_category software _Software.Sf_framecode software_4 _Software.Entry_ID 51711 _Software.ID 4 _Software.Type . _Software.Name istHMS _Software.Version V211 _Software.DOI . _Software.Details . loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID processing . 51711 4 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 51711 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name 750 _NMR_spectrometer.Details 'Oxford Instruments Company magnet, Avance IIHD console, 5mm TCI cryoprobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 750 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 51711 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name 950 _NMR_spectrometer.Details 'Oxford Instruments Company magnet, Avance IIHD console, 5mm TCI cryoprobe' _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 950 save_ ############################# # NMR applied experiments # ############################# save_experiment_list_1 _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list_1 _Experiment_list.Entry_ID 51711 _Experiment_list.ID 1 _Experiment_list.Details . loop_ _Experiment.ID _Experiment.Name _Experiment.Raw_data_flag _Experiment.NUS_flag _Experiment.Interleaved_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.Details _Experiment.Entry_ID _Experiment.Experiment_list_ID 1 '2D 1H-15N BEST-TROSY' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51711 1 2 '2D 1H-15N BEST-TROSY' no no no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 51711 1 3 '3D BEST-TROSY-HNCA' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51711 1 4 '3D BEST-TROSY-HNCACB' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 51711 1 5 '3D BEST-TROSY-HN(CO)CACB' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51711 1 6 '3D BEST-TROSY-HNCO' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51711 1 7 '3D BEST-TROSY-HN(CA)CO' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51711 1 8 '3D (H)CC(CO)NH' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51711 1 9 '3D HN(CA)NNH' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51711 1 10 '3D HN(COCA)NNH' no yes no . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 51711 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 51711 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name 'reference set 1' _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.251449530 . . . . . 51711 1 H 1 DSS 'methyl protons' . . . . ppm 0.00 internal direct 1.000000000 . . . . . 51711 1 N 15 DSS 'methyl protons' . . . . ppm 0.00 na indirect 0.101329118 . . . . . 51711 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 51711 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name '1H/13C/15N at pH 6.5' _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 '2D 1H-15N BEST-TROSY' . . . 51711 1 2 '2D 1H-15N BEST-TROSY' . . . 51711 1 3 '3D BEST-TROSY-HNCA' . . . 51711 1 4 '3D BEST-TROSY-HNCACB' . . . 51711 1 5 '3D BEST-TROSY-HN(CO)CACB' . . . 51711 1 6 '3D BEST-TROSY-HNCO' . . . 51711 1 7 '3D BEST-TROSY-HN(CA)CO' . . . 51711 1 8 '3D (H)CC(CO)NH' . . . 51711 1 9 '3D HN(CA)NNH' . . . 51711 1 10 '3D HN(COCA)NNH' . . . 51711 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 2 $software_2 . . 51711 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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 . 1 . 1 2 2 GLY H H 1 8.380 0.002 . 1 . . . . . 2 GLY H . 51711 1 2 . 1 . 1 2 2 GLY C C 13 173.859 0.000 . 1 . . . . . 2 GLY C . 51711 1 3 . 1 . 1 2 2 GLY N N 15 110.385 0.034 . 1 . . . . . 2 GLY N . 51711 1 4 . 1 . 1 3 3 ASP H H 1 8.186 0.001 . 1 . . . . . 3 ASP H . 51711 1 5 . 1 . 1 3 3 ASP C C 13 176.549 0.007 . 1 . . . . . 3 ASP C . 51711 1 6 . 1 . 1 3 3 ASP CA C 13 54.513 0.000 . 1 . . . . . 3 ASP CA . 51711 1 7 . 1 . 1 3 3 ASP CB C 13 41.268 0.000 . 1 . . . . . 3 ASP CB . 51711 1 8 . 1 . 1 3 3 ASP N N 15 120.801 0.029 . 1 . . . . . 3 ASP N . 51711 1 9 . 1 . 1 4 4 GLU H H 1 8.459 0.003 . 1 . . . . . 4 GLU H . 51711 1 10 . 1 . 1 4 4 GLU C C 13 176.418 0.005 . 1 . . . . . 4 GLU C . 51711 1 11 . 1 . 1 4 4 GLU CA C 13 57.052 0.000 . 1 . . . . . 4 GLU CA . 51711 1 12 . 1 . 1 4 4 GLU CB C 13 29.941 0.000 . 1 . . . . . 4 GLU CB . 51711 1 13 . 1 . 1 4 4 GLU N N 15 120.751 0.033 . 1 . . . . . 4 GLU N . 51711 1 14 . 1 . 1 5 5 ASP H H 1 8.284 0.003 . 1 . . . . . 5 ASP H . 51711 1 15 . 1 . 1 5 5 ASP C C 13 176.225 0.000 . 1 . . . . . 5 ASP C . 51711 1 16 . 1 . 1 5 5 ASP CA C 13 54.335 0.000 . 1 . . . . . 5 ASP CA . 51711 1 17 . 1 . 1 5 5 ASP CB C 13 40.931 0.000 . 1 . . . . . 5 ASP CB . 51711 1 18 . 1 . 1 5 5 ASP N N 15 121.047 0.041 . 1 . . . . . 5 ASP N . 51711 1 19 . 1 . 1 6 6 TRP H H 1 7.908 0.002 . 1 . . . . . 6 TRP H . 51711 1 20 . 1 . 1 6 6 TRP C C 13 176.507 0.020 . 1 . . . . . 6 TRP C . 51711 1 21 . 1 . 1 6 6 TRP CA C 13 57.796 0.043 . 1 . . . . . 6 TRP CA . 51711 1 22 . 1 . 1 6 6 TRP CB C 13 29.386 0.000 . 1 . . . . . 6 TRP CB . 51711 1 23 . 1 . 1 6 6 TRP N N 15 121.900 0.024 . 1 . . . . . 6 TRP N . 51711 1 24 . 1 . 1 7 7 GLU H H 1 8.028 0.004 . 1 . . . . . 7 GLU H . 51711 1 25 . 1 . 1 7 7 GLU C C 13 175.984 0.036 . 1 . . . . . 7 GLU C . 51711 1 26 . 1 . 1 7 7 GLU CA C 13 56.778 0.033 . 1 . . . . . 7 GLU CA . 51711 1 27 . 1 . 1 7 7 GLU CB C 13 30.112 0.034 . 1 . . . . . 7 GLU CB . 51711 1 28 . 1 . 1 7 7 GLU CG C 13 36.008 0.000 . 1 . . . . . 7 GLU CG . 51711 1 29 . 1 . 1 7 7 GLU N N 15 122.125 0.064 . 1 . . . . . 7 GLU N . 51711 1 30 . 1 . 1 8 8 ALA H H 1 7.843 0.002 . 1 . . . . . 8 ALA H . 51711 1 31 . 1 . 1 8 8 ALA C C 13 177.760 0.007 . 1 . . . . . 8 ALA C . 51711 1 32 . 1 . 1 8 8 ALA CA C 13 52.750 0.023 . 1 . . . . . 8 ALA CA . 51711 1 33 . 1 . 1 8 8 ALA CB C 13 19.268 0.000 . 1 . . . . . 8 ALA CB . 51711 1 34 . 1 . 1 8 8 ALA N N 15 123.844 0.030 . 1 . . . . . 8 ALA N . 51711 1 35 . 1 . 1 9 9 GLU H H 1 8.123 0.003 . 1 . . . . . 9 GLU H . 51711 1 36 . 1 . 1 9 9 GLU C C 13 176.413 0.015 . 1 . . . . . 9 GLU C . 51711 1 37 . 1 . 1 9 9 GLU CA C 13 56.607 0.018 . 1 . . . . . 9 GLU CA . 51711 1 38 . 1 . 1 9 9 GLU CB C 13 30.277 0.026 . 1 . . . . . 9 GLU CB . 51711 1 39 . 1 . 1 9 9 GLU CG C 13 36.126 0.000 . 1 . . . . . 9 GLU CG . 51711 1 40 . 1 . 1 9 9 GLU N N 15 119.318 0.043 . 1 . . . . . 9 GLU N . 51711 1 41 . 1 . 1 10 10 ILE H H 1 7.947 0.004 . 1 . . . . . 10 ILE H . 51711 1 42 . 1 . 1 10 10 ILE C C 13 175.601 0.001 . 1 . . . . . 10 ILE C . 51711 1 43 . 1 . 1 10 10 ILE CA C 13 61.122 0.044 . 1 . . . . . 10 ILE CA . 51711 1 44 . 1 . 1 10 10 ILE CB C 13 38.621 0.022 . 1 . . . . . 10 ILE CB . 51711 1 45 . 1 . 1 10 10 ILE CG1 C 13 26.903 0.000 . 1 . . . . . 10 ILE CG1 . 51711 1 46 . 1 . 1 10 10 ILE CG2 C 13 17.295 0.000 . 1 . . . . . 10 ILE CG2 . 51711 1 47 . 1 . 1 10 10 ILE N N 15 120.880 0.060 . 1 . . . . . 10 ILE N . 51711 1 48 . 1 . 1 11 11 ASN H H 1 8.321 0.006 . 1 . . . . . 11 ASN H . 51711 1 49 . 1 . 1 11 11 ASN C C 13 173.416 0.000 . 1 . . . . . 11 ASN C . 51711 1 50 . 1 . 1 11 11 ASN CA C 13 51.105 0.000 . 1 . . . . . 11 ASN CA . 51711 1 51 . 1 . 1 11 11 ASN CB C 13 39.162 0.000 . 1 . . . . . 11 ASN CB . 51711 1 52 . 1 . 1 11 11 ASN N N 15 123.116 0.045 . 1 . . . . . 11 ASN N . 51711 1 53 . 1 . 1 16 16 SER H H 1 8.194 0.004 . 1 . . . . . 16 SER H . 51711 1 54 . 1 . 1 16 16 SER C C 13 173.811 0.000 . 1 . . . . . 16 SER C . 51711 1 55 . 1 . 1 16 16 SER CB C 13 63.777 0.000 . 1 . . . . . 16 SER CB . 51711 1 56 . 1 . 1 16 16 SER N N 15 117.408 0.028 . 1 . . . . . 16 SER N . 51711 1 57 . 1 . 1 17 17 TYR H H 1 8.090 0.003 . 1 . . . . . 17 TYR H . 51711 1 58 . 1 . 1 17 17 TYR C C 13 174.908 0.013 . 1 . . . . . 17 TYR C . 51711 1 59 . 1 . 1 17 17 TYR CA C 13 58.087 0.040 . 1 . . . . . 17 TYR CA . 51711 1 60 . 1 . 1 17 17 TYR CB C 13 38.911 0.004 . 1 . . . . . 17 TYR CB . 51711 1 61 . 1 . 1 17 17 TYR N N 15 122.783 0.032 . 1 . . . . . 17 TYR N . 51711 1 62 . 1 . 1 18 18 VAL H H 1 7.795 0.002 . 1 . . . . . 18 VAL H . 51711 1 63 . 1 . 1 18 18 VAL C C 13 173.443 0.000 . 1 . . . . . 18 VAL C . 51711 1 64 . 1 . 1 18 18 VAL CA C 13 59.387 0.000 . 1 . . . . . 18 VAL CA . 51711 1 65 . 1 . 1 18 18 VAL CB C 13 33.172 0.000 . 1 . . . . . 18 VAL CB . 51711 1 66 . 1 . 1 18 18 VAL N N 15 125.879 0.084 . 1 . . . . . 18 VAL N . 51711 1 67 . 1 . 1 19 19 PRO C C 13 176.446 0.000 . 1 . . . . . 19 PRO C . 51711 1 68 . 1 . 1 19 19 PRO CA C 13 62.795 0.000 . 1 . . . . . 19 PRO CA . 51711 1 69 . 1 . 1 19 19 PRO CB C 13 32.054 0.000 . 1 . . . . . 19 PRO CB . 51711 1 70 . 1 . 1 19 19 PRO CG C 13 27.277 0.000 . 1 . . . . . 19 PRO CG . 51711 1 71 . 1 . 1 20 20 ILE H H 1 7.930 0.003 . 1 . . . . . 20 ILE H . 51711 1 72 . 1 . 1 20 20 ILE C C 13 175.971 0.000 . 1 . . . . . 20 ILE C . 51711 1 73 . 1 . 1 20 20 ILE CA C 13 61.226 0.042 . 1 . . . . . 20 ILE CA . 51711 1 74 . 1 . 1 20 20 ILE CB C 13 38.926 0.010 . 1 . . . . . 20 ILE CB . 51711 1 75 . 1 . 1 20 20 ILE CG1 C 13 27.171 0.000 . 1 . . . . . 20 ILE CG1 . 51711 1 76 . 1 . 1 20 20 ILE CG2 C 13 17.265 0.000 . 1 . . . . . 20 ILE CG2 . 51711 1 77 . 1 . 1 20 20 ILE N N 15 120.577 0.041 . 1 . . . . . 20 ILE N . 51711 1 78 . 1 . 1 21 21 PHE H H 1 8.149 0.004 . 1 . . . . . 21 PHE H . 51711 1 79 . 1 . 1 21 21 PHE C C 13 175.683 0.000 . 1 . . . . . 21 PHE C . 51711 1 80 . 1 . 1 21 21 PHE CA C 13 57.433 0.006 . 1 . . . . . 21 PHE CA . 51711 1 81 . 1 . 1 21 21 PHE CB C 13 39.645 0.019 . 1 . . . . . 21 PHE CB . 51711 1 82 . 1 . 1 21 21 PHE N N 15 123.564 0.048 . 1 . . . . . 21 PHE N . 51711 1 83 . 1 . 1 22 22 GLU H H 1 8.293 0.002 . 1 . . . . . 22 GLU H . 51711 1 84 . 1 . 1 22 22 GLU C C 13 176.316 0.004 . 1 . . . . . 22 GLU C . 51711 1 85 . 1 . 1 22 22 GLU CA C 13 56.659 0.000 . 1 . . . . . 22 GLU CA . 51711 1 86 . 1 . 1 22 22 GLU CB C 13 30.345 0.028 . 1 . . . . . 22 GLU CB . 51711 1 87 . 1 . 1 22 22 GLU CG C 13 36.296 0.000 . 1 . . . . . 22 GLU CG . 51711 1 88 . 1 . 1 22 22 GLU N N 15 123.098 0.041 . 1 . . . . . 22 GLU N . 51711 1 89 . 1 . 1 23 23 LYS H H 1 8.150 0.002 . 1 . . . . . 23 LYS H . 51711 1 90 . 1 . 1 23 23 LYS C C 13 176.435 0.000 . 1 . . . . . 23 LYS C . 51711 1 91 . 1 . 1 23 23 LYS CA C 13 57.033 0.000 . 1 . . . . . 23 LYS CA . 51711 1 92 . 1 . 1 23 23 LYS CB C 13 32.903 0.000 . 1 . . . . . 23 LYS CB . 51711 1 93 . 1 . 1 23 23 LYS CG C 13 24.551 0.000 . 1 . . . . . 23 LYS CG . 51711 1 94 . 1 . 1 23 23 LYS N N 15 121.791 0.032 . 1 . . . . . 23 LYS N . 51711 1 95 . 1 . 1 24 24 ASP H H 1 8.292 0.003 . 1 . . . . . 24 ASP H . 51711 1 96 . 1 . 1 24 24 ASP C C 13 176.308 0.000 . 1 . . . . . 24 ASP C . 51711 1 97 . 1 . 1 24 24 ASP CA C 13 54.677 0.000 . 1 . . . . . 24 ASP CA . 51711 1 98 . 1 . 1 24 24 ASP CB C 13 41.088 0.007 . 1 . . . . . 24 ASP CB . 51711 1 99 . 1 . 1 24 24 ASP N N 15 120.513 0.050 . 1 . . . . . 24 ASP N . 51711 1 100 . 1 . 1 25 25 ARG H H 1 7.998 0.001 . 1 . . . . . 25 ARG H . 51711 1 101 . 1 . 1 25 25 ARG C C 13 176.134 0.005 . 1 . . . . . 25 ARG C . 51711 1 102 . 1 . 1 25 25 ARG CA C 13 56.607 0.000 . 1 . . . . . 25 ARG CA . 51711 1 103 . 1 . 1 25 25 ARG CB C 13 30.582 0.022 . 1 . . . . . 25 ARG CB . 51711 1 104 . 1 . 1 25 25 ARG CG C 13 26.648 0.000 . 1 . . . . . 25 ARG CG . 51711 1 105 . 1 . 1 25 25 ARG N N 15 120.965 0.036 . 1 . . . . . 25 ARG N . 51711 1 106 . 1 . 1 26 26 TYR H H 1 8.191 0.002 . 1 . . . . . 26 TYR H . 51711 1 107 . 1 . 1 26 26 TYR C C 13 175.987 0.000 . 1 . . . . . 26 TYR C . 51711 1 108 . 1 . 1 26 26 TYR CA C 13 57.851 0.000 . 1 . . . . . 26 TYR CA . 51711 1 109 . 1 . 1 26 26 TYR CB C 13 38.608 0.024 . 1 . . . . . 26 TYR CB . 51711 1 110 . 1 . 1 26 26 TYR N N 15 120.686 0.122 . 1 . . . . . 26 TYR N . 51711 1 111 . 1 . 1 27 27 SER H H 1 8.151 0.003 . 1 . . . . . 27 SER H . 51711 1 112 . 1 . 1 27 27 SER C C 13 174.880 0.021 . 1 . . . . . 27 SER C . 51711 1 113 . 1 . 1 27 27 SER CA C 13 58.456 0.033 . 1 . . . . . 27 SER CA . 51711 1 114 . 1 . 1 27 27 SER CB C 13 63.971 0.005 . 1 . . . . . 27 SER CB . 51711 1 115 . 1 . 1 27 27 SER N N 15 117.981 0.047 . 1 . . . . . 27 SER N . 51711 1 116 . 1 . 1 28 28 GLY H H 1 7.907 0.001 . 1 . . . . . 28 GLY H . 51711 1 117 . 1 . 1 28 28 GLY C C 13 174.223 0.000 . 1 . . . . . 28 GLY C . 51711 1 118 . 1 . 1 28 28 GLY CA C 13 45.403 0.003 . 1 . . . . . 28 GLY CA . 51711 1 119 . 1 . 1 28 28 GLY N N 15 110.606 0.015 . 1 . . . . . 28 GLY N . 51711 1 120 . 1 . 1 29 29 GLU H H 1 8.286 0.002 . 1 . . . . . 29 GLU H . 51711 1 121 . 1 . 1 29 29 GLU C C 13 176.458 0.000 . 1 . . . . . 29 GLU C . 51711 1 122 . 1 . 1 29 29 GLU CA C 13 56.735 0.000 . 1 . . . . . 29 GLU CA . 51711 1 123 . 1 . 1 29 29 GLU CB C 13 30.177 0.000 . 1 . . . . . 29 GLU CB . 51711 1 124 . 1 . 1 29 29 GLU CG C 13 36.118 0.000 . 1 . . . . . 29 GLU CG . 51711 1 125 . 1 . 1 29 29 GLU N N 15 120.749 0.036 . 1 . . . . . 29 GLU N . 51711 1 126 . 1 . 1 30 30 ASN H H 1 8.452 0.005 . 1 . . . . . 30 ASN H . 51711 1 127 . 1 . 1 30 30 ASN C C 13 175.691 0.007 . 1 . . . . . 30 ASN C . 51711 1 128 . 1 . 1 30 30 ASN CA C 13 53.446 0.015 . 1 . . . . . 30 ASN CA . 51711 1 129 . 1 . 1 30 30 ASN CB C 13 39.095 0.000 . 1 . . . . . 30 ASN CB . 51711 1 130 . 1 . 1 30 30 ASN N N 15 119.351 0.023 . 1 . . . . . 30 ASN N . 51711 1 131 . 1 . 1 31 31 GLY H H 1 8.268 0.002 . 1 . . . . . 31 GLY H . 51711 1 132 . 1 . 1 31 31 GLY C C 13 174.058 0.005 . 1 . . . . . 31 GLY C . 51711 1 133 . 1 . 1 31 31 GLY CA C 13 45.595 0.000 . 1 . . . . . 31 GLY CA . 51711 1 134 . 1 . 1 31 31 GLY N N 15 109.372 0.030 . 1 . . . . . 31 GLY N . 51711 1 135 . 1 . 1 32 32 ASP H H 1 8.195 0.002 . 1 . . . . . 32 ASP H . 51711 1 136 . 1 . 1 32 32 ASP C C 13 176.176 0.000 . 1 . . . . . 32 ASP C . 51711 1 137 . 1 . 1 32 32 ASP CA C 13 54.507 0.047 . 1 . . . . . 32 ASP CA . 51711 1 138 . 1 . 1 32 32 ASP CB C 13 41.221 0.049 . 1 . . . . . 32 ASP CB . 51711 1 139 . 1 . 1 32 32 ASP N N 15 120.532 0.034 . 1 . . . . . 32 ASP N . 51711 1 140 . 1 . 1 33 33 ASN H H 1 8.273 0.002 . 1 . . . . . 33 ASN H . 51711 1 141 . 1 . 1 33 33 ASN C C 13 175.159 0.004 . 1 . . . . . 33 ASN C . 51711 1 142 . 1 . 1 33 33 ASN CA C 13 53.470 0.007 . 1 . . . . . 33 ASN CA . 51711 1 143 . 1 . 1 33 33 ASN CB C 13 38.763 0.000 . 1 . . . . . 33 ASN CB . 51711 1 144 . 1 . 1 33 33 ASN N N 15 118.581 0.022 . 1 . . . . . 33 ASN N . 51711 1 145 . 1 . 1 34 34 PHE H H 1 8.096 0.003 . 1 . . . . . 34 PHE H . 51711 1 146 . 1 . 1 34 34 PHE C C 13 175.490 0.000 . 1 . . . . . 34 PHE C . 51711 1 147 . 1 . 1 34 34 PHE CA C 13 57.977 0.000 . 1 . . . . . 34 PHE CA . 51711 1 148 . 1 . 1 34 34 PHE CB C 13 39.267 0.000 . 1 . . . . . 34 PHE CB . 51711 1 149 . 1 . 1 34 34 PHE N N 15 120.215 0.025 . 1 . . . . . 34 PHE N . 51711 1 150 . 1 . 1 35 35 ASN H H 1 8.275 0.002 . 1 . . . . . 35 ASN H . 51711 1 151 . 1 . 1 35 35 ASN C C 13 174.725 0.007 . 1 . . . . . 35 ASN C . 51711 1 152 . 1 . 1 35 35 ASN CA C 13 53.324 0.000 . 1 . . . . . 35 ASN CA . 51711 1 153 . 1 . 1 35 35 ASN CB C 13 38.869 0.022 . 1 . . . . . 35 ASN CB . 51711 1 154 . 1 . 1 35 35 ASN N N 15 120.149 0.053 . 1 . . . . . 35 ASN N . 51711 1 155 . 1 . 1 36 36 ARG H H 1 8.110 0.002 . 1 . . . . . 36 ARG H . 51711 1 156 . 1 . 1 36 36 ARG C C 13 176.128 0.005 . 1 . . . . . 36 ARG C . 51711 1 157 . 1 . 1 36 36 ARG CA C 13 56.042 0.061 . 1 . . . . . 36 ARG CA . 51711 1 158 . 1 . 1 36 36 ARG CB C 13 30.863 0.000 . 1 . . . . . 36 ARG CB . 51711 1 159 . 1 . 1 36 36 ARG CG C 13 27.084 0.000 . 1 . . . . . 36 ARG CG . 51711 1 160 . 1 . 1 36 36 ARG N N 15 121.479 0.018 . 1 . . . . . 36 ARG N . 51711 1 161 . 1 . 1 37 37 THR H H 1 8.199 0.003 . 1 . . . . . 37 THR H . 51711 1 162 . 1 . 1 37 37 THR C C 13 172.875 0.000 . 1 . . . . . 37 THR C . 51711 1 163 . 1 . 1 37 37 THR CA C 13 59.917 0.000 . 1 . . . . . 37 THR CA . 51711 1 164 . 1 . 1 37 37 THR CB C 13 69.602 0.000 . 1 . . . . . 37 THR CB . 51711 1 165 . 1 . 1 37 37 THR N N 15 118.005 0.062 . 1 . . . . . 37 THR N . 51711 1 166 . 1 . 1 38 38 PRO C C 13 176.689 0.000 . 1 . . . . . 38 PRO C . 51711 1 167 . 1 . 1 38 38 PRO CA C 13 63.331 0.000 . 1 . . . . . 38 PRO CA . 51711 1 168 . 1 . 1 38 38 PRO CB C 13 32.189 0.000 . 1 . . . . . 38 PRO CB . 51711 1 169 . 1 . 1 38 38 PRO CG C 13 27.244 0.000 . 1 . . . . . 38 PRO CG . 51711 1 170 . 1 . 1 39 39 ALA H H 1 8.363 0.003 . 1 . . . . . 39 ALA H . 51711 1 171 . 1 . 1 39 39 ALA C C 13 177.859 0.008 . 1 . . . . . 39 ALA C . 51711 1 172 . 1 . 1 39 39 ALA CA C 13 52.632 0.032 . 1 . . . . . 39 ALA CA . 51711 1 173 . 1 . 1 39 39 ALA CB C 13 19.268 0.028 . 1 . . . . . 39 ALA CB . 51711 1 174 . 1 . 1 39 39 ALA N N 15 124.458 0.040 . 1 . . . . . 39 ALA N . 51711 1 175 . 1 . 1 40 40 SER H H 1 8.237 0.003 . 1 . . . . . 40 SER H . 51711 1 176 . 1 . 1 40 40 SER C C 13 174.689 0.000 . 1 . . . . . 40 SER C . 51711 1 177 . 1 . 1 40 40 SER CA C 13 58.255 0.000 . 1 . . . . . 40 SER CA . 51711 1 178 . 1 . 1 40 40 SER CB C 13 63.931 0.000 . 1 . . . . . 40 SER CB . 51711 1 179 . 1 . 1 40 40 SER N N 15 115.077 0.056 . 1 . . . . . 40 SER N . 51711 1 180 . 1 . 1 41 41 SER H H 1 8.345 0.003 . 1 . . . . . 41 SER H . 51711 1 181 . 1 . 1 41 41 SER N N 15 117.937 0.026 . 1 . . . . . 41 SER N . 51711 1 182 . 1 . 1 42 42 SER H H 1 8.343 0.004 . 1 . . . . . 42 SER H . 51711 1 183 . 1 . 1 42 42 SER C C 13 174.645 0.000 . 1 . . . . . 42 SER C . 51711 1 184 . 1 . 1 42 42 SER CA C 13 58.762 0.000 . 1 . . . . . 42 SER CA . 51711 1 185 . 1 . 1 42 42 SER CB C 13 63.930 0.000 . 1 . . . . . 42 SER CB . 51711 1 186 . 1 . 1 42 42 SER N N 15 117.884 0.013 . 1 . . . . . 42 SER N . 51711 1 187 . 1 . 1 43 43 GLU H H 1 8.362 0.004 . 1 . . . . . 43 GLU H . 51711 1 188 . 1 . 1 43 43 GLU C C 13 176.514 0.001 . 1 . . . . . 43 GLU C . 51711 1 189 . 1 . 1 43 43 GLU CA C 13 56.891 0.000 . 1 . . . . . 43 GLU CA . 51711 1 190 . 1 . 1 43 43 GLU CB C 13 30.052 0.000 . 1 . . . . . 43 GLU CB . 51711 1 191 . 1 . 1 43 43 GLU N N 15 122.605 0.037 . 1 . . . . . 43 GLU N . 51711 1 192 . 1 . 1 44 44 MET H H 1 8.199 0.003 . 1 . . . . . 44 MET H . 51711 1 193 . 1 . 1 44 44 MET C C 13 175.937 0.003 . 1 . . . . . 44 MET C . 51711 1 194 . 1 . 1 44 44 MET CA C 13 55.621 0.000 . 1 . . . . . 44 MET CA . 51711 1 195 . 1 . 1 44 44 MET CB C 13 33.042 0.000 . 1 . . . . . 44 MET CB . 51711 1 196 . 1 . 1 44 44 MET CG C 13 31.925 0.000 . 1 . . . . . 44 MET CG . 51711 1 197 . 1 . 1 44 44 MET N N 15 120.334 0.050 . 1 . . . . . 44 MET N . 51711 1 198 . 1 . 1 45 45 ASP H H 1 8.211 0.003 . 1 . . . . . 45 ASP H . 51711 1 199 . 1 . 1 45 45 ASP C C 13 175.736 0.000 . 1 . . . . . 45 ASP C . 51711 1 200 . 1 . 1 45 45 ASP CA C 13 54.480 0.000 . 1 . . . . . 45 ASP CA . 51711 1 201 . 1 . 1 45 45 ASP CB C 13 41.354 0.000 . 1 . . . . . 45 ASP CB . 51711 1 202 . 1 . 1 45 45 ASP N N 15 121.686 0.027 . 1 . . . . . 45 ASP N . 51711 1 203 . 1 . 1 46 46 ASP H H 1 8.259 0.001 . 1 . . . . . 46 ASP H . 51711 1 204 . 1 . 1 46 46 ASP C C 13 176.445 0.003 . 1 . . . . . 46 ASP C . 51711 1 205 . 1 . 1 46 46 ASP CA C 13 54.186 0.000 . 1 . . . . . 46 ASP CA . 51711 1 206 . 1 . 1 46 46 ASP CB C 13 41.334 0.000 . 1 . . . . . 46 ASP CB . 51711 1 207 . 1 . 1 46 46 ASP N N 15 121.185 0.028 . 1 . . . . . 46 ASP N . 51711 1 208 . 1 . 1 47 47 GLY H H 1 8.212 0.002 . 1 . . . . . 47 GLY H . 51711 1 209 . 1 . 1 47 47 GLY C C 13 172.613 0.000 . 1 . . . . . 47 GLY C . 51711 1 210 . 1 . 1 47 47 GLY CA C 13 45.545 0.000 . 1 . . . . . 47 GLY CA . 51711 1 211 . 1 . 1 47 47 GLY N N 15 109.278 0.024 . 1 . . . . . 47 GLY N . 51711 1 212 . 1 . 1 48 48 PRO C C 13 177.526 0.027 . 1 . . . . . 48 PRO C . 51711 1 213 . 1 . 1 48 48 PRO CA C 13 63.833 0.022 . 1 . . . . . 48 PRO CA . 51711 1 214 . 1 . 1 48 48 PRO CB C 13 32.156 0.000 . 1 . . . . . 48 PRO CB . 51711 1 215 . 1 . 1 48 48 PRO CG C 13 27.005 0.000 . 1 . . . . . 48 PRO CG . 51711 1 216 . 1 . 1 49 49 SER H H 1 8.269 0.002 . 1 . . . . . 49 SER H . 51711 1 217 . 1 . 1 49 49 SER C C 13 174.994 0.000 . 1 . . . . . 49 SER C . 51711 1 218 . 1 . 1 49 49 SER CA C 13 59.022 0.021 . 1 . . . . . 49 SER CA . 51711 1 219 . 1 . 1 49 49 SER N N 15 115.112 0.032 . 1 . . . . . 49 SER N . 51711 1 220 . 1 . 1 50 50 ARG H H 1 8.168 0.003 . 1 . . . . . 50 ARG H . 51711 1 221 . 1 . 1 50 50 ARG C C 13 176.622 0.000 . 1 . . . . . 50 ARG C . 51711 1 222 . 1 . 1 50 50 ARG CA C 13 56.544 0.000 . 1 . . . . . 50 ARG CA . 51711 1 223 . 1 . 1 50 50 ARG N N 15 122.855 0.019 . 1 . . . . . 50 ARG N . 51711 1 224 . 1 . 1 56 56 LYS CB C 13 32.989 0.000 . 1 . . . . . 56 LYS CB . 51711 1 225 . 1 . 1 56 56 LYS CG C 13 24.628 0.000 . 1 . . . . . 56 LYS CG . 51711 1 226 . 1 . 1 56 56 LYS CD C 13 26.767 0.000 . 1 . . . . . 56 LYS CD . 51711 1 227 . 1 . 1 57 57 SER H H 1 8.199 0.005 . 1 . . . . . 57 SER H . 51711 1 228 . 1 . 1 57 57 SER N N 15 116.446 0.025 . 1 . . . . . 57 SER N . 51711 1 229 . 1 . 1 58 58 GLY H H 1 8.301 0.003 . 1 . . . . . 58 GLY H . 51711 1 230 . 1 . 1 58 58 GLY CA C 13 45.368 0.000 . 1 . . . . . 58 GLY CA . 51711 1 231 . 1 . 1 58 58 GLY N N 15 110.722 0.018 . 1 . . . . . 58 GLY N . 51711 1 232 . 1 . 1 59 59 PHE H H 1 8.024 0.002 . 1 . . . . . 59 PHE H . 51711 1 233 . 1 . 1 59 59 PHE C C 13 175.715 0.000 . 1 . . . . . 59 PHE C . 51711 1 234 . 1 . 1 59 59 PHE CA C 13 57.824 0.007 . 1 . . . . . 59 PHE CA . 51711 1 235 . 1 . 1 59 59 PHE CB C 13 39.677 0.005 . 1 . . . . . 59 PHE CB . 51711 1 236 . 1 . 1 59 59 PHE N N 15 120.192 0.034 . 1 . . . . . 59 PHE N . 51711 1 237 . 1 . 1 60 60 ALA H H 1 8.231 0.002 . 1 . . . . . 60 ALA H . 51711 1 238 . 1 . 1 60 60 ALA C C 13 177.442 0.008 . 1 . . . . . 60 ALA C . 51711 1 239 . 1 . 1 60 60 ALA CA C 13 52.587 0.022 . 1 . . . . . 60 ALA CA . 51711 1 240 . 1 . 1 60 60 ALA CB C 13 19.243 0.053 . 1 . . . . . 60 ALA CB . 51711 1 241 . 1 . 1 60 60 ALA N N 15 125.505 0.073 . 1 . . . . . 60 ALA N . 51711 1 242 . 1 . 1 61 61 SER H H 1 8.120 0.003 . 1 . . . . . 61 SER H . 51711 1 243 . 1 . 1 61 61 SER CA C 13 58.595 0.000 . 1 . . . . . 61 SER CA . 51711 1 244 . 1 . 1 61 61 SER CB C 13 63.906 0.000 . 1 . . . . . 61 SER CB . 51711 1 245 . 1 . 1 61 61 SER N N 15 114.995 0.036 . 1 . . . . . 61 SER N . 51711 1 246 . 1 . 1 62 62 GLY H H 1 8.316 0.003 . 1 . . . . . 62 GLY H . 51711 1 247 . 1 . 1 62 62 GLY N N 15 110.741 0.013 . 1 . . . . . 62 GLY N . 51711 1 248 . 1 . 1 63 63 ARG H H 1 8.052 0.004 . 1 . . . . . 63 ARG H . 51711 1 249 . 1 . 1 63 63 ARG N N 15 120.371 0.022 . 1 . . . . . 63 ARG N . 51711 1 250 . 1 . 1 64 64 ASN H H 1 8.333 0.001 . 1 . . . . . 64 ASN H . 51711 1 251 . 1 . 1 64 64 ASN N N 15 119.508 0.011 . 1 . . . . . 64 ASN N . 51711 1 252 . 1 . 1 65 65 PHE H H 1 8.158 0.004 . 1 . . . . . 65 PHE H . 51711 1 253 . 1 . 1 65 65 PHE N N 15 120.986 0.011 . 1 . . . . . 65 PHE N . 51711 1 254 . 1 . 1 66 66 GLY H H 1 8.324 0.000 . 1 . . . . . 66 GLY H . 51711 1 255 . 1 . 1 66 66 GLY C C 13 173.835 0.000 . 1 . . . . . 66 GLY C . 51711 1 256 . 1 . 1 66 66 GLY CA C 13 45.511 0.000 . 1 . . . . . 66 GLY CA . 51711 1 257 . 1 . 1 66 66 GLY N N 15 110.051 0.020 . 1 . . . . . 66 GLY N . 51711 1 258 . 1 . 1 67 67 ASN H H 1 8.241 0.002 . 1 . . . . . 67 ASN H . 51711 1 259 . 1 . 1 67 67 ASN C C 13 175.390 0.038 . 1 . . . . . 67 ASN C . 51711 1 260 . 1 . 1 67 67 ASN CA C 13 53.259 0.005 . 1 . . . . . 67 ASN CA . 51711 1 261 . 1 . 1 67 67 ASN CB C 13 38.893 0.015 . 1 . . . . . 67 ASN CB . 51711 1 262 . 1 . 1 67 67 ASN N N 15 119.013 0.121 . 1 . . . . . 67 ASN N . 51711 1 263 . 1 . 1 68 68 ARG H H 1 8.316 0.002 . 1 . . . . . 68 ARG H . 51711 1 264 . 1 . 1 68 68 ARG C C 13 176.055 0.000 . 1 . . . . . 68 ARG C . 51711 1 265 . 1 . 1 68 68 ARG CA C 13 56.403 0.000 . 1 . . . . . 68 ARG CA . 51711 1 266 . 1 . 1 68 68 ARG CB C 13 30.757 0.000 . 1 . . . . . 68 ARG CB . 51711 1 267 . 1 . 1 68 68 ARG CG C 13 26.961 0.000 . 1 . . . . . 68 ARG CG . 51711 1 268 . 1 . 1 68 68 ARG N N 15 121.673 0.036 . 1 . . . . . 68 ARG N . 51711 1 269 . 1 . 1 69 69 ASP H H 1 8.331 0.003 . 1 . . . . . 69 ASP H . 51711 1 270 . 1 . 1 69 69 ASP C C 13 176.148 0.013 . 1 . . . . . 69 ASP C . 51711 1 271 . 1 . 1 69 69 ASP CA C 13 54.419 0.029 . 1 . . . . . 69 ASP CA . 51711 1 272 . 1 . 1 69 69 ASP CB C 13 41.412 0.038 . 1 . . . . . 69 ASP CB . 51711 1 273 . 1 . 1 69 69 ASP N N 15 121.472 0.026 . 1 . . . . . 69 ASP N . 51711 1 274 . 1 . 1 70 70 ALA H H 1 8.232 0.003 . 1 . . . . . 70 ALA H . 51711 1 275 . 1 . 1 70 70 ALA C C 13 178.312 0.005 . 1 . . . . . 70 ALA C . 51711 1 276 . 1 . 1 70 70 ALA CA C 13 53.016 0.003 . 1 . . . . . 70 ALA CA . 51711 1 277 . 1 . 1 70 70 ALA CB C 13 19.191 0.000 . 1 . . . . . 70 ALA CB . 51711 1 278 . 1 . 1 70 70 ALA N N 15 125.012 0.040 . 1 . . . . . 70 ALA N . 51711 1 279 . 1 . 1 71 71 GLY H H 1 8.359 0.002 . 1 . . . . . 71 GLY H . 51711 1 280 . 1 . 1 71 71 GLY C C 13 174.500 0.002 . 1 . . . . . 71 GLY C . 51711 1 281 . 1 . 1 71 71 GLY CA C 13 45.524 0.026 . 1 . . . . . 71 GLY CA . 51711 1 282 . 1 . 1 71 71 GLY N N 15 107.804 0.021 . 1 . . . . . 71 GLY N . 51711 1 283 . 1 . 1 72 72 GLU H H 1 8.215 0.001 . 1 . . . . . 72 GLU H . 51711 1 284 . 1 . 1 72 72 GLU N N 15 120.829 0.015 . 1 . . . . . 72 GLU N . 51711 1 285 . 1 . 1 73 73 CYS H H 1 8.345 0.000 . 1 . . . . . 73 CYS H . 51711 1 286 . 1 . 1 73 73 CYS N N 15 119.818 0.007 . 1 . . . . . 73 CYS N . 51711 1 287 . 1 . 1 74 74 ASN H H 1 8.421 0.000 . 1 . . . . . 74 ASN H . 51711 1 288 . 1 . 1 74 74 ASN N N 15 121.139 0.000 . 1 . . . . . 74 ASN N . 51711 1 289 . 1 . 1 75 75 LYS H H 1 8.147 0.000 . 1 . . . . . 75 LYS H . 51711 1 290 . 1 . 1 75 75 LYS N N 15 121.956 0.000 . 1 . . . . . 75 LYS N . 51711 1 291 . 1 . 1 76 76 ARG H H 1 8.295 0.000 . 1 . . . . . 76 ARG H . 51711 1 292 . 1 . 1 76 76 ARG N N 15 122.155 0.024 . 1 . . . . . 76 ARG N . 51711 1 293 . 1 . 1 77 77 ASP H H 1 8.274 0.001 . 1 . . . . . 77 ASP H . 51711 1 294 . 1 . 1 77 77 ASP N N 15 121.309 0.010 . 1 . . . . . 77 ASP N . 51711 1 295 . 1 . 1 78 78 ASN H H 1 8.422 0.001 . 1 . . . . . 78 ASN H . 51711 1 296 . 1 . 1 78 78 ASN N N 15 119.977 0.029 . 1 . . . . . 78 ASN N . 51711 1 297 . 1 . 1 79 79 THR H H 1 8.236 0.001 . 1 . . . . . 79 THR H . 51711 1 298 . 1 . 1 79 79 THR CB C 13 69.705 0.000 . 1 . . . . . 79 THR CB . 51711 1 299 . 1 . 1 79 79 THR CG2 C 13 21.515 0.000 . 1 . . . . . 79 THR CG2 . 51711 1 300 . 1 . 1 79 79 THR N N 15 114.020 0.025 . 1 . . . . . 79 THR N . 51711 1 301 . 1 . 1 80 80 SER H H 1 8.304 0.002 . 1 . . . . . 80 SER H . 51711 1 302 . 1 . 1 80 80 SER N N 15 118.014 0.022 . 1 . . . . . 80 SER N . 51711 1 303 . 1 . 1 81 81 THR H H 1 8.108 0.000 . 1 . . . . . 81 THR H . 51711 1 304 . 1 . 1 81 81 THR N N 15 115.499 0.028 . 1 . . . . . 81 THR N . 51711 1 305 . 1 . 1 82 82 MET H H 1 8.252 0.003 . 1 . . . . . 82 MET H . 51711 1 306 . 1 . 1 82 82 MET C C 13 176.670 0.000 . 1 . . . . . 82 MET C . 51711 1 307 . 1 . 1 82 82 MET N N 15 122.290 0.042 . 1 . . . . . 82 MET N . 51711 1 308 . 1 . 1 83 83 GLY H H 1 8.294 0.001 . 1 . . . . . 83 GLY H . 51711 1 309 . 1 . 1 83 83 GLY N N 15 109.975 0.011 . 1 . . . . . 83 GLY N . 51711 1 310 . 1 . 1 84 84 GLY H H 1 8.121 0.005 . 1 . . . . . 84 GLY H . 51711 1 311 . 1 . 1 84 84 GLY N N 15 108.664 0.023 . 1 . . . . . 84 GLY N . 51711 1 312 . 1 . 1 85 85 PHE H H 1 8.115 0.003 . 1 . . . . . 85 PHE H . 51711 1 313 . 1 . 1 85 85 PHE N N 15 119.983 0.013 . 1 . . . . . 85 PHE N . 51711 1 314 . 1 . 1 86 86 GLY H H 1 8.291 0.002 . 1 . . . . . 86 GLY H . 51711 1 315 . 1 . 1 86 86 GLY C C 13 173.994 0.000 . 1 . . . . . 86 GLY C . 51711 1 316 . 1 . 1 86 86 GLY CA C 13 45.378 0.000 . 1 . . . . . 86 GLY CA . 51711 1 317 . 1 . 1 86 86 GLY N N 15 110.743 0.019 . 1 . . . . . 86 GLY N . 51711 1 318 . 1 . 1 87 87 VAL H H 1 7.913 0.004 . 1 . . . . . 87 VAL H . 51711 1 319 . 1 . 1 87 87 VAL C C 13 176.776 0.012 . 1 . . . . . 87 VAL C . 51711 1 320 . 1 . 1 87 87 VAL CA C 13 62.432 0.006 . 1 . . . . . 87 VAL CA . 51711 1 321 . 1 . 1 87 87 VAL CB C 13 32.606 0.015 . 1 . . . . . 87 VAL CB . 51711 1 322 . 1 . 1 87 87 VAL CG1 C 13 20.667 0.000 . 1 . . . . . 87 VAL CG1 . 51711 1 323 . 1 . 1 87 87 VAL N N 15 119.127 0.045 . 1 . . . . . 87 VAL N . 51711 1 324 . 1 . 1 88 88 GLY H H 1 8.462 0.002 . 1 . . . . . 88 GLY H . 51711 1 325 . 1 . 1 88 88 GLY CA C 13 45.390 0.000 . 1 . . . . . 88 GLY CA . 51711 1 326 . 1 . 1 88 88 GLY N N 15 112.572 0.025 . 1 . . . . . 88 GLY N . 51711 1 327 . 1 . 1 94 94 ARG CA C 13 56.530 0.000 . 1 . . . . . 94 ARG CA . 51711 1 328 . 1 . 1 94 94 ARG CB C 13 30.537 0.000 . 1 . . . . . 94 ARG CB . 51711 1 329 . 1 . 1 94 94 ARG CG C 13 27.059 0.000 . 1 . . . . . 94 ARG CG . 51711 1 330 . 1 . 1 95 95 GLY H H 1 8.278 0.004 . 1 . . . . . 95 GLY H . 51711 1 331 . 1 . 1 95 95 GLY C C 13 173.828 0.024 . 1 . . . . . 95 GLY C . 51711 1 332 . 1 . 1 95 95 GLY N N 15 109.350 0.018 . 1 . . . . . 95 GLY N . 51711 1 333 . 1 . 1 96 96 PHE H H 1 8.043 0.003 . 1 . . . . . 96 PHE H . 51711 1 334 . 1 . 1 96 96 PHE C C 13 175.898 0.018 . 1 . . . . . 96 PHE C . 51711 1 335 . 1 . 1 96 96 PHE CB C 13 39.685 0.000 . 1 . . . . . 96 PHE CB . 51711 1 336 . 1 . 1 96 96 PHE N N 15 120.038 0.024 . 1 . . . . . 96 PHE N . 51711 1 337 . 1 . 1 97 97 SER H H 1 8.261 0.003 . 1 . . . . . 97 SER H . 51711 1 338 . 1 . 1 97 97 SER C C 13 174.248 0.000 . 1 . . . . . 97 SER C . 51711 1 339 . 1 . 1 97 97 SER N N 15 117.216 0.029 . 1 . . . . . 97 SER N . 51711 1 340 . 1 . 1 98 98 ASN H H 1 8.388 0.005 . 1 . . . . . 98 ASN H . 51711 1 341 . 1 . 1 98 98 ASN C C 13 175.199 0.002 . 1 . . . . . 98 ASN C . 51711 1 342 . 1 . 1 98 98 ASN CA C 13 53.434 0.028 . 1 . . . . . 98 ASN CA . 51711 1 343 . 1 . 1 98 98 ASN CB C 13 38.865 0.034 . 1 . . . . . 98 ASN CB . 51711 1 344 . 1 . 1 98 98 ASN N N 15 121.056 0.024 . 1 . . . . . 98 ASN N . 51711 1 345 . 1 . 1 99 99 SER H H 1 8.189 0.003 . 1 . . . . . 99 SER H . 51711 1 346 . 1 . 1 99 99 SER C C 13 174.307 0.000 . 1 . . . . . 99 SER C . 51711 1 347 . 1 . 1 99 99 SER CA C 13 58.806 0.000 . 1 . . . . . 99 SER CA . 51711 1 348 . 1 . 1 99 99 SER CB C 13 63.892 0.007 . 1 . . . . . 99 SER CB . 51711 1 349 . 1 . 1 99 99 SER N N 15 116.065 0.033 . 1 . . . . . 99 SER N . 51711 1 350 . 1 . 1 100 100 ARG H H 1 8.198 0.002 . 1 . . . . . 100 ARG H . 51711 1 351 . 1 . 1 100 100 ARG C C 13 175.959 0.000 . 1 . . . . . 100 ARG C . 51711 1 352 . 1 . 1 100 100 ARG CA C 13 56.282 0.000 . 1 . . . . . 100 ARG CA . 51711 1 353 . 1 . 1 100 100 ARG CB C 13 30.582 0.000 . 1 . . . . . 100 ARG CB . 51711 1 354 . 1 . 1 100 100 ARG CG C 13 26.894 0.000 . 1 . . . . . 100 ARG CG . 51711 1 355 . 1 . 1 100 100 ARG N N 15 122.488 0.072 . 1 . . . . . 100 ARG N . 51711 1 356 . 1 . 1 101 101 PHE H H 1 8.154 0.003 . 1 . . . . . 101 PHE H . 51711 1 357 . 1 . 1 101 101 PHE C C 13 175.845 0.023 . 1 . . . . . 101 PHE C . 51711 1 358 . 1 . 1 101 101 PHE CA C 13 57.863 0.040 . 1 . . . . . 101 PHE CA . 51711 1 359 . 1 . 1 101 101 PHE CB C 13 39.479 0.040 . 1 . . . . . 101 PHE CB . 51711 1 360 . 1 . 1 101 101 PHE N N 15 121.018 0.035 . 1 . . . . . 101 PHE N . 51711 1 361 . 1 . 1 102 102 GLU H H 1 8.362 0.005 . 1 . . . . . 102 GLU H . 51711 1 362 . 1 . 1 102 102 GLU CA C 13 56.755 0.000 . 1 . . . . . 102 GLU CA . 51711 1 363 . 1 . 1 102 102 GLU CB C 13 30.452 0.000 . 1 . . . . . 102 GLU CB . 51711 1 364 . 1 . 1 102 102 GLU CG C 13 36.116 0.000 . 1 . . . . . 102 GLU CG . 51711 1 365 . 1 . 1 102 102 GLU N N 15 122.036 0.036 . 1 . . . . . 102 GLU N . 51711 1 366 . 1 . 1 103 103 ASP H H 1 8.193 0.004 . 1 . . . . . 103 ASP H . 51711 1 367 . 1 . 1 103 103 ASP CA C 13 54.462 0.036 . 1 . . . . . 103 ASP CA . 51711 1 368 . 1 . 1 103 103 ASP CB C 13 41.348 0.000 . 1 . . . . . 103 ASP CB . 51711 1 369 . 1 . 1 103 103 ASP N N 15 121.180 0.041 . 1 . . . . . 103 ASP N . 51711 1 370 . 1 . 1 104 104 GLY H H 1 8.207 0.003 . 1 . . . . . 104 GLY H . 51711 1 371 . 1 . 1 104 104 GLY N N 15 109.279 0.005 . 1 . . . . . 104 GLY N . 51711 1 372 . 1 . 1 105 105 ASP H H 1 8.216 0.001 . 1 . . . . . 105 ASP H . 51711 1 373 . 1 . 1 105 105 ASP C C 13 176.814 0.008 . 1 . . . . . 105 ASP C . 51711 1 374 . 1 . 1 105 105 ASP CA C 13 54.442 0.000 . 1 . . . . . 105 ASP CA . 51711 1 375 . 1 . 1 105 105 ASP CB C 13 41.553 0.000 . 1 . . . . . 105 ASP CB . 51711 1 376 . 1 . 1 105 105 ASP N N 15 120.792 0.037 . 1 . . . . . 105 ASP N . 51711 1 377 . 1 . 1 106 106 SER H H 1 8.349 0.003 . 1 . . . . . 106 SER H . 51711 1 378 . 1 . 1 106 106 SER C C 13 175.038 0.009 . 1 . . . . . 106 SER C . 51711 1 379 . 1 . 1 106 106 SER CA C 13 58.766 0.000 . 1 . . . . . 106 SER CA . 51711 1 380 . 1 . 1 106 106 SER CB C 13 63.730 0.000 . 1 . . . . . 106 SER CB . 51711 1 381 . 1 . 1 106 106 SER N N 15 117.170 0.041 . 1 . . . . . 106 SER N . 51711 1 382 . 1 . 1 107 107 SER H H 1 8.350 0.003 . 1 . . . . . 107 SER H . 51711 1 383 . 1 . 1 107 107 SER C C 13 175.155 0.000 . 1 . . . . . 107 SER C . 51711 1 384 . 1 . 1 107 107 SER CA C 13 59.469 0.000 . 1 . . . . . 107 SER CA . 51711 1 385 . 1 . 1 107 107 SER CB C 13 63.784 0.000 . 1 . . . . . 107 SER CB . 51711 1 386 . 1 . 1 107 107 SER N N 15 117.865 0.022 . 1 . . . . . 107 SER N . 51711 1 387 . 1 . 1 108 108 GLY H H 1 8.221 0.005 . 1 . . . . . 108 GLY H . 51711 1 388 . 1 . 1 108 108 GLY C C 13 174.009 0.007 . 1 . . . . . 108 GLY C . 51711 1 389 . 1 . 1 108 108 GLY CA C 13 45.503 0.000 . 1 . . . . . 108 GLY CA . 51711 1 390 . 1 . 1 108 108 GLY N N 15 110.312 0.024 . 1 . . . . . 108 GLY N . 51711 1 391 . 1 . 1 109 109 PHE H H 1 7.913 0.001 . 1 . . . . . 109 PHE H . 51711 1 392 . 1 . 1 109 109 PHE C C 13 175.527 0.006 . 1 . . . . . 109 PHE C . 51711 1 393 . 1 . 1 109 109 PHE CA C 13 58.076 0.000 . 1 . . . . . 109 PHE CA . 51711 1 394 . 1 . 1 109 109 PHE CB C 13 39.399 0.000 . 1 . . . . . 109 PHE CB . 51711 1 395 . 1 . 1 109 109 PHE N N 15 120.228 0.021 . 1 . . . . . 109 PHE N . 51711 1 396 . 1 . 1 110 110 TRP H H 1 7.985 0.002 . 1 . . . . . 110 TRP H . 51711 1 397 . 1 . 1 110 110 TRP C C 13 175.756 0.015 . 1 . . . . . 110 TRP C . 51711 1 398 . 1 . 1 110 110 TRP CA C 13 57.345 0.025 . 1 . . . . . 110 TRP CA . 51711 1 399 . 1 . 1 110 110 TRP CB C 13 29.580 0.000 . 1 . . . . . 110 TRP CB . 51711 1 400 . 1 . 1 110 110 TRP N N 15 122.116 0.060 . 1 . . . . . 110 TRP N . 51711 1 401 . 1 . 1 111 111 ARG H H 1 7.779 0.003 . 1 . . . . . 111 ARG H . 51711 1 402 . 1 . 1 111 111 ARG C C 13 175.745 0.014 . 1 . . . . . 111 ARG C . 51711 1 403 . 1 . 1 111 111 ARG CA C 13 56.031 0.000 . 1 . . . . . 111 ARG CA . 51711 1 404 . 1 . 1 111 111 ARG CB C 13 31.172 0.000 . 1 . . . . . 111 ARG CB . 51711 1 405 . 1 . 1 111 111 ARG N N 15 122.777 0.048 . 1 . . . . . 111 ARG N . 51711 1 406 . 1 . 1 112 112 GLU H H 1 8.239 0.004 . 1 . . . . . 112 GLU H . 51711 1 407 . 1 . 1 112 112 GLU C C 13 176.503 0.003 . 1 . . . . . 112 GLU C . 51711 1 408 . 1 . 1 112 112 GLU CA C 13 56.786 0.034 . 1 . . . . . 112 GLU CA . 51711 1 409 . 1 . 1 112 112 GLU CB C 13 30.257 0.074 . 1 . . . . . 112 GLU CB . 51711 1 410 . 1 . 1 112 112 GLU CG C 13 36.198 0.000 . 1 . . . . . 112 GLU CG . 51711 1 411 . 1 . 1 112 112 GLU N N 15 121.981 0.051 . 1 . . . . . 112 GLU N . 51711 1 412 . 1 . 1 113 113 SER H H 1 8.251 0.002 . 1 . . . . . 113 SER H . 51711 1 413 . 1 . 1 113 113 SER C C 13 174.582 0.005 . 1 . . . . . 113 SER C . 51711 1 414 . 1 . 1 113 113 SER CA C 13 58.315 0.000 . 1 . . . . . 113 SER CA . 51711 1 415 . 1 . 1 113 113 SER CB C 13 63.971 0.000 . 1 . . . . . 113 SER CB . 51711 1 416 . 1 . 1 113 113 SER N N 15 116.728 0.033 . 1 . . . . . 113 SER N . 51711 1 417 . 1 . 1 114 114 SER H H 1 8.309 0.003 . 1 . . . . . 114 SER H . 51711 1 418 . 1 . 1 114 114 SER C C 13 174.347 0.000 . 1 . . . . . 114 SER C . 51711 1 419 . 1 . 1 114 114 SER CB C 13 63.873 0.013 . 1 . . . . . 114 SER CB . 51711 1 420 . 1 . 1 114 114 SER N N 15 117.833 0.021 . 1 . . . . . 114 SER N . 51711 1 421 . 1 . 1 115 115 ASN H H 1 8.401 0.004 . 1 . . . . . 115 ASN H . 51711 1 422 . 1 . 1 115 115 ASN C C 13 174.975 0.025 . 1 . . . . . 115 ASN C . 51711 1 423 . 1 . 1 115 115 ASN CA C 13 53.461 0.000 . 1 . . . . . 115 ASN CA . 51711 1 424 . 1 . 1 115 115 ASN CB C 13 39.004 0.078 . 1 . . . . . 115 ASN CB . 51711 1 425 . 1 . 1 115 115 ASN N N 15 120.800 0.079 . 1 . . . . . 115 ASN N . 51711 1 426 . 1 . 1 116 116 ASP H H 1 8.291 0.005 . 1 . . . . . 116 ASP H . 51711 1 427 . 1 . 1 116 116 ASP C C 13 176.129 0.000 . 1 . . . . . 116 ASP C . 51711 1 428 . 1 . 1 116 116 ASP CA C 13 54.615 0.000 . 1 . . . . . 116 ASP CA . 51711 1 429 . 1 . 1 116 116 ASP CB C 13 41.110 0.000 . 1 . . . . . 116 ASP CB . 51711 1 430 . 1 . 1 116 116 ASP N N 15 120.963 0.060 . 1 . . . . . 116 ASP N . 51711 1 431 . 1 . 1 117 117 CYS H H 1 8.210 0.003 . 1 . . . . . 117 CYS H . 51711 1 432 . 1 . 1 117 117 CYS C C 13 174.738 0.016 . 1 . . . . . 117 CYS C . 51711 1 433 . 1 . 1 117 117 CYS CA C 13 58.624 0.019 . 1 . . . . . 117 CYS CA . 51711 1 434 . 1 . 1 117 117 CYS CB C 13 28.144 0.000 . 1 . . . . . 117 CYS CB . 51711 1 435 . 1 . 1 117 117 CYS N N 15 118.900 0.029 . 1 . . . . . 117 CYS N . 51711 1 436 . 1 . 1 118 118 GLU H H 1 8.436 0.003 . 1 . . . . . 118 GLU H . 51711 1 437 . 1 . 1 118 118 GLU C C 13 176.071 0.004 . 1 . . . . . 118 GLU C . 51711 1 438 . 1 . 1 118 118 GLU CA C 13 56.862 0.000 . 1 . . . . . 118 GLU CA . 51711 1 439 . 1 . 1 118 118 GLU CB C 13 30.287 0.000 . 1 . . . . . 118 GLU CB . 51711 1 440 . 1 . 1 118 118 GLU N N 15 123.044 0.039 . 1 . . . . . 118 GLU N . 51711 1 441 . 1 . 1 119 119 ASP H H 1 8.271 0.001 . 1 . . . . . 119 ASP H . 51711 1 442 . 1 . 1 119 119 ASP C C 13 175.485 0.013 . 1 . . . . . 119 ASP C . 51711 1 443 . 1 . 1 119 119 ASP CA C 13 54.359 0.000 . 1 . . . . . 119 ASP CA . 51711 1 444 . 1 . 1 119 119 ASP CB C 13 41.223 0.000 . 1 . . . . . 119 ASP CB . 51711 1 445 . 1 . 1 119 119 ASP N N 15 120.864 0.046 . 1 . . . . . 119 ASP N . 51711 1 446 . 1 . 1 120 120 ASN H H 1 8.155 0.004 . 1 . . . . . 120 ASN H . 51711 1 447 . 1 . 1 120 120 ASN C C 13 173.604 0.000 . 1 . . . . . 120 ASN C . 51711 1 448 . 1 . 1 120 120 ASN CA C 13 51.492 0.000 . 1 . . . . . 120 ASN CA . 51711 1 449 . 1 . 1 120 120 ASN CB C 13 39.123 0.000 . 1 . . . . . 120 ASN CB . 51711 1 450 . 1 . 1 120 120 ASN N N 15 119.493 0.025 . 1 . . . . . 120 ASN N . 51711 1 451 . 1 . 1 121 121 PRO C C 13 177.558 0.000 . 1 . . . . . 121 PRO C . 51711 1 452 . 1 . 1 121 121 PRO CA C 13 64.066 0.000 . 1 . . . . . 121 PRO CA . 51711 1 453 . 1 . 1 121 121 PRO CB C 13 32.162 0.000 . 1 . . . . . 121 PRO CB . 51711 1 454 . 1 . 1 121 121 PRO CG C 13 27.280 0.000 . 1 . . . . . 121 PRO CG . 51711 1 455 . 1 . 1 122 122 THR H H 1 8.086 0.002 . 1 . . . . . 122 THR H . 51711 1 456 . 1 . 1 122 122 THR C C 13 174.972 0.004 . 1 . . . . . 122 THR C . 51711 1 457 . 1 . 1 122 122 THR CA C 13 62.586 0.024 . 1 . . . . . 122 THR CA . 51711 1 458 . 1 . 1 122 122 THR CB C 13 69.345 0.043 . 1 . . . . . 122 THR CB . 51711 1 459 . 1 . 1 122 122 THR CG2 C 13 21.668 0.000 . 1 . . . . . 122 THR CG2 . 51711 1 460 . 1 . 1 122 122 THR N N 15 112.479 0.036 . 1 . . . . . 122 THR N . 51711 1 461 . 1 . 1 123 123 ARG H H 1 7.937 0.003 . 1 . . . . . 123 ARG H . 51711 1 462 . 1 . 1 123 123 ARG C C 13 176.026 0.000 . 1 . . . . . 123 ARG C . 51711 1 463 . 1 . 1 123 123 ARG CA C 13 56.468 0.057 . 1 . . . . . 123 ARG CA . 51711 1 464 . 1 . 1 123 123 ARG CB C 13 30.575 0.005 . 1 . . . . . 123 ARG CB . 51711 1 465 . 1 . 1 123 123 ARG CG C 13 27.001 0.000 . 1 . . . . . 123 ARG CG . 51711 1 466 . 1 . 1 123 123 ARG N N 15 122.304 0.033 . 1 . . . . . 123 ARG N . 51711 1 467 . 1 . 1 124 124 ASN H H 1 8.286 0.004 . 1 . . . . . 124 ASN H . 51711 1 468 . 1 . 1 124 124 ASN N N 15 119.349 0.035 . 1 . . . . . 124 ASN N . 51711 1 469 . 1 . 1 135 135 ASP CA C 13 54.348 0.000 . 1 . . . . . 135 ASP CA . 51711 1 470 . 1 . 1 135 135 ASP CB C 13 41.387 0.000 . 1 . . . . . 135 ASP CB . 51711 1 471 . 1 . 1 136 136 GLY H H 1 8.266 0.002 . 1 . . . . . 136 GLY H . 51711 1 472 . 1 . 1 136 136 GLY C C 13 174.078 0.015 . 1 . . . . . 136 GLY C . 51711 1 473 . 1 . 1 136 136 GLY CA C 13 45.584 0.000 . 1 . . . . . 136 GLY CA . 51711 1 474 . 1 . 1 136 136 GLY N N 15 109.338 0.029 . 1 . . . . . 136 GLY N . 51711 1 475 . 1 . 1 137 137 ASN H H 1 8.324 0.003 . 1 . . . . . 137 ASN H . 51711 1 476 . 1 . 1 137 137 ASN C C 13 175.085 0.000 . 1 . . . . . 137 ASN C . 51711 1 477 . 1 . 1 137 137 ASN CA C 13 53.283 0.000 . 1 . . . . . 137 ASN CA . 51711 1 478 . 1 . 1 137 137 ASN CB C 13 38.881 0.000 . 1 . . . . . 137 ASN CB . 51711 1 479 . 1 . 1 137 137 ASN N N 15 118.956 0.035 . 1 . . . . . 137 ASN N . 51711 1 480 . 1 . 1 138 138 ASN H H 1 8.393 0.003 . 1 . . . . . 138 ASN H . 51711 1 481 . 1 . 1 138 138 ASN C C 13 175.406 0.000 . 1 . . . . . 138 ASN C . 51711 1 482 . 1 . 1 138 138 ASN CA C 13 53.494 0.000 . 1 . . . . . 138 ASN CA . 51711 1 483 . 1 . 1 138 138 ASN CB C 13 38.831 0.000 . 1 . . . . . 138 ASN CB . 51711 1 484 . 1 . 1 138 138 ASN N N 15 119.530 0.024 . 1 . . . . . 138 ASN N . 51711 1 485 . 1 . 1 139 139 SER H H 1 8.293 0.002 . 1 . . . . . 139 SER H . 51711 1 486 . 1 . 1 139 139 SER C C 13 174.760 0.008 . 1 . . . . . 139 SER C . 51711 1 487 . 1 . 1 139 139 SER CA C 13 58.949 0.034 . 1 . . . . . 139 SER CA . 51711 1 488 . 1 . 1 139 139 SER CB C 13 63.832 0.000 . 1 . . . . . 139 SER CB . 51711 1 489 . 1 . 1 139 139 SER N N 15 116.528 0.017 . 1 . . . . . 139 SER N . 51711 1 490 . 1 . 1 140 140 GLU H H 1 8.409 0.004 . 1 . . . . . 140 GLU H . 51711 1 491 . 1 . 1 140 140 GLU C C 13 176.421 0.004 . 1 . . . . . 140 GLU C . 51711 1 492 . 1 . 1 140 140 GLU CA C 13 56.822 0.000 . 1 . . . . . 140 GLU CA . 51711 1 493 . 1 . 1 140 140 GLU CB C 13 30.102 0.000 . 1 . . . . . 140 GLU CB . 51711 1 494 . 1 . 1 140 140 GLU CG C 13 36.194 0.000 . 1 . . . . . 140 GLU CG . 51711 1 495 . 1 . 1 140 140 GLU N N 15 122.703 0.033 . 1 . . . . . 140 GLU N . 51711 1 496 . 1 . 1 141 141 ALA H H 1 8.190 0.005 . 1 . . . . . 141 ALA H . 51711 1 497 . 1 . 1 141 141 ALA C C 13 177.605 0.005 . 1 . . . . . 141 ALA C . 51711 1 498 . 1 . 1 141 141 ALA CA C 13 52.690 0.000 . 1 . . . . . 141 ALA CA . 51711 1 499 . 1 . 1 141 141 ALA CB C 13 19.287 0.012 . 1 . . . . . 141 ALA CB . 51711 1 500 . 1 . 1 141 141 ALA N N 15 124.581 0.075 . 1 . . . . . 141 ALA N . 51711 1 501 . 1 . 1 142 142 SER H H 1 8.136 0.003 . 1 . . . . . 142 SER H . 51711 1 502 . 1 . 1 142 142 SER C C 13 174.596 0.000 . 1 . . . . . 142 SER C . 51711 1 503 . 1 . 1 142 142 SER CA C 13 58.231 0.033 . 1 . . . . . 142 SER CA . 51711 1 504 . 1 . 1 142 142 SER CB C 13 64.182 0.045 . 1 . . . . . 142 SER CB . 51711 1 505 . 1 . 1 142 142 SER N N 15 114.650 0.059 . 1 . . . . . 142 SER N . 51711 1 506 . 1 . 1 143 143 GLY H H 1 8.126 0.002 . 1 . . . . . 143 GLY H . 51711 1 507 . 1 . 1 143 143 GLY C C 13 172.162 0.000 . 1 . . . . . 143 GLY C . 51711 1 508 . 1 . 1 143 143 GLY CA C 13 45.033 0.000 . 1 . . . . . 143 GLY CA . 51711 1 509 . 1 . 1 143 143 GLY N N 15 110.652 0.007 . 1 . . . . . 143 GLY N . 51711 1 510 . 1 . 1 158 158 GLY C C 13 174.365 0.000 . 1 . . . . . 158 GLY C . 51711 1 511 . 1 . 1 159 159 GLY H H 1 8.129 0.000 . 1 . . . . . 159 GLY H . 51711 1 512 . 1 . 1 159 159 GLY C C 13 173.922 0.021 . 1 . . . . . 159 GLY C . 51711 1 513 . 1 . 1 159 159 GLY N N 15 108.719 0.014 . 1 . . . . . 159 GLY N . 51711 1 514 . 1 . 1 160 160 PHE H H 1 8.119 0.004 . 1 . . . . . 160 PHE H . 51711 1 515 . 1 . 1 160 160 PHE C C 13 176.268 0.013 . 1 . . . . . 160 PHE C . 51711 1 516 . 1 . 1 160 160 PHE CB C 13 39.622 0.000 . 1 . . . . . 160 PHE CB . 51711 1 517 . 1 . 1 160 160 PHE N N 15 120.005 0.019 . 1 . . . . . 160 PHE N . 51711 1 518 . 1 . 1 161 161 GLY H H 1 8.354 0.003 . 1 . . . . . 161 GLY H . 51711 1 519 . 1 . 1 161 161 GLY C C 13 174.082 0.021 . 1 . . . . . 161 GLY C . 51711 1 520 . 1 . 1 161 161 GLY CA C 13 45.354 0.000 . 1 . . . . . 161 GLY CA . 51711 1 521 . 1 . 1 161 161 GLY N N 15 110.747 0.055 . 1 . . . . . 161 GLY N . 51711 1 522 . 1 . 1 162 162 LEU H H 1 8.076 0.004 . 1 . . . . . 162 LEU H . 51711 1 523 . 1 . 1 162 162 LEU C C 13 177.848 0.040 . 1 . . . . . 162 LEU C . 51711 1 524 . 1 . 1 162 162 LEU CA C 13 55.249 0.000 . 1 . . . . . 162 LEU CA . 51711 1 525 . 1 . 1 162 162 LEU CB C 13 42.392 0.000 . 1 . . . . . 162 LEU CB . 51711 1 526 . 1 . 1 162 162 LEU N N 15 121.856 0.025 . 1 . . . . . 162 LEU N . 51711 1 527 . 1 . 1 163 163 GLY H H 1 8.416 0.003 . 1 . . . . . 163 GLY H . 51711 1 528 . 1 . 1 163 163 GLY C C 13 173.793 0.008 . 1 . . . . . 163 GLY C . 51711 1 529 . 1 . 1 163 163 GLY CA C 13 45.240 0.000 . 1 . . . . . 163 GLY CA . 51711 1 530 . 1 . 1 163 163 GLY N N 15 109.838 0.027 . 1 . . . . . 163 GLY N . 51711 1 531 . 1 . 1 164 164 SER H H 1 8.102 0.001 . 1 . . . . . 164 SER H . 51711 1 532 . 1 . 1 164 164 SER CA C 13 56.318 0.000 . 1 . . . . . 164 SER CA . 51711 1 533 . 1 . 1 164 164 SER CB C 13 63.614 0.000 . 1 . . . . . 164 SER CB . 51711 1 534 . 1 . 1 164 164 SER N N 15 116.877 0.040 . 1 . . . . . 164 SER N . 51711 1 535 . 1 . 1 165 165 PRO C C 13 176.600 0.000 . 1 . . . . . 165 PRO C . 51711 1 536 . 1 . 1 165 165 PRO CA C 13 63.584 0.000 . 1 . . . . . 165 PRO CA . 51711 1 537 . 1 . 1 165 165 PRO CB C 13 32.003 0.000 . 1 . . . . . 165 PRO CB . 51711 1 538 . 1 . 1 165 165 PRO CG C 13 27.074 0.000 . 1 . . . . . 165 PRO CG . 51711 1 539 . 1 . 1 166 166 ASN H H 1 8.334 0.010 . 1 . . . . . 166 ASN H . 51711 1 540 . 1 . 1 166 166 ASN C C 13 174.886 0.010 . 1 . . . . . 166 ASN C . 51711 1 541 . 1 . 1 166 166 ASN CA C 13 53.328 0.028 . 1 . . . . . 166 ASN CA . 51711 1 542 . 1 . 1 166 166 ASN CB C 13 39.009 0.017 . 1 . . . . . 166 ASN CB . 51711 1 543 . 1 . 1 166 166 ASN N N 15 118.182 0.062 . 1 . . . . . 166 ASN N . 51711 1 544 . 1 . 1 167 167 ASN H H 1 8.281 0.003 . 1 . . . . . 167 ASN H . 51711 1 545 . 1 . 1 167 167 ASN C C 13 174.743 0.015 . 1 . . . . . 167 ASN C . 51711 1 546 . 1 . 1 167 167 ASN CA C 13 53.443 0.000 . 1 . . . . . 167 ASN CA . 51711 1 547 . 1 . 1 167 167 ASN N N 15 119.420 0.041 . 1 . . . . . 167 ASN N . 51711 1 548 . 1 . 1 168 168 ASP H H 1 8.281 0.004 . 1 . . . . . 168 ASP H . 51711 1 549 . 1 . 1 168 168 ASP C C 13 175.840 0.012 . 1 . . . . . 168 ASP C . 51711 1 550 . 1 . 1 168 168 ASP CA C 13 54.640 0.037 . 1 . . . . . 168 ASP CA . 51711 1 551 . 1 . 1 168 168 ASP CB C 13 41.056 0.000 . 1 . . . . . 168 ASP CB . 51711 1 552 . 1 . 1 168 168 ASP N N 15 120.567 0.037 . 1 . . . . . 168 ASP N . 51711 1 553 . 1 . 1 169 169 LEU H H 1 7.937 0.004 . 1 . . . . . 169 LEU H . 51711 1 554 . 1 . 1 169 169 LEU C C 13 176.720 0.001 . 1 . . . . . 169 LEU C . 51711 1 555 . 1 . 1 169 169 LEU CA C 13 54.845 0.000 . 1 . . . . . 169 LEU CA . 51711 1 556 . 1 . 1 169 169 LEU CB C 13 42.695 0.055 . 1 . . . . . 169 LEU CB . 51711 1 557 . 1 . 1 169 169 LEU N N 15 121.337 0.036 . 1 . . . . . 169 LEU N . 51711 1 558 . 1 . 1 170 170 ASP H H 1 8.358 0.002 . 1 . . . . . 170 ASP H . 51711 1 559 . 1 . 1 170 170 ASP C C 13 174.899 0.000 . 1 . . . . . 170 ASP C . 51711 1 560 . 1 . 1 170 170 ASP CA C 13 52.257 0.000 . 1 . . . . . 170 ASP CA . 51711 1 561 . 1 . 1 170 170 ASP CB C 13 41.317 0.000 . 1 . . . . . 170 ASP CB . 51711 1 562 . 1 . 1 170 170 ASP N N 15 123.175 0.050 . 1 . . . . . 170 ASP N . 51711 1 563 . 1 . 1 171 171 PRO C C 13 177.354 0.000 . 1 . . . . . 171 PRO C . 51711 1 564 . 1 . 1 171 171 PRO CA C 13 64.073 0.000 . 1 . . . . . 171 PRO CA . 51711 1 565 . 1 . 1 171 171 PRO CB C 13 32.185 0.000 . 1 . . . . . 171 PRO CB . 51711 1 566 . 1 . 1 172 172 ASP H H 1 8.350 0.003 . 1 . . . . . 172 ASP H . 51711 1 567 . 1 . 1 172 172 ASP C C 13 177.027 0.016 . 1 . . . . . 172 ASP C . 51711 1 568 . 1 . 1 172 172 ASP CA C 13 55.246 0.037 . 1 . . . . . 172 ASP CA . 51711 1 569 . 1 . 1 172 172 ASP CB C 13 41.031 0.010 . 1 . . . . . 172 ASP CB . 51711 1 570 . 1 . 1 172 172 ASP N N 15 119.377 0.042 . 1 . . . . . 172 ASP N . 51711 1 571 . 1 . 1 173 173 GLU H H 1 8.138 0.002 . 1 . . . . . 173 GLU H . 51711 1 572 . 1 . 1 173 173 GLU C C 13 177.146 0.043 . 1 . . . . . 173 GLU C . 51711 1 573 . 1 . 1 173 173 GLU CA C 13 57.553 0.026 . 1 . . . . . 173 GLU CA . 51711 1 574 . 1 . 1 173 173 GLU CB C 13 29.947 0.037 . 1 . . . . . 173 GLU CB . 51711 1 575 . 1 . 1 173 173 GLU CG C 13 36.353 0.000 . 1 . . . . . 173 GLU CG . 51711 1 576 . 1 . 1 173 173 GLU N N 15 121.311 0.062 . 1 . . . . . 173 GLU N . 51711 1 577 . 1 . 1 174 174 CYS H H 1 8.246 0.002 . 1 . . . . . 174 CYS H . 51711 1 578 . 1 . 1 174 174 CYS C C 13 175.372 0.005 . 1 . . . . . 174 CYS C . 51711 1 579 . 1 . 1 174 174 CYS CA C 13 59.784 0.009 . 1 . . . . . 174 CYS CA . 51711 1 580 . 1 . 1 174 174 CYS CB C 13 27.588 0.051 . 1 . . . . . 174 CYS CB . 51711 1 581 . 1 . 1 174 174 CYS N N 15 118.742 0.070 . 1 . . . . . 174 CYS N . 51711 1 582 . 1 . 1 175 175 MET H H 1 8.228 0.003 . 1 . . . . . 175 MET H . 51711 1 583 . 1 . 1 175 175 MET C C 13 176.693 0.000 . 1 . . . . . 175 MET C . 51711 1 584 . 1 . 1 175 175 MET CA C 13 56.442 0.000 . 1 . . . . . 175 MET CA . 51711 1 585 . 1 . 1 175 175 MET CB C 13 30.721 0.000 . 1 . . . . . 175 MET CB . 51711 1 586 . 1 . 1 175 175 MET N N 15 121.483 0.018 . 1 . . . . . 175 MET N . 51711 1 587 . 1 . 1 177 177 ARG H H 1 8.228 0.005 . 1 . . . . . 177 ARG H . 51711 1 588 . 1 . 1 177 177 ARG C C 13 176.690 0.000 . 1 . . . . . 177 ARG C . 51711 1 589 . 1 . 1 177 177 ARG CA C 13 56.437 0.000 . 1 . . . . . 177 ARG CA . 51711 1 590 . 1 . 1 177 177 ARG CB C 13 30.668 0.000 . 1 . . . . . 177 ARG CB . 51711 1 591 . 1 . 1 177 177 ARG CG C 13 27.235 0.000 . 1 . . . . . 177 ARG CG . 51711 1 592 . 1 . 1 177 177 ARG N N 15 121.405 0.027 . 1 . . . . . 177 ARG N . 51711 1 593 . 1 . 1 178 178 THR H H 1 8.083 0.003 . 1 . . . . . 178 THR H . 51711 1 594 . 1 . 1 178 178 THR C C 13 175.183 0.022 . 1 . . . . . 178 THR C . 51711 1 595 . 1 . 1 178 178 THR CA C 13 62.107 0.009 . 1 . . . . . 178 THR CA . 51711 1 596 . 1 . 1 178 178 THR CB C 13 70.001 0.035 . 1 . . . . . 178 THR CB . 51711 1 597 . 1 . 1 178 178 THR N N 15 113.886 0.033 . 1 . . . . . 178 THR N . 51711 1 598 . 1 . 1 179 179 GLY H H 1 8.356 0.005 . 1 . . . . . 179 GLY H . 51711 1 599 . 1 . 1 179 179 GLY CA C 13 45.557 0.000 . 1 . . . . . 179 GLY CA . 51711 1 600 . 1 . 1 179 179 GLY N N 15 111.289 0.042 . 1 . . . . . 179 GLY N . 51711 1 601 . 1 . 1 180 180 GLY H H 1 8.212 0.003 . 1 . . . . . 180 GLY H . 51711 1 602 . 1 . 1 180 180 GLY CA C 13 45.354 0.000 . 1 . . . . . 180 GLY CA . 51711 1 603 . 1 . 1 180 180 GLY N N 15 108.712 0.008 . 1 . . . . . 180 GLY N . 51711 1 604 . 1 . 1 181 181 LEU H H 1 8.075 0.003 . 1 . . . . . 181 LEU H . 51711 1 605 . 1 . 1 181 181 LEU C C 13 177.277 0.013 . 1 . . . . . 181 LEU C . 51711 1 606 . 1 . 1 181 181 LEU N N 15 121.852 0.031 . 1 . . . . . 181 LEU N . 51711 1 607 . 1 . 1 182 182 PHE H H 1 8.224 0.003 . 1 . . . . . 182 PHE H . 51711 1 608 . 1 . 1 182 182 PHE C C 13 176.415 0.033 . 1 . . . . . 182 PHE C . 51711 1 609 . 1 . 1 182 182 PHE CA C 13 57.880 0.033 . 1 . . . . . 182 PHE CA . 51711 1 610 . 1 . 1 182 182 PHE CB C 13 39.485 0.001 . 1 . . . . . 182 PHE CB . 51711 1 611 . 1 . 1 182 182 PHE N N 15 120.174 0.057 . 1 . . . . . 182 PHE N . 51711 1 612 . 1 . 1 183 183 GLY H H 1 8.213 0.002 . 1 . . . . . 183 GLY H . 51711 1 613 . 1 . 1 183 183 GLY C C 13 174.186 0.000 . 1 . . . . . 183 GLY C . 51711 1 614 . 1 . 1 183 183 GLY CA C 13 45.528 0.000 . 1 . . . . . 183 GLY CA . 51711 1 615 . 1 . 1 183 183 GLY N N 15 110.296 0.029 . 1 . . . . . 183 GLY N . 51711 1 616 . 1 . 1 184 184 SER H H 1 8.153 0.001 . 1 . . . . . 184 SER H . 51711 1 617 . 1 . 1 184 184 SER C C 13 174.476 0.000 . 1 . . . . . 184 SER C . 51711 1 618 . 1 . 1 184 184 SER CA C 13 58.511 0.000 . 1 . . . . . 184 SER CA . 51711 1 619 . 1 . 1 184 184 SER CB C 13 63.970 0.000 . 1 . . . . . 184 SER CB . 51711 1 620 . 1 . 1 184 184 SER N N 15 115.927 0.022 . 1 . . . . . 184 SER N . 51711 1 621 . 1 . 1 185 185 ARG H H 1 8.291 0.002 . 1 . . . . . 185 ARG H . 51711 1 622 . 1 . 1 185 185 ARG C C 13 175.888 0.015 . 1 . . . . . 185 ARG C . 51711 1 623 . 1 . 1 185 185 ARG CA C 13 56.004 0.000 . 1 . . . . . 185 ARG CA . 51711 1 624 . 1 . 1 185 185 ARG CB C 13 30.756 0.000 . 1 . . . . . 185 ARG CB . 51711 1 625 . 1 . 1 185 185 ARG CG C 13 27.063 0.000 . 1 . . . . . 185 ARG CG . 51711 1 626 . 1 . 1 185 185 ARG N N 15 122.750 0.045 . 1 . . . . . 185 ARG N . 51711 1 627 . 1 . 1 186 186 ARG H H 1 8.254 0.002 . 1 . . . . . 186 ARG H . 51711 1 628 . 1 . 1 186 186 ARG C C 13 174.115 0.000 . 1 . . . . . 186 ARG C . 51711 1 629 . 1 . 1 186 186 ARG CA C 13 54.018 0.000 . 1 . . . . . 186 ARG CA . 51711 1 630 . 1 . 1 186 186 ARG CB C 13 30.127 0.000 . 1 . . . . . 186 ARG CB . 51711 1 631 . 1 . 1 186 186 ARG N N 15 123.611 0.047 . 1 . . . . . 186 ARG N . 51711 1 632 . 1 . 1 187 187 PRO C C 13 176.574 0.000 . 1 . . . . . 187 PRO C . 51711 1 633 . 1 . 1 187 187 PRO CA C 13 63.112 0.000 . 1 . . . . . 187 PRO CA . 51711 1 634 . 1 . 1 187 187 PRO CB C 13 31.983 0.000 . 1 . . . . . 187 PRO CB . 51711 1 635 . 1 . 1 188 188 VAL H H 1 8.188 0.002 . 1 . . . . . 188 VAL H . 51711 1 636 . 1 . 1 188 188 VAL C C 13 176.174 0.006 . 1 . . . . . 188 VAL C . 51711 1 637 . 1 . 1 188 188 VAL CA C 13 62.376 0.002 . 1 . . . . . 188 VAL CA . 51711 1 638 . 1 . 1 188 188 VAL CB C 13 32.724 0.000 . 1 . . . . . 188 VAL CB . 51711 1 639 . 1 . 1 188 188 VAL CG1 C 13 20.876 0.000 . 1 . . . . . 188 VAL CG1 . 51711 1 640 . 1 . 1 188 188 VAL CG2 C 13 20.876 0.000 . 1 . . . . . 188 VAL CG2 . 51711 1 641 . 1 . 1 188 188 VAL N N 15 121.056 0.025 . 1 . . . . . 188 VAL N . 51711 1 642 . 1 . 1 189 189 LEU H H 1 8.326 0.003 . 1 . . . . . 189 LEU H . 51711 1 643 . 1 . 1 189 189 LEU C C 13 177.177 0.004 . 1 . . . . . 189 LEU C . 51711 1 644 . 1 . 1 189 189 LEU CA C 13 54.888 0.017 . 1 . . . . . 189 LEU CA . 51711 1 645 . 1 . 1 189 189 LEU CB C 13 42.215 0.110 . 1 . . . . . 189 LEU CB . 51711 1 646 . 1 . 1 189 189 LEU N N 15 126.522 0.046 . 1 . . . . . 189 LEU N . 51711 1 647 . 1 . 1 190 190 SER H H 1 8.267 0.004 . 1 . . . . . 190 SER H . 51711 1 648 . 1 . 1 190 190 SER C C 13 174.973 0.012 . 1 . . . . . 190 SER C . 51711 1 649 . 1 . 1 190 190 SER CA C 13 58.334 0.000 . 1 . . . . . 190 SER CA . 51711 1 650 . 1 . 1 190 190 SER CB C 13 63.986 0.000 . 1 . . . . . 190 SER CB . 51711 1 651 . 1 . 1 190 190 SER N N 15 117.057 0.038 . 1 . . . . . 190 SER N . 51711 1 652 . 1 . 1 191 191 GLY H H 1 8.444 0.005 . 1 . . . . . 191 GLY H . 51711 1 653 . 1 . 1 191 191 GLY C C 13 174.498 0.005 . 1 . . . . . 191 GLY C . 51711 1 654 . 1 . 1 191 191 GLY CA C 13 45.536 0.000 . 1 . . . . . 191 GLY CA . 51711 1 655 . 1 . 1 191 191 GLY N N 15 111.260 0.012 . 1 . . . . . 191 GLY N . 51711 1 656 . 1 . 1 192 192 THR H H 1 8.123 0.002 . 1 . . . . . 192 THR H . 51711 1 657 . 1 . 1 192 192 THR C C 13 175.378 0.000 . 1 . . . . . 192 THR C . 51711 1 658 . 1 . 1 192 192 THR CA C 13 61.903 0.002 . 1 . . . . . 192 THR CA . 51711 1 659 . 1 . 1 192 192 THR CB C 13 69.849 0.029 . 1 . . . . . 192 THR CB . 51711 1 660 . 1 . 1 192 192 THR CG2 C 13 21.528 0.000 . 1 . . . . . 192 THR CG2 . 51711 1 661 . 1 . 1 192 192 THR N N 15 112.964 0.027 . 1 . . . . . 192 THR N . 51711 1 662 . 1 . 1 193 193 GLY H H 1 8.467 0.004 . 1 . . . . . 193 GLY H . 51711 1 663 . 1 . 1 193 193 GLY C C 13 174.080 0.014 . 1 . . . . . 193 GLY C . 51711 1 664 . 1 . 1 193 193 GLY CA C 13 45.512 0.000 . 1 . . . . . 193 GLY CA . 51711 1 665 . 1 . 1 193 193 GLY N N 15 111.414 0.052 . 1 . . . . . 193 GLY N . 51711 1 666 . 1 . 1 194 194 ASN H H 1 8.326 0.002 . 1 . . . . . 194 ASN H . 51711 1 667 . 1 . 1 194 194 ASN C C 13 175.788 0.003 . 1 . . . . . 194 ASN C . 51711 1 668 . 1 . 1 194 194 ASN CA C 13 53.283 0.000 . 1 . . . . . 194 ASN CA . 51711 1 669 . 1 . 1 194 194 ASN CB C 13 39.098 0.000 . 1 . . . . . 194 ASN CB . 51711 1 670 . 1 . 1 194 194 ASN N N 15 118.987 0.030 . 1 . . . . . 194 ASN N . 51711 1 671 . 1 . 1 195 195 GLY H H 1 8.428 0.003 . 1 . . . . . 195 GLY H . 51711 1 672 . 1 . 1 195 195 GLY C C 13 174.056 0.000 . 1 . . . . . 195 GLY C . 51711 1 673 . 1 . 1 195 195 GLY CA C 13 45.523 0.000 . 1 . . . . . 195 GLY CA . 51711 1 674 . 1 . 1 195 195 GLY N N 15 109.684 0.023 . 1 . . . . . 195 GLY N . 51711 1 675 . 1 . 1 196 196 ASP H H 1 8.221 0.003 . 1 . . . . . 196 ASP H . 51711 1 676 . 1 . 1 196 196 ASP C C 13 177.010 0.000 . 1 . . . . . 196 ASP C . 51711 1 677 . 1 . 1 196 196 ASP CA C 13 54.368 0.056 . 1 . . . . . 196 ASP CA . 51711 1 678 . 1 . 1 196 196 ASP CB C 13 41.208 0.000 . 1 . . . . . 196 ASP CB . 51711 1 679 . 1 . 1 196 196 ASP N N 15 120.824 0.025 . 1 . . . . . 196 ASP N . 51711 1 680 . 1 . 1 197 197 THR H H 1 8.230 0.001 . 1 . . . . . 197 THR H . 51711 1 681 . 1 . 1 197 197 THR C C 13 175.248 0.005 . 1 . . . . . 197 THR C . 51711 1 682 . 1 . 1 197 197 THR CA C 13 61.931 0.000 . 1 . . . . . 197 THR CA . 51711 1 683 . 1 . 1 197 197 THR CB C 13 69.611 0.004 . 1 . . . . . 197 THR CB . 51711 1 684 . 1 . 1 197 197 THR CG2 C 13 21.481 0.000 . 1 . . . . . 197 THR CG2 . 51711 1 685 . 1 . 1 197 197 THR N N 15 114.760 0.035 . 1 . . . . . 197 THR N . 51711 1 686 . 1 . 1 198 198 SER H H 1 8.405 0.003 . 1 . . . . . 198 SER H . 51711 1 687 . 1 . 1 198 198 SER CA C 13 59.351 0.047 . 1 . . . . . 198 SER CA . 51711 1 688 . 1 . 1 198 198 SER CB C 13 63.644 0.013 . 1 . . . . . 198 SER CB . 51711 1 689 . 1 . 1 198 198 SER N N 15 118.487 0.035 . 1 . . . . . 198 SER N . 51711 1 690 . 1 . 1 199 199 GLN H H 1 8.288 0.003 . 1 . . . . . 199 GLN H . 51711 1 691 . 1 . 1 199 199 GLN C C 13 176.202 0.000 . 1 . . . . . 199 GLN C . 51711 1 692 . 1 . 1 199 199 GLN CA C 13 56.206 0.000 . 1 . . . . . 199 GLN CA . 51711 1 693 . 1 . 1 199 199 GLN CB C 13 29.380 0.000 . 1 . . . . . 199 GLN CB . 51711 1 694 . 1 . 1 199 199 GLN CG C 13 33.546 0.000 . 1 . . . . . 199 GLN CG . 51711 1 695 . 1 . 1 199 199 GLN N N 15 121.785 0.052 . 1 . . . . . 199 GLN N . 51711 1 696 . 1 . 1 200 200 SER H H 1 8.219 0.003 . 1 . . . . . 200 SER H . 51711 1 697 . 1 . 1 200 200 SER CA C 13 58.601 0.000 . 1 . . . . . 200 SER CA . 51711 1 698 . 1 . 1 200 200 SER CB C 13 63.742 0.087 . 1 . . . . . 200 SER CB . 51711 1 699 . 1 . 1 200 200 SER N N 15 116.712 0.046 . 1 . . . . . 200 SER N . 51711 1 700 . 1 . 1 201 201 ARG H H 1 8.326 0.001 . 1 . . . . . 201 ARG H . 51711 1 701 . 1 . 1 201 201 ARG C C 13 176.434 0.023 . 1 . . . . . 201 ARG C . 51711 1 702 . 1 . 1 201 201 ARG CA C 13 56.159 0.048 . 1 . . . . . 201 ARG CA . 51711 1 703 . 1 . 1 201 201 ARG CB C 13 30.812 0.000 . 1 . . . . . 201 ARG CB . 51711 1 704 . 1 . 1 201 201 ARG CG C 13 27.022 0.000 . 1 . . . . . 201 ARG CG . 51711 1 705 . 1 . 1 201 201 ARG N N 15 123.124 0.019 . 1 . . . . . 201 ARG N . 51711 1 706 . 1 . 1 202 202 SER H H 1 8.301 0.004 . 1 . . . . . 202 SER H . 51711 1 707 . 1 . 1 202 202 SER C C 13 175.067 0.012 . 1 . . . . . 202 SER C . 51711 1 708 . 1 . 1 202 202 SER CA C 13 58.483 0.000 . 1 . . . . . 202 SER CA . 51711 1 709 . 1 . 1 202 202 SER CB C 13 63.992 0.000 . 1 . . . . . 202 SER CB . 51711 1 710 . 1 . 1 202 202 SER N N 15 116.938 0.042 . 1 . . . . . 202 SER N . 51711 1 711 . 1 . 1 203 203 GLY H H 1 8.410 0.002 . 1 . . . . . 203 GLY H . 51711 1 712 . 1 . 1 203 203 GLY C C 13 174.357 0.002 . 1 . . . . . 203 GLY C . 51711 1 713 . 1 . 1 203 203 GLY CA C 13 45.355 0.000 . 1 . . . . . 203 GLY CA . 51711 1 714 . 1 . 1 203 203 GLY N N 15 111.304 0.024 . 1 . . . . . 203 GLY N . 51711 1 715 . 1 . 1 204 204 SER H H 1 8.302 0.003 . 1 . . . . . 204 SER H . 51711 1 716 . 1 . 1 204 204 SER C C 13 175.269 0.000 . 1 . . . . . 204 SER C . 51711 1 717 . 1 . 1 204 204 SER CA C 13 58.654 0.071 . 1 . . . . . 204 SER CA . 51711 1 718 . 1 . 1 204 204 SER CB C 13 64.053 0.056 . 1 . . . . . 204 SER CB . 51711 1 719 . 1 . 1 204 204 SER N N 15 116.102 0.064 . 1 . . . . . 204 SER N . 51711 1 720 . 1 . 1 205 205 GLY H H 1 8.560 0.001 . 1 . . . . . 205 GLY H . 51711 1 721 . 1 . 1 205 205 GLY C C 13 174.493 0.013 . 1 . . . . . 205 GLY C . 51711 1 722 . 1 . 1 205 205 GLY CA C 13 45.606 0.000 . 1 . . . . . 205 GLY CA . 51711 1 723 . 1 . 1 205 205 GLY N N 15 111.579 0.013 . 1 . . . . . 205 GLY N . 51711 1 724 . 1 . 1 206 206 SER H H 1 8.190 0.004 . 1 . . . . . 206 SER H . 51711 1 725 . 1 . 1 206 206 SER C C 13 174.752 0.021 . 1 . . . . . 206 SER C . 51711 1 726 . 1 . 1 206 206 SER CA C 13 58.610 0.019 . 1 . . . . . 206 SER CA . 51711 1 727 . 1 . 1 206 206 SER CB C 13 63.912 0.027 . 1 . . . . . 206 SER CB . 51711 1 728 . 1 . 1 206 206 SER N N 15 115.988 0.051 . 1 . . . . . 206 SER N . 51711 1 729 . 1 . 1 207 207 GLU H H 1 8.554 0.002 . 1 . . . . . 207 GLU H . 51711 1 730 . 1 . 1 207 207 GLU C C 13 176.704 0.006 . 1 . . . . . 207 GLU C . 51711 1 731 . 1 . 1 207 207 GLU CA C 13 56.982 0.000 . 1 . . . . . 207 GLU CA . 51711 1 732 . 1 . 1 207 207 GLU CB C 13 29.862 0.000 . 1 . . . . . 207 GLU CB . 51711 1 733 . 1 . 1 207 207 GLU CG C 13 36.323 0.000 . 1 . . . . . 207 GLU CG . 51711 1 734 . 1 . 1 207 207 GLU N N 15 123.119 0.026 . 1 . . . . . 207 GLU N . 51711 1 735 . 1 . 1 208 208 ARG H H 1 8.316 0.001 . 1 . . . . . 208 ARG H . 51711 1 736 . 1 . 1 208 208 ARG CA C 13 56.528 0.000 . 1 . . . . . 208 ARG CA . 51711 1 737 . 1 . 1 208 208 ARG N N 15 121.796 0.025 . 1 . . . . . 208 ARG N . 51711 1 738 . 1 . 1 209 209 GLY H H 1 8.347 0.003 . 1 . . . . . 209 GLY H . 51711 1 739 . 1 . 1 209 209 GLY CA C 13 45.476 0.000 . 1 . . . . . 209 GLY CA . 51711 1 740 . 1 . 1 209 209 GLY N N 15 110.008 0.077 . 1 . . . . . 209 GLY N . 51711 1 741 . 1 . 1 210 210 GLY H H 1 8.197 0.003 . 1 . . . . . 210 GLY H . 51711 1 742 . 1 . 1 210 210 GLY C C 13 173.905 0.000 . 1 . . . . . 210 GLY C . 51711 1 743 . 1 . 1 210 210 GLY CA C 13 45.208 0.000 . 1 . . . . . 210 GLY CA . 51711 1 744 . 1 . 1 210 210 GLY N N 15 108.971 0.051 . 1 . . . . . 210 GLY N . 51711 1 745 . 1 . 1 211 211 TYR H H 1 8.073 0.001 . 1 . . . . . 211 TYR H . 51711 1 746 . 1 . 1 211 211 TYR C C 13 175.902 0.007 . 1 . . . . . 211 TYR C . 51711 1 747 . 1 . 1 211 211 TYR CA C 13 58.192 0.003 . 1 . . . . . 211 TYR CA . 51711 1 748 . 1 . 1 211 211 TYR CB C 13 38.810 0.054 . 1 . . . . . 211 TYR CB . 51711 1 749 . 1 . 1 211 211 TYR N N 15 120.665 0.032 . 1 . . . . . 211 TYR N . 51711 1 750 . 1 . 1 212 212 LYS H H 1 8.261 0.001 . 1 . . . . . 212 LYS H . 51711 1 751 . 1 . 1 212 212 LYS C C 13 176.498 0.010 . 1 . . . . . 212 LYS C . 51711 1 752 . 1 . 1 212 212 LYS CA C 13 56.249 0.010 . 1 . . . . . 212 LYS CA . 51711 1 753 . 1 . 1 212 212 LYS CB C 13 33.037 0.037 . 1 . . . . . 212 LYS CB . 51711 1 754 . 1 . 1 212 212 LYS CG C 13 24.560 0.000 . 1 . . . . . 212 LYS CG . 51711 1 755 . 1 . 1 212 212 LYS N N 15 124.424 0.037 . 1 . . . . . 212 LYS N . 51711 1 756 . 1 . 1 213 213 GLY H H 1 7.808 0.001 . 1 . . . . . 213 GLY H . 51711 1 757 . 1 . 1 213 213 GLY C C 13 173.869 0.004 . 1 . . . . . 213 GLY C . 51711 1 758 . 1 . 1 213 213 GLY CA C 13 45.302 0.029 . 1 . . . . . 213 GLY CA . 51711 1 759 . 1 . 1 213 213 GLY N N 15 109.524 0.016 . 1 . . . . . 213 GLY N . 51711 1 760 . 1 . 1 214 214 LEU H H 1 8.083 0.003 . 1 . . . . . 214 LEU H . 51711 1 761 . 1 . 1 214 214 LEU C C 13 177.197 0.015 . 1 . . . . . 214 LEU C . 51711 1 762 . 1 . 1 214 214 LEU CA C 13 55.400 0.011 . 1 . . . . . 214 LEU CA . 51711 1 763 . 1 . 1 214 214 LEU CB C 13 42.562 0.010 . 1 . . . . . 214 LEU CB . 51711 1 764 . 1 . 1 214 214 LEU N N 15 121.709 0.077 . 1 . . . . . 214 LEU N . 51711 1 765 . 1 . 1 215 215 ASN H H 1 8.463 0.003 . 1 . . . . . 215 ASN H . 51711 1 766 . 1 . 1 215 215 ASN C C 13 175.044 0.044 . 1 . . . . . 215 ASN C . 51711 1 767 . 1 . 1 215 215 ASN CA C 13 53.412 0.019 . 1 . . . . . 215 ASN CA . 51711 1 768 . 1 . 1 215 215 ASN CB C 13 38.931 0.006 . 1 . . . . . 215 ASN CB . 51711 1 769 . 1 . 1 215 215 ASN N N 15 119.383 0.037 . 1 . . . . . 215 ASN N . 51711 1 770 . 1 . 1 216 216 GLU H H 1 8.291 0.001 . 1 . . . . . 216 GLU H . 51711 1 771 . 1 . 1 216 216 GLU C C 13 176.341 0.000 . 1 . . . . . 216 GLU C . 51711 1 772 . 1 . 1 216 216 GLU CB C 13 30.355 0.000 . 1 . . . . . 216 GLU CB . 51711 1 773 . 1 . 1 216 216 GLU CG C 13 36.353 0.000 . 1 . . . . . 216 GLU CG . 51711 1 774 . 1 . 1 216 216 GLU N N 15 121.095 0.040 . 1 . . . . . 216 GLU N . 51711 1 775 . 1 . 1 217 217 GLU H H 1 8.366 0.002 . 1 . . . . . 217 GLU H . 51711 1 776 . 1 . 1 217 217 GLU C C 13 176.410 0.016 . 1 . . . . . 217 GLU C . 51711 1 777 . 1 . 1 217 217 GLU CA C 13 56.719 0.036 . 1 . . . . . 217 GLU CA . 51711 1 778 . 1 . 1 217 217 GLU CB C 13 30.302 0.000 . 1 . . . . . 217 GLU CB . 51711 1 779 . 1 . 1 217 217 GLU CG C 13 36.201 0.000 . 1 . . . . . 217 GLU CG . 51711 1 780 . 1 . 1 217 217 GLU N N 15 121.989 0.022 . 1 . . . . . 217 GLU N . 51711 1 781 . 1 . 1 218 218 VAL H H 1 8.101 0.002 . 1 . . . . . 218 VAL H . 51711 1 782 . 1 . 1 218 218 VAL C C 13 176.181 0.020 . 1 . . . . . 218 VAL C . 51711 1 783 . 1 . 1 218 218 VAL CA C 13 62.583 0.003 . 1 . . . . . 218 VAL CA . 51711 1 784 . 1 . 1 218 218 VAL CB C 13 32.546 0.076 . 1 . . . . . 218 VAL CB . 51711 1 785 . 1 . 1 218 218 VAL CG1 C 13 20.952 0.000 . 1 . . . . . 218 VAL CG1 . 51711 1 786 . 1 . 1 218 218 VAL CG2 C 13 20.952 0.000 . 1 . . . . . 218 VAL CG2 . 51711 1 787 . 1 . 1 218 218 VAL N N 15 121.799 0.033 . 1 . . . . . 218 VAL N . 51711 1 788 . 1 . 1 219 219 ILE H H 1 8.226 0.002 . 1 . . . . . 219 ILE H . 51711 1 789 . 1 . 1 219 219 ILE C C 13 176.602 0.001 . 1 . . . . . 219 ILE C . 51711 1 790 . 1 . 1 219 219 ILE CA C 13 61.127 0.004 . 1 . . . . . 219 ILE CA . 51711 1 791 . 1 . 1 219 219 ILE CB C 13 38.495 0.067 . 1 . . . . . 219 ILE CB . 51711 1 792 . 1 . 1 219 219 ILE CG1 C 13 27.284 0.000 . 1 . . . . . 219 ILE CG1 . 51711 1 793 . 1 . 1 219 219 ILE CG2 C 13 17.305 0.000 . 1 . . . . . 219 ILE CG2 . 51711 1 794 . 1 . 1 219 219 ILE N N 15 125.113 0.036 . 1 . . . . . 219 ILE N . 51711 1 795 . 1 . 1 220 220 THR H H 1 8.217 0.002 . 1 . . . . . 220 THR H . 51711 1 796 . 1 . 1 220 220 THR C C 13 175.143 0.016 . 1 . . . . . 220 THR C . 51711 1 797 . 1 . 1 220 220 THR CA C 13 62.028 0.018 . 1 . . . . . 220 THR CA . 51711 1 798 . 1 . 1 220 220 THR CB C 13 69.942 0.026 . 1 . . . . . 220 THR CB . 51711 1 799 . 1 . 1 220 220 THR CG2 C 13 21.537 0.000 . 1 . . . . . 220 THR CG2 . 51711 1 800 . 1 . 1 220 220 THR N N 15 118.431 0.036 . 1 . . . . . 220 THR N . 51711 1 801 . 1 . 1 221 221 GLY H H 1 8.361 0.003 . 1 . . . . . 221 GLY H . 51711 1 802 . 1 . 1 221 221 GLY C C 13 174.313 0.000 . 1 . . . . . 221 GLY C . 51711 1 803 . 1 . 1 221 221 GLY CA C 13 45.536 0.021 . 1 . . . . . 221 GLY CA . 51711 1 804 . 1 . 1 221 221 GLY N N 15 111.512 0.075 . 1 . . . . . 221 GLY N . 51711 1 805 . 1 . 1 222 222 SER H H 1 8.262 0.004 . 1 . . . . . 222 SER H . 51711 1 806 . 1 . 1 222 222 SER C C 13 175.196 0.000 . 1 . . . . . 222 SER C . 51711 1 807 . 1 . 1 222 222 SER CA C 13 58.312 0.000 . 1 . . . . . 222 SER CA . 51711 1 808 . 1 . 1 222 222 SER CB C 13 63.953 0.001 . 1 . . . . . 222 SER CB . 51711 1 809 . 1 . 1 222 222 SER N N 15 115.922 0.050 . 1 . . . . . 222 SER N . 51711 1 810 . 1 . 1 223 223 GLY H H 1 8.462 0.008 . 1 . . . . . 223 GLY H . 51711 1 811 . 1 . 1 223 223 GLY C C 13 174.273 0.020 . 1 . . . . . 223 GLY C . 51711 1 812 . 1 . 1 223 223 GLY CA C 13 45.512 0.000 . 1 . . . . . 223 GLY CA . 51711 1 813 . 1 . 1 223 223 GLY N N 15 111.194 0.039 . 1 . . . . . 223 GLY N . 51711 1 814 . 1 . 1 224 224 LYS H H 1 8.114 0.005 . 1 . . . . . 224 LYS H . 51711 1 815 . 1 . 1 224 224 LYS C C 13 176.485 0.008 . 1 . . . . . 224 LYS C . 51711 1 816 . 1 . 1 224 224 LYS CA C 13 56.458 0.000 . 1 . . . . . 224 LYS CA . 51711 1 817 . 1 . 1 224 224 LYS CB C 13 32.904 0.000 . 1 . . . . . 224 LYS CB . 51711 1 818 . 1 . 1 224 224 LYS CG C 13 24.563 0.000 . 1 . . . . . 224 LYS CG . 51711 1 819 . 1 . 1 224 224 LYS N N 15 121.000 0.023 . 1 . . . . . 224 LYS N . 51711 1 820 . 1 . 1 225 225 ASN H H 1 8.418 0.006 . 1 . . . . . 225 ASN H . 51711 1 821 . 1 . 1 225 225 ASN C C 13 175.277 0.057 . 1 . . . . . 225 ASN C . 51711 1 822 . 1 . 1 225 225 ASN CA C 13 53.332 0.051 . 1 . . . . . 225 ASN CA . 51711 1 823 . 1 . 1 225 225 ASN CB C 13 38.856 0.000 . 1 . . . . . 225 ASN CB . 51711 1 824 . 1 . 1 225 225 ASN N N 15 119.626 0.037 . 1 . . . . . 225 ASN N . 51711 1 825 . 1 . 1 226 226 SER H H 1 8.112 0.003 . 1 . . . . . 226 SER H . 51711 1 826 . 1 . 1 226 226 SER C C 13 174.131 0.000 . 1 . . . . . 226 SER C . 51711 1 827 . 1 . 1 226 226 SER CA C 13 58.522 0.046 . 1 . . . . . 226 SER CA . 51711 1 828 . 1 . 1 226 226 SER CB C 13 63.754 0.000 . 1 . . . . . 226 SER CB . 51711 1 829 . 1 . 1 226 226 SER N N 15 116.168 0.037 . 1 . . . . . 226 SER N . 51711 1 830 . 1 . 1 227 227 TRP H H 1 8.044 0.001 . 1 . . . . . 227 TRP H . 51711 1 831 . 1 . 1 227 227 TRP C C 13 175.929 0.022 . 1 . . . . . 227 TRP C . 51711 1 832 . 1 . 1 227 227 TRP CA C 13 57.484 0.017 . 1 . . . . . 227 TRP CA . 51711 1 833 . 1 . 1 227 227 TRP CB C 13 29.446 0.000 . 1 . . . . . 227 TRP CB . 51711 1 834 . 1 . 1 227 227 TRP N N 15 123.021 0.015 . 1 . . . . . 227 TRP N . 51711 1 835 . 1 . 1 228 228 LYS H H 1 7.881 0.001 . 1 . . . . . 228 LYS H . 51711 1 836 . 1 . 1 228 228 LYS C C 13 175.966 0.008 . 1 . . . . . 228 LYS C . 51711 1 837 . 1 . 1 228 228 LYS CA C 13 56.185 0.017 . 1 . . . . . 228 LYS CA . 51711 1 838 . 1 . 1 228 228 LYS CB C 13 33.301 0.000 . 1 . . . . . 228 LYS CB . 51711 1 839 . 1 . 1 228 228 LYS CG C 13 24.162 0.000 . 1 . . . . . 228 LYS CG . 51711 1 840 . 1 . 1 228 228 LYS N N 15 123.294 0.022 . 1 . . . . . 228 LYS N . 51711 1 841 . 1 . 1 229 229 SER H H 1 8.184 0.002 . 1 . . . . . 229 SER H . 51711 1 842 . 1 . 1 229 229 SER C C 13 174.871 0.018 . 1 . . . . . 229 SER C . 51711 1 843 . 1 . 1 229 229 SER CA C 13 58.369 0.025 . 1 . . . . . 229 SER CA . 51711 1 844 . 1 . 1 229 229 SER CB C 13 63.916 0.000 . 1 . . . . . 229 SER CB . 51711 1 845 . 1 . 1 229 229 SER N N 15 117.404 0.026 . 1 . . . . . 229 SER N . 51711 1 846 . 1 . 1 230 230 GLU H H 1 8.475 0.003 . 1 . . . . . 230 GLU H . 51711 1 847 . 1 . 1 230 230 GLU C C 13 176.422 0.003 . 1 . . . . . 230 GLU C . 51711 1 848 . 1 . 1 230 230 GLU CA C 13 56.873 0.016 . 1 . . . . . 230 GLU CA . 51711 1 849 . 1 . 1 230 230 GLU CB C 13 30.095 0.000 . 1 . . . . . 230 GLU CB . 51711 1 850 . 1 . 1 230 230 GLU CG C 13 36.194 0.000 . 1 . . . . . 230 GLU CG . 51711 1 851 . 1 . 1 230 230 GLU N N 15 123.223 0.039 . 1 . . . . . 230 GLU N . 51711 1 852 . 1 . 1 231 231 ALA H H 1 8.198 0.003 . 1 . . . . . 231 ALA H . 51711 1 853 . 1 . 1 231 231 ALA C C 13 177.854 0.011 . 1 . . . . . 231 ALA C . 51711 1 854 . 1 . 1 231 231 ALA CA C 13 52.691 0.005 . 1 . . . . . 231 ALA CA . 51711 1 855 . 1 . 1 231 231 ALA CB C 13 19.208 0.000 . 1 . . . . . 231 ALA CB . 51711 1 856 . 1 . 1 231 231 ALA N N 15 124.382 0.055 . 1 . . . . . 231 ALA N . 51711 1 857 . 1 . 1 232 232 GLU H H 1 8.230 0.001 . 1 . . . . . 232 GLU H . 51711 1 858 . 1 . 1 232 232 GLU C C 13 177.007 0.017 . 1 . . . . . 232 GLU C . 51711 1 859 . 1 . 1 232 232 GLU CA C 13 56.666 0.000 . 1 . . . . . 232 GLU CA . 51711 1 860 . 1 . 1 232 232 GLU CB C 13 30.379 0.000 . 1 . . . . . 232 GLU CB . 51711 1 861 . 1 . 1 232 232 GLU CG C 13 36.224 0.000 . 1 . . . . . 232 GLU CG . 51711 1 862 . 1 . 1 232 232 GLU N N 15 120.286 0.019 . 1 . . . . . 232 GLU N . 51711 1 863 . 1 . 1 233 233 GLY H H 1 8.345 0.002 . 1 . . . . . 233 GLY H . 51711 1 864 . 1 . 1 233 233 GLY C C 13 174.620 0.001 . 1 . . . . . 233 GLY C . 51711 1 865 . 1 . 1 233 233 GLY CA C 13 45.438 0.000 . 1 . . . . . 233 GLY CA . 51711 1 866 . 1 . 1 233 233 GLY N N 15 110.102 0.025 . 1 . . . . . 233 GLY N . 51711 1 867 . 1 . 1 234 234 GLY H H 1 8.201 0.004 . 1 . . . . . 234 GLY H . 51711 1 868 . 1 . 1 234 234 GLY C C 13 174.066 0.024 . 1 . . . . . 234 GLY C . 51711 1 869 . 1 . 1 234 234 GLY CA C 13 45.265 0.000 . 1 . . . . . 234 GLY CA . 51711 1 870 . 1 . 1 234 234 GLY N N 15 109.023 0.048 . 1 . . . . . 234 GLY N . 51711 1 871 . 1 . 1 235 235 GLU H H 1 8.349 0.002 . 1 . . . . . 235 GLU H . 51711 1 872 . 1 . 1 235 235 GLU C C 13 175.844 0.005 . 1 . . . . . 235 GLU C . 51711 1 873 . 1 . 1 235 235 GLU CA C 13 56.614 0.010 . 1 . . . . . 235 GLU CA . 51711 1 874 . 1 . 1 235 235 GLU CB C 13 30.527 0.000 . 1 . . . . . 235 GLU CB . 51711 1 875 . 1 . 1 235 235 GLU CG C 13 36.249 0.000 . 1 . . . . . 235 GLU CG . 51711 1 876 . 1 . 1 235 235 GLU N N 15 121.139 0.019 . 1 . . . . . 235 GLU N . 51711 1 877 . 1 . 1 236 236 SER H H 1 7.988 0.002 . 1 . . . . . 236 SER H . 51711 1 878 . 1 . 1 236 236 SER C C 13 178.615 0.000 . 1 . . . . . 236 SER C . 51711 1 879 . 1 . 1 236 236 SER CA C 13 60.035 0.000 . 1 . . . . . 236 SER CA . 51711 1 880 . 1 . 1 236 236 SER CB C 13 64.901 0.000 . 1 . . . . . 236 SER CB . 51711 1 881 . 1 . 1 236 236 SER N N 15 122.609 0.040 . 1 . . . . . 236 SER N . 51711 1 stop_ save_