data_34692 ####################### # Entry information # ####################### save_entry_information _Entry.Sf_category entry_information _Entry.Sf_framecode entry_information _Entry.ID 34692 _Entry.Title ; NMR structure of Npl3 RRM12 bound to the AUCCAGUGGAA RNA ; _Entry.Type macromolecule _Entry.Version_type original _Entry.Submission_date 2021-11-26 _Entry.Accession_date 2021-11-26 _Entry.Last_release_date 2021-12-21 _Entry.Original_release_date 2021-12-21 _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 NMR' _Entry.Source_data_format . _Entry.Source_data_format_version . _Entry.Generated_software_name . _Entry.Generated_software_version . _Entry.Generated_software_ID . _Entry.Generated_software_label . _Entry.Generated_date . _Entry.DOI . _Entry.UUID . _Entry.Related_coordinate_file_name . _Entry.Details . _Entry.BMRB_internal_directory_name . loop_ _Entry_author.Ordinal _Entry_author.Given_name _Entry_author.Family_name _Entry_author.First_initial _Entry_author.Middle_initials _Entry_author.Family_title _Entry_author.ORCID _Entry_author.Entry_ID 1 F. Allain F. H.-T. . . 34692 2 A. Clery A. . . . 34692 3 A. Moursy A. . . . 34692 stop_ loop_ _Struct_keywords.Keywords _Struct_keywords.Text _Struct_keywords.Entry_ID 'RNA BINDING PROTEIN' . 34692 RRM . 34692 U2snRNA . 34692 'protein-RNA complex' . 34692 splicing . 34692 yeast . 34692 stop_ loop_ _Data_set.Type _Data_set.Count _Data_set.Entry_ID assigned_chemical_shifts 1 34692 stop_ loop_ _Datum.Type _Datum.Count _Datum.Entry_ID '13C chemical shifts' 356 34692 '15N chemical shifts' 146 34692 '1H chemical shifts' 618 34692 stop_ loop_ _Release.Release_number _Release.Format_type _Release.Format_version _Release.Date _Release.Submission_date _Release.Type _Release.Author _Release.Detail _Release.Entry_ID 2 . . 2023-12-15 2021-11-26 update BMRB 'update entry citation' 34692 1 . . 2022-12-16 2021-11-26 original author 'original release' 34692 stop_ loop_ _Related_entries.Database_name _Related_entries.Database_accession_code _Related_entries.Relationship _Related_entries.Entry_ID PDB 7QDE 'BMRB Entry Tracking System' 34692 stop_ save_ ############### # Citations # ############### save_citation_1 _Citation.Sf_category citations _Citation.Sf_framecode citation_1 _Citation.Entry_ID 34692 _Citation.ID 1 _Citation.Name . _Citation.Class 'entry citation' _Citation.CAS_abstract_code . _Citation.MEDLINE_UI_code . _Citation.PubMed_ID 37935663 _Citation.DOI . _Citation.Full_citation . _Citation.Title ; RNA recognition by Npl3p reveals U2 snRNA-binding compatible with a chaperone role during splicing ; _Citation.Status published _Citation.Type journal _Citation.Journal_abbrev 'Nat. Commun.' _Citation.Journal_name_full 'Nature communications' _Citation.Journal_volume 14 _Citation.Journal_issue 1 _Citation.Journal_ASTM . _Citation.Journal_ISSN 2041-1723 _Citation.Journal_CSD 0353 _Citation.Book_title . _Citation.Book_chapter_title . _Citation.Book_volume . _Citation.Book_series . _Citation.Book_publisher . _Citation.Book_publisher_city . _Citation.Book_ISBN . _Citation.Conference_title . _Citation.Conference_site . _Citation.Conference_state_province . _Citation.Conference_country . _Citation.Conference_start_date . _Citation.Conference_end_date . _Citation.Conference_abstract_number . _Citation.Thesis_institution . _Citation.Thesis_institution_city . _Citation.Thesis_institution_country . _Citation.WWW_URL . _Citation.Page_first 7166 _Citation.Page_last 7166 _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 Ahmed Moursy A. . . . 34692 1 2 Antoine Clery A. . . . 34692 1 3 Stefan Gerhardy S. . . . 34692 1 4 Katharina Betz K. M. . . 34692 1 5 Sanjana Rao S. . . . 34692 1 6 Jaroslaw Mazur J. . . . 34692 1 7 Sebastien Campagne S. . . . 34692 1 8 Irene Beusch I. . . . 34692 1 9 Malgorzata Duszczyk M. M. . . 34692 1 10 Mark Robinson M. D. . . 34692 1 11 'Vikram Govind' Panse V. G. . . 34692 1 12 'Frederic H-T' Allain F. H. . . 34692 1 stop_ save_ ############################################# # Molecular system (assembly) description # ############################################# save_assembly _Assembly.Sf_category assembly _Assembly.Sf_framecode assembly _Assembly.Entry_ID 34692 _Assembly.ID 1 _Assembly.Name 'Nucleolar protein 3/RNA Complex' _Assembly.BMRB_code . _Assembly.Number_of_components . _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Non_standard_bonds . _Assembly.Ambiguous_conformational_states . _Assembly.Ambiguous_chem_comp_sites . _Assembly.Molecules_in_chemical_exchange . _Assembly.Paramagnetic no _Assembly.Thiol_state . _Assembly.Molecular_mass . _Assembly.Enzyme_commission_number . _Assembly.Details . _Assembly.DB_query_date . _Assembly.DB_query_revised_last_date . loop_ _Entity_assembly.ID _Entity_assembly.Entity_assembly_name _Entity_assembly.Entity_ID _Entity_assembly.Entity_label _Entity_assembly.Asym_ID _Entity_assembly.PDB_chain_ID _Entity_assembly.Experimental_data_reported _Entity_assembly.Physical_state _Entity_assembly.Conformational_isomer _Entity_assembly.Chemical_exchange_state _Entity_assembly.Magnetic_equivalence_group_code _Entity_assembly.Role _Entity_assembly.Details _Entity_assembly.Entry_ID _Entity_assembly.Assembly_ID 1 unit_1 1 $entity_1 A A yes . . . . . . 34692 1 2 unit_2 2 $entity_2 B B yes . . . . . . 34692 1 stop_ save_ #################################### # Biological polymers and ligands # #################################### save_entity_1 _Entity.Sf_category entity _Entity.Sf_framecode entity_1 _Entity.Entry_ID 34692 _Entity.ID 1 _Entity.BMRB_code . _Entity.Name entity_1 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polyribonucleotide _Entity.Polymer_type_details . _Entity.Polymer_strand_ID A _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; AUCCAGUGGAA ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 11 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state 'not present' _Entity.Src_method man _Entity.Parent_entity_ID 1 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 3530.178 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details 'synthetic RNA from horizon' _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_comp_index.ID _Entity_comp_index.Auth_seq_ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 103 A . 34692 1 2 104 U . 34692 1 3 105 C . 34692 1 4 106 C . 34692 1 5 107 A . 34692 1 6 108 G . 34692 1 7 109 U . 34692 1 8 110 G . 34692 1 9 111 G . 34692 1 10 112 A . 34692 1 11 113 A . 34692 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 . A 1 1 34692 1 . U 2 2 34692 1 . C 3 3 34692 1 . C 4 4 34692 1 . A 5 5 34692 1 . G 6 6 34692 1 . U 7 7 34692 1 . G 8 8 34692 1 . G 9 9 34692 1 . A 10 10 34692 1 . A 11 11 34692 1 stop_ save_ save_entity_2 _Entity.Sf_category entity _Entity.Sf_framecode entity_2 _Entity.Entry_ID 34692 _Entity.ID 2 _Entity.BMRB_code . _Entity.Name entity_2 _Entity.Type polymer _Entity.Polymer_common_type . _Entity.Polymer_type polypeptide(L) _Entity.Polymer_type_details . _Entity.Polymer_strand_ID B _Entity.Polymer_seq_one_letter_code_can . _Entity.Polymer_seq_one_letter_code ; MHHRQEGELSNTRLFVRPFP LDVQESELNEIFGPFGPMKE VKILNGFAFVEFEEAESAAK AIEEVHGKSFANQPLEVVYS KLPAKRYRITMKNLPEGCSW QDLKDLARENSLETTFSSVN TRDFDGTGALEFPSEEILVE ALERLNNIEFRGSVITVERD DNPPPIRRS ; _Entity.Target_identifier . _Entity.Polymer_author_defined_seq . _Entity.Polymer_author_seq_details . _Entity.Ambiguous_conformational_states . _Entity.Ambiguous_chem_comp_sites . _Entity.Nstd_monomer no _Entity.Nstd_chirality . _Entity.Nstd_linkage no _Entity.Nonpolymer_comp_ID . _Entity.Nonpolymer_comp_label . _Entity.Number_of_monomers 169 _Entity.Number_of_nonpolymer_components . _Entity.Paramagnetic no _Entity.Thiol_state . _Entity.Src_method man _Entity.Parent_entity_ID 2 _Entity.Fragment . _Entity.Mutation . _Entity.EC_number . _Entity.Calc_isoelectric_point . _Entity.Formula_weight 19294.615 _Entity.Formula_weight_exptl . _Entity.Formula_weight_exptl_meth . _Entity.Details . _Entity.DB_query_date . _Entity.DB_query_revised_last_date . loop_ _Entity_common_name.Name _Entity_common_name.Type _Entity_common_name.Entry_ID _Entity_common_name.Entity_ID 'Mitochondrial targeting suppressor 1 protein' common 34692 2 'Nuclear polyadenylated RNA-binding protein 1' common 34692 2 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 1 114 MET . 34692 2 2 115 HIS . 34692 2 3 116 HIS . 34692 2 4 117 ARG . 34692 2 5 118 GLN . 34692 2 6 119 GLU . 34692 2 7 120 GLY . 34692 2 8 121 GLU . 34692 2 9 122 LEU . 34692 2 10 123 SER . 34692 2 11 124 ASN . 34692 2 12 125 THR . 34692 2 13 126 ARG . 34692 2 14 127 LEU . 34692 2 15 128 PHE . 34692 2 16 129 VAL . 34692 2 17 130 ARG . 34692 2 18 131 PRO . 34692 2 19 132 PHE . 34692 2 20 133 PRO . 34692 2 21 134 LEU . 34692 2 22 135 ASP . 34692 2 23 136 VAL . 34692 2 24 137 GLN . 34692 2 25 138 GLU . 34692 2 26 139 SER . 34692 2 27 140 GLU . 34692 2 28 141 LEU . 34692 2 29 142 ASN . 34692 2 30 143 GLU . 34692 2 31 144 ILE . 34692 2 32 145 PHE . 34692 2 33 146 GLY . 34692 2 34 147 PRO . 34692 2 35 148 PHE . 34692 2 36 149 GLY . 34692 2 37 150 PRO . 34692 2 38 151 MET . 34692 2 39 152 LYS . 34692 2 40 153 GLU . 34692 2 41 154 VAL . 34692 2 42 155 LYS . 34692 2 43 156 ILE . 34692 2 44 157 LEU . 34692 2 45 158 ASN . 34692 2 46 159 GLY . 34692 2 47 160 PHE . 34692 2 48 161 ALA . 34692 2 49 162 PHE . 34692 2 50 163 VAL . 34692 2 51 164 GLU . 34692 2 52 165 PHE . 34692 2 53 166 GLU . 34692 2 54 167 GLU . 34692 2 55 168 ALA . 34692 2 56 169 GLU . 34692 2 57 170 SER . 34692 2 58 171 ALA . 34692 2 59 172 ALA . 34692 2 60 173 LYS . 34692 2 61 174 ALA . 34692 2 62 175 ILE . 34692 2 63 176 GLU . 34692 2 64 177 GLU . 34692 2 65 178 VAL . 34692 2 66 179 HIS . 34692 2 67 180 GLY . 34692 2 68 181 LYS . 34692 2 69 182 SER . 34692 2 70 183 PHE . 34692 2 71 184 ALA . 34692 2 72 185 ASN . 34692 2 73 186 GLN . 34692 2 74 187 PRO . 34692 2 75 188 LEU . 34692 2 76 189 GLU . 34692 2 77 190 VAL . 34692 2 78 191 VAL . 34692 2 79 192 TYR . 34692 2 80 193 SER . 34692 2 81 194 LYS . 34692 2 82 195 LEU . 34692 2 83 196 PRO . 34692 2 84 197 ALA . 34692 2 85 198 LYS . 34692 2 86 199 ARG . 34692 2 87 200 TYR . 34692 2 88 201 ARG . 34692 2 89 202 ILE . 34692 2 90 203 THR . 34692 2 91 204 MET . 34692 2 92 205 LYS . 34692 2 93 206 ASN . 34692 2 94 207 LEU . 34692 2 95 208 PRO . 34692 2 96 209 GLU . 34692 2 97 210 GLY . 34692 2 98 211 CYS . 34692 2 99 212 SER . 34692 2 100 213 TRP . 34692 2 101 214 GLN . 34692 2 102 215 ASP . 34692 2 103 216 LEU . 34692 2 104 217 LYS . 34692 2 105 218 ASP . 34692 2 106 219 LEU . 34692 2 107 220 ALA . 34692 2 108 221 ARG . 34692 2 109 222 GLU . 34692 2 110 223 ASN . 34692 2 111 224 SER . 34692 2 112 225 LEU . 34692 2 113 226 GLU . 34692 2 114 227 THR . 34692 2 115 228 THR . 34692 2 116 229 PHE . 34692 2 117 230 SER . 34692 2 118 231 SER . 34692 2 119 232 VAL . 34692 2 120 233 ASN . 34692 2 121 234 THR . 34692 2 122 235 ARG . 34692 2 123 236 ASP . 34692 2 124 237 PHE . 34692 2 125 238 ASP . 34692 2 126 239 GLY . 34692 2 127 240 THR . 34692 2 128 241 GLY . 34692 2 129 242 ALA . 34692 2 130 243 LEU . 34692 2 131 244 GLU . 34692 2 132 245 PHE . 34692 2 133 246 PRO . 34692 2 134 247 SER . 34692 2 135 248 GLU . 34692 2 136 249 GLU . 34692 2 137 250 ILE . 34692 2 138 251 LEU . 34692 2 139 252 VAL . 34692 2 140 253 GLU . 34692 2 141 254 ALA . 34692 2 142 255 LEU . 34692 2 143 256 GLU . 34692 2 144 257 ARG . 34692 2 145 258 LEU . 34692 2 146 259 ASN . 34692 2 147 260 ASN . 34692 2 148 261 ILE . 34692 2 149 262 GLU . 34692 2 150 263 PHE . 34692 2 151 264 ARG . 34692 2 152 265 GLY . 34692 2 153 266 SER . 34692 2 154 267 VAL . 34692 2 155 268 ILE . 34692 2 156 269 THR . 34692 2 157 270 VAL . 34692 2 158 271 GLU . 34692 2 159 272 ARG . 34692 2 160 273 ASP . 34692 2 161 274 ASP . 34692 2 162 275 ASN . 34692 2 163 276 PRO . 34692 2 164 277 PRO . 34692 2 165 278 PRO . 34692 2 166 279 ILE . 34692 2 167 280 ARG . 34692 2 168 281 ARG . 34692 2 169 282 SER . 34692 2 stop_ loop_ _Entity_poly_seq.Hetero _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID . MET 1 1 34692 2 . HIS 2 2 34692 2 . HIS 3 3 34692 2 . ARG 4 4 34692 2 . GLN 5 5 34692 2 . GLU 6 6 34692 2 . GLY 7 7 34692 2 . GLU 8 8 34692 2 . LEU 9 9 34692 2 . SER 10 10 34692 2 . ASN 11 11 34692 2 . THR 12 12 34692 2 . ARG 13 13 34692 2 . LEU 14 14 34692 2 . PHE 15 15 34692 2 . VAL 16 16 34692 2 . ARG 17 17 34692 2 . PRO 18 18 34692 2 . PHE 19 19 34692 2 . PRO 20 20 34692 2 . LEU 21 21 34692 2 . ASP 22 22 34692 2 . VAL 23 23 34692 2 . GLN 24 24 34692 2 . GLU 25 25 34692 2 . SER 26 26 34692 2 . GLU 27 27 34692 2 . LEU 28 28 34692 2 . ASN 29 29 34692 2 . GLU 30 30 34692 2 . ILE 31 31 34692 2 . PHE 32 32 34692 2 . GLY 33 33 34692 2 . PRO 34 34 34692 2 . PHE 35 35 34692 2 . GLY 36 36 34692 2 . PRO 37 37 34692 2 . MET 38 38 34692 2 . LYS 39 39 34692 2 . GLU 40 40 34692 2 . VAL 41 41 34692 2 . LYS 42 42 34692 2 . ILE 43 43 34692 2 . LEU 44 44 34692 2 . ASN 45 45 34692 2 . GLY 46 46 34692 2 . PHE 47 47 34692 2 . ALA 48 48 34692 2 . PHE 49 49 34692 2 . VAL 50 50 34692 2 . GLU 51 51 34692 2 . PHE 52 52 34692 2 . GLU 53 53 34692 2 . GLU 54 54 34692 2 . ALA 55 55 34692 2 . GLU 56 56 34692 2 . SER 57 57 34692 2 . ALA 58 58 34692 2 . ALA 59 59 34692 2 . LYS 60 60 34692 2 . ALA 61 61 34692 2 . ILE 62 62 34692 2 . GLU 63 63 34692 2 . GLU 64 64 34692 2 . VAL 65 65 34692 2 . HIS 66 66 34692 2 . GLY 67 67 34692 2 . LYS 68 68 34692 2 . SER 69 69 34692 2 . PHE 70 70 34692 2 . ALA 71 71 34692 2 . ASN 72 72 34692 2 . GLN 73 73 34692 2 . PRO 74 74 34692 2 . LEU 75 75 34692 2 . GLU 76 76 34692 2 . VAL 77 77 34692 2 . VAL 78 78 34692 2 . TYR 79 79 34692 2 . SER 80 80 34692 2 . LYS 81 81 34692 2 . LEU 82 82 34692 2 . PRO 83 83 34692 2 . ALA 84 84 34692 2 . LYS 85 85 34692 2 . ARG 86 86 34692 2 . TYR 87 87 34692 2 . ARG 88 88 34692 2 . ILE 89 89 34692 2 . THR 90 90 34692 2 . MET 91 91 34692 2 . LYS 92 92 34692 2 . ASN 93 93 34692 2 . LEU 94 94 34692 2 . PRO 95 95 34692 2 . GLU 96 96 34692 2 . GLY 97 97 34692 2 . CYS 98 98 34692 2 . SER 99 99 34692 2 . TRP 100 100 34692 2 . GLN 101 101 34692 2 . ASP 102 102 34692 2 . LEU 103 103 34692 2 . LYS 104 104 34692 2 . ASP 105 105 34692 2 . LEU 106 106 34692 2 . ALA 107 107 34692 2 . ARG 108 108 34692 2 . GLU 109 109 34692 2 . ASN 110 110 34692 2 . SER 111 111 34692 2 . LEU 112 112 34692 2 . GLU 113 113 34692 2 . THR 114 114 34692 2 . THR 115 115 34692 2 . PHE 116 116 34692 2 . SER 117 117 34692 2 . SER 118 118 34692 2 . VAL 119 119 34692 2 . ASN 120 120 34692 2 . THR 121 121 34692 2 . ARG 122 122 34692 2 . ASP 123 123 34692 2 . PHE 124 124 34692 2 . ASP 125 125 34692 2 . GLY 126 126 34692 2 . THR 127 127 34692 2 . GLY 128 128 34692 2 . ALA 129 129 34692 2 . LEU 130 130 34692 2 . GLU 131 131 34692 2 . PHE 132 132 34692 2 . PRO 133 133 34692 2 . SER 134 134 34692 2 . GLU 135 135 34692 2 . GLU 136 136 34692 2 . ILE 137 137 34692 2 . LEU 138 138 34692 2 . VAL 139 139 34692 2 . GLU 140 140 34692 2 . ALA 141 141 34692 2 . LEU 142 142 34692 2 . GLU 143 143 34692 2 . ARG 144 144 34692 2 . LEU 145 145 34692 2 . ASN 146 146 34692 2 . ASN 147 147 34692 2 . ILE 148 148 34692 2 . GLU 149 149 34692 2 . PHE 150 150 34692 2 . ARG 151 151 34692 2 . GLY 152 152 34692 2 . SER 153 153 34692 2 . VAL 154 154 34692 2 . ILE 155 155 34692 2 . THR 156 156 34692 2 . VAL 157 157 34692 2 . GLU 158 158 34692 2 . ARG 159 159 34692 2 . ASP 160 160 34692 2 . ASP 161 161 34692 2 . ASN 162 162 34692 2 . PRO 163 163 34692 2 . PRO 164 164 34692 2 . PRO 165 165 34692 2 . ILE 166 166 34692 2 . ARG 167 167 34692 2 . ARG 168 168 34692 2 . SER 169 169 34692 2 stop_ save_ #################### # Natural source # #################### save_natural_source _Entity_natural_src_list.Sf_category natural_source _Entity_natural_src_list.Sf_framecode natural_source _Entity_natural_src_list.Entry_ID 34692 _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 2 $entity_2 . 559292 organism . 'Saccharomyces cerevisiae (strain ATCC 204508 / S288c)' "Baker's yeast" . . Eukaryota Fungi Saccharomyces cerevisiae 'ATCC 204508 / S288c' . . . . . . . . . . 'NPL3, MTR13, MTS1, NAB1, NOP3, YDR432W, D9461.19' . 34692 1 stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Entity_experimental_src_list.Sf_category experimental_source _Entity_experimental_src_list.Sf_framecode experimental_source _Entity_experimental_src_list.Entry_ID 34692 _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 2 $entity_2 . 'recombinant technology' 'unidentified plasmid' . . 45202 unidentified plasmid . . . . . . . . . . 34692 1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Sample.Sf_category sample _Sample.Sf_framecode sample_1 _Sample.Entry_ID 34692 _Sample.ID 1 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.9 mM [U-15N] Npl3 RRM12, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Npl3 RRM12' [U-15N] . . 2 $entity_2 . . 0.9 . . mM . . . . 34692 1 stop_ save_ save_sample_2 _Sample.Sf_category sample _Sample.Sf_framecode sample_2 _Sample.Entry_ID 34692 _Sample.ID 2 _Sample.Name . _Sample.Type solution _Sample.Sub_type . _Sample.Details '0.9 mM [U-100% 13C; U-100% 15N] Npl3 RRM12, 90% H2O/10% D2O' _Sample.Aggregate_sample_number . _Sample.Solvent_system '90% H2O/10% D2O' _Sample.Preparation_date . _Sample.Preparation_expiration_date . _Sample.Polycrystallization_protocol . _Sample.Single_crystal_protocol . _Sample.Crystal_grow_apparatus . _Sample.Crystal_grow_atmosphere . _Sample.Crystal_grow_details . _Sample.Crystal_grow_method . _Sample.Crystal_grow_method_cit_ID . _Sample.Crystal_grow_pH . _Sample.Crystal_grow_pH_range . _Sample.Crystal_grow_pressure . _Sample.Crystal_grow_pressure_esd . _Sample.Crystal_grow_seeding . _Sample.Crystal_grow_seeding_cit_ID . _Sample.Crystal_grow_temp . _Sample.Crystal_grow_temp_details . _Sample.Crystal_grow_temp_esd . _Sample.Crystal_grow_time . _Sample.Oriented_sample_prep_protocol . _Sample.Lyophilization_cryo_protectant . _Sample.Storage_protocol . loop_ _Sample_component.ID _Sample_component.Mol_common_name _Sample_component.Isotopic_labeling _Sample_component.Assembly_ID _Sample_component.Assembly_label _Sample_component.Entity_ID _Sample_component.Entity_label _Sample_component.Product_ID _Sample_component.Type _Sample_component.Concentration_val _Sample_component.Concentration_val_min _Sample_component.Concentration_val_max _Sample_component.Concentration_val_units _Sample_component.Concentration_val_err _Sample_component.Vendor _Sample_component.Vendor_product_name _Sample_component.Vendor_product_code _Sample_component.Entry_ID _Sample_component.Sample_ID 1 'Npl3 RRM12' '[U-100% 13C; U-100% 15N]' . . 2 $entity_2 . . 0.9 . . mM . . . . 34692 2 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 34692 _Sample_condition_list.ID 1 _Sample_condition_list.Name . _Sample_condition_list.Details . loop_ _Sample_condition_variable.Type _Sample_condition_variable.Val _Sample_condition_variable.Val_err _Sample_condition_variable.Val_units _Sample_condition_variable.Entry_ID _Sample_condition_variable.Sample_condition_list_ID 'ionic strength' 50 . mM 34692 1 pH 6.9 . pH 34692 1 pressure 0 . Pa 34692 1 temperature 313 . K 34692 1 stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Software.Sf_category software _Software.Sf_framecode software_1 _Software.Entry_ID 34692 _Software.ID 1 _Software.Type . _Software.Name Amber _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Case, Darden, Cheatham III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . 34692 1 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID refinement . 34692 1 stop_ save_ save_software_2 _Software.Sf_category software _Software.Sf_framecode software_2 _Software.Entry_ID 34692 _Software.ID 2 _Software.Type . _Software.Name CYANA _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID 'Guntert, Mumenthaler and Wuthrich' . . 34692 2 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'peak picking' . 34692 2 'structure calculation' . 34692 2 stop_ save_ save_software_3 _Software.Sf_category software _Software.Sf_framecode software_3 _Software.Entry_ID 34692 _Software.ID 3 _Software.Type . _Software.Name Sparky _Software.Version . _Software.DOI . _Software.Details . loop_ _Vendor.Name _Vendor.Address _Vendor.Electronic_address _Vendor.Entry_ID _Vendor.Software_ID Goddard . . 34692 3 stop_ loop_ _Task.Task _Task.Software_module _Task.Entry_ID _Task.Software_ID 'chemical shift assignment' . 34692 3 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 34692 _NMR_spectrometer.ID 1 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model AVANCE _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 900 save_ save_NMR_spectrometer_2 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_2 _NMR_spectrometer.Entry_ID 34692 _NMR_spectrometer.ID 2 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 700 save_ save_NMR_spectrometer_3 _NMR_spectrometer.Sf_category NMR_spectrometer _NMR_spectrometer.Sf_framecode NMR_spectrometer_3 _NMR_spectrometer.Entry_ID 34692 _NMR_spectrometer.ID 3 _NMR_spectrometer.Name . _NMR_spectrometer.Details . _NMR_spectrometer.Manufacturer Bruker _NMR_spectrometer.Model 'AVANCE III' _NMR_spectrometer.Serial_number . _NMR_spectrometer.Field_strength 600 save_ save_NMR_spectrometer_list _NMR_spectrometer_list.Sf_category NMR_spectrometer_list _NMR_spectrometer_list.Sf_framecode NMR_spectrometer_list _NMR_spectrometer_list.Entry_ID 34692 _NMR_spectrometer_list.ID 1 _NMR_spectrometer_list.Name . loop_ _NMR_spectrometer_view.ID _NMR_spectrometer_view.Name _NMR_spectrometer_view.Manufacturer _NMR_spectrometer_view.Model _NMR_spectrometer_view.Serial_number _NMR_spectrometer_view.Field_strength _NMR_spectrometer_view.Details _NMR_spectrometer_view.Citation_ID _NMR_spectrometer_view.Citation_label _NMR_spectrometer_view.Entry_ID _NMR_spectrometer_view.NMR_spectrometer_list_ID 1 NMR_spectrometer_1 Bruker AVANCE . 900 . . . 34692 1 2 NMR_spectrometer_2 Bruker 'AVANCE III' . 700 . . . 34692 1 3 NMR_spectrometer_3 Bruker 'AVANCE III' . 600 . . . 34692 1 stop_ save_ ############################# # NMR applied experiments # ############################# save_experiment_list _Experiment_list.Sf_category experiment_list _Experiment_list.Sf_framecode experiment_list _Experiment_list.Entry_ID 34692 _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 '3D 1H-15N NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34692 1 2 '3D 1H-13C NOESY aliphatic' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34692 1 3 '3D 1H-13C NOESY aromatic' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 1 $NMR_spectrometer_1 . . . . . . . . . . . . . . . . . 34692 1 4 '2D NOESY' no . . . . . . . . . . . . 1 $sample_1 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34692 1 5 '2D NOESY F1F2f' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34692 1 6 '2D NOESY F2f' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 3 $NMR_spectrometer_3 . . . . . . . . . . . . . . . . . 34692 1 7 '3D HNCACB' no . . . . . . . . . . . . 2 $sample_2 isotropic . . 1 $sample_conditions_1 . . . 2 $NMR_spectrometer_2 . . . . . . . . . . . . . . . . . 34692 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 34692 _Chem_shift_reference.ID 1 _Chem_shift_reference.Name . _Chem_shift_reference.Details . loop_ _Chem_shift_ref.Atom_type _Chem_shift_ref.Atom_isotope_number _Chem_shift_ref.Mol_common_name _Chem_shift_ref.Atom_group _Chem_shift_ref.Concentration_val _Chem_shift_ref.Concentration_units _Chem_shift_ref.Solvent _Chem_shift_ref.Rank _Chem_shift_ref.Chem_shift_units _Chem_shift_ref.Chem_shift_val _Chem_shift_ref.Ref_method _Chem_shift_ref.Ref_type _Chem_shift_ref.Indirect_shift_ratio _Chem_shift_ref.External_ref_loc _Chem_shift_ref.External_ref_sample_geometry _Chem_shift_ref.External_ref_axis _Chem_shift_ref.Ref_correction_type _Chem_shift_ref.Correction_val _Chem_shift_ref.Entry_ID _Chem_shift_ref.Chem_shift_reference_ID C 13 water protons . . . . ppm 4.7 internal direct 1.0 . . . . . 34692 1 H 1 water protons . . . . ppm 4.7 internal direct 1.0 . . . . . 34692 1 N 15 water protons . . . . ppm 4.7 internal direct 1.0 . . . . . 34692 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 34692 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D 1H-15N NOESY' . . . 34692 1 2 '3D 1H-13C NOESY aliphatic' . . . 34692 1 3 '3D 1H-13C NOESY aromatic' . . . 34692 1 4 '2D NOESY' . . . 34692 1 5 '2D NOESY F1F2f' . . . 34692 1 6 '2D NOESY F2f' . . . 34692 1 7 '3D HNCACB' . . . 34692 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 1 1 A H1' H 1 6.216 0.002 . . . . . . A 103 A H1' . 34692 1 2 . 1 . 1 1 1 A H2 H 1 8.317 0.000 . . . . . . A 103 A H2 . 34692 1 3 . 1 . 1 1 1 A H2' H 1 4.973 0.000 . . . . . . A 103 A H2' . 34692 1 4 . 1 . 1 1 1 A H3' H 1 4.861 0.000 . . . . . . A 103 A H3' . 34692 1 5 . 1 . 1 1 1 A H4' H 1 4.537 0.000 . . . . . . A 103 A H4' . 34692 1 6 . 1 . 1 1 1 A H8 H 1 8.452 0.000 . . . . . . A 103 A H8 . 34692 1 7 . 1 . 1 1 1 A H5' H 1 3.933 0.000 . . . . . . A 103 A Q5' . 34692 1 8 . 1 . 1 2 2 U H1' H 1 6.080 0.001 . . . . . . A 104 U H1' . 34692 1 9 . 1 . 1 2 2 U H2' H 1 4.415 0.000 . . . . . . A 104 U H2' . 34692 1 10 . 1 . 1 2 2 U H3' H 1 4.735 0.000 . . . . . . A 104 U H3' . 34692 1 11 . 1 . 1 2 2 U H4' H 1 3.994 0.000 . . . . . . A 104 U H4' . 34692 1 12 . 1 . 1 2 2 U H5 H 1 5.973 0.000 . . . . . . A 104 U H5 . 34692 1 13 . 1 . 1 2 2 U H5' H 1 4.228 0.000 . . . . . . A 104 U H5' . 34692 1 14 . 1 . 1 2 2 U H5'' H 1 4.288 0.000 . . . . . . A 104 U H5'' . 34692 1 15 . 1 . 1 2 2 U H6 H 1 7.967 0.000 . . . . . . A 104 U H6 . 34692 1 16 . 1 . 1 3 3 C H1' H 1 6.371 0.001 . . . . . . A 105 C H1' . 34692 1 17 . 1 . 1 3 3 C H2' H 1 4.268 0.002 . . . . . . A 105 C H2' . 34692 1 18 . 1 . 1 3 3 C H3' H 1 4.848 0.002 . . . . . . A 105 C H3' . 34692 1 19 . 1 . 1 3 3 C H4' H 1 4.353 0.001 . . . . . . A 105 C H4' . 34692 1 20 . 1 . 1 3 3 C H5 H 1 5.192 0.000 . . . . . . A 105 C H5 . 34692 1 21 . 1 . 1 3 3 C H6 H 1 7.099 0.002 . . . . . . A 105 C H6 . 34692 1 22 . 1 . 1 3 3 C H5' H 1 4.019 0.008 . . . . . . A 105 C Q5' . 34692 1 23 . 1 . 1 4 4 C H1' H 1 5.549 0.002 . . . . . . A 106 C H1' . 34692 1 24 . 1 . 1 4 4 C H2' H 1 4.010 0.000 . . . . . . A 106 C H2' . 34692 1 25 . 1 . 1 4 4 C H3' H 1 4.734 0.000 . . . . . . A 106 C H3' . 34692 1 26 . 1 . 1 4 4 C H4' H 1 4.417 0.000 . . . . . . A 106 C H4' . 34692 1 27 . 1 . 1 4 4 C H5 H 1 6.369 0.000 . . . . . . A 106 C H5 . 34692 1 28 . 1 . 1 4 4 C H5' H 1 4.231 0.000 . . . . . . A 106 C H5' . 34692 1 29 . 1 . 1 4 4 C H5'' H 1 4.314 0.000 . . . . . . A 106 C H5'' . 34692 1 30 . 1 . 1 4 4 C H6 H 1 7.998 0.001 . . . . . . A 106 C H6 . 34692 1 31 . 1 . 1 5 5 A H1' H 1 6.093 0.002 . . . . . . A 107 A H1' . 34692 1 32 . 1 . 1 5 5 A H2 H 1 8.157 0.001 . . . . . . A 107 A H2 . 34692 1 33 . 1 . 1 5 5 A H2' H 1 4.566 0.000 . . . . . . A 107 A H2' . 34692 1 34 . 1 . 1 5 5 A H3' H 1 4.852 0.000 . . . . . . A 107 A H3' . 34692 1 35 . 1 . 1 5 5 A H4' H 1 4.482 0.000 . . . . . . A 107 A H4' . 34692 1 36 . 1 . 1 5 5 A H5' H 1 4.162 0.000 . . . . . . A 107 A H5' . 34692 1 37 . 1 . 1 5 5 A H5'' H 1 4.340 0.000 . . . . . . A 107 A H5'' . 34692 1 38 . 1 . 1 5 5 A H8 H 1 8.494 0.000 . . . . . . A 107 A H8 . 34692 1 39 . 1 . 1 6 6 G H1' H 1 5.592 0.008 . . . . . . A 108 G H1' . 34692 1 40 . 1 . 1 6 6 G H2' H 1 4.854 0.001 . . . . . . A 108 G H2' . 34692 1 41 . 1 . 1 6 6 G H3' H 1 4.546 0.000 . . . . . . A 108 G H3' . 34692 1 42 . 1 . 1 6 6 G H4' H 1 4.349 0.004 . . . . . . A 108 G H4' . 34692 1 43 . 1 . 1 6 6 G H5' H 1 4.165 0.000 . . . . . . A 108 G H5' . 34692 1 44 . 1 . 1 6 6 G H5'' H 1 4.088 0.000 . . . . . . A 108 G H5" . 34692 1 45 . 1 . 1 6 6 G H8 H 1 7.791 0.004 . . . . . . A 108 G H8 . 34692 1 46 . 1 . 1 7 7 U H1' H 1 6.074 0.000 . . . . . . A 109 U H1' . 34692 1 47 . 1 . 1 7 7 U H5 H 1 5.951 0.001 . . . . . . A 109 U H5 . 34692 1 48 . 1 . 1 7 7 U H6 H 1 7.826 0.000 . . . . . . A 109 U H6 . 34692 1 49 . 1 . 1 8 8 G H1' H 1 5.911 0.000 . . . . . . A 110 G H1' . 34692 1 50 . 1 . 1 8 8 G H8 H 1 8.019 0.002 . . . . . . A 110 G H8 . 34692 1 51 . 1 . 1 9 9 G H1' H 1 5.835 0.001 . . . . . . A 111 G H1' . 34692 1 52 . 1 . 1 9 9 G H8 H 1 8.260 0.001 . . . . . . A 111 G H8 . 34692 1 53 . 1 . 1 10 10 A H1' H 1 6.050 0.001 . . . . . . A 112 A H1' . 34692 1 54 . 1 . 1 10 10 A H2 H 1 8.100 0.001 . . . . . . A 112 A H2 . 34692 1 55 . 1 . 1 10 10 A H8 H 1 8.398 0.001 . . . . . . A 112 A H8 . 34692 1 56 . 1 . 1 11 11 A H1' H 1 6.103 0.001 . . . . . . A 113 A H1' . 34692 1 57 . 1 . 1 11 11 A H2 H 1 8.262 0.000 . . . . . . A 113 A H2 . 34692 1 58 . 1 . 1 11 11 A H8 H 1 8.403 0.000 . . . . . . A 113 A H8 . 34692 1 59 . 2 . 2 6 6 GLU H H 1 8.477 0.002 . . . . . . B 119 GLU H . 34692 1 60 . 2 . 2 6 6 GLU HA H 1 4.363 0.015 . . . . . . B 119 GLU HA . 34692 1 61 . 2 . 2 6 6 GLU HB2 H 1 1.984 0.008 . . . . . . B 119 GLU HB2 . 34692 1 62 . 2 . 2 6 6 GLU HB3 H 1 2.092 0.000 . . . . . . B 119 GLU HB3 . 34692 1 63 . 2 . 2 6 6 GLU CA C 13 56.837 0.046 . . . . . . B 119 GLU CA . 34692 1 64 . 2 . 2 6 6 GLU CB C 13 31.020 0.011 . . . . . . B 119 GLU CB . 34692 1 65 . 2 . 2 6 6 GLU CG C 13 36.409 0.000 . . . . . . B 119 GLU CG . 34692 1 66 . 2 . 2 6 6 GLU N N 15 122.391 0.010 . . . . . . B 119 GLU N . 34692 1 67 . 2 . 2 7 7 GLY H H 1 8.332 0.000 . . . . . . B 120 GLY H . 34692 1 68 . 2 . 2 7 7 GLY CA C 13 45.215 0.000 . . . . . . B 120 GLY CA . 34692 1 69 . 2 . 2 7 7 GLY N N 15 109.549 0.000 . . . . . . B 120 GLY N . 34692 1 70 . 2 . 2 8 8 GLU H H 1 8.209 0.000 . . . . . . B 121 GLU H . 34692 1 71 . 2 . 2 8 8 GLU HA H 1 4.388 0.009 . . . . . . B 121 GLU HA . 34692 1 72 . 2 . 2 8 8 GLU HB2 H 1 1.937 0.033 . . . . . . B 121 GLU HB2 . 34692 1 73 . 2 . 2 8 8 GLU HB3 H 1 2.047 0.051 . . . . . . B 121 GLU HB3 . 34692 1 74 . 2 . 2 8 8 GLU HG2 H 1 2.293 0.007 . . . . . . B 121 GLU HG2 . 34692 1 75 . 2 . 2 8 8 GLU HG3 H 1 2.293 0.007 . . . . . . B 121 GLU HG3 . 34692 1 76 . 2 . 2 8 8 GLU CA C 13 56.405 0.018 . . . . . . B 121 GLU CA . 34692 1 77 . 2 . 2 8 8 GLU CB C 13 31.184 0.184 . . . . . . B 121 GLU CB . 34692 1 78 . 2 . 2 8 8 GLU N N 15 119.973 0.005 . . . . . . B 121 GLU N . 34692 1 79 . 2 . 2 9 9 LEU H H 1 8.216 0.002 . . . . . . B 122 LEU H . 34692 1 80 . 2 . 2 9 9 LEU HA H 1 4.886 0.013 . . . . . . B 122 LEU HA . 34692 1 81 . 2 . 2 9 9 LEU HB2 H 1 1.558 0.016 . . . . . . B 122 LEU HB2 . 34692 1 82 . 2 . 2 9 9 LEU HB3 H 1 1.558 0.016 . . . . . . B 122 LEU HB3 . 34692 1 83 . 2 . 2 9 9 LEU HG H 1 1.678 0.004 . . . . . . B 122 LEU HG . 34692 1 84 . 2 . 2 9 9 LEU HD11 H 1 0.821 0.005 . . . . . . B 122 LEU HD11 . 34692 1 85 . 2 . 2 9 9 LEU HD12 H 1 0.821 0.005 . . . . . . B 122 LEU HD12 . 34692 1 86 . 2 . 2 9 9 LEU HD13 H 1 0.821 0.005 . . . . . . B 122 LEU HD13 . 34692 1 87 . 2 . 2 9 9 LEU HD21 H 1 0.939 0.069 . . . . . . B 122 LEU HD21 . 34692 1 88 . 2 . 2 9 9 LEU HD22 H 1 0.939 0.069 . . . . . . B 122 LEU HD22 . 34692 1 89 . 2 . 2 9 9 LEU HD23 H 1 0.939 0.069 . . . . . . B 122 LEU HD23 . 34692 1 90 . 2 . 2 9 9 LEU CA C 13 53.934 0.038 . . . . . . B 122 LEU CA . 34692 1 91 . 2 . 2 9 9 LEU CB C 13 43.766 0.000 . . . . . . B 122 LEU CB . 34692 1 92 . 2 . 2 9 9 LEU CG C 13 26.944 0.000 . . . . . . B 122 LEU CG . 34692 1 93 . 2 . 2 9 9 LEU CD1 C 13 23.347 0.052 . . . . . . B 122 LEU CD1 . 34692 1 94 . 2 . 2 9 9 LEU CD2 C 13 25.448 0.000 . . . . . . B 122 LEU CD2 . 34692 1 95 . 2 . 2 9 9 LEU N N 15 121.696 0.007 . . . . . . B 122 LEU N . 34692 1 96 . 2 . 2 10 10 SER H H 1 8.884 0.001 . . . . . . B 123 SER H . 34692 1 97 . 2 . 2 10 10 SER HA H 1 4.323 0.003 . . . . . . B 123 SER HA . 34692 1 98 . 2 . 2 10 10 SER HB2 H 1 3.950 0.005 . . . . . . B 123 SER HB2 . 34692 1 99 . 2 . 2 10 10 SER HB3 H 1 4.101 0.005 . . . . . . B 123 SER HB3 . 34692 1 100 . 2 . 2 10 10 SER CA C 13 58.025 0.000 . . . . . . B 123 SER CA . 34692 1 101 . 2 . 2 10 10 SER CB C 13 63.925 0.019 . . . . . . B 123 SER CB . 34692 1 102 . 2 . 2 11 11 ASN H H 1 8.258 0.001 . . . . . . B 124 ASN H . 34692 1 103 . 2 . 2 11 11 ASN HA H 1 4.704 0.000 . . . . . . B 124 ASN HA . 34692 1 104 . 2 . 2 11 11 ASN CB C 13 39.281 0.027 . . . . . . B 124 ASN CB . 34692 1 105 . 2 . 2 11 11 ASN N N 15 118.797 0.003 . . . . . . B 124 ASN N . 34692 1 106 . 2 . 2 12 12 THR H H 1 8.349 0.000 . . . . . . B 125 THR H . 34692 1 107 . 2 . 2 12 12 THR HA H 1 4.605 0.002 . . . . . . B 125 THR HA . 34692 1 108 . 2 . 2 12 12 THR CA C 13 62.208 0.000 . . . . . . B 125 THR CA . 34692 1 109 . 2 . 2 12 12 THR CB C 13 70.475 0.001 . . . . . . B 125 THR CB . 34692 1 110 . 2 . 2 12 12 THR N N 15 107.556 0.007 . . . . . . B 125 THR N . 34692 1 111 . 2 . 2 13 13 ARG HA H 1 5.111 0.000 . . . . . . B 126 ARG HA . 34692 1 112 . 2 . 2 13 13 ARG HB2 H 1 1.770 0.292 . . . . . . B 126 ARG HB2 . 34692 1 113 . 2 . 2 13 13 ARG HB3 H 1 1.971 0.000 . . . . . . B 126 ARG HB3 . 34692 1 114 . 2 . 2 13 13 ARG HG2 H 1 1.485 0.000 . . . . . . B 126 ARG HG2 . 34692 1 115 . 2 . 2 13 13 ARG HG3 H 1 1.618 0.000 . . . . . . B 126 ARG HG3 . 34692 1 116 . 2 . 2 13 13 ARG HD2 H 1 3.207 0.006 . . . . . . B 126 ARG HD2 . 34692 1 117 . 2 . 2 13 13 ARG HD3 H 1 3.207 0.006 . . . . . . B 126 ARG HD3 . 34692 1 118 . 2 . 2 13 13 ARG CB C 13 32.530 0.028 . . . . . . B 126 ARG CB . 34692 1 119 . 2 . 2 13 13 ARG CD C 13 43.474 0.000 . . . . . . B 126 ARG CD . 34692 1 120 . 2 . 2 13 13 ARG N N 15 125.587 0.019 . . . . . . B 126 ARG N . 34692 1 121 . 2 . 2 14 14 LEU H H 1 9.666 0.002 . . . . . . B 127 LEU H . 34692 1 122 . 2 . 2 14 14 LEU HA H 1 5.131 0.005 . . . . . . B 127 LEU HA . 34692 1 123 . 2 . 2 14 14 LEU HB2 H 1 1.231 0.007 . . . . . . B 127 LEU HB2 . 34692 1 124 . 2 . 2 14 14 LEU HB3 H 1 1.678 0.004 . . . . . . B 127 LEU HB3 . 34692 1 125 . 2 . 2 14 14 LEU CA C 13 53.735 0.031 . . . . . . B 127 LEU CA . 34692 1 126 . 2 . 2 14 14 LEU CB C 13 43.411 0.017 . . . . . . B 127 LEU CB . 34692 1 127 . 2 . 2 14 14 LEU CG C 13 26.953 0.000 . . . . . . B 127 LEU CG . 34692 1 128 . 2 . 2 14 14 LEU CD1 C 13 24.157 0.004 . . . . . . B 127 LEU CD1 . 34692 1 129 . 2 . 2 14 14 LEU CD2 C 13 26.303 0.001 . . . . . . B 127 LEU CD2 . 34692 1 130 . 2 . 2 14 14 LEU N N 15 129.519 0.032 . . . . . . B 127 LEU N . 34692 1 131 . 2 . 2 15 15 PHE HA H 1 4.711 0.000 . . . . . . B 128 PHE HA . 34692 1 132 . 2 . 2 15 15 PHE HB2 H 1 2.650 0.017 . . . . . . B 128 PHE HB2 . 34692 1 133 . 2 . 2 15 15 PHE HB3 H 1 2.650 0.017 . . . . . . B 128 PHE HB3 . 34692 1 134 . 2 . 2 15 15 PHE CB C 13 40.881 0.009 . . . . . . B 128 PHE CB . 34692 1 135 . 2 . 2 15 15 PHE N N 15 125.035 0.004 . . . . . . B 128 PHE N . 34692 1 136 . 2 . 2 16 16 VAL H H 1 8.365 0.000 . . . . . . B 129 VAL H . 34692 1 137 . 2 . 2 16 16 VAL HA H 1 5.155 0.004 . . . . . . B 129 VAL HA . 34692 1 138 . 2 . 2 16 16 VAL CA C 13 59.815 0.010 . . . . . . B 129 VAL CA . 34692 1 139 . 2 . 2 16 16 VAL CB C 13 35.096 0.006 . . . . . . B 129 VAL CB . 34692 1 140 . 2 . 2 16 16 VAL N N 15 125.944 0.004 . . . . . . B 129 VAL N . 34692 1 141 . 2 . 2 17 17 ARG H H 1 8.269 0.004 . . . . . . B 130 ARG H . 34692 1 142 . 2 . 2 17 17 ARG HA H 1 4.402 0.006 . . . . . . B 130 ARG HA . 34692 1 143 . 2 . 2 17 17 ARG HB2 H 1 1.564 0.004 . . . . . . B 130 ARG HB2 . 34692 1 144 . 2 . 2 17 17 ARG HB3 H 1 1.564 0.004 . . . . . . B 130 ARG HB3 . 34692 1 145 . 2 . 2 17 17 ARG CA C 13 53.925 0.000 . . . . . . B 130 ARG CA . 34692 1 146 . 2 . 2 17 17 ARG CB C 13 30.719 0.090 . . . . . . B 130 ARG CB . 34692 1 147 . 2 . 2 17 17 ARG CG C 13 24.243 0.038 . . . . . . B 130 ARG CG . 34692 1 148 . 2 . 2 17 17 ARG N N 15 121.880 0.040 . . . . . . B 130 ARG N . 34692 1 149 . 2 . 2 18 18 PRO HA H 1 4.822 0.001 . . . . . . B 131 PRO HA . 34692 1 150 . 2 . 2 18 18 PRO CB C 13 32.911 0.023 . . . . . . B 131 PRO CB . 34692 1 151 . 2 . 2 19 19 PHE H H 1 7.335 0.004 . . . . . . B 132 PHE H . 34692 1 152 . 2 . 2 19 19 PHE HA H 1 5.055 0.004 . . . . . . B 132 PHE HA . 34692 1 153 . 2 . 2 19 19 PHE HB2 H 1 2.132 0.018 . . . . . . B 132 PHE HB2 . 34692 1 154 . 2 . 2 19 19 PHE HB3 H 1 3.063 0.007 . . . . . . B 132 PHE HB3 . 34692 1 155 . 2 . 2 19 19 PHE CA C 13 55.629 0.046 . . . . . . B 132 PHE CA . 34692 1 156 . 2 . 2 19 19 PHE CB C 13 43.220 0.018 . . . . . . B 132 PHE CB . 34692 1 157 . 2 . 2 19 19 PHE N N 15 112.873 0.014 . . . . . . B 132 PHE N . 34692 1 158 . 2 . 2 20 20 PRO HA H 1 4.695 0.002 . . . . . . B 133 PRO HA . 34692 1 159 . 2 . 2 20 20 PRO HB2 H 1 2.132 0.003 . . . . . . B 133 PRO HB2 . 34692 1 160 . 2 . 2 20 20 PRO HB3 H 1 2.600 0.002 . . . . . . B 133 PRO HB3 . 34692 1 161 . 2 . 2 20 20 PRO HG2 H 1 2.202 0.001 . . . . . . B 133 PRO HG2 . 34692 1 162 . 2 . 2 20 20 PRO HG3 H 1 2.294 0.000 . . . . . . B 133 PRO HG3 . 34692 1 163 . 2 . 2 20 20 PRO CB C 13 32.856 0.045 . . . . . . B 133 PRO CB . 34692 1 164 . 2 . 2 20 20 PRO CG C 13 27.850 0.022 . . . . . . B 133 PRO CG . 34692 1 165 . 2 . 2 20 20 PRO CD C 13 51.008 0.051 . . . . . . B 133 PRO CD . 34692 1 166 . 2 . 2 21 21 LEU H H 1 8.709 0.002 . . . . . . B 134 LEU H . 34692 1 167 . 2 . 2 21 21 LEU HA H 1 4.233 0.001 . . . . . . B 134 LEU HA . 34692 1 168 . 2 . 2 21 21 LEU HB2 H 1 1.657 0.000 . . . . . . B 134 LEU HB2 . 34692 1 169 . 2 . 2 21 21 LEU HB3 H 1 1.755 0.006 . . . . . . B 134 LEU HB3 . 34692 1 170 . 2 . 2 21 21 LEU HG H 1 1.807 0.001 . . . . . . B 134 LEU HG . 34692 1 171 . 2 . 2 21 21 LEU CA C 13 57.114 0.020 . . . . . . B 134 LEU CA . 34692 1 172 . 2 . 2 21 21 LEU CB C 13 41.182 0.015 . . . . . . B 134 LEU CB . 34692 1 173 . 2 . 2 21 21 LEU N N 15 121.479 0.005 . . . . . . B 134 LEU N . 34692 1 174 . 2 . 2 22 22 ASP H H 1 8.236 0.002 . . . . . . B 135 ASP H . 34692 1 175 . 2 . 2 22 22 ASP HA H 1 4.681 0.000 . . . . . . B 135 ASP HA . 34692 1 176 . 2 . 2 22 22 ASP HB2 H 1 2.592 0.001 . . . . . . B 135 ASP HB2 . 34692 1 177 . 2 . 2 22 22 ASP HB3 H 1 2.986 0.001 . . . . . . B 135 ASP HB3 . 34692 1 178 . 2 . 2 22 22 ASP CB C 13 39.678 0.042 . . . . . . B 135 ASP CB . 34692 1 179 . 2 . 2 22 22 ASP N N 15 114.825 0.001 . . . . . . B 135 ASP N . 34692 1 180 . 2 . 2 23 23 VAL H H 1 7.067 0.001 . . . . . . B 136 VAL H . 34692 1 181 . 2 . 2 23 23 VAL HA H 1 4.243 0.014 . . . . . . B 136 VAL HA . 34692 1 182 . 2 . 2 23 23 VAL CA C 13 62.411 0.006 . . . . . . B 136 VAL CA . 34692 1 183 . 2 . 2 23 23 VAL CB C 13 32.191 0.162 . . . . . . B 136 VAL CB . 34692 1 184 . 2 . 2 23 23 VAL N N 15 121.017 0.001 . . . . . . B 136 VAL N . 34692 1 185 . 2 . 2 24 24 GLN H H 1 8.589 0.003 . . . . . . B 137 GLN H . 34692 1 186 . 2 . 2 24 24 GLN HA H 1 4.691 0.008 . . . . . . B 137 GLN HA . 34692 1 187 . 2 . 2 24 24 GLN HB2 H 1 2.014 0.003 . . . . . . B 137 GLN HB2 . 34692 1 188 . 2 . 2 24 24 GLN HB3 H 1 2.456 0.000 . . . . . . B 137 GLN HB3 . 34692 1 189 . 2 . 2 24 24 GLN CB C 13 32.046 0.056 . . . . . . B 137 GLN CB . 34692 1 190 . 2 . 2 24 24 GLN CG C 13 34.286 0.012 . . . . . . B 137 GLN CG . 34692 1 191 . 2 . 2 24 24 GLN N N 15 123.793 0.003 . . . . . . B 137 GLN N . 34692 1 192 . 2 . 2 25 25 GLU H H 1 9.170 0.000 . . . . . . B 138 GLU H . 34692 1 193 . 2 . 2 25 25 GLU HA H 1 3.639 0.001 . . . . . . B 138 GLU HA . 34692 1 194 . 2 . 2 25 25 GLU HB2 H 1 2.020 0.001 . . . . . . B 138 GLU HB2 . 34692 1 195 . 2 . 2 25 25 GLU HB3 H 1 2.128 0.003 . . . . . . B 138 GLU HB3 . 34692 1 196 . 2 . 2 25 25 GLU HG2 H 1 2.227 0.010 . . . . . . B 138 GLU HG2 . 34692 1 197 . 2 . 2 25 25 GLU HG3 H 1 2.227 0.010 . . . . . . B 138 GLU HG3 . 34692 1 198 . 2 . 2 25 25 GLU CA C 13 60.922 0.002 . . . . . . B 138 GLU CA . 34692 1 199 . 2 . 2 25 25 GLU CB C 13 29.376 0.023 . . . . . . B 138 GLU CB . 34692 1 200 . 2 . 2 25 25 GLU CG C 13 36.473 0.000 . . . . . . B 138 GLU CG . 34692 1 201 . 2 . 2 25 25 GLU N N 15 123.817 0.002 . . . . . . B 138 GLU N . 34692 1 202 . 2 . 2 26 26 SER H H 1 8.613 0.010 . . . . . . B 139 SER H . 34692 1 203 . 2 . 2 26 26 SER HA H 1 4.156 0.002 . . . . . . B 139 SER HA . 34692 1 204 . 2 . 2 26 26 SER CA C 13 61.429 0.001 . . . . . . B 139 SER CA . 34692 1 205 . 2 . 2 26 26 SER CB C 13 61.797 0.040 . . . . . . B 139 SER CB . 34692 1 206 . 2 . 2 26 26 SER N N 15 112.649 0.002 . . . . . . B 139 SER N . 34692 1 207 . 2 . 2 27 27 GLU H H 1 7.366 0.005 . . . . . . B 140 GLU H . 34692 1 208 . 2 . 2 27 27 GLU HA H 1 4.249 0.003 . . . . . . B 140 GLU HA . 34692 1 209 . 2 . 2 27 27 GLU HB2 H 1 2.121 0.004 . . . . . . B 140 GLU HB2 . 34692 1 210 . 2 . 2 27 27 GLU HB3 H 1 2.451 0.006 . . . . . . B 140 GLU HB3 . 34692 1 211 . 2 . 2 27 27 GLU CA C 13 59.275 0.000 . . . . . . B 140 GLU CA . 34692 1 212 . 2 . 2 27 27 GLU CB C 13 29.543 0.056 . . . . . . B 140 GLU CB . 34692 1 213 . 2 . 2 27 27 GLU CG C 13 38.303 0.009 . . . . . . B 140 GLU CG . 34692 1 214 . 2 . 2 27 27 GLU N N 15 121.829 0.001 . . . . . . B 140 GLU N . 34692 1 215 . 2 . 2 28 28 LEU H H 1 7.135 0.002 . . . . . . B 141 LEU H . 34692 1 216 . 2 . 2 28 28 LEU CA C 13 58.685 0.000 . . . . . . B 141 LEU CA . 34692 1 217 . 2 . 2 28 28 LEU N N 15 119.912 0.002 . . . . . . B 141 LEU N . 34692 1 218 . 2 . 2 29 29 ASN HA H 1 4.362 0.002 . . . . . . B 142 ASN HA . 34692 1 219 . 2 . 2 29 29 ASN HB2 H 1 2.855 0.000 . . . . . . B 142 ASN HB2 . 34692 1 220 . 2 . 2 29 29 ASN HB3 H 1 2.908 0.001 . . . . . . B 142 ASN HB3 . 34692 1 221 . 2 . 2 29 29 ASN CA C 13 56.669 0.000 . . . . . . B 142 ASN CA . 34692 1 222 . 2 . 2 29 29 ASN CB C 13 38.149 0.010 . . . . . . B 142 ASN CB . 34692 1 223 . 2 . 2 29 29 ASN N N 15 119.731 0.002 . . . . . . B 142 ASN N . 34692 1 224 . 2 . 2 30 30 GLU H H 1 7.675 0.000 . . . . . . B 143 GLU H . 34692 1 225 . 2 . 2 30 30 GLU HA H 1 4.099 0.004 . . . . . . B 143 GLU HA . 34692 1 226 . 2 . 2 30 30 GLU HB2 H 1 2.204 0.002 . . . . . . B 143 GLU HB2 . 34692 1 227 . 2 . 2 30 30 GLU HB3 H 1 2.241 0.029 . . . . . . B 143 GLU HB3 . 34692 1 228 . 2 . 2 30 30 GLU CA C 13 59.165 0.017 . . . . . . B 143 GLU CA . 34692 1 229 . 2 . 2 30 30 GLU CB C 13 29.883 0.013 . . . . . . B 143 GLU CB . 34692 1 230 . 2 . 2 30 30 GLU CG C 13 36.396 0.041 . . . . . . B 143 GLU CG . 34692 1 231 . 2 . 2 30 30 GLU N N 15 119.599 0.002 . . . . . . B 143 GLU N . 34692 1 232 . 2 . 2 31 31 ILE H H 1 7.143 0.002 . . . . . . B 144 ILE H . 34692 1 233 . 2 . 2 31 31 ILE CA C 13 64.111 0.016 . . . . . . B 144 ILE CA . 34692 1 234 . 2 . 2 31 31 ILE N N 15 115.826 0.001 . . . . . . B 144 ILE N . 34692 1 235 . 2 . 2 32 32 PHE HA H 1 4.994 0.002 . . . . . . B 145 PHE HA . 34692 1 236 . 2 . 2 32 32 PHE HB2 H 1 2.833 0.002 . . . . . . B 145 PHE HB2 . 34692 1 237 . 2 . 2 32 32 PHE HB3 H 1 3.633 0.005 . . . . . . B 145 PHE HB3 . 34692 1 238 . 2 . 2 32 32 PHE CA C 13 61.205 0.020 . . . . . . B 145 PHE CA . 34692 1 239 . 2 . 2 32 32 PHE CB C 13 41.219 0.105 . . . . . . B 145 PHE CB . 34692 1 240 . 2 . 2 32 32 PHE N N 15 112.994 0.002 . . . . . . B 145 PHE N . 34692 1 241 . 2 . 2 33 33 GLY H H 1 8.337 0.001 . . . . . . B 146 GLY H . 34692 1 242 . 2 . 2 33 33 GLY CA C 13 48.070 0.000 . . . . . . B 146 GLY CA . 34692 1 243 . 2 . 2 33 33 GLY N N 15 109.476 0.000 . . . . . . B 146 GLY N . 34692 1 244 . 2 . 2 34 34 PRO HA H 1 4.196 0.001 . . . . . . B 147 PRO HA . 34692 1 245 . 2 . 2 34 34 PRO HB2 H 1 0.682 0.002 . . . . . . B 147 PRO HB2 . 34692 1 246 . 2 . 2 34 34 PRO HB3 H 1 2.102 0.004 . . . . . . B 147 PRO HB3 . 34692 1 247 . 2 . 2 34 34 PRO HG2 H 1 1.759 0.003 . . . . . . B 147 PRO HG2 . 34692 1 248 . 2 . 2 34 34 PRO HG3 H 1 1.759 0.003 . . . . . . B 147 PRO HG3 . 34692 1 249 . 2 . 2 34 34 PRO HD2 H 1 3.113 0.004 . . . . . . B 147 PRO HD2 . 34692 1 250 . 2 . 2 34 34 PRO HD3 H 1 3.577 0.001 . . . . . . B 147 PRO HD3 . 34692 1 251 . 2 . 2 34 34 PRO CA C 13 65.042 0.006 . . . . . . B 147 PRO CA . 34692 1 252 . 2 . 2 34 34 PRO CB C 13 31.881 0.028 . . . . . . B 147 PRO CB . 34692 1 253 . 2 . 2 34 34 PRO CG C 13 28.061 0.120 . . . . . . B 147 PRO CG . 34692 1 254 . 2 . 2 34 34 PRO CD C 13 52.270 0.006 . . . . . . B 147 PRO CD . 34692 1 255 . 2 . 2 35 35 PHE H H 1 7.595 0.009 . . . . . . B 148 PHE H . 34692 1 256 . 2 . 2 35 35 PHE HA H 1 4.360 0.009 . . . . . . B 148 PHE HA . 34692 1 257 . 2 . 2 35 35 PHE HB2 H 1 3.051 0.004 . . . . . . B 148 PHE HB2 . 34692 1 258 . 2 . 2 35 35 PHE HB3 H 1 3.271 0.003 . . . . . . B 148 PHE HB3 . 34692 1 259 . 2 . 2 35 35 PHE CA C 13 59.974 0.013 . . . . . . B 148 PHE CA . 34692 1 260 . 2 . 2 35 35 PHE CB C 13 38.418 0.010 . . . . . . B 148 PHE CB . 34692 1 261 . 2 . 2 35 35 PHE N N 15 112.473 0.002 . . . . . . B 148 PHE N . 34692 1 262 . 2 . 2 36 36 GLY H H 1 7.803 0.000 . . . . . . B 149 GLY H . 34692 1 263 . 2 . 2 36 36 GLY CA C 13 44.910 0.000 . . . . . . B 149 GLY CA . 34692 1 264 . 2 . 2 36 36 GLY N N 15 108.572 0.000 . . . . . . B 149 GLY N . 34692 1 265 . 2 . 2 37 37 PRO HA H 1 4.525 0.001 . . . . . . B 150 PRO HA . 34692 1 266 . 2 . 2 37 37 PRO HB2 H 1 1.976 0.007 . . . . . . B 150 PRO HB2 . 34692 1 267 . 2 . 2 37 37 PRO HB3 H 1 2.411 0.003 . . . . . . B 150 PRO HB3 . 34692 1 268 . 2 . 2 37 37 PRO HG2 H 1 2.143 0.002 . . . . . . B 150 PRO HG2 . 34692 1 269 . 2 . 2 37 37 PRO HG3 H 1 2.261 0.001 . . . . . . B 150 PRO HG3 . 34692 1 270 . 2 . 2 37 37 PRO HD2 H 1 3.705 0.003 . . . . . . B 150 PRO HD2 . 34692 1 271 . 2 . 2 37 37 PRO HD3 H 1 3.857 0.006 . . . . . . B 150 PRO HD3 . 34692 1 272 . 2 . 2 37 37 PRO CA C 13 63.630 0.026 . . . . . . B 150 PRO CA . 34692 1 273 . 2 . 2 37 37 PRO CB C 13 32.384 0.019 . . . . . . B 150 PRO CB . 34692 1 274 . 2 . 2 37 37 PRO CG C 13 27.982 0.042 . . . . . . B 150 PRO CG . 34692 1 275 . 2 . 2 37 37 PRO CD C 13 49.974 0.074 . . . . . . B 150 PRO CD . 34692 1 276 . 2 . 2 38 38 MET H H 1 9.101 0.000 . . . . . . B 151 MET H . 34692 1 277 . 2 . 2 38 38 MET HA H 1 4.570 0.018 . . . . . . B 151 MET HA . 34692 1 278 . 2 . 2 38 38 MET CA C 13 55.802 0.040 . . . . . . B 151 MET CA . 34692 1 279 . 2 . 2 38 38 MET CB C 13 35.392 0.051 . . . . . . B 151 MET CB . 34692 1 280 . 2 . 2 38 38 MET N N 15 124.482 0.003 . . . . . . B 151 MET N . 34692 1 281 . 2 . 2 39 39 LYS H H 1 8.977 0.002 . . . . . . B 152 LYS H . 34692 1 282 . 2 . 2 39 39 LYS HA H 1 4.360 0.001 . . . . . . B 152 LYS HA . 34692 1 283 . 2 . 2 39 39 LYS HB2 H 1 1.469 0.001 . . . . . . B 152 LYS HB2 . 34692 1 284 . 2 . 2 39 39 LYS HB3 H 1 1.469 0.001 . . . . . . B 152 LYS HB3 . 34692 1 285 . 2 . 2 39 39 LYS CA C 13 57.211 0.000 . . . . . . B 152 LYS CA . 34692 1 286 . 2 . 2 39 39 LYS CB C 13 34.928 0.005 . . . . . . B 152 LYS CB . 34692 1 287 . 2 . 2 39 39 LYS CG C 13 24.721 0.035 . . . . . . B 152 LYS CG . 34692 1 288 . 2 . 2 39 39 LYS N N 15 123.561 0.002 . . . . . . B 152 LYS N . 34692 1 289 . 2 . 2 40 40 GLU H H 1 7.440 0.004 . . . . . . B 153 GLU H . 34692 1 290 . 2 . 2 40 40 GLU HA H 1 4.480 0.003 . . . . . . B 153 GLU HA . 34692 1 291 . 2 . 2 40 40 GLU HB2 H 1 1.808 0.002 . . . . . . B 153 GLU HB2 . 34692 1 292 . 2 . 2 40 40 GLU HB3 H 1 2.009 0.008 . . . . . . B 153 GLU HB3 . 34692 1 293 . 2 . 2 40 40 GLU CA C 13 56.504 0.002 . . . . . . B 153 GLU CA . 34692 1 294 . 2 . 2 40 40 GLU CB C 13 33.709 0.035 . . . . . . B 153 GLU CB . 34692 1 295 . 2 . 2 40 40 GLU CG C 13 36.366 0.043 . . . . . . B 153 GLU CG . 34692 1 296 . 2 . 2 40 40 GLU N N 15 114.934 0.004 . . . . . . B 153 GLU N . 34692 1 297 . 2 . 2 41 41 VAL H H 1 8.241 0.007 . . . . . . B 154 VAL H . 34692 1 298 . 2 . 2 41 41 VAL CA C 13 61.761 0.039 . . . . . . B 154 VAL CA . 34692 1 299 . 2 . 2 41 41 VAL N N 15 123.529 0.047 . . . . . . B 154 VAL N . 34692 1 300 . 2 . 2 42 42 LYS H H 1 9.204 0.006 . . . . . . B 155 LYS H . 34692 1 301 . 2 . 2 42 42 LYS HA H 1 4.700 0.000 . . . . . . B 155 LYS HA . 34692 1 302 . 2 . 2 42 42 LYS HB2 H 1 1.657 0.009 . . . . . . B 155 LYS HB2 . 34692 1 303 . 2 . 2 42 42 LYS HB3 H 1 1.895 0.008 . . . . . . B 155 LYS HB3 . 34692 1 304 . 2 . 2 42 42 LYS HD2 H 1 1.742 0.000 . . . . . . B 155 LYS HD2 . 34692 1 305 . 2 . 2 42 42 LYS HE2 H 1 3.002 0.000 . . . . . . B 155 LYS HE2 . 34692 1 306 . 2 . 2 42 42 LYS CB C 13 35.944 0.017 . . . . . . B 155 LYS CB . 34692 1 307 . 2 . 2 42 42 LYS CG C 13 24.981 0.029 . . . . . . B 155 LYS CG . 34692 1 308 . 2 . 2 42 42 LYS N N 15 128.760 0.031 . . . . . . B 155 LYS N . 34692 1 309 . 2 . 2 43 43 ILE H H 1 8.855 0.003 . . . . . . B 156 ILE H . 34692 1 310 . 2 . 2 43 43 ILE HA H 1 3.899 0.002 . . . . . . B 156 ILE HA . 34692 1 311 . 2 . 2 43 43 ILE CA C 13 62.306 0.015 . . . . . . B 156 ILE CA . 34692 1 312 . 2 . 2 43 43 ILE CB C 13 38.921 0.018 . . . . . . B 156 ILE CB . 34692 1 313 . 2 . 2 43 43 ILE N N 15 127.444 0.010 . . . . . . B 156 ILE N . 34692 1 314 . 2 . 2 44 44 LEU H H 1 8.201 0.004 . . . . . . B 157 LEU H . 34692 1 315 . 2 . 2 44 44 LEU HA H 1 4.626 0.002 . . . . . . B 157 LEU HA . 34692 1 316 . 2 . 2 44 44 LEU HB2 H 1 0.274 0.005 . . . . . . B 157 LEU HB2 . 34692 1 317 . 2 . 2 44 44 LEU HB3 H 1 1.250 0.006 . . . . . . B 157 LEU HB3 . 34692 1 318 . 2 . 2 44 44 LEU CA C 13 53.824 0.048 . . . . . . B 157 LEU CA . 34692 1 319 . 2 . 2 44 44 LEU CB C 13 39.979 0.011 . . . . . . B 157 LEU CB . 34692 1 320 . 2 . 2 44 44 LEU CG C 13 28.301 0.030 . . . . . . B 157 LEU CG . 34692 1 321 . 2 . 2 44 44 LEU CD1 C 13 25.941 0.003 . . . . . . B 157 LEU CD1 . 34692 1 322 . 2 . 2 44 44 LEU CD2 C 13 25.122 0.000 . . . . . . B 157 LEU CD2 . 34692 1 323 . 2 . 2 44 44 LEU N N 15 132.038 0.006 . . . . . . B 157 LEU N . 34692 1 324 . 2 . 2 45 45 ASN H H 1 7.362 0.005 . . . . . . B 158 ASN H . 34692 1 325 . 2 . 2 45 45 ASN HA H 1 4.761 0.000 . . . . . . B 158 ASN HA . 34692 1 326 . 2 . 2 45 45 ASN CB C 13 36.995 0.008 . . . . . . B 158 ASN CB . 34692 1 327 . 2 . 2 45 45 ASN N N 15 117.610 0.006 . . . . . . B 158 ASN N . 34692 1 328 . 2 . 2 46 46 GLY H H 1 8.720 0.002 . . . . . . B 159 GLY H . 34692 1 329 . 2 . 2 46 46 GLY CA C 13 45.254 0.008 . . . . . . B 159 GLY CA . 34692 1 330 . 2 . 2 46 46 GLY N N 15 111.588 0.003 . . . . . . B 159 GLY N . 34692 1 331 . 2 . 2 47 47 PHE H H 1 7.257 0.011 . . . . . . B 160 PHE H . 34692 1 332 . 2 . 2 47 47 PHE HA H 1 5.156 0.003 . . . . . . B 160 PHE HA . 34692 1 333 . 2 . 2 47 47 PHE HB2 H 1 2.595 0.014 . . . . . . B 160 PHE HB2 . 34692 1 334 . 2 . 2 47 47 PHE HB3 H 1 2.973 0.004 . . . . . . B 160 PHE HB3 . 34692 1 335 . 2 . 2 47 47 PHE HD1 H 1 6.759 0.003 . . . . . . B 160 PHE HD1 . 34692 1 336 . 2 . 2 47 47 PHE HD2 H 1 6.759 0.003 . . . . . . B 160 PHE HD2 . 34692 1 337 . 2 . 2 47 47 PHE HE1 H 1 7.404 0.002 . . . . . . B 160 PHE HE1 . 34692 1 338 . 2 . 2 47 47 PHE HE2 H 1 7.404 0.002 . . . . . . B 160 PHE HE2 . 34692 1 339 . 2 . 2 47 47 PHE HZ H 1 7.457 0.000 . . . . . . B 160 PHE HZ . 34692 1 340 . 2 . 2 47 47 PHE CA C 13 54.877 0.008 . . . . . . B 160 PHE CA . 34692 1 341 . 2 . 2 47 47 PHE CB C 13 41.195 0.093 . . . . . . B 160 PHE CB . 34692 1 342 . 2 . 2 47 47 PHE CD1 C 13 133.124 0.004 . . . . . . B 160 PHE CD1 . 34692 1 343 . 2 . 2 47 47 PHE CE1 C 13 131.461 0.000 . . . . . . B 160 PHE CE1 . 34692 1 344 . 2 . 2 47 47 PHE CZ C 13 130.426 0.000 . . . . . . B 160 PHE CZ . 34692 1 345 . 2 . 2 47 47 PHE N N 15 115.822 0.005 . . . . . . B 160 PHE N . 34692 1 346 . 2 . 2 48 48 ALA H H 1 9.277 0.005 . . . . . . B 161 ALA H . 34692 1 347 . 2 . 2 48 48 ALA HA H 1 4.993 0.007 . . . . . . B 161 ALA HA . 34692 1 348 . 2 . 2 48 48 ALA CA C 13 50.102 0.011 . . . . . . B 161 ALA CA . 34692 1 349 . 2 . 2 48 48 ALA CB C 13 24.702 0.003 . . . . . . B 161 ALA CB . 34692 1 350 . 2 . 2 48 48 ALA N N 15 120.905 0.001 . . . . . . B 161 ALA N . 34692 1 351 . 2 . 2 49 49 PHE H H 1 8.853 0.006 . . . . . . B 162 PHE H . 34692 1 352 . 2 . 2 49 49 PHE HA H 1 5.835 0.002 . . . . . . B 162 PHE HA . 34692 1 353 . 2 . 2 49 49 PHE HB2 H 1 2.634 0.007 . . . . . . B 162 PHE HB2 . 34692 1 354 . 2 . 2 49 49 PHE HB3 H 1 2.817 0.007 . . . . . . B 162 PHE HB3 . 34692 1 355 . 2 . 2 49 49 PHE CA C 13 56.085 0.024 . . . . . . B 162 PHE CA . 34692 1 356 . 2 . 2 49 49 PHE CB C 13 42.188 0.008 . . . . . . B 162 PHE CB . 34692 1 357 . 2 . 2 49 49 PHE N N 15 114.795 0.005 . . . . . . B 162 PHE N . 34692 1 358 . 2 . 2 50 50 VAL H H 1 8.325 0.007 . . . . . . B 163 VAL H . 34692 1 359 . 2 . 2 50 50 VAL HA H 1 4.399 0.004 . . . . . . B 163 VAL HA . 34692 1 360 . 2 . 2 50 50 VAL CA C 13 60.466 0.085 . . . . . . B 163 VAL CA . 34692 1 361 . 2 . 2 50 50 VAL CB C 13 35.059 0.004 . . . . . . B 163 VAL CB . 34692 1 362 . 2 . 2 50 50 VAL N N 15 119.919 0.020 . . . . . . B 163 VAL N . 34692 1 363 . 2 . 2 51 51 GLU H H 1 9.096 0.004 . . . . . . B 164 GLU H . 34692 1 364 . 2 . 2 51 51 GLU HA H 1 5.554 0.014 . . . . . . B 164 GLU HA . 34692 1 365 . 2 . 2 51 51 GLU HB2 H 1 1.827 0.000 . . . . . . B 164 GLU HB2 . 34692 1 366 . 2 . 2 51 51 GLU HB3 H 1 1.901 0.003 . . . . . . B 164 GLU HB3 . 34692 1 367 . 2 . 2 51 51 GLU HG2 H 1 2.138 0.005 . . . . . . B 164 GLU HG2 . 34692 1 368 . 2 . 2 51 51 GLU HG3 H 1 2.255 0.005 . . . . . . B 164 GLU HG3 . 34692 1 369 . 2 . 2 51 51 GLU CA C 13 53.974 0.023 . . . . . . B 164 GLU CA . 34692 1 370 . 2 . 2 51 51 GLU CB C 13 32.602 0.047 . . . . . . B 164 GLU CB . 34692 1 371 . 2 . 2 51 51 GLU CG C 13 37.081 0.037 . . . . . . B 164 GLU CG . 34692 1 372 . 2 . 2 51 51 GLU N N 15 126.536 0.101 . . . . . . B 164 GLU N . 34692 1 373 . 2 . 2 52 52 PHE H H 1 8.516 0.005 . . . . . . B 165 PHE H . 34692 1 374 . 2 . 2 52 52 PHE HA H 1 4.795 0.006 . . . . . . B 165 PHE HA . 34692 1 375 . 2 . 2 52 52 PHE HB2 H 1 2.740 0.002 . . . . . . B 165 PHE HB2 . 34692 1 376 . 2 . 2 52 52 PHE HB3 H 1 3.837 0.036 . . . . . . B 165 PHE HB3 . 34692 1 377 . 2 . 2 52 52 PHE CB C 13 41.871 0.023 . . . . . . B 165 PHE CB . 34692 1 378 . 2 . 2 52 52 PHE N N 15 127.123 0.016 . . . . . . B 165 PHE N . 34692 1 379 . 2 . 2 53 53 GLU HA H 1 4.148 0.004 . . . . . . B 166 GLU HA . 34692 1 380 . 2 . 2 53 53 GLU HB2 H 1 2.006 0.001 . . . . . . B 166 GLU HB2 . 34692 1 381 . 2 . 2 53 53 GLU HB3 H 1 2.264 0.011 . . . . . . B 166 GLU HB3 . 34692 1 382 . 2 . 2 53 53 GLU CA C 13 59.665 0.000 . . . . . . B 166 GLU CA . 34692 1 383 . 2 . 2 53 53 GLU CB C 13 30.665 0.054 . . . . . . B 166 GLU CB . 34692 1 384 . 2 . 2 54 54 GLU H H 1 8.578 0.000 . . . . . . B 167 GLU H . 34692 1 385 . 2 . 2 54 54 GLU HA H 1 4.849 0.003 . . . . . . B 167 GLU HA . 34692 1 386 . 2 . 2 54 54 GLU HB2 H 1 2.101 0.003 . . . . . . B 167 GLU HB2 . 34692 1 387 . 2 . 2 54 54 GLU HB3 H 1 2.398 0.000 . . . . . . B 167 GLU HB3 . 34692 1 388 . 2 . 2 54 54 GLU N N 15 114.371 0.001 . . . . . . B 167 GLU N . 34692 1 389 . 2 . 2 55 55 ALA H H 1 8.952 0.001 . . . . . . B 168 ALA H . 34692 1 390 . 2 . 2 55 55 ALA HA H 1 4.270 0.004 . . . . . . B 168 ALA HA . 34692 1 391 . 2 . 2 55 55 ALA CA C 13 55.035 0.000 . . . . . . B 168 ALA CA . 34692 1 392 . 2 . 2 55 55 ALA CB C 13 18.596 0.001 . . . . . . B 168 ALA CB . 34692 1 393 . 2 . 2 55 55 ALA N N 15 126.819 0.004 . . . . . . B 168 ALA N . 34692 1 394 . 2 . 2 56 56 GLU H H 1 9.477 0.001 . . . . . . B 169 GLU H . 34692 1 395 . 2 . 2 56 56 GLU HA H 1 4.156 0.002 . . . . . . B 169 GLU HA . 34692 1 396 . 2 . 2 56 56 GLU HB2 H 1 2.082 0.002 . . . . . . B 169 GLU HB2 . 34692 1 397 . 2 . 2 56 56 GLU HB3 H 1 2.219 0.002 . . . . . . B 169 GLU HB3 . 34692 1 398 . 2 . 2 56 56 GLU CA C 13 60.320 0.000 . . . . . . B 169 GLU CA . 34692 1 399 . 2 . 2 56 56 GLU CB C 13 29.286 0.015 . . . . . . B 169 GLU CB . 34692 1 400 . 2 . 2 56 56 GLU N N 15 119.026 0.000 . . . . . . B 169 GLU N . 34692 1 401 . 2 . 2 57 57 SER H H 1 7.186 0.003 . . . . . . B 170 SER H . 34692 1 402 . 2 . 2 57 57 SER HA H 1 4.092 0.001 . . . . . . B 170 SER HA . 34692 1 403 . 2 . 2 57 57 SER CA C 13 61.933 0.021 . . . . . . B 170 SER CA . 34692 1 404 . 2 . 2 57 57 SER CB C 13 63.206 0.041 . . . . . . B 170 SER CB . 34692 1 405 . 2 . 2 57 57 SER N N 15 114.455 0.003 . . . . . . B 170 SER N . 34692 1 406 . 2 . 2 58 58 ALA H H 1 6.791 0.003 . . . . . . B 171 ALA H . 34692 1 407 . 2 . 2 58 58 ALA HA H 1 3.751 0.006 . . . . . . B 171 ALA HA . 34692 1 408 . 2 . 2 58 58 ALA CA C 13 55.006 0.000 . . . . . . B 171 ALA CA . 34692 1 409 . 2 . 2 58 58 ALA CB C 13 18.280 0.003 . . . . . . B 171 ALA CB . 34692 1 410 . 2 . 2 58 58 ALA N N 15 121.626 0.001 . . . . . . B 171 ALA N . 34692 1 411 . 2 . 2 59 59 ALA H H 1 7.796 0.003 . . . . . . B 172 ALA H . 34692 1 412 . 2 . 2 59 59 ALA HA H 1 4.075 0.002 . . . . . . B 172 ALA HA . 34692 1 413 . 2 . 2 59 59 ALA CA C 13 55.071 0.007 . . . . . . B 172 ALA CA . 34692 1 414 . 2 . 2 59 59 ALA CB C 13 18.173 0.003 . . . . . . B 172 ALA CB . 34692 1 415 . 2 . 2 59 59 ALA N N 15 117.704 0.001 . . . . . . B 172 ALA N . 34692 1 416 . 2 . 2 60 60 LYS H H 1 7.612 0.019 . . . . . . B 173 LYS H . 34692 1 417 . 2 . 2 60 60 LYS HA H 1 4.066 0.004 . . . . . . B 173 LYS HA . 34692 1 418 . 2 . 2 60 60 LYS CA C 13 58.449 0.026 . . . . . . B 173 LYS CA . 34692 1 419 . 2 . 2 60 60 LYS CB C 13 32.306 0.062 . . . . . . B 173 LYS CB . 34692 1 420 . 2 . 2 60 60 LYS N N 15 119.167 0.066 . . . . . . B 173 LYS N . 34692 1 421 . 2 . 2 61 61 ALA H H 1 7.682 0.003 . . . . . . B 174 ALA H . 34692 1 422 . 2 . 2 61 61 ALA HA H 1 2.651 0.003 . . . . . . B 174 ALA HA . 34692 1 423 . 2 . 2 61 61 ALA CA C 13 54.437 0.001 . . . . . . B 174 ALA CA . 34692 1 424 . 2 . 2 61 61 ALA CB C 13 18.788 0.003 . . . . . . B 174 ALA CB . 34692 1 425 . 2 . 2 61 61 ALA N N 15 121.114 0.000 . . . . . . B 174 ALA N . 34692 1 426 . 2 . 2 62 62 ILE H H 1 7.665 0.001 . . . . . . B 175 ILE H . 34692 1 427 . 2 . 2 62 62 ILE CA C 13 66.490 0.007 . . . . . . B 175 ILE CA . 34692 1 428 . 2 . 2 62 62 ILE N N 15 117.317 0.002 . . . . . . B 175 ILE N . 34692 1 429 . 2 . 2 63 63 GLU H H 1 7.264 0.002 . . . . . . B 176 GLU H . 34692 1 430 . 2 . 2 63 63 GLU HA H 1 3.995 0.003 . . . . . . B 176 GLU HA . 34692 1 431 . 2 . 2 63 63 GLU HB2 H 1 2.216 0.001 . . . . . . B 176 GLU HB2 . 34692 1 432 . 2 . 2 63 63 GLU HB3 H 1 2.216 0.001 . . . . . . B 176 GLU HB3 . 34692 1 433 . 2 . 2 63 63 GLU HG2 H 1 2.326 0.009 . . . . . . B 176 GLU HG2 . 34692 1 434 . 2 . 2 63 63 GLU HG3 H 1 2.462 0.002 . . . . . . B 176 GLU HG3 . 34692 1 435 . 2 . 2 63 63 GLU CA C 13 59.407 0.009 . . . . . . B 176 GLU CA . 34692 1 436 . 2 . 2 63 63 GLU CB C 13 30.170 0.009 . . . . . . B 176 GLU CB . 34692 1 437 . 2 . 2 63 63 GLU CG C 13 36.320 0.011 . . . . . . B 176 GLU CG . 34692 1 438 . 2 . 2 63 63 GLU N N 15 116.795 0.000 . . . . . . B 176 GLU N . 34692 1 439 . 2 . 2 64 64 GLU H H 1 8.014 0.003 . . . . . . B 177 GLU H . 34692 1 440 . 2 . 2 64 64 GLU HA H 1 4.482 0.002 . . . . . . B 177 GLU HA . 34692 1 441 . 2 . 2 64 64 GLU HB2 H 1 1.968 0.002 . . . . . . B 177 GLU HB2 . 34692 1 442 . 2 . 2 64 64 GLU HB3 H 1 2.287 0.002 . . . . . . B 177 GLU HB3 . 34692 1 443 . 2 . 2 64 64 GLU CA C 13 57.806 0.022 . . . . . . B 177 GLU CA . 34692 1 444 . 2 . 2 64 64 GLU CB C 13 31.654 0.005 . . . . . . B 177 GLU CB . 34692 1 445 . 2 . 2 64 64 GLU N N 15 114.369 0.001 . . . . . . B 177 GLU N . 34692 1 446 . 2 . 2 65 65 VAL H H 1 8.619 0.003 . . . . . . B 178 VAL H . 34692 1 447 . 2 . 2 65 65 VAL HA H 1 4.011 0.010 . . . . . . B 178 VAL HA . 34692 1 448 . 2 . 2 65 65 VAL CA C 13 63.775 0.006 . . . . . . B 178 VAL CA . 34692 1 449 . 2 . 2 65 65 VAL CB C 13 32.272 0.000 . . . . . . B 178 VAL CB . 34692 1 450 . 2 . 2 65 65 VAL N N 15 118.272 0.000 . . . . . . B 178 VAL N . 34692 1 451 . 2 . 2 66 66 HIS H H 1 7.579 0.002 . . . . . . B 179 HIS H . 34692 1 452 . 2 . 2 66 66 HIS HA H 1 4.196 0.003 . . . . . . B 179 HIS HA . 34692 1 453 . 2 . 2 66 66 HIS HB2 H 1 3.293 0.006 . . . . . . B 179 HIS HB2 . 34692 1 454 . 2 . 2 66 66 HIS HB3 H 1 3.377 0.008 . . . . . . B 179 HIS HB3 . 34692 1 455 . 2 . 2 66 66 HIS CA C 13 60.483 0.002 . . . . . . B 179 HIS CA . 34692 1 456 . 2 . 2 66 66 HIS CB C 13 31.521 0.013 . . . . . . B 179 HIS CB . 34692 1 457 . 2 . 2 66 66 HIS N N 15 118.340 0.012 . . . . . . B 179 HIS N . 34692 1 458 . 2 . 2 67 67 GLY H H 1 8.885 0.000 . . . . . . B 180 GLY H . 34692 1 459 . 2 . 2 67 67 GLY CA C 13 45.177 0.001 . . . . . . B 180 GLY CA . 34692 1 460 . 2 . 2 67 67 GLY N N 15 116.939 0.001 . . . . . . B 180 GLY N . 34692 1 461 . 2 . 2 68 68 LYS H H 1 8.397 0.005 . . . . . . B 181 LYS H . 34692 1 462 . 2 . 2 68 68 LYS HA H 1 4.305 0.002 . . . . . . B 181 LYS HA . 34692 1 463 . 2 . 2 68 68 LYS HB2 H 1 1.911 0.003 . . . . . . B 181 LYS HB2 . 34692 1 464 . 2 . 2 68 68 LYS HB3 H 1 2.108 0.002 . . . . . . B 181 LYS HB3 . 34692 1 465 . 2 . 2 68 68 LYS HG2 H 1 1.460 0.001 . . . . . . B 181 LYS HG2 . 34692 1 466 . 2 . 2 68 68 LYS HG3 H 1 1.689 0.000 . . . . . . B 181 LYS HG3 . 34692 1 467 . 2 . 2 68 68 LYS CA C 13 56.078 0.020 . . . . . . B 181 LYS CA . 34692 1 468 . 2 . 2 68 68 LYS CB C 13 32.968 0.030 . . . . . . B 181 LYS CB . 34692 1 469 . 2 . 2 68 68 LYS CG C 13 25.540 0.011 . . . . . . B 181 LYS CG . 34692 1 470 . 2 . 2 68 68 LYS CD C 13 28.996 0.020 . . . . . . B 181 LYS CD . 34692 1 471 . 2 . 2 68 68 LYS N N 15 122.818 0.000 . . . . . . B 181 LYS N . 34692 1 472 . 2 . 2 69 69 SER HA H 1 4.747 0.000 . . . . . . B 182 SER HA . 34692 1 473 . 2 . 2 69 69 SER HB2 H 1 3.597 0.000 . . . . . . B 182 SER HB2 . 34692 1 474 . 2 . 2 69 69 SER HB3 H 1 3.675 0.001 . . . . . . B 182 SER HB3 . 34692 1 475 . 2 . 2 69 69 SER CB C 13 64.462 0.008 . . . . . . B 182 SER CB . 34692 1 476 . 2 . 2 69 69 SER N N 15 116.700 0.002 . . . . . . B 182 SER N . 34692 1 477 . 2 . 2 70 70 PHE H H 1 9.059 0.002 . . . . . . B 183 PHE H . 34692 1 478 . 2 . 2 70 70 PHE HA H 1 4.495 0.006 . . . . . . B 183 PHE HA . 34692 1 479 . 2 . 2 70 70 PHE HB2 H 1 2.872 0.002 . . . . . . B 183 PHE HB2 . 34692 1 480 . 2 . 2 70 70 PHE HB3 H 1 2.989 0.004 . . . . . . B 183 PHE HB3 . 34692 1 481 . 2 . 2 70 70 PHE CA C 13 58.531 0.000 . . . . . . B 183 PHE CA . 34692 1 482 . 2 . 2 70 70 PHE CB C 13 42.381 0.030 . . . . . . B 183 PHE CB . 34692 1 483 . 2 . 2 70 70 PHE CD1 C 13 132.105 0.023 . . . . . . B 183 PHE CD1 . 34692 1 484 . 2 . 2 70 70 PHE N N 15 126.206 0.004 . . . . . . B 183 PHE N . 34692 1 485 . 2 . 2 71 71 ALA H H 1 8.803 0.004 . . . . . . B 184 ALA H . 34692 1 486 . 2 . 2 71 71 ALA HA H 1 3.788 0.002 . . . . . . B 184 ALA HA . 34692 1 487 . 2 . 2 71 71 ALA CA C 13 53.432 0.018 . . . . . . B 184 ALA CA . 34692 1 488 . 2 . 2 71 71 ALA CB C 13 16.414 0.007 . . . . . . B 184 ALA CB . 34692 1 489 . 2 . 2 71 71 ALA N N 15 132.770 0.002 . . . . . . B 184 ALA N . 34692 1 490 . 2 . 2 72 72 ASN H H 1 8.471 0.001 . . . . . . B 185 ASN H . 34692 1 491 . 2 . 2 72 72 ASN HA H 1 4.136 0.001 . . . . . . B 185 ASN HA . 34692 1 492 . 2 . 2 72 72 ASN CA C 13 54.812 0.004 . . . . . . B 185 ASN CA . 34692 1 493 . 2 . 2 72 72 ASN CB C 13 38.139 0.008 . . . . . . B 185 ASN CB . 34692 1 494 . 2 . 2 72 72 ASN N N 15 107.815 0.005 . . . . . . B 185 ASN N . 34692 1 495 . 2 . 2 73 73 GLN H H 1 7.761 0.007 . . . . . . B 186 GLN H . 34692 1 496 . 2 . 2 73 73 GLN HA H 1 4.957 0.003 . . . . . . B 186 GLN HA . 34692 1 497 . 2 . 2 73 73 GLN CA C 13 52.936 0.000 . . . . . . B 186 GLN CA . 34692 1 498 . 2 . 2 73 73 GLN CB C 13 31.125 0.004 . . . . . . B 186 GLN CB . 34692 1 499 . 2 . 2 73 73 GLN N N 15 118.031 0.000 . . . . . . B 186 GLN N . 34692 1 500 . 2 . 2 74 74 PRO HA H 1 4.242 0.003 . . . . . . B 187 PRO HA . 34692 1 501 . 2 . 2 74 74 PRO HB2 H 1 1.795 0.003 . . . . . . B 187 PRO HB2 . 34692 1 502 . 2 . 2 74 74 PRO HB3 H 1 1.996 0.005 . . . . . . B 187 PRO HB3 . 34692 1 503 . 2 . 2 74 74 PRO HD2 H 1 3.685 0.000 . . . . . . B 187 PRO HD2 . 34692 1 504 . 2 . 2 74 74 PRO CA C 13 62.200 0.007 . . . . . . B 187 PRO CA . 34692 1 505 . 2 . 2 74 74 PRO CB C 13 31.584 0.031 . . . . . . B 187 PRO CB . 34692 1 506 . 2 . 2 74 74 PRO CG C 13 27.515 0.026 . . . . . . B 187 PRO CG . 34692 1 507 . 2 . 2 75 75 LEU H H 1 8.625 0.001 . . . . . . B 188 LEU H . 34692 1 508 . 2 . 2 75 75 LEU HA H 1 4.474 0.022 . . . . . . B 188 LEU HA . 34692 1 509 . 2 . 2 75 75 LEU HB2 H 1 0.914 0.008 . . . . . . B 188 LEU HB2 . 34692 1 510 . 2 . 2 75 75 LEU HB3 H 1 1.907 0.032 . . . . . . B 188 LEU HB3 . 34692 1 511 . 2 . 2 75 75 LEU HG H 1 1.838 0.001 . . . . . . B 188 LEU HG . 34692 1 512 . 2 . 2 75 75 LEU CA C 13 54.303 0.037 . . . . . . B 188 LEU CA . 34692 1 513 . 2 . 2 75 75 LEU CB C 13 43.602 0.024 . . . . . . B 188 LEU CB . 34692 1 514 . 2 . 2 75 75 LEU N N 15 122.901 0.001 . . . . . . B 188 LEU N . 34692 1 515 . 2 . 2 76 76 GLU H H 1 9.545 0.001 . . . . . . B 189 GLU H . 34692 1 516 . 2 . 2 76 76 GLU HA H 1 4.996 0.002 . . . . . . B 189 GLU HA . 34692 1 517 . 2 . 2 76 76 GLU HB2 H 1 2.015 0.000 . . . . . . B 189 GLU HB2 . 34692 1 518 . 2 . 2 76 76 GLU HB3 H 1 2.051 0.000 . . . . . . B 189 GLU HB3 . 34692 1 519 . 2 . 2 76 76 GLU HG2 H 1 2.235 0.001 . . . . . . B 189 GLU HG2 . 34692 1 520 . 2 . 2 76 76 GLU HG3 H 1 2.311 0.002 . . . . . . B 189 GLU HG3 . 34692 1 521 . 2 . 2 76 76 GLU CA C 13 54.740 0.000 . . . . . . B 189 GLU CA . 34692 1 522 . 2 . 2 76 76 GLU CB C 13 31.194 0.013 . . . . . . B 189 GLU CB . 34692 1 523 . 2 . 2 76 76 GLU CG C 13 36.508 0.025 . . . . . . B 189 GLU CG . 34692 1 524 . 2 . 2 76 76 GLU N N 15 125.015 0.002 . . . . . . B 189 GLU N . 34692 1 525 . 2 . 2 77 77 VAL H H 1 10.811 0.006 . . . . . . B 190 VAL H . 34692 1 526 . 2 . 2 77 77 VAL HA H 1 4.697 0.005 . . . . . . B 190 VAL HA . 34692 1 527 . 2 . 2 77 77 VAL CB C 13 33.820 0.019 . . . . . . B 190 VAL CB . 34692 1 528 . 2 . 2 77 77 VAL N N 15 129.555 0.004 . . . . . . B 190 VAL N . 34692 1 529 . 2 . 2 78 78 VAL HA H 1 4.729 0.019 . . . . . . B 191 VAL HA . 34692 1 530 . 2 . 2 78 78 VAL CB C 13 36.695 0.022 . . . . . . B 191 VAL CB . 34692 1 531 . 2 . 2 78 78 VAL N N 15 116.590 0.006 . . . . . . B 191 VAL N . 34692 1 532 . 2 . 2 79 79 TYR H H 1 8.104 0.006 . . . . . . B 192 TYR H . 34692 1 533 . 2 . 2 79 79 TYR HA H 1 4.696 0.000 . . . . . . B 192 TYR HA . 34692 1 534 . 2 . 2 79 79 TYR HB2 H 1 2.803 0.005 . . . . . . B 192 TYR HB2 . 34692 1 535 . 2 . 2 79 79 TYR HB3 H 1 3.722 0.010 . . . . . . B 192 TYR HB3 . 34692 1 536 . 2 . 2 79 79 TYR CB C 13 39.397 0.017 . . . . . . B 192 TYR CB . 34692 1 537 . 2 . 2 79 79 TYR N N 15 119.501 0.004 . . . . . . B 192 TYR N . 34692 1 538 . 2 . 2 80 80 SER H H 1 9.152 0.004 . . . . . . B 193 SER H . 34692 1 539 . 2 . 2 80 80 SER HB2 H 1 3.975 0.010 . . . . . . B 193 SER HB2 . 34692 1 540 . 2 . 2 80 80 SER HB3 H 1 3.975 0.010 . . . . . . B 193 SER HB3 . 34692 1 541 . 2 . 2 80 80 SER CB C 13 66.352 0.000 . . . . . . B 193 SER CB . 34692 1 542 . 2 . 2 80 80 SER N N 15 117.017 0.000 . . . . . . B 193 SER N . 34692 1 543 . 2 . 2 81 81 LYS HA H 1 4.600 0.004 . . . . . . B 194 LYS HA . 34692 1 544 . 2 . 2 81 81 LYS HB2 H 1 1.686 0.003 . . . . . . B 194 LYS HB2 . 34692 1 545 . 2 . 2 81 81 LYS HB3 H 1 1.873 0.004 . . . . . . B 194 LYS HB3 . 34692 1 546 . 2 . 2 81 81 LYS HG2 H 1 1.406 0.014 . . . . . . B 194 LYS HG2 . 34692 1 547 . 2 . 2 81 81 LYS HG3 H 1 1.406 0.014 . . . . . . B 194 LYS HG3 . 34692 1 548 . 2 . 2 81 81 LYS HD2 H 1 1.463 0.000 . . . . . . B 194 LYS HD2 . 34692 1 549 . 2 . 2 81 81 LYS HD3 H 1 1.551 0.002 . . . . . . B 194 LYS HD3 . 34692 1 550 . 2 . 2 81 81 LYS CB C 13 33.654 0.031 . . . . . . B 194 LYS CB . 34692 1 551 . 2 . 2 81 81 LYS CG C 13 25.521 0.020 . . . . . . B 194 LYS CG . 34692 1 552 . 2 . 2 81 81 LYS CD C 13 29.344 0.012 . . . . . . B 194 LYS CD . 34692 1 553 . 2 . 2 82 82 LEU H H 1 8.292 0.000 . . . . . . B 195 LEU H . 34692 1 554 . 2 . 2 82 82 LEU HA H 1 4.522 0.000 . . . . . . B 195 LEU HA . 34692 1 555 . 2 . 2 82 82 LEU HB2 H 1 1.499 0.004 . . . . . . B 195 LEU HB2 . 34692 1 556 . 2 . 2 82 82 LEU HB3 H 1 1.499 0.004 . . . . . . B 195 LEU HB3 . 34692 1 557 . 2 . 2 82 82 LEU CA C 13 53.526 0.011 . . . . . . B 195 LEU CA . 34692 1 558 . 2 . 2 82 82 LEU CB C 13 41.358 0.187 . . . . . . B 195 LEU CB . 34692 1 559 . 2 . 2 82 82 LEU CG C 13 27.155 0.006 . . . . . . B 195 LEU CG . 34692 1 560 . 2 . 2 82 82 LEU CD1 C 13 23.007 0.000 . . . . . . B 195 LEU CD1 . 34692 1 561 . 2 . 2 82 82 LEU CD2 C 13 25.547 0.000 . . . . . . B 195 LEU CD2 . 34692 1 562 . 2 . 2 83 83 PRO HA H 1 4.291 0.009 . . . . . . B 196 PRO HA . 34692 1 563 . 2 . 2 83 83 PRO HB2 H 1 1.674 0.027 . . . . . . B 196 PRO HB2 . 34692 1 564 . 2 . 2 83 83 PRO HB3 H 1 1.674 0.027 . . . . . . B 196 PRO HB3 . 34692 1 565 . 2 . 2 83 83 PRO HG2 H 1 1.782 0.019 . . . . . . B 196 PRO HG2 . 34692 1 566 . 2 . 2 83 83 PRO HG3 H 1 1.782 0.019 . . . . . . B 196 PRO HG3 . 34692 1 567 . 2 . 2 83 83 PRO HD2 H 1 3.508 0.017 . . . . . . B 196 PRO HD2 . 34692 1 568 . 2 . 2 83 83 PRO HD3 H 1 3.729 0.005 . . . . . . B 196 PRO HD3 . 34692 1 569 . 2 . 2 83 83 PRO CA C 13 62.894 0.180 . . . . . . B 196 PRO CA . 34692 1 570 . 2 . 2 83 83 PRO CB C 13 31.899 0.004 . . . . . . B 196 PRO CB . 34692 1 571 . 2 . 2 83 83 PRO CG C 13 27.303 0.016 . . . . . . B 196 PRO CG . 34692 1 572 . 2 . 2 83 83 PRO CD C 13 50.292 0.018 . . . . . . B 196 PRO CD . 34692 1 573 . 2 . 2 84 84 ALA H H 1 8.287 0.005 . . . . . . B 197 ALA H . 34692 1 574 . 2 . 2 84 84 ALA HA H 1 4.175 0.006 . . . . . . B 197 ALA HA . 34692 1 575 . 2 . 2 84 84 ALA CA C 13 52.049 0.002 . . . . . . B 197 ALA CA . 34692 1 576 . 2 . 2 84 84 ALA CB C 13 19.259 0.002 . . . . . . B 197 ALA CB . 34692 1 577 . 2 . 2 84 84 ALA N N 15 124.598 0.001 . . . . . . B 197 ALA N . 34692 1 578 . 2 . 2 85 85 LYS H H 1 8.160 0.005 . . . . . . B 198 LYS H . 34692 1 579 . 2 . 2 85 85 LYS HA H 1 3.991 0.006 . . . . . . B 198 LYS HA . 34692 1 580 . 2 . 2 85 85 LYS CA C 13 56.603 0.031 . . . . . . B 198 LYS CA . 34692 1 581 . 2 . 2 85 85 LYS CB C 13 32.918 0.032 . . . . . . B 198 LYS CB . 34692 1 582 . 2 . 2 85 85 LYS N N 15 121.902 0.028 . . . . . . B 198 LYS N . 34692 1 583 . 2 . 2 86 86 ARG H H 1 7.902 0.001 . . . . . . B 199 ARG H . 34692 1 584 . 2 . 2 86 86 ARG HA H 1 4.307 0.003 . . . . . . B 199 ARG HA . 34692 1 585 . 2 . 2 86 86 ARG HB2 H 1 1.515 0.005 . . . . . . B 199 ARG HB2 . 34692 1 586 . 2 . 2 86 86 ARG HB3 H 1 1.433 0.001 . . . . . . B 199 ARG HB3 . 34692 1 587 . 2 . 2 86 86 ARG HG2 H 1 1.547 0.000 . . . . . . B 199 ARG HG2 . 34692 1 588 . 2 . 2 86 86 ARG HG3 H 1 1.439 0.000 . . . . . . B 199 ARG HG3 . 34692 1 589 . 2 . 2 86 86 ARG CA C 13 54.529 0.008 . . . . . . B 199 ARG CA . 34692 1 590 . 2 . 2 86 86 ARG CB C 13 32.171 0.033 . . . . . . B 199 ARG CB . 34692 1 591 . 2 . 2 86 86 ARG CG C 13 26.866 0.035 . . . . . . B 199 ARG CG . 34692 1 592 . 2 . 2 86 86 ARG N N 15 121.348 0.001 . . . . . . B 199 ARG N . 34692 1 593 . 2 . 2 87 87 TYR H H 1 8.554 0.001 . . . . . . B 200 TYR H . 34692 1 594 . 2 . 2 87 87 TYR HA H 1 4.649 0.021 . . . . . . B 200 TYR HA . 34692 1 595 . 2 . 2 87 87 TYR HB2 H 1 3.257 0.002 . . . . . . B 200 TYR HB2 . 34692 1 596 . 2 . 2 87 87 TYR HB3 H 1 2.981 0.001 . . . . . . B 200 TYR HB3 . 34692 1 597 . 2 . 2 87 87 TYR CA C 13 57.499 0.076 . . . . . . B 200 TYR CA . 34692 1 598 . 2 . 2 87 87 TYR CB C 13 37.588 0.023 . . . . . . B 200 TYR CB . 34692 1 599 . 2 . 2 87 87 TYR N N 15 122.835 0.002 . . . . . . B 200 TYR N . 34692 1 600 . 2 . 2 88 88 ARG H H 1 8.906 0.015 . . . . . . B 201 ARG H . 34692 1 601 . 2 . 2 88 88 ARG HA H 1 5.635 0.003 . . . . . . B 201 ARG HA . 34692 1 602 . 2 . 2 88 88 ARG HB2 H 1 2.020 0.003 . . . . . . B 201 ARG HB2 . 34692 1 603 . 2 . 2 88 88 ARG HB3 H 1 1.388 0.002 . . . . . . B 201 ARG HB3 . 34692 1 604 . 2 . 2 88 88 ARG CA C 13 54.773 0.020 . . . . . . B 201 ARG CA . 34692 1 605 . 2 . 2 88 88 ARG CB C 13 36.276 0.037 . . . . . . B 201 ARG CB . 34692 1 606 . 2 . 2 88 88 ARG CG C 13 28.762 0.003 . . . . . . B 201 ARG CG . 34692 1 607 . 2 . 2 88 88 ARG N N 15 127.170 0.005 . . . . . . B 201 ARG N . 34692 1 608 . 2 . 2 89 89 ILE H H 1 9.202 0.014 . . . . . . B 202 ILE H . 34692 1 609 . 2 . 2 89 89 ILE HA H 1 5.281 0.001 . . . . . . B 202 ILE HA . 34692 1 610 . 2 . 2 89 89 ILE HD11 H 1 0.978 0.008 . . . . . . B 202 ILE HD11 . 34692 1 611 . 2 . 2 89 89 ILE HD12 H 1 0.978 0.008 . . . . . . B 202 ILE HD12 . 34692 1 612 . 2 . 2 89 89 ILE HD13 H 1 0.978 0.008 . . . . . . B 202 ILE HD13 . 34692 1 613 . 2 . 2 89 89 ILE CA C 13 59.156 0.013 . . . . . . B 202 ILE CA . 34692 1 614 . 2 . 2 89 89 ILE CB C 13 40.908 0.033 . . . . . . B 202 ILE CB . 34692 1 615 . 2 . 2 89 89 ILE CD1 C 13 14.184 0.049 . . . . . . B 202 ILE CD1 . 34692 1 616 . 2 . 2 89 89 ILE N N 15 118.252 0.154 . . . . . . B 202 ILE N . 34692 1 617 . 2 . 2 90 90 THR HA H 1 4.987 0.003 . . . . . . B 203 THR HA . 34692 1 618 . 2 . 2 90 90 THR CA C 13 61.357 0.011 . . . . . . B 203 THR CA . 34692 1 619 . 2 . 2 90 90 THR CB C 13 70.371 0.004 . . . . . . B 203 THR CB . 34692 1 620 . 2 . 2 90 90 THR N N 15 117.944 0.001 . . . . . . B 203 THR N . 34692 1 621 . 2 . 2 91 91 MET H H 1 8.797 0.002 . . . . . . B 204 MET H . 34692 1 622 . 2 . 2 91 91 MET HA H 1 5.298 0.002 . . . . . . B 204 MET HA . 34692 1 623 . 2 . 2 91 91 MET HB2 H 1 2.003 0.005 . . . . . . B 204 MET HB2 . 34692 1 624 . 2 . 2 91 91 MET HB3 H 1 1.643 0.004 . . . . . . B 204 MET HB3 . 34692 1 625 . 2 . 2 91 91 MET HG2 H 1 2.398 0.026 . . . . . . B 204 MET HG2 . 34692 1 626 . 2 . 2 91 91 MET HG3 H 1 2.368 0.022 . . . . . . B 204 MET HG3 . 34692 1 627 . 2 . 2 91 91 MET CA C 13 53.960 0.014 . . . . . . B 204 MET CA . 34692 1 628 . 2 . 2 91 91 MET CB C 13 35.938 0.053 . . . . . . B 204 MET CB . 34692 1 629 . 2 . 2 91 91 MET CG C 13 31.762 0.022 . . . . . . B 204 MET CG . 34692 1 630 . 2 . 2 91 91 MET N N 15 123.793 0.004 . . . . . . B 204 MET N . 34692 1 631 . 2 . 2 92 92 LYS H H 1 8.983 0.003 . . . . . . B 205 LYS H . 34692 1 632 . 2 . 2 92 92 LYS CA C 13 55.174 0.000 . . . . . . B 205 LYS CA . 34692 1 633 . 2 . 2 92 92 LYS N N 15 120.714 0.005 . . . . . . B 205 LYS N . 34692 1 634 . 2 . 2 93 93 ASN H H 1 8.379 0.056 . . . . . . B 206 ASN H . 34692 1 635 . 2 . 2 93 93 ASN HA H 1 4.414 0.003 . . . . . . B 206 ASN HA . 34692 1 636 . 2 . 2 93 93 ASN HB2 H 1 3.584 0.002 . . . . . . B 206 ASN HB2 . 34692 1 637 . 2 . 2 93 93 ASN HB3 H 1 2.954 0.001 . . . . . . B 206 ASN HB3 . 34692 1 638 . 2 . 2 93 93 ASN CA C 13 54.005 0.011 . . . . . . B 206 ASN CA . 34692 1 639 . 2 . 2 93 93 ASN CB C 13 38.218 0.006 . . . . . . B 206 ASN CB . 34692 1 640 . 2 . 2 94 94 LEU H H 1 9.029 0.002 . . . . . . B 207 LEU H . 34692 1 641 . 2 . 2 94 94 LEU HA H 1 4.329 0.000 . . . . . . B 207 LEU HA . 34692 1 642 . 2 . 2 94 94 LEU HB2 H 1 1.570 0.004 . . . . . . B 207 LEU HB2 . 34692 1 643 . 2 . 2 94 94 LEU HB3 H 1 1.468 0.000 . . . . . . B 207 LEU HB3 . 34692 1 644 . 2 . 2 94 94 LEU CA C 13 53.655 0.000 . . . . . . B 207 LEU CA . 34692 1 645 . 2 . 2 94 94 LEU CB C 13 40.977 0.005 . . . . . . B 207 LEU CB . 34692 1 646 . 2 . 2 94 94 LEU N N 15 116.812 0.001 . . . . . . B 207 LEU N . 34692 1 647 . 2 . 2 95 95 PRO HA H 1 4.545 0.017 . . . . . . B 208 PRO HA . 34692 1 648 . 2 . 2 95 95 PRO HB2 H 1 2.241 0.004 . . . . . . B 208 PRO HB2 . 34692 1 649 . 2 . 2 95 95 PRO HB3 H 1 1.958 0.016 . . . . . . B 208 PRO HB3 . 34692 1 650 . 2 . 2 95 95 PRO CA C 13 62.131 0.032 . . . . . . B 208 PRO CA . 34692 1 651 . 2 . 2 95 95 PRO CB C 13 31.968 0.024 . . . . . . B 208 PRO CB . 34692 1 652 . 2 . 2 96 96 GLU H H 1 8.436 0.002 . . . . . . B 209 GLU H . 34692 1 653 . 2 . 2 96 96 GLU HA H 1 3.746 0.004 . . . . . . B 209 GLU HA . 34692 1 654 . 2 . 2 96 96 GLU HB2 H 1 1.915 0.006 . . . . . . B 209 GLU HB2 . 34692 1 655 . 2 . 2 96 96 GLU HB3 H 1 1.915 0.006 . . . . . . B 209 GLU HB3 . 34692 1 656 . 2 . 2 96 96 GLU HG2 H 1 2.238 0.000 . . . . . . B 209 GLU HG2 . 34692 1 657 . 2 . 2 96 96 GLU HG3 H 1 2.203 0.000 . . . . . . B 209 GLU HG3 . 34692 1 658 . 2 . 2 96 96 GLU CA C 13 58.052 0.003 . . . . . . B 209 GLU CA . 34692 1 659 . 2 . 2 96 96 GLU CB C 13 29.578 0.032 . . . . . . B 209 GLU CB . 34692 1 660 . 2 . 2 96 96 GLU CG C 13 36.275 0.002 . . . . . . B 209 GLU CG . 34692 1 661 . 2 . 2 96 96 GLU N N 15 120.447 0.001 . . . . . . B 209 GLU N . 34692 1 662 . 2 . 2 97 97 GLY H H 1 8.354 0.006 . . . . . . B 210 GLY H . 34692 1 663 . 2 . 2 97 97 GLY CA C 13 45.252 0.006 . . . . . . B 210 GLY CA . 34692 1 664 . 2 . 2 97 97 GLY N N 15 112.247 0.001 . . . . . . B 210 GLY N . 34692 1 665 . 2 . 2 98 98 CYS H H 1 7.553 0.002 . . . . . . B 211 CYS H . 34692 1 666 . 2 . 2 98 98 CYS HA H 1 4.540 0.002 . . . . . . B 211 CYS HA . 34692 1 667 . 2 . 2 98 98 CYS HB2 H 1 3.015 0.009 . . . . . . B 211 CYS HB2 . 34692 1 668 . 2 . 2 98 98 CYS HB3 H 1 2.972 0.001 . . . . . . B 211 CYS HB3 . 34692 1 669 . 2 . 2 98 98 CYS CA C 13 59.841 0.024 . . . . . . B 211 CYS CA . 34692 1 670 . 2 . 2 98 98 CYS CB C 13 28.061 0.011 . . . . . . B 211 CYS CB . 34692 1 671 . 2 . 2 98 98 CYS N N 15 119.226 0.004 . . . . . . B 211 CYS N . 34692 1 672 . 2 . 2 99 99 SER H H 1 9.182 0.009 . . . . . . B 212 SER H . 34692 1 673 . 2 . 2 99 99 SER HA H 1 5.070 0.010 . . . . . . B 212 SER HA . 34692 1 674 . 2 . 2 99 99 SER HB2 H 1 4.137 0.007 . . . . . . B 212 SER HB2 . 34692 1 675 . 2 . 2 99 99 SER HB3 H 1 3.942 0.013 . . . . . . B 212 SER HB3 . 34692 1 676 . 2 . 2 99 99 SER CA C 13 55.845 0.131 . . . . . . B 212 SER CA . 34692 1 677 . 2 . 2 99 99 SER CB C 13 67.501 0.015 . . . . . . B 212 SER CB . 34692 1 678 . 2 . 2 99 99 SER N N 15 122.327 0.008 . . . . . . B 212 SER N . 34692 1 679 . 2 . 2 100 100 TRP H H 1 8.639 0.005 . . . . . . B 213 TRP H . 34692 1 680 . 2 . 2 100 100 TRP HA H 1 4.083 0.006 . . . . . . B 213 TRP HA . 34692 1 681 . 2 . 2 100 100 TRP HB2 H 1 3.384 0.003 . . . . . . B 213 TRP HB2 . 34692 1 682 . 2 . 2 100 100 TRP HB3 H 1 3.006 0.004 . . . . . . B 213 TRP HB3 . 34692 1 683 . 2 . 2 100 100 TRP CA C 13 60.011 0.107 . . . . . . B 213 TRP CA . 34692 1 684 . 2 . 2 100 100 TRP CB C 13 27.236 0.015 . . . . . . B 213 TRP CB . 34692 1 685 . 2 . 2 100 100 TRP N N 15 119.883 0.029 . . . . . . B 213 TRP N . 34692 1 686 . 2 . 2 101 101 GLN H H 1 7.895 0.002 . . . . . . B 214 GLN H . 34692 1 687 . 2 . 2 101 101 GLN HA H 1 2.646 0.010 . . . . . . B 214 GLN HA . 34692 1 688 . 2 . 2 101 101 GLN HB2 H 1 1.063 0.011 . . . . . . B 214 GLN HB2 . 34692 1 689 . 2 . 2 101 101 GLN HB3 H 1 0.926 0.027 . . . . . . B 214 GLN HB3 . 34692 1 690 . 2 . 2 101 101 GLN CA C 13 61.184 0.017 . . . . . . B 214 GLN CA . 34692 1 691 . 2 . 2 101 101 GLN CB C 13 26.408 0.070 . . . . . . B 214 GLN CB . 34692 1 692 . 2 . 2 101 101 GLN N N 15 126.678 0.012 . . . . . . B 214 GLN N . 34692 1 693 . 2 . 2 102 102 ASP H H 1 7.565 0.001 . . . . . . B 215 ASP H . 34692 1 694 . 2 . 2 102 102 ASP HA H 1 4.306 0.004 . . . . . . B 215 ASP HA . 34692 1 695 . 2 . 2 102 102 ASP HB2 H 1 3.369 0.003 . . . . . . B 215 ASP HB2 . 34692 1 696 . 2 . 2 102 102 ASP HB3 H 1 2.739 0.002 . . . . . . B 215 ASP HB3 . 34692 1 697 . 2 . 2 102 102 ASP CA C 13 57.262 0.010 . . . . . . B 215 ASP CA . 34692 1 698 . 2 . 2 102 102 ASP CB C 13 41.571 0.070 . . . . . . B 215 ASP CB . 34692 1 699 . 2 . 2 102 102 ASP N N 15 118.720 0.008 . . . . . . B 215 ASP N . 34692 1 700 . 2 . 2 103 103 LEU H H 1 7.376 0.007 . . . . . . B 216 LEU H . 34692 1 701 . 2 . 2 103 103 LEU HA H 1 3.945 0.003 . . . . . . B 216 LEU HA . 34692 1 702 . 2 . 2 103 103 LEU HB2 H 1 1.843 0.006 . . . . . . B 216 LEU HB2 . 34692 1 703 . 2 . 2 103 103 LEU HB3 H 1 1.500 0.005 . . . . . . B 216 LEU HB3 . 34692 1 704 . 2 . 2 103 103 LEU CA C 13 57.353 0.066 . . . . . . B 216 LEU CA . 34692 1 705 . 2 . 2 103 103 LEU CB C 13 41.931 0.023 . . . . . . B 216 LEU CB . 34692 1 706 . 2 . 2 103 103 LEU CG C 13 27.039 0.039 . . . . . . B 216 LEU CG . 34692 1 707 . 2 . 2 103 103 LEU N N 15 118.206 0.005 . . . . . . B 216 LEU N . 34692 1 708 . 2 . 2 104 104 LYS H H 1 7.560 0.003 . . . . . . B 217 LYS H . 34692 1 709 . 2 . 2 104 104 LYS HA H 1 3.897 0.005 . . . . . . B 217 LYS HA . 34692 1 710 . 2 . 2 104 104 LYS HB2 H 1 2.044 0.000 . . . . . . B 217 LYS HB2 . 34692 1 711 . 2 . 2 104 104 LYS HG2 H 1 1.630 0.001 . . . . . . B 217 LYS HG2 . 34692 1 712 . 2 . 2 104 104 LYS HG3 H 1 1.549 0.013 . . . . . . B 217 LYS HG3 . 34692 1 713 . 2 . 2 104 104 LYS CA C 13 60.819 0.000 . . . . . . B 217 LYS CA . 34692 1 714 . 2 . 2 104 104 LYS CB C 13 32.342 0.000 . . . . . . B 217 LYS CB . 34692 1 715 . 2 . 2 104 104 LYS CG C 13 27.247 0.023 . . . . . . B 217 LYS CG . 34692 1 716 . 2 . 2 104 104 LYS CD C 13 29.931 0.000 . . . . . . B 217 LYS CD . 34692 1 717 . 2 . 2 104 104 LYS N N 15 119.723 0.004 . . . . . . B 217 LYS N . 34692 1 718 . 2 . 2 105 105 ASP H H 1 8.331 0.003 . . . . . . B 218 ASP H . 34692 1 719 . 2 . 2 105 105 ASP HA H 1 4.496 0.002 . . . . . . B 218 ASP HA . 34692 1 720 . 2 . 2 105 105 ASP HB2 H 1 2.969 0.004 . . . . . . B 218 ASP HB2 . 34692 1 721 . 2 . 2 105 105 ASP HB3 H 1 2.858 0.004 . . . . . . B 218 ASP HB3 . 34692 1 722 . 2 . 2 105 105 ASP CA C 13 57.633 0.018 . . . . . . B 218 ASP CA . 34692 1 723 . 2 . 2 105 105 ASP CB C 13 39.516 0.016 . . . . . . B 218 ASP CB . 34692 1 724 . 2 . 2 105 105 ASP N N 15 121.002 0.003 . . . . . . B 218 ASP N . 34692 1 725 . 2 . 2 106 106 LEU H H 1 7.989 0.010 . . . . . . B 219 LEU H . 34692 1 726 . 2 . 2 106 106 LEU HA H 1 4.120 0.008 . . . . . . B 219 LEU HA . 34692 1 727 . 2 . 2 106 106 LEU HB2 H 1 1.824 0.004 . . . . . . B 219 LEU HB2 . 34692 1 728 . 2 . 2 106 106 LEU HB3 H 1 1.195 0.015 . . . . . . B 219 LEU HB3 . 34692 1 729 . 2 . 2 106 106 LEU HG H 1 1.133 0.004 . . . . . . B 219 LEU HG . 34692 1 730 . 2 . 2 106 106 LEU CA C 13 58.073 0.231 . . . . . . B 219 LEU CA . 34692 1 731 . 2 . 2 106 106 LEU CB C 13 41.450 0.022 . . . . . . B 219 LEU CB . 34692 1 732 . 2 . 2 106 106 LEU N N 15 123.316 0.003 . . . . . . B 219 LEU N . 34692 1 733 . 2 . 2 107 107 ALA H H 1 8.039 0.009 . . . . . . B 220 ALA H . 34692 1 734 . 2 . 2 107 107 ALA HA H 1 3.991 0.018 . . . . . . B 220 ALA HA . 34692 1 735 . 2 . 2 107 107 ALA CA C 13 56.304 0.000 . . . . . . B 220 ALA CA . 34692 1 736 . 2 . 2 107 107 ALA CB C 13 18.025 0.000 . . . . . . B 220 ALA CB . 34692 1 737 . 2 . 2 107 107 ALA N N 15 121.714 0.151 . . . . . . B 220 ALA N . 34692 1 738 . 2 . 2 108 108 ARG H H 1 8.537 0.004 . . . . . . B 221 ARG H . 34692 1 739 . 2 . 2 108 108 ARG HA H 1 4.128 0.003 . . . . . . B 221 ARG HA . 34692 1 740 . 2 . 2 108 108 ARG HB2 H 1 2.133 0.023 . . . . . . B 221 ARG HB2 . 34692 1 741 . 2 . 2 108 108 ARG HB3 H 1 2.133 0.023 . . . . . . B 221 ARG HB3 . 34692 1 742 . 2 . 2 108 108 ARG HG2 H 1 1.894 0.003 . . . . . . B 221 ARG HG2 . 34692 1 743 . 2 . 2 108 108 ARG HG3 H 1 1.734 0.016 . . . . . . B 221 ARG HG3 . 34692 1 744 . 2 . 2 108 108 ARG CA C 13 60.336 0.006 . . . . . . B 221 ARG CA . 34692 1 745 . 2 . 2 108 108 ARG CB C 13 30.106 0.141 . . . . . . B 221 ARG CB . 34692 1 746 . 2 . 2 108 108 ARG CG C 13 28.239 0.020 . . . . . . B 221 ARG CG . 34692 1 747 . 2 . 2 108 108 ARG CD C 13 43.280 0.035 . . . . . . B 221 ARG CD . 34692 1 748 . 2 . 2 108 108 ARG N N 15 120.837 0.006 . . . . . . B 221 ARG N . 34692 1 749 . 2 . 2 109 109 GLU H H 1 8.666 0.001 . . . . . . B 222 GLU H . 34692 1 750 . 2 . 2 109 109 GLU HA H 1 4.227 0.006 . . . . . . B 222 GLU HA . 34692 1 751 . 2 . 2 109 109 GLU CA C 13 59.015 0.000 . . . . . . B 222 GLU CA . 34692 1 752 . 2 . 2 109 109 GLU CB C 13 29.480 0.029 . . . . . . B 222 GLU CB . 34692 1 753 . 2 . 2 109 109 GLU N N 15 121.271 0.004 . . . . . . B 222 GLU N . 34692 1 754 . 2 . 2 110 110 ASN H H 1 7.602 0.367 . . . . . . B 223 ASN H . 34692 1 755 . 2 . 2 110 110 ASN HA H 1 4.808 0.004 . . . . . . B 223 ASN HA . 34692 1 756 . 2 . 2 110 110 ASN CA C 13 54.246 0.014 . . . . . . B 223 ASN CA . 34692 1 757 . 2 . 2 110 110 ASN CB C 13 40.580 0.047 . . . . . . B 223 ASN CB . 34692 1 758 . 2 . 2 110 110 ASN N N 15 118.402 3.041 . . . . . . B 223 ASN N . 34692 1 759 . 2 . 2 111 111 SER H H 1 8.060 0.000 . . . . . . B 224 SER H . 34692 1 760 . 2 . 2 111 111 SER HA H 1 4.099 0.001 . . . . . . B 224 SER HA . 34692 1 761 . 2 . 2 111 111 SER HB2 H 1 4.200 0.003 . . . . . . B 224 SER HB2 . 34692 1 762 . 2 . 2 111 111 SER HB3 H 1 4.047 0.003 . . . . . . B 224 SER HB3 . 34692 1 763 . 2 . 2 111 111 SER CA C 13 59.216 0.000 . . . . . . B 224 SER CA . 34692 1 764 . 2 . 2 111 111 SER CB C 13 61.366 0.010 . . . . . . B 224 SER CB . 34692 1 765 . 2 . 2 111 111 SER N N 15 110.214 0.000 . . . . . . B 224 SER N . 34692 1 766 . 2 . 2 112 112 LEU H H 1 7.917 0.001 . . . . . . B 225 LEU H . 34692 1 767 . 2 . 2 112 112 LEU HA H 1 4.674 0.003 . . . . . . B 225 LEU HA . 34692 1 768 . 2 . 2 112 112 LEU HB2 H 1 1.852 0.009 . . . . . . B 225 LEU HB2 . 34692 1 769 . 2 . 2 112 112 LEU HB3 H 1 1.130 0.002 . . . . . . B 225 LEU HB3 . 34692 1 770 . 2 . 2 112 112 LEU HG H 1 0.848 0.002 . . . . . . B 225 LEU HG . 34692 1 771 . 2 . 2 112 112 LEU CB C 13 43.359 0.016 . . . . . . B 225 LEU CB . 34692 1 772 . 2 . 2 112 112 LEU N N 15 119.258 0.009 . . . . . . B 225 LEU N . 34692 1 773 . 2 . 2 113 113 GLU H H 1 8.050 0.002 . . . . . . B 226 GLU H . 34692 1 774 . 2 . 2 113 113 GLU HA H 1 4.425 0.008 . . . . . . B 226 GLU HA . 34692 1 775 . 2 . 2 113 113 GLU HB2 H 1 2.080 0.041 . . . . . . B 226 GLU HB2 . 34692 1 776 . 2 . 2 113 113 GLU HB3 H 1 2.044 0.000 . . . . . . B 226 GLU HB3 . 34692 1 777 . 2 . 2 113 113 GLU CA C 13 56.619 0.000 . . . . . . B 226 GLU CA . 34692 1 778 . 2 . 2 113 113 GLU CB C 13 30.660 0.029 . . . . . . B 226 GLU CB . 34692 1 779 . 2 . 2 113 113 GLU N N 15 125.702 0.007 . . . . . . B 226 GLU N . 34692 1 780 . 2 . 2 114 114 THR H H 1 7.914 0.002 . . . . . . B 227 THR H . 34692 1 781 . 2 . 2 114 114 THR HA H 1 5.116 0.002 . . . . . . B 227 THR HA . 34692 1 782 . 2 . 2 114 114 THR HB H 1 4.057 0.002 . . . . . . B 227 THR HB . 34692 1 783 . 2 . 2 114 114 THR HG21 H 1 1.133 0.008 . . . . . . B 227 THR HG21 . 34692 1 784 . 2 . 2 114 114 THR HG22 H 1 1.133 0.008 . . . . . . B 227 THR HG22 . 34692 1 785 . 2 . 2 114 114 THR HG23 H 1 1.133 0.008 . . . . . . B 227 THR HG23 . 34692 1 786 . 2 . 2 114 114 THR CA C 13 59.647 0.026 . . . . . . B 227 THR CA . 34692 1 787 . 2 . 2 114 114 THR CB C 13 72.233 0.002 . . . . . . B 227 THR CB . 34692 1 788 . 2 . 2 114 114 THR CG2 C 13 23.378 0.005 . . . . . . B 227 THR CG2 . 34692 1 789 . 2 . 2 114 114 THR N N 15 111.564 0.003 . . . . . . B 227 THR N . 34692 1 790 . 2 . 2 115 115 THR H H 1 8.742 0.001 . . . . . . B 228 THR H . 34692 1 791 . 2 . 2 115 115 THR HA H 1 4.503 0.003 . . . . . . B 228 THR HA . 34692 1 792 . 2 . 2 115 115 THR CA C 13 62.208 0.026 . . . . . . B 228 THR CA . 34692 1 793 . 2 . 2 115 115 THR CB C 13 68.289 0.015 . . . . . . B 228 THR CB . 34692 1 794 . 2 . 2 115 115 THR N N 15 112.916 0.006 . . . . . . B 228 THR N . 34692 1 795 . 2 . 2 116 116 PHE H H 1 7.217 0.004 . . . . . . B 229 PHE H . 34692 1 796 . 2 . 2 116 116 PHE HA H 1 4.503 0.006 . . . . . . B 229 PHE HA . 34692 1 797 . 2 . 2 116 116 PHE CA C 13 59.041 0.042 . . . . . . B 229 PHE CA . 34692 1 798 . 2 . 2 116 116 PHE CB C 13 43.081 0.016 . . . . . . B 229 PHE CB . 34692 1 799 . 2 . 2 116 116 PHE N N 15 120.245 0.011 . . . . . . B 229 PHE N . 34692 1 800 . 2 . 2 117 117 SER H H 1 7.867 0.006 . . . . . . B 230 SER H . 34692 1 801 . 2 . 2 117 117 SER HA H 1 5.220 0.003 . . . . . . B 230 SER HA . 34692 1 802 . 2 . 2 117 117 SER HB2 H 1 3.693 0.001 . . . . . . B 230 SER HB2 . 34692 1 803 . 2 . 2 117 117 SER HB3 H 1 3.693 0.001 . . . . . . B 230 SER HB3 . 34692 1 804 . 2 . 2 117 117 SER CA C 13 55.627 0.016 . . . . . . B 230 SER CA . 34692 1 805 . 2 . 2 117 117 SER CB C 13 66.237 0.000 . . . . . . B 230 SER CB . 34692 1 806 . 2 . 2 117 117 SER N N 15 120.101 0.000 . . . . . . B 230 SER N . 34692 1 807 . 2 . 2 118 118 SER H H 1 9.050 0.006 . . . . . . B 231 SER H . 34692 1 808 . 2 . 2 118 118 SER HA H 1 4.898 0.002 . . . . . . B 231 SER HA . 34692 1 809 . 2 . 2 118 118 SER HB2 H 1 3.718 0.000 . . . . . . B 231 SER HB2 . 34692 1 810 . 2 . 2 118 118 SER HB3 H 1 3.792 0.004 . . . . . . B 231 SER HB3 . 34692 1 811 . 2 . 2 118 118 SER CA C 13 57.231 0.000 . . . . . . B 231 SER CA . 34692 1 812 . 2 . 2 118 118 SER CB C 13 65.930 0.012 . . . . . . B 231 SER CB . 34692 1 813 . 2 . 2 118 118 SER N N 15 118.932 0.009 . . . . . . B 231 SER N . 34692 1 814 . 2 . 2 119 119 VAL H H 1 8.279 0.008 . . . . . . B 232 VAL H . 34692 1 815 . 2 . 2 119 119 VAL HA H 1 4.496 0.004 . . . . . . B 232 VAL HA . 34692 1 816 . 2 . 2 119 119 VAL CA C 13 62.025 0.031 . . . . . . B 232 VAL CA . 34692 1 817 . 2 . 2 119 119 VAL CB C 13 36.056 0.017 . . . . . . B 232 VAL CB . 34692 1 818 . 2 . 2 119 119 VAL N N 15 119.724 0.004 . . . . . . B 232 VAL N . 34692 1 819 . 2 . 2 120 120 ASN H H 1 8.571 0.000 . . . . . . B 233 ASN H . 34692 1 820 . 2 . 2 120 120 ASN HA H 1 4.897 0.006 . . . . . . B 233 ASN HA . 34692 1 821 . 2 . 2 120 120 ASN HB2 H 1 3.248 0.003 . . . . . . B 233 ASN HB2 . 34692 1 822 . 2 . 2 120 120 ASN HB3 H 1 2.829 0.005 . . . . . . B 233 ASN HB3 . 34692 1 823 . 2 . 2 120 120 ASN CA C 13 53.393 0.027 . . . . . . B 233 ASN CA . 34692 1 824 . 2 . 2 120 120 ASN CB C 13 37.861 0.017 . . . . . . B 233 ASN CB . 34692 1 825 . 2 . 2 120 120 ASN N N 15 124.490 0.001 . . . . . . B 233 ASN N . 34692 1 826 . 2 . 2 121 121 THR H H 1 8.315 0.007 . . . . . . B 234 THR H . 34692 1 827 . 2 . 2 121 121 THR CA C 13 62.651 0.005 . . . . . . B 234 THR CA . 34692 1 828 . 2 . 2 121 121 THR N N 15 116.225 0.007 . . . . . . B 234 THR N . 34692 1 829 . 2 . 2 122 122 ARG H H 1 8.237 0.014 . . . . . . B 235 ARG H . 34692 1 830 . 2 . 2 122 122 ARG HA H 1 4.321 0.004 . . . . . . B 235 ARG HA . 34692 1 831 . 2 . 2 122 122 ARG CA C 13 57.913 0.032 . . . . . . B 235 ARG CA . 34692 1 832 . 2 . 2 122 122 ARG CB C 13 30.517 0.031 . . . . . . B 235 ARG CB . 34692 1 833 . 2 . 2 122 122 ARG N N 15 123.109 0.002 . . . . . . B 235 ARG N . 34692 1 834 . 2 . 2 123 123 ASP H H 1 7.859 0.010 . . . . . . B 236 ASP H . 34692 1 835 . 2 . 2 123 123 ASP CA C 13 52.939 0.000 . . . . . . B 236 ASP CA . 34692 1 836 . 2 . 2 123 123 ASP N N 15 118.940 0.003 . . . . . . B 236 ASP N . 34692 1 837 . 2 . 2 124 124 PHE H H 1 7.885 0.002 . . . . . . B 237 PHE H . 34692 1 838 . 2 . 2 124 124 PHE HA H 1 4.518 0.002 . . . . . . B 237 PHE HA . 34692 1 839 . 2 . 2 124 124 PHE HB2 H 1 3.219 0.008 . . . . . . B 237 PHE HB2 . 34692 1 840 . 2 . 2 124 124 PHE HB3 H 1 3.219 0.008 . . . . . . B 237 PHE HB3 . 34692 1 841 . 2 . 2 124 124 PHE CA C 13 59.619 0.000 . . . . . . B 237 PHE CA . 34692 1 842 . 2 . 2 124 124 PHE CB C 13 38.891 0.000 . . . . . . B 237 PHE CB . 34692 1 843 . 2 . 2 124 124 PHE N N 15 119.416 0.000 . . . . . . B 237 PHE N . 34692 1 844 . 2 . 2 125 125 ASP H H 1 8.062 0.001 . . . . . . B 238 ASP H . 34692 1 845 . 2 . 2 125 125 ASP HA H 1 4.704 0.000 . . . . . . B 238 ASP HA . 34692 1 846 . 2 . 2 125 125 ASP HB2 H 1 3.061 0.003 . . . . . . B 238 ASP HB2 . 34692 1 847 . 2 . 2 125 125 ASP HB3 H 1 2.559 0.003 . . . . . . B 238 ASP HB3 . 34692 1 848 . 2 . 2 125 125 ASP CB C 13 41.162 0.018 . . . . . . B 238 ASP CB . 34692 1 849 . 2 . 2 125 125 ASP N N 15 123.802 0.005 . . . . . . B 238 ASP N . 34692 1 850 . 2 . 2 126 126 GLY H H 1 6.837 0.003 . . . . . . B 239 GLY H . 34692 1 851 . 2 . 2 126 126 GLY CA C 13 46.348 0.045 . . . . . . B 239 GLY CA . 34692 1 852 . 2 . 2 126 126 GLY N N 15 107.287 0.005 . . . . . . B 239 GLY N . 34692 1 853 . 2 . 2 127 127 THR H H 1 7.759 0.002 . . . . . . B 240 THR H . 34692 1 854 . 2 . 2 127 127 THR HA H 1 5.698 0.001 . . . . . . B 240 THR HA . 34692 1 855 . 2 . 2 127 127 THR CA C 13 60.349 0.001 . . . . . . B 240 THR CA . 34692 1 856 . 2 . 2 127 127 THR CB C 13 72.882 0.025 . . . . . . B 240 THR CB . 34692 1 857 . 2 . 2 127 127 THR N N 15 109.525 0.001 . . . . . . B 240 THR N . 34692 1 858 . 2 . 2 128 128 GLY CA C 13 45.762 0.032 . . . . . . B 241 GLY CA . 34692 1 859 . 2 . 2 128 128 GLY N N 15 108.296 0.002 . . . . . . B 241 GLY N . 34692 1 860 . 2 . 2 129 129 ALA H H 1 9.431 0.003 . . . . . . B 242 ALA H . 34692 1 861 . 2 . 2 129 129 ALA HA H 1 5.457 0.003 . . . . . . B 242 ALA HA . 34692 1 862 . 2 . 2 129 129 ALA CA C 13 52.178 0.002 . . . . . . B 242 ALA CA . 34692 1 863 . 2 . 2 129 129 ALA CB C 13 22.727 0.003 . . . . . . B 242 ALA CB . 34692 1 864 . 2 . 2 129 129 ALA N N 15 123.594 0.002 . . . . . . B 242 ALA N . 34692 1 865 . 2 . 2 130 130 LEU H H 1 7.987 0.010 . . . . . . B 243 LEU H . 34692 1 866 . 2 . 2 130 130 LEU HA H 1 5.004 0.003 . . . . . . B 243 LEU HA . 34692 1 867 . 2 . 2 130 130 LEU HB2 H 1 1.452 0.004 . . . . . . B 243 LEU HB2 . 34692 1 868 . 2 . 2 130 130 LEU HB3 H 1 0.967 0.013 . . . . . . B 243 LEU HB3 . 34692 1 869 . 2 . 2 130 130 LEU CA C 13 53.491 0.018 . . . . . . B 243 LEU CA . 34692 1 870 . 2 . 2 130 130 LEU CB C 13 48.891 0.008 . . . . . . B 243 LEU CB . 34692 1 871 . 2 . 2 130 130 LEU CG C 13 26.888 0.000 . . . . . . B 243 LEU CG . 34692 1 872 . 2 . 2 130 130 LEU N N 15 117.650 0.002 . . . . . . B 243 LEU N . 34692 1 873 . 2 . 2 131 131 GLU H H 1 8.224 0.001 . . . . . . B 244 GLU H . 34692 1 874 . 2 . 2 131 131 GLU HA H 1 5.452 0.005 . . . . . . B 244 GLU HA . 34692 1 875 . 2 . 2 131 131 GLU HB2 H 1 2.099 0.002 . . . . . . B 244 GLU HB2 . 34692 1 876 . 2 . 2 131 131 GLU HB3 H 1 1.882 0.005 . . . . . . B 244 GLU HB3 . 34692 1 877 . 2 . 2 131 131 GLU HG2 H 1 2.278 0.007 . . . . . . B 244 GLU HG2 . 34692 1 878 . 2 . 2 131 131 GLU HG3 H 1 2.178 0.000 . . . . . . B 244 GLU HG3 . 34692 1 879 . 2 . 2 131 131 GLU CA C 13 53.753 0.024 . . . . . . B 244 GLU CA . 34692 1 880 . 2 . 2 131 131 GLU CB C 13 32.656 0.040 . . . . . . B 244 GLU CB . 34692 1 881 . 2 . 2 131 131 GLU CG C 13 36.927 0.023 . . . . . . B 244 GLU CG . 34692 1 882 . 2 . 2 131 131 GLU N N 15 117.518 0.034 . . . . . . B 244 GLU N . 34692 1 883 . 2 . 2 132 132 PHE H H 1 8.832 0.005 . . . . . . B 245 PHE H . 34692 1 884 . 2 . 2 132 132 PHE HA H 1 5.386 0.007 . . . . . . B 245 PHE HA . 34692 1 885 . 2 . 2 132 132 PHE CA C 13 55.795 0.018 . . . . . . B 245 PHE CA . 34692 1 886 . 2 . 2 132 132 PHE CB C 13 42.249 0.032 . . . . . . B 245 PHE CB . 34692 1 887 . 2 . 2 132 132 PHE CD1 C 13 133.252 0.008 . . . . . . B 245 PHE CD1 . 34692 1 888 . 2 . 2 132 132 PHE N N 15 118.619 0.019 . . . . . . B 245 PHE N . 34692 1 889 . 2 . 2 133 133 PRO HA H 1 4.700 0.002 . . . . . . B 246 PRO HA . 34692 1 890 . 2 . 2 133 133 PRO HB2 H 1 2.420 0.003 . . . . . . B 246 PRO HB2 . 34692 1 891 . 2 . 2 133 133 PRO HB3 H 1 2.124 0.005 . . . . . . B 246 PRO HB3 . 34692 1 892 . 2 . 2 133 133 PRO CB C 13 32.675 0.109 . . . . . . B 246 PRO CB . 34692 1 893 . 2 . 2 133 133 PRO CG C 13 27.186 0.028 . . . . . . B 246 PRO CG . 34692 1 894 . 2 . 2 134 134 SER H H 1 6.917 0.008 . . . . . . B 247 SER H . 34692 1 895 . 2 . 2 134 134 SER HA H 1 4.360 0.002 . . . . . . B 247 SER HA . 34692 1 896 . 2 . 2 134 134 SER CA C 13 56.003 0.000 . . . . . . B 247 SER CA . 34692 1 897 . 2 . 2 134 134 SER CB C 13 66.681 0.011 . . . . . . B 247 SER CB . 34692 1 898 . 2 . 2 134 134 SER N N 15 107.775 0.005 . . . . . . B 247 SER N . 34692 1 899 . 2 . 2 135 135 GLU H H 1 8.120 0.003 . . . . . . B 248 GLU H . 34692 1 900 . 2 . 2 135 135 GLU HA H 1 3.434 0.001 . . . . . . B 248 GLU HA . 34692 1 901 . 2 . 2 135 135 GLU HB2 H 1 1.860 0.002 . . . . . . B 248 GLU HB2 . 34692 1 902 . 2 . 2 135 135 GLU HB3 H 1 1.746 0.001 . . . . . . B 248 GLU HB3 . 34692 1 903 . 2 . 2 135 135 GLU HG2 H 1 2.353 0.002 . . . . . . B 248 GLU HG2 . 34692 1 904 . 2 . 2 135 135 GLU HG3 H 1 2.115 0.006 . . . . . . B 248 GLU HG3 . 34692 1 905 . 2 . 2 135 135 GLU CA C 13 58.495 0.008 . . . . . . B 248 GLU CA . 34692 1 906 . 2 . 2 135 135 GLU CB C 13 29.626 0.018 . . . . . . B 248 GLU CB . 34692 1 907 . 2 . 2 135 135 GLU CG C 13 36.157 0.005 . . . . . . B 248 GLU CG . 34692 1 908 . 2 . 2 135 135 GLU N N 15 122.695 0.006 . . . . . . B 248 GLU N . 34692 1 909 . 2 . 2 136 136 GLU H H 1 8.542 0.000 . . . . . . B 249 GLU H . 34692 1 910 . 2 . 2 136 136 GLU HA H 1 3.876 0.003 . . . . . . B 249 GLU HA . 34692 1 911 . 2 . 2 136 136 GLU HB2 H 1 2.037 0.009 . . . . . . B 249 GLU HB2 . 34692 1 912 . 2 . 2 136 136 GLU HB3 H 1 1.924 0.002 . . . . . . B 249 GLU HB3 . 34692 1 913 . 2 . 2 136 136 GLU CA C 13 60.541 0.029 . . . . . . B 249 GLU CA . 34692 1 914 . 2 . 2 136 136 GLU CB C 13 28.950 0.004 . . . . . . B 249 GLU CB . 34692 1 915 . 2 . 2 136 136 GLU N N 15 117.184 0.004 . . . . . . B 249 GLU N . 34692 1 916 . 2 . 2 137 137 ILE H H 1 7.281 0.000 . . . . . . B 250 ILE H . 34692 1 917 . 2 . 2 137 137 ILE HA H 1 3.734 0.003 . . . . . . B 250 ILE HA . 34692 1 918 . 2 . 2 137 137 ILE HD11 H 1 1.039 0.001 . . . . . . B 250 ILE HD11 . 34692 1 919 . 2 . 2 137 137 ILE HD12 H 1 1.039 0.001 . . . . . . B 250 ILE HD12 . 34692 1 920 . 2 . 2 137 137 ILE HD13 H 1 1.039 0.001 . . . . . . B 250 ILE HD13 . 34692 1 921 . 2 . 2 137 137 ILE CA C 13 64.256 0.015 . . . . . . B 250 ILE CA . 34692 1 922 . 2 . 2 137 137 ILE CB C 13 38.609 0.005 . . . . . . B 250 ILE CB . 34692 1 923 . 2 . 2 137 137 ILE CD1 C 13 13.796 0.002 . . . . . . B 250 ILE CD1 . 34692 1 924 . 2 . 2 137 137 ILE N N 15 119.295 0.002 . . . . . . B 250 ILE N . 34692 1 925 . 2 . 2 138 138 LEU H H 1 7.154 0.002 . . . . . . B 251 LEU H . 34692 1 926 . 2 . 2 138 138 LEU HA H 1 3.218 0.002 . . . . . . B 251 LEU HA . 34692 1 927 . 2 . 2 138 138 LEU HB2 H 1 2.175 0.017 . . . . . . B 251 LEU HB2 . 34692 1 928 . 2 . 2 138 138 LEU HB3 H 1 1.573 0.002 . . . . . . B 251 LEU HB3 . 34692 1 929 . 2 . 2 138 138 LEU CA C 13 59.241 0.001 . . . . . . B 251 LEU CA . 34692 1 930 . 2 . 2 138 138 LEU CB C 13 41.465 0.012 . . . . . . B 251 LEU CB . 34692 1 931 . 2 . 2 138 138 LEU CG C 13 27.527 0.018 . . . . . . B 251 LEU CG . 34692 1 932 . 2 . 2 138 138 LEU N N 15 121.871 0.001 . . . . . . B 251 LEU N . 34692 1 933 . 2 . 2 139 139 VAL H H 1 8.343 0.000 . . . . . . B 252 VAL H . 34692 1 934 . 2 . 2 139 139 VAL HA H 1 3.489 0.003 . . . . . . B 252 VAL HA . 34692 1 935 . 2 . 2 139 139 VAL CA C 13 67.231 0.003 . . . . . . B 252 VAL CA . 34692 1 936 . 2 . 2 139 139 VAL CB C 13 31.632 0.003 . . . . . . B 252 VAL CB . 34692 1 937 . 2 . 2 139 139 VAL N N 15 117.864 0.001 . . . . . . B 252 VAL N . 34692 1 938 . 2 . 2 140 140 GLU H H 1 7.272 0.006 . . . . . . B 253 GLU H . 34692 1 939 . 2 . 2 140 140 GLU HA H 1 4.088 0.002 . . . . . . B 253 GLU HA . 34692 1 940 . 2 . 2 140 140 GLU HB2 H 1 2.131 0.007 . . . . . . B 253 GLU HB2 . 34692 1 941 . 2 . 2 140 140 GLU HB3 H 1 1.913 0.004 . . . . . . B 253 GLU HB3 . 34692 1 942 . 2 . 2 140 140 GLU CA C 13 59.264 0.000 . . . . . . B 253 GLU CA . 34692 1 943 . 2 . 2 140 140 GLU CB C 13 29.339 0.149 . . . . . . B 253 GLU CB . 34692 1 944 . 2 . 2 140 140 GLU CG C 13 36.287 0.045 . . . . . . B 253 GLU CG . 34692 1 945 . 2 . 2 140 140 GLU N N 15 120.504 0.002 . . . . . . B 253 GLU N . 34692 1 946 . 2 . 2 141 141 ALA H H 1 8.513 0.002 . . . . . . B 254 ALA H . 34692 1 947 . 2 . 2 141 141 ALA HA H 1 3.723 0.001 . . . . . . B 254 ALA HA . 34692 1 948 . 2 . 2 141 141 ALA CA C 13 55.583 0.008 . . . . . . B 254 ALA CA . 34692 1 949 . 2 . 2 141 141 ALA CB C 13 20.544 0.000 . . . . . . B 254 ALA CB . 34692 1 950 . 2 . 2 141 141 ALA N N 15 122.990 0.002 . . . . . . B 254 ALA N . 34692 1 951 . 2 . 2 142 142 LEU H H 1 8.138 0.001 . . . . . . B 255 LEU H . 34692 1 952 . 2 . 2 142 142 LEU HA H 1 3.845 0.001 . . . . . . B 255 LEU HA . 34692 1 953 . 2 . 2 142 142 LEU HB2 H 1 2.014 0.002 . . . . . . B 255 LEU HB2 . 34692 1 954 . 2 . 2 142 142 LEU HB3 H 1 1.504 0.003 . . . . . . B 255 LEU HB3 . 34692 1 955 . 2 . 2 142 142 LEU HD21 H 1 0.954 0.003 . . . . . . B 255 LEU HD21 . 34692 1 956 . 2 . 2 142 142 LEU HD22 H 1 0.954 0.003 . . . . . . B 255 LEU HD22 . 34692 1 957 . 2 . 2 142 142 LEU HD23 H 1 0.954 0.003 . . . . . . B 255 LEU HD23 . 34692 1 958 . 2 . 2 142 142 LEU CA C 13 57.837 0.004 . . . . . . B 255 LEU CA . 34692 1 959 . 2 . 2 142 142 LEU CB C 13 41.894 0.008 . . . . . . B 255 LEU CB . 34692 1 960 . 2 . 2 142 142 LEU CG C 13 26.680 0.022 . . . . . . B 255 LEU CG . 34692 1 961 . 2 . 2 142 142 LEU N N 15 116.519 0.001 . . . . . . B 255 LEU N . 34692 1 962 . 2 . 2 143 143 GLU H H 1 7.203 0.007 . . . . . . B 256 GLU H . 34692 1 963 . 2 . 2 143 143 GLU HA H 1 4.251 0.002 . . . . . . B 256 GLU HA . 34692 1 964 . 2 . 2 143 143 GLU CA C 13 58.336 0.000 . . . . . . B 256 GLU CA . 34692 1 965 . 2 . 2 143 143 GLU CB C 13 30.374 0.025 . . . . . . B 256 GLU CB . 34692 1 966 . 2 . 2 143 143 GLU N N 15 115.740 0.001 . . . . . . B 256 GLU N . 34692 1 967 . 2 . 2 144 144 ARG H H 1 8.523 0.001 . . . . . . B 257 ARG H . 34692 1 968 . 2 . 2 144 144 ARG HA H 1 4.242 0.002 . . . . . . B 257 ARG HA . 34692 1 969 . 2 . 2 144 144 ARG HB2 H 1 1.843 0.007 . . . . . . B 257 ARG HB2 . 34692 1 970 . 2 . 2 144 144 ARG HB3 H 1 1.763 0.001 . . . . . . B 257 ARG HB3 . 34692 1 971 . 2 . 2 144 144 ARG HG2 H 1 1.940 0.000 . . . . . . B 257 ARG HG2 . 34692 1 972 . 2 . 2 144 144 ARG HG3 H 1 1.833 0.002 . . . . . . B 257 ARG HG3 . 34692 1 973 . 2 . 2 144 144 ARG CA C 13 58.536 0.000 . . . . . . B 257 ARG CA . 34692 1 974 . 2 . 2 144 144 ARG CB C 13 32.052 0.009 . . . . . . B 257 ARG CB . 34692 1 975 . 2 . 2 144 144 ARG CG C 13 28.032 0.048 . . . . . . B 257 ARG CG . 34692 1 976 . 2 . 2 144 144 ARG CD C 13 43.783 0.012 . . . . . . B 257 ARG CD . 34692 1 977 . 2 . 2 144 144 ARG N N 15 116.571 0.004 . . . . . . B 257 ARG N . 34692 1 978 . 2 . 2 145 145 LEU H H 1 8.339 0.000 . . . . . . B 258 LEU H . 34692 1 979 . 2 . 2 145 145 LEU HA H 1 4.442 0.001 . . . . . . B 258 LEU HA . 34692 1 980 . 2 . 2 145 145 LEU HB2 H 1 1.813 0.011 . . . . . . B 258 LEU HB2 . 34692 1 981 . 2 . 2 145 145 LEU HB3 H 1 1.398 0.003 . . . . . . B 258 LEU HB3 . 34692 1 982 . 2 . 2 145 145 LEU CA C 13 54.253 0.000 . . . . . . B 258 LEU CA . 34692 1 983 . 2 . 2 145 145 LEU CB C 13 42.458 0.009 . . . . . . B 258 LEU CB . 34692 1 984 . 2 . 2 145 145 LEU CD1 C 13 22.210 0.017 . . . . . . B 258 LEU CD1 . 34692 1 985 . 2 . 2 145 145 LEU CD2 C 13 26.237 0.007 . . . . . . B 258 LEU CD2 . 34692 1 986 . 2 . 2 145 145 LEU N N 15 112.307 0.003 . . . . . . B 258 LEU N . 34692 1 987 . 2 . 2 146 146 ASN H H 1 6.658 0.002 . . . . . . B 259 ASN H . 34692 1 988 . 2 . 2 146 146 ASN HA H 1 4.612 0.003 . . . . . . B 259 ASN HA . 34692 1 989 . 2 . 2 146 146 ASN HB2 H 1 3.006 0.003 . . . . . . B 259 ASN HB2 . 34692 1 990 . 2 . 2 146 146 ASN HB3 H 1 2.921 0.001 . . . . . . B 259 ASN HB3 . 34692 1 991 . 2 . 2 146 146 ASN CA C 13 54.549 0.009 . . . . . . B 259 ASN CA . 34692 1 992 . 2 . 2 146 146 ASN CB C 13 39.370 0.010 . . . . . . B 259 ASN CB . 34692 1 993 . 2 . 2 146 146 ASN N N 15 113.421 0.013 . . . . . . B 259 ASN N . 34692 1 994 . 2 . 2 147 147 ASN H H 1 8.782 0.003 . . . . . . B 260 ASN H . 34692 1 995 . 2 . 2 147 147 ASN CA C 13 55.075 0.000 . . . . . . B 260 ASN CA . 34692 1 996 . 2 . 2 147 147 ASN N N 15 121.472 0.000 . . . . . . B 260 ASN N . 34692 1 997 . 2 . 2 148 148 ILE H H 1 7.192 0.007 . . . . . . B 261 ILE H . 34692 1 998 . 2 . 2 148 148 ILE HA H 1 4.476 0.010 . . . . . . B 261 ILE HA . 34692 1 999 . 2 . 2 148 148 ILE CA C 13 60.876 0.009 . . . . . . B 261 ILE CA . 34692 1 1000 . 2 . 2 148 148 ILE CB C 13 39.944 0.004 . . . . . . B 261 ILE CB . 34692 1 1001 . 2 . 2 148 148 ILE N N 15 115.139 0.002 . . . . . . B 261 ILE N . 34692 1 1002 . 2 . 2 149 149 GLU H H 1 8.258 0.001 . . . . . . B 262 GLU H . 34692 1 1003 . 2 . 2 149 149 GLU HA H 1 4.885 0.004 . . . . . . B 262 GLU HA . 34692 1 1004 . 2 . 2 149 149 GLU CA C 13 55.711 0.006 . . . . . . B 262 GLU CA . 34692 1 1005 . 2 . 2 149 149 GLU CB C 13 30.578 0.032 . . . . . . B 262 GLU CB . 34692 1 1006 . 2 . 2 149 149 GLU N N 15 123.395 0.045 . . . . . . B 262 GLU N . 34692 1 1007 . 2 . 2 150 150 PHE H H 1 9.389 0.001 . . . . . . B 263 PHE H . 34692 1 1008 . 2 . 2 150 150 PHE HA H 1 5.047 0.018 . . . . . . B 263 PHE HA . 34692 1 1009 . 2 . 2 150 150 PHE CA C 13 55.627 0.007 . . . . . . B 263 PHE CA . 34692 1 1010 . 2 . 2 150 150 PHE CB C 13 41.327 0.011 . . . . . . B 263 PHE CB . 34692 1 1011 . 2 . 2 150 150 PHE CD1 C 13 131.487 0.015 . . . . . . B 263 PHE CD1 . 34692 1 1012 . 2 . 2 150 150 PHE N N 15 128.094 0.005 . . . . . . B 263 PHE N . 34692 1 1013 . 2 . 2 151 151 ARG H H 1 9.162 0.000 . . . . . . B 264 ARG H . 34692 1 1014 . 2 . 2 151 151 ARG HA H 1 3.683 0.002 . . . . . . B 264 ARG HA . 34692 1 1015 . 2 . 2 151 151 ARG CA C 13 56.851 0.009 . . . . . . B 264 ARG CA . 34692 1 1016 . 2 . 2 151 151 ARG CB C 13 28.080 0.031 . . . . . . B 264 ARG CB . 34692 1 1017 . 2 . 2 151 151 ARG N N 15 124.498 0.008 . . . . . . B 264 ARG N . 34692 1 1018 . 2 . 2 152 152 GLY H H 1 8.581 0.001 . . . . . . B 265 GLY H . 34692 1 1019 . 2 . 2 152 152 GLY CA C 13 45.471 0.013 . . . . . . B 265 GLY CA . 34692 1 1020 . 2 . 2 152 152 GLY N N 15 103.764 0.001 . . . . . . B 265 GLY N . 34692 1 1021 . 2 . 2 153 153 SER H H 1 7.898 0.002 . . . . . . B 266 SER H . 34692 1 1022 . 2 . 2 153 153 SER HA H 1 4.797 0.001 . . . . . . B 266 SER HA . 34692 1 1023 . 2 . 2 153 153 SER HB2 H 1 4.112 0.002 . . . . . . B 266 SER HB2 . 34692 1 1024 . 2 . 2 153 153 SER HB3 H 1 3.718 0.004 . . . . . . B 266 SER HB3 . 34692 1 1025 . 2 . 2 153 153 SER CA C 13 57.314 0.018 . . . . . . B 266 SER CA . 34692 1 1026 . 2 . 2 153 153 SER CB C 13 65.864 0.011 . . . . . . B 266 SER CB . 34692 1 1027 . 2 . 2 153 153 SER N N 15 117.356 0.002 . . . . . . B 266 SER N . 34692 1 1028 . 2 . 2 154 154 VAL H H 1 8.412 0.012 . . . . . . B 267 VAL H . 34692 1 1029 . 2 . 2 154 154 VAL HA H 1 4.534 0.041 . . . . . . B 267 VAL HA . 34692 1 1030 . 2 . 2 154 154 VAL CA C 13 62.710 0.021 . . . . . . B 267 VAL CA . 34692 1 1031 . 2 . 2 154 154 VAL CB C 13 31.383 0.009 . . . . . . B 267 VAL CB . 34692 1 1032 . 2 . 2 154 154 VAL N N 15 125.449 0.003 . . . . . . B 267 VAL N . 34692 1 1033 . 2 . 2 155 155 ILE H H 1 8.805 0.000 . . . . . . B 268 ILE H . 34692 1 1034 . 2 . 2 155 155 ILE HA H 1 4.803 0.001 . . . . . . B 268 ILE HA . 34692 1 1035 . 2 . 2 155 155 ILE CA C 13 60.725 0.042 . . . . . . B 268 ILE CA . 34692 1 1036 . 2 . 2 155 155 ILE CB C 13 39.689 0.010 . . . . . . B 268 ILE CB . 34692 1 1037 . 2 . 2 155 155 ILE N N 15 128.079 0.006 . . . . . . B 268 ILE N . 34692 1 1038 . 2 . 2 156 156 THR H H 1 7.905 0.002 . . . . . . B 269 THR H . 34692 1 1039 . 2 . 2 156 156 THR HA H 1 5.078 0.003 . . . . . . B 269 THR HA . 34692 1 1040 . 2 . 2 156 156 THR CA C 13 60.313 0.035 . . . . . . B 269 THR CA . 34692 1 1041 . 2 . 2 156 156 THR CB C 13 71.784 0.002 . . . . . . B 269 THR CB . 34692 1 1042 . 2 . 2 156 156 THR N N 15 113.594 0.002 . . . . . . B 269 THR N . 34692 1 1043 . 2 . 2 157 157 VAL H H 1 8.287 0.006 . . . . . . B 270 VAL H . 34692 1 1044 . 2 . 2 157 157 VAL HA H 1 5.653 0.002 . . . . . . B 270 VAL HA . 34692 1 1045 . 2 . 2 157 157 VAL CA C 13 58.672 0.000 . . . . . . B 270 VAL CA . 34692 1 1046 . 2 . 2 157 157 VAL CB C 13 35.713 0.023 . . . . . . B 270 VAL CB . 34692 1 1047 . 2 . 2 157 157 VAL N N 15 114.179 0.004 . . . . . . B 270 VAL N . 34692 1 1048 . 2 . 2 158 158 GLU HA H 1 4.678 0.002 . . . . . . B 271 GLU HA . 34692 1 1049 . 2 . 2 158 158 GLU HB2 H 1 2.121 0.002 . . . . . . B 271 GLU HB2 . 34692 1 1050 . 2 . 2 158 158 GLU HB3 H 1 1.959 0.000 . . . . . . B 271 GLU HB3 . 34692 1 1051 . 2 . 2 158 158 GLU HG2 H 1 2.292 0.001 . . . . . . B 271 GLU HG2 . 34692 1 1052 . 2 . 2 158 158 GLU HG3 H 1 2.191 0.003 . . . . . . B 271 GLU HG3 . 34692 1 1053 . 2 . 2 158 158 GLU CB C 13 34.122 0.018 . . . . . . B 271 GLU CB . 34692 1 1054 . 2 . 2 158 158 GLU CG C 13 35.993 0.012 . . . . . . B 271 GLU CG . 34692 1 1055 . 2 . 2 158 158 GLU N N 15 118.923 0.004 . . . . . . B 271 GLU N . 34692 1 1056 . 2 . 2 159 159 ARG HA H 1 4.317 0.000 . . . . . . B 272 ARG HA . 34692 1 1057 . 2 . 2 159 159 ARG HB2 H 1 2.014 0.000 . . . . . . B 272 ARG HB2 . 34692 1 1058 . 2 . 2 159 159 ARG HB3 H 1 1.871 0.000 . . . . . . B 272 ARG HB3 . 34692 1 1059 . 2 . 2 159 159 ARG HG2 H 1 1.684 0.000 . . . . . . B 272 ARG HG2 . 34692 1 1060 . 2 . 2 159 159 ARG HG3 H 1 1.756 0.000 . . . . . . B 272 ARG HG3 . 34692 1 1061 . 2 . 2 159 159 ARG HD2 H 1 3.395 0.005 . . . . . . B 272 ARG HD2 . 34692 1 1062 . 2 . 2 159 159 ARG HD3 H 1 3.214 0.001 . . . . . . B 272 ARG HD3 . 34692 1 1063 . 2 . 2 159 159 ARG CA C 13 58.228 0.000 . . . . . . B 272 ARG CA . 34692 1 1064 . 2 . 2 159 159 ARG CB C 13 31.547 0.012 . . . . . . B 272 ARG CB . 34692 1 1065 . 2 . 2 159 159 ARG CG C 13 28.520 0.031 . . . . . . B 272 ARG CG . 34692 1 1066 . 2 . 2 159 159 ARG CD C 13 43.888 0.036 . . . . . . B 272 ARG CD . 34692 1 1067 . 2 . 2 159 159 ARG N N 15 123.858 0.002 . . . . . . B 272 ARG N . 34692 1 1068 . 2 . 2 160 160 ASP HA H 1 4.925 0.003 . . . . . . B 273 ASP HA . 34692 1 1069 . 2 . 2 160 160 ASP HB2 H 1 2.648 0.006 . . . . . . B 273 ASP HB2 . 34692 1 1070 . 2 . 2 160 160 ASP HB3 H 1 2.508 0.003 . . . . . . B 273 ASP HB3 . 34692 1 1071 . 2 . 2 160 160 ASP CA C 13 53.106 0.006 . . . . . . B 273 ASP CA . 34692 1 1072 . 2 . 2 160 160 ASP CB C 13 41.407 0.012 . . . . . . B 273 ASP CB . 34692 1 1073 . 2 . 2 160 160 ASP N N 15 126.025 0.003 . . . . . . B 273 ASP N . 34692 1 1074 . 2 . 2 161 161 ASP H H 1 8.593 0.000 . . . . . . B 274 ASP H . 34692 1 1075 . 2 . 2 161 161 ASP HA H 1 4.783 0.002 . . . . . . B 274 ASP HA . 34692 1 1076 . 2 . 2 161 161 ASP CA C 13 54.884 0.019 . . . . . . B 274 ASP CA . 34692 1 1077 . 2 . 2 161 161 ASP CB C 13 41.895 0.006 . . . . . . B 274 ASP CB . 34692 1 1078 . 2 . 2 161 161 ASP N N 15 123.818 0.006 . . . . . . B 274 ASP N . 34692 1 1079 . 2 . 2 162 162 ASN H H 1 8.491 0.002 . . . . . . B 275 ASN H . 34692 1 1080 . 2 . 2 162 162 ASN HA H 1 5.008 0.003 . . . . . . B 275 ASN HA . 34692 1 1081 . 2 . 2 162 162 ASN HB2 H 1 2.760 0.001 . . . . . . B 275 ASN HB2 . 34692 1 1082 . 2 . 2 162 162 ASN HB3 H 1 2.631 0.002 . . . . . . B 275 ASN HB3 . 34692 1 1083 . 2 . 2 162 162 ASN CA C 13 51.543 0.055 . . . . . . B 275 ASN CA . 34692 1 1084 . 2 . 2 162 162 ASN CB C 13 39.397 0.009 . . . . . . B 275 ASN CB . 34692 1 1085 . 2 . 2 162 162 ASN N N 15 118.527 0.005 . . . . . . B 275 ASN N . 34692 1 1086 . 2 . 2 165 165 PRO HA H 1 4.285 0.001 . . . . . . B 278 PRO HA . 34692 1 1087 . 2 . 2 165 165 PRO HB2 H 1 2.174 0.002 . . . . . . B 278 PRO HB2 . 34692 1 1088 . 2 . 2 165 165 PRO HB3 H 1 2.174 0.002 . . . . . . B 278 PRO HB3 . 34692 1 1089 . 2 . 2 165 165 PRO HG2 H 1 1.948 0.003 . . . . . . B 278 PRO HG2 . 34692 1 1090 . 2 . 2 165 165 PRO HG3 H 1 1.948 0.003 . . . . . . B 278 PRO HG3 . 34692 1 1091 . 2 . 2 165 165 PRO HD2 H 1 3.736 0.002 . . . . . . B 278 PRO HD2 . 34692 1 1092 . 2 . 2 165 165 PRO HD3 H 1 3.530 0.002 . . . . . . B 278 PRO HD3 . 34692 1 1093 . 2 . 2 165 165 PRO CA C 13 62.663 0.023 . . . . . . B 278 PRO CA . 34692 1 1094 . 2 . 2 165 165 PRO CB C 13 31.827 0.014 . . . . . . B 278 PRO CB . 34692 1 1095 . 2 . 2 165 165 PRO CG C 13 27.379 0.002 . . . . . . B 278 PRO CG . 34692 1 1096 . 2 . 2 165 165 PRO CD C 13 50.301 0.038 . . . . . . B 278 PRO CD . 34692 1 1097 . 2 . 2 166 166 ILE H H 1 8.035 0.003 . . . . . . B 279 ILE H . 34692 1 1098 . 2 . 2 166 166 ILE HA H 1 3.626 0.006 . . . . . . B 279 ILE HA . 34692 1 1099 . 2 . 2 166 166 ILE HB H 1 1.422 0.004 . . . . . . B 279 ILE HB . 34692 1 1100 . 2 . 2 166 166 ILE HG12 H 1 1.212 0.002 . . . . . . B 279 ILE HG12 . 34692 1 1101 . 2 . 2 166 166 ILE HG13 H 1 0.461 0.019 . . . . . . B 279 ILE HG13 . 34692 1 1102 . 2 . 2 166 166 ILE HG21 H 1 0.340 0.005 . . . . . . B 279 ILE HG21 . 34692 1 1103 . 2 . 2 166 166 ILE HG22 H 1 0.340 0.005 . . . . . . B 279 ILE HG22 . 34692 1 1104 . 2 . 2 166 166 ILE HG23 H 1 0.340 0.005 . . . . . . B 279 ILE HG23 . 34692 1 1105 . 2 . 2 166 166 ILE HD11 H 1 0.437 0.003 . . . . . . B 279 ILE HD11 . 34692 1 1106 . 2 . 2 166 166 ILE HD12 H 1 0.437 0.003 . . . . . . B 279 ILE HD12 . 34692 1 1107 . 2 . 2 166 166 ILE HD13 H 1 0.437 0.003 . . . . . . B 279 ILE HD13 . 34692 1 1108 . 2 . 2 166 166 ILE CA C 13 61.629 0.055 . . . . . . B 279 ILE CA . 34692 1 1109 . 2 . 2 166 166 ILE CB C 13 38.310 0.004 . . . . . . B 279 ILE CB . 34692 1 1110 . 2 . 2 166 166 ILE CG1 C 13 27.417 0.024 . . . . . . B 279 ILE CG1 . 34692 1 1111 . 2 . 2 166 166 ILE CG2 C 13 17.201 0.013 . . . . . . B 279 ILE CG2 . 34692 1 1112 . 2 . 2 166 166 ILE CD1 C 13 12.678 0.021 . . . . . . B 279 ILE CD1 . 34692 1 1113 . 2 . 2 166 166 ILE N N 15 121.380 0.034 . . . . . . B 279 ILE N . 34692 1 1114 . 2 . 2 167 167 ARG H H 1 8.047 0.008 . . . . . . B 280 ARG H . 34692 1 1115 . 2 . 2 167 167 ARG HA H 1 4.397 0.019 . . . . . . B 280 ARG HA . 34692 1 1116 . 2 . 2 167 167 ARG HB2 H 1 1.799 0.000 . . . . . . B 280 ARG HB2 . 34692 1 1117 . 2 . 2 167 167 ARG HB3 H 1 1.699 0.003 . . . . . . B 280 ARG HB3 . 34692 1 1118 . 2 . 2 167 167 ARG CA C 13 55.535 0.000 . . . . . . B 280 ARG CA . 34692 1 1119 . 2 . 2 167 167 ARG CB C 13 31.306 0.002 . . . . . . B 280 ARG CB . 34692 1 1120 . 2 . 2 167 167 ARG N N 15 125.637 0.053 . . . . . . B 280 ARG N . 34692 1 stop_ save_