data_17945 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NMR backbone assignment of a Tau protein fragment ; _BMRB_accession_number 17945 _BMRB_flat_file_name bmr17945.str _Entry_type original _Submission_date 2011-09-19 _Accession_date 2011-09-19 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details 'NMR backbone and CB assignment of a fragment (TauF4) of the neuronal Tau protein encompassing part of the proline rich region and the microtubule binding region' loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Verdegem Dries . . 2 Sibille Nathalie . . 3 Wieruzeski Jean-Michel . . 4 Lippens Guy . . 5 Landrieu Isabelle . . 6 Huvent Isabelle . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 99 "13C chemical shifts" 214 "15N chemical shifts" 99 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2013-03-25 update BMRB 'update entry citation' 2011-10-28 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Structural characterization by nuclear magnetic resonance of the impact of phosphorylation in the proline-rich region of the disordered Tau protein.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 22072628 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Sibille Nathalie . . 2 Huvent Isabelle . . 3 Fauquant Caroline . . 4 Verdegem Dries . . 5 Amniai Laziza . . 6 Leroy Arnaud . . 7 Wieruszeski Jean-Michel . . 8 Lippens Guy . . 9 Landrieu Isabelle . . stop_ _Journal_abbreviation Proteins _Journal_name_full Proteins _Journal_volume 80 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 454 _Page_last 462 _Year 2012 _Details . loop_ _Keyword 'Alzheimer's disease' 'Disordered protein' 'Microtubule associated protein' Phosphorylation 'Tau protein' stop_ save_ ####################################### # Cited references within the entry # ####################################### save_Reference _Saveframe_category citation _Citation_full . _Citation_title 'Systematic identification of tubulin interacting fragments of the microtubule-associated protein TAU leads to a highly efficient promoter of microtubule assembly.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 21757739 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Fauquant Caroline . . 2 Redeker Virginie . . 3 Landrieu Isabelle . . 4 Wieruzeski Jean-Michel . . 5 Verdegem Dries . . 6 Lippens Guy . . 7 Gigant Benoit . . 8 Knossow Marcel . . 9 Laprevote Olivier . . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_name_full . _Journal_volume . _Journal_issue . _Journal_CSD . _Book_title . _Book_chapter_title . _Book_volume . _Book_series . _Book_publisher . _Book_publisher_city . _Book_ISBN . _Conference_title . _Conference_site . _Conference_state_province . _Conference_country . _Conference_start_date . _Conference_end_date . _Conference_abstract_number . _Thesis_institution . _Thesis_institution_city . _Thesis_institution_country . _Page_first . _Page_last . _Year 2011 _Details . save_ save_Reference_2 _Saveframe_category citation _Citation_full . _Citation_title 'Graphical interpretation of Boolean operators for protein NMR assignments.' _Citation_status 'in preparation' _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 18762868 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Verdegem Dries . . 2 Dijkstra Klaas . . 3 Hanoulle Xavier . . 4 Lippens Guy . . stop_ _Journal_abbreviation 'J. Biomol. NMR' _Journal_name_full . _Journal_volume 42 _Journal_issue 1 _Journal_CSD . _Book_title . _Book_chapter_title . _Book_volume . _Book_series . _Book_publisher . _Book_publisher_city . _Book_ISBN . _Conference_title . _Conference_site . _Conference_state_province . _Conference_country . _Conference_start_date . _Conference_end_date . _Conference_abstract_number . _Thesis_institution . _Thesis_institution_city . _Thesis_institution_country . _Page_first 11 _Page_last 21 _Year 2008 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'TauF4 Fragment' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Polypeptide $TauF4 stop_ _System_molecular_weight 13355.4 _System_physical_state 'intrinsically disordered' _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . loop_ _Biological_function 'Microtubule associated protein' stop_ _Database_query_date . _Details 'Monomeric Polypeptide in solution' save_ ######################## # Monomeric polymers # ######################## save_TauF4 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common TauF4 _Molecular_mass 13355.4 _Mol_thiol_state 'all free' loop_ _Biological_function 'Microtubule associated protein (MAP)' 'neuronal Tau protein' 'Paired Helical Filaments (PHF) formation' stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 124 _Mol_residue_sequence ; MHHHHHHSRSRTPSLPTPPT REPKKVAVVRTPPKSPSSAK SRLQTAPVPMPDLKNVKSKI GSTENLKHQPGGGKVQIINK KLDLSNVQSKCGSKDNIKHV PGGGSVQIVYKPVDLSKVTS KSGS ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 201 MET 2 202 HIS 3 203 HIS 4 204 HIS 5 205 HIS 6 206 HIS 7 207 HIS 8 208 SER 9 209 ARG 10 210 SER 11 211 ARG 12 212 THR 13 213 PRO 14 214 SER 15 215 LEU 16 216 PRO 17 217 THR 18 218 PRO 19 219 PRO 20 220 THR 21 221 ARG 22 222 GLU 23 223 PRO 24 224 LYS 25 225 LYS 26 226 VAL 27 227 ALA 28 228 VAL 29 229 VAL 30 230 ARG 31 231 THR 32 232 PRO 33 233 PRO 34 234 LYS 35 235 SER 36 236 PRO 37 237 SER 38 238 SER 39 239 ALA 40 240 LYS 41 241 SER 42 242 ARG 43 243 LEU 44 244 GLN 45 245 THR 46 246 ALA 47 247 PRO 48 248 VAL 49 249 PRO 50 250 MET 51 251 PRO 52 252 ASP 53 253 LEU 54 254 LYS 55 255 ASN 56 256 VAL 57 257 LYS 58 258 SER 59 259 LYS 60 260 ILE 61 261 GLY 62 262 SER 63 263 THR 64 264 GLU 65 265 ASN 66 266 LEU 67 267 LYS 68 268 HIS 69 269 GLN 70 270 PRO 71 271 GLY 72 272 GLY 73 273 GLY 74 274 LYS 75 275 VAL 76 276 GLN 77 277 ILE 78 278 ILE 79 279 ASN 80 280 LYS 81 281 LYS 82 282 LEU 83 283 ASP 84 284 LEU 85 285 SER 86 286 ASN 87 287 VAL 88 288 GLN 89 289 SER 90 290 LYS 91 291 CYS 92 292 GLY 93 293 SER 94 294 LYS 95 295 ASP 96 296 ASN 97 297 ILE 98 298 LYS 99 299 HIS 100 300 VAL 101 301 PRO 102 302 GLY 103 303 GLY 104 304 GLY 105 305 SER 106 306 VAL 107 307 GLN 108 308 ILE 109 309 VAL 110 310 TYR 111 311 LYS 112 312 PRO 113 313 VAL 114 314 ASP 115 315 LEU 116 316 SER 117 317 LYS 118 318 VAL 119 319 THR 120 320 SER 121 321 LYS 122 322 SER 123 323 GLY 124 324 SER stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-11-04 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 17920 tau-filaments 94.35 441 99.15 99.15 5.39e-70 BMRB 19253 tau_K18 65.32 129 98.77 100.00 1.78e-46 EMBL CAA32636 "unnamed protein product [Homo sapiens]" 94.35 383 99.15 99.15 2.39e-70 GB AAC04277 "PNS specific microtubule-associated protein tau, adult isoform [Homo sapiens]" 94.35 758 99.15 99.15 2.44e-67 GB AAC04279 "CNS specific microtubule-associated protein tau, adult isoform [Homo sapiens]" 94.35 441 99.15 99.15 5.39e-70 GB AAF97596 "tau protein [Papio hamadryas]" 94.35 383 98.29 98.29 1.04e-69 GB AAI14949 "Microtubule-associated protein tau [Homo sapiens]" 94.35 383 99.15 99.15 2.39e-70 GB AAQ92319 "microtubule-associated protein tau [Spermophilus citellus]" 94.35 430 97.44 98.29 3.86e-69 REF NP_001009068 "microtubule-associated protein tau [Pan troglodytes]" 94.35 776 99.15 99.15 3.11e-67 REF NP_001104271 "microtubule-associated protein tau [Canis lupus familiaris]" 94.35 765 97.44 99.15 1.37e-66 REF NP_001116538 "microtubule-associated protein tau isoform 6 [Homo sapiens]" 94.35 776 99.15 99.15 3.17e-67 REF NP_001116539 "microtubule-associated protein tau isoform 5 [Homo sapiens]" 94.35 412 99.15 99.15 2.78e-70 REF NP_005901 "microtubule-associated protein tau isoform 2 [Homo sapiens]" 94.35 441 99.15 99.15 5.39e-70 SP P10636 "RecName: Full=Microtubule-associated protein tau; AltName: Full=Neurofibrillary tangle protein; AltName: Full=Paired helical fi" 94.35 758 99.15 99.15 2.49e-67 SP P57786 "RecName: Full=Microtubule-associated protein tau; AltName: Full=Neurofibrillary tangle protein; AltName: Full=Paired helical fi" 94.35 459 98.29 98.29 2.91e-69 SP Q5S6V2 "RecName: Full=Microtubule-associated protein tau" 94.35 758 99.15 99.15 3.21e-67 SP Q5YCV9 "RecName: Full=Microtubule-associated protein tau" 94.35 776 99.15 99.15 3.08e-67 SP Q5YCW0 "RecName: Full=Microtubule-associated protein tau" 94.35 776 99.15 99.15 2.69e-67 TPE CAG26750 "TPA: microtubule-associated protein tau [Homo sapiens]" 94.35 776 99.15 99.15 3.34e-67 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species _Details $TauF4 Human 9606 Eukaryota Metazoa Homo sapiens Neuronal stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name _Details $TauF4 'recombinant technology' . Escherichia coli Bl21(DE3)pLysS pET15b 'Both pET3 and pET15b were used.' stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $TauF4 300-450 uM '[U-95% 15N]' stop_ save_ save_Sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $TauF4 300-450 uM '[U-95% 13C; U-95% 15N]' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 2.1 loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task 'chemical shift calculation' processing stop_ _Details . save_ save_NMRPy _Saveframe_category software _Name NMRPy _Version . loop_ _Vendor _Address _Electronic_address 'In house' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details ; Graphical interpretation of Boolean operators for protein NMR assignments. Verdegem D, Dijkstra K, Hanoulle X, Lippens G. J Biomol NMR. 2008 Sep;42(1):11-21. ; save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DMX _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $Sample_2 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $Sample_2 save_ save_3D_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $Sample_2 save_ save_3D_HN(CO)CA_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $Sample_2 save_ save_HN(CA)N_6 _Saveframe_category NMR_applied_experiment _Experiment_name HN(CA)N _Sample_label $Sample_2 save_ save_NMR_spectrometer_expt _Saveframe_category NMR_applied_experiment _Experiment_name . _BMRB_pulse_sequence_accession_number . _Details . save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 25 . mM pH 6.6 . pH pressure 1 . atm temperature 293 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details '1H chemical shift reference is TMSP' loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio 'Trimethyl silyl propionate' C 13 'methyl protons' ppm 0 internal indirect . . . 0.251449530 'Trimethyl silyl propionate' N 15 'methyl protons' ppm 0 internal indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HNCACB' HN(CA)N stop_ loop_ _Sample_label $sample_1 $Sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name Polypeptide _Text_data_format . _Text_data . loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 211 11 ARG CA C 56.0 . . 2 211 11 ARG CB C 30.7 . . 3 212 12 THR H H 8.31 . . 4 212 12 THR CA C 59.9 . . 5 212 12 THR CB C 69.8 . . 6 212 12 THR N N 118.3 . . 7 213 13 PRO CA C 63.3 . . 8 213 13 PRO CB C 32.2 . . 9 214 14 SER H H 8.46 . . 10 214 14 SER CA C 58.2 . . 11 214 14 SER CB C 63.8 . . 12 214 14 SER N N 116.9 . . 13 215 15 LEU H H 8.35 . . 14 215 15 LEU CA C 53.0 . . 15 215 15 LEU CB C 41.8 . . 16 215 15 LEU N N 125.7 . . 17 216 16 PRO CA C 63.0 . . 18 216 16 PRO CB C 32.0 . . 19 217 17 THR H H 8.38 . . 20 217 17 THR CA C 60.0 . . 21 217 17 THR CB C 69.8 . . 22 217 17 THR N N 118.2 . . 23 219 19 PRO CA C 62.8 . . 24 219 19 PRO CB C 32.0 . . 25 220 20 THR H H 8.30 . . 26 220 20 THR CA C 61.8 . . 27 220 20 THR CB C 69.8 . . 28 220 20 THR N N 115.2 . . 29 221 21 ARG H H 8.46 . . 30 221 21 ARG CA C 55.6 . . 31 221 21 ARG CB C 30.7 . . 32 221 21 ARG N N 123.9 . . 33 222 22 GLU H H 8.50 . . 34 222 22 GLU CA C 54.3 . . 35 222 22 GLU CB C 29.7 . . 36 222 22 GLU N N 124.1 . . 37 223 23 PRO CA C 62.8 . . 38 223 23 PRO CB C 32.0 . . 39 224 24 LYS H H 8.45 . . 40 224 24 LYS CA C 56.2 . . 41 224 24 LYS CB C 32.8 . . 42 224 24 LYS N N 122.0 . . 43 225 25 LYS H H 8.45 . . 44 225 25 LYS CA C 56.1 . . 45 225 25 LYS CB C 33.1 . . 46 225 25 LYS N N 124.0 . . 47 226 26 VAL H H 8.26 . . 48 226 26 VAL CA C 61.8 . . 49 226 26 VAL CB C 32.8 . . 50 226 26 VAL N N 122.8 . . 51 227 27 ALA H H 8.46 . . 52 227 27 ALA CA C 52.2 . . 53 227 27 ALA CB C 19.1 . . 54 227 27 ALA N N 128.9 . . 55 228 28 VAL H H 8.25 . . 56 228 28 VAL CA C 62.2 . . 57 228 28 VAL CB C 32.8 . . 58 228 28 VAL N N 121.3 . . 59 229 29 VAL H H 8.40 . . 60 229 29 VAL CA C 62.1 . . 61 229 29 VAL CB C 32.6 . . 62 229 29 VAL N N 126.1 . . 63 230 30 ARG H H 8.60 . . 64 230 30 ARG CA C 55.6 . . 65 230 30 ARG CB C 30.7 . . 66 230 30 ARG N N 126.5 . . 67 231 31 THR H H 8.35 . . 68 231 31 THR CA C 59.7 . . 69 231 31 THR CB C 69.6 . . 70 231 31 THR N N 119.3 . . 71 233 33 PRO CA C 62.8 . . 72 233 33 PRO CB C 32.0 . . 73 234 34 LYS H H 8.48 . . 74 234 34 LYS CA C 56.1 . . 75 234 34 LYS CB C 33.1 . . 76 234 34 LYS N N 122.0 . . 77 235 35 SER H H 8.49 . . 78 235 35 SER CA C 56.4 . . 79 235 35 SER CB C 63.3 . . 80 235 35 SER N N 118.9 . . 81 236 36 PRO CA C 63.0 . . 82 236 36 PRO CB C 32.2 . . 83 237 37 SER H H 8.48 . . 84 237 37 SER CA C 58.4 . . 85 237 37 SER CB C 63.6 . . 86 237 37 SER N N 115.9 . . 87 238 38 SER H H 8.38 . . 88 238 38 SER CA C 58.2 . . 89 238 38 SER CB C 63.9 . . 90 238 38 SER N N 118.3 . . 91 239 39 ALA H H 8.35 . . 92 239 39 ALA CA C 52.7 . . 93 239 39 ALA CB C 18.8 . . 94 239 39 ALA N N 126.0 . . 95 240 40 LYS H H 8.29 . . 96 240 40 LYS CA C 56.4 . . 97 240 40 LYS CB C 32.8 . . 98 240 40 LYS N N 120.3 . . 99 241 41 SER H H 8.27 . . 100 241 41 SER CA C 58.4 . . 101 241 41 SER CB C 63.6 . . 102 241 41 SER N N 116.8 . . 103 242 42 ARG H H 8.39 . . 104 242 42 ARG CA C 56.1 . . 105 242 42 ARG CB C 30.5 . . 106 242 42 ARG N N 123.1 . . 107 243 43 LEU H H 8.23 . . 108 243 43 LEU CA C 55.1 . . 109 243 43 LEU CB C 42.1 . . 110 243 43 LEU N N 123.0 . . 111 244 44 GLN H H 8.44 . . 112 244 44 GLN CA C 55.9 . . 113 244 44 GLN CB C 29.4 . . 114 244 44 GLN N N 121.8 . . 115 245 45 THR H H 8.18 . . 116 245 45 THR CA C 61.5 . . 117 245 45 THR CB C 69.8 . . 118 245 45 THR N N 116.0 . . 119 246 46 ALA H H 8.37 . . 120 246 46 ALA CA C 50.4 . . 121 246 46 ALA CB C 18.1 . . 122 246 46 ALA N N 128.1 . . 123 247 47 PRO CA C 62.8 . . 124 247 47 PRO CB C 31.8 . . 125 248 48 VAL H H 8.29 . . 126 248 48 VAL CA C 59.7 . . 127 248 48 VAL CB C 32.5 . . 128 248 48 VAL N N 122.3 . . 129 249 49 PRO CA C 63.0 . . 130 249 49 PRO CB C 32.2 . . 131 250 50 MET H H 8.49 . . 132 250 50 MET CA C 53.3 . . 133 250 50 MET CB C 32.7 . . 134 250 50 MET N N 122.2 . . 135 251 51 PRO CA C 63.2 . . 136 251 51 PRO CB C 32.2 . . 137 252 52 ASP H H 8.48 . . 138 252 52 ASP CA C 54.0 . . 139 252 52 ASP CB C 41.0 . . 140 252 52 ASP N N 120.7 . . 141 253 53 LEU H H 8.32 . . 142 253 53 LEU CA C 55.3 . . 143 253 53 LEU CB C 41.9 . . 144 253 53 LEU N N 123.8 . . 145 254 54 LYS H H 8.34 . . 146 254 54 LYS CA C 56.9 . . 147 254 54 LYS CB C 32.5 . . 148 254 54 LYS N N 120.5 . . 149 255 55 ASN H H 8.31 . . 150 255 55 ASN CA C 53.3 . . 151 255 55 ASN N N 118.7 . . 152 256 56 VAL H H 8.00 . . 153 256 56 VAL CA C 62.7 . . 154 256 56 VAL CB C 32.6 . . 155 256 56 VAL N N 120.5 . . 156 257 57 LYS H H 8.47 . . 157 257 57 LYS CA C 56.4 . . 158 257 57 LYS CB C 32.9 . . 159 257 57 LYS N N 125.0 . . 160 258 58 SER H H 8.31 . . 161 258 58 SER CA C 58.4 . . 162 258 58 SER CB C 63.9 . . 163 258 58 SER N N 117.1 . . 164 259 59 LYS H H 8.45 . . 165 259 59 LYS CA C 56.4 . . 166 259 59 LYS CB C 32.8 . . 167 259 59 LYS N N 123.7 . . 168 260 60 ILE H H 8.22 . . 169 260 60 ILE CA C 61.4 . . 170 260 60 ILE CB C 38.5 . . 171 260 60 ILE N N 122.5 . . 172 261 61 GLY H H 8.59 . . 173 261 61 GLY CA C 45.2 . . 174 261 61 GLY N N 113.6 . . 175 262 62 SER H H 8.29 . . 176 262 62 SER CA C 58.4 . . 177 262 62 SER CB C 63.9 . . 178 262 62 SER N N 115.7 . . 179 263 63 THR H H 8.39 . . 180 263 63 THR CA C 62.2 . . 181 263 63 THR CB C 69.6 . . 182 263 63 THR N N 115.9 . . 183 264 64 GLU H H 8.45 . . 184 264 64 GLU CA C 57.0 . . 185 264 64 GLU CB C 30.1 . . 186 264 64 GLU N N 123.1 . . 187 265 65 ASN H H 8.49 . . 188 265 65 ASN CA C 53.4 . . 189 265 65 ASN CB C 38.6 . . 190 265 65 ASN N N 119.5 . . 191 266 66 LEU H H 8.19 . . 192 266 66 LEU CA C 55.4 . . 193 266 66 LEU CB C 42.1 . . 194 266 66 LEU N N 122.4 . . 195 267 67 LYS H H 8.22 . . 196 267 67 LYS CA C 56.5 . . 197 267 67 LYS CB C 32.8 . . 198 267 67 LYS N N 121.1 . . 199 268 68 HIS H H 8.23 . . 200 268 68 HIS CA C 55.9 . . 201 268 68 HIS CB C 30.6 . . 202 268 68 HIS N N 120.2 . . 203 269 69 GLN H H 8.36 . . 204 269 69 GLN CA C 53.3 . . 205 269 69 GLN CB C 28.7 . . 206 269 69 GLN N N 123.2 . . 207 270 70 PRO CA C 63.6 . . 208 270 70 PRO CB C 32.0 . . 209 271 71 GLY H H 8.68 . . 210 271 71 GLY CA C 45.4 . . 211 271 71 GLY N N 110.2 . . 212 272 72 GLY H H 8.4 . . 213 272 72 GLY CA C 45.4 . . 214 272 72 GLY N N 108.8 . . 215 273 73 GLY H H 8.39 . . 216 273 73 GLY CA C 45.1 . . 217 273 73 GLY N N 108.7 . . 218 274 74 LYS H H 8.22 . . 219 274 74 LYS CA C 56.4 . . 220 274 74 LYS CB C 33.1 . . 221 274 74 LYS N N 120.9 . . 222 275 75 VAL H H 8.23 . . 223 275 75 VAL CA C 62.3 . . 224 275 75 VAL CB C 32.6 . . 225 275 75 VAL N N 122.2 . . 226 276 76 GLN H H 8.56 . . 227 276 76 GLN CA C 55.6 . . 228 276 76 GLN CB C 29.4 . . 229 276 76 GLN N N 125.4 . . 230 277 77 ILE H H 8.39 . . 231 277 77 ILE CA C 61.0 . . 232 277 77 ILE CB C 38.4 . . 233 277 77 ILE N N 124.3 . . 234 278 78 ILE H H 8.37 . . 235 278 78 ILE CA C 60.8 . . 236 278 78 ILE CB C 38.6 . . 237 278 78 ILE N N 126.2 . . 238 279 79 ASN H H 8.62 . . 239 279 79 ASN CA C 53.0 . . 240 279 79 ASN CB C 38.9 . . 241 279 79 ASN N N 124.1 . . 242 280 80 LYS H H 8.40 . . 243 280 80 LYS CA C 56.4 . . 244 280 80 LYS CB C 33.1 . . 245 280 80 LYS N N 123.1 . . 246 281 81 LYS H H 8.37 . . 247 281 81 LYS CA C 56.4 . . 248 281 81 LYS CB C 32.7 . . 249 281 81 LYS N N 122.8 . . 250 282 82 LEU H H 8.24 . . 251 282 82 LEU CA C 55.1 . . 252 282 82 LEU CB C 42.4 . . 253 282 82 LEU N N 123.8 . . 254 283 83 ASP H H 8.41 . . 255 283 83 ASP CA C 53.8 . . 256 283 83 ASP CB C 41.0 . . 257 283 83 ASP N N 122.2 . . 258 284 84 LEU H H 8.41 . . 259 284 84 LEU CA C 55.1 . . 260 284 84 LEU CB C 41.6 . . 261 284 84 LEU N N 124.1 . . 262 285 85 SER H H 8.42 . . 263 285 85 SER CA C 59.5 . . 264 285 85 SER CB C 63.6 . . 265 285 85 SER N N 116.1 . . 266 286 86 ASN H H 8.36 . . 267 286 86 ASN CA C 53.3 . . 268 286 86 ASN CB C 38.8 . . 269 286 86 ASN N N 120.5 . . 270 287 87 VAL H H 8.01 . . 271 287 87 VAL CA C 63.0 . . 272 287 87 VAL CB C 32.6 . . 273 287 87 VAL N N 120.2 . . 274 288 88 GLN H H 8.51 . . 275 288 88 GLN CA C 56.1 . . 276 288 88 GLN CB C 29.3 . . 277 288 88 GLN N N 123.7 . . 278 289 89 SER H H 8.38 . . 279 289 89 SER CA C 58.6 . . 280 289 89 SER CB C 63.8 . . 281 289 89 SER N N 117.2 . . 282 290 90 LYS H H 8.46 . . 283 290 90 LYS CA C 56.5 . . 284 290 90 LYS CB C 32.9 . . 285 290 90 LYS N N 123.4 . . 286 291 91 CYS H H 8.42 . . 287 291 91 CYS CA C 58.8 . . 288 291 91 CYS CB C 28.0 . . 289 291 91 CYS N N 120.2 . . 290 292 92 GLY H H 8.57 . . 291 292 92 GLY CA C 45.4 . . 292 292 92 GLY N N 111.8 . . 293 293 93 SER H H 8.30 . . 294 293 93 SER CA C 58.4 . . 295 293 93 SER CB C 63.9 . . 296 293 93 SER N N 115.8 . . 297 294 94 LYS H H 8.54 . . 298 294 94 LYS CA C 56.6 . . 299 294 94 LYS CB C 32.8 . . 300 294 94 LYS N N 123.2 . . 301 295 95 ASP H H 8.26 . . 302 295 95 ASP CA C 54.6 . . 303 295 95 ASP CB C 41.1 . . 304 295 95 ASP N N 120.5 . . 305 296 96 ASN H H 8.35 . . 306 296 96 ASN CA C 53.3 . . 307 296 96 ASN CB C 38.6 . . 308 296 96 ASN N N 118.8 . . 309 297 97 ILE H H 8.03 . . 310 297 97 ILE CA C 61.3 . . 311 297 97 ILE CB C 38.4 . . 312 297 97 ILE N N 121.0 . . 313 298 98 LYS H H 8.37 . . 314 298 98 LYS CA C 55.9 . . 315 298 98 LYS CB C 32.8 . . 316 298 98 LYS N N 125.4 . . 317 299 99 HIS H H 8.40 . . 318 299 99 HIS CA C 55.8 . . 319 299 99 HIS CB C 30.7 . . 320 299 99 HIS N N 122.1 . . 321 300 100 VAL H H 8.21 . . 322 300 100 VAL CA C 59.5 . . 323 300 100 VAL CB C 32.6 . . 324 300 100 VAL N N 124.2 . . 325 301 101 PRO CA C 63.6 . . 326 301 101 PRO CB C 32.0 . . 327 302 102 GLY H H 8.66 . . 328 302 102 GLY CA C 45.4 . . 329 302 102 GLY N N 110.4 . . 330 303 103 GLY H H 8.41 . . 331 303 103 GLY CA C 45.4 . . 332 303 103 GLY N N 108.9 . . 333 304 104 GLY H H 8.41 . . 334 304 104 GLY CA C 45.2 . . 335 304 104 GLY N N 108.9 . . 336 305 105 SER H H 8.30 . . 337 305 105 SER CA C 58.3 . . 338 305 105 SER CB C 64.0 . . 339 305 105 SER N N 115.7 . . 340 306 106 VAL H H 8.22 . . 341 306 106 VAL CA C 62.3 . . 342 306 106 VAL CB C 32.8 . . 343 306 106 VAL N N 121.8 . . 344 307 107 GLN H H 8.50 . . 345 307 107 GLN CA C 55.6 . . 346 307 107 GLN CB C 29.4 . . 347 307 107 GLN N N 124.9 . . 348 308 108 ILE H H 8.33 . . 349 308 108 ILE CA C 61.0 . . 350 308 108 ILE CB C 38.5 . . 351 308 108 ILE N N 124.3 . . 352 309 109 VAL H H 8.25 . . 353 309 109 VAL CA C 61.8 . . 354 309 109 VAL CB C 32.8 . . 355 309 109 VAL N N 125.7 . . 356 310 110 TYR H H 8.50 . . 357 310 110 TYR CA C 57.9 . . 358 310 110 TYR CB C 38.9 . . 359 310 110 TYR N N 126.4 . . 360 311 111 LYS H H 8.22 . . 361 311 111 LYS CA C 53.5 . . 362 311 111 LYS CB C 32.8 . . 363 311 111 LYS N N 126.1 . . 364 312 112 PRO CA C 62.8 . . 365 312 112 PRO CB C 32.0 . . 366 313 113 VAL H H 8.24 . . 367 313 113 VAL CA C 62.3 . . 368 313 113 VAL CB C 32.8 . . 369 313 113 VAL N N 120.6 . . 370 314 114 ASP H H 8.44 . . 371 314 114 ASP CA C 53.5 . . 372 314 114 ASP CB C 40.8 . . 373 314 114 ASP N N 124.5 . . 374 315 115 LEU H H 8.58 . . 375 315 115 LEU CA C 55.3 . . 376 315 115 LEU CB C 41.6 . . 377 315 115 LEU N N 125.4 . . 378 316 116 SER H H 8.47 . . 379 316 116 SER CA C 59.8 . . 380 316 116 SER CB C 63.7 . . 381 316 116 SER N N 116.2 . . 382 317 117 LYS H H 8.01 . . 383 317 117 LYS CA C 56.1 . . 384 317 117 LYS CB C 32.9 . . 385 317 117 LYS N N 122.1 . . 386 318 118 VAL H H 7.97 . . 387 318 118 VAL CA C 62.7 . . 388 318 118 VAL CB C 32.7 . . 389 318 118 VAL N N 121.2 . . 390 319 119 THR H H 8.32 . . 391 319 119 THR CA C 61.8 . . 392 319 119 THR CB C 70.0 . . 393 319 119 THR N N 118.1 . . 394 320 120 SER H H 8.37 . . 395 320 120 SER CA C 58.2 . . 396 320 120 SER CB C 64.0 . . 397 320 120 SER N N 118.6 . . 398 321 121 LYS H H 8.51 . . 399 321 121 LYS CA C 56.4 . . 400 321 121 LYS CB C 33.0 . . 401 321 121 LYS N N 123.7 . . 402 322 122 SER H H 8.47 . . 403 322 122 SER CA C 58.4 . . 404 322 122 SER CB C 63.9 . . 405 322 122 SER N N 117.4 . . 406 323 123 GLY H H 8.49 . . 407 323 123 GLY CA C 45.2 . . 408 323 123 GLY N N 111.9 . . 409 324 124 SER H H 7.97 . . 410 324 124 SER CA C 59.9 . . 411 324 124 SER CB C 64.9 . . 412 324 124 SER N N 121.4 . . stop_ save_