data_25595 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; NMR Structure of TDP-43 prion-like hydrophobic helix in DPC ; _BMRB_accession_number 25595 _BMRB_flat_file_name bmr25595.str _Entry_type original _Submission_date 2015-05-06 _Accession_date 2015-05-06 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details ; NMR solution Structures of hydrophobic helices in prion-like domain (M307-P349) of TDP-43 (TAR DNA-binding protein-43) using DPC. ; loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Lim 'Liang Zhong' . . 2 Song Jianxing . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 155 "13C chemical shifts" 84 "15N chemical shifts" 40 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2015-11-19 original BMRB . stop_ _Original_release_date 2015-11-19 save_ ############################# # Citation for this entry # ############################# save_citation1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; ALS-causing mutations significantly perturb the self-assembly and interaction with nucleic acid of the intrinsically-disordered prion-like domain of TDP-43 ; _Citation_status submitted _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Lim 'Liang Zhong' . . 2 Song Jianxing . . stop_ _Journal_abbreviation 'Plos Biology' _Journal_volume . _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year . _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'TDP-43 prion-like hydrophobic helix in DPC' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label entity $entity stop_ _System_molecular_weight . _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_entity _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity _Molecular_mass 4336.979 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 43 _Mol_residue_sequence ; MGGGMNFGAFSINPAMMAAA QAALQSSWGMMGMLASQQNQ SGP ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 307 MET 2 308 GLY 3 309 GLY 4 310 GLY 5 311 MET 6 312 ASN 7 313 PHE 8 314 GLY 9 315 ALA 10 316 PHE 11 317 SER 12 318 ILE 13 319 ASN 14 320 PRO 15 321 ALA 16 322 MET 17 323 MET 18 324 ALA 19 325 ALA 20 326 ALA 21 327 GLN 22 328 ALA 23 329 ALA 24 330 LEU 25 331 GLN 26 332 SER 27 333 SER 28 334 TRP 29 335 GLY 30 336 MET 31 337 MET 32 338 GLY 33 339 MET 34 340 LEU 35 341 ALA 36 342 SER 37 343 GLN 38 344 GLN 39 345 ASN 40 346 GLN 41 347 SER 42 348 GLY 43 349 PRO stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-11-25 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 DBJ BAC27753 "unnamed protein product [Mus musculus]" 100.00 414 100.00 100.00 1.06e-17 DBJ BAD96474 "TAR DNA binding protein variant [Homo sapiens]" 100.00 414 100.00 100.00 8.81e-18 DBJ BAE21557 "unnamed protein product [Mus musculus]" 100.00 414 100.00 100.00 9.57e-18 DBJ BAE26823 "unnamed protein product [Mus musculus]" 100.00 414 100.00 100.00 1.06e-17 DBJ BAE32189 "unnamed protein product [Mus musculus]" 100.00 414 100.00 100.00 1.17e-17 EMBL CAB43367 "hypothetical protein [Homo sapiens]" 100.00 414 100.00 100.00 8.72e-18 EMBL CAG31358 "hypothetical protein RCJMB04_5g9 [Gallus gallus]" 100.00 414 100.00 100.00 1.26e-17 EMBL CAG38565 "TARDBP [Homo sapiens]" 100.00 414 100.00 100.00 8.72e-18 EMBL CAH92854 "hypothetical protein [Pongo abelii]" 100.00 414 100.00 100.00 9.18e-18 EMBL CAJ81570 "TAR DNA binding protein [Xenopus (Silurana) tropicalis]" 97.67 409 100.00 100.00 4.66e-17 GB AAA70033 "TAR DNA-binding protein-43 [Homo sapiens]" 100.00 414 100.00 100.00 8.72e-18 GB AAH12873 "TAR DNA binding protein [Mus musculus]" 100.00 414 100.00 100.00 1.06e-17 GB AAH25544 "TAR DNA binding protein [Mus musculus]" 100.00 414 100.00 100.00 1.06e-17 GB AAH27772 "TAR DNA binding protein [Mus musculus]" 100.00 414 100.00 100.00 1.06e-17 GB AAH31126 "TAR DNA binding protein [Mus musculus]" 100.00 414 100.00 100.00 1.06e-17 REF NP_001026049 "TAR DNA-binding protein 43 [Gallus gallus]" 100.00 414 100.00 100.00 1.26e-17 REF NP_001039950 "TAR DNA-binding protein 43 [Bos taurus]" 100.00 414 100.00 100.00 9.37e-18 REF NP_001127597 "TAR DNA-binding protein 43 [Pongo abelii]" 100.00 414 100.00 100.00 9.18e-18 REF NP_001231687 "TAR DNA-binding protein 43 isoform 2 [Xenopus (Silurana) tropicalis]" 97.67 353 100.00 100.00 3.41e-17 REF NP_001231688 "TAR DNA-binding protein 43 isoform 3 [Xenopus (Silurana) tropicalis]" 97.67 247 100.00 100.00 6.41e-17 SP Q13148 "RecName: Full=TAR DNA-binding protein 43; Short=TDP-43" 100.00 414 100.00 100.00 8.72e-18 SP Q28F51 "RecName: Full=TAR DNA-binding protein 43; Short=TDP-43" 97.67 409 100.00 100.00 4.66e-17 SP Q5R5W2 "RecName: Full=TAR DNA-binding protein 43; Short=TDP-43" 100.00 414 100.00 100.00 9.18e-18 SP Q5ZLN5 "RecName: Full=TAR DNA-binding protein 43; Short=TDP-43" 100.00 414 100.00 100.00 1.26e-17 SP Q921F2 "RecName: Full=TAR DNA-binding protein 43; Short=TDP-43" 100.00 414 100.00 100.00 1.06e-17 TPG DAA21291 "TPA: TAR DNA binding protein [Bos taurus]" 100.00 414 100.00 100.00 9.37e-18 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity Human 9606 Eukaryota Metazoa Homo sapiens 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 $entity 'recombinant technology' . Escherichia coli BL21 pET28a 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 $entity 300 uM '[U-100% 15N]' DPC 60 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_CYANA _Saveframe_category software _Name CYANA _Version 2.1 loop_ _Vendor _Address _Electronic_address 'Guntert, Mumenthaler and Wuthrich' . . stop_ loop_ _Task 'structure solution' stop_ _Details . save_ save_AMBER _Saveframe_category software _Name AMBER _Version . loop_ _Vendor _Address _Electronic_address 'Case, Darden, Cheatham, III, Simmerling, Wang, Duke, Luo, ... and Kollman' . . stop_ loop_ _Task refinement stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_Machine1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_1H-15N_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_1H-15N_TOCSY_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N TOCSY' _Sample_label $sample_1 save_ save_3D_H(CCO)NH_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D H(CCO)NH' _Sample_label $sample_1 save_ save_3D_HCCH-TOCSY_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HCCH-TOCSY' _Sample_label $sample_1 save_ save_3D_HNCACB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 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' 1 . mM pH 4 . pH pressure 1 . atm temperature 313 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . 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 DSS C 13 'methyl protons' ppm 0 external indirect . . . 0.251449530 water H 1 protons ppm 0 internal indirect . . . 1 DSS N 15 'methyl protons' ppm 0 external 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_ _Software_label $CYANA stop_ loop_ _Experiment_label '3D 1H-15N NOESY' '3D 1H-15N TOCSY' '3D H(CCO)NH' '3D HCCH-TOCSY' '3D HNCACB' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name entity _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 1 307 1 MET H H 8.39 . . 2 307 1 MET HA H 4.56 . . 3 307 1 MET HB2 H 2.09 . . 4 307 1 MET HB3 H 2.21 . . 5 307 1 MET HE H 2.68 . . 6 307 1 MET HE H 2.59 . . 7 307 1 MET CA C 56.05 . . 8 307 1 MET CB C 33.04 . . 9 307 1 MET N N 120.26 . . 10 308 2 GLY H H 8.43 . . 11 308 2 GLY HA2 H 4.05 . . 12 308 2 GLY CA C 45.57 . . 13 308 2 GLY N N 109.29 . . 14 309 3 GLY H H 8.31 . . 15 309 3 GLY HA2 H 4.05 . . 16 309 3 GLY CA C 45.59 . . 17 309 3 GLY N N 108.72 . . 18 310 4 GLY H H 7.98 . . 19 310 4 GLY HA2 H 3.99 . . 20 310 4 GLY CA C 45.29 . . 21 310 4 GLY N N 107.76 . . 22 311 5 MET H H 8.37 . . 23 311 5 MET HA H 4.47 . . 24 311 5 MET HB2 H 1.97 . . 25 311 5 MET HE H 2.50 . . 26 311 5 MET CA C 55.56 . . 27 311 5 MET CB C 33.82 . . 28 311 5 MET N N 119.52 . . 29 312 6 ASN H H 8.36 . . 30 312 6 ASN HA H 4.88 . . 31 312 6 ASN HB2 H 2.75 . . 32 312 6 ASN HB3 H 2.90 . . 33 312 6 ASN CA C 52.90 . . 34 312 6 ASN CB C 39.49 . . 35 312 6 ASN N N 120.20 . . 36 313 7 PHE H H 8.54 . . 37 313 7 PHE HA H 4.62 . . 38 313 7 PHE HB2 H 2.96 . . 39 313 7 PHE HB3 H 3.27 . . 40 313 7 PHE CA C 58.47 . . 41 313 7 PHE CB C 39.65 . . 42 313 7 PHE N N 121.51 . . 43 314 8 GLY H H 8.51 . . 44 314 8 GLY HA2 H 3.86 . . 45 314 8 GLY HA3 H 4.00 . . 46 314 8 GLY CA C 46.44 . . 47 314 8 GLY N N 108.90 . . 48 315 9 ALA H H 8.13 . . 49 315 9 ALA HA H 4.34 . . 50 315 9 ALA HB H 1.37 . . 51 315 9 ALA CA C 52.77 . . 52 315 9 ALA CB C 19.32 . . 53 315 9 ALA N N 123.79 . . 54 316 10 PHE H H 7.82 . . 55 316 10 PHE HA H 4.71 . . 56 316 10 PHE HB2 H 3.18 . . 57 316 10 PHE HB3 H 3.24 . . 58 316 10 PHE CA C 57.56 . . 59 316 10 PHE CB C 40.27 . . 60 316 10 PHE N N 116.81 . . 61 317 11 SER H H 8.13 . . 62 317 11 SER HA H 4.73 . . 63 317 11 SER HB2 H 3.86 . . 64 317 11 SER CA C 57.76 . . 65 317 11 SER CB C 64.70 . . 66 317 11 SER N N 116.50 . . 67 318 12 ILE H H 8.29 . . 68 318 12 ILE HA H 4.41 . . 69 318 12 ILE HB H 1.97 . . 70 318 12 ILE HG13 H 1.64 . . 71 318 12 ILE HG2 H 1.27 . . 72 318 12 ILE HD1 H 1.01 . . 73 318 12 ILE CA C 60.37 . . 74 318 12 ILE CB C 39.08 . . 75 318 12 ILE CG1 C 27.72 . . 76 318 12 ILE CG2 C 18.21 . . 77 318 12 ILE CD1 C 13.38 . . 78 318 12 ILE N N 121.18 . . 79 319 13 ASN H H 8.16 . . 80 319 13 ASN HA H 5.01 . . 81 319 13 ASN HB2 H 2.85 . . 82 319 13 ASN CA C 52.06 . . 83 319 13 ASN CB C 38.99 . . 84 319 13 ASN N N 124.88 . . 85 320 14 PRO CA C 65.96 . . 86 320 14 PRO CB C 32.25 . . 87 321 15 ALA H H 8.30 . . 88 321 15 ALA HA H 4.34 . . 89 321 15 ALA HB H 1.56 . . 90 321 15 ALA CA C 55.29 . . 91 321 15 ALA CB C 18.34 . . 92 321 15 ALA N N 121.04 . . 93 322 16 MET CA C 58.49 . . 94 322 16 MET CB C 33.03 . . 95 323 17 MET H H 7.91 . . 96 323 17 MET HA H 4.25 . . 97 323 17 MET HB2 H 2.22 . . 98 323 17 MET HE H 2.68 . . 99 323 17 MET HE H 2.59 . . 100 323 17 MET CA C 58.66 . . 101 323 17 MET CB C 32.29 . . 102 323 17 MET N N 117.80 . . 103 324 18 ALA H H 8.18 . . 104 324 18 ALA HA H 4.23 . . 105 324 18 ALA HB H 1.60 . . 106 324 18 ALA CA C 55.14 . . 107 324 18 ALA CB C 18.18 . . 108 324 18 ALA N N 121.02 . . 109 325 19 ALA H H 8.15 . . 110 325 19 ALA HA H 4.25 . . 111 325 19 ALA HB H 1.61 . . 112 325 19 ALA CA C 55.12 . . 113 325 19 ALA CB C 18.52 . . 114 325 19 ALA N N 121.02 . . 115 326 20 ALA H H 8.34 . . 116 326 20 ALA HA H 4.11 . . 117 326 20 ALA HB H 1.60 . . 118 326 20 ALA CA C 56.14 . . 119 326 20 ALA CB C 18.45 . . 120 326 20 ALA N N 120.87 . . 121 327 21 GLN H H 8.38 . . 122 327 21 GLN HA H 3.95 . . 123 327 21 GLN HB2 H 2.26 . . 124 327 21 GLN HB3 H 2.37 . . 125 327 21 GLN HG2 H 2.51 . . 126 327 21 GLN CA C 60.00 . . 127 327 21 GLN CB C 28.82 . . 128 327 21 GLN N N 116.50 . . 129 328 22 ALA H H 8.02 . . 130 328 22 ALA HA H 4.28 . . 131 328 22 ALA HB H 1.62 . . 132 328 22 ALA CA C 55.12 . . 133 328 22 ALA CB C 18.21 . . 134 328 22 ALA N N 120.80 . . 135 329 23 ALA H H 7.92 . . 136 329 23 ALA HA H 4.30 . . 137 329 23 ALA HB H 1.65 . . 138 329 23 ALA CA C 55.10 . . 139 329 23 ALA CB C 18.53 . . 140 329 23 ALA N N 121.62 . . 141 330 24 LEU H H 8.24 . . 142 330 24 LEU HA H 4.26 . . 143 330 24 LEU HB2 H 1.74 . . 144 330 24 LEU HB3 H 1.91 . . 145 330 24 LEU HG H 1.62 . . 146 330 24 LEU HD1 H 0.97 . . 147 330 24 LEU CA C 57.80 . . 148 330 24 LEU CB C 42.06 . . 149 330 24 LEU N N 118.68 . . 150 331 25 GLN H H 8.16 . . 151 331 25 GLN HA H 4.17 . . 152 331 25 GLN HB2 H 2.28 . . 153 331 25 GLN HG2 H 2.61 . . 154 331 25 GLN HG3 H 2.52 . . 155 331 25 GLN CA C 58.82 . . 156 331 25 GLN CB C 28.84 . . 157 331 25 GLN N N 117.20 . . 158 332 26 SER H H 8.12 . . 159 332 26 SER HA H 4.52 . . 160 332 26 SER HB2 H 4.07 . . 161 332 26 SER CA C 60.65 . . 162 332 26 SER CB C 63.81 . . 163 332 26 SER N N 113.99 . . 164 333 27 SER H H 8.13 . . 165 333 27 SER HA H 4.46 . . 166 333 27 SER HB2 H 3.98 . . 167 333 27 SER HB3 H 3.98 . . 168 333 27 SER CA C 61.10 . . 169 333 27 SER CB C 63.84 . . 170 333 27 SER N N 116.99 . . 171 334 28 TRP H H 8.16 . . 172 334 28 TRP HA H 4.58 . . 173 334 28 TRP HB2 H 3.44 . . 174 334 28 TRP CA C 59.45 . . 175 334 28 TRP CB C 29.90 . . 176 334 28 TRP N N 122.55 . . 177 335 29 GLY H H 8.40 . . 178 335 29 GLY HA2 H 4.00 . . 179 335 29 GLY HA3 H 4.05 . . 180 335 29 GLY CA C 46.79 . . 181 335 29 GLY N N 126.52 . . 182 336 30 MET H H 8.08 . . 183 336 30 MET HA H 4.41 . . 184 336 30 MET HB2 H 2.20 . . 185 336 30 MET HE H 2.68 . . 186 336 30 MET HE H 2.63 . . 187 336 30 MET CA C 57.38 . . 188 336 30 MET CB C 32.96 . . 189 336 30 MET N N 119.78 . . 190 337 31 MET H H 8.12 . . 191 337 31 MET HA H 4.30 . . 192 337 31 MET HB2 H 2.13 . . 193 337 31 MET HB3 H 2.11 . . 194 337 31 MET HE H 2.66 . . 195 337 31 MET HE H 2.57 . . 196 337 31 MET CA C 57.66 . . 197 337 31 MET CB C 32.52 . . 198 337 31 MET N N 117.51 . . 199 338 32 GLY H H 8.18 . . 200 338 32 GLY HA2 H 3.90 . . 201 338 32 GLY CA C 46.54 . . 202 338 32 GLY N N 126.46 . . 203 339 33 MET H H 7.91 . . 204 339 33 MET HA H 4.41 . . 205 339 33 MET HB2 H 2.19 . . 206 339 33 MET HE H 2.70 . . 207 339 33 MET HE H 2.62 . . 208 339 33 MET CA C 57.30 . . 209 339 33 MET CB C 32.54 . . 210 339 33 MET N N 119.21 . . 211 340 34 LEU H H 7.96 . . 212 340 34 LEU HA H 4.32 . . 213 340 34 LEU HB2 H 1.85 . . 214 340 34 LEU HG H 1.69 . . 215 340 34 LEU HD1 H 0.97 . . 216 340 34 LEU HD2 H 1.02 . . 217 340 34 LEU CA C 56.23 . . 218 340 34 LEU CB C 42.42 . . 219 340 34 LEU N N 119.45 . . 220 341 35 ALA H H 7.98 . . 221 341 35 ALA HA H 4.37 . . 222 341 35 ALA HB H 1.50 . . 223 341 35 ALA CA C 53.10 . . 224 341 35 ALA CB C 19.46 . . 225 341 35 ALA N N 121.25 . . 226 342 36 SER H H 8.05 . . 227 342 36 SER HA H 4.47 . . 228 342 36 SER HB2 H 3.99 . . 229 342 36 SER CA C 59.15 . . 230 342 36 SER CB C 64.02 . . 231 342 36 SER N N 113.59 . . 232 343 37 GLN H H 8.28 . . 233 343 37 GLN HA H 4.40 . . 234 343 37 GLN HB2 H 2.09 . . 235 343 37 GLN HB3 H 2.24 . . 236 343 37 GLN HG2 H 2.46 . . 237 343 37 GLN CA C 56.36 . . 238 343 37 GLN CB C 29.45 . . 239 343 37 GLN N N 121.24 . . 240 344 38 GLN H H 8.29 . . 241 344 38 GLN HA H 4.40 . . 242 344 38 GLN HB2 H 2.07 . . 243 344 38 GLN HB3 H 2.20 . . 244 344 38 GLN HG2 H 2.44 . . 245 344 38 GLN CA C 56.37 . . 246 344 38 GLN CB C 29.46 . . 247 344 38 GLN N N 120.20 . . 248 345 39 ASN H H 8.43 . . 249 345 39 ASN HA H 4.78 . . 250 345 39 ASN HB2 H 2.81 . . 251 345 39 ASN HB3 H 2.88 . . 252 345 39 ASN CA C 53.66 . . 253 345 39 ASN CB C 38.97 . . 254 345 39 ASN N N 119.01 . . 255 346 40 GLN H H 8.37 . . 256 346 40 GLN HA H 4.48 . . 257 346 40 GLN HB2 H 2.07 . . 258 346 40 GLN HB3 H 2.24 . . 259 346 40 GLN HG2 H 2.44 . . 260 346 40 GLN CA C 56.11 . . 261 346 40 GLN CB C 29.55 . . 262 346 40 GLN N N 120.68 . . 263 347 41 SER H H 8.35 . . 264 347 41 SER HA H 4.58 . . 265 347 41 SER HB2 H 3.96 . . 266 347 41 SER CA C 58.70 . . 267 347 41 SER CB C 64.28 . . 268 347 41 SER N N 116.65 . . 269 348 42 GLY H H 8.22 . . 270 348 42 GLY HA2 H 4.18 . . 271 348 42 GLY HA3 H 4.24 . . 272 348 42 GLY CA C 44.93 . . 273 348 42 GLY N N 110.40 . . 274 349 43 PRO HA H 4.55 . . 275 349 43 PRO HB3 H 2.06 . . 276 349 43 PRO CA C 63.63 . . 277 349 43 PRO CB C 32.27 . . 278 349 43 PRO CG C 27.286 . . 279 349 43 PRO CD C 49.97 . . stop_ save_