data_28034 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone resonance assignments for the HSP27 (HSPB1) alpha-crystallin domain monomer ; _BMRB_accession_number 28034 _BMRB_flat_file_name bmr28034.str _Entry_type original _Submission_date 2019-10-29 _Accession_date 2019-10-29 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details . loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Alderson Reid . . 2 Bax Ad . . 3 Baldwin Andrew . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 80 "13C chemical shifts" 167 "15N chemical shifts" 80 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2020-06-03 update BMRB 'update entry citation' 2020-02-26 original author 'original release' stop_ loop_ _Related_BMRB_accession_number _Relationship 25645 'HSPB1 ACD' 26994 'Proline isomerization in the C-terminal region of HSP27' 27046 'oxidized alpha-crystallin domain of HSP27 (HSPB1)' 27681 'HSPB1 containing residues 1-176' stop_ _Original_release_date 2019-10-30 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Conditional disorder in small heat-shock proteins ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 32081587 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Alderson 'T. Reid' R. . 2 Ying Jinfa . . 3 Bax Ad . . 4 Benesch Justin . . 5 Baldwin Andrew J. . stop_ _Journal_abbreviation 'J. Mol. Biol.' _Journal_volume 432 _Journal_issue 9 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 3033 _Page_last 3049 _Year 2020 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'HSP27 alpha-crystallin domain monomer' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'HSP27 (HSPB1)' $HSP27_(HSPB1) stop_ _System_molecular_weight 9831.97 _System_physical_state native _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_HSP27_(HSPB1) _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'HSP27 (HSPB1)' _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 88 _Mol_residue_sequence ; GVSEIRHTADRWRVSLDVNH FAPDELTVKTKDGVVEITGK HEERQDEHGYISRSFTRKYT LPPGVDPTQVSSSLSPEGTL TVEAPMPK ; loop_ _Residue_seq_code _Residue_label 1 GLY 2 VAL 3 SER 4 GLU 5 ILE 6 ARG 7 HIS 8 THR 9 ALA 10 ASP 11 ARG 12 TRP 13 ARG 14 VAL 15 SER 16 LEU 17 ASP 18 VAL 19 ASN 20 HIS 21 PHE 22 ALA 23 PRO 24 ASP 25 GLU 26 LEU 27 THR 28 VAL 29 LYS 30 THR 31 LYS 32 ASP 33 GLY 34 VAL 35 VAL 36 GLU 37 ILE 38 THR 39 GLY 40 LYS 41 HIS 42 GLU 43 GLU 44 ARG 45 GLN 46 ASP 47 GLU 48 HIS 49 GLY 50 TYR 51 ILE 52 SER 53 ARG 54 SER 55 PHE 56 THR 57 ARG 58 LYS 59 TYR 60 THR 61 LEU 62 PRO 63 PRO 64 GLY 65 VAL 66 ASP 67 PRO 68 THR 69 GLN 70 VAL 71 SER 72 SER 73 SER 74 LEU 75 SER 76 PRO 77 GLU 78 GLY 79 THR 80 LEU 81 THR 82 VAL 83 GLU 84 ALA 85 PRO 86 MET 87 PRO 88 LYS stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $HSP27_(HSPB1) 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 _Details $HSP27_(HSPB1) 'recombinant technology' . Escherichia coli . pET-29b 'The N-terminal His-tag was cleaved by TEV protease. The Gly overhang corresponds to G84 in the amino acid sequence of HSP27.' 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 $HSP27_(HSPB1) 0.1 mM '[U-13C; U-15N; U-2H]' 'sodium phosphate' 30 mM 'natural abundance' EDTA 2 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Saveframe_category software _Name SPARKY _Version NMRFAM-SPARKY loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . stop_ loop_ _Task collection stop_ _Details . save_ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_HNCO_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_2D_1H-15N_HSQC_3 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _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 pH 4.1 . pH pressure 1 . atm temperature 298 . 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 water C 13 protons ppm 4.773 na indirect . . . 0.251449530 water H 1 protons ppm 4.773 na direct . . . 1 water N 15 protons ppm 4.773 na 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 '2H isotope effect: all 13C; all nitrogens.' loop_ _Experiment_label '3D HNCO' '3D HNCA' '2D 1H-15N HSQC' 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 'HSP27 (HSPB1)' _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 1 1 GLY C C 170.265 . 1 2 1 1 GLY CA C 42.820 . 1 3 2 2 VAL H H 8.497 . 1 4 2 2 VAL C C 176.343 . 1 5 2 2 VAL CA C 61.941 . 1 6 2 2 VAL N N 118.592 . 1 7 3 3 SER H H 8.460 . 1 8 3 3 SER C C 174.338 . 1 9 3 3 SER CA C 57.935 . 1 10 3 3 SER N N 118.757 . 1 11 4 4 GLU H H 8.404 . 1 12 4 4 GLU C C 176.052 . 1 13 4 4 GLU CA C 55.767 . 1 14 4 4 GLU N N 122.740 . 1 15 5 5 ILE H H 8.175 . 1 16 5 5 ILE C C 176.056 . 1 17 5 5 ILE CA C 60.685 . 1 18 5 5 ILE N N 122.232 . 1 19 6 6 ARG H H 8.385 . 1 20 6 6 ARG C C 175.878 . 1 21 6 6 ARG CA C 55.291 . 1 22 6 6 ARG N N 124.620 . 1 23 7 7 HIS H H 8.655 . 1 24 7 7 HIS C C 174.524 . 1 25 7 7 HIS CA C 54.771 . 1 26 7 7 HIS N N 120.13 . 1 27 8 8 THR H H 8.248 . 1 28 8 8 THR C C 174.218 . 1 29 8 8 THR CA C 61.318 . 1 30 8 8 THR N N 115.943 . 1 31 9 9 ALA H H 8.424 . 1 32 9 9 ALA C C 177.228 . 1 33 9 9 ALA CA C 51.987 . 1 34 9 9 ALA N N 125.182 . 1 35 10 10 ASP H H 8.372 . 1 36 10 10 ASP C C 175.796 . 1 37 10 10 ASP CA C 53.854 . 1 38 10 10 ASP N N 118.817 . 1 39 11 11 ARG H H 8.119 . 1 40 11 11 ARG C C 175.107 . 1 41 11 11 ARG CA C 54.715 . 1 42 11 11 ARG N N 119.283 . 1 43 12 12 TRP H H 9.080 . 1 44 12 12 TRP C C 174.584 . 1 45 12 12 TRP CA C 57.595 . 1 46 12 12 TRP N N 126.307 . 1 47 13 13 ARG H H 7.352 . 1 48 13 13 ARG C C 174.450 . 1 49 13 13 ARG CA C 54.482 . 1 50 13 13 ARG N N 124.285 . 1 51 14 14 VAL H H 8.294 . 1 52 14 14 VAL C C 173.449 . 1 53 14 14 VAL CA C 59.632 . 1 54 14 14 VAL N N 119.958 . 1 55 15 15 SER H H 8.002 . 1 56 15 15 SER C C 173.103 . 1 57 15 15 SER CA C 56.271 . 1 58 15 15 SER N N 115.757 . 1 59 16 16 LEU H H 9.111 . 1 60 16 16 LEU C C 174.453 . 1 61 16 16 LEU CA C 53.918 . 1 62 16 16 LEU N N 122.931 . 1 63 17 17 ASP H H 8.519 . 1 64 17 17 ASP C C 176.381 . 1 65 17 17 ASP CA C 53.949 . 1 66 17 17 ASP N N 122.679 . 1 67 18 18 VAL H H 8.643 . 1 68 18 18 VAL C C 175.600 . 1 69 18 18 VAL CA C 58.898 . 1 70 18 18 VAL N N 120.280 . 1 71 19 19 ASN H H 8.132 . 1 72 19 19 ASN C C 175.654 . 1 73 19 19 ASN CA C 55.203 . 1 74 19 19 ASN N N 118.816 . 1 75 20 20 HIS H H 8.560 . 1 76 20 20 HIS C C 173.691 . 1 77 20 20 HIS CA C 56.724 . 1 78 20 20 HIS N N 112.755 . 1 79 21 21 PHE H H 8.029 . 1 80 21 21 PHE C C 174.458 . 1 81 21 21 PHE CA C 57.899 . 1 82 21 21 PHE N N 117.851 . 1 83 22 22 ALA H H 8.894 . 1 84 22 22 ALA CA C 49.487 . 1 85 22 22 ALA N N 125.523 . 1 86 23 23 PRO C C 176.459 . 1 87 23 23 PRO CA C 65.667 . 1 88 24 24 ASP H H 8.244 . 1 89 24 24 ASP C C 176.603 . 1 90 24 24 ASP CA C 53.799 . 1 91 24 24 ASP N N 110.617 . 1 92 25 25 GLU H H 8.218 . 1 93 25 25 GLU C C 175.461 . 1 94 25 25 GLU CA C 55.698 . 1 95 25 25 GLU N N 118.748 . 1 96 26 26 LEU H H 7.247 . 1 97 26 26 LEU C C 176.455 . 1 98 26 26 LEU CA C 52.932 . 1 99 26 26 LEU N N 120.467 . 1 100 27 27 THR H H 8.919 . 1 101 27 27 THR C C 172.550 . 1 102 27 27 THR CA C 60.808 . 1 103 27 27 THR N N 115.59 . 1 104 28 28 VAL H H 8.506 . 1 105 28 28 VAL C C 175.154 . 1 106 28 28 VAL CA C 61.198 . 1 107 28 28 VAL N N 124.451 . 1 108 29 29 LYS H H 8.930 . 1 109 29 29 LYS C C 174.884 . 1 110 29 29 LYS CA C 54.419 . 1 111 29 29 LYS N N 126.787 . 1 112 30 30 THR H H 8.614 . 1 113 30 30 THR C C 174.273 . 1 114 30 30 THR CA C 60.917 . 1 115 30 30 THR N N 119.039 . 1 116 31 31 LYS H H 8.744 . 1 117 31 31 LYS C C 175.471 . 1 118 31 31 LYS CA C 55.618 . 1 119 31 31 LYS N N 125.181 . 1 120 32 32 ASP H H 9.268 . 1 121 32 32 ASP C C 175.665 . 1 122 32 32 ASP CA C 55.019 . 1 123 32 32 ASP N N 124.830 . 1 124 33 33 GLY H H 8.846 . 1 125 33 33 GLY C C 173.219 . 1 126 33 33 GLY CA C 45.325 . 1 127 33 33 GLY N N 104.236 . 1 128 34 34 VAL H H 7.788 . 1 129 34 34 VAL C C 174.927 . 1 130 34 34 VAL CA C 60.147 . 1 131 34 34 VAL N N 120.157 . 1 132 35 35 VAL H H 9.186 . 1 133 35 35 VAL C C 174.003 . 1 134 35 35 VAL CA C 60.427 . 1 135 35 35 VAL N N 125.372 . 1 136 36 36 GLU H H 9.421 . 1 137 36 36 GLU C C 175.209 . 1 138 36 36 GLU CA C 54.055 . 1 139 36 36 GLU N N 127.372 . 1 140 37 37 ILE H H 9.420 . 1 141 37 37 ILE C C 174.757 . 1 142 37 37 ILE CA C 59.738 . 1 143 37 37 ILE N N 128.104 . 1 144 38 38 THR H H 8.753 . 1 145 38 38 THR C C 172.886 . 1 146 38 38 THR CA C 59.404 . 1 147 38 38 THR N N 119.903 . 1 148 39 39 GLY H H 7.342 . 1 149 39 39 GLY C C 172.475 . 1 150 39 39 GLY CA C 43.827 . 1 151 39 39 GLY N N 109.975 . 1 152 40 40 LYS H H 8.252 . 1 153 40 40 LYS C C 174.075 . 1 154 40 40 LYS CA C 55.662 . 1 155 40 40 LYS N N 122.587 . 1 156 41 41 HIS H H 8.994 . 1 157 41 41 HIS C C 173.212 . 1 158 41 41 HIS CA C 54.241 . 1 159 41 41 HIS N N 122.792 . 1 160 42 42 GLU H H 8.599 . 1 161 42 42 GLU C C 174.86 . 1 162 42 42 GLU CA C 54.602 . 1 163 42 42 GLU N N 126.090 . 1 164 43 43 GLU H H 8.543 . 1 165 43 43 GLU C C 175.424 . 1 166 43 43 GLU CA C 54.880 . 1 167 43 43 GLU N N 122.06 . 1 168 44 44 ARG H H 8.539 . 1 169 44 44 ARG C C 176.149 . 1 170 44 44 ARG CA C 55.601 . 1 171 44 44 ARG N N 122.284 . 1 172 45 45 GLN H H 8.495 . 1 173 45 45 GLN C C 175.425 . 1 174 45 45 GLN CA C 55.621 . 1 175 45 45 GLN N N 121.649 . 1 176 46 46 ASP H H 8.447 . 1 177 46 46 ASP C C 175.917 . 1 178 46 46 ASP CA C 54.036 . 1 179 46 46 ASP N N 120.027 . 1 180 47 47 GLU H H 8.349 . 1 181 47 47 GLU C C 176.210 . 1 182 47 47 GLU CA C 56.625 . 1 183 47 47 GLU N N 117.954 . 1 184 48 48 HIS H H 8.434 . 1 185 48 48 HIS C C 174.570 . 1 186 48 48 HIS CA C 55.016 . 1 187 48 48 HIS N N 116.647 . 1 188 49 49 GLY H H 8.238 . 1 189 49 49 GLY C C 173.253 . 1 190 49 49 GLY CA C 44.908 . 1 191 49 49 GLY N N 109.270 . 1 192 50 50 TYR H H 8.206 . 1 193 50 50 TYR C C 175.146 . 1 194 50 50 TYR CA C 57.137 . 1 195 50 50 TYR N N 119.907 . 1 196 51 51 ILE H H 8.373 . 1 197 51 51 ILE C C 175.301 . 1 198 51 51 ILE CA C 59.772 . 1 199 51 51 ILE N N 122.302 . 1 200 52 52 SER H H 8.412 . 1 201 52 52 SER C C 174.373 . 1 202 52 52 SER CA C 57.351 . 1 203 52 52 SER N N 119.949 . 1 204 53 53 ARG H H 8.552 . 1 205 53 53 ARG C C 175.172 . 1 206 53 53 ARG CA C 55.102 . 1 207 53 53 ARG N N 122.598 . 1 208 54 54 SER H H 8.658 . 1 209 54 54 SER C C 173.976 . 1 210 54 54 SER CA C 57.299 . 1 211 54 54 SER N N 116.158 . 1 212 55 55 PHE H H 8.499 . 1 213 55 55 PHE C C 173.191 . 1 214 55 55 PHE CA C 56.779 . 1 215 55 55 PHE N N 117.958 . 1 216 56 56 THR H H 8.442 . 1 217 56 56 THR C C 173.702 . 1 218 56 56 THR CA C 61.305 . 1 219 56 56 THR N N 116.311 . 1 220 57 57 ARG H H 9.417 . 1 221 57 57 ARG C C 173.706 . 1 222 57 57 ARG CA C 53.895 . 1 223 57 57 ARG N N 126.704 . 1 224 58 58 LYS H H 9.222 . 1 225 58 58 LYS C C 175.551 . 1 226 58 58 LYS CA C 54.474 . 1 227 58 58 LYS N N 120.053 . 1 228 59 59 TYR H H 9.221 . 1 229 59 59 TYR C C 174.912 . 1 230 59 59 TYR CA C 56.631 . 1 231 59 59 TYR N N 120.052 . 1 232 60 60 THR H H 8.936 . 1 233 60 60 THR C C 174.333 . 1 234 60 60 THR CA C 62.843 . 1 235 60 60 THR N N 119.968 . 1 236 61 61 LEU H H 8.205 . 1 237 61 61 LEU CA C 52.291 . 1 238 61 61 LEU N N 127.683 . 1 239 63 63 PRO C C 177.660 . 1 240 63 63 PRO CA C 63.029 . 1 241 64 64 GLY H H 8.519 . 1 242 64 64 GLY C C 174.542 . 1 243 64 64 GLY CA C 44.769 . 1 244 64 64 GLY N N 109.577 . 1 245 65 65 VAL H H 7.041 . 1 246 65 65 VAL C C 175.104 . 1 247 65 65 VAL CA C 62.228 . 1 248 65 65 VAL N N 119.761 . 1 249 66 66 ASP H H 8.832 . 1 250 66 66 ASP CA C 50.082 . 1 251 66 66 ASP N N 129.036 . 1 252 67 67 PRO C C 178.445 . 1 253 67 67 PRO CA C 63.923 . 1 254 68 68 THR H H 8.343 . 1 255 68 68 THR C C 175.927 . 1 256 68 68 THR CA C 63.421 . 1 257 68 68 THR N N 108.695 . 1 258 69 69 GLN H H 7.984 . 1 259 69 69 GLN C C 174.964 . 1 260 69 69 GLN CA C 54.434 . 1 261 69 69 GLN N N 118.606 . 1 262 70 70 VAL H H 6.930 . 1 263 70 70 VAL C C 176.113 . 1 264 70 70 VAL CA C 62.440 . 1 265 70 70 VAL N N 120.166 . 1 266 71 71 SER H H 9.478 . 1 267 71 71 SER C C 172.148 . 1 268 71 71 SER CA C 56.498 . 1 269 71 71 SER N N 124.104 . 1 270 72 72 SER H H 8.419 . 1 271 72 72 SER C C 173.548 . 1 272 72 72 SER CA C 56.555 . 1 273 72 72 SER N N 113.529 . 1 274 73 73 SER H H 8.651 . 1 275 73 73 SER C C 171.775 . 1 276 73 73 SER CA C 57.055 . 1 277 73 73 SER N N 113.931 . 1 278 74 74 LEU H H 8.647 . 1 279 74 74 LEU C C 176.251 . 1 280 74 74 LEU CA C 52.927 . 1 281 74 74 LEU N N 126.404 . 1 282 75 75 SER H H 8.931 . 1 283 75 75 SER CA C 55.684 . 1 284 75 75 SER N N 123.745 . 1 285 76 76 PRO C C 177.251 . 1 286 76 76 PRO CA C 64.361 . 1 287 77 77 GLU H H 7.797 . 1 288 77 77 GLU C C 176.574 . 1 289 77 77 GLU CA C 56.148 . 1 290 77 77 GLU N N 113.402 . 1 291 78 78 GLY H H 8.084 . 1 292 78 78 GLY C C 172.747 . 1 293 78 78 GLY CA C 45.813 . 1 294 78 78 GLY N N 107.920 . 1 295 79 79 THR H H 7.459 . 1 296 79 79 THR C C 173.822 . 1 297 79 79 THR CA C 61.216 . 1 298 79 79 THR N N 113.858 . 1 299 80 80 LEU H H 9.520 . 1 300 80 80 LEU C C 174.734 . 1 301 80 80 LEU CA C 53.372 . 1 302 80 80 LEU N N 133.356 . 1 303 81 81 THR H H 9.124 . 1 304 81 81 THR C C 173.610 . 1 305 81 81 THR CA C 61.174 . 1 306 81 81 THR N N 122.918 . 1 307 82 82 VAL H H 8.840 . 1 308 82 82 VAL C C 173.436 . 1 309 82 82 VAL CA C 60.139 . 1 310 82 82 VAL N N 128.077 . 1 311 83 83 GLU H H 8.920 . 1 312 83 83 GLU C C 174.266 . 1 313 83 83 GLU CA C 53.629 . 1 314 83 83 GLU N N 121.235 . 1 315 84 84 ALA H H 9.076 . 1 316 84 84 ALA CA C 50.041 . 1 317 84 84 ALA N N 119.667 . 1 318 85 85 PRO C C 176.195 . 1 319 85 85 PRO CA C 62.316 . 1 320 86 86 MET H H 7.961 . 1 321 86 86 MET CA C 52.185 . 1 322 86 86 MET N N 119.378 . 1 323 87 87 PRO C C 175.974 . 1 324 87 87 PRO CA C 62.762 . 1 325 88 88 LYS H H 7.977 . 1 326 88 88 LYS CA C 57.056 . 1 327 88 88 LYS N N 125.057 . 1 stop_ save_