data_27334 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Ataxin7N10QT3N9 (Residues:1-62) ; _BMRB_accession_number 27334 _BMRB_flat_file_name bmr27334.str _Entry_type original _Submission_date 2017-12-07 _Accession_date 2017-12-07 _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 Hu Hongyu . . 2 Hong Junye . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 149 "13C chemical shifts" 158 "15N chemical shifts" 43 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-02-07 original BMRB . stop_ loop_ _Related_BMRB_accession_number _Relationship 27333 'Ataxin7N10Q (Residues:1-62)' 27335 'Ataxin7N22QT3N9 (Residues:1-62)' stop_ _Original_release_date 2017-12-07 save_ ############################# # Citation for this entry # ############################# save_citations_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Structural and dynamic studies reveal that the alanine-rich region in the N-terminus of ataxin-7 initiates -helix formation of the polyglutamine tract but inhibits its amyloid aggregation ; _Citation_status 'in preparation' _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 Hu Hongyu . . 2 Hong Junye . . 3 Wang Dongdong . . 4 Xue Wei . . 5 Yue Hongwei . . 6 Yang Hui . . 7 Jiang Leilei . . 8 Wang Wenning . . stop_ _Journal_abbreviation 'J. Biol. Chem.' _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 Ataxin7N10QT3N9(1-62) _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Ataxin7N10QT3N9 $Atx7N10QT3N9 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_Atx7N10QT3N9 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Atx7N10QT3N9 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 62 _Mol_residue_sequence ; MSERAADDVRGEPRRAAAAA GGAAAAAARQQTQQQQQNQP PPPQPQRQQHPPPPPRRTRP ED ; loop_ _Residue_seq_code _Residue_label 1 MET 2 SER 3 GLU 4 ARG 5 ALA 6 ALA 7 ASP 8 ASP 9 VAL 10 ARG 11 GLY 12 GLU 13 PRO 14 ARG 15 ARG 16 ALA 17 ALA 18 ALA 19 ALA 20 ALA 21 GLY 22 GLY 23 ALA 24 ALA 25 ALA 26 ALA 27 ALA 28 ALA 29 ARG 30 GLN 31 GLN 32 THR 33 GLN 34 GLN 35 GLN 36 GLN 37 GLN 38 ASN 39 GLN 40 PRO 41 PRO 42 PRO 43 PRO 44 GLN 45 PRO 46 GLN 47 ARG 48 GLN 49 GLN 50 HIS 51 PRO 52 PRO 53 PRO 54 PRO 55 PRO 56 ARG 57 ARG 58 THR 59 ARG 60 PRO 61 GLU 62 ASP 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 $Atx7N10QT3N9 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 $Atx7N10QT3N9 'recombinant technology' . . . . pET-32M 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 _Concentration_min_value _Concentration_max_value _Isotopic_labeling $Atx7N10QT3N9 300 uM 100 500 '[U-13C; U-15N]' $Atx7N10QT3N9 300 uM 100 500 [U-15N] stop_ save_ ############################ # Computer software used # ############################ save_SPARKY _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . Goddard . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model 'Uniform NMR System' _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_1 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HNHA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNHA' _Sample_label $sample_1 save_ save_3D_1H-15N_NOESY_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample_1 save_ save_3D_1H-15N_TOCSY_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N TOCSY' _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' 70 . mM pH 6.5 . 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 DSS C 13 'methyl protons' ppm 0.00 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 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 . loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HNCACB' '3D HNHA' '3D 1H-15N NOESY' '3D 1H-15N TOCSY' 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 Ataxin7N10QT3N9 _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 MET H H 8.586 . . 2 1 1 MET HA H 4.369 . . 3 1 1 MET C C 176.432 . . 4 1 1 MET CA C 55.735 . . 5 1 1 MET CB C 32.365 . . 6 1 1 MET CG C 31.921 . . 7 1 1 MET N N 122.365 . . 8 2 2 SER H H 8.234 . . 9 2 2 SER HA H 4.301 . . 10 2 2 SER HB2 H 3.710 . . 11 2 2 SER C C 174.454 . . 12 2 2 SER CA C 58.576 . . 13 2 2 SER CB C 63.473 . . 14 2 2 SER N N 116.696 . . 15 3 3 GLU H H 8.261 . . 16 3 3 GLU HA H 4.110 . . 17 3 3 GLU HB2 H 1.779 . . 18 3 3 GLU HG2 H 2.112 . . 19 3 3 GLU CA C 56.578 . . 20 3 3 GLU CB C 30.190 . . 21 3 3 GLU CG C 36.177 . . 22 3 3 GLU N N 122.934 . . 23 4 4 ARG H H 8.185 . . 24 4 4 ARG HA H 4.136 . . 25 4 4 ARG HB2 H 1.816 . . 26 4 4 ARG HB3 H 1.616 . . 27 4 4 ARG HG2 H 1.473 . . 28 4 4 ARG HD2 H 3.037 . . 29 4 4 ARG C C 176.011 . . 30 4 4 ARG CA C 55.963 . . 31 4 4 ARG CB C 30.738 . . 32 4 4 ARG CG C 27.186 . . 33 4 4 ARG CD C 43.166 . . 34 4 4 ARG N N 121.996 . . 35 5 5 ALA H H 8.320 . . 36 5 5 ALA HA H 4.110 . . 37 5 5 ALA HB H 1.221 . . 38 5 5 ALA C C 177.763 . . 39 5 5 ALA CA C 52.377 . . 40 5 5 ALA CB C 19.032 . . 41 5 5 ALA N N 125.744 . . 42 6 6 ALA H H 8.275 . . 43 6 6 ALA HA H 4.095 . . 44 6 6 ALA HB H 1.236 . . 45 6 6 ALA C C 177.729 . . 46 6 6 ALA CA C 52.770 . . 47 6 6 ALA CB C 18.901 . . 48 6 6 ALA N N 123.212 . . 49 7 7 ASP H H 8.132 . . 50 7 7 ASP HA H 4.383 . . 51 7 7 ASP HB2 H 2.490 . . 52 7 7 ASP C C 176.058 . . 53 7 7 ASP CA C 54.284 . . 54 7 7 ASP CB C 40.768 . . 55 7 7 ASP N N 118.504 . . 56 8 8 ASP H H 8.026 . . 57 8 8 ASP HA H 4.413 . . 58 8 8 ASP HB2 H 2.506 . . 59 8 8 ASP C C 176.422 . . 60 8 8 ASP CA C 54.223 . . 61 8 8 ASP CB C 40.965 . . 62 8 8 ASP N N 120.486 . . 63 9 9 VAL H H 7.983 . . 64 9 9 VAL HA H 3.924 . . 65 9 9 VAL HB H 1.976 . . 66 9 9 VAL HG1 H 0.768 . . 67 9 9 VAL HG2 H 0.763 . . 68 9 9 VAL C C 176.451 . . 69 9 9 VAL CA C 62.527 . . 70 9 9 VAL CB C 32.151 . . 71 9 9 VAL CG1 C 21.167 . . 72 9 9 VAL CG2 C 20.666 . . 73 9 9 VAL N N 120.633 . . 74 10 10 ARG H H 8.291 . . 75 10 10 ARG HA H 4.128 . . 76 10 10 ARG HB2 H 1.674 . . 77 10 10 ARG HB3 H 1.541 . . 78 10 10 ARG C C 176.757 . . 79 10 10 ARG CA C 56.355 . . 80 10 10 ARG CB C 30.494 . . 81 10 10 ARG CG C 27.143 . . 82 10 10 ARG CD C 43.192 . . 83 10 10 ARG N N 123.904 . . 84 11 11 GLY H H 8.210 . . 85 11 11 GLY HA2 H 3.782 . . 86 11 11 GLY CA C 44.888 . . 87 11 11 GLY N N 109.269 . . 88 12 12 GLU H H 8.103 . . 89 12 12 GLU HA H 4.424 . . 90 12 12 GLU HB2 H 1.895 . . 91 12 12 GLU HB3 H 1.851 . . 92 12 12 GLU HG2 H 2.122 . . 93 12 12 GLU CA C 54.344 . . 94 12 12 GLU CB C 29.466 . . 95 12 12 GLU N N 121.809 . . 96 13 13 PRO HA H 4.247 . . 97 13 13 PRO HB2 H 2.168 . . 98 13 13 PRO HB3 H 2.134 . . 99 13 13 PRO HG2 H 1.860 . . 100 13 13 PRO HD2 H 3.653 . . 101 13 13 PRO HD3 H 3.467 . . 102 13 13 PRO C C 176.650 . . 103 13 13 PRO CA C 62.661 . . 104 13 13 PRO CB C 32.022 . . 105 13 13 PRO CG C 27.411 . . 106 13 13 PRO CD C 50.264 . . 107 14 14 ARG H H 8.336 . . 108 14 14 ARG HA H 4.117 . . 109 14 14 ARG HB3 H 1.629 . . 110 14 14 ARG HE H 7.185 . . 111 14 14 ARG C C 176.636 . . 112 14 14 ARG CA C 55.880 . . 113 14 14 ARG CB C 30.584 . . 114 14 14 ARG CG C 27.070 . . 115 14 14 ARG CD C 43.160 . . 116 14 14 ARG N N 121.789 . . 117 14 14 ARG NE N 84.438 . . 118 15 15 ARG H H 8.402 . . 119 15 15 ARG HA H 4.114 . . 120 15 15 ARG HB2 H 1.787 . . 121 15 15 ARG HB3 H 1.640 . . 122 15 15 ARG HE H 7.103 . . 123 15 15 ARG C C 175.932 . . 124 15 15 ARG CA C 55.889 . . 125 15 15 ARG CB C 30.766 . . 126 15 15 ARG CG C 27.002 . . 127 15 15 ARG CD C 43.174 . . 128 15 15 ARG N N 122.085 . . 129 15 15 ARG NE N 84.372 . . 130 16 16 ALA H H 8.354 . . 131 16 16 ALA HA H 4.104 . . 132 16 16 ALA HB H 1.246 . . 133 16 16 ALA C C 177.612 . . 134 16 16 ALA CA C 52.337 . . 135 16 16 ALA CB C 19.004 . . 136 16 16 ALA N N 126.163 . . 137 17 17 ALA H H 8.148 . . 138 17 17 ALA HA H 4.088 . . 139 17 17 ALA HB H 1.222 . . 140 17 17 ALA C C 177.516 . . 141 17 17 ALA CA C 52.346 . . 142 17 17 ALA CB C 18.983 . . 143 17 17 ALA N N 123.361 . . 144 18 18 ALA H H 8.199 . . 145 18 18 ALA HA H 4.108 . . 146 18 18 ALA HB H 1.222 . . 147 18 18 ALA CA C 52.304 . . 148 18 18 ALA CB C 19.002 . . 149 18 18 ALA N N 123.584 . . 150 19 19 ALA H H 8.278 . . 151 19 19 ALA CA C 52.438 . . 152 19 19 ALA N N 123.033 . . 153 20 20 ALA HB H 1.238 . . 154 20 20 ALA C C 178.288 . . 155 20 20 ALA CA C 52.539 . . 156 20 20 ALA CB C 18.964 . . 157 21 21 GLY H H 8.288 . . 158 21 21 GLY HA3 H 3.816 . . 159 21 21 GLY C C 174.640 . . 160 21 21 GLY CA C 45.248 . . 161 21 21 GLY N N 108.174 . . 162 22 22 GLY H H 8.178 . . 163 22 22 GLY HA3 H 3.819 . . 164 22 22 GLY C C 174.275 . . 165 22 22 GLY CA C 45.326 . . 166 22 22 GLY N N 108.808 . . 167 23 23 ALA H H 8.226 . . 168 23 23 ALA HA H 4.098 . . 169 23 23 ALA HB H 1.257 . . 170 23 23 ALA C C 178.576 . . 171 23 23 ALA CA C 53.141 . . 172 23 23 ALA CB C 18.741 . . 173 23 23 ALA N N 124.313 . . 174 24 24 ALA H H 8.258 . . 175 24 24 ALA HB H 1.234 . . 176 24 24 ALA C C 178.528 . . 177 24 24 ALA CA C 53.156 . . 178 24 24 ALA CB C 18.564 . . 179 24 24 ALA N N 122.865 . . 180 25 25 ALA H H 7.986 . . 181 25 25 ALA HA H 4.057 . . 182 25 25 ALA HB H 1.247 . . 183 25 25 ALA C C 178.584 . . 184 25 25 ALA CA C 53.136 . . 185 25 25 ALA CB C 18.505 . . 186 25 25 ALA N N 122.446 . . 187 26 26 ALA H H 7.991 . . 188 26 26 ALA HA H 4.068 . . 189 26 26 ALA HB H 1.244 . . 190 26 26 ALA CA C 53.156 . . 191 26 26 ALA CB C 18.577 . . 192 26 26 ALA N N 122.792 . . 193 27 27 ALA C C 178.362 . . 194 27 27 ALA CA C 53.029 . . 195 27 27 ALA CB C 18.517 . . 196 28 28 ALA H H 7.920 . . 197 28 28 ALA HA H 4.086 . . 198 28 28 ALA HB H 1.263 . . 199 28 28 ALA C C 178.396 . . 200 28 28 ALA CA C 52.993 . . 201 28 28 ALA CB C 18.593 . . 202 28 28 ALA N N 122.199 . . 203 29 29 ARG H H 7.966 . . 204 29 29 ARG HA H 4.093 . . 205 29 29 ARG HB2 H 1.685 . . 206 29 29 ARG C C 176.792 . . 207 29 29 ARG CA C 56.726 . . 208 29 29 ARG CB C 30.455 . . 209 29 29 ARG CD C 43.294 . . 210 29 29 ARG N N 119.475 . . 211 30 30 GLN H H 8.137 . . 212 30 30 GLN HA H 4.089 . . 213 30 30 GLN HB2 H 1.904 . . 214 30 30 GLN HG2 H 2.214 . . 215 30 30 GLN HG3 H 2.138 . . 216 30 30 GLN CA C 56.340 . . 217 30 30 GLN CB C 29.009 . . 218 30 30 GLN N N 120.787 . . 219 31 31 GLN C C 176.526 . . 220 31 31 GLN CA C 56.294 . . 221 31 31 GLN CB C 29.218 . . 222 31 31 GLN CG C 33.761 . . 223 32 32 THR H H 8.115 . . 224 32 32 THR HA H 4.146 . . 225 32 32 THR HB H 4.068 . . 226 32 32 THR HG2 H 1.051 . . 227 32 32 THR C C 174.795 . . 228 32 32 THR CA C 62.624 . . 229 32 32 THR CB C 69.583 . . 230 32 32 THR CG2 C 21.770 . . 231 32 32 THR N N 115.297 . . 232 33 33 GLN H H 8.322 . . 233 33 33 GLN HA H 4.128 . . 234 33 33 GLN HB2 H 1.897 . . 235 33 33 GLN HG2 H 2.210 . . 236 33 33 GLN CA C 56.144 . . 237 33 33 GLN CB C 29.091 . . 238 33 33 GLN N N 122.359 . . 239 36 36 GLN HA H 4.126 . . 240 36 36 GLN HG2 H 2.206 . . 241 36 36 GLN CA C 56.188 . . 242 36 36 GLN CB C 29.051 . . 243 36 36 GLN CG C 33.666 . . 244 37 37 GLN H H 8.309 . . 245 37 37 GLN HA H 4.123 . . 246 37 37 GLN HB2 H 1.917 . . 247 37 37 GLN HB3 H 1.826 . . 248 37 37 GLN HG2 H 2.189 . . 249 37 37 GLN C C 175.622 . . 250 37 37 GLN CA C 55.837 . . 251 37 37 GLN CB C 29.238 . . 252 37 37 GLN CG C 33.708 . . 253 37 37 GLN N N 121.213 . . 254 38 38 ASN H H 8.371 . . 255 38 38 ASN HA H 4.535 . . 256 38 38 ASN HB2 H 2.654 . . 257 38 38 ASN HB3 H 2.570 . . 258 38 38 ASN HD21 H 7.508 . . 259 38 38 ASN HD22 H 6.817 . . 260 38 38 ASN C C 174.619 . . 261 38 38 ASN CA C 53.197 . . 262 38 38 ASN CB C 38.634 . . 263 38 38 ASN N N 119.504 . . 264 38 38 ASN ND2 N 112.634 . . 265 39 39 GLN H H 8.202 . . 266 39 39 GLN HA H 4.448 . . 267 39 39 GLN HB2 H 1.920 . . 268 39 39 GLN HG2 H 2.208 . . 269 39 39 GLN CA C 55.940 . . 270 39 39 GLN CB C 28.813 . . 271 39 39 GLN N N 121.411 . . 272 40 40 PRO HD3 H 3.505 . . 273 43 43 PRO CA C 62.912 . . 274 43 43 PRO CB C 31.940 . . 275 43 43 PRO CG C 27.439 . . 276 43 43 PRO CD C 50.479 . . 277 44 44 GLN H H 8.386 . . 278 44 44 GLN HA H 4.098 . . 279 44 44 GLN HG2 H 2.191 . . 280 44 44 GLN CA C 53.499 . . 281 44 44 GLN CB C 30.362 . . 282 44 44 GLN N N 121.426 . . 283 45 45 PRO CA C 63.020 . . 284 45 45 PRO CB C 32.016 . . 285 45 45 PRO CG C 27.465 . . 286 45 45 PRO CD C 50.539 . . 287 46 46 GLN H H 8.481 . . 288 46 46 GLN HA H 4.210 . . 289 46 46 GLN HB2 H 1.820 . . 290 46 46 GLN HG2 H 2.192 . . 291 46 46 GLN C C 176.004 . . 292 46 46 GLN CA C 55.691 . . 293 46 46 GLN CB C 29.271 . . 294 46 46 GLN CG C 33.701 . . 295 46 46 GLN N N 120.978 . . 296 47 47 ARG H H 8.355 . . 297 47 47 ARG HA H 4.126 . . 298 47 47 ARG HB2 H 1.863 . . 299 47 47 ARG HG2 H 1.614 . . 300 47 47 ARG CA C 55.877 . . 301 47 47 ARG CB C 30.653 . . 302 47 47 ARG N N 122.853 . . 303 56 56 ARG CA C 55.918 . . 304 56 56 ARG CB C 30.793 . . 305 56 56 ARG CG C 27.096 . . 306 56 56 ARG CD C 43.214 . . 307 57 57 ARG H H 8.447 . . 308 57 57 ARG HA H 4.168 . . 309 57 57 ARG HB2 H 1.623 . . 310 57 57 ARG C C 176.322 . . 311 57 57 ARG CA C 55.816 . . 312 57 57 ARG CB C 30.762 . . 313 57 57 ARG CG C 27.136 . . 314 57 57 ARG CD C 43.238 . . 315 57 57 ARG N N 123.526 . . 316 58 58 THR H H 8.266 . . 317 58 58 THR HA H 4.139 . . 318 58 58 THR HG2 H 1.046 . . 319 58 58 THR C C 174.014 . . 320 58 58 THR CA C 61.933 . . 321 58 58 THR CB C 69.684 . . 322 58 58 THR CG2 C 21.905 . . 323 58 58 THR N N 116.284 . . 324 59 59 ARG H H 8.253 . . 325 59 59 ARG HA H 4.256 . . 326 59 59 ARG HB2 H 1.655 . . 327 59 59 ARG HG2 H 1.535 . . 328 59 59 ARG CA C 53.710 . . 329 59 59 ARG CB C 30.260 . . 330 59 59 ARG N N 123.989 . . 331 60 60 PRO C C 176.752 . . 332 60 60 PRO CA C 63.538 . . 333 60 60 PRO CB C 31.947 . . 334 60 60 PRO CG C 27.514 . . 335 60 60 PRO CD C 50.625 . . 336 61 61 GLU H H 8.506 . . 337 61 61 GLU HA H 4.095 . . 338 61 61 GLU HB2 H 1.778 . . 339 61 61 GLU HG2 H 2.137 . . 340 61 61 GLU C C 175.475 . . 341 61 61 GLU CA C 56.567 . . 342 61 61 GLU CB C 29.851 . . 343 61 61 GLU CG C 36.240 . . 344 61 61 GLU N N 119.708 . . 345 62 62 ASP H H 7.769 . . 346 62 62 ASP HA H 4.134 . . 347 62 62 ASP HB2 H 2.433 . . 348 62 62 ASP CA C 56.146 . . 349 62 62 ASP CB C 41.890 . . 350 62 62 ASP N N 126.775 . . stop_ save_