data_50258 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; ch-TOG 1-250 ; _BMRB_accession_number 50258 _BMRB_flat_file_name bmr50258.str _Entry_type original _Submission_date 2020-05-01 _Accession_date 2020-05-01 _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 Ryan Veronica . . 2 Naik Mandar . . 3 Fawzi Nicolas . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 2 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 190 "13C chemical shifts" 637 "15N chemical shifts" 190 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2020-12-07 original BMRB . stop_ _Original_release_date 2020-05-01 save_ ############################# # Citation for this entry # ############################# save_citations_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Tyrosine phosphorylation regulates hnRNPA2 granule protein partitioning & reduces neurodegeneration ; _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 Ryan Veronica . . 2 Perdikari Theodora . . 3 Naik Mandar . . 4 Saueressig Camillo . . 5 Lins Jeremy . . 6 Dignon Gregory . . 7 Mittal Jeetain . . 8 Hart Anne . . 9 Fawzi Nicolas . . stop_ _Journal_abbreviation 'Not known' _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_1 _Saveframe_category molecular_system _Mol_system_name 'assembly 1' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'TOG D1' $entity_1 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_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity_1 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 250 _Mol_residue_sequence ; MGDDSEWLKLPVDQKCEHKL WKARLSGYEEALKIFQKIKD EKSPEWSKFLGLIKKFVTDS NAVVQLKGLEAALVYVENAH VAGKTTGEVVSGVVSKVFNQ PKAKAKELGIEICLMYIEIE KGEAVQEELLKGLDNKNPKI IVACIETLRKALSEFGSKII LLKPIIKVLPKLFESREKAV RDEAKLIAVEIYRWIRDALR PPLQNINSVQLKELEEEWVK LPTSAPRPTRFLRSQQELEA KLEQQQSAGG ; loop_ _Residue_seq_code _Residue_label 1 MET 2 GLY 3 ASP 4 ASP 5 SER 6 GLU 7 TRP 8 LEU 9 LYS 10 LEU 11 PRO 12 VAL 13 ASP 14 GLN 15 LYS 16 CYS 17 GLU 18 HIS 19 LYS 20 LEU 21 TRP 22 LYS 23 ALA 24 ARG 25 LEU 26 SER 27 GLY 28 TYR 29 GLU 30 GLU 31 ALA 32 LEU 33 LYS 34 ILE 35 PHE 36 GLN 37 LYS 38 ILE 39 LYS 40 ASP 41 GLU 42 LYS 43 SER 44 PRO 45 GLU 46 TRP 47 SER 48 LYS 49 PHE 50 LEU 51 GLY 52 LEU 53 ILE 54 LYS 55 LYS 56 PHE 57 VAL 58 THR 59 ASP 60 SER 61 ASN 62 ALA 63 VAL 64 VAL 65 GLN 66 LEU 67 LYS 68 GLY 69 LEU 70 GLU 71 ALA 72 ALA 73 LEU 74 VAL 75 TYR 76 VAL 77 GLU 78 ASN 79 ALA 80 HIS 81 VAL 82 ALA 83 GLY 84 LYS 85 THR 86 THR 87 GLY 88 GLU 89 VAL 90 VAL 91 SER 92 GLY 93 VAL 94 VAL 95 SER 96 LYS 97 VAL 98 PHE 99 ASN 100 GLN 101 PRO 102 LYS 103 ALA 104 LYS 105 ALA 106 LYS 107 GLU 108 LEU 109 GLY 110 ILE 111 GLU 112 ILE 113 CYS 114 LEU 115 MET 116 TYR 117 ILE 118 GLU 119 ILE 120 GLU 121 LYS 122 GLY 123 GLU 124 ALA 125 VAL 126 GLN 127 GLU 128 GLU 129 LEU 130 LEU 131 LYS 132 GLY 133 LEU 134 ASP 135 ASN 136 LYS 137 ASN 138 PRO 139 LYS 140 ILE 141 ILE 142 VAL 143 ALA 144 CYS 145 ILE 146 GLU 147 THR 148 LEU 149 ARG 150 LYS 151 ALA 152 LEU 153 SER 154 GLU 155 PHE 156 GLY 157 SER 158 LYS 159 ILE 160 ILE 161 LEU 162 LEU 163 LYS 164 PRO 165 ILE 166 ILE 167 LYS 168 VAL 169 LEU 170 PRO 171 LYS 172 LEU 173 PHE 174 GLU 175 SER 176 ARG 177 GLU 178 LYS 179 ALA 180 VAL 181 ARG 182 ASP 183 GLU 184 ALA 185 LYS 186 LEU 187 ILE 188 ALA 189 VAL 190 GLU 191 ILE 192 TYR 193 ARG 194 TRP 195 ILE 196 ARG 197 ASP 198 ALA 199 LEU 200 ARG 201 PRO 202 PRO 203 LEU 204 GLN 205 ASN 206 ILE 207 ASN 208 SER 209 VAL 210 GLN 211 LEU 212 LYS 213 GLU 214 LEU 215 GLU 216 GLU 217 GLU 218 TRP 219 VAL 220 LYS 221 LEU 222 PRO 223 THR 224 SER 225 ALA 226 PRO 227 ARG 228 PRO 229 THR 230 ARG 231 PHE 232 LEU 233 ARG 234 SER 235 GLN 236 GLN 237 GLU 238 LEU 239 GLU 240 ALA 241 LYS 242 LEU 243 GLU 244 GLN 245 GLN 246 GLN 247 SER 248 ALA 249 GLY 250 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ #################### # Natural source # #################### save_natural_source_1 _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity_1 Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name $entity_1 'recombinant technology' . Escherichia coli . plasmid pJ411 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_1 250 uM '[U-100% 13C; U-100% 15N; U-80% 2H]' DTT 1 mM 'natural abundance' D2O 10 % '[U-99% 2H]' MES 20 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name NMRPipe _Version . loop_ _Task 'data analysis' stop_ _Details . save_ save_software_2 _Saveframe_category software _Name NMRFAM-SPARKY _Version . loop_ _Task 'chemical shift assignment' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 850 _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_HNCO_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_HNCACO_6 _Saveframe_category NMR_applied_experiment _Experiment_name HNCACO _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' 0 . M pH 5.5 . pH pressure 1 . atm temperature 298 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_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 na indirect . . . . DSS H 1 'methyl protons' ppm 0 internal direct . . . 1 DSS N 15 'methyl protons' ppm 0 na indirect . . . . 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 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $software_1 $software_2 stop_ loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HNCO' '3D HNCA' '3D HNCACB' HNCACO stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name 'TOG D1' _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 C C 176.636 0.00 1 2 1 1 MET CA C 55.346 0.04 1 3 1 1 MET CB C 31.769 0.00 1 4 2 2 GLY H H 8.440 0.00 1 5 2 2 GLY C C 173.731 0.03 1 6 2 2 GLY CA C 44.982 0.06 1 7 2 2 GLY N N 110.900 0.02 1 8 3 3 ASP H H 8.312 0.00 9 9 3 3 ASP C C 176.520 0.00 9 10 3 3 ASP CA C 53.810 0.04 9 11 3 3 ASP CB C 40.812 0.03 9 12 3 3 ASP N N 121.318 0.06 9 13 4 4 ASP H H 8.384 0.01 9 14 4 4 ASP C C 176.402 0.04 9 15 4 4 ASP CA C 54.724 0.03 9 16 4 4 ASP CB C 39.818 0.02 9 17 4 4 ASP N N 121.923 0.01 9 18 5 5 SER H H 8.093 0.01 9 19 5 5 SER C C 175.778 0.01 9 20 5 5 SER CA C 59.726 0.00 9 21 5 5 SER CB C 62.247 0.01 9 22 5 5 SER N N 115.047 0.00 9 23 6 6 GLU H H 8.165 0.00 1 24 6 6 GLU C C 177.370 0.02 1 25 6 6 GLU CA C 57.913 0.02 1 26 6 6 GLU CB C 28.723 0.03 1 27 6 6 GLU N N 121.532 0.02 1 28 7 7 TRP H H 7.028 0.00 1 29 7 7 TRP C C 177.979 0.02 1 30 7 7 TRP CA C 55.438 0.03 1 31 7 7 TRP CB C 29.290 0.04 1 32 7 7 TRP N N 115.517 0.02 1 33 8 8 LEU H H 6.984 0.00 1 34 8 8 LEU C C 178.423 0.02 1 35 8 8 LEU CA C 58.274 0.04 1 36 8 8 LEU CB C 41.469 0.03 1 37 8 8 LEU N N 123.430 0.02 1 38 9 9 LYS H H 7.705 0.00 1 39 9 9 LYS C C 176.994 0.01 1 40 9 9 LYS CA C 55.133 0.02 1 41 9 9 LYS CB C 31.167 0.02 1 42 9 9 LYS N N 114.636 0.03 1 43 10 10 LEU H H 7.418 0.00 1 44 10 10 LEU C C 174.711 0.00 1 45 10 10 LEU CA C 58.327 0.03 1 46 10 10 LEU CB C 40.685 0.00 1 47 10 10 LEU N N 121.614 0.05 1 48 11 11 PRO C C 178.258 0.02 1 49 11 11 PRO CA C 61.976 0.03 1 50 11 11 PRO CB C 32.113 0.02 1 51 12 12 VAL H H 8.828 0.00 1 52 12 12 VAL C C 176.333 0.00 1 53 12 12 VAL CA C 65.919 0.01 1 54 12 12 VAL CB C 30.784 0.02 1 55 12 12 VAL N N 121.981 0.01 1 56 13 13 ASP H H 9.010 0.00 1 57 13 13 ASP C C 177.514 0.04 1 58 13 13 ASP CA C 56.845 0.04 1 59 13 13 ASP CB C 37.875 0.03 1 60 13 13 ASP N N 118.836 0.02 1 61 14 14 GLN H H 7.101 0.01 1 62 14 14 GLN C C 180.450 0.00 1 63 14 14 GLN CA C 57.828 0.00 1 64 14 14 GLN CB C 28.728 0.00 1 65 14 14 GLN N N 118.438 0.02 1 66 15 15 LYS C C 180.484 0.03 1 67 15 15 LYS CA C 57.896 0.09 1 68 16 16 CYS H H 8.272 0.01 1 69 16 16 CYS C C 178.236 0.02 1 70 16 16 CYS CA C 61.454 0.03 1 71 16 16 CYS CB C 32.010 0.06 1 72 16 16 CYS N N 120.913 0.02 1 73 17 17 GLU H H 7.901 0.00 1 74 17 17 GLU C C 174.169 0.02 1 75 17 17 GLU CA C 64.114 0.04 1 76 17 17 GLU CB C 28.028 0.02 1 77 17 17 GLU N N 111.060 0.05 1 78 18 18 HIS H H 6.880 0.00 1 79 18 18 HIS C C 175.156 0.01 1 80 18 18 HIS CA C 54.864 0.05 1 81 18 18 HIS CB C 29.935 0.02 1 82 18 18 HIS N N 113.915 0.02 1 83 19 19 LYS H H 7.180 0.00 1 84 19 19 LYS C C 175.349 0.00 1 85 19 19 LYS CA C 58.706 0.01 1 86 19 19 LYS CB C 32.018 0.00 1 87 19 19 LYS N N 124.170 0.01 1 88 20 20 LEU C C 178.909 0.00 1 89 20 20 LEU CA C 54.184 0.03 1 90 20 20 LEU CB C 40.010 0.01 1 91 21 21 TRP H H 8.672 0.00 1 92 21 21 TRP C C 176.987 0.01 1 93 21 21 TRP CA C 59.741 0.03 1 94 21 21 TRP CB C 26.875 0.02 1 95 21 21 TRP N N 127.299 0.01 1 96 22 22 LYS H H 6.184 0.01 1 97 22 22 LYS C C 177.833 0.02 1 98 22 22 LYS CA C 59.060 0.03 1 99 22 22 LYS CB C 31.355 0.03 1 100 22 22 LYS N N 119.965 0.02 1 101 23 23 ALA H H 5.738 0.01 1 102 23 23 ALA C C 178.640 0.02 1 103 23 23 ALA CA C 53.042 0.02 1 104 23 23 ALA CB C 17.026 0.03 1 105 23 23 ALA N N 120.968 0.02 1 106 24 24 ARG H H 7.072 0.00 1 107 24 24 ARG C C 177.690 0.01 1 108 24 24 ARG CA C 59.458 0.03 1 109 24 24 ARG CB C 29.523 0.06 1 110 24 24 ARG N N 117.757 0.05 1 111 25 25 LEU H H 8.151 0.00 1 112 25 25 LEU C C 177.881 0.03 1 113 25 25 LEU CA C 57.783 0.01 1 114 25 25 LEU CB C 40.442 0.01 1 115 25 25 LEU N N 117.989 0.02 1 116 26 26 SER H H 6.778 0.01 1 117 26 26 SER C C 178.154 0.11 1 118 26 26 SER CA C 60.766 0.02 1 119 26 26 SER CB C 62.989 0.03 1 120 26 26 SER N N 110.636 0.02 1 121 27 27 GLY H H 8.607 0.00 1 122 27 27 GLY C C 174.318 0.01 1 123 27 27 GLY CA C 48.482 0.02 1 124 27 27 GLY N N 108.919 0.01 1 125 28 28 TYR H H 9.644 0.00 1 126 28 28 TYR C C 178.612 0.01 1 127 28 28 TYR CA C 58.263 0.08 1 128 28 28 TYR CB C 35.322 0.05 1 129 28 28 TYR N N 124.221 0.01 1 130 29 29 GLU H H 8.171 0.01 1 131 29 29 GLU C C 178.858 0.02 1 132 29 29 GLU CA C 59.358 0.03 1 133 29 29 GLU CB C 29.157 0.08 1 134 29 29 GLU N N 119.510 0.12 1 135 30 30 GLU H H 8.234 0.01 1 136 30 30 GLU C C 179.038 0.02 1 137 30 30 GLU CA C 59.114 0.03 1 138 30 30 GLU CB C 28.696 0.03 1 139 30 30 GLU N N 121.496 0.04 1 140 31 31 ALA H H 8.660 0.01 1 141 31 31 ALA C C 176.646 0.02 1 142 31 31 ALA CA C 54.432 0.03 1 143 31 31 ALA CB C 16.975 0.08 1 144 31 31 ALA N N 122.931 0.08 1 145 32 32 LEU H H 7.667 0.00 1 146 32 32 LEU C C 177.759 0.00 1 147 32 32 LEU CA C 58.423 0.00 1 148 32 32 LEU CB C 40.716 0.05 1 149 32 32 LEU N N 116.770 0.02 1 150 33 33 LYS C C 180.198 0.00 1 151 33 33 LYS CA C 58.817 0.07 1 152 33 33 LYS CB C 31.267 0.01 1 153 34 34 ILE H H 7.851 0.01 1 154 34 34 ILE C C 179.332 0.04 1 155 34 34 ILE CA C 65.082 0.05 1 156 34 34 ILE CB C 37.038 0.02 1 157 34 34 ILE N N 121.510 0.02 1 158 35 35 PHE H H 8.786 0.00 1 159 35 35 PHE C C 178.663 0.02 1 160 35 35 PHE CA C 55.917 0.05 1 161 35 35 PHE CB C 37.019 0.05 1 162 35 35 PHE N N 118.398 0.03 1 163 36 36 GLN H H 8.127 0.00 1 164 36 36 GLN C C 176.974 0.01 1 165 36 36 GLN CA C 57.538 0.01 1 166 36 36 GLN CB C 28.513 0.06 1 167 36 36 GLN N N 114.607 0.07 1 168 37 37 LYS H H 7.442 0.00 1 169 37 37 LYS C C 177.014 0.02 1 170 37 37 LYS CA C 55.746 0.02 1 171 37 37 LYS CB C 32.833 0.05 1 172 37 37 LYS N N 116.899 0.02 1 173 38 38 ILE H H 7.081 0.01 1 174 38 38 ILE C C 176.450 0.00 1 175 38 38 ILE CA C 63.155 0.01 1 176 38 38 ILE CB C 36.911 0.02 1 177 38 38 ILE N N 122.331 0.02 1 178 41 41 GLU C C 176.431 0.04 1 179 41 41 GLU CA C 61.725 0.04 1 180 42 42 LYS H H 8.629 0.00 1 181 42 42 LYS C C 175.966 0.01 1 182 42 42 LYS CA C 65.058 0.04 1 183 42 42 LYS CB C 30.365 0.02 1 184 42 42 LYS N N 117.764 0.03 1 185 43 43 SER H H 7.611 0.01 1 186 43 43 SER C C 177.225 0.00 1 187 43 43 SER CA C 58.387 0.00 1 188 43 43 SER CB C 63.834 0.00 1 189 43 43 SER N N 115.959 0.07 1 190 44 44 PRO C C 179.165 0.00 1 191 44 44 PRO CA C 64.336 0.03 1 192 44 44 PRO CB C 31.427 0.02 1 193 45 45 GLU H H 8.436 0.00 1 194 45 45 GLU C C 179.217 0.01 1 195 45 45 GLU CA C 58.562 0.03 1 196 45 45 GLU CB C 28.988 0.02 1 197 45 45 GLU N N 119.064 0.03 1 198 46 46 TRP H H 7.209 0.00 1 199 46 46 TRP C C 182.611 0.01 1 200 46 46 TRP CA C 58.868 0.03 1 201 46 46 TRP CB C 30.243 0.02 1 202 46 46 TRP N N 112.900 0.03 1 203 47 47 SER H H 8.025 0.00 1 204 47 47 SER C C 175.522 0.04 1 205 47 47 SER CA C 62.197 0.07 1 206 47 47 SER CB C 62.313 0.04 1 207 47 47 SER N N 116.789 0.04 1 208 48 48 LYS H H 7.582 0.00 1 209 48 48 LYS C C 177.003 0.02 1 210 48 48 LYS CA C 58.035 0.02 1 211 48 48 LYS CB C 30.991 0.02 1 212 48 48 LYS N N 120.705 0.02 1 213 49 49 PHE H H 7.352 0.00 1 214 49 49 PHE C C 175.329 0.00 1 215 49 49 PHE CA C 57.530 0.01 1 216 49 49 PHE CB C 40.407 0.01 1 217 49 49 PHE N N 113.628 0.02 1 218 50 50 LEU H H 7.084 0.00 1 219 50 50 LEU C C 178.442 0.03 1 220 50 50 LEU CA C 58.650 0.03 1 221 50 50 LEU CB C 42.567 0.02 1 222 50 50 LEU N N 122.366 0.02 1 223 51 51 GLY H H 8.577 0.00 1 224 51 51 GLY C C 174.566 0.02 1 225 51 51 GLY CA C 44.975 0.01 1 226 51 51 GLY N N 103.684 0.03 1 227 52 52 LEU H H 7.389 0.00 1 228 52 52 LEU C C 177.708 0.05 1 229 52 52 LEU CA C 54.612 0.03 1 230 52 52 LEU CB C 42.082 0.05 1 231 52 52 LEU N N 118.012 0.04 1 232 53 53 ILE H H 6.727 0.01 1 233 53 53 ILE C C 178.175 0.01 1 234 53 53 ILE CA C 63.053 0.03 1 235 53 53 ILE CB C 32.344 0.02 1 236 53 53 ILE N N 118.334 0.01 1 237 54 54 LYS H H 8.607 0.00 1 238 54 54 LYS C C 177.802 0.00 1 239 54 54 LYS CA C 58.642 0.08 1 240 54 54 LYS CB C 30.116 0.09 1 241 54 54 LYS N N 115.408 0.03 1 242 55 55 LYS H H 6.970 0.01 1 243 55 55 LYS C C 178.206 0.01 1 244 55 55 LYS CA C 58.433 0.02 1 245 55 55 LYS CB C 30.246 0.01 1 246 55 55 LYS N N 121.840 0.01 1 247 56 56 PHE H H 8.194 0.00 1 248 56 56 PHE C C 178.198 0.00 1 249 56 56 PHE CA C 56.652 0.03 1 250 56 56 PHE CB C 36.532 0.01 1 251 56 56 PHE N N 119.851 0.09 1 252 57 57 VAL H H 6.935 0.00 1 253 57 57 VAL C C 175.881 0.05 1 254 57 57 VAL CA C 62.683 0.05 1 255 57 57 VAL CB C 30.694 0.03 1 256 57 57 VAL N N 103.304 0.05 1 257 58 58 THR H H 7.171 0.01 1 258 58 58 THR C C 174.100 0.03 1 259 58 58 THR CA C 60.008 0.03 1 260 58 58 THR CB C 69.210 0.02 1 261 58 58 THR N N 105.438 0.03 1 262 59 59 ASP H H 6.658 0.01 1 263 59 59 ASP C C 175.351 0.01 1 264 59 59 ASP CA C 56.194 0.08 1 265 59 59 ASP CB C 42.656 0.01 1 266 59 59 ASP N N 124.791 0.02 1 267 60 60 SER H H 8.210 0.00 1 268 60 60 SER C C 174.172 0.03 1 269 60 60 SER CA C 59.554 0.04 1 270 60 60 SER CB C 63.046 0.02 1 271 60 60 SER N N 119.591 0.02 1 272 61 61 ASN H H 9.262 0.00 1 273 61 61 ASN C C 174.528 0.00 1 274 61 61 ASN CA C 52.350 0.04 1 275 61 61 ASN CB C 39.134 0.03 1 276 61 61 ASN N N 125.068 0.01 1 277 62 62 ALA H H 8.653 0.00 1 278 62 62 ALA C C 180.355 0.01 1 279 62 62 ALA CA C 55.338 0.03 1 280 62 62 ALA CB C 18.434 0.02 1 281 62 62 ALA N N 129.505 0.01 1 282 63 63 VAL H H 7.574 0.00 1 283 63 63 VAL C C 178.698 0.05 1 284 63 63 VAL CA C 65.728 0.01 1 285 63 63 VAL CB C 30.817 0.01 1 286 63 63 VAL N N 119.223 0.02 1 287 64 64 VAL H H 7.932 0.00 1 288 64 64 VAL C C 178.449 0.02 1 289 64 64 VAL CA C 65.920 0.02 1 290 64 64 VAL CB C 31.166 0.07 1 291 64 64 VAL N N 123.409 0.03 1 292 65 65 GLN H H 9.299 0.00 1 293 65 65 GLN C C 177.390 0.00 1 294 65 65 GLN CA C 58.329 0.00 1 295 65 65 GLN CB C 28.209 0.00 1 296 65 65 GLN N N 119.553 0.01 1 297 66 66 LEU C C 181.649 0.02 1 298 66 66 LEU CA C 57.375 0.06 1 299 66 66 LEU CB C 40.116 0.01 1 300 67 67 LYS H H 7.468 0.00 1 301 67 67 LYS C C 180.932 0.01 1 302 67 67 LYS CA C 59.137 0.04 1 303 67 67 LYS CB C 31.611 0.05 1 304 67 67 LYS N N 120.008 0.03 1 305 68 68 GLY H H 7.792 0.00 1 306 68 68 GLY C C 174.530 0.00 1 307 68 68 GLY CA C 46.729 0.03 1 308 68 68 GLY N N 109.009 0.04 1 309 69 69 LEU H H 7.187 0.00 1 310 69 69 LEU C C 176.076 0.00 1 311 69 69 LEU CA C 56.140 0.02 1 312 69 69 LEU CB C 39.356 0.00 1 313 69 69 LEU N N 116.306 0.03 1 314 70 70 GLU C C 179.371 0.00 1 315 70 70 GLU CA C 59.481 0.02 1 316 70 70 GLU CB C 29.440 0.05 1 317 71 71 ALA H H 8.198 0.00 1 318 71 71 ALA C C 179.238 0.02 1 319 71 71 ALA CA C 54.838 0.05 1 320 71 71 ALA CB C 16.505 0.05 1 321 71 71 ALA N N 120.399 0.04 1 322 72 72 ALA H H 9.094 0.00 1 323 72 72 ALA C C 178.368 0.01 1 324 72 72 ALA CA C 54.836 0.05 1 325 72 72 ALA CB C 18.376 0.04 1 326 72 72 ALA N N 119.990 0.01 1 327 73 73 LEU H H 8.027 0.00 1 328 73 73 LEU C C 178.216 0.01 1 329 73 73 LEU CA C 58.313 0.04 1 330 73 73 LEU CB C 40.132 0.02 1 331 73 73 LEU N N 117.894 0.04 1 332 74 74 VAL H H 7.180 0.00 1 333 74 74 VAL C C 178.471 0.00 1 334 74 74 VAL CA C 65.821 0.01 1 335 74 74 VAL CB C 30.909 0.01 1 336 74 74 VAL N N 117.570 0.09 1 337 75 75 TYR H H 8.094 0.01 1 338 75 75 TYR C C 176.641 0.00 1 339 75 75 TYR CA C 61.704 0.02 1 340 75 75 TYR CB C 38.164 0.00 1 341 75 75 TYR N N 122.296 0.03 1 342 76 76 VAL H H 7.828 0.00 1 343 76 76 VAL C C 178.705 0.05 1 344 76 76 VAL CA C 65.717 0.01 1 345 76 76 VAL CB C 30.558 0.05 1 346 76 76 VAL N N 123.561 0.04 1 347 77 77 GLU H H 7.333 0.00 1 348 77 77 GLU C C 177.251 0.01 1 349 77 77 GLU CA C 58.255 0.24 1 350 77 77 GLU CB C 28.277 0.09 1 351 77 77 GLU N N 119.432 0.10 1 352 78 78 ASN H H 6.881 0.01 1 353 78 78 ASN C C 173.557 0.02 1 354 78 78 ASN CA C 54.539 0.02 1 355 78 78 ASN CB C 43.258 0.02 1 356 78 78 ASN N N 112.378 0.05 1 357 79 79 ALA H H 7.611 0.00 1 358 79 79 ALA C C 179.853 0.02 1 359 79 79 ALA CA C 50.641 0.02 1 360 79 79 ALA CB C 16.631 0.05 1 361 79 79 ALA N N 120.774 0.02 1 362 80 80 HIS H H 8.829 0.01 1 363 80 80 HIS C C 177.941 0.04 1 364 80 80 HIS CA C 59.753 0.01 1 365 80 80 HIS CB C 29.125 0.10 1 366 80 80 HIS N N 128.897 0.04 1 367 81 81 VAL H H 7.931 0.01 1 368 81 81 VAL C C 175.986 0.01 1 369 81 81 VAL CA C 61.893 0.03 1 370 81 81 VAL CB C 30.972 0.01 1 371 81 81 VAL N N 109.640 0.03 1 372 82 82 ALA H H 7.443 0.00 1 373 82 82 ALA C C 180.686 0.04 1 374 82 82 ALA CA C 55.000 0.03 1 375 82 82 ALA CB C 19.161 0.01 1 376 82 82 ALA N N 120.569 0.03 1 377 83 83 GLY H H 8.225 0.01 1 378 83 83 GLY C C 175.586 0.02 1 379 83 83 GLY CA C 46.654 0.03 1 380 83 83 GLY N N 105.390 0.03 1 381 84 84 LYS H H 7.942 0.00 1 382 84 84 LYS C C 178.060 0.02 1 383 84 84 LYS CA C 58.262 0.02 1 384 84 84 LYS CB C 32.043 0.06 1 385 84 84 LYS N N 120.589 0.07 1 386 85 85 THR H H 7.701 0.00 1 387 85 85 THR C C 174.186 0.04 1 388 85 85 THR CA C 61.071 0.03 1 389 85 85 THR CB C 70.609 0.02 1 390 85 85 THR N N 106.552 0.01 1 391 86 86 THR H H 6.950 0.01 1 392 86 86 THR C C 175.326 0.01 1 393 86 86 THR CA C 66.469 0.05 1 394 86 86 THR CB C 68.636 0.01 1 395 86 86 THR N N 115.281 0.04 1 396 87 87 GLY H H 8.544 0.00 1 397 87 87 GLY C C 176.262 0.04 1 398 87 87 GLY CA C 47.370 0.01 1 399 87 87 GLY N N 107.073 0.02 1 400 88 88 GLU H H 8.066 0.00 1 401 88 88 GLU C C 179.254 0.02 1 402 88 88 GLU CA C 58.488 0.03 1 403 88 88 GLU CB C 28.794 0.11 1 404 88 88 GLU N N 120.027 0.01 1 405 89 89 VAL H H 8.035 0.00 1 406 89 89 VAL C C 177.852 0.02 1 407 89 89 VAL CA C 66.541 0.05 1 408 89 89 VAL CB C 30.597 0.06 1 409 89 89 VAL N N 120.870 0.06 1 410 90 90 VAL H H 8.796 0.00 1 411 90 90 VAL C C 177.829 0.04 1 412 90 90 VAL CA C 67.130 0.02 1 413 90 90 VAL CB C 30.049 0.01 1 414 90 90 VAL N N 119.552 0.02 1 415 91 91 SER H H 7.953 0.00 1 416 91 91 SER C C 177.936 0.16 1 417 91 91 SER CA C 61.219 0.12 1 418 91 91 SER CB C 61.877 0.07 1 419 91 91 SER N N 113.592 0.03 1 420 92 92 GLY H H 7.283 0.01 1 421 92 92 GLY C C 174.364 0.03 1 422 92 92 GLY CA C 46.658 0.03 1 423 92 92 GLY N N 111.234 0.03 1 424 93 93 VAL H H 8.329 0.00 1 425 93 93 VAL C C 177.761 0.00 1 426 93 93 VAL CA C 64.571 0.02 1 427 93 93 VAL CB C 30.379 0.04 1 428 93 93 VAL N N 123.949 0.02 1 429 94 94 VAL H H 8.244 0.00 1 430 94 94 VAL C C 174.765 0.02 1 431 94 94 VAL CA C 66.349 0.05 1 432 94 94 VAL CB C 31.014 0.03 1 433 94 94 VAL N N 121.038 0.02 1 434 95 95 SER H H 7.271 0.00 1 435 95 95 SER C C 176.539 0.00 1 436 95 95 SER CA C 60.498 0.02 1 437 95 95 SER CB C 64.120 0.03 1 438 95 95 SER N N 104.376 0.05 1 439 96 96 LYS H H 8.145 0.00 1 440 96 96 LYS C C 177.106 0.05 1 441 96 96 LYS CA C 55.137 0.06 1 442 96 96 LYS CB C 32.385 0.10 1 443 96 96 LYS N N 115.844 0.06 1 444 97 97 VAL H H 7.755 0.01 1 445 97 97 VAL C C 178.382 0.02 1 446 97 97 VAL CA C 63.653 0.02 1 447 97 97 VAL CB C 29.816 0.04 1 448 97 97 VAL N N 119.723 0.08 1 449 98 98 PHE H H 8.133 0.01 1 450 98 98 PHE C C 174.553 0.00 1 451 98 98 PHE CA C 54.603 0.04 1 452 98 98 PHE CB C 35.621 0.04 1 453 98 98 PHE N N 117.482 0.04 1 454 99 99 ASN H H 8.143 0.00 1 455 99 99 ASN C C 175.954 0.02 1 456 99 99 ASN CA C 52.692 0.04 1 457 99 99 ASN CB C 36.764 0.03 1 458 99 99 ASN N N 112.961 0.06 1 459 100 100 GLN H H 7.713 0.00 1 460 100 100 GLN C C 175.775 0.00 1 461 100 100 GLN CA C 53.414 0.01 1 462 100 100 GLN CB C 27.510 0.00 1 463 100 100 GLN N N 121.146 0.01 1 464 101 101 PRO C C 177.172 0.00 1 465 101 101 PRO CA C 63.215 0.02 1 466 101 101 PRO CB C 30.995 0.06 1 467 102 102 LYS H H 6.990 0.00 1 468 102 102 LYS C C 176.869 0.03 1 469 102 102 LYS CA C 55.593 0.05 1 470 102 102 LYS CB C 32.004 0.18 1 471 102 102 LYS N N 118.782 0.01 1 472 103 103 ALA H H 8.755 0.01 1 473 103 103 ALA C C 179.487 0.04 1 474 103 103 ALA CA C 54.949 0.06 1 475 103 103 ALA CB C 17.507 0.05 1 476 103 103 ALA N N 130.647 0.07 1 477 104 104 LYS H H 8.476 0.00 1 478 104 104 LYS C C 177.961 0.01 1 479 104 104 LYS CA C 57.660 0.01 1 480 104 104 LYS CB C 31.193 0.01 1 481 104 104 LYS N N 117.036 0.04 1 482 105 105 ALA H H 7.177 0.00 1 483 105 105 ALA C C 178.023 0.02 1 484 105 105 ALA CA C 54.639 0.03 1 485 105 105 ALA CB C 16.265 0.06 1 486 105 105 ALA N N 118.585 0.07 1 487 106 106 LYS H H 6.997 0.01 1 488 106 106 LYS C C 177.863 0.01 1 489 106 106 LYS CA C 60.333 0.04 1 490 106 106 LYS CB C 29.858 0.01 1 491 106 106 LYS N N 117.176 0.01 1 492 107 107 GLU H H 8.354 0.00 1 493 107 107 GLU C C 179.969 0.02 1 494 107 107 GLU CA C 59.512 0.03 1 495 107 107 GLU CB C 28.593 0.01 1 496 107 107 GLU N N 117.548 0.02 1 497 108 108 LEU H H 8.029 0.00 1 498 108 108 LEU C C 179.332 0.02 1 499 108 108 LEU CA C 57.730 0.02 1 500 108 108 LEU CB C 42.430 0.02 1 501 108 108 LEU N N 119.886 0.02 1 502 109 109 GLY H H 8.648 0.00 1 503 109 109 GLY C C 175.593 0.04 1 504 109 109 GLY CA C 48.063 0.03 1 505 109 109 GLY N N 107.308 0.02 1 506 110 110 ILE H H 8.987 0.00 1 507 110 110 ILE C C 175.433 0.04 1 508 110 110 ILE CA C 67.081 0.01 1 509 110 110 ILE CB C 37.159 0.00 1 510 110 110 ILE N N 124.298 0.04 1 511 111 111 GLU H H 5.805 0.00 1 512 111 111 GLU C C 178.428 0.02 1 513 111 111 GLU CA C 65.125 0.05 1 514 111 111 GLU CB C 30.797 0.02 1 515 111 111 GLU N N 113.592 0.08 1 516 112 112 ILE H H 6.701 0.01 1 517 112 112 ILE C C 177.338 0.00 1 518 112 112 ILE CA C 63.835 0.00 1 519 112 112 ILE CB C 37.768 0.01 1 520 112 112 ILE N N 116.407 0.01 1 521 119 119 ILE C C 175.107 0.01 1 522 119 119 ILE CA C 61.559 0.02 1 523 119 119 ILE CB C 35.409 0.08 1 524 120 120 GLU H H 7.710 0.00 1 525 120 120 GLU C C 177.215 0.03 1 526 120 120 GLU CA C 58.180 0.05 1 527 120 120 GLU CB C 24.516 0.03 1 528 120 120 GLU N N 112.466 0.02 1 529 121 121 LYS H H 8.153 0.01 1 530 121 121 LYS C C 177.136 0.03 1 531 121 121 LYS CA C 52.223 0.04 1 532 121 121 LYS CB C 29.245 0.05 1 533 121 121 LYS N N 120.715 0.10 1 534 122 122 GLY H H 8.913 0.00 1 535 122 122 GLY C C 176.572 0.01 1 536 122 122 GLY CA C 47.886 0.02 1 537 122 122 GLY N N 107.609 0.01 1 538 123 123 GLU H H 8.887 0.00 1 539 123 123 GLU C C 178.675 0.03 1 540 123 123 GLU CA C 60.039 0.04 1 541 123 123 GLU CB C 27.919 0.05 1 542 123 123 GLU N N 125.139 0.02 1 543 124 124 ALA H H 7.808 0.00 1 544 124 124 ALA C C 180.418 0.01 1 545 124 124 ALA CA C 54.044 0.02 1 546 124 124 ALA CB C 17.270 0.05 1 547 124 124 ALA N N 123.042 0.02 1 548 125 125 VAL H H 7.373 0.01 1 549 125 125 VAL C C 177.857 0.03 1 550 125 125 VAL CA C 66.117 0.04 1 551 125 125 VAL CB C 31.384 0.09 1 552 125 125 VAL N N 115.766 0.09 1 553 126 126 GLN H H 8.252 0.00 1 554 126 126 GLN C C 176.804 0.01 1 555 126 126 GLN CA C 60.398 0.04 1 556 126 126 GLN CB C 28.384 0.07 1 557 126 126 GLN N N 116.319 0.01 1 558 127 127 GLU H H 7.795 0.00 1 559 127 127 GLU C C 179.582 0.00 1 560 127 127 GLU CA C 59.443 0.00 1 561 127 127 GLU CB C 28.636 0.00 1 562 127 127 GLU N N 118.323 0.02 1 563 129 129 LEU C C 179.012 0.00 1 564 129 129 LEU CA C 58.479 0.11 1 565 130 130 LEU H H 7.412 0.01 1 566 130 130 LEU C C 179.430 0.02 1 567 130 130 LEU CA C 58.426 0.08 1 568 130 130 LEU CB C 40.689 0.04 1 569 130 130 LEU N N 117.844 0.03 1 570 131 131 LYS H H 7.081 0.00 1 571 131 131 LYS C C 178.391 0.02 1 572 131 131 LYS CA C 55.741 0.03 1 573 131 131 LYS CB C 28.268 0.04 1 574 131 131 LYS N N 119.040 0.05 1 575 132 132 GLY H H 9.085 0.00 1 576 132 132 GLY C C 175.948 0.01 1 577 132 132 GLY CA C 47.128 0.03 1 578 132 132 GLY N N 109.489 0.04 1 579 133 133 LEU H H 8.964 0.00 1 580 133 133 LEU C C 178.041 0.00 1 581 133 133 LEU CA C 57.575 0.01 1 582 133 133 LEU CB C 42.295 0.00 1 583 133 133 LEU N N 122.676 0.13 1 584 134 134 ASP C C 175.910 0.03 1 585 134 134 ASP CA C 52.920 0.03 1 586 134 134 ASP CB C 41.134 0.00 1 587 135 135 ASN H H 7.310 0.00 1 588 135 135 ASN C C 174.569 0.01 1 589 135 135 ASN CA C 54.391 0.03 1 590 135 135 ASN CB C 40.699 0.05 1 591 135 135 ASN N N 121.914 0.02 1 592 136 136 LYS H H 8.299 0.00 1 593 136 136 LYS C C 177.087 0.04 1 594 136 136 LYS CA C 56.973 0.03 1 595 136 136 LYS CB C 31.571 0.04 1 596 136 136 LYS N N 121.837 0.13 1 597 137 137 ASN H H 9.414 0.00 1 598 137 137 ASN C C 175.116 0.00 1 599 137 137 ASN CA C 49.518 0.02 1 600 137 137 ASN CB C 38.373 0.00 1 601 137 137 ASN N N 120.672 0.01 1 602 138 138 PRO C C 177.599 0.01 1 603 138 138 PRO CA C 64.119 0.05 1 604 138 138 PRO CB C 31.264 0.00 1 605 139 139 LYS H H 7.922 0.00 1 606 139 139 LYS C C 179.756 0.01 1 607 139 139 LYS CA C 59.117 0.03 1 608 139 139 LYS CB C 31.311 0.06 1 609 139 139 LYS N N 117.154 0.02 1 610 140 140 ILE H H 6.946 0.00 1 611 140 140 ILE C C 177.626 0.00 1 612 140 140 ILE CA C 65.316 0.03 1 613 140 140 ILE CB C 37.782 0.00 1 614 140 140 ILE N N 119.088 0.02 1 615 141 141 ILE C C 178.638 0.01 1 616 141 141 ILE CA C 66.139 0.02 1 617 141 141 ILE CB C 37.776 0.01 1 618 142 142 VAL H H 8.047 0.00 1 619 142 142 VAL C C 176.987 0.01 1 620 142 142 VAL CA C 66.794 0.03 1 621 142 142 VAL CB C 31.010 0.01 1 622 142 142 VAL N N 115.496 0.03 1 623 143 143 ALA H H 7.208 0.00 1 624 143 143 ALA C C 180.557 0.00 1 625 143 143 ALA CA C 54.252 0.01 1 626 143 143 ALA CB C 16.604 0.04 1 627 143 143 ALA N N 119.987 0.02 1 628 150 150 LYS C C 176.351 0.01 1 629 150 150 LYS CA C 56.264 0.05 1 630 150 150 LYS CB C 29.205 0.03 1 631 151 151 ALA H H 8.035 0.00 1 632 151 151 ALA C C 177.426 0.02 1 633 151 151 ALA CA C 52.110 0.04 1 634 151 151 ALA CB C 18.354 0.02 1 635 151 151 ALA N N 124.646 0.06 1 636 152 152 LEU H H 8.076 0.01 1 637 152 152 LEU C C 175.613 0.00 1 638 152 152 LEU CA C 55.529 0.00 1 639 152 152 LEU CB C 41.605 0.00 1 640 152 152 LEU N N 121.349 0.08 1 641 156 156 GLY C C 174.057 0.02 1 642 156 156 GLY CA C 44.471 0.08 1 643 157 157 SER H H 5.364 0.01 1 644 157 157 SER C C 174.222 0.05 1 645 157 157 SER CA C 59.242 0.03 1 646 157 157 SER CB C 62.877 0.02 1 647 157 157 SER N N 109.064 0.03 1 648 158 158 LYS H H 8.400 0.00 1 649 158 158 LYS C C 176.992 0.01 1 650 158 158 LYS CA C 57.086 0.04 1 651 158 158 LYS CB C 31.003 0.02 1 652 158 158 LYS N N 120.701 0.06 1 653 159 159 ILE H H 6.851 0.01 1 654 159 159 ILE C C 175.116 0.00 1 655 159 159 ILE CA C 59.970 0.03 1 656 159 159 ILE CB C 37.555 0.01 1 657 159 159 ILE N N 118.411 0.03 1 658 160 160 ILE H H 7.328 0.00 1 659 160 160 ILE C C 173.337 0.02 1 660 160 160 ILE CA C 56.356 0.01 1 661 160 160 ILE CB C 33.226 0.02 1 662 160 160 ILE N N 120.358 0.01 1 663 161 161 LEU H H 7.808 0.00 1 664 161 161 LEU C C 178.382 0.00 1 665 161 161 LEU CA C 53.810 0.04 1 666 161 161 LEU CB C 39.226 0.02 1 667 161 161 LEU N N 124.997 0.01 1 668 162 162 LEU H H 8.583 0.00 1 669 162 162 LEU C C 179.466 0.02 1 670 162 162 LEU CA C 56.403 0.01 1 671 162 162 LEU CB C 41.200 0.02 1 672 162 162 LEU N N 122.924 0.02 1 673 163 163 LYS H H 8.717 0.00 1 674 163 163 LYS C C 175.988 0.00 1 675 163 163 LYS CA C 62.019 0.00 1 676 163 163 LYS CB C 28.705 0.03 1 677 163 163 LYS N N 120.705 0.08 1 678 165 165 ILE CA C 67.343 0.04 1 679 166 166 ILE H H 7.913 0.00 1 680 166 166 ILE C C 177.927 0.00 1 681 166 166 ILE CA C 65.283 0.04 1 682 166 166 ILE CB C 37.390 0.06 1 683 166 166 ILE N N 114.945 0.12 1 684 167 167 LYS H H 7.479 0.00 1 685 167 167 LYS C C 177.931 0.02 1 686 167 167 LYS CA C 58.571 0.02 1 687 167 167 LYS CB C 31.907 0.04 1 688 167 167 LYS N N 116.249 0.02 1 689 168 168 VAL H H 6.963 0.00 1 690 168 168 VAL C C 176.158 0.00 1 691 168 168 VAL CA C 61.264 0.01 1 692 168 168 VAL CB C 31.864 0.00 1 693 168 168 VAL N N 111.765 0.02 1 694 170 170 PRO C C 176.529 0.03 1 695 170 170 PRO CA C 63.212 0.04 1 696 171 171 LYS H H 8.434 0.01 1 697 171 171 LYS C C 175.976 0.00 1 698 171 171 LYS CA C 55.394 0.02 1 699 171 171 LYS CB C 31.549 0.00 1 700 171 171 LYS N N 125.379 0.04 1 701 172 172 LEU C C 179.289 0.00 1 702 172 172 LEU CA C 56.940 0.03 1 703 173 173 PHE H H 7.890 0.00 1 704 173 173 PHE C C 176.599 0.02 1 705 173 173 PHE CA C 61.868 0.03 1 706 173 173 PHE CB C 37.647 0.01 1 707 173 173 PHE N N 114.782 0.02 1 708 174 174 GLU H H 7.219 0.01 1 709 174 174 GLU C C 176.271 0.02 1 710 174 174 GLU CA C 55.188 0.02 1 711 174 174 GLU CB C 29.430 0.02 1 712 174 174 GLU N N 115.482 0.02 1 713 175 175 SER H H 7.089 0.01 1 714 175 175 SER C C 176.301 0.01 1 715 175 175 SER CA C 58.925 0.02 1 716 175 175 SER CB C 63.267 0.00 1 717 175 175 SER N N 114.816 0.05 1 718 176 176 ARG H H 8.887 0.00 1 719 176 176 ARG C C 176.704 0.01 1 720 176 176 ARG CA C 56.796 0.02 1 721 176 176 ARG CB C 28.914 0.06 1 722 176 176 ARG N N 126.391 0.02 1 723 177 177 GLU H H 8.598 0.00 1 724 177 177 GLU C C 176.305 0.04 1 725 177 177 GLU CA C 53.945 0.02 1 726 177 177 GLU CB C 27.944 0.02 1 727 177 177 GLU N N 121.118 0.02 1 728 178 178 LYS H H 9.052 0.00 1 729 178 178 LYS C C 177.247 0.04 1 730 178 178 LYS CA C 59.867 0.02 1 731 178 178 LYS CB C 31.634 0.03 1 732 178 178 LYS N N 131.917 0.12 1 733 179 179 ALA H H 8.969 0.00 1 734 179 179 ALA C C 181.026 0.00 1 735 179 179 ALA CA C 54.720 0.04 1 736 179 179 ALA CB C 18.219 0.03 1 737 179 179 ALA N N 117.156 0.01 1 738 180 180 VAL H H 6.811 0.01 1 739 180 180 VAL C C 176.942 0.01 1 740 180 180 VAL CA C 65.794 0.02 1 741 180 180 VAL CB C 30.626 0.06 1 742 180 180 VAL N N 116.481 0.02 1 743 181 181 ARG H H 7.358 0.01 1 744 181 181 ARG C C 179.809 0.01 1 745 181 181 ARG CA C 60.079 0.03 1 746 181 181 ARG CB C 29.591 0.01 1 747 181 181 ARG N N 118.467 0.05 1 748 182 182 ASP H H 8.916 0.00 1 749 182 182 ASP C C 179.047 0.00 1 750 182 182 ASP CA C 56.923 0.03 1 751 182 182 ASP CB C 39.203 0.00 1 752 182 182 ASP N N 119.434 0.02 1 753 183 183 GLU C C 175.980 0.00 1 754 183 183 GLU CA C 55.949 0.05 1 755 183 183 GLU CB C 29.462 0.03 1 756 184 184 ALA H H 8.115 0.00 1 757 184 184 ALA C C 176.591 0.00 1 758 184 184 ALA CA C 51.992 0.03 1 759 184 184 ALA CB C 18.259 0.05 1 760 184 184 ALA N N 126.158 0.02 1 761 185 185 LYS H H 7.826 0.00 1 762 185 185 LYS CA C 57.226 0.00 1 763 185 185 LYS N N 126.876 0.04 1 764 188 188 ALA C C 178.718 0.01 1 765 188 188 ALA CA C 53.972 0.04 1 766 188 188 ALA CB C 15.502 0.10 1 767 189 189 VAL H H 7.879 0.00 1 768 189 189 VAL C C 177.667 0.00 1 769 189 189 VAL CA C 59.887 0.00 1 770 189 189 VAL CB C 30.805 0.03 1 771 189 189 VAL N N 118.481 0.05 1 772 195 195 ILE C C 174.659 0.02 1 773 195 195 ILE CA C 60.244 0.02 1 774 195 195 ILE CB C 38.271 0.06 1 775 196 196 ARG H H 8.633 0.00 1 776 196 196 ARG C C 175.244 0.02 1 777 196 196 ARG CA C 55.233 0.04 1 778 196 196 ARG CB C 26.908 0.04 1 779 196 196 ARG N N 124.652 0.01 1 780 197 197 ASP H H 7.402 0.00 1 781 197 197 ASP C C 177.574 0.01 1 782 197 197 ASP CA C 57.278 0.05 1 783 197 197 ASP CB C 39.824 0.04 1 784 197 197 ASP N N 116.535 0.06 1 785 198 198 ALA H H 7.531 0.00 1 786 198 198 ALA C C 178.572 0.02 1 787 198 198 ALA CA C 53.801 0.04 1 788 198 198 ALA CB C 17.168 0.05 1 789 198 198 ALA N N 124.633 0.02 1 790 199 199 LEU H H 8.208 0.00 1 791 199 199 LEU C C 175.393 0.03 1 792 199 199 LEU CA C 54.248 0.03 1 793 199 199 LEU CB C 41.775 0.03 1 794 199 199 LEU N N 117.978 0.04 1 795 200 200 ARG H H 7.324 0.00 1 796 200 200 ARG CA C 61.258 0.00 1 797 200 200 ARG CB C 26.718 0.00 1 798 200 200 ARG N N 113.820 0.02 1 799 202 202 PRO C C 177.767 0.00 1 800 202 202 PRO CA C 64.856 0.01 1 801 202 202 PRO CB C 30.465 0.03 1 802 203 203 LEU H H 7.326 0.00 1 803 203 203 LEU C C 176.608 0.02 1 804 203 203 LEU CA C 53.346 0.03 1 805 203 203 LEU CB C 40.362 0.06 1 806 203 203 LEU N N 116.603 0.06 1 807 204 204 GLN H H 7.414 0.00 1 808 204 204 GLN C C 176.036 0.03 1 809 204 204 GLN CA C 58.089 0.07 1 810 204 204 GLN CB C 28.329 0.02 1 811 204 204 GLN N N 117.091 0.10 1 812 205 205 ASN H H 8.375 0.00 1 813 205 205 ASN C C 176.188 0.02 1 814 205 205 ASN CA C 52.358 0.05 1 815 205 205 ASN CB C 38.550 0.02 1 816 205 205 ASN N N 114.285 0.03 1 817 206 206 ILE H H 7.027 0.01 1 818 206 206 ILE C C 173.988 0.03 1 819 206 206 ILE CA C 61.169 0.05 1 820 206 206 ILE CB C 37.806 0.01 1 821 206 206 ILE N N 114.919 0.03 1 822 207 207 ASN H H 8.448 0.00 1 823 207 207 ASN C C 176.985 0.01 1 824 207 207 ASN CA C 54.742 0.06 1 825 207 207 ASN CB C 39.349 0.03 1 826 207 207 ASN N N 119.274 0.02 1 827 208 208 SER H H 8.761 0.00 1 828 208 208 SER C C 176.988 0.00 1 829 208 208 SER CA C 61.614 0.06 1 830 208 208 SER CB C 62.287 0.00 1 831 208 208 SER N N 121.406 0.07 1 832 213 213 GLU C C 175.952 0.00 1 833 213 213 GLU CA C 57.624 0.07 1 834 213 213 GLU CB C 28.929 0.07 1 835 214 214 LEU H H 7.438 0.01 1 836 214 214 LEU C C 178.215 0.03 1 837 214 214 LEU CA C 52.754 0.03 1 838 214 214 LEU CB C 41.778 0.01 1 839 214 214 LEU N N 118.914 0.11 1 840 215 215 GLU H H 9.707 0.01 1 841 215 215 GLU C C 177.409 0.02 1 842 215 215 GLU CA C 58.600 0.03 1 843 215 215 GLU CB C 28.073 0.02 1 844 215 215 GLU N N 130.124 0.02 1 845 216 216 GLU H H 8.756 0.00 1 846 216 216 GLU C C 175.950 0.01 1 847 216 216 GLU CA C 55.437 0.06 1 848 216 216 GLU CB C 30.776 0.07 1 849 216 216 GLU N N 119.848 0.03 1 850 217 217 GLU H H 7.612 0.01 1 851 217 217 GLU C C 176.294 0.00 1 852 217 217 GLU CA C 56.238 0.02 1 853 217 217 GLU CB C 29.670 0.06 1 854 217 217 GLU N N 115.885 0.05 1 855 219 219 VAL C C 176.393 0.00 1 856 219 219 VAL CA C 63.616 0.06 1 857 219 219 VAL CB C 30.924 0.02 1 858 220 220 LYS H H 7.031 0.01 1 859 220 220 LYS C C 177.669 0.04 1 860 220 220 LYS CA C 56.465 0.02 1 861 220 220 LYS CB C 32.459 0.01 1 862 220 220 LYS N N 118.328 0.03 1 863 221 221 LEU H H 7.110 0.00 1 864 221 221 LEU C C 175.703 0.00 1 865 221 221 LEU CA C 53.243 0.03 1 866 221 221 LEU CB C 40.325 0.00 1 867 221 221 LEU N N 120.067 0.05 1 868 222 222 PRO C C 177.541 0.00 1 869 222 222 PRO CA C 62.469 0.02 1 870 222 222 PRO CB C 31.316 0.03 1 871 223 223 THR H H 8.580 0.00 1 872 223 223 THR C C 175.152 0.01 1 873 223 223 THR CA C 62.205 0.06 1 874 223 223 THR CB C 68.239 0.01 1 875 223 223 THR N N 112.082 0.02 1 876 224 224 SER H H 7.162 0.00 1 877 224 224 SER C C 173.701 0.00 1 878 224 224 SER CA C 56.732 0.02 1 879 224 224 SER CB C 63.293 0.02 1 880 224 224 SER N N 115.325 0.01 1 881 225 225 ALA H H 8.512 0.00 1 882 225 225 ALA C C 175.978 0.00 1 883 225 225 ALA CA C 49.904 0.01 1 884 225 225 ALA CB C 16.737 0.04 1 885 225 225 ALA N N 127.430 0.01 1 886 226 226 PRO C C 175.365 0.00 1 887 226 226 PRO CA C 58.672 0.06 1 888 226 226 PRO CB C 32.101 0.04 1 889 227 227 ARG H H 7.734 0.00 1 890 227 227 ARG C C 178.407 0.00 1 891 227 227 ARG CA C 58.079 0.00 1 892 227 227 ARG CB C 31.847 0.00 1 893 227 227 ARG N N 124.738 0.01 1 894 228 228 PRO C C 175.419 0.02 1 895 228 228 PRO CA C 62.912 0.05 1 896 228 228 PRO CB C 32.161 0.02 1 897 229 229 THR H H 8.480 0.00 1 898 229 229 THR C C 173.099 0.01 1 899 229 229 THR CA C 60.600 0.02 1 900 229 229 THR CB C 69.077 0.02 1 901 229 229 THR N N 109.857 0.02 1 902 230 230 ARG H H 7.531 0.00 1 903 230 230 ARG C C 172.092 0.01 1 904 230 230 ARG CA C 54.474 0.05 1 905 230 230 ARG CB C 33.995 0.01 1 906 230 230 ARG N N 127.788 0.03 1 907 231 231 PHE H H 8.294 0.01 1 908 231 231 PHE C C 175.526 0.02 1 909 231 231 PHE CA C 56.177 0.07 1 910 231 231 PHE CB C 42.045 0.03 1 911 231 231 PHE N N 120.765 0.04 1 912 232 232 LEU H H 9.030 0.01 1 913 232 232 LEU C C 180.334 0.06 1 914 232 232 LEU CA C 54.991 0.02 1 915 232 232 LEU CB C 41.175 0.02 1 916 232 232 LEU N N 121.115 0.02 1 917 233 233 ARG H H 8.710 0.01 1 918 233 233 ARG C C 178.481 0.05 1 919 233 233 ARG CA C 58.010 0.01 1 920 233 233 ARG CB C 28.777 0.04 1 921 233 233 ARG N N 121.232 0.12 1 922 234 234 SER H H 8.423 0.00 1 923 234 234 SER C C 175.806 0.03 1 924 234 234 SER CA C 59.782 0.04 1 925 234 234 SER CB C 62.022 0.01 1 926 234 234 SER N N 111.686 0.01 1 927 235 235 GLN H H 7.845 0.01 1 928 235 235 GLN C C 176.349 0.01 1 929 235 235 GLN CA C 55.507 0.05 1 930 235 235 GLN CB C 28.414 0.19 1 931 235 235 GLN N N 121.736 0.03 1 932 236 236 GLN H H 7.756 0.01 1 933 236 236 GLN C C 177.158 0.00 1 934 236 236 GLN CA C 57.449 0.06 1 935 236 236 GLN CB C 28.917 0.17 1 936 236 236 GLN N N 120.205 0.04 1 937 237 237 GLU H H 7.442 0.01 1 938 237 237 GLU C C 177.287 0.05 1 939 237 237 GLU CA C 57.111 0.07 1 940 237 237 GLU CB C 28.808 0.06 1 941 237 237 GLU N N 119.544 0.04 1 942 238 238 LEU H H 7.901 0.00 1 943 238 238 LEU C C 178.375 0.02 1 944 238 238 LEU CA C 56.092 0.05 1 945 238 238 LEU CB C 41.120 0.03 1 946 238 238 LEU N N 122.131 0.04 1 947 239 239 GLU H H 8.097 0.00 1 948 239 239 GLU C C 177.365 0.02 1 949 239 239 GLU CA C 57.161 0.04 1 950 239 239 GLU CB C 28.723 0.02 1 951 239 239 GLU N N 120.146 0.04 1 952 240 240 ALA H H 7.976 0.00 1 953 240 240 ALA C C 178.623 0.03 1 954 240 240 ALA CA C 52.913 0.01 1 955 240 240 ALA CB C 17.932 0.00 1 956 240 240 ALA N N 123.606 0.08 1 957 241 241 LYS H H 7.943 0.00 1 958 241 241 LYS C C 177.542 0.02 1 959 241 241 LYS CA C 56.571 0.02 1 960 241 241 LYS CB C 31.691 0.03 1 961 241 241 LYS N N 119.973 0.02 1 962 242 242 LEU H H 8.058 0.00 1 963 242 242 LEU C C 178.235 0.03 1 964 242 242 LEU CA C 55.604 0.07 1 965 242 242 LEU CB C 41.039 0.02 1 966 242 242 LEU N N 122.645 0.02 1 967 243 243 GLU H H 8.235 0.00 1 968 243 243 GLU C C 177.221 0.03 1 969 243 243 GLU CA C 56.841 0.03 1 970 243 243 GLU CB C 29.064 0.11 1 971 243 243 GLU N N 121.139 0.05 1 972 244 244 GLN H H 8.167 0.00 1 973 244 244 GLN C C 176.590 0.02 1 974 244 244 GLN CA C 55.953 0.03 1 975 244 244 GLN CB C 28.455 0.02 1 976 244 244 GLN N N 120.723 0.05 1 977 245 245 GLN H H 8.274 0.00 1 978 245 245 GLN C C 176.503 0.01 1 979 245 245 GLN CA C 55.952 0.06 1 980 245 245 GLN CB C 28.499 0.01 1 981 245 245 GLN N N 121.162 0.03 1 982 246 246 GLN H H 8.353 0.00 1 983 246 246 GLN C C 176.370 0.00 1 984 246 246 GLN CA C 55.814 0.04 1 985 246 246 GLN CB C 28.542 0.02 1 986 246 246 GLN N N 121.459 0.02 1 987 247 247 SER H H 8.291 0.00 1 988 247 247 SER C C 174.519 0.01 1 989 247 247 SER CA C 58.038 0.01 1 990 247 247 SER CB C 63.169 0.01 1 991 247 247 SER N N 117.229 0.01 1 992 248 248 ALA H H 8.323 0.00 1 993 248 248 ALA C C 178.199 0.01 1 994 248 248 ALA CA C 52.355 0.04 1 995 248 248 ALA CB C 18.461 0.04 1 996 248 248 ALA N N 126.426 0.01 1 997 249 249 GLY H H 8.274 0.00 1 998 249 249 GLY C C 173.763 0.02 1 999 249 249 GLY CA C 44.910 0.05 1 1000 249 249 GLY N N 108.772 0.01 1 1001 250 250 GLY H H 7.877 0.00 1 1002 250 250 GLY C C 179.201 0.00 1 1003 250 250 GLY CA C 45.572 0.00 1 1004 250 250 GLY N N 115.624 0.01 1 stop_ save_ save_assigned_chemical_shifts_2 _Saveframe_category assigned_chemical_shifts _Details 'These assignments are from a degenerate second population (likely unclipped tag or N-term degradation).' loop_ _Experiment_label '2D 1H-15N HSQC' '3D CBCA(CO)NH' '3D HNCO' '3D HNCA' '3D HNCACB' HNCACO stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name 'TOG D1' _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 3 3 ASP C C 176.571 0.02 9 2 3 3 ASP CA C 53.966 0.02 9 3 3 3 ASP CB C 40.841 0.03 9 4 4 4 ASP H H 8.481 0.00 9 5 4 4 ASP C C 176.454 0.05 9 6 4 4 ASP CA C 54.758 0.04 9 7 4 4 ASP CB C 39.842 0.03 9 8 4 4 ASP N N 122.022 0.02 9 9 5 5 SER H H 8.125 0.01 9 10 5 5 SER C C 175.872 0.00 9 11 5 5 SER CA C 59.793 0.03 9 12 5 5 SER CB C 62.275 0.00 9 13 5 5 SER N N 115.237 0.04 9 stop_ save_