data_28060 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; HP1 ; _BMRB_accession_number 28060 _BMRB_flat_file_name bmr28060.str _Entry_type original _Submission_date 2020-01-03 _Accession_date 2020-01-03 _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 Leighton Gage O. . 2 Williams David C. Jr. stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 61 "13C chemical shifts" 187 "15N chemical shifts" 61 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2020-01-21 original BMRB . stop_ _Original_release_date 2020-01-16 save_ ############################# # Citation for this entry # ############################# save_citations_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; HP1 ; _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 Leighton Gage O. . 2 Williams David C. Jr. 3 Waters Marcey L. . 4 Krone Mackenzie W. . 5 Albanese Katherine I. . 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 _Saveframe_category molecular_system _Mol_system_name HP1 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label HP1 $HP1 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_HP1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common HP1 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 69 _Mol_residue_sequence ; MKKHHHHHHAEEEEEEYAVE KIIDRRVRKGMVEYYLKWKG YPETENTWEPENNLDCQDLI QQYEASRKD ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 8 MET 2 9 LYS 3 10 LYS 4 11 HIS 5 12 HIS 6 13 HIS 7 14 HIS 8 15 HIS 9 16 HIS 10 17 ALA 11 18 GLU 12 19 GLU 13 20 GLU 14 21 GLU 15 22 GLU 16 23 GLU 17 24 TYR 18 25 ALA 19 26 VAL 20 27 GLU 21 28 LYS 22 29 ILE 23 30 ILE 24 31 ASP 25 32 ARG 26 33 ARG 27 34 VAL 28 35 ARG 29 36 LYS 30 37 GLY 31 38 MET 32 39 VAL 33 40 GLU 34 41 TYR 35 42 TYR 36 43 LEU 37 44 LYS 38 45 TRP 39 46 LYS 40 47 GLY 41 48 TYR 42 49 PRO 43 50 GLU 44 51 THR 45 52 GLU 46 53 ASN 47 54 THR 48 55 TRP 49 56 GLU 50 57 PRO 51 58 GLU 52 59 ASN 53 60 ASN 54 61 LEU 55 62 ASP 56 63 CYS 57 64 GLN 58 65 ASP 59 66 LEU 60 67 ILE 61 68 GLN 62 69 GLN 63 70 TYR 64 71 GLU 65 72 ALA 66 73 SER 67 74 ARG 68 75 LYS 69 76 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 $HP1 'fruit fly' 7227 Eukaryota Metazoa Drosophila melanogaster 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 $HP1 'recombinant technology' . Escherichia coli . pET11a 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 $HP1 250 uM '[U-100% 13C; U-100% 15N]' 'sodium phosphate' 20 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ 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_ save_CCPNMR _Saveframe_category software _Name CCPNMR _Version . loop_ _Vendor _Address _Electronic_address CCPN . . stop_ loop_ _Task 'chemical shift assignment' 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_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_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 40 . mM pH 7.5 . 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 HNCO' '3D HNCA' '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 HP1 _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 13 6 HIS C C 175.792 0.000 1 2 13 6 HIS CA C 55.945 0.000 1 3 13 6 HIS CB C 33.337 0.000 1 4 14 7 HIS H H 8.390 0.002 1 5 14 7 HIS C C 175.981 0.000 1 6 14 7 HIS CA C 55.979 0.032 1 7 14 7 HIS CB C 33.614 0.056 1 8 14 7 HIS N N 122.343 0.015 1 9 15 8 HIS H H 8.730 0.053 1 10 15 8 HIS C C 174.514 0.000 1 11 15 8 HIS CA C 55.893 0.041 1 12 15 8 HIS CB C 29.889 0.014 1 13 15 8 HIS N N 120.559 0.081 1 14 16 9 HIS H H 8.527 0.010 1 15 16 9 HIS C C 174.297 0.000 1 16 16 9 HIS CA C 55.656 0.011 1 17 16 9 HIS CB C 29.762 0.054 1 18 16 9 HIS N N 120.488 0.066 1 19 17 10 ALA H H 8.448 0.005 1 20 17 10 ALA C C 177.689 0.000 1 21 17 10 ALA CA C 52.969 0.031 1 22 17 10 ALA CB C 19.233 0.018 1 23 17 10 ALA N N 125.142 0.033 1 24 18 11 GLU H H 8.595 0.003 1 25 18 11 GLU C C 176.607 0.000 1 26 18 11 GLU CA C 57.163 0.031 1 27 18 11 GLU CB C 29.718 0.001 1 28 18 11 GLU N N 119.132 0.030 1 29 19 12 GLU H H 8.277 0.004 1 30 19 12 GLU C C 176.355 0.000 1 31 19 12 GLU CA C 56.680 0.033 1 32 19 12 GLU CB C 30.178 0.066 1 33 19 12 GLU N N 119.893 0.051 1 34 20 13 GLU H H 8.283 0.007 1 35 20 13 GLU C C 176.289 0.000 1 36 20 13 GLU CA C 56.549 0.018 1 37 20 13 GLU CB C 30.427 0.050 1 38 20 13 GLU N N 121.024 0.032 1 39 21 14 GLU H H 8.348 0.005 1 40 21 14 GLU C C 176.120 0.000 1 41 21 14 GLU CA C 56.417 0.060 1 42 21 14 GLU CB C 30.791 0.000 1 43 21 14 GLU N N 121.432 0.039 1 44 22 15 GLU H H 8.282 0.002 1 45 22 15 GLU C C 175.374 0.000 1 46 22 15 GLU CA C 56.278 0.031 1 47 22 15 GLU CB C 30.784 0.006 1 48 22 15 GLU N N 122.126 0.014 1 49 23 16 GLU H H 8.292 0.000 1 50 23 16 GLU C C 175.940 0.000 1 51 23 16 GLU CA C 56.081 0.042 1 52 23 16 GLU CB C 30.791 0.030 1 53 23 16 GLU N N 122.141 0.000 1 54 24 17 TYR H H 8.705 0.379 1 55 24 17 TYR C C 174.700 0.000 1 56 24 17 TYR CA C 57.613 0.020 1 57 24 17 TYR CB C 39.805 0.014 1 58 24 17 TYR N N 124.426 1.050 1 59 25 18 ALA H H 9.259 0.039 1 60 25 18 ALA C C 176.584 0.000 1 61 25 18 ALA CA C 50.903 0.012 1 62 25 18 ALA CB C 21.517 0.000 1 63 25 18 ALA N N 125.871 0.275 1 64 26 19 VAL H H 8.887 0.001 1 65 26 19 VAL C C 175.196 0.000 1 66 26 19 VAL CA C 64.113 0.018 1 67 26 19 VAL CB C 32.791 0.023 1 68 26 19 VAL N N 124.713 0.010 1 69 27 20 GLU H H 9.403 0.018 1 70 27 20 GLU C C 175.639 0.000 1 71 27 20 GLU CA C 57.243 0.000 1 72 27 20 GLU CB C 32.262 0.000 1 73 27 20 GLU N N 127.443 0.017 1 74 28 21 LYS H H 7.381 0.017 1 75 28 21 LYS C C 172.788 0.000 1 76 28 21 LYS CA C 55.496 0.006 1 77 28 21 LYS CB C 36.456 0.020 1 78 28 21 LYS N N 114.706 0.033 1 79 29 22 ILE H H 8.457 0.002 1 80 29 22 ILE C C 174.817 0.000 1 81 29 22 ILE CA C 60.859 0.000 1 82 29 22 ILE CB C 37.683 0.004 1 83 29 22 ILE N N 123.202 0.016 1 84 30 23 ILE H H 8.912 0.000 1 85 30 23 ILE C C 175.271 0.000 1 86 30 23 ILE CA C 61.123 0.064 1 87 30 23 ILE CB C 39.210 0.006 1 88 30 23 ILE N N 124.814 0.007 1 89 31 24 ASP H H 7.610 0.009 1 90 31 24 ASP C C 173.306 0.000 1 91 31 24 ASP CA C 52.575 0.007 1 92 31 24 ASP CB C 44.491 0.031 1 93 31 24 ASP N N 117.510 0.028 1 94 32 25 ARG H H 9.433 0.005 1 95 32 25 ARG C C 174.034 0.000 1 96 32 25 ARG CA C 55.236 0.007 1 97 32 25 ARG CB C 35.365 0.000 1 98 32 25 ARG N N 121.774 0.019 1 99 33 26 ARG H H 9.413 0.006 1 100 33 26 ARG C C 171.914 0.000 1 101 33 26 ARG CA C 54.149 0.029 1 102 33 26 ARG CB C 32.643 0.068 1 103 33 26 ARG N N 124.218 0.013 1 104 34 27 VAL H H 8.264 0.003 1 105 34 27 VAL C C 176.163 0.000 1 106 34 27 VAL CA C 61.027 0.000 1 107 34 27 VAL CB C 32.860 0.000 1 108 34 27 VAL N N 119.076 0.028 1 109 35 28 ARG H H 9.003 0.003 1 110 35 28 ARG C C 175.328 0.000 1 111 35 28 ARG CA C 54.892 0.019 1 112 35 28 ARG CB C 33.426 0.047 1 113 35 28 ARG N N 128.729 0.018 1 114 36 29 LYS H H 9.469 0.003 1 115 36 29 LYS C C 176.402 0.000 1 116 36 29 LYS CA C 56.993 0.048 1 117 36 29 LYS CB C 30.075 0.015 1 118 36 29 LYS N N 126.758 0.026 1 119 37 30 GLY H H 8.297 0.003 1 120 37 30 GLY C C 173.295 0.000 1 121 37 30 GLY CA C 45.410 0.001 1 122 37 30 GLY N N 105.645 7.506 1 123 38 31 MET H H 7.838 0.005 1 124 38 31 MET C C 174.195 0.000 1 125 38 31 MET CA C 53.573 0.030 1 126 38 31 MET CB C 34.242 0.029 1 127 38 31 MET N N 120.979 0.017 1 128 39 32 VAL H H 8.641 0.001 1 129 39 32 VAL C C 175.685 0.000 1 130 39 32 VAL CA C 63.251 0.032 1 131 39 32 VAL CB C 31.690 0.000 1 132 39 32 VAL N N 125.336 0.011 1 133 40 33 GLU H H 9.083 0.002 1 134 40 33 GLU C C 174.385 0.000 1 135 40 33 GLU CA C 53.875 0.012 1 136 40 33 GLU CB C 34.911 0.000 1 137 40 33 GLU N N 125.986 0.017 1 138 41 34 TYR H H 8.973 0.004 1 139 41 34 TYR C C 173.386 0.000 1 140 41 34 TYR CA C 57.066 0.038 1 141 41 34 TYR CB C 42.548 0.013 1 142 41 34 TYR N N 118.412 0.028 1 143 42 35 TYR H H 7.980 0.002 1 144 42 35 TYR C C 174.233 0.000 1 145 42 35 TYR CA C 54.830 0.015 1 146 42 35 TYR CB C 37.315 0.014 1 147 42 35 TYR N N 126.112 0.032 1 148 43 36 LEU H H 8.388 0.011 1 149 43 36 LEU C C 173.269 0.000 1 150 43 36 LEU CA C 53.926 0.007 1 151 43 36 LEU CB C 43.598 0.020 1 152 43 36 LEU N N 127.561 0.021 1 153 44 37 LYS H H 7.478 0.013 1 154 44 37 LYS C C 175.620 0.000 1 155 44 37 LYS CA C 53.199 0.004 1 156 44 37 LYS CB C 35.406 0.000 1 157 44 37 LYS N N 118.392 0.012 1 158 45 38 TRP H H 9.166 0.037 1 159 45 38 TRP C C 177.068 0.000 1 160 45 38 TRP CA C 55.814 0.032 1 161 45 38 TRP CB C 30.802 0.040 1 162 45 38 TRP N N 131.396 0.132 1 163 46 39 LYS H H 9.357 0.026 1 164 46 39 LYS C C 178.148 0.000 1 165 46 39 LYS CA C 58.280 0.000 1 166 46 39 LYS CB C 32.866 0.025 1 167 46 39 LYS N N 125.191 0.064 1 168 47 40 GLY H H 9.215 0.031 1 169 47 40 GLY C C 173.341 0.000 1 170 47 40 GLY CA C 45.173 0.011 1 171 47 40 GLY N N 112.880 0.071 1 172 48 41 TYR H H 7.700 0.047 1 173 48 41 TYR CA C 55.854 0.022 1 174 48 41 TYR CB C 40.336 0.000 1 175 48 41 TYR N N 118.480 0.017 1 176 49 42 PRO C C 177.761 0.000 1 177 49 42 PRO CA C 61.942 0.039 1 178 49 42 PRO CB C 33.303 0.010 1 179 50 43 GLU H H 9.092 0.001 1 180 50 43 GLU C C 178.277 0.000 1 181 50 43 GLU CA C 58.301 0.007 1 182 50 43 GLU CB C 29.258 0.000 1 183 50 43 GLU N N 118.824 0.072 1 184 51 44 THR H H 7.210 0.007 1 185 51 44 THR C C 176.092 0.000 1 186 51 44 THR CA C 63.651 0.048 1 187 51 44 THR CB C 68.160 0.011 1 188 51 44 THR N N 108.954 0.071 1 189 52 45 GLU H H 8.125 0.014 1 190 52 45 GLU C C 174.912 0.000 1 191 52 45 GLU CA C 54.664 0.000 1 192 52 45 GLU CB C 28.803 0.000 1 193 52 45 GLU N N 119.404 0.122 1 194 53 46 ASN H H 7.279 0.042 1 195 53 46 ASN C C 176.385 0.000 1 196 53 46 ASN CA C 54.270 0.020 1 197 53 46 ASN CB C 36.873 0.017 1 198 53 46 ASN N N 120.070 0.011 1 199 54 47 THR H H 7.456 0.013 1 200 54 47 THR C C 173.023 0.000 1 201 54 47 THR CA C 59.718 0.066 1 202 54 47 THR CB C 72.400 0.018 1 203 54 47 THR N N 110.007 0.021 1 204 55 48 TRP H H 8.595 0.003 1 205 55 48 TRP C C 177.449 0.000 1 206 55 48 TRP CA C 56.153 0.044 1 207 55 48 TRP CB C 30.473 0.026 1 208 55 48 TRP N N 120.539 0.061 1 209 56 49 GLU H H 9.552 0.002 1 210 56 49 GLU CA C 52.038 0.005 1 211 56 49 GLU CB C 32.807 0.000 1 212 56 49 GLU N N 122.425 0.019 1 213 57 50 PRO C C 178.222 0.000 1 214 57 50 PRO CA C 62.469 0.030 1 215 57 50 PRO CB C 32.570 0.026 1 216 58 51 GLU H H 8.840 0.007 1 217 58 51 GLU C C 177.436 0.000 1 218 58 51 GLU CA C 59.839 0.010 1 219 58 51 GLU CB C 29.840 0.000 1 220 58 51 GLU N N 122.294 0.030 1 221 59 52 ASN H H 8.295 0.008 1 222 59 52 ASN C C 175.527 0.000 1 223 59 52 ASN CA C 54.699 0.000 1 224 59 52 ASN CB C 37.465 0.012 1 225 59 52 ASN N N 114.036 0.017 1 226 60 53 ASN H H 7.974 0.003 1 227 60 53 ASN C C 174.950 0.000 1 228 60 53 ASN CA C 52.488 0.019 1 229 60 53 ASN CB C 39.523 0.000 1 230 60 53 ASN N N 117.340 0.019 1 231 61 54 LEU H H 7.476 0.004 1 232 61 54 LEU C C 176.585 0.000 1 233 61 54 LEU CA C 54.757 0.048 1 234 61 54 LEU CB C 44.288 0.020 1 235 61 54 LEU N N 119.571 0.070 1 236 62 55 ASP H H 8.618 0.029 1 237 62 55 ASP C C 176.172 0.000 1 238 62 55 ASP CA C 52.976 0.005 1 239 62 55 ASP CB C 41.063 0.006 1 240 62 55 ASP N N 120.188 0.037 1 241 63 56 CYS H H 7.776 0.011 1 242 63 56 CYS C C 175.295 0.000 1 243 63 56 CYS CA C 53.425 0.025 1 244 63 56 CYS CB C 27.562 0.026 1 245 63 56 CYS N N 116.824 0.054 1 246 64 57 GLN H H 8.381 0.002 1 247 64 57 GLN C C 177.459 0.000 1 248 64 57 GLN CA C 59.763 0.004 1 249 64 57 GLN CB C 28.137 0.078 1 250 64 57 GLN N N 122.540 0.008 1 251 65 58 ASP H H 8.797 0.001 1 252 65 58 ASP C C 178.475 0.000 1 253 65 58 ASP CA C 57.083 0.037 1 254 65 58 ASP CB C 39.094 0.017 1 255 65 58 ASP N N 118.141 0.009 1 256 66 59 LEU H H 7.599 0.006 1 257 66 59 LEU C C 180.634 0.000 1 258 66 59 LEU CA C 57.441 0.006 1 259 66 59 LEU CB C 41.667 0.000 1 260 66 59 LEU N N 120.696 0.024 1 261 67 60 ILE H H 7.843 0.010 1 262 67 60 ILE C C 177.361 0.000 1 263 67 60 ILE CA C 66.097 0.001 1 264 67 60 ILE CB C 38.361 0.007 1 265 67 60 ILE N N 121.945 0.038 1 266 68 61 GLN H H 8.341 0.014 1 267 68 61 GLN C C 179.445 0.000 1 268 68 61 GLN CA C 59.232 0.005 1 269 68 61 GLN CB C 27.880 0.001 1 270 68 61 GLN N N 118.831 0.014 1 271 69 62 GLN H H 7.919 0.007 1 272 69 62 GLN C C 178.445 0.000 1 273 69 62 GLN CA C 58.801 0.037 1 274 69 62 GLN CB C 28.730 0.038 1 275 69 62 GLN N N 118.396 0.023 1 276 70 63 TYR H H 8.037 0.001 1 277 70 63 TYR C C 178.986 0.000 1 278 70 63 TYR CA C 61.771 0.032 1 279 70 63 TYR CB C 38.429 0.008 1 280 70 63 TYR N N 121.894 0.013 1 281 71 64 GLU H H 8.881 0.003 1 282 71 64 GLU C C 179.191 0.000 1 283 71 64 GLU CA C 58.860 0.046 1 284 71 64 GLU CB C 29.075 0.000 1 285 71 64 GLU N N 119.651 0.021 1 286 72 65 ALA H H 7.951 0.007 1 287 72 65 ALA C C 178.895 0.000 1 288 72 65 ALA CA C 54.154 0.018 1 289 72 65 ALA CB C 18.335 0.000 1 290 72 65 ALA N N 119.944 0.014 1 291 73 66 SER H H 7.469 0.003 1 292 73 66 SER C C 174.230 0.000 1 293 73 66 SER CA C 58.877 0.038 1 294 73 66 SER CB C 64.097 0.035 1 295 73 66 SER N N 112.066 0.017 1 296 74 67 ARG H H 7.284 0.002 1 297 74 67 ARG C C 176.020 0.000 1 298 74 67 ARG CA C 56.437 0.014 1 299 74 67 ARG CB C 30.595 0.016 1 300 74 67 ARG N N 122.396 0.007 1 301 75 68 LYS H H 8.179 0.002 1 302 75 68 LYS C C 175.266 0.000 1 303 75 68 LYS CA C 55.768 0.000 1 304 75 68 LYS CB C 33.293 0.000 1 305 75 68 LYS N N 122.590 0.010 1 306 76 69 ASP H H 7.973 0.003 1 307 76 69 ASP CA C 55.769 0.023 1 308 76 69 ASP CB C 42.133 0.000 1 309 76 69 ASP N N 126.856 0.014 1 stop_ save_