data_30663 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution NMR Structure Of The delta30-ngMinE Protein From Neisseria gonorrheae ; _BMRB_accession_number 30663 _BMRB_flat_file_name bmr30663.str _Entry_type original _Submission_date 2019-08-30 _Accession_date 2019-08-30 _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 Cai M. . . 2 Shen Y. . . 3 Clore M. . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 51 "13C chemical shifts" 152 "15N chemical shifts" 51 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2020-07-05 original BMRB . stop_ _Original_release_date 2019-11-15 save_ ############################# # Citation for this entry # ############################# save_citation_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Solution NMR Structure Of The delta30-ngMinE Protein From Neisseria gonorrheae ; _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 Cai M. . . 2 Shen Y. . . 3 Clore M. . . stop_ _Journal_abbreviation . _Journal_volume . _Journal_issue . _Journal_CSD 0353 _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 'Cell division topological specificity factor' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'entity_1, 1' $entity_1 'entity_1, 2' $entity_1 stop_ _System_molecular_weight . _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 7637.639 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 65 _Mol_residue_sequence ; AQEGQTPDYLPTLRKELMEV LSKYVNVSLDNIRISQEKQD GMDVLELNITLPEQKKVLEH HHHHH ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 31 ALA 2 32 GLN 3 33 GLU 4 34 GLY 5 35 GLN 6 36 THR 7 37 PRO 8 38 ASP 9 39 TYR 10 40 LEU 11 41 PRO 12 42 THR 13 43 LEU 14 44 ARG 15 45 LYS 16 46 GLU 17 47 LEU 18 48 MET 19 49 GLU 20 50 VAL 21 51 LEU 22 52 SER 23 53 LYS 24 54 TYR 25 55 VAL 26 56 ASN 27 57 VAL 28 58 SER 29 59 LEU 30 60 ASP 31 61 ASN 32 62 ILE 33 63 ARG 34 64 ILE 35 65 SER 36 66 GLN 37 67 GLU 38 68 LYS 39 69 GLN 40 70 ASP 41 71 GLY 42 72 MET 43 73 ASP 44 74 VAL 45 75 LEU 46 76 GLU 47 77 LEU 48 78 ASN 49 79 ILE 50 80 THR 51 81 LEU 52 82 PRO 53 83 GLU 54 84 GLN 55 85 LYS 56 86 LYS 57 87 VAL 58 88 LEU 59 89 GLU 60 90 HIS 61 91 HIS 62 92 HIS 63 93 HIS 64 94 HIS 65 95 HIS 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 _Gene_mnemonic $entity_1 'Neisseria gonorrhoeae' 485 Bacteria . Neisseria gonorrhoeae minE stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $entity_1 'recombinant technology' . Escherichia coli . . stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details '1.0 mM U-13C/15N MinE-d30, 95% H2O/5% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 1.0 mM '[U-13C; U-15N]' 'potassium phosphate' 25 mM 'natural abundance' EDTA 0.5 mM 'natural abundance' 'benzamidine chloride' 0.1 mM 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details '1 mM U-2H/15N MinE-d30-RDC, 1 mM U-2H/15N MinE-d30-CPMG, 90% H2O/10% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 1 mM '[U-2H; U-15N]' $entity_1 1 mM '[U-2H; U-15N]' stop_ save_ save_sample_3 _Saveframe_category sample _Sample_type solution _Details '1 mM U-13C/15N MinE-d30-I24N, 95% H2O/5% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 1 mM '[U-13C; U-15N]' 'potassium phosphate' 25 mM 'natural abundance' EDTA 0.5 mM 'natural abundance' 'benzamidine chloride' 0.1 mM 'natural abundance' stop_ save_ save_sample_4 _Saveframe_category sample _Sample_type solution _Details '1 mM 2H/15N MinE-d30-I24N-RDC, 1 mM 2H/15N MinE-d30-I24N-CPMG, 90% H2O/10% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $entity_1 1 mM '[U-2H; U-15N]' $entity_1 1 mM '[U-2H; U-15N]' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name PIPP _Version . loop_ _Vendor _Address _Electronic_address Garrett . . stop_ loop_ _Task 'chemical shift assignment' 'peak picking' stop_ _Details . save_ save_software_2 _Saveframe_category software _Name CS-ROSETTA _Version . loop_ _Vendor _Address _Electronic_address 'Shen, Vernon, Baker and Bax' . . stop_ loop_ _Task refinement 'structure calculation' stop_ _Details . save_ save_software_3 _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_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model AVANCE _Field_strength 500 _Details . save_ save_NMR_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model AVANCE _Field_strength 600 _Details . save_ save_NMR_spectrometer_3 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model AVANCE _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_CBCA(CO)NH_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCACB_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _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_HBHA(CBCACO)NH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CBCACO)NH' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_3 save_ save_3D_HBHA(CBCACO)NH_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HBHA(CBCACO)NH' _Sample_label $sample_3 save_ save_3D_HNCO_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_3 save_ save_3D_HNCACB_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_3 save_ save_HSQC_IPAP_9 _Saveframe_category NMR_applied_experiment _Experiment_name 'HSQC IPAP' _Sample_label $sample_2 save_ save_HSQC_IPAP_10 _Saveframe_category NMR_applied_experiment _Experiment_name 'HSQC IPAP' _Sample_label $sample_2 save_ save_HSQC_IPAP_11 _Saveframe_category NMR_applied_experiment _Experiment_name 'HSQC IPAP' _Sample_label $sample_4 save_ save_HSQC_IPAP_12 _Saveframe_category NMR_applied_experiment _Experiment_name 'HSQC IPAP' _Sample_label $sample_4 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' 25 . mM pH 6.5 . pH pressure 1 . bar temperature 298 . K stop_ save_ save_sample_conditions_2 _Saveframe_category sample_conditions _Details . loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 200 . mM pH 6.5 . pH pressure 1 . bar 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 0.000 internal indirect . . . 0.25144953 DSS H 1 'methyl protons' ppm 0.000 internal direct . . . 1.0 DSS N 15 'methyl protons' ppm 0.000 internal indirect . . . 0.10132912 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_ _Experiment_label '3D CBCA(CO)NH' '3D HNCACB' '3D HNCO' '3D HBHA(CBCACO)NH' 'HSQC IPAP' stop_ loop_ _Sample_label $sample_1 $sample_3 $sample_2 $sample_4 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name 'entity_1, 1' _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 31 1 ALA H H 8.279 . . 2 31 1 ALA C C 177.908 . . 3 31 1 ALA CA C 52.803 . . 4 31 1 ALA CB C 19.093 . . 5 31 1 ALA N N 124.990 . . 6 32 2 GLN H H 8.247 . . 7 32 2 GLN C C 176.212 . . 8 32 2 GLN CA C 56.199 . . 9 32 2 GLN CB C 29.456 . . 10 32 2 GLN N N 119.514 . . 11 33 3 GLU H H 8.423 . . 12 33 3 GLU C C 177.049 . . 13 33 3 GLU CA C 56.998 . . 14 33 3 GLU CB C 30.230 . . 15 33 3 GLU N N 122.144 . . 16 34 4 GLY H H 8.484 . . 17 34 4 GLY C C 174.006 . . 18 34 4 GLY CA C 45.287 . . 19 34 4 GLY N N 110.067 . . 20 35 5 GLN H H 8.213 . . 21 35 5 GLN C C 176.011 . . 22 35 5 GLN CA C 55.653 . . 23 35 5 GLN CB C 29.677 . . 24 35 5 GLN N N 119.549 . . 25 36 6 THR H H 8.308 . . 26 36 6 THR CA C 59.870 . . 27 36 6 THR CB C 69.626 . . 28 36 6 THR N N 117.822 . . 29 37 7 PRO C C 177.090 . . 30 37 7 PRO CA C 63.267 . . 31 37 7 PRO CB C 32.149 . . 32 38 8 ASP H H 8.506 . . 33 38 8 ASP C C 176.683 . . 34 38 8 ASP CA C 54.652 . . 35 38 8 ASP CB C 40.795 . . 36 38 8 ASP N N 121.089 . . 37 39 9 TYR H H 7.566 . . 38 39 9 TYR C C 176.593 . . 39 39 9 TYR CA C 57.980 . . 40 39 9 TYR CB C 38.576 . . 41 39 9 TYR N N 118.901 . . 42 40 10 LEU H H 8.011 . . 43 40 10 LEU CA C 59.297 . . 44 40 10 LEU CB C 38.857 . . 45 40 10 LEU N N 123.098 . . 46 41 11 PRO C C 179.736 . . 47 41 11 PRO CA C 66.409 . . 48 41 11 PRO CB C 31.139 . . 49 42 12 THR H H 7.434 . . 50 42 12 THR C C 176.239 . . 51 42 12 THR CA C 66.100 . . 52 42 12 THR CB C 68.533 . . 53 42 12 THR N N 113.916 . . 54 43 13 LEU H H 8.111 . . 55 43 13 LEU C C 177.846 . . 56 43 13 LEU CA C 57.845 . . 57 43 13 LEU CB C 41.624 . . 58 43 13 LEU N N 124.098 . . 59 44 14 ARG H H 8.598 . . 60 44 14 ARG C C 177.536 . . 61 44 14 ARG CA C 61.054 . . 62 44 14 ARG CB C 30.629 . . 63 44 14 ARG N N 118.140 . . 64 45 15 LYS H H 7.441 . . 65 45 15 LYS C C 178.439 . . 66 45 15 LYS CA C 59.635 . . 67 45 15 LYS CB C 32.501 . . 68 45 15 LYS N N 117.418 . . 69 46 16 GLU H H 7.964 . . 70 46 16 GLU C C 181.079 . . 71 46 16 GLU CA C 55.007 . . 72 46 16 GLU CB C 18.415 . . 73 46 16 GLU N N 122.170 . . 74 47 17 LEU H H 8.502 . . 75 47 17 LEU C C 178.643 . . 76 47 17 LEU CA C 57.593 . . 77 47 17 LEU CB C 41.969 . . 78 47 17 LEU N N 117.429 . . 79 48 18 MET H H 8.116 . . 80 48 18 MET C C 178.350 . . 81 48 18 MET CA C 59.221 . . 82 48 18 MET CB C 32.171 . . 83 48 18 MET N N 118.312 . . 84 49 19 GLU H H 8.058 . . 85 49 19 GLU C C 179.230 . . 86 49 19 GLU CA C 59.630 . . 87 49 19 GLU CB C 29.466 . . 88 49 19 GLU N N 119.338 . . 89 50 20 VAL H H 7.565 . . 90 50 20 VAL CA C 65.969 . . 91 50 20 VAL CB C 31.880 . . 92 50 20 VAL N N 118.225 . . 93 51 21 LEU H H 8.330 . . 94 51 21 LEU C C 178.749 . . 95 51 21 LEU CA C 58.426 . . 96 51 21 LEU CB C 42.264 . . 97 51 21 LEU N N 118.951 . . 98 52 22 SER H H 8.215 . . 99 52 22 SER C C 175.585 . . 100 52 22 SER CA C 61.169 . . 101 52 22 SER CB C 63.353 . . 102 52 22 SER N N 112.199 . . 103 53 23 LYS H H 7.325 . . 104 53 23 LYS C C 177.050 . . 105 53 23 LYS CA C 57.876 . . 106 53 23 LYS CB C 32.193 . . 107 53 23 LYS N N 119.417 . . 108 54 24 TYR H H 8.053 . . 109 54 24 TYR C C 175.804 . . 110 54 24 TYR CA C 60.013 . . 111 54 24 TYR CB C 41.322 . . 112 54 24 TYR N N 115.914 . . 113 55 25 VAL H H 8.249 . . 114 55 25 VAL CA C 60.229 . . 115 55 25 VAL CB C 34.288 . . 116 55 25 VAL N N 114.119 . . 117 56 26 ASN H H 8.143 . . 118 56 26 ASN C C 174.280 . . 119 56 26 ASN CA C 53.413 . . 120 56 26 ASN CB C 37.627 . . 121 56 26 ASN N N 119.649 . . 122 57 27 VAL H H 7.754 . . 123 57 27 VAL C C 174.253 . . 124 57 27 VAL CA C 59.616 . . 125 57 27 VAL CB C 35.118 . . 126 57 27 VAL N N 116.218 . . 127 58 28 SER H H 8.530 . . 128 58 28 SER C C 175.613 . . 129 58 28 SER CA C 57.145 . . 130 58 28 SER CB C 65.115 . . 131 58 28 SER N N 118.173 . . 132 59 29 LEU H H 8.675 . . 133 59 29 LEU C C 178.486 . . 134 59 29 LEU CA C 57.848 . . 135 59 29 LEU CB C 41.761 . . 136 59 29 LEU N N 123.443 . . 137 60 30 ASP H H 8.114 . . 138 60 30 ASP C C 176.625 . . 139 60 30 ASP CA C 55.740 . . 140 60 30 ASP CB C 40.442 . . 141 60 30 ASP N N 114.900 . . 142 61 31 ASN H H 7.894 . . 143 61 31 ASN C C 173.704 . . 144 61 31 ASN CA C 54.328 . . 145 61 31 ASN CB C 39.678 . . 146 61 31 ASN N N 116.069 . . 147 62 32 ILE H H 7.613 . . 148 62 32 ILE C C 174.027 . . 149 62 32 ILE CA C 61.201 . . 150 62 32 ILE CB C 39.373 . . 151 62 32 ILE N N 119.528 . . 152 63 33 ARG H H 8.773 . . 153 63 33 ARG C C 175.055 . . 154 63 33 ARG CA C 55.606 . . 155 63 33 ARG CB C 32.202 . . 156 63 33 ARG N N 128.122 . . 157 64 34 ILE H H 8.615 . . 158 64 34 ILE C C 174.486 . . 159 64 34 ILE CA C 60.005 . . 160 64 34 ILE CB C 40.989 . . 161 64 34 ILE N N 123.617 . . 162 65 35 SER H H 9.120 . . 163 65 35 SER C C 172.144 . . 164 65 35 SER CA C 57.174 . . 165 65 35 SER CB C 65.360 . . 166 65 35 SER N N 122.187 . . 167 66 36 GLN H H 8.591 . . 168 66 36 GLN C C 174.642 . . 169 66 36 GLN CA C 55.082 . . 170 66 36 GLN CB C 31.385 . . 171 66 36 GLN N N 123.239 . . 172 67 37 GLU H H 8.871 . . 173 67 37 GLU C C 175.041 . . 174 67 37 GLU CA C 54.501 . . 175 67 37 GLU CB C 33.582 . . 176 67 37 GLU N N 124.056 . . 177 68 38 LYS H H 8.720 . . 178 68 38 LYS C C 176.603 . . 179 68 38 LYS CA C 55.096 . . 180 68 38 LYS CB C 34.184 . . 181 68 38 LYS N N 123.053 . . 182 69 39 GLN H H 8.891 . . 183 69 39 GLN C C 175.379 . . 184 69 39 GLN CA C 54.980 . . 185 69 39 GLN CB C 31.089 . . 186 69 39 GLN N N 123.730 . . 187 70 40 ASP H H 9.269 . . 188 70 40 ASP C C 175.714 . . 189 70 40 ASP CA C 55.500 . . 190 70 40 ASP CB C 40.028 . . 191 70 40 ASP N N 126.215 . . 192 71 41 GLY H H 8.567 . . 193 71 41 GLY C C 173.817 . . 194 71 41 GLY CA C 45.518 . . 195 71 41 GLY N N 104.657 . . 196 72 42 MET H H 7.912 . . 197 72 42 MET C C 174.990 . . 198 72 42 MET CA C 53.943 . . 199 72 42 MET CB C 34.444 . . 200 72 42 MET N N 119.654 . . 201 73 43 ASP H H 8.842 . . 202 73 43 ASP C C 174.518 . . 203 73 43 ASP CA C 55.270 . . 204 73 43 ASP CB C 42.709 . . 205 73 43 ASP N N 122.534 . . 206 74 44 VAL H H 8.716 . . 207 74 44 VAL C C 175.241 . . 208 74 44 VAL CA C 60.646 . . 209 74 44 VAL CB C 35.249 . . 210 74 44 VAL N N 121.272 . . 211 75 45 LEU H H 9.190 . . 212 75 45 LEU C C 174.642 . . 213 75 45 LEU CA C 53.594 . . 214 75 45 LEU CB C 44.731 . . 215 75 45 LEU N N 127.040 . . 216 76 46 GLU H H 8.961 . . 217 76 46 GLU CA C 54.564 . . 218 76 46 GLU CB C 31.740 . . 219 76 46 GLU N N 124.877 . . 220 77 47 LEU H H 9.142 . . 221 77 47 LEU C C 174.668 . . 222 77 47 LEU CA C 54.207 . . 223 77 47 LEU CB C 44.705 . . 224 77 47 LEU N N 125.030 . . 225 78 48 ASN H H 9.015 . . 226 78 48 ASN C C 173.900 . . 227 78 48 ASN CA C 52.740 . . 228 78 48 ASN CB C 42.428 . . 229 78 48 ASN N N 122.704 . . 230 79 49 ILE H H 9.236 . . 231 79 49 ILE CA C 59.901 . . 232 79 49 ILE CB C 41.703 . . 233 79 49 ILE N N 125.703 . . 234 80 50 THR H H 8.639 . . 235 80 50 THR CA C 62.392 . . 236 80 50 THR CB C 69.739 . . 237 80 50 THR N N 123.376 . . 238 81 51 LEU H H 8.681 . . 239 81 51 LEU CA C 52.290 . . 240 81 51 LEU CB C 41.639 . . 241 81 51 LEU N N 126.353 . . 242 82 52 PRO C C 176.505 . . 243 82 52 PRO CA C 62.766 . . 244 82 52 PRO CB C 32.301 . . 245 83 53 GLU H H 8.417 . . 246 83 53 GLU C C 176.784 . . 247 83 53 GLU CA C 56.894 . . 248 83 53 GLU CB C 30.466 . . 249 83 53 GLU N N 121.410 . . 250 84 54 GLN H H 8.648 . . 251 84 54 GLN C C 175.911 . . 252 84 54 GLN CA C 55.834 . . 253 84 54 GLN CB C 29.652 . . 254 84 54 GLN N N 123.260 . . stop_ save_