data_26810 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone Chemical Shift Assignment of LIN54 residues 586 to 646. ; _BMRB_accession_number 26810 _BMRB_flat_file_name bmr26810.str _Entry_type original _Submission_date 2016-05-31 _Accession_date 2016-05-31 _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 Marceau Aimee H. . 2 Lee Hsiau-Wei . . 3 Rubin Seth M. . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 65 "13C chemical shifts" 176 "15N chemical shifts" 62 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2016-08-31 original BMRB . stop_ _Original_release_date 2016-08-31 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Structural basis for LIN54 recognition of CHR elements in cell cycle-regulated promoters ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 27465258 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Marceau Aimee H. . 2 Felthousen Jessica G. . 3 Goetsch Paul D. . 4 Iness Audra N. . 5 Lee Hsiau-Wei . . 6 Tripathi Sarvind M. . 7 Strome Susan . . 8 Litovchick Larisa . . 9 Rubin Seth M. . stop_ _Journal_abbreviation 'Nat. Comm.' _Journal_volume 7 _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 12301 _Page_last 12301 _Year 2016 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name LIN54 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label LIN54 $LIN54 'ZINC ION, 1' $entity_ZN 'ZINC ION, 2' $entity_ZN 'ZINC ION, 3' $entity_ZN 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_LIN54 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common LIN54 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 61 _Mol_residue_sequence ; GEFGESDRRHSKGCNCKRSG CLKNYCECYEAKIMCSSICK CIGCKNFEESPERKTLMHLA D ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 586 GLY 2 587 GLU 3 588 PHE 4 589 GLY 5 590 GLU 6 591 SER 7 592 ASP 8 593 ARG 9 594 ARG 10 595 HIS 11 596 SER 12 597 LYS 13 598 GLY 14 599 CYS 15 600 ASN 16 601 CYS 17 602 LYS 18 603 ARG 19 604 SER 20 605 GLY 21 606 CYS 22 607 LEU 23 608 LYS 24 609 ASN 25 610 TYR 26 611 CYS 27 612 GLU 28 613 CYS 29 614 TYR 30 615 GLU 31 616 ALA 32 617 LYS 33 618 ILE 34 619 MET 35 620 CYS 36 621 SER 37 622 SER 38 623 ILE 39 624 CYS 40 625 LYS 41 626 CYS 42 627 ILE 43 628 GLY 44 629 CYS 45 630 LYS 46 631 ASN 47 632 PHE 48 633 GLU 49 634 GLU 50 635 SER 51 636 PRO 52 637 GLU 53 638 ARG 54 639 LYS 55 640 THR 56 641 LEU 57 642 MET 58 643 HIS 59 644 LEU 60 645 ALA 61 646 ASP stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . save_ ############# # Ligands # ############# save_ZN _Saveframe_category ligand _Mol_type "non-polymer (NON-POLYMER)" _Name_common 'ZINC ION' _BMRB_code ZN _PDB_code ZN _Molecular_mass 65.409 _Mol_charge 2 _Mol_paramagnetic . _Mol_aromatic no _Details . loop_ _Atom_name _PDB_atom_name _Atom_type _Atom_chirality _Atom_charge _Atom_oxidation_number _Atom_unpaired_electrons ZN ZN ZN . 2 . ? stop_ _Mol_thiol_state . _Sequence_homology_query_date . save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $LIN54 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 $LIN54 'recombinant technology' . Escherichia coli BL21 pGEV 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 $LIN54 0.4 mM '[U-100% 13C; U-100% 15N]' MES 35 mM 'natural abundance' 'sodium chloride' 75 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_VNMRJ _Saveframe_category software _Name VNMRJ _Version . loop_ _Vendor _Address _Electronic_address Varian . . stop_ loop_ _Task collection stop_ _Details . save_ save_NMRPipe _Saveframe_category software _Name NMRPipe _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task processing stop_ _Details . save_ save_SPARKY _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details 'With a 5 mm Cold Probe' 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_HNCO_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _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' 75 . mM pH 6 . pH pressure 1 . atm temperature 293 . 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 na indirect . . . 0.251 DSS H 1 'methyl protons' ppm 0 internal direct . . . 1 DSS N 15 'methyl protons' ppm 0 na indirect . . . 0.101 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 HNCO' 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 LIN54 _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 1 586 1 GLY C C 170.170 0.000 . 2 586 1 GLY CA C 43.325 0.040 . 3 587 2 GLU H H 8.640 0.003 . 4 587 2 GLU C C 176.243 0.000 . 5 587 2 GLU CA C 56.565 0.022 . 6 587 2 GLU CB C 30.457 0.047 . 7 587 2 GLU N N 120.606 0.012 . 8 588 3 PHE H H 8.510 0.001 . 9 588 3 PHE C C 176.353 0.000 . 10 588 3 PHE CA C 57.831 0.023 . 11 588 3 PHE CB C 39.395 0.038 . 12 588 3 PHE N N 120.734 0.011 . 13 589 4 GLY H H 8.377 0.001 . 14 589 4 GLY C C 174.317 0.000 . 15 589 4 GLY CA C 45.278 0.035 . 16 589 4 GLY N N 110.884 0.014 . 17 590 5 GLU H H 8.318 0.001 . 18 590 5 GLU C C 177.032 0.000 . 19 590 5 GLU CA C 56.973 0.019 . 20 590 5 GLU CB C 30.164 0.047 . 21 590 5 GLU N N 120.856 0.013 . 22 591 6 SER H H 8.396 0.001 . 23 591 6 SER C C 174.434 0.000 . 24 591 6 SER CA C 58.861 0.006 . 25 591 6 SER CB C 63.632 0.023 . 26 591 6 SER N N 116.164 0.013 . 27 592 7 ASP H H 8.252 0.001 . 28 592 7 ASP C C 176.424 0.000 . 29 592 7 ASP CA C 54.432 0.038 . 30 592 7 ASP CB C 41.123 0.043 . 31 592 7 ASP N N 121.989 0.011 . 32 593 8 ARG H H 8.184 0.001 . 33 593 8 ARG C C 176.532 0.000 . 34 593 8 ARG CA C 56.330 0.036 . 35 593 8 ARG CB C 30.367 0.055 . 36 593 8 ARG N N 121.219 0.028 . 37 594 9 ARG H H 8.208 0.001 . 38 594 9 ARG C C 176.241 0.000 . 39 594 9 ARG CA C 56.447 0.030 . 40 594 9 ARG CB C 30.469 0.022 . 41 594 9 ARG N N 120.693 0.015 . 42 595 10 HIS H H 8.370 0.001 . 43 595 10 HIS C C 174.430 0.000 . 44 595 10 HIS CA C 55.400 0.033 . 45 595 10 HIS CB C 29.468 0.056 . 46 595 10 HIS N N 118.972 0.012 . 47 596 11 SER H H 8.217 0.001 . 48 596 11 SER C C 174.008 0.000 . 49 596 11 SER CA C 58.190 0.003 . 50 596 11 SER CB C 63.937 0.025 . 51 596 11 SER N N 116.718 0.012 . 52 597 12 LYS H H 8.324 0.000 . 53 597 12 LYS C C 176.000 0.000 . 54 597 12 LYS CA C 56.078 0.025 . 55 597 12 LYS CB C 33.546 0.053 . 56 597 12 LYS N N 122.553 0.011 . 57 598 13 GLY H H 8.132 0.000 . 58 598 13 GLY C C 172.564 0.000 . 59 598 13 GLY CA C 45.268 0.039 . 60 598 13 GLY N N 109.877 0.015 . 61 599 14 CYS H H 8.466 0.000 . 62 599 14 CYS C C 174.185 0.000 . 63 599 14 CYS CA C 57.047 0.026 . 64 599 14 CYS CB C 34.830 0.050 . 65 599 14 CYS N N 121.708 0.013 . 66 600 15 ASN H H 9.154 0.001 . 67 600 15 ASN HD21 H 7.588 0.000 . 68 600 15 ASN HD22 H 6.729 0.000 . 69 600 15 ASN C C 175.354 0.000 . 70 600 15 ASN CA C 52.436 0.029 . 71 600 15 ASN CB C 39.798 0.050 . 72 600 15 ASN N N 117.843 0.012 . 73 600 15 ASN ND2 N 112.311 0.118 . 74 601 16 CYS H H 7.527 0.001 . 75 601 16 CYS C C 175.359 0.000 . 76 601 16 CYS CA C 60.879 0.014 . 77 601 16 CYS CB C 32.412 0.054 . 78 601 16 CYS N N 120.209 0.013 . 79 602 17 LYS H H 8.829 0.001 . 80 602 17 LYS C C 175.772 0.000 . 81 602 17 LYS CA C 55.094 0.058 . 82 602 17 LYS CB C 32.452 0.048 . 83 602 17 LYS N N 122.560 0.013 . 84 603 18 ARG H H 7.963 0.001 . 85 603 18 ARG C C 175.505 0.000 . 86 603 18 ARG CA C 57.064 0.016 . 87 603 18 ARG CB C 29.735 0.049 . 88 603 18 ARG N N 116.586 0.068 . 89 604 19 SER H H 7.991 0.001 . 90 604 19 SER C C 176.329 0.000 . 91 604 19 SER CA C 59.185 0.007 . 92 604 19 SER CB C 63.633 0.016 . 93 604 19 SER N N 111.455 0.013 . 94 605 20 GLY H H 9.023 0.001 . 95 605 20 GLY C C 173.722 0.000 . 96 605 20 GLY CA C 46.488 0.030 . 97 605 20 GLY N N 113.797 0.014 . 98 606 21 CYS H H 8.272 0.001 . 99 606 21 CYS C C 171.559 0.000 . 100 606 21 CYS CA C 60.959 0.008 . 101 606 21 CYS CB C 30.677 0.044 . 102 606 21 CYS N N 111.056 0.018 . 103 607 22 LEU H H 6.859 0.001 . 104 607 22 LEU C C 175.437 0.000 . 105 607 22 LEU CA C 52.110 0.031 . 106 607 22 LEU CB C 41.825 0.047 . 107 607 22 LEU N N 112.954 0.012 . 108 608 23 LYS H H 6.346 0.001 . 109 608 23 LYS C C 176.311 0.000 . 110 608 23 LYS CA C 53.584 0.029 . 111 608 23 LYS CB C 36.748 0.050 . 112 608 23 LYS N N 113.440 0.012 . 113 609 24 ASN H H 8.593 0.001 . 114 609 24 ASN HD21 H 7.524 0.000 . 115 609 24 ASN HD22 H 6.770 0.000 . 116 609 24 ASN C C 174.000 0.000 . 117 609 24 ASN CA C 55.450 0.051 . 118 609 24 ASN CB C 37.432 0.016 . 119 609 24 ASN N N 117.623 0.014 . 120 609 24 ASN ND2 N 110.466 0.125 . 121 610 25 TYR H H 6.600 0.001 . 122 610 25 TYR C C 175.192 0.000 . 123 610 25 TYR CA C 57.903 0.021 . 124 610 25 TYR CB C 37.404 0.055 . 125 610 25 TYR N N 114.361 0.014 . 126 611 26 CYS H H 7.970 0.001 . 127 611 26 CYS C C 175.236 0.000 . 128 611 26 CYS CA C 59.817 0.001 . 129 611 26 CYS CB C 30.643 0.045 . 130 611 26 CYS N N 123.090 0.014 . 131 612 27 GLU H H 9.906 0.002 . 132 612 27 GLU C C 178.830 0.000 . 133 612 27 GLU CA C 60.781 0.021 . 134 612 27 GLU CB C 29.553 0.062 . 135 612 27 GLU N N 130.419 0.007 . 136 613 28 CYS H H 8.484 0.001 . 137 613 28 CYS C C 176.072 0.000 . 138 613 28 CYS CA C 62.543 0.022 . 139 613 28 CYS CB C 29.149 0.072 . 140 613 28 CYS N N 124.837 0.011 . 141 614 29 TYR H H 8.054 0.000 . 142 614 29 TYR C C 181.252 0.000 . 143 614 29 TYR CA C 62.398 0.038 . 144 614 29 TYR CB C 37.715 0.041 . 145 614 29 TYR N N 124.420 0.012 . 146 615 30 GLU H H 9.097 0.001 . 147 615 30 GLU C C 177.206 0.000 . 148 615 30 GLU CA C 59.371 0.013 . 149 615 30 GLU CB C 29.242 0.049 . 150 615 30 GLU N N 120.517 0.010 . 151 616 31 ALA H H 7.152 0.000 . 152 616 31 ALA C C 175.454 0.000 . 153 616 31 ALA CA C 51.873 0.008 . 154 616 31 ALA CB C 18.779 0.054 . 155 616 31 ALA N N 119.572 0.013 . 156 617 32 LYS H H 7.893 0.001 . 157 617 32 LYS C C 175.858 0.000 . 158 617 32 LYS CA C 56.305 0.025 . 159 617 32 LYS CB C 28.455 0.042 . 160 617 32 LYS N N 114.376 0.013 . 161 618 33 ILE H H 7.799 0.001 . 162 618 33 ILE C C 175.563 0.000 . 163 618 33 ILE CA C 59.190 0.026 . 164 618 33 ILE CB C 41.648 0.030 . 165 618 33 ILE N N 113.645 0.014 . 166 619 34 MET H H 8.153 0.001 . 167 619 34 MET C C 178.431 0.000 . 168 619 34 MET CA C 54.939 0.043 . 169 619 34 MET CB C 33.814 0.110 . 170 619 34 MET N N 119.444 0.013 . 171 620 35 CYS H H 8.103 0.000 . 172 620 35 CYS C C 174.209 0.000 . 173 620 35 CYS CA C 61.458 0.022 . 174 620 35 CYS CB C 33.686 0.055 . 175 620 35 CYS N N 120.945 0.014 . 176 621 36 SER H H 9.388 0.001 . 177 621 36 SER C C 176.222 0.000 . 178 621 36 SER CA C 57.795 0.009 . 179 621 36 SER CB C 66.904 0.020 . 180 621 36 SER N N 119.467 0.010 . 181 622 37 SER H H 8.820 0.001 . 182 622 37 SER C C 174.854 0.000 . 183 622 37 SER CA C 61.035 0.052 . 184 622 37 SER CB C 62.840 0.010 . 185 622 37 SER N N 115.822 0.014 . 186 623 38 ILE H H 7.345 0.001 . 187 623 38 ILE C C 177.188 0.000 . 188 623 38 ILE CA C 61.491 0.018 . 189 623 38 ILE CB C 38.222 0.036 . 190 623 38 ILE N N 114.973 0.013 . 191 624 39 CYS H H 7.807 0.001 . 192 624 39 CYS C C 176.075 0.000 . 193 624 39 CYS CA C 62.828 0.027 . 194 624 39 CYS CB C 32.085 0.053 . 195 624 39 CYS N N 123.747 0.011 . 196 625 40 LYS H H 8.728 0.001 . 197 625 40 LYS C C 175.578 0.000 . 198 625 40 LYS CA C 54.302 0.033 . 199 625 40 LYS CB C 31.861 0.083 . 200 625 40 LYS N N 122.462 0.011 . 201 626 41 CYS H H 7.456 0.000 . 202 626 41 CYS C C 174.992 0.000 . 203 626 41 CYS CA C 55.191 0.036 . 204 626 41 CYS CB C 33.851 0.054 . 205 626 41 CYS N N 119.301 0.012 . 206 627 42 ILE H H 8.050 0.001 . 207 627 42 ILE C C 177.067 0.000 . 208 627 42 ILE CA C 59.504 0.022 . 209 627 42 ILE CB C 41.343 0.032 . 210 627 42 ILE N N 116.697 0.013 . 211 628 43 GLY H H 8.963 0.001 . 212 628 43 GLY C C 174.088 0.000 . 213 628 43 GLY CA C 46.391 0.038 . 214 628 43 GLY N N 117.760 0.010 . 215 629 44 CYS H H 7.926 0.001 . 216 629 44 CYS C C 177.702 0.000 . 217 629 44 CYS CA C 63.207 0.030 . 218 629 44 CYS CB C 33.421 0.058 . 219 629 44 CYS N N 120.838 0.015 . 220 630 45 LYS H H 8.708 0.001 . 221 630 45 LYS C C 175.683 0.000 . 222 630 45 LYS CA C 55.420 0.035 . 223 630 45 LYS CB C 33.665 0.045 . 224 630 45 LYS N N 126.191 0.011 . 225 631 46 ASN H H 10.204 0.001 . 226 631 46 ASN HD21 H 7.394 0.001 . 227 631 46 ASN HD22 H 7.015 0.000 . 228 631 46 ASN C C 172.487 0.000 . 229 631 46 ASN CA C 52.132 0.042 . 230 631 46 ASN CB C 39.551 0.046 . 231 631 46 ASN N N 129.684 0.009 . 232 631 46 ASN ND2 N 109.924 0.158 . 233 632 47 PHE H H 6.834 0.001 . 234 632 47 PHE C C 176.228 0.000 . 235 632 47 PHE CA C 55.516 0.042 . 236 632 47 PHE CB C 40.880 0.043 . 237 632 47 PHE N N 114.082 0.022 . 238 633 48 GLU H H 8.961 0.001 . 239 633 48 GLU C C 177.579 0.000 . 240 633 48 GLU CA C 59.653 0.009 . 241 633 48 GLU CB C 30.026 0.044 . 242 633 48 GLU N N 123.758 0.011 . 243 634 49 GLU H H 8.763 0.001 . 244 634 49 GLU C C 175.546 0.000 . 245 634 49 GLU CA C 56.343 0.026 . 246 634 49 GLU CB C 28.794 0.047 . 247 634 49 GLU N N 117.935 0.017 . 248 635 50 SER H H 7.135 0.001 . 249 635 50 SER CA C 54.492 0.000 . 250 635 50 SER CB C 63.958 0.000 . 251 635 50 SER N N 116.787 0.013 . 252 636 51 PRO C C 178.960 0.000 . 253 636 51 PRO CA C 64.974 0.036 . 254 636 51 PRO CB C 32.023 0.051 . 255 637 52 GLU H H 8.646 0.000 . 256 637 52 GLU C C 178.258 0.000 . 257 637 52 GLU CA C 59.471 0.014 . 258 637 52 GLU CB C 29.700 0.044 . 259 637 52 GLU N N 118.001 0.012 . 260 638 53 ARG H H 7.532 0.001 . 261 638 53 ARG C C 177.922 0.000 . 262 638 53 ARG CA C 58.534 0.026 . 263 638 53 ARG CB C 30.132 0.036 . 264 638 53 ARG N N 119.941 0.015 . 265 639 54 LYS H H 7.960 0.001 . 266 639 54 LYS C C 178.669 0.000 . 267 639 54 LYS CA C 59.427 0.018 . 268 639 54 LYS CB C 32.524 0.044 . 269 639 54 LYS N N 118.791 0.014 . 270 640 55 THR H H 8.088 0.001 . 271 640 55 THR C C 175.914 0.000 . 272 640 55 THR CA C 64.854 0.017 . 273 640 55 THR CB C 69.153 0.002 . 274 640 55 THR N N 114.587 0.013 . 275 641 56 LEU H H 7.610 0.001 . 276 641 56 LEU C C 178.129 0.000 . 277 641 56 LEU CA C 56.537 0.042 . 278 641 56 LEU CB C 42.327 0.049 . 279 641 56 LEU N N 122.343 0.015 . 280 642 57 MET H H 7.878 0.000 . 281 642 57 MET C C 176.124 0.000 . 282 642 57 MET CA C 55.972 0.072 . 283 642 57 MET CB C 32.605 0.114 . 284 642 57 MET N N 117.501 0.013 . 285 643 58 HIS H H 7.989 0.001 . 286 643 58 HIS C C 174.428 0.000 . 287 643 58 HIS CA C 55.774 0.051 . 288 643 58 HIS CB C 28.285 0.049 . 289 643 58 HIS N N 117.409 0.016 . 290 644 59 LEU H H 8.097 0.001 . 291 644 59 LEU C C 176.816 0.000 . 292 644 59 LEU CA C 55.327 0.074 . 293 644 59 LEU CB C 42.431 0.045 . 294 644 59 LEU N N 122.313 0.013 . 295 645 60 ALA H H 8.142 0.001 . 296 645 60 ALA C C 176.290 0.000 . 297 645 60 ALA CA C 52.123 0.012 . 298 645 60 ALA CB C 19.598 0.055 . 299 645 60 ALA N N 124.250 0.009 . 300 646 61 ASP H H 7.807 0.000 . 301 646 61 ASP CA C 55.927 0.000 . 302 646 61 ASP CB C 42.008 0.000 . 303 646 61 ASP N N 125.201 0.009 . stop_ save_