data_27763 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; FoxM1 Transactivation Domain ; _BMRB_accession_number 27763 _BMRB_flat_file_name bmr27763.str _Entry_type original _Submission_date 2019-01-22 _Accession_date 2019-01-22 _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 Brison Caileen . . 3 Nerli Santrupti . . 4 Arsenault Heather E. . 5 McShane Andrew C. . 6 Chen Eefei . . 7 Lee Hsiau-Wei . . 8 Benanti Jennifer A. . 9 Sgourakis Nikolaos G. . 10 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" 50 "13C chemical shifts" 185 "15N chemical shifts" 49 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2019-06-13 original BMRB . stop_ loop_ _Related_BMRB_accession_number _Relationship 27764 'Phosphorylated FoxM1 TAD' stop_ _Original_release_date 2019-01-22 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; An order-to-disorder structural switch activates the FoxM1 transcription factor. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 31134895 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Marceau Aimee H. . 2 Brison Caileen . . 3 Nerli Santrupti . . 4 Arsenault Heather E. . 5 McShane Andrew C. . 6 Chen Eefei . . 7 Lee Hsiau-Wei . . 8 Benanti Jennifer A. . 9 Sgourakis Nikolaos G. . 10 Rubin Seth M. . stop_ _Journal_abbreviation Elife _Journal_name_full eLife _Journal_volume 8 _Journal_issue . _Journal_ISSN 2050-084X _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first e46131 _Page_last e46131 _Year 2019 _Details . save_ ################################## # Molecular system description # ################################## save_assembly_1 _Saveframe_category molecular_system _Mol_system_name 'FoxM1 TAD' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'FoxM1 TAD' $FoxM1_TAD 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_FoxM1_TAD _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common FoxM1_TAD _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 55 _Mol_residue_sequence ; GEFGAANRSLTEGFVLDTMN DSLSKILVDISFSGLEDEDL GMGNISWSQFIPELK ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 569 GLY 2 570 GLU 3 571 PHE 4 572 GLY 5 573 ALA 6 574 ALA 7 575 ASN 8 576 ARG 9 577 SER 10 578 LEU 11 579 THR 12 580 GLU 13 581 GLY 14 582 PHE 15 583 VAL 16 584 LEU 17 585 ASP 18 586 THR 19 587 MET 20 588 ASN 21 589 ASP 22 590 SER 23 591 LEU 24 592 SER 25 593 LYS 26 594 ILE 27 595 LEU 28 596 VAL 29 597 ASP 30 598 ILE 31 599 SER 32 600 PHE 33 601 SER 34 602 GLY 35 603 LEU 36 604 GLU 37 605 ASP 38 606 GLU 39 607 ASP 40 608 LEU 41 609 GLY 42 610 MET 43 611 GLY 44 612 ASN 45 613 ILE 46 614 SER 47 615 TRP 48 616 SER 49 617 GLN 50 618 PHE 51 619 ILE 52 620 PRO 53 621 GLU 54 622 LEU 55 623 LYS 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 $FoxM1_TAD zebrafish 7955 Eukaryota Metazoa Danio rerio 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 $FoxM1_TAD 'recombinant technology' . Escherichia coli . 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 $FoxM1_TAD 450 mM '[U-100% 13C; U-100% 15N]' D2O 10 % [U-2H] 'sodium chloride' 100 mM 'natural abundance' 'sodium phosphate' 10 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version . loop_ _Vendor _Address _Electronic_address 'Bruker Biospin' . . 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_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 800 _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_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_CBCA(CO)NH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_C(CO)NH_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $sample_1 save_ ####################### # Sample conditions # ####################### save_sample_conditions_1 _Saveframe_category sample_conditions _Details ; 20 mM Sodium Phosphate 100 mM Sodium Chloride ; loop_ _Variable_type _Variable_value _Variable_value_error _Variable_value_units 'ionic strength' 100 . mM pH 6.3 . 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 0.00 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_chemical_shifts_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCACB' '3D HNCO' '3D CBCA(CO)NH' '3D C(CO)NH' 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 'FoxM1 TAD' _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 1 570 2 GLU C C 176.237 0.000 . 2 570 2 GLU CA C 56.513 0.013 . 3 570 2 GLU CB C 30.528 0.000 . 4 570 2 GLU CG C 35.806 0.000 . 5 571 3 PHE H H 8.513 0.004 . 6 571 3 PHE C C 176.376 0.000 . 7 571 3 PHE CA C 58.033 0.019 . 8 571 3 PHE CB C 39.424 0.070 . 9 571 3 PHE N N 121.417 0.020 . 10 572 4 GLY H H 8.323 0.002 . 11 572 4 GLY C C 173.775 0.000 . 12 572 4 GLY CA C 45.298 0.022 . 13 572 4 GLY N N 111.136 0.023 . 14 573 5 ALA H H 8.056 0.001 . 15 573 5 ALA C C 177.476 0.000 . 16 573 5 ALA CA C 52.504 0.020 . 17 573 5 ALA CB C 19.392 0.077 . 18 573 5 ALA N N 123.853 0.008 . 19 574 6 ALA H H 8.268 0.001 . 20 574 6 ALA C C 177.434 0.000 . 21 574 6 ALA CA C 52.573 0.023 . 22 574 6 ALA CB C 19.235 0.082 . 23 574 6 ALA N N 122.706 0.015 . 24 575 7 ASN H H 8.302 0.001 . 25 575 7 ASN C C 174.071 0.000 . 26 575 7 ASN CA C 53.345 0.031 . 27 575 7 ASN CB C 38.875 0.060 . 28 575 7 ASN N N 117.815 0.011 . 29 576 8 ARG H H 7.814 0.000 . 30 576 8 ARG CA C 57.474 0.000 . 31 576 8 ARG CB C 31.586 0.000 . 32 576 8 ARG N N 125.827 0.012 . 33 578 10 LEU C C 177.452 0.000 . 34 578 10 LEU CA C 55.730 0.031 . 35 578 10 LEU CB C 42.413 0.045 . 36 578 10 LEU CG C 27.027 0.000 . 37 578 10 LEU CD1 C 24.805 0.000 . 38 578 10 LEU CD2 C 23.561 0.000 . 39 579 11 THR H H 8.153 0.001 . 40 579 11 THR C C 174.416 0.000 . 41 579 11 THR CA C 61.929 0.044 . 42 579 11 THR CB C 69.708 0.054 . 43 579 11 THR CG2 C 21.502 0.000 . 44 579 11 THR N N 114.482 0.006 . 45 580 12 GLU H H 8.284 0.003 . 46 580 12 GLU C C 176.596 0.000 . 47 580 12 GLU CA C 56.819 0.009 . 48 580 12 GLU CB C 30.419 0.004 . 49 580 12 GLU CG C 36.049 0.000 . 50 580 12 GLU N N 123.241 0.015 . 51 581 13 GLY H H 8.363 0.000 . 52 581 13 GLY C C 173.577 0.000 . 53 581 13 GLY CA C 45.235 0.019 . 54 581 13 GLY N N 109.864 0.006 . 55 582 14 PHE H H 7.981 0.001 . 56 582 14 PHE C C 175.400 0.000 . 57 582 14 PHE CA C 57.714 0.015 . 58 582 14 PHE CB C 39.778 0.071 . 59 582 14 PHE N N 120.006 0.007 . 60 583 15 VAL H H 8.053 0.001 . 61 583 15 VAL C C 175.483 0.000 . 62 583 15 VAL CA C 62.164 0.038 . 63 583 15 VAL CB C 33.063 0.086 . 64 583 15 VAL N N 122.911 0.093 . 65 584 16 LEU H H 8.220 0.001 . 66 584 16 LEU C C 176.886 0.000 . 67 584 16 LEU CA C 55.210 0.047 . 68 584 16 LEU CB C 42.630 0.039 . 69 584 16 LEU CG C 27.104 0.000 . 70 584 16 LEU CD1 C 24.690 0.000 . 71 584 16 LEU CD2 C 24.140 0.000 . 72 584 16 LEU N N 126.280 0.029 . 73 585 17 ASP H H 8.355 0.001 . 74 585 17 ASP C C 176.526 0.000 . 75 585 17 ASP CA C 54.416 0.047 . 76 585 17 ASP CB C 41.196 0.045 . 77 585 17 ASP N N 121.918 0.021 . 78 586 18 THR H H 8.024 0.001 . 79 586 18 THR C C 174.937 0.000 . 80 586 18 THR CA C 62.157 0.025 . 81 586 18 THR CB C 69.593 0.057 . 82 586 18 THR CG2 C 21.542 0.000 . 83 586 18 THR N N 113.707 0.012 . 84 587 19 MET H H 8.315 0.004 . 85 587 19 MET C C 176.126 0.000 . 86 587 19 MET CA C 55.900 0.023 . 87 587 19 MET CB C 32.573 0.105 . 88 587 19 MET CG C 32.040 0.000 . 89 587 19 MET N N 121.735 0.035 . 90 588 20 ASN H H 8.291 0.002 . 91 588 20 ASN C C 175.077 0.000 . 92 588 20 ASN CA C 53.532 0.044 . 93 588 20 ASN CB C 39.071 0.048 . 94 588 20 ASN N N 119.420 0.034 . 95 589 21 ASP H H 8.319 0.002 . 96 589 21 ASP C C 176.523 0.000 . 97 589 21 ASP CA C 54.692 0.081 . 98 589 21 ASP CB C 41.109 0.048 . 99 589 21 ASP N N 121.171 0.024 . 100 590 22 SER H H 8.242 0.004 . 101 590 22 SER C C 174.691 0.000 . 102 590 22 SER CA C 59.102 0.054 . 103 590 22 SER CB C 63.698 0.055 . 104 590 22 SER N N 115.729 0.025 . 105 591 23 LEU H H 8.119 0.000 . 106 591 23 LEU C C 177.435 0.000 . 107 591 23 LEU CA C 55.389 0.120 . 108 591 23 LEU CB C 42.243 0.049 . 109 591 23 LEU CG C 26.906 0.000 . 110 591 23 LEU CD1 C 25.011 0.000 . 111 591 23 LEU CD2 C 23.322 0.000 . 112 591 23 LEU N N 123.027 0.027 . 113 592 24 SER H H 8.135 0.001 . 114 592 24 SER C C 173.445 0.000 . 115 592 24 SER CA C 58.444 0.055 . 116 592 24 SER CB C 63.831 0.040 . 117 592 24 SER N N 116.549 0.235 . 118 593 25 LYS H H 7.879 0.001 . 119 593 25 LYS CA C 56.919 0.576 . 120 593 25 LYS CB C 33.376 0.389 . 121 593 25 LYS N N 128.289 0.014 . 122 594 26 ILE H H 7.945 0.001 . 123 594 26 ILE CA C 61.443 0.049 . 124 594 26 ILE CB C 38.647 0.049 . 125 594 26 ILE N N 121.151 0.009 . 126 595 27 LEU H H 8.195 0.002 . 127 595 27 LEU C C 176.441 0.000 . 128 595 27 LEU CA C 55.157 0.019 . 129 595 27 LEU CB C 42.376 0.107 . 130 595 27 LEU CG C 27.047 0.000 . 131 595 27 LEU CD1 C 24.700 0.000 . 132 595 27 LEU CD2 C 24.280 0.000 . 133 595 27 LEU N N 125.820 0.036 . 134 596 28 VAL H H 8.211 0.001 . 135 596 28 VAL C C 175.254 0.000 . 136 596 28 VAL CA C 62.049 0.030 . 137 596 28 VAL CB C 33.103 0.100 . 138 596 28 VAL CG1 C 20.814 0.000 . 139 596 28 VAL CG2 C 20.455 0.000 . 140 596 28 VAL N N 122.105 0.019 . 141 597 29 ASP H H 8.336 0.000 . 142 597 29 ASP C C 176.150 0.000 . 143 597 29 ASP CA C 54.119 0.049 . 144 597 29 ASP CB C 41.387 0.037 . 145 597 29 ASP N N 124.309 0.008 . 146 598 30 ILE H H 8.088 0.001 . 147 598 30 ILE C C 176.128 0.000 . 148 598 30 ILE CA C 61.394 0.033 . 149 598 30 ILE CB C 38.831 0.111 . 150 598 30 ILE CG1 C 27.109 0.000 . 151 598 30 ILE CG2 C 17.561 0.000 . 152 598 30 ILE CD1 C 13.382 0.000 . 153 598 30 ILE N N 121.148 0.013 . 154 599 31 SER H H 8.336 0.001 . 155 599 31 SER C C 174.199 0.000 . 156 599 31 SER CA C 58.661 0.058 . 157 599 31 SER CB C 63.802 0.033 . 158 599 31 SER N N 119.174 0.024 . 159 600 32 PHE H H 8.180 0.000 . 160 600 32 PHE C C 175.787 0.000 . 161 600 32 PHE CA C 57.870 0.073 . 162 600 32 PHE CB C 39.560 0.055 . 163 600 32 PHE N N 122.339 0.011 . 164 601 33 SER H H 8.335 0.004 . 165 601 33 SER C C 174.802 0.000 . 166 601 33 SER CA C 58.619 0.038 . 167 601 33 SER CB C 64.004 0.035 . 168 601 33 SER N N 117.995 0.008 . 169 602 34 GLY H H 7.978 0.003 . 170 602 34 GLY C C 174.002 0.000 . 171 602 34 GLY CA C 45.432 0.020 . 172 602 34 GLY N N 110.705 0.010 . 173 603 35 LEU H H 8.022 0.003 . 174 603 35 LEU C C 177.487 0.000 . 175 603 35 LEU CA C 55.127 0.054 . 176 603 35 LEU CB C 42.497 0.047 . 177 603 35 LEU CG C 26.906 0.000 . 178 603 35 LEU CD1 C 25.026 0.000 . 179 603 35 LEU CD2 C 23.357 0.000 . 180 603 35 LEU N N 121.244 0.019 . 181 604 36 GLU H H 8.518 0.001 . 182 604 36 GLU C C 176.234 0.000 . 183 604 36 GLU CA C 56.791 0.023 . 184 604 36 GLU CB C 30.153 0.020 . 185 604 36 GLU CG C 36.016 0.000 . 186 604 36 GLU N N 121.094 0.021 . 187 605 37 ASP H H 8.254 0.000 . 188 605 37 ASP CA C 54.859 0.279 . 189 605 37 ASP CB C 41.856 0.673 . 190 605 37 ASP N N 120.692 0.018 . 191 606 38 GLU H H 8.333 0.151 . 192 606 38 GLU C C 176.187 0.000 . 193 606 38 GLU CA C 56.959 0.040 . 194 606 38 GLU CB C 30.406 0.016 . 195 606 38 GLU CG C 35.950 0.000 . 196 606 38 GLU N N 122.107 0.847 . 197 607 39 ASP H H 8.373 0.000 . 198 607 39 ASP C C 176.562 0.000 . 199 607 39 ASP CA C 54.404 0.041 . 200 607 39 ASP CB C 41.134 0.083 . 201 607 39 ASP N N 121.112 0.007 . 202 608 40 LEU H H 8.207 0.001 . 203 608 40 LEU C C 178.245 0.000 . 204 608 40 LEU CA C 55.572 0.044 . 205 608 40 LEU CB C 41.972 0.051 . 206 608 40 LEU CG C 26.831 0.000 . 207 608 40 LEU CD1 C 25.116 0.000 . 208 608 40 LEU CD2 C 23.145 0.000 . 209 608 40 LEU N N 123.024 0.021 . 210 609 41 GLY H H 8.399 0.001 . 211 609 41 GLY C C 174.733 0.000 . 212 609 41 GLY CA C 45.766 0.022 . 213 609 41 GLY N N 108.541 0.033 . 214 610 42 MET H H 8.150 0.000 . 215 610 42 MET C C 176.914 0.000 . 216 610 42 MET CA C 55.766 0.012 . 217 610 42 MET CB C 32.490 0.265 . 218 610 42 MET N N 119.284 0.010 . 219 611 43 GLY H H 8.411 0.000 . 220 611 43 GLY C C 173.898 0.000 . 221 611 43 GLY CA C 45.498 0.020 . 222 611 43 GLY N N 109.048 0.027 . 223 612 44 ASN H H 8.182 0.000 . 224 612 44 ASN C C 175.241 0.000 . 225 612 44 ASN CA C 53.252 0.032 . 226 612 44 ASN CB C 38.873 0.063 . 227 612 44 ASN N N 118.570 0.008 . 228 613 45 ILE H H 8.024 0.002 . 229 613 45 ILE C C 176.201 0.000 . 230 613 45 ILE CA C 61.352 0.047 . 231 613 45 ILE CB C 38.837 0.141 . 232 613 45 ILE CG1 C 27.206 0.000 . 233 613 45 ILE CG2 C 17.270 0.000 . 234 613 45 ILE CD1 C 13.087 0.000 . 235 613 45 ILE N N 120.862 0.009 . 236 614 46 SER H H 8.255 0.001 . 237 614 46 SER C C 174.411 0.000 . 238 614 46 SER CA C 58.334 0.048 . 239 614 46 SER CB C 63.664 0.035 . 240 614 46 SER N N 119.201 0.017 . 241 615 47 TRP H H 8.074 0.001 . 242 615 47 TRP HE1 H 10.101 0.000 . 243 615 47 TRP C C 176.330 0.000 . 244 615 47 TRP CA C 57.601 0.038 . 245 615 47 TRP CB C 29.598 0.035 . 246 615 47 TRP N N 123.910 1.738 . 247 616 48 SER H H 7.967 0.003 . 248 616 48 SER C C 174.106 0.000 . 249 616 48 SER CA C 58.589 0.026 . 250 616 48 SER CB C 63.744 0.032 . 251 616 48 SER N N 116.599 0.018 . 252 617 49 GLN H H 8.036 0.003 . 253 617 49 GLN C C 175.226 0.000 . 254 617 49 GLN CA C 55.960 0.020 . 255 617 49 GLN CB C 29.420 0.008 . 256 617 49 GLN CG C 33.558 0.000 . 257 617 49 GLN N N 121.294 0.018 . 258 618 50 PHE H H 8.070 0.004 . 259 618 50 PHE CA C 57.665 0.000 . 260 618 50 PHE CB C 39.659 0.000 . 261 618 50 PHE N N 121.196 0.042 . 262 620 52 PRO C C 176.543 0.000 . 263 620 52 PRO CA C 63.158 0.030 . 264 620 52 PRO CB C 32.196 0.042 . 265 620 52 PRO CG C 27.232 0.000 . 266 620 52 PRO CD C 50.843 0.000 . 267 621 53 GLU H H 8.373 0.001 . 268 621 53 GLU C C 176.138 0.000 . 269 621 53 GLU CA C 56.521 0.014 . 270 621 53 GLU CB C 30.469 0.011 . 271 621 53 GLU CG C 36.154 0.000 . 272 621 53 GLU N N 120.715 0.033 . 273 622 54 LEU H H 8.230 0.000 . 274 622 54 LEU C C 176.054 0.000 . 275 622 54 LEU CA C 55.142 0.021 . 276 622 54 LEU CB C 42.188 0.048 . 277 622 54 LEU CG C 26.897 0.000 . 278 622 54 LEU CD1 C 24.939 0.000 . 279 622 54 LEU CD2 C 23.593 0.000 . 280 622 54 LEU N N 124.595 0.008 . 281 623 55 LYS H H 7.850 0.001 . 282 623 55 LYS CA C 57.501 0.000 . 283 623 55 LYS CB C 33.931 0.000 . 284 623 55 LYS N N 127.841 0.011 . stop_ save_