data_11511 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; acidic intrinsically disordered region of SSRP1 ; _BMRB_accession_number 11511 _BMRB_flat_file_name bmr11511.str _Entry_type original _Submission_date 2012-09-21 _Accession_date 2012-09-23 _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 Hashimoto Manami . . 2 Kodera Noriyuki . . 3 Tsunaka Yasuo . . 4 Ando Toshio . . 5 Morikawa Kosuke . . 6 Tate Shin-ichi . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 79 "13C chemical shifts" 225 "15N chemical shifts" 79 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-12-18 original BMRB . stop_ _Original_release_date 2012-09-23 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Phosphorylation-coupled intramolecular dynamics of unstructured regions in chromatin remodeler FACT. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 23708362 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Hashimoto Manami . . 2 Kodera Noriyuki . . 3 Tsunaka Yasuo . . 4 Oda Masayuki . . 5 Tanimoto Mitsuru . . 6 Ando Toshio . . 7 Morikawa Kosuke . . 8 Tate Shin-ichi . . stop_ _Journal_abbreviation 'Biophys. J.' _Journal_name_full 'Biophysical journal' _Journal_volume 104 _Journal_issue 10 _Journal_ISSN 0006-3495 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 2222 _Page_last 2234 _Year 2013 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'structure specific recognition protein 1' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label polypeptide $acidic_intrinsically_disordered_region_of_SSRP1 stop_ _System_molecular_weight . _System_physical_state 'intrinsically disordered' _System_oligomer_state ? _System_paramagnetic no _System_thiol_state . _Database_query_date . _Details . save_ ######################## # Monomeric polymers # ######################## save_acidic_intrinsically_disordered_region_of_SSRP1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common acidic_intrinsically_disordered_region_of_SSRP1 _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 89 _Mol_residue_sequence ; GSHMGYKDVDFGDSDNENEP DAYLARLKAEAREKEEDDDD GDSDEESTDEDFKPNENESD VAEEYDSNVESDSDDDSDAS GGGGDSDGA ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 430 GLY 2 431 SER 3 432 HIS 4 433 MET 5 434 GLY 6 435 TYR 7 436 LYS 8 437 ASP 9 438 VAL 10 439 ASP 11 440 PHE 12 441 GLY 13 442 ASP 14 443 SER 15 444 ASP 16 445 ASN 17 446 GLU 18 447 ASN 19 448 GLU 20 449 PRO 21 450 ASP 22 451 ALA 23 452 TYR 24 453 LEU 25 454 ALA 26 455 ARG 27 456 LEU 28 457 LYS 29 458 ALA 30 459 GLU 31 460 ALA 32 461 ARG 33 462 GLU 34 463 LYS 35 464 GLU 36 465 GLU 37 466 ASP 38 467 ASP 39 468 ASP 40 469 ASP 41 470 GLY 42 471 ASP 43 472 SER 44 473 ASP 45 474 GLU 46 475 GLU 47 476 SER 48 477 THR 49 478 ASP 50 479 GLU 51 480 ASP 52 481 PHE 53 482 LYS 54 483 PRO 55 484 ASN 56 485 GLU 57 486 ASN 58 487 GLU 59 488 SER 60 489 ASP 61 490 VAL 62 491 ALA 63 492 GLU 64 493 GLU 65 494 TYR 66 495 ASP 67 496 SER 68 497 ASN 69 498 VAL 70 499 GLU 71 500 SER 72 501 ASP 73 502 SER 74 503 ASP 75 504 ASP 76 505 ASP 77 506 SER 78 507 ASP 79 508 ALA 80 509 SER 81 510 GLY 82 511 GLY 83 512 GLY 84 513 GLY 85 514 ASP 86 515 SER 87 516 ASP 88 517 GLY 89 518 ALA 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 $acidic_intrinsically_disordered_region_of_SSRP1 '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 $acidic_intrinsically_disordered_region_of_SSRP1 'recombinant technology' 'E. coli' Escherichia coli . pET28a 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 $acidic_intrinsically_disordered_region_of_SSRP1 1 mM '[U-13C; U-15N]' 'sodium phosphate' 50 mM 'natural abundance' D2O 5 % . H2O 95 % . 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 'data analysis' 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 DMX _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_HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _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_HNCACB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ save_3D_HNCACO_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACO' _Sample_label $sample_1 save_ save_3D_HNCANNH_8 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCANNH' _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' 50 . mM pH 6.4 . pH pressure 1 . atm temperature 303 . 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 HNCO' '3D HNCA' '3D CBCA(CO)NH' '3D HNCACB' '3D HN(CO)CA' '3D HNCACO' '3D HNCANNH' 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 polypeptide _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 1 433 4 MET CA C 55.659 0.000 1 2 433 4 MET CB C 32.601 0.000 1 3 434 5 GLY H H 8.372 0.000 1 4 434 5 GLY C C 173.711 0.000 1 5 434 5 GLY CA C 45.223 0.000 1 6 434 5 GLY N N 110.084 0.000 1 7 435 6 TYR H H 7.952 0.000 1 8 435 6 TYR C C 175.553 0.000 1 9 435 6 TYR CA C 57.854 0.000 1 10 435 6 TYR CB C 38.914 0.000 1 11 435 6 TYR N N 119.948 0.000 1 12 436 7 LYS H H 8.109 0.000 1 13 436 7 LYS C C 175.622 0.000 1 14 436 7 LYS CA C 56.147 0.000 1 15 436 7 LYS CB C 33.167 0.000 1 16 436 7 LYS N N 122.740 0.000 1 17 437 8 ASP H H 8.220 0.000 1 18 437 8 ASP C C 176.077 0.000 1 19 437 8 ASP CA C 54.606 0.000 1 20 437 8 ASP CB C 41.150 0.000 1 21 437 8 ASP N N 121.593 0.000 1 22 438 9 VAL H H 7.870 0.000 1 23 438 9 VAL C C 175.345 0.000 1 24 438 9 VAL CA C 62.052 0.000 1 25 438 9 VAL CB C 32.834 0.000 1 26 438 9 VAL N N 118.588 0.000 1 27 439 10 ASP H H 8.194 0.000 1 28 439 10 ASP C C 175.914 0.000 1 29 439 10 ASP CA C 54.075 0.000 1 30 439 10 ASP CB C 41.335 0.000 1 31 439 10 ASP N N 123.010 0.000 1 32 440 11 PHE H H 8.114 0.000 1 33 440 11 PHE C C 176.300 0.000 1 34 440 11 PHE CA C 57.959 0.000 1 35 440 11 PHE CB C 39.513 0.000 1 36 440 11 PHE N N 121.067 0.000 1 37 441 12 GLY H H 8.323 0.000 1 38 441 12 GLY C C 173.838 0.000 1 39 441 12 GLY CA C 45.428 0.000 1 40 441 12 GLY N N 110.124 0.000 1 41 442 13 ASP H H 8.142 0.000 1 42 442 13 ASP C C 176.474 0.000 1 43 442 13 ASP CA C 54.289 0.000 1 44 442 13 ASP CB C 41.290 0.000 1 45 442 13 ASP N N 120.536 0.000 1 46 443 14 SER H H 8.228 0.000 1 47 443 14 SER CA C 58.698 0.000 1 48 443 14 SER CB C 63.973 0.000 1 49 443 14 SER N N 115.790 0.000 1 50 444 15 ASP H H 8.340 0.000 1 51 444 15 ASP C C 176.042 0.000 1 52 444 15 ASP CA C 54.558 0.000 1 53 444 15 ASP CB C 41.101 0.000 1 54 444 15 ASP N N 122.163 0.000 1 55 445 16 ASN H H 8.215 0.000 1 56 445 16 ASN C C 175.345 0.000 1 57 445 16 ASN CA C 53.475 0.000 1 58 445 16 ASN CB C 39.136 0.000 1 59 445 16 ASN N N 118.618 0.000 1 60 446 17 GLU H H 8.359 0.000 1 61 446 17 GLU C C 176.209 0.000 1 62 446 17 GLU CA C 56.944 0.000 1 63 446 17 GLU CB C 30.282 0.000 1 64 446 17 GLU N N 120.823 0.000 1 65 447 18 ASN H H 8.284 0.000 1 66 447 18 ASN C C 174.806 0.000 1 67 447 18 ASN CA C 53.238 0.000 1 68 447 18 ASN CB C 39.352 0.000 1 69 447 18 ASN N N 118.515 0.000 1 70 448 19 GLU H H 8.163 0.000 1 71 448 19 GLU C C 174.692 0.000 1 72 448 19 GLU CA C 54.681 0.000 1 73 448 19 GLU N N 121.941 0.000 1 74 449 20 PRO C C 177.310 0.000 1 75 449 20 PRO CA C 64.110 0.000 1 76 449 20 PRO CB C 32.042 0.000 1 77 450 21 ASP H H 8.357 0.000 1 78 450 21 ASP C C 177.100 0.000 1 79 450 21 ASP CA C 55.021 0.000 1 80 450 21 ASP N N 119.121 0.000 1 81 451 22 ALA H H 8.147 0.000 1 82 451 22 ALA C C 179.070 0.000 1 83 451 22 ALA CA C 54.144 0.000 1 84 451 22 ALA CB C 18.746 0.000 1 85 451 22 ALA N N 124.896 0.000 1 86 452 23 TYR H H 8.104 0.000 1 87 452 23 TYR C C 176.875 0.000 1 88 452 23 TYR CA C 59.772 0.000 1 89 452 23 TYR CB C 37.960 0.000 1 90 452 23 TYR N N 118.845 0.000 1 91 453 24 LEU H H 7.788 0.000 1 92 453 24 LEU C C 178.539 0.000 1 93 453 24 LEU CA C 56.619 0.000 1 94 453 24 LEU CB C 41.774 0.000 1 95 453 24 LEU N N 120.822 0.000 1 96 454 25 ALA H H 7.905 0.000 1 97 454 25 ALA C C 179.355 0.000 1 98 454 25 ALA CA C 54.008 0.000 1 99 454 25 ALA CB C 18.377 0.000 1 100 454 25 ALA N N 121.869 0.000 1 101 455 26 ARG H H 7.770 0.000 1 102 455 26 ARG C C 177.390 0.000 1 103 455 26 ARG CA C 57.651 0.000 1 104 455 26 ARG CB C 30.065 0.000 1 105 455 26 ARG N N 119.126 0.000 1 106 456 27 LEU H H 7.815 0.000 1 107 456 27 LEU C C 178.753 0.000 1 108 456 27 LEU CA C 56.517 0.000 1 109 456 27 LEU CB C 41.903 0.000 1 110 456 27 LEU N N 121.047 0.000 1 111 457 28 LYS H H 7.946 0.000 1 112 457 28 LYS C C 177.257 0.000 1 113 457 28 LYS CA C 57.382 0.000 1 114 457 28 LYS CB C 32.707 0.000 1 115 457 28 LYS N N 120.213 0.000 1 116 458 29 ALA H H 7.922 0.000 1 117 458 29 ALA C C 178.577 0.000 1 118 458 29 ALA CA C 53.353 0.000 1 119 458 29 ALA CB C 18.861 0.000 1 120 458 29 ALA N N 123.577 0.000 1 121 459 30 GLU H H 8.142 0.000 1 122 459 30 GLU C C 176.652 0.000 1 123 459 30 GLU CA C 57.065 0.000 1 124 459 30 GLU CB C 30.074 0.000 1 125 459 30 GLU N N 118.914 0.000 1 126 460 31 ALA H H 7.947 0.000 1 127 460 31 ALA C C 177.731 0.000 1 128 460 31 ALA CA C 52.762 0.000 1 129 460 31 ALA CB C 18.957 0.000 1 130 460 31 ALA N N 123.825 0.000 1 131 461 32 ARG H H 8.040 0.000 1 132 461 32 ARG C C 176.537 0.000 1 133 461 32 ARG CA C 56.228 0.000 1 134 461 32 ARG CB C 30.850 0.000 1 135 461 32 ARG N N 119.954 0.000 1 136 462 33 GLU H H 8.345 0.000 1 137 462 33 GLU C C 176.417 0.000 1 138 462 33 GLU CA C 56.949 0.000 1 139 462 33 GLU CB C 30.087 0.000 1 140 462 33 GLU N N 121.788 0.000 1 141 463 34 LYS H H 8.109 0.000 1 142 463 34 LYS C C 176.378 0.000 1 143 463 34 LYS CA C 56.272 0.000 1 144 463 34 LYS CB C 33.308 0.000 1 145 463 34 LYS N N 121.085 0.000 1 146 464 35 GLU H H 8.433 0.000 1 147 464 35 GLU C C 176.545 0.000 1 148 464 35 GLU CA C 56.707 0.000 1 149 464 35 GLU CB C 30.210 0.000 1 150 464 35 GLU N N 122.529 0.000 1 151 465 36 GLU H H 8.317 0.000 1 152 465 36 GLU C C 176.057 0.000 1 153 465 36 GLU N N 120.833 0.000 1 154 469 40 ASP C C 176.892 0.000 1 155 469 40 ASP CA C 54.459 0.000 1 156 469 40 ASP CB C 41.098 0.000 1 157 470 41 GLY H H 8.290 0.000 1 158 470 41 GLY C C 174.016 0.000 1 159 470 41 GLY CA C 45.456 0.000 1 160 470 41 GLY N N 109.054 0.000 1 161 471 42 ASP H H 8.219 0.000 1 162 471 42 ASP C C 176.353 0.000 1 163 471 42 ASP CA C 54.167 0.000 1 164 471 42 ASP CB C 41.367 0.000 1 165 471 42 ASP N N 120.566 0.000 1 166 472 43 SER H H 8.270 0.000 1 167 472 43 SER CA C 58.208 0.000 1 168 472 43 SER CB C 64.149 0.000 1 169 472 43 SER N N 116.153 0.000 1 170 473 44 ASP H H 8.379 0.000 1 171 473 44 ASP CA C 54.256 0.000 1 172 473 44 ASP CB C 41.279 0.000 1 173 473 44 ASP N N 122.949 0.000 1 174 474 45 GLU H H 8.264 0.000 1 175 474 45 GLU C C 176.429 0.000 1 176 474 45 GLU CA C 56.501 0.000 1 177 474 45 GLU CB C 30.436 0.000 1 178 474 45 GLU N N 121.147 0.000 1 179 475 46 GLU H H 8.393 0.000 1 180 475 46 GLU C C 176.427 0.000 1 181 475 46 GLU CA C 56.397 0.000 1 182 475 46 GLU CB C 30.403 0.000 1 183 475 46 GLU N N 122.426 0.000 1 184 476 47 SER H H 8.350 0.000 1 185 476 47 SER C C 174.698 0.000 1 186 476 47 SER CA C 58.156 0.000 1 187 476 47 SER CB C 63.820 0.000 1 188 476 47 SER N N 117.562 0.000 1 189 477 48 THR H H 8.281 0.000 1 190 477 48 THR C C 174.229 0.000 1 191 477 48 THR CA C 61.456 0.000 1 192 477 48 THR CB C 70.007 0.000 1 193 477 48 THR N N 116.180 0.000 1 194 478 49 ASP H H 8.309 0.000 1 195 478 49 ASP C C 176.335 0.000 1 196 478 49 ASP CA C 54.427 0.000 1 197 478 49 ASP CB C 41.314 0.000 1 198 478 49 ASP N N 122.975 0.000 1 199 479 50 GLU H H 8.330 0.000 1 200 479 50 GLU C C 176.091 0.000 1 201 479 50 GLU CA C 56.605 0.000 1 202 479 50 GLU CB C 30.335 0.000 1 203 479 50 GLU N N 121.477 0.000 1 204 480 51 ASP H H 8.270 0.000 1 205 480 51 ASP C C 175.707 0.000 1 206 480 51 ASP CA C 54.288 0.000 1 207 480 51 ASP CB C 41.122 0.000 1 208 480 51 ASP N N 121.111 0.000 1 209 481 52 PHE H H 8.011 0.000 1 210 481 52 PHE C C 175.054 0.000 1 211 481 52 PHE CA C 57.755 0.000 1 212 481 52 PHE CB C 39.508 0.000 1 213 481 52 PHE N N 121.064 0.000 1 214 482 53 LYS H H 8.020 0.000 1 215 482 53 LYS C C 173.711 0.000 1 216 482 53 LYS CA C 53.490 0.000 1 217 482 53 LYS N N 125.928 0.000 1 218 483 54 PRO C C 176.606 0.000 1 219 483 54 PRO CA C 62.924 0.000 1 220 483 54 PRO CB C 32.157 0.000 1 221 484 55 ASN H H 8.469 0.000 1 222 484 55 ASN C C 175.366 0.000 1 223 484 55 ASN CA C 53.236 0.000 1 224 484 55 ASN CB C 38.934 0.000 1 225 484 55 ASN N N 118.935 0.000 1 226 485 56 GLU H H 8.402 0.000 1 227 485 56 GLU C C 176.112 0.000 1 228 485 56 GLU CA C 56.710 0.000 1 229 485 56 GLU CB C 30.264 0.000 1 230 485 56 GLU N N 121.923 0.000 1 231 486 57 ASN H H 8.414 0.000 1 232 486 57 ASN C C 175.188 0.000 1 233 486 57 ASN CA C 53.307 0.000 1 234 486 57 ASN CB C 39.097 0.000 1 235 486 57 ASN N N 119.148 0.000 1 236 487 58 GLU H H 8.333 0.000 1 237 487 58 GLU C C 176.431 0.000 1 238 487 58 GLU CA C 56.760 0.000 1 239 487 58 GLU CB C 30.264 0.000 1 240 487 58 GLU N N 121.647 0.000 1 241 488 59 SER H H 8.245 0.000 1 242 488 59 SER C C 174.202 0.000 1 243 488 59 SER CA C 58.270 0.000 1 244 488 59 SER CB C 64.085 0.000 1 245 488 59 SER N N 116.386 0.000 1 246 489 60 ASP H H 8.311 0.000 1 247 489 60 ASP C C 176.061 0.000 1 248 489 60 ASP CA C 54.354 0.000 1 249 489 60 ASP CB C 41.121 0.000 1 250 489 60 ASP N N 122.953 0.000 1 251 490 61 VAL H H 7.975 0.000 1 252 490 61 VAL C C 175.699 0.000 1 253 490 61 VAL CA C 62.060 0.000 1 254 490 61 VAL CB C 32.647 0.000 1 255 490 61 VAL N N 120.250 0.000 1 256 491 62 ALA H H 8.281 0.000 1 257 491 62 ALA C C 177.503 0.000 1 258 491 62 ALA CA C 52.259 0.000 1 259 491 62 ALA CB C 19.356 0.000 1 260 491 62 ALA N N 128.435 0.000 1 261 492 63 GLU H H 8.262 0.000 1 262 492 63 GLU C C 176.074 0.000 1 263 492 63 GLU CA C 56.411 0.000 1 264 492 63 GLU CB C 30.386 0.000 1 265 492 63 GLU N N 120.837 0.000 1 266 493 64 GLU H H 8.274 0.000 1 267 493 64 GLU C C 175.882 0.000 1 268 493 64 GLU CA C 56.199 0.000 1 269 493 64 GLU CB C 30.527 0.000 1 270 493 64 GLU N N 122.043 0.000 1 271 494 65 TYR H H 8.146 0.000 1 272 494 65 TYR C C 175.231 0.000 1 273 494 65 TYR CA C 57.625 0.000 1 274 494 65 TYR CB C 39.167 0.000 1 275 494 65 TYR N N 121.641 0.000 1 276 495 66 ASP H H 8.244 0.000 1 277 495 66 ASP C C 175.954 0.000 1 278 495 66 ASP CA C 53.946 0.000 1 279 495 66 ASP CB C 41.321 0.000 1 280 495 66 ASP N N 123.004 0.000 1 281 496 67 SER H H 8.165 0.000 1 282 496 67 SER C C 174.441 0.000 1 283 496 67 SER CA C 58.487 0.000 1 284 496 67 SER CB C 63.879 0.000 1 285 496 67 SER N N 116.976 0.000 1 286 497 68 ASN H H 8.454 0.000 1 287 497 68 ASN C C 175.027 0.000 1 288 497 68 ASN CA C 53.489 0.000 1 289 497 68 ASN CB C 38.910 0.000 1 290 497 68 ASN N N 121.144 0.000 1 291 498 69 VAL H H 7.930 0.000 1 292 498 69 VAL C C 176.073 0.000 1 293 498 69 VAL CA C 62.244 0.000 1 294 498 69 VAL CB C 32.750 0.000 1 295 498 69 VAL N N 120.194 0.000 1 296 499 70 GLU H H 8.408 0.000 1 297 499 70 GLU C C 176.365 0.000 1 298 499 70 GLU CA C 56.370 0.000 1 299 499 70 GLU CB C 30.329 0.000 1 300 499 70 GLU N N 124.905 0.000 1 301 500 71 SER H H 8.308 0.000 1 302 500 71 SER CA C 58.186 0.000 1 303 500 71 SER CB C 64.149 0.000 1 304 500 71 SER N N 117.240 0.000 1 305 501 72 ASP H H 8.383 0.000 1 306 501 72 ASP C C 176.186 0.000 1 307 501 72 ASP CA C 54.294 0.000 1 308 501 72 ASP CB C 41.290 0.000 1 309 501 72 ASP N N 122.976 0.000 1 310 502 73 SER H H 8.226 0.000 1 311 502 73 SER C C 174.267 0.000 1 312 502 73 SER CA C 58.310 0.000 1 313 502 73 SER N N 115.878 0.000 1 314 503 74 ASP H H 8.372 0.000 1 315 503 74 ASP C C 175.940 0.000 1 316 503 74 ASP N N 122.914 0.000 1 317 504 75 ASP H H 8.210 0.000 1 318 504 75 ASP C C 176.040 0.000 1 319 504 75 ASP CA C 54.364 0.000 1 320 504 75 ASP CB C 41.352 0.000 1 321 504 75 ASP N N 120.863 0.000 1 322 505 76 ASP H H 8.294 0.000 1 323 505 76 ASP C C 176.687 0.000 1 324 505 76 ASP CA C 54.158 0.000 1 325 505 76 ASP CB C 41.013 0.000 1 326 505 76 ASP N N 121.613 0.000 1 327 506 77 SER H H 8.204 0.000 1 328 506 77 SER C C 174.687 0.000 1 329 506 77 SER CA C 59.120 0.000 1 330 506 77 SER CB C 63.973 0.000 1 331 506 77 SER N N 116.478 0.000 1 332 507 78 ASP H H 8.336 0.000 1 333 507 78 ASP C C 176.368 0.000 1 334 507 78 ASP CA C 54.490 0.000 1 335 507 78 ASP CB C 41.008 0.000 1 336 507 78 ASP N N 122.199 0.000 1 337 508 79 ALA H H 8.174 0.000 1 338 508 79 ALA C C 178.231 0.000 1 339 508 79 ALA CA C 52.790 0.000 1 340 508 79 ALA CB C 18.879 0.000 1 341 508 79 ALA N N 125.023 0.000 1 342 509 80 SER H H 8.254 0.000 1 343 509 80 SER C C 175.393 0.000 1 344 509 80 SER CA C 58.919 0.000 1 345 509 80 SER CB C 64.110 0.000 1 346 509 80 SER N N 114.853 0.000 1 347 510 81 GLY H H 8.293 0.000 1 348 510 81 GLY C C 174.837 0.000 1 349 510 81 GLY CA C 45.453 0.000 1 350 510 81 GLY N N 110.699 0.000 1 351 511 82 GLY H H 8.225 0.000 1 352 511 82 GLY CA C 45.288 0.000 1 353 511 82 GLY N N 108.724 0.000 1 354 512 83 GLY H H 8.298 0.000 1 355 512 83 GLY C C 174.820 0.000 1 356 512 83 GLY CA C 45.355 0.000 1 357 512 83 GLY N N 109.084 0.000 1 358 513 84 GLY H H 8.329 0.000 1 359 513 84 GLY C C 174.107 0.000 1 360 513 84 GLY CA C 45.273 0.000 1 361 513 84 GLY N N 108.847 0.000 1 362 514 85 ASP H H 8.290 0.000 1 363 514 85 ASP C C 176.539 0.000 1 364 514 85 ASP CA C 54.380 0.000 1 365 514 85 ASP N N 120.480 0.000 1 366 515 86 SER H H 8.273 0.000 1 367 515 86 SER C C 174.516 0.000 1 368 515 86 SER CA C 58.416 0.000 1 369 515 86 SER CB C 63.961 0.000 1 370 515 86 SER N N 115.909 0.000 1 371 516 87 ASP H H 8.317 0.000 1 372 516 87 ASP C C 176.735 0.000 1 373 516 87 ASP CA C 54.660 0.000 1 374 516 87 ASP CB C 41.111 0.000 1 375 516 87 ASP N N 122.411 0.000 1 376 517 88 GLY H H 8.234 0.000 1 377 517 88 GLY C C 173.073 0.000 1 378 517 88 GLY CA C 45.490 0.000 1 379 517 88 GLY N N 109.590 0.000 1 380 518 89 ALA H H 7.746 0.000 1 381 518 89 ALA C C 167.955 0.000 1 382 518 89 ALA CA C 53.724 0.000 1 383 518 89 ALA N N 129.333 0.000 1 stop_ save_