data_19317 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Solution structure of HRDC1 domain of RecQ helicase from Deinococcus radiodurans ; _BMRB_accession_number 19317 _BMRB_flat_file_name bmr19317.str _Entry_type original _Submission_date 2013-06-24 _Accession_date 2013-06-24 _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 Liu Shanshan . . 2 Zhang Wen . . 3 Gao Zengqiang . . 4 Ming Qianqian . . 5 Hou Haifeng . . 6 Lan Wenxian . . 7 Wu Houming . . 8 Cao Chunyang . . 9 Dong Yuhui . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 415 "13C chemical shifts" 283 "15N chemical shifts" 70 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2013-10-09 update BMRB 'update entry citation' 2013-07-08 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_citations _Saveframe_category entry_citation _Citation_full . _Citation_title 'NMR structure of the N-terminal-most HRDC1 domain of RecQ helicase from Deinococcus radiodurans.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 23831579 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Liu Shanshan . . 2 Zhang Wen . . 3 Gao Zengqiang . . 4 Ming Qianqian . . 5 Hou Haifeng . . 6 Lan Wenxian . . 7 Wu Houming . . 8 Cao Chunyang . . 9 Dong Yuhui . . stop_ _Journal_abbreviation 'FEBS Lett.' _Journal_name_full 'FEBS letters' _Journal_volume 587 _Journal_issue 16 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 2635 _Page_last 2642 _Year 2013 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'DNA helicase RecQ' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'DNA helicase RecQ' $DNA_helicase_RecQ 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_DNA_helicase_RecQ _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common DNA_helicase_RecQ _Molecular_mass 8054.224 _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 75 _Mol_residue_sequence ; HDAPLFEALRAWRLQKAKEL SLPPYTIFHDATLKTIAELR PGSHATLGTVSGVGGRKLAA YGDEVLQVVRDSSGG ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 536 HIS 2 537 ASP 3 538 ALA 4 539 PRO 5 540 LEU 6 541 PHE 7 542 GLU 8 543 ALA 9 544 LEU 10 545 ARG 11 546 ALA 12 547 TRP 13 548 ARG 14 549 LEU 15 550 GLN 16 551 LYS 17 552 ALA 18 553 LYS 19 554 GLU 20 555 LEU 21 556 SER 22 557 LEU 23 558 PRO 24 559 PRO 25 560 TYR 26 561 THR 27 562 ILE 28 563 PHE 29 564 HIS 30 565 ASP 31 566 ALA 32 567 THR 33 568 LEU 34 569 LYS 35 570 THR 36 571 ILE 37 572 ALA 38 573 GLU 39 574 LEU 40 575 ARG 41 576 PRO 42 577 GLY 43 578 SER 44 579 HIS 45 580 ALA 46 581 THR 47 582 LEU 48 583 GLY 49 584 THR 50 585 VAL 51 586 SER 52 587 GLY 53 588 VAL 54 589 GLY 55 590 GLY 56 591 ARG 57 592 LYS 58 593 LEU 59 594 ALA 60 595 ALA 61 596 TYR 62 597 GLY 63 598 ASP 64 599 GLU 65 600 VAL 66 601 LEU 67 602 GLN 68 603 VAL 69 604 VAL 70 605 ARG 71 606 ASP 72 607 SER 73 608 SER 74 609 GLY 75 610 GLY stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-06-12 loop_ _Database_name _Database_accession_code _Database_entry_mol_name _Sequence_query_to_submitted_percentage _Sequence_subject_length _Sequence_identity _Sequence_positive _Sequence_homology_expectation_value BMRB 18124 D._radiodurans_RecQ 100.00 75 100.00 100.00 1.23e-45 PDB 2MA1 "Solution Structure Of Hrdc1 Domain Of Recq Helicase From Deinococcus Radiodurans" 100.00 75 100.00 100.00 1.23e-45 stop_ 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 $DNA_helicase_RecQ 'Deinococcus radiodurans' 1299 Bacteria . Deinococcus radiodurans DrRecQ 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 $DNA_helicase_RecQ 'recombinant technology' . Escherichia coli BL21(DE3) pET28a stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample _Saveframe_category sample _Sample_type solution _Details '50mM phosphate buffer; 90% H2O, 10% D2O' loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $DNA_helicase_RecQ 2 mM '[U-98% 13C; U-98% 15N]' 'phosphate buffer' 50 mM 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_CNS _Saveframe_category software _Name CNS _Version . loop_ _Vendor _Address _Electronic_address 'Brunger A. T. et.al.' . . stop_ loop_ _Task refinement stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 600 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_1H-15N_NOESY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-15N NOESY' _Sample_label $sample save_ save_3D_1H-13C_NOESY_aliphatic_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aliphatic' _Sample_label $sample save_ save_3D_1H-13C_NOESY_aromatic_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D 1H-13C NOESY aromatic' _Sample_label $sample 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 7.0 . 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 0.00 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 '3D 1H-15N NOESY' '3D 1H-13C NOESY aliphatic' '3D 1H-13C NOESY aromatic' stop_ loop_ _Sample_label $sample stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'DNA helicase RecQ' _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 1 536 1 HIS HA H 4.133 . 1 2 536 1 HIS HB2 H 2.852 . . 3 536 1 HIS HB3 H 3.101 . 2 4 536 1 HIS HD2 H 6.843 . 1 5 536 1 HIS C C 177.493 . . 6 536 1 HIS CA C 54.947 . 1 7 536 1 HIS CB C 31.549 . 1 8 536 1 HIS CD2 C 118.655 . 1 9 537 2 ASP H H 8.873 . 1 10 537 2 ASP HA H 4.382 . 1 11 537 2 ASP HB2 H 2.599 . . 12 537 2 ASP HB3 H 2.321 . 2 13 537 2 ASP C C 176.166 . . 14 537 2 ASP CA C 53.771 . 1 15 537 2 ASP CB C 40.956 . 1 16 537 2 ASP N N 121.532 . 1 17 538 3 ALA H H 7.941 . 1 18 538 3 ALA HA H 4.485 . 1 19 538 3 ALA HB H 1.500 . 1 20 538 3 ALA CA C 54.380 . 1 21 538 3 ALA CB C 17.051 . 1 22 538 3 ALA N N 124.230 . 1 23 539 4 PRO HA H 4.396 . 1 24 539 4 PRO HB2 H 2.382 . 2 25 539 4 PRO HB3 H 2.382 . 2 26 539 4 PRO HG2 H 2.080 . 2 27 539 4 PRO HG3 H 2.080 . 2 28 539 4 PRO HD2 H 3.731 . 2 29 539 4 PRO HD3 H 3.731 . 2 30 539 4 PRO C C 179.726 . . 31 539 4 PRO CA C 65.343 . 1 32 539 4 PRO CB C 31.240 . 1 33 539 4 PRO CD C 50.208 . 1 34 540 5 LEU H H 7.923 . 1 35 540 5 LEU HA H 4.337 . 1 36 540 5 LEU HB2 H 1.915 . . 37 540 5 LEU HB3 H 1.652 . 2 38 540 5 LEU HG H 1.178 . 1 39 540 5 LEU HD1 H 1.031 . . 40 540 5 LEU HD2 H 1.031 . . 41 540 5 LEU C C 177.936 . . 42 540 5 LEU CA C 57.621 . 1 43 540 5 LEU CB C 40.494 . 1 44 540 5 LEU CD1 C 24.149 . . 45 540 5 LEU CD2 C 24.149 . . 46 540 5 LEU N N 120.634 . 1 47 541 6 PHE H H 8.595 . 1 48 541 6 PHE HA H 4.186 . 1 49 541 6 PHE HB2 H 3.254 . . 50 541 6 PHE HB3 H 3.101 . 2 51 541 6 PHE HD1 H 7.055 . . 52 541 6 PHE HD2 H 7.055 . . 53 541 6 PHE HE1 H 6.772 . . 54 541 6 PHE HE2 H 6.772 . . 55 541 6 PHE HZ H 6.431 . 1 56 541 6 PHE C C 177.369 . . 57 541 6 PHE CA C 61.402 . 1 58 541 6 PHE CB C 38.697 . 1 59 541 6 PHE CD1 C 131.520 . . 60 541 6 PHE CD2 C 131.520 . . 61 541 6 PHE CE1 C 132.621 . . 62 541 6 PHE N N 120.847 . 1 63 542 7 GLU H H 8.411 . 1 64 542 7 GLU HA H 3.931 . 1 65 542 7 GLU HB2 H 2.049 . 2 66 542 7 GLU HB3 H 2.049 . 2 67 542 7 GLU HG2 H 2.413 . 2 68 542 7 GLU HG3 H 2.413 . 2 69 542 7 GLU C C 179.561 . . 70 542 7 GLU CA C 58.832 . 1 71 542 7 GLU CB C 28.546 . 1 72 542 7 GLU CG C 35.477 . 1 73 542 7 GLU N N 117.121 . 1 74 543 8 ALA H H 8.270 . 1 75 543 8 ALA HA H 4.278 . 1 76 543 8 ALA HB H 1.522 . 1 77 543 8 ALA C C 181.975 . . 78 543 8 ALA CA C 55.156 . 1 79 543 8 ALA CB C 18.195 . 1 80 543 8 ALA N N 124.498 . 1 81 544 9 LEU H H 8.712 . 1 82 544 9 LEU HA H 4.320 . 1 83 544 9 LEU HB2 H 2.183 . . 84 544 9 LEU HB3 H 1.479 . 2 85 544 9 LEU HG H 1.767 . 1 86 544 9 LEU HD1 H 0.805 . 2 87 544 9 LEU HD2 H 0.683 . 2 88 544 9 LEU C C 178.862 . . 89 544 9 LEU CA C 57.823 . 1 90 544 9 LEU CB C 42.265 . 1 91 544 9 LEU CD1 C 22.947 . . 92 544 9 LEU CD2 C 22.947 . . 93 544 9 LEU N N 121.753 . 1 94 545 10 ARG H H 8.532 . 1 95 545 10 ARG HA H 3.655 . 1 96 545 10 ARG HB2 H 1.711 . 2 97 545 10 ARG HB3 H 1.711 . 2 98 545 10 ARG HG2 H 1.281 . . 99 545 10 ARG HG3 H 1.102 . 2 100 545 10 ARG HD2 H 2.870 . . 101 545 10 ARG HD3 H 2.809 . 2 102 545 10 ARG C C 179.358 . . 103 545 10 ARG CA C 60.665 . 1 104 545 10 ARG CB C 30.073 . 1 105 545 10 ARG CG C 27.501 . 1 106 545 10 ARG CD C 43.806 . 1 107 545 10 ARG N N 121.300 . 1 108 546 11 ALA H H 8.359 . 1 109 546 11 ALA HA H 4.179 . 1 110 546 11 ALA HB H 1.540 . 1 111 546 11 ALA C C 180.514 . . 112 546 11 ALA CA C 55.404 . 1 113 546 11 ALA CB C 17.857 . 1 114 546 11 ALA N N 124.043 . 1 115 547 12 TRP H H 8.337 . 1 116 547 12 TRP HA H 4.134 . 1 117 547 12 TRP HB2 H 3.409 . . 118 547 12 TRP HB3 H 3.623 . 2 119 547 12 TRP HD1 H 7.263 . 1 120 547 12 TRP HE1 H 8.421 . 1 121 547 12 TRP C C 176.957 . . 122 547 12 TRP CA C 61.679 . 1 123 547 12 TRP CB C 27.947 . 1 124 547 12 TRP CD1 C 127.332 . . 125 547 12 TRP N N 121.943 . 1 126 548 13 ARG H H 8.698 . 1 127 548 13 ARG HA H 2.684 . 1 128 548 13 ARG HB2 H 2.131 . . 129 548 13 ARG HB3 H 1.815 . 2 130 548 13 ARG HG2 H 1.506 . . 131 548 13 ARG HG3 H 1.387 . 2 132 548 13 ARG HD2 H 3.945 . . 133 548 13 ARG HD3 H 2.900 . 2 134 548 13 ARG HE H 6.670 . 1 135 548 13 ARG HH11 H 6.717 . . 136 548 13 ARG HH21 H 6.715 . . 137 548 13 ARG C C 176.643 . . 138 548 13 ARG CA C 59.057 . 1 139 548 13 ARG CB C 29.977 . 1 140 548 13 ARG CD C 43.586 . 1 141 548 13 ARG N N 120.252 . 1 142 549 14 LEU H H 7.726 . 1 143 549 14 LEU HA H 3.827 . 1 144 549 14 LEU HB2 H 1.747 . 2 145 549 14 LEU HB3 H 1.747 . 2 146 549 14 LEU HG H 1.678 . 1 147 549 14 LEU HD1 H 0.902 . . 148 549 14 LEU HD2 H 0.902 . . 149 549 14 LEU C C 178.737 . . 150 549 14 LEU CA C 57.968 . 1 151 549 14 LEU CB C 41.944 . 1 152 549 14 LEU CD1 C 24.275 . . 153 549 14 LEU CD2 C 24.275 . . 154 549 14 LEU N N 119.884 . 1 155 550 15 GLN H H 7.438 . 1 156 550 15 GLN HA H 3.921 . 1 157 550 15 GLN HB2 H 2.096 . 2 158 550 15 GLN HB3 H 2.096 . 2 159 550 15 GLN HG2 H 2.366 . 2 160 550 15 GLN HG3 H 2.366 . 2 161 550 15 GLN HE21 H 7.667 . 2 162 550 15 GLN HE22 H 6.930 . 2 163 550 15 GLN C C 178.399 . . 164 550 15 GLN CA C 58.360 . 1 165 550 15 GLN CB C 27.603 . 1 166 550 15 GLN CG C 32.939 . 1 167 550 15 GLN N N 118.697 . 1 168 550 15 GLN NE2 N 112.462 . 1 169 551 16 LYS H H 8.207 . 1 170 551 16 LYS HA H 3.846 . 1 171 551 16 LYS HB2 H 0.676 . . 172 551 16 LYS HB3 H 0.984 . 2 173 551 16 LYS HG2 H 0.668 . . 174 551 16 LYS HG3 H 0.958 . 2 175 551 16 LYS HD2 H 0.995 . . 176 551 16 LYS HD3 H 0.676 . 2 177 551 16 LYS HE2 H 2.999 . 2 178 551 16 LYS HE3 H 2.999 . 2 179 551 16 LYS C C 177.667 . . 180 551 16 LYS CA C 56.470 . 1 181 551 16 LYS CB C 29.687 . 1 182 551 16 LYS CG C 29.634 . 1 183 551 16 LYS CE C 41.910 . 1 184 551 16 LYS N N 122.490 . 1 185 552 17 ALA H H 8.325 . 1 186 552 17 ALA HA H 3.702 . 1 187 552 17 ALA HB H 1.441 . 1 188 552 17 ALA C C 179.949 . . 189 552 17 ALA CA C 55.493 . 1 190 552 17 ALA CB C 17.846 . 1 191 552 17 ALA N N 121.373 . 1 192 553 18 LYS H H 7.633 . 1 193 553 18 LYS HA H 4.045 . 1 194 553 18 LYS HB2 H 1.894 . 2 195 553 18 LYS HB3 H 1.894 . 2 196 553 18 LYS HG2 H 1.374 . . 197 553 18 LYS HG3 H 1.544 . 2 198 553 18 LYS HD2 H 1.402 . 2 199 553 18 LYS HD3 H 1.402 . 2 200 553 18 LYS HE2 H 2.912 . 2 201 553 18 LYS HE3 H 2.912 . 2 202 553 18 LYS C C 180.012 . . 203 553 18 LYS CA C 58.925 . 1 204 553 18 LYS CB C 32.046 . 1 205 553 18 LYS CG C 25.062 . 1 206 553 18 LYS CD C 25.061 . 1 207 553 18 LYS CE C 41.891 . 1 208 553 18 LYS N N 117.317 . 1 209 554 19 GLU H H 8.073 . 1 210 554 19 GLU HA H 3.938 . 1 211 554 19 GLU HB2 H 2.189 . 2 212 554 19 GLU HB3 H 2.189 . 2 213 554 19 GLU HG2 H 2.451 . 2 214 554 19 GLU HG3 H 2.451 . 2 215 554 19 GLU C C 178.905 . . 216 554 19 GLU CA C 59.264 . 1 217 554 19 GLU CB C 29.773 . 1 218 554 19 GLU CG C 36.001 . 1 219 554 19 GLU N N 118.028 . 1 220 555 20 LEU H H 7.996 . 1 221 555 20 LEU HA H 4.330 . 1 222 555 20 LEU HB2 H 1.523 . 2 223 555 20 LEU HB3 H 1.523 . 2 224 555 20 LEU HG H 1.778 . 1 225 555 20 LEU HD1 H 0.903 . . 226 555 20 LEU HD2 H 0.903 . . 227 555 20 LEU C C 176.014 . . 228 555 20 LEU CA C 54.690 . 1 229 555 20 LEU CB C 42.556 . 1 230 555 20 LEU N N 115.956 . 1 231 556 21 SER H H 7.802 . 1 232 556 21 SER HB2 H 4.001 . 2 233 556 21 SER HB3 H 4.001 . 2 234 556 21 SER C C 173.701 . . 235 556 21 SER CA C 58.593 . 1 236 556 21 SER CB C 61.228 . 1 237 556 21 SER N N 114.976 . 1 238 557 22 LEU H H 8.110 . 1 239 557 22 LEU HA H 4.818 . 1 240 557 22 LEU HB2 H 1.010 . . 241 557 22 LEU HB3 H 1.233 . 2 242 557 22 LEU HG H 1.494 . 1 243 557 22 LEU HD1 H 0.859 . 2 244 557 22 LEU HD2 H 0.697 . 2 245 557 22 LEU CA C 51.042 . 1 246 557 22 LEU CB C 44.790 . 1 247 557 22 LEU CD1 C 25.391 . . 248 557 22 LEU CD2 C 25.165 . 2 249 557 22 LEU N N 119.301 . 1 250 558 23 PRO HA H 4.514 . 1 251 558 23 PRO HB2 H 2.299 . . 252 558 23 PRO HB3 H 1.367 . 2 253 558 23 PRO HG2 H 1.995 . . 254 558 23 PRO HG3 H 1.929 . 2 255 558 23 PRO HD2 H 3.430 . . 256 558 23 PRO HD3 H 3.680 . 2 257 558 23 PRO CA C 60.543 . 1 258 558 23 PRO CB C 31.301 . 1 259 558 23 PRO CD C 50.100 . 1 260 559 24 PRO HA H 3.792 . 1 261 559 24 PRO HB2 H 1.778 . 2 262 559 24 PRO HB3 H 1.778 . 2 263 559 24 PRO HG2 H 1.894 . 2 264 559 24 PRO HG3 H 1.894 . 2 265 559 24 PRO C C 177.927 . . 266 559 24 PRO CA C 66.073 . 1 267 559 24 PRO CB C 31.677 . 1 268 560 25 TYR H H 7.672 . 1 269 560 25 TYR HA H 4.393 . 1 270 560 25 TYR HB2 H 2.922 . 2 271 560 25 TYR HB3 H 2.922 . 2 272 560 25 TYR HD1 H 6.991 . . 273 560 25 TYR HD2 H 6.991 . . 274 560 25 TYR HE2 H 6.890 . 3 275 560 25 TYR C C 176.096 . . 276 560 25 TYR CA C 57.592 . 1 277 560 25 TYR CB C 35.625 . 1 278 560 25 TYR CD1 C 132.661 . . 279 560 25 TYR CD2 C 132.661 . . 280 560 25 TYR N N 112.183 . 1 281 561 26 THR H H 7.414 . 1 282 561 26 THR HA H 4.015 . 1 283 561 26 THR HB H 4.012 . 1 284 561 26 THR HG2 H 1.110 . 1 285 561 26 THR C C 175.218 . . 286 561 26 THR CA C 63.644 . 1 287 561 26 THR CB C 66.333 . 1 288 561 26 THR CG2 C 22.414 . . 289 561 26 THR N N 112.685 . 1 290 562 27 ILE H H 7.355 . 1 291 562 27 ILE HA H 3.466 . 1 292 562 27 ILE HB H 1.748 . 1 293 562 27 ILE HG12 H 0.791 . . 294 562 27 ILE HG13 H 1.127 . 2 295 562 27 ILE HG2 H 0.026 . 1 296 562 27 ILE HD1 H 0.349 . 1 297 562 27 ILE C C 173.966 . . 298 562 27 ILE CA C 63.713 . 1 299 562 27 ILE CB C 35.866 . 1 300 562 27 ILE CG1 C 27.116 . 1 301 562 27 ILE CG2 C 16.561 . 1 302 562 27 ILE CD1 C 12.315 . 1 303 562 27 ILE N N 123.954 . 1 304 563 28 PHE H H 6.697 . 1 305 563 28 PHE HA H 5.150 . 1 306 563 28 PHE HB2 H 3.402 . . 307 563 28 PHE HB3 H 2.308 . 2 308 563 28 PHE HD1 H 7.228 . . 309 563 28 PHE HD2 H 7.228 . . 310 563 28 PHE HE1 H 7.257 . . 311 563 28 PHE HE2 H 7.257 . . 312 563 28 PHE HZ H 6.955 . 1 313 563 28 PHE C C 175.669 . . 314 563 28 PHE CA C 57.100 . 1 315 563 28 PHE CB C 46.778 . 1 316 563 28 PHE CD1 C 132.733 . . 317 563 28 PHE CD2 C 132.733 . . 318 563 28 PHE CE1 C 131.546 . . 319 563 28 PHE CZ C 127.492 . 1 320 563 28 PHE N N 108.622 . 1 321 564 29 HIS H H 9.734 . 1 322 564 29 HIS HA H 4.628 . 1 323 564 29 HIS HB2 H 3.317 . . 324 564 29 HIS HB3 H 3.499 . 2 325 564 29 HIS HD2 H 7.317 . 1 326 564 29 HIS HE1 H 7.166 . . 327 564 29 HIS C C 176.976 . . 328 564 29 HIS CA C 56.812 . 1 329 564 29 HIS CB C 30.828 . 1 330 564 29 HIS CD2 C 131.953 . 1 331 564 29 HIS N N 121.497 . 1 332 565 30 ASP H H 9.368 . 1 333 565 30 ASP HA H 4.349 . 1 334 565 30 ASP HB2 H 2.848 . 2 335 565 30 ASP HB3 H 2.848 . 2 336 565 30 ASP C C 178.440 . . 337 565 30 ASP CA C 59.058 . 1 338 565 30 ASP CB C 39.745 . 1 339 565 30 ASP N N 124.257 . 1 340 566 31 ALA H H 9.527 . 1 341 566 31 ALA HA H 4.116 . 1 342 566 31 ALA HB H 1.466 . 1 343 566 31 ALA C C 180.729 . . 344 566 31 ALA CA C 55.520 . 1 345 566 31 ALA CB C 18.124 . 1 346 566 31 ALA N N 121.118 . 1 347 567 32 THR H H 7.197 . 1 348 567 32 THR HA H 4.018 . 1 349 567 32 THR HB H 4.283 . 1 350 567 32 THR HG2 H 1.039 . 1 351 567 32 THR C C 176.107 . . 352 567 32 THR CA C 65.948 . 1 353 567 32 THR CB C 68.850 . 1 354 567 32 THR CG2 C 22.833 . . 355 567 32 THR N N 115.054 . 1 356 568 33 LEU H H 7.674 . 1 357 568 33 LEU HA H 4.006 . 1 358 568 33 LEU HB2 H 2.376 . . 359 568 33 LEU HB3 H 1.481 . 2 360 568 33 LEU HG H 1.879 . 1 361 568 33 LEU HD1 H 0.771 . . 362 568 33 LEU HD2 H 0.771 . . 363 568 33 LEU C C 178.263 . . 364 568 33 LEU CA C 58.014 . 1 365 568 33 LEU CB C 41.202 . 1 366 568 33 LEU CD1 C 26.091 . . 367 568 33 LEU CD2 C 26.091 . . 368 568 33 LEU N N 118.298 . 1 369 569 34 LYS H H 8.564 . 1 370 569 34 LYS HA H 3.685 . 1 371 569 34 LYS HB2 H 1.609 . . 372 569 34 LYS HB3 H 1.820 . 2 373 569 34 LYS HG2 H 0.988 . . 374 569 34 LYS HG3 H 1.095 . 2 375 569 34 LYS HD2 H 1.852 . 2 376 569 34 LYS HD3 H 1.852 . 2 377 569 34 LYS HE2 H 2.525 . . 378 569 34 LYS HE3 H 2.586 . 2 379 569 34 LYS C C 178.299 . . 380 569 34 LYS CA C 59.707 . 1 381 569 34 LYS CB C 31.758 . 1 382 569 34 LYS CG C 24.964 . 1 383 569 34 LYS CD C 24.889 . . 384 569 34 LYS CE C 41.787 . 1 385 569 34 LYS N N 119.630 . 1 386 570 35 THR H H 7.810 . 1 387 570 35 THR HA H 3.960 . 1 388 570 35 THR HB H 4.186 . 1 389 570 35 THR HG2 H 1.314 . 1 390 570 35 THR C C 176.752 . . 391 570 35 THR CA C 66.674 . 1 392 570 35 THR CB C 67.978 . 1 393 570 35 THR CG2 C 23.522 . . 394 570 35 THR N N 116.903 . 1 395 571 36 ILE H H 8.224 . 1 396 571 36 ILE HA H 3.183 . 1 397 571 36 ILE HB H 1.711 . 1 398 571 36 ILE HG12 H 1.900 . . 399 571 36 ILE HG13 H 0.390 . 2 400 571 36 ILE HG2 H 0.464 . . 401 571 36 ILE HD1 H 0.190 . 1 402 571 36 ILE C C 177.015 . . 403 571 36 ILE CA C 66.716 . 1 404 571 36 ILE CB C 37.545 . 1 405 571 36 ILE CG1 C 29.815 . 1 406 571 36 ILE CG2 C 17.854 . 1 407 571 36 ILE CD1 C 13.456 . 1 408 571 36 ILE N N 121.329 . 1 409 572 37 ALA H H 8.288 . 1 410 572 37 ALA HA H 3.936 . 1 411 572 37 ALA HB H 1.541 . 1 412 572 37 ALA C C 177.693 . . 413 572 37 ALA CA C 54.148 . 1 414 572 37 ALA CB C 17.831 . 1 415 572 37 ALA N N 120.820 . 1 416 573 38 GLU H H 7.717 . 1 417 573 38 GLU HA H 4.027 . 1 418 573 38 GLU HB2 H 2.024 . . 419 573 38 GLU HB3 H 2.186 . 2 420 573 38 GLU HG2 H 2.209 . . 421 573 38 GLU HG3 H 2.441 . 2 422 573 38 GLU C C 178.618 . . 423 573 38 GLU CA C 58.404 . 1 424 573 38 GLU CB C 30.103 . 1 425 573 38 GLU CG C 36.074 . 1 426 573 38 GLU N N 115.552 . 1 427 574 39 LEU H H 8.201 . 1 428 574 39 LEU HA H 4.073 . 1 429 574 39 LEU HB2 H 1.497 . . 430 574 39 LEU HB3 H 1.565 . 2 431 574 39 LEU HD1 H 0.795 . 2 432 574 39 LEU HD2 H 0.695 . 2 433 574 39 LEU C C 177.167 . . 434 574 39 LEU CA C 56.348 . 1 435 574 39 LEU CB C 43.574 . 1 436 574 39 LEU CD1 C 24.958 . . 437 574 39 LEU CD2 C 24.958 . . 438 574 39 LEU N N 119.498 . 1 439 575 40 ARG H H 8.418 . 1 440 575 40 ARG HA H 3.424 . 1 441 575 40 ARG HB2 H 1.913 . . 442 575 40 ARG HB3 H 1.529 . 2 443 575 40 ARG HG2 H 1.919 . . 444 575 40 ARG HG3 H 1.529 . 2 445 575 40 ARG HD2 H 3.178 . . 446 575 40 ARG HD3 H 3.148 . 2 447 575 40 ARG CA C 56.700 . 1 448 575 40 ARG CB C 27.979 . 1 449 575 40 ARG N N 112.157 . 1 450 576 41 PRO HA H 4.262 . 1 451 576 41 PRO HB2 H 2.123 . 2 452 576 41 PRO HB3 H 1.798 . . 453 576 41 PRO HG2 H 1.807 . . 454 576 41 PRO HG3 H 1.731 . 2 455 576 41 PRO HD2 H 3.743 . . 456 576 41 PRO HD3 H 3.603 . 2 457 576 41 PRO C C 176.072 . . 458 576 41 PRO CA C 62.832 . 1 459 576 41 PRO CB C 31.712 . 1 460 577 42 GLY H H 8.520 . 1 461 577 42 GLY HA2 H 3.645 . . 462 577 42 GLY HA3 H 4.338 . 2 463 577 42 GLY C C 173.596 . . 464 577 42 GLY CA C 44.302 . 1 465 577 42 GLY N N 105.613 . 1 466 578 43 SER H H 7.371 . 1 467 578 43 SER HA H 4.260 . 1 468 578 43 SER HB2 H 4.317 . 2 469 578 43 SER HB3 H 4.317 . 2 470 578 43 SER CA C 55.926 . 1 471 578 43 SER CB C 66.724 . 1 472 578 43 SER N N 111.416 . 1 473 579 44 HIS HA H 3.898 . 1 474 579 44 HIS HB2 H 3.134 . . 475 579 44 HIS HB3 H 3.265 . 2 476 579 44 HIS HD1 H 7.666 . 1 477 579 44 HIS HD2 H 6.870 . 1 478 579 44 HIS HE1 H 7.211 . 1 479 579 44 HIS C C 176.915 . . 480 579 44 HIS CA C 61.674 . 1 481 579 44 HIS CB C 29.831 . 1 482 579 44 HIS CD2 C 117.096 . 1 483 579 44 HIS CE1 C 130.944 . 1 484 580 45 ALA H H 8.614 . 1 485 580 45 ALA HA H 3.709 . 1 486 580 45 ALA HB H 1.424 . 1 487 580 45 ALA CA C 55.239 . 1 488 580 45 ALA CB C 17.936 . 1 489 580 45 ALA N N 120.561 . 1 490 581 46 THR H H 7.764 . 1 491 581 46 THR HA H 4.079 . 1 492 581 46 THR HB H 4.009 . 1 493 581 46 THR HG2 H 1.253 . 1 494 581 46 THR C C 177.943 . . 495 581 46 THR CA C 64.843 . 1 496 581 46 THR CB C 68.572 . 1 497 581 46 THR CG2 C 22.761 . . 498 581 46 THR N N 110.832 . 1 499 582 47 LEU H H 8.191 . 1 500 582 47 LEU HA H 3.944 . 1 501 582 47 LEU HB2 H 1.281 . . 502 582 47 LEU HB3 H 1.907 . 2 503 582 47 LEU HG H 1.443 . 1 504 582 47 LEU HD1 H 0.757 . 2 505 582 47 LEU HD2 H 0.636 . 2 506 582 47 LEU C C 177.008 . . 507 582 47 LEU CA C 57.984 . 1 508 582 47 LEU CB C 41.064 . 1 509 582 47 LEU CD1 C 27.037 . . 510 582 47 LEU CD2 C 27.037 . . 511 582 47 LEU N N 125.277 . 1 512 583 48 GLY H H 8.419 . 1 513 583 48 GLY HA2 H 3.964 . 2 514 583 48 GLY HA3 H 3.964 . 2 515 583 48 GLY C C 174.504 . . 516 583 48 GLY CA C 46.334 . 1 517 583 48 GLY N N 101.730 . 1 518 584 49 THR H H 7.293 . 1 519 584 49 THR HA H 4.360 . 1 520 584 49 THR HB H 4.377 . 1 521 584 49 THR HG2 H 1.370 . . 522 584 49 THR C C 174.927 . . 523 584 49 THR CA C 62.244 . 1 524 584 49 THR CB C 69.866 . 1 525 584 49 THR CG2 C 21.169 . 1 526 584 49 THR N N 108.629 . 1 527 585 50 VAL H H 7.495 . 1 528 585 50 VAL HA H 3.729 . 1 529 585 50 VAL HB H 2.176 . 1 530 585 50 VAL HG1 H 0.948 . 2 531 585 50 VAL HG2 H 0.905 . 2 532 585 50 VAL CA C 63.091 . 1 533 585 50 VAL CB C 31.245 . 1 534 585 50 VAL CG1 C 22.502 . . 535 585 50 VAL N N 124.933 . 1 536 586 51 SER H H 8.961 . 1 537 586 51 SER HA H 4.462 . 1 538 586 51 SER HB2 H 3.881 . 2 539 586 51 SER HB3 H 3.881 . 2 540 586 51 SER C C 175.570 . . 541 586 51 SER CA C 60.384 . 1 542 586 51 SER CB C 62.438 . 1 543 586 51 SER N N 125.196 . 1 544 587 52 GLY H H 8.945 . 1 545 587 52 GLY HA2 H 3.869 . . 546 587 52 GLY HA3 H 4.530 . 2 547 587 52 GLY C C 174.724 . . 548 587 52 GLY CA C 45.097 . 1 549 587 52 GLY N N 114.565 . 1 550 588 53 VAL H H 8.126 . 1 551 588 53 VAL HA H 4.454 . 1 552 588 53 VAL HB H 2.519 . 1 553 588 53 VAL HG1 H 0.974 . 2 554 588 53 VAL HG2 H 0.605 . 2 555 588 53 VAL C C 174.941 . . 556 588 53 VAL CA C 62.313 . 1 557 588 53 VAL CB C 29.574 . 1 558 588 53 VAL CG1 C 22.284 . 2 559 588 53 VAL CG2 C 21.377 . 2 560 588 53 VAL N N 122.386 . 1 561 589 54 GLY H H 7.730 . 1 562 589 54 GLY HA2 H 4.200 . 2 563 589 54 GLY HA3 H 4.200 . 2 564 589 54 GLY C C 174.401 . . 565 589 54 GLY CA C 44.745 . 1 566 589 54 GLY N N 108.127 . 1 567 590 55 GLY H H 8.676 . 1 568 590 55 GLY HA2 H 3.744 . . 569 590 55 GLY HA3 H 4.086 . 2 570 590 55 GLY C C 176.922 . . 571 590 55 GLY CA C 47.768 . 1 572 590 55 GLY N N 106.445 . 1 573 591 56 ARG H H 8.703 . 1 574 591 56 ARG HA H 4.165 . 1 575 591 56 ARG HB2 H 1.936 . . 576 591 56 ARG HB3 H 1.869 . 2 577 591 56 ARG HG2 H 1.738 . . 578 591 56 ARG HG3 H 1.601 . 2 579 591 56 ARG HD2 H 3.202 . 2 580 591 56 ARG HD3 H 3.202 . 2 581 591 56 ARG C C 179.785 . . 582 591 56 ARG CA C 59.462 . 1 583 591 56 ARG CB C 29.708 . 1 584 591 56 ARG CG C 39.975 . . 585 591 56 ARG CD C 40.041 . 1 586 591 56 ARG N N 123.309 . 1 587 592 57 LYS H H 8.281 . 1 588 592 57 LYS HA H 3.964 . 1 589 592 57 LYS HB2 H 1.997 . . 590 592 57 LYS HB3 H 2.262 . 2 591 592 57 LYS HG2 H 1.449 . 2 592 592 57 LYS HG3 H 1.449 . 2 593 592 57 LYS HD2 H 1.621 . 2 594 592 57 LYS HD3 H 1.621 . 2 595 592 57 LYS HE2 H 3.153 . . 596 592 57 LYS HE3 H 3.272 . 2 597 592 57 LYS C C 178.739 . . 598 592 57 LYS CA C 59.643 . 1 599 592 57 LYS CB C 33.012 . 1 600 592 57 LYS CG C 27.284 . 1 601 592 57 LYS N N 119.834 . 1 602 593 58 LEU H H 8.479 . 1 603 593 58 LEU HA H 3.825 . 1 604 593 58 LEU HB2 H 1.613 . . 605 593 58 LEU HB3 H 1.970 . 2 606 593 58 LEU HG H 0.941 . 1 607 593 58 LEU HD1 H 0.629 . . 608 593 58 LEU HD2 H 0.629 . . 609 593 58 LEU C C 179.579 . . 610 593 58 LEU CA C 58.032 . 1 611 593 58 LEU CB C 42.119 . 1 612 593 58 LEU N N 121.057 . 1 613 594 59 ALA H H 7.704 . 1 614 594 59 ALA HA H 4.148 . 1 615 594 59 ALA HB H 1.460 . 1 616 594 59 ALA C C 179.542 . . 617 594 59 ALA CA C 54.804 . 1 618 594 59 ALA CB C 18.081 . 1 619 594 59 ALA N N 120.701 . 1 620 595 60 ALA H H 7.699 . 1 621 595 60 ALA HA H 4.030 . 1 622 595 60 ALA HB H 0.634 . 1 623 595 60 ALA C C 179.834 . . 624 595 60 ALA CA C 54.702 . 1 625 595 60 ALA CB C 17.878 . 1 626 595 60 ALA N N 118.593 . 1 627 596 61 TYR H H 8.204 . 1 628 596 61 TYR HA H 5.361 . 1 629 596 61 TYR HB2 H 2.816 . . 630 596 61 TYR HB3 H 3.843 . 2 631 596 61 TYR HD1 H 7.031 . . 632 596 61 TYR HD2 H 7.031 . . 633 596 61 TYR HE1 H 6.541 . . 634 596 61 TYR HE2 H 6.541 . . 635 596 61 TYR C C 176.882 . . 636 596 61 TYR CA C 56.021 . 1 637 596 61 TYR CB C 40.758 . 1 638 596 61 TYR CD1 C 132.714 . . 639 596 61 TYR CD2 C 132.714 . . 640 596 61 TYR CE1 C 117.892 . . 641 596 61 TYR CE2 C 117.892 . . 642 596 61 TYR N N 112.428 . 1 643 597 62 GLY H H 8.212 . 1 644 597 62 GLY HA2 H 3.373 . . 645 597 62 GLY HA3 H 3.978 . 2 646 597 62 GLY C C 174.011 . . 647 597 62 GLY CA C 48.807 . 1 648 597 62 GLY N N 108.007 . 1 649 598 63 ASP H H 8.589 . 1 650 598 63 ASP HA H 4.307 . 1 651 598 63 ASP HB2 H 2.707 . 2 652 598 63 ASP HB3 H 2.707 . 2 653 598 63 ASP C C 179.400 . . 654 598 63 ASP CA C 58.150 . 1 655 598 63 ASP CB C 39.843 . 1 656 598 63 ASP N N 119.333 . 1 657 599 64 GLU H H 8.033 . 1 658 599 64 GLU HA H 3.949 . 1 659 599 64 GLU HB2 H 2.161 . 2 660 599 64 GLU HB3 H 2.161 . 2 661 599 64 GLU HG2 H 2.422 . . 662 599 64 GLU HG3 H 2.650 . 2 663 599 64 GLU C C 179.061 . . 664 599 64 GLU CA C 59.860 . 1 665 599 64 GLU CB C 29.949 . 1 666 599 64 GLU CG C 37.734 . 1 667 599 64 GLU N N 119.736 . 1 668 600 65 VAL H H 7.943 . 1 669 600 65 VAL HA H 2.611 . 1 670 600 65 VAL HB H 1.710 . 1 671 600 65 VAL HG1 H 0.454 . 2 672 600 65 VAL HG2 H 0.254 . 2 673 600 65 VAL C C 177.589 . . 674 600 65 VAL CA C 66.557 . 1 675 600 65 VAL CB C 30.962 . 1 676 600 65 VAL CG1 C 21.678 . 2 677 600 65 VAL CG2 C 22.755 . 2 678 600 65 VAL N N 119.541 . 1 679 601 66 LEU H H 8.236 . 1 680 601 66 LEU HA H 3.648 . 1 681 601 66 LEU HB2 H 1.164 . . 682 601 66 LEU HB3 H 1.719 . 2 683 601 66 LEU HG H 1.514 . 1 684 601 66 LEU HD1 H 0.343 . 2 685 601 66 LEU HD2 H 0.152 . 2 686 601 66 LEU C C 179.595 . . 687 601 66 LEU CA C 57.688 . 1 688 601 66 LEU CB C 40.360 . 1 689 601 66 LEU CG C 25.918 . 1 690 601 66 LEU CD1 C 22.329 . 2 691 601 66 LEU CD2 C 24.568 . 2 692 601 66 LEU N N 117.080 . 1 693 602 67 GLN H H 7.522 . 1 694 602 67 GLN HA H 3.814 . 1 695 602 67 GLN HB2 H 2.256 . 2 696 602 67 GLN HB3 H 2.256 . 2 697 602 67 GLN HG2 H 2.307 . 2 698 602 67 GLN HG3 H 2.307 . 2 699 602 67 GLN C C 176.797 . . 700 602 67 GLN CA C 58.616 . 1 701 602 67 GLN CB C 27.911 . 1 702 602 67 GLN N N 120.179 . 1 703 603 68 VAL H H 7.555 . 1 704 603 68 VAL HA H 3.625 . 1 705 603 68 VAL HB H 1.948 . 1 706 603 68 VAL HG1 H 0.825 . 2 707 603 68 VAL HG2 H 0.727 . 2 708 603 68 VAL C C 179.235 . . 709 603 68 VAL CA C 66.216 . 1 710 603 68 VAL CB C 31.248 . 1 711 603 68 VAL CG1 C 22.383 . . 712 603 68 VAL N N 120.566 . 1 713 604 69 VAL H H 7.842 . 1 714 604 69 VAL HA H 3.514 . 1 715 604 69 VAL HB H 2.109 . 1 716 604 69 VAL HG1 H 0.851 . 2 717 604 69 VAL HG2 H 0.687 . 2 718 604 69 VAL C C 179.489 . . 719 604 69 VAL CA C 66.221 . 1 720 604 69 VAL CB C 31.501 . 1 721 604 69 VAL CG1 C 21.035 . . 722 604 69 VAL N N 117.926 . 1 723 605 70 ARG H H 8.170 . 1 724 605 70 ARG HA H 4.269 . 1 725 605 70 ARG HB2 H 2.101 . . 726 605 70 ARG HB3 H 1.430 . 2 727 605 70 ARG HG2 H 1.997 . . 728 605 70 ARG HD2 H 3.168 . 2 729 605 70 ARG HD3 H 3.168 . 2 730 605 70 ARG C C 179.042 . . 731 605 70 ARG CA C 60.040 . 1 732 605 70 ARG CB C 30.911 . 1 733 605 70 ARG N N 121.237 . 1 734 606 71 ASP H H 8.507 . 1 735 606 71 ASP HA H 4.521 . 1 736 606 71 ASP HB2 H 2.739 . 2 737 606 71 ASP HB3 H 2.739 . 2 738 606 71 ASP C C 177.957 . . 739 606 71 ASP CA C 56.210 . 1 740 606 71 ASP CB C 40.419 . 1 741 606 71 ASP N N 119.059 . 1 742 607 72 SER H H 7.738 . 1 743 607 72 SER HA H 4.525 . 1 744 607 72 SER HB2 H 3.926 . 2 745 607 72 SER HB3 H 3.926 . 2 746 607 72 SER C C 174.969 . . 747 607 72 SER CA C 59.329 . 1 748 607 72 SER CB C 64.121 . 1 749 607 72 SER N N 114.635 . 1 750 608 73 SER H H 7.928 . 1 751 608 73 SER HA H 4.511 . 1 752 608 73 SER HB2 H 3.967 . 2 753 608 73 SER HB3 H 3.967 . 2 754 608 73 SER C C 174.899 . . 755 608 73 SER CA C 59.111 . 1 756 608 73 SER CB C 64.052 . 1 757 608 73 SER N N 116.611 . 1 758 609 74 GLY H H 8.350 . 1 759 609 74 GLY HA2 H 4.006 . . 760 609 74 GLY HA3 H 4.830 . 2 761 609 74 GLY C C 173.762 . . 762 609 74 GLY CA C 45.319 . 1 763 609 74 GLY N N 110.832 . 1 764 610 75 GLY H H 8.037 . 1 765 610 75 GLY HA2 H 3.768 . 2 766 610 75 GLY HA3 H 3.768 . 2 767 610 75 GLY CA C 45.895 . 1 768 610 75 GLY N N 115.224 . 1 stop_ save_