data_17552 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone resonance chemical shift assignments of Ph SAM linker ; _BMRB_accession_number 17552 _BMRB_flat_file_name bmr17552.str _Entry_type original _Submission_date 2011-03-28 _Accession_date 2011-03-28 _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 Ilangovan Udayar . . 2 Kim Chongwoo . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 98 "13C chemical shifts" 203 "15N chemical shifts" 98 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2012-05-10 original author . stop_ _Original_release_date 2012-05-10 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'The growth-suppressive function of the polycomb group protein polyhomeotic is mediated by polymerization of its sterile alpha motif (SAM) domain.' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 22275371 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Robinson Angela K. . 2 Leal Belinda Z. . 3 Chadwell Linda V. . 4 Wang Renjing . . 5 Ilangovan Udayar . . 6 Kaur Yogeet . . 7 Junco Sarah E. . 8 Schirf Virgil . . 9 Osmulski Pawel A. . 10 Gaczynska Maria . . 11 Hinck Andrew P. . 12 Demeler Borries . . 13 McEwen Donald G. . 14 Kim Chongwoo A. . stop_ _Journal_abbreviation 'J. Biol. Chem.' _Journal_name_full 'The Journal of biological chemistry' _Journal_volume 287 _Journal_issue 12 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 8702 _Page_last 8713 _Year 2012 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Ph SAM linker' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'Ph SAM linker' $Ph_SAM_Linker 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_Ph_SAM_Linker _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common Ph_SAM_Linker _Molecular_mass . _Mol_thiol_state 'not present' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 108 _Mol_residue_sequence ; GTRGVGSGETNGLGTGGIVG VDAMALVDRLDEAMAEEKMQ TEATPKLSESFILGASTEVP MSLPVQAAISALAAPLGSLS VALPTLAPLSVVTSGAAPKS SEVNGTDR ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1 GLY 2 2 THR 3 3 ARG 4 1397 GLY 5 1398 VAL 6 1399 GLY 7 1400 SER 8 1401 GLY 9 1402 GLU 10 1403 THR 11 1404 ASN 12 1405 GLY 13 1406 LEU 14 1407 GLY 15 1408 THR 16 1409 GLY 17 1410 GLY 18 1411 ILE 19 1412 VAL 20 1413 GLY 21 1414 VAL 22 1415 ASP 23 1416 ALA 24 1417 MET 25 1418 ALA 26 1419 LEU 27 1420 VAL 28 1421 ASP 29 1422 ARG 30 1423 LEU 31 1424 ASP 32 1425 GLU 33 1426 ALA 34 1427 MET 35 1428 ALA 36 1429 GLU 37 1430 GLU 38 1431 LYS 39 1432 MET 40 1433 GLN 41 1434 THR 42 1435 GLU 43 1436 ALA 44 1437 THR 45 1438 PRO 46 1439 LYS 47 1440 LEU 48 1441 SER 49 1442 GLU 50 1443 SER 51 1444 PHE 52 1446 ILE 53 1447 LEU 54 1448 GLY 55 1449 ALA 56 1450 SER 57 1451 THR 58 1452 GLU 59 1453 VAL 60 1455 PRO 61 1456 MET 62 1457 SER 63 1458 LEU 64 1459 PRO 65 1460 VAL 66 1461 GLN 67 1462 ALA 68 1463 ALA 69 1464 ILE 70 1465 SER 71 1466 ALA 72 1469 LEU 73 1470 ALA 74 1471 ALA 75 1473 PRO 76 1474 LEU 77 1475 GLY 78 1476 SER 79 1478 LEU 80 1479 SER 81 1480 VAL 82 1481 ALA 83 1482 LEU 84 1483 PRO 85 1484 THR 86 1485 LEU 87 1486 ALA 88 1487 PRO 89 1488 LEU 90 1489 SER 91 1490 VAL 92 1491 VAL 93 1492 THR 94 1493 SER 95 1494 GLY 96 1495 ALA 97 1496 ALA 98 1497 PRO 99 1498 LYS 100 1499 SER 101 1500 SER 102 1501 GLU 103 1502 VAL 104 1503 ASN 105 1504 GLY 106 1505 THR 107 1506 ASP 108 1507 ARG 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 $Ph_SAM_Linker '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 $Ph_SAM_Linker 'recombinant technology' . Escherichia coli . pET-3c 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 $Ph_SAM_Linker 1.5 mM '[U-100% 15N]' H2O 95 % 'natural abundance' D2O 5 % 'natural abundance' stop_ save_ save_sample_2 _Saveframe_category sample _Sample_type solution _Details . loop_ _Mol_label _Concentration_value _Concentration_value_units _Isotopic_labeling $Ph_SAM_Linker 1.5 mM '[U-100% 13C; U-100% 15N]' H2O 95 % 'natural abundance' D2O 5 % 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_TOPSPIN _Saveframe_category software _Name TOPSPIN _Version 2.1 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_NMRDraw _Saveframe_category software _Name NMRDraw _Version . loop_ _Vendor _Address _Electronic_address 'Delaglio, Grzesiek, Vuister, Zhu, Pfeifer and Bax' . . stop_ loop_ _Task 'Spectral Visualization' stop_ _Details . save_ save_SPARKY _Saveframe_category software _Name SPARKY _Version . loop_ _Vendor _Address _Electronic_address Goddard . . stop_ loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength 700 _Details . save_ save_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model DRX _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_CBCA(CO)NH_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_2 save_ save_3D_HNCACB_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_2 save_ save_3D_CBCANH_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCANH' _Sample_label $sample_2 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' 0.05 . M pH 5 . pH pressure 1 . atm temperature 300 . 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 . indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 . 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 CBCA(CO)NH' '3D HNCACB' '3D CBCANH' stop_ loop_ _Sample_label $sample_1 $sample_2 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chemical_shift_reference_1 _Mol_system_component_name 'Ph SAM linker' _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 1 1 GLY CA C 43.130 . 1 2 2 2 THR H H 8.408 . 1 3 2 2 THR CA C 61.784 . 1 4 2 2 THR CB C 69.678 . 1 5 2 2 THR N N 114.165 . 1 6 3 3 ARG H H 8.358 . 1 7 3 3 ARG CA C 56.133 . 1 8 3 3 ARG CB C 30.496 . 1 9 3 3 ARG N N 123.733 . 1 10 1397 4 GLY H H 8.283 . 1 11 1397 4 GLY CA C 44.899 . 1 12 1397 4 GLY N N 110.561 . 1 13 1398 5 VAL H H 7.839 . 1 14 1398 5 VAL CA C 62.378 . 1 15 1398 5 VAL CB C 32.428 . 1 16 1398 5 VAL N N 119.052 . 1 17 1399 6 GLY H H 8.309 . 1 18 1399 6 GLY CA C 44.959 . 1 19 1399 6 GLY N N 112.922 . 1 20 1400 7 SER H H 8.128 . 1 21 1400 7 SER CA C 58.171 . 1 22 1400 7 SER CB C 63.636 . 1 23 1400 7 SER N N 115.684 . 1 24 1401 8 GLY H H 8.243 . 1 25 1401 8 GLY CA C 45.073 . 1 26 1401 8 GLY N N 111.021 . 1 27 1402 9 GLU H H 8.096 . 1 28 1402 9 GLU CA C 56.339 . 1 29 1402 9 GLU CB C 29.834 . 1 30 1402 9 GLU N N 120.281 . 1 31 1403 10 THR H H 8.084 . 1 32 1403 10 THR CA C 61.682 . 1 33 1403 10 THR CB C 69.530 . 1 34 1403 10 THR N N 114.443 . 1 35 1404 11 ASN H H 8.295 . 1 36 1404 11 ASN CA C 53.202 . 1 37 1404 11 ASN CB C 38.567 . 1 38 1404 11 ASN N N 120.719 . 1 39 1405 12 GLY H H 8.203 . 1 40 1405 12 GLY CA C 45.448 . 1 41 1405 12 GLY N N 108.919 . 1 42 1406 13 LEU H H 7.963 . 1 43 1406 13 LEU CA C 55.060 . 1 44 1406 13 LEU CB C 42.096 . 1 45 1406 13 LEU N N 121.224 . 1 46 1407 14 GLY H H 8.299 . 1 47 1407 14 GLY CA C 45.387 . 1 48 1407 14 GLY N N 109.384 . 1 49 1408 15 THR H H 7.921 . 1 50 1408 15 THR CA C 61.737 . 1 51 1408 15 THR CB C 69.512 . 1 52 1408 15 THR N N 112.600 . 1 53 1409 16 GLY H H 8.355 . 1 54 1409 16 GLY CA C 45.227 . 1 55 1409 16 GLY N N 111.091 . 1 56 1410 17 GLY H H 8.054 . 1 57 1410 17 GLY CA C 44.911 . 1 58 1410 17 GLY N N 108.476 . 1 59 1411 18 ILE H H 7.884 . 1 60 1411 18 ILE CA C 60.825 . 1 61 1411 18 ILE CB C 38.402 . 1 62 1411 18 ILE N N 120.385 . 1 63 1412 19 VAL H H 8.108 . 1 64 1412 19 VAL CA C 62.375 . 1 65 1412 19 VAL CB C 32.369 . 1 66 1412 19 VAL N N 125.164 . 1 67 1413 20 GLY H H 8.427 . 1 68 1413 20 GLY CA C 44.896 . 1 69 1413 20 GLY N N 112.814 . 1 70 1414 21 VAL H H 7.952 . 1 71 1414 21 VAL CA C 62.361 . 1 72 1414 21 VAL CB C 32.408 . 1 73 1414 21 VAL N N 119.275 . 1 74 1415 22 ASP H H 8.240 . 1 75 1415 22 ASP CA C 54.088 . 1 76 1415 22 ASP CB C 40.673 . 1 77 1415 22 ASP N N 123.161 . 1 78 1416 23 ALA H H 8.052 . 1 79 1416 23 ALA CA C 52.998 . 1 80 1416 23 ALA CB C 18.774 . 1 81 1416 23 ALA N N 124.638 . 1 82 1417 24 MET H H 8.036 . 1 83 1417 24 MET CA C 55.495 . 1 84 1417 24 MET CB C 32.089 . 1 85 1417 24 MET N N 117.897 . 1 86 1418 25 ALA H H 7.831 . 1 87 1418 25 ALA CA C 52.406 . 1 88 1418 25 ALA CB C 18.715 . 1 89 1418 25 ALA N N 123.942 . 1 90 1419 26 LEU H H 7.867 . 1 91 1419 26 LEU CA C 55.269 . 1 92 1419 26 LEU CB C 41.794 . 1 93 1419 26 LEU N N 120.668 . 1 94 1420 27 VAL H H 7.710 . 1 95 1420 27 VAL CA C 62.442 . 1 96 1420 27 VAL CB C 32.477 . 1 97 1420 27 VAL N N 119.789 . 1 98 1421 28 ASP H H 8.115 . 1 99 1421 28 ASP CA C 54.196 . 1 100 1421 28 ASP CB C 40.582 . 1 101 1421 28 ASP N N 123.063 . 1 102 1422 29 ARG H H 7.993 . 1 103 1422 29 ARG CA C 56.142 . 1 104 1422 29 ARG CB C 30.348 . 1 105 1422 29 ARG N N 121.148 . 1 106 1423 30 LEU H H 8.123 . 1 107 1423 30 LEU CA C 55.738 . 1 108 1423 30 LEU CB C 41.751 . 1 109 1423 30 LEU N N 122.945 . 1 110 1424 31 ASP H H 8.118 . 1 111 1424 31 ASP CA C 54.397 . 1 112 1424 31 ASP CB C 40.352 . 1 113 1424 31 ASP N N 120.424 . 1 114 1425 32 GLU H H 8.081 . 1 115 1425 32 GLU CA C 57.088 . 1 116 1425 32 GLU CB C 29.318 . 1 117 1425 32 GLU N N 121.379 . 1 118 1426 33 ALA H H 8.029 . 1 119 1426 33 ALA CA C 53.086 . 1 120 1426 33 ALA CB C 18.430 . 1 121 1426 33 ALA N N 123.586 . 1 122 1427 34 MET H H 7.982 . 1 123 1427 34 MET CA C 55.833 . 1 124 1427 34 MET CB C 32.430 . 1 125 1427 34 MET N N 118.559 . 1 126 1428 35 ALA H H 7.944 . 1 127 1428 35 ALA CA C 52.811 . 1 128 1428 35 ALA CB C 18.631 . 1 129 1428 35 ALA N N 124.279 . 1 130 1429 36 GLU H H 8.074 . 1 131 1429 36 GLU CA C 56.907 . 1 132 1429 36 GLU CB C 29.510 . 1 133 1429 36 GLU N N 119.319 . 1 134 1430 37 GLU H H 8.101 . 1 135 1430 37 GLU CA C 56.882 . 1 136 1430 37 GLU CB C 29.276 . 1 137 1430 37 GLU N N 121.311 . 1 138 1431 38 LYS H H 8.013 . 1 139 1431 38 LYS CA C 56.389 . 1 140 1431 38 LYS CB C 32.609 . 1 141 1431 38 LYS N N 121.405 . 1 142 1432 39 MET H H 8.031 . 1 143 1432 39 MET CA C 55.681 . 1 144 1432 39 MET CB C 32.425 . 1 145 1432 39 MET N N 120.507 . 1 146 1433 40 GLN H H 8.161 . 1 147 1433 40 GLN CA C 55.821 . 1 148 1433 40 GLN CB C 28.994 . 1 149 1433 40 GLN N N 121.140 . 1 150 1434 41 THR H H 7.997 . 1 151 1434 41 THR CA C 61.899 . 1 152 1434 41 THR CB C 69.671 . 1 153 1434 41 THR N N 115.230 . 1 154 1435 42 GLU H H 8.130 . 1 155 1435 42 GLU CA C 56.223 . 1 156 1435 42 GLU CB C 29.820 . 1 157 1435 42 GLU N N 125.073 . 1 158 1436 43 ALA H H 8.130 . 1 159 1436 43 ALA CA C 52.232 . 1 160 1436 43 ALA CB C 18.960 . 1 161 1436 43 ALA N N 125.100 . 1 162 1437 44 THR H H 7.941 . 1 163 1437 44 THR CA C 59.725 . 1 164 1437 44 THR CB C 69.512 . 1 165 1437 44 THR N N 116.195 . 1 166 1438 45 PRO CA C 63.043 . 1 167 1438 45 PRO CB C 31.744 . 1 168 1439 46 LYS H H 8.261 . 1 169 1439 46 LYS CA C 55.918 . 1 170 1439 46 LYS CB C 32.741 . 1 171 1439 46 LYS N N 122.124 . 1 172 1440 47 LEU H H 8.183 . 1 173 1440 47 LEU CA C 55.013 . 1 174 1440 47 LEU CB C 42.051 . 1 175 1440 47 LEU N N 124.248 . 1 176 1441 48 SER H H 8.121 . 1 177 1441 48 SER CA C 58.255 . 1 178 1441 48 SER CB C 63.591 . 1 179 1441 48 SER N N 116.323 . 1 180 1442 49 GLU H H 8.171 . 1 181 1442 49 GLU CA C 55.723 . 1 182 1442 49 GLU CB C 31.719 . 1 183 1442 49 GLU N N 122.479 . 1 184 1443 50 SER H H 8.111 . 1 185 1443 50 SER CA C 57.845 . 1 186 1443 50 SER CB C 63.621 . 1 187 1443 50 SER N N 117.235 . 1 188 1444 51 PHE H H 7.979 . 1 189 1444 51 PHE CA C 55.470 . 1 190 1444 51 PHE CB C 38.774 . 1 191 1444 51 PHE N N 122.676 . 1 192 1446 52 ILE H H 8.213 . 1 193 1446 52 ILE CA C 60.917 . 1 194 1446 52 ILE CB C 38.225 . 1 195 1446 52 ILE N N 126.996 . 1 196 1447 53 LEU H H 8.213 . 1 197 1447 53 LEU CA C 54.933 . 1 198 1447 53 LEU CB C 42.060 . 1 199 1447 53 LEU N N 126.995 . 1 200 1448 54 GLY H H 8.237 . 1 201 1448 54 GLY CA C 44.908 . 1 202 1448 54 GLY N N 110.182 . 1 203 1449 55 ALA H H 7.964 . 1 204 1449 55 ALA CA C 52.132 . 1 205 1449 55 ALA CB C 19.184 . 1 206 1449 55 ALA N N 123.451 . 1 207 1450 56 SER H H 8.226 . 1 208 1450 56 SER CA C 58.064 . 1 209 1450 56 SER CB C 63.536 . 1 210 1450 56 SER N N 115.161 . 1 211 1451 57 THR H H 8.005 . 1 212 1451 57 THR CA C 61.627 . 1 213 1451 57 THR CB C 69.418 . 1 214 1451 57 THR N N 115.537 . 1 215 1452 58 GLU H H 8.135 . 1 216 1452 58 GLU CA C 56.125 . 1 217 1452 58 GLU CB C 29.824 . 1 218 1452 58 GLU N N 123.271 . 1 219 1453 59 VAL H H 8.073 . 1 220 1453 59 VAL CA C 59.672 . 1 221 1453 59 VAL CB C 32.250 . 1 222 1453 59 VAL N N 123.609 . 1 223 1455 60 PRO CA C 62.749 . 1 224 1455 60 PRO CB C 31.611 . 1 225 1456 61 MET H H 8.235 . 1 226 1456 61 MET CA C 55.883 . 1 227 1456 61 MET CB C 32.800 . 1 228 1456 61 MET N N 120.108 . 1 229 1457 62 SER H H 8.253 . 1 230 1457 62 SER CA C 58.008 . 1 231 1457 62 SER CB C 63.599 . 1 232 1457 62 SER N N 117.344 . 1 233 1458 63 LEU H H 8.067 . 1 234 1458 63 LEU CA C 52.832 . 1 235 1458 63 LEU CB C 41.535 . 1 236 1458 63 LEU N N 125.264 . 1 237 1459 64 PRO CA C 62.840 . 1 238 1459 64 PRO CB C 31.665 . 1 239 1460 65 VAL H H 8.035 . 1 240 1460 65 VAL CA C 62.301 . 1 241 1460 65 VAL CB C 32.288 . 1 242 1460 65 VAL N N 120.723 . 1 243 1461 66 GLN H H 8.273 . 1 244 1461 66 GLN CA C 55.410 . 1 245 1461 66 GLN CB C 29.347 . 1 246 1461 66 GLN N N 124.462 . 1 247 1462 67 ALA H H 8.173 . 1 248 1462 67 ALA CA C 52.196 . 1 249 1462 67 ALA CB C 19.010 . 1 250 1462 67 ALA N N 126.002 . 1 251 1463 68 ALA H H 8.102 . 1 252 1463 68 ALA CA C 52.066 . 1 253 1463 68 ALA CB C 18.878 . 1 254 1463 68 ALA N N 123.484 . 1 255 1464 69 ILE H H 7.944 . 1 256 1464 69 ILE CA C 60.814 . 1 257 1464 69 ILE CB C 38.660 . 1 258 1464 69 ILE N N 120.156 . 1 259 1465 70 SER H H 8.148 . 1 260 1465 70 SER CA C 57.762 . 1 261 1465 70 SER CB C 63.621 . 1 262 1465 70 SER N N 120.119 . 1 263 1466 71 ALA H H 8.118 . 1 264 1466 71 ALA CA C 50.178 . 1 265 1466 71 ALA CB C 17.853 . 1 266 1466 71 ALA N N 127.311 . 1 267 1469 72 LEU CA C 54.545 . 1 268 1469 72 LEU CB C 41.999 . 1 269 1470 73 ALA H H 7.957 . 1 270 1470 73 ALA CA C 51.843 . 1 271 1470 73 ALA CB C 18.875 . 1 272 1470 73 ALA N N 124.650 . 1 273 1471 74 ALA H H 7.956 . 1 274 1471 74 ALA CA C 51.843 . 1 275 1471 74 ALA CB C 18.875 . 1 276 1471 74 ALA N N 124.640 . 1 277 1473 75 PRO CA C 62.695 . 1 278 1473 75 PRO CB C 31.737 . 1 279 1474 76 LEU H H 8.168 . 1 280 1474 76 LEU CA C 55.145 . 1 281 1474 76 LEU CB C 42.041 . 1 282 1474 76 LEU N N 122.026 . 1 283 1475 77 GLY H H 8.251 . 1 284 1475 77 GLY CA C 44.791 . 1 285 1475 77 GLY N N 109.844 . 1 286 1476 78 SER H H 7.929 . 1 287 1476 78 SER CA C 56.237 . 1 288 1476 78 SER CB C 63.273 . 1 289 1476 78 SER N N 116.540 . 1 290 1478 79 LEU CA C 55.037 . 1 291 1478 79 LEU CB C 41.947 . 1 292 1479 80 SER H H 7.996 . 1 293 1479 80 SER CA C 58.039 . 1 294 1479 80 SER CB C 63.549 . 1 295 1479 80 SER N N 116.385 . 1 296 1480 81 VAL H H 7.837 . 1 297 1480 81 VAL CA C 61.723 . 1 298 1480 81 VAL CB C 32.689 . 1 299 1480 81 VAL N N 121.391 . 1 300 1481 82 ALA H H 8.104 . 1 301 1481 82 ALA CA C 51.782 . 1 302 1481 82 ALA CB C 18.885 . 1 303 1481 82 ALA N N 127.665 . 1 304 1482 83 LEU H H 8.051 . 1 305 1482 83 LEU CA C 52.560 . 1 306 1482 83 LEU CB C 41.343 . 1 307 1482 83 LEU N N 123.242 . 1 308 1483 84 PRO CA C 62.898 . 1 309 1483 84 PRO CB C 31.718 . 1 310 1484 85 THR H H 8.013 . 1 311 1484 85 THR CA C 61.755 . 1 312 1484 85 THR CB C 69.594 . 1 313 1484 85 THR N N 114.845 . 1 314 1485 86 LEU H H 8.057 . 1 315 1485 86 LEU CA C 54.517 . 1 316 1485 86 LEU CB C 42.292 . 1 317 1485 86 LEU N N 125.117 . 1 318 1486 87 ALA H H 8.089 . 1 319 1486 87 ALA CA C 50.220 . 1 320 1486 87 ALA CB C 17.639 . 1 321 1486 87 ALA N N 126.658 . 1 322 1487 88 PRO CA C 63.170 . 1 323 1487 88 PRO CB C 31.743 . 1 324 1488 89 LEU H H 7.965 . 1 325 1488 89 LEU CA C 54.976 . 1 326 1488 89 LEU CB C 42.000 . 1 327 1488 89 LEU N N 121.376 . 1 328 1489 90 SER H H 8.078 . 1 329 1489 90 SER CA C 57.898 . 1 330 1489 90 SER CB C 63.600 . 1 331 1489 90 SER N N 116.580 . 1 332 1490 91 VAL H H 7.954 . 1 333 1490 91 VAL CA C 62.078 . 1 334 1490 91 VAL CB C 32.505 . 1 335 1490 91 VAL N N 121.997 . 1 336 1491 92 VAL H H 8.093 . 1 337 1491 92 VAL CA C 62.217 . 1 338 1491 92 VAL CB C 32.391 . 1 339 1491 92 VAL N N 124.336 . 1 340 1492 93 THR H H 8.113 . 1 341 1492 93 THR CA C 61.474 . 1 342 1492 93 THR CB C 69.618 . 1 343 1492 93 THR N N 118.325 . 1 344 1493 94 SER H H 8.157 . 1 345 1493 94 SER CA C 58.205 . 1 346 1493 94 SER CB C 63.634 . 1 347 1493 94 SER N N 118.105 . 1 348 1494 95 GLY H H 8.357 . 1 349 1494 95 GLY CA C 45.041 . 1 350 1494 95 GLY N N 110.820 . 1 351 1495 96 ALA H H 7.888 . 1 352 1495 96 ALA CA C 51.778 . 1 353 1495 96 ALA CB C 19.106 . 1 354 1495 96 ALA N N 123.441 . 1 355 1496 97 ALA H H 8.112 . 1 356 1496 97 ALA CA C 50.250 . 1 357 1496 97 ALA CB C 17.622 . 1 358 1496 97 ALA N N 125.026 . 1 359 1497 98 PRO CA C 62.671 . 1 360 1497 98 PRO CB C 31.768 . 1 361 1498 99 LYS H H 8.257 . 1 362 1498 99 LYS CA C 55.950 . 1 363 1498 99 LYS CB C 31.762 . 1 364 1498 99 LYS N N 117.448 . 1 365 1499 100 SER H H 8.256 . 1 366 1499 100 SER CA C 58.498 . 1 367 1499 100 SER CB C 63.496 . 1 368 1499 100 SER N N 117.443 . 1 369 1500 101 SER H H 8.216 . 1 370 1500 101 SER CA C 58.245 . 1 371 1500 101 SER CB C 63.560 . 1 372 1500 101 SER N N 117.518 . 1 373 1501 102 GLU H H 7.961 . 1 374 1501 102 GLU CA C 56.196 . 1 375 1501 102 GLU CB C 29.742 . 1 376 1501 102 GLU N N 120.689 . 1 377 1502 103 VAL H H 7.961 . 1 378 1502 103 VAL CA C 62.268 . 1 379 1502 103 VAL CB C 32.356 . 1 380 1502 103 VAL N N 120.698 . 1 381 1503 104 ASN H H 8.364 . 1 382 1503 104 ASN CA C 53.066 . 1 383 1503 104 ASN CB C 38.863 . 1 384 1503 104 ASN N N 122.056 . 1 385 1504 105 GLY H H 8.199 . 1 386 1504 105 GLY CA C 45.265 . 1 387 1504 105 GLY N N 109.369 . 1 388 1505 106 THR H H 7.910 . 1 389 1505 106 THR CA C 62.799 . 1 390 1505 106 THR CB C 69.612 . 1 391 1505 106 THR N N 112.661 . 1 392 1506 107 ASP H H 8.243 . 1 393 1506 107 ASP CA C 54.460 . 1 394 1506 107 ASP CB C 40.928 . 1 395 1506 107 ASP N N 122.689 . 1 396 1507 108 ARG H H 7.646 . 1 397 1507 108 ARG CA C 56.987 . 1 398 1507 108 ARG CB C 31.272 . 1 399 1507 108 ARG N N 125.448 . 1 stop_ save_