data_16256 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Drosha RNA Binding Domain ; _BMRB_accession_number 16256 _BMRB_flat_file_name bmr16256.str _Entry_type original _Submission_date 2009-04-13 _Accession_date 2009-04-13 _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 Mueller Geoffrey A. . 2 Miller Matthew . . 3 Ghosh Mahua . . 4 DeRose Eugene F. . 5 London Robert E. . 6 Hall Traci . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 399 "13C chemical shifts" 244 "15N chemical shifts" 68 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2013-07-30 update BMRB 'delete of shift 18 LEU C 0.000' 2010-11-03 update BMRB 'correct residue number' 2010-05-28 update BMRB 'edit entity/assembly name' 2010-04-01 original author 'original release' stop_ save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title 'Solution structure of the Drosha double-stranded RNA-binding domain' _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 20226070 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Mueller Geoffrey . . 2 Miller Matthew . . 3 DeRose Eugene . . 4 Ghosh Mahua . . 5 London Robert . . 6 Hall Traci . . stop_ _Journal_abbreviation Silence _Journal_volume 1 _Journal_issue 2 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 2 _Page_last . _Year 2010 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name Drosha _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label 'binding domain' $entity 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_entity _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common 'binding domain' _Molecular_mass 8761.069 _Mol_thiol_state unknown _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 90 _Mol_residue_sequence ; GSPQFMLNQDWNDPKSQLQQ CCLTLRTEGKEPDIPLYKTL QTVGPSHARTYTVAVYFKGE RIGCGKGPSIQQAEMGAAMD ALEKYNFPQM ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 1248 GLY 2 1249 SER 3 1250 PRO 4 1251 GLN 5 1252 PHE 6 1253 MET 7 1254 LEU 8 1255 ASN 9 1256 GLN 10 1257 ASP 11 1258 TRP 12 1259 ASN 13 1260 ASP 14 1261 PRO 15 1262 LYS 16 1263 SER 17 1264 GLN 18 1265 LEU 19 1266 GLN 20 1267 GLN 21 1268 CYS 22 1269 CYS 23 1270 LEU 24 1271 THR 25 1272 LEU 26 1273 ARG 27 1274 THR 28 1275 GLU 29 1276 GLY 30 1277 LYS 31 1278 GLU 32 1279 PRO 33 1280 ASP 34 1281 ILE 35 1282 PRO 36 1283 LEU 37 1284 TYR 38 1285 LYS 39 1286 THR 40 1287 LEU 41 1288 GLN 42 1289 THR 43 1290 VAL 44 1291 GLY 45 1292 PRO 46 1293 SER 47 1294 HIS 48 1295 ALA 49 1296 ARG 50 1297 THR 51 1298 TYR 52 1299 THR 53 1300 VAL 54 1301 ALA 55 1302 VAL 56 1303 TYR 57 1304 PHE 58 1305 LYS 59 1306 GLY 60 1307 GLU 61 1308 ARG 62 1309 ILE 63 1310 GLY 64 1311 CYS 65 1312 GLY 66 1313 LYS 67 1314 GLY 68 1315 PRO 69 1316 SER 70 1317 ILE 71 1318 GLN 72 1319 GLN 73 1320 ALA 74 1321 GLU 75 1322 MET 76 1323 GLY 77 1324 ALA 78 1325 ALA 79 1326 MET 80 1327 ASP 81 1328 ALA 82 1329 LEU 83 1330 GLU 84 1331 LYS 85 1332 TYR 86 1333 ASN 87 1334 PHE 88 1335 PRO 89 1336 GLN 90 1337 MET stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date 2015-07-08 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 PDB 2KHX "Drosha Double-Stranded Rna Binding Motif" 87.78 85 100.00 100.00 2.53e-51 DBJ BAA91511 "unnamed protein product [Homo sapiens]" 96.67 769 97.70 100.00 1.12e-52 DBJ BAB22917 "unnamed protein product [Mus musculus]" 96.67 134 97.70 100.00 4.87e-57 DBJ BAE25729 "unnamed protein product [Mus musculus]" 96.67 1373 97.70 100.00 2.87e-51 DBJ BAE28629 "unnamed protein product [Mus musculus]" 96.67 1373 97.70 100.00 2.87e-51 DBJ BAO93839 "ribonuclease, partial [Bubalus bubalis]" 96.67 129 97.70 100.00 2.95e-57 EMBL CAG32380 "hypothetical protein RCJMB04_24a21 [Gallus gallus]" 96.67 1336 97.70 100.00 1.26e-51 EMBL CBN82191 "Ribonuclease 3 [Dicentrarchus labrax]" 72.22 1569 96.92 100.00 7.52e-36 EMBL CDQ74551 "unnamed protein product [Oncorhynchus mykiss]" 90.00 323 97.53 100.00 9.17e-50 GB AAD29637 "putative ribonuclease III [Homo sapiens]" 96.67 541 97.70 100.00 4.12e-55 GB AAF80558 "ribonuclease III [Homo sapiens]" 96.67 1374 97.70 100.00 2.90e-51 GB AAH41162 "RNASEN protein, partial [Homo sapiens]" 96.67 722 97.70 100.00 9.84e-53 GB AAH50057 "Rnasen protein, partial [Mus musculus]" 96.67 705 97.70 100.00 7.08e-53 GB AAH55696 "Rnasen protein, partial [Mus musculus]" 96.67 780 97.70 100.00 1.26e-52 REF NP_001006379 "ribonuclease 3 [Gallus gallus]" 96.67 1336 97.70 100.00 1.26e-51 REF NP_001093882 "ribonuclease 3 isoform 2 [Homo sapiens]" 96.67 1337 97.70 100.00 3.02e-51 REF NP_001101125 "ribonuclease 3 [Rattus norvegicus]" 96.67 1373 97.70 100.00 3.20e-51 REF NP_001103942 "ribonuclease 3 [Danio rerio]" 96.67 1289 97.70 100.00 2.32e-51 REF NP_001107152 "ribonuclease 3 [Xenopus (Silurana) tropicalis]" 96.67 1325 97.70 100.00 1.84e-51 SP Q5HZJ0 "RecName: Full=Ribonuclease 3; AltName: Full=Protein Drosha; AltName: Full=Ribonuclease III; Short=RNase III" 96.67 1373 97.70 100.00 2.87e-51 SP Q9NRR4 "RecName: Full=Ribonuclease 3; AltName: Full=Protein Drosha; AltName: Full=Ribonuclease III; Short=RNase III; AltName: Full=p241" 96.67 1374 97.70 100.00 2.82e-51 TPG DAA17862 "TPA: ribonuclease III, nuclear-like isoform 1 [Bos taurus]" 96.67 1367 97.70 100.00 3.33e-51 TPG DAA17863 "TPA: ribonuclease III, nuclear-like isoform 2 [Bos taurus]" 96.67 1330 97.70 100.00 2.69e-51 stop_ save_ #################### # Natural source # #################### save_natural_source _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_name $entity 'recombinant technology' . Escherichia coli . pet21c 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 _Concentration_min_value _Concentration_max_value _Isotopic_labeling $entity . mM 1 2 '[U-99% 13C; U-99% 15N]' TRIS 25 mM . . [U-2H] 'potassium chloride' 100 mM . . 'natural abundance' DTT 1 mM . . [U-2H] EDTA 1 mM . . 'natural abundance' DSS 10 uM . . 'natural abundance' 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 processing stop_ _Details . save_ save_NMRView _Saveframe_category software _Name NMRView _Version . loop_ _Vendor _Address _Electronic_address 'Johnson, One Moon Scientific' . . stop_ loop_ _Task 'chemical shift assignment' stop_ _Details . save_ save_CYANA _Saveframe_category software _Name CYANA _Version . loop_ _Vendor _Address _Electronic_address 'Guntert, Mumenthaler and Wuthrich' . . stop_ loop_ _Task 'structure solution' stop_ _Details . save_ save_X-PLOR_NIH _Saveframe_category software _Name 'X-PLOR NIH' _Version . loop_ _Vendor _Address _Electronic_address 'Schwieters, Kuszewski, Tjandra and Clore' . . 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_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_2D_1H-13C_HSQC_2 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-13C HSQC' _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_HNCACB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_H(CCO)NH_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D H(CCO)NH' _Sample_label $sample_1 save_ save_3D_C(CO)NH_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D C(CO)NH' _Sample_label $sample_1 save_ save_CN-4D_simultaneous_NOESY_8 _Saveframe_category NMR_applied_experiment _Experiment_name 'CN-4D simultaneous NOESY' _Sample_label $sample_1 save_ save_HB-HE/HD-aromatic_9 _Saveframe_category NMR_applied_experiment _Experiment_name HB-HE/HD-aromatic _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' 0.125 . M pH 7.0 . pH pressure 1.0 . atm temperature 298 . 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 internal indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0 internal direct . . . 1 DSS N 15 'methyl protons' ppm 0 internal 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' '2D 1H-13C HSQC' '3D HNCO' '3D CBCA(CO)NH' '3D HNCACB' '3D H(CCO)NH' '3D C(CO)NH' 'CN-4D simultaneous NOESY' HB-HE/HD-aromatic 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 'binding domain' _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 1263 16 SER HA H 4.204 . 1 2 1263 16 SER HB2 H 3.884 . 1 3 1263 16 SER HB3 H 3.884 . 1 4 1263 16 SER CA C 61.754 . 1 5 1263 16 SER CB C 61.982 . 1 6 1264 17 GLN H H 8.379 . 1 7 1264 17 GLN HA H 4.014 . 1 8 1264 17 GLN HE21 H 7.216 . 1 9 1264 17 GLN HE22 H 7.422 . 1 10 1264 17 GLN HG2 H 2.306 . 1 11 1264 17 GLN HG3 H 2.306 . 1 12 1264 17 GLN CA C 59.068 . 1 13 1264 17 GLN CB C 28.906 . 1 14 1264 17 GLN CG C 33.679 . 1 15 1264 17 GLN N N 122.081 . 1 16 1264 17 GLN NE2 N 111.310 . 1 17 1265 18 LEU H H 8.614 . 1 18 1265 18 LEU HA H 3.944 . 1 19 1265 18 LEU HB2 H 2.006 . 2 20 1265 18 LEU HB3 H 1.450 . 2 21 1265 18 LEU HD1 H 0.772 . 2 22 1265 18 LEU HD2 H 0.909 . 2 23 1265 18 LEU HG H 1.429 . 1 24 1265 18 LEU CA C 58.313 . 1 25 1265 18 LEU CB C 41.196 . 1 26 1265 18 LEU CD1 C 23.790 . 2 27 1265 18 LEU CD2 C 26.883 . 2 28 1265 18 LEU CG C 27.293 . 1 29 1265 18 LEU N N 120.354 . 1 30 1266 19 GLN H H 7.907 . 1 31 1266 19 GLN HB2 H 2.148 . 2 32 1266 19 GLN HB3 H 2.262 . 2 33 1266 19 GLN CA C 60.725 . 1 34 1266 19 GLN CB C 28.125 . 1 35 1266 19 GLN N N 119.071 . 1 36 1267 20 GLN HA H 3.983 . 1 37 1267 20 GLN HB2 H 2.160 . 2 38 1267 20 GLN HB3 H 2.140 . 2 39 1267 20 GLN HG2 H 2.410 . 2 40 1267 20 GLN HG3 H 2.450 . 2 41 1267 20 GLN CA C 59.043 . 1 42 1267 20 GLN CB C 28.390 . 1 43 1267 20 GLN CG C 33.747 . 1 44 1268 21 CYS H H 8.165 . 1 45 1268 21 CYS HA H 3.910 . 1 46 1268 21 CYS HB2 H 1.830 . 2 47 1268 21 CYS HB3 H 2.406 . 2 48 1268 21 CYS CA C 63.270 . 1 49 1268 21 CYS CB C 26.042 . 1 50 1268 21 CYS N N 118.288 . 1 51 1269 22 CYS H H 8.057 . 1 52 1269 22 CYS HA H 3.822 . 1 53 1269 22 CYS HB2 H 2.448 . 2 54 1269 22 CYS HB3 H 2.700 . 2 55 1269 22 CYS CA C 64.012 . 1 56 1269 22 CYS CB C 27.328 . 1 57 1269 22 CYS N N 117.737 . 1 58 1270 23 LEU H H 7.899 . 1 59 1270 23 LEU HA H 4.265 . 1 60 1270 23 LEU HB2 H 1.878 . 1 61 1270 23 LEU HB3 H 1.878 . 1 62 1270 23 LEU HD1 H 0.930 . 1 63 1270 23 LEU HD2 H 0.930 . 1 64 1270 23 LEU HG H 1.680 . 1 65 1270 23 LEU CA C 57.448 . 1 66 1270 23 LEU CB C 41.984 . 1 67 1270 23 LEU CD1 C 23.528 . 2 68 1270 23 LEU CD2 C 25.208 . 2 69 1270 23 LEU CG C 27.275 . 1 70 1270 23 LEU N N 120.640 . 1 71 1271 24 THR H H 7.537 . 1 72 1271 24 THR HA H 4.315 . 1 73 1271 24 THR HB H 4.261 . 1 74 1271 24 THR HG2 H 1.359 . 1 75 1271 24 THR CA C 63.845 . 1 76 1271 24 THR CB C 69.648 . 1 77 1271 24 THR CG2 C 21.792 . 1 78 1271 24 THR N N 110.288 . 1 79 1272 25 LEU H H 7.410 . 1 80 1272 25 LEU HA H 4.515 . 1 81 1272 25 LEU HB2 H 1.902 . 2 82 1272 25 LEU HB3 H 2.017 . 2 83 1272 25 LEU HD1 H 0.907 . 2 84 1272 25 LEU HD2 H 1.103 . 2 85 1272 25 LEU HG H 1.850 . 1 86 1272 25 LEU CA C 54.734 . 1 87 1272 25 LEU CB C 41.691 . 1 88 1272 25 LEU CD1 C 23.590 . 2 89 1272 25 LEU CD2 C 26.169 . 2 90 1272 25 LEU CG C 27.107 . 1 91 1272 25 LEU N N 121.830 . 1 92 1273 26 ARG H H 7.707 . 1 93 1273 26 ARG HA H 4.511 . 1 94 1273 26 ARG HB2 H 1.950 . 1 95 1273 26 ARG HB3 H 1.950 . 1 96 1273 26 ARG HD2 H 3.214 . 1 97 1273 26 ARG HD3 H 3.214 . 1 98 1273 26 ARG HG2 H 1.643 . 1 99 1273 26 ARG HG3 H 1.643 . 1 100 1273 26 ARG CA C 56.368 . 1 101 1273 26 ARG CB C 31.019 . 1 102 1273 26 ARG CD C 43.665 . 1 103 1273 26 ARG CG C 26.632 . 1 104 1273 26 ARG N N 121.231 . 1 105 1274 27 THR H H 8.783 . 1 106 1274 27 THR HA H 4.447 . 1 107 1274 27 THR HB H 4.107 . 1 108 1274 27 THR HG2 H 1.255 . 1 109 1274 27 THR CA C 61.634 . 1 110 1274 27 THR CB C 70.244 . 1 111 1274 27 THR CG2 C 21.686 . 1 112 1274 27 THR N N 119.448 . 1 113 1275 28 GLU H H 8.731 . 1 114 1275 28 GLU HA H 4.156 . 1 115 1275 28 GLU HB2 H 2.020 . 1 116 1275 28 GLU HB3 H 2.020 . 1 117 1275 28 GLU HG2 H 2.287 . 1 118 1275 28 GLU HG3 H 2.287 . 1 119 1275 28 GLU CA C 57.713 . 1 120 1275 28 GLU CB C 29.718 . 1 121 1275 28 GLU CG C 36.083 . 1 122 1275 28 GLU N N 125.009 . 1 123 1276 29 GLY H H 8.672 . 1 124 1276 29 GLY HA2 H 3.807 . 2 125 1276 29 GLY HA3 H 4.151 . 2 126 1276 29 GLY CA C 45.476 . 1 127 1276 29 GLY N N 111.397 . 1 128 1277 30 LYS H H 7.865 . 1 129 1277 30 LYS HA H 4.572 . 1 130 1277 30 LYS HB2 H 1.891 . 1 131 1277 30 LYS HB3 H 1.891 . 1 132 1277 30 LYS HD2 H 1.694 . 1 133 1277 30 LYS HD3 H 1.694 . 1 134 1277 30 LYS HE2 H 3.013 . 1 135 1277 30 LYS HE3 H 3.013 . 1 136 1277 30 LYS HG2 H 1.390 . 1 137 1277 30 LYS HG3 H 1.390 . 1 138 1277 30 LYS CA C 54.942 . 1 139 1277 30 LYS CB C 34.473 . 1 140 1277 30 LYS CD C 28.778 . 1 141 1277 30 LYS CE C 42.170 . 1 142 1277 30 LYS CG C 24.600 . 1 143 1277 30 LYS N N 119.422 . 1 144 1278 31 GLU H H 8.563 . 1 145 1278 31 GLU HB2 H 1.857 . 2 146 1278 31 GLU HB3 H 1.737 . 2 147 1278 31 GLU CA C 54.813 . 1 148 1278 31 GLU CB C 34.460 . 1 149 1278 31 GLU N N 122.903 . 1 150 1279 32 PRO HA H 4.494 . 1 151 1279 32 PRO HB2 H 2.311 . 1 152 1279 32 PRO HB3 H 2.311 . 1 153 1279 32 PRO HD2 H 4.014 . 1 154 1279 32 PRO HD3 H 4.014 . 1 155 1279 32 PRO HG2 H 2.028 . 1 156 1279 32 PRO HG3 H 2.028 . 1 157 1279 32 PRO CA C 63.277 . 1 158 1279 32 PRO CB C 32.288 . 1 159 1279 32 PRO CD C 50.607 . 1 160 1279 32 PRO CG C 27.406 . 1 161 1280 33 ASP H H 8.213 . 1 162 1280 33 ASP HA H 4.789 . 1 163 1280 33 ASP HB2 H 2.449 . 1 164 1280 33 ASP HB3 H 2.449 . 1 165 1280 33 ASP CA C 54.735 . 1 166 1280 33 ASP CB C 43.419 . 1 167 1280 33 ASP N N 121.944 . 1 168 1281 34 ILE H H 8.204 . 1 169 1281 34 ILE HB H 1.979 . 1 170 1281 34 ILE HD1 H 0.905 . 1 171 1281 34 ILE HG12 H 1.460 . 2 172 1281 34 ILE HG13 H 1.180 . 2 173 1281 34 ILE HG2 H 0.996 . 1 174 1281 34 ILE CA C 58.379 . 1 175 1281 34 ILE CB C 39.996 . 1 176 1281 34 ILE CD1 C 13.445 . 1 177 1281 34 ILE CG1 C 25.710 . 1 178 1281 34 ILE CG2 C 17.990 . 1 179 1281 34 ILE N N 116.642 . 1 180 1282 35 PRO HA H 4.977 . 1 181 1282 35 PRO HB2 H 2.027 . 1 182 1282 35 PRO HB3 H 2.027 . 1 183 1282 35 PRO HD2 H 3.768 . 1 184 1282 35 PRO HD3 H 3.768 . 1 185 1282 35 PRO HG2 H 1.813 . 1 186 1282 35 PRO HG3 H 1.813 . 1 187 1282 35 PRO CA C 63.211 . 1 188 1282 35 PRO CB C 32.059 . 1 189 1282 35 PRO CD C 50.616 . 1 190 1282 35 PRO CG C 28.270 . 1 191 1283 36 LEU H H 8.809 . 1 192 1283 36 LEU HA H 4.776 . 1 193 1283 36 LEU HB2 H 1.645 . 1 194 1283 36 LEU HB3 H 1.645 . 1 195 1283 36 LEU HD1 H 0.849 . 2 196 1283 36 LEU HD2 H 0.937 . 2 197 1283 36 LEU CA C 53.760 . 1 198 1283 36 LEU CB C 45.498 . 1 199 1283 36 LEU CD1 C 24.852 . 2 200 1283 36 LEU CD2 C 25.074 . 2 201 1283 36 LEU CG C 26.861 . 1 202 1283 36 LEU N N 124.265 . 1 203 1284 37 TYR H H 8.933 . 1 204 1284 37 TYR HA H 5.173 . 1 205 1284 37 TYR HB2 H 2.717 . 2 206 1284 37 TYR HB3 H 2.920 . 2 207 1284 37 TYR HD1 H 6.911 . 3 208 1284 37 TYR HD2 H 6.911 . 3 209 1284 37 TYR HE1 H 6.650 . 3 210 1284 37 TYR HE2 H 6.650 . 3 211 1284 37 TYR CA C 57.938 . 1 212 1284 37 TYR CB C 39.851 . 1 213 1284 37 TYR CD1 C 132.766 . 3 214 1284 37 TYR CD2 C 132.766 . 3 215 1284 37 TYR CE1 C 117.746 . 3 216 1284 37 TYR CE2 C 117.746 . 3 217 1284 37 TYR N N 123.990 . 1 218 1285 38 LYS H H 9.366 . 1 219 1285 38 LYS HA H 4.824 . 1 220 1285 38 LYS HB2 H 1.810 . 1 221 1285 38 LYS HB3 H 1.810 . 1 222 1285 38 LYS HE2 H 2.661 . 1 223 1285 38 LYS HE3 H 2.661 . 1 224 1285 38 LYS HG2 H 1.400 . 1 225 1285 38 LYS HG3 H 1.400 . 1 226 1285 38 LYS CA C 55.136 . 1 227 1285 38 LYS CB C 37.007 . 1 228 1285 38 LYS CD C 29.131 . 1 229 1285 38 LYS CE C 41.886 . 1 230 1285 38 LYS CG C 24.838 . 1 231 1285 38 LYS N N 122.774 . 1 232 1286 39 THR H H 8.983 . 1 233 1286 39 THR HA H 4.534 . 1 234 1286 39 THR HB H 4.150 . 1 235 1286 39 THR HG2 H 1.270 . 1 236 1286 39 THR CA C 63.579 . 1 237 1286 39 THR CB C 68.310 . 1 238 1286 39 THR CG2 C 22.897 . 1 239 1286 39 THR N N 122.902 . 1 240 1287 40 LEU H H 9.287 . 1 241 1287 40 LEU HB2 H 1.620 . 2 242 1287 40 LEU HB3 H 1.560 . 2 243 1287 40 LEU HD1 H 0.901 . 2 244 1287 40 LEU HD2 H 0.985 . 2 245 1287 40 LEU HG H 1.770 . 1 246 1287 40 LEU CA C 55.611 . 1 247 1287 40 LEU CB C 43.381 . 1 248 1287 40 LEU CD1 C 22.266 . 2 249 1287 40 LEU CD2 C 26.220 . 2 250 1287 40 LEU CG C 26.880 . 1 251 1287 40 LEU N N 128.842 . 1 252 1288 41 GLN H H 7.712 . 1 253 1288 41 GLN HA H 4.621 . 1 254 1288 41 GLN HB2 H 2.070 . 2 255 1288 41 GLN HB3 H 1.944 . 2 256 1288 41 GLN HE21 H 6.836 . 1 257 1288 41 GLN HE22 H 7.373 . 1 258 1288 41 GLN HG2 H 2.292 . 1 259 1288 41 GLN HG3 H 2.292 . 1 260 1288 41 GLN CA C 55.764 . 1 261 1288 41 GLN CB C 32.277 . 1 262 1288 41 GLN CG C 33.774 . 1 263 1288 41 GLN N N 115.497 . 1 264 1288 41 GLN NE2 N 111.666 . 1 265 1289 42 THR H H 8.409 . 1 266 1289 42 THR HA H 4.606 . 1 267 1289 42 THR HB H 3.773 . 1 268 1289 42 THR HG2 H 0.810 . 1 269 1289 42 THR CA C 61.825 . 1 270 1289 42 THR CB C 70.658 . 1 271 1289 42 THR CG2 C 21.584 . 1 272 1289 42 THR N N 119.082 . 1 273 1290 43 VAL H H 8.268 . 1 274 1290 43 VAL HA H 4.533 . 1 275 1290 43 VAL HB H 2.018 . 1 276 1290 43 VAL HG1 H 0.852 . 2 277 1290 43 VAL HG2 H 0.836 . 2 278 1290 43 VAL CA C 60.487 . 1 279 1290 43 VAL CB C 35.681 . 1 280 1290 43 VAL CG1 C 21.181 . 2 281 1290 43 VAL CG2 C 20.121 . 2 282 1290 43 VAL N N 121.527 . 1 283 1291 44 GLY H H 8.288 . 1 284 1291 44 GLY HA2 H 3.855 . 1 285 1291 44 GLY HA3 H 3.855 . 1 286 1291 44 GLY CA C 43.906 . 1 287 1291 44 GLY N N 110.721 . 1 288 1292 45 PRO HA H 4.601 . 1 289 1292 45 PRO HB2 H 1.969 . 1 290 1292 45 PRO HB3 H 1.969 . 1 291 1292 45 PRO HD2 H 3.550 . 1 292 1292 45 PRO HD3 H 3.550 . 1 293 1292 45 PRO HG2 H 1.251 . 1 294 1292 45 PRO HG3 H 1.251 . 1 295 1292 45 PRO CA C 62.244 . 1 296 1292 45 PRO CB C 32.562 . 1 297 1292 45 PRO CD C 48.767 . 1 298 1292 45 PRO CG C 26.824 . 1 299 1293 46 SER H H 8.807 . 1 300 1293 46 SER HA H 3.770 . 1 301 1293 46 SER HB2 H 3.930 . 1 302 1293 46 SER HB3 H 3.930 . 1 303 1293 46 SER CA C 62.074 . 1 304 1293 46 SER CB C 62.880 . 1 305 1293 46 SER N N 114.401 . 1 306 1294 47 HIS H H 7.985 . 1 307 1294 47 HIS HA H 4.693 . 1 308 1294 47 HIS HB2 H 2.974 . 2 309 1294 47 HIS HB3 H 3.388 . 2 310 1294 47 HIS CA C 56.231 . 1 311 1294 47 HIS CB C 30.481 . 1 312 1294 47 HIS N N 125.596 . 1 313 1295 48 ALA H H 7.666 . 1 314 1295 48 ALA HB H 0.984 . 1 315 1295 48 ALA CA C 51.764 . 1 316 1295 48 ALA CB C 18.281 . 1 317 1295 48 ALA N N 128.326 . 1 318 1296 49 ARG H H 8.102 . 1 319 1296 49 ARG HB2 H 3.097 . 1 320 1296 49 ARG HB3 H 3.097 . 1 321 1296 49 ARG HD2 H 2.729 . 1 322 1296 49 ARG HD3 H 2.729 . 1 323 1296 49 ARG HG2 H 1.296 . 1 324 1296 49 ARG HG3 H 1.296 . 1 325 1296 49 ARG CA C 55.461 . 1 326 1296 49 ARG CB C 32.370 . 1 327 1296 49 ARG CD C 43.460 . 1 328 1296 49 ARG CG C 26.403 . 1 329 1296 49 ARG N N 122.980 . 1 330 1297 50 THR H H 8.618 . 1 331 1297 50 THR HA H 4.469 . 1 332 1297 50 THR HB H 3.730 . 1 333 1297 50 THR HG2 H 1.070 . 1 334 1297 50 THR CA C 62.408 . 1 335 1297 50 THR CB C 70.670 . 1 336 1297 50 THR CG2 C 21.529 . 1 337 1297 50 THR N N 116.246 . 1 338 1298 51 TYR H H 9.254 . 1 339 1298 51 TYR HA H 4.926 . 1 340 1298 51 TYR HB2 H 2.635 . 1 341 1298 51 TYR HB3 H 2.635 . 1 342 1298 51 TYR HD1 H 6.897 . 3 343 1298 51 TYR HD2 H 6.897 . 3 344 1298 51 TYR HE1 H 6.767 . 3 345 1298 51 TYR HE2 H 6.767 . 3 346 1298 51 TYR CA C 57.483 . 1 347 1298 51 TYR CB C 40.886 . 1 348 1298 51 TYR CD1 C 133.731 . 3 349 1298 51 TYR CD2 C 133.731 . 3 350 1298 51 TYR CE1 C 118.145 . 3 351 1298 51 TYR CE2 C 118.145 . 3 352 1298 51 TYR N N 127.449 . 1 353 1299 52 THR H H 8.772 . 1 354 1299 52 THR HA H 5.263 . 1 355 1299 52 THR HB H 3.853 . 1 356 1299 52 THR HG2 H 1.162 . 1 357 1299 52 THR CA C 61.900 . 1 358 1299 52 THR CB C 70.049 . 1 359 1299 52 THR CG2 C 21.759 . 1 360 1299 52 THR N N 117.282 . 1 361 1300 53 VAL H H 9.394 . 1 362 1300 53 VAL HA H 4.981 . 1 363 1300 53 VAL HB H 1.680 . 1 364 1300 53 VAL HG1 H 1.007 . 2 365 1300 53 VAL HG2 H 1.088 . 2 366 1300 53 VAL CA C 60.141 . 1 367 1300 53 VAL CB C 36.171 . 1 368 1300 53 VAL CG1 C 22.960 . 2 369 1300 53 VAL CG2 C 22.968 . 2 370 1300 53 VAL N N 127.917 . 1 371 1301 54 ALA H H 9.081 . 1 372 1301 54 ALA HA H 5.360 . 1 373 1301 54 ALA HB H 1.403 . 1 374 1301 54 ALA CA C 49.841 . 1 375 1301 54 ALA CB C 23.690 . 1 376 1301 54 ALA N N 127.143 . 1 377 1302 55 VAL H H 8.366 . 1 378 1302 55 VAL HA H 5.103 . 1 379 1302 55 VAL HB H 1.336 . 1 380 1302 55 VAL HG1 H 0.476 . 2 381 1302 55 VAL HG2 H 0.058 . 2 382 1302 55 VAL CA C 57.798 . 1 383 1302 55 VAL CB C 34.997 . 1 384 1302 55 VAL CG1 C 19.603 . 2 385 1302 55 VAL CG2 C 22.552 . 2 386 1302 55 VAL N N 118.836 . 1 387 1303 56 TYR H H 9.375 . 1 388 1303 56 TYR HA H 5.283 . 1 389 1303 56 TYR HB2 H 2.699 . 2 390 1303 56 TYR HB3 H 2.592 . 2 391 1303 56 TYR HD1 H 6.779 . 3 392 1303 56 TYR HD2 H 6.779 . 3 393 1303 56 TYR HE1 H 6.688 . 3 394 1303 56 TYR HE2 H 6.688 . 3 395 1303 56 TYR CA C 56.154 . 1 396 1303 56 TYR CB C 42.587 . 1 397 1303 56 TYR CD1 C 132.730 . 3 398 1303 56 TYR CD2 C 132.730 . 3 399 1303 56 TYR CE1 C 118.574 . 3 400 1303 56 TYR CE2 C 118.574 . 3 401 1303 56 TYR N N 127.325 . 1 402 1304 57 PHE H H 9.091 . 1 403 1304 57 PHE HA H 4.900 . 1 404 1304 57 PHE HB2 H 2.708 . 2 405 1304 57 PHE HB3 H 2.740 . 2 406 1304 57 PHE HD1 H 6.947 . 3 407 1304 57 PHE HD2 H 6.947 . 3 408 1304 57 PHE HE1 H 7.289 . 3 409 1304 57 PHE HE2 H 7.289 . 3 410 1304 57 PHE HZ H 7.378 . 1 411 1304 57 PHE CA C 56.674 . 1 412 1304 57 PHE CB C 43.169 . 1 413 1304 57 PHE CD1 C 131.647 . 3 414 1304 57 PHE CD2 C 131.647 . 3 415 1304 57 PHE CE1 C 131.832 . 3 416 1304 57 PHE CE2 C 131.832 . 3 417 1304 57 PHE CZ C 130.010 . 1 418 1304 57 PHE N N 119.480 . 1 419 1305 58 LYS H H 8.986 . 1 420 1305 58 LYS HA H 3.529 . 1 421 1305 58 LYS HB2 H 1.737 . 1 422 1305 58 LYS HB3 H 1.737 . 1 423 1305 58 LYS HD2 H 1.365 . 1 424 1305 58 LYS HD3 H 1.365 . 1 425 1305 58 LYS HE2 H 2.824 . 1 426 1305 58 LYS HE3 H 2.824 . 1 427 1305 58 LYS HG2 H -0.059 . 2 428 1305 58 LYS HG3 H 0.672 . 2 429 1305 58 LYS CA C 57.452 . 1 430 1305 58 LYS CB C 29.633 . 1 431 1305 58 LYS CD C 29.506 . 1 432 1305 58 LYS CE C 41.775 . 1 433 1305 58 LYS CG C 24.231 . 1 434 1305 58 LYS N N 127.296 . 1 435 1306 59 GLY H H 9.026 . 1 436 1306 59 GLY HA2 H 3.559 . 2 437 1306 59 GLY HA3 H 4.185 . 2 438 1306 59 GLY CA C 45.376 . 1 439 1306 59 GLY N N 104.195 . 1 440 1307 60 GLU H H 7.669 . 1 441 1307 60 GLU HA H 4.671 . 1 442 1307 60 GLU HB2 H 2.029 . 2 443 1307 60 GLU HB3 H 1.912 . 2 444 1307 60 GLU HG2 H 2.290 . 2 445 1307 60 GLU HG3 H 2.130 . 2 446 1307 60 GLU CA C 54.251 . 1 447 1307 60 GLU CB C 32.357 . 1 448 1307 60 GLU CG C 35.731 . 1 449 1307 60 GLU N N 120.691 . 1 450 1308 61 ARG H H 8.948 . 1 451 1308 61 ARG HA H 3.595 . 1 452 1308 61 ARG HB2 H 1.441 . 1 453 1308 61 ARG HB3 H 1.441 . 1 454 1308 61 ARG HD2 H 3.019 . 1 455 1308 61 ARG HD3 H 3.019 . 1 456 1308 61 ARG HG2 H 1.122 . 1 457 1308 61 ARG HG3 H 1.122 . 1 458 1308 61 ARG CA C 56.859 . 1 459 1308 61 ARG CB C 30.237 . 1 460 1308 61 ARG CD C 43.959 . 1 461 1308 61 ARG CG C 26.938 . 1 462 1308 61 ARG N N 126.247 . 1 463 1309 62 ILE H H 8.914 . 1 464 1309 62 ILE HA H 4.626 . 1 465 1309 62 ILE HB H 1.857 . 1 466 1309 62 ILE HD1 H 0.460 . 1 467 1309 62 ILE HG12 H 1.857 . 1 468 1309 62 ILE HG13 H 1.857 . 1 469 1309 62 ILE HG2 H 0.748 . 1 470 1309 62 ILE CA C 61.706 . 1 471 1309 62 ILE CB C 40.034 . 1 472 1309 62 ILE CD1 C 14.788 . 1 473 1309 62 ILE CG1 C 26.838 . 1 474 1309 62 ILE CG2 C 18.216 . 1 475 1309 62 ILE N N 122.118 . 1 476 1310 63 GLY H H 7.290 . 1 477 1310 63 GLY HA2 H 3.817 . 1 478 1310 63 GLY HA3 H 3.817 . 1 479 1310 63 GLY CA C 45.571 . 1 480 1310 63 GLY N N 106.793 . 1 481 1313 66 LYS HA H 6.092 . 1 482 1313 66 LYS HB2 H 1.875 . 2 483 1313 66 LYS HB3 H 1.670 . 2 484 1313 66 LYS HD2 H 1.550 . 1 485 1313 66 LYS HD3 H 1.550 . 1 486 1313 66 LYS HG2 H 1.310 . 2 487 1313 66 LYS HG3 H 1.350 . 2 488 1313 66 LYS CA C 54.175 . 1 489 1313 66 LYS CB C 37.236 . 1 490 1313 66 LYS CD C 29.730 . 1 491 1313 66 LYS CG C 24.840 . 1 492 1314 67 GLY H H 8.592 . 1 493 1314 67 GLY HA2 H 4.186 . 2 494 1314 67 GLY HA3 H 4.044 . 2 495 1314 67 GLY CA C 46.144 . 1 496 1314 67 GLY N N 105.704 . 1 497 1315 68 PRO HB2 H 2.404 . 2 498 1315 68 PRO HB3 H 2.322 . 2 499 1315 68 PRO HD2 H 3.717 . 2 500 1315 68 PRO HD3 H 3.496 . 2 501 1315 68 PRO HG2 H 2.080 . 2 502 1315 68 PRO HG3 H 2.177 . 2 503 1315 68 PRO CB C 31.890 . 1 504 1315 68 PRO CD C 50.014 . 1 505 1315 68 PRO CG C 26.374 . 1 506 1316 69 SER H H 8.396 . 1 507 1316 69 SER HA H 4.598 . 1 508 1316 69 SER HB2 H 4.080 . 1 509 1316 69 SER HB3 H 4.080 . 1 510 1316 69 SER CA C 56.338 . 1 511 1316 69 SER CB C 66.562 . 1 512 1316 69 SER N N 124.307 . 1 513 1317 70 ILE H H 8.527 . 1 514 1317 70 ILE HA H 3.138 . 1 515 1317 70 ILE HB H 1.358 . 1 516 1317 70 ILE HD1 H 0.657 . 1 517 1317 70 ILE HG12 H 0.460 . 2 518 1317 70 ILE HG13 H 0.654 . 2 519 1317 70 ILE HG2 H 0.615 . 1 520 1317 70 ILE CA C 65.143 . 1 521 1317 70 ILE CB C 37.278 . 1 522 1317 70 ILE CD1 C 12.830 . 1 523 1317 70 ILE CG1 C 29.190 . 1 524 1317 70 ILE CG2 C 17.137 . 1 525 1317 70 ILE N N 124.291 . 1 526 1318 71 GLN H H 8.439 . 1 527 1318 71 GLN HA H 3.893 . 1 528 1318 71 GLN HB2 H 2.014 . 2 529 1318 71 GLN HB3 H 1.906 . 2 530 1318 71 GLN HE21 H 7.420 . 1 531 1318 71 GLN HG2 H 2.330 . 1 532 1318 71 GLN HG3 H 2.330 . 1 533 1318 71 GLN CA C 59.719 . 1 534 1318 71 GLN CB C 28.158 . 1 535 1318 71 GLN CG C 30.380 . 1 536 1318 71 GLN N N 118.095 . 1 537 1318 71 GLN NE2 N 112.240 . 1 538 1319 72 GLN H H 7.813 . 1 539 1319 72 GLN HA H 3.890 . 1 540 1319 72 GLN HB2 H 2.018 . 2 541 1319 72 GLN HB3 H 1.899 . 2 542 1319 72 GLN HG2 H 2.420 . 2 543 1319 72 GLN HG3 H 2.320 . 2 544 1319 72 GLN CA C 59.600 . 1 545 1319 72 GLN CB C 27.953 . 1 546 1319 72 GLN CG C 34.020 . 1 547 1319 72 GLN N N 116.836 . 1 548 1320 73 ALA H H 8.127 . 1 549 1320 73 ALA HA H 3.875 . 1 550 1320 73 ALA HB H 1.444 . 1 551 1320 73 ALA CA C 55.914 . 1 552 1320 73 ALA CB C 18.717 . 1 553 1320 73 ALA N N 124.208 . 1 554 1321 74 GLU H H 8.792 . 1 555 1321 74 GLU HA H 3.807 . 1 556 1321 74 GLU HB2 H 1.172 . 2 557 1321 74 GLU HB3 H 2.141 . 2 558 1321 74 GLU HG2 H 1.875 . 2 559 1321 74 GLU HG3 H 2.513 . 2 560 1321 74 GLU CA C 59.825 . 1 561 1321 74 GLU CB C 30.229 . 1 562 1321 74 GLU CG C 36.957 . 1 563 1321 74 GLU N N 117.744 . 1 564 1322 75 MET H H 7.738 . 1 565 1322 75 MET HA H 4.083 . 1 566 1322 75 MET HB2 H 2.283 . 2 567 1322 75 MET HB3 H 2.427 . 2 568 1322 75 MET HE H 2.155 . 1 569 1322 75 MET HG2 H 2.779 . 2 570 1322 75 MET HG3 H 2.631 . 2 571 1322 75 MET CA C 58.897 . 1 572 1322 75 MET CB C 32.328 . 1 573 1322 75 MET CE C 17.764 . 1 574 1322 75 MET CG C 32.580 . 1 575 1322 75 MET N N 116.639 . 1 576 1323 76 GLY H H 8.226 . 1 577 1323 76 GLY HA2 H 3.970 . 1 578 1323 76 GLY HA3 H 3.970 . 1 579 1323 76 GLY CA C 47.517 . 1 580 1323 76 GLY N N 106.218 . 1 581 1324 77 ALA H H 8.657 . 1 582 1324 77 ALA HA H 3.885 . 1 583 1324 77 ALA HB H 1.498 . 1 584 1324 77 ALA CA C 55.377 . 1 585 1324 77 ALA CB C 17.809 . 1 586 1324 77 ALA N N 127.613 . 1 587 1325 78 ALA H H 8.392 . 1 588 1325 78 ALA HA H 4.120 . 1 589 1325 78 ALA HB H 1.599 . 1 590 1325 78 ALA CA C 55.377 . 1 591 1325 78 ALA CB C 17.702 . 1 592 1325 78 ALA N N 119.784 . 1 593 1327 80 ASP HA H 4.435 . 1 594 1327 80 ASP HB2 H 2.962 . 1 595 1327 80 ASP HB3 H 2.962 . 1 596 1327 80 ASP CA C 57.795 . 1 597 1327 80 ASP CB C 43.320 . 1 598 1328 81 ALA H H 8.140 . 1 599 1328 81 ALA HA H 4.376 . 1 600 1328 81 ALA HB H 1.263 . 1 601 1328 81 ALA CA C 54.789 . 1 602 1328 81 ALA CB C 19.794 . 1 603 1328 81 ALA N N 119.778 . 1 604 1329 82 LEU H H 8.405 . 1 605 1329 82 LEU HA H 4.163 . 1 606 1329 82 LEU HB2 H 2.037 . 1 607 1329 82 LEU HB3 H 2.037 . 1 608 1329 82 LEU HD1 H 0.774 . 2 609 1329 82 LEU HD2 H 0.945 . 2 610 1329 82 LEU HG H 1.511 . 1 611 1329 82 LEU CA C 57.894 . 1 612 1329 82 LEU CB C 42.509 . 1 613 1329 82 LEU CD1 C 23.780 . 2 614 1329 82 LEU CD2 C 26.087 . 2 615 1329 82 LEU CG C 26.037 . 1 616 1329 82 LEU N N 116.681 . 1 617 1330 83 GLU H H 7.847 . 1 618 1330 83 GLU HA H 4.221 . 1 619 1330 83 GLU HB2 H 2.226 . 2 620 1330 83 GLU HB3 H 1.649 . 2 621 1330 83 GLU HG2 H 2.509 . 2 622 1330 83 GLU HG3 H 2.299 . 2 623 1330 83 GLU CA C 58.559 . 1 624 1330 83 GLU CB C 30.505 . 1 625 1330 83 GLU CG C 36.720 . 1 626 1330 83 GLU N N 117.788 . 1 627 1331 84 LYS H H 7.920 . 1 628 1331 84 LYS HA H 4.249 . 1 629 1331 84 LYS HB2 H 1.877 . 1 630 1331 84 LYS HB3 H 1.877 . 1 631 1331 84 LYS HD2 H 1.642 . 1 632 1331 84 LYS HD3 H 1.642 . 1 633 1331 84 LYS HE2 H 2.997 . 1 634 1331 84 LYS HE3 H 2.997 . 1 635 1331 84 LYS HG2 H 1.471 . 1 636 1331 84 LYS HG3 H 1.471 . 1 637 1331 84 LYS CA C 58.095 . 1 638 1331 84 LYS CB C 34.611 . 1 639 1331 84 LYS CD C 28.888 . 1 640 1331 84 LYS CE C 42.478 . 1 641 1331 84 LYS CG C 25.839 . 1 642 1331 84 LYS N N 117.419 . 1 643 1332 85 TYR H H 8.496 . 1 644 1332 85 TYR HA H 4.222 . 1 645 1332 85 TYR HB2 H 2.658 . 2 646 1332 85 TYR HB3 H 2.761 . 2 647 1332 85 TYR HD1 H 6.340 . 3 648 1332 85 TYR HD2 H 6.340 . 3 649 1332 85 TYR HE1 H 6.555 . 3 650 1332 85 TYR HE2 H 6.555 . 3 651 1332 85 TYR CA C 59.116 . 1 652 1332 85 TYR CB C 39.234 . 1 653 1332 85 TYR CD1 C 133.093 . 3 654 1332 85 TYR CD2 C 133.093 . 3 655 1332 85 TYR CE1 C 118.018 . 3 656 1332 85 TYR CE2 C 118.018 . 3 657 1332 85 TYR N N 121.294 . 1 658 1333 86 ASN H H 7.566 . 1 659 1333 86 ASN HA H 4.650 . 1 660 1333 86 ASN HB2 H 2.472 . 2 661 1333 86 ASN HB3 H 2.634 . 2 662 1333 86 ASN HD21 H 7.417 . 1 663 1333 86 ASN HD22 H 6.734 . 1 664 1333 86 ASN CA C 52.651 . 1 665 1333 86 ASN CB C 38.228 . 1 666 1333 86 ASN N N 121.137 . 1 667 1333 86 ASN ND2 N 111.857 . 1 668 1334 87 PHE H H 8.061 . 1 669 1334 87 PHE HB2 H 3.145 . 2 670 1334 87 PHE HB3 H 2.899 . 2 671 1334 87 PHE HD1 H 7.286 . 3 672 1334 87 PHE HD2 H 7.286 . 3 673 1334 87 PHE HE1 H 7.050 . 3 674 1334 87 PHE HE2 H 7.050 . 3 675 1334 87 PHE HZ H 6.720 . 1 676 1334 87 PHE CA C 57.621 . 1 677 1334 87 PHE CB C 38.648 . 1 678 1334 87 PHE CD1 C 132.000 . 3 679 1334 87 PHE CD2 C 132.000 . 3 680 1334 87 PHE CE1 C 131.860 . 3 681 1334 87 PHE CE2 C 131.860 . 3 682 1334 87 PHE CZ C 129.928 . 1 683 1334 87 PHE N N 122.039 . 1 684 1335 88 PRO HA H 4.391 . 1 685 1335 88 PRO HB2 H 2.310 . 1 686 1335 88 PRO HB3 H 2.310 . 1 687 1335 88 PRO HD2 H 3.832 . 1 688 1335 88 PRO HD3 H 3.832 . 1 689 1335 88 PRO HG2 H 2.046 . 1 690 1335 88 PRO HG3 H 2.046 . 1 691 1335 88 PRO CA C 64.034 . 1 692 1335 88 PRO CB C 31.913 . 1 693 1335 88 PRO CD C 50.720 . 1 694 1335 88 PRO CG C 27.653 . 1 695 1336 89 GLN H H 8.455 . 1 696 1336 89 GLN HA H 4.273 . 1 697 1336 89 GLN HB2 H 1.960 . 1 698 1336 89 GLN HB3 H 1.960 . 1 699 1336 89 GLN HE21 H 6.839 . 1 700 1336 89 GLN HE22 H 7.655 . 1 701 1336 89 GLN HG2 H 2.381 . 2 702 1336 89 GLN HG3 H 2.270 . 2 703 1336 89 GLN CA C 56.242 . 1 704 1336 89 GLN CB C 29.172 . 1 705 1336 89 GLN CG C 33.961 . 1 706 1336 89 GLN N N 118.313 . 1 707 1336 89 GLN NE2 N 112.462 . 1 708 1337 90 MET H H 8.178 . 1 709 1337 90 MET CA C 55.755 . 1 710 1337 90 MET CB C 32.973 . 1 711 1337 90 MET N N 120.288 . 1 stop_ save_