data_50478 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Human growth hormone receptor intracellular domain ; _BMRB_accession_number 50478 _BMRB_flat_file_name bmr50478.str _Entry_type original _Submission_date 2020-09-23 _Accession_date 2020-09-23 _Entry_origination author _NMR_STAR_version 2.1.1 _Experimental_method NMR _Details ; residues 270-370 of the intracellular domain of the human growth hormone receptor constituting the membrane proximal 100 residues ; loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Kragelund Birthe B. . 2 Nikolajsen Louise . . 3 Haxholm Gitte W. . 4 Seiffert Pernille . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 93 "13C chemical shifts" 289 "15N chemical shifts" 93 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2020-10-23 original BMRB . stop_ _Original_release_date 2020-09-23 save_ ############################# # Citation for this entry # ############################# save_citations_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; Intrinsically disordered cytoplasmic domains of two cytokine receptors mediate conserved interactions with membranes. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 25846210 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Haxholm Gitte W. . 2 Nikolajsen Louise F. . 3 Olsen Johan G. . 4 Fredsted Jacob . . 5 Larsen Flemming H. . 6 Goffin Vincent . . 7 Pedersen Stine F. . 8 Brooks Andrew J. . 9 Waters Michael J. . 10 Kragelund Birthe B. . stop_ _Journal_abbreviation 'Biochem. J.' _Journal_name_full 'The Biochemical journal' _Journal_volume 468 _Journal_issue 3 _Journal_ISSN 1470-8728 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 495 _Page_last 506 _Year 2015 _Details . save_ ################################## # Molecular system description # ################################## save_assembly_1 _Saveframe_category molecular_system _Mol_system_name GHR-ICD270-370 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label GHR-ICD270-370 $entity_1 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_1 _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common entity_1 _Molecular_mass . _Mol_thiol_state 'all free' loop_ _Biological_function ; Receptor for growth hormone involved in e.g. regulating postnatal body growth. On ligand binding, couples to the JAK2/STAT5 pathway ; stop_ _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 103 _Mol_residue_sequence ; GSSKQQRIKMLILPPVPVPK IKGIDPDLLKEGKLEEVNTI LAIHDSYKPEFHSDDSWVEF IELDIDEPDEKTEESDTDRL LSSDHEKSHSNLGVKDGDSG RTS ; loop_ _Residue_seq_code _Residue_author_seq_code _Residue_label 1 268 GLY 2 269 SER 3 270 SER 4 271 LYS 5 272 GLN 6 273 GLN 7 274 ARG 8 275 ILE 9 276 LYS 10 277 MET 11 278 LEU 12 279 ILE 13 280 LEU 14 281 PRO 15 282 PRO 16 283 VAL 17 284 PRO 18 285 VAL 19 286 PRO 20 287 LYS 21 288 ILE 22 289 LYS 23 290 GLY 24 291 ILE 25 292 ASP 26 293 PRO 27 294 ASP 28 295 LEU 29 296 LEU 30 297 LYS 31 298 GLU 32 299 GLY 33 300 LYS 34 301 LEU 35 302 GLU 36 303 GLU 37 304 VAL 38 305 ASN 39 306 THR 40 307 ILE 41 308 LEU 42 309 ALA 43 310 ILE 44 311 HIS 45 312 ASP 46 313 SER 47 314 TYR 48 315 LYS 49 316 PRO 50 317 GLU 51 318 PHE 52 319 HIS 53 320 SER 54 321 ASP 55 322 ASP 56 323 SER 57 324 TRP 58 325 VAL 59 326 GLU 60 327 PHE 61 328 ILE 62 329 GLU 63 330 LEU 64 331 ASP 65 332 ILE 66 333 ASP 67 334 GLU 68 335 PRO 69 336 ASP 70 337 GLU 71 338 LYS 72 339 THR 73 340 GLU 74 341 GLU 75 342 SER 76 343 ASP 77 344 THR 78 345 ASP 79 346 ARG 80 347 LEU 81 348 LEU 82 349 SER 83 350 SER 84 351 ASP 85 352 HIS 86 353 GLU 87 354 LYS 88 355 SER 89 356 HIS 90 357 SER 91 358 ASN 92 359 LEU 93 360 GLY 94 361 VAL 95 362 LYS 96 363 ASP 97 364 GLY 98 365 ASP 99 366 SER 100 367 GLY 101 368 ARG 102 369 THR 103 370 SER stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . 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 UNP P10912-1 GHR . . . . . stop_ save_ #################### # Natural source # #################### save_natural_source_1 _Saveframe_category natural_source loop_ _Mol_label _Organism_name_common _NCBI_taxonomy_ID _Superkingdom _Kingdom _Genus _Species $entity_1 Human 9606 Eukaryota Metazoa Homo sapiens stop_ save_ ######################### # Experimental source # ######################### save_experimental_source_1 _Saveframe_category experimental_source loop_ _Mol_label _Production_method _Host_organism_name_common _Genus _Species _Strain _Vector_type _Vector_name $entity_1 'recombinant technology' . Escherichia coli Bl21(DE3) plasmid pGEX-6P-1 stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details ; 20 mM Na2HPO4/NaH2PO4, 10% (v/v) 2H2O, 5-8 mM tris(2-carboxyethyl)phosphine (TCEP) and 0.5 mM 2,2-dimethyl-2-silapentane-5-sulfonic acid (DSS), pH 7.3. ; loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling $entity_1 500 mM . . '[U-95% 13C; U-95% 15N]' Na2HPO4/NaH2PO4 20 mM . . 'natural abundance' 'tris(2-carboxyethyl)phosphine (TCEP)' 6.5 mM 5 8 'natural abundance' '2,2-dimethyl-2-silapentane-5-sulfonic acid (DSS)' 0.5 mM . . 'natural abundance' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name CcpNMR _Version . loop_ _Task analyses stop_ _Details . save_ save_software_2 _Saveframe_category software _Name NMRPipe _Version . loop_ _Task 'transformation and visualization' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Agilent _Model INOVA _Field_strength 750 _Details . save_ save_NMR_spectrometer_2 _Saveframe_category NMR_spectrometer _Manufacturer Agilent _Model INOVA _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_3D_CBCA(CO)NH_1 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCA_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _Sample_label $sample_1 save_ save_3D_HNCACB_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _Sample_label $sample_1 save_ save_3D_HNCO_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_2D_1H-15N_HSQC_6 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _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' 20 . mM pH 7.3 . pH pressure 1 . atm temperature 278 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chem_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 na indirect . . . . DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . . stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $software_1 $software_2 stop_ loop_ _Experiment_label '3D CBCA(CO)NH' '3D HNCA' '3D HN(CO)CA' '3D HNCACB' '3D HNCO' '2D 1H-15N HSQC' stop_ loop_ _Sample_label $sample_1 stop_ _Sample_conditions_label $sample_conditions_1 _Chem_shift_reference_set_label $chem_shift_reference_1 _Mol_system_component_name GHR-ICD270-370 _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 1 269 2 SER H H 8.286 0.000 1 2 269 2 SER C C 175.096 0.000 1 3 269 2 SER CA C 58.556 0.000 1 4 269 2 SER CB C 63.696 0.000 1 5 269 2 SER N N 116.184 0.000 1 6 270 3 SER H H 8.465 0.000 1 7 270 3 SER C C 174.874 0.000 1 8 270 3 SER CA C 58.545 0.000 1 9 270 3 SER CB C 63.750 0.000 1 10 270 3 SER N N 117.977 0.000 1 11 271 4 LYS H H 8.534 0.008 1 12 271 4 LYS C C 176.866 0.000 1 13 271 4 LYS CA C 56.851 0.000 1 14 271 4 LYS CB C 32.826 0.000 1 15 271 4 LYS N N 123.537 0.033 1 16 272 5 GLN H H 8.401 0.004 1 17 272 5 GLN C C 176.174 0.000 1 18 272 5 GLN CA C 56.129 0.000 1 19 272 5 GLN CB C 29.415 0.000 1 20 272 5 GLN N N 121.076 0.076 1 21 273 6 GLN H H 8.454 0.000 1 22 273 6 GLN C C 176.031 0.000 1 23 273 6 GLN CA C 56.327 0.000 1 24 273 6 GLN CB C 29.873 0.000 1 25 273 6 GLN N N 121.903 0.000 1 26 274 7 ARG H H 8.462 0.003 1 27 274 7 ARG C C 176.431 0.000 1 28 274 7 ARG CA C 56.403 0.000 1 29 274 7 ARG CB C 30.724 0.000 1 30 274 7 ARG N N 122.770 0.011 1 31 275 8 ILE H H 8.287 0.000 1 32 275 8 ILE C C 176.211 0.000 1 33 275 8 ILE CA C 61.250 0.000 1 34 275 8 ILE CB C 38.828 0.000 1 35 275 8 ILE N N 122.354 0.000 1 36 276 9 LYS H H 8.396 0.002 1 37 276 9 LYS C C 176.275 0.000 1 38 276 9 LYS CA C 56.386 0.000 1 39 276 9 LYS CB C 33.072 0.000 1 40 276 9 LYS N N 125.719 0.074 1 41 277 10 MET H H 8.372 0.002 1 42 277 10 MET C C 175.669 0.000 1 43 277 10 MET CA C 55.232 0.000 1 44 277 10 MET CB C 33.093 0.000 1 45 277 10 MET N N 122.375 0.067 1 46 278 11 LEU H H 8.295 0.002 1 47 278 11 LEU C C 176.633 0.000 1 48 278 11 LEU CA C 55.111 0.000 1 49 278 11 LEU CB C 42.425 0.000 1 50 278 11 LEU N N 124.441 0.051 1 51 279 12 ILE H H 8.223 0.005 1 52 279 12 ILE C C 175.832 0.000 1 53 279 12 ILE CA C 60.509 0.000 1 54 279 12 ILE CB C 38.446 0.000 1 55 279 12 ILE N N 123.484 0.083 1 56 280 13 LEU H H 8.461 0.009 1 57 280 13 LEU C C 174.463 0.000 1 58 280 13 LEU CA C 52.672 0.000 1 59 280 13 LEU CB C 41.569 0.000 1 60 280 13 LEU N N 119.615 9.403 1 61 282 15 PRO C C 176.776 0.000 1 62 282 15 PRO CA C 62.665 0.000 1 63 282 15 PRO CB C 31.985 0.000 1 64 286 19 PRO C C 176.672 0.000 1 65 286 19 PRO CA C 63.091 0.000 1 66 286 19 PRO CB C 32.280 0.000 1 67 287 20 LYS H H 8.478 0.002 1 68 287 20 LYS C C 176.679 0.000 1 69 287 20 LYS CA C 56.149 0.000 1 70 287 20 LYS CB C 33.119 0.000 1 71 287 20 LYS N N 122.537 0.024 1 72 288 21 ILE H H 8.319 0.004 1 73 288 21 ILE C C 176.114 0.000 1 74 288 21 ILE CA C 60.803 0.000 1 75 288 21 ILE CB C 38.752 0.000 1 76 288 21 ILE N N 123.275 0.027 1 77 289 22 LYS H H 8.547 0.001 1 78 289 22 LYS C C 176.876 0.000 1 79 289 22 LYS CA C 56.635 0.000 1 80 289 22 LYS CB C 33.000 0.000 1 81 289 22 LYS N N 126.932 0.035 1 82 290 23 GLY H H 8.507 0.003 1 83 290 23 GLY C C 173.631 0.000 1 84 290 23 GLY CA C 44.991 0.000 1 85 290 23 GLY N N 111.233 0.008 1 86 291 24 ILE H H 8.070 0.009 1 87 291 24 ILE C C 175.877 0.000 1 88 291 24 ILE CA C 60.634 0.000 1 89 291 24 ILE CB C 38.875 0.000 1 90 291 24 ILE N N 120.397 0.049 1 91 292 25 ASP H H 8.513 0.005 1 92 292 25 ASP C C 174.975 0.000 1 93 292 25 ASP CA C 52.208 0.000 1 94 292 25 ASP CB C 41.284 0.000 1 95 292 25 ASP N N 127.136 0.059 1 96 293 26 PRO C C 177.480 0.000 1 97 293 26 PRO CA C 63.765 0.000 1 98 293 26 PRO CB C 32.203 0.000 1 99 294 27 ASP H H 8.492 0.004 1 100 294 27 ASP C C 176.976 0.000 1 101 294 27 ASP CA C 55.076 0.000 1 102 294 27 ASP CB C 40.626 0.000 1 103 294 27 ASP N N 119.494 0.008 1 104 295 28 LEU H H 7.912 0.002 1 105 295 28 LEU C C 177.968 0.000 1 106 295 28 LEU CA C 55.761 0.000 1 107 295 28 LEU CB C 42.015 0.000 1 108 295 28 LEU N N 121.565 0.017 1 109 296 29 LEU H H 7.985 0.005 1 110 296 29 LEU C C 177.710 0.000 1 111 296 29 LEU CA C 55.364 0.000 1 112 296 29 LEU CB C 41.832 0.000 1 113 296 29 LEU N N 121.178 0.024 1 114 297 30 LYS H H 8.042 0.003 1 115 297 30 LYS C C 176.784 0.000 1 116 297 30 LYS CA C 56.621 0.000 1 117 297 30 LYS CB C 32.827 0.000 1 118 297 30 LYS N N 121.447 0.024 1 119 298 31 GLU H H 8.387 0.004 1 120 298 31 GLU C C 177.069 0.000 1 121 298 31 GLU CA C 56.762 0.000 1 122 298 31 GLU CB C 30.126 0.000 1 123 298 31 GLU N N 121.335 0.045 1 124 299 32 GLY H H 8.445 0.002 1 125 299 32 GLY C C 174.004 0.000 1 126 299 32 GLY CA C 45.341 0.000 1 127 299 32 GLY N N 109.961 0.021 1 128 300 33 LYS H H 8.142 0.000 1 129 300 33 LYS C C 176.589 0.000 1 130 300 33 LYS CA C 56.055 0.000 1 131 300 33 LYS CB C 33.140 0.000 1 132 300 33 LYS N N 120.927 0.000 1 133 301 34 LEU H H 8.417 0.001 1 134 301 34 LEU C C 177.457 0.000 1 135 301 34 LEU CA C 55.185 0.000 1 136 301 34 LEU CB C 42.283 0.000 1 137 301 34 LEU N N 124.241 0.021 1 138 302 35 GLU H H 8.501 0.002 1 139 302 35 GLU C C 176.490 0.000 1 140 302 35 GLU CA C 56.484 0.000 1 141 302 35 GLU CB C 30.227 0.000 1 142 302 35 GLU N N 121.989 0.024 1 143 303 36 GLU H H 8.463 0.014 1 144 303 36 GLU C C 176.602 0.000 1 145 303 36 GLU CA C 56.591 0.000 1 146 303 36 GLU CB C 30.259 0.000 1 147 303 36 GLU N N 122.873 0.047 1 148 304 37 VAL H H 8.298 0.001 1 149 304 37 VAL C C 176.006 0.000 1 150 304 37 VAL CA C 62.588 0.000 1 151 304 37 VAL CB C 32.718 0.000 1 152 304 37 VAL N N 121.703 0.024 1 153 305 38 ASN H H 8.632 0.003 1 154 305 38 ASN C C 175.501 0.000 1 155 305 38 ASN CA C 53.306 0.000 1 156 305 38 ASN CB C 38.861 0.000 1 157 305 38 ASN N N 122.649 0.035 1 158 306 39 THR H H 8.206 0.004 1 159 306 39 THR C C 174.545 0.000 1 160 306 39 THR CA C 62.430 0.000 1 161 306 39 THR CB C 69.664 0.000 1 162 306 39 THR N N 116.086 0.031 1 163 307 40 ILE H H 8.213 0.004 1 164 307 40 ILE C C 176.337 0.000 1 165 307 40 ILE CA C 61.387 0.000 1 166 307 40 ILE CB C 38.330 0.000 1 167 307 40 ILE N N 124.052 0.030 1 168 308 41 LEU H H 8.291 0.005 1 169 308 41 LEU C C 176.942 0.000 1 170 308 41 LEU CA C 54.992 0.000 1 171 308 41 LEU CB C 42.288 0.000 1 172 308 41 LEU N N 126.543 0.032 1 173 309 42 ALA H H 8.268 0.004 1 174 309 42 ALA C C 177.640 0.000 1 175 309 42 ALA CA C 52.364 0.000 1 176 309 42 ALA CB C 19.103 0.000 1 177 309 42 ALA N N 125.413 0.024 1 178 310 43 ILE H H 8.089 0.001 1 179 310 43 ILE C C 176.333 0.000 1 180 310 43 ILE CA C 61.268 0.000 1 181 310 43 ILE CB C 38.649 0.000 1 182 310 43 ILE N N 120.112 0.013 1 183 311 44 HIS H H 8.388 0.006 1 184 311 44 HIS C C 175.098 0.000 1 185 311 44 HIS CA C 56.120 0.000 1 186 311 44 HIS CB C 30.699 0.000 1 187 311 44 HIS N N 123.606 0.019 1 188 312 45 ASP H H 8.345 0.003 1 189 312 45 ASP C C 176.258 0.000 1 190 312 45 ASP CA C 54.584 0.000 1 191 312 45 ASP CB C 41.166 0.000 1 192 312 45 ASP N N 122.437 0.018 1 193 313 46 SER H H 8.338 0.003 1 194 313 46 SER C C 174.104 0.000 1 195 313 46 SER CA C 58.538 0.000 1 196 313 46 SER CB C 63.716 0.000 1 197 313 46 SER N N 116.251 0.010 1 198 314 47 TYR H H 8.241 0.005 1 199 314 47 TYR C C 175.223 0.000 1 200 314 47 TYR CA C 58.093 0.000 1 201 314 47 TYR CB C 38.574 0.000 1 202 314 47 TYR N N 122.680 0.026 1 203 315 48 LYS H H 8.038 0.003 1 204 315 48 LYS C C 173.586 0.000 1 205 315 48 LYS CA C 53.518 0.000 1 206 315 48 LYS CB C 32.964 0.000 1 207 315 48 LYS N N 126.365 0.024 1 208 316 49 PRO C C 176.792 0.000 1 209 316 49 PRO CA C 63.020 0.000 1 210 316 49 PRO CB C 32.039 0.000 1 211 317 50 GLU H H 8.582 0.002 1 212 317 50 GLU C C 176.010 0.000 1 213 317 50 GLU CA C 56.574 0.000 1 214 317 50 GLU CB C 30.252 0.000 1 215 317 50 GLU N N 120.851 0.011 1 216 318 51 PHE H H 8.208 0.001 1 217 318 51 PHE C C 175.139 0.000 1 218 318 51 PHE CA C 57.499 0.000 1 219 318 51 PHE CB C 39.719 0.000 1 220 318 51 PHE N N 121.165 0.024 1 221 319 52 HIS H H 8.262 0.000 1 222 319 52 HIS C C 174.393 0.000 1 223 319 52 HIS CA C 55.463 0.000 1 224 319 52 HIS CB C 30.449 0.000 1 225 319 52 HIS N N 122.058 0.000 1 226 320 53 SER H H 8.341 0.007 1 227 320 53 SER C C 174.242 0.000 1 228 320 53 SER CA C 58.332 0.000 1 229 320 53 SER CB C 63.807 0.000 1 230 320 53 SER N N 118.046 0.026 1 231 321 54 ASP H H 8.532 0.002 1 232 321 54 ASP C C 176.151 0.000 1 233 321 54 ASP CA C 54.382 0.000 1 234 321 54 ASP CB C 41.115 0.000 1 235 321 54 ASP N N 122.618 0.031 1 236 322 55 ASP H H 8.331 0.008 1 237 322 55 ASP C C 176.565 0.000 1 238 322 55 ASP CA C 54.650 0.000 1 239 322 55 ASP CB C 40.790 0.000 1 240 322 55 ASP N N 120.950 0.046 1 241 323 56 SER H H 8.298 0.007 1 242 323 56 SER C C 174.199 0.000 1 243 323 56 SER CA C 58.968 0.000 1 244 323 56 SER CB C 63.692 0.000 1 245 323 56 SER N N 115.855 0.027 1 246 324 57 TRP H H 8.064 0.004 1 247 324 57 TRP C C 175.796 0.000 1 248 324 57 TRP CA C 57.487 0.000 1 249 324 57 TRP CB C 29.485 0.000 1 250 324 57 TRP N N 123.283 0.057 1 251 325 58 VAL H H 7.656 0.019 1 252 325 58 VAL C C 175.029 0.000 1 253 325 58 VAL CA C 61.785 0.000 1 254 325 58 VAL CB C 33.267 0.000 1 255 325 58 VAL N N 123.225 0.103 1 256 326 59 GLU H H 8.169 0.008 1 257 326 59 GLU C C 175.717 0.000 1 258 326 59 GLU CA C 56.456 0.000 1 259 326 59 GLU CB C 30.585 0.000 1 260 326 59 GLU N N 124.491 0.043 1 261 327 60 PHE H H 8.286 0.000 1 262 327 60 PHE C C 174.997 0.000 1 263 327 60 PHE CA C 57.574 0.000 1 264 327 60 PHE CB C 40.057 0.000 1 265 327 60 PHE N N 122.375 0.000 1 266 328 61 ILE H H 8.006 0.025 1 267 328 61 ILE C C 175.159 0.000 1 268 328 61 ILE CA C 60.416 0.000 1 269 328 61 ILE CB C 39.224 0.000 1 270 328 61 ILE N N 124.797 0.174 1 271 329 62 GLU H H 8.427 0.003 1 272 329 62 GLU C C 175.992 0.000 1 273 329 62 GLU CA C 56.120 0.000 1 274 329 62 GLU CB C 30.390 0.000 1 275 329 62 GLU N N 125.913 0.060 1 276 330 63 LEU H H 8.374 0.006 1 277 330 63 LEU C C 176.883 0.000 1 278 330 63 LEU CA C 54.797 0.000 1 279 330 63 LEU CB C 42.810 0.000 1 280 330 63 LEU N N 124.653 0.035 1 281 331 64 ASP H H 8.504 0.004 1 282 331 64 ASP C C 175.998 0.000 1 283 331 64 ASP CA C 54.182 0.000 1 284 331 64 ASP CB C 41.010 0.000 1 285 331 64 ASP N N 122.271 0.067 1 286 332 65 ILE H H 8.151 0.001 1 287 332 65 ILE C C 175.831 0.000 1 288 332 65 ILE CA C 60.832 0.000 1 289 332 65 ILE CB C 39.261 0.000 1 290 332 65 ILE N N 121.004 0.013 1 291 333 66 ASP H H 8.460 0.012 1 292 333 66 ASP C C 175.783 0.000 1 293 333 66 ASP CA C 54.243 0.000 1 294 333 66 ASP CB C 41.246 0.000 1 295 333 66 ASP N N 124.915 0.056 1 296 334 67 GLU H H 8.367 0.008 1 297 334 67 GLU C C 174.432 0.000 1 298 334 67 GLU CA C 54.194 0.000 1 299 334 67 GLU CB C 29.986 0.000 1 300 334 67 GLU N N 123.082 0.030 1 301 335 68 PRO C C 176.664 0.000 1 302 335 68 PRO CA C 63.067 0.000 1 303 335 68 PRO CB C 32.239 0.000 1 304 336 69 ASP H H 8.544 0.003 1 305 336 69 ASP C C 176.341 0.000 1 306 336 69 ASP CA C 54.306 0.000 1 307 336 69 ASP CB C 41.173 0.000 1 308 336 69 ASP N N 121.326 0.030 1 309 337 70 GLU H H 8.446 0.000 1 310 337 70 GLU C C 176.346 0.000 1 311 337 70 GLU CA C 56.399 0.000 1 312 337 70 GLU CB C 30.347 0.000 1 313 337 70 GLU N N 121.957 0.011 1 314 338 71 LYS H H 8.518 0.001 1 315 338 71 LYS C C 176.830 0.000 1 316 338 71 LYS CA C 56.128 0.000 1 317 338 71 LYS CB C 32.852 0.000 1 318 338 71 LYS N N 123.397 0.016 1 319 339 72 THR H H 8.358 0.001 1 320 339 72 THR C C 174.634 0.000 1 321 339 72 THR CA C 61.882 0.000 1 322 339 72 THR CB C 69.902 0.000 1 323 339 72 THR N N 116.841 0.008 1 324 340 73 GLU H H 8.597 0.002 1 325 340 73 GLU C C 176.547 0.000 1 326 340 73 GLU CA C 56.434 0.000 1 327 340 73 GLU CB C 30.399 0.000 1 328 340 73 GLU N N 123.720 0.017 1 329 341 74 GLU H H 8.593 0.000 1 330 341 74 GLU C C 176.594 0.000 1 331 341 74 GLU CA C 56.639 0.000 1 332 341 74 GLU CB C 30.391 0.000 1 333 341 74 GLU N N 122.858 0.000 1 334 342 75 SER H H 8.576 0.002 1 335 342 75 SER C C 174.658 0.000 1 336 342 75 SER CA C 58.212 0.000 1 337 342 75 SER CB C 64.134 0.000 1 338 342 75 SER N N 117.621 0.005 1 339 343 76 ASP H H 8.596 0.001 1 340 343 76 ASP C C 177.232 0.000 1 341 343 76 ASP CA C 54.944 0.000 1 342 343 76 ASP CB C 40.751 0.000 1 343 343 76 ASP N N 122.875 0.016 1 344 344 77 THR H H 8.132 0.004 1 345 344 77 THR C C 175.230 0.000 1 346 344 77 THR CA C 63.353 0.000 1 347 344 77 THR CB C 69.332 0.000 1 348 344 77 THR N N 114.454 0.003 1 349 345 78 ASP H H 8.309 0.006 1 350 345 78 ASP C C 177.055 0.000 1 351 345 78 ASP CA C 55.315 0.000 1 352 345 78 ASP CB C 40.679 0.000 1 353 345 78 ASP N N 122.612 0.032 1 354 346 79 ARG H H 8.082 0.007 1 355 346 79 ARG C C 176.948 0.000 1 356 346 79 ARG CA C 56.965 0.000 1 357 346 79 ARG CB C 30.392 0.000 1 358 346 79 ARG N N 120.946 0.030 1 359 347 80 LEU H H 8.162 0.009 1 360 347 80 LEU C C 177.908 0.000 1 361 347 80 LEU CA C 55.669 0.000 1 362 347 80 LEU CB C 41.932 0.000 1 363 347 80 LEU N N 122.113 0.060 1 364 348 81 LEU H H 8.159 0.009 1 365 348 81 LEU C C 177.834 0.000 1 366 348 81 LEU CA C 55.268 0.000 1 367 348 81 LEU CB C 42.119 0.000 1 368 348 81 LEU N N 121.929 0.060 1 369 349 82 SER H H 8.240 0.007 1 370 349 82 SER C C 175.096 0.000 1 371 349 82 SER CA C 58.525 0.000 1 372 349 82 SER CB C 63.696 0.000 1 373 349 82 SER N N 116.243 0.045 1 374 350 83 SER H H 8.417 0.006 1 375 350 83 SER C C 174.673 0.000 1 376 350 83 SER CA C 58.844 0.000 1 377 350 83 SER CB C 63.636 0.000 1 378 350 83 SER N N 117.982 0.020 1 379 351 84 ASP H H 8.342 0.005 1 380 351 84 ASP C C 176.630 0.000 1 381 351 84 ASP CA C 54.770 0.000 1 382 351 84 ASP CB C 40.770 0.000 1 383 351 84 ASP N N 122.092 0.027 1 384 352 85 HIS H H 8.216 0.003 1 385 352 85 HIS C C 175.837 0.000 1 386 352 85 HIS CA C 56.917 0.000 1 387 352 85 HIS CB C 30.175 0.000 1 388 352 85 HIS N N 119.682 0.020 1 389 353 86 GLU H H 8.327 0.001 1 390 353 86 GLU C C 177.054 0.000 1 391 353 86 GLU CA C 57.028 0.000 1 392 353 86 GLU CB C 29.922 0.000 1 393 353 86 GLU N N 121.376 0.045 1 394 354 87 LYS H H 8.322 0.007 1 395 354 87 LYS C C 177.022 0.000 1 396 354 87 LYS CA C 56.680 0.000 1 397 354 87 LYS CB C 32.772 0.000 1 398 354 87 LYS N N 121.799 0.045 1 399 355 88 SER H H 8.284 0.006 1 400 355 88 SER C C 174.665 0.000 1 401 355 88 SER CA C 58.597 0.000 1 402 355 88 SER CB C 63.621 0.000 1 403 355 88 SER N N 116.242 0.051 1 404 356 89 HIS H H 8.375 0.012 1 405 356 89 HIS C C 175.323 0.000 1 406 356 89 HIS CA C 56.151 0.000 1 407 356 89 HIS CB C 30.234 0.000 1 408 356 89 HIS N N 121.352 0.097 1 409 357 90 SER H H 8.294 0.005 1 410 357 90 SER C C 174.333 0.000 1 411 357 90 SER CA C 58.476 0.000 1 412 357 90 SER CB C 63.736 0.000 1 413 357 90 SER N N 116.710 0.020 1 414 358 91 ASN H H 8.662 0.004 1 415 358 91 ASN C C 175.354 0.000 1 416 358 91 ASN CA C 53.273 0.000 1 417 358 91 ASN CB C 38.594 0.000 1 418 358 91 ASN N N 121.244 0.016 1 419 359 92 LEU H H 8.278 0.001 1 420 359 92 LEU C C 177.999 0.000 1 421 359 92 LEU CA C 55.438 0.000 1 422 359 92 LEU CB C 41.973 0.000 1 423 359 92 LEU N N 122.155 0.009 1 424 360 93 GLY H H 8.468 0.003 1 425 360 93 GLY C C 174.081 0.000 1 426 360 93 GLY CA C 45.251 0.000 1 427 360 93 GLY N N 109.661 0.021 1 428 361 94 VAL H H 7.989 0.001 1 429 361 94 VAL C C 176.431 0.000 1 430 361 94 VAL CA C 62.280 0.000 1 431 361 94 VAL CB C 32.745 0.000 1 432 361 94 VAL N N 119.804 0.004 1 433 362 95 LYS H H 8.588 0.001 1 434 362 95 LYS C C 176.370 0.000 1 435 362 95 LYS CA C 56.102 0.000 1 436 362 95 LYS CB C 33.037 0.000 1 437 362 95 LYS N N 126.006 0.013 1 438 363 96 ASP H H 8.470 0.001 1 439 363 96 ASP C C 176.890 0.000 1 440 363 96 ASP CA C 54.837 0.000 1 441 363 96 ASP CB C 41.123 0.000 1 442 363 96 ASP N N 122.344 0.003 1 443 364 97 GLY H H 8.468 0.000 1 444 364 97 GLY C C 174.278 0.000 1 445 364 97 GLY CA C 45.483 0.000 1 446 364 97 GLY N N 109.880 0.010 1 447 365 98 ASP H H 8.304 0.004 1 448 365 98 ASP C C 176.906 0.000 1 449 365 98 ASP CA C 54.378 0.000 1 450 365 98 ASP CB C 41.286 0.000 1 451 365 98 ASP N N 120.814 0.017 1 452 366 99 SER H H 8.436 0.002 1 453 366 99 SER C C 175.402 0.000 1 454 366 99 SER CA C 59.084 0.000 1 455 366 99 SER CB C 63.610 0.000 1 456 366 99 SER N N 116.894 0.012 1 457 367 100 GLY H H 8.554 0.002 1 458 367 100 GLY C C 174.191 0.000 1 459 367 100 GLY CA C 45.365 0.000 1 460 367 100 GLY N N 110.830 0.016 1 461 368 101 ARG H H 8.089 0.006 1 462 368 101 ARG C C 176.797 0.000 1 463 368 101 ARG CA C 56.140 0.000 1 464 368 101 ARG CB C 30.995 0.000 1 465 368 101 ARG N N 120.680 0.019 1 466 369 102 THR H H 8.431 0.001 1 467 369 102 THR C C 173.970 0.000 1 468 369 102 THR CA C 61.698 0.000 1 469 369 102 THR CB C 69.896 0.000 1 470 369 102 THR N N 115.593 0.005 1 471 370 103 SER H H 8.041 0.003 1 472 370 103 SER C C 178.661 0.000 1 473 370 103 SER CA C 60.036 0.000 1 474 370 103 SER CB C 64.693 0.000 1 475 370 103 SER N N 123.528 0.027 1 stop_ save_