data_27267 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C and 15N Chemical Shift Assignments for c-Jun ; _BMRB_accession_number 27267 _BMRB_flat_file_name bmr27267.str _Entry_type original _Submission_date 2017-09-29 _Accession_date 2017-09-29 _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 Csizmok Veronika . . 2 Forman-Kay Julie . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 208 "13C chemical shifts" 437 "15N chemical shifts" 208 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2018-01-18 update BMRB 'update entry citation' 2017-10-31 original author 'original release' stop_ _Original_release_date 2017-09-29 save_ ############################# # Citation for this entry # ############################# save_entry_citation _Saveframe_category entry_citation _Citation_full . _Citation_title ; Multivalent Interactions with Fbw7 and Pin1 Facilitate Recognition of c-Jun by the SCFFbw7 Ubiquitin Ligase. ; _Citation_status published _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID 29225075 loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Csizmok Veronika . . 2 Montecchio Meri . . 3 Lin Hong . . 4 Tyers Mike . . 5 Sunnerhagen Maria . . 6 Forman-Kay Julie . . stop_ _Journal_abbreviation Structure _Journal_name_full 'Structure (London, England : 1993)' _Journal_volume 26 _Journal_issue 1 _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first 28 _Page_last 39.e2 _Year 2018 _Details . save_ ################################## # Molecular system description # ################################## save_assembly _Saveframe_category molecular_system _Mol_system_name 'Jun monomer' _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Jun $JUN 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_JUN _Saveframe_category monomeric_polymer _Mol_type polymer _Mol_polymer_class protein _Name_common JUN _Molecular_mass . _Mol_thiol_state 'all free' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 276 _Mol_residue_sequence ; MTAKMETTFYDDALNASFLP SESGPYGYSNPKILKQSMTL NLADPVGSLKPHLRAKNSDL LTSPDVGLLKLASPELERLI IQSSNGHITTTPTPTQFLCP KNVTDEQEGFAEGFVRALAE LHSQNTLPSVTSAAQPVNGA GMVAPAVASVAGGSGSGGFS ASLHSEPPVYANLSNFNPGA LSSGGGAPSYGAAGLAFPAQ PQQQQQPPHHLPQQMPVQHP RLQALKEEPQTVPEMPGETP PLSPIDMESQERIKAERKRM RNRIAASKCRKRKLER ; loop_ _Residue_seq_code _Residue_label 1 MET 2 THR 3 ALA 4 LYS 5 MET 6 GLU 7 THR 8 THR 9 PHE 10 TYR 11 ASP 12 ASP 13 ALA 14 LEU 15 ASN 16 ALA 17 SER 18 PHE 19 LEU 20 PRO 21 SER 22 GLU 23 SER 24 GLY 25 PRO 26 TYR 27 GLY 28 TYR 29 SER 30 ASN 31 PRO 32 LYS 33 ILE 34 LEU 35 LYS 36 GLN 37 SER 38 MET 39 THR 40 LEU 41 ASN 42 LEU 43 ALA 44 ASP 45 PRO 46 VAL 47 GLY 48 SER 49 LEU 50 LYS 51 PRO 52 HIS 53 LEU 54 ARG 55 ALA 56 LYS 57 ASN 58 SER 59 ASP 60 LEU 61 LEU 62 THR 63 SER 64 PRO 65 ASP 66 VAL 67 GLY 68 LEU 69 LEU 70 LYS 71 LEU 72 ALA 73 SER 74 PRO 75 GLU 76 LEU 77 GLU 78 ARG 79 LEU 80 ILE 81 ILE 82 GLN 83 SER 84 SER 85 ASN 86 GLY 87 HIS 88 ILE 89 THR 90 THR 91 THR 92 PRO 93 THR 94 PRO 95 THR 96 GLN 97 PHE 98 LEU 99 CYS 100 PRO 101 LYS 102 ASN 103 VAL 104 THR 105 ASP 106 GLU 107 GLN 108 GLU 109 GLY 110 PHE 111 ALA 112 GLU 113 GLY 114 PHE 115 VAL 116 ARG 117 ALA 118 LEU 119 ALA 120 GLU 121 LEU 122 HIS 123 SER 124 GLN 125 ASN 126 THR 127 LEU 128 PRO 129 SER 130 VAL 131 THR 132 SER 133 ALA 134 ALA 135 GLN 136 PRO 137 VAL 138 ASN 139 GLY 140 ALA 141 GLY 142 MET 143 VAL 144 ALA 145 PRO 146 ALA 147 VAL 148 ALA 149 SER 150 VAL 151 ALA 152 GLY 153 GLY 154 SER 155 GLY 156 SER 157 GLY 158 GLY 159 PHE 160 SER 161 ALA 162 SER 163 LEU 164 HIS 165 SER 166 GLU 167 PRO 168 PRO 169 VAL 170 TYR 171 ALA 172 ASN 173 LEU 174 SER 175 ASN 176 PHE 177 ASN 178 PRO 179 GLY 180 ALA 181 LEU 182 SER 183 SER 184 GLY 185 GLY 186 GLY 187 ALA 188 PRO 189 SER 190 TYR 191 GLY 192 ALA 193 ALA 194 GLY 195 LEU 196 ALA 197 PHE 198 PRO 199 ALA 200 GLN 201 PRO 202 GLN 203 GLN 204 GLN 205 GLN 206 GLN 207 PRO 208 PRO 209 HIS 210 HIS 211 LEU 212 PRO 213 GLN 214 GLN 215 MET 216 PRO 217 VAL 218 GLN 219 HIS 220 PRO 221 ARG 222 LEU 223 GLN 224 ALA 225 LEU 226 LYS 227 GLU 228 GLU 229 PRO 230 GLN 231 THR 232 VAL 233 PRO 234 GLU 235 MET 236 PRO 237 GLY 238 GLU 239 THR 240 PRO 241 PRO 242 LEU 243 SER 244 PRO 245 ILE 246 ASP 247 MET 248 GLU 249 SER 250 GLN 251 GLU 252 ARG 253 ILE 254 LYS 255 ALA 256 GLU 257 ARG 258 LYS 259 ARG 260 MET 261 ARG 262 ASN 263 ARG 264 ILE 265 ALA 266 ALA 267 SER 268 LYS 269 CYS 270 ARG 271 LYS 272 ARG 273 LYS 274 LEU 275 GLU 276 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 $JUN 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 $JUN 'recombinant technology' . Escherichia coli . pET-His-Sumo 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 $JUN 0.3 mM '[U-99% 13C; U-99% 15N]' H2O 52 M 'natural abundance' 'sodium phosphate' 0.05 mM 'natural abundance' DTT 0.02 mM 'natural abundance' 'sodium chloride' 0.15 mM '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_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Varian _Model INOVA _Field_strength 800 _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_HSQC_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N HSQC' _Sample_label $sample_1 save_ save_3D_HNCO_2 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCO' _Sample_label $sample_1 save_ save_3D_CBCA(CO)NH_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D CBCA(CO)NH' _Sample_label $sample_1 save_ save_3D_HNCA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HNCACB_5 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCACB' _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' 0.15 . M pH 7.2 . pH pressure 1 . atm temperature 273 . K stop_ save_ #################### # NMR parameters # #################### ############################## # Assigned chemical shifts # ############################## ################################ # Chemical shift referencing # ################################ save_chemical_shift_reference_1 _Saveframe_category chemical_shift_reference _Details . loop_ _Mol_common_name _Atom_type _Atom_isotope_number _Atom_group _Chem_shift_units _Chem_shift_value _Reference_method _Reference_type _External_reference_sample_geometry _External_reference_location _External_reference_axis _Indirect_shift_ratio DSS C 13 'methyl protons' ppm 0.00 na indirect . . . 0.251449530 DSS H 1 'methyl protons' ppm 0.00 internal direct . . . 1.000000000 DSS N 15 'methyl protons' ppm 0.00 na indirect . . . 0.101329118 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Experiment_label '2D 1H-15N HSQC' '3D HNCO' '3D CBCA(CO)NH' '3D HNCA' '3D HNCACB' 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 Jun _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 MET C C 176.218 0.0772 . 2 1 1 MET CA C 55.339 0.0498 . 3 2 2 THR H H 8.352 0.0007 . 4 2 2 THR C C 174.058 0.0078 . 5 2 2 THR CA C 61.569 0.0219 . 6 2 2 THR N N 116.634 0.0219 . 7 3 3 ALA H H 8.456 0.0014 . 8 3 3 ALA C C 177.469 0.0021 . 9 3 3 ALA CA C 52.161 0.0099 . 10 3 3 ALA N N 127.218 0.0141 . 11 4 4 LYS H H 8.420 0.0042 . 12 4 4 LYS C C 176.541 0.0014 . 13 4 4 LYS CA C 56.088 0.0955 . 14 4 4 LYS N N 121.234 0.0322 . 15 5 5 MET H H 8.507 0.0028 . 16 5 5 MET C C 176.144 0.0127 . 17 5 5 MET CA C 55.097 0.0679 . 18 5 5 MET N N 122.402 0.0564 . 19 6 6 GLU H H 8.605 0.0014 . 20 6 6 GLU C C 176.499 0.0772 . 21 6 6 GLU CA C 56.221 0.0498 . 22 6 6 GLU N N 122.698 0.0219 . 23 7 7 THR C C 174.385 0.0772 . 24 7 7 THR CA C 61.612 0.0498 . 25 8 8 THR H H 8.189 0.0014 . 26 8 8 THR C C 173.745 0.0042 . 27 8 8 THR CA C 61.526 0.0361 . 28 8 8 THR N N 116.905 0.0007 . 29 9 9 PHE H H 8.327 0.0014 . 30 9 9 PHE C C 175.094 0.0057 . 31 9 9 PHE CA C 57.537 0.0042 . 32 9 9 PHE N N 122.901 0.0134 . 33 10 10 TYR H H 8.185 0.0007 . 34 10 10 TYR C C 174.954 0.0028 . 35 10 10 TYR CA C 57.531 0.0346 . 36 10 10 TYR N N 122.176 0.0085 . 37 11 11 ASP H H 8.173 0.0014 . 38 11 11 ASP C C 175.971 0.0000 . 39 11 11 ASP CA C 53.833 0.0092 . 40 11 11 ASP N N 122.631 0.0424 . 41 12 12 ASP H H 8.304 0.0042 . 42 12 12 ASP C C 176.662 0.0099 . 43 12 12 ASP CA C 54.462 0.0771 . 44 12 12 ASP N N 122.083 0.0177 . 45 13 13 ALA H H 8.259 0.0014 . 46 13 13 ALA C C 178.542 0.0007 . 47 13 13 ALA CA C 52.866 0.1195 . 48 13 13 ALA N N 123.348 0.0049 . 49 14 14 LEU H H 8.049 0.0057 . 50 14 14 LEU C C 177.622 0.0085 . 51 14 14 LEU CA C 55.317 0.0255 . 52 14 14 LEU N N 119.305 0.0028 . 53 15 15 ASN H H 8.174 0.0028 . 54 15 15 ASN C C 175.226 0.0134 . 55 15 15 ASN CA C 53.102 0.0495 . 56 15 15 ASN N N 118.362 0.0064 . 57 16 16 ALA H H 8.178 0.0007 . 58 16 16 ALA C C 177.756 0.0071 . 59 16 16 ALA CA C 52.770 0.0537 . 60 16 16 ALA N N 123.894 0.0035 . 61 17 17 SER H H 8.229 0.0007 . 62 17 17 SER C C 173.822 0.0134 . 63 17 17 SER CA C 58.210 0.0212 . 64 17 17 SER N N 114.337 0.0431 . 65 18 18 PHE H H 8.039 0.0042 . 66 18 18 PHE C C 175.052 0.0099 . 67 18 18 PHE CA C 57.033 0.0014 . 68 18 18 PHE N N 121.383 0.0057 . 69 19 19 LEU H H 8.213 0.0014 . 70 19 19 LEU C C 174.745 0.0772 . 71 19 19 LEU CA C 52.312 0.0498 . 72 19 19 LEU N N 125.185 0.0134 . 73 21 21 SER H H 8.425 0.0007 . 74 21 21 SER C C 174.829 0.0772 . 75 21 21 SER CA C 57.862 0.1739 . 76 21 21 SER N N 115.556 0.0226 . 77 22 22 GLU H H 8.566 0.0007 . 78 22 22 GLU C C 176.355 0.0042 . 79 22 22 GLU CA C 56.250 0.0184 . 80 22 22 GLU N N 122.735 0.0078 . 81 23 23 SER H H 8.358 0.0007 . 82 23 23 SER C C 174.376 0.0772 . 83 23 23 SER CA C 58.260 0.1803 . 84 23 23 SER N N 115.768 0.0792 . 85 24 24 GLY H H 8.190 0.0049 . 86 24 24 GLY CA C 44.495 0.0498 . 87 24 24 GLY N N 110.471 0.0014 . 88 26 26 TYR H H 8.376 0.0021 . 89 26 26 TYR C C 176.396 0.0014 . 90 26 26 TYR CA C 57.507 0.0141 . 91 26 26 TYR N N 119.687 0.0431 . 92 27 27 GLY H H 8.114 0.0021 . 93 27 27 GLY C C 173.743 0.0049 . 94 27 27 GLY CA C 44.926 0.0339 . 95 27 27 GLY N N 110.303 0.0064 . 96 28 28 TYR H H 8.049 0.0014 . 97 28 28 TYR C C 175.729 0.0007 . 98 28 28 TYR CA C 57.772 0.0014 . 99 28 28 TYR N N 120.126 0.0099 . 100 29 29 SER H H 8.197 0.0064 . 101 29 29 SER CA C 57.574 0.0290 . 102 29 29 SER N N 117.671 0.0127 . 103 30 30 ASN CA C 50.885 0.0498 . 104 32 32 LYS H H 8.312 0.0042 . 105 32 32 LYS C C 176.662 0.0085 . 106 32 32 LYS CA C 56.125 0.1761 . 107 32 32 LYS N N 120.317 0.0672 . 108 33 33 ILE H H 7.991 0.0007 . 109 33 33 ILE C C 176.099 0.0035 . 110 33 33 ILE CA C 60.701 0.0346 . 111 33 33 ILE N N 121.679 0.0474 . 112 34 34 LEU H H 8.329 0.0014 . 113 34 34 LEU C C 177.196 0.0141 . 114 34 34 LEU CA C 54.736 0.0007 . 115 34 34 LEU N N 126.633 0.0035 . 116 35 35 LYS H H 8.366 0.0028 . 117 35 35 LYS C C 176.612 0.0290 . 118 35 35 LYS CA C 56.146 0.0184 . 119 35 35 LYS N N 122.672 0.0219 . 120 36 36 GLN H H 8.501 0.0021 . 121 36 36 GLN C C 176.064 0.0219 . 122 36 36 GLN CA C 55.775 0.0226 . 123 36 36 GLN N N 121.805 0.0064 . 124 37 37 SER H H 8.477 0.0049 . 125 37 37 SER C C 174.624 0.0141 . 126 37 37 SER CA C 58.217 0.0375 . 127 37 37 SER N N 117.209 0.0099 . 128 38 38 MET H H 8.516 0.0014 . 129 38 38 MET C C 176.322 0.0601 . 130 38 38 MET CA C 55.097 0.1428 . 131 38 38 MET N N 122.447 0.0054 . 132 39 39 THR H H 8.235 0.0007 . 133 39 39 THR C C 174.232 0.0099 . 134 39 39 THR CA C 61.697 0.0078 . 135 39 39 THR N N 115.683 0.0021 . 136 40 40 LEU H H 8.312 0.0007 . 137 40 40 LEU C C 176.628 0.0163 . 138 40 40 LEU CA C 54.815 0.0205 . 139 40 40 LEU N N 124.745 0.0368 . 140 41 41 ASN H H 8.563 0.0007 . 141 41 41 ASN C C 175.008 0.0170 . 142 41 41 ASN CA C 52.580 0.0431 . 143 41 41 ASN N N 120.043 0.0255 . 144 42 42 LEU H H 8.349 0.0014 . 145 42 42 LEU C C 176.955 0.0148 . 146 42 42 LEU CA C 54.745 0.0184 . 147 42 42 LEU N N 123.192 0.0177 . 148 43 43 ALA H H 8.260 0.0024 . 149 43 43 ALA C C 177.155 0.0120 . 150 43 43 ALA CA C 51.886 0.0092 . 151 43 43 ALA N N 124.007 0.0035 . 152 44 44 ASP H H 8.232 0.0007 . 153 44 44 ASP C C 174.404 0.0772 . 154 44 44 ASP N N 120.749 0.0007 . 155 46 46 VAL H H 8.351 0.0068 . 156 46 46 VAL C C 177.127 0.0021 . 157 46 46 VAL CA C 62.757 0.0134 . 158 46 46 VAL N N 120.276 0.0057 . 159 47 47 GLY H H 8.485 0.0021 . 160 47 47 GLY C C 174.303 0.0120 . 161 47 47 GLY CA C 45.089 0.0085 . 162 47 47 GLY N N 111.982 0.0120 . 163 48 48 SER H H 8.200 0.0014 . 164 48 48 SER C C 174.465 0.0184 . 165 48 48 SER CA C 58.153 0.0566 . 166 48 48 SER N N 115.399 0.0184 . 167 49 49 LEU H H 8.325 0.0021 . 168 49 49 LEU C C 177.123 0.0240 . 169 49 49 LEU CA C 54.664 0.0587 . 170 49 49 LEU N N 123.798 0.0198 . 171 50 50 LYS H H 8.305 0.0014 . 172 50 50 LYS C C 174.424 0.0772 . 173 50 50 LYS CA C 54.030 0.0498 . 174 50 50 LYS N N 123.357 0.0318 . 175 52 52 HIS H H 8.545 0.0028 . 176 52 52 HIS C C 175.033 0.0184 . 177 52 52 HIS CA C 55.668 0.0233 . 178 52 52 HIS N N 119.182 0.0042 . 179 53 53 LEU H H 8.209 0.0035 . 180 53 53 LEU C C 176.949 0.0156 . 181 53 53 LEU CA C 54.240 0.2312 . 182 53 53 LEU N N 123.893 0.0265 . 183 54 54 ARG H H 8.388 0.0028 . 184 54 54 ARG C C 175.871 0.0120 . 185 54 54 ARG CA C 55.416 0.0969 . 186 54 54 ARG N N 122.340 0.0304 . 187 55 55 ALA H H 8.453 0.0014 . 188 55 55 ALA C C 177.692 0.0099 . 189 55 55 ALA CA C 52.025 0.0212 . 190 55 55 ALA N N 125.843 0.0120 . 191 56 56 LYS H H 8.499 0.0014 . 192 56 56 LYS C C 176.511 0.0099 . 193 56 56 LYS CA C 56.072 0.0290 . 194 56 56 LYS N N 121.186 0.0170 . 195 57 57 ASN H H 8.625 0.0007 . 196 57 57 ASN C C 175.494 0.0085 . 197 57 57 ASN CA C 53.049 0.0948 . 198 57 57 ASN N N 120.015 0.0304 . 199 58 58 SER H H 8.389 0.0085 . 200 58 58 SER CA C 58.331 0.0498 . 201 58 58 SER N N 116.139 0.0693 . 202 59 59 ASP C C 176.186 0.0772 . 203 59 59 ASP CA C 54.328 0.0498 . 204 60 60 LEU H H 8.100 0.0007 . 205 60 60 LEU C C 177.387 0.0772 . 206 60 60 LEU CA C 54.928 0.0498 . 207 60 60 LEU N N 121.296 0.0028 . 208 61 61 LEU C C 177.480 0.0772 . 209 61 61 LEU CA C 54.848 0.0498 . 210 62 62 THR H H 8.073 0.0007 . 211 62 62 THR C C 174.166 0.0085 . 212 62 62 THR CA C 61.184 0.0212 . 213 62 62 THR N N 114.339 0.0233 . 214 63 63 SER H H 8.395 0.0028 . 215 63 63 SER CA C 55.813 0.0498 . 216 63 63 SER N N 119.552 0.0332 . 217 65 65 ASP H H 8.430 0.0014 . 218 65 65 ASP C C 176.669 0.0057 . 219 65 65 ASP CA C 53.957 0.0410 . 220 65 65 ASP N N 120.329 0.0099 . 221 66 66 VAL H H 8.149 0.0035 . 222 66 66 VAL C C 176.927 0.0078 . 223 66 66 VAL CA C 62.455 0.0325 . 224 66 66 VAL N N 120.646 0.0219 . 225 67 67 GLY H H 8.556 0.0021 . 226 67 67 GLY C C 174.366 0.0000 . 227 67 67 GLY CA C 45.170 0.0453 . 228 67 67 GLY N N 111.325 0.0191 . 229 68 68 LEU H H 8.022 0.0007 . 230 68 68 LEU C C 177.636 0.0014 . 231 68 68 LEU CA C 54.962 0.0573 . 232 68 68 LEU N N 121.181 0.0028 . 233 69 69 LEU H H 8.141 0.0021 . 234 69 69 LEU C C 177.172 0.0276 . 235 69 69 LEU CA C 54.965 0.0042 . 236 69 69 LEU N N 122.284 0.0636 . 237 70 70 LYS H H 8.250 0.0007 . 238 70 70 LYS C C 176.282 0.0106 . 239 70 70 LYS CA C 55.722 0.0481 . 240 70 70 LYS N N 122.099 0.0445 . 241 71 71 LEU H H 8.245 0.0007 . 242 71 71 LEU C C 176.939 0.0127 . 243 71 71 LEU CA C 54.403 0.0771 . 244 71 71 LEU N N 123.511 0.0262 . 245 72 72 ALA H H 8.380 0.0007 . 246 72 72 ALA C C 177.357 0.0198 . 247 72 72 ALA CA C 51.918 0.0297 . 248 72 72 ALA N N 124.828 0.0085 . 249 73 73 SER H H 8.370 0.0028 . 250 73 73 SER CA C 56.182 0.0498 . 251 73 73 SER N N 116.483 0.0262 . 252 79 79 LEU C C 177.482 0.0772 . 253 79 79 LEU CA C 55.296 0.0498 . 254 80 80 ILE H H 8.218 0.0014 . 255 80 80 ILE C C 176.623 0.0113 . 256 80 80 ILE CA C 61.181 0.0255 . 257 80 80 ILE N N 122.829 0.0721 . 258 81 81 ILE H H 8.317 0.0014 . 259 81 81 ILE C C 176.572 0.0078 . 260 81 81 ILE CA C 61.141 0.0679 . 261 81 81 ILE N N 125.609 0.0509 . 262 82 82 GLN H H 8.565 0.0028 . 263 82 82 GLN C C 176.102 0.0772 . 264 82 82 GLN CA C 55.739 0.0498 . 265 82 82 GLN N N 124.480 0.0436 . 266 83 83 SER C C 174.766 0.0772 . 267 83 83 SER CA C 58.187 0.0498 . 268 84 84 SER H H 8.495 0.0035 . 269 84 84 SER C C 174.479 0.0772 . 270 84 84 SER CA C 58.212 0.0658 . 271 84 84 SER N N 117.842 0.0078 . 272 85 85 ASN H H 8.495 0.0007 . 273 85 85 ASN C C 175.651 0.0106 . 274 85 85 ASN CA C 52.981 0.0127 . 275 85 85 ASN N N 120.462 0.0233 . 276 86 86 GLY H H 8.401 0.0021 . 277 86 86 GLY C C 173.748 0.0007 . 278 86 86 GLY CA C 44.907 0.0813 . 279 86 86 GLY N N 108.642 0.0354 . 280 87 87 HIS H H 8.253 0.0021 . 281 87 87 HIS C C 174.771 0.0057 . 282 87 87 HIS CA C 55.401 0.0064 . 283 87 87 HIS N N 118.958 0.0021 . 284 88 88 ILE H H 8.293 0.0007 . 285 88 88 ILE C C 176.251 0.0099 . 286 88 88 ILE CA C 60.557 0.0141 . 287 88 88 ILE N N 123.382 0.0318 . 288 89 89 THR H H 8.503 0.0021 . 289 89 89 THR C C 174.377 0.0106 . 290 89 89 THR CA C 61.229 0.0757 . 291 89 89 THR N N 119.858 0.0262 . 292 90 90 THR H H 8.360 0.0021 . 293 90 90 THR C C 174.238 0.0049 . 294 90 90 THR CA C 61.167 0.0226 . 295 90 90 THR N N 117.366 0.0226 . 296 91 91 THR H H 8.396 0.0021 . 297 91 91 THR CA C 59.548 0.0498 . 298 91 91 THR N N 119.959 0.0410 . 299 93 93 THR H H 8.506 0.0021 . 300 93 93 THR CA C 59.690 0.0498 . 301 93 93 THR N N 118.392 0.0156 . 302 95 95 THR H H 8.342 0.0014 . 303 95 95 THR C C 174.429 0.0035 . 304 95 95 THR CA C 61.952 0.0601 . 305 95 95 THR N N 115.091 0.0325 . 306 96 96 GLN H H 8.407 0.0007 . 307 96 96 GLN C C 175.252 0.0049 . 308 96 96 GLN CA C 55.609 0.0693 . 309 96 96 GLN N N 122.498 0.0537 . 310 97 97 PHE H H 8.344 0.0028 . 311 97 97 PHE C C 175.215 0.0007 . 312 97 97 PHE CA C 57.187 0.0028 . 313 97 97 PHE N N 121.549 0.0346 . 314 98 98 LEU H H 8.218 0.0007 . 315 98 98 LEU C C 176.318 0.0772 . 316 98 98 LEU CA C 54.239 0.0498 . 317 98 98 LEU N N 124.080 0.0431 . 318 101 101 LYS H H 8.523 0.0021 . 319 101 101 LYS C C 176.238 0.0099 . 320 101 101 LYS CA C 55.870 0.0856 . 321 101 101 LYS N N 121.703 0.0297 . 322 102 102 ASN H H 8.593 0.0007 . 323 102 102 ASN C C 175.206 0.0049 . 324 102 102 ASN CA C 52.805 0.3380 . 325 102 102 ASN N N 120.162 0.0014 . 326 103 103 VAL H H 8.284 0.0028 . 327 103 103 VAL C C 176.374 0.0057 . 328 103 103 VAL CA C 62.179 0.0658 . 329 103 103 VAL N N 120.778 0.0728 . 330 104 104 THR H H 8.267 0.0013 . 331 104 104 THR C C 174.341 0.0772 . 332 104 104 THR CA C 61.660 0.0219 . 333 104 104 THR N N 116.948 0.0170 . 334 105 105 ASP C C 176.433 0.0772 . 335 105 105 ASP CA C 54.364 0.0488 . 336 106 106 GLU H H 8.429 0.0027 . 337 106 106 GLU C C 176.638 0.0064 . 338 106 106 GLU CA C 56.527 0.0622 . 339 106 106 GLU N N 121.293 0.0163 . 340 107 107 GLN H H 8.440 0.0008 . 341 107 107 GLN C C 176.202 0.0940 . 342 107 107 GLN CA C 55.632 0.1025 . 343 107 107 GLN N N 120.735 0.0028 . 344 108 108 GLU H H 8.483 0.0007 . 345 108 108 GLU C C 176.970 0.0113 . 346 108 108 GLU CA C 56.739 0.0488 . 347 108 108 GLU N N 122.319 0.0035 . 348 109 109 GLY H H 8.479 0.0014 . 349 109 109 GLY C C 174.037 0.0262 . 350 109 109 GLY CA C 44.857 0.0078 . 351 109 109 GLY N N 110.006 0.0127 . 352 110 110 PHE H H 8.125 0.0029 . 353 110 110 PHE C C 175.927 0.0057 . 354 110 110 PHE CA C 57.610 0.0396 . 355 110 110 PHE N N 120.256 0.0014 . 356 111 111 ALA H H 8.394 0.0007 . 357 111 111 ALA C C 177.834 0.0085 . 358 111 111 ALA CA C 52.483 0.0007 . 359 111 111 ALA N N 125.242 0.0064 . 360 112 112 GLU H H 8.483 0.0014 . 361 112 112 GLU C C 177.485 0.0078 . 362 112 112 GLU CA C 57.197 0.0226 . 363 112 112 GLU N N 120.153 0.0056 . 364 113 113 GLY H H 8.468 0.0071 . 365 113 113 GLY C C 174.332 0.0772 . 366 113 113 GLY CA C 45.211 0.0453 . 367 113 113 GLY N N 109.465 0.0403 . 368 114 114 PHE H H 7.998 0.0021 . 369 114 114 PHE C C 175.851 0.0085 . 370 114 114 PHE CA C 58.289 0.0339 . 371 114 114 PHE N N 120.913 0.0353 . 372 115 115 VAL H H 8.045 0.0049 . 373 115 115 VAL C C 176.475 0.0156 . 374 115 115 VAL CA C 62.960 0.0615 . 375 115 115 VAL N N 122.695 0.0212 . 376 116 116 ARG H H 8.316 0.0021 . 377 116 116 ARG C C 175.881 0.4285 . 378 116 116 ARG CA C 56.610 0.0417 . 379 116 116 ARG N N 124.581 0.0467 . 380 117 117 ALA H H 8.313 0.0014 . 381 117 117 ALA C C 178.474 2.1623 . 382 117 117 ALA CA C 52.545 0.1478 . 383 117 117 ALA N N 124.384 0.1640 . 384 118 118 LEU H H 8.155 0.0021 . 385 118 118 LEU C C 177.785 0.0184 . 386 118 118 LEU CA C 55.488 0.0106 . 387 118 118 LEU N N 121.046 0.0120 . 388 119 119 ALA H H 8.163 0.0021 . 389 119 119 ALA C C 178.442 0.0772 . 390 119 119 ALA CA C 52.872 0.0498 . 391 119 119 ALA N N 123.514 0.0042 . 392 120 120 GLU C C 177.040 0.0772 . 393 120 120 GLU CA C 56.614 0.0498 . 394 121 121 LEU H H 8.115 0.0163 . 395 121 121 LEU C C 177.600 0.1994 . 396 121 121 LEU CA C 55.389 0.0339 . 397 121 121 LEU N N 122.451 0.1216 . 398 122 122 HIS H H 8.375 0.0035 . 399 122 122 HIS C C 175.350 0.0057 . 400 122 122 HIS CA C 55.700 0.0226 . 401 122 122 HIS N N 118.842 0.0134 . 402 123 123 SER H H 8.307 0.0028 . 403 123 123 SER C C 174.712 0.0772 . 404 123 123 SER CA C 58.399 0.0198 . 405 123 123 SER N N 116.567 0.0233 . 406 124 124 GLN H H 8.532 0.0014 . 407 124 124 GLN C C 175.762 0.0035 . 408 124 124 GLN CA C 55.874 0.0481 . 409 124 124 GLN N N 121.709 0.0389 . 410 125 125 ASN H H 8.478 0.0035 . 411 125 125 ASN C C 175.123 0.0092 . 412 125 125 ASN CA C 52.933 0.0354 . 413 125 125 ASN N N 119.330 0.0198 . 414 126 126 THR H H 8.147 0.0014 . 415 126 126 THR C C 174.218 0.0106 . 416 126 126 THR CA C 61.467 0.0057 . 417 126 126 THR N N 114.768 0.0156 . 418 127 127 LEU H H 8.395 0.0014 . 419 127 127 LEU C C 175.104 0.0772 . 420 127 127 LEU CA C 52.797 0.0498 . 421 127 127 LEU N N 126.460 0.0170 . 422 129 129 SER H H 8.504 0.0018 . 423 129 129 SER C C 174.716 0.0035 . 424 129 129 SER CA C 57.868 0.0106 . 425 129 129 SER N N 116.362 0.0262 . 426 130 130 VAL H H 8.352 0.0014 . 427 130 130 VAL C C 176.435 0.0085 . 428 130 130 VAL CA C 61.956 0.0247 . 429 130 130 VAL N N 122.150 0.0071 . 430 131 131 THR H H 8.339 0.0071 . 431 131 131 THR C C 174.480 0.0134 . 432 131 131 THR CA C 61.568 0.0474 . 433 131 131 THR N N 118.004 0.0445 . 434 132 132 SER H H 8.404 0.0294 . 435 132 132 SER C C 174.069 0.0106 . 436 132 132 SER CA C 57.904 0.0679 . 437 132 132 SER N N 118.630 0.0255 . 438 133 133 ALA H H 8.413 0.0035 . 439 133 133 ALA C C 177.207 0.3691 . 440 133 133 ALA CA C 51.968 0.0544 . 441 133 133 ALA N N 126.170 0.2263 . 442 134 134 ALA H H 8.313 0.0028 . 443 134 134 ALA C C 177.444 0.0177 . 444 134 134 ALA CA C 51.938 0.0099 . 445 134 134 ALA N N 123.438 0.0361 . 446 135 135 GLN H H 8.397 0.0021 . 447 135 135 GLN C C 173.876 0.0772 . 448 135 135 GLN CA C 53.056 0.0498 . 449 135 135 GLN N N 120.966 0.0141 . 450 137 137 VAL H H 8.433 0.0035 . 451 137 137 VAL C C 176.069 0.0530 . 452 137 137 VAL CA C 62.066 0.0453 . 453 137 137 VAL N N 120.713 0.0157 . 454 138 138 ASN H H 8.643 0.0007 . 455 138 138 ASN C C 175.694 0.0078 . 456 138 138 ASN CA C 52.834 0.0064 . 457 138 138 ASN N N 122.296 0.0184 . 458 139 139 GLY H H 8.502 0.0021 . 459 139 139 GLY C C 173.922 0.0134 . 460 139 139 GLY CA C 45.054 0.0163 . 461 139 139 GLY N N 110.003 0.0368 . 462 140 140 ALA H H 8.255 0.0042 . 463 140 140 ALA C C 178.245 0.0148 . 464 140 140 ALA CA C 52.444 0.0552 . 465 140 140 ALA N N 123.513 0.0184 . 466 141 141 GLY H H 8.492 0.0007 . 467 141 141 GLY C C 173.924 0.0120 . 468 141 141 GLY CA C 44.863 0.0184 . 469 141 141 GLY N N 108.072 0.0247 . 470 142 142 MET H H 8.166 0.0007 . 471 142 142 MET C C 176.002 0.0106 . 472 142 142 MET CA C 55.023 0.0318 . 473 142 142 MET N N 119.891 0.0389 . 474 143 143 VAL H H 8.293 0.0007 . 475 143 143 VAL C C 175.378 0.0141 . 476 143 143 VAL CA C 61.556 0.0042 . 477 143 143 VAL N N 122.482 0.0431 . 478 144 144 ALA H H 8.561 0.0007 . 479 144 144 ALA C C 175.161 0.0772 . 480 144 144 ALA CA C 50.052 0.0498 . 481 144 144 ALA N N 130.185 15.6115 . 482 146 146 ALA H H 8.491 0.0410 . 483 146 146 ALA C C 177.787 1.8328 . 484 146 146 ALA CA C 52.037 0.0014 . 485 146 146 ALA N N 124.672 0.1096 . 486 147 147 VAL H H 8.253 0.0035 . 487 147 147 VAL C C 176.015 0.0764 . 488 147 147 VAL CA C 61.615 0.0191 . 489 147 147 VAL N N 120.211 0.0007 . 490 148 148 ALA H H 8.516 0.0120 . 491 148 148 ALA C C 177.634 0.4059 . 492 148 148 ALA CA C 52.212 0.0799 . 493 148 148 ALA N N 128.240 0.1541 . 494 149 149 SER H H 8.406 0.0035 . 495 149 149 SER C C 174.533 0.0120 . 496 149 149 SER CA C 57.782 0.0148 . 497 149 149 SER N N 115.825 0.0078 . 498 150 150 VAL H H 8.286 0.0028 . 499 150 150 VAL C C 175.857 0.1018 . 500 150 150 VAL CA C 61.656 0.0014 . 501 150 150 VAL N N 122.019 0.0212 . 502 151 151 ALA H H 8.535 0.0141 . 503 151 151 ALA C C 178.224 0.4292 . 504 151 151 ALA CA C 52.120 0.2093 . 505 151 151 ALA N N 128.033 0.1174 . 506 152 152 GLY H H 8.503 0.0007 . 507 152 152 GLY C C 174.539 0.1174 . 508 152 152 GLY CA C 44.952 0.0177 . 509 152 152 GLY N N 108.808 0.0219 . 510 153 153 GLY H H 8.345 0.0488 . 511 153 153 GLY C C 174.394 0.3684 . 512 153 153 GLY CA C 44.686 0.0509 . 513 153 153 GLY N N 108.700 0.1329 . 514 154 154 SER H H 8.507 0.0058 . 515 154 154 SER C C 175.096 0.0933 . 516 154 154 SER CA C 58.258 0.1160 . 517 154 154 SER N N 115.843 0.0007 . 518 155 155 GLY H H 8.621 0.0849 . 519 155 155 GLY C C 174.426 0.2072 . 520 155 155 GLY CA C 45.050 0.0389 . 521 155 155 GLY N N 111.077 0.2270 . 522 156 156 SER H H 8.384 0.0021 . 523 156 156 SER C C 175.217 0.0772 . 524 156 156 SER CA C 58.124 0.0498 . 525 156 156 SER N N 115.796 0.0177 . 526 157 157 GLY C C 174.699 0.0772 . 527 157 157 GLY CA C 45.067 0.0498 . 528 158 158 GLY H H 8.274 0.0523 . 529 158 158 GLY C C 173.882 0.3783 . 530 158 158 GLY CA C 44.747 0.0651 . 531 158 158 GLY N N 108.521 0.1188 . 532 159 159 PHE H H 8.253 0.0033 . 533 159 159 PHE C C 175.949 0.0544 . 534 159 159 PHE CA C 57.618 0.0205 . 535 159 159 PHE N N 120.183 0.0198 . 536 160 160 SER H H 8.346 0.0021 . 537 160 160 SER C C 174.077 0.0304 . 538 160 160 SER CA C 57.716 0.1110 . 539 160 160 SER N N 117.986 0.0502 . 540 161 161 ALA H H 8.415 0.0007 . 541 161 161 ALA C C 177.747 0.3705 . 542 161 161 ALA CA C 52.106 0.2192 . 543 161 161 ALA N N 126.468 0.1923 . 544 162 162 SER H H 8.285 0.0014 . 545 162 162 SER C C 174.476 0.0141 . 546 162 162 SER CA C 57.945 0.0375 . 547 162 162 SER N N 114.679 0.0417 . 548 163 163 LEU H H 8.230 0.0007 . 549 163 163 LEU C C 177.065 0.0071 . 550 163 163 LEU CA C 54.862 0.0544 . 551 163 163 LEU N N 123.913 0.0474 . 552 164 164 HIS H H 8.401 0.0057 . 553 164 164 HIS C C 174.624 0.0028 . 554 164 164 HIS CA C 55.293 0.0170 . 555 164 164 HIS N N 119.485 0.0113 . 556 165 165 SER H H 8.304 0.0021 . 557 165 165 SER C C 173.807 0.0247 . 558 165 165 SER CA C 57.647 0.0856 . 559 165 165 SER N N 117.461 0.0262 . 560 166 166 GLU H H 8.537 0.0007 . 561 166 166 GLU C C 173.890 0.0772 . 562 166 166 GLU CA C 53.910 0.0498 . 563 166 166 GLU N N 124.020 0.0184 . 564 169 169 VAL H H 8.207 0.0021 . 565 169 169 VAL C C 175.886 0.0148 . 566 169 169 VAL CA C 61.987 0.1124 . 567 169 169 VAL N N 120.287 0.0205 . 568 170 170 TYR H H 8.316 0.0014 . 569 170 170 TYR C C 175.428 2.1454 . 570 170 170 TYR CA C 57.115 0.0000 . 571 170 170 TYR N N 124.221 0.2036 . 572 171 171 ALA H H 8.307 0.0014 . 573 171 171 ALA C C 176.836 0.0092 . 574 171 171 ALA CA C 52.078 0.0141 . 575 171 171 ALA N N 125.619 0.0021 . 576 172 172 ASN H H 8.390 0.0021 . 577 172 172 ASN C C 175.290 0.0113 . 578 172 172 ASN CA C 52.516 0.1725 . 579 172 172 ASN N N 117.560 0.0269 . 580 173 173 LEU H H 8.346 0.0021 . 581 173 173 LEU C C 177.614 0.0078 . 582 173 173 LEU CA C 55.020 0.0064 . 583 173 173 LEU N N 122.724 0.0078 . 584 174 174 SER H H 8.357 0.0035 . 585 174 174 SER C C 174.166 0.0035 . 586 174 174 SER CA C 58.262 0.1047 . 587 174 174 SER N N 115.856 0.0332 . 588 175 175 ASN H H 8.354 0.0007 . 589 175 175 ASN C C 174.481 0.0120 . 590 175 175 ASN CA C 52.784 0.0085 . 591 175 175 ASN N N 120.087 0.0516 . 592 176 176 PHE H H 8.148 0.0028 . 593 176 176 PHE C C 174.620 0.0191 . 594 176 176 PHE CA C 57.392 0.0085 . 595 176 176 PHE N N 120.673 0.0750 . 596 177 177 ASN H H 8.384 0.0042 . 597 177 177 ASN C C 176.111 0.0772 . 598 177 177 ASN CA C 50.206 0.0498 . 599 177 177 ASN N N 122.606 0.0127 . 600 179 179 GLY H H 8.381 0.0028 . 601 179 179 GLY C C 173.947 0.0099 . 602 179 179 GLY CA C 44.821 0.0311 . 603 179 179 GLY N N 108.374 0.0267 . 604 180 180 ALA H H 7.944 0.0028 . 605 180 180 ALA C C 177.881 0.0078 . 606 180 180 ALA CA C 52.203 0.0877 . 607 180 180 ALA N N 123.352 0.0042 . 608 181 181 LEU H H 8.284 0.0007 . 609 181 181 LEU C C 177.739 0.0042 . 610 181 181 LEU CA C 54.825 0.1527 . 611 181 181 LEU N N 120.741 0.0516 . 612 182 182 SER H H 8.364 0.0014 . 613 182 182 SER C C 174.739 0.0078 . 614 182 182 SER CA C 57.888 0.0488 . 615 182 182 SER N N 116.381 0.0622 . 616 183 183 SER H H 8.450 0.0007 . 617 183 183 SER C C 175.232 0.0820 . 618 183 183 SER CA C 58.125 0.0686 . 619 183 183 SER N N 117.721 0.0120 . 620 184 184 GLY H H 8.499 0.0870 . 621 184 184 GLY C C 174.732 0.1556 . 622 184 184 GLY CA C 45.078 0.0092 . 623 184 184 GLY N N 110.769 0.1945 . 624 185 185 GLY H H 8.375 0.0013 . 625 185 185 GLY C C 174.523 0.0772 . 626 185 185 GLY CA C 44.945 0.0127 . 627 185 185 GLY N N 108.759 0.0163 . 628 186 186 GLY H H 8.345 0.0015 . 629 186 186 GLY C C 173.312 0.0772 . 630 186 186 GLY CA C 44.686 0.2418 . 631 186 186 GLY N N 108.700 0.0157 . 632 187 187 ALA H H 8.248 0.0008 . 633 187 187 ALA C C 175.462 0.0772 . 634 187 187 ALA CA C 50.178 0.0498 . 635 187 187 ALA N N 124.813 0.0134 . 636 189 189 SER H H 8.394 0.0028 . 637 189 189 SER C C 174.121 0.0049 . 638 189 189 SER CA C 57.543 0.0361 . 639 189 189 SER N N 115.812 0.0113 . 640 190 190 TYR H H 8.309 0.0042 . 641 190 190 TYR C C 176.305 0.0042 . 642 190 190 TYR CA C 57.599 0.0269 . 643 190 190 TYR N N 122.081 0.0184 . 644 191 191 GLY H H 8.368 0.0014 . 645 191 191 GLY C C 173.863 0.0134 . 646 191 191 GLY CA C 44.807 0.0205 . 647 191 191 GLY N N 110.540 0.0057 . 648 192 192 ALA H H 8.240 0.0035 . 649 192 192 ALA C C 177.771 0.0092 . 650 192 192 ALA CA C 52.433 0.0290 . 651 192 192 ALA N N 123.900 0.0622 . 652 193 193 ALA H H 8.417 0.0035 . 653 193 193 ALA C C 178.222 0.0772 . 654 193 193 ALA CA C 52.378 0.0339 . 655 193 193 ALA N N 122.608 0.0396 . 656 194 194 GLY H H 8.281 0.0032 . 657 194 194 GLY C C 173.916 0.0772 . 658 194 194 GLY CA C 44.915 0.0226 . 659 194 194 GLY N N 107.558 0.0236 . 660 195 195 LEU H H 7.991 0.0014 . 661 195 195 LEU C C 176.789 0.0177 . 662 195 195 LEU CA C 54.523 0.0042 . 663 195 195 LEU N N 121.299 0.0134 . 664 196 196 ALA H H 8.227 0.0014 . 665 196 196 ALA C C 176.804 0.0085 . 666 196 196 ALA CA C 51.779 0.0509 . 667 196 196 ALA N N 124.340 0.0375 . 668 197 197 PHE H H 8.165 0.0042 . 669 197 197 PHE C C 173.626 0.0772 . 670 197 197 PHE N N 119.941 0.0170 . 671 199 199 ALA H H 8.468 0.0007 . 672 199 199 ALA C C 177.547 0.0007 . 673 199 199 ALA CA C 51.934 0.0566 . 674 199 199 ALA N N 124.316 0.0014 . 675 200 200 GLN H H 8.455 0.0007 . 676 200 200 GLN C C 173.984 0.0772 . 677 200 200 GLN CA C 53.042 0.0498 . 678 200 200 GLN N N 120.645 0.0226 . 679 209 209 HIS H H 8.456 0.0014 . 680 209 209 HIS C C 174.625 0.0000 . 681 209 209 HIS CA C 55.476 0.0064 . 682 209 209 HIS N N 119.035 0.0071 . 683 210 210 HIS H H 8.373 0.0014 . 684 210 210 HIS C C 174.415 0.0772 . 685 210 210 HIS CA C 55.459 0.0700 . 686 210 210 HIS N N 120.442 0.0339 . 687 211 211 LEU H H 8.448 0.0049 . 688 211 211 LEU C C 174.917 0.0772 . 689 211 211 LEU CA C 52.537 0.0498 . 690 211 211 LEU N N 125.340 0.0247 . 691 213 213 GLN H H 8.611 0.0014 . 692 213 213 GLN C C 175.814 0.0170 . 693 213 213 GLN CA C 55.431 0.0587 . 694 213 213 GLN N N 120.635 0.0014 . 695 214 214 GLN H H 8.541 0.0021 . 696 214 214 GLN C C 175.627 0.0071 . 697 214 214 GLN CA C 55.130 0.0297 . 698 214 214 GLN N N 122.110 0.0233 . 699 215 215 MET H H 8.586 0.0028 . 700 215 215 MET C C 174.136 0.0772 . 701 215 215 MET CA C 52.817 0.0498 . 702 215 215 MET N N 123.768 0.0113 . 703 217 217 VAL H H 8.374 0.0007 . 704 217 217 VAL C C 176.008 0.0057 . 705 217 217 VAL CA C 62.106 0.0502 . 706 217 217 VAL N N 121.428 0.0361 . 707 218 218 GLN H H 8.554 0.0007 . 708 218 218 GLN CA C 54.953 0.0498 . 709 218 218 GLN N N 124.539 0.0255 . 710 221 221 ARG H H 8.827 0.0028 . 711 221 221 ARG C C 176.348 0.0453 . 712 221 221 ARG CA C 55.879 0.0498 . 713 221 221 ARG N N 121.981 0.0064 . 714 222 222 LEU H H 8.415 0.0049 . 715 222 222 LEU C C 177.265 0.1259 . 716 222 222 LEU CA C 54.864 0.0071 . 717 222 222 LEU N N 123.755 0.1075 . 718 223 223 GLN H H 8.413 0.0019 . 719 223 223 GLN C C 175.423 0.0071 . 720 223 223 GLN CA C 55.219 0.1047 . 721 223 223 GLN N N 121.444 0.0226 . 722 224 224 ALA H H 8.413 0.0030 . 723 224 224 ALA C C 177.560 0.0078 . 724 224 224 ALA CA C 52.063 0.0042 . 725 224 224 ALA N N 125.670 0.0191 . 726 225 225 LEU H H 8.329 0.0028 . 727 225 225 LEU C C 177.249 0.0772 . 728 225 225 LEU CA C 54.692 0.0498 . 729 225 225 LEU N N 121.805 0.0021 . 730 226 226 LYS C C 176.659 0.0772 . 731 226 226 LYS CA C 56.451 0.0498 . 732 227 227 GLU H H 8.277 0.0057 . 733 227 227 GLU C C 174.786 0.0134 . 734 227 227 GLU CA C 58.603 0.0636 . 735 227 227 GLU N N 120.121 0.0085 . 736 228 228 GLU H H 8.493 0.0014 . 737 228 228 GLU C C 176.253 0.0772 . 738 228 228 GLU CA C 55.980 0.0498 . 739 228 228 GLU N N 124.153 0.0177 . 740 230 230 GLN H H 8.695 0.0033 . 741 230 230 GLN C C 176.146 0.0085 . 742 230 230 GLN CA C 55.221 0.0092 . 743 230 230 GLN N N 121.195 0.0184 . 744 231 231 THR H H 8.385 0.0007 . 745 231 231 THR C C 174.139 0.0120 . 746 231 231 THR CA C 61.507 0.0269 . 747 231 231 THR N N 117.038 0.0375 . 748 232 232 VAL H H 8.448 0.0014 . 749 232 232 VAL C C 174.200 0.0772 . 750 232 232 VAL CA C 59.453 0.0498 . 751 232 232 VAL N N 124.890 0.0219 . 752 234 234 GLU H H 8.559 0.0053 . 753 234 234 GLU C C 176.263 0.0127 . 754 234 234 GLU CA C 56.071 0.0042 . 755 234 234 GLU N N 121.443 0.0212 . 756 235 235 MET H H 8.607 0.0049 . 757 235 235 MET C C 174.113 0.0772 . 758 235 235 MET CA C 52.564 0.0498 . 759 235 235 MET N N 123.275 0.0382 . 760 237 237 GLY H H 8.605 0.0029 . 761 237 237 GLY C C 173.860 0.0035 . 762 237 237 GLY CA C 44.655 0.0007 . 763 237 237 GLY N N 109.715 0.0205 . 764 238 238 GLU H H 8.311 0.0007 . 765 238 238 GLU C C 176.490 0.0042 . 766 238 238 GLU CA C 55.883 0.0643 . 767 238 238 GLU N N 120.410 0.0304 . 768 239 239 THR H H 8.505 0.0021 . 769 239 239 THR CA C 59.549 0.0498 . 770 239 239 THR N N 119.300 0.0233 . 771 242 242 LEU H H 8.452 0.0021 . 772 242 242 LEU C C 177.265 0.1315 . 773 242 242 LEU CA C 54.585 0.0071 . 774 242 242 LEU N N 122.554 0.0163 . 775 243 243 SER H H 8.674 0.0007 . 776 243 243 SER CA C 55.795 0.0498 . 777 243 243 SER N N 118.778 0.0071 . 778 245 245 ILE H H 8.142 0.0007 . 779 245 245 ILE C C 176.504 0.0772 . 780 245 245 ILE CA C 61.544 0.0498 . 781 245 245 ILE N N 119.485 0.0042 . 782 248 248 GLU C C 176.128 0.0772 . 783 248 248 GLU CA C 55.890 0.0498 . 784 249 249 SER H H 8.476 0.0035 . 785 249 249 SER C C 174.893 0.0905 . 786 249 249 SER CA C 58.103 0.0679 . 787 249 249 SER N N 117.161 0.0332 . 788 250 250 GLN H H 8.627 0.0021 . 789 250 250 GLN CA C 56.259 0.0498 . 790 250 250 GLN N N 122.833 0.0233 . 791 252 252 ARG C C 177.063 0.0772 . 792 252 252 ARG CA C 56.964 0.0498 . 793 253 253 ILE H H 8.131 0.0007 . 794 253 253 ILE C C 176.500 0.0772 . 795 253 253 ILE CA C 61.489 0.0498 . 796 253 253 ILE N N 121.569 0.0113 . 797 255 255 ALA C C 176.052 0.0772 . 798 255 255 ALA CA C 51.815 0.0498 . 799 256 256 GLU H H 8.158 0.0085 . 800 256 256 GLU CA C 56.431 0.0498 . 801 256 256 GLU N N 120.622 0.0792 . 802 261 261 ARG C C 177.377 0.0772 . 803 261 261 ARG CA C 57.504 0.0498 . 804 262 262 ASN H H 8.249 0.0035 . 805 262 262 ASN C C 175.478 0.0092 . 806 262 262 ASN CA C 53.666 0.0608 . 807 262 262 ASN N N 118.401 0.0014 . 808 263 263 ARG H H 8.077 0.0042 . 809 263 263 ARG C C 177.053 0.0772 . 810 263 263 ARG CA C 56.732 0.0498 . 811 263 263 ARG N N 120.773 0.0148 . 812 264 264 ILE C C 176.501 0.0772 . 813 264 264 ILE CA C 61.561 0.0498 . 814 265 265 ALA H H 8.302 0.0042 . 815 265 265 ALA C C 178.321 0.0772 . 816 265 265 ALA CA C 52.704 0.0498 . 817 265 265 ALA N N 127.253 0.0396 . 818 267 267 SER C C 174.947 0.0772 . 819 267 267 SER CA C 58.571 0.0498 . 820 268 268 LYS H H 8.434 0.0071 . 821 268 268 LYS C C 176.579 0.0772 . 822 268 268 LYS CA C 56.532 0.0498 . 823 268 268 LYS N N 123.294 0.0087 . 824 269 269 CYS C C 178.024 0.0772 . 825 269 269 CYS CA C 58.585 0.0498 . 826 270 270 ARG H H 7.954 0.0057 . 827 270 270 ARG C C 176.268 0.0772 . 828 270 270 ARG CA C 56.208 0.0498 . 829 270 270 ARG N N 119.640 0.0113 . 830 271 271 LYS H H 8.456 0.0014 . 831 271 271 LYS C C 176.529 0.0007 . 832 271 271 LYS CA C 55.965 0.1110 . 833 271 271 LYS N N 123.157 0.0120 . 834 272 272 ARG H H 8.455 0.0014 . 835 272 272 ARG C C 176.156 0.0007 . 836 272 272 ARG CA C 55.965 0.1117 . 837 272 272 ARG N N 123.071 0.0290 . 838 273 273 LYS H H 8.490 0.0014 . 839 273 273 LYS C C 176.433 0.0863 . 840 273 273 LYS CA C 56.094 0.0474 . 841 273 273 LYS N N 123.491 0.0057 . 842 274 274 LEU H H 8.418 0.0049 . 843 274 274 LEU C C 177.095 0.0764 . 844 274 274 LEU CA C 54.728 0.0064 . 845 274 274 LEU N N 123.846 0.0016 . 846 275 275 GLU H H 8.452 0.0021 . 847 275 275 GLU C C 175.320 0.0064 . 848 275 275 GLU CA C 56.008 0.0311 . 849 275 275 GLU N N 122.588 0.0184 . 850 276 276 ARG H H 8.049 0.0007 . 851 276 276 ARG C C 175.314 0.0772 . 852 276 276 ARG CA C 57.042 0.0498 . 853 276 276 ARG N N 126.850 0.0014 . stop_ save_