data_50470 ####################### # Entry information # ####################### save_entry_information _Saveframe_category entry_information _Entry_title ; Backbone 1H, 13C, and 15N Chemical Shift Assignment for Human Atg3 without N-terminal 25 resides ; _BMRB_accession_number 50470 _BMRB_flat_file_name bmr50470.str _Entry_type original _Submission_date 2020-09-17 _Accession_date 2020-09-17 _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 Ye Yansheng . . 2 Tyndall Erin R. . 3 Tian Fang . . stop_ loop_ _Saveframe_category_type _Saveframe_category_type_count assigned_chemical_shifts 1 stop_ loop_ _Data_type _Data_type_count "1H chemical shifts" 220 "13C chemical shifts" 727 "15N chemical shifts" 220 stop_ loop_ _Revision_date _Revision_keyword _Revision_author _Revision_detail 2020-11-25 original BMRB . stop_ loop_ _Related_BMRB_accession_number _Relationship 50479 'human Atg3 with deletion of residues 90-190' 50480 'human Atg3 with deletion of 90 to 190 residues in bicelles' 50481 'human Atg3 P21A with deletion of 90 to 190 residues in ficelle' stop_ _Original_release_date 2020-09-17 save_ ############################# # Citation for this entry # ############################# save_citations_1 _Saveframe_category entry_citation _Citation_full . _Citation_title ; An N-terminal conserved region in human Atg3 couples membrane curvature sensitivity to conjugase activity during autophagy ; _Citation_status submitted _Citation_type journal _CAS_abstract_code . _MEDLINE_UI_code . _PubMed_ID ? loop_ _Author_ordinal _Author_family_name _Author_given_name _Author_middle_initials _Author_family_title 1 Tyndall Erin R. . 2 Ye Yansheng . . 3 Bui Van . . 4 Tang Zhenyuan . . 5 Shen Yan . . 6 Jiang Xuejun . . 7 Flanagan John M. . 8 Wang Hong-Gang . . 9 Tian Fang . . stop_ _Journal_abbreviation 'Nature Communication' _Journal_volume . _Journal_issue . _Journal_CSD . _Book_chapter_title . _Book_volume . _Book_series . _Book_ISBN . _Conference_state_province . _Conference_abstract_number . _Page_first . _Page_last . _Year . _Details . loop_ _Keyword Atg3 autophagy stop_ save_ ################################## # Molecular system description # ################################## save_assembly_1 _Saveframe_category molecular_system _Mol_system_name Atg3 _Enzyme_commission_number . loop_ _Mol_system_component_name _Mol_label Atg3 $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' _Details . ############################## # Polymer residue sequence # ############################## _Residue_count 289 _Mol_residue_sequence ; SKFKETGVITPEEFVAAGDH LVHHCPTWQWATGEELKVKA YLPTGKQFLVTKNVPCYKRC KQMEYSDELEAIIEEDDGDG GWVDTYHNTGITGITEAVKE ITLENKDNIRLQDCSALCEE EEDEDEGEAADMEEYEESGL LETDEATLDTRKIVEACKAK TDAGGEDAILQTRTYDLYIT YDKYYQTPRLWLFGYDEQRQ PLTVEHMYEDISQDHVKKTV TIENHPHLPPPPMCSVHPCR HAEVMKKIIETVAEGGGELG VHMYLLIFLKFVQAVIPTIE YDYTRHFTM ; loop_ _Residue_seq_code _Residue_label 1 SER 2 LYS 3 PHE 4 LYS 5 GLU 6 THR 7 GLY 8 VAL 9 ILE 10 THR 11 PRO 12 GLU 13 GLU 14 PHE 15 VAL 16 ALA 17 ALA 18 GLY 19 ASP 20 HIS 21 LEU 22 VAL 23 HIS 24 HIS 25 CYS 26 PRO 27 THR 28 TRP 29 GLN 30 TRP 31 ALA 32 THR 33 GLY 34 GLU 35 GLU 36 LEU 37 LYS 38 VAL 39 LYS 40 ALA 41 TYR 42 LEU 43 PRO 44 THR 45 GLY 46 LYS 47 GLN 48 PHE 49 LEU 50 VAL 51 THR 52 LYS 53 ASN 54 VAL 55 PRO 56 CYS 57 TYR 58 LYS 59 ARG 60 CYS 61 LYS 62 GLN 63 MET 64 GLU 65 TYR 66 SER 67 ASP 68 GLU 69 LEU 70 GLU 71 ALA 72 ILE 73 ILE 74 GLU 75 GLU 76 ASP 77 ASP 78 GLY 79 ASP 80 GLY 81 GLY 82 TRP 83 VAL 84 ASP 85 THR 86 TYR 87 HIS 88 ASN 89 THR 90 GLY 91 ILE 92 THR 93 GLY 94 ILE 95 THR 96 GLU 97 ALA 98 VAL 99 LYS 100 GLU 101 ILE 102 THR 103 LEU 104 GLU 105 ASN 106 LYS 107 ASP 108 ASN 109 ILE 110 ARG 111 LEU 112 GLN 113 ASP 114 CYS 115 SER 116 ALA 117 LEU 118 CYS 119 GLU 120 GLU 121 GLU 122 GLU 123 ASP 124 GLU 125 ASP 126 GLU 127 GLY 128 GLU 129 ALA 130 ALA 131 ASP 132 MET 133 GLU 134 GLU 135 TYR 136 GLU 137 GLU 138 SER 139 GLY 140 LEU 141 LEU 142 GLU 143 THR 144 ASP 145 GLU 146 ALA 147 THR 148 LEU 149 ASP 150 THR 151 ARG 152 LYS 153 ILE 154 VAL 155 GLU 156 ALA 157 CYS 158 LYS 159 ALA 160 LYS 161 THR 162 ASP 163 ALA 164 GLY 165 GLY 166 GLU 167 ASP 168 ALA 169 ILE 170 LEU 171 GLN 172 THR 173 ARG 174 THR 175 TYR 176 ASP 177 LEU 178 TYR 179 ILE 180 THR 181 TYR 182 ASP 183 LYS 184 TYR 185 TYR 186 GLN 187 THR 188 PRO 189 ARG 190 LEU 191 TRP 192 LEU 193 PHE 194 GLY 195 TYR 196 ASP 197 GLU 198 GLN 199 ARG 200 GLN 201 PRO 202 LEU 203 THR 204 VAL 205 GLU 206 HIS 207 MET 208 TYR 209 GLU 210 ASP 211 ILE 212 SER 213 GLN 214 ASP 215 HIS 216 VAL 217 LYS 218 LYS 219 THR 220 VAL 221 THR 222 ILE 223 GLU 224 ASN 225 HIS 226 PRO 227 HIS 228 LEU 229 PRO 230 PRO 231 PRO 232 PRO 233 MET 234 CYS 235 SER 236 VAL 237 HIS 238 PRO 239 CYS 240 ARG 241 HIS 242 ALA 243 GLU 244 VAL 245 MET 246 LYS 247 LYS 248 ILE 249 ILE 250 GLU 251 THR 252 VAL 253 ALA 254 GLU 255 GLY 256 GLY 257 GLY 258 GLU 259 LEU 260 GLY 261 VAL 262 HIS 263 MET 264 TYR 265 LEU 266 LEU 267 ILE 268 PHE 269 LEU 270 LYS 271 PHE 272 VAL 273 GLN 274 ALA 275 VAL 276 ILE 277 PRO 278 THR 279 ILE 280 GLU 281 TYR 282 ASP 283 TYR 284 THR 285 ARG 286 HIS 287 PHE 288 THR 289 MET stop_ _Sequence_homology_query_date . _Sequence_homology_query_revised_last_date . 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 . plasmid pET28a stop_ save_ ##################################### # Sample contents and methodology # ##################################### ######################## # Sample description # ######################## save_sample_1 _Saveframe_category sample _Sample_type solution _Details 'The sample was prepared with protonated glucose and D2O.' loop_ _Mol_label _Concentration_value _Concentration_value_units _Concentration_min_value _Concentration_max_value _Isotopic_labeling $entity_1 0.4 mM 0.3 0.5 '[U-13C; U-15N]' stop_ save_ ############################ # Computer software used # ############################ save_software_1 _Saveframe_category software _Name NMRPipe _Version . loop_ _Task processing stop_ _Details . save_ save_software_2 _Saveframe_category software _Name NMRView _Version . loop_ _Task 'data analysis' stop_ _Details . save_ ######################### # Experimental detail # ######################### ################################## # NMR Spectrometer definitions # ################################## save_NMR_spectrometer_1 _Saveframe_category NMR_spectrometer _Manufacturer Bruker _Model Avance _Field_strength '600 MHz' _Details . save_ ############################# # NMR applied experiments # ############################# save_2D_1H-15N_TROSY_1 _Saveframe_category NMR_applied_experiment _Experiment_name '2D 1H-15N TROSY' _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_HNCA_3 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HNCA' _Sample_label $sample_1 save_ save_3D_HN(CO)CA_4 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CA' _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_HN(CO)CACB_6 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CO)CACB' _Sample_label $sample_1 save_ save_3D_HN(CA)CO_7 _Saveframe_category NMR_applied_experiment _Experiment_name '3D HN(CA)CO' _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 6.5 . pH pressure 1 . atm temperature 298 . 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 internal indirect . . . 0.25144953 DSS H 1 'methyl protons' ppm 0 internal direct . . . 1.00 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_chemical_shifts_1 _Saveframe_category assigned_chemical_shifts _Details . loop_ _Software_label $software_1 $software_2 stop_ loop_ _Experiment_label '3D HNCO' '3D HNCA' '3D HN(CO)CA' '3D HNCACB' '3D HN(CO)CACB' '3D HN(CA)CO' 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 Atg3 _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 SER C C 175.8200 . 1 2 1 1 SER CA C 58.1200 . 1 3 1 1 SER CB C 63.2600 . 1 4 2 2 LYS H H 8.9100 . 1 5 2 2 LYS C C 178.1600 . 1 6 2 2 LYS CA C 56.1600 . 1 7 2 2 LYS CB C 31.3800 . 1 8 2 2 LYS N N 126.4800 . 1 9 3 3 PHE H H 8.5260 . 1 10 3 3 PHE C C 176.3400 . 1 11 3 3 PHE CA C 60.2800 . 1 12 3 3 PHE CB C 38.3300 . 1 13 3 3 PHE N N 124.1900 . 1 14 4 4 LYS H H 7.7740 . 1 15 4 4 LYS C C 177.6400 . 1 16 4 4 LYS CA C 57.7900 . 1 17 4 4 LYS N N 118.6400 . 1 18 5 5 GLU C C 177.6400 . 1 19 5 5 GLU CA C 57.1500 . 1 20 5 5 GLU CB C 30.1800 . 1 21 6 6 THR H H 7.9370 . 1 22 6 6 THR C C 175.6200 . 1 23 6 6 THR CA C 61.4300 . 1 24 6 6 THR CB C 70.8300 . 1 25 6 6 THR N N 106.9100 . 1 26 7 7 GLY H H 8.3680 . 1 27 7 7 GLY C C 172.7000 . 1 28 7 7 GLY CA C 45.6200 . 1 29 7 7 GLY N N 111.1300 . 1 30 8 8 VAL H H 7.1080 . 1 31 8 8 VAL C C 175.6400 . 1 32 8 8 VAL CA C 60.0600 . 1 33 8 8 VAL CB C 31.7600 . 1 34 8 8 VAL N N 113.4100 . 1 35 9 9 ILE H H 8.5350 . 1 36 9 9 ILE C C 176.2200 . 1 37 9 9 ILE CA C 58.1200 . 1 38 9 9 ILE CB C 42.1800 . 1 39 9 9 ILE N N 112.3700 . 1 40 10 10 THR H H 9.2190 . 1 41 10 10 THR C C 173.6200 . 1 42 10 10 THR CA C 59.8900 . 1 43 10 10 THR CB C 67.7700 . 1 44 10 10 THR N N 116.6700 . 1 45 11 11 PRO C C 178.0400 . 1 46 11 11 PRO CA C 65.3500 . 1 47 11 11 PRO CB C 31.1200 . 1 48 12 12 GLU H H 8.3470 . 1 49 12 12 GLU C C 180.3000 . 1 50 12 12 GLU CA C 60.0900 . 1 51 12 12 GLU CB C 28.1800 . 1 52 12 12 GLU N N 115.8800 . 1 53 14 14 PHE C C 176.8300 . 1 54 14 14 PHE CA C 61.4200 . 1 55 14 14 PHE CB C 37.8500 . 1 56 15 15 VAL H H 7.9350 . 1 57 15 15 VAL C C 177.7700 . 1 58 15 15 VAL CA C 65.7500 . 1 59 15 15 VAL CB C 30.6000 . 1 60 15 15 VAL N N 119.5000 . 1 61 16 16 ALA H H 7.6700 . 1 62 16 16 ALA C C 181.6200 . 1 63 16 16 ALA CA C 54.8800 . 1 64 16 16 ALA CB C 16.9300 . 1 65 16 16 ALA N N 122.3000 . 1 66 17 17 ALA H H 8.6830 . 1 67 17 17 ALA C C 181.5200 . 1 68 17 17 ALA CA C 53.4600 . 1 69 17 17 ALA CB C 17.4600 . 1 70 17 17 ALA N N 121.8600 . 1 71 18 18 GLY H H 9.1210 . 1 72 18 18 GLY C C 174.2600 . 1 73 18 18 GLY CA C 47.3200 . 1 74 18 18 GLY N N 113.4600 . 1 75 19 19 ASP H H 9.3570 . 1 76 19 19 ASP C C 179.2700 . 1 77 19 19 ASP CA C 57.1100 . 1 78 19 19 ASP CB C 39.2400 . 1 79 19 19 ASP N N 122.8300 . 1 80 20 20 HIS H H 7.7540 . 1 81 20 20 HIS C C 177.4100 . 1 82 20 20 HIS CA C 60.3000 . 1 83 20 20 HIS CB C 31.0200 . 1 84 20 20 HIS N N 120.4800 . 1 85 21 21 LEU H H 7.7030 . 1 86 21 21 LEU C C 177.2700 . 1 87 21 21 LEU CA C 58.6800 . 1 88 21 21 LEU CB C 41.4100 . 1 89 21 21 LEU N N 120.5500 . 1 90 22 22 VAL H H 8.2550 . 1 91 22 22 VAL C C 178.1200 . 1 92 22 22 VAL CA C 64.4800 . 1 93 22 22 VAL CB C 30.8500 . 1 94 22 22 VAL N N 115.6800 . 1 95 23 23 HIS H H 7.6100 . 1 96 23 23 HIS C C 176.4600 . 1 97 23 23 HIS CA C 57.7500 . 1 98 23 23 HIS CB C 28.8700 . 1 99 23 23 HIS N N 116.6800 . 1 100 24 24 HIS H H 7.6630 . 1 101 24 24 HIS C C 175.9100 . 1 102 24 24 HIS CA C 58.7000 . 1 103 24 24 HIS CB C 30.7700 . 1 104 24 24 HIS N N 115.7200 . 1 105 25 25 CYS H H 8.8240 . 1 106 25 25 CYS C C 172.3700 . 1 107 25 25 CYS CA C 55.9000 . 1 108 25 25 CYS CB C 29.1300 . 1 109 25 25 CYS N N 119.0500 . 1 110 26 26 PRO C C 177.7900 . 1 111 26 26 PRO CA C 64.5500 . 1 112 26 26 PRO CB C 31.0900 . 1 113 27 27 THR H H 7.4930 . 1 114 27 27 THR C C 176.8400 . 1 115 27 27 THR CA C 63.4000 . 1 116 27 27 THR CB C 67.9100 . 1 117 27 27 THR N N 110.6400 . 1 118 28 28 TRP H H 8.8350 . 1 119 28 28 TRP C C 174.4600 . 1 120 28 28 TRP CA C 56.6800 . 1 121 28 28 TRP CB C 29.6800 . 1 122 28 28 TRP N N 128.3700 . 1 123 29 29 GLN H H 8.6690 . 1 124 29 29 GLN C C 175.5100 . 1 125 29 29 GLN CA C 53.4400 . 1 126 29 29 GLN CB C 33.1000 . 1 127 29 29 GLN N N 115.3500 . 1 128 30 30 TRP H H 8.4430 . 1 129 30 30 TRP C C 177.0400 . 1 130 30 30 TRP CA C 57.3800 . 1 131 30 30 TRP CB C 31.6300 . 1 132 30 30 TRP N N 120.9100 . 1 133 31 31 ALA H H 8.9260 . 1 134 31 31 ALA C C 175.4400 . 1 135 31 31 ALA CA C 50.7100 . 1 136 31 31 ALA CB C 22.4900 . 1 137 31 31 ALA N N 124.1600 . 1 138 32 32 THR H H 7.8490 . 1 139 32 32 THR C C 174.5200 . 1 140 32 32 THR CA C 64.3700 . 1 141 32 32 THR CB C 70.9600 . 1 142 32 32 THR N N 115.1800 . 1 143 33 33 GLY H H 8.0290 . 1 144 33 33 GLY C C 173.3900 . 1 145 33 33 GLY CA C 44.0400 . 1 146 33 33 GLY N N 107.7900 . 1 147 34 34 GLU H H 8.5660 . 1 148 34 34 GLU C C 179.6200 . 1 149 34 34 GLU CA C 56.8500 . 1 150 34 34 GLU CB C 29.7000 . 1 151 34 34 GLU N N 120.4500 . 1 152 35 35 GLU H H 9.0620 . 1 153 35 35 GLU C C 178.8900 . 1 154 35 35 GLU CA C 59.8200 . 1 155 35 35 GLU CB C 29.1300 . 1 156 35 35 GLU N N 128.4000 . 1 157 36 36 LEU H H 8.4830 . 1 158 36 36 LEU C C 177.8900 . 1 159 36 36 LEU CA C 55.9800 . 1 160 36 36 LEU CB C 40.6000 . 1 161 36 36 LEU N N 116.6900 . 1 162 37 37 LYS H H 7.5230 . 1 163 37 37 LYS C C 174.8400 . 1 164 37 37 LYS CA C 55.1900 . 1 165 37 37 LYS CB C 32.1900 . 1 166 37 37 LYS N N 117.6200 . 1 167 38 38 VAL H H 6.7990 . 1 168 38 38 VAL C C 177.4300 . 1 169 38 38 VAL CA C 63.2300 . 1 170 38 38 VAL CB C 32.0800 . 1 171 38 38 VAL N N 120.9000 . 1 172 39 39 LYS H H 10.0210 . 1 173 39 39 LYS C C 178.0800 . 1 174 39 39 LYS CA C 52.6100 . 1 175 39 39 LYS CB C 31.5100 . 1 176 39 39 LYS N N 128.8700 . 1 177 40 40 ALA H H 8.6610 . 1 178 40 40 ALA C C 177.0700 . 1 179 40 40 ALA CA C 53.6500 . 1 180 40 40 ALA CB C 17.7100 . 1 181 40 40 ALA N N 124.6300 . 1 182 41 41 TYR H H 6.1750 . 1 183 41 41 TYR C C 174.0100 . 1 184 41 41 TYR CA C 54.9900 . 1 185 41 41 TYR CB C 35.9700 . 1 186 41 41 TYR N N 109.1500 . 1 187 42 42 LEU H H 7.2200 . 1 188 42 42 LEU C C 172.6000 . 1 189 42 42 LEU CA C 51.7700 . 1 190 42 42 LEU CB C 42.7600 . 1 191 42 42 LEU N N 124.9500 . 1 192 43 43 PRO C C 179.8600 . 1 193 43 43 PRO CA C 61.4400 . 1 194 43 43 PRO CB C 30.1800 . 1 195 44 44 THR H H 8.7690 . 1 196 44 44 THR C C 175.2300 . 1 197 44 44 THR CA C 66.7100 . 1 198 44 44 THR CB C 68.0000 . 1 199 44 44 THR N N 123.7500 . 1 200 45 45 GLY H H 8.3060 . 1 201 45 45 GLY C C 173.0100 . 1 202 45 45 GLY CA C 44.2400 . 1 203 45 45 GLY N N 104.9800 . 1 204 46 46 LYS H H 7.1870 . 1 205 46 46 LYS C C 171.0200 . 1 206 46 46 LYS CA C 54.2600 . 1 207 46 46 LYS CB C 31.3300 . 1 208 46 46 LYS N N 121.7400 . 1 209 47 47 GLN H H 6.6880 . 1 210 47 47 GLN C C 175.7100 . 1 211 47 47 GLN CA C 56.3800 . 1 212 47 47 GLN CB C 29.1900 . 1 213 47 47 GLN N N 114.2400 . 1 214 48 48 PHE H H 7.6520 . 1 215 48 48 PHE C C 171.4700 . 1 216 48 48 PHE CA C 55.6000 . 1 217 48 48 PHE CB C 39.9900 . 1 218 48 48 PHE N N 108.7200 . 1 219 49 49 LEU H H 9.0230 . 1 220 49 49 LEU C C 176.9100 . 1 221 49 49 LEU CA C 53.5200 . 1 222 49 49 LEU CB C 44.7200 . 1 223 49 49 LEU N N 121.3500 . 1 224 50 50 VAL H H 9.4710 . 1 225 50 50 VAL C C 173.0600 . 1 226 50 50 VAL CA C 58.5500 . 1 227 50 50 VAL CB C 34.9400 . 1 228 50 50 VAL N N 120.4100 . 1 229 51 51 THR H H 8.4070 . 1 230 51 51 THR C C 171.3900 . 1 231 51 51 THR CA C 59.6900 . 1 232 51 51 THR CB C 69.9300 . 1 233 51 51 THR N N 124.6600 . 1 234 52 52 LYS H H 7.9230 . 1 235 52 52 LYS C C 176.7100 . 1 236 52 52 LYS CA C 54.5800 . 1 237 52 52 LYS CB C 34.8400 . 1 238 52 52 LYS N N 124.6800 . 1 239 53 53 ASN H H 8.5010 . 1 240 53 53 ASN C C 174.3600 . 1 241 53 53 ASN CA C 54.0700 . 1 242 53 53 ASN CB C 36.9700 . 1 243 53 53 ASN N N 117.6500 . 1 244 54 54 VAL H H 9.5740 . 1 245 54 54 VAL C C 174.9400 . 1 246 54 54 VAL CA C 59.9300 . 1 247 54 54 VAL CB C 30.8800 . 1 248 54 54 VAL N N 122.7900 . 1 249 56 56 CYS C C 174.8400 . 1 250 56 56 CYS CA C 57.3100 . 1 251 56 56 CYS CB C 27.5700 . 1 252 57 57 TYR H H 9.2980 . 1 253 57 57 TYR C C 174.9400 . 1 254 57 57 TYR CA C 60.2700 . 1 255 57 57 TYR CB C 38.8400 . 1 256 57 57 TYR N N 127.4700 . 1 257 58 58 LYS H H 7.4150 . 1 258 58 58 LYS C C 174.0600 . 1 259 58 58 LYS CA C 53.8400 . 1 260 58 58 LYS CB C 34.9300 . 1 261 58 58 LYS N N 115.7300 . 1 262 59 59 ARG H H 8.4430 . 1 263 59 59 ARG C C 177.9400 . 1 264 59 59 ARG CA C 53.4200 . 1 265 59 59 ARG CB C 31.8200 . 1 266 59 59 ARG N N 119.0300 . 1 267 60 60 CYS H H 8.1870 . 1 268 60 60 CYS CA C 54.9100 . 1 269 60 60 CYS CB C 26.5100 . 1 270 60 60 CYS N N 119.6200 . 1 271 64 64 GLU C C 175.8500 . 1 272 64 64 GLU CA C 55.9200 . 1 273 64 64 GLU CB C 29.6200 . 1 274 65 65 TYR H H 8.1730 . 1 275 65 65 TYR C C 175.6600 . 1 276 65 65 TYR CA C 57.5400 . 1 277 65 65 TYR CB C 38.2400 . 1 278 65 65 TYR N N 122.2300 . 1 279 66 66 SER H H 8.0650 . 1 280 66 66 SER C C 174.1100 . 1 281 66 66 SER CA C 57.5100 . 1 282 66 66 SER CB C 63.7600 . 1 283 66 66 SER N N 118.2800 . 1 284 67 67 ASP C C 176.4100 . 1 285 67 67 ASP CA C 54.1700 . 1 286 67 67 ASP CB C 40.7700 . 1 287 68 68 GLU H H 8.2270 . 1 288 68 68 GLU C C 176.6400 . 1 289 68 68 GLU CA C 56.5200 . 1 290 68 68 GLU CB C 29.3000 . 1 291 68 68 GLU N N 121.2100 . 1 292 69 69 LEU H H 8.0480 . 1 293 69 69 LEU C C 177.4500 . 1 294 69 69 LEU CA C 55.0200 . 1 295 69 69 LEU CB C 41.3200 . 1 296 69 69 LEU N N 122.7900 . 1 297 70 70 GLU H H 8.1250 . 1 298 70 70 GLU C C 176.0400 . 1 299 70 70 GLU CA C 56.2000 . 1 300 70 70 GLU CB C 29.4100 . 1 301 70 70 GLU N N 121.8400 . 1 302 71 71 ALA H H 8.0230 . 1 303 71 71 ALA C C 177.3600 . 1 304 71 71 ALA CA C 51.9100 . 1 305 71 71 ALA CB C 18.5200 . 1 306 71 71 ALA N N 125.1300 . 1 307 72 72 ILE H H 7.9710 . 1 308 72 72 ILE C C 176.0900 . 1 309 72 72 ILE CA C 60.6700 . 1 310 72 72 ILE CB C 37.6900 . 1 311 72 72 ILE N N 121.3700 . 1 312 73 73 ILE H H 8.1110 . 1 313 73 73 ILE C C 176.0200 . 1 314 73 73 ILE CA C 60.4700 . 1 315 73 73 ILE CB C 37.7400 . 1 316 73 73 ILE N N 126.0500 . 1 317 74 74 GLU H H 8.3590 . 1 318 74 74 GLU C C 176.1000 . 1 319 74 74 GLU CA C 55.8600 . 1 320 74 74 GLU CB C 29.6900 . 1 321 74 74 GLU N N 126.1400 . 1 322 75 75 GLU H H 8.3330 . 1 323 75 75 GLU CA C 56.1700 . 1 324 75 75 GLU CB C 29.6600 . 1 325 75 75 GLU N N 123.3900 . 1 326 76 76 ASP C C 177.2300 . 1 327 76 76 ASP CA C 55.2000 . 1 328 77 77 ASP H H 8.2290 . 1 329 77 77 ASP C C 177.0000 . 1 330 77 77 ASP CA C 56.3100 . 1 331 77 77 ASP N N 121.8100 . 1 332 78 78 GLY H H 8.3230 . 1 333 78 78 GLY C C 174.1500 . 1 334 78 78 GLY CA C 45.0100 . 1 335 78 78 GLY N N 110.0800 . 1 336 79 79 ASP H H 8.2170 . 1 337 79 79 ASP C C 177.0200 . 1 338 79 79 ASP CA C 54.1000 . 1 339 79 79 ASP N N 121.1400 . 1 340 80 80 GLY H H 8.3390 . 1 341 80 80 GLY C C 173.4100 . 1 342 80 80 GLY CA C 45.2200 . 1 343 80 80 GLY N N 109.8800 . 1 344 81 81 GLY C C 173.8800 . 1 345 81 81 GLY CA C 44.8800 . 1 346 82 82 TRP H H 7.9370 . 1 347 82 82 TRP C C 176.1300 . 1 348 82 82 TRP CA C 57.3500 . 1 349 82 82 TRP CB C 29.1800 . 1 350 82 82 TRP N N 121.8600 . 1 351 83 83 VAL H H 7.6560 . 1 352 83 83 VAL C C 175.2000 . 1 353 83 83 VAL CA C 61.6600 . 1 354 83 83 VAL CB C 32.1500 . 1 355 83 83 VAL N N 122.7800 . 1 356 84 84 ASP H H 8.0860 . 1 357 84 84 ASP C C 176.5100 . 1 358 84 84 ASP CA C 53.8400 . 1 359 84 84 ASP CB C 40.6600 . 1 360 84 84 ASP N N 123.7100 . 1 361 85 85 THR H H 7.8610 . 1 362 85 85 THR C C 174.6200 . 1 363 85 85 THR CA C 62.1000 . 1 364 85 85 THR CB C 69.0700 . 1 365 85 85 THR N N 115.2600 . 1 366 86 86 TYR H H 8.0670 . 1 367 86 86 TYR C C 175.8300 . 1 368 86 86 TYR CA C 58.0600 . 1 369 86 86 TYR CB C 37.8400 . 1 370 86 86 TYR N N 122.3000 . 1 371 87 87 HIS H H 8.0340 . 1 372 87 87 HIS C C 174.2100 . 1 373 87 87 HIS CA C 55.2600 . 1 374 87 87 HIS CB C 29.1000 . 1 375 87 87 HIS N N 120.4100 . 1 376 88 88 ASN C C 175.4700 . 1 377 88 88 ASN CA C 53.0200 . 1 378 88 88 ASN CB C 38.0200 . 1 379 89 89 THR H H 8.0930 . 1 380 89 89 THR C C 175.2500 . 1 381 89 89 THR CA C 61.8100 . 1 382 89 89 THR CB C 69.1200 . 1 383 89 89 THR N N 114.6800 . 1 384 90 90 GLY H H 8.3020 . 1 385 90 90 GLY C C 174.1600 . 1 386 90 90 GLY CA C 45.0200 . 1 387 90 90 GLY N N 111.5100 . 1 388 91 91 ILE H H 7.9040 . 1 389 91 91 ILE C C 176.6600 . 1 390 91 91 ILE CA C 60.8900 . 1 391 91 91 ILE CB C 37.8100 . 1 392 91 91 ILE N N 120.5300 . 1 393 92 92 THR H H 8.1600 . 1 394 92 92 THR C C 175.0600 . 1 395 92 92 THR CA C 61.7400 . 1 396 92 92 THR CB C 69.3100 . 1 397 92 92 THR N N 118.2400 . 1 398 93 93 GLY H H 8.2470 . 1 399 93 93 GLY C C 174.0600 . 1 400 93 93 GLY CA C 44.9800 . 1 401 93 93 GLY N N 111.5400 . 1 402 94 94 ILE H H 7.9040 . 1 403 94 94 ILE C C 176.6600 . 1 404 94 94 ILE CA C 60.8900 . 1 405 94 94 ILE CB C 37.8100 . 1 406 94 94 ILE N N 120.5300 . 1 407 95 95 THR H H 8.1190 . 1 408 95 95 THR C C 174.4600 . 1 409 95 95 THR CA C 61.7200 . 1 410 95 95 THR CB C 69.5500 . 1 411 95 95 THR N N 118.4500 . 1 412 96 96 GLU H H 8.2660 . 1 413 96 96 GLU C C 176.0200 . 1 414 96 96 GLU CA C 56.1600 . 1 415 96 96 GLU CB C 29.6400 . 1 416 96 96 GLU N N 124.1300 . 1 417 97 97 ALA H H 8.1610 . 1 418 97 97 ALA C C 177.7000 . 1 419 97 97 ALA CA C 52.1600 . 1 420 97 97 ALA CB C 18.2800 . 1 421 97 97 ALA N N 125.6900 . 1 422 98 98 VAL H H 7.9790 . 1 423 98 98 VAL C C 176.2500 . 1 424 98 98 VAL CA C 62.0800 . 1 425 98 98 VAL CB C 31.7800 . 1 426 98 98 VAL N N 120.1100 . 1 427 99 99 LYS H H 8.2000 . 1 428 99 99 LYS C C 176.3000 . 1 429 99 99 LYS CA C 55.9400 . 1 430 99 99 LYS CB C 32.0900 . 1 431 99 99 LYS N N 125.5900 . 1 432 100 100 GLU H H 8.2590 . 1 433 100 100 GLU C C 176.3300 . 1 434 100 100 GLU CA C 56.1200 . 1 435 100 100 GLU CB C 29.4100 . 1 436 100 100 GLU N N 122.8100 . 1 437 101 101 ILE H H 8.1320 . 1 438 101 101 ILE C C 176.3500 . 1 439 101 101 ILE CA C 60.8200 . 1 440 101 101 ILE CB C 37.7800 . 1 441 101 101 ILE N N 122.8600 . 1 442 102 102 THR H H 8.1570 . 1 443 102 102 THR C C 174.3600 . 1 444 102 102 THR CA C 61.3500 . 1 445 102 102 THR CB C 69.4400 . 1 446 102 102 THR N N 119.5000 . 1 447 103 103 LEU H H 8.2000 . 1 448 103 103 LEU C C 177.2900 . 1 449 103 103 LEU CA C 54.8200 . 1 450 103 103 LEU CB C 41.4500 . 1 451 103 103 LEU N N 125.5400 . 1 452 104 104 GLU H H 8.2590 . 1 453 104 104 GLU C C 176.1600 . 1 454 104 104 GLU CA C 56.2200 . 1 455 104 104 GLU CB C 29.4400 . 1 456 104 104 GLU N N 121.8400 . 1 457 105 105 ASN H H 8.3260 . 1 458 105 105 ASN C C 175.4800 . 1 459 105 105 ASN CA C 52.9700 . 1 460 105 105 ASN CB C 38.3400 . 1 461 105 105 ASN N N 120.4500 . 1 462 106 106 LYS H H 8.2440 . 1 463 106 106 LYS C C 176.4700 . 1 464 106 106 LYS CA C 56.3500 . 1 465 106 106 LYS CB C 32.0300 . 1 466 106 106 LYS N N 122.7000 . 1 467 107 107 ASP H H 8.2120 . 1 468 107 107 ASP C C 175.6900 . 1 469 107 107 ASP CA C 54.4300 . 1 470 107 107 ASP CB C 40.8400 . 1 471 107 107 ASP N N 120.9300 . 1 472 108 108 ASN H H 8.1300 . 1 473 108 108 ASN C C 175.2500 . 1 474 108 108 ASN CA C 53.1300 . 1 475 108 108 ASN CB C 38.2700 . 1 476 108 108 ASN N N 119.0300 . 1 477 109 109 ILE H H 7.8700 . 1 478 109 109 ILE C C 176.2500 . 1 479 109 109 ILE CA C 61.1300 . 1 480 109 109 ILE CB C 37.7000 . 1 481 109 109 ILE N N 121.3800 . 1 482 110 110 ARG H H 8.2180 . 1 483 110 110 ARG C C 176.2700 . 1 484 110 110 ARG CA C 55.6300 . 1 485 110 110 ARG CB C 29.7000 . 1 486 110 110 ARG N N 125.1400 . 1 487 111 111 LEU H H 8.1330 . 1 488 111 111 LEU C C 177.4900 . 1 489 111 111 LEU CA C 55.0000 . 1 490 111 111 LEU CB C 40.9900 . 1 491 111 111 LEU N N 124.1600 . 1 492 112 112 GLN C C 175.6800 . 1 493 112 112 GLN CA C 55.5600 . 1 494 112 112 GLN CB C 29.0400 . 1 495 113 113 ASP H H 8.2200 . 1 496 113 113 ASP C C 176.2900 . 1 497 113 113 ASP CA C 54.0600 . 1 498 113 113 ASP CB C 40.7400 . 1 499 113 113 ASP N N 121.9400 . 1 500 114 114 CYS H H 8.2530 . 1 501 114 114 CYS C C 174.8700 . 1 502 114 114 CYS CA C 58.3700 . 1 503 114 114 CYS CB C 27.6700 . 1 504 114 114 CYS N N 120.4300 . 1 505 115 115 SER H H 8.3450 . 1 506 115 115 SER C C 174.2900 . 1 507 115 115 SER CA C 58.7100 . 1 508 115 115 SER CB C 63.2400 . 1 509 115 115 SER N N 119.0100 . 1 510 116 116 ALA H H 8.1030 . 1 511 116 116 ALA C C 177.4800 . 1 512 116 116 ALA CA C 52.1000 . 1 513 116 116 ALA CB C 18.4100 . 1 514 116 116 ALA N N 126.0700 . 1 515 117 117 LEU H H 8.0040 . 1 516 117 117 LEU C C 177.3300 . 1 517 117 117 LEU CA C 54.8500 . 1 518 117 117 LEU CB C 41.3200 . 1 519 117 117 LEU N N 121.4900 . 1 520 118 118 CYS C C 174.4600 . 1 521 118 118 CYS CA C 57.9800 . 1 522 118 118 CYS CB C 27.6400 . 1 523 119 119 GLU H H 8.4290 . 1 524 119 119 GLU C C 176.2700 . 1 525 119 119 GLU CA C 56.2500 . 1 526 119 119 GLU CB C 29.2200 . 1 527 119 119 GLU N N 124.1800 . 1 528 120 120 GLU H H 8.2920 . 1 529 120 120 GLU C C 176.2900 . 1 530 120 120 GLU CA C 56.3100 . 1 531 120 120 GLU N N 122.4500 . 1 532 121 121 GLU H H 8.2350 . 1 533 121 121 GLU C C 176.0400 . 1 534 121 121 GLU CA C 55.9500 . 1 535 121 121 GLU CB C 29.3900 . 1 536 121 121 GLU N N 122.2900 . 1 537 122 122 GLU C C 176.0200 . 1 538 122 122 GLU CA C 55.9800 . 1 539 122 122 GLU CB C 29.5400 . 1 540 123 123 ASP H H 8.0940 . 1 541 123 123 ASP C C 175.5900 . 1 542 123 123 ASP CA C 57.4800 . 1 543 123 123 ASP CB C 38.3100 . 1 544 123 123 ASP N N 122.2000 . 1 545 124 124 GLU H H 8.1400 . 1 546 124 124 GLU C C 176.0800 . 1 547 124 124 GLU CA C 55.7700 . 1 548 124 124 GLU CB C 28.9900 . 1 549 124 124 GLU N N 124.1500 . 1 550 125 125 ASP H H 8.2200 . 1 551 125 125 ASP C C 176.2900 . 1 552 125 125 ASP CA C 54.0600 . 1 553 125 125 ASP CB C 40.7400 . 1 554 125 125 ASP N N 121.9400 . 1 555 126 126 GLU H H 8.3750 . 1 556 126 126 GLU C C 177.1300 . 1 557 126 126 GLU CA C 56.4000 . 1 558 126 126 GLU CB C 29.3100 . 1 559 126 126 GLU N N 122.8200 . 1 560 127 127 GLY H H 8.3270 . 1 561 127 127 GLY C C 174.1300 . 1 562 127 127 GLY CA C 44.8400 . 1 563 127 127 GLY N N 110.1100 . 1 564 128 128 GLU H H 8.1780 . 1 565 128 128 GLU C C 176.3300 . 1 566 128 128 GLU CA C 55.8900 . 1 567 128 128 GLU CB C 29.3800 . 1 568 128 128 GLU N N 121.3600 . 1 569 129 129 ALA H H 8.2680 . 1 570 129 129 ALA C C 177.5400 . 1 571 129 129 ALA CA C 52.0700 . 1 572 129 129 ALA CB C 18.4500 . 1 573 129 129 ALA N N 126.0700 . 1 574 130 130 ALA H H 8.1670 . 1 575 130 130 ALA C C 177.4900 . 1 576 130 130 ALA CA C 52.0300 . 1 577 130 130 ALA CB C 18.5100 . 1 578 130 130 ALA N N 124.1800 . 1 579 131 131 ASP H H 8.1810 . 1 580 131 131 ASP C C 176.2600 . 1 581 131 131 ASP CA C 53.9700 . 1 582 131 131 ASP CB C 40.4100 . 1 583 131 131 ASP N N 120.0100 . 1 584 132 132 MET H H 8.1580 . 1 585 132 132 MET C C 176.2800 . 1 586 132 132 MET CA C 55.0400 . 1 587 132 132 MET CB C 32.1100 . 1 588 132 132 MET N N 121.3600 . 1 589 137 137 GLU C C 176.6900 . 1 590 137 137 GLU CA C 56.2300 . 1 591 137 137 GLU CB C 29.3400 . 1 592 138 138 SER H H 8.3310 . 1 593 138 138 SER C C 175.2700 . 1 594 138 138 SER CA C 58.4800 . 1 595 138 138 SER CB C 63.6300 . 1 596 138 138 SER N N 118.0800 . 1 597 139 139 GLY H H 8.3610 . 1 598 139 139 GLY C C 174.0400 . 1 599 139 139 GLY CA C 44.9900 . 1 600 139 139 GLY N N 111.5200 . 1 601 140 140 LEU H H 7.9230 . 1 602 140 140 LEU C C 177.2400 . 1 603 140 140 LEU CA C 54.8100 . 1 604 140 140 LEU CB C 41.3200 . 1 605 140 140 LEU N N 121.8900 . 1 606 141 141 LEU H H 8.1220 . 1 607 141 141 LEU C C 177.2900 . 1 608 141 141 LEU CA C 54.6200 . 1 609 141 141 LEU CB C 41.5200 . 1 610 141 141 LEU N N 123.3100 . 1 611 142 142 GLU H H 8.3100 . 1 612 142 142 GLU C C 176.5400 . 1 613 142 142 GLU CA C 56.0900 . 1 614 142 142 GLU N N 122.7400 . 1 615 143 143 THR H H 8.0040 . 1 616 143 143 THR C C 174.2200 . 1 617 143 143 THR CA C 61.2400 . 1 618 143 143 THR CB C 69.4100 . 1 619 143 143 THR N N 115.2300 . 1 620 144 144 ASP H H 8.2740 . 1 621 144 144 ASP C C 176.4600 . 1 622 144 144 ASP CA C 54.0800 . 1 623 144 144 ASP CB C 40.7400 . 1 624 144 144 ASP N N 123.2700 . 1 625 145 145 GLU H H 8.3390 . 1 626 145 145 GLU C C 176.6500 . 1 627 145 145 GLU CA C 56.7700 . 1 628 145 145 GLU N N 122.8000 . 1 629 146 146 ALA H H 8.2200 . 1 630 146 146 ALA C C 178.2800 . 1 631 146 146 ALA CA C 52.5900 . 1 632 146 146 ALA CB C 18.4800 . 1 633 146 146 ALA N N 124.6000 . 1 634 147 147 THR H H 7.9100 . 1 635 147 147 THR C C 174.8300 . 1 636 147 147 THR CA C 61.8100 . 1 637 147 147 THR CB C 69.0500 . 1 638 147 147 THR N N 113.4000 . 1 639 148 148 LEU H H 8.0100 . 1 640 148 148 LEU C C 177.2100 . 1 641 148 148 LEU CA C 55.2500 . 1 642 148 148 LEU CB C 41.3500 . 1 643 148 148 LEU N N 124.6500 . 1 644 149 149 ASP C C 176.9600 . 1 645 149 149 ASP CA C 54.1000 . 1 646 149 149 ASP CB C 40.2400 . 1 647 150 150 THR H H 7.9890 . 1 648 150 150 THR C C 175.2300 . 1 649 150 150 THR CA C 62.2900 . 1 650 150 150 THR CB C 68.9000 . 1 651 150 150 THR N N 115.2800 . 1 652 151 151 ARG H H 8.1010 . 1 653 151 151 ARG C C 176.6200 . 1 654 151 151 ARG CA C 56.5600 . 1 655 151 151 ARG CB C 29.3800 . 1 656 151 151 ARG N N 122.8300 . 1 657 152 152 LYS H H 8.0170 . 1 658 152 152 LYS C C 176.6900 . 1 659 152 152 LYS CA C 56.2300 . 1 660 152 152 LYS CB C 31.9200 . 1 661 152 152 LYS N N 121.8300 . 1 662 153 153 ILE H H 7.9390 . 1 663 153 153 ILE C C 176.5500 . 1 664 153 153 ILE CA C 61.1400 . 1 665 153 153 ILE CB C 37.3900 . 1 666 153 153 ILE N N 122.8000 . 1 667 154 154 VAL H H 8.0610 . 1 668 154 154 VAL C C 176.4800 . 1 669 154 154 VAL CA C 62.3200 . 1 670 154 154 VAL CB C 31.8800 . 1 671 154 154 VAL N N 124.6500 . 1 672 155 155 GLU H H 8.3080 . 1 673 155 155 GLU C C 176.4700 . 1 674 155 155 GLU CA C 56.3700 . 1 675 155 155 GLU CB C 29.1800 . 1 676 155 155 GLU N N 124.7200 . 1 677 156 156 ALA H H 8.1900 . 1 678 156 156 ALA C C 177.9100 . 1 679 156 156 ALA CA C 52.5000 . 1 680 156 156 ALA CB C 18.2800 . 1 681 156 156 ALA N N 125.4100 . 1 682 157 157 CYS H H 8.1800 . 1 683 157 157 CYS C C 174.8300 . 1 684 157 157 CYS CA C 58.5500 . 1 685 157 157 CYS CB C 27.3300 . 1 686 157 157 CYS N N 118.5900 . 1 687 158 158 LYS H H 8.1750 . 1 688 158 158 LYS C C 176.2800 . 1 689 158 158 LYS CA C 56.1300 . 1 690 158 158 LYS CB C 32.1100 . 1 691 158 158 LYS N N 124.2400 . 1 692 159 159 ALA H H 8.1320 . 1 693 159 159 ALA C C 177.7200 . 1 694 159 159 ALA CA C 52.1500 . 1 695 159 159 ALA CB C 18.4200 . 1 696 159 159 ALA N N 125.4100 . 1 697 160 160 LYS H H 8.1870 . 1 698 160 160 LYS C C 176.9600 . 1 699 160 160 LYS CA C 55.9600 . 1 700 160 160 LYS CB C 32.1500 . 1 701 160 160 LYS N N 121.3800 . 1 702 161 161 THR H H 8.0790 . 1 703 161 161 THR C C 174.4100 . 1 704 161 161 THR CA C 61.4400 . 1 705 161 161 THR CB C 69.3600 . 1 706 161 161 THR N N 115.6900 . 1 707 162 162 ASP H H 8.2610 . 1 708 162 162 ASP C C 176.3100 . 1 709 162 162 ASP CA C 54.0800 . 1 710 162 162 ASP CB C 40.7400 . 1 711 162 162 ASP N N 123.2800 . 1 712 163 163 ALA H H 8.1780 . 1 713 163 163 ALA C C 178.2700 . 1 714 163 163 ALA CA C 52.4100 . 1 715 163 163 ALA CB C 18.4100 . 1 716 163 163 ALA N N 125.1500 . 1 717 164 164 GLY H H 8.3330 . 1 718 164 164 GLY C C 174.8400 . 1 719 164 164 GLY CA C 45.0000 . 1 720 164 164 GLY N N 108.7200 . 1 721 165 165 GLY H H 8.1480 . 1 722 165 165 GLY C C 174.6400 . 1 723 165 165 GLY CA C 44.8900 . 1 724 165 165 GLY N N 109.3200 . 1 725 166 166 GLU H H 8.3820 . 1 726 166 166 GLU C C 176.5400 . 1 727 166 166 GLU CA C 56.5600 . 1 728 166 166 GLU CB C 29.1800 . 1 729 166 166 GLU N N 121.3800 . 1 730 167 167 ASP H H 8.2920 . 1 731 167 167 ASP C C 176.1300 . 1 732 167 167 ASP CA C 54.3100 . 1 733 167 167 ASP CB C 40.5600 . 1 734 167 167 ASP N N 121.3000 . 1 735 168 168 ALA H H 7.9830 . 1 736 168 168 ALA C C 177.8700 . 1 737 168 168 ALA CA C 52.4400 . 1 738 168 168 ALA CB C 18.5000 . 1 739 168 168 ALA N N 124.2200 . 1 740 169 169 ILE H H 7.9040 . 1 741 169 169 ILE C C 176.2500 . 1 742 169 169 ILE CA C 61.1000 . 1 743 169 169 ILE CB C 37.6300 . 1 744 169 169 ILE N N 119.9800 . 1 745 170 170 LEU H H 8.1390 . 1 746 170 170 LEU C C 177.1600 . 1 747 170 170 LEU CA C 54.6200 . 1 748 170 170 LEU CB C 41.0900 . 1 749 170 170 LEU N N 125.5900 . 1 750 171 171 GLN C C 175.6800 . 1 751 171 171 GLN CA C 55.1800 . 1 752 171 171 GLN CB C 29.1800 . 1 753 172 172 THR H H 8.4750 . 1 754 172 172 THR C C 173.8800 . 1 755 172 172 THR CA C 63.3900 . 1 756 172 172 THR CB C 68.8200 . 1 757 172 172 THR N N 121.3100 . 1 758 173 173 ARG H H 8.4330 . 1 759 173 173 ARG C C 175.2400 . 1 760 173 173 ARG CA C 54.2200 . 1 761 173 173 ARG CB C 33.8000 . 1 762 173 173 ARG N N 127.0200 . 1 763 174 174 THR H H 8.0550 . 1 764 174 174 THR C C 172.8100 . 1 765 174 174 THR CA C 59.0900 . 1 766 174 174 THR CB C 72.7400 . 1 767 174 174 THR N N 110.1100 . 1 768 175 175 TYR H H 9.4460 . 1 769 175 175 TYR C C 175.0400 . 1 770 175 175 TYR CA C 57.3300 . 1 771 175 175 TYR CB C 43.4900 . 1 772 175 175 TYR N N 119.5100 . 1 773 176 176 ASP H H 9.4440 . 1 774 176 176 ASP C C 174.8100 . 1 775 176 176 ASP CA C 52.7100 . 1 776 176 176 ASP CB C 40.9400 . 1 777 176 176 ASP N N 121.8400 . 1 778 177 177 LEU H H 8.4720 . 1 779 177 177 LEU C C 175.1900 . 1 780 177 177 LEU CA C 53.1000 . 1 781 177 177 LEU CB C 44.7900 . 1 782 177 177 LEU N N 120.6500 . 1 783 178 178 TYR H H 9.2110 . 1 784 178 178 TYR C C 176.4400 . 1 785 178 178 TYR CA C 54.7900 . 1 786 178 178 TYR CB C 42.4400 . 1 787 178 178 TYR N N 114.7900 . 1 788 179 179 ILE H H 9.4920 . 1 789 179 179 ILE C C 177.0200 . 1 790 179 179 ILE CA C 60.2700 . 1 791 179 179 ILE CB C 39.9500 . 1 792 179 179 ILE N N 120.9200 . 1 793 180 180 THR C C 172.0600 . 1 794 180 180 THR CA C 59.1800 . 1 795 180 180 THR CB C 69.9600 . 1 796 181 181 TYR H H 8.8790 . 1 797 181 181 TYR C C 174.7900 . 1 798 181 181 TYR CA C 56.9400 . 1 799 181 181 TYR CB C 37.8500 . 1 800 181 181 TYR N N 119.4900 . 1 801 182 182 ASP H H 8.1120 . 1 802 182 182 ASP C C 174.8500 . 1 803 182 182 ASP CA C 52.5100 . 1 804 182 182 ASP CB C 42.0200 . 1 805 182 182 ASP N N 132.1400 . 1 806 183 183 LYS H H 8.4150 . 1 807 183 183 LYS C C 176.2800 . 1 808 183 183 LYS CA C 57.4700 . 1 809 183 183 LYS CB C 31.9100 . 1 810 183 183 LYS N N 126.5700 . 1 811 184 184 TYR H H 8.0140 . 1 812 184 184 TYR C C 177.5200 . 1 813 184 184 TYR CA C 60.4800 . 1 814 184 184 TYR CB C 37.4300 . 1 815 184 184 TYR N N 119.8900 . 1 816 185 185 TYR C C 175.1600 . 1 817 185 185 TYR CA C 59.6000 . 1 818 185 185 TYR CB C 38.7200 . 1 819 186 186 GLN H H 8.0800 . 1 820 186 186 GLN C C 173.4100 . 1 821 186 186 GLN CA C 56.8500 . 1 822 186 186 GLN CB C 26.1400 . 1 823 186 186 GLN N N 116.5100 . 1 824 187 187 THR H H 7.0050 . 1 825 187 187 THR C C 171.4600 . 1 826 187 187 THR CA C 57.9300 . 1 827 187 187 THR CB C 70.6500 . 1 828 187 187 THR N N 104.9500 . 1 829 190 190 LEU C C 174.7200 . 1 830 190 190 LEU CA C 53.4200 . 1 831 190 190 LEU CB C 44.8500 . 1 832 191 191 TRP H H 9.4840 . 1 833 191 191 TRP C C 175.2900 . 1 834 191 191 TRP CA C 54.8000 . 1 835 191 191 TRP CB C 32.0500 . 1 836 191 191 TRP N N 126.9700 . 1 837 192 192 LEU H H 9.4670 . 1 838 192 192 LEU C C 175.6000 . 1 839 192 192 LEU CA C 54.3600 . 1 840 192 192 LEU CB C 45.3600 . 1 841 192 192 LEU N N 119.9800 . 1 842 193 193 PHE H H 8.9380 . 1 843 193 193 PHE C C 173.6700 . 1 844 193 193 PHE CA C 59.1900 . 1 845 193 193 PHE CB C 42.7400 . 1 846 193 193 PHE N N 122.7700 . 1 847 194 194 GLY H H 6.8050 . 1 848 194 194 GLY C C 170.9500 . 1 849 194 194 GLY CA C 44.5600 . 1 850 194 194 GLY N N 114.9200 . 1 851 195 195 TYR H H 8.8010 . 1 852 195 195 TYR C C 175.4700 . 1 853 195 195 TYR CA C 55.7800 . 1 854 195 195 TYR CB C 41.8100 . 1 855 195 195 TYR N N 116.2200 . 1 856 196 196 ASP H H 8.5120 . 1 857 196 196 ASP C C 178.6800 . 1 858 196 196 ASP CA C 51.7200 . 1 859 196 196 ASP CB C 40.9600 . 1 860 196 196 ASP N N 118.4600 . 1 861 197 197 GLU H H 9.0080 . 1 862 197 197 GLU C C 177.4800 . 1 863 197 197 GLU CA C 58.6800 . 1 864 197 197 GLU CB C 28.0600 . 1 865 197 197 GLU N N 119.9700 . 1 866 198 198 GLN C C 175.1900 . 1 867 198 198 GLN CA C 54.9500 . 1 868 198 198 GLN CB C 27.6100 . 1 869 199 199 ARG H H 8.3490 . 1 870 199 199 ARG C C 175.0200 . 1 871 199 199 ARG CA C 57.1300 . 1 872 199 199 ARG CB C 25.5000 . 1 873 199 199 ARG N N 115.3200 . 1 874 200 200 GLN H H 8.4100 . 1 875 200 200 GLN C C 174.5500 . 1 876 200 200 GLN CA C 52.3400 . 1 877 200 200 GLN CB C 27.0600 . 1 878 200 200 GLN N N 120.4400 . 1 879 201 201 PRO C C 177.5300 . 1 880 201 201 PRO CA C 62.6400 . 1 881 201 201 PRO CB C 30.7800 . 1 882 202 202 LEU H H 8.0970 . 1 883 202 202 LEU C C 177.6800 . 1 884 202 202 LEU CA C 53.3300 . 1 885 202 202 LEU CB C 42.6300 . 1 886 202 202 LEU N N 125.9700 . 1 887 203 203 THR H H 7.9190 . 1 888 203 203 THR C C 176.5200 . 1 889 203 203 THR CA C 60.2900 . 1 890 203 203 THR CB C 69.9100 . 1 891 203 203 THR N N 110.6200 . 1 892 204 204 VAL H H 8.5860 . 1 893 204 204 VAL C C 176.6900 . 1 894 204 204 VAL CA C 66.5500 . 1 895 204 204 VAL CB C 30.4900 . 1 896 204 204 VAL N N 121.9900 . 1 897 205 205 GLU H H 8.2430 . 1 898 205 205 GLU C C 179.5400 . 1 899 205 205 GLU CA C 59.7000 . 1 900 205 205 GLU CB C 27.2500 . 1 901 205 205 GLU N N 116.7000 . 1 902 206 206 HIS H H 7.4270 . 1 903 206 206 HIS C C 179.4900 . 1 904 206 206 HIS CA C 57.6400 . 1 905 206 206 HIS CB C 29.1900 . 1 906 206 206 HIS N N 116.2000 . 1 907 207 207 MET H H 8.4100 . 1 908 207 207 MET C C 178.4900 . 1 909 207 207 MET CA C 60.0400 . 1 910 207 207 MET CB C 33.0700 . 1 911 207 207 MET N N 125.1200 . 1 912 208 208 TYR H H 8.0750 . 1 913 208 208 TYR C C 178.4500 . 1 914 208 208 TYR CA C 58.9400 . 1 915 208 208 TYR CB C 36.4300 . 1 916 208 208 TYR N N 116.0800 . 1 917 209 209 GLU H H 7.5700 . 1 918 209 209 GLU C C 177.2400 . 1 919 209 209 GLU CA C 57.7200 . 1 920 209 209 GLU CB C 30.3400 . 1 921 209 209 GLU N N 116.6100 . 1 922 210 210 ASP H H 8.0130 . 1 923 210 210 ASP C C 173.6000 . 1 924 210 210 ASP CA C 55.0200 . 1 925 210 210 ASP CB C 40.6600 . 1 926 210 210 ASP N N 119.4900 . 1 927 211 211 ILE H H 7.1770 . 1 928 211 211 ILE C C 175.2300 . 1 929 211 211 ILE CA C 58.6900 . 1 930 211 211 ILE CB C 38.8800 . 1 931 211 211 ILE N N 121.3500 . 1 932 212 212 SER H H 8.9810 . 1 933 212 212 SER C C 175.2500 . 1 934 212 212 SER CA C 58.3200 . 1 935 212 212 SER CB C 63.2200 . 1 936 212 212 SER N N 122.2700 . 1 937 220 220 VAL C C 176.1100 . 1 938 220 220 VAL CA C 60.7500 . 1 939 220 220 VAL CB C 32.5700 . 1 940 221 221 THR H H 8.7490 . 1 941 221 221 THR C C 172.1700 . 1 942 221 221 THR CA C 59.2400 . 1 943 221 221 THR CB C 71.3400 . 1 944 221 221 THR N N 119.0200 . 1 945 222 222 ILE H H 8.3760 . 1 946 222 222 ILE C C 176.6500 . 1 947 222 222 ILE CA C 58.5200 . 1 948 222 222 ILE CB C 35.8700 . 1 949 222 222 ILE N N 121.9600 . 1 950 223 223 GLU H H 8.8360 . 1 951 223 223 GLU C C 174.7500 . 1 952 223 223 GLU CA C 54.2300 . 1 953 223 223 GLU CB C 34.0400 . 1 954 223 223 GLU N N 125.1200 . 1 955 224 224 ASN H H 8.8340 . 1 956 224 224 ASN C C 174.4400 . 1 957 224 224 ASN CA C 53.6500 . 1 958 224 224 ASN CB C 37.6900 . 1 959 224 224 ASN N N 122.3000 . 1 960 225 225 HIS H H 8.8810 . 1 961 225 225 HIS C C 175.8000 . 1 962 225 225 HIS CA C 54.2100 . 1 963 225 225 HIS CB C 30.1600 . 1 964 225 225 HIS N N 127.8800 . 1 965 226 226 PRO C C 176.8000 . 1 966 226 226 PRO CA C 63.3900 . 1 967 226 226 PRO CB C 31.1200 . 1 968 227 227 HIS H H 9.7500 . 1 969 227 227 HIS C C 172.7100 . 1 970 227 227 HIS CA C 54.6200 . 1 971 227 227 HIS CB C 32.1400 . 1 972 227 227 HIS N N 117.1600 . 1 973 228 228 LEU H H 6.7350 . 1 974 228 228 LEU C C 173.4200 . 1 975 228 228 LEU CA C 51.9700 . 1 976 228 228 LEU CB C 43.4500 . 1 977 228 228 LEU N N 120.9100 . 1 978 232 232 PRO C C 173.8100 . 1 979 232 232 PRO CA C 63.1900 . 1 980 232 232 PRO CB C 31.9400 . 1 981 233 233 MET H H 8.3120 . 1 982 233 233 MET C C 174.4100 . 1 983 233 233 MET CA C 53.9200 . 1 984 233 233 MET CB C 35.8800 . 1 985 233 233 MET N N 116.3500 . 1 986 234 234 CYS H H 8.3000 . 1 987 234 234 CYS C C 174.3800 . 1 988 234 234 CYS CA C 58.8800 . 1 989 234 234 CYS CB C 27.4500 . 1 990 234 234 CYS N N 116.5400 . 1 991 241 241 HIS C C 176.0600 . 1 992 241 241 HIS CA C 56.3800 . 1 993 241 241 HIS CB C 29.1800 . 1 994 242 242 ALA H H 7.9620 . 1 995 242 242 ALA C C 173.7900 . 1 996 242 242 ALA CA C 52.0600 . 1 997 242 242 ALA CB C 18.6300 . 1 998 242 242 ALA N N 125.5700 . 1 999 243 243 GLU H H 8.0920 . 1 1000 243 243 GLU C C 175.8800 . 1 1001 243 243 GLU CA C 56.2400 . 1 1002 243 243 GLU N N 123.7000 . 1 1003 249 249 ILE C C 178.2900 . 1 1004 249 249 ILE CA C 65.1600 . 1 1005 249 249 ILE CB C 37.0900 . 1 1006 250 250 GLU H H 7.9910 . 1 1007 250 250 GLU C C 178.8300 . 1 1008 250 250 GLU CA C 58.7100 . 1 1009 250 250 GLU CB C 28.7900 . 1 1010 250 250 GLU N N 119.0300 . 1 1011 251 251 THR H H 7.8320 . 1 1012 251 251 THR CA C 65.9300 . 1 1013 251 251 THR CB C 68.1800 . 1 1014 251 251 THR N N 116.2100 . 1 1015 252 252 VAL C C 178.0700 . 1 1016 252 252 VAL CA C 64.7900 . 1 1017 253 253 ALA H H 8.1690 . 1 1018 253 253 ALA C C 179.7300 . 1 1019 253 253 ALA CA C 53.6000 . 1 1020 253 253 ALA N N 123.3000 . 1 1021 254 254 GLU H H 7.8510 . 1 1022 254 254 GLU C C 177.8500 . 1 1023 254 254 GLU CA C 57.5000 . 1 1024 254 254 GLU CB C 28.6300 . 1 1025 254 254 GLU N N 119.4200 . 1 1026 255 255 GLY H H 7.9420 . 1 1027 255 255 GLY C C 175.0400 . 1 1028 255 255 GLY CA C 45.2600 . 1 1029 255 255 GLY N N 107.7900 . 1 1030 256 256 GLY H H 7.9420 . 1 1031 256 256 GLY C C 174.9000 . 1 1032 256 256 GLY CA C 45.0100 . 1 1033 256 256 GLY N N 108.7000 . 1 1034 257 257 GLY H H 8.2190 . 1 1035 257 257 GLY C C 174.0100 . 1 1036 257 257 GLY CA C 44.8900 . 1 1037 257 257 GLY N N 109.2400 . 1 1038 258 258 GLU H H 8.2760 . 1 1039 258 258 GLU CA C 56.1900 . 1 1040 258 258 GLU N N 120.9600 . 1 1041 259 259 LEU C C 176.4300 . 1 1042 259 259 LEU CA C 54.4100 . 1 1043 259 259 LEU CB C 41.8100 . 1 1044 260 260 GLY H H 7.6330 . 1 1045 260 260 GLY C C 174.6700 . 1 1046 260 260 GLY CA C 44.3700 . 1 1047 260 260 GLY N N 109.6500 . 1 1048 261 261 VAL H H 8.4700 . 1 1049 261 261 VAL C C 176.0500 . 1 1050 261 261 VAL CA C 64.1300 . 1 1051 261 261 VAL CB C 30.9900 . 1 1052 261 261 VAL N N 122.3200 . 1 1053 262 262 HIS H H 8.0710 . 1 1054 262 262 HIS C C 175.4800 . 1 1055 262 262 HIS CA C 57.8100 . 1 1056 262 262 HIS CB C 28.1300 . 1 1057 262 262 HIS N N 118.1400 . 1 1058 263 263 MET H H 7.2280 . 1 1059 263 263 MET C C 177.8600 . 1 1060 263 263 MET CA C 54.2600 . 1 1061 263 263 MET CB C 30.9400 . 1 1062 263 263 MET N N 116.2400 . 1 1063 264 264 TYR H H 7.9020 . 1 1064 264 264 TYR C C 178.0400 . 1 1065 264 264 TYR CA C 62.7100 . 1 1066 264 264 TYR CB C 39.0900 . 1 1067 264 264 TYR N N 119.3900 . 1 1068 265 265 LEU H H 8.1410 . 1 1069 265 265 LEU C C 178.1400 . 1 1070 265 265 LEU CA C 56.7300 . 1 1071 265 265 LEU CB C 39.8400 . 1 1072 265 265 LEU N N 112.4200 . 1 1073 266 266 LEU H H 7.1500 . 1 1074 266 266 LEU C C 178.9700 . 1 1075 266 266 LEU CA C 57.9900 . 1 1076 266 266 LEU CB C 39.9000 . 1 1077 266 266 LEU N N 120.4400 . 1 1078 267 267 ILE H H 7.3830 . 1 1079 267 267 ILE C C 177.6300 . 1 1080 267 267 ILE CA C 64.1600 . 1 1081 267 267 ILE CB C 36.8400 . 1 1082 267 267 ILE N N 119.4700 . 1 1083 269 269 LEU C C 178.5300 . 1 1084 269 269 LEU CA C 56.5100 . 1 1085 269 269 LEU CB C 40.4600 . 1 1086 270 270 LYS H H 7.3460 . 1 1087 270 270 LYS C C 178.7000 . 1 1088 270 270 LYS CA C 58.5000 . 1 1089 270 270 LYS CB C 31.1400 . 1 1090 270 270 LYS N N 121.7000 . 1 1091 271 271 PHE H H 7.6530 . 1 1092 271 271 PHE CA C 60.2400 . 1 1093 271 271 PHE N N 119.5000 . 1 1094 272 272 VAL C C 175.8200 . 1 1095 272 272 VAL CA C 63.7600 . 1 1096 272 272 VAL CB C 30.5900 . 1 1097 273 273 GLN H H 6.8030 . 1 1098 273 273 GLN C C 176.9500 . 1 1099 273 273 GLN CA C 58.3900 . 1 1100 273 273 GLN CB C 28.2300 . 1 1101 273 273 GLN N N 122.8100 . 1 1102 274 274 ALA H H 6.7950 . 1 1103 274 274 ALA C C 178.9100 . 1 1104 274 274 ALA CA C 53.3800 . 1 1105 274 274 ALA CB C 17.9300 . 1 1106 274 274 ALA N N 114.4100 . 1 1107 275 275 VAL H H 7.6240 . 1 1108 275 275 VAL C C 174.8400 . 1 1109 275 275 VAL CA C 63.8100 . 1 1110 275 275 VAL CB C 31.1200 . 1 1111 275 275 VAL N N 117.1400 . 1 1112 276 276 ILE H H 6.8040 . 1 1113 276 276 ILE C C 174.8900 . 1 1114 276 276 ILE CA C 57.2200 . 1 1115 276 276 ILE CB C 36.9900 . 1 1116 276 276 ILE N N 111.0600 . 1 1117 277 277 PRO C C 178.8800 . 1 1118 277 277 PRO CA C 65.1600 . 1 1119 277 277 PRO CB C 32.0500 . 1 1120 278 278 THR H H 9.2400 . 1 1121 278 278 THR C C 174.3900 . 1 1122 278 278 THR CA C 59.8800 . 1 1123 278 278 THR CB C 68.9000 . 1 1124 278 278 THR N N 110.4900 . 1 1125 279 279 ILE H H 7.3180 . 1 1126 279 279 ILE C C 175.7000 . 1 1127 279 279 ILE CA C 62.7800 . 1 1128 279 279 ILE CB C 36.1200 . 1 1129 279 279 ILE N N 126.0800 . 1 1130 280 280 GLU H H 8.0840 . 1 1131 280 280 GLU C C 175.7500 . 1 1132 280 280 GLU CA C 55.7600 . 1 1133 280 280 GLU CB C 26.3600 . 1 1134 280 280 GLU N N 129.8200 . 1 1135 281 281 TYR H H 7.3020 . 1 1136 281 281 TYR C C 174.7900 . 1 1137 281 281 TYR CA C 55.6800 . 1 1138 281 281 TYR CB C 38.5500 . 1 1139 281 281 TYR N N 119.0600 . 1 1140 282 282 ASP H H 8.5310 . 1 1141 282 282 ASP C C 175.8600 . 1 1142 282 282 ASP CA C 54.2900 . 1 1143 282 282 ASP CB C 42.1900 . 1 1144 282 282 ASP N N 121.3700 . 1 1145 283 283 TYR H H 7.8290 . 1 1146 283 283 TYR C C 173.9600 . 1 1147 283 283 TYR CA C 57.5500 . 1 1148 283 283 TYR CB C 37.4800 . 1 1149 283 283 TYR N N 117.7200 . 1 1150 284 284 THR H H 7.0430 . 1 1151 284 284 THR C C 173.8400 . 1 1152 284 284 THR CA C 61.4300 . 1 1153 284 284 THR CB C 68.9300 . 1 1154 284 284 THR N N 114.8000 . 1 1155 287 287 PHE C C 175.2600 . 1 1156 287 287 PHE CA C 56.9400 . 1 1157 287 287 PHE CB C 38.9100 . 1 1158 288 288 THR H H 7.9700 . 1 1159 288 288 THR C C 173.3600 . 1 1160 288 288 THR CA C 61.1500 . 1 1161 288 288 THR CB C 69.8200 . 1 1162 288 288 THR N N 116.1500 . 1 1163 289 289 MET H H 7.9160 . 1 1164 289 289 MET C C 180.7000 . 1 1165 289 289 MET CA C 56.8700 . 1 1166 289 289 MET CB C 33.0200 . 1 1167 289 289 MET N N 127.9400 . 1 stop_ save_