################################### # 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 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 51637 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 1H-15N_chemical_shifts _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 51637 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 51637 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 3 3 ARG H H 1 8.510 0.000 . 1 . . . . . 1229 ARG H . 51637 1 2 . 1 . 1 3 3 ARG N N 15 123.640 0.000 . 1 . . . . . 1229 ARG N . 51637 1 3 . 1 . 1 4 4 ALA H H 1 8.442 0.000 . 1 . . . . . 1230 ALA H . 51637 1 4 . 1 . 1 4 4 ALA N N 15 126.687 0.000 . 1 . . . . . 1230 ALA N . 51637 1 5 . 1 . 1 5 5 LYS H H 1 8.408 0.000 . 1 . . . . . 1231 LYS H . 51637 1 6 . 1 . 1 5 5 LYS N N 15 121.628 0.000 . 1 . . . . . 1231 LYS N . 51637 1 7 . 1 . 1 6 6 GLY H H 1 8.487 0.000 . 1 . . . . . 1232 GLY H . 51637 1 8 . 1 . 1 6 6 GLY N N 15 110.914 0.000 . 1 . . . . . 1232 GLY N . 51637 1 9 . 1 . 1 7 7 GLU H H 1 8.287 0.000 . 1 . . . . . 1233 GLU H . 51637 1 10 . 1 . 1 7 7 GLU N N 15 121.083 0.000 . 1 . . . . . 1233 GLU N . 51637 1 11 . 1 . 1 8 8 GLY H H 1 8.530 0.000 . 1 . . . . . 1234 GLY H . 51637 1 12 . 1 . 1 8 8 GLY N N 15 110.745 0.000 . 1 . . . . . 1234 GLY N . 51637 1 13 . 1 . 1 9 9 LYS H H 1 8.183 0.000 . 1 . . . . . 1235 LYS H . 51637 1 14 . 1 . 1 9 9 LYS N N 15 121.504 0.000 . 1 . . . . . 1235 LYS N . 51637 1 15 . 1 . 1 10 10 ARG H H 1 8.471 0.000 . 1 . . . . . 1236 ARG H . 51637 1 16 . 1 . 1 10 10 ARG N N 15 123.540 0.000 . 1 . . . . . 1236 ARG N . 51637 1 17 . 1 . 1 11 11 GLN H H 1 8.568 0.000 . 1 . . . . . 1237 GLN H . 51637 1 18 . 1 . 1 11 11 GLN N N 15 123.077 0.000 . 1 . . . . . 1237 GLN N . 51637 1 19 . 1 . 1 12 12 SER H H 1 8.289 0.000 . 1 . . . . . 1238 SER H . 51637 1 20 . 1 . 1 12 12 SER N N 15 117.637 0.000 . 1 . . . . . 1238 SER N . 51637 1 21 . 1 . 1 13 13 GLU H H 1 8.697 0.000 . 1 . . . . . 1239 GLU H . 51637 1 22 . 1 . 1 13 13 GLU N N 15 122.677 0.000 . 1 . . . . . 1239 GLU N . 51637 1 23 . 1 . 1 14 14 ASP H H 1 8.158 0.000 . 1 . . . . . 1240 ASP H . 51637 1 24 . 1 . 1 14 14 ASP N N 15 118.632 0.000 . 1 . . . . . 1240 ASP N . 51637 1 25 . 1 . 1 15 15 GLU H H 1 7.372 0.000 . 1 . . . . . 1241 GLU H . 51637 1 26 . 1 . 1 15 15 GLU N N 15 117.546 0.000 . 1 . . . . . 1241 GLU N . 51637 1 27 . 1 . 1 16 16 CYS H H 1 8.281 0.000 . 1 . . . . . 1242 CYS H . 51637 1 28 . 1 . 1 16 16 CYS N N 15 123.857 0.000 . 1 . . . . . 1242 CYS N . 51637 1 29 . 1 . 1 17 17 PHE H H 1 8.990 0.000 . 1 . . . . . 1243 PHE H . 51637 1 30 . 1 . 1 17 17 PHE N N 15 131.572 0.000 . 1 . . . . . 1243 PHE N . 51637 1 31 . 1 . 1 18 18 ARG H H 1 8.672 0.000 . 1 . . . . . 1244 ARG H . 51637 1 32 . 1 . 1 18 18 ARG N N 15 116.940 0.000 . 1 . . . . . 1244 ARG N . 51637 1 33 . 1 . 1 19 19 CYS H H 1 8.195 0.000 . 1 . . . . . 1245 CYS H . 51637 1 34 . 1 . 1 19 19 CYS N N 15 117.049 0.000 . 1 . . . . . 1245 CYS N . 51637 1 35 . 1 . 1 20 20 GLY H H 1 8.437 0.000 . 1 . . . . . 1246 GLY H . 51637 1 36 . 1 . 1 20 20 GLY N N 15 114.274 0.000 . 1 . . . . . 1246 GLY N . 51637 1 37 . 1 . 1 21 21 ASP H H 1 8.510 0.000 . 1 . . . . . 1247 ASP H . 51637 1 38 . 1 . 1 21 21 ASP N N 15 122.221 0.000 . 1 . . . . . 1247 ASP N . 51637 1 39 . 1 . 1 22 22 GLY H H 1 8.560 0.000 . 1 . . . . . 1248 GLY H . 51637 1 40 . 1 . 1 22 22 GLY N N 15 107.999 0.000 . 1 . . . . . 1248 GLY N . 51637 1 41 . 1 . 1 23 23 GLY H H 1 8.717 0.000 . 1 . . . . . 1249 GLY H . 51637 1 42 . 1 . 1 23 23 GLY N N 15 110.049 0.000 . 1 . . . . . 1249 GLY N . 51637 1 43 . 1 . 1 24 24 GLN H H 1 8.833 0.000 . 1 . . . . . 1250 GLN H . 51637 1 44 . 1 . 1 24 24 GLN N N 15 124.704 0.000 . 1 . . . . . 1250 GLN N . 51637 1 45 . 1 . 1 25 25 LEU H H 1 8.257 0.000 . 1 . . . . . 1251 LEU H . 51637 1 46 . 1 . 1 25 25 LEU N N 15 125.970 0.000 . 1 . . . . . 1251 LEU N . 51637 1 47 . 1 . 1 26 26 VAL H H 1 9.529 0.000 . 1 . . . . . 1252 VAL H . 51637 1 48 . 1 . 1 26 26 VAL N N 15 121.035 0.000 . 1 . . . . . 1252 VAL N . 51637 1 49 . 1 . 1 27 27 LEU H H 1 8.506 0.000 . 1 . . . . . 1253 LEU H . 51637 1 50 . 1 . 1 27 27 LEU N N 15 126.262 0.000 . 1 . . . . . 1253 LEU N . 51637 1 51 . 1 . 1 28 28 CYS H H 1 8.238 0.000 . 1 . . . . . 1254 CYS H . 51637 1 52 . 1 . 1 28 28 CYS N N 15 124.452 0.000 . 1 . . . . . 1254 CYS N . 51637 1 53 . 1 . 1 30 30 ARG H H 1 9.421 0.000 . 1 . . . . . 1256 ARG H . 51637 1 54 . 1 . 1 30 30 ARG N N 15 127.261 0.000 . 1 . . . . . 1256 ARG N . 51637 1 55 . 1 . 1 31 31 LYS H H 1 8.560 0.000 . 1 . . . . . 1257 LYS H . 51637 1 56 . 1 . 1 31 31 LYS N N 15 130.049 0.000 . 1 . . . . . 1257 LYS N . 51637 1 57 . 1 . 1 32 32 PHE H H 1 8.625 0.000 . 1 . . . . . 1258 PHE H . 51637 1 58 . 1 . 1 32 32 PHE N N 15 117.387 0.000 . 1 . . . . . 1258 PHE N . 51637 1 59 . 1 . 1 33 33 CYS H H 1 8.132 0.000 . 1 . . . . . 1259 CYS H . 51637 1 60 . 1 . 1 33 33 CYS N N 15 124.652 0.000 . 1 . . . . . 1259 CYS N . 51637 1 61 . 1 . 1 35 35 LYS H H 1 8.650 0.000 . 1 . . . . . 1261 LYS H . 51637 1 62 . 1 . 1 35 35 LYS N N 15 123.078 0.000 . 1 . . . . . 1261 LYS N . 51637 1 63 . 1 . 1 36 36 ALA H H 1 8.358 0.000 . 1 . . . . . 1262 ALA H . 51637 1 64 . 1 . 1 36 36 ALA N N 15 125.182 0.000 . 1 . . . . . 1262 ALA N . 51637 1 65 . 1 . 1 37 37 TYR H H 1 8.833 0.000 . 1 . . . . . 1263 TYR H . 51637 1 66 . 1 . 1 37 37 TYR N N 15 114.290 0.000 . 1 . . . . . 1263 TYR N . 51637 1 67 . 1 . 1 38 38 HIS H H 1 8.873 0.000 . 1 . . . . . 1264 HIS H . 51637 1 68 . 1 . 1 38 38 HIS N N 15 121.037 0.000 . 1 . . . . . 1264 HIS N . 51637 1 69 . 1 . 1 39 39 LEU H H 1 9.394 0.000 . 1 . . . . . 1265 LEU H . 51637 1 70 . 1 . 1 39 39 LEU N N 15 126.013 0.000 . 1 . . . . . 1265 LEU N . 51637 1 71 . 1 . 1 40 40 SER H H 1 8.778 0.000 . 1 . . . . . 1266 SER H . 51637 1 72 . 1 . 1 40 40 SER N N 15 112.638 0.000 . 1 . . . . . 1266 SER N . 51637 1 73 . 1 . 1 41 41 CYS H H 1 7.195 0.000 . 1 . . . . . 1267 CYS H . 51637 1 74 . 1 . 1 41 41 CYS N N 15 122.586 0.000 . 1 . . . . . 1267 CYS N . 51637 1 75 . 1 . 1 42 42 LEU H H 1 7.558 0.000 . 1 . . . . . 1268 LEU H . 51637 1 76 . 1 . 1 42 42 LEU N N 15 118.924 0.000 . 1 . . . . . 1268 LEU N . 51637 1 77 . 1 . 1 43 43 GLY H H 1 7.827 0.000 . 1 . . . . . 1269 GLY H . 51637 1 78 . 1 . 1 43 43 GLY N N 15 108.370 0.000 . 1 . . . . . 1269 GLY N . 51637 1 79 . 1 . 1 44 44 LEU H H 1 7.484 0.000 . 1 . . . . . 1270 LEU H . 51637 1 80 . 1 . 1 44 44 LEU N N 15 119.110 0.000 . 1 . . . . . 1270 LEU N . 51637 1 81 . 1 . 1 45 45 GLY H H 1 8.726 0.000 . 1 . . . . . 1271 GLY H . 51637 1 82 . 1 . 1 45 45 GLY N N 15 108.645 0.000 . 1 . . . . . 1271 GLY N . 51637 1 83 . 1 . 1 46 46 LYS H H 1 7.360 0.000 . 1 . . . . . 1272 LYS H . 51637 1 84 . 1 . 1 46 46 LYS N N 15 117.511 0.000 . 1 . . . . . 1272 LYS N . 51637 1 85 . 1 . 1 47 47 ARG H H 1 8.764 0.000 . 1 . . . . . 1273 ARG H . 51637 1 86 . 1 . 1 47 47 ARG N N 15 125.240 0.000 . 1 . . . . . 1273 ARG N . 51637 1 87 . 1 . 1 49 49 PHE H H 1 8.380 0.000 . 1 . . . . . 1275 PHE H . 51637 1 88 . 1 . 1 49 49 PHE N N 15 122.673 0.000 . 1 . . . . . 1275 PHE N . 51637 1 89 . 1 . 1 50 50 GLY H H 1 8.184 0.000 . 1 . . . . . 1276 GLY H . 51637 1 90 . 1 . 1 50 50 GLY N N 15 113.549 0.000 . 1 . . . . . 1276 GLY N . 51637 1 91 . 1 . 1 51 51 LYS H H 1 8.222 0.000 . 1 . . . . . 1277 LYS H . 51637 1 92 . 1 . 1 51 51 LYS N N 15 122.041 0.000 . 1 . . . . . 1277 LYS N . 51637 1 93 . 1 . 1 52 52 TRP H H 1 10.218 0.000 . 1 . . . . . 1278 TRP H . 51637 1 94 . 1 . 1 52 52 TRP HE1 H 1 9.918 0.000 . 1 . . . . . 1278 TRP HE1 . 51637 1 95 . 1 . 1 52 52 TRP N N 15 131.283 0.000 . 1 . . . . . 1278 TRP N . 51637 1 96 . 1 . 1 52 52 TRP NE1 N 15 129.704 0.000 . 1 . . . . . 1278 TRP NE1 . 51637 1 97 . 1 . 1 53 53 GLU H H 1 7.672 0.000 . 1 . . . . . 1279 GLU H . 51637 1 98 . 1 . 1 53 53 GLU N N 15 126.236 0.000 . 1 . . . . . 1279 GLU N . 51637 1 99 . 1 . 1 54 54 CYS H H 1 9.368 0.000 . 1 . . . . . 1280 CYS H . 51637 1 100 . 1 . 1 54 54 CYS N N 15 130.495 0.000 . 1 . . . . . 1280 CYS N . 51637 1 101 . 1 . 1 56 56 TRP H H 1 8.424 0.000 . 1 . . . . . 1282 TRP H . 51637 1 102 . 1 . 1 56 56 TRP HE1 H 1 11.294 0.000 . 1 . . . . . 1282 TRP HE1 . 51637 1 103 . 1 . 1 56 56 TRP N N 15 122.724 0.000 . 1 . . . . . 1282 TRP N . 51637 1 104 . 1 . 1 56 56 TRP NE1 N 15 131.108 0.000 . 1 . . . . . 1282 TRP NE1 . 51637 1 105 . 1 . 1 57 57 HIS H H 1 6.760 0.000 . 1 . . . . . 1283 HIS H . 51637 1 106 . 1 . 1 57 57 HIS N N 15 110.229 0.000 . 1 . . . . . 1283 HIS N . 51637 1 107 . 1 . 1 58 58 HIS H H 1 7.342 0.000 . 1 . . . . . 1284 HIS H . 51637 1 108 . 1 . 1 58 58 HIS N N 15 117.982 0.000 . 1 . . . . . 1284 HIS N . 51637 1 109 . 1 . 1 59 59 CYS H H 1 9.492 0.000 . 1 . . . . . 1285 CYS H . 51637 1 110 . 1 . 1 59 59 CYS N N 15 124.466 0.000 . 1 . . . . . 1285 CYS N . 51637 1 111 . 1 . 1 60 60 ASP H H 1 8.927 0.000 . 1 . . . . . 1286 ASP H . 51637 1 112 . 1 . 1 60 60 ASP N N 15 132.887 0.000 . 1 . . . . . 1286 ASP N . 51637 1 113 . 1 . 1 61 61 VAL H H 1 8.958 0.000 . 1 . . . . . 1287 VAL H . 51637 1 114 . 1 . 1 61 61 VAL N N 15 119.796 0.000 . 1 . . . . . 1287 VAL N . 51637 1 115 . 1 . 1 62 62 CYS H H 1 7.714 0.000 . 1 . . . . . 1288 CYS H . 51637 1 116 . 1 . 1 62 62 CYS N N 15 116.504 0.000 . 1 . . . . . 1288 CYS N . 51637 1 117 . 1 . 1 63 63 GLY H H 1 8.793 0.000 . 1 . . . . . 1289 GLY H . 51637 1 118 . 1 . 1 63 63 GLY N N 15 114.426 0.000 . 1 . . . . . 1289 GLY N . 51637 1 119 . 1 . 1 64 64 LYS H H 1 8.626 0.000 . 1 . . . . . 1290 LYS H . 51637 1 120 . 1 . 1 64 64 LYS N N 15 124.554 0.000 . 1 . . . . . 1290 LYS N . 51637 1 121 . 1 . 1 66 66 SER H H 1 7.826 0.000 . 1 . . . . . 1292 SER H . 51637 1 122 . 1 . 1 66 66 SER N N 15 120.539 0.000 . 1 . . . . . 1292 SER N . 51637 1 123 . 1 . 1 67 67 THR H H 1 8.734 0.000 . 1 . . . . . 1293 THR H . 51637 1 124 . 1 . 1 67 67 THR N N 15 111.827 0.000 . 1 . . . . . 1293 THR N . 51637 1 125 . 1 . 1 68 68 SER H H 1 7.712 0.000 . 1 . . . . . 1294 SER H . 51637 1 126 . 1 . 1 68 68 SER N N 15 119.893 0.000 . 1 . . . . . 1294 SER N . 51637 1 127 . 1 . 1 69 69 PHE H H 1 8.670 0.000 . 1 . . . . . 1295 PHE H . 51637 1 128 . 1 . 1 69 69 PHE N N 15 122.686 0.000 . 1 . . . . . 1295 PHE N . 51637 1 129 . 1 . 1 70 70 CYS H H 1 9.081 0.000 . 1 . . . . . 1296 CYS H . 51637 1 130 . 1 . 1 70 70 CYS N N 15 125.824 0.000 . 1 . . . . . 1296 CYS N . 51637 1 131 . 1 . 1 71 71 HIS H H 1 8.918 0.000 . 1 . . . . . 1297 HIS H . 51637 1 132 . 1 . 1 71 71 HIS N N 15 123.877 0.000 . 1 . . . . . 1297 HIS N . 51637 1 133 . 1 . 1 72 72 LEU H H 1 10.019 0.000 . 1 . . . . . 1298 LEU H . 51637 1 134 . 1 . 1 72 72 LEU N N 15 124.343 0.000 . 1 . . . . . 1298 LEU N . 51637 1 135 . 1 . 1 73 73 CYS H H 1 8.347 0.000 . 1 . . . . . 1299 CYS H . 51637 1 136 . 1 . 1 73 73 CYS N N 15 128.177 0.000 . 1 . . . . . 1299 CYS N . 51637 1 137 . 1 . 1 75 75 ASN H H 1 8.693 0.000 . 1 . . . . . 1301 ASN H . 51637 1 138 . 1 . 1 75 75 ASN N N 15 124.429 0.000 . 1 . . . . . 1301 ASN N . 51637 1 139 . 1 . 1 76 76 SER H H 1 8.033 0.000 . 1 . . . . . 1302 SER H . 51637 1 140 . 1 . 1 76 76 SER N N 15 114.082 0.000 . 1 . . . . . 1302 SER N . 51637 1 141 . 1 . 1 77 77 PHE H H 1 8.426 0.000 . 1 . . . . . 1303 PHE H . 51637 1 142 . 1 . 1 77 77 PHE N N 15 115.226 0.000 . 1 . . . . . 1303 PHE N . 51637 1 143 . 1 . 1 78 78 CYS H H 1 9.168 0.000 . 1 . . . . . 1304 CYS H . 51637 1 144 . 1 . 1 78 78 CYS N N 15 119.664 0.000 . 1 . . . . . 1304 CYS N . 51637 1 145 . 1 . 1 79 79 LYS H H 1 8.304 0.000 . 1 . . . . . 1305 LYS H . 51637 1 146 . 1 . 1 79 79 LYS N N 15 119.146 0.000 . 1 . . . . . 1305 LYS N . 51637 1 147 . 1 . 1 80 80 GLU H H 1 8.252 0.000 . 1 . . . . . 1306 GLU H . 51637 1 148 . 1 . 1 80 80 GLU N N 15 119.494 0.000 . 1 . . . . . 1306 GLU N . 51637 1 149 . 1 . 1 81 81 HIS H H 1 7.635 0.000 . 1 . . . . . 1307 HIS H . 51637 1 150 . 1 . 1 81 81 HIS N N 15 117.407 0.000 . 1 . . . . . 1307 HIS N . 51637 1 151 . 1 . 1 82 82 GLN H H 1 7.595 0.000 . 1 . . . . . 1308 GLN H . 51637 1 152 . 1 . 1 82 82 GLN N N 15 119.248 0.000 . 1 . . . . . 1308 GLN N . 51637 1 153 . 1 . 1 83 83 ASP H H 1 7.972 0.000 . 1 . . . . . 1309 ASP H . 51637 1 154 . 1 . 1 83 83 ASP N N 15 120.514 0.000 . 1 . . . . . 1309 ASP N . 51637 1 155 . 1 . 1 84 84 GLY H H 1 8.129 0.000 . 1 . . . . . 1310 GLY H . 51637 1 156 . 1 . 1 84 84 GLY N N 15 109.676 0.000 . 1 . . . . . 1310 GLY N . 51637 1 157 . 1 . 1 85 85 THR H H 1 7.544 0.000 . 1 . . . . . 1311 THR H . 51637 1 158 . 1 . 1 85 85 THR N N 15 113.744 0.000 . 1 . . . . . 1311 THR N . 51637 1 159 . 1 . 1 86 86 ALA H H 1 8.058 0.000 . 1 . . . . . 1312 ALA H . 51637 1 160 . 1 . 1 86 86 ALA N N 15 126.049 0.000 . 1 . . . . . 1312 ALA N . 51637 1 161 . 1 . 1 87 87 PHE H H 1 8.360 0.000 . 1 . . . . . 1313 PHE H . 51637 1 162 . 1 . 1 87 87 PHE N N 15 121.044 0.000 . 1 . . . . . 1313 PHE N . 51637 1 163 . 1 . 1 88 88 SER H H 1 8.575 0.000 . 1 . . . . . 1314 SER H . 51637 1 164 . 1 . 1 88 88 SER N N 15 118.908 0.000 . 1 . . . . . 1314 SER N . 51637 1 165 . 1 . 1 89 89 CYS H H 1 8.579 0.000 . 1 . . . . . 1315 CYS H . 51637 1 166 . 1 . 1 89 89 CYS N N 15 119.847 0.000 . 1 . . . . . 1315 CYS N . 51637 1 167 . 1 . 1 90 90 THR H H 1 9.174 0.000 . 1 . . . . . 1316 THR H . 51637 1 168 . 1 . 1 90 90 THR N N 15 117.982 0.000 . 1 . . . . . 1316 THR N . 51637 1 169 . 1 . 1 92 92 ASP H H 1 7.884 0.000 . 1 . . . . . 1318 ASP H . 51637 1 170 . 1 . 1 92 92 ASP N N 15 111.818 0.000 . 1 . . . . . 1318 ASP N . 51637 1 171 . 1 . 1 93 93 GLY H H 1 8.156 0.000 . 1 . . . . . 1319 GLY H . 51637 1 172 . 1 . 1 93 93 GLY N N 15 108.536 0.000 . 1 . . . . . 1319 GLY N . 51637 1 173 . 1 . 1 94 94 ARG H H 1 7.819 0.000 . 1 . . . . . 1320 ARG H . 51637 1 174 . 1 . 1 94 94 ARG N N 15 121.450 0.000 . 1 . . . . . 1320 ARG N . 51637 1 175 . 1 . 1 96 96 TYR H H 1 9.031 0.000 . 1 . . . . . 1322 TYR H . 51637 1 176 . 1 . 1 96 96 TYR N N 15 120.429 0.000 . 1 . . . . . 1322 TYR N . 51637 1 177 . 1 . 1 97 97 CYS H H 1 10.254 0.000 . 1 . . . . . 1323 CYS H . 51637 1 178 . 1 . 1 97 97 CYS N N 15 126.839 0.000 . 1 . . . . . 1323 CYS N . 51637 1 179 . 1 . 1 98 98 SER H H 1 8.275 0.000 . 1 . . . . . 1324 SER H . 51637 1 180 . 1 . 1 98 98 SER N N 15 114.755 0.000 . 1 . . . . . 1324 SER N . 51637 1 181 . 1 . 1 99 99 GLU H H 1 8.539 0.000 . 1 . . . . . 1325 GLU H . 51637 1 182 . 1 . 1 99 99 GLU N N 15 121.902 0.000 . 1 . . . . . 1325 GLU N . 51637 1 183 . 1 . 1 100 100 HIS H H 1 7.448 0.000 . 1 . . . . . 1326 HIS H . 51637 1 184 . 1 . 1 100 100 HIS N N 15 116.718 0.000 . 1 . . . . . 1326 HIS N . 51637 1 185 . 1 . 1 101 101 ASP H H 1 8.478 0.000 . 1 . . . . . 1327 ASP H . 51637 1 186 . 1 . 1 101 101 ASP N N 15 122.097 0.000 . 1 . . . . . 1327 ASP N . 51637 1 187 . 1 . 1 102 102 LEU H H 1 8.196 0.000 . 1 . . . . . 1328 LEU H . 51637 1 188 . 1 . 1 102 102 LEU N N 15 124.458 0.000 . 1 . . . . . 1328 LEU N . 51637 1 189 . 1 . 1 103 103 GLY H H 1 8.446 0.000 . 1 . . . . . 1329 GLY H . 51637 1 190 . 1 . 1 103 103 GLY N N 15 109.520 0.000 . 1 . . . . . 1329 GLY N . 51637 1 191 . 1 . 1 104 104 ALA H H 1 7.991 0.000 . 1 . . . . . 1330 ALA H . 51637 1 192 . 1 . 1 104 104 ALA N N 15 124.632 0.000 . 1 . . . . . 1330 ALA N . 51637 1 193 . 1 . 1 105 105 ALA H H 1 7.923 0.000 . 1 . . . . . 1331 ALA H . 51637 1 194 . 1 . 1 105 105 ALA N N 15 129.749 0.000 . 1 . . . . . 1331 ALA N . 51637 1 stop_ save_