################################### # 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 52971 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name Stm1_226-273.prot _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 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.1 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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 '3D HNCACB' . . . 52971 1 2 '3D CBCA(CO)NH' . . . 52971 1 3 '3D HN(CA)CO' . . . 52971 1 4 '3D HNCO' . . . 52971 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 . . 52971 1 2 $software_2 . . 52971 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 2 2 ASN H H 1 8.529 0.020 . 1 . . . . . 228 ASN H . 52971 1 2 . 1 . 1 2 2 ASN C C 13 175.425 0.3 . 1 . . . . . 228 ASN C . 52971 1 3 . 1 . 1 2 2 ASN N N 15 119.476 0.3 . 1 . . . . . 228 ASN N . 52971 1 4 . 1 . 1 3 3 SER H H 1 8.275 0.020 . 1 . . . . . 229 SER H . 52971 1 5 . 1 . 1 3 3 SER C C 13 174.651 0.3 . 1 . . . . . 229 SER C . 52971 1 6 . 1 . 1 3 3 SER CA C 13 58.919 0.3 . 1 . . . . . 229 SER CA . 52971 1 7 . 1 . 1 3 3 SER CB C 13 63.813 0.3 . 1 . . . . . 229 SER CB . 52971 1 8 . 1 . 1 3 3 SER N N 15 116.206 0.3 . 1 . . . . . 229 SER N . 52971 1 9 . 1 . 1 4 4 ARG H H 1 8.322 0.020 . 1 . . . . . 230 ARG H . 52971 1 10 . 1 . 1 4 4 ARG C C 13 176.031 0.3 . 1 . . . . . 230 ARG C . 52971 1 11 . 1 . 1 4 4 ARG CA C 13 56.313 0.3 . 1 . . . . . 230 ARG CA . 52971 1 12 . 1 . 1 4 4 ARG CB C 13 30.561 0.3 . 1 . . . . . 230 ARG CB . 52971 1 13 . 1 . 1 4 4 ARG N N 15 122.352 0.3 . 1 . . . . . 230 ARG N . 52971 1 14 . 1 . 1 5 5 ASN H H 1 8.294 0.020 . 1 . . . . . 231 ASN H . 52971 1 15 . 1 . 1 5 5 ASN C C 13 174.827 0.3 . 1 . . . . . 231 ASN C . 52971 1 16 . 1 . 1 5 5 ASN CA C 13 53.450 0.3 . 1 . . . . . 231 ASN CA . 52971 1 17 . 1 . 1 5 5 ASN CB C 13 38.901 0.3 . 1 . . . . . 231 ASN CB . 52971 1 18 . 1 . 1 5 5 ASN N N 15 118.949 0.3 . 1 . . . . . 231 ASN N . 52971 1 19 . 1 . 1 6 6 ASN H H 1 8.252 0.020 . 1 . . . . . 232 ASN H . 52971 1 20 . 1 . 1 6 6 ASN C C 13 175.069 0.3 . 1 . . . . . 232 ASN C . 52971 1 21 . 1 . 1 6 6 ASN CA C 13 53.421 0.3 . 1 . . . . . 232 ASN CA . 52971 1 22 . 1 . 1 6 6 ASN CB C 13 38.773 0.3 . 1 . . . . . 232 ASN CB . 52971 1 23 . 1 . 1 6 6 ASN N N 15 118.985 0.3 . 1 . . . . . 232 ASN N . 52971 1 24 . 1 . 1 7 7 PHE H H 1 8.196 0.020 . 1 . . . . . 233 PHE H . 52971 1 25 . 1 . 1 7 7 PHE C C 13 175.571 0.3 . 1 . . . . . 233 PHE C . 52971 1 26 . 1 . 1 7 7 PHE CA C 13 58.167 0.3 . 1 . . . . . 233 PHE CA . 52971 1 27 . 1 . 1 7 7 PHE CB C 13 39.187 0.3 . 1 . . . . . 233 PHE CB . 52971 1 28 . 1 . 1 7 7 PHE N N 15 120.422 0.3 . 1 . . . . . 233 PHE N . 52971 1 29 . 1 . 1 8 8 ASN H H 1 8.329 0.020 . 1 . . . . . 234 ASN H . 52971 1 30 . 1 . 1 8 8 ASN C C 13 174.736 0.3 . 1 . . . . . 234 ASN C . 52971 1 31 . 1 . 1 8 8 ASN CA C 13 53.450 0.3 . 1 . . . . . 234 ASN CA . 52971 1 32 . 1 . 1 8 8 ASN CB C 13 39.062 0.3 . 1 . . . . . 234 ASN CB . 52971 1 33 . 1 . 1 8 8 ASN N N 15 119.508 0.3 . 1 . . . . . 234 ASN N . 52971 1 34 . 1 . 1 9 9 ASN H H 1 8.239 0.020 . 1 . . . . . 235 ASN H . 52971 1 35 . 1 . 1 9 9 ASN CA C 13 53.437 0.3 . 1 . . . . . 235 ASN CA . 52971 1 36 . 1 . 1 9 9 ASN CB C 13 38.812 0.3 . 1 . . . . . 235 ASN CB . 52971 1 37 . 1 . 1 9 9 ASN N N 15 118.883 0.3 . 1 . . . . . 235 ASN N . 52971 1 38 . 1 . 1 10 10 ARG H H 1 8.177 0.020 . 1 . . . . . 236 ARG H . 52971 1 39 . 1 . 1 10 10 ARG C C 13 176.490 0.3 . 1 . . . . . 236 ARG C . 52971 1 40 . 1 . 1 10 10 ARG CA C 13 56.415 0.3 . 1 . . . . . 236 ARG CA . 52971 1 41 . 1 . 1 10 10 ARG CB C 13 30.502 0.3 . 1 . . . . . 236 ARG CB . 52971 1 42 . 1 . 1 10 10 ARG N N 15 120.727 0.3 . 1 . . . . . 236 ARG N . 52971 1 43 . 1 . 1 11 11 ARG H H 1 8.329 0.020 . 1 . . . . . 237 ARG H . 52971 1 44 . 1 . 1 11 11 ARG C C 13 176.936 0.3 . 1 . . . . . 237 ARG C . 52971 1 45 . 1 . 1 11 11 ARG CA C 13 56.360 0.3 . 1 . . . . . 237 ARG CA . 52971 1 46 . 1 . 1 11 11 ARG CB C 13 30.811 0.3 . 1 . . . . . 237 ARG CB . 52971 1 47 . 1 . 1 11 11 ARG N N 15 121.692 0.3 . 1 . . . . . 237 ARG N . 52971 1 48 . 1 . 1 12 12 GLY H H 1 8.405 0.020 . 1 . . . . . 238 GLY H . 52971 1 49 . 1 . 1 12 12 GLY C C 13 174.679 0.3 . 1 . . . . . 238 GLY C . 52971 1 50 . 1 . 1 12 12 GLY CA C 13 45.370 0.3 . 1 . . . . . 238 GLY CA . 52971 1 51 . 1 . 1 12 12 GLY N N 15 109.940 0.3 . 1 . . . . . 238 GLY N . 52971 1 52 . 1 . 1 13 13 GLY H H 1 8.283 0.020 . 1 . . . . . 239 GLY H . 52971 1 53 . 1 . 1 13 13 GLY C C 13 174.379 0.3 . 1 . . . . . 239 GLY C . 52971 1 54 . 1 . 1 13 13 GLY CA C 13 45.312 0.3 . 1 . . . . . 239 GLY CA . 52971 1 55 . 1 . 1 13 13 GLY N N 15 108.706 0.3 . 1 . . . . . 239 GLY N . 52971 1 56 . 1 . 1 14 14 ARG H H 1 8.338 0.020 . 1 . . . . . 240 ARG H . 52971 1 57 . 1 . 1 14 14 ARG C C 13 177.116 0.3 . 1 . . . . . 240 ARG C . 52971 1 58 . 1 . 1 14 14 ARG CA C 13 56.445 0.3 . 1 . . . . . 240 ARG CA . 52971 1 59 . 1 . 1 14 14 ARG CB C 13 30.831 0.3 . 1 . . . . . 240 ARG CB . 52971 1 60 . 1 . 1 14 14 ARG N N 15 120.632 0.3 . 1 . . . . . 240 ARG N . 52971 1 61 . 1 . 1 15 15 GLY H H 1 8.487 0.020 . 1 . . . . . 241 GLY H . 52971 1 62 . 1 . 1 15 15 GLY C C 13 173.815 0.3 . 1 . . . . . 241 GLY C . 52971 1 63 . 1 . 1 15 15 GLY CA C 13 45.312 0.3 . 1 . . . . . 241 GLY CA . 52971 1 64 . 1 . 1 15 15 GLY N N 15 109.980 0.3 . 1 . . . . . 241 GLY N . 52971 1 65 . 1 . 1 16 16 ALA H H 1 8.118 0.020 . 1 . . . . . 242 ALA H . 52971 1 66 . 1 . 1 16 16 ALA C C 13 177.811 0.3 . 1 . . . . . 242 ALA C . 52971 1 67 . 1 . 1 16 16 ALA CA C 13 52.562 0.3 . 1 . . . . . 242 ALA CA . 52971 1 68 . 1 . 1 16 16 ALA CB C 13 19.435 0.3 . 1 . . . . . 242 ALA CB . 52971 1 69 . 1 . 1 16 16 ALA N N 15 123.774 0.3 . 1 . . . . . 242 ALA N . 52971 1 70 . 1 . 1 17 17 ARG H H 1 8.321 0.020 . 1 . . . . . 243 ARG H . 52971 1 71 . 1 . 1 17 17 ARG C C 13 176.347 0.3 . 1 . . . . . 243 ARG C . 52971 1 72 . 1 . 1 17 17 ARG CA C 13 56.188 0.3 . 1 . . . . . 243 ARG CA . 52971 1 73 . 1 . 1 17 17 ARG CB C 13 30.811 0.3 . 1 . . . . . 243 ARG CB . 52971 1 74 . 1 . 1 17 17 ARG N N 15 120.529 0.3 . 1 . . . . . 243 ARG N . 52971 1 75 . 1 . 1 18 18 LYS H H 1 8.392 0.020 . 1 . . . . . 244 LYS H . 52971 1 76 . 1 . 1 18 18 LYS C C 13 176.986 0.3 . 1 . . . . . 244 LYS C . 52971 1 77 . 1 . 1 18 18 LYS CA C 13 56.438 0.3 . 1 . . . . . 244 LYS CA . 52971 1 78 . 1 . 1 18 18 LYS CB C 13 33.186 0.3 . 1 . . . . . 244 LYS CB . 52971 1 79 . 1 . 1 18 18 LYS N N 15 123.063 0.3 . 1 . . . . . 244 LYS N . 52971 1 80 . 1 . 1 19 19 GLY H H 1 8.431 0.020 . 1 . . . . . 245 GLY H . 52971 1 81 . 1 . 1 19 19 GLY C C 13 173.757 0.3 . 1 . . . . . 245 GLY C . 52971 1 82 . 1 . 1 19 19 GLY CA C 13 45.312 0.3 . 1 . . . . . 245 GLY CA . 52971 1 83 . 1 . 1 19 19 GLY N N 15 110.187 0.3 . 1 . . . . . 245 GLY N . 52971 1 84 . 1 . 1 20 20 ASN H H 1 8.372 0.020 . 1 . . . . . 246 ASN H . 52971 1 85 . 1 . 1 20 20 ASN C C 13 175.139 0.3 . 1 . . . . . 246 ASN C . 52971 1 86 . 1 . 1 20 20 ASN CA C 13 53.291 0.3 . 1 . . . . . 246 ASN CA . 52971 1 87 . 1 . 1 20 20 ASN CB C 13 39.062 0.3 . 1 . . . . . 246 ASN CB . 52971 1 88 . 1 . 1 20 20 ASN N N 15 118.695 0.3 . 1 . . . . . 246 ASN N . 52971 1 89 . 1 . 1 21 21 ASN H H 1 8.540 0.020 . 1 . . . . . 247 ASN H . 52971 1 90 . 1 . 1 21 21 ASN C C 13 175.552 0.3 . 1 . . . . . 247 ASN C . 52971 1 91 . 1 . 1 21 21 ASN CA C 13 53.562 0.3 . 1 . . . . . 247 ASN CA . 52971 1 92 . 1 . 1 21 21 ASN CB C 13 38.937 0.3 . 1 . . . . . 247 ASN CB . 52971 1 93 . 1 . 1 21 21 ASN N N 15 119.558 0.3 . 1 . . . . . 247 ASN N . 52971 1 94 . 1 . 1 22 22 THR H H 1 8.141 0.020 . 1 . . . . . 248 THR H . 52971 1 95 . 1 . 1 22 22 THR C C 13 174.568 0.3 . 1 . . . . . 248 THR C . 52971 1 96 . 1 . 1 22 22 THR CA C 13 62.313 0.3 . 1 . . . . . 248 THR CA . 52971 1 97 . 1 . 1 22 22 THR CB C 13 69.938 0.3 . 1 . . . . . 248 THR CB . 52971 1 98 . 1 . 1 22 22 THR N N 15 114.328 0.3 . 1 . . . . . 248 THR N . 52971 1 99 . 1 . 1 23 23 ALA H H 1 8.306 0.020 . 1 . . . . . 249 ALA H . 52971 1 100 . 1 . 1 23 23 ALA C C 13 177.521 0.3 . 1 . . . . . 249 ALA C . 52971 1 101 . 1 . 1 23 23 ALA CA C 13 52.937 0.3 . 1 . . . . . 249 ALA CA . 52971 1 102 . 1 . 1 23 23 ALA CB C 13 19.185 0.3 . 1 . . . . . 249 ALA CB . 52971 1 103 . 1 . 1 23 23 ALA N N 15 126.059 0.3 . 1 . . . . . 249 ALA N . 52971 1 104 . 1 . 1 24 24 ASN H H 1 8.319 0.020 . 1 . . . . . 250 ASN H . 52971 1 105 . 1 . 1 24 24 ASN C C 13 175.111 0.3 . 1 . . . . . 250 ASN C . 52971 1 106 . 1 . 1 24 24 ASN CA C 13 53.437 0.3 . 1 . . . . . 250 ASN CA . 52971 1 107 . 1 . 1 24 24 ASN CB C 13 38.937 0.3 . 1 . . . . . 250 ASN CB . 52971 1 108 . 1 . 1 24 24 ASN N N 15 117.764 0.3 . 1 . . . . . 250 ASN N . 52971 1 109 . 1 . 1 25 25 ALA H H 1 8.243 0.020 . 1 . . . . . 251 ALA H . 52971 1 110 . 1 . 1 25 25 ALA C C 13 178.079 0.3 . 1 . . . . . 251 ALA C . 52971 1 111 . 1 . 1 25 25 ALA CA C 13 52.937 0.3 . 1 . . . . . 251 ALA CA . 52971 1 112 . 1 . 1 25 25 ALA CB C 13 19.435 0.3 . 1 . . . . . 251 ALA CB . 52971 1 113 . 1 . 1 25 25 ALA N N 15 124.332 0.3 . 1 . . . . . 251 ALA N . 52971 1 114 . 1 . 1 26 26 THR H H 1 8.158 0.020 . 1 . . . . . 252 THR H . 52971 1 115 . 1 . 1 26 26 THR C C 13 174.524 0.3 . 1 . . . . . 252 THR C . 52971 1 116 . 1 . 1 26 26 THR CA C 13 62.229 0.3 . 1 . . . . . 252 THR CA . 52971 1 117 . 1 . 1 26 26 THR CB C 13 69.744 0.3 . 1 . . . . . 252 THR CB . 52971 1 118 . 1 . 1 26 26 THR N N 15 112.911 0.3 . 1 . . . . . 252 THR N . 52971 1 119 . 1 . 1 27 27 ASN H H 1 8.400 0.020 . 1 . . . . . 253 ASN H . 52971 1 120 . 1 . 1 27 27 ASN C C 13 175.395 0.3 . 1 . . . . . 253 ASN C . 52971 1 121 . 1 . 1 27 27 ASN CA C 13 53.437 0.3 . 1 . . . . . 253 ASN CA . 52971 1 122 . 1 . 1 27 27 ASN CB C 13 39.062 0.3 . 1 . . . . . 253 ASN CB . 52971 1 123 . 1 . 1 27 27 ASN N N 15 120.980 0.3 . 1 . . . . . 253 ASN N . 52971 1 124 . 1 . 1 28 28 SER H H 1 8.302 0.020 . 1 . . . . . 254 SER H . 52971 1 125 . 1 . 1 28 28 SER C C 13 174.431 0.3 . 1 . . . . . 254 SER C . 52971 1 126 . 1 . 1 28 28 SER CA C 13 58.813 0.3 . 1 . . . . . 254 SER CA . 52971 1 127 . 1 . 1 28 28 SER CB C 13 63.813 0.3 . 1 . . . . . 254 SER CB . 52971 1 128 . 1 . 1 28 28 SER N N 15 116.562 0.3 . 1 . . . . . 254 SER N . 52971 1 129 . 1 . 1 29 29 ALA H H 1 8.326 0.020 . 1 . . . . . 255 ALA H . 52971 1 130 . 1 . 1 29 29 ALA C C 13 177.521 0.3 . 1 . . . . . 255 ALA C . 52971 1 131 . 1 . 1 29 29 ALA CA C 13 52.937 0.3 . 1 . . . . . 255 ALA CA . 52971 1 132 . 1 . 1 29 29 ALA CB C 13 19.185 0.3 . 1 . . . . . 255 ALA CB . 52971 1 133 . 1 . 1 29 29 ALA N N 15 125.399 0.3 . 1 . . . . . 255 ALA N . 52971 1 134 . 1 . 1 30 30 ASN H H 1 8.301 0.020 . 1 . . . . . 256 ASN H . 52971 1 135 . 1 . 1 30 30 ASN C C 13 175.481 0.3 . 1 . . . . . 256 ASN C . 52971 1 136 . 1 . 1 30 30 ASN CA C 13 53.312 0.3 . 1 . . . . . 256 ASN CA . 52971 1 137 . 1 . 1 30 30 ASN CB C 13 38.937 0.3 . 1 . . . . . 256 ASN CB . 52971 1 138 . 1 . 1 30 30 ASN N N 15 117.304 0.3 . 1 . . . . . 256 ASN N . 52971 1 139 . 1 . 1 31 31 THR H H 1 8.014 0.020 . 1 . . . . . 257 THR H . 52971 1 140 . 1 . 1 31 31 THR C C 13 174.618 0.3 . 1 . . . . . 257 THR C . 52971 1 141 . 1 . 1 31 31 THR CA C 13 62.313 0.3 . 1 . . . . . 257 THR CA . 52971 1 142 . 1 . 1 31 31 THR CB C 13 69.813 0.3 . 1 . . . . . 257 THR CB . 52971 1 143 . 1 . 1 31 31 THR N N 15 114.385 0.3 . 1 . . . . . 257 THR N . 52971 1 144 . 1 . 1 32 32 VAL H H 1 8.110 0.020 . 1 . . . . . 258 VAL H . 52971 1 145 . 1 . 1 32 32 VAL C C 13 176.225 0.3 . 1 . . . . . 258 VAL C . 52971 1 146 . 1 . 1 32 32 VAL CA C 13 62.796 0.3 . 1 . . . . . 258 VAL CA . 52971 1 147 . 1 . 1 32 32 VAL CB C 13 32.686 0.3 . 1 . . . . . 258 VAL CB . 52971 1 148 . 1 . 1 32 32 VAL N N 15 122.606 0.3 . 1 . . . . . 258 VAL N . 52971 1 149 . 1 . 1 33 33 GLN H H 1 8.423 0.020 . 1 . . . . . 259 GLN H . 52971 1 150 . 1 . 1 33 33 GLN C C 13 175.989 0.3 . 1 . . . . . 259 GLN C . 52971 1 151 . 1 . 1 33 33 GLN CA C 13 55.938 0.3 . 1 . . . . . 259 GLN CA . 52971 1 152 . 1 . 1 33 33 GLN CB C 13 29.436 0.3 . 1 . . . . . 259 GLN CB . 52971 1 153 . 1 . 1 33 33 GLN N N 15 124.282 0.3 . 1 . . . . . 259 GLN N . 52971 1 154 . 1 . 1 34 34 LYS H H 1 8.361 0.020 . 1 . . . . . 260 LYS H . 52971 1 155 . 1 . 1 34 34 LYS C C 13 176.337 0.3 . 1 . . . . . 260 LYS C . 52971 1 156 . 1 . 1 34 34 LYS CA C 13 56.688 0.3 . 1 . . . . . 260 LYS CA . 52971 1 157 . 1 . 1 34 34 LYS CB C 13 33.186 0.3 . 1 . . . . . 260 LYS CB . 52971 1 158 . 1 . 1 34 34 LYS N N 15 122.910 0.3 . 1 . . . . . 260 LYS N . 52971 1 159 . 1 . 1 35 35 ASN H H 1 8.443 0.020 . 1 . . . . . 261 ASN H . 52971 1 160 . 1 . 1 35 35 ASN C C 13 175.180 0.3 . 1 . . . . . 261 ASN C . 52971 1 161 . 1 . 1 35 35 ASN CA C 13 53.437 0.3 . 1 . . . . . 261 ASN CA . 52971 1 162 . 1 . 1 35 35 ASN CB C 13 38.812 0.3 . 1 . . . . . 261 ASN CB . 52971 1 163 . 1 . 1 35 35 ASN N N 15 119.457 0.3 . 1 . . . . . 261 ASN N . 52971 1 164 . 1 . 1 36 36 ARG H H 1 8.318 0.020 . 1 . . . . . 262 ARG H . 52971 1 165 . 1 . 1 36 36 ARG C C 13 175.947 0.3 . 1 . . . . . 262 ARG C . 52971 1 166 . 1 . 1 36 36 ARG CA C 13 56.313 0.3 . 1 . . . . . 262 ARG CA . 52971 1 167 . 1 . 1 36 36 ARG CB C 13 30.811 0.3 . 1 . . . . . 262 ARG CB . 52971 1 168 . 1 . 1 36 36 ARG N N 15 121.387 0.3 . 1 . . . . . 262 ARG N . 52971 1 169 . 1 . 1 37 37 ASN H H 1 8.490 0.020 . 1 . . . . . 263 ASN H . 52971 1 170 . 1 . 1 37 37 ASN C C 13 175.055 0.3 . 1 . . . . . 263 ASN C . 52971 1 171 . 1 . 1 37 37 ASN CA C 13 53.562 0.3 . 1 . . . . . 263 ASN CA . 52971 1 172 . 1 . 1 37 37 ASN CB C 13 38.812 0.3 . 1 . . . . . 263 ASN CB . 52971 1 173 . 1 . 1 37 37 ASN N N 15 119.863 0.3 . 1 . . . . . 263 ASN N . 52971 1 174 . 1 . 1 38 38 ILE H H 1 7.985 0.020 . 1 . . . . . 264 ILE H . 52971 1 175 . 1 . 1 38 38 ILE C C 13 175.612 0.3 . 1 . . . . . 264 ILE C . 52971 1 176 . 1 . 1 38 38 ILE CA C 13 61.188 0.3 . 1 . . . . . 264 ILE CA . 52971 1 177 . 1 . 1 38 38 ILE CB C 13 39.183 0.3 . 1 . . . . . 264 ILE CB . 52971 1 178 . 1 . 1 38 38 ILE N N 15 120.320 0.3 . 1 . . . . . 264 ILE N . 52971 1 179 . 1 . 1 39 39 ASP H H 1 8.380 0.020 . 1 . . . . . 265 ASP H . 52971 1 180 . 1 . 1 39 39 ASP C C 13 176.490 0.3 . 1 . . . . . 265 ASP C . 52971 1 181 . 1 . 1 39 39 ASP CA C 13 54.312 0.3 . 1 . . . . . 265 ASP CA . 52971 1 182 . 1 . 1 39 39 ASP CB C 13 41.312 0.3 . 1 . . . . . 265 ASP CB . 52971 1 183 . 1 . 1 39 39 ASP N N 15 124.434 0.3 . 1 . . . . . 265 ASP N . 52971 1 184 . 1 . 1 40 40 VAL H H 1 8.130 0.020 . 1 . . . . . 266 VAL H . 52971 1 185 . 1 . 1 40 40 VAL C C 13 176.467 0.3 . 1 . . . . . 266 VAL C . 52971 1 186 . 1 . 1 40 40 VAL CA C 13 62.438 0.3 . 1 . . . . . 266 VAL CA . 52971 1 187 . 1 . 1 40 40 VAL CB C 13 32.311 0.3 . 1 . . . . . 266 VAL CB . 52971 1 188 . 1 . 1 40 40 VAL N N 15 119.965 0.3 . 1 . . . . . 266 VAL N . 52971 1 189 . 1 . 1 41 41 SER H H 1 8.400 0.020 . 1 . . . . . 267 SER H . 52971 1 190 . 1 . 1 41 41 SER C C 13 174.317 0.3 . 1 . . . . . 267 SER C . 52971 1 191 . 1 . 1 41 41 SER CA C 13 59.188 0.3 . 1 . . . . . 267 SER CA . 52971 1 192 . 1 . 1 41 41 SER CB C 13 63.813 0.3 . 1 . . . . . 267 SER CB . 52971 1 193 . 1 . 1 41 41 SER N N 15 118.492 0.3 . 1 . . . . . 267 SER N . 52971 1 194 . 1 . 1 42 42 ASN H H 1 8.294 0.020 . 1 . . . . . 268 ASN H . 52971 1 195 . 1 . 1 42 42 ASN C C 13 174.693 0.3 . 1 . . . . . 268 ASN C . 52971 1 196 . 1 . 1 42 42 ASN N N 15 120.219 0.3 . 1 . . . . . 268 ASN N . 52971 1 197 . 1 . 1 43 43 LEU H H 1 7.993 0.020 . 1 . . . . . 269 LEU H . 52971 1 198 . 1 . 1 43 43 LEU C C 13 175.278 0.3 . 1 . . . . . 269 LEU C . 52971 1 199 . 1 . 1 43 43 LEU CA C 13 53.437 0.3 . 1 . . . . . 269 LEU CA . 52971 1 200 . 1 . 1 43 43 LEU CB C 13 41.687 0.3 . 1 . . . . . 269 LEU CB . 52971 1 201 . 1 . 1 43 43 LEU N N 15 123.164 0.3 . 1 . . . . . 269 LEU N . 52971 1 202 . 1 . 1 45 45 SER H H 1 8.314 0.020 . 1 . . . . . 271 SER H . 52971 1 203 . 1 . 1 45 45 SER C C 13 174.553 0.3 . 1 . . . . . 271 SER C . 52971 1 204 . 1 . 1 45 45 SER CA C 13 58.313 0.3 . 1 . . . . . 271 SER CA . 52971 1 205 . 1 . 1 45 45 SER CB C 13 63.938 0.3 . 1 . . . . . 271 SER CB . 52971 1 206 . 1 . 1 45 45 SER N N 15 115.699 0.3 . 1 . . . . . 271 SER N . 52971 1 207 . 1 . 1 46 46 LEU H H 1 8.283 0.020 . 1 . . . . . 272 LEU H . 52971 1 208 . 1 . 1 46 46 LEU CA C 13 55.188 0.3 . 1 . . . . . 272 LEU CA . 52971 1 209 . 1 . 1 46 46 LEU CB C 13 42.437 0.3 . 1 . . . . . 272 LEU CB . 52971 1 210 . 1 . 1 46 46 LEU N N 15 124.942 0.3 . 1 . . . . . 272 LEU N . 52971 1 211 . 1 . 1 47 47 ALA H H 1 7.842 0.020 . 1 . . . . . 273 ALA H . 52971 1 212 . 1 . 1 47 47 ALA CA C 13 53.937 0.3 . 1 . . . . . 273 ALA CA . 52971 1 213 . 1 . 1 47 47 ALA CB C 13 20.310 0.3 . 1 . . . . . 273 ALA CB . 52971 1 214 . 1 . 1 47 47 ALA N N 15 130.008 0.3 . 1 . . . . . 273 ALA N . 52971 1 stop_ save_