################################### # 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 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15946 _Assigned_chem_shift_list.ID 1 _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 $chemical_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 2 TOCSY . . . 15946 1 3 NOESY . . . 15946 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_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.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 1 1 PRO HA H 1 4.236 . . 5 . . . . 1 PRO HA . 15946 1 2 . 1 1 1 1 PRO HB2 H 1 1.701 . . 5 . . . . 1 PRO HB2 . 15946 1 3 . 1 1 1 1 PRO HB3 H 1 1.701 . . 2 . . . . 1 PRO HB3 . 15946 1 4 . 1 1 1 1 PRO HD2 H 1 3.398 . . 5 . . . . 1 PRO HD2 . 15946 1 5 . 1 1 1 1 PRO HD3 H 1 3.398 . . 2 . . . . 1 PRO HD3 . 15946 1 6 . 1 1 1 1 PRO HG2 H 1 1.736 . . 5 . . . . 1 PRO HG2 . 15946 1 7 . 1 1 1 1 PRO HG3 H 1 1.736 . . 2 . . . . 1 PRO HG3 . 15946 1 8 . 1 1 2 2 PHE H H 1 8.049 . . 1 . . . . 2 PHE H . 15946 1 9 . 1 1 2 2 PHE HA H 1 4.745 . . 1 . . . . 2 PHE HA . 15946 1 10 . 1 1 2 2 PHE HB2 H 1 2.962 . . 1 . . . . 2 PHE HB2 . 15946 1 11 . 1 1 2 2 PHE HB3 H 1 2.689 . . 1 . . . . 2 PHE HB3 . 15946 1 12 . 1 1 2 2 PHE HD1 H 1 7.111 . . 3 . . . . 2 PHE HD1 . 15946 1 13 . 1 1 2 2 PHE HD2 H 1 7.111 . . 3 . . . . 2 PHE HD2 . 15946 1 14 . 1 1 2 2 PHE HE1 H 1 7.104 . . 3 . . . . 2 PHE HE1 . 15946 1 15 . 1 1 2 2 PHE HE2 H 1 7.104 . . 3 . . . . 2 PHE HE2 . 15946 1 16 . 1 1 3 3 PRO HD2 H 1 3.507 . . 2 . . . . 3 PRO HD2 . 15946 1 17 . 1 1 3 3 PRO HD3 H 1 3.377 . . 2 . . . . 3 PRO HD3 . 15946 1 18 . 1 1 4 4 PRO HA H 1 4.386 . . 1 . . . . 4 PRO HA . 15946 1 19 . 1 1 4 4 PRO HB2 H 1 2.182 . . 2 . . . . 4 PRO HB2 . 15946 1 20 . 1 1 4 4 PRO HB3 H 1 2.182 . . 2 . . . . 4 PRO HB3 . 15946 1 21 . 1 1 4 4 PRO HG2 H 1 1.908 . . 2 . . . . 4 PRO HG2 . 15946 1 22 . 1 1 4 4 PRO HG3 H 1 1.908 . . 2 . . . . 4 PRO HG3 . 15946 1 23 . 1 1 5 5 THR H H 1 8.402 . . 1 . . . . 5 THR H . 15946 1 24 . 1 1 5 5 THR HA H 1 4.339 . . 1 . . . . 5 THR HA . 15946 1 25 . 1 1 5 5 THR HB H 1 3.807 . . 1 . . . . 5 THR HB . 15946 1 26 . 1 1 5 5 THR HG21 H 1 1.072 . . 1 . . . . 5 THR HG1 . 15946 1 27 . 1 1 5 5 THR HG22 H 1 1.072 . . 1 . . . . 5 THR HG1 . 15946 1 28 . 1 1 5 5 THR HG23 H 1 1.072 . . 1 . . . . 5 THR HG1 . 15946 1 29 . 1 1 6 6 PRO HA H 1 3.810 . . 1 . . . . 6 PRO HA . 15946 1 30 . 1 1 6 6 PRO HB2 H 1 1.564 . . 2 . . . . 6 PRO HB2 . 15946 1 31 . 1 1 6 6 PRO HB3 H 1 1.564 . . 2 . . . . 6 PRO HB3 . 15946 1 32 . 1 1 6 6 PRO HD2 H 1 3.807 . . 2 . . . . 6 PRO HD2 . 15946 1 33 . 1 1 6 6 PRO HD3 H 1 3.807 . . 2 . . . . 6 PRO HD3 . 15946 1 34 . 1 1 6 6 PRO HG2 H 1 1.783 . . 2 . . . . 6 PRO HG2 . 15946 1 35 . 1 1 6 6 PRO HG3 H 1 1.674 . . 2 . . . . 6 PRO HG3 . 15946 1 36 . 1 1 7 7 PRO HA H 1 4.236 . . 5 . . . . 7 PRO HA . 15946 1 37 . 1 1 7 7 PRO HB2 H 1 1.701 . . 5 . . . . 7 PRO HB2 . 15946 1 38 . 1 1 7 7 PRO HB3 H 1 1.701 . . 2 . . . . 7 PRO HB3 . 15946 1 39 . 1 1 7 7 PRO HD2 H 1 3.398 . . 5 . . . . 7 PRO HD2 . 15946 1 40 . 1 1 7 7 PRO HD3 H 1 3.398 . . 2 . . . . 7 PRO HD3 . 15946 1 41 . 1 1 7 7 PRO HG2 H 1 1.736 . . 5 . . . . 7 PRO HG2 . 15946 1 42 . 1 1 7 7 PRO HG3 H 1 1.736 . . 2 . . . . 7 PRO HG3 . 15946 1 43 . 1 1 8 8 GLY H H 1 8.174 . . 1 . . . . 8 GLY H . 15946 1 44 . 1 1 8 8 GLY HA2 H 1 3.849 . . 2 . . . . 8 GLY HA2 . 15946 1 45 . 1 1 8 8 GLY HA3 H 1 3.771 . . 2 . . . . 8 GLY HA3 . 15946 1 46 . 1 1 9 9 GLU H H 1 8.338 . . 1 . . . . 9 GLU H . 15946 1 47 . 1 1 9 9 GLU HA H 1 3.877 . . 1 . . . . 9 GLU HA . 15946 1 48 . 1 1 9 9 GLU HB2 H 1 2.111 . . 2 . . . . 9 GLU HB2 . 15946 1 49 . 1 1 9 9 GLU HB3 H 1 2.111 . . 2 . . . . 9 GLU HB3 . 15946 1 50 . 1 1 9 9 GLU HG2 H 1 1.814 . . 2 . . . . 9 GLU HG2 . 15946 1 51 . 1 1 9 9 GLU HG3 H 1 1.814 . . 2 . . . . 9 GLU HG3 . 15946 1 52 . 1 1 10 10 GLU H H 1 8.643 . . 1 . . . . 10 GLU H . 15946 1 53 . 1 1 10 10 GLU HA H 1 4.129 . . 1 . . . . 10 GLU HA . 15946 1 54 . 1 1 10 10 GLU HB2 H 1 2.012 . . 2 . . . . 10 GLU HB2 . 15946 1 55 . 1 1 10 10 GLU HB3 H 1 1.763 . . 2 . . . . 10 GLU HB3 . 15946 1 56 . 1 1 11 11 ALA H H 1 7.382 . . 1 . . . . 11 ALA H . 15946 1 57 . 1 1 11 11 ALA HA H 1 4.293 . . 1 . . . . 11 ALA HA . 15946 1 58 . 1 1 11 11 ALA HB1 H 1 1.243 . . 1 . . . . 11 ALA MB . 15946 1 59 . 1 1 11 11 ALA HB2 H 1 1.243 . . 1 . . . . 11 ALA MB . 15946 1 60 . 1 1 11 11 ALA HB3 H 1 1.243 . . 1 . . . . 11 ALA MB . 15946 1 61 . 1 1 12 12 PRO HA H 1 4.447 . . 1 . . . . 12 PRO HA . 15946 1 62 . 1 1 12 12 PRO HB2 H 1 2.254 . . 2 . . . . 12 PRO HB2 . 15946 1 63 . 1 1 12 12 PRO HB3 H 1 1.986 . . 2 . . . . 12 PRO HB3 . 15946 1 64 . 1 1 12 12 PRO HD2 H 1 3.670 . . 2 . . . . 12 PRO HD2 . 15946 1 65 . 1 1 12 12 PRO HD3 H 1 3.670 . . 2 . . . . 12 PRO HD3 . 15946 1 66 . 1 1 12 12 PRO HG2 H 1 1.806 . . 2 . . . . 12 PRO HG2 . 15946 1 67 . 1 1 12 12 PRO HG3 H 1 1.806 . . 2 . . . . 12 PRO HG3 . 15946 1 68 . 1 1 13 13 VAL H H 1 8.549 . . 1 . . . . 13 VAL H . 15946 1 69 . 1 1 13 13 VAL HA H 1 3.674 . . 1 . . . . 13 VAL HA . 15946 1 70 . 1 1 13 13 VAL HB H 1 1.986 . . 1 . . . . 13 VAL HB . 15946 1 71 . 1 1 13 13 VAL HG11 H 1 0.923 . . 2 . . . . 13 VAL MG1 . 15946 1 72 . 1 1 13 13 VAL HG12 H 1 0.923 . . 2 . . . . 13 VAL MG1 . 15946 1 73 . 1 1 13 13 VAL HG13 H 1 0.923 . . 2 . . . . 13 VAL MG1 . 15946 1 74 . 1 1 13 13 VAL HG21 H 1 0.829 . . 2 . . . . 13 VAL MG2 . 15946 1 75 . 1 1 13 13 VAL HG22 H 1 0.829 . . 2 . . . . 13 VAL MG2 . 15946 1 76 . 1 1 13 13 VAL HG23 H 1 0.829 . . 2 . . . . 13 VAL MG2 . 15946 1 77 . 1 1 14 14 GLU H H 1 9.063 . . 1 . . . . 14 GLU H . 15946 1 78 . 1 1 14 14 GLU HA H 1 3.896 . . 1 . . . . 14 GLU HA . 15946 1 79 . 1 1 14 14 GLU HB2 H 1 1.986 . . 2 . . . . 14 GLU HB2 . 15946 1 80 . 1 1 14 14 GLU HB3 H 1 1.880 . . 2 . . . . 14 GLU HB3 . 15946 1 81 . 1 1 14 14 GLU HG2 H 1 2.293 . . 2 . . . . 14 GLU HG2 . 15946 1 82 . 1 1 14 14 GLU HG3 H 1 2.158 . . 2 . . . . 14 GLU HG3 . 15946 1 83 . 1 1 15 15 ASP H H 1 7.588 . . 1 . . . . 15 ASP H . 15946 1 84 . 1 1 15 15 ASP HA H 1 4.439 . . 1 . . . . 15 ASP HA . 15946 1 85 . 1 1 15 15 ASP HB2 H 1 2.689 . . 2 . . . . 15 ASP HB2 . 15946 1 86 . 1 1 15 15 ASP HB3 H 1 2.409 . . 2 . . . . 15 ASP HB3 . 15946 1 87 . 1 1 16 16 LEU H H 1 7.593 . . 1 . . . . 16 LEU H . 15946 1 88 . 1 1 16 16 LEU HA H 1 4.033 . . 1 . . . . 16 LEU HA . 15946 1 89 . 1 1 16 16 LEU HB2 H 1 1.553 . . 2 . . . . 16 LEU HB2 . 15946 1 90 . 1 1 16 16 LEU HB3 H 1 1.547 . . 2 . . . . 16 LEU HB3 . 15946 1 91 . 1 1 16 16 LEU HD11 H 1 0.752 . . 1 . . . . 16 LEU MD1 . 15946 1 92 . 1 1 16 16 LEU HD12 H 1 0.752 . . 1 . . . . 16 LEU MD1 . 15946 1 93 . 1 1 16 16 LEU HD13 H 1 0.752 . . 1 . . . . 16 LEU MD1 . 15946 1 94 . 1 1 16 16 LEU HD21 H 1 0.752 . . 1 . . . . 16 LEU MD2 . 15946 1 95 . 1 1 16 16 LEU HD22 H 1 0.752 . . 1 . . . . 16 LEU MD2 . 15946 1 96 . 1 1 16 16 LEU HD23 H 1 0.752 . . 1 . . . . 16 LEU MD2 . 15946 1 97 . 1 1 16 16 LEU HG H 1 0.752 . . 1 . . . . 16 LEU HG . 15946 1 98 . 1 1 17 17 ILE H H 1 8.252 . . 1 . . . . 17 ILE H . 15946 1 99 . 1 1 17 17 ILE HA H 1 3.592 . . 1 . . . . 17 ILE HA . 15946 1 100 . 1 1 17 17 ILE HB H 1 1.724 . . 1 . . . . 17 ILE HB . 15946 1 101 . 1 1 17 17 ILE HD11 H 1 0.705 . . 1 . . . . 17 ILE MD . 15946 1 102 . 1 1 17 17 ILE HD12 H 1 0.705 . . 1 . . . . 17 ILE MD . 15946 1 103 . 1 1 17 17 ILE HD13 H 1 0.705 . . 1 . . . . 17 ILE MD . 15946 1 104 . 1 1 17 17 ILE HG12 H 1 1.579 . . 2 . . . . 17 ILE HG12 . 15946 1 105 . 1 1 17 17 ILE HG13 H 1 0.963 . . 2 . . . . 17 ILE HG13 . 15946 1 106 . 1 1 17 17 ILE HG21 H 1 0.814 . . 1 . . . . 17 ILE MG . 15946 1 107 . 1 1 17 17 ILE HG22 H 1 0.814 . . 1 . . . . 17 ILE MG . 15946 1 108 . 1 1 17 17 ILE HG23 H 1 0.814 . . 1 . . . . 17 ILE MG . 15946 1 109 . 1 1 18 18 ARG H H 1 7.499 . . 1 . . . . 18 ARG H . 15946 1 110 . 1 1 18 18 ARG HA H 1 4.002 . . 1 . . . . 18 ARG HA . 15946 1 111 . 1 1 18 18 ARG HB2 H 1 1.838 . . 2 . . . . 18 ARG HB2 . 15946 1 112 . 1 1 18 18 ARG HB3 H 1 1.838 . . 2 . . . . 18 ARG HB3 . 15946 1 113 . 1 1 18 18 ARG HD2 H 1 3.149 . . 2 . . . . 18 ARG HD2 . 15946 1 114 . 1 1 18 18 ARG HD3 H 1 3.149 . . 2 . . . . 18 ARG HD3 . 15946 1 115 . 1 1 18 18 ARG HE H 1 6.853 . . 1 . . . . 18 ARG HE . 15946 1 116 . 1 1 18 18 ARG HG2 H 1 1.572 . . 2 . . . . 18 ARG HG2 . 15946 1 117 . 1 1 18 18 ARG HG3 H 1 1.721 . . 2 . . . . 18 ARG HG3 . 15946 1 118 . 1 1 19 19 PHE H H 1 7.849 . . 1 . . . . 19 PHE H . 15946 1 119 . 1 1 19 19 PHE HA H 1 4.330 . . 1 . . . . 19 PHE HA . 15946 1 120 . 1 1 19 19 PHE HB2 H 1 3.041 . . 2 . . . . 19 PHE HB2 . 15946 1 121 . 1 1 19 19 PHE HB3 H 1 3.166 . . 2 . . . . 19 PHE HB3 . 15946 1 122 . 1 1 19 19 PHE HD1 H 1 6.979 . . 1 . . . . 19 PHE HD1 . 15946 1 123 . 1 1 19 19 PHE HD2 H 1 6.979 . . 3 . . . . 19 PHE HD2 . 15946 1 124 . 1 1 19 19 PHE HE1 H 1 6.979 . . 1 . . . . 19 PHE HE1 . 15946 1 125 . 1 1 19 19 PHE HE2 H 1 6.979 . . 3 . . . . 19 PHE HE2 . 15946 1 126 . 1 1 20 20 TYR H H 1 8.496 . . 1 . . . . 20 TYR H . 15946 1 127 . 1 1 20 20 TYR HA H 1 3.744 . . 1 . . . . 20 TYR HA . 15946 1 128 . 1 1 20 20 TYR HB2 H 1 2.876 . . 2 . . . . 20 TYR HB2 . 15946 1 129 . 1 1 20 20 TYR HB3 H 1 3.117 . . 2 . . . . 20 TYR HB3 . 15946 1 130 . 1 1 20 20 TYR HD1 H 1 6.807 . . 3 . . . . 20 TYR HD1 . 15946 1 131 . 1 1 20 20 TYR HD2 H 1 6.807 . . 3 . . . . 20 TYR HD2 . 15946 1 132 . 1 1 20 20 TYR HE1 H 1 6.471 . . 3 . . . . 20 TYR HE1 . 15946 1 133 . 1 1 20 20 TYR HE2 H 1 6.471 . . 3 . . . . 20 TYR HE2 . 15946 1 134 . 1 1 21 21 ASN H H 1 8.174 . . 1 . . . . 21 ASN H . 15946 1 135 . 1 1 21 21 ASN HA H 1 4.231 . . 1 . . . . 21 ASN HA . 15946 1 136 . 1 1 21 21 ASN HB2 H 1 2.822 . . 2 . . . . 21 ASN HB2 . 15946 1 137 . 1 1 21 21 ASN HB3 H 1 2.697 . . 2 . . . . 21 ASN HB3 . 15946 1 138 . 1 1 21 21 ASN HD21 H 1 6.455 . . 2 . . . . 21 ASN HD21 . 15946 1 139 . 1 1 22 22 ASP H H 1 8.464 . . 1 . . . . 22 ASP H . 15946 1 140 . 1 1 22 22 ASP HA H 1 4.268 . . 1 . . . . 22 ASP HA . 15946 1 141 . 1 1 22 22 ASP HB2 H 1 2.353 . . 2 . . . . 22 ASP HB2 . 15946 1 142 . 1 1 22 22 ASP HB3 H 1 2.353 . . 2 . . . . 22 ASP HB3 . 15946 1 143 . 1 1 23 23 LEU H H 1 8.838 . . 1 . . . . 23 LEU H . 15946 1 144 . 1 1 23 23 LEU HA H 1 3.744 . . 1 . . . . 23 LEU HA . 15946 1 145 . 1 1 23 23 LEU HB2 H 1 1.478 . . 2 . . . . 23 LEU HB2 . 15946 1 146 . 1 1 23 23 LEU HB3 H 1 1.329 . . 1 . . . . 23 LEU HB3 . 15946 1 147 . 1 1 23 23 LEU HD11 H 1 0.814 . . 2 . . . . 23 LEU MD1 . 15946 1 148 . 1 1 23 23 LEU HD12 H 1 0.814 . . 2 . . . . 23 LEU MD1 . 15946 1 149 . 1 1 23 23 LEU HD13 H 1 0.814 . . 2 . . . . 23 LEU MD1 . 15946 1 150 . 1 1 23 23 LEU HD21 H 1 0.713 . . 2 . . . . 23 LEU MD2 . 15946 1 151 . 1 1 23 23 LEU HD22 H 1 0.713 . . 2 . . . . 23 LEU MD2 . 15946 1 152 . 1 1 23 23 LEU HD23 H 1 0.713 . . 2 . . . . 23 LEU MD2 . 15946 1 153 . 1 1 23 23 LEU HG H 1 1.329 . . 1 . . . . 23 LEU HG . 15946 1 154 . 1 1 24 24 GLN H H 1 8.114 . . 1 . . . . 24 GLN H . 15946 1 155 . 1 1 24 24 GLN HA H 1 3.478 . . 1 . . . . 24 GLN HA . 15946 1 156 . 1 1 24 24 GLN HB2 H 1 2.009 . . 2 . . . . 24 GLN HB2 . 15946 1 157 . 1 1 24 24 GLN HB3 H 1 1.924 . . 2 . . . . 24 GLN HB3 . 15946 1 158 . 1 1 24 24 GLN HG2 H 1 2.135 . . 2 . . . . 24 GLN HG2 . 15946 1 159 . 1 1 24 24 GLN HG3 H 1 2.127 . . 2 . . . . 24 GLN HG3 . 15946 1 160 . 1 1 25 25 GLN H H 1 7.534 . . 1 . . . . 25 GLN H . 15946 1 161 . 1 1 25 25 GLN HA H 1 3.904 . . 1 . . . . 25 GLN HA . 15946 1 162 . 1 1 25 25 GLN HB2 H 1 1.981 . . 2 . . . . 25 GLN HB2 . 15946 1 163 . 1 1 25 25 GLN HB3 H 1 1.994 . . 2 . . . . 25 GLN HB3 . 15946 1 164 . 1 1 25 25 GLN HG2 H 1 2.293 . . 2 . . . . 25 GLN HG2 . 15946 1 165 . 1 1 25 25 GLN HG3 H 1 2.283 . . 2 . . . . 25 GLN HG3 . 15946 1 166 . 1 1 26 26 TYR H H 1 7.784 . . 1 . . . . 26 TYR H . 15946 1 167 . 1 1 26 26 TYR HA H 1 4.049 . . 1 . . . . 26 TYR HA . 15946 1 168 . 1 1 26 26 TYR HB2 H 1 2.955 . . 2 . . . . 26 TYR HB2 . 15946 1 169 . 1 1 26 26 TYR HB3 H 1 2.923 . . 2 . . . . 26 TYR HB3 . 15946 1 170 . 1 1 26 26 TYR HD1 H 1 6.768 . . 3 . . . . 26 TYR HD1 . 15946 1 171 . 1 1 26 26 TYR HD2 H 1 6.760 . . 3 . . . . 26 TYR HD2 . 15946 1 172 . 1 1 26 26 TYR HE1 H 1 6.424 . . 3 . . . . 26 TYR HE1 . 15946 1 173 . 1 1 26 26 TYR HE2 H 1 6.424 . . 3 . . . . 26 TYR HE2 . 15946 1 174 . 1 1 27 27 LEU H H 1 8.363 . . 1 . . . . 27 LEU H . 15946 1 175 . 1 1 27 27 LEU HA H 1 3.643 . . 1 . . . . 27 LEU HA . 15946 1 176 . 1 1 27 27 LEU HB2 H 1 1.643 . . 2 . . . . 27 LEU HB2 . 15946 1 177 . 1 1 27 27 LEU HB3 H 1 1.494 . . 2 . . . . 27 LEU HB3 . 15946 1 178 . 1 1 27 27 LEU HD11 H 1 0.666 . . 2 . . . . 27 LEU MD1 . 15946 1 179 . 1 1 27 27 LEU HD12 H 1 0.666 . . 2 . . . . 27 LEU MD1 . 15946 1 180 . 1 1 27 27 LEU HD13 H 1 0.666 . . 2 . . . . 27 LEU MD1 . 15946 1 181 . 1 1 27 27 LEU HD21 H 1 0.478 . . 2 . . . . 27 LEU MD2 . 15946 1 182 . 1 1 27 27 LEU HD22 H 1 0.478 . . 2 . . . . 27 LEU MD2 . 15946 1 183 . 1 1 27 27 LEU HD23 H 1 0.478 . . 2 . . . . 27 LEU MD2 . 15946 1 184 . 1 1 27 27 LEU HG H 1 1.119 . . 1 . . . . 27 LEU HG . 15946 1 185 . 1 1 28 28 ASN H H 1 7.698 . . 1 . . . . 28 ASN H . 15946 1 186 . 1 1 28 28 ASN HA H 1 4.285 . . 1 . . . . 28 ASN HA . 15946 1 187 . 1 1 28 28 ASN HB2 H 1 2.666 . . 2 . . . . 28 ASN HB2 . 15946 1 188 . 1 1 28 28 ASN HB3 H 1 2.662 . . 2 . . . . 28 ASN HB3 . 15946 1 189 . 1 1 29 29 VAL H H 1 7.471 . . 1 . . . . 29 VAL H . 15946 1 190 . 1 1 29 29 VAL HA H 1 3.771 . . 1 . . . . 29 VAL HA . 15946 1 191 . 1 1 29 29 VAL HB H 1 1.935 . . 1 . . . . 29 VAL HB . 15946 1 192 . 1 1 29 29 VAL HG11 H 1 0.806 . . 2 . . . . 29 VAL MG1 . 15946 1 193 . 1 1 29 29 VAL HG12 H 1 0.806 . . 2 . . . . 29 VAL MG1 . 15946 1 194 . 1 1 29 29 VAL HG13 H 1 0.806 . . 2 . . . . 29 VAL MG1 . 15946 1 195 . 1 1 29 29 VAL HG21 H 1 0.679 . . 2 . . . . 29 VAL MG2 . 15946 1 196 . 1 1 29 29 VAL HG22 H 1 0.679 . . 2 . . . . 29 VAL MG2 . 15946 1 197 . 1 1 29 29 VAL HG23 H 1 0.679 . . 2 . . . . 29 VAL MG2 . 15946 1 198 . 1 1 30 30 VAL H H 1 7.588 . . 1 . . . . 30 VAL H . 15946 1 199 . 1 1 30 30 VAL HA H 1 3.756 . . 1 . . . . 30 VAL HA . 15946 1 200 . 1 1 30 30 VAL HB H 1 1.722 . . 1 . . . . 30 VAL HB . 15946 1 201 . 1 1 30 30 VAL HG11 H 1 0.533 . . 2 . . . . 30 VAL MG1 . 15946 1 202 . 1 1 30 30 VAL HG12 H 1 0.533 . . 2 . . . . 30 VAL MG1 . 15946 1 203 . 1 1 30 30 VAL HG13 H 1 0.533 . . 2 . . . . 30 VAL MG1 . 15946 1 204 . 1 1 30 30 VAL HG21 H 1 0.494 . . 2 . . . . 30 VAL MG2 . 15946 1 205 . 1 1 30 30 VAL HG22 H 1 0.494 . . 2 . . . . 30 VAL MG2 . 15946 1 206 . 1 1 30 30 VAL HG23 H 1 0.494 . . 2 . . . . 30 VAL MG2 . 15946 1 stop_ loop_ _Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID _Ambiguous_atom_chem_shift.Atom_chem_shift_ID _Ambiguous_atom_chem_shift.Entry_ID _Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID 1 1 15946 1 1 36 15946 1 2 2 15946 1 2 37 15946 1 3 4 15946 1 3 39 15946 1 4 6 15946 1 4 41 15946 1 stop_ save_