################################### # 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 16105 _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 1 '3D 1H-15N NOESY' . . . 16105 1 2 '3D HNCA' . . . 16105 1 3 '3D HNHB' . . . 16105 1 4 '2D 1H-1H NOESY' . . . 16105 1 5 '3D TROSY' . . . 16105 1 6 '3D TOCSY' . . . 16105 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 LYS HA H 1 4.105 0.05 . 1 . . . . 1 LYS HA . 16105 1 2 . 1 1 2 2 CYS H H 1 8.735 0.05 . 1 . . . . 2 CYS H . 16105 1 3 . 1 1 2 2 CYS HA H 1 4.815 0.05 . 1 . . . . 2 CYS HA . 16105 1 4 . 1 1 2 2 CYS HB2 H 1 3.215 0.05 . 2 . . . . 2 CYS HB2 . 16105 1 5 . 1 1 2 2 CYS HB3 H 1 3.155 0.05 . 2 . . . . 2 CYS HB3 . 16105 1 6 . 1 1 2 2 CYS N N 15 122.02 0.3 . 1 . . . . 2 CYS N . 16105 1 7 . 1 1 3 3 ASN H H 1 8.635 0.05 . 1 . . . . 3 ASN H . 16105 1 8 . 1 1 3 3 ASN HA H 1 4.795 0.05 . 1 . . . . 3 ASN HA . 16105 1 9 . 1 1 3 3 ASN HB2 H 1 2.835 0.05 . 2 . . . . 3 ASN HB2 . 16105 1 10 . 1 1 3 3 ASN HB3 H 1 2.985 0.05 . 2 . . . . 3 ASN HB3 . 16105 1 11 . 1 1 3 3 ASN HD21 H 1 7.635 0.05 . 2 . . . . 3 ASN HD21 . 16105 1 12 . 1 1 3 3 ASN HD22 H 1 6.925 0.05 . 2 . . . . 3 ASN HD22 . 16105 1 13 . 1 1 3 3 ASN N N 15 119.65 0.3 . 1 . . . . 3 ASN N . 16105 1 14 . 1 1 3 3 ASN ND2 N 15 113.04 0.3 . 1 . . . . 3 ASN ND2 . 16105 1 15 . 1 1 4 4 THR H H 1 7.432 0.05 . 1 . . . . 4 THR H . 16105 1 16 . 1 1 4 4 THR HA H 1 4.695 0.05 . 1 . . . . 4 THR HA . 16105 1 17 . 1 1 4 4 THR HG21 H 1 1.295 0.05 . 1 . . . . 4 THR MG . 16105 1 18 . 1 1 4 4 THR HG22 H 1 1.295 0.05 . 1 . . . . 4 THR MG . 16105 1 19 . 1 1 4 4 THR HG23 H 1 1.295 0.05 . 1 . . . . 4 THR MG . 16105 1 20 . 1 1 4 4 THR N N 15 107.81 0.3 . 1 . . . . 4 THR N . 16105 1 21 . 1 1 5 5 ALA H H 1 8.745 0.05 . 1 . . . . 5 ALA H . 16105 1 22 . 1 1 5 5 ALA HA H 1 4.145 0.05 . 1 . . . . 5 ALA HA . 16105 1 23 . 1 1 5 5 ALA HB1 H 1 1.535 0.05 . 1 . . . . 5 ALA MB . 16105 1 24 . 1 1 5 5 ALA HB2 H 1 1.535 0.05 . 1 . . . . 5 ALA MB . 16105 1 25 . 1 1 5 5 ALA HB3 H 1 1.535 0.05 . 1 . . . . 5 ALA MB . 16105 1 26 . 1 1 5 5 ALA N N 15 123.22 0.3 . 1 . . . . 5 ALA N . 16105 1 27 . 1 1 6 6 THR H H 1 7.991 0.05 . 1 . . . . 6 THR H . 16105 1 28 . 1 1 6 6 THR HA H 1 4.225 0.05 . 1 . . . . 6 THR HA . 16105 1 29 . 1 1 6 6 THR HG21 H 1 1.255 0.05 . 1 . . . . 6 THR MG . 16105 1 30 . 1 1 6 6 THR HG22 H 1 1.255 0.05 . 1 . . . . 6 THR MG . 16105 1 31 . 1 1 6 6 THR HG23 H 1 1.255 0.05 . 1 . . . . 6 THR MG . 16105 1 32 . 1 1 6 6 THR N N 15 110.78 0.3 . 1 . . . . 6 THR N . 16105 1 33 . 1 1 7 7 CYS H H 1 7.805 0.05 . 1 . . . . 7 CYS H . 16105 1 34 . 1 1 7 7 CYS HA H 1 4.465 0.05 . 1 . . . . 7 CYS HA . 16105 1 35 . 1 1 7 7 CYS HB2 H 1 3.175 0.05 . 1 . . . . 7 CYS HB2 . 16105 1 36 . 1 1 7 7 CYS HB3 H 1 3.445 0.05 . 1 . . . . 7 CYS HB3 . 16105 1 37 . 1 1 7 7 CYS N N 15 120.81 0.3 . 1 . . . . 7 CYS N . 16105 1 38 . 1 1 8 8 ALA H H 1 8.085 0.05 . 1 . . . . 8 ALA H . 16105 1 39 . 1 1 8 8 ALA HA H 1 4.045 0.05 . 1 . . . . 8 ALA HA . 16105 1 40 . 1 1 8 8 ALA HB1 H 1 1.485 0.05 . 1 . . . . 8 ALA MB . 16105 1 41 . 1 1 8 8 ALA HB2 H 1 1.485 0.05 . 1 . . . . 8 ALA MB . 16105 1 42 . 1 1 8 8 ALA HB3 H 1 1.485 0.05 . 1 . . . . 8 ALA MB . 16105 1 43 . 1 1 8 8 ALA N N 15 123.57 0.3 . 1 . . . . 8 ALA N . 16105 1 44 . 1 1 9 9 THR H H 1 8.39 0.05 . 1 . . . . 9 THR H . 16105 1 45 . 1 1 9 9 THR HA H 1 3.893 0.05 . 1 . . . . 9 THR HA . 16105 1 46 . 1 1 9 9 THR HB H 1 4.206 0.05 . 1 . . . . 9 THR HB . 16105 1 47 . 1 1 9 9 THR HG21 H 1 1.335 0.05 . 1 . . . . 9 THR MG . 16105 1 48 . 1 1 9 9 THR HG22 H 1 1.335 0.05 . 1 . . . . 9 THR MG . 16105 1 49 . 1 1 9 9 THR HG23 H 1 1.335 0.05 . 1 . . . . 9 THR MG . 16105 1 50 . 1 1 9 9 THR N N 15 109.64 0.3 . 1 . . . . 9 THR N . 16105 1 51 . 1 1 10 10 GLN H H 1 7.715 0.05 . 1 . . . . 10 GLN H . 16105 1 52 . 1 1 10 10 GLN HA H 1 4.125 0.05 . 1 . . . . 10 GLN HA . 16105 1 53 . 1 1 10 10 GLN HB2 H 1 2.055 0.05 . 2 . . . . 10 GLN HB2 . 16105 1 54 . 1 1 10 10 GLN HB3 H 1 2.195 0.05 . 2 . . . . 10 GLN HB3 . 16105 1 55 . 1 1 10 10 GLN HE21 H 1 7.405 0.05 . 2 . . . . 10 GLN HE21 . 16105 1 56 . 1 1 10 10 GLN HE22 H 1 6.755 0.05 . 2 . . . . 10 GLN HE22 . 16105 1 57 . 1 1 10 10 GLN HG2 H 1 2.405 0.05 . 2 . . . . 10 GLN HG2 . 16105 1 58 . 1 1 10 10 GLN HG3 H 1 2.515 0.05 . 2 . . . . 10 GLN HG3 . 16105 1 59 . 1 1 10 10 GLN N N 15 120.96 0.3 . 1 . . . . 10 GLN N . 16105 1 60 . 1 1 10 10 GLN NE2 N 15 111.96 0.3 . 1 . . . . 10 GLN NE2 . 16105 1 61 . 1 1 11 11 ARG H H 1 7.918 0.05 . 1 . . . . 11 ARG H . 16105 1 62 . 1 1 11 11 ARG HA H 1 4.205 0.05 . 1 . . . . 11 ARG HA . 16105 1 63 . 1 1 11 11 ARG HB2 H 1 2.017 0.05 . 2 . . . . 11 ARG HB2 . 16105 1 64 . 1 1 11 11 ARG HB3 H 1 2.105 0.05 . 2 . . . . 11 ARG HB3 . 16105 1 65 . 1 1 11 11 ARG HD2 H 1 3.245 0.05 . 2 . . . . 11 ARG HD2 . 16105 1 66 . 1 1 11 11 ARG HE H 1 7.125 0.05 . 1 . . . . 11 ARG HE . 16105 1 67 . 1 1 11 11 ARG N N 15 119.55 0.3 . 1 . . . . 11 ARG N . 16105 1 68 . 1 1 11 11 ARG NE N 15 120.54 0.3 . 1 . . . . 11 ARG NE . 16105 1 69 . 1 1 12 12 LEU H H 1 8.145 0.05 . 1 . . . . 12 LEU H . 16105 1 70 . 1 1 12 12 LEU HA H 1 4.115 0.05 . 1 . . . . 12 LEU HA . 16105 1 71 . 1 1 12 12 LEU HB2 H 1 1.755 0.05 . 1 . . . . 12 LEU HB2 . 16105 1 72 . 1 1 12 12 LEU HB3 H 1 1.875 0.05 . 1 . . . . 12 LEU HB3 . 16105 1 73 . 1 1 12 12 LEU HD11 H 1 0.945 0.05 . 2 . . . . 12 LEU MD1 . 16105 1 74 . 1 1 12 12 LEU HD12 H 1 0.945 0.05 . 2 . . . . 12 LEU MD1 . 16105 1 75 . 1 1 12 12 LEU HD13 H 1 0.945 0.05 . 2 . . . . 12 LEU MD1 . 16105 1 76 . 1 1 12 12 LEU N N 15 119.97 0.3 . 1 . . . . 12 LEU N . 16105 1 77 . 1 1 13 13 ALA H H 1 8.435 0.05 . 1 . . . . 13 ALA H . 16105 1 78 . 1 1 13 13 ALA HA H 1 3.955 0.05 . 1 . . . . 13 ALA HA . 16105 1 79 . 1 1 13 13 ALA HB1 H 1 1.548 0.05 . 1 . . . . 13 ALA MB . 16105 1 80 . 1 1 13 13 ALA HB2 H 1 1.548 0.05 . 1 . . . . 13 ALA MB . 16105 1 81 . 1 1 13 13 ALA HB3 H 1 1.548 0.05 . 1 . . . . 13 ALA MB . 16105 1 82 . 1 1 13 13 ALA N N 15 120.96 0.3 . 1 . . . . 13 ALA N . 16105 1 83 . 1 1 14 14 ASN H H 1 8.095 0.05 . 1 . . . . 14 ASN H . 16105 1 84 . 1 1 14 14 ASN HA H 1 4.425 0.05 . 1 . . . . 14 ASN HA . 16105 1 85 . 1 1 14 14 ASN HB2 H 1 2.895 0.05 . 1 . . . . 14 ASN HB2 . 16105 1 86 . 1 1 14 14 ASN HB3 H 1 2.975 0.05 . 1 . . . . 14 ASN HB3 . 16105 1 87 . 1 1 14 14 ASN HD21 H 1 7.385 0.05 . 2 . . . . 14 ASN HD21 . 16105 1 88 . 1 1 14 14 ASN HD22 H 1 6.755 0.05 . 2 . . . . 14 ASN HD22 . 16105 1 89 . 1 1 14 14 ASN N N 15 114.80 0.3 . 1 . . . . 14 ASN N . 16105 1 90 . 1 1 14 14 ASN ND2 N 15 111.63 0.3 . 1 . . . . 14 ASN ND2 . 16105 1 91 . 1 1 15 15 PHE H H 1 8.095 0.05 . 1 . . . . 15 PHE H . 16105 1 92 . 1 1 15 15 PHE HA H 1 4.455 0.05 . 1 . . . . 15 PHE HA . 16105 1 93 . 1 1 15 15 PHE HB2 H 1 3.335 0.05 . 1 . . . . 15 PHE HB2 . 16105 1 94 . 1 1 15 15 PHE HB3 H 1 2.595 0.05 . 1 . . . . 15 PHE HB3 . 16105 1 95 . 1 1 15 15 PHE N N 15 120.67 0.3 . 1 . . . . 15 PHE N . 16105 1 96 . 1 1 16 16 LEU H H 1 8.385 0.05 . 1 . . . . 16 LEU H . 16105 1 97 . 1 1 16 16 LEU HA H 1 3.955 0.05 . 1 . . . . 16 LEU HA . 16105 1 98 . 1 1 16 16 LEU HB2 H 1 1.995 0.05 . 2 . . . . 16 LEU HB2 . 16105 1 99 . 1 1 16 16 LEU HD11 H 1 0.945 0.05 . 2 . . . . 16 LEU MD1 . 16105 1 100 . 1 1 16 16 LEU HD12 H 1 0.945 0.05 . 2 . . . . 16 LEU MD1 . 16105 1 101 . 1 1 16 16 LEU HD13 H 1 0.945 0.05 . 2 . . . . 16 LEU MD1 . 16105 1 102 . 1 1 16 16 LEU N N 15 119.62 0.3 . 1 . . . . 16 LEU N . 16105 1 103 . 1 1 17 17 VAL H H 1 8.058 0.05 . 1 . . . . 17 VAL H . 16105 1 104 . 1 1 17 17 VAL HA H 1 3.875 0.05 . 1 . . . . 17 VAL HA . 16105 1 105 . 1 1 17 17 VAL HB H 1 2.115 0.05 . 1 . . . . 17 VAL HB . 16105 1 106 . 1 1 17 17 VAL HG11 H 1 0.985 0.05 . 2 . . . . 17 VAL MG1 . 16105 1 107 . 1 1 17 17 VAL HG12 H 1 0.985 0.05 . 2 . . . . 17 VAL MG1 . 16105 1 108 . 1 1 17 17 VAL HG13 H 1 0.985 0.05 . 2 . . . . 17 VAL MG1 . 16105 1 109 . 1 1 17 17 VAL HG21 H 1 0.825 0.05 . 2 . . . . 17 VAL MG2 . 16105 1 110 . 1 1 17 17 VAL HG22 H 1 0.825 0.05 . 2 . . . . 17 VAL MG2 . 16105 1 111 . 1 1 17 17 VAL HG23 H 1 0.825 0.05 . 2 . . . . 17 VAL MG2 . 16105 1 112 . 1 1 17 17 VAL N N 15 116.51 0.3 . 1 . . . . 17 VAL N . 16105 1 113 . 1 1 18 18 HIS H H 1 7.777 0.05 . 1 . . . . 18 HIS H . 16105 1 114 . 1 1 18 18 HIS HA H 1 4.615 0.05 . 1 . . . . 18 HIS HA . 16105 1 115 . 1 1 18 18 HIS HB2 H 1 3.285 0.05 . 1 . . . . 18 HIS HB2 . 16105 1 116 . 1 1 18 18 HIS HB3 H 1 3.405 0.05 . 1 . . . . 18 HIS HB3 . 16105 1 117 . 1 1 18 18 HIS N N 15 116.79 0.3 . 1 . . . . 18 HIS N . 16105 1 118 . 1 1 19 19 SER H H 1 7.87 0.05 . 1 . . . . 19 SER H . 16105 1 119 . 1 1 19 19 SER HA H 1 4.345 0.05 . 1 . . . . 19 SER HA . 16105 1 120 . 1 1 19 19 SER HB2 H 1 3.685 0.05 . 2 . . . . 19 SER HB2 . 16105 1 121 . 1 1 19 19 SER N N 15 115.59 0.3 . 1 . . . . 19 SER N . 16105 1 122 . 1 1 20 20 SER H H 1 8.092 0.05 . 1 . . . . 20 SER H . 16105 1 123 . 1 1 20 20 SER HA H 1 4.225 0.05 . 1 . . . . 20 SER HA . 16105 1 124 . 1 1 20 20 SER HB2 H 1 3.893 0.05 . 2 . . . . 20 SER HB2 . 16105 1 125 . 1 1 20 20 SER N N 15 117.00 0.3 . 1 . . . . 20 SER N . 16105 1 126 . 1 1 21 21 ASN H H 1 8.123 0.05 . 1 . . . . 21 ASN H . 16105 1 127 . 1 1 21 21 ASN HA H 1 4.615 0.05 . 1 . . . . 21 ASN HA . 16105 1 128 . 1 1 21 21 ASN HB2 H 1 2.665 0.05 . 2 . . . . 21 ASN HB2 . 16105 1 129 . 1 1 21 21 ASN HD21 H 1 7.385 0.05 . 2 . . . . 21 ASN HD21 . 16105 1 130 . 1 1 21 21 ASN HD22 H 1 6.785 0.05 . 2 . . . . 21 ASN HD22 . 16105 1 131 . 1 1 21 21 ASN N N 15 119.55 0.3 . 1 . . . . 21 ASN N . 16105 1 132 . 1 1 21 21 ASN ND2 N 15 112.61 0.3 . 1 . . . . 21 ASN ND2 . 16105 1 133 . 1 1 22 22 ASN H H 1 8.177 0.05 . 1 . . . . 22 ASN H . 16105 1 134 . 1 1 22 22 ASN HA H 1 4.775 0.05 . 1 . . . . 22 ASN HA . 16105 1 135 . 1 1 22 22 ASN HB2 H 1 2.785 0.05 . 2 . . . . 22 ASN HB2 . 16105 1 136 . 1 1 22 22 ASN HB3 H 1 2.625 0.05 . 2 . . . . 22 ASN HB3 . 16105 1 137 . 1 1 22 22 ASN HD21 H 1 7.385 0.05 . 2 . . . . 22 ASN HD21 . 16105 1 138 . 1 1 22 22 ASN HD22 H 1 6.785 0.05 . 2 . . . . 22 ASN HD22 . 16105 1 139 . 1 1 22 22 ASN N N 15 117.85 0.3 . 1 . . . . 22 ASN N . 16105 1 140 . 1 1 22 22 ASN ND2 N 15 112.61 0.3 . 1 . . . . 22 ASN ND2 . 16105 1 141 . 1 1 23 23 PHE H H 1 8.16 0.05 . 1 . . . . 23 PHE H . 16105 1 142 . 1 1 23 23 PHE HA H 1 4.465 0.05 . 1 . . . . 23 PHE HA . 16105 1 143 . 1 1 23 23 PHE HB2 H 1 3.135 0.05 . 2 . . . . 23 PHE HB2 . 16105 1 144 . 1 1 23 23 PHE HD1 H 1 7.245 0.05 . 4 . . . . 23 PHE HD1 . 16105 1 145 . 1 1 23 23 PHE HD2 H 1 7.555 0.05 . 4 . . . . 23 PHE HD2 . 16105 1 146 . 1 1 23 23 PHE N N 15 119.97 0.3 . 1 . . . . 23 PHE N . 16105 1 147 . 1 1 24 24 GLY H H 1 8.459 0.05 . 1 . . . . 24 GLY H . 16105 1 148 . 1 1 24 24 GLY HA2 H 1 3.725 0.05 . 1 . . . . 24 GLY HA2 . 16105 1 149 . 1 1 24 24 GLY HA3 H 1 4.035 0.05 . 1 . . . . 24 GLY HA3 . 16105 1 150 . 1 1 24 24 GLY N N 15 107.81 0.3 . 1 . . . . 24 GLY N . 16105 1 151 . 1 1 25 25 ALA H H 1 7.894 0.05 . 1 . . . . 25 ALA H . 16105 1 152 . 1 1 25 25 ALA HA H 1 4.225 0.05 . 1 . . . . 25 ALA HA . 16105 1 153 . 1 1 25 25 ALA HB1 H 1 1.455 0.05 . 1 . . . . 25 ALA MB . 16105 1 154 . 1 1 25 25 ALA HB2 H 1 1.455 0.05 . 1 . . . . 25 ALA MB . 16105 1 155 . 1 1 25 25 ALA HB3 H 1 1.455 0.05 . 1 . . . . 25 ALA MB . 16105 1 156 . 1 1 25 25 ALA N N 15 123.71 0.3 . 1 . . . . 25 ALA N . 16105 1 157 . 1 1 26 26 ILE H H 1 7.845 0.05 . 1 . . . . 26 ILE H . 16105 1 158 . 1 1 26 26 ILE HA H 1 3.915 0.05 . 1 . . . . 26 ILE HA . 16105 1 159 . 1 1 26 26 ILE HB H 1 1.995 0.05 . 1 . . . . 26 ILE HB . 16105 1 160 . 1 1 26 26 ILE HG12 H 1 1.455 0.05 . 2 . . . . 26 ILE HG12 . 16105 1 161 . 1 1 26 26 ILE HG13 H 1 1.255 0.05 . 2 . . . . 26 ILE HG13 . 16105 1 162 . 1 1 26 26 ILE HG21 H 1 0.905 0.05 . 1 . . . . 26 ILE MG . 16105 1 163 . 1 1 26 26 ILE HG22 H 1 0.905 0.05 . 1 . . . . 26 ILE MG . 16105 1 164 . 1 1 26 26 ILE HG23 H 1 0.905 0.05 . 1 . . . . 26 ILE MG . 16105 1 165 . 1 1 26 26 ILE N N 15 118.76 0.3 . 1 . . . . 26 ILE N . 16105 1 166 . 1 1 27 27 LEU H H 1 7.975 0.05 . 1 . . . . 27 LEU H . 16105 1 167 . 1 1 27 27 LEU HA H 1 4.145 0.05 . 1 . . . . 27 LEU HA . 16105 1 168 . 1 1 27 27 LEU HB2 H 1 1.725 0.05 . 1 . . . . 27 LEU HB2 . 16105 1 169 . 1 1 27 27 LEU HB3 H 1 1.625 0.05 . 1 . . . . 27 LEU HB3 . 16105 1 170 . 1 1 27 27 LEU HD11 H 1 0.885 0.05 . 2 . . . . 27 LEU MD1 . 16105 1 171 . 1 1 27 27 LEU HD12 H 1 0.885 0.05 . 2 . . . . 27 LEU MD1 . 16105 1 172 . 1 1 27 27 LEU HD13 H 1 0.885 0.05 . 2 . . . . 27 LEU MD1 . 16105 1 173 . 1 1 27 27 LEU N N 15 119.61 0.3 . 1 . . . . 27 LEU N . 16105 1 174 . 1 1 28 28 SER H H 1 8.004 0.05 . 1 . . . . 28 SER H . 16105 1 175 . 1 1 28 28 SER HA H 1 4.386 0.05 . 1 . . . . 28 SER HA . 16105 1 176 . 1 1 28 28 SER HB2 H 1 3.995 0.05 . 2 . . . . 28 SER HB2 . 16105 1 177 . 1 1 28 28 SER HB3 H 1 3.935 0.05 . 2 . . . . 28 SER HB3 . 16105 1 178 . 1 1 28 28 SER N N 15 113.32 0.3 . 1 . . . . 28 SER N . 16105 1 179 . 1 1 29 29 SER H H 1 7.85 0.05 . 1 . . . . 29 SER H . 16105 1 180 . 1 1 29 29 SER HA H 1 4.58 0.05 . 1 . . . . 29 SER HA . 16105 1 181 . 1 1 29 29 SER HB2 H 1 4.035 0.05 . 2 . . . . 29 SER HB2 . 16105 1 182 . 1 1 29 29 SER HB3 H 1 4.305 0.05 . 2 . . . . 29 SER HB3 . 16105 1 183 . 1 1 29 29 SER N N 15 116.36 0.3 . 1 . . . . 29 SER N . 16105 1 184 . 1 1 30 30 THR H H 1 7.704 0.05 . 1 . . . . 30 THR H . 16105 1 185 . 1 1 30 30 THR HA H 1 4.505 0.05 . 1 . . . . 30 THR HA . 16105 1 186 . 1 1 30 30 THR HB H 1 4.345 0.05 . 1 . . . . 30 THR HB . 16105 1 187 . 1 1 30 30 THR HG21 H 1 1.255 0.05 . 1 . . . . 30 THR MG . 16105 1 188 . 1 1 30 30 THR HG22 H 1 1.255 0.05 . 1 . . . . 30 THR MG . 16105 1 189 . 1 1 30 30 THR HG23 H 1 1.255 0.05 . 1 . . . . 30 THR MG . 16105 1 190 . 1 1 30 30 THR N N 15 113.67 0.3 . 1 . . . . 30 THR N . 16105 1 191 . 1 1 31 31 ASN H H 1 8.385 0.05 . 1 . . . . 31 ASN H . 16105 1 192 . 1 1 31 31 ASN HA H 1 4.835 0.05 . 1 . . . . 31 ASN HA . 16105 1 193 . 1 1 31 31 ASN HB2 H 1 2.925 0.05 . 2 . . . . 31 ASN HB2 . 16105 1 194 . 1 1 31 31 ASN HB3 H 1 2.795 0.05 . 2 . . . . 31 ASN HB3 . 16105 1 195 . 1 1 31 31 ASN HD21 H 1 7.515 0.05 . 2 . . . . 31 ASN HD21 . 16105 1 196 . 1 1 31 31 ASN HD22 H 1 6.825 0.05 . 2 . . . . 31 ASN HD22 . 16105 1 197 . 1 1 31 31 ASN N N 15 119.68 0.3 . 1 . . . . 31 ASN N . 16105 1 198 . 1 1 31 31 ASN ND2 N 15 113.04 0.3 . 1 . . . . 31 ASN ND2 . 16105 1 199 . 1 1 32 32 VAL H H 1 7.965 0.05 . 1 . . . . 32 VAL H . 16105 1 200 . 1 1 32 32 VAL HA H 1 4.035 0.05 . 1 . . . . 32 VAL HA . 16105 1 201 . 1 1 32 32 VAL HB H 1 1.705 0.05 . 1 . . . . 32 VAL HB . 16105 1 202 . 1 1 32 32 VAL HG11 H 1 0.985 0.05 . 2 . . . . 32 VAL MG1 . 16105 1 203 . 1 1 32 32 VAL HG12 H 1 0.985 0.05 . 2 . . . . 32 VAL MG1 . 16105 1 204 . 1 1 32 32 VAL HG13 H 1 0.985 0.05 . 2 . . . . 32 VAL MG1 . 16105 1 205 . 1 1 32 32 VAL N N 15 119.62 0.3 . 1 . . . . 32 VAL N . 16105 1 206 . 1 1 33 33 GLY H H 1 8.346 0.05 . 1 . . . . 33 GLY H . 16105 1 207 . 1 1 33 33 GLY HA2 H 1 4.075 0.05 . 2 . . . . 33 GLY HA2 . 16105 1 208 . 1 1 33 33 GLY HA3 H 1 3.955 0.05 . 2 . . . . 33 GLY HA3 . 16105 1 209 . 1 1 33 33 GLY N N 15 111.06 0.3 . 1 . . . . 33 GLY N . 16105 1 210 . 1 1 34 34 SER H H 1 8.014 0.05 . 1 . . . . 34 SER H . 16105 1 211 . 1 1 34 34 SER HA H 1 4.425 0.05 . 1 . . . . 34 SER HA . 16105 1 212 . 1 1 34 34 SER HB2 H 1 3.905 0.05 . 2 . . . . 34 SER HB2 . 16105 1 213 . 1 1 34 34 SER N N 15 114.95 0.3 . 1 . . . . 34 SER N . 16105 1 214 . 1 1 35 35 ASN H H 1 8.231 0.05 . 1 . . . . 35 ASN H . 16105 1 215 . 1 1 35 35 ASN HA H 1 4.775 0.05 . 1 . . . . 35 ASN HA . 16105 1 216 . 1 1 35 35 ASN HB2 H 1 2.786 0.05 . 2 . . . . 35 ASN HB2 . 16105 1 217 . 1 1 35 35 ASN HD21 H 1 7.445 0.05 . 2 . . . . 35 ASN HD21 . 16105 1 218 . 1 1 35 35 ASN HD22 H 1 6.825 0.05 . 2 . . . . 35 ASN HD22 . 16105 1 219 . 1 1 35 35 ASN N N 15 119.90 0.3 . 1 . . . . 35 ASN N . 16105 1 220 . 1 1 35 35 ASN ND2 N 15 112.61 0.3 . 1 . . . . 35 ASN ND2 . 16105 1 221 . 1 1 36 36 THR H H 1 7.924 0.05 . 1 . . . . 36 THR H . 16105 1 222 . 1 1 36 36 THR HA H 1 4.265 0.05 . 1 . . . . 36 THR HA . 16105 1 223 . 1 1 36 36 THR HB H 1 4.075 0.05 . 1 . . . . 36 THR HB . 16105 1 224 . 1 1 36 36 THR HG21 H 1 1.095 0.05 . 1 . . . . 36 THR MG . 16105 1 225 . 1 1 36 36 THR HG22 H 1 1.095 0.05 . 1 . . . . 36 THR MG . 16105 1 226 . 1 1 36 36 THR HG23 H 1 1.095 0.05 . 1 . . . . 36 THR MG . 16105 1 227 . 1 1 36 36 THR N N 15 113.89 0.3 . 1 . . . . 36 THR N . 16105 1 228 . 1 1 37 37 TYR H H 1 7.905 0.05 . 1 . . . . 37 TYR H . 16105 1 229 . 1 1 37 37 TYR HA H 1 4.585 0.05 . 1 . . . . 37 TYR HA . 16105 1 230 . 1 1 37 37 TYR HB2 H 1 2.895 0.05 . 1 . . . . 37 TYR HB2 . 16105 1 231 . 1 1 37 37 TYR HB3 H 1 3.135 0.05 . 1 . . . . 37 TYR HB3 . 16105 1 232 . 1 1 37 37 TYR HD1 H 1 7.085 0.05 . 1 . . . . 37 TYR HD1 . 16105 1 233 . 1 1 37 37 TYR HD2 H 1 7.085 0.05 . 1 . . . . 37 TYR HD2 . 16105 1 234 . 1 1 37 37 TYR HE1 H 1 6.805 0.05 . 1 . . . . 37 TYR HE1 . 16105 1 235 . 1 1 37 37 TYR HE2 H 1 6.805 0.05 . 1 . . . . 37 TYR HE2 . 16105 1 236 . 1 1 37 37 TYR N N 15 123.15 0.3 . 1 . . . . 37 TYR N . 16105 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 1 144 16105 1 1 145 16105 1 stop_ save_