################################### # 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 17193 _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 '2D 1H-1H TOCSY' . . . 17193 1 2 '2D 1H-1H NOESY' . . . 17193 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 GLY HA2 H 1 4.003 0.02 . 1 . . . . 1 GLY HA2 . 17193 1 2 . 1 1 1 1 GLY HA3 H 1 4.110 0.02 . 1 . . . . 1 GLY HA3 . 17193 1 3 . 1 1 2 2 ILE H H 1 8.371 0.02 . 1 . . . . 2 ILE H . 17193 1 4 . 1 1 2 2 ILE HA H 1 4.255 0.02 . 1 . . . . 2 ILE HA . 17193 1 5 . 1 1 2 2 ILE HB H 1 1.968 0.02 . 1 . . . . 2 ILE HB . 17193 1 6 . 1 1 2 2 ILE HG12 H 1 1.303 0.02 . 2 . . . . 2 ILE HG12 . 17193 1 7 . 1 1 2 2 ILE HG13 H 1 1.508 0.02 . 2 . . . . 2 ILE HG13 . 17193 1 8 . 1 1 2 2 ILE HG21 H 1 0.972 0.02 . 1 . . . . 2 ILE MG . 17193 1 9 . 1 1 2 2 ILE HG22 H 1 0.972 0.02 . 1 . . . . 2 ILE MG . 17193 1 10 . 1 1 2 2 ILE HG23 H 1 0.972 0.02 . 1 . . . . 2 ILE MG . 17193 1 11 . 1 1 3 3 HIS H H 1 8.292 0.02 . 1 . . . . 3 HIS H . 17193 1 12 . 1 1 3 3 HIS HA H 1 4.864 0.02 . 1 . . . . 3 HIS HA . 17193 1 13 . 1 1 3 3 HIS HB2 H 1 3.295 0.02 . 2 . . . . 3 HIS HB2 . 17193 1 14 . 1 1 3 3 HIS HB3 H 1 3.439 0.02 . 2 . . . . 3 HIS HB3 . 17193 1 15 . 1 1 3 3 HIS HD2 H 1 7.516 0.02 . 1 . . . . 3 HIS HD2 . 17193 1 16 . 1 1 3 3 HIS HE1 H 1 8.765 0.02 . 1 . . . . 3 HIS HE1 . 17193 1 17 . 1 1 4 4 LYS H H 1 8.133 0.02 . 1 . . . . 4 LYS H . 17193 1 18 . 1 1 4 4 LYS HA H 1 4.358 0.02 . 1 . . . . 4 LYS HA . 17193 1 19 . 1 1 4 4 LYS HB2 H 1 1.884 0.02 . 2 . . . . 4 LYS HB2 . 17193 1 20 . 1 1 4 4 LYS HB3 H 1 1.951 0.02 . 2 . . . . 4 LYS HB3 . 17193 1 21 . 1 1 4 4 LYS HD2 H 1 1.814 0.02 . 1 . . . . 4 LYS HD2 . 17193 1 22 . 1 1 4 4 LYS HD3 H 1 1.814 0.02 . 1 . . . . 4 LYS HD3 . 17193 1 23 . 1 1 4 4 LYS HE2 H 1 3.134 0.02 . 1 . . . . 4 LYS HE2 . 17193 1 24 . 1 1 4 4 LYS HE3 H 1 3.134 0.02 . 1 . . . . 4 LYS HE3 . 17193 1 25 . 1 1 4 4 LYS HG2 H 1 1.554 0.02 . 1 . . . . 4 LYS HG2 . 17193 1 26 . 1 1 4 4 LYS HG3 H 1 1.554 0.02 . 1 . . . . 4 LYS HG3 . 17193 1 27 . 1 1 5 5 GLN H H 1 8.290 0.02 . 1 . . . . 5 GLN H . 17193 1 28 . 1 1 5 5 GLN HA H 1 4.405 0.02 . 1 . . . . 5 GLN HA . 17193 1 29 . 1 1 5 5 GLN HB2 H 1 2.121 0.02 . 2 . . . . 5 GLN HB2 . 17193 1 30 . 1 1 5 5 GLN HB3 H 1 2.207 0.02 . 2 . . . . 5 GLN HB3 . 17193 1 31 . 1 1 5 5 GLN HG2 H 1 2.464 0.02 . 1 . . . . 5 GLN HG2 . 17193 1 32 . 1 1 5 5 GLN HG3 H 1 2.464 0.02 . 1 . . . . 5 GLN HG3 . 17193 1 33 . 1 1 6 6 LYS H H 1 8.219 0.02 . 1 . . . . 6 LYS H . 17193 1 34 . 1 1 6 6 LYS HA H 1 4.403 0.02 . 1 . . . . 6 LYS HA . 17193 1 35 . 1 1 6 6 LYS HB2 H 1 1.897 0.02 . 2 . . . . 6 LYS HB2 . 17193 1 36 . 1 1 6 6 LYS HB3 H 1 1.960 0.02 . 2 . . . . 6 LYS HB3 . 17193 1 37 . 1 1 6 6 LYS HD2 H 1 1.813 0.02 . 1 . . . . 6 LYS HD2 . 17193 1 38 . 1 1 6 6 LYS HD3 H 1 1.813 0.02 . 1 . . . . 6 LYS HD3 . 17193 1 39 . 1 1 6 6 LYS HE2 H 1 3.124 0.02 . 1 . . . . 6 LYS HE2 . 17193 1 40 . 1 1 6 6 LYS HE3 H 1 3.124 0.02 . 1 . . . . 6 LYS HE3 . 17193 1 41 . 1 1 6 6 LYS HG2 H 1 1.534 0.02 . 1 . . . . 6 LYS HG2 . 17193 1 42 . 1 1 6 6 LYS HG3 H 1 1.534 0.02 . 1 . . . . 6 LYS HG3 . 17193 1 43 . 1 1 7 7 GLU H H 1 8.352 0.02 . 1 . . . . 7 GLU H . 17193 1 44 . 1 1 7 7 GLU HA H 1 4.436 0.02 . 1 . . . . 7 GLU HA . 17193 1 45 . 1 1 7 7 GLU HB2 H 1 2.119 0.02 . 2 . . . . 7 GLU HB2 . 17193 1 46 . 1 1 7 7 GLU HB3 H 1 2.224 0.02 . 2 . . . . 7 GLU HB3 . 17193 1 47 . 1 1 7 7 GLU HG2 H 1 2.572 0.02 . 1 . . . . 7 GLU HG2 . 17193 1 48 . 1 1 7 7 GLU HG3 H 1 2.572 0.02 . 1 . . . . 7 GLU HG3 . 17193 1 49 . 1 1 8 8 LYS H H 1 8.164 0.02 . 1 . . . . 8 LYS H . 17193 1 50 . 1 1 8 8 LYS HA H 1 4.436 0.02 . 1 . . . . 8 LYS HA . 17193 1 51 . 1 1 8 8 LYS HB2 H 1 1.899 0.02 . 2 . . . . 8 LYS HB2 . 17193 1 52 . 1 1 8 8 LYS HB3 H 1 1.963 0.02 . 2 . . . . 8 LYS HB3 . 17193 1 53 . 1 1 8 8 LYS HD2 H 1 1.805 0.02 . 1 . . . . 8 LYS HD2 . 17193 1 54 . 1 1 8 8 LYS HD3 H 1 1.805 0.02 . 1 . . . . 8 LYS HD3 . 17193 1 55 . 1 1 8 8 LYS HE2 H 1 3.120 0.02 . 1 . . . . 8 LYS HE2 . 17193 1 56 . 1 1 8 8 LYS HE3 H 1 3.120 0.02 . 1 . . . . 8 LYS HE3 . 17193 1 57 . 1 1 8 8 LYS HG2 H 1 1.529 0.02 . 1 . . . . 8 LYS HG2 . 17193 1 58 . 1 1 8 8 LYS HG3 H 1 1.529 0.02 . 1 . . . . 8 LYS HG3 . 17193 1 59 . 1 1 9 9 SER H H 1 8.220 0.02 . 1 . . . . 9 SER H . 17193 1 60 . 1 1 9 9 SER HA H 1 4.583 0.02 . 1 . . . . 9 SER HA . 17193 1 61 . 1 1 9 9 SER HB2 H 1 3.980 0.02 . 2 . . . . 9 SER HB2 . 17193 1 62 . 1 1 9 9 SER HB3 H 1 4.030 0.02 . 2 . . . . 9 SER HB3 . 17193 1 63 . 1 1 10 10 ARG H H 1 8.292 0.02 . 1 . . . . 10 ARG H . 17193 1 64 . 1 1 10 10 ARG HA H 1 4.428 0.02 . 1 . . . . 10 ARG HA . 17193 1 65 . 1 1 10 10 ARG HB2 H 1 1.947 0.02 . 2 . . . . 10 ARG HB2 . 17193 1 66 . 1 1 10 10 ARG HB3 H 1 2.025 0.02 . 2 . . . . 10 ARG HB3 . 17193 1 67 . 1 1 10 10 ARG HD2 H 1 3.299 0.02 . 1 . . . . 10 ARG HD2 . 17193 1 68 . 1 1 10 10 ARG HD3 H 1 3.299 0.02 . 1 . . . . 10 ARG HD3 . 17193 1 69 . 1 1 10 10 ARG HE H 1 7.282 0.02 . 1 . . . . 10 ARG HE . 17193 1 70 . 1 1 10 10 ARG HG2 H 1 1.810 0.02 . 1 . . . . 10 ARG HG2 . 17193 1 71 . 1 1 10 10 ARG HG3 H 1 1.810 0.02 . 1 . . . . 10 ARG HG3 . 17193 1 72 . 1 1 11 11 LEU H H 1 7.980 0.02 . 1 . . . . 11 LEU H . 17193 1 73 . 1 1 11 11 LEU HA H 1 4.560 0.02 . 1 . . . . 11 LEU HA . 17193 1 74 . 1 1 11 11 LEU HB2 H 1 1.880 0.02 . 1 . . . . 11 LEU HB2 . 17193 1 75 . 1 1 11 11 LEU HB3 H 1 1.880 0.02 . 1 . . . . 11 LEU HB3 . 17193 1 76 . 1 1 11 11 LEU HD11 H 1 1.005 0.02 . 2 . . . . 11 LEU MD1 . 17193 1 77 . 1 1 11 11 LEU HD12 H 1 1.005 0.02 . 2 . . . . 11 LEU MD1 . 17193 1 78 . 1 1 11 11 LEU HD13 H 1 1.005 0.02 . 2 . . . . 11 LEU MD1 . 17193 1 79 . 1 1 11 11 LEU HD21 H 1 1.054 0.02 . 2 . . . . 11 LEU MD2 . 17193 1 80 . 1 1 11 11 LEU HD22 H 1 1.054 0.02 . 2 . . . . 11 LEU MD2 . 17193 1 81 . 1 1 11 11 LEU HD23 H 1 1.054 0.02 . 2 . . . . 11 LEU MD2 . 17193 1 82 . 1 1 11 11 LEU HG H 1 1.771 0.02 . 1 . . . . 11 LEU HG . 17193 1 83 . 1 1 12 12 GLN H H 1 8.019 0.02 . 1 . . . . 12 GLN H . 17193 1 84 . 1 1 12 12 GLN HA H 1 4.492 0.02 . 1 . . . . 12 GLN HA . 17193 1 85 . 1 1 12 12 GLN HB2 H 1 2.137 0.02 . 2 . . . . 12 GLN HB2 . 17193 1 86 . 1 1 12 12 GLN HB3 H 1 2.315 0.02 . 2 . . . . 12 GLN HB3 . 17193 1 87 . 1 1 13 13 GLY H H 1 8.385 0.02 . 1 . . . . 13 GLY H . 17193 1 88 . 1 1 13 13 GLY HA2 H 1 4.057 0.02 . 1 . . . . 13 GLY HA2 . 17193 1 89 . 1 1 13 13 GLY HA3 H 1 4.057 0.02 . 1 . . . . 13 GLY HA3 . 17193 1 90 . 1 1 14 14 GLY H H 1 8.314 0.02 . 1 . . . . 14 GLY H . 17193 1 91 . 1 1 14 14 GLY HA2 H 1 4.112 0.02 . 1 . . . . 14 GLY HA2 . 17193 1 92 . 1 1 14 14 GLY HA3 H 1 4.112 0.02 . 1 . . . . 14 GLY HA3 . 17193 1 93 . 1 1 15 15 VAL H H 1 7.867 0.02 . 1 . . . . 15 VAL H . 17193 1 94 . 1 1 15 15 VAL HA H 1 3.960 0.02 . 1 . . . . 15 VAL HA . 17193 1 95 . 1 1 15 15 VAL HB H 1 2.250 0.02 . 1 . . . . 15 VAL HB . 17193 1 96 . 1 1 15 15 VAL HG11 H 1 1.082 0.02 . 2 . . . . 15 VAL MG1 . 17193 1 97 . 1 1 15 15 VAL HG12 H 1 1.082 0.02 . 2 . . . . 15 VAL MG1 . 17193 1 98 . 1 1 15 15 VAL HG13 H 1 1.082 0.02 . 2 . . . . 15 VAL MG1 . 17193 1 99 . 1 1 15 15 VAL HG21 H 1 1.169 0.02 . 2 . . . . 15 VAL MG2 . 17193 1 100 . 1 1 15 15 VAL HG22 H 1 1.169 0.02 . 2 . . . . 15 VAL MG2 . 17193 1 101 . 1 1 15 15 VAL HG23 H 1 1.169 0.02 . 2 . . . . 15 VAL MG2 . 17193 1 102 . 1 1 16 16 LEU H H 1 8.268 0.02 . 1 . . . . 16 LEU H . 17193 1 103 . 1 1 16 16 LEU HA H 1 4.285 0.02 . 1 . . . . 16 LEU HA . 17193 1 104 . 1 1 16 16 LEU HD11 H 1 1.009 0.02 . 2 . . . . 16 LEU MD1 . 17193 1 105 . 1 1 16 16 LEU HD12 H 1 1.009 0.02 . 2 . . . . 16 LEU MD1 . 17193 1 106 . 1 1 16 16 LEU HD13 H 1 1.009 0.02 . 2 . . . . 16 LEU MD1 . 17193 1 107 . 1 1 16 16 LEU HD21 H 1 1.172 0.02 . 2 . . . . 16 LEU MD2 . 17193 1 108 . 1 1 16 16 LEU HD22 H 1 1.172 0.02 . 2 . . . . 16 LEU MD2 . 17193 1 109 . 1 1 16 16 LEU HD23 H 1 1.172 0.02 . 2 . . . . 16 LEU MD2 . 17193 1 110 . 1 1 17 17 VAL H H 1 7.989 0.02 . 1 . . . . 17 VAL H . 17193 1 111 . 1 1 17 17 VAL HA H 1 3.630 0.02 . 1 . . . . 17 VAL HA . 17193 1 112 . 1 1 17 17 VAL HB H 1 2.148 0.02 . 1 . . . . 17 VAL HB . 17193 1 113 . 1 1 17 17 VAL HG11 H 1 1.069 0.02 . 2 . . . . 17 VAL MG1 . 17193 1 114 . 1 1 17 17 VAL HG12 H 1 1.069 0.02 . 2 . . . . 17 VAL MG1 . 17193 1 115 . 1 1 17 17 VAL HG13 H 1 1.069 0.02 . 2 . . . . 17 VAL MG1 . 17193 1 116 . 1 1 17 17 VAL HG21 H 1 1.175 0.02 . 2 . . . . 17 VAL MG2 . 17193 1 117 . 1 1 17 17 VAL HG22 H 1 1.175 0.02 . 2 . . . . 17 VAL MG2 . 17193 1 118 . 1 1 17 17 VAL HG23 H 1 1.175 0.02 . 2 . . . . 17 VAL MG2 . 17193 1 119 . 1 1 18 18 ASN H H 1 8.069 0.02 . 1 . . . . 18 ASN H . 17193 1 120 . 1 1 18 18 ASN HA H 1 4.494 0.02 . 1 . . . . 18 ASN HA . 17193 1 121 . 1 1 18 18 ASN HB2 H 1 2.847 0.02 . 2 . . . . 18 ASN HB2 . 17193 1 122 . 1 1 18 18 ASN HB3 H 1 3.018 0.02 . 2 . . . . 18 ASN HB3 . 17193 1 123 . 1 1 19 19 GLU H H 1 8.263 0.02 . 1 . . . . 19 GLU H . 17193 1 124 . 1 1 19 19 GLU HA H 1 4.223 0.02 . 1 . . . . 19 GLU HA . 17193 1 125 . 1 1 19 19 GLU HG2 H 1 2.495 0.02 . 2 . . . . 19 GLU HG2 . 17193 1 126 . 1 1 19 19 GLU HG3 H 1 2.636 0.02 . 2 . . . . 19 GLU HG3 . 17193 1 127 . 1 1 20 20 ILE H H 1 8.263 0.02 . 1 . . . . 20 ILE H . 17193 1 128 . 1 1 20 20 ILE HA H 1 4.412 0.02 . 1 . . . . 20 ILE HA . 17193 1 129 . 1 1 20 20 ILE HG21 H 1 1.069 0.02 . 1 . . . . 20 ILE MG . 17193 1 130 . 1 1 20 20 ILE HG22 H 1 1.069 0.02 . 1 . . . . 20 ILE MG . 17193 1 131 . 1 1 20 20 ILE HG23 H 1 1.069 0.02 . 1 . . . . 20 ILE MG . 17193 1 132 . 1 1 21 21 LEU H H 1 8.418 0.02 . 1 . . . . 21 LEU H . 17193 1 133 . 1 1 21 21 LEU HA H 1 3.783 0.02 . 1 . . . . 21 LEU HA . 17193 1 134 . 1 1 21 21 LEU HB2 H 1 1.990 0.02 . 2 . . . . 21 LEU HB2 . 17193 1 135 . 1 1 21 21 LEU HB3 H 1 2.150 0.02 . 2 . . . . 21 LEU HB3 . 17193 1 136 . 1 1 21 21 LEU HD11 H 1 0.920 0.02 . 2 . . . . 21 LEU MD1 . 17193 1 137 . 1 1 21 21 LEU HD12 H 1 0.920 0.02 . 2 . . . . 21 LEU MD1 . 17193 1 138 . 1 1 21 21 LEU HD13 H 1 0.920 0.02 . 2 . . . . 21 LEU MD1 . 17193 1 139 . 1 1 21 21 LEU HD21 H 1 1.020 0.02 . 2 . . . . 21 LEU MD2 . 17193 1 140 . 1 1 21 21 LEU HD22 H 1 1.020 0.02 . 2 . . . . 21 LEU MD2 . 17193 1 141 . 1 1 21 21 LEU HD23 H 1 1.020 0.02 . 2 . . . . 21 LEU MD2 . 17193 1 142 . 1 1 21 21 LEU HG H 1 1.124 0.02 . 1 . . . . 21 LEU HG . 17193 1 143 . 1 1 22 22 ASN H H 1 8.248 0.02 . 1 . . . . 22 ASN H . 17193 1 144 . 1 1 22 22 ASN HA H 1 4.586 0.02 . 1 . . . . 22 ASN HA . 17193 1 145 . 1 1 22 22 ASN HB2 H 1 2.779 0.02 . 2 . . . . 22 ASN HB2 . 17193 1 146 . 1 1 22 22 ASN HB3 H 1 2.995 0.02 . 2 . . . . 22 ASN HB3 . 17193 1 147 . 1 1 23 23 HIS H H 1 8.026 0.02 . 1 . . . . 23 HIS H . 17193 1 148 . 1 1 23 23 HIS HA H 1 4.634 0.02 . 1 . . . . 23 HIS HA . 17193 1 149 . 1 1 23 23 HIS HB2 H 1 3.285 0.02 . 2 . . . . 23 HIS HB2 . 17193 1 150 . 1 1 23 23 HIS HB3 H 1 3.601 0.02 . 2 . . . . 23 HIS HB3 . 17193 1 151 . 1 1 23 23 HIS HD2 H 1 7.674 0.02 . 1 . . . . 23 HIS HD2 . 17193 1 152 . 1 1 23 23 HIS HE1 H 1 8.897 0.02 . 1 . . . . 23 HIS HE1 . 17193 1 153 . 1 1 24 24 MET HA H 1 3.833 0.02 . 1 . . . . 24 MET HA . 17193 1 154 . 1 1 24 24 MET HB2 H 1 1.962 0.02 . 1 . . . . 24 MET HB2 . 17193 1 155 . 1 1 24 24 MET HB3 H 1 1.962 0.02 . 1 . . . . 24 MET HB3 . 17193 1 156 . 1 1 26 26 ARG HA H 1 4.396 0.02 . 1 . . . . 26 ARG HA . 17193 1 157 . 1 1 26 26 ARG HB2 H 1 1.951 0.02 . 2 . . . . 26 ARG HB2 . 17193 1 158 . 1 1 26 26 ARG HB3 H 1 2.033 0.02 . 2 . . . . 26 ARG HB3 . 17193 1 159 . 1 1 26 26 ARG HD2 H 1 3.290 0.02 . 1 . . . . 26 ARG HD2 . 17193 1 160 . 1 1 26 26 ARG HD3 H 1 3.290 0.02 . 1 . . . . 26 ARG HD3 . 17193 1 161 . 1 1 26 26 ARG HE H 1 7.188 0.02 . 1 . . . . 26 ARG HE . 17193 1 162 . 1 1 26 26 ARG HG2 H 1 1.814 0.02 . 1 . . . . 26 ARG HG2 . 17193 1 163 . 1 1 26 26 ARG HG3 H 1 1.814 0.02 . 1 . . . . 26 ARG HG3 . 17193 1 164 . 1 1 27 27 ALA H H 1 7.977 0.02 . 1 . . . . 27 ALA H . 17193 1 165 . 1 1 27 27 ALA HA H 1 4.396 0.02 . 1 . . . . 27 ALA HA . 17193 1 166 . 1 1 27 27 ALA HB1 H 1 1.575 0.02 . 1 . . . . 27 ALA MB . 17193 1 167 . 1 1 27 27 ALA HB2 H 1 1.575 0.02 . 1 . . . . 27 ALA MB . 17193 1 168 . 1 1 27 27 ALA HB3 H 1 1.575 0.02 . 1 . . . . 27 ALA MB . 17193 1 169 . 1 1 28 28 THR H H 1 7.840 0.02 . 1 . . . . 28 THR H . 17193 1 170 . 1 1 28 28 THR HA H 1 4.392 0.02 . 1 . . . . 28 THR HA . 17193 1 171 . 1 1 28 28 THR HB H 1 4.343 0.02 . 1 . . . . 28 THR HB . 17193 1 172 . 1 1 28 28 THR HG21 H 1 1.345 0.02 . 1 . . . . 28 THR MG . 17193 1 173 . 1 1 28 28 THR HG22 H 1 1.345 0.02 . 1 . . . . 28 THR MG . 17193 1 174 . 1 1 28 28 THR HG23 H 1 1.345 0.02 . 1 . . . . 28 THR MG . 17193 1 175 . 1 1 29 29 GLN H H 1 8.031 0.02 . 1 . . . . 29 GLN H . 17193 1 176 . 1 1 29 29 GLN HA H 1 4.549 0.02 . 1 . . . . 29 GLN HA . 17193 1 177 . 1 1 29 29 GLN HB2 H 1 2.128 0.02 . 2 . . . . 29 GLN HB2 . 17193 1 178 . 1 1 29 29 GLN HB3 H 1 2.267 0.02 . 2 . . . . 29 GLN HB3 . 17193 1 179 . 1 1 30 30 ILE H H 1 7.895 0.02 . 1 . . . . 30 ILE H . 17193 1 180 . 1 1 30 30 ILE HA H 1 4.324 0.02 . 1 . . . . 30 ILE HA . 17193 1 181 . 1 1 30 30 ILE HB H 1 1.770 0.02 . 1 . . . . 30 ILE HB . 17193 1 182 . 1 1 30 30 ILE HD11 H 1 1.020 0.02 . 1 . . . . 30 ILE MD . 17193 1 183 . 1 1 30 30 ILE HD12 H 1 1.020 0.02 . 1 . . . . 30 ILE MD . 17193 1 184 . 1 1 30 30 ILE HD13 H 1 1.020 0.02 . 1 . . . . 30 ILE MD . 17193 1 185 . 1 1 30 30 ILE HG12 H 1 1.329 0.02 . 2 . . . . 30 ILE HG12 . 17193 1 186 . 1 1 30 30 ILE HG13 H 1 1.081 0.02 . 2 . . . . 30 ILE HG13 . 17193 1 187 . 1 1 31 31 PRO HA H 1 4.324 0.02 . 1 . . . . 31 PRO HA . 17193 1 188 . 1 1 31 31 PRO HB2 H 1 2.420 0.02 . 1 . . . . 31 PRO HB2 . 17193 1 189 . 1 1 31 31 PRO HB3 H 1 2.420 0.02 . 1 . . . . 31 PRO HB3 . 17193 1 190 . 1 1 31 31 PRO HD2 H 1 3.701 0.02 . 1 . . . . 31 PRO HD2 . 17193 1 191 . 1 1 31 31 PRO HD3 H 1 3.701 0.02 . 1 . . . . 31 PRO HD3 . 17193 1 192 . 1 1 31 31 PRO HG2 H 1 2.073 0.02 . 1 . . . . 31 PRO HG2 . 17193 1 193 . 1 1 31 31 PRO HG3 H 1 2.073 0.02 . 1 . . . . 31 PRO HG3 . 17193 1 194 . 1 1 32 32 SER H H 1 7.914 0.02 . 1 . . . . 32 SER H . 17193 1 195 . 1 1 32 32 SER HA H 1 4.484 0.02 . 1 . . . . 32 SER HA . 17193 1 196 . 1 1 32 32 SER HB2 H 1 3.919 0.02 . 2 . . . . 32 SER HB2 . 17193 1 197 . 1 1 32 32 SER HB3 H 1 3.998 0.02 . 2 . . . . 32 SER HB3 . 17193 1 198 . 1 1 33 33 TYR H H 1 8.019 0.02 . 1 . . . . 33 TYR H . 17193 1 199 . 1 1 33 33 TYR HA H 1 4.503 0.02 . 1 . . . . 33 TYR HA . 17193 1 200 . 1 1 33 33 TYR HB2 H 1 3.138 0.02 . 2 . . . . 33 TYR HB2 . 17193 1 201 . 1 1 33 33 TYR HB3 H 1 3.168 0.02 . 2 . . . . 33 TYR HB3 . 17193 1 202 . 1 1 33 33 TYR HD1 H 1 7.168 0.02 . 1 . . . . 33 TYR HD1 . 17193 1 203 . 1 1 33 33 TYR HD2 H 1 7.168 0.02 . 1 . . . . 33 TYR HD2 . 17193 1 204 . 1 1 33 33 TYR HE1 H 1 6.890 0.02 . 1 . . . . 33 TYR HE1 . 17193 1 205 . 1 1 33 33 TYR HE2 H 1 6.890 0.02 . 1 . . . . 33 TYR HE2 . 17193 1 206 . 1 1 34 34 LYS H H 1 7.820 0.02 . 1 . . . . 34 LYS H . 17193 1 207 . 1 1 34 34 LYS HA H 1 4.079 0.02 . 1 . . . . 34 LYS HA . 17193 1 208 . 1 1 34 34 LYS HB2 H 1 1.934 0.02 . 1 . . . . 34 LYS HB2 . 17193 1 209 . 1 1 34 34 LYS HB3 H 1 1.934 0.02 . 1 . . . . 34 LYS HB3 . 17193 1 210 . 1 1 34 34 LYS HD2 H 1 1.763 0.02 . 2 . . . . 34 LYS HD2 . 17193 1 211 . 1 1 34 34 LYS HD3 H 1 1.815 0.02 . 2 . . . . 34 LYS HD3 . 17193 1 212 . 1 1 34 34 LYS HE2 H 1 3.177 0.02 . 1 . . . . 34 LYS HE2 . 17193 1 213 . 1 1 34 34 LYS HE3 H 1 3.177 0.02 . 1 . . . . 34 LYS HE3 . 17193 1 214 . 1 1 34 34 LYS HG2 H 1 1.421 0.02 . 1 . . . . 34 LYS HG2 . 17193 1 215 . 1 1 34 34 LYS HG3 H 1 1.421 0.02 . 1 . . . . 34 LYS HG3 . 17193 1 216 . 1 1 35 35 LYS H H 1 7.698 0.02 . 1 . . . . 35 LYS H . 17193 1 217 . 1 1 35 35 LYS HA H 1 4.259 0.02 . 1 . . . . 35 LYS HA . 17193 1 218 . 1 1 35 35 LYS HB2 H 1 1.932 0.02 . 2 . . . . 35 LYS HB2 . 17193 1 219 . 1 1 35 35 LYS HB3 H 1 1.992 0.02 . 2 . . . . 35 LYS HB3 . 17193 1 220 . 1 1 35 35 LYS HD2 H 1 1.814 0.02 . 1 . . . . 35 LYS HD2 . 17193 1 221 . 1 1 35 35 LYS HD3 H 1 1.814 0.02 . 1 . . . . 35 LYS HD3 . 17193 1 222 . 1 1 36 36 LEU H H 1 7.823 0.02 . 1 . . . . 36 LEU H . 17193 1 223 . 1 1 36 36 LEU HA H 1 4.334 0.02 . 1 . . . . 36 LEU HA . 17193 1 224 . 1 1 36 36 LEU HB2 H 1 1.863 0.02 . 1 . . . . 36 LEU HB2 . 17193 1 225 . 1 1 36 36 LEU HB3 H 1 1.863 0.02 . 1 . . . . 36 LEU HB3 . 17193 1 226 . 1 1 36 36 LEU HD11 H 1 1.007 0.02 . 2 . . . . 36 LEU MD1 . 17193 1 227 . 1 1 36 36 LEU HD12 H 1 1.007 0.02 . 2 . . . . 36 LEU MD1 . 17193 1 228 . 1 1 36 36 LEU HD13 H 1 1.007 0.02 . 2 . . . . 36 LEU MD1 . 17193 1 229 . 1 1 36 36 LEU HD21 H 1 1.075 0.02 . 2 . . . . 36 LEU MD2 . 17193 1 230 . 1 1 36 36 LEU HD22 H 1 1.075 0.02 . 2 . . . . 36 LEU MD2 . 17193 1 231 . 1 1 36 36 LEU HD23 H 1 1.075 0.02 . 2 . . . . 36 LEU MD2 . 17193 1 232 . 1 1 37 37 ILE H H 1 7.518 0.02 . 1 . . . . 37 ILE H . 17193 1 233 . 1 1 37 37 ILE HA H 1 4.257 0.02 . 1 . . . . 37 ILE HA . 17193 1 234 . 1 1 37 37 ILE HB H 1 2.073 0.02 . 1 . . . . 37 ILE HB . 17193 1 235 . 1 1 37 37 ILE HG12 H 1 1.363 0.02 . 2 . . . . 37 ILE HG12 . 17193 1 236 . 1 1 37 37 ILE HG13 H 1 1.610 0.02 . 2 . . . . 37 ILE HG13 . 17193 1 237 . 1 1 37 37 ILE HG21 H 1 1.012 0.02 . 1 . . . . 37 ILE MG . 17193 1 238 . 1 1 37 37 ILE HG22 H 1 1.012 0.02 . 1 . . . . 37 ILE MG . 17193 1 239 . 1 1 37 37 ILE HG23 H 1 1.012 0.02 . 1 . . . . 37 ILE MG . 17193 1 240 . 1 1 38 38 MET H H 1 7.854 0.02 . 1 . . . . 38 MET H . 17193 1 241 . 1 1 38 38 MET HA H 1 4.520 0.02 . 1 . . . . 38 MET HA . 17193 1 242 . 1 1 38 38 MET HB2 H 1 2.057 0.02 . 2 . . . . 38 MET HB2 . 17193 1 243 . 1 1 38 38 MET HB3 H 1 2.098 0.02 . 2 . . . . 38 MET HB3 . 17193 1 244 . 1 1 38 38 MET HG2 H 1 2.546 0.02 . 2 . . . . 38 MET HG2 . 17193 1 245 . 1 1 38 38 MET HG3 H 1 2.618 0.02 . 2 . . . . 38 MET HG3 . 17193 1 246 . 1 1 39 39 TYR H H 1 7.705 0.02 . 1 . . . . 39 TYR H . 17193 1 247 . 1 1 39 39 TYR HA H 1 4.631 0.02 . 1 . . . . 39 TYR HA . 17193 1 248 . 1 1 39 39 TYR HB2 H 1 3.124 0.02 . 2 . . . . 39 TYR HB2 . 17193 1 249 . 1 1 39 39 TYR HB3 H 1 3.199 0.02 . 2 . . . . 39 TYR HB3 . 17193 1 250 . 1 1 39 39 TYR HD1 H 1 7.219 0.02 . 1 . . . . 39 TYR HD1 . 17193 1 251 . 1 1 39 39 TYR HD2 H 1 7.219 0.02 . 1 . . . . 39 TYR HD2 . 17193 1 252 . 1 1 39 39 TYR HE1 H 1 6.917 0.02 . 1 . . . . 39 TYR HE1 . 17193 1 253 . 1 1 39 39 TYR HE2 H 1 6.917 0.02 . 1 . . . . 39 TYR HE2 . 17193 1 stop_ save_