################################### # 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 7254 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _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 $sample_1 isotropic 7254 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 GLU H H 1 8.31 0.01 . 1 . . . . 1 GLU H . 7254 1 2 . 1 1 1 1 GLU HA H 1 4.15 0.01 . 1 . . . . 1 GLU HA . 7254 1 3 . 1 1 1 1 GLU HB2 H 1 1.85 0.01 . 1 . . . . 1 GLU HB2 . 7254 1 4 . 1 1 1 1 GLU HB3 H 1 1.85 0.01 . 1 . . . . 1 GLU HB3 . 7254 1 5 . 1 1 1 1 GLU HG2 H 1 2.03 0.01 . 2 . . . . 1 GLU HG2 . 7254 1 6 . 1 1 1 1 GLU HG3 H 1 2.18 0.01 . 2 . . . . 1 GLU HG3 . 7254 1 7 . 1 1 2 2 SER H H 1 7.90 0.01 . 1 . . . . 2 SER H . 7254 1 8 . 1 1 2 2 SER HA H 1 4.87 0.01 . 1 . . . . 2 SER HA . 7254 1 9 . 1 1 2 2 SER HB2 H 1 3.50 0.01 . 2 . . . . 2 SER HB2 . 7254 1 10 . 1 1 2 2 SER HB3 H 1 3.53 0.01 . 2 . . . . 2 SER HB3 . 7254 1 11 . 1 1 3 3 PHE H H 1 9.12 0.01 . 1 . . . . 3 PHE H . 7254 1 12 . 1 1 3 3 PHE HA H 1 4.32 0.01 . 1 . . . . 3 PHE HA . 7254 1 13 . 1 1 3 3 PHE HB2 H 1 1.95 0.01 . 2 . . . . 3 PHE HB2 . 7254 1 14 . 1 1 3 3 PHE HB3 H 1 2.24 0.01 . 2 . . . . 3 PHE HB3 . 7254 1 15 . 1 1 3 3 PHE HD1 H 1 6.79 0.01 . 1 . . . . 3 PHE HD1 . 7254 1 16 . 1 1 3 3 PHE HD2 H 1 6.79 0.01 . 1 . . . . 3 PHE HD2 . 7254 1 17 . 1 1 3 3 PHE HE1 H 1 7.04 0.01 . 1 . . . . 3 PHE HE1 . 7254 1 18 . 1 1 3 3 PHE HE2 H 1 7.04 0.01 . 1 . . . . 3 PHE HE2 . 7254 1 19 . 1 1 3 3 PHE HZ H 1 7.14 0.01 . 1 . . . . 3 PHE HZ . 7254 1 20 . 1 1 4 4 GLY H H 1 8.37 0.01 . 1 . . . . 4 GLY H . 7254 1 21 . 1 1 4 4 GLY HA2 H 1 3.44 0.01 . 2 . . . . 4 GLY HA2 . 7254 1 22 . 1 1 4 4 GLY HA3 H 1 4.81 0.01 . 2 . . . . 4 GLY HA3 . 7254 1 23 . 1 1 5 5 LEU H H 1 8.93 0.01 . 1 . . . . 5 LEU H . 7254 1 24 . 1 1 5 5 LEU HA H 1 4.81 0.01 . 1 . . . . 5 LEU HA . 7254 1 25 . 1 1 5 5 LEU HB3 H 1 1.89 0.01 . 2 . . . . 5 LEU HB3 . 7254 1 26 . 1 1 5 5 LEU HG H 1 1.39 0.01 . 1 . . . . 5 LEU HG . 7254 1 27 . 1 1 5 5 LEU HD11 H 1 0.49 0.01 . 2 . . . . 5 LEU HD1 . 7254 1 28 . 1 1 5 5 LEU HD12 H 1 0.49 0.01 . 2 . . . . 5 LEU HD1 . 7254 1 29 . 1 1 5 5 LEU HD13 H 1 0.49 0.01 . 2 . . . . 5 LEU HD1 . 7254 1 30 . 1 1 5 5 LEU HD21 H 1 0.87 0.01 . 2 . . . . 5 LEU HD2 . 7254 1 31 . 1 1 5 5 LEU HD22 H 1 0.87 0.01 . 2 . . . . 5 LEU HD2 . 7254 1 32 . 1 1 5 5 LEU HD23 H 1 0.87 0.01 . 2 . . . . 5 LEU HD2 . 7254 1 33 . 1 1 6 6 GLY H H 1 8.66 0.01 . 1 . . . . 6 GLY H . 7254 1 34 . 1 1 6 6 GLY HA2 H 1 3.42 0.01 . 2 . . . . 6 GLY HA2 . 7254 1 35 . 1 1 6 6 GLY HA3 H 1 4.60 0.01 . 2 . . . . 6 GLY HA3 . 7254 1 36 . 1 1 7 7 ILE H H 1 8.98 0.01 . 1 . . . . 7 ILE H . 7254 1 37 . 1 1 7 7 ILE HA H 1 4.31 0.01 . 1 . . . . 7 ILE HA . 7254 1 38 . 1 1 7 7 ILE HB H 1 1.88 0.01 . 1 . . . . 7 ILE HB . 7254 1 39 . 1 1 7 7 ILE HG12 H 1 1.11 0.01 . 2 . . . . 7 ILE HG12 . 7254 1 40 . 1 1 7 7 ILE HG13 H 1 1.39 0.01 . 2 . . . . 7 ILE HG13 . 7254 1 41 . 1 1 7 7 ILE HG21 H 1 0.96 0.01 . 1 . . . . 7 ILE HG2 . 7254 1 42 . 1 1 7 7 ILE HG22 H 1 0.96 0.01 . 1 . . . . 7 ILE HG2 . 7254 1 43 . 1 1 7 7 ILE HG23 H 1 0.96 0.01 . 1 . . . . 7 ILE HG2 . 7254 1 44 . 1 1 7 7 ILE HD11 H 1 0.67 0.01 . 1 . . . . 7 ILE HD1 . 7254 1 45 . 1 1 7 7 ILE HD12 H 1 0.67 0.01 . 1 . . . . 7 ILE HD1 . 7254 1 46 . 1 1 7 7 ILE HD13 H 1 0.67 0.01 . 1 . . . . 7 ILE HD1 . 7254 1 47 . 1 1 8 8 ARG H H 1 9.66 0.01 . 1 . . . . 8 ARG H . 7254 1 48 . 1 1 8 8 ARG HA H 1 4.70 0.01 . 1 . . . . 8 ARG HA . 7254 1 49 . 1 1 8 8 ARG HB2 H 1 1.74 0.01 . 2 . . . . 8 ARG HB2 . 7254 1 50 . 1 1 8 8 ARG HB3 H 1 1.79 0.01 . 2 . . . . 8 ARG HB3 . 7254 1 51 . 1 1 8 8 ARG HG2 H 1 1.49 0.01 . 2 . . . . 8 ARG HG2 . 7254 1 52 . 1 1 8 8 ARG HG3 H 1 1.63 0.01 . 2 . . . . 8 ARG HG3 . 7254 1 53 . 1 1 8 8 ARG HD2 H 1 3.15 0.01 . 1 . . . . 8 ARG HD2 . 7254 1 54 . 1 1 8 8 ARG HD3 H 1 3.15 0.01 . 1 . . . . 8 ARG HD3 . 7254 1 55 . 1 1 9 9 GLY H H 1 8.59 0.01 . 1 . . . . 9 GLY H . 7254 1 56 . 1 1 9 9 GLY HA2 H 1 3.84 0.01 . 2 . . . . 9 GLY HA2 . 7254 1 57 . 1 1 9 9 GLY HA3 H 1 4.74 0.01 . 2 . . . . 9 GLY HA3 . 7254 1 58 . 1 1 10 10 ARG H H 1 8.92 0.01 . 1 . . . . 10 ARG H . 7254 1 59 . 1 1 10 10 ARG HA H 1 3.34 0.01 . 1 . . . . 10 ARG HA . 7254 1 60 . 1 1 10 10 ARG HB2 H 1 1.76 0.01 . 2 . . . . 10 ARG HB2 . 7254 1 61 . 1 1 10 10 ARG HB3 H 1 1.88 0.01 . 2 . . . . 10 ARG HB3 . 7254 1 62 . 1 1 10 10 ARG HG2 H 1 1.43 0.01 . 2 . . . . 10 ARG HG2 . 7254 1 63 . 1 1 10 10 ARG HG3 H 1 1.58 0.01 . 2 . . . . 10 ARG HG3 . 7254 1 64 . 1 1 10 10 ARG HD2 H 1 3.02 0.01 . 2 . . . . 10 ARG HD2 . 7254 1 65 . 1 1 10 10 ARG HD3 H 1 3.09 0.01 . 2 . . . . 10 ARG HD3 . 7254 1 66 . 1 1 11 11 GLU H H 1 8.87 0.01 . 1 . . . . 11 GLU H . 7254 1 67 . 1 1 11 11 GLU HA H 1 3.94 0.01 . 1 . . . . 11 GLU HA . 7254 1 68 . 1 1 11 11 GLU HB2 H 1 1.97 0.01 . 2 . . . . 11 GLU HB2 . 7254 1 69 . 1 1 11 11 GLU HB3 H 1 2.07 0.01 . 2 . . . . 11 GLU HB3 . 7254 1 70 . 1 1 11 11 GLU HG2 H 1 2.29 0.01 . 2 . . . . 11 GLU HG2 . 7254 1 71 . 1 1 11 11 GLU HG3 H 1 2.41 0.01 . 2 . . . . 11 GLU HG3 . 7254 1 72 . 1 1 12 12 ARG H H 1 7.98 0.01 . 1 . . . . 12 ARG H . 7254 1 73 . 1 1 12 12 ARG HA H 1 3.89 0.01 . 1 . . . . 12 ARG HA . 7254 1 74 . 1 1 12 12 ARG HB2 H 1 2.00 0.01 . 2 . . . . 12 ARG HB2 . 7254 1 75 . 1 1 12 12 ARG HB3 H 1 2.05 0.01 . 2 . . . . 12 ARG HB3 . 7254 1 76 . 1 1 12 12 ARG HG2 H 1 1.67 0.01 . 2 . . . . 12 ARG HG2 . 7254 1 77 . 1 1 12 12 ARG HD2 H 1 3.47 0.01 . 2 . . . . 12 ARG HD2 . 7254 1 78 . 1 1 12 12 ARG HD3 H 1 3.66 0.01 . 2 . . . . 12 ARG HD3 . 7254 1 79 . 1 1 12 12 ARG HE H 1 7.36 0.01 . 1 . . . . 12 ARG HE . 7254 1 80 . 1 1 13 13 PHE H H 1 8.41 0.01 . 1 . . . . 13 PHE H . 7254 1 81 . 1 1 13 13 PHE HA H 1 4.13 0.01 . 1 . . . . 13 PHE HA . 7254 1 82 . 1 1 13 13 PHE HB2 H 1 2.81 0.01 . 2 . . . . 13 PHE HB2 . 7254 1 83 . 1 1 13 13 PHE HB3 H 1 2.85 0.01 . 2 . . . . 13 PHE HB3 . 7254 1 84 . 1 1 13 13 PHE HD1 H 1 6.80 0.01 . 1 . . . . 13 PHE HD1 . 7254 1 85 . 1 1 13 13 PHE HD2 H 1 6.80 0.01 . 1 . . . . 13 PHE HD2 . 7254 1 86 . 1 1 13 13 PHE HE1 H 1 7.18 0.01 . 1 . . . . 13 PHE HE1 . 7254 1 87 . 1 1 13 13 PHE HE2 H 1 7.18 0.01 . 1 . . . . 13 PHE HE2 . 7254 1 88 . 1 1 13 13 PHE HZ H 1 7.35 0.01 . 1 . . . . 13 PHE HZ . 7254 1 89 . 1 1 14 14 GLU H H 1 8.52 0.01 . 1 . . . . 14 GLU H . 7254 1 90 . 1 1 14 14 GLU HA H 1 3.54 0.01 . 1 . . . . 14 GLU HA . 7254 1 91 . 1 1 14 14 GLU HB2 H 1 1.95 0.01 . 1 . . . . 14 GLU HB2 . 7254 1 92 . 1 1 14 14 GLU HB3 H 1 1.95 0.01 . 1 . . . . 14 GLU HB3 . 7254 1 93 . 1 1 14 14 GLU HG2 H 1 2.32 0.01 . 2 . . . . 14 GLU HG2 . 7254 1 94 . 1 1 14 14 GLU HG3 H 1 2.45 0.01 . 2 . . . . 14 GLU HG3 . 7254 1 95 . 1 1 15 15 MET H H 1 7.63 0.01 . 1 . . . . 15 MET H . 7254 1 96 . 1 1 15 15 MET HA H 1 4.06 0.01 . 1 . . . . 15 MET HA . 7254 1 97 . 1 1 15 15 MET HB2 H 1 1.93 0.01 . 2 . . . . 15 MET HB2 . 7254 1 98 . 1 1 15 15 MET HB3 H 1 2.21 0.01 . 2 . . . . 15 MET HB3 . 7254 1 99 . 1 1 15 15 MET HG2 H 1 2.00 0.01 . 2 . . . . 15 MET HG2 . 7254 1 100 . 1 1 15 15 MET HG3 H 1 2.52 0.01 . 2 . . . . 15 MET HG3 . 7254 1 101 . 1 1 15 15 MET HE1 H 1 1.48 0.01 . 1 . . . . 15 MET HE . 7254 1 102 . 1 1 15 15 MET HE2 H 1 1.48 0.01 . 1 . . . . 15 MET HE . 7254 1 103 . 1 1 15 15 MET HE3 H 1 1.48 0.01 . 1 . . . . 15 MET HE . 7254 1 104 . 1 1 16 16 PHE H H 1 8.05 0.01 . 1 . . . . 16 PHE H . 7254 1 105 . 1 1 16 16 PHE HA H 1 4.10 0.01 . 1 . . . . 16 PHE HA . 7254 1 106 . 1 1 16 16 PHE HB2 H 1 2.64 0.01 . 2 . . . . 16 PHE HB2 . 7254 1 107 . 1 1 16 16 PHE HB3 H 1 2.86 0.01 . 2 . . . . 16 PHE HB3 . 7254 1 108 . 1 1 16 16 PHE HD1 H 1 7.12 0.01 . 1 . . . . 16 PHE HD1 . 7254 1 109 . 1 1 16 16 PHE HD2 H 1 7.12 0.01 . 1 . . . . 16 PHE HD2 . 7254 1 110 . 1 1 16 16 PHE HE1 H 1 7.28 0.01 . 1 . . . . 16 PHE HE1 . 7254 1 111 . 1 1 16 16 PHE HE2 H 1 7.28 0.01 . 1 . . . . 16 PHE HE2 . 7254 1 112 . 1 1 16 16 PHE HZ H 1 6.89 0.01 . 1 . . . . 16 PHE HZ . 7254 1 113 . 1 1 17 17 ARG H H 1 9.21 0.01 . 1 . . . . 17 ARG H . 7254 1 114 . 1 1 17 17 ARG HA H 1 3.65 0.01 . 1 . . . . 17 ARG HA . 7254 1 115 . 1 1 17 17 ARG HB2 H 1 1.47 0.01 . 1 . . . . 17 ARG HB2 . 7254 1 116 . 1 1 17 17 ARG HB3 H 1 1.51 0.01 . 1 . . . . 17 ARG HB3 . 7254 1 117 . 1 1 17 17 ARG HG2 H 1 1.38 0.01 . 1 . . . . 17 ARG HG2 . 7254 1 118 . 1 1 17 17 ARG HG3 H 1 1.38 0.01 . 1 . . . . 17 ARG HG3 . 7254 1 119 . 1 1 17 17 ARG HD2 H 1 2.76 0.01 . 2 . . . . 17 ARG HD2 . 7254 1 120 . 1 1 17 17 ARG HD3 H 1 3.17 0.01 . 2 . . . . 17 ARG HD3 . 7254 1 121 . 1 1 18 18 GLU H H 1 7.87 0.01 . 1 . . . . 18 GLU H . 7254 1 122 . 1 1 18 18 GLU HA H 1 3.99 0.01 . 1 . . . . 18 GLU HA . 7254 1 123 . 1 1 18 18 GLU HB2 H 1 2.05 0.01 . 1 . . . . 18 GLU HB2 . 7254 1 124 . 1 1 18 18 GLU HB3 H 1 2.05 0.01 . 1 . . . . 18 GLU HB3 . 7254 1 125 . 1 1 18 18 GLU HG2 H 1 2.15 0.01 . 2 . . . . 18 GLU HG2 . 7254 1 126 . 1 1 18 18 GLU HG3 H 1 2.22 0.01 . 2 . . . . 18 GLU HG3 . 7254 1 127 . 1 1 19 19 LEU H H 1 7.84 0.01 . 1 . . . . 19 LEU H . 7254 1 128 . 1 1 19 19 LEU HA H 1 4.05 0.01 . 1 . . . . 19 LEU HA . 7254 1 129 . 1 1 19 19 LEU HB2 H 1 1.52 0.01 . 2 . . . . 19 LEU HB2 . 7254 1 130 . 1 1 19 19 LEU HB3 H 1 2.21 0.01 . 2 . . . . 19 LEU HB3 . 7254 1 131 . 1 1 19 19 LEU HG H 1 2.02 0.01 . 1 . . . . 19 LEU HG . 7254 1 132 . 1 1 19 19 LEU HD11 H 1 0.74 0.01 . 2 . . . . 19 LEU HD1 . 7254 1 133 . 1 1 19 19 LEU HD12 H 1 0.74 0.01 . 2 . . . . 19 LEU HD1 . 7254 1 134 . 1 1 19 19 LEU HD13 H 1 0.74 0.01 . 2 . . . . 19 LEU HD1 . 7254 1 135 . 1 1 19 19 LEU HD21 H 1 0.88 0.01 . 2 . . . . 19 LEU HD2 . 7254 1 136 . 1 1 19 19 LEU HD22 H 1 0.88 0.01 . 2 . . . . 19 LEU HD2 . 7254 1 137 . 1 1 19 19 LEU HD23 H 1 0.88 0.01 . 2 . . . . 19 LEU HD2 . 7254 1 138 . 1 1 20 20 ASN H H 1 8.78 0.01 . 1 . . . . 20 ASN H . 7254 1 139 . 1 1 20 20 ASN HA H 1 4.52 0.01 . 1 . . . . 20 ASN HA . 7254 1 140 . 1 1 20 20 ASN HB2 H 1 2.34 0.01 . 2 . . . . 20 ASN HB2 . 7254 1 141 . 1 1 20 20 ASN HB3 H 1 2.76 0.01 . 2 . . . . 20 ASN HB3 . 7254 1 142 . 1 1 20 20 ASN HD21 H 1 6.29 0.01 . 2 . . . . 20 ASN HD21 . 7254 1 143 . 1 1 20 20 ASN HD22 H 1 7.62 0.01 . 2 . . . . 20 ASN HD22 . 7254 1 144 . 1 1 21 21 GLU H H 1 8.76 0.01 . 1 . . . . 21 GLU H . 7254 1 145 . 1 1 21 21 GLU HA H 1 3.99 0.01 . 1 . . . . 21 GLU HA . 7254 1 146 . 1 1 21 21 GLU HB2 H 1 2.06 0.01 . 2 . . . . 21 GLU HB2 . 7254 1 147 . 1 1 21 21 GLU HB3 H 1 2.15 0.01 . 2 . . . . 21 GLU HB3 . 7254 1 148 . 1 1 21 21 GLU HG2 H 1 2.20 0.01 . 2 . . . . 21 GLU HG2 . 7254 1 149 . 1 1 21 21 GLU HG3 H 1 2.49 0.01 . 2 . . . . 21 GLU HG3 . 7254 1 150 . 1 1 22 22 ALA H H 1 8.09 0.01 . 1 . . . . 22 ALA H . 7254 1 151 . 1 1 22 22 ALA HA H 1 4.05 0.01 . 1 . . . . 22 ALA HA . 7254 1 152 . 1 1 22 22 ALA HB1 H 1 1.51 0.01 . 1 . . . . 22 ALA HB . 7254 1 153 . 1 1 22 22 ALA HB2 H 1 1.51 0.01 . 1 . . . . 22 ALA HB . 7254 1 154 . 1 1 22 22 ALA HB3 H 1 1.51 0.01 . 1 . . . . 22 ALA HB . 7254 1 155 . 1 1 23 23 LEU H H 1 8.03 0.01 . 1 . . . . 23 LEU H . 7254 1 156 . 1 1 23 23 LEU HA H 1 4.01 0.01 . 1 . . . . 23 LEU HA . 7254 1 157 . 1 1 23 23 LEU HB2 H 1 1.39 0.01 . 2 . . . . 23 LEU HB2 . 7254 1 158 . 1 1 23 23 LEU HB3 H 1 2.17 0.01 . 2 . . . . 23 LEU HB3 . 7254 1 159 . 1 1 23 23 LEU HG H 1 2.00 0.01 . 1 . . . . 23 LEU HG . 7254 1 160 . 1 1 23 23 LEU HD11 H 1 0.85 0.01 . 2 . . . . 23 LEU HD1 . 7254 1 161 . 1 1 23 23 LEU HD12 H 1 0.85 0.01 . 2 . . . . 23 LEU HD1 . 7254 1 162 . 1 1 23 23 LEU HD13 H 1 0.85 0.01 . 2 . . . . 23 LEU HD1 . 7254 1 163 . 1 1 23 23 LEU HD21 H 1 0.97 0.01 . 2 . . . . 23 LEU HD2 . 7254 1 164 . 1 1 23 23 LEU HD22 H 1 0.97 0.01 . 2 . . . . 23 LEU HD2 . 7254 1 165 . 1 1 23 23 LEU HD23 H 1 0.97 0.01 . 2 . . . . 23 LEU HD2 . 7254 1 166 . 1 1 24 24 GLU H H 1 8.38 0.01 . 1 . . . . 24 GLU H . 7254 1 167 . 1 1 24 24 GLU HA H 1 4.19 0.01 . 1 . . . . 24 GLU HA . 7254 1 168 . 1 1 24 24 GLU HB2 H 1 2.05 0.01 . 2 . . . . 24 GLU HB2 . 7254 1 169 . 1 1 24 24 GLU HB3 H 1 2.16 0.01 . 2 . . . . 24 GLU HB3 . 7254 1 170 . 1 1 24 24 GLU HG2 H 1 2.74 0.01 . 2 . . . . 24 GLU HG2 . 7254 1 171 . 1 1 25 25 LEU H H 1 8.20 0.01 . 1 . . . . 25 LEU H . 7254 1 172 . 1 1 25 25 LEU HA H 1 4.24 0.01 . 1 . . . . 25 LEU HA . 7254 1 173 . 1 1 25 25 LEU HB2 H 1 1.78 0.01 . 2 . . . . 25 LEU HB2 . 7254 1 174 . 1 1 25 25 LEU HB3 H 1 1.93 0.01 . 2 . . . . 25 LEU HB3 . 7254 1 175 . 1 1 25 25 LEU HG H 1 1.67 0.01 . 1 . . . . 25 LEU HG . 7254 1 176 . 1 1 25 25 LEU HD11 H 1 0.87 0.01 . 2 . . . . 25 LEU HD1 . 7254 1 177 . 1 1 25 25 LEU HD12 H 1 0.87 0.01 . 2 . . . . 25 LEU HD1 . 7254 1 178 . 1 1 25 25 LEU HD13 H 1 0.87 0.01 . 2 . . . . 25 LEU HD1 . 7254 1 179 . 1 1 25 25 LEU HD21 H 1 0.93 0.01 . 2 . . . . 25 LEU HD2 . 7254 1 180 . 1 1 25 25 LEU HD22 H 1 0.93 0.01 . 2 . . . . 25 LEU HD2 . 7254 1 181 . 1 1 25 25 LEU HD23 H 1 0.93 0.01 . 2 . . . . 25 LEU HD2 . 7254 1 182 . 1 1 26 26 LYS H H 1 7.88 0.01 . 1 . . . . 26 LYS H . 7254 1 183 . 1 1 26 26 LYS HA H 1 3.95 0.01 . 1 . . . . 26 LYS HA . 7254 1 184 . 1 1 26 26 LYS HB2 H 1 1.80 0.01 . 2 . . . . 26 LYS HB2 . 7254 1 185 . 1 1 26 26 LYS HB3 H 1 2.28 0.01 . 2 . . . . 26 LYS HB3 . 7254 1 186 . 1 1 26 26 LYS HG2 H 1 1.49 0.01 . 2 . . . . 26 LYS HG2 . 7254 1 187 . 1 1 26 26 LYS HG3 H 1 1.55 0.01 . 2 . . . . 26 LYS HG3 . 7254 1 188 . 1 1 26 26 LYS HD2 H 1 1.63 0.01 . 2 . . . . 26 LYS HD2 . 7254 1 189 . 1 1 26 26 LYS HD3 H 1 1.68 0.01 . 2 . . . . 26 LYS HD3 . 7254 1 190 . 1 1 26 26 LYS HE2 H 1 2.98 0.01 . 1 . . . . 26 LYS HE2 . 7254 1 191 . 1 1 26 26 LYS HE3 H 1 2.98 0.01 . 1 . . . . 26 LYS HE3 . 7254 1 192 . 1 1 27 27 ASP H H 1 8.20 0.01 . 1 . . . . 27 ASP H . 7254 1 193 . 1 1 27 27 ASP HA H 1 4.36 0.01 . 1 . . . . 27 ASP HA . 7254 1 194 . 1 1 27 27 ASP HB2 H 1 2.74 0.01 . 2 . . . . 27 ASP HB2 . 7254 1 195 . 1 1 27 27 ASP HB3 H 1 2.96 0.01 . 2 . . . . 27 ASP HB3 . 7254 1 196 . 1 1 28 28 ALA H H 1 7.70 0.01 . 1 . . . . 28 ALA H . 7254 1 197 . 1 1 28 28 ALA HA H 1 4.24 0.01 . 1 . . . . 28 ALA HA . 7254 1 198 . 1 1 28 28 ALA HB1 H 1 1.56 0.01 . 1 . . . . 28 ALA HB . 7254 1 199 . 1 1 28 28 ALA HB2 H 1 1.56 0.01 . 1 . . . . 28 ALA HB . 7254 1 200 . 1 1 28 28 ALA HB3 H 1 1.56 0.01 . 1 . . . . 28 ALA HB . 7254 1 201 . 1 1 29 29 GLN H H 1 7.89 0.01 . 1 . . . . 29 GLN H . 7254 1 202 . 1 1 29 29 GLN HA H 1 4.24 0.01 . 1 . . . . 29 GLN HA . 7254 1 203 . 1 1 29 29 GLN HB2 H 1 2.09 0.01 . 2 . . . . 29 GLN HB2 . 7254 1 204 . 1 1 29 29 GLN HB3 H 1 2.24 0.01 . 2 . . . . 29 GLN HB3 . 7254 1 205 . 1 1 29 29 GLN HG2 H 1 2.50 0.01 . 1 . . . . 29 GLN HG2 . 7254 1 206 . 1 1 29 29 GLN HG3 H 1 2.50 0.01 . 1 . . . . 29 GLN HG3 . 7254 1 207 . 1 1 29 29 GLN HE21 H 1 6.92 0.01 . 2 . . . . 29 GLN HE21 . 7254 1 208 . 1 1 29 29 GLN HE22 H 1 7.45 0.01 . 2 . . . . 29 GLN HE22 . 7254 1 209 . 1 1 30 30 ALA H H 1 7.96 0.01 . 1 . . . . 30 ALA H . 7254 1 210 . 1 1 30 30 ALA HA H 1 4.32 0.01 . 1 . . . . 30 ALA HA . 7254 1 211 . 1 1 30 30 ALA HB1 H 1 1.48 0.01 . 1 . . . . 30 ALA HB . 7254 1 212 . 1 1 30 30 ALA HB2 H 1 1.48 0.01 . 1 . . . . 30 ALA HB . 7254 1 213 . 1 1 30 30 ALA HB3 H 1 1.48 0.01 . 1 . . . . 30 ALA HB . 7254 1 214 . 1 1 31 31 GLY H H 1 8.16 0.01 . 1 . . . . 31 GLY H . 7254 1 215 . 1 1 31 31 GLY HA2 H 1 3.92 0.01 . 1 . . . . 31 GLY HA2 . 7254 1 216 . 1 1 31 31 GLY HA3 H 1 3.92 0.01 . 1 . . . . 31 GLY HA3 . 7254 1 stop_ save_