################################### # 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_chemical_shift_set_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_set_1 _Assigned_chem_shift_list.Entry_ID 6654 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference _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 NOESY' 1 $sample_1 . 6654 1 2 '2D TOCSY' 1 $sample_1 . 6654 1 3 DQF-COSY 1 $sample_1 . 6654 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.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 1 1 GLY HA2 H 1 3.94 0.01 . 1 . . . . . . . . . 6654 1 2 . 1 1 1 1 GLY HA3 H 1 3.94 0.01 . 1 . . . . . . . . . 6654 1 3 . 1 1 2 2 CYS H H 1 8.68 0.01 . 1 . . . . . . . . . 6654 1 4 . 1 1 2 2 CYS HA H 1 4.80 0.01 . 1 . . . . . . . . . 6654 1 5 . 1 1 2 2 CYS HB2 H 1 3.11 0.01 . 2 . . . . . . . . . 6654 1 6 . 1 1 2 2 CYS HB3 H 1 2.99 0.01 . 2 . . . . . . . . . 6654 1 7 . 1 1 3 3 GLY H H 1 8.99 0.01 . 1 . . . . . . . . . 6654 1 8 . 1 1 3 3 GLY HA2 H 1 4.10 0.01 . 2 . . . . . . . . . 6654 1 9 . 1 1 3 3 GLY HA3 H 1 3.69 0.01 . 2 . . . . . . . . . 6654 1 10 . 1 1 4 4 GLY H H 1 7.98 0.01 . 1 . . . . . . . . . 6654 1 11 . 1 1 4 4 GLY HA2 H 1 3.46 0.01 . 2 . . . . . . . . . 6654 1 12 . 1 1 4 4 GLY HA3 H 1 3.15 0.01 . 2 . . . . . . . . . 6654 1 13 . 1 1 5 5 LEU H H 1 7.46 0.01 . 1 . . . . . . . . . 6654 1 14 . 1 1 5 5 LEU HA H 1 3.31 0.01 . 1 . . . . . . . . . 6654 1 15 . 1 1 5 5 LEU HB2 H 1 1.54 0.01 . 2 . . . . . . . . . 6654 1 16 . 1 1 5 5 LEU HB3 H 1 1.28 0.01 . 2 . . . . . . . . . 6654 1 17 . 1 1 5 5 LEU HG H 1 1.28 0.01 . 1 . . . . . . . . . 6654 1 18 . 1 1 5 5 LEU HD11 H 1 0.83 0.01 . 1 . . . . . . . . . 6654 1 19 . 1 1 5 5 LEU HD12 H 1 0.83 0.01 . 1 . . . . . . . . . 6654 1 20 . 1 1 5 5 LEU HD13 H 1 0.83 0.01 . 1 . . . . . . . . . 6654 1 21 . 1 1 5 5 LEU HD21 H 1 0.83 0.01 . 1 . . . . . . . . . 6654 1 22 . 1 1 5 5 LEU HD22 H 1 0.83 0.01 . 1 . . . . . . . . . 6654 1 23 . 1 1 5 5 LEU HD23 H 1 0.83 0.01 . 1 . . . . . . . . . 6654 1 24 . 1 1 6 6 MET H H 1 9.24 0.01 . 1 . . . . . . . . . 6654 1 25 . 1 1 6 6 MET HA H 1 3.30 0.01 . 1 . . . . . . . . . 6654 1 26 . 1 1 6 6 MET HB2 H 1 1.90 0.01 . 2 . . . . . . . . . 6654 1 27 . 1 1 6 6 MET HB3 H 1 1.65 0.01 . 2 . . . . . . . . . 6654 1 28 . 1 1 6 6 MET HG2 H 1 1.28 0.01 . 1 . . . . . . . . . 6654 1 29 . 1 1 6 6 MET HG3 H 1 1.28 0.01 . 1 . . . . . . . . . 6654 1 30 . 1 1 7 7 ALA H H 1 8.15 0.01 . 1 . . . . . . . . . 6654 1 31 . 1 1 7 7 ALA HA H 1 4.28 0.01 . 1 . . . . . . . . . 6654 1 32 . 1 1 7 7 ALA HB1 H 1 1.34 0.01 . 1 . . . . . . . . . 6654 1 33 . 1 1 7 7 ALA HB2 H 1 1.34 0.01 . 1 . . . . . . . . . 6654 1 34 . 1 1 7 7 ALA HB3 H 1 1.34 0.01 . 1 . . . . . . . . . 6654 1 35 . 1 1 8 8 GLY H H 1 8.58 0.01 . 1 . . . . . . . . . 6654 1 36 . 1 1 8 8 GLY HA2 H 1 4.44 0.01 . 2 . . . . . . . . . 6654 1 37 . 1 1 8 8 GLY HA3 H 1 3.80 0.01 . 2 . . . . . . . . . 6654 1 38 . 1 1 9 9 CYS H H 1 8.09 0.01 . 1 . . . . . . . . . 6654 1 39 . 1 1 9 9 CYS HA H 1 4.94 0.01 . 1 . . . . . . . . . 6654 1 40 . 1 1 9 9 CYS HB2 H 1 3.03 0.01 . 2 . . . . . . . . . 6654 1 41 . 1 1 9 9 CYS HB3 H 1 2.94 0.01 . 2 . . . . . . . . . 6654 1 42 . 1 1 10 10 ASP H H 1 8.39 0.01 . 1 . . . . . . . . . 6654 1 43 . 1 1 10 10 ASP HA H 1 4.65 0.01 . 1 . . . . . . . . . 6654 1 44 . 1 1 10 10 ASP HB2 H 1 2.98 0.01 . 2 . . . . . . . . . 6654 1 45 . 1 1 10 10 ASP HB3 H 1 2.59 0.01 . 2 . . . . . . . . . 6654 1 46 . 1 1 11 11 GLY H H 1 8.29 0.01 . 1 . . . . . . . . . 6654 1 47 . 1 1 11 11 GLY HA2 H 1 4.06 0.01 . 2 . . . . . . . . . 6654 1 48 . 1 1 11 11 GLY HA3 H 1 3.66 0.01 . 2 . . . . . . . . . 6654 1 49 . 1 1 12 12 LYS H H 1 8.40 0.01 . 1 . . . . . . . . . 6654 1 50 . 1 1 12 12 LYS HA H 1 4.53 0.01 . 1 . . . . . . . . . 6654 1 51 . 1 1 12 12 LYS HB2 H 1 1.78 0.01 . 2 . . . . . . . . . 6654 1 52 . 1 1 12 12 LYS HB3 H 1 1.62 0.01 . 2 . . . . . . . . . 6654 1 53 . 1 1 12 12 LYS HG2 H 1 1.38 0.01 . 2 . . . . . . . . . 6654 1 54 . 1 1 12 12 LYS HG3 H 1 1.32 0.01 . 2 . . . . . . . . . 6654 1 55 . 1 1 12 12 LYS HZ1 H 1 7.14 0.01 . 1 . . . . . . . . . 6654 1 56 . 1 1 12 12 LYS HZ2 H 1 7.14 0.01 . 1 . . . . . . . . . 6654 1 57 . 1 1 12 12 LYS HZ3 H 1 7.14 0.01 . 1 . . . . . . . . . 6654 1 58 . 1 1 13 13 SER H H 1 9.75 0.01 . 1 . . . . . . . . . 6654 1 59 . 1 1 13 13 SER HA H 1 4.65 0.01 . 1 . . . . . . . . . 6654 1 60 . 1 1 13 13 SER HB2 H 1 3.90 0.01 . 1 . . . . . . . . . 6654 1 61 . 1 1 13 13 SER HB3 H 1 3.90 0.01 . 1 . . . . . . . . . 6654 1 62 . 1 1 14 14 THR H H 1 8.09 0.01 . 1 . . . . . . . . . 6654 1 63 . 1 1 14 14 THR HA H 1 4.56 0.01 . 1 . . . . . . . . . 6654 1 64 . 1 1 14 14 THR HB H 1 4.16 0.01 . 1 . . . . . . . . . 6654 1 65 . 1 1 14 14 THR HG21 H 1 1.12 0.01 . 1 . . . . . . . . . 6654 1 66 . 1 1 14 14 THR HG22 H 1 1.12 0.01 . 1 . . . . . . . . . 6654 1 67 . 1 1 14 14 THR HG23 H 1 1.12 0.01 . 1 . . . . . . . . . 6654 1 68 . 1 1 15 15 PHE H H 1 8.67 0.01 . 1 . . . . . . . . . 6654 1 69 . 1 1 15 15 PHE HA H 1 4.92 0.01 . 1 . . . . . . . . . 6654 1 70 . 1 1 15 15 PHE HB2 H 1 3.28 0.01 . 2 . . . . . . . . . 6654 1 71 . 1 1 15 15 PHE HB3 H 1 2.84 0.01 . 2 . . . . . . . . . 6654 1 72 . 1 1 15 15 PHE HD1 H 1 7.12 0.01 . 1 . . . . . . . . . 6654 1 73 . 1 1 15 15 PHE HD2 H 1 7.12 0.01 . 1 . . . . . . . . . 6654 1 74 . 1 1 15 15 PHE HE1 H 1 7.23 0.01 . 1 . . . . . . . . . 6654 1 75 . 1 1 15 15 PHE HE2 H 1 7.23 0.01 . 1 . . . . . . . . . 6654 1 76 . 1 1 15 15 PHE HZ H 1 7.08 0.01 . 1 . . . . . . . . . 6654 1 77 . 1 1 16 16 CYS H H 1 9.33 0.01 . 1 . . . . . . . . . 6654 1 78 . 1 1 16 16 CYS HA H 1 5.15 0.01 . 1 . . . . . . . . . 6654 1 79 . 1 1 16 16 CYS HB2 H 1 3.27 0.01 . 2 . . . . . . . . . 6654 1 80 . 1 1 16 16 CYS HB3 H 1 2.67 0.01 . 2 . . . . . . . . . 6654 1 81 . 1 1 17 17 CYS H H 1 9.97 0.01 . 1 . . . . . . . . . 6654 1 82 . 1 1 17 17 CYS HA H 1 4.72 0.01 . 1 . . . . . . . . . 6654 1 83 . 1 1 17 17 CYS HB2 H 1 3.55 0.01 . 2 . . . . . . . . . 6654 1 84 . 1 1 17 17 CYS HB3 H 1 2.54 0.01 . 2 . . . . . . . . . 6654 1 85 . 1 1 18 18 SER H H 1 8.62 0.01 . 1 . . . . . . . . . 6654 1 86 . 1 1 18 18 SER HA H 1 4.37 0.01 . 1 . . . . . . . . . 6654 1 87 . 1 1 18 18 SER HB2 H 1 3.92 0.01 . 2 . . . . . . . . . 6654 1 88 . 1 1 18 18 SER HB3 H 1 3.90 0.01 . 2 . . . . . . . . . 6654 1 89 . 1 1 19 19 GLY H H 1 8.89 0.01 . 1 . . . . . . . . . 6654 1 90 . 1 1 19 19 GLY HA2 H 1 4.22 0.01 . 2 . . . . . . . . . 6654 1 91 . 1 1 19 19 GLY HA3 H 1 3.53 0.01 . 2 . . . . . . . . . 6654 1 92 . 1 1 20 20 TYR H H 1 8.31 0.01 . 1 . . . . . . . . . 6654 1 93 . 1 1 20 20 TYR HA H 1 5.37 0.01 . 1 . . . . . . . . . 6654 1 94 . 1 1 20 20 TYR HB2 H 1 3.23 0.01 . 2 . . . . . . . . . 6654 1 95 . 1 1 20 20 TYR HB3 H 1 2.88 0.01 . 2 . . . . . . . . . 6654 1 96 . 1 1 20 20 TYR HD1 H 1 6.66 0.01 . 1 . . . . . . . . . 6654 1 97 . 1 1 20 20 TYR HD2 H 1 6.66 0.01 . 1 . . . . . . . . . 6654 1 98 . 1 1 20 20 TYR HE1 H 1 6.59 0.01 . 1 . . . . . . . . . 6654 1 99 . 1 1 20 20 TYR HE2 H 1 6.59 0.01 . 1 . . . . . . . . . 6654 1 100 . 1 1 21 21 ASN H H 1 9.48 0.01 . 1 . . . . . . . . . 6654 1 101 . 1 1 21 21 ASN HA H 1 5.13 0.01 . 1 . . . . . . . . . 6654 1 102 . 1 1 21 21 ASN HB2 H 1 2.74 0.01 . 2 . . . . . . . . . 6654 1 103 . 1 1 21 21 ASN HB3 H 1 2.58 0.01 . 2 . . . . . . . . . 6654 1 104 . 1 1 21 21 ASN HD21 H 1 7.56 0.01 . 2 . . . . . . . . . 6654 1 105 . 1 1 21 21 ASN HD22 H 1 7.05 0.01 . 2 . . . . . . . . . 6654 1 106 . 1 1 22 22 CYS H H 1 9.22 0.01 . 1 . . . . . . . . . 6654 1 107 . 1 1 22 22 CYS HA H 1 4.76 0.01 . 1 . . . . . . . . . 6654 1 108 . 1 1 22 22 CYS HB2 H 1 3.05 0.01 . 2 . . . . . . . . . 6654 1 109 . 1 1 22 22 CYS HB3 H 1 2.94 0.01 . 2 . . . . . . . . . 6654 1 110 . 1 1 23 23 SER H H 1 8.55 0.01 . 1 . . . . . . . . . 6654 1 111 . 1 1 23 23 SER HA H 1 4.78 0.01 . 1 . . . . . . . . . 6654 1 112 . 1 1 23 23 SER HB2 H 1 4.44 0.01 . 2 . . . . . . . . . 6654 1 113 . 1 1 23 23 SER HB3 H 1 4.02 0.01 . 2 . . . . . . . . . 6654 1 114 . 1 1 24 24 PRO HA H 1 4.42 0.01 . 1 . . . . . . . . . 6654 1 115 . 1 1 24 24 PRO HB2 H 1 2.35 0.01 . 2 . . . . . . . . . 6654 1 116 . 1 1 24 24 PRO HB3 H 1 1.93 0.01 . 2 . . . . . . . . . 6654 1 117 . 1 1 24 24 PRO HG2 H 1 2.07 0.01 . 1 . . . . . . . . . 6654 1 118 . 1 1 24 24 PRO HG3 H 1 2.07 0.01 . 1 . . . . . . . . . 6654 1 119 . 1 1 24 24 PRO HD2 H 1 4.19 0.01 . 2 . . . . . . . . . 6654 1 120 . 1 1 24 24 PRO HD3 H 1 3.93 0.01 . 2 . . . . . . . . . 6654 1 121 . 1 1 25 25 THR H H 1 7.22 0.01 . 1 . . . . . . . . . 6654 1 122 . 1 1 25 25 THR HA H 1 3.79 0.01 . 1 . . . . . . . . . 6654 1 123 . 1 1 25 25 THR HB H 1 3.07 0.01 . 1 . . . . . . . . . 6654 1 124 . 1 1 25 25 THR HG21 H 1 0.26 0.01 . 1 . . . . . . . . . 6654 1 125 . 1 1 25 25 THR HG22 H 1 0.26 0.01 . 1 . . . . . . . . . 6654 1 126 . 1 1 25 25 THR HG23 H 1 0.26 0.01 . 1 . . . . . . . . . 6654 1 127 . 1 1 26 26 TRP H H 1 7.06 0.01 . 1 . . . . . . . . . 6654 1 128 . 1 1 26 26 TRP HA H 1 4.14 0.01 . 1 . . . . . . . . . 6654 1 129 . 1 1 26 26 TRP HB2 H 1 1.43 0.01 . 2 . . . . . . . . . 6654 1 130 . 1 1 26 26 TRP HB3 H 1 1.13 0.01 . 2 . . . . . . . . . 6654 1 131 . 1 1 26 26 TRP HD1 H 1 6.92 0.01 . 4 . . . . . . . . . 6654 1 132 . 1 1 26 26 TRP HE1 H 1 10.06 0.01 . 4 . . . . . . . . . 6654 1 133 . 1 1 26 26 TRP HE3 H 1 7.19 0.01 . 4 . . . . . . . . . 6654 1 134 . 1 1 26 26 TRP HZ2 H 1 7.47 0.01 . 4 . . . . . . . . . 6654 1 135 . 1 1 26 26 TRP HZ3 H 1 6.62 0.01 . 4 . . . . . . . . . 6654 1 136 . 1 1 26 26 TRP HH2 H 1 6.80 0.01 . 4 . . . . . . . . . 6654 1 137 . 1 1 27 27 LYS H H 1 8.08 0.01 . 1 . . . . . . . . . 6654 1 138 . 1 1 27 27 LYS HA H 1 3.91 0.01 . 1 . . . . . . . . . 6654 1 139 . 1 1 27 27 LYS HB2 H 1 2.13 0.01 . 1 . . . . . . . . . 6654 1 140 . 1 1 27 27 LYS HB3 H 1 2.13 0.01 . 1 . . . . . . . . . 6654 1 141 . 1 1 27 27 LYS HG2 H 1 1.23 0.01 . 1 . . . . . . . . . 6654 1 142 . 1 1 27 27 LYS HG3 H 1 1.23 0.01 . 1 . . . . . . . . . 6654 1 143 . 1 1 27 27 LYS HD2 H 1 1.64 0.01 . 1 . . . . . . . . . 6654 1 144 . 1 1 27 27 LYS HD3 H 1 1.64 0.01 . 1 . . . . . . . . . 6654 1 145 . 1 1 27 27 LYS HE2 H 1 2.96 0.01 . 1 . . . . . . . . . 6654 1 146 . 1 1 27 27 LYS HE3 H 1 2.96 0.01 . 1 . . . . . . . . . 6654 1 147 . 1 1 27 27 LYS HZ1 H 1 7.48 0.01 . 1 . . . . . . . . . 6654 1 148 . 1 1 27 27 LYS HZ2 H 1 7.48 0.01 . 1 . . . . . . . . . 6654 1 149 . 1 1 27 27 LYS HZ3 H 1 7.48 0.01 . 1 . . . . . . . . . 6654 1 150 . 1 1 28 28 TRP H H 1 7.11 0.01 . 1 . . . . . . . . . 6654 1 151 . 1 1 28 28 TRP HA H 1 5.72 0.01 . 1 . . . . . . . . . 6654 1 152 . 1 1 28 28 TRP HB2 H 1 3.23 0.01 . 2 . . . . . . . . . 6654 1 153 . 1 1 28 28 TRP HB3 H 1 2.69 0.01 . 2 . . . . . . . . . 6654 1 154 . 1 1 28 28 TRP HD1 H 1 6.96 0.01 . 4 . . . . . . . . . 6654 1 155 . 1 1 28 28 TRP HE1 H 1 9.90 0.01 . 4 . . . . . . . . . 6654 1 156 . 1 1 28 28 TRP HE3 H 1 7.54 0.01 . 4 . . . . . . . . . 6654 1 157 . 1 1 29 29 CYS H H 1 9.09 0.01 . 1 . . . . . . . . . 6654 1 158 . 1 1 29 29 CYS HA H 1 5.22 0.01 . 1 . . . . . . . . . 6654 1 159 . 1 1 29 29 CYS HB2 H 1 3.46 0.01 . 2 . . . . . . . . . 6654 1 160 . 1 1 29 29 CYS HB3 H 1 2.50 0.01 . 2 . . . . . . . . . 6654 1 161 . 1 1 30 30 VAL H H 1 9.62 0.01 . 1 . . . . . . . . . 6654 1 162 . 1 1 30 30 VAL HA H 1 4.95 0.01 . 1 . . . . . . . . . 6654 1 163 . 1 1 30 30 VAL HB H 1 2.60 0.01 . 1 . . . . . . . . . 6654 1 164 . 1 1 30 30 VAL HG11 H 1 1.387 0.01 . 2 . . . . . . . . . 6654 1 165 . 1 1 30 30 VAL HG12 H 1 1.387 0.01 . 2 . . . . . . . . . 6654 1 166 . 1 1 30 30 VAL HG13 H 1 1.387 0.01 . 2 . . . . . . . . . 6654 1 167 . 1 1 30 30 VAL HG21 H 1 1.13 0.01 . 2 . . . . . . . . . 6654 1 168 . 1 1 30 30 VAL HG22 H 1 1.13 0.01 . 2 . . . . . . . . . 6654 1 169 . 1 1 30 30 VAL HG23 H 1 1.13 0.01 . 2 . . . . . . . . . 6654 1 170 . 1 1 31 31 TYR H H 1 8.49 0.01 . 1 . . . . . . . . . 6654 1 171 . 1 1 31 31 TYR HA H 1 4.28 0.01 . 1 . . . . . . . . . 6654 1 172 . 1 1 31 31 TYR HB2 H 1 3.04 0.01 . 2 . . . . . . . . . 6654 1 173 . 1 1 31 31 TYR HB3 H 1 2.84 0.01 . 2 . . . . . . . . . 6654 1 174 . 1 1 31 31 TYR HD1 H 1 7.03 0.01 . 1 . . . . . . . . . 6654 1 175 . 1 1 31 31 TYR HD2 H 1 7.03 0.01 . 1 . . . . . . . . . 6654 1 176 . 1 1 31 31 TYR HE1 H 1 6.88 0.01 . 1 . . . . . . . . . 6654 1 177 . 1 1 31 31 TYR HE2 H 1 6.88 0.01 . 1 . . . . . . . . . 6654 1 178 . 1 1 32 32 ALA H H 1 8.24 0.01 . 1 . . . . . . . . . 6654 1 179 . 1 1 32 32 ALA HA H 1 4.31 0.01 . 1 . . . . . . . . . 6654 1 180 . 1 1 32 32 ALA HB1 H 1 1.13 0.01 . 1 . . . . . . . . . 6654 1 181 . 1 1 32 32 ALA HB2 H 1 1.13 0.01 . 1 . . . . . . . . . 6654 1 182 . 1 1 32 32 ALA HB3 H 1 1.13 0.01 . 1 . . . . . . . . . 6654 1 183 . 1 1 33 33 ARG H H 1 8.05 0.01 . 1 . . . . . . . . . 6654 1 184 . 1 1 33 33 ARG HA H 1 4.61 0.01 . 1 . . . . . . . . . 6654 1 185 . 1 1 33 33 ARG HB2 H 1 1.85 0.01 . 2 . . . . . . . . . 6654 1 186 . 1 1 33 33 ARG HB3 H 1 1.71 0.01 . 2 . . . . . . . . . 6654 1 187 . 1 1 33 33 ARG HG2 H 1 1.66 0.01 . 1 . . . . . . . . . 6654 1 188 . 1 1 33 33 ARG HG3 H 1 1.66 0.01 . 1 . . . . . . . . . 6654 1 189 . 1 1 33 33 ARG HD2 H 1 3.22 0.01 . 1 . . . . . . . . . 6654 1 190 . 1 1 33 33 ARG HD3 H 1 3.22 0.01 . 1 . . . . . . . . . 6654 1 191 . 1 1 33 33 ARG HH11 H 1 7.21 0.01 . 1 . . . . . . . . . 6654 1 192 . 1 1 33 33 ARG HH12 H 1 7.21 0.01 . 1 . . . . . . . . . 6654 1 193 . 1 1 33 33 ARG HH21 H 1 7.21 0.01 . 1 . . . . . . . . . 6654 1 194 . 1 1 33 33 ARG HH22 H 1 7.21 0.01 . 1 . . . . . . . . . 6654 1 195 . 1 1 34 34 PRO HA H 1 4.37 0.01 . 1 . . . . . . . . . 6654 1 196 . 1 1 34 34 PRO HB2 H 1 2.32 0.01 . 2 . . . . . . . . . 6654 1 197 . 1 1 34 34 PRO HB3 H 1 1.96 0.01 . 2 . . . . . . . . . 6654 1 198 . 1 1 34 34 PRO HG2 H 1 2.04 0.01 . 1 . . . . . . . . . 6654 1 199 . 1 1 34 34 PRO HG3 H 1 2.04 0.01 . 1 . . . . . . . . . 6654 1 200 . 1 1 34 34 PRO HD2 H 1 3.77 0.01 . 2 . . . . . . . . . 6654 1 201 . 1 1 34 34 PRO HD3 H 1 3.63 0.01 . 2 . . . . . . . . . 6654 1 stop_ save_