################################### # 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 5028 _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_ref_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 NOESY' 1 $sample_1 . 5028 1 2 DQF-COSY 1 $sample_1 . 5028 1 3 E-COSY 1 $sample_1 . 5028 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 SER H H 1 8.852 0.02 . 1 . . . . . . . . . 5028 1 2 . 1 1 1 1 SER HA H 1 4.529 0.02 . 1 . . . . . . . . . 5028 1 3 . 1 1 1 1 SER HB2 H 1 3.933 0.02 . 1 . . . . . . . . . 5028 1 4 . 1 1 1 1 SER HB3 H 1 3.933 0.02 . 1 . . . . . . . . . 5028 1 5 . 1 1 2 2 GLY H H 1 9.189 0.02 . 1 . . . . . . . . . 5028 1 6 . 1 1 2 2 GLY HA2 H 1 4.443 0.02 . 2 . . . . . . . . . 5028 1 7 . 1 1 2 2 GLY HA3 H 1 3.898 0.02 . 2 . . . . . . . . . 5028 1 8 . 1 1 3 3 SER H H 1 8.738 0.02 . 1 . . . . . . . . . 5028 1 9 . 1 1 3 3 SER HA H 1 4.486 0.02 . 1 . . . . . . . . . 5028 1 10 . 1 1 3 3 SER HB2 H 1 3.915 0.02 . 1 . . . . . . . . . 5028 1 11 . 1 1 3 3 SER HB3 H 1 3.915 0.02 . 1 . . . . . . . . . 5028 1 12 . 1 1 4 4 ASP H H 1 8.621 0.02 . 1 . . . . . . . . . 5028 1 13 . 1 1 4 4 ASP HA H 1 4.824 0.02 . 1 . . . . . . . . . 5028 1 14 . 1 1 4 4 ASP HB2 H 1 2.947 0.02 . 2 . . . . . . . . . 5028 1 15 . 1 1 4 4 ASP HB3 H 1 2.862 0.02 . 2 . . . . . . . . . 5028 1 16 . 1 1 5 5 GLY H H 1 8.25 0.02 . 1 . . . . . . . . . 5028 1 17 . 1 1 5 5 GLY HA2 H 1 4.11 0.02 . 2 . . . . . . . . . 5028 1 18 . 1 1 5 5 GLY HA3 H 1 3.834 0.02 . 2 . . . . . . . . . 5028 1 19 . 1 1 6 6 GLY H H 1 8.162 0.02 . 1 . . . . . . . . . 5028 1 20 . 1 1 6 6 GLY HA2 H 1 3.93 0.02 . 1 . . . . . . . . . 5028 1 21 . 1 1 6 6 GLY HA3 H 1 3.93 0.02 . 1 . . . . . . . . . 5028 1 22 . 1 1 7 7 VAL H H 1 8.542 0.02 . 1 . . . . . . . . . 5028 1 23 . 1 1 7 7 VAL HA H 1 4.016 0.02 . 1 . . . . . . . . . 5028 1 24 . 1 1 7 7 VAL HB H 1 1.991 0.02 . 1 . . . . . . . . . 5028 1 25 . 1 1 7 7 VAL HG11 H 1 0.943 0.02 . 1 . . . . . . . . . 5028 1 26 . 1 1 7 7 VAL HG12 H 1 0.943 0.02 . 1 . . . . . . . . . 5028 1 27 . 1 1 7 7 VAL HG13 H 1 0.943 0.02 . 1 . . . . . . . . . 5028 1 28 . 1 1 7 7 VAL HG21 H 1 0.839 0.02 . 1 . . . . . . . . . 5028 1 29 . 1 1 7 7 VAL HG22 H 1 0.839 0.02 . 1 . . . . . . . . . 5028 1 30 . 1 1 7 7 VAL HG23 H 1 0.839 0.02 . 1 . . . . . . . . . 5028 1 31 . 1 1 8 8 CYS H H 1 8.75 0.02 . 1 . . . . . . . . . 5028 1 32 . 1 1 8 8 CYS HA H 1 5.198 0.02 . 1 . . . . . . . . . 5028 1 33 . 1 1 8 8 CYS HB2 H 1 2.875 0.02 . 1 . . . . . . . . . 5028 1 34 . 1 1 8 8 CYS HB3 H 1 2.875 0.02 . 1 . . . . . . . . . 5028 1 35 . 1 1 9 9 PRO HA H 1 4.371 0.02 . 1 . . . . . . . . . 5028 1 36 . 1 1 9 9 PRO HB2 H 1 2.31 0.02 . 2 . . . . . . . . . 5028 1 37 . 1 1 9 9 PRO HB3 H 1 1.862 0.02 . 2 . . . . . . . . . 5028 1 38 . 1 1 9 9 PRO HG2 H 1 2.007 0.02 . 2 . . . . . . . . . 5028 1 39 . 1 1 9 9 PRO HG3 H 1 1.947 0.02 . 2 . . . . . . . . . 5028 1 40 . 1 1 9 9 PRO HD2 H 1 3.853 0.02 . 1 . . . . . . . . . 5028 1 41 . 1 1 9 9 PRO HD3 H 1 3.853 0.02 . 1 . . . . . . . . . 5028 1 42 . 1 1 10 10 LYS H H 1 8.29 0.02 . 1 . . . . . . . . . 5028 1 43 . 1 1 10 10 LYS HA H 1 4.263 0.02 . 1 . . . . . . . . . 5028 1 44 . 1 1 10 10 LYS HB2 H 1 1.829 0.02 . 2 . . . . . . . . . 5028 1 45 . 1 1 10 10 LYS HB3 H 1 1.704 0.02 . 2 . . . . . . . . . 5028 1 46 . 1 1 10 10 LYS HG2 H 1 1.367 0.02 . 1 . . . . . . . . . 5028 1 47 . 1 1 10 10 LYS HG3 H 1 1.367 0.02 . 1 . . . . . . . . . 5028 1 48 . 1 1 10 10 LYS HD2 H 1 1.481 0.02 . 1 . . . . . . . . . 5028 1 49 . 1 1 10 10 LYS HD3 H 1 1.481 0.02 . 1 . . . . . . . . . 5028 1 50 . 1 1 10 10 LYS HE2 H 1 2.993 0.02 . 1 . . . . . . . . . 5028 1 51 . 1 1 10 10 LYS HE3 H 1 2.993 0.02 . 1 . . . . . . . . . 5028 1 52 . 1 1 10 10 LYS HZ1 H 1 7.542 0.02 . 1 . . . . . . . . . 5028 1 53 . 1 1 10 10 LYS HZ2 H 1 7.542 0.02 . 1 . . . . . . . . . 5028 1 54 . 1 1 10 10 LYS HZ3 H 1 7.542 0.02 . 1 . . . . . . . . . 5028 1 55 . 1 1 11 11 ILE H H 1 7.752 0.02 . 1 . . . . . . . . . 5028 1 56 . 1 1 11 11 ILE HA H 1 4.387 0.02 . 1 . . . . . . . . . 5028 1 57 . 1 1 11 11 ILE HB H 1 1.795 0.02 . 1 . . . . . . . . . 5028 1 58 . 1 1 11 11 ILE HG12 H 1 1.356 0.02 . 1 . . . . . . . . . 5028 1 59 . 1 1 11 11 ILE HG13 H 1 1.356 0.02 . 1 . . . . . . . . . 5028 1 60 . 1 1 11 11 ILE HG21 H 1 0.831 0.02 . 1 . . . . . . . . . 5028 1 61 . 1 1 11 11 ILE HG22 H 1 0.831 0.02 . 1 . . . . . . . . . 5028 1 62 . 1 1 11 11 ILE HG23 H 1 0.831 0.02 . 1 . . . . . . . . . 5028 1 63 . 1 1 11 11 ILE HD11 H 1 1.07 0.02 . 1 . . . . . . . . . 5028 1 64 . 1 1 11 11 ILE HD12 H 1 1.07 0.02 . 1 . . . . . . . . . 5028 1 65 . 1 1 11 11 ILE HD13 H 1 1.07 0.02 . 1 . . . . . . . . . 5028 1 66 . 1 1 12 12 LEU H H 1 8.736 0.02 . 1 . . . . . . . . . 5028 1 67 . 1 1 12 12 LEU HA H 1 4.548 0.02 . 1 . . . . . . . . . 5028 1 68 . 1 1 12 12 LEU HB2 H 1 1.747 0.02 . 1 . . . . . . . . . 5028 1 69 . 1 1 12 12 LEU HB3 H 1 1.747 0.02 . 1 . . . . . . . . . 5028 1 70 . 1 1 12 12 LEU HG H 1 1.478 0.02 . 1 . . . . . . . . . 5028 1 71 . 1 1 12 12 LEU HD11 H 1 0.767 0.02 . 1 . . . . . . . . . 5028 1 72 . 1 1 12 12 LEU HD12 H 1 0.767 0.02 . 1 . . . . . . . . . 5028 1 73 . 1 1 12 12 LEU HD13 H 1 0.767 0.02 . 1 . . . . . . . . . 5028 1 74 . 1 1 12 12 LEU HD21 H 1 0.767 0.02 . 1 . . . . . . . . . 5028 1 75 . 1 1 12 12 LEU HD22 H 1 0.767 0.02 . 1 . . . . . . . . . 5028 1 76 . 1 1 12 12 LEU HD23 H 1 0.767 0.02 . 1 . . . . . . . . . 5028 1 77 . 1 1 13 13 LYS H H 1 8.946 0.02 . 1 . . . . . . . . . 5028 1 78 . 1 1 13 13 LYS HA H 1 4.592 0.02 . 1 . . . . . . . . . 5028 1 79 . 1 1 13 13 LYS HB2 H 1 1.606 0.02 . 2 . . . . . . . . . 5028 1 80 . 1 1 13 13 LYS HB3 H 1 1.566 0.02 . 2 . . . . . . . . . 5028 1 81 . 1 1 13 13 LYS HG2 H 1 1.414 0.02 . 1 . . . . . . . . . 5028 1 82 . 1 1 13 13 LYS HG3 H 1 1.414 0.02 . 1 . . . . . . . . . 5028 1 83 . 1 1 13 13 LYS HD2 H 1 1.754 0.02 . 1 . . . . . . . . . 5028 1 84 . 1 1 13 13 LYS HD3 H 1 1.754 0.02 . 1 . . . . . . . . . 5028 1 85 . 1 1 13 13 LYS HE2 H 1 3.089 0.02 . 1 . . . . . . . . . 5028 1 86 . 1 1 13 13 LYS HE3 H 1 3.089 0.02 . 1 . . . . . . . . . 5028 1 87 . 1 1 13 13 LYS HZ1 H 1 7.626 0.02 . 1 . . . . . . . . . 5028 1 88 . 1 1 13 13 LYS HZ2 H 1 7.626 0.02 . 1 . . . . . . . . . 5028 1 89 . 1 1 13 13 LYS HZ3 H 1 7.626 0.02 . 1 . . . . . . . . . 5028 1 90 . 1 1 14 14 LYS H H 1 8.672 0.02 . 1 . . . . . . . . . 5028 1 91 . 1 1 14 14 LYS HA H 1 4.316 0.02 . 1 . . . . . . . . . 5028 1 92 . 1 1 14 14 LYS HB2 H 1 1.643 0.02 . 2 . . . . . . . . . 5028 1 93 . 1 1 14 14 LYS HB3 H 1 1.513 0.02 . 2 . . . . . . . . . 5028 1 94 . 1 1 14 14 LYS HG2 H 1 0.937 0.02 . 1 . . . . . . . . . 5028 1 95 . 1 1 14 14 LYS HG3 H 1 0.937 0.02 . 1 . . . . . . . . . 5028 1 96 . 1 1 14 14 LYS HD2 H 1 1.309 0.02 . 1 . . . . . . . . . 5028 1 97 . 1 1 14 14 LYS HD3 H 1 1.309 0.02 . 1 . . . . . . . . . 5028 1 98 . 1 1 14 14 LYS HE2 H 1 2.93 0.02 . 1 . . . . . . . . . 5028 1 99 . 1 1 14 14 LYS HE3 H 1 2.93 0.02 . 1 . . . . . . . . . 5028 1 100 . 1 1 14 14 LYS HZ1 H 1 7.474 0.02 . 1 . . . . . . . . . 5028 1 101 . 1 1 14 14 LYS HZ2 H 1 7.474 0.02 . 1 . . . . . . . . . 5028 1 102 . 1 1 14 14 LYS HZ3 H 1 7.474 0.02 . 1 . . . . . . . . . 5028 1 103 . 1 1 15 15 CYS H H 1 8.437 0.02 . 1 . . . . . . . . . 5028 1 104 . 1 1 15 15 CYS HA H 1 4.888 0.02 . 1 . . . . . . . . . 5028 1 105 . 1 1 15 15 CYS HB2 H 1 3.198 0.02 . 2 . . . . . . . . . 5028 1 106 . 1 1 15 15 CYS HB3 H 1 2.932 0.02 . 2 . . . . . . . . . 5028 1 107 . 1 1 16 16 ARG H H 1 9.399 0.02 . 1 . . . . . . . . . 5028 1 108 . 1 1 16 16 ARG HA H 1 4.443 0.02 . 1 . . . . . . . . . 5028 1 109 . 1 1 16 16 ARG HB2 H 1 1.881 0.02 . 2 . . . . . . . . . 5028 1 110 . 1 1 16 16 ARG HB3 H 1 1.729 0.02 . 2 . . . . . . . . . 5028 1 111 . 1 1 16 16 ARG HG2 H 1 1.63 0.02 . 1 . . . . . . . . . 5028 1 112 . 1 1 16 16 ARG HG3 H 1 1.63 0.02 . 1 . . . . . . . . . 5028 1 113 . 1 1 16 16 ARG HD2 H 1 3.186 0.02 . 1 . . . . . . . . . 5028 1 114 . 1 1 16 16 ARG HD3 H 1 3.186 0.02 . 1 . . . . . . . . . 5028 1 115 . 1 1 16 16 ARG HE H 1 7.308 0.02 . 1 . . . . . . . . . 5028 1 116 . 1 1 17 17 ARG H H 1 8.081 0.02 . 1 . . . . . . . . . 5028 1 117 . 1 1 17 17 ARG HA H 1 4.742 0.02 . 1 . . . . . . . . . 5028 1 118 . 1 1 17 17 ARG HB2 H 1 2.034 0.02 . 2 . . . . . . . . . 5028 1 119 . 1 1 17 17 ARG HB3 H 1 1.793 0.02 . 2 . . . . . . . . . 5028 1 120 . 1 1 17 17 ARG HG2 H 1 1.559 0.02 . 2 . . . . . . . . . 5028 1 121 . 1 1 17 17 ARG HG3 H 1 1.457 0.02 . 2 . . . . . . . . . 5028 1 122 . 1 1 17 17 ARG HD2 H 1 3.153 0.02 . 1 . . . . . . . . . 5028 1 123 . 1 1 17 17 ARG HD3 H 1 3.153 0.02 . 1 . . . . . . . . . 5028 1 124 . 1 1 17 17 ARG HE H 1 7.169 0.02 . 1 . . . . . . . . . 5028 1 125 . 1 1 18 18 ASP H H 1 9.348 0.02 . 1 . . . . . . . . . 5028 1 126 . 1 1 18 18 ASP HA H 1 4.118 0.02 . 1 . . . . . . . . . 5028 1 127 . 1 1 18 18 ASP HB2 H 1 3.004 0.02 . 2 . . . . . . . . . 5028 1 128 . 1 1 18 18 ASP HB3 H 1 2.83 0.02 . 2 . . . . . . . . . 5028 1 129 . 1 1 19 19 SER H H 1 8.217 0.02 . 1 . . . . . . . . . 5028 1 130 . 1 1 19 19 SER HA H 1 4.303 0.02 . 1 . . . . . . . . . 5028 1 131 . 1 1 19 19 SER HB2 H 1 4.119 0.02 . 1 . . . . . . . . . 5028 1 132 . 1 1 19 19 SER HB3 H 1 3.834 0.02 . 1 . . . . . . . . . 5028 1 133 . 1 1 20 20 ASP H H 1 7.739 0.02 . 1 . . . . . . . . . 5028 1 134 . 1 1 20 20 ASP HA H 1 4.634 0.02 . 1 . . . . . . . . . 5028 1 135 . 1 1 20 20 ASP HB2 H 1 3.039 0.02 . 2 . . . . . . . . . 5028 1 136 . 1 1 20 20 ASP HB3 H 1 2.965 0.02 . 2 . . . . . . . . . 5028 1 137 . 1 1 21 21 CYS H H 1 8.16 0.02 . 1 . . . . . . . . . 5028 1 138 . 1 1 21 21 CYS HA H 1 5.063 0.02 . 1 . . . . . . . . . 5028 1 139 . 1 1 21 21 CYS HB2 H 1 2.845 0.02 . 1 . . . . . . . . . 5028 1 140 . 1 1 21 21 CYS HB3 H 1 2.674 0.02 . 1 . . . . . . . . . 5028 1 141 . 1 1 22 22 PRO HA H 1 4.624 0.02 . 1 . . . . . . . . . 5028 1 142 . 1 1 22 22 PRO HB2 H 1 2.26 0.02 . 2 . . . . . . . . . 5028 1 143 . 1 1 22 22 PRO HB3 H 1 1.938 0.02 . 2 . . . . . . . . . 5028 1 144 . 1 1 22 22 PRO HG2 H 1 2.099 0.02 . 2 . . . . . . . . . 5028 1 145 . 1 1 22 22 PRO HG3 H 1 2.041 0.02 . 2 . . . . . . . . . 5028 1 146 . 1 1 22 22 PRO HD2 H 1 3.742 0.02 . 2 . . . . . . . . . 5028 1 147 . 1 1 22 22 PRO HD3 H 1 3.43 0.02 . 2 . . . . . . . . . 5028 1 148 . 1 1 23 23 GLY H H 1 8.525 0.02 . 1 . . . . . . . . . 5028 1 149 . 1 1 23 23 GLY HA2 H 1 3.838 0.02 . 1 . . . . . . . . . 5028 1 150 . 1 1 23 23 GLY HA3 H 1 3.758 0.02 . 1 . . . . . . . . . 5028 1 151 . 1 1 24 24 ALA H H 1 8.451 0.02 . 1 . . . . . . . . . 5028 1 152 . 1 1 24 24 ALA HA H 1 4.537 0.02 . 1 . . . . . . . . . 5028 1 153 . 1 1 24 24 ALA HB1 H 1 1.366 0.02 . 1 . . . . . . . . . 5028 1 154 . 1 1 24 24 ALA HB2 H 1 1.366 0.02 . 1 . . . . . . . . . 5028 1 155 . 1 1 24 24 ALA HB3 H 1 1.366 0.02 . 1 . . . . . . . . . 5028 1 156 . 1 1 25 25 CYS H H 1 8.325 0.02 . 1 . . . . . . . . . 5028 1 157 . 1 1 25 25 CYS HA H 1 4.59 0.02 . 1 . . . . . . . . . 5028 1 158 . 1 1 25 25 CYS HB2 H 1 3.199 0.02 . 1 . . . . . . . . . 5028 1 159 . 1 1 25 25 CYS HB3 H 1 3.199 0.02 . 1 . . . . . . . . . 5028 1 160 . 1 1 26 26 ILE H H 1 9.083 0.02 . 1 . . . . . . . . . 5028 1 161 . 1 1 26 26 ILE HA H 1 4.427 0.02 . 1 . . . . . . . . . 5028 1 162 . 1 1 26 26 ILE HB H 1 1.928 0.02 . 1 . . . . . . . . . 5028 1 163 . 1 1 26 26 ILE HG12 H 1 1.071 0.02 . 1 . . . . . . . . . 5028 1 164 . 1 1 26 26 ILE HG13 H 1 1.071 0.02 . 1 . . . . . . . . . 5028 1 165 . 1 1 26 26 ILE HG21 H 1 0.853 0.02 . 1 . . . . . . . . . 5028 1 166 . 1 1 26 26 ILE HG22 H 1 0.853 0.02 . 1 . . . . . . . . . 5028 1 167 . 1 1 26 26 ILE HG23 H 1 0.853 0.02 . 1 . . . . . . . . . 5028 1 168 . 1 1 26 26 ILE HD11 H 1 0.973 0.02 . 1 . . . . . . . . . 5028 1 169 . 1 1 26 26 ILE HD12 H 1 0.973 0.02 . 1 . . . . . . . . . 5028 1 170 . 1 1 26 26 ILE HD13 H 1 0.973 0.02 . 1 . . . . . . . . . 5028 1 171 . 1 1 27 27 CYS H H 1 8.951 0.02 . 1 . . . . . . . . . 5028 1 172 . 1 1 27 27 CYS HA H 1 4.963 0.02 . 1 . . . . . . . . . 5028 1 173 . 1 1 27 27 CYS HB2 H 1 2.811 0.02 . 1 . . . . . . . . . 5028 1 174 . 1 1 27 27 CYS HB3 H 1 2.471 0.02 . 1 . . . . . . . . . 5028 1 175 . 1 1 28 28 ARG H H 1 8.086 0.02 . 1 . . . . . . . . . 5028 1 176 . 1 1 28 28 ARG HA H 1 4.325 0.02 . 1 . . . . . . . . . 5028 1 177 . 1 1 28 28 ARG HB2 H 1 2.507 0.02 . 2 . . . . . . . . . 5028 1 178 . 1 1 28 28 ARG HB3 H 1 2.067 0.02 . 2 . . . . . . . . . 5028 1 179 . 1 1 28 28 ARG HG2 H 1 1.751 0.02 . 2 . . . . . . . . . 5028 1 180 . 1 1 28 28 ARG HG3 H 1 1.606 0.02 . 2 . . . . . . . . . 5028 1 181 . 1 1 28 28 ARG HD2 H 1 3.254 0.02 . 1 . . . . . . . . . 5028 1 182 . 1 1 28 28 ARG HD3 H 1 3.254 0.02 . 1 . . . . . . . . . 5028 1 183 . 1 1 28 28 ARG HE H 1 6.99 0.02 . 2 . . . . . . . . . 5028 1 184 . 1 1 29 29 GLY H H 1 8.942 0.02 . 1 . . . . . . . . . 5028 1 185 . 1 1 29 29 GLY HA2 H 1 3.933 0.02 . 1 . . . . . . . . . 5028 1 186 . 1 1 29 29 GLY HA3 H 1 3.933 0.02 . 1 . . . . . . . . . 5028 1 187 . 1 1 30 30 ASN H H 1 7.822 0.02 . 1 . . . . . . . . . 5028 1 188 . 1 1 30 30 ASN HA H 1 4.706 0.02 . 1 . . . . . . . . . 5028 1 189 . 1 1 30 30 ASN HB2 H 1 3.331 0.02 . 1 . . . . . . . . . 5028 1 190 . 1 1 30 30 ASN HB3 H 1 2.867 0.02 . 1 . . . . . . . . . 5028 1 191 . 1 1 30 30 ASN HD21 H 1 7.59 0.02 . 2 . . . . . . . . . 5028 1 192 . 1 1 30 30 ASN HD22 H 1 6.634 0.02 . 2 . . . . . . . . . 5028 1 193 . 1 1 31 31 GLY H H 1 8.439 0.02 . 1 . . . . . . . . . 5028 1 194 . 1 1 31 31 GLY HA2 H 1 3.999 0.02 . 2 . . . . . . . . . 5028 1 195 . 1 1 31 31 GLY HA3 H 1 3.686 0.02 . 2 . . . . . . . . . 5028 1 196 . 1 1 32 32 TYR H H 1 7.302 0.02 . 1 . . . . . . . . . 5028 1 197 . 1 1 32 32 TYR HA H 1 5.267 0.02 . 1 . . . . . . . . . 5028 1 198 . 1 1 32 32 TYR HB2 H 1 3.073 0.02 . 1 . . . . . . . . . 5028 1 199 . 1 1 32 32 TYR HB3 H 1 2.652 0.02 . 1 . . . . . . . . . 5028 1 200 . 1 1 32 32 TYR HD1 H 1 6.882 0.02 . 1 . . . . . . . . . 5028 1 201 . 1 1 32 32 TYR HD2 H 1 6.882 0.02 . 1 . . . . . . . . . 5028 1 202 . 1 1 32 32 TYR HE1 H 1 6.707 0.02 . 1 . . . . . . . . . 5028 1 203 . 1 1 32 32 TYR HE2 H 1 6.707 0.02 . 1 . . . . . . . . . 5028 1 204 . 1 1 33 33 CYS H H 1 8.831 0.02 . 1 . . . . . . . . . 5028 1 205 . 1 1 33 33 CYS HA H 1 5.41 0.02 . 1 . . . . . . . . . 5028 1 206 . 1 1 33 33 CYS HB2 H 1 3.057 0.02 . 1 . . . . . . . . . 5028 1 207 . 1 1 33 33 CYS HB3 H 1 2.801 0.02 . 1 . . . . . . . . . 5028 1 208 . 1 1 34 34 GLY H H 1 9.838 0.02 . 1 . . . . . . . . . 5028 1 209 . 1 1 34 34 GLY HA2 H 1 4.522 0.02 . 2 . . . . . . . . . 5028 1 210 . 1 1 34 34 GLY HA3 H 1 3.967 0.02 . 2 . . . . . . . . . 5028 1 stop_ save_