################################### # 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 17876 _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 NOESY . . . 17876 1 2 '2D 1H-1H TOCSY' . . . 17876 1 3 '2D DQF-C' . . . 17876 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 4.095 0.003 . 2 . . . A 1 GLY HA2 . 17876 1 2 . 1 1 1 1 GLY HA3 H 1 4.127 0.003 . 2 . . . A 1 GLY HA3 . 17876 1 3 . 1 1 1 1 GLY H H 1 8.350 0.003 . 1 . . . A 1 GLY H1 . 17876 1 4 . 1 1 2 2 SER H H 1 8.592 0.003 . 1 . . . A 2 SER H . 17876 1 5 . 1 1 2 2 SER HA H 1 4.507 0.003 . 1 . . . A 2 SER HA . 17876 1 6 . 1 1 2 2 SER HB2 H 1 3.843 0.003 . 2 . . . A 2 SER HB2 . 17876 1 7 . 1 1 2 2 SER HB3 H 1 3.843 0.003 . 2 . . . A 2 SER HB3 . 17876 1 8 . 1 1 3 3 GLY H H 1 8.357 0.003 . 1 . . . A 3 GLY H . 17876 1 9 . 1 1 3 3 GLY HA2 H 1 3.766 0.003 . 2 . . . A 3 GLY HA2 . 17876 1 10 . 1 1 3 3 GLY HA3 H 1 3.798 0.003 . 2 . . . A 3 GLY HA3 . 17876 1 11 . 1 1 4 4 CYS H H 1 8.340 0.003 . 1 . . . A 4 CYS H . 17876 1 12 . 1 1 4 4 CYS HA H 1 4.800 0.003 . 1 . . . A 4 CYS HA . 17876 1 13 . 1 1 4 4 CYS HB2 H 1 2.968 0.003 . 2 . . . A 4 CYS HB2 . 17876 1 14 . 1 1 4 4 CYS HB3 H 1 3.055 0.003 . 2 . . . A 4 CYS HB3 . 17876 1 15 . 1 1 5 5 MET H H 1 8.483 0.003 . 1 . . . A 5 MET H . 17876 1 16 . 1 1 5 5 MET HA H 1 4.747 0.003 . 1 . . . A 5 MET HA . 17876 1 17 . 1 1 5 5 MET HB2 H 1 1.981 0.003 . 2 . . . A 5 MET HB2 . 17876 1 18 . 1 1 5 5 MET HB3 H 1 2.281 0.003 . 2 . . . A 5 MET HB3 . 17876 1 19 . 1 1 5 5 MET HG2 H 1 2.575 0.003 . 2 . . . A 5 MET HG2 . 17876 1 20 . 1 1 5 5 MET HG3 H 1 2.748 0.003 . 2 . . . A 5 MET HG3 . 17876 1 21 . 1 1 6 6 PRO HB2 H 1 2.300 0.003 . 2 . . . A 6 PRO HB2 . 17876 1 22 . 1 1 6 6 PRO HB3 H 1 1.904 0.003 . 2 . . . A 6 PRO HB3 . 17876 1 23 . 1 1 6 6 PRO HG2 H 1 2.143 0.003 . 2 . . . A 6 PRO HG2 . 17876 1 24 . 1 1 6 6 PRO HG3 H 1 2.143 0.003 . 2 . . . A 6 PRO HG3 . 17876 1 25 . 1 1 6 6 PRO HD2 H 1 3.840 0.003 . 2 . . . A 6 PRO HD2 . 17876 1 26 . 1 1 6 6 PRO HD3 H 1 3.840 0.003 . 2 . . . A 6 PRO HD3 . 17876 1 27 . 1 1 7 7 GLU H H 1 8.988 0.003 . 1 . . . A 7 GLU H . 17876 1 28 . 1 1 7 7 GLU HA H 1 4.003 0.003 . 1 . . . A 7 GLU HA . 17876 1 29 . 1 1 7 7 GLU HB2 H 1 1.960 0.003 . 2 . . . A 7 GLU HB2 . 17876 1 30 . 1 1 7 7 GLU HB3 H 1 2.045 0.003 . 2 . . . A 7 GLU HB3 . 17876 1 31 . 1 1 7 7 GLU HG2 H 1 2.396 0.003 . 2 . . . A 7 GLU HG2 . 17876 1 32 . 1 1 7 7 GLU HG3 H 1 2.396 0.003 . 2 . . . A 7 GLU HG3 . 17876 1 33 . 1 1 8 8 TYR H H 1 7.176 0.003 . 1 . . . A 8 TYR H . 17876 1 34 . 1 1 8 8 TYR HA H 1 4.190 0.003 . 1 . . . A 8 TYR HA . 17876 1 35 . 1 1 8 8 TYR HB2 H 1 3.061 0.003 . 2 . . . A 8 TYR HB2 . 17876 1 36 . 1 1 8 8 TYR HB3 H 1 3.162 0.003 . 2 . . . A 8 TYR HB3 . 17876 1 37 . 1 1 8 8 TYR HD1 H 1 6.972 0.003 . 3 . . . A 8 TYR HD1 . 17876 1 38 . 1 1 8 8 TYR HD2 H 1 6.972 0.003 . 3 . . . A 8 TYR HD2 . 17876 1 39 . 1 1 8 8 TYR HE1 H 1 6.626 0.003 . 3 . . . A 8 TYR HE1 . 17876 1 40 . 1 1 8 8 TYR HE2 H 1 6.626 0.003 . 3 . . . A 8 TYR HE2 . 17876 1 41 . 1 1 9 9 CYS H H 1 7.900 0.003 . 1 . . . A 9 CYS H . 17876 1 42 . 1 1 9 9 CYS HA H 1 4.156 0.003 . 1 . . . A 9 CYS HA . 17876 1 43 . 1 1 9 9 CYS HB2 H 1 2.764 0.003 . 2 . . . A 9 CYS HB2 . 17876 1 44 . 1 1 9 9 CYS HB3 H 1 2.845 0.003 . 2 . . . A 9 CYS HB3 . 17876 1 45 . 1 1 10 10 ALA H H 1 8.475 0.003 . 1 . . . A 10 ALA H . 17876 1 46 . 1 1 10 10 ALA HA H 1 4.022 0.003 . 1 . . . A 10 ALA HA . 17876 1 47 . 1 1 10 10 ALA HB1 H 1 1.305 0.003 . . . . . A 10 ALA HB1 . 17876 1 48 . 1 1 10 10 ALA HB2 H 1 1.305 0.003 . . . . . A 10 ALA HB2 . 17876 1 49 . 1 1 10 10 ALA HB3 H 1 1.305 0.003 . . . . . A 10 ALA HB3 . 17876 1 50 . 1 1 11 11 GLY H H 1 7.244 0.003 . 1 . . . A 11 GLY H . 17876 1 51 . 1 1 11 11 GLY HA2 H 1 3.734 0.003 . 2 . . . A 11 GLY HA2 . 17876 1 52 . 1 1 11 11 GLY HA3 H 1 3.999 0.003 . 2 . . . A 11 GLY HA3 . 17876 1 53 . 1 1 12 12 GLN H H 1 7.457 0.003 . 1 . . . A 12 GLN H . 17876 1 54 . 1 1 12 12 GLN HA H 1 4.119 0.003 . 1 . . . A 12 GLN HA . 17876 1 55 . 1 1 12 12 GLN HB2 H 1 1.484 0.003 . 2 . . . A 12 GLN HB2 . 17876 1 56 . 1 1 12 12 GLN HB3 H 1 1.484 0.003 . 2 . . . A 12 GLN HB3 . 17876 1 57 . 1 1 12 12 GLN HG2 H 1 1.806 0.003 . 2 . . . A 12 GLN HG2 . 17876 1 58 . 1 1 12 12 GLN HG3 H 1 1.900 0.003 . 2 . . . A 12 GLN HG3 . 17876 1 59 . 1 1 13 13 CYS H H 1 7.630 0.003 . 1 . . . A 13 CYS H . 17876 1 60 . 1 1 13 13 CYS HA H 1 4.952 0.003 . 1 . . . A 13 CYS HA . 17876 1 61 . 1 1 13 13 CYS HB2 H 1 2.468 0.003 . 2 . . . A 13 CYS HB2 . 17876 1 62 . 1 1 13 13 CYS HB3 H 1 3.229 0.003 . 2 . . . A 13 CYS HB3 . 17876 1 63 . 1 1 14 14 ARG H H 1 8.725 0.003 . 1 . . . A 14 ARG H . 17876 1 64 . 1 1 14 14 ARG HA H 1 4.432 0.003 . 1 . . . A 14 ARG HA . 17876 1 65 . 1 1 14 14 ARG HB2 H 1 1.728 0.003 . 2 . . . A 14 ARG HB2 . 17876 1 66 . 1 1 14 14 ARG HB3 H 1 1.728 0.003 . 2 . . . A 14 ARG HB3 . 17876 1 67 . 1 1 14 14 ARG HG2 H 1 1.493 0.003 . 2 . . . A 14 ARG HG2 . 17876 1 68 . 1 1 14 14 ARG HG3 H 1 1.595 0.003 . 2 . . . A 14 ARG HG3 . 17876 1 69 . 1 1 14 14 ARG HD2 H 1 3.096 0.003 . 2 . . . A 14 ARG HD2 . 17876 1 70 . 1 1 14 14 ARG HD3 H 1 3.131 0.003 . 2 . . . A 14 ARG HD3 . 17876 1 71 . 1 1 15 15 GLY H H 1 8.405 0.003 . 1 . . . A 15 GLY H . 17876 1 72 . 1 1 15 15 GLY HA2 H 1 3.665 0.003 . 2 . . . A 15 GLY HA2 . 17876 1 73 . 1 1 15 15 GLY HA3 H 1 4.274 0.003 . 2 . . . A 15 GLY HA3 . 17876 1 74 . 1 1 16 16 LYS H H 1 8.243 0.003 . 1 . . . A 16 LYS H . 17876 1 75 . 1 1 16 16 LYS HA H 1 3.839 0.003 . 1 . . . A 16 LYS HA . 17876 1 76 . 1 1 16 16 LYS HB2 H 1 1.733 0.003 . 2 . . . A 16 LYS HB2 . 17876 1 77 . 1 1 16 16 LYS HB3 H 1 1.800 0.003 . 2 . . . A 16 LYS HB3 . 17876 1 78 . 1 1 16 16 LYS HG2 H 1 1.334 0.003 . 2 . . . A 16 LYS HG2 . 17876 1 79 . 1 1 16 16 LYS HG3 H 1 1.405 0.003 . 2 . . . A 16 LYS HG3 . 17876 1 80 . 1 1 16 16 LYS HD2 H 1 1.589 0.003 . 2 . . . A 16 LYS HD2 . 17876 1 81 . 1 1 16 16 LYS HD3 H 1 1.680 0.003 . 2 . . . A 16 LYS HD3 . 17876 1 82 . 1 1 16 16 LYS HE2 H 1 2.950 0.003 . 2 . . . A 16 LYS HE2 . 17876 1 83 . 1 1 16 16 LYS HE3 H 1 2.950 0.003 . 2 . . . A 16 LYS HE3 . 17876 1 84 . 1 1 17 17 VAL H H 1 7.990 0.003 . 1 . . . A 17 VAL H . 17876 1 85 . 1 1 17 17 VAL HA H 1 3.752 0.003 . 1 . . . A 17 VAL HA . 17876 1 86 . 1 1 17 17 VAL HB H 1 1.910 0.003 . 1 . . . A 17 VAL HB . 17876 1 87 . 1 1 17 17 VAL HG11 H 1 0.873 0.003 . . . . . A 17 VAL HG11 . 17876 1 88 . 1 1 17 17 VAL HG12 H 1 0.873 0.003 . . . . . A 17 VAL HG12 . 17876 1 89 . 1 1 17 17 VAL HG13 H 1 0.873 0.003 . . . . . A 17 VAL HG13 . 17876 1 90 . 1 1 17 17 VAL HG21 H 1 0.993 0.003 . . . . . A 17 VAL HG21 . 17876 1 91 . 1 1 17 17 VAL HG22 H 1 0.993 0.003 . . . . . A 17 VAL HG22 . 17876 1 92 . 1 1 17 17 VAL HG23 H 1 0.993 0.003 . . . . . A 17 VAL HG23 . 17876 1 93 . 1 1 18 18 SER H H 1 8.323 0.003 . 1 . . . A 18 SER H . 17876 1 94 . 1 1 18 18 SER HA H 1 4.183 0.003 . 1 . . . A 18 SER HA . 17876 1 95 . 1 1 18 18 SER HB2 H 1 3.847 0.003 . 2 . . . A 18 SER HB2 . 17876 1 96 . 1 1 18 18 SER HB3 H 1 3.916 0.003 . 2 . . . A 18 SER HB3 . 17876 1 97 . 1 1 19 19 GLN H H 1 8.281 0.003 . 1 . . . A 19 GLN H . 17876 1 98 . 1 1 19 19 GLN HA H 1 3.563 0.003 . 1 . . . A 19 GLN HA . 17876 1 99 . 1 1 19 19 GLN HB2 H 1 1.910 0.003 . 2 . . . A 19 GLN HB2 . 17876 1 100 . 1 1 19 19 GLN HB3 H 1 2.053 0.003 . 2 . . . A 19 GLN HB3 . 17876 1 101 . 1 1 19 19 GLN HG2 H 1 2.217 0.003 . 2 . . . A 19 GLN HG2 . 17876 1 102 . 1 1 19 19 GLN HG3 H 1 2.364 0.003 . 2 . . . A 19 GLN HG3 . 17876 1 103 . 1 1 19 19 GLN HE21 H 1 6.709 0.003 . 2 . . . A 19 GLN HE21 . 17876 1 104 . 1 1 19 19 GLN HE22 H 1 7.295 0.003 . 2 . . . A 19 GLN HE22 . 17876 1 105 . 1 1 20 20 ASP H H 1 8.737 0.003 . 1 . . . A 20 ASP H . 17876 1 106 . 1 1 20 20 ASP HA H 1 4.391 0.003 . 1 . . . A 20 ASP HA . 17876 1 107 . 1 1 20 20 ASP HB2 H 1 2.630 0.003 . 2 . . . A 20 ASP HB2 . 17876 1 108 . 1 1 20 20 ASP HB3 H 1 2.885 0.003 . 2 . . . A 20 ASP HB3 . 17876 1 109 . 1 1 21 21 TYR H H 1 7.999 0.003 . 1 . . . A 21 TYR H . 17876 1 110 . 1 1 21 21 TYR HA H 1 4.161 0.003 . 1 . . . A 21 TYR HA . 17876 1 111 . 1 1 21 21 TYR HB2 H 1 3.144 0.003 . 2 . . . A 21 TYR HB2 . 17876 1 112 . 1 1 21 21 TYR HB3 H 1 3.351 0.003 . 2 . . . A 21 TYR HB3 . 17876 1 113 . 1 1 21 21 TYR HD1 H 1 7.201 0.003 . 3 . . . A 21 TYR HD1 . 17876 1 114 . 1 1 21 21 TYR HD2 H 1 7.201 0.003 . 3 . . . A 21 TYR HD2 . 17876 1 115 . 1 1 21 21 TYR HE1 H 1 6.560 0.003 . 3 . . . A 21 TYR HE1 . 17876 1 116 . 1 1 21 21 TYR HE2 H 1 6.560 0.003 . 3 . . . A 21 TYR HE2 . 17876 1 117 . 1 1 22 22 CYS H H 1 8.545 0.003 . 1 . . . A 22 CYS H . 17876 1 118 . 1 1 22 22 CYS HA H 1 4.430 0.003 . 1 . . . A 22 CYS HA . 17876 1 119 . 1 1 22 22 CYS HB2 H 1 3.238 0.003 . 2 . . . A 22 CYS HB2 . 17876 1 120 . 1 1 22 22 CYS HB3 H 1 3.502 0.003 . 2 . . . A 22 CYS HB3 . 17876 1 121 . 1 1 23 23 LEU H H 1 8.217 0.003 . 1 . . . A 23 LEU H . 17876 1 122 . 1 1 23 23 LEU HA H 1 4.054 0.003 . 1 . . . A 23 LEU HA . 17876 1 123 . 1 1 23 23 LEU HB2 H 1 1.918 0.003 . 2 . . . A 23 LEU HB2 . 17876 1 124 . 1 1 23 23 LEU HB3 H 1 2.030 0.003 . 2 . . . A 23 LEU HB3 . 17876 1 125 . 1 1 23 23 LEU HG H 1 1.495 0.003 . 1 . . . A 23 LEU HG . 17876 1 126 . 1 1 23 23 LEU HD11 H 1 0.762 0.003 . . . . . A 23 LEU HD11 . 17876 1 127 . 1 1 23 23 LEU HD12 H 1 0.762 0.003 . . . . . A 23 LEU HD12 . 17876 1 128 . 1 1 23 23 LEU HD13 H 1 0.762 0.003 . . . . . A 23 LEU HD13 . 17876 1 129 . 1 1 23 23 LEU HD21 H 1 0.931 0.003 . . . . . A 23 LEU HD21 . 17876 1 130 . 1 1 23 23 LEU HD22 H 1 0.931 0.003 . . . . . A 23 LEU HD22 . 17876 1 131 . 1 1 23 23 LEU HD23 H 1 0.931 0.003 . . . . . A 23 LEU HD23 . 17876 1 132 . 1 1 24 24 LYS H H 1 6.849 0.003 . 1 . . . A 24 LYS H . 17876 1 133 . 1 1 24 24 LYS HA H 1 4.318 0.003 . 1 . . . A 24 LYS HA . 17876 1 134 . 1 1 24 24 LYS HB2 H 1 1.651 0.003 . 2 . . . A 24 LYS HB2 . 17876 1 135 . 1 1 24 24 LYS HB3 H 1 1.651 0.003 . 2 . . . A 24 LYS HB3 . 17876 1 136 . 1 1 24 24 LYS HG2 H 1 1.302 0.003 . 2 . . . A 24 LYS HG2 . 17876 1 137 . 1 1 24 24 LYS HG3 H 1 1.408 0.003 . 2 . . . A 24 LYS HG3 . 17876 1 138 . 1 1 24 24 LYS HD2 H 1 1.566 0.003 . 2 . . . A 24 LYS HD2 . 17876 1 139 . 1 1 24 24 LYS HD3 H 1 1.566 0.003 . 2 . . . A 24 LYS HD3 . 17876 1 140 . 1 1 24 24 LYS HE2 H 1 2.902 0.003 . 2 . . . A 24 LYS HE2 . 17876 1 141 . 1 1 24 24 LYS HE3 H 1 2.902 0.003 . 2 . . . A 24 LYS HE3 . 17876 1 142 . 1 1 24 24 LYS HZ1 H 1 5.350 0.003 . 1 . . . A 24 LYS HZ1 . 17876 1 143 . 1 1 24 24 LYS HZ2 H 1 5.350 0.003 . 1 . . . A 24 LYS HZ2 . 17876 1 144 . 1 1 24 24 LYS HZ3 H 1 5.350 0.003 . 1 . . . A 24 LYS HZ3 . 17876 1 145 . 1 1 25 25 ASN H H 1 8.082 0.003 . 1 . . . A 25 ASN H . 17876 1 146 . 1 1 25 25 ASN HA H 1 4.687 0.003 . 1 . . . A 25 ASN HA . 17876 1 147 . 1 1 25 25 ASN HB2 H 1 1.984 0.003 . 2 . . . A 25 ASN HB2 . 17876 1 148 . 1 1 25 25 ASN HB3 H 1 2.434 0.003 . 2 . . . A 25 ASN HB3 . 17876 1 149 . 1 1 26 26 CYS H H 1 9.940 0.003 . 1 . . . A 26 CYS H . 17876 1 150 . 1 1 26 26 CYS HA H 1 4.443 0.003 . 1 . . . A 26 CYS HA . 17876 1 151 . 1 1 26 26 CYS HB2 H 1 3.296 0.003 . 2 . . . A 26 CYS HB2 . 17876 1 152 . 1 1 26 26 CYS HB3 H 1 3.214 0.003 . 2 . . . A 26 CYS HB3 . 17876 1 153 . 1 1 27 27 ARG H H 1 7.238 0.003 . 1 . . . A 27 ARG H . 17876 1 154 . 1 1 27 27 ARG HA H 1 4.669 0.003 . 1 . . . A 27 ARG HA . 17876 1 155 . 1 1 27 27 ARG HB2 H 1 1.719 0.003 . 2 . . . A 27 ARG HB2 . 17876 1 156 . 1 1 27 27 ARG HB3 H 1 2.004 0.003 . 2 . . . A 27 ARG HB3 . 17876 1 157 . 1 1 27 27 ARG HG2 H 1 1.527 0.003 . 2 . . . A 27 ARG HG2 . 17876 1 158 . 1 1 27 27 ARG HG3 H 1 1.527 0.003 . 2 . . . A 27 ARG HG3 . 17876 1 159 . 1 1 27 27 ARG HD2 H 1 3.226 0.003 . 2 . . . A 27 ARG HD2 . 17876 1 160 . 1 1 27 27 ARG HD3 H 1 3.226 0.003 . 2 . . . A 27 ARG HD3 . 17876 1 161 . 1 1 27 27 ARG HE H 1 7.189 0.003 . 1 . . . A 27 ARG HE . 17876 1 162 . 1 1 28 28 CYS H H 1 8.568 0.003 . 1 . . . A 28 CYS H . 17876 1 163 . 1 1 28 28 CYS HA H 1 4.802 0.003 . 1 . . . A 28 CYS HA . 17876 1 164 . 1 1 28 28 CYS HB2 H 1 2.516 0.003 . 2 . . . A 28 CYS HB2 . 17876 1 165 . 1 1 28 28 CYS HB3 H 1 3.226 0.003 . 2 . . . A 28 CYS HB3 . 17876 1 166 . 1 1 29 29 ILE H H 1 7.528 0.003 . 1 . . . A 29 ILE H . 17876 1 167 . 1 1 29 29 ILE HA H 1 3.510 0.003 . 1 . . . A 29 ILE HA . 17876 1 168 . 1 1 29 29 ILE HB H 1 1.346 0.003 . 1 . . . A 29 ILE HB . 17876 1 169 . 1 1 29 29 ILE HG12 H 1 0.863 0.003 . 2 . . . A 29 ILE HG12 . 17876 1 170 . 1 1 29 29 ILE HG13 H 1 0.753 0.003 . 2 . . . A 29 ILE HG13 . 17876 1 171 . 1 1 29 29 ILE HG21 H 1 0.649 0.003 . . . . . A 29 ILE HG21 . 17876 1 172 . 1 1 29 29 ILE HG22 H 1 0.649 0.003 . . . . . A 29 ILE HG22 . 17876 1 173 . 1 1 29 29 ILE HG23 H 1 0.649 0.003 . . . . . A 29 ILE HG23 . 17876 1 174 . 1 1 29 29 ILE HD11 H 1 0.555 0.003 . . . . . A 29 ILE HD11 . 17876 1 175 . 1 1 29 29 ILE HD12 H 1 0.555 0.003 . . . . . A 29 ILE HD12 . 17876 1 176 . 1 1 29 29 ILE HD13 H 1 0.555 0.003 . . . . . A 29 ILE HD13 . 17876 1 177 . 1 1 30 30 ARG H H 1 7.525 0.003 . 1 . . . A 30 ARG H . 17876 1 178 . 1 1 30 30 ARG HA H 1 3.958 0.003 . 1 . . . A 30 ARG HA . 17876 1 179 . 1 1 30 30 ARG HB2 H 1 1.632 0.003 . 2 . . . A 30 ARG HB2 . 17876 1 180 . 1 1 30 30 ARG HB3 H 1 1.728 0.003 . 2 . . . A 30 ARG HB3 . 17876 1 181 . 1 1 30 30 ARG HG2 H 1 1.569 0.003 . 2 . . . A 30 ARG HG2 . 17876 1 182 . 1 1 30 30 ARG HG3 H 1 1.461 0.003 . 2 . . . A 30 ARG HG3 . 17876 1 183 . 1 1 30 30 ARG HD2 H 1 3.084 0.003 . 2 . . . A 30 ARG HD2 . 17876 1 184 . 1 1 30 30 ARG HD3 H 1 3.084 0.003 . 2 . . . A 30 ARG HD3 . 17876 1 185 . 1 1 30 30 ARG HE H 1 7.081 0.003 . 1 . . . A 30 ARG HE . 17876 1 stop_ save_