################################### # 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 36167 _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 $chem_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-15N HSQC' 1 $sample_1 isotropic 36167 1 2 '2D 1H-13C HSQC' 1 $sample_1 isotropic 36167 1 3 '2D 1H-13C HMBC' 1 $sample_1 isotropic 36167 1 4 '2D 1H-1H TOCSY' 1 $sample_1 isotropic 36167 1 5 '2D 1H-1H TOCSY' 1 $sample_1 isotropic 36167 1 6 '2D 1H-1H NOESY' 1 $sample_1 isotropic 36167 1 7 '2D 1H-1H NOESY' 1 $sample_1 isotropic 36167 1 8 '2D DQF-COSY' 1 $sample_1 isotropic 36167 1 9 '1D 1H' 1 $sample_1 isotropic 36167 1 10 '1D 13C' 1 $sample_1 isotropic 36167 1 11 DEPT135 1 $sample_1 isotropic 36167 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 ASP H H 1 8.59 . . 1 . . . . A 1 ASP H1 . 36167 1 2 . 1 1 1 1 ASP HA H 1 4.21 . . 1 . . . . A 1 ASP HA . 36167 1 3 . 1 1 1 1 ASP HB2 H 1 2.89 . . 2 . . . . A 1 ASP HB2 . 36167 1 4 . 1 1 1 1 ASP HB3 H 1 2.41 . . 2 . . . . A 1 ASP HB3 . 36167 1 5 . 1 1 2 2 GLY H H 1 8.61 . . 1 . . . . A 2 GLY H . 36167 1 6 . 1 1 2 2 GLY HA2 H 1 3.81 . . 2 . . . . A 2 GLY HA2 . 36167 1 7 . 1 1 2 2 GLY HA3 H 1 3.73 . . 2 . . . . A 2 GLY HA3 . 36167 1 8 . 1 1 2 2 GLY CA C 13 44.1 . . 1 . . . . A 2 GLY CA . 36167 1 9 . 1 1 3 3 MET H H 1 9.24 . . 1 . . . . A 3 MET H . 36167 1 10 . 1 1 3 3 MET HA H 1 4.35 . . 1 . . . . A 3 MET HA . 36167 1 11 . 1 1 3 3 MET HB2 H 1 2.03 . . 2 . . . . A 3 MET HB2 . 36167 1 12 . 1 1 3 3 MET HB3 H 1 1.97 . . 2 . . . . A 3 MET HB3 . 36167 1 13 . 1 1 3 3 MET HG2 H 1 2.57 . . 2 . . . . A 3 MET HG2 . 36167 1 14 . 1 1 3 3 MET HG3 H 1 2.27 . . 2 . . . . A 3 MET HG3 . 36167 1 15 . 1 1 3 3 MET CA C 13 52.5 . . 1 . . . . A 3 MET CA . 36167 1 16 . 1 1 3 3 MET CB C 13 31.3 . . 1 . . . . A 3 MET CB . 36167 1 17 . 1 1 3 3 MET CG C 13 29.5 . . 1 . . . . A 3 MET CG . 36167 1 18 . 1 1 4 4 GLY H H 1 6.86 . . 1 . . . . A 4 GLY H . 36167 1 19 . 1 1 4 4 GLY HA2 H 1 3.82 . . 2 . . . . A 4 GLY HA2 . 36167 1 20 . 1 1 4 4 GLY HA3 H 1 3.73 . . 2 . . . . A 4 GLY HA3 . 36167 1 21 . 1 1 4 4 GLY CA C 13 42.1 . . 1 . . . . A 4 GLY CA . 36167 1 22 . 1 1 5 5 GLU H H 1 8.61 . . 1 . . . . A 5 GLU H . 36167 1 23 . 1 1 5 5 GLU HA H 1 4.42 . . 1 . . . . A 5 GLU HA . 36167 1 24 . 1 1 5 5 GLU HB2 H 1 1.96 . . 2 . . . . A 5 GLU HB2 . 36167 1 25 . 1 1 5 5 GLU HB3 H 1 1.64 . . 2 . . . . A 5 GLU HB3 . 36167 1 26 . 1 1 5 5 GLU HG2 H 1 2.18 . . 2 . . . . A 5 GLU HG2 . 36167 1 27 . 1 1 5 5 GLU HG3 H 1 2.05 . . 2 . . . . A 5 GLU HG3 . 36167 1 28 . 1 1 5 5 GLU CA C 13 51.4 . . 1 . . . . A 5 GLU CA . 36167 1 29 . 1 1 5 5 GLU CB C 13 26.3 . . 1 . . . . A 5 GLU CB . 36167 1 30 . 1 1 5 5 GLU CG C 13 30.0 . . 1 . . . . A 5 GLU CG . 36167 1 31 . 1 1 6 6 GLU H H 1 7.40 . . 1 . . . . A 6 GLU H . 36167 1 32 . 1 1 6 6 GLU HA H 1 3.93 . . 1 . . . . A 6 GLU HA . 36167 1 33 . 1 1 6 6 GLU HB2 H 1 1.86 . . 2 . . . . A 6 GLU HB2 . 36167 1 34 . 1 1 6 6 GLU HB3 H 1 1.41 . . 2 . . . . A 6 GLU HB3 . 36167 1 35 . 1 1 6 6 GLU HG2 H 1 2.06 . . 2 . . . . A 6 GLU HG2 . 36167 1 36 . 1 1 6 6 GLU HG3 H 1 1.92 . . 2 . . . . A 6 GLU HG3 . 36167 1 37 . 1 1 7 7 PHE H H 1 8.03 . . 1 . . . . A 7 PHE H . 36167 1 38 . 1 1 7 7 PHE HA H 1 4.63 . . 1 . . . . A 7 PHE HA . 36167 1 39 . 1 1 7 7 PHE HB2 H 1 3.29 . . 2 . . . . A 7 PHE HB2 . 36167 1 40 . 1 1 7 7 PHE HB3 H 1 2.16 . . 2 . . . . A 7 PHE HB3 . 36167 1 41 . 1 1 7 7 PHE HD1 H 1 7.07 . . 3 . . . . A 7 PHE HD1 . 36167 1 42 . 1 1 7 7 PHE HD2 H 1 7.07 . . 3 . . . . A 7 PHE HD2 . 36167 1 43 . 1 1 7 7 PHE HE1 H 1 7.20 . . 3 . . . . A 7 PHE HE1 . 36167 1 44 . 1 1 7 7 PHE HE2 H 1 7.20 . . 3 . . . . A 7 PHE HE2 . 36167 1 45 . 1 1 7 7 PHE HZ H 1 7.13 . . 1 . . . . A 7 PHE HZ . 36167 1 46 . 1 1 7 7 PHE CA C 13 51.9 . . 1 . . . . A 7 PHE CA . 36167 1 47 . 1 1 7 7 PHE CD1 C 13 130.3 . . 3 . . . . A 7 PHE CD1 . 36167 1 48 . 1 1 7 7 PHE CD2 C 13 130.3 . . 3 . . . . A 7 PHE CD2 . 36167 1 49 . 1 1 7 7 PHE CE1 C 13 127.9 . . 3 . . . . A 7 PHE CE1 . 36167 1 50 . 1 1 7 7 PHE CE2 C 13 127.9 . . 3 . . . . A 7 PHE CE2 . 36167 1 51 . 1 1 7 7 PHE CZ C 13 126.1 . . 1 . . . . A 7 PHE CZ . 36167 1 52 . 1 1 8 8 ILE H H 1 8.54 . . 1 . . . . A 8 ILE H . 36167 1 53 . 1 1 8 8 ILE HA H 1 4.52 . . 1 . . . . A 8 ILE HA . 36167 1 54 . 1 1 8 8 ILE HB H 1 1.70 . . 1 . . . . A 8 ILE HB . 36167 1 55 . 1 1 8 8 ILE HG12 H 1 1.41 . . 2 . . . . A 8 ILE HG12 . 36167 1 56 . 1 1 8 8 ILE HG13 H 1 1.10 . . 2 . . . . A 8 ILE HG13 . 36167 1 57 . 1 1 8 8 ILE HG21 H 1 0.81 . . 1 . . . . A 8 ILE HG21 . 36167 1 58 . 1 1 8 8 ILE HG22 H 1 0.81 . . 1 . . . . A 8 ILE HG22 . 36167 1 59 . 1 1 8 8 ILE HG23 H 1 0.81 . . 1 . . . . A 8 ILE HG23 . 36167 1 60 . 1 1 8 8 ILE HD11 H 1 0.77 . . 1 . . . . A 8 ILE HD11 . 36167 1 61 . 1 1 8 8 ILE HD12 H 1 0.77 . . 1 . . . . A 8 ILE HD12 . 36167 1 62 . 1 1 8 8 ILE HD13 H 1 0.77 . . 1 . . . . A 8 ILE HD13 . 36167 1 63 . 1 1 8 8 ILE CA C 13 58.0 . . 1 . . . . A 8 ILE CA . 36167 1 64 . 1 1 8 8 ILE CB C 13 37.2 . . 1 . . . . A 8 ILE CB . 36167 1 65 . 1 1 8 8 ILE CG1 C 13 24.6 . . 1 . . . . A 8 ILE CG1 . 36167 1 66 . 1 1 8 8 ILE CG2 C 13 18.2 . . 1 . . . . A 8 ILE CG2 . 36167 1 67 . 1 1 8 8 ILE CD1 C 13 11.0 . . 1 . . . . A 8 ILE CD1 . 36167 1 68 . 1 1 9 9 GLU H H 1 8.53 . . 1 . . . . A 9 GLU H . 36167 1 69 . 1 1 9 9 GLU HA H 1 4.19 . . 1 . . . . A 9 GLU HA . 36167 1 70 . 1 1 9 9 GLU HB2 H 1 1.91 . . 2 . . . . A 9 GLU HB2 . 36167 1 71 . 1 1 9 9 GLU HB3 H 1 1.69 . . 2 . . . . A 9 GLU HB3 . 36167 1 72 . 1 1 9 9 GLU HG2 H 1 2.35 . . 2 . . . . A 9 GLU HG2 . 36167 1 73 . 1 1 9 9 GLU HG3 H 1 2.18 . . 2 . . . . A 9 GLU HG3 . 36167 1 74 . 1 1 10 10 GLY H H 1 7.85 . . 1 . . . . A 10 GLY H . 36167 1 75 . 1 1 10 10 GLY HA2 H 1 3.91 . . 1 . . . . A 10 GLY HA2 . 36167 1 76 . 1 1 10 10 GLY HA3 H 1 3.91 . . 1 . . . . A 10 GLY HA3 . 36167 1 77 . 1 1 10 10 GLY CA C 13 43.1 . . 1 . . . . A 10 GLY CA . 36167 1 78 . 1 1 11 11 LEU H H 1 8.38 . . 1 . . . . A 11 LEU H . 36167 1 79 . 1 1 11 11 LEU HA H 1 3.95 . . 1 . . . . A 11 LEU HA . 36167 1 80 . 1 1 11 11 LEU HB2 H 1 1.52 . . 2 . . . . A 11 LEU HB2 . 36167 1 81 . 1 1 11 11 LEU HB3 H 1 1.53 . . 2 . . . . A 11 LEU HB3 . 36167 1 82 . 1 1 11 11 LEU HG H 1 1.64 . . 1 . . . . A 11 LEU HG . 36167 1 83 . 1 1 11 11 LEU HD11 H 1 0.89 . . 2 . . . . A 11 LEU HD11 . 36167 1 84 . 1 1 11 11 LEU HD12 H 1 0.89 . . 2 . . . . A 11 LEU HD12 . 36167 1 85 . 1 1 11 11 LEU HD13 H 1 0.89 . . 2 . . . . A 11 LEU HD13 . 36167 1 86 . 1 1 11 11 LEU HD21 H 1 0.83 . . 2 . . . . A 11 LEU HD21 . 36167 1 87 . 1 1 11 11 LEU HD22 H 1 0.83 . . 2 . . . . A 11 LEU HD22 . 36167 1 88 . 1 1 11 11 LEU HD23 H 1 0.83 . . 2 . . . . A 11 LEU HD23 . 36167 1 89 . 1 1 11 11 LEU CA C 13 54.1 . . 1 . . . . A 11 LEU CA . 36167 1 90 . 1 1 11 11 LEU CB C 13 40.4 . . 1 . . . . A 11 LEU CB . 36167 1 91 . 1 1 11 11 LEU CG C 13 26.3 . . 1 . . . . A 11 LEU CG . 36167 1 92 . 1 1 11 11 LEU CD1 C 13 23.1 . . 2 . . . . A 11 LEU CD1 . 36167 1 93 . 1 1 11 11 LEU CD2 C 13 21.5 . . 2 . . . . A 11 LEU CD2 . 36167 1 94 . 1 1 12 12 VAL H H 1 7.78 . . 1 . . . . A 12 VAL H . 36167 1 95 . 1 1 12 12 VAL HA H 1 4.19 . . 1 . . . . A 12 VAL HA . 36167 1 96 . 1 1 12 12 VAL HB H 1 2.21 . . 1 . . . . A 12 VAL HB . 36167 1 97 . 1 1 12 12 VAL HG11 H 1 0.81 . . 1 . . . . A 12 VAL HG11 . 36167 1 98 . 1 1 12 12 VAL HG12 H 1 0.81 . . 1 . . . . A 12 VAL HG12 . 36167 1 99 . 1 1 12 12 VAL HG13 H 1 0.81 . . 1 . . . . A 12 VAL HG13 . 36167 1 100 . 1 1 12 12 VAL HG21 H 1 0.81 . . 1 . . . . A 12 VAL HG21 . 36167 1 101 . 1 1 12 12 VAL HG22 H 1 0.81 . . 1 . . . . A 12 VAL HG22 . 36167 1 102 . 1 1 12 12 VAL HG23 H 1 0.81 . . 1 . . . . A 12 VAL HG23 . 36167 1 103 . 1 1 12 12 VAL CA C 13 58.1 . . 1 . . . . A 12 VAL CA . 36167 1 104 . 1 1 12 12 VAL CB C 13 30.1 . . 1 . . . . A 12 VAL CB . 36167 1 105 . 1 1 12 12 VAL CG1 C 13 20.6 . . 2 . . . . A 12 VAL CG1 . 36167 1 106 . 1 1 12 12 VAL CG2 C 13 19.8 . . 2 . . . . A 12 VAL CG2 . 36167 1 107 . 1 1 13 13 ARG H H 1 7.20 . . 1 . . . . A 13 ARG H . 36167 1 108 . 1 1 13 13 ARG HA H 1 4.62 . . 1 . . . . A 13 ARG HA . 36167 1 109 . 1 1 13 13 ARG HB2 H 1 1.70 . . 1 . . . . A 13 ARG HB2 . 36167 1 110 . 1 1 13 13 ARG HB3 H 1 1.70 . . 1 . . . . A 13 ARG HB3 . 36167 1 111 . 1 1 13 13 ARG HG2 H 1 1.54 . . 1 . . . . A 13 ARG HG2 . 36167 1 112 . 1 1 13 13 ARG HG3 H 1 1.54 . . 1 . . . . A 13 ARG HG3 . 36167 1 113 . 1 1 13 13 ARG HD2 H 1 3.00 . . 1 . . . . A 13 ARG HD2 . 36167 1 114 . 1 1 13 13 ARG HD3 H 1 3.00 . . 1 . . . . A 13 ARG HD3 . 36167 1 115 . 1 1 13 13 ARG HE H 1 7.26 . . 1 . . . . A 13 ARG HE . 36167 1 116 . 1 1 14 14 ASP H H 1 8.83 . . 1 . . . . A 14 ASP H . 36167 1 117 . 1 1 14 14 ASP HA H 1 5.03 . . 1 . . . . A 14 ASP HA . 36167 1 118 . 1 1 14 14 ASP HB2 H 1 2.77 . . 1 . . . . A 14 ASP HB2 . 36167 1 119 . 1 1 14 14 ASP HB3 H 1 2.77 . . 1 . . . . A 14 ASP HB3 . 36167 1 120 . 1 1 14 14 ASP CA C 13 50.0 . . 1 . . . . A 14 ASP CA . 36167 1 121 . 1 1 14 14 ASP CB C 13 36.6 . . 1 . . . . A 14 ASP CB . 36167 1 122 . 1 1 15 15 SER H H 1 8.25 . . 1 . . . . A 15 SER H . 36167 1 123 . 1 1 15 15 SER HA H 1 4.89 . . 1 . . . . A 15 SER HA . 36167 1 124 . 1 1 15 15 SER HB2 H 1 3.63 . . 2 . . . . A 15 SER HB2 . 36167 1 125 . 1 1 15 15 SER HB3 H 1 3.24 . . 2 . . . . A 15 SER HB3 . 36167 1 126 . 1 1 15 15 SER CA C 13 53.4 . . 1 . . . . A 15 SER CA . 36167 1 127 . 1 1 15 15 SER CB C 13 65.2 . . 1 . . . . A 15 SER CB . 36167 1 128 . 1 1 16 16 LEU HA H 1 4.08 . . 1 . . . . A 16 LEU HA . 36167 1 129 . 1 1 16 16 LEU HB2 H 1 1.95 . . 1 . . . . A 16 LEU HB2 . 36167 1 130 . 1 1 16 16 LEU HB3 H 1 1.95 . . 1 . . . . A 16 LEU HB3 . 36167 1 131 . 1 1 16 16 LEU HG H 1 0.80 . . 1 . . . . A 16 LEU HG . 36167 1 132 . 1 1 16 16 LEU HD11 H 1 0.67 . . 2 . . . . A 16 LEU HD11 . 36167 1 133 . 1 1 16 16 LEU HD12 H 1 0.67 . . 2 . . . . A 16 LEU HD12 . 36167 1 134 . 1 1 16 16 LEU HD13 H 1 0.67 . . 2 . . . . A 16 LEU HD13 . 36167 1 135 . 1 1 16 16 LEU HD21 H 1 0.93 . . 2 . . . . A 16 LEU HD21 . 36167 1 136 . 1 1 16 16 LEU HD22 H 1 0.93 . . 2 . . . . A 16 LEU HD22 . 36167 1 137 . 1 1 16 16 LEU HD23 H 1 0.93 . . 2 . . . . A 16 LEU HD23 . 36167 1 138 . 1 1 16 16 LEU CA C 13 54.3 . . 1 . . . . A 16 LEU CA . 36167 1 139 . 1 1 16 16 LEU CD1 C 13 23.7 . . 2 . . . . A 16 LEU CD1 . 36167 1 140 . 1 1 17 17 TYR H H 1 9.15 . . 1 . . . . A 17 TYR H . 36167 1 141 . 1 1 17 17 TYR HA H 1 4.51 . . 1 . . . . A 17 TYR HA . 36167 1 142 . 1 1 17 17 TYR HB2 H 1 2.76 . . 2 . . . . A 17 TYR HB2 . 36167 1 143 . 1 1 17 17 TYR HB3 H 1 2.62 . . 2 . . . . A 17 TYR HB3 . 36167 1 144 . 1 1 17 17 TYR HD1 H 1 7.12 . . 3 . . . . A 17 TYR HD1 . 36167 1 145 . 1 1 17 17 TYR HD2 H 1 7.12 . . 3 . . . . A 17 TYR HD2 . 36167 1 146 . 1 1 17 17 TYR HE1 H 1 6.58 . . 3 . . . . A 17 TYR HE1 . 36167 1 147 . 1 1 17 17 TYR HE2 H 1 6.58 . . 3 . . . . A 17 TYR HE2 . 36167 1 148 . 1 1 17 17 TYR HH H 1 9.15 . . 1 . . . . A 17 TYR HH . 36167 1 149 . 1 1 17 17 TYR CA C 13 52.6 . . 1 . . . . A 17 TYR CA . 36167 1 150 . 1 1 17 17 TYR CB C 13 34.3 . . 1 . . . . A 17 TYR CB . 36167 1 151 . 1 1 17 17 TYR CD1 C 13 130.2 . . 3 . . . . A 17 TYR CD1 . 36167 1 152 . 1 1 17 17 TYR CD2 C 13 130.2 . . 3 . . . . A 17 TYR CD2 . 36167 1 153 . 1 1 17 17 TYR CE1 C 13 114.8 . . 3 . . . . A 17 TYR CE1 . 36167 1 154 . 1 1 17 17 TYR CE2 C 13 114.8 . . 3 . . . . A 17 TYR CE2 . 36167 1 155 . 1 1 18 18 PRO HD2 H 1 3.50 . . 1 . . . . A 18 PRO HD2 . 36167 1 156 . 1 1 18 18 PRO HD3 H 1 3.50 . . 1 . . . . A 18 PRO HD3 . 36167 1 157 . 1 1 19 19 PRO HA H 1 4.26 . . 1 . . . . A 19 PRO HA . 36167 1 158 . 1 1 19 19 PRO HB2 H 1 1.98 . . 2 . . . . A 19 PRO HB2 . 36167 1 159 . 1 1 19 19 PRO HB3 H 1 1.84 . . 2 . . . . A 19 PRO HB3 . 36167 1 160 . 1 1 19 19 PRO HG2 H 1 2.12 . . 2 . . . . A 19 PRO HG2 . 36167 1 161 . 1 1 19 19 PRO HG3 H 1 1.94 . . 2 . . . . A 19 PRO HG3 . 36167 1 162 . 1 1 19 19 PRO HD2 H 1 3.21 . . 1 . . . . A 19 PRO HD2 . 36167 1 163 . 1 1 19 19 PRO HD3 H 1 3.21 . . 1 . . . . A 19 PRO HD3 . 36167 1 164 . 1 1 19 19 PRO CA C 13 59.4 . . 1 . . . . A 19 PRO CA . 36167 1 165 . 1 1 19 19 PRO CB C 13 29.2 . . 1 . . . . A 19 PRO CB . 36167 1 166 . 1 1 19 19 PRO CG C 13 24.8 . . 1 . . . . A 19 PRO CG . 36167 1 167 . 1 1 19 19 PRO CD C 13 47.1 . . 1 . . . . A 19 PRO CD . 36167 1 168 . 1 1 20 20 ALA H H 1 7.85 . . 1 . . . . A 20 ALA H . 36167 1 169 . 1 1 20 20 ALA HA H 1 4.16 . . 1 . . . . A 20 ALA HA . 36167 1 170 . 1 1 20 20 ALA HB1 H 1 1.15 . . 1 . . . . A 20 ALA HB1 . 36167 1 171 . 1 1 20 20 ALA HB2 H 1 1.15 . . 1 . . . . A 20 ALA HB2 . 36167 1 172 . 1 1 20 20 ALA HB3 H 1 1.15 . . 1 . . . . A 20 ALA HB3 . 36167 1 173 . 1 1 20 20 ALA C C 13 172.6 . . 1 . . . . A 20 ALA C . 36167 1 174 . 1 1 20 20 ALA CA C 13 48.0 . . 1 . . . . A 20 ALA CA . 36167 1 175 . 1 1 20 20 ALA CB C 13 18.1 . . 1 . . . . A 20 ALA CB . 36167 1 176 . 1 1 21 21 GLY H H 1 8.00 . . 1 . . . . A 21 GLY H . 36167 1 177 . 1 1 21 21 GLY HA2 H 1 3.72 . . 2 . . . . A 21 GLY HA2 . 36167 1 178 . 1 1 21 21 GLY HA3 H 1 3.68 . . 2 . . . . A 21 GLY HA3 . 36167 1 179 . 1 1 21 21 GLY CA C 13 40.6 . . 1 . . . . A 21 GLY CA . 36167 1 stop_ save_