################################### # 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 34339 _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 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 TOCSY' . . . 34339 1 2 '2D TOCSY' . . . 34339 1 3 '2D NOESY' . . . 34339 1 4 '2D 1H-15N HSQC' . . . 34339 1 5 '2D 1H-13C HSQC aliphatic' . . . 34339 1 6 '2D 1H-13C HSQC aromatic' . . . 34339 1 7 '2D NOESY' . . . 34339 1 8 '2D DQF-COSY' . . . 34339 1 9 '2D ROESY' . . . 34339 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 ARG HA H 1 3.85 0.02 . 1 . . . . A 1 ARG HA . 34339 1 2 . 1 1 1 1 ARG HB2 H 1 1.90 0.02 . 2 . . . . A 1 ARG HB2 . 34339 1 3 . 1 1 1 1 ARG HB3 H 1 1.90 0.02 . 2 . . . . A 1 ARG HB3 . 34339 1 4 . 1 1 1 1 ARG HG2 H 1 1.59 0.02 . 2 . . . . A 1 ARG HG2 . 34339 1 5 . 1 1 1 1 ARG HG3 H 1 1.59 0.02 . 2 . . . . A 1 ARG HG3 . 34339 1 6 . 1 1 2 2 ASP H H 1 9.09 0.02 . 1 . . . . A 2 ASP H . 34339 1 7 . 1 1 2 2 ASP HA H 1 5.07 0.02 . 1 . . . . A 2 ASP HA . 34339 1 8 . 1 1 2 2 ASP HB2 H 1 2.99 0.02 . 1 . . . . A 2 ASP HB2 . 34339 1 9 . 1 1 2 2 ASP HB3 H 1 2.88 0.02 . 1 . . . . A 2 ASP HB3 . 34339 1 10 . 1 1 3 3 PRO HA H 1 4.02 0.02 . 1 . . . . A 3 PRO HA . 34339 1 11 . 1 1 3 3 PRO HB2 H 1 2.05 0.02 . 1 . . . . A 3 PRO HB2 . 34339 1 12 . 1 1 3 3 PRO HG2 H 1 1.92 0.02 . 2 . . . . A 3 PRO HG2 . 34339 1 13 . 1 1 3 3 PRO HG3 H 1 1.92 0.02 . 2 . . . . A 3 PRO HG3 . 34339 1 14 . 1 1 3 3 PRO HD2 H 1 3.57 0.02 . 1 . . . . A 3 PRO HD2 . 34339 1 15 . 1 1 3 3 PRO HD3 H 1 3.51 0.02 . 1 . . . . A 3 PRO HD3 . 34339 1 16 . 1 1 4 4 LEU H H 1 8.36 0.02 . 1 . . . . A 4 LEU H . 34339 1 17 . 1 1 4 4 LEU HA H 1 4.12 0.02 . 1 . . . . A 4 LEU HA . 34339 1 18 . 1 1 4 4 LEU HB2 H 1 1.73 0.02 . 2 . . . . A 4 LEU HB2 . 34339 1 19 . 1 1 4 4 LEU HB3 H 1 1.73 0.02 . 2 . . . . A 4 LEU HB3 . 34339 1 20 . 1 1 4 4 LEU HG H 1 1.63 0.02 . 1 . . . . A 4 LEU HG . 34339 1 21 . 1 1 4 4 LEU HD11 H 1 0.93 0.02 . 2 . . . . A 4 LEU HD11 . 34339 1 22 . 1 1 4 4 LEU HD12 H 1 0.93 0.02 . 2 . . . . A 4 LEU HD12 . 34339 1 23 . 1 1 4 4 LEU HD13 H 1 0.93 0.02 . 2 . . . . A 4 LEU HD13 . 34339 1 24 . 1 1 4 4 LEU HD21 H 1 0.86 0.02 . 2 . . . . A 4 LEU HD21 . 34339 1 25 . 1 1 4 4 LEU HD22 H 1 0.86 0.02 . 2 . . . . A 4 LEU HD22 . 34339 1 26 . 1 1 4 4 LEU HD23 H 1 0.86 0.02 . 2 . . . . A 4 LEU HD23 . 34339 1 27 . 1 1 5 5 LEU H H 1 7.68 0.02 . 1 . . . . A 5 LEU H . 34339 1 28 . 1 1 5 5 LEU HA H 1 3.96 0.02 . 1 . . . . A 5 LEU HA . 34339 1 29 . 1 1 5 5 LEU HB2 H 1 1.68 0.02 . 2 . . . . A 5 LEU HB2 . 34339 1 30 . 1 1 5 5 LEU HB3 H 1 1.68 0.02 . 2 . . . . A 5 LEU HB3 . 34339 1 31 . 1 1 5 5 LEU HG H 1 1.63 0.02 . 1 . . . . A 5 LEU HG . 34339 1 32 . 1 1 5 5 LEU HD11 H 1 0.93 0.02 . 2 . . . . A 5 LEU HD11 . 34339 1 33 . 1 1 5 5 LEU HD12 H 1 0.93 0.02 . 2 . . . . A 5 LEU HD12 . 34339 1 34 . 1 1 5 5 LEU HD13 H 1 0.93 0.02 . 2 . . . . A 5 LEU HD13 . 34339 1 35 . 1 1 5 5 LEU HD21 H 1 0.85 0.02 . 2 . . . . A 5 LEU HD21 . 34339 1 36 . 1 1 5 5 LEU HD22 H 1 0.85 0.02 . 2 . . . . A 5 LEU HD22 . 34339 1 37 . 1 1 5 5 LEU HD23 H 1 0.85 0.02 . 2 . . . . A 5 LEU HD23 . 34339 1 38 . 1 1 6 6 ASP H H 1 8.01 0.02 . 1 . . . . A 6 ASP H . 34339 1 39 . 1 1 6 6 ASP HA H 1 4.34 0.02 . 1 . . . . A 6 ASP HA . 34339 1 40 . 1 1 6 6 ASP HB2 H 1 2.76 0.02 . 2 . . . . A 6 ASP HB2 . 34339 1 41 . 1 1 6 6 ASP HB3 H 1 2.76 0.02 . 2 . . . . A 6 ASP HB3 . 34339 1 42 . 1 1 7 7 ALA H H 1 7.85 0.02 . 1 . . . . A 7 ALA H . 34339 1 43 . 1 1 7 7 ALA HA H 1 4.10 0.02 . 1 . . . . A 7 ALA HA . 34339 1 44 . 1 1 7 7 ALA HB1 H 1 1.51 0.02 . 1 . . . . A 7 ALA HB1 . 34339 1 45 . 1 1 7 7 ALA HB2 H 1 1.51 0.02 . 1 . . . . A 7 ALA HB2 . 34339 1 46 . 1 1 7 7 ALA HB3 H 1 1.51 0.02 . 1 . . . . A 7 ALA HB3 . 34339 1 47 . 1 1 8 8 NLE H H 1 8.08 0.02 . 1 . . . . A 8 NLE H . 34339 1 48 . 1 1 8 8 NLE HA H 1 3.97 0.02 . 1 . . . . A 8 NLE HA . 34339 1 49 . 1 1 8 8 NLE HD2 H 1 1.24 0.02 . 2 . . . . A 8 NLE HD2 . 34339 1 50 . 1 1 8 8 NLE HD3 H 1 1.24 0.02 . 2 . . . . A 8 NLE HD3 . 34339 1 51 . 1 1 8 8 NLE HE1 H 1 0.80 0.02 . 2 . . . . A 8 NLE HE1 . 34339 1 52 . 1 1 8 8 NLE HE2 H 1 0.80 0.02 . 2 . . . . A 8 NLE HE2 . 34339 1 53 . 1 1 8 8 NLE HE3 H 1 0.80 0.02 . 2 . . . . A 8 NLE HE3 . 34339 1 54 . 1 1 9 9 ARG H H 1 8.08 0.02 . 1 . . . . A 9 ARG H . 34339 1 55 . 1 1 9 9 ARG HA H 1 3.98 0.02 . 1 . . . . A 9 ARG HA . 34339 1 56 . 1 1 9 9 ARG HB2 H 1 1.98 0.02 . 1 . . . . A 9 ARG HB2 . 34339 1 57 . 1 1 9 9 ARG HB3 H 1 1.89 0.02 . 1 . . . . A 9 ARG HB3 . 34339 1 58 . 1 1 9 9 ARG HG2 H 1 1.76 0.02 . 1 . . . . A 9 ARG HG2 . 34339 1 59 . 1 1 9 9 ARG HG3 H 1 1.59 0.02 . 1 . . . . A 9 ARG HG3 . 34339 1 60 . 1 1 9 9 ARG HD2 H 1 3.15 0.02 . 2 . . . . A 9 ARG HD2 . 34339 1 61 . 1 1 9 9 ARG HD3 H 1 3.15 0.02 . 2 . . . . A 9 ARG HD3 . 34339 1 62 . 1 1 9 9 ARG HE H 1 7.50 0.02 . 1 . . . . A 9 ARG HE . 34339 1 63 . 1 1 10 10 ARG H H 1 7.89 0.02 . 1 . . . . A 10 ARG H . 34339 1 64 . 1 1 10 10 ARG HA H 1 4.12 0.02 . 1 . . . . A 10 ARG HA . 34339 1 65 . 1 1 10 10 ARG HB2 H 1 1.92 0.02 . 2 . . . . A 10 ARG HB2 . 34339 1 66 . 1 1 10 10 ARG HB3 H 1 1.92 0.02 . 2 . . . . A 10 ARG HB3 . 34339 1 67 . 1 1 10 10 ARG HG2 H 1 1.76 0.02 . 1 . . . . A 10 ARG HG2 . 34339 1 68 . 1 1 10 10 ARG HG3 H 1 1.60 0.02 . 1 . . . . A 10 ARG HG3 . 34339 1 69 . 1 1 10 10 ARG HD2 H 1 3.19 0.02 . 2 . . . . A 10 ARG HD2 . 34339 1 70 . 1 1 10 10 ARG HD3 H 1 3.19 0.02 . 2 . . . . A 10 ARG HD3 . 34339 1 71 . 1 1 10 10 ARG HE H 1 7.35 0.02 . 1 . . . . A 10 ARG HE . 34339 1 72 . 1 1 11 11 GLU H H 1 8.02 0.02 . 1 . . . . A 11 GLU H . 34339 1 73 . 1 1 11 11 GLU HA H 1 4.26 0.02 . 1 . . . . A 11 GLU HA . 34339 1 74 . 1 1 11 11 GLU HB2 H 1 2.17 0.02 . 2 . . . . A 11 GLU HB2 . 34339 1 75 . 1 1 11 11 GLU HB3 H 1 2.17 0.02 . 2 . . . . A 11 GLU HB3 . 34339 1 76 . 1 1 11 11 GLU HG2 H 1 2.50 0.02 . 1 . . . . A 11 GLU HG2 . 34339 1 77 . 1 1 11 11 GLU HG3 H 1 2.42 0.02 . 1 . . . . A 11 GLU HG3 . 34339 1 78 . 1 1 12 12 GLY H H 1 8.15 0.02 . 1 . . . . A 12 GLY H . 34339 1 79 . 1 1 12 12 GLY HA2 H 1 3.88 0.02 . 2 . . . . A 12 GLY HA2 . 34339 1 80 . 1 1 12 12 GLY HA3 H 1 3.88 0.02 . 2 . . . . A 12 GLY HA3 . 34339 1 81 . 1 1 13 13 ALA H H 1 7.96 0.02 . 1 . . . . A 13 ALA H . 34339 1 82 . 1 1 13 13 ALA HA H 1 4.12 0.02 . 1 . . . . A 13 ALA HA . 34339 1 83 . 1 1 13 13 ALA HB1 H 1 1.42 0.02 . 1 . . . . A 13 ALA HB1 . 34339 1 84 . 1 1 13 13 ALA HB2 H 1 1.42 0.02 . 1 . . . . A 13 ALA HB2 . 34339 1 85 . 1 1 13 13 ALA HB3 H 1 1.42 0.02 . 1 . . . . A 13 ALA HB3 . 34339 1 86 . 1 1 15 15 ASP H H 1 8.12 0.02 . 1 . . . . A 15 ASP H . 34339 1 87 . 1 1 15 15 ASP HA H 1 4.45 0.02 . 1 . . . . A 15 ASP HA . 34339 1 88 . 1 1 15 15 ASP HB2 H 1 2.76 0.02 . 1 . . . . A 15 ASP HB2 . 34339 1 89 . 1 1 15 15 ASP HB3 H 1 2.71 0.02 . 1 . . . . A 15 ASP HB3 . 34339 1 90 . 1 1 16 16 PHE H H 1 7.93 0.02 . 1 . . . . A 16 PHE H . 34339 1 91 . 1 1 16 16 PHE HA H 1 4.28 0.02 . 1 . . . . A 16 PHE HA . 34339 1 92 . 1 1 16 16 PHE HB2 H 1 2.99 0.02 . 2 . . . . A 16 PHE HB2 . 34339 1 93 . 1 1 16 16 PHE HB3 H 1 2.99 0.02 . 2 . . . . A 16 PHE HB3 . 34339 1 94 . 1 1 17 17 TRP H H 1 7.83 0.02 . 1 . . . . A 17 TRP H . 34339 1 95 . 1 1 17 17 TRP HA H 1 4.42 0.02 . 1 . . . . A 17 TRP HA . 34339 1 96 . 1 1 17 17 TRP HB2 H 1 3.32 0.02 . 1 . . . . A 17 TRP HB2 . 34339 1 97 . 1 1 17 17 TRP HB3 H 1 3.21 0.02 . 1 . . . . A 17 TRP HB3 . 34339 1 98 . 1 1 17 17 TRP HD1 H 1 7.08 0.02 . 1 . . . . A 17 TRP HD1 . 34339 1 99 . 1 1 17 17 TRP HE3 H 1 7.43 0.02 . 1 . . . . A 17 TRP HE3 . 34339 1 100 . 1 1 17 17 TRP HZ2 H 1 7.23 0.02 . 1 . . . . A 17 TRP HZ2 . 34339 1 101 . 1 1 17 17 TRP HH2 H 1 6.99 0.02 . 1 . . . . A 17 TRP HH2 . 34339 1 102 . 1 1 18 18 SER H H 1 7.96 0.02 . 1 . . . . A 18 SER H . 34339 1 103 . 1 1 18 18 SER HA H 1 4.23 0.02 . 1 . . . . A 18 SER HA . 34339 1 104 . 1 1 18 18 SER HB2 H 1 3.88 0.02 . 1 . . . . A 18 SER HB2 . 34339 1 105 . 1 1 18 18 SER HB3 H 1 3.81 0.02 . 1 . . . . A 18 SER HB3 . 34339 1 106 . 1 1 19 19 ALA H H 1 8.07 0.02 . 1 . . . . A 19 ALA H . 34339 1 107 . 1 1 19 19 ALA HA H 1 4.14 0.02 . 1 . . . . A 19 ALA HA . 34339 1 108 . 1 1 19 19 ALA HB1 H 1 1.39 0.02 . 1 . . . . A 19 ALA HB1 . 34339 1 109 . 1 1 19 19 ALA HB2 H 1 1.39 0.02 . 1 . . . . A 19 ALA HB2 . 34339 1 110 . 1 1 19 19 ALA HB3 H 1 1.39 0.02 . 1 . . . . A 19 ALA HB3 . 34339 1 111 . 1 1 20 20 GLY H H 1 8.15 0.02 . 1 . . . . A 20 GLY H . 34339 1 112 . 1 1 20 20 GLY HA2 H 1 3.75 0.02 . 2 . . . . A 20 GLY HA2 . 34339 1 113 . 1 1 20 20 GLY HA3 H 1 3.75 0.02 . 2 . . . . A 20 GLY HA3 . 34339 1 114 . 1 1 21 21 ABA H H 1 7.84 0.02 . 1 . . . . A 21 ABA H . 34339 1 115 . 1 1 21 21 ABA HA H 1 3.86 0.02 . 1 . . . . A 21 ABA HA . 34339 1 116 . 1 1 21 21 ABA HB2 H 1 1.61 0.02 . 2 . . . . A 21 ABA HB2 . 34339 1 117 . 1 1 21 21 ABA HB3 H 1 1.61 0.02 . 2 . . . . A 21 ABA HB3 . 34339 1 118 . 1 1 21 21 ABA HG1 H 1 0.69 0.02 . 2 . . . . A 21 ABA HG1 . 34339 1 119 . 1 1 21 21 ABA HG2 H 1 0.69 0.02 . 2 . . . . A 21 ABA HG2 . 34339 1 120 . 1 1 21 21 ABA HG3 H 1 0.69 0.02 . 2 . . . . A 21 ABA HG3 . 34339 1 121 . 1 1 22 22 TYR H H 1 7.86 0.02 . 1 . . . . A 22 TYR H . 34339 1 122 . 1 1 22 22 TYR HA H 1 4.32 0.02 . 1 . . . . A 22 TYR HA . 34339 1 123 . 1 1 22 22 TYR HB2 H 1 3.02 0.02 . 1 . . . . A 22 TYR HB2 . 34339 1 124 . 1 1 22 22 TYR HB3 H 1 2.91 0.02 . 1 . . . . A 22 TYR HB3 . 34339 1 125 . 1 1 22 22 TYR HD1 H 1 7.03 0.02 . 3 . . . . A 22 TYR HD1 . 34339 1 126 . 1 1 22 22 TYR HD2 H 1 7.03 0.02 . 3 . . . . A 22 TYR HD2 . 34339 1 127 . 1 1 22 22 TYR HE1 H 1 6.75 0.02 . 3 . . . . A 22 TYR HE1 . 34339 1 128 . 1 1 22 22 TYR HE2 H 1 6.75 0.02 . 3 . . . . A 22 TYR HE2 . 34339 1 129 . 1 1 23 23 ALA H H 1 7.95 0.02 . 1 . . . . A 23 ALA H . 34339 1 130 . 1 1 23 23 ALA HA H 1 4.11 0.02 . 1 . . . . A 23 ALA HA . 34339 1 131 . 1 1 23 23 ALA HB1 H 1 1.36 0.02 . 1 . . . . A 23 ALA HB1 . 34339 1 132 . 1 1 23 23 ALA HB2 H 1 1.36 0.02 . 1 . . . . A 23 ALA HB2 . 34339 1 133 . 1 1 23 23 ALA HB3 H 1 1.36 0.02 . 1 . . . . A 23 ALA HB3 . 34339 1 134 . 1 1 24 24 ARG H H 1 7.83 0.02 . 1 . . . . A 24 ARG H . 34339 1 135 . 1 1 24 24 ARG HA H 1 4.17 0.02 . 1 . . . . A 24 ARG HA . 34339 1 136 . 1 1 24 24 ARG HB2 H 1 1.88 0.02 . 1 . . . . A 24 ARG HB2 . 34339 1 137 . 1 1 24 24 ARG HB3 H 1 1.75 0.02 . 1 . . . . A 24 ARG HB3 . 34339 1 138 . 1 1 24 24 ARG HG2 H 1 1.67 0.02 . 2 . . . . A 24 ARG HG2 . 34339 1 139 . 1 1 24 24 ARG HG3 H 1 1.67 0.02 . 2 . . . . A 24 ARG HG3 . 34339 1 140 . 1 1 24 24 ARG HD2 H 1 3.13 0.02 . 2 . . . . A 24 ARG HD2 . 34339 1 141 . 1 1 24 24 ARG HD3 H 1 3.13 0.02 . 2 . . . . A 24 ARG HD3 . 34339 1 142 . 1 1 24 24 ARG HE H 1 7.32 0.02 . 1 . . . . A 24 ARG HE . 34339 1 143 . 1 1 25 25 GLY H H 1 8.06 0.02 . 1 . . . . A 25 GLY H . 34339 1 144 . 1 1 25 25 GLY HA2 H 1 3.87 0.02 . 2 . . . . A 25 GLY HA2 . 34339 1 145 . 1 1 25 25 GLY HA3 H 1 3.87 0.02 . 2 . . . . A 25 GLY HA3 . 34339 1 146 . 1 1 26 26 VAL H H 1 7.80 0.02 . 1 . . . . A 26 VAL H . 34339 1 147 . 1 1 26 26 VAL HA H 1 4.30 0.02 . 1 . . . . A 26 VAL HA . 34339 1 148 . 1 1 26 26 VAL HB H 1 2.04 0.02 . 1 . . . . A 26 VAL HB . 34339 1 149 . 1 1 26 26 VAL HG11 H 1 0.89 0.02 . 2 . . . . A 26 VAL HG11 . 34339 1 150 . 1 1 26 26 VAL HG12 H 1 0.89 0.02 . 2 . . . . A 26 VAL HG12 . 34339 1 151 . 1 1 26 26 VAL HG13 H 1 0.89 0.02 . 2 . . . . A 26 VAL HG13 . 34339 1 152 . 1 1 26 26 VAL HG21 H 1 0.89 0.02 . 2 . . . . A 26 VAL HG21 . 34339 1 153 . 1 1 26 26 VAL HG22 H 1 0.89 0.02 . 2 . . . . A 26 VAL HG22 . 34339 1 154 . 1 1 26 26 VAL HG23 H 1 0.89 0.02 . 2 . . . . A 26 VAL HG23 . 34339 1 155 . 1 1 27 27 PRO HA H 1 4.40 0.02 . 1 . . . . A 27 PRO HA . 34339 1 156 . 1 1 27 27 PRO HB2 H 1 2.17 0.02 . 2 . . . . A 27 PRO HB2 . 34339 1 157 . 1 1 27 27 PRO HB3 H 1 2.17 0.02 . 2 . . . . A 27 PRO HB3 . 34339 1 158 . 1 1 27 27 PRO HG2 H 1 1.98 0.02 . 1 . . . . A 27 PRO HG2 . 34339 1 159 . 1 1 27 27 PRO HG3 H 1 1.92 0.02 . 1 . . . . A 27 PRO HG3 . 34339 1 160 . 1 1 27 27 PRO HD2 H 1 3.82 0.02 . 1 . . . . A 27 PRO HD2 . 34339 1 161 . 1 1 27 27 PRO HD3 H 1 3.57 0.02 . 1 . . . . A 27 PRO HD3 . 34339 1 162 . 1 1 28 28 LEU H H 1 8.11 0.02 . 1 . . . . A 28 LEU H . 34339 1 163 . 1 1 28 28 LEU HA H 1 4.30 0.02 . 1 . . . . A 28 LEU HA . 34339 1 164 . 1 1 28 28 LEU HB2 H 1 1.61 0.02 . 2 . . . . A 28 LEU HB2 . 34339 1 165 . 1 1 28 28 LEU HB3 H 1 1.61 0.02 . 2 . . . . A 28 LEU HB3 . 34339 1 166 . 1 1 28 28 LEU HG H 1 1.57 0.02 . 1 . . . . A 28 LEU HG . 34339 1 167 . 1 1 28 28 LEU HD11 H 1 0.90 0.02 . 2 . . . . A 28 LEU HD11 . 34339 1 168 . 1 1 28 28 LEU HD12 H 1 0.90 0.02 . 2 . . . . A 28 LEU HD12 . 34339 1 169 . 1 1 28 28 LEU HD13 H 1 0.90 0.02 . 2 . . . . A 28 LEU HD13 . 34339 1 170 . 1 1 28 28 LEU HD21 H 1 0.84 0.02 . 2 . . . . A 28 LEU HD21 . 34339 1 171 . 1 1 28 28 LEU HD22 H 1 0.84 0.02 . 2 . . . . A 28 LEU HD22 . 34339 1 172 . 1 1 28 28 LEU HD23 H 1 0.84 0.02 . 2 . . . . A 28 LEU HD23 . 34339 1 173 . 1 1 29 29 SER H H 1 8.08 0.02 . 1 . . . . A 29 SER H . 34339 1 174 . 1 1 29 29 SER HA H 1 4.40 0.02 . 1 . . . . A 29 SER HA . 34339 1 175 . 1 1 29 29 SER HB2 H 1 3.79 0.02 . 2 . . . . A 29 SER HB2 . 34339 1 176 . 1 1 29 29 SER HB3 H 1 3.79 0.02 . 2 . . . . A 29 SER HB3 . 34339 1 177 . 1 1 30 30 GLU H H 1 8.16 0.02 . 1 . . . . A 30 GLU H . 34339 1 178 . 1 1 30 30 GLU HA H 1 4.64 0.02 . 1 . . . . A 30 GLU HA . 34339 1 179 . 1 1 30 30 GLU HB2 H 1 2.03 0.02 . 1 . . . . A 30 GLU HB2 . 34339 1 180 . 1 1 30 30 GLU HB3 H 1 1.83 0.02 . 1 . . . . A 30 GLU HB3 . 34339 1 181 . 1 1 30 30 GLU HG2 H 1 2.41 0.02 . 2 . . . . A 30 GLU HG2 . 34339 1 182 . 1 1 30 30 GLU HG3 H 1 2.41 0.02 . 2 . . . . A 30 GLU HG3 . 34339 1 183 . 1 1 31 31 PRO HA H 1 4.59 0.02 . 1 . . . . A 31 PRO HA . 34339 1 184 . 1 1 31 31 PRO HB2 H 1 2.26 0.02 . 2 . . . . A 31 PRO HB2 . 34339 1 185 . 1 1 31 31 PRO HB3 H 1 2.26 0.02 . 2 . . . . A 31 PRO HB3 . 34339 1 186 . 1 1 31 31 PRO HG2 H 1 1.98 0.02 . 1 . . . . A 31 PRO HG2 . 34339 1 187 . 1 1 31 31 PRO HG3 H 1 1.88 0.02 . 1 . . . . A 31 PRO HG3 . 34339 1 188 . 1 1 31 31 PRO HD2 H 1 3.76 0.02 . 1 . . . . A 31 PRO HD2 . 34339 1 189 . 1 1 31 31 PRO HD3 H 1 3.60 0.02 . 1 . . . . A 31 PRO HD3 . 34339 1 190 . 1 1 32 32 PRO HA H 1 4.34 0.02 . 1 . . . . A 32 PRO HA . 34339 1 191 . 1 1 32 32 PRO HB2 H 1 2.26 0.02 . 2 . . . . A 32 PRO HB2 . 34339 1 192 . 1 1 32 32 PRO HB3 H 1 2.26 0.02 . 2 . . . . A 32 PRO HB3 . 34339 1 193 . 1 1 32 32 PRO HG2 H 1 1.98 0.02 . 1 . . . . A 32 PRO HG2 . 34339 1 194 . 1 1 32 32 PRO HG3 H 1 1.87 0.02 . 1 . . . . A 32 PRO HG3 . 34339 1 195 . 1 1 32 32 PRO HD2 H 1 3.73 0.02 . 1 . . . . A 32 PRO HD2 . 34339 1 196 . 1 1 32 32 PRO HD3 H 1 3.58 0.02 . 1 . . . . A 32 PRO HD3 . 34339 1 197 . 1 1 33 33 GLN H H 1 8.47 0.02 . 1 . . . . A 33 GLN H . 34339 1 198 . 1 1 33 33 GLN HA H 1 4.16 0.02 . 1 . . . . A 33 GLN HA . 34339 1 199 . 1 1 33 33 GLN HB2 H 1 2.03 0.02 . 1 . . . . A 33 GLN HB2 . 34339 1 200 . 1 1 33 33 GLN HB3 H 1 1.95 0.02 . 1 . . . . A 33 GLN HB3 . 34339 1 201 . 1 1 33 33 GLN HG2 H 1 2.35 0.02 . 2 . . . . A 33 GLN HG2 . 34339 1 202 . 1 1 33 33 GLN HG3 H 1 2.35 0.02 . 2 . . . . A 33 GLN HG3 . 34339 1 203 . 1 1 34 34 ALA H H 1 8.25 0.02 . 1 . . . . A 34 ALA H . 34339 1 204 . 1 1 34 34 ALA HA H 1 4.22 0.02 . 1 . . . . A 34 ALA HA . 34339 1 205 . 1 1 34 34 ALA HB1 H 1 1.34 0.02 . 1 . . . . A 34 ALA HB1 . 34339 1 206 . 1 1 34 34 ALA HB2 H 1 1.34 0.02 . 1 . . . . A 34 ALA HB2 . 34339 1 207 . 1 1 34 34 ALA HB3 H 1 1.34 0.02 . 1 . . . . A 34 ALA HB3 . 34339 1 208 . 1 1 35 35 LEU H H 1 7.95 0.02 . 1 . . . . A 35 LEU H . 34339 1 209 . 1 1 35 35 LEU HA H 1 4.22 0.02 . 1 . . . . A 35 LEU HA . 34339 1 210 . 1 1 35 35 LEU HB2 H 1 1.61 0.02 . 2 . . . . A 35 LEU HB2 . 34339 1 211 . 1 1 35 35 LEU HB3 H 1 1.61 0.02 . 2 . . . . A 35 LEU HB3 . 34339 1 212 . 1 1 35 35 LEU HG H 1 1.56 0.02 . 1 . . . . A 35 LEU HG . 34339 1 213 . 1 1 35 35 LEU HD11 H 1 0.88 0.02 . 2 . . . . A 35 LEU HD11 . 34339 1 214 . 1 1 35 35 LEU HD12 H 1 0.88 0.02 . 2 . . . . A 35 LEU HD12 . 34339 1 215 . 1 1 35 35 LEU HD13 H 1 0.88 0.02 . 2 . . . . A 35 LEU HD13 . 34339 1 216 . 1 1 35 35 LEU HD21 H 1 0.82 0.02 . 2 . . . . A 35 LEU HD21 . 34339 1 217 . 1 1 35 35 LEU HD22 H 1 0.82 0.02 . 2 . . . . A 35 LEU HD22 . 34339 1 218 . 1 1 35 35 LEU HD23 H 1 0.82 0.02 . 2 . . . . A 35 LEU HD23 . 34339 1 stop_ save_