################################### # 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 31284 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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 0.01 _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 '1H NMR with water suppression' . . . 31284 1 2 '2D 1H-1H TOCSY' . . . 31284 1 3 '2D 1H-1H NOESY' . . . 31284 1 4 '2D 1H-15N HSQC' . . . 31284 1 5 '2D 1H-13C HSQC' . . . 31284 1 6 '3D 1H-13C HSQC-TOCSY' . . . 31284 1 7 '3D 1H-15N HSQC-TOCSY' . . . 31284 1 8 '3D 1H-13C HSQC-NOESY' . . . 31284 1 9 '3D 1H-15N HSQC-NOESY' . . . 31284 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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 ALA H H 1 8.17 0.05 . 1 . . . . . 1 ALA H . 31284 1 2 . 1 . 1 1 1 ALA HA H 1 4.30 0.05 . 1 . . . . . 1 ALA HA . 31284 1 3 . 1 . 1 1 1 ALA HB1 H 1 1.23 0.05 . 1 . . . . . 1 ALA HB . 31284 1 4 . 1 . 1 1 1 ALA HB2 H 1 1.23 0.05 . 1 . . . . . 1 ALA HB . 31284 1 5 . 1 . 1 1 1 ALA HB3 H 1 1.23 0.05 . 1 . . . . . 1 ALA HB . 31284 1 6 . 1 . 1 1 1 ALA CA C 13 51.3 0.5 . 1 . . . . . 1 ALA CA . 31284 1 7 . 1 . 1 1 1 ALA CB C 13 21.1 0.5 . 1 . . . . . 1 ALA CB . 31284 1 8 . 1 . 1 1 1 ALA N N 15 122.3 0.3 . 1 . . . . . 1 ALA N . 31284 1 9 . 1 . 1 2 2 LYS H H 1 9.38 0.05 . 1 . . . . . 2 LYS H . 31284 1 10 . 1 . 1 2 2 LYS HA H 1 4.45 0.05 . 1 . . . . . 2 LYS HA . 31284 1 11 . 1 . 1 2 2 LYS HB2 H 1 1.82 0.05 . 1 . . . . . 2 LYS HB2 . 31284 1 12 . 1 . 1 2 2 LYS HB3 H 1 1.74 0.05 . 1 . . . . . 2 LYS HB3 . 31284 1 13 . 1 . 1 2 2 LYS HG2 H 1 1.32 0.05 . 1 . . . . . 2 LYS HG2 . 31284 1 14 . 1 . 1 2 2 LYS HG3 H 1 1.22 0.05 . 1 . . . . . 2 LYS HG3 . 31284 1 15 . 1 . 1 2 2 LYS HD2 H 1 1.35 0.05 . 1 . . . . . 2 LYS HD2 . 31284 1 16 . 1 . 1 2 2 LYS HD3 H 1 1.17 0.05 . 1 . . . . . 2 LYS HD3 . 31284 1 17 . 1 . 1 2 2 LYS HE2 H 1 3.44 0.05 . 1 . . . . . 2 LYS HE2 . 31284 1 18 . 1 . 1 2 2 LYS HE3 H 1 2.98 0.05 . 1 . . . . . 2 LYS HE3 . 31284 1 19 . 1 . 1 2 2 LYS HZ1 H 1 7.59 0.05 . 1 . . . . . 2 LYS QZ . 31284 1 20 . 1 . 1 2 2 LYS HZ2 H 1 7.59 0.05 . 1 . . . . . 2 LYS QZ . 31284 1 21 . 1 . 1 2 2 LYS HZ3 H 1 7.59 0.05 . 1 . . . . . 2 LYS QZ . 31284 1 22 . 1 . 1 2 2 LYS CA C 13 57.1 0.5 . 1 . . . . . 2 LYS CA . 31284 1 23 . 1 . 1 2 2 LYS CB C 13 31.6 0.5 . 1 . . . . . 2 LYS CB . 31284 1 24 . 1 . 1 2 2 LYS CG C 13 24.7 0.5 . 1 . . . . . 2 LYS CG . 31284 1 25 . 1 . 1 2 2 LYS CD C 13 28.2 0.5 . 1 . . . . . 2 LYS CD . 31284 1 26 . 1 . 1 2 2 LYS CE C 13 42.7 0.5 . 1 . . . . . 2 LYS CE . 31284 1 27 . 1 . 1 2 2 LYS N N 15 127.0 0.3 . 1 . . . . . 2 LYS N . 31284 1 28 . 1 . 1 3 3 LYS H H 1 8.71 0.05 . 1 . . . . . 3 LYS H . 31284 1 29 . 1 . 1 3 3 LYS HA H 1 3.63 0.05 . 1 . . . . . 3 LYS HA . 31284 1 30 . 1 . 1 3 3 LYS HB2 H 1 1.73 0.05 . 1 . . . . . 3 LYS HB2 . 31284 1 31 . 1 . 1 3 3 LYS HB3 H 1 1.65 0.05 . 1 . . . . . 3 LYS HB3 . 31284 1 32 . 1 . 1 3 3 LYS HG2 H 1 1.36 0.05 . 1 . . . . . 3 LYS HG2 . 31284 1 33 . 1 . 1 3 3 LYS HG3 H 1 1.28 0.05 . 1 . . . . . 3 LYS HG3 . 31284 1 34 . 1 . 1 3 3 LYS HD2 H 1 1.57 0.05 . 1 . . . . . 3 LYS HD2 . 31284 1 35 . 1 . 1 3 3 LYS HD3 H 1 1.52 0.05 . 1 . . . . . 3 LYS HD3 . 31284 1 36 . 1 . 1 3 3 LYS HE2 H 1 2.91 0.05 . 2 . . . . . 3 LYS QE . 31284 1 37 . 1 . 1 3 3 LYS HE3 H 1 2.91 0.05 . 2 . . . . . 3 LYS QE . 31284 1 38 . 1 . 1 3 3 LYS HZ1 H 1 7.49 0.05 . 1 . . . . . 3 LYS QZ . 31284 1 39 . 1 . 1 3 3 LYS HZ2 H 1 7.49 0.05 . 1 . . . . . 3 LYS QZ . 31284 1 40 . 1 . 1 3 3 LYS HZ3 H 1 7.49 0.05 . 1 . . . . . 3 LYS QZ . 31284 1 41 . 1 . 1 3 3 LYS CA C 13 57.2 0.5 . 1 . . . . . 3 LYS CA . 31284 1 42 . 1 . 1 3 3 LYS CB C 13 35.4 0.5 . 1 . . . . . 3 LYS CB . 31284 1 43 . 1 . 1 3 3 LYS CG C 13 25.4 0.5 . 1 . . . . . 3 LYS CG . 31284 1 44 . 1 . 1 3 3 LYS CD C 13 28.6 0.5 . 1 . . . . . 3 LYS CD . 31284 1 45 . 1 . 1 3 3 LYS CE C 13 42.2 0.5 . 1 . . . . . 3 LYS CE . 31284 1 46 . 1 . 1 3 3 LYS N N 15 123.4 0.3 . 1 . . . . . 3 LYS N . 31284 1 47 . 1 . 1 4 4 SER H H 1 8.20 0.05 . 1 . . . . . 4 SER H . 31284 1 48 . 1 . 1 4 4 SER HA H 1 3.88 0.05 . 1 . . . . . 4 SER HA . 31284 1 49 . 1 . 1 4 4 SER HB2 H 1 3.98 0.05 . 1 . . . . . 4 SER HB2 . 31284 1 50 . 1 . 1 4 4 SER HB3 H 1 3.63 0.05 . 1 . . . . . 4 SER HB3 . 31284 1 51 . 1 . 1 4 4 SER CA C 13 57.6 0.5 . 1 . . . . . 4 SER CA . 31284 1 52 . 1 . 1 4 4 SER CB C 13 62.5 0.5 . 1 . . . . . 4 SER CB . 31284 1 53 . 1 . 1 4 4 SER N N 15 112.0 0.3 . 1 . . . . . 4 SER N . 31284 1 54 . 1 . 1 5 5 LYS H H 1 8.06 0.05 . 1 . . . . . 5 LYS H . 31284 1 55 . 1 . 1 5 5 LYS HA H 1 4.39 0.05 . 1 . . . . . 5 LYS HA . 31284 1 56 . 1 . 1 5 5 LYS HB2 H 1 1.65 0.05 . 1 . . . . . 5 LYS HB2 . 31284 1 57 . 1 . 1 5 5 LYS HB3 H 1 1.53 0.05 . 1 . . . . . 5 LYS HB3 . 31284 1 58 . 1 . 1 5 5 LYS HG2 H 1 1.22 0.05 . 2 . . . . . 5 LYS QG . 31284 1 59 . 1 . 1 5 5 LYS HG3 H 1 1.22 0.05 . 2 . . . . . 5 LYS QG . 31284 1 60 . 1 . 1 5 5 LYS HD2 H 1 1.53 0.05 . 1 . . . . . 5 LYS HD2 . 31284 1 61 . 1 . 1 5 5 LYS HD3 H 1 1.50 0.05 . 1 . . . . . 5 LYS HD3 . 31284 1 62 . 1 . 1 5 5 LYS HE2 H 1 2.83 0.05 . 2 . . . . . 5 LYS QE . 31284 1 63 . 1 . 1 5 5 LYS HE3 H 1 2.83 0.05 . 2 . . . . . 5 LYS QE . 31284 1 64 . 1 . 1 5 5 LYS HZ1 H 1 7.40 0.05 . 1 . . . . . 5 LYS QZ . 31284 1 65 . 1 . 1 5 5 LYS HZ2 H 1 7.40 0.05 . 1 . . . . . 5 LYS QZ . 31284 1 66 . 1 . 1 5 5 LYS HZ3 H 1 7.40 0.05 . 1 . . . . . 5 LYS QZ . 31284 1 67 . 1 . 1 5 5 LYS CA C 13 53.8 0.5 . 1 . . . . . 5 LYS CA . 31284 1 68 . 1 . 1 5 5 LYS CB C 13 34.1 0.5 . 1 . . . . . 5 LYS CB . 31284 1 69 . 1 . 1 5 5 LYS CG C 13 24.2 0.5 . 1 . . . . . 5 LYS CG . 31284 1 70 . 1 . 1 5 5 LYS CD C 13 29.1 0.5 . 1 . . . . . 5 LYS CD . 31284 1 71 . 1 . 1 5 5 LYS CE C 13 41.9 0.5 . 1 . . . . . 5 LYS CE . 31284 1 72 . 1 . 1 5 5 LYS N N 15 120.7 0.3 . 1 . . . . . 5 LYS N . 31284 1 73 . 1 . 1 6 6 PRO HA H 1 4.51 0.05 . 1 . . . . . 6 PRO HA . 31284 1 74 . 1 . 1 6 6 PRO HB2 H 1 2.41 0.05 . 1 . . . . . 6 PRO HB2 . 31284 1 75 . 1 . 1 6 6 PRO HB3 H 1 2.21 0.05 . 1 . . . . . 6 PRO HB3 . 31284 1 76 . 1 . 1 6 6 PRO HG2 H 1 1.85 0.05 . 1 . . . . . 6 PRO HG2 . 31284 1 77 . 1 . 1 6 6 PRO HG3 H 1 1.68 0.05 . 1 . . . . . 6 PRO HG3 . 31284 1 78 . 1 . 1 6 6 PRO HD2 H 1 3.43 0.05 . 1 . . . . . 6 PRO HD2 . 31284 1 79 . 1 . 1 6 6 PRO HD3 H 1 3.35 0.05 . 1 . . . . . 6 PRO HD3 . 31284 1 80 . 1 . 1 6 6 PRO CA C 13 61.9 0.5 . 1 . . . . . 6 PRO CA . 31284 1 81 . 1 . 1 6 6 PRO CB C 13 35.3 0.5 . 1 . . . . . 6 PRO CB . 31284 1 82 . 1 . 1 6 6 PRO CG C 13 24.8 0.5 . 1 . . . . . 6 PRO CG . 31284 1 83 . 1 . 1 6 6 PRO CD C 13 50.8 0.5 . 1 . . . . . 6 PRO CD . 31284 1 84 . 1 . 1 7 7 GLY H H 1 8.52 0.05 . 1 . . . . . 7 GLY H . 31284 1 85 . 1 . 1 7 7 GLY HA2 H 1 4.59 0.05 . 1 . . . . . 7 GLY HA2 . 31284 1 86 . 1 . 1 7 7 GLY HA3 H 1 3.86 0.05 . 1 . . . . . 7 GLY HA3 . 31284 1 87 . 1 . 1 7 7 GLY CA C 13 46.1 0.5 . 1 . . . . . 7 GLY CA . 31284 1 88 . 1 . 1 7 7 GLY N N 15 105.7 0.3 . 1 . . . . . 7 GLY N . 31284 1 89 . 1 . 1 8 8 ASP H H 1 7.74 0.05 . 1 . . . . . 8 ASP H . 31284 1 90 . 1 . 1 8 8 ASP HA H 1 4.75 0.05 . 1 . . . . . 8 ASP HA . 31284 1 91 . 1 . 1 8 8 ASP HB2 H 1 3.19 0.05 . 1 . . . . . 8 ASP HB2 . 31284 1 92 . 1 . 1 8 8 ASP HB3 H 1 1.95 0.05 . 1 . . . . . 8 ASP HB3 . 31284 1 93 . 1 . 1 8 8 ASP CA C 13 50.6 0.5 . 1 . . . . . 8 ASP CA . 31284 1 94 . 1 . 1 8 8 ASP CB C 13 40.0 0.5 . 1 . . . . . 8 ASP CB . 31284 1 95 . 1 . 1 8 8 ASP N N 15 119.7 0.3 . 1 . . . . . 8 ASP N . 31284 1 96 . 1 . 1 9 9 GLY H H 1 8.49 0.05 . 1 . . . . . 9 GLY H . 31284 1 97 . 1 . 1 9 9 GLY HA2 H 1 4.26 0.05 . 1 . . . . . 9 GLY HA2 . 31284 1 98 . 1 . 1 9 9 GLY HA3 H 1 3.48 0.05 . 1 . . . . . 9 GLY HA3 . 31284 1 99 . 1 . 1 9 9 GLY CA C 13 44.9 0.5 . 1 . . . . . 9 GLY CA . 31284 1 100 . 1 . 1 9 9 GLY N N 15 109.3 0.3 . 1 . . . . . 9 GLY N . 31284 1 101 . 1 . 1 10 10 LYS H H 1 7.42 0.05 . 1 . . . . . 10 LYS H . 31284 1 102 . 1 . 1 10 10 LYS HA H 1 4.56 0.05 . 1 . . . . . 10 LYS HA . 31284 1 103 . 1 . 1 10 10 LYS HB2 H 1 1.67 0.05 . 1 . . . . . 10 LYS HB2 . 31284 1 104 . 1 . 1 10 10 LYS HB3 H 1 1.65 0.05 . 1 . . . . . 10 LYS HB3 . 31284 1 105 . 1 . 1 10 10 LYS HG2 H 1 1.32 0.05 . 1 . . . . . 10 LYS HG2 . 31284 1 106 . 1 . 1 10 10 LYS HG3 H 1 1.22 0.05 . 1 . . . . . 10 LYS HG3 . 31284 1 107 . 1 . 1 10 10 LYS HD2 H 1 1.54 0.05 . 2 . . . . . 10 LYS QD . 31284 1 108 . 1 . 1 10 10 LYS HD3 H 1 1.54 0.05 . 2 . . . . . 10 LYS QD . 31284 1 109 . 1 . 1 10 10 LYS HE2 H 1 2.99 0.05 . 1 . . . . . 10 LYS HE2 . 31284 1 110 . 1 . 1 10 10 LYS HE3 H 1 2.83 0.05 . 1 . . . . . 10 LYS HE3 . 31284 1 111 . 1 . 1 10 10 LYS CA C 13 53.8 0.5 . 1 . . . . . 10 LYS CA . 31284 1 112 . 1 . 1 10 10 LYS CB C 13 33.1 0.5 . 1 . . . . . 10 LYS CB . 31284 1 113 . 1 . 1 10 10 LYS CG C 13 24.7 0.5 . 1 . . . . . 10 LYS CG . 31284 1 114 . 1 . 1 10 10 LYS CD C 13 28.9 0.5 . 1 . . . . . 10 LYS CD . 31284 1 115 . 1 . 1 10 10 LYS CE C 13 42.2 0.5 . 1 . . . . . 10 LYS CE . 31284 1 116 . 1 . 1 10 10 LYS N N 15 119.6 0.3 . 1 . . . . . 10 LYS N . 31284 1 117 . 1 . 1 11 11 HIS H H 1 8.95 0.05 . 1 . . . . . 11 HIS H . 31284 1 118 . 1 . 1 11 11 HIS HA H 1 4.22 0.05 . 1 . . . . . 11 HIS HA . 31284 1 119 . 1 . 1 11 11 HIS HB2 H 1 3.17 0.05 . 1 . . . . . 11 HIS HB2 . 31284 1 120 . 1 . 1 11 11 HIS HB3 H 1 3.11 0.05 . 1 . . . . . 11 HIS HB3 . 31284 1 121 . 1 . 1 11 11 HIS HD2 H 1 8.54 0.05 . 4 . . . . . 11 HIS HD2 . 31284 1 122 . 1 . 1 11 11 HIS HE1 H 1 7.23 0.05 . 4 . . . . . 11 HIS HE1 . 31284 1 123 . 1 . 1 11 11 HIS CA C 13 57.7 0.5 . 1 . . . . . 11 HIS CA . 31284 1 124 . 1 . 1 11 11 HIS CB C 13 27.9 0.5 . 1 . . . . . 11 HIS CB . 31284 1 125 . 1 . 1 11 11 HIS N N 15 123.3 0.3 . 1 . . . . . 11 HIS N . 31284 1 126 . 1 . 1 12 12 GLY H H 1 8.81 0.05 . 1 . . . . . 12 GLY H . 31284 1 127 . 1 . 1 12 12 GLY HA2 H 1 3.87 0.05 . 1 . . . . . 12 GLY HA2 . 31284 1 128 . 1 . 1 12 12 GLY HA3 H 1 3.57 0.05 . 1 . . . . . 12 GLY HA3 . 31284 1 129 . 1 . 1 12 12 GLY CA C 13 45.6 0.5 . 1 . . . . . 12 GLY CA . 31284 1 130 . 1 . 1 12 12 GLY N N 15 114.0 0.3 . 1 . . . . . 12 GLY N . 31284 1 131 . 1 . 1 13 13 ARG H H 1 7.74 0.05 . 1 . . . . . 13 ARG H . 31284 1 132 . 1 . 1 13 13 ARG HA H 1 4.54 0.05 . 1 . . . . . 13 ARG HA . 31284 1 133 . 1 . 1 13 13 ARG HB2 H 1 1.92 0.05 . 1 . . . . . 13 ARG HB2 . 31284 1 134 . 1 . 1 13 13 ARG HB3 H 1 1.82 0.05 . 1 . . . . . 13 ARG HB3 . 31284 1 135 . 1 . 1 13 13 ARG HG2 H 1 1.42 0.05 . 1 . . . . . 13 ARG HG2 . 31284 1 136 . 1 . 1 13 13 ARG HG3 H 1 1.35 0.05 . 1 . . . . . 13 ARG HG3 . 31284 1 137 . 1 . 1 13 13 ARG HD2 H 1 3.06 0.05 . 1 . . . . . 13 ARG HD2 . 31284 1 138 . 1 . 1 13 13 ARG HD3 H 1 2.95 0.05 . 1 . . . . . 13 ARG HD3 . 31284 1 139 . 1 . 1 13 13 ARG HE H 1 6.97 0.05 . 1 . . . . . 13 ARG HE . 31284 1 140 . 1 . 1 13 13 ARG CA C 13 54.2 0.5 . 1 . . . . . 13 ARG CA . 31284 1 141 . 1 . 1 13 13 ARG CB C 13 31.6 0.5 . 1 . . . . . 13 ARG CB . 31284 1 142 . 1 . 1 13 13 ARG CG C 13 26.8 0.5 . 1 . . . . . 13 ARG CG . 31284 1 143 . 1 . 1 13 13 ARG CD C 13 42.7 0.5 . 1 . . . . . 13 ARG CD . 31284 1 144 . 1 . 1 13 13 ARG N N 15 119.3 0.3 . 1 . . . . . 13 ARG N . 31284 1 145 . 1 . 1 14 14 GLY H H 1 6.57 0.05 . 1 . . . . . 14 GLY H . 31284 1 146 . 1 . 1 14 14 GLY HA2 H 1 4.80 0.05 . 1 . . . . . 14 GLY HA2 . 31284 1 147 . 1 . 1 14 14 GLY HA3 H 1 3.52 0.05 . 1 . . . . . 14 GLY HA3 . 31284 1 148 . 1 . 1 14 14 GLY CA C 13 45.8 0.5 . 1 . . . . . 14 GLY CA . 31284 1 149 . 1 . 1 14 14 GLY N N 15 106.5 0.3 . 1 . . . . . 14 GLY N . 31284 1 150 . 1 . 1 15 15 VAL H H 1 7.54 0.05 . 1 . . . . . 15 VAL H . 31284 1 151 . 1 . 1 15 15 VAL HA H 1 4.18 0.05 . 1 . . . . . 15 VAL HA . 31284 1 152 . 1 . 1 15 15 VAL HB H 1 2.32 0.05 . 1 . . . . . 15 VAL HB . 31284 1 153 . 1 . 1 15 15 VAL HG11 H 1 0.75 0.05 . 2 . . . . . 15 VAL QG1 . 31284 1 154 . 1 . 1 15 15 VAL HG12 H 1 0.75 0.05 . 2 . . . . . 15 VAL QG1 . 31284 1 155 . 1 . 1 15 15 VAL HG13 H 1 0.75 0.05 . 2 . . . . . 15 VAL QG1 . 31284 1 156 . 1 . 1 15 15 VAL HG21 H 1 0.71 0.05 . 2 . . . . . 15 VAL QG2 . 31284 1 157 . 1 . 1 15 15 VAL HG22 H 1 0.71 0.05 . 2 . . . . . 15 VAL QG2 . 31284 1 158 . 1 . 1 15 15 VAL HG23 H 1 0.71 0.05 . 2 . . . . . 15 VAL QG2 . 31284 1 159 . 1 . 1 15 15 VAL CA C 13 62.0 0.5 . 1 . . . . . 15 VAL CA . 31284 1 160 . 1 . 1 15 15 VAL CB C 13 32.5 0.5 . 1 . . . . . 15 VAL CB . 31284 1 161 . 1 . 1 15 15 VAL CG1 C 13 21.6 0.5 . 1 . . . . . 15 VAL CG1 . 31284 1 162 . 1 . 1 15 15 VAL CG2 C 13 18.0 0.5 . 1 . . . . . 15 VAL CG2 . 31284 1 163 . 1 . 1 16 16 LYS H H 1 8.38 0.05 . 1 . . . . . 16 LYS H . 31284 1 164 . 1 . 1 16 16 LYS HA H 1 4.34 0.05 . 1 . . . . . 16 LYS HA . 31284 1 165 . 1 . 1 16 16 LYS HB2 H 1 1.63 0.05 . 1 . . . . . 16 LYS HB2 . 31284 1 166 . 1 . 1 16 16 LYS HB3 H 1 1.59 0.05 . 1 . . . . . 16 LYS HB3 . 31284 1 167 . 1 . 1 16 16 LYS HG2 H 1 1.47 0.05 . 1 . . . . . 16 LYS HG2 . 31284 1 168 . 1 . 1 16 16 LYS HG3 H 1 1.31 0.05 . 1 . . . . . 16 LYS HG3 . 31284 1 169 . 1 . 1 16 16 LYS HD2 H 1 1.57 0.05 . 2 . . . . . 16 LYS QD . 31284 1 170 . 1 . 1 16 16 LYS HD3 H 1 1.57 0.05 . 2 . . . . . 16 LYS QD . 31284 1 171 . 1 . 1 16 16 LYS HE2 H 1 3.00 0.05 . 1 . . . . . 16 LYS HE2 . 31284 1 172 . 1 . 1 16 16 LYS HE3 H 1 2.97 0.05 . 1 . . . . . 16 LYS HE3 . 31284 1 173 . 1 . 1 16 16 LYS HZ1 H 1 7.53 0.05 . 1 . . . . . 16 LYS QZ . 31284 1 174 . 1 . 1 16 16 LYS HZ2 H 1 7.53 0.05 . 1 . . . . . 16 LYS QZ . 31284 1 175 . 1 . 1 16 16 LYS HZ3 H 1 7.53 0.05 . 1 . . . . . 16 LYS QZ . 31284 1 176 . 1 . 1 16 16 LYS CA C 13 55.4 0.5 . 1 . . . . . 16 LYS CA . 31284 1 177 . 1 . 1 16 16 LYS CB C 13 33.3 0.5 . 1 . . . . . 16 LYS CB . 31284 1 178 . 1 . 1 16 16 LYS CG C 13 25.3 0.5 . 1 . . . . . 16 LYS CG . 31284 1 179 . 1 . 1 16 16 LYS CD C 13 28.8 0.5 . 1 . . . . . 16 LYS CD . 31284 1 180 . 1 . 1 16 16 LYS CE C 13 42.3 0.5 . 1 . . . . . 16 LYS CE . 31284 1 181 . 1 . 1 16 16 LYS N N 15 121.2 0.3 . 1 . . . . . 16 LYS N . 31284 1 182 . 1 . 1 17 17 LYS H H 1 8.77 0.05 . 1 . . . . . 17 LYS H . 31284 1 183 . 1 . 1 17 17 LYS HA H 1 3.63 0.05 . 1 . . . . . 17 LYS HA . 31284 1 184 . 1 . 1 17 17 LYS HB2 H 1 1.86 0.05 . 1 . . . . . 17 LYS HB2 . 31284 1 185 . 1 . 1 17 17 LYS HB3 H 1 1.80 0.05 . 1 . . . . . 17 LYS HB3 . 31284 1 186 . 1 . 1 17 17 LYS HG2 H 1 1.29 0.05 . 1 . . . . . 17 LYS HG2 . 31284 1 187 . 1 . 1 17 17 LYS HG3 H 1 1.24 0.05 . 1 . . . . . 17 LYS HG3 . 31284 1 188 . 1 . 1 17 17 LYS HD2 H 1 1.58 0.05 . 1 . . . . . 17 LYS HD2 . 31284 1 189 . 1 . 1 17 17 LYS HD3 H 1 1.52 0.05 . 1 . . . . . 17 LYS HD3 . 31284 1 190 . 1 . 1 17 17 LYS HE2 H 1 2.88 0.05 . 2 . . . . . 17 LYS QE . 31284 1 191 . 1 . 1 17 17 LYS HE3 H 1 2.88 0.05 . 2 . . . . . 17 LYS QE . 31284 1 192 . 1 . 1 17 17 LYS HZ1 H 1 7.47 0.05 . 1 . . . . . 17 LYS QZ . 31284 1 193 . 1 . 1 17 17 LYS HZ2 H 1 7.47 0.05 . 1 . . . . . 17 LYS QZ . 31284 1 194 . 1 . 1 17 17 LYS HZ3 H 1 7.47 0.05 . 1 . . . . . 17 LYS QZ . 31284 1 195 . 1 . 1 17 17 LYS CA C 13 57.3 0.5 . 1 . . . . . 17 LYS CA . 31284 1 196 . 1 . 1 17 17 LYS CB C 13 29.4 0.5 . 1 . . . . . 17 LYS CB . 31284 1 197 . 1 . 1 17 17 LYS CG C 13 25.3 0.5 . 1 . . . . . 17 LYS CG . 31284 1 198 . 1 . 1 17 17 LYS CD C 13 29.1 0.5 . 1 . . . . . 17 LYS CD . 31284 1 199 . 1 . 1 17 17 LYS CE C 13 42.1 0.5 . 1 . . . . . 17 LYS CE . 31284 1 200 . 1 . 1 17 17 LYS N N 15 114.9 0.3 . 1 . . . . . 17 LYS N . 31284 1 stop_ save_