################################### # 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 30660 _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 . _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' . . . 30660 1 2 '3D HNCO' . . . 30660 1 3 '3D HNCACB' . . . 30660 1 4 '3D C(CO)NH' . . . 30660 1 5 '2D 1H-13C HSQC aliphatic' . . . 30660 1 6 '3D 1H-13C NOESY aliphatic' . . . 30660 1 7 '3D 1H-13C NOESY aromatic' . . . 30660 1 8 'Deuterium exchange' . . . 30660 1 9 '3D 1H-15N NOESY' . . . 30660 1 10 '3D 1H-13C NOESY aliphatic' . . . 30660 1 11 '3D H(CCO)NH' . . . 30660 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 HA H 1 4.05 0.02 . 1 . . . . A 1 ALA HA . 30660 1 2 . 1 . 1 1 1 ALA HB1 H 1 1.53 0.02 . 1 . . . . A 1 ALA HB1 . 30660 1 3 . 1 . 1 1 1 ALA HB2 H 1 1.53 0.02 . 1 . . . . A 1 ALA HB2 . 30660 1 4 . 1 . 1 1 1 ALA HB3 H 1 1.53 0.02 . 1 . . . . A 1 ALA HB3 . 30660 1 5 . 1 . 1 1 1 ALA C C 13 173.0 0.2 . 1 . . . . A 1 ALA C . 30660 1 6 . 1 . 1 1 1 ALA CA C 13 51.7 0.2 . 1 . . . . A 1 ALA CA . 30660 1 7 . 1 . 1 1 1 ALA CB C 13 19.5 0.2 . 1 . . . . A 1 ALA CB . 30660 1 8 . 1 . 1 2 2 PHE H H 1 8.67 0.02 . 1 . . . . A 2 PHE H . 30660 1 9 . 1 . 1 2 2 PHE HA H 1 4.72 0.02 . 1 . . . . A 2 PHE HA . 30660 1 10 . 1 . 1 2 2 PHE HB2 H 1 3.05 0.02 . 2 . . . . A 2 PHE HB2 . 30660 1 11 . 1 . 1 2 2 PHE HB3 H 1 3.05 0.02 . 2 . . . . A 2 PHE HB3 . 30660 1 12 . 1 . 1 2 2 PHE HD1 H 1 7.26 0.02 . 3 . . . . A 2 PHE HD1 . 30660 1 13 . 1 . 1 2 2 PHE HD2 H 1 7.26 0.02 . 3 . . . . A 2 PHE HD2 . 30660 1 14 . 1 . 1 2 2 PHE HE1 H 1 7.36 0.02 . 3 . . . . A 2 PHE HE1 . 30660 1 15 . 1 . 1 2 2 PHE HE2 H 1 7.36 0.02 . 3 . . . . A 2 PHE HE2 . 30660 1 16 . 1 . 1 2 2 PHE HZ H 1 7.32 0.02 . 1 . . . . A 2 PHE HZ . 30660 1 17 . 1 . 1 2 2 PHE C C 13 174.9 0.2 . 1 . . . . A 2 PHE C . 30660 1 18 . 1 . 1 2 2 PHE CA C 13 57.6 0.2 . 1 . . . . A 2 PHE CA . 30660 1 19 . 1 . 1 2 2 PHE CB C 13 39.6 0.2 . 1 . . . . A 2 PHE CB . 30660 1 20 . 1 . 1 2 2 PHE CD1 C 13 131.8 0.2 . 3 . . . . A 2 PHE CD1 . 30660 1 21 . 1 . 1 2 2 PHE CD2 C 13 131.8 0.2 . 3 . . . . A 2 PHE CD2 . 30660 1 22 . 1 . 1 2 2 PHE CE1 C 13 131.5 0.2 . 3 . . . . A 2 PHE CE1 . 30660 1 23 . 1 . 1 2 2 PHE CE2 C 13 131.5 0.2 . 3 . . . . A 2 PHE CE2 . 30660 1 24 . 1 . 1 2 2 PHE CZ C 13 129.9 0.2 . 1 . . . . A 2 PHE CZ . 30660 1 25 . 1 . 1 2 2 PHE N N 15 120.2 0.2 . 1 . . . . A 2 PHE N . 30660 1 26 . 1 . 1 3 3 ILE H H 1 8.21 0.02 . 1 . . . . A 3 ILE H . 30660 1 27 . 1 . 1 3 3 ILE HA H 1 4.09 0.02 . 1 . . . . A 3 ILE HA . 30660 1 28 . 1 . 1 3 3 ILE HB H 1 1.72 0.02 . 1 . . . . A 3 ILE HB . 30660 1 29 . 1 . 1 3 3 ILE HG12 H 1 1.44 0.02 . 2 . . . . A 3 ILE HG12 . 30660 1 30 . 1 . 1 3 3 ILE HG13 H 1 1.12 0.02 . 2 . . . . A 3 ILE HG13 . 30660 1 31 . 1 . 1 3 3 ILE HG21 H 1 0.82 0.02 . 1 . . . . A 3 ILE HG21 . 30660 1 32 . 1 . 1 3 3 ILE HG22 H 1 0.82 0.02 . 1 . . . . A 3 ILE HG22 . 30660 1 33 . 1 . 1 3 3 ILE HG23 H 1 0.82 0.02 . 1 . . . . A 3 ILE HG23 . 30660 1 34 . 1 . 1 3 3 ILE HD11 H 1 0.83 0.02 . 1 . . . . A 3 ILE HD11 . 30660 1 35 . 1 . 1 3 3 ILE HD12 H 1 0.83 0.02 . 1 . . . . A 3 ILE HD12 . 30660 1 36 . 1 . 1 3 3 ILE HD13 H 1 0.83 0.02 . 1 . . . . A 3 ILE HD13 . 30660 1 37 . 1 . 1 3 3 ILE CA C 13 60.4 0.2 . 1 . . . . A 3 ILE CA . 30660 1 38 . 1 . 1 3 3 ILE CB C 13 39.0 0.2 . 1 . . . . A 3 ILE CB . 30660 1 39 . 1 . 1 3 3 ILE CG1 C 13 27.2 0.2 . 1 . . . . A 3 ILE CG1 . 30660 1 40 . 1 . 1 3 3 ILE CG2 C 13 17.0 0.2 . 1 . . . . A 3 ILE CG2 . 30660 1 41 . 1 . 1 3 3 ILE CD1 C 13 12.9 0.2 . 1 . . . . A 3 ILE CD1 . 30660 1 42 . 1 . 1 3 3 ILE N N 15 124.6 0.2 . 1 . . . . A 3 ILE N . 30660 1 43 . 1 . 1 4 4 GLN H H 1 8.46 0.02 . 1 . . . . A 4 GLN H . 30660 1 44 . 1 . 1 4 4 GLN HA H 1 4.28 0.02 . 1 . . . . A 4 GLN HA . 30660 1 45 . 1 . 1 4 4 GLN HB2 H 1 2.05 0.02 . 2 . . . . A 4 GLN HB2 . 30660 1 46 . 1 . 1 4 4 GLN HB3 H 1 1.95 0.02 . 2 . . . . A 4 GLN HB3 . 30660 1 47 . 1 . 1 4 4 GLN HG2 H 1 2.31 0.02 . 2 . . . . A 4 GLN HG2 . 30660 1 48 . 1 . 1 4 4 GLN HG3 H 1 2.31 0.02 . 2 . . . . A 4 GLN HG3 . 30660 1 49 . 1 . 1 4 4 GLN HE21 H 1 7.79 0.02 . 2 . . . . A 4 GLN HE21 . 30660 1 50 . 1 . 1 4 4 GLN HE22 H 1 6.91 0.02 . 2 . . . . A 4 GLN HE22 . 30660 1 51 . 1 . 1 4 4 GLN CA C 13 55.3 0.2 . 1 . . . . A 4 GLN CA . 30660 1 52 . 1 . 1 4 4 GLN CB C 13 29.6 0.2 . 1 . . . . A 4 GLN CB . 30660 1 53 . 1 . 1 4 4 GLN CG C 13 33.7 0.2 . 1 . . . . A 4 GLN CG . 30660 1 54 . 1 . 1 4 4 GLN N N 15 125.3 0.2 . 1 . . . . A 4 GLN N . 30660 1 55 . 1 . 1 4 4 GLN NE2 N 15 112.2 0.2 . 1 . . . . A 4 GLN NE2 . 30660 1 56 . 1 . 1 5 5 LEU H H 1 8.46 0.02 . 1 . . . . A 5 LEU H . 30660 1 57 . 1 . 1 5 5 LEU HA H 1 4.37 0.02 . 1 . . . . A 5 LEU HA . 30660 1 58 . 1 . 1 5 5 LEU HB2 H 1 1.67 0.02 . 2 . . . . A 5 LEU HB2 . 30660 1 59 . 1 . 1 5 5 LEU HB3 H 1 1.58 0.02 . 2 . . . . A 5 LEU HB3 . 30660 1 60 . 1 . 1 5 5 LEU HG H 1 1.63 0.02 . 1 . . . . A 5 LEU HG . 30660 1 61 . 1 . 1 5 5 LEU HD11 H 1 0.90 0.02 . 2 . . . . A 5 LEU HD11 . 30660 1 62 . 1 . 1 5 5 LEU HD12 H 1 0.90 0.02 . 2 . . . . A 5 LEU HD12 . 30660 1 63 . 1 . 1 5 5 LEU HD13 H 1 0.90 0.02 . 2 . . . . A 5 LEU HD13 . 30660 1 64 . 1 . 1 5 5 LEU HD21 H 1 0.83 0.02 . 2 . . . . A 5 LEU HD21 . 30660 1 65 . 1 . 1 5 5 LEU HD22 H 1 0.83 0.02 . 2 . . . . A 5 LEU HD22 . 30660 1 66 . 1 . 1 5 5 LEU HD23 H 1 0.83 0.02 . 2 . . . . A 5 LEU HD23 . 30660 1 67 . 1 . 1 5 5 LEU C C 13 177.2 0.2 . 1 . . . . A 5 LEU C . 30660 1 68 . 1 . 1 5 5 LEU CA C 13 54.9 0.2 . 1 . . . . A 5 LEU CA . 30660 1 69 . 1 . 1 5 5 LEU CB C 13 42.4 0.2 . 1 . . . . A 5 LEU CB . 30660 1 70 . 1 . 1 5 5 LEU CG C 13 26.5 0.2 . 1 . . . . A 5 LEU CG . 30660 1 71 . 1 . 1 5 5 LEU CD1 C 13 24.9 0.2 . 2 . . . . A 5 LEU CD1 . 30660 1 72 . 1 . 1 5 5 LEU CD2 C 13 23.2 0.2 . 2 . . . . A 5 LEU CD2 . 30660 1 73 . 1 . 1 5 5 LEU N N 15 125.3 0.2 . 1 . . . . A 5 LEU N . 30660 1 74 . 1 . 1 6 6 SER H H 1 8.34 0.02 . 1 . . . . A 6 SER H . 30660 1 75 . 1 . 1 6 6 SER HA H 1 4.54 0.02 . 1 . . . . A 6 SER HA . 30660 1 76 . 1 . 1 6 6 SER HB2 H 1 3.88 0.02 . 2 . . . . A 6 SER HB2 . 30660 1 77 . 1 . 1 6 6 SER HB3 H 1 3.81 0.02 . 2 . . . . A 6 SER HB3 . 30660 1 78 . 1 . 1 6 6 SER C C 13 173.2 0.2 . 1 . . . . A 6 SER C . 30660 1 79 . 1 . 1 6 6 SER CA C 13 57.9 0.2 . 1 . . . . A 6 SER CA . 30660 1 80 . 1 . 1 6 6 SER CB C 13 63.8 0.2 . 1 . . . . A 6 SER CB . 30660 1 81 . 1 . 1 6 6 SER N N 15 116.5 0.2 . 1 . . . . A 6 SER N . 30660 1 82 . 1 . 1 7 7 LYS H H 1 8.46 0.02 . 1 . . . . A 7 LYS H . 30660 1 83 . 1 . 1 7 7 LYS HA H 1 4.74 0.02 . 1 . . . . A 7 LYS HA . 30660 1 84 . 1 . 1 7 7 LYS HB2 H 1 1.77 0.02 . 2 . . . . A 7 LYS HB2 . 30660 1 85 . 1 . 1 7 7 LYS HB3 H 1 1.77 0.02 . 2 . . . . A 7 LYS HB3 . 30660 1 86 . 1 . 1 7 7 LYS CA C 13 53.7 0.2 . 1 . . . . A 7 LYS CA . 30660 1 87 . 1 . 1 7 7 LYS CB C 13 33.7 0.2 . 1 . . . . A 7 LYS CB . 30660 1 88 . 1 . 1 7 7 LYS N N 15 124.3 0.2 . 1 . . . . A 7 LYS N . 30660 1 89 . 1 . 1 8 8 PRO HA H 1 4.73 0.02 . 1 . . . . A 8 PRO HA . 30660 1 90 . 1 . 1 8 8 PRO HB2 H 1 2.12 0.02 . 2 . . . . A 8 PRO HB2 . 30660 1 91 . 1 . 1 8 8 PRO HB3 H 1 1.79 0.02 . 2 . . . . A 8 PRO HB3 . 30660 1 92 . 1 . 1 8 8 PRO HG2 H 1 2.04 0.02 . 2 . . . . A 8 PRO HG2 . 30660 1 93 . 1 . 1 8 8 PRO HG3 H 1 2.02 0.02 . 2 . . . . A 8 PRO HG3 . 30660 1 94 . 1 . 1 8 8 PRO HD2 H 1 4.01 0.02 . 2 . . . . A 8 PRO HD2 . 30660 1 95 . 1 . 1 8 8 PRO HD3 H 1 3.71 0.02 . 2 . . . . A 8 PRO HD3 . 30660 1 96 . 1 . 1 8 8 PRO C C 13 175.7 0.2 . 1 . . . . A 8 PRO C . 30660 1 97 . 1 . 1 8 8 PRO CA C 13 62.1 0.2 . 1 . . . . A 8 PRO CA . 30660 1 98 . 1 . 1 8 8 PRO CB C 13 32.5 0.2 . 1 . . . . A 8 PRO CB . 30660 1 99 . 1 . 1 8 8 PRO CG C 13 27.4 0.2 . 1 . . . . A 8 PRO CG . 30660 1 100 . 1 . 1 8 8 PRO CD C 13 50.9 0.2 . 1 . . . . A 8 PRO CD . 30660 1 101 . 1 . 1 9 9 CYS H H 1 8.06 0.02 . 1 . . . . A 9 CYS H . 30660 1 102 . 1 . 1 9 9 CYS HA H 1 4.86 0.02 . 1 . . . . A 9 CYS HA . 30660 1 103 . 1 . 1 9 9 CYS HB2 H 1 3.24 0.02 . 2 . . . . A 9 CYS HB2 . 30660 1 104 . 1 . 1 9 9 CYS HB3 H 1 2.96 0.02 . 2 . . . . A 9 CYS HB3 . 30660 1 105 . 1 . 1 9 9 CYS C C 13 173.5 0.2 . 1 . . . . A 9 CYS C . 30660 1 106 . 1 . 1 9 9 CYS CA C 13 54.0 0.2 . 1 . . . . A 9 CYS CA . 30660 1 107 . 1 . 1 9 9 CYS CB C 13 45.6 0.2 . 1 . . . . A 9 CYS CB . 30660 1 108 . 1 . 1 9 9 CYS N N 15 115.7 0.2 . 1 . . . . A 9 CYS N . 30660 1 109 . 1 . 1 10 10 ILE H H 1 9.26 0.02 . 1 . . . . A 10 ILE H . 30660 1 110 . 1 . 1 10 10 ILE HA H 1 4.27 0.02 . 1 . . . . A 10 ILE HA . 30660 1 111 . 1 . 1 10 10 ILE HB H 1 1.99 0.02 . 1 . . . . A 10 ILE HB . 30660 1 112 . 1 . 1 10 10 ILE HG12 H 1 1.37 0.02 . 2 . . . . A 10 ILE HG12 . 30660 1 113 . 1 . 1 10 10 ILE HG13 H 1 1.21 0.02 . 2 . . . . A 10 ILE HG13 . 30660 1 114 . 1 . 1 10 10 ILE HG21 H 1 0.89 0.02 . 1 . . . . A 10 ILE HG21 . 30660 1 115 . 1 . 1 10 10 ILE HG22 H 1 0.89 0.02 . 1 . . . . A 10 ILE HG22 . 30660 1 116 . 1 . 1 10 10 ILE HG23 H 1 0.89 0.02 . 1 . . . . A 10 ILE HG23 . 30660 1 117 . 1 . 1 10 10 ILE HD11 H 1 0.81 0.02 . 1 . . . . A 10 ILE HD11 . 30660 1 118 . 1 . 1 10 10 ILE HD12 H 1 0.81 0.02 . 1 . . . . A 10 ILE HD12 . 30660 1 119 . 1 . 1 10 10 ILE HD13 H 1 0.81 0.02 . 1 . . . . A 10 ILE HD13 . 30660 1 120 . 1 . 1 10 10 ILE C C 13 175.7 0.2 . 1 . . . . A 10 ILE C . 30660 1 121 . 1 . 1 10 10 ILE CA C 13 61.3 0.2 . 1 . . . . A 10 ILE CA . 30660 1 122 . 1 . 1 10 10 ILE CB C 13 39.4 0.2 . 1 . . . . A 10 ILE CB . 30660 1 123 . 1 . 1 10 10 ILE CG1 C 13 27.1 0.2 . 1 . . . . A 10 ILE CG1 . 30660 1 124 . 1 . 1 10 10 ILE CG2 C 13 17.5 0.2 . 1 . . . . A 10 ILE CG2 . 30660 1 125 . 1 . 1 10 10 ILE CD1 C 13 13.1 0.2 . 1 . . . . A 10 ILE CD1 . 30660 1 126 . 1 . 1 10 10 ILE N N 15 116.8 0.2 . 1 . . . . A 10 ILE N . 30660 1 127 . 1 . 1 11 11 SER H H 1 8.23 0.02 . 1 . . . . A 11 SER H . 30660 1 128 . 1 . 1 11 11 SER HA H 1 4.82 0.02 . 1 . . . . A 11 SER HA . 30660 1 129 . 1 . 1 11 11 SER HB2 H 1 4.13 0.02 . 2 . . . . A 11 SER HB2 . 30660 1 130 . 1 . 1 11 11 SER HB3 H 1 3.83 0.02 . 2 . . . . A 11 SER HB3 . 30660 1 131 . 1 . 1 11 11 SER C C 13 173.1 0.2 . 1 . . . . A 11 SER C . 30660 1 132 . 1 . 1 11 11 SER CA C 13 56.2 0.2 . 1 . . . . A 11 SER CA . 30660 1 133 . 1 . 1 11 11 SER CB C 13 66.3 0.2 . 1 . . . . A 11 SER CB . 30660 1 134 . 1 . 1 11 11 SER N N 15 116.4 0.2 . 1 . . . . A 11 SER N . 30660 1 135 . 1 . 1 12 12 ASP H H 1 8.92 0.02 . 1 . . . . A 12 ASP H . 30660 1 136 . 1 . 1 12 12 ASP HA H 1 4.12 0.02 . 1 . . . . A 12 ASP HA . 30660 1 137 . 1 . 1 12 12 ASP HB2 H 1 2.84 0.02 . 2 . . . . A 12 ASP HB2 . 30660 1 138 . 1 . 1 12 12 ASP HB3 H 1 2.70 0.02 . 2 . . . . A 12 ASP HB3 . 30660 1 139 . 1 . 1 12 12 ASP C C 13 175.9 0.2 . 1 . . . . A 12 ASP C . 30660 1 140 . 1 . 1 12 12 ASP CA C 13 58.0 0.2 . 1 . . . . A 12 ASP CA . 30660 1 141 . 1 . 1 12 12 ASP CB C 13 40.4 0.2 . 1 . . . . A 12 ASP CB . 30660 1 142 . 1 . 1 12 12 ASP N N 15 121.7 0.2 . 1 . . . . A 12 ASP N . 30660 1 143 . 1 . 1 13 13 LYS H H 1 8.17 0.02 . 1 . . . . A 13 LYS H . 30660 1 144 . 1 . 1 13 13 LYS HA H 1 4.09 0.02 . 1 . . . . A 13 LYS HA . 30660 1 145 . 1 . 1 13 13 LYS HB2 H 1 1.83 0.02 . 2 . . . . A 13 LYS HB2 . 30660 1 146 . 1 . 1 13 13 LYS HB3 H 1 1.83 0.02 . 2 . . . . A 13 LYS HB3 . 30660 1 147 . 1 . 1 13 13 LYS HG2 H 1 1.46 0.02 . 2 . . . . A 13 LYS HG2 . 30660 1 148 . 1 . 1 13 13 LYS HG3 H 1 1.46 0.02 . 2 . . . . A 13 LYS HG3 . 30660 1 149 . 1 . 1 13 13 LYS HD2 H 1 1.70 0.02 . 2 . . . . A 13 LYS HD2 . 30660 1 150 . 1 . 1 13 13 LYS HD3 H 1 1.70 0.02 . 2 . . . . A 13 LYS HD3 . 30660 1 151 . 1 . 1 13 13 LYS HE2 H 1 3.00 0.02 . 2 . . . . A 13 LYS HE2 . 30660 1 152 . 1 . 1 13 13 LYS HE3 H 1 3.00 0.02 . 2 . . . . A 13 LYS HE3 . 30660 1 153 . 1 . 1 13 13 LYS C C 13 177.9 0.2 . 1 . . . . A 13 LYS C . 30660 1 154 . 1 . 1 13 13 LYS CA C 13 58.6 0.2 . 1 . . . . A 13 LYS CA . 30660 1 155 . 1 . 1 13 13 LYS CB C 13 31.9 0.2 . 1 . . . . A 13 LYS CB . 30660 1 156 . 1 . 1 13 13 LYS CG C 13 24.6 0.2 . 1 . . . . A 13 LYS CG . 30660 1 157 . 1 . 1 13 13 LYS CD C 13 28.9 0.2 . 1 . . . . A 13 LYS CD . 30660 1 158 . 1 . 1 13 13 LYS CE C 13 42.1 0.2 . 1 . . . . A 13 LYS CE . 30660 1 159 . 1 . 1 13 13 LYS N N 15 118.0 0.2 . 1 . . . . A 13 LYS N . 30660 1 160 . 1 . 1 14 14 GLU H H 1 7.52 0.02 . 1 . . . . A 14 GLU H . 30660 1 161 . 1 . 1 14 14 GLU HA H 1 4.20 0.02 . 1 . . . . A 14 GLU HA . 30660 1 162 . 1 . 1 14 14 GLU HB2 H 1 2.23 0.02 . 2 . . . . A 14 GLU HB2 . 30660 1 163 . 1 . 1 14 14 GLU HB3 H 1 2.23 0.02 . 2 . . . . A 14 GLU HB3 . 30660 1 164 . 1 . 1 14 14 GLU HG2 H 1 2.38 0.02 . 2 . . . . A 14 GLU HG2 . 30660 1 165 . 1 . 1 14 14 GLU HG3 H 1 2.26 0.02 . 2 . . . . A 14 GLU HG3 . 30660 1 166 . 1 . 1 14 14 GLU C C 13 176.6 0.2 . 1 . . . . A 14 GLU C . 30660 1 167 . 1 . 1 14 14 GLU CA C 13 58.0 0.2 . 1 . . . . A 14 GLU CA . 30660 1 168 . 1 . 1 14 14 GLU CB C 13 30.6 0.2 . 1 . . . . A 14 GLU CB . 30660 1 169 . 1 . 1 14 14 GLU CG C 13 37.8 0.2 . 1 . . . . A 14 GLU CG . 30660 1 170 . 1 . 1 14 14 GLU N N 15 116.4 0.2 . 1 . . . . A 14 GLU N . 30660 1 171 . 1 . 1 15 15 CYS H H 1 7.60 0.02 . 1 . . . . A 15 CYS H . 30660 1 172 . 1 . 1 15 15 CYS HA H 1 4.83 0.02 . 1 . . . . A 15 CYS HA . 30660 1 173 . 1 . 1 15 15 CYS HB2 H 1 3.09 0.02 . 2 . . . . A 15 CYS HB2 . 30660 1 174 . 1 . 1 15 15 CYS HB3 H 1 2.72 0.02 . 2 . . . . A 15 CYS HB3 . 30660 1 175 . 1 . 1 15 15 CYS C C 13 174.7 0.2 . 1 . . . . A 15 CYS C . 30660 1 176 . 1 . 1 15 15 CYS CA C 13 53.5 0.2 . 1 . . . . A 15 CYS CA . 30660 1 177 . 1 . 1 15 15 CYS CB C 13 38.0 0.2 . 1 . . . . A 15 CYS CB . 30660 1 178 . 1 . 1 15 15 CYS N N 15 116.2 0.2 . 1 . . . . A 15 CYS N . 30660 1 179 . 1 . 1 16 16 SER H H 1 8.20 0.02 . 1 . . . . A 16 SER H . 30660 1 180 . 1 . 1 16 16 SER HA H 1 4.38 0.02 . 1 . . . . A 16 SER HA . 30660 1 181 . 1 . 1 16 16 SER HB2 H 1 3.91 0.02 . 2 . . . . A 16 SER HB2 . 30660 1 182 . 1 . 1 16 16 SER HB3 H 1 3.91 0.02 . 2 . . . . A 16 SER HB3 . 30660 1 183 . 1 . 1 16 16 SER C C 13 173.7 0.2 . 1 . . . . A 16 SER C . 30660 1 184 . 1 . 1 16 16 SER CA C 13 59.3 0.2 . 1 . . . . A 16 SER CA . 30660 1 185 . 1 . 1 16 16 SER CB C 13 63.4 0.2 . 1 . . . . A 16 SER CB . 30660 1 186 . 1 . 1 16 16 SER N N 15 117.8 0.2 . 1 . . . . A 16 SER N . 30660 1 187 . 1 . 1 17 17 ILE H H 1 8.03 0.02 . 1 . . . . A 17 ILE H . 30660 1 188 . 1 . 1 17 17 ILE HA H 1 4.21 0.02 . 1 . . . . A 17 ILE HA . 30660 1 189 . 1 . 1 17 17 ILE HB H 1 1.90 0.02 . 1 . . . . A 17 ILE HB . 30660 1 190 . 1 . 1 17 17 ILE HG12 H 1 1.52 0.02 . 2 . . . . A 17 ILE HG12 . 30660 1 191 . 1 . 1 17 17 ILE HG13 H 1 1.18 0.02 . 2 . . . . A 17 ILE HG13 . 30660 1 192 . 1 . 1 17 17 ILE HG21 H 1 0.92 0.02 . 1 . . . . A 17 ILE HG21 . 30660 1 193 . 1 . 1 17 17 ILE HG22 H 1 0.92 0.02 . 1 . . . . A 17 ILE HG22 . 30660 1 194 . 1 . 1 17 17 ILE HG23 H 1 0.92 0.02 . 1 . . . . A 17 ILE HG23 . 30660 1 195 . 1 . 1 17 17 ILE HD11 H 1 0.91 0.02 . 1 . . . . A 17 ILE HD11 . 30660 1 196 . 1 . 1 17 17 ILE HD12 H 1 0.91 0.02 . 1 . . . . A 17 ILE HD12 . 30660 1 197 . 1 . 1 17 17 ILE HD13 H 1 0.91 0.02 . 1 . . . . A 17 ILE HD13 . 30660 1 198 . 1 . 1 17 17 ILE C C 13 175.8 0.2 . 1 . . . . A 17 ILE C . 30660 1 199 . 1 . 1 17 17 ILE CA C 13 61.4 0.2 . 1 . . . . A 17 ILE CA . 30660 1 200 . 1 . 1 17 17 ILE CB C 13 38.8 0.2 . 1 . . . . A 17 ILE CB . 30660 1 201 . 1 . 1 17 17 ILE CG1 C 13 27.4 0.2 . 1 . . . . A 17 ILE CG1 . 30660 1 202 . 1 . 1 17 17 ILE CG2 C 13 17.6 0.2 . 1 . . . . A 17 ILE CG2 . 30660 1 203 . 1 . 1 17 17 ILE CD1 C 13 13.3 0.2 . 1 . . . . A 17 ILE CD1 . 30660 1 204 . 1 . 1 17 17 ILE N N 15 120.3 0.2 . 1 . . . . A 17 ILE N . 30660 1 205 . 1 . 1 18 18 VAL H H 1 8.13 0.02 . 1 . . . . A 18 VAL H . 30660 1 206 . 1 . 1 18 18 VAL HA H 1 4.17 0.02 . 1 . . . . A 18 VAL HA . 30660 1 207 . 1 . 1 18 18 VAL HB H 1 1.95 0.02 . 1 . . . . A 18 VAL HB . 30660 1 208 . 1 . 1 18 18 VAL HG11 H 1 0.88 0.02 . 2 . . . . A 18 VAL HG11 . 30660 1 209 . 1 . 1 18 18 VAL HG12 H 1 0.88 0.02 . 2 . . . . A 18 VAL HG12 . 30660 1 210 . 1 . 1 18 18 VAL HG13 H 1 0.88 0.02 . 2 . . . . A 18 VAL HG13 . 30660 1 211 . 1 . 1 18 18 VAL HG21 H 1 0.88 0.02 . 2 . . . . A 18 VAL HG21 . 30660 1 212 . 1 . 1 18 18 VAL HG22 H 1 0.88 0.02 . 2 . . . . A 18 VAL HG22 . 30660 1 213 . 1 . 1 18 18 VAL HG23 H 1 0.88 0.02 . 2 . . . . A 18 VAL HG23 . 30660 1 214 . 1 . 1 18 18 VAL C C 13 173.4 0.2 . 1 . . . . A 18 VAL C . 30660 1 215 . 1 . 1 18 18 VAL CA C 13 61.4 0.2 . 1 . . . . A 18 VAL CA . 30660 1 216 . 1 . 1 18 18 VAL CB C 13 33.6 0.2 . 1 . . . . A 18 VAL CB . 30660 1 217 . 1 . 1 18 18 VAL CG1 C 13 21.4 0.2 . 2 . . . . A 18 VAL CG1 . 30660 1 218 . 1 . 1 18 18 VAL CG2 C 13 21.4 0.2 . 2 . . . . A 18 VAL CG2 . 30660 1 219 . 1 . 1 18 18 VAL N N 15 124.0 0.2 . 1 . . . . A 18 VAL N . 30660 1 220 . 1 . 1 19 19 LYS H H 1 8.56 0.02 . 1 . . . . A 19 LYS H . 30660 1 221 . 1 . 1 19 19 LYS HA H 1 4.08 0.02 . 1 . . . . A 19 LYS HA . 30660 1 222 . 1 . 1 19 19 LYS HB2 H 1 1.82 0.02 . 2 . . . . A 19 LYS HB2 . 30660 1 223 . 1 . 1 19 19 LYS HB3 H 1 1.82 0.02 . 2 . . . . A 19 LYS HB3 . 30660 1 224 . 1 . 1 19 19 LYS C C 13 176.6 0.2 . 1 . . . . A 19 LYS C . 30660 1 225 . 1 . 1 19 19 LYS CA C 13 57.6 0.2 . 1 . . . . A 19 LYS CA . 30660 1 226 . 1 . 1 19 19 LYS CB C 13 32.0 0.2 . 1 . . . . A 19 LYS CB . 30660 1 227 . 1 . 1 19 19 LYS CG C 13 24.9 0.2 . 1 . . . . A 19 LYS CG . 30660 1 228 . 1 . 1 19 19 LYS CD C 13 29.1 0.2 . 1 . . . . A 19 LYS CD . 30660 1 229 . 1 . 1 19 19 LYS CE C 13 41.9 0.2 . 1 . . . . A 19 LYS CE . 30660 1 230 . 1 . 1 19 19 LYS N N 15 124.8 0.2 . 1 . . . . A 19 LYS N . 30660 1 231 . 1 . 1 20 20 ASN H H 1 8.64 0.02 . 1 . . . . A 20 ASN H . 30660 1 232 . 1 . 1 20 20 ASN HA H 1 4.34 0.02 . 1 . . . . A 20 ASN HA . 30660 1 233 . 1 . 1 20 20 ASN HB2 H 1 3.01 0.02 . 2 . . . . A 20 ASN HB2 . 30660 1 234 . 1 . 1 20 20 ASN HB3 H 1 2.94 0.02 . 2 . . . . A 20 ASN HB3 . 30660 1 235 . 1 . 1 20 20 ASN HD21 H 1 7.58 0.02 . 2 . . . . A 20 ASN HD21 . 30660 1 236 . 1 . 1 20 20 ASN HD22 H 1 7.03 0.02 . 2 . . . . A 20 ASN HD22 . 30660 1 237 . 1 . 1 20 20 ASN C C 13 173.5 0.2 . 1 . . . . A 20 ASN C . 30660 1 238 . 1 . 1 20 20 ASN CA C 13 54.9 0.2 . 1 . . . . A 20 ASN CA . 30660 1 239 . 1 . 1 20 20 ASN CB C 13 37.4 0.2 . 1 . . . . A 20 ASN CB . 30660 1 240 . 1 . 1 20 20 ASN N N 15 114.6 0.2 . 1 . . . . A 20 ASN N . 30660 1 241 . 1 . 1 20 20 ASN ND2 N 15 112.6 0.2 . 1 . . . . A 20 ASN ND2 . 30660 1 242 . 1 . 1 21 21 TYR H H 1 8.02 0.02 . 1 . . . . A 21 TYR H . 30660 1 243 . 1 . 1 21 21 TYR HA H 1 4.93 0.02 . 1 . . . . A 21 TYR HA . 30660 1 244 . 1 . 1 21 21 TYR HB2 H 1 2.90 0.02 . 2 . . . . A 21 TYR HB2 . 30660 1 245 . 1 . 1 21 21 TYR HB3 H 1 2.90 0.02 . 2 . . . . A 21 TYR HB3 . 30660 1 246 . 1 . 1 21 21 TYR HD1 H 1 7.01 0.02 . 3 . . . . A 21 TYR HD1 . 30660 1 247 . 1 . 1 21 21 TYR HD2 H 1 7.01 0.02 . 3 . . . . A 21 TYR HD2 . 30660 1 248 . 1 . 1 21 21 TYR HE1 H 1 6.81 0.02 . 3 . . . . A 21 TYR HE1 . 30660 1 249 . 1 . 1 21 21 TYR HE2 H 1 6.81 0.02 . 3 . . . . A 21 TYR HE2 . 30660 1 250 . 1 . 1 21 21 TYR C C 13 174.7 0.2 . 1 . . . . A 21 TYR C . 30660 1 251 . 1 . 1 21 21 TYR CA C 13 57.1 0.2 . 1 . . . . A 21 TYR CA . 30660 1 252 . 1 . 1 21 21 TYR CB C 13 40.8 0.2 . 1 . . . . A 21 TYR CB . 30660 1 253 . 1 . 1 21 21 TYR CD1 C 13 133.4 0.2 . 3 . . . . A 21 TYR CD1 . 30660 1 254 . 1 . 1 21 21 TYR CD2 C 13 133.4 0.2 . 3 . . . . A 21 TYR CD2 . 30660 1 255 . 1 . 1 21 21 TYR CE1 C 13 117.8 0.2 . 3 . . . . A 21 TYR CE1 . 30660 1 256 . 1 . 1 21 21 TYR CE2 C 13 117.8 0.2 . 3 . . . . A 21 TYR CE2 . 30660 1 257 . 1 . 1 21 21 TYR N N 15 117.1 0.2 . 1 . . . . A 21 TYR N . 30660 1 258 . 1 . 1 22 22 ARG H H 1 8.77 0.02 . 1 . . . . A 22 ARG H . 30660 1 259 . 1 . 1 22 22 ARG HA H 1 4.54 0.02 . 1 . . . . A 22 ARG HA . 30660 1 260 . 1 . 1 22 22 ARG HB2 H 1 1.82 0.02 . 2 . . . . A 22 ARG HB2 . 30660 1 261 . 1 . 1 22 22 ARG HB3 H 1 1.72 0.02 . 2 . . . . A 22 ARG HB3 . 30660 1 262 . 1 . 1 22 22 ARG HG2 H 1 1.63 0.02 . 2 . . . . A 22 ARG HG2 . 30660 1 263 . 1 . 1 22 22 ARG HG3 H 1 1.63 0.02 . 2 . . . . A 22 ARG HG3 . 30660 1 264 . 1 . 1 22 22 ARG C C 13 175.0 0.2 . 1 . . . . A 22 ARG C . 30660 1 265 . 1 . 1 22 22 ARG CA C 13 55.2 0.2 . 1 . . . . A 22 ARG CA . 30660 1 266 . 1 . 1 22 22 ARG CB C 13 31.5 0.2 . 1 . . . . A 22 ARG CB . 30660 1 267 . 1 . 1 22 22 ARG CG C 13 27.2 0.2 . 1 . . . . A 22 ARG CG . 30660 1 268 . 1 . 1 22 22 ARG CD C 13 43.1 0.2 . 1 . . . . A 22 ARG CD . 30660 1 269 . 1 . 1 22 22 ARG N N 15 121.1 0.2 . 1 . . . . A 22 ARG N . 30660 1 270 . 1 . 1 23 23 ALA H H 1 8.65 0.02 . 1 . . . . A 23 ALA H . 30660 1 271 . 1 . 1 23 23 ALA HA H 1 5.14 0.02 . 1 . . . . A 23 ALA HA . 30660 1 272 . 1 . 1 23 23 ALA HB1 H 1 1.33 0.02 . 1 . . . . A 23 ALA HB1 . 30660 1 273 . 1 . 1 23 23 ALA HB2 H 1 1.33 0.02 . 1 . . . . A 23 ALA HB2 . 30660 1 274 . 1 . 1 23 23 ALA HB3 H 1 1.33 0.02 . 1 . . . . A 23 ALA HB3 . 30660 1 275 . 1 . 1 23 23 ALA C C 13 175.7 0.2 . 1 . . . . A 23 ALA C . 30660 1 276 . 1 . 1 23 23 ALA CA C 13 50.9 0.2 . 1 . . . . A 23 ALA CA . 30660 1 277 . 1 . 1 23 23 ALA CB C 13 21.8 0.2 . 1 . . . . A 23 ALA CB . 30660 1 278 . 1 . 1 23 23 ALA N N 15 127.1 0.2 . 1 . . . . A 23 ALA N . 30660 1 279 . 1 . 1 24 24 ARG H H 1 8.61 0.02 . 1 . . . . A 24 ARG H . 30660 1 280 . 1 . 1 24 24 ARG HA H 1 4.45 0.02 . 1 . . . . A 24 ARG HA . 30660 1 281 . 1 . 1 24 24 ARG HB2 H 1 1.68 0.02 . 2 . . . . A 24 ARG HB2 . 30660 1 282 . 1 . 1 24 24 ARG HB3 H 1 1.68 0.02 . 2 . . . . A 24 ARG HB3 . 30660 1 283 . 1 . 1 24 24 ARG HG2 H 1 1.53 0.02 . 2 . . . . A 24 ARG HG2 . 30660 1 284 . 1 . 1 24 24 ARG HG3 H 1 1.53 0.02 . 2 . . . . A 24 ARG HG3 . 30660 1 285 . 1 . 1 24 24 ARG HD2 H 1 3.18 0.02 . 2 . . . . A 24 ARG HD2 . 30660 1 286 . 1 . 1 24 24 ARG HD3 H 1 3.18 0.02 . 2 . . . . A 24 ARG HD3 . 30660 1 287 . 1 . 1 24 24 ARG C C 13 173.2 0.2 . 1 . . . . A 24 ARG C . 30660 1 288 . 1 . 1 24 24 ARG CA C 13 53.6 0.2 . 1 . . . . A 24 ARG CA . 30660 1 289 . 1 . 1 24 24 ARG CB C 13 33.7 0.2 . 1 . . . . A 24 ARG CB . 30660 1 290 . 1 . 1 24 24 ARG CG C 13 26.7 0.2 . 1 . . . . A 24 ARG CG . 30660 1 291 . 1 . 1 24 24 ARG CD C 13 43.3 0.2 . 1 . . . . A 24 ARG CD . 30660 1 292 . 1 . 1 24 24 ARG N N 15 117.7 0.2 . 1 . . . . A 24 ARG N . 30660 1 293 . 1 . 1 25 25 CYS H H 1 9.44 0.02 . 1 . . . . A 25 CYS H . 30660 1 294 . 1 . 1 25 25 CYS HA H 1 4.83 0.02 . 1 . . . . A 25 CYS HA . 30660 1 295 . 1 . 1 25 25 CYS HB2 H 1 2.82 0.02 . 2 . . . . A 25 CYS HB2 . 30660 1 296 . 1 . 1 25 25 CYS HB3 H 1 2.66 0.02 . 2 . . . . A 25 CYS HB3 . 30660 1 297 . 1 . 1 25 25 CYS C C 13 174.0 0.2 . 1 . . . . A 25 CYS C . 30660 1 298 . 1 . 1 25 25 CYS CA C 13 55.6 0.2 . 1 . . . . A 25 CYS CA . 30660 1 299 . 1 . 1 25 25 CYS CB C 13 40.3 0.2 . 1 . . . . A 25 CYS CB . 30660 1 300 . 1 . 1 25 25 CYS N N 15 122.6 0.2 . 1 . . . . A 25 CYS N . 30660 1 301 . 1 . 1 26 26 ARG H H 1 9.30 0.02 . 1 . . . . A 26 ARG H . 30660 1 302 . 1 . 1 26 26 ARG HA H 1 4.70 0.02 . 1 . . . . A 26 ARG HA . 30660 1 303 . 1 . 1 26 26 ARG HB2 H 1 1.84 0.02 . 2 . . . . A 26 ARG HB2 . 30660 1 304 . 1 . 1 26 26 ARG HB3 H 1 1.61 0.02 . 2 . . . . A 26 ARG HB3 . 30660 1 305 . 1 . 1 26 26 ARG C C 13 174.5 0.2 . 1 . . . . A 26 ARG C . 30660 1 306 . 1 . 1 26 26 ARG CA C 13 54.6 0.2 . 1 . . . . A 26 ARG CA . 30660 1 307 . 1 . 1 26 26 ARG CB C 13 32.6 0.2 . 1 . . . . A 26 ARG CB . 30660 1 308 . 1 . 1 26 26 ARG CG C 13 27.0 0.2 . 1 . . . . A 26 ARG CG . 30660 1 309 . 1 . 1 26 26 ARG CD C 13 43.2 0.2 . 1 . . . . A 26 ARG CD . 30660 1 310 . 1 . 1 26 26 ARG N N 15 131.2 0.2 . 1 . . . . A 26 ARG N . 30660 1 311 . 1 . 1 27 27 LYS H H 1 9.48 0.02 . 1 . . . . A 27 LYS H . 30660 1 312 . 1 . 1 27 27 LYS HA H 1 3.88 0.02 . 1 . . . . A 27 LYS HA . 30660 1 313 . 1 . 1 27 27 LYS HB2 H 1 2.10 0.02 . 2 . . . . A 27 LYS HB2 . 30660 1 314 . 1 . 1 27 27 LYS HB3 H 1 1.91 0.02 . 2 . . . . A 27 LYS HB3 . 30660 1 315 . 1 . 1 27 27 LYS HG2 H 1 1.46 0.02 . 2 . . . . A 27 LYS HG2 . 30660 1 316 . 1 . 1 27 27 LYS HG3 H 1 1.46 0.02 . 2 . . . . A 27 LYS HG3 . 30660 1 317 . 1 . 1 27 27 LYS HD2 H 1 1.72 0.02 . 2 . . . . A 27 LYS HD2 . 30660 1 318 . 1 . 1 27 27 LYS HD3 H 1 1.72 0.02 . 2 . . . . A 27 LYS HD3 . 30660 1 319 . 1 . 1 27 27 LYS HE2 H 1 3.01 0.02 . 2 . . . . A 27 LYS HE2 . 30660 1 320 . 1 . 1 27 27 LYS HE3 H 1 3.01 0.02 . 2 . . . . A 27 LYS HE3 . 30660 1 321 . 1 . 1 27 27 LYS C C 13 176.0 0.2 . 1 . . . . A 27 LYS C . 30660 1 322 . 1 . 1 27 27 LYS CA C 13 56.7 0.2 . 1 . . . . A 27 LYS CA . 30660 1 323 . 1 . 1 27 27 LYS CB C 13 30.1 0.2 . 1 . . . . A 27 LYS CB . 30660 1 324 . 1 . 1 27 27 LYS CG C 13 25.2 0.2 . 1 . . . . A 27 LYS CG . 30660 1 325 . 1 . 1 27 27 LYS CD C 13 29.2 0.2 . 1 . . . . A 27 LYS CD . 30660 1 326 . 1 . 1 27 27 LYS CE C 13 41.9 0.2 . 1 . . . . A 27 LYS CE . 30660 1 327 . 1 . 1 27 27 LYS N N 15 125.6 0.2 . 1 . . . . A 27 LYS N . 30660 1 328 . 1 . 1 28 28 GLY H H 1 7.96 0.02 . 1 . . . . A 28 GLY H . 30660 1 329 . 1 . 1 28 28 GLY HA2 H 1 3.98 0.02 . 2 . . . . A 28 GLY HA2 . 30660 1 330 . 1 . 1 28 28 GLY HA3 H 1 3.87 0.02 . 2 . . . . A 28 GLY HA3 . 30660 1 331 . 1 . 1 28 28 GLY C C 13 173.3 0.2 . 1 . . . . A 28 GLY C . 30660 1 332 . 1 . 1 28 28 GLY CA C 13 45.4 0.2 . 1 . . . . A 28 GLY CA . 30660 1 333 . 1 . 1 28 28 GLY N N 15 102.3 0.2 . 1 . . . . A 28 GLY N . 30660 1 334 . 1 . 1 29 29 TYR H H 1 7.77 0.02 . 1 . . . . A 29 TYR H . 30660 1 335 . 1 . 1 29 29 TYR HA H 1 5.10 0.02 . 1 . . . . A 29 TYR HA . 30660 1 336 . 1 . 1 29 29 TYR HB2 H 1 2.98 0.02 . 2 . . . . A 29 TYR HB2 . 30660 1 337 . 1 . 1 29 29 TYR HB3 H 1 2.62 0.02 . 2 . . . . A 29 TYR HB3 . 30660 1 338 . 1 . 1 29 29 TYR HD1 H 1 7.03 0.02 . 3 . . . . A 29 TYR HD1 . 30660 1 339 . 1 . 1 29 29 TYR HD2 H 1 7.03 0.02 . 3 . . . . A 29 TYR HD2 . 30660 1 340 . 1 . 1 29 29 TYR HE1 H 1 6.81 0.02 . 3 . . . . A 29 TYR HE1 . 30660 1 341 . 1 . 1 29 29 TYR HE2 H 1 6.81 0.02 . 3 . . . . A 29 TYR HE2 . 30660 1 342 . 1 . 1 29 29 TYR C C 13 175.3 0.2 . 1 . . . . A 29 TYR C . 30660 1 343 . 1 . 1 29 29 TYR CA C 13 57.4 0.2 . 1 . . . . A 29 TYR CA . 30660 1 344 . 1 . 1 29 29 TYR CB C 13 42.5 0.2 . 1 . . . . A 29 TYR CB . 30660 1 345 . 1 . 1 29 29 TYR CD1 C 13 133.6 0.2 . 3 . . . . A 29 TYR CD1 . 30660 1 346 . 1 . 1 29 29 TYR CD2 C 13 133.6 0.2 . 3 . . . . A 29 TYR CD2 . 30660 1 347 . 1 . 1 29 29 TYR CE1 C 13 117.8 0.2 . 3 . . . . A 29 TYR CE1 . 30660 1 348 . 1 . 1 29 29 TYR CE2 C 13 117.8 0.2 . 3 . . . . A 29 TYR CE2 . 30660 1 349 . 1 . 1 29 29 TYR N N 15 118.5 0.2 . 1 . . . . A 29 TYR N . 30660 1 350 . 1 . 1 30 30 CYS H H 1 8.86 0.02 . 1 . . . . A 30 CYS H . 30660 1 351 . 1 . 1 30 30 CYS HA H 1 5.12 0.02 . 1 . . . . A 30 CYS HA . 30660 1 352 . 1 . 1 30 30 CYS HB2 H 1 2.90 0.02 . 2 . . . . A 30 CYS HB2 . 30660 1 353 . 1 . 1 30 30 CYS HB3 H 1 2.84 0.2 . 2 . . . . A 30 CYS HB3 . 30660 1 354 . 1 . 1 30 30 CYS C C 13 175.2 0.2 . 1 . . . . A 30 CYS C . 30660 1 355 . 1 . 1 30 30 CYS CA C 13 55.2 0.2 . 1 . . . . A 30 CYS CA . 30660 1 356 . 1 . 1 30 30 CYS CB C 13 39.5 0.2 . 1 . . . . A 30 CYS CB . 30660 1 357 . 1 . 1 30 30 CYS N N 15 120.2 0.2 . 1 . . . . A 30 CYS N . 30660 1 358 . 1 . 1 31 31 VAL H H 1 9.44 0.02 . 1 . . . . A 31 VAL H . 30660 1 359 . 1 . 1 31 31 VAL HA H 1 4.53 0.02 . 1 . . . . A 31 VAL HA . 30660 1 360 . 1 . 1 31 31 VAL HB H 1 2.14 0.02 . 1 . . . . A 31 VAL HB . 30660 1 361 . 1 . 1 31 31 VAL HG11 H 1 1.00 0.02 . 2 . . . . A 31 VAL HG11 . 30660 1 362 . 1 . 1 31 31 VAL HG12 H 1 1.00 0.02 . 2 . . . . A 31 VAL HG12 . 30660 1 363 . 1 . 1 31 31 VAL HG13 H 1 1.00 0.02 . 2 . . . . A 31 VAL HG13 . 30660 1 364 . 1 . 1 31 31 VAL HG21 H 1 0.97 0.02 . 2 . . . . A 31 VAL HG21 . 30660 1 365 . 1 . 1 31 31 VAL HG22 H 1 0.97 0.02 . 2 . . . . A 31 VAL HG22 . 30660 1 366 . 1 . 1 31 31 VAL HG23 H 1 0.97 0.02 . 2 . . . . A 31 VAL HG23 . 30660 1 367 . 1 . 1 31 31 VAL C C 13 175.1 0.2 . 1 . . . . A 31 VAL C . 30660 1 368 . 1 . 1 31 31 VAL CA C 13 61.0 0.2 . 1 . . . . A 31 VAL CA . 30660 1 369 . 1 . 1 31 31 VAL CB C 13 34.5 0.2 . 1 . . . . A 31 VAL CB . 30660 1 370 . 1 . 1 31 31 VAL CG1 C 13 21.4 0.2 . 2 . . . . A 31 VAL CG1 . 30660 1 371 . 1 . 1 31 31 VAL CG2 C 13 20.9 0.2 . 2 . . . . A 31 VAL CG2 . 30660 1 372 . 1 . 1 31 31 VAL N N 15 123.3 0.2 . 1 . . . . A 31 VAL N . 30660 1 373 . 1 . 1 32 32 ARG H H 1 8.79 0.02 . 1 . . . . A 32 ARG H . 30660 1 374 . 1 . 1 32 32 ARG HA H 1 4.90 0.02 . 1 . . . . A 32 ARG HA . 30660 1 375 . 1 . 1 32 32 ARG HB2 H 1 1.68 0.02 . 2 . . . . A 32 ARG HB2 . 30660 1 376 . 1 . 1 32 32 ARG HB3 H 1 1.68 0.02 . 2 . . . . A 32 ARG HB3 . 30660 1 377 . 1 . 1 32 32 ARG HG2 H 1 1.55 0.02 . 2 . . . . A 32 ARG HG2 . 30660 1 378 . 1 . 1 32 32 ARG HG3 H 1 1.55 0.02 . 2 . . . . A 32 ARG HG3 . 30660 1 379 . 1 . 1 32 32 ARG C C 13 175.5 0.2 . 1 . . . . A 32 ARG C . 30660 1 380 . 1 . 1 32 32 ARG CA C 13 55.7 0.2 . 1 . . . . A 32 ARG CA . 30660 1 381 . 1 . 1 32 32 ARG CB C 13 32.3 0.2 . 1 . . . . A 32 ARG CB . 30660 1 382 . 1 . 1 32 32 ARG CG C 13 27.4 0.2 . 1 . . . . A 32 ARG CG . 30660 1 383 . 1 . 1 32 32 ARG CD C 13 43.2 0.2 . 1 . . . . A 32 ARG CD . 30660 1 384 . 1 . 1 32 32 ARG N N 15 124.2 0.2 . 1 . . . . A 32 ARG N . 30660 1 385 . 1 . 1 33 33 ARG H H 1 8.58 0.02 . 1 . . . . A 33 ARG H . 30660 1 386 . 1 . 1 33 33 ARG HA H 1 4.55 0.02 . 1 . . . . A 33 ARG HA . 30660 1 387 . 1 . 1 33 33 ARG C C 13 175.0 0.2 . 1 . . . . A 33 ARG C . 30660 1 388 . 1 . 1 33 33 ARG CA C 13 55.5 0.2 . 1 . . . . A 33 ARG CA . 30660 1 389 . 1 . 1 33 33 ARG CB C 13 32.4 0.2 . 1 . . . . A 33 ARG CB . 30660 1 390 . 1 . 1 33 33 ARG CG C 13 27.2 0.2 . 1 . . . . A 33 ARG CG . 30660 1 391 . 1 . 1 33 33 ARG CD C 13 43.3 0.2 . 1 . . . . A 33 ARG CD . 30660 1 392 . 1 . 1 33 33 ARG N N 15 122.4 0.2 . 1 . . . . A 33 ARG N . 30660 1 393 . 1 . 1 34 34 ARG H H 1 8.76 0.02 . 1 . . . . A 34 ARG H . 30660 1 394 . 1 . 1 34 34 ARG HA H 1 4.05 0.02 . 1 . . . . A 34 ARG HA . 30660 1 395 . 1 . 1 34 34 ARG HB2 H 1 1.76 0.02 . 2 . . . . A 34 ARG HB2 . 30660 1 396 . 1 . 1 34 34 ARG HB3 H 1 1.62 0.02 . 2 . . . . A 34 ARG HB3 . 30660 1 397 . 1 . 1 34 34 ARG HG2 H 1 1.47 0.02 . 2 . . . . A 34 ARG HG2 . 30660 1 398 . 1 . 1 34 34 ARG HG3 H 1 1.47 0.02 . 2 . . . . A 34 ARG HG3 . 30660 1 399 . 1 . 1 34 34 ARG C C 13 176.0 0.2 . 1 . . . . A 34 ARG C . 30660 1 400 . 1 . 1 34 34 ARG CA C 13 56.4 0.2 . 1 . . . . A 34 ARG CA . 30660 1 401 . 1 . 1 34 34 ARG CB C 13 30.8 0.2 . 1 . . . . A 34 ARG CB . 30660 1 402 . 1 . 1 34 34 ARG CG C 13 27.4 0.2 . 1 . . . . A 34 ARG CG . 30660 1 403 . 1 . 1 34 34 ARG CD C 13 43.2 0.2 . 1 . . . . A 34 ARG CD . 30660 1 404 . 1 . 1 34 34 ARG N N 15 125.4 0.2 . 1 . . . . A 34 ARG N . 30660 1 405 . 1 . 1 35 35 ILE H H 1 8.34 0.02 . 1 . . . . A 35 ILE H . 30660 1 406 . 1 . 1 35 35 ILE HA H 1 4.09 0.02 . 1 . . . . A 35 ILE HA . 30660 1 407 . 1 . 1 35 35 ILE HB H 1 1.79 0.02 . 1 . . . . A 35 ILE HB . 30660 1 408 . 1 . 1 35 35 ILE HG12 H 1 1.37 0.02 . 2 . . . . A 35 ILE HG12 . 30660 1 409 . 1 . 1 35 35 ILE HG13 H 1 1.04 0.02 . 2 . . . . A 35 ILE HG13 . 30660 1 410 . 1 . 1 35 35 ILE HG21 H 1 0.88 0.02 . 1 . . . . A 35 ILE HG21 . 30660 1 411 . 1 . 1 35 35 ILE HG22 H 1 0.88 0.02 . 1 . . . . A 35 ILE HG22 . 30660 1 412 . 1 . 1 35 35 ILE HG23 H 1 0.88 0.02 . 1 . . . . A 35 ILE HG23 . 30660 1 413 . 1 . 1 35 35 ILE HD11 H 1 0.82 0.02 . 1 . . . . A 35 ILE HD11 . 30660 1 414 . 1 . 1 35 35 ILE HD12 H 1 0.82 0.02 . 1 . . . . A 35 ILE HD12 . 30660 1 415 . 1 . 1 35 35 ILE HD13 H 1 0.82 0.02 . 1 . . . . A 35 ILE HD13 . 30660 1 416 . 1 . 1 35 35 ILE C C 13 175.0 0.2 . 1 . . . . A 35 ILE C . 30660 1 417 . 1 . 1 35 35 ILE CA C 13 61.8 0.2 . 1 . . . . A 35 ILE CA . 30660 1 418 . 1 . 1 35 35 ILE CB C 13 38.8 0.2 . 1 . . . . A 35 ILE CB . 30660 1 419 . 1 . 1 35 35 ILE CG1 C 13 27.5 0.2 . 1 . . . . A 35 ILE CG1 . 30660 1 420 . 1 . 1 35 35 ILE CG2 C 13 17.5 0.2 . 1 . . . . A 35 ILE CG2 . 30660 1 421 . 1 . 1 35 35 ILE CD1 C 13 13.2 0.2 . 1 . . . . A 35 ILE CD1 . 30660 1 422 . 1 . 1 35 35 ILE N N 15 123.7 0.2 . 1 . . . . A 35 ILE N . 30660 1 423 . 1 . 1 36 36 ARG H H 1 7.85 0.02 . 1 . . . . A 36 ARG H . 30660 1 424 . 1 . 1 36 36 ARG HA H 1 4.11 0.02 . 1 . . . . A 36 ARG HA . 30660 1 425 . 1 . 1 36 36 ARG HB2 H 1 1.82 0.02 . 2 . . . . A 36 ARG HB2 . 30660 1 426 . 1 . 1 36 36 ARG HB3 H 1 1.72 0.02 . 2 . . . . A 36 ARG HB3 . 30660 1 427 . 1 . 1 36 36 ARG HG2 H 1 1.57 0.02 . 2 . . . . A 36 ARG HG2 . 30660 1 428 . 1 . 1 36 36 ARG HG3 H 1 1.57 0.02 . 2 . . . . A 36 ARG HG3 . 30660 1 429 . 1 . 1 36 36 ARG CA C 13 57.4 0.2 . 1 . . . . A 36 ARG CA . 30660 1 430 . 1 . 1 36 36 ARG CB C 13 31.6 0.2 . 1 . . . . A 36 ARG CB . 30660 1 431 . 1 . 1 36 36 ARG N N 15 127.7 0.2 . 1 . . . . A 36 ARG N . 30660 1 stop_ save_