################################### # 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 15338 _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 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 1H-15N HSQC' . . . 15338 1 11 '3D 1H-15N NOESY' . . . 15338 1 12 '3D 1H-13C NOESY' . . . 15338 1 14 '3D aromatic 1H-13C NOESY' . . . 15338 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $NMRPipe . . 15338 1 2 $SPARKY . . 15338 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 MET HA H 1 4.17 0.02 . 1 . . . . 1 MET HA . 15338 1 2 . 1 1 1 1 MET HB2 H 1 2.21 0.02 . 2 . . . . 1 MET HB2 . 15338 1 3 . 1 1 1 1 MET HB3 H 1 2.21 0.02 . 2 . . . . 1 MET HB3 . 15338 1 4 . 1 1 1 1 MET C C 13 171.9 0.2 . 1 . . . . 1 MET C . 15338 1 5 . 1 1 1 1 MET CA C 13 55.1 0.2 . 1 . . . . 1 MET CA . 15338 1 6 . 1 1 1 1 MET CB C 13 32.9 0.2 . 1 . . . . 1 MET CB . 15338 1 7 . 1 1 2 2 GLU H H 1 8.85 0.02 . 1 . . . . 2 GLU H . 15338 1 8 . 1 1 2 2 GLU HA H 1 4.45 0.02 . 1 . . . . 2 GLU HA . 15338 1 9 . 1 1 2 2 GLU HB2 H 1 1.92 0.02 . 2 . . . . 2 GLU HB2 . 15338 1 10 . 1 1 2 2 GLU HB3 H 1 2.02 0.02 . 2 . . . . 2 GLU HB3 . 15338 1 11 . 1 1 2 2 GLU HG2 H 1 2.24 0.02 . 2 . . . . 2 GLU HG2 . 15338 1 12 . 1 1 2 2 GLU HG3 H 1 2.31 0.02 . 2 . . . . 2 GLU HG3 . 15338 1 13 . 1 1 2 2 GLU C C 13 175.4 0.2 . 1 . . . . 2 GLU C . 15338 1 14 . 1 1 2 2 GLU CA C 13 55.9 0.2 . 1 . . . . 2 GLU CA . 15338 1 15 . 1 1 2 2 GLU CB C 13 30.3 0.2 . 1 . . . . 2 GLU CB . 15338 1 16 . 1 1 2 2 GLU CG C 13 35.4 0.2 . 1 . . . . 2 GLU CG . 15338 1 17 . 1 1 2 2 GLU N N 15 123.6 0.2 . 1 . . . . 2 GLU N . 15338 1 18 . 1 1 3 3 ILE H H 1 8.59 0.02 . 1 . . . . 3 ILE H . 15338 1 19 . 1 1 3 3 ILE HA H 1 4.31 0.02 . 1 . . . . 3 ILE HA . 15338 1 20 . 1 1 3 3 ILE HB H 1 1.61 0.02 . 1 . . . . 3 ILE HB . 15338 1 21 . 1 1 3 3 ILE HD11 H 1 0.63 0.02 . 1 . . . . 3 ILE HD1 . 15338 1 22 . 1 1 3 3 ILE HD12 H 1 0.63 0.02 . 1 . . . . 3 ILE HD1 . 15338 1 23 . 1 1 3 3 ILE HD13 H 1 0.63 0.02 . 1 . . . . 3 ILE HD1 . 15338 1 24 . 1 1 3 3 ILE HG12 H 1 1.04 0.02 . 2 . . . . 3 ILE HG12 . 15338 1 25 . 1 1 3 3 ILE HG13 H 1 1.54 0.02 . 2 . . . . 3 ILE HG13 . 15338 1 26 . 1 1 3 3 ILE HG21 H 1 0.78 0.02 . 1 . . . . 3 ILE HG2 . 15338 1 27 . 1 1 3 3 ILE HG22 H 1 0.78 0.02 . 1 . . . . 3 ILE HG2 . 15338 1 28 . 1 1 3 3 ILE HG23 H 1 0.78 0.02 . 1 . . . . 3 ILE HG2 . 15338 1 29 . 1 1 3 3 ILE C C 13 175.1 0.2 . 1 . . . . 3 ILE C . 15338 1 30 . 1 1 3 3 ILE CA C 13 60.7 0.2 . 1 . . . . 3 ILE CA . 15338 1 31 . 1 1 3 3 ILE CB C 13 39.5 0.2 . 1 . . . . 3 ILE CB . 15338 1 32 . 1 1 3 3 ILE CD1 C 13 14.3 0.2 . 1 . . . . 3 ILE CD1 . 15338 1 33 . 1 1 3 3 ILE CG1 C 13 26.6 0.2 . 1 . . . . 3 ILE CG1 . 15338 1 34 . 1 1 3 3 ILE CG2 C 13 18.4 0.2 . 1 . . . . 3 ILE CG2 . 15338 1 35 . 1 1 3 3 ILE N N 15 122.1 0.2 . 1 . . . . 3 ILE N . 15338 1 36 . 1 1 4 4 THR H H 1 8.13 0.02 . 1 . . . . 4 THR H . 15338 1 37 . 1 1 4 4 THR HA H 1 4.54 0.02 . 1 . . . . 4 THR HA . 15338 1 38 . 1 1 4 4 THR HB H 1 3.62 0.02 . 1 . . . . 4 THR HB . 15338 1 39 . 1 1 4 4 THR HG21 H 1 0.92 0.02 . 1 . . . . 4 THR HG2 . 15338 1 40 . 1 1 4 4 THR HG22 H 1 0.92 0.02 . 1 . . . . 4 THR HG2 . 15338 1 41 . 1 1 4 4 THR HG23 H 1 0.92 0.02 . 1 . . . . 4 THR HG2 . 15338 1 42 . 1 1 4 4 THR C C 13 173.0 0.2 . 1 . . . . 4 THR C . 15338 1 43 . 1 1 4 4 THR CA C 13 59.7 0.2 . 1 . . . . 4 THR CA . 15338 1 44 . 1 1 4 4 THR CB C 13 71.4 0.2 . 1 . . . . 4 THR CB . 15338 1 45 . 1 1 4 4 THR CG2 C 13 21.6 0.2 . 1 . . . . 4 THR CG2 . 15338 1 46 . 1 1 4 4 THR N N 15 116.8 0.2 . 1 . . . . 4 THR N . 15338 1 47 . 1 1 5 5 CYS H H 1 8.70 0.02 . 1 . . . . 5 CYS H . 15338 1 48 . 1 1 5 5 CYS HA H 1 3.96 0.02 . 1 . . . . 5 CYS HA . 15338 1 49 . 1 1 5 5 CYS HB2 H 1 2.79 0.02 . 2 . . . . 5 CYS HB2 . 15338 1 50 . 1 1 5 5 CYS HB3 H 1 3.13 0.02 . 2 . . . . 5 CYS HB3 . 15338 1 51 . 1 1 5 5 CYS CA C 13 56.8 0.2 . 1 . . . . 5 CYS CA . 15338 1 52 . 1 1 5 5 CYS CB C 13 32.0 0.2 . 1 . . . . 5 CYS CB . 15338 1 53 . 1 1 5 5 CYS N N 15 125.6 0.2 . 1 . . . . 5 CYS N . 15338 1 54 . 1 1 6 6 PRO HA H 1 4.26 0.02 . 1 . . . . 6 PRO HA . 15338 1 55 . 1 1 6 6 PRO HB2 H 1 1.93 0.02 . 2 . . . . 6 PRO HB2 . 15338 1 56 . 1 1 6 6 PRO HB3 H 1 2.19 0.02 . 2 . . . . 6 PRO HB3 . 15338 1 57 . 1 1 6 6 PRO HD2 H 1 3.19 0.02 . 2 . . . . 6 PRO HD2 . 15338 1 58 . 1 1 6 6 PRO HD3 H 1 3.54 0.02 . 2 . . . . 6 PRO HD3 . 15338 1 59 . 1 1 6 6 PRO HG2 H 1 1.75 0.02 . 2 . . . . 6 PRO HG2 . 15338 1 60 . 1 1 6 6 PRO HG3 H 1 1.75 0.02 . 2 . . . . 6 PRO HG3 . 15338 1 61 . 1 1 6 6 PRO C C 13 176.0 0.2 . 1 . . . . 6 PRO C . 15338 1 62 . 1 1 6 6 PRO CA C 13 63.9 0.2 . 1 . . . . 6 PRO CA . 15338 1 63 . 1 1 6 6 PRO CB C 13 32.1 0.2 . 1 . . . . 6 PRO CB . 15338 1 64 . 1 1 6 6 PRO CD C 13 50.5 0.2 . 1 . . . . 6 PRO CD . 15338 1 65 . 1 1 6 6 PRO CG C 13 27.2 0.2 . 1 . . . . 6 PRO CG . 15338 1 66 . 1 1 7 7 VAL H H 1 9.21 0.02 . 1 . . . . 7 VAL H . 15338 1 67 . 1 1 7 7 VAL HA H 1 3.82 0.02 . 1 . . . . 7 VAL HA . 15338 1 68 . 1 1 7 7 VAL HB H 1 2.41 0.02 . 1 . . . . 7 VAL HB . 15338 1 69 . 1 1 7 7 VAL HG11 H 1 0.78 0.02 . 2 . . . . 7 VAL HG1 . 15338 1 70 . 1 1 7 7 VAL HG12 H 1 0.78 0.02 . 2 . . . . 7 VAL HG1 . 15338 1 71 . 1 1 7 7 VAL HG13 H 1 0.78 0.02 . 2 . . . . 7 VAL HG1 . 15338 1 72 . 1 1 7 7 VAL HG21 H 1 0.93 0.02 . 2 . . . . 7 VAL HG2 . 15338 1 73 . 1 1 7 7 VAL HG22 H 1 0.93 0.02 . 2 . . . . 7 VAL HG2 . 15338 1 74 . 1 1 7 7 VAL HG23 H 1 0.93 0.02 . 2 . . . . 7 VAL HG2 . 15338 1 75 . 1 1 7 7 VAL CA C 13 64.9 0.2 . 1 . . . . 7 VAL CA . 15338 1 76 . 1 1 7 7 VAL CB C 13 32.2 0.2 . 1 . . . . 7 VAL CB . 15338 1 77 . 1 1 7 7 VAL CG1 C 13 21.1 0.02 . 2 . . . . 7 VAL CG1 . 15338 1 78 . 1 1 7 7 VAL CG2 C 13 21.2 0.02 . 2 . . . . 7 VAL CG2 . 15338 1 79 . 1 1 7 7 VAL N N 15 122.5 0.2 . 1 . . . . 7 VAL N . 15338 1 80 . 1 1 8 8 CYS HA H 1 4.56 0.02 . 1 . . . . 8 CYS HA . 15338 1 81 . 1 1 8 8 CYS HB2 H 1 2.44 0.02 . 2 . . . . 8 CYS HB2 . 15338 1 82 . 1 1 8 8 CYS HB3 H 1 3.00 0.02 . 2 . . . . 8 CYS HB3 . 15338 1 83 . 1 1 8 8 CYS C C 13 176.8 0.2 . 1 . . . . 8 CYS C . 15338 1 84 . 1 1 8 8 CYS CA C 13 58.9 0.2 . 1 . . . . 8 CYS CA . 15338 1 85 . 1 1 8 8 CYS CB C 13 32.0 0.2 . 1 . . . . 8 CYS CB . 15338 1 86 . 1 1 9 9 HIS H H 1 7.55 0.02 . 1 . . . . 9 HIS H . 15338 1 87 . 1 1 9 9 HIS HA H 1 4.47 0.02 . 1 . . . . 9 HIS HA . 15338 1 88 . 1 1 9 9 HIS HB2 H 1 3.36 0.02 . 2 . . . . 9 HIS HB2 . 15338 1 89 . 1 1 9 9 HIS HB3 H 1 3.47 0.02 . 2 . . . . 9 HIS HB3 . 15338 1 90 . 1 1 9 9 HIS HD2 H 1 7.07 0.02 . 1 . . . . 9 HIS HD2 . 15338 1 91 . 1 1 9 9 HIS CA C 13 56.9 0.2 . 1 . . . . 9 HIS CA . 15338 1 92 . 1 1 9 9 HIS CB C 13 25.9 0.2 . 1 . . . . 9 HIS CB . 15338 1 93 . 1 1 9 9 HIS CD2 C 13 119.5 0.2 . 1 . . . . 9 HIS CD2 . 15338 1 94 . 1 1 9 9 HIS N N 15 115.0 0.2 . 1 . . . . 9 HIS N . 15338 1 95 . 1 1 10 10 HIS HA H 1 4.79 0.02 . 1 . . . . 10 HIS HA . 15338 1 96 . 1 1 10 10 HIS HB2 H 1 3.32 0.02 . 2 . . . . 10 HIS HB2 . 15338 1 97 . 1 1 10 10 HIS HB3 H 1 3.56 0.02 . 2 . . . . 10 HIS HB3 . 15338 1 98 . 1 1 10 10 HIS HD2 H 1 7.47 0.02 . 1 . . . . 10 HIS HD2 . 15338 1 99 . 1 1 10 10 HIS HE1 H 1 8.69 0.02 . 1 . . . . 10 HIS HE1 . 15338 1 100 . 1 1 10 10 HIS C C 13 174.7 0.2 . 1 . . . . 10 HIS C . 15338 1 101 . 1 1 10 10 HIS CA C 13 55.7 0.2 . 1 . . . . 10 HIS CA . 15338 1 102 . 1 1 10 10 HIS CB C 13 29.8 0.2 . 1 . . . . 10 HIS CB . 15338 1 103 . 1 1 10 10 HIS CD2 C 13 119.9 0.2 . 1 . . . . 10 HIS CD2 . 15338 1 104 . 1 1 10 10 HIS CE1 C 13 135.3 0.2 . 1 . . . . 10 HIS CE1 . 15338 1 105 . 1 1 11 11 ALA H H 1 8.79 0.02 . 1 . . . . 11 ALA H . 15338 1 106 . 1 1 11 11 ALA HA H 1 4.31 0.02 . 1 . . . . 11 ALA HA . 15338 1 107 . 1 1 11 11 ALA HB1 H 1 1.41 0.02 . 1 . . . . 11 ALA HB . 15338 1 108 . 1 1 11 11 ALA HB2 H 1 1.41 0.02 . 1 . . . . 11 ALA HB . 15338 1 109 . 1 1 11 11 ALA HB3 H 1 1.41 0.02 . 1 . . . . 11 ALA HB . 15338 1 110 . 1 1 11 11 ALA C C 13 177.8 0.2 . 1 . . . . 11 ALA C . 15338 1 111 . 1 1 11 11 ALA CA C 13 53.4 0.2 . 1 . . . . 11 ALA CA . 15338 1 112 . 1 1 11 11 ALA CB C 13 18.6 0.2 . 1 . . . . 11 ALA CB . 15338 1 113 . 1 1 11 11 ALA N N 15 124.5 0.2 . 1 . . . . 11 ALA N . 15338 1 114 . 1 1 12 12 LEU H H 1 8.48 0.02 . 1 . . . . 12 LEU H . 15338 1 115 . 1 1 12 12 LEU HA H 1 4.64 0.02 . 1 . . . . 12 LEU HA . 15338 1 116 . 1 1 12 12 LEU HB2 H 1 1.17 0.02 . 2 . . . . 12 LEU HB2 . 15338 1 117 . 1 1 12 12 LEU HB3 H 1 1.45 0.02 . 2 . . . . 12 LEU HB3 . 15338 1 118 . 1 1 12 12 LEU HD11 H 1 0.40 0.02 . 2 . . . . 12 LEU HD1 . 15338 1 119 . 1 1 12 12 LEU HD12 H 1 0.40 0.02 . 2 . . . . 12 LEU HD1 . 15338 1 120 . 1 1 12 12 LEU HD13 H 1 0.40 0.02 . 2 . . . . 12 LEU HD1 . 15338 1 121 . 1 1 12 12 LEU HD21 H 1 0.81 0.02 . 2 . . . . 12 LEU HD2 . 15338 1 122 . 1 1 12 12 LEU HD22 H 1 0.81 0.02 . 2 . . . . 12 LEU HD2 . 15338 1 123 . 1 1 12 12 LEU HD23 H 1 0.81 0.02 . 2 . . . . 12 LEU HD2 . 15338 1 124 . 1 1 12 12 LEU HG H 1 1.51 0.02 . 1 . . . . 12 LEU HG . 15338 1 125 . 1 1 12 12 LEU C C 13 176.9 0.2 . 1 . . . . 12 LEU C . 15338 1 126 . 1 1 12 12 LEU CA C 13 53.5 0.2 . 1 . . . . 12 LEU CA . 15338 1 127 . 1 1 12 12 LEU CB C 13 44.1 0.2 . 1 . . . . 12 LEU CB . 15338 1 128 . 1 1 12 12 LEU CD1 C 13 26.4 0.02 . 2 . . . . 12 LEU CD1 . 15338 1 129 . 1 1 12 12 LEU CD2 C 13 24.3 0.02 . 2 . . . . 12 LEU CD2 . 15338 1 130 . 1 1 12 12 LEU CG C 13 26.7 0.2 . 1 . . . . 12 LEU CG . 15338 1 131 . 1 1 12 12 LEU N N 15 121.2 0.2 . 1 . . . . 12 LEU N . 15338 1 132 . 1 1 13 13 GLU H H 1 8.60 0.02 . 1 . . . . 13 GLU H . 15338 1 133 . 1 1 13 13 GLU HA H 1 4.59 0.02 . 1 . . . . 13 GLU HA . 15338 1 134 . 1 1 13 13 GLU HB2 H 1 2.12 0.02 . 2 . . . . 13 GLU HB2 . 15338 1 135 . 1 1 13 13 GLU HB3 H 1 2.12 0.02 . 2 . . . . 13 GLU HB3 . 15338 1 136 . 1 1 13 13 GLU HG2 H 1 2.37 0.02 . 2 . . . . 13 GLU HG2 . 15338 1 137 . 1 1 13 13 GLU HG3 H 1 2.47 0.02 . 2 . . . . 13 GLU HG3 . 15338 1 138 . 1 1 13 13 GLU C C 13 175.7 0.2 . 1 . . . . 13 GLU C . 15338 1 139 . 1 1 13 13 GLU CA C 13 54.7 0.2 . 1 . . . . 13 GLU CA . 15338 1 140 . 1 1 13 13 GLU CB C 13 30.2 0.2 . 1 . . . . 13 GLU CB . 15338 1 141 . 1 1 13 13 GLU CG C 13 34.4 0.2 . 1 . . . . 13 GLU CG . 15338 1 142 . 1 1 13 13 GLU N N 15 120.3 0.2 . 1 . . . . 13 GLU N . 15338 1 143 . 1 1 14 14 ARG H H 1 9.01 0.02 . 1 . . . . 14 ARG H . 15338 1 144 . 1 1 14 14 ARG HA H 1 4.46 0.02 . 1 . . . . 14 ARG HA . 15338 1 145 . 1 1 14 14 ARG HB2 H 1 1.44 0.02 . 2 . . . . 14 ARG HB2 . 15338 1 146 . 1 1 14 14 ARG HB3 H 1 1.79 0.02 . 2 . . . . 14 ARG HB3 . 15338 1 147 . 1 1 14 14 ARG HD2 H 1 2.53 0.02 . 2 . . . . 14 ARG HD2 . 15338 1 148 . 1 1 14 14 ARG HD3 H 1 2.56 0.02 . 2 . . . . 14 ARG HD3 . 15338 1 149 . 1 1 14 14 ARG HG2 H 1 1.30 0.02 . 2 . . . . 14 ARG HG2 . 15338 1 150 . 1 1 14 14 ARG HG3 H 1 1.33 0.02 . 2 . . . . 14 ARG HG3 . 15338 1 151 . 1 1 14 14 ARG C C 13 174.9 0.2 . 1 . . . . 14 ARG C . 15338 1 152 . 1 1 14 14 ARG CA C 13 56.4 0.2 . 1 . . . . 14 ARG CA . 15338 1 153 . 1 1 14 14 ARG CB C 13 31.8 0.2 . 1 . . . . 14 ARG CB . 15338 1 154 . 1 1 14 14 ARG CD C 13 43.0 0.2 . 1 . . . . 14 ARG CD . 15338 1 155 . 1 1 14 14 ARG CG C 13 27.6 0.2 . 1 . . . . 14 ARG CG . 15338 1 156 . 1 1 14 14 ARG N N 15 126.5 0.2 . 1 . . . . 14 ARG N . 15338 1 157 . 1 1 15 15 ASN H H 1 8.67 0.02 . 1 . . . . 15 ASN H . 15338 1 158 . 1 1 15 15 ASN HA H 1 4.85 0.02 . 1 . . . . 15 ASN HA . 15338 1 159 . 1 1 15 15 ASN HB2 H 1 2.56 0.02 . 2 . . . . 15 ASN HB2 . 15338 1 160 . 1 1 15 15 ASN HB3 H 1 2.66 0.02 . 2 . . . . 15 ASN HB3 . 15338 1 161 . 1 1 15 15 ASN C C 13 174.9 0.2 . 1 . . . . 15 ASN C . 15338 1 162 . 1 1 15 15 ASN CA C 13 52.1 0.2 . 1 . . . . 15 ASN CA . 15338 1 163 . 1 1 15 15 ASN CB C 13 39.2 0.2 . 1 . . . . 15 ASN CB . 15338 1 164 . 1 1 15 15 ASN N N 15 125.1 0.2 . 1 . . . . 15 ASN N . 15338 1 165 . 1 1 16 16 GLY H H 1 8.88 0.02 . 1 . . . . 16 GLY H . 15338 1 166 . 1 1 16 16 GLY HA2 H 1 3.57 0.02 . 2 . . . . 16 GLY HA2 . 15338 1 167 . 1 1 16 16 GLY HA3 H 1 4.00 0.02 . 2 . . . . 16 GLY HA3 . 15338 1 168 . 1 1 16 16 GLY C C 13 173.7 0.2 . 1 . . . . 16 GLY C . 15338 1 169 . 1 1 16 16 GLY CA C 13 47.2 0.2 . 1 . . . . 16 GLY CA . 15338 1 170 . 1 1 16 16 GLY N N 15 114.4 0.2 . 1 . . . . 16 GLY N . 15338 1 171 . 1 1 17 17 ASP H H 1 8.60 0.02 . 1 . . . . 17 ASP H . 15338 1 172 . 1 1 17 17 ASP HA H 1 4.60 0.02 . 1 . . . . 17 ASP HA . 15338 1 173 . 1 1 17 17 ASP HB2 H 1 2.93 0.02 . 2 . . . . 17 ASP HB2 . 15338 1 174 . 1 1 17 17 ASP HB3 H 1 2.93 0.02 . 2 . . . . 17 ASP HB3 . 15338 1 175 . 1 1 17 17 ASP C C 13 174.8 0.2 . 1 . . . . 17 ASP C . 15338 1 176 . 1 1 17 17 ASP CA C 13 53.8 0.2 . 1 . . . . 17 ASP CA . 15338 1 177 . 1 1 17 17 ASP CB C 13 40.2 0.2 . 1 . . . . 17 ASP CB . 15338 1 178 . 1 1 17 17 ASP N N 15 126.4 0.2 . 1 . . . . 17 ASP N . 15338 1 179 . 1 1 18 18 THR H H 1 7.71 0.02 . 1 . . . . 18 THR H . 15338 1 180 . 1 1 18 18 THR HA H 1 5.12 0.02 . 1 . . . . 18 THR HA . 15338 1 181 . 1 1 18 18 THR HB H 1 4.15 0.02 . 1 . . . . 18 THR HB . 15338 1 182 . 1 1 18 18 THR HG21 H 1 1.18 0.02 . 1 . . . . 18 THR HG2 . 15338 1 183 . 1 1 18 18 THR HG22 H 1 1.18 0.02 . 1 . . . . 18 THR HG2 . 15338 1 184 . 1 1 18 18 THR HG23 H 1 1.18 0.02 . 1 . . . . 18 THR HG2 . 15338 1 185 . 1 1 18 18 THR C C 13 171.9 0.2 . 1 . . . . 18 THR C . 15338 1 186 . 1 1 18 18 THR CA C 13 60.4 0.2 . 1 . . . . 18 THR CA . 15338 1 187 . 1 1 18 18 THR CB C 13 72.3 0.2 . 1 . . . . 18 THR CB . 15338 1 188 . 1 1 18 18 THR CG2 C 13 21.4 0.2 . 1 . . . . 18 THR CG2 . 15338 1 189 . 1 1 18 18 THR N N 15 112.3 0.2 . 1 . . . . 18 THR N . 15338 1 190 . 1 1 19 19 ALA H H 1 9.09 0.02 . 1 . . . . 19 ALA H . 15338 1 191 . 1 1 19 19 ALA HA H 1 5.25 0.02 . 1 . . . . 19 ALA HA . 15338 1 192 . 1 1 19 19 ALA HB1 H 1 1.21 0.02 . 1 . . . . 19 ALA HB . 15338 1 193 . 1 1 19 19 ALA HB2 H 1 1.21 0.02 . 1 . . . . 19 ALA HB . 15338 1 194 . 1 1 19 19 ALA HB3 H 1 1.21 0.02 . 1 . . . . 19 ALA HB . 15338 1 195 . 1 1 19 19 ALA C C 13 175.0 0.2 . 1 . . . . 19 ALA C . 15338 1 196 . 1 1 19 19 ALA CA C 13 50.3 0.2 . 1 . . . . 19 ALA CA . 15338 1 197 . 1 1 19 19 ALA CB C 13 23.9 0.2 . 1 . . . . 19 ALA CB . 15338 1 198 . 1 1 19 19 ALA N N 15 123.3 0.2 . 1 . . . . 19 ALA N . 15338 1 199 . 1 1 20 20 HIS H H 1 9.13 0.02 . 1 . . . . 20 HIS H . 15338 1 200 . 1 1 20 20 HIS HA H 1 5.55 0.02 . 1 . . . . 20 HIS HA . 15338 1 201 . 1 1 20 20 HIS HB2 H 1 3.15 0.02 . 2 . . . . 20 HIS HB2 . 15338 1 202 . 1 1 20 20 HIS HB3 H 1 3.15 0.02 . 2 . . . . 20 HIS HB3 . 15338 1 203 . 1 1 20 20 HIS HD2 H 1 7.09 0.02 . 1 . . . . 20 HIS HD2 . 15338 1 204 . 1 1 20 20 HIS HE1 H 1 8.48 0.02 . 1 . . . . 20 HIS HE1 . 15338 1 205 . 1 1 20 20 HIS C C 13 173.1 0.2 . 1 . . . . 20 HIS C . 15338 1 206 . 1 1 20 20 HIS CA C 13 54.7 0.2 . 1 . . . . 20 HIS CA . 15338 1 207 . 1 1 20 20 HIS CB C 13 31.9 0.2 . 1 . . . . 20 HIS CB . 15338 1 208 . 1 1 20 20 HIS CD2 C 13 119.8 0.2 . 1 . . . . 20 HIS CD2 . 15338 1 209 . 1 1 20 20 HIS CE1 C 13 135.8 0.2 . 1 . . . . 20 HIS CE1 . 15338 1 210 . 1 1 20 20 HIS N N 15 120.0 0.2 . 1 . . . . 20 HIS N . 15338 1 211 . 1 1 21 21 CYS H H 1 8.91 0.02 . 1 . . . . 21 CYS H . 15338 1 212 . 1 1 21 21 CYS HA H 1 4.70 0.02 . 1 . . . . 21 CYS HA . 15338 1 213 . 1 1 21 21 CYS HB2 H 1 2.85 0.02 . 2 . . . . 21 CYS HB2 . 15338 1 214 . 1 1 21 21 CYS HB3 H 1 2.85 0.02 . 2 . . . . 21 CYS HB3 . 15338 1 215 . 1 1 21 21 CYS C C 13 176.4 0.2 . 1 . . . . 21 CYS C . 15338 1 216 . 1 1 21 21 CYS CA C 13 57.9 0.2 . 1 . . . . 21 CYS CA . 15338 1 217 . 1 1 21 21 CYS CB C 13 31.7 0.2 . 1 . . . . 21 CYS CB . 15338 1 218 . 1 1 21 21 CYS N N 15 129.2 0.2 . 1 . . . . 21 CYS N . 15338 1 219 . 1 1 22 22 GLU H H 1 9.03 0.02 . 1 . . . . 22 GLU H . 15338 1 220 . 1 1 22 22 GLU HA H 1 4.13 0.02 . 1 . . . . 22 GLU HA . 15338 1 221 . 1 1 22 22 GLU HB2 H 1 2.16 0.02 . 2 . . . . 22 GLU HB2 . 15338 1 222 . 1 1 22 22 GLU HB3 H 1 2.16 0.02 . 2 . . . . 22 GLU HB3 . 15338 1 223 . 1 1 22 22 GLU HG2 H 1 2.47 0.02 . 2 . . . . 22 GLU HG2 . 15338 1 224 . 1 1 22 22 GLU HG3 H 1 2.47 0.02 . 2 . . . . 22 GLU HG3 . 15338 1 225 . 1 1 22 22 GLU C C 13 177.4 0.2 . 1 . . . . 22 GLU C . 15338 1 226 . 1 1 22 22 GLU CA C 13 58.2 0.2 . 1 . . . . 22 GLU CA . 15338 1 227 . 1 1 22 22 GLU CB C 13 29.5 0.2 . 1 . . . . 22 GLU CB . 15338 1 228 . 1 1 22 22 GLU CG C 13 34.6 0.2 . 1 . . . . 22 GLU CG . 15338 1 229 . 1 1 22 22 GLU N N 15 128.8 0.2 . 1 . . . . 22 GLU N . 15338 1 230 . 1 1 23 23 THR H H 1 8.36 0.02 . 1 . . . . 23 THR H . 15338 1 231 . 1 1 23 23 THR HA H 1 3.92 0.02 . 1 . . . . 23 THR HA . 15338 1 232 . 1 1 23 23 THR HB H 1 4.49 0.02 . 1 . . . . 23 THR HB . 15338 1 233 . 1 1 23 23 THR HG21 H 1 1.10 0.02 . 1 . . . . 23 THR HG2 . 15338 1 234 . 1 1 23 23 THR HG22 H 1 1.10 0.02 . 1 . . . . 23 THR HG2 . 15338 1 235 . 1 1 23 23 THR HG23 H 1 1.10 0.02 . 1 . . . . 23 THR HG2 . 15338 1 236 . 1 1 23 23 THR C C 13 176.5 0.2 . 1 . . . . 23 THR C . 15338 1 237 . 1 1 23 23 THR CA C 13 66.8 0.2 . 1 . . . . 23 THR CA . 15338 1 238 . 1 1 23 23 THR CB C 13 69.1 0.2 . 1 . . . . 23 THR CB . 15338 1 239 . 1 1 23 23 THR CG2 C 13 21.7 0.2 . 1 . . . . 23 THR CG2 . 15338 1 240 . 1 1 23 23 THR N N 15 119.8 0.2 . 1 . . . . 23 THR N . 15338 1 241 . 1 1 24 24 CYS H H 1 9.57 0.02 . 1 . . . . 24 CYS H . 15338 1 242 . 1 1 24 24 CYS HA H 1 3.88 0.02 . 1 . . . . 24 CYS HA . 15338 1 243 . 1 1 24 24 CYS HB2 H 1 2.62 0.02 . 2 . . . . 24 CYS HB2 . 15338 1 244 . 1 1 24 24 CYS HB3 H 1 2.88 0.02 . 2 . . . . 24 CYS HB3 . 15338 1 245 . 1 1 24 24 CYS C C 13 174.9 0.2 . 1 . . . . 24 CYS C . 15338 1 246 . 1 1 24 24 CYS CA C 13 62.0 0.2 . 1 . . . . 24 CYS CA . 15338 1 247 . 1 1 24 24 CYS CB C 13 30.3 0.2 . 1 . . . . 24 CYS CB . 15338 1 248 . 1 1 24 24 CYS N N 15 123.6 0.2 . 1 . . . . 24 CYS N . 15338 1 249 . 1 1 25 25 ALA H H 1 7.72 0.02 . 1 . . . . 25 ALA H . 15338 1 250 . 1 1 25 25 ALA HA H 1 3.82 0.02 . 1 . . . . 25 ALA HA . 15338 1 251 . 1 1 25 25 ALA HB1 H 1 1.38 0.02 . 1 . . . . 25 ALA HB . 15338 1 252 . 1 1 25 25 ALA HB2 H 1 1.38 0.02 . 1 . . . . 25 ALA HB . 15338 1 253 . 1 1 25 25 ALA HB3 H 1 1.38 0.02 . 1 . . . . 25 ALA HB . 15338 1 254 . 1 1 25 25 ALA C C 13 175.4 0.2 . 1 . . . . 25 ALA C . 15338 1 255 . 1 1 25 25 ALA CA C 13 52.5 0.2 . 1 . . . . 25 ALA CA . 15338 1 256 . 1 1 25 25 ALA CB C 13 16.0 0.2 . 1 . . . . 25 ALA CB . 15338 1 257 . 1 1 25 25 ALA N N 15 121.4 0.2 . 1 . . . . 25 ALA N . 15338 1 258 . 1 1 26 26 LYS H H 1 6.91 0.02 . 1 . . . . 26 LYS H . 15338 1 259 . 1 1 26 26 LYS HA H 1 4.45 0.02 . 1 . . . . 26 LYS HA . 15338 1 260 . 1 1 26 26 LYS HB2 H 1 1.18 0.02 . 2 . . . . 26 LYS HB2 . 15338 1 261 . 1 1 26 26 LYS HB3 H 1 1.18 0.02 . 2 . . . . 26 LYS HB3 . 15338 1 262 . 1 1 26 26 LYS HD2 H 1 1.48 0.02 . 2 . . . . 26 LYS HD2 . 15338 1 263 . 1 1 26 26 LYS HD3 H 1 1.59 0.02 . 2 . . . . 26 LYS HD3 . 15338 1 264 . 1 1 26 26 LYS HE2 H 1 2.81 0.02 . 2 . . . . 26 LYS HE2 . 15338 1 265 . 1 1 26 26 LYS HE3 H 1 2.81 0.02 . 2 . . . . 26 LYS HE3 . 15338 1 266 . 1 1 26 26 LYS HG2 H 1 0.96 0.02 . 2 . . . . 26 LYS HG2 . 15338 1 267 . 1 1 26 26 LYS HG3 H 1 1.08 0.02 . 2 . . . . 26 LYS HG3 . 15338 1 268 . 1 1 26 26 LYS CA C 13 54.6 0.2 . 1 . . . . 26 LYS CA . 15338 1 269 . 1 1 26 26 LYS CB C 13 37.9 0.2 . 1 . . . . 26 LYS CB . 15338 1 270 . 1 1 26 26 LYS CD C 13 28.7 0.2 . 1 . . . . 26 LYS CD . 15338 1 271 . 1 1 26 26 LYS CE C 13 41.9 0.2 . 1 . . . . 26 LYS CE . 15338 1 272 . 1 1 26 26 LYS CG C 13 24.4 0.2 . 1 . . . . 26 LYS CG . 15338 1 273 . 1 1 26 26 LYS N N 15 116.1 0.2 . 1 . . . . 26 LYS N . 15338 1 274 . 1 1 27 27 ASP HA H 1 5.61 0.02 . 1 . . . . 27 ASP HA . 15338 1 275 . 1 1 27 27 ASP HB2 H 1 2.39 0.02 . 2 . . . . 27 ASP HB2 . 15338 1 276 . 1 1 27 27 ASP HB3 H 1 2.47 0.02 . 2 . . . . 27 ASP HB3 . 15338 1 277 . 1 1 27 27 ASP C C 13 174.4 0.2 . 1 . . . . 27 ASP C . 15338 1 278 . 1 1 27 27 ASP CA C 13 53.0 0.2 . 1 . . . . 27 ASP CA . 15338 1 279 . 1 1 27 27 ASP CB C 13 44.2 0.2 . 1 . . . . 27 ASP CB . 15338 1 280 . 1 1 28 28 PHE H H 1 9.20 0.02 . 1 . . . . 28 PHE H . 15338 1 281 . 1 1 28 28 PHE HA H 1 4.89 0.02 . 1 . . . . 28 PHE HA . 15338 1 282 . 1 1 28 28 PHE HB2 H 1 2.47 0.02 . 2 . . . . 28 PHE HB2 . 15338 1 283 . 1 1 28 28 PHE HB3 H 1 3.18 0.02 . 2 . . . . 28 PHE HB3 . 15338 1 284 . 1 1 28 28 PHE HD1 H 1 7.07 0.02 . 3 . . . . 28 PHE HD1 . 15338 1 285 . 1 1 28 28 PHE HD2 H 1 7.07 0.02 . 3 . . . . 28 PHE HD2 . 15338 1 286 . 1 1 28 28 PHE HE1 H 1 7.07 0.02 . 3 . . . . 28 PHE HE1 . 15338 1 287 . 1 1 28 28 PHE HE2 H 1 7.07 0.02 . 3 . . . . 28 PHE HE2 . 15338 1 288 . 1 1 28 28 PHE HZ H 1 7.29 0.02 . 1 . . . . 28 PHE HZ . 15338 1 289 . 1 1 28 28 PHE C C 13 175.5 0.2 . 1 . . . . 28 PHE C . 15338 1 290 . 1 1 28 28 PHE CA C 13 56.8 0.2 . 1 . . . . 28 PHE CA . 15338 1 291 . 1 1 28 28 PHE CB C 13 42.9 0.2 . 1 . . . . 28 PHE CB . 15338 1 292 . 1 1 28 28 PHE CD1 C 13 131.9 0.02 . 3 . . . . 28 PHE CD1 . 15338 1 293 . 1 1 28 28 PHE CD2 C 13 131.9 0.02 . 3 . . . . 28 PHE CD2 . 15338 1 294 . 1 1 28 28 PHE CE1 C 13 131.9 0.02 . 3 . . . . 28 PHE CE1 . 15338 1 295 . 1 1 28 28 PHE CE2 C 13 131.9 0.02 . 3 . . . . 28 PHE CE2 . 15338 1 296 . 1 1 28 28 PHE CZ C 13 131.3 0.2 . 1 . . . . 28 PHE CZ . 15338 1 297 . 1 1 28 28 PHE N N 15 118.1 0.2 . 1 . . . . 28 PHE N . 15338 1 298 . 1 1 29 29 SER H H 1 9.07 0.02 . 1 . . . . 29 SER H . 15338 1 299 . 1 1 29 29 SER HA H 1 4.75 0.02 . 1 . . . . 29 SER HA . 15338 1 300 . 1 1 29 29 SER HB2 H 1 3.93 0.02 . 2 . . . . 29 SER HB2 . 15338 1 301 . 1 1 29 29 SER HB3 H 1 3.93 0.02 . 2 . . . . 29 SER HB3 . 15338 1 302 . 1 1 29 29 SER C C 13 173.4 0.2 . 1 . . . . 29 SER C . 15338 1 303 . 1 1 29 29 SER CA C 13 58.4 0.2 . 1 . . . . 29 SER CA . 15338 1 304 . 1 1 29 29 SER CB C 13 64.1 0.2 . 1 . . . . 29 SER CB . 15338 1 305 . 1 1 29 29 SER N N 15 118.4 0.2 . 1 . . . . 29 SER N . 15338 1 306 . 1 1 30 30 LEU H H 1 8.18 0.02 . 1 . . . . 30 LEU H . 15338 1 307 . 1 1 30 30 LEU HA H 1 5.20 0.02 . 1 . . . . 30 LEU HA . 15338 1 308 . 1 1 30 30 LEU HB2 H 1 1.31 0.02 . 2 . . . . 30 LEU HB2 . 15338 1 309 . 1 1 30 30 LEU HB3 H 1 1.50 0.02 . 2 . . . . 30 LEU HB3 . 15338 1 310 . 1 1 30 30 LEU HD11 H 1 0.44 0.02 . 2 . . . . 30 LEU HD1 . 15338 1 311 . 1 1 30 30 LEU HD12 H 1 0.44 0.02 . 2 . . . . 30 LEU HD1 . 15338 1 312 . 1 1 30 30 LEU HD13 H 1 0.44 0.02 . 2 . . . . 30 LEU HD1 . 15338 1 313 . 1 1 30 30 LEU HD21 H 1 0.54 0.02 . 2 . . . . 30 LEU HD2 . 15338 1 314 . 1 1 30 30 LEU HD22 H 1 0.54 0.02 . 2 . . . . 30 LEU HD2 . 15338 1 315 . 1 1 30 30 LEU HD23 H 1 0.54 0.02 . 2 . . . . 30 LEU HD2 . 15338 1 316 . 1 1 30 30 LEU HG H 1 1.35 0.02 . 1 . . . . 30 LEU HG . 15338 1 317 . 1 1 30 30 LEU CA C 13 53.1 0.2 . 1 . . . . 30 LEU CA . 15338 1 318 . 1 1 30 30 LEU CB C 13 44.8 0.2 . 1 . . . . 30 LEU CB . 15338 1 319 . 1 1 30 30 LEU CD1 C 13 25.7 0.02 . 2 . . . . 30 LEU CD1 . 15338 1 320 . 1 1 30 30 LEU CD2 C 13 23.7 0.02 . 2 . . . . 30 LEU CD2 . 15338 1 321 . 1 1 30 30 LEU CG C 13 26.8 0.2 . 1 . . . . 30 LEU CG . 15338 1 322 . 1 1 30 30 LEU N N 15 122.2 0.2 . 1 . . . . 30 LEU N . 15338 1 323 . 1 1 31 31 GLN HA H 1 4.68 0.02 . 1 . . . . 31 GLN HA . 15338 1 324 . 1 1 31 31 GLN HB2 H 1 1.83 0.02 . 2 . . . . 31 GLN HB2 . 15338 1 325 . 1 1 31 31 GLN HB3 H 1 1.94 0.02 . 2 . . . . 31 GLN HB3 . 15338 1 326 . 1 1 31 31 GLN HG2 H 1 2.10 0.02 . 2 . . . . 31 GLN HG2 . 15338 1 327 . 1 1 31 31 GLN HG3 H 1 2.23 0.02 . 2 . . . . 31 GLN HG3 . 15338 1 328 . 1 1 31 31 GLN C C 13 173.6 0.2 . 1 . . . . 31 GLN C . 15338 1 329 . 1 1 31 31 GLN CA C 13 54.2 0.2 . 1 . . . . 31 GLN CA . 15338 1 330 . 1 1 31 31 GLN CB C 13 31.8 0.2 . 1 . . . . 31 GLN CB . 15338 1 331 . 1 1 31 31 GLN CG C 13 34.2 0.2 . 1 . . . . 31 GLN CG . 15338 1 332 . 1 1 32 32 ALA H H 1 8.56 0.02 . 1 . . . . 32 ALA H . 15338 1 333 . 1 1 32 32 ALA HA H 1 3.99 0.02 . 1 . . . . 32 ALA HA . 15338 1 334 . 1 1 32 32 ALA HB1 H 1 0.95 0.02 . 1 . . . . 32 ALA HB . 15338 1 335 . 1 1 32 32 ALA HB2 H 1 0.95 0.02 . 1 . . . . 32 ALA HB . 15338 1 336 . 1 1 32 32 ALA HB3 H 1 0.95 0.02 . 1 . . . . 32 ALA HB . 15338 1 337 . 1 1 32 32 ALA C C 13 175.6 0.2 . 1 . . . . 32 ALA C . 15338 1 338 . 1 1 32 32 ALA CA C 13 50.9 0.2 . 1 . . . . 32 ALA CA . 15338 1 339 . 1 1 32 32 ALA CB C 13 20.3 0.2 . 1 . . . . 32 ALA CB . 15338 1 340 . 1 1 32 32 ALA N N 15 128.1 0.2 . 1 . . . . 32 ALA N . 15338 1 341 . 1 1 33 33 LEU H H 1 8.74 0.02 . 1 . . . . 33 LEU H . 15338 1 342 . 1 1 33 33 LEU HA H 1 4.56 0.02 . 1 . . . . 33 LEU HA . 15338 1 343 . 1 1 33 33 LEU HB2 H 1 0.81 0.02 . 2 . . . . 33 LEU HB2 . 15338 1 344 . 1 1 33 33 LEU HB3 H 1 1.65 0.02 . 2 . . . . 33 LEU HB3 . 15338 1 345 . 1 1 33 33 LEU HD11 H 1 0.70 0.02 . 2 . . . . 33 LEU HD1 . 15338 1 346 . 1 1 33 33 LEU HD12 H 1 0.70 0.02 . 2 . . . . 33 LEU HD1 . 15338 1 347 . 1 1 33 33 LEU HD13 H 1 0.70 0.02 . 2 . . . . 33 LEU HD1 . 15338 1 348 . 1 1 33 33 LEU HD21 H 1 0.53 0.02 . 2 . . . . 33 LEU HD2 . 15338 1 349 . 1 1 33 33 LEU HD22 H 1 0.53 0.02 . 2 . . . . 33 LEU HD2 . 15338 1 350 . 1 1 33 33 LEU HD23 H 1 0.53 0.02 . 2 . . . . 33 LEU HD2 . 15338 1 351 . 1 1 33 33 LEU HG H 1 1.45 0.02 . 1 . . . . 33 LEU HG . 15338 1 352 . 1 1 33 33 LEU C C 13 175.4 0.2 . 1 . . . . 33 LEU C . 15338 1 353 . 1 1 33 33 LEU CA C 13 52.7 0.2 . 1 . . . . 33 LEU CA . 15338 1 354 . 1 1 33 33 LEU CB C 13 44.2 0.2 . 1 . . . . 33 LEU CB . 15338 1 355 . 1 1 33 33 LEU CD1 C 13 25.7 0.02 . 2 . . . . 33 LEU CD1 . 15338 1 356 . 1 1 33 33 LEU CD2 C 13 21.4 0.02 . 2 . . . . 33 LEU CD2 . 15338 1 357 . 1 1 33 33 LEU CG C 13 25.9 0.2 . 1 . . . . 33 LEU CG . 15338 1 358 . 1 1 33 33 LEU N N 15 124.5 0.2 . 1 . . . . 33 LEU N . 15338 1 359 . 1 1 34 34 CYS H H 1 8.26 0.02 . 1 . . . . 34 CYS H . 15338 1 360 . 1 1 34 34 CYS HA H 1 4.27 0.02 . 1 . . . . 34 CYS HA . 15338 1 361 . 1 1 34 34 CYS HB2 H 1 2.81 0.02 . 2 . . . . 34 CYS HB2 . 15338 1 362 . 1 1 34 34 CYS HB3 H 1 3.23 0.02 . 2 . . . . 34 CYS HB3 . 15338 1 363 . 1 1 34 34 CYS CA C 13 56.9 0.2 . 1 . . . . 34 CYS CA . 15338 1 364 . 1 1 34 34 CYS CB C 13 31.4 0.2 . 1 . . . . 34 CYS CB . 15338 1 365 . 1 1 34 34 CYS N N 15 123.6 0.2 . 1 . . . . 34 CYS N . 15338 1 366 . 1 1 35 35 PRO HA H 1 4.29 0.02 . 1 . . . . 35 PRO HA . 15338 1 367 . 1 1 35 35 PRO HB2 H 1 1.87 0.02 . 2 . . . . 35 PRO HB2 . 15338 1 368 . 1 1 35 35 PRO HB3 H 1 2.33 0.02 . 2 . . . . 35 PRO HB3 . 15338 1 369 . 1 1 35 35 PRO HD2 H 1 3.37 0.02 . 2 . . . . 35 PRO HD2 . 15338 1 370 . 1 1 35 35 PRO HD3 H 1 4.37 0.02 . 2 . . . . 35 PRO HD3 . 15338 1 371 . 1 1 35 35 PRO HG2 H 1 1.74 0.02 . 2 . . . . 35 PRO HG2 . 15338 1 372 . 1 1 35 35 PRO HG3 H 1 1.81 0.02 . 2 . . . . 35 PRO HG3 . 15338 1 373 . 1 1 35 35 PRO C C 13 176.1 0.2 . 1 . . . . 35 PRO C . 15338 1 374 . 1 1 35 35 PRO CA C 13 63.7 0.2 . 1 . . . . 35 PRO CA . 15338 1 375 . 1 1 35 35 PRO CB C 13 31.6 0.2 . 1 . . . . 35 PRO CB . 15338 1 376 . 1 1 35 35 PRO CD C 13 51.3 0.2 . 1 . . . . 35 PRO CD . 15338 1 377 . 1 1 35 35 PRO CG C 13 26.6 0.2 . 1 . . . . 35 PRO CG . 15338 1 378 . 1 1 36 36 ASP H H 1 8.98 0.02 . 1 . . . . 36 ASP H . 15338 1 379 . 1 1 36 36 ASP HA H 1 4.60 0.02 . 1 . . . . 36 ASP HA . 15338 1 380 . 1 1 36 36 ASP HB2 H 1 1.15 0.02 . 2 . . . . 36 ASP HB2 . 15338 1 381 . 1 1 36 36 ASP HB3 H 1 1.74 0.02 . 2 . . . . 36 ASP HB3 . 15338 1 382 . 1 1 36 36 ASP C C 13 176.5 0.2 . 1 . . . . 36 ASP C . 15338 1 383 . 1 1 36 36 ASP CA C 13 56.4 0.2 . 1 . . . . 36 ASP CA . 15338 1 384 . 1 1 36 36 ASP CB C 13 40.1 0.2 . 1 . . . . 36 ASP CB . 15338 1 385 . 1 1 36 36 ASP N N 15 122.2 0.2 . 1 . . . . 36 ASP N . 15338 1 386 . 1 1 37 37 CYS H H 1 7.84 0.02 . 1 . . . . 37 CYS H . 15338 1 387 . 1 1 37 37 CYS HA H 1 5.00 0.02 . 1 . . . . 37 CYS HA . 15338 1 388 . 1 1 37 37 CYS HB2 H 1 2.99 0.02 . 2 . . . . 37 CYS HB2 . 15338 1 389 . 1 1 37 37 CYS HB3 H 1 3.32 0.02 . 2 . . . . 37 CYS HB3 . 15338 1 390 . 1 1 37 37 CYS C C 13 175.4 0.2 . 1 . . . . 37 CYS C . 15338 1 391 . 1 1 37 37 CYS CA C 13 58.4 0.2 . 1 . . . . 37 CYS CA . 15338 1 392 . 1 1 37 37 CYS CB C 13 32.3 0.2 . 1 . . . . 37 CYS CB . 15338 1 393 . 1 1 37 37 CYS N N 15 116.0 0.2 . 1 . . . . 37 CYS N . 15338 1 394 . 1 1 38 38 ARG H H 1 7.88 0.02 . 1 . . . . 38 ARG H . 15338 1 395 . 1 1 38 38 ARG HA H 1 4.05 0.02 . 1 . . . . 38 ARG HA . 15338 1 396 . 1 1 38 38 ARG HB2 H 1 2.03 0.02 . 2 . . . . 38 ARG HB2 . 15338 1 397 . 1 1 38 38 ARG HB3 H 1 2.03 0.02 . 2 . . . . 38 ARG HB3 . 15338 1 398 . 1 1 38 38 ARG HD2 H 1 3.07 0.02 . 2 . . . . 38 ARG HD2 . 15338 1 399 . 1 1 38 38 ARG HD3 H 1 3.07 0.02 . 2 . . . . 38 ARG HD3 . 15338 1 400 . 1 1 38 38 ARG HG2 H 1 1.43 0.02 . 2 . . . . 38 ARG HG2 . 15338 1 401 . 1 1 38 38 ARG HG3 H 1 1.52 0.02 . 2 . . . . 38 ARG HG3 . 15338 1 402 . 1 1 38 38 ARG C C 13 173.7 0.2 . 1 . . . . 38 ARG C . 15338 1 403 . 1 1 38 38 ARG CA C 13 58.1 0.2 . 1 . . . . 38 ARG CA . 15338 1 404 . 1 1 38 38 ARG CB C 13 27.4 0.2 . 1 . . . . 38 ARG CB . 15338 1 405 . 1 1 38 38 ARG CD C 13 42.8 0.2 . 1 . . . . 38 ARG CD . 15338 1 406 . 1 1 38 38 ARG CG C 13 27.7 0.2 . 1 . . . . 38 ARG CG . 15338 1 407 . 1 1 38 38 ARG N N 15 117.7 0.2 . 1 . . . . 38 ARG N . 15338 1 408 . 1 1 39 39 GLN H H 1 7.72 0.02 . 1 . . . . 39 GLN H . 15338 1 409 . 1 1 39 39 GLN HA H 1 4.71 0.02 . 1 . . . . 39 GLN HA . 15338 1 410 . 1 1 39 39 GLN HB2 H 1 2.14 0.02 . 2 . . . . 39 GLN HB2 . 15338 1 411 . 1 1 39 39 GLN HB3 H 1 2.14 0.02 . 2 . . . . 39 GLN HB3 . 15338 1 412 . 1 1 39 39 GLN HG2 H 1 2.44 0.02 . 2 . . . . 39 GLN HG2 . 15338 1 413 . 1 1 39 39 GLN HG3 H 1 2.44 0.02 . 2 . . . . 39 GLN HG3 . 15338 1 414 . 1 1 39 39 GLN CA C 13 53.9 0.2 . 1 . . . . 39 GLN CA . 15338 1 415 . 1 1 39 39 GLN CB C 13 28.1 0.2 . 1 . . . . 39 GLN CB . 15338 1 416 . 1 1 39 39 GLN CG C 13 34.0 0.2 . 1 . . . . 39 GLN CG . 15338 1 417 . 1 1 39 39 GLN N N 15 117.5 0.2 . 1 . . . . 39 GLN N . 15338 1 418 . 1 1 40 40 PRO HA H 1 4.57 0.02 . 1 . . . . 40 PRO HA . 15338 1 419 . 1 1 40 40 PRO HB2 H 1 1.93 0.02 . 2 . . . . 40 PRO HB2 . 15338 1 420 . 1 1 40 40 PRO HB3 H 1 2.30 0.02 . 2 . . . . 40 PRO HB3 . 15338 1 421 . 1 1 40 40 PRO HD2 H 1 3.64 0.02 . 2 . . . . 40 PRO HD2 . 15338 1 422 . 1 1 40 40 PRO HD3 H 1 3.85 0.02 . 2 . . . . 40 PRO HD3 . 15338 1 423 . 1 1 40 40 PRO HG2 H 1 1.78 0.02 . 2 . . . . 40 PRO HG2 . 15338 1 424 . 1 1 40 40 PRO HG3 H 1 2.16 0.02 . 2 . . . . 40 PRO HG3 . 15338 1 425 . 1 1 40 40 PRO C C 13 176.6 0.2 . 1 . . . . 40 PRO C . 15338 1 426 . 1 1 40 40 PRO CA C 13 63.7 0.2 . 1 . . . . 40 PRO CA . 15338 1 427 . 1 1 40 40 PRO CB C 13 31.9 0.2 . 1 . . . . 40 PRO CB . 15338 1 428 . 1 1 40 40 PRO CD C 13 50.8 0.2 . 1 . . . . 40 PRO CD . 15338 1 429 . 1 1 40 40 PRO CG C 13 27.8 0.2 . 1 . . . . 40 PRO CG . 15338 1 430 . 1 1 41 41 LEU H H 1 8.17 0.02 . 1 . . . . 41 LEU H . 15338 1 431 . 1 1 41 41 LEU HA H 1 4.46 0.02 . 1 . . . . 41 LEU HA . 15338 1 432 . 1 1 41 41 LEU HB2 H 1 1.46 0.02 . 2 . . . . 41 LEU HB2 . 15338 1 433 . 1 1 41 41 LEU HB3 H 1 1.46 0.02 . 2 . . . . 41 LEU HB3 . 15338 1 434 . 1 1 41 41 LEU HD11 H 1 0.50 0.02 . 2 . . . . 41 LEU HD1 . 15338 1 435 . 1 1 41 41 LEU HD12 H 1 0.50 0.02 . 2 . . . . 41 LEU HD1 . 15338 1 436 . 1 1 41 41 LEU HD13 H 1 0.50 0.02 . 2 . . . . 41 LEU HD1 . 15338 1 437 . 1 1 41 41 LEU HD21 H 1 0.80 0.02 . 2 . . . . 41 LEU HD2 . 15338 1 438 . 1 1 41 41 LEU HD22 H 1 0.80 0.02 . 2 . . . . 41 LEU HD2 . 15338 1 439 . 1 1 41 41 LEU HD23 H 1 0.80 0.02 . 2 . . . . 41 LEU HD2 . 15338 1 440 . 1 1 41 41 LEU HG H 1 1.59 0.02 . 1 . . . . 41 LEU HG . 15338 1 441 . 1 1 41 41 LEU C C 13 177.2 0.2 . 1 . . . . 41 LEU C . 15338 1 442 . 1 1 41 41 LEU CA C 13 54.0 0.2 . 1 . . . . 41 LEU CA . 15338 1 443 . 1 1 41 41 LEU CB C 13 43.2 0.2 . 1 . . . . 41 LEU CB . 15338 1 444 . 1 1 41 41 LEU CD1 C 13 27.9 0.02 . 2 . . . . 41 LEU CD1 . 15338 1 445 . 1 1 41 41 LEU CD2 C 13 25.2 0.02 . 2 . . . . 41 LEU CD2 . 15338 1 446 . 1 1 41 41 LEU CG C 13 27.9 0.2 . 1 . . . . 41 LEU CG . 15338 1 447 . 1 1 41 41 LEU N N 15 124.1 0.2 . 1 . . . . 41 LEU N . 15338 1 448 . 1 1 42 42 GLN H H 1 9.24 0.02 . 1 . . . . 42 GLN H . 15338 1 449 . 1 1 42 42 GLN HA H 1 4.49 0.02 . 1 . . . . 42 GLN HA . 15338 1 450 . 1 1 42 42 GLN HB2 H 1 2.13 0.02 . 2 . . . . 42 GLN HB2 . 15338 1 451 . 1 1 42 42 GLN HB3 H 1 2.35 0.02 . 2 . . . . 42 GLN HB3 . 15338 1 452 . 1 1 42 42 GLN HG2 H 1 2.26 0.02 . 2 . . . . 42 GLN HG2 . 15338 1 453 . 1 1 42 42 GLN HG3 H 1 2.47 0.02 . 2 . . . . 42 GLN HG3 . 15338 1 454 . 1 1 42 42 GLN C C 13 175.0 0.2 . 1 . . . . 42 GLN C . 15338 1 455 . 1 1 42 42 GLN CA C 13 55.3 0.2 . 1 . . . . 42 GLN CA . 15338 1 456 . 1 1 42 42 GLN CB C 13 29.6 0.2 . 1 . . . . 42 GLN CB . 15338 1 457 . 1 1 42 42 GLN CG C 13 33.7 0.2 . 1 . . . . 42 GLN CG . 15338 1 458 . 1 1 42 42 GLN N N 15 122.1 0.2 . 1 . . . . 42 GLN N . 15338 1 459 . 1 1 43 43 VAL H H 1 8.60 0.02 . 1 . . . . 43 VAL H . 15338 1 460 . 1 1 43 43 VAL HA H 1 4.26 0.02 . 1 . . . . 43 VAL HA . 15338 1 461 . 1 1 43 43 VAL HB H 1 1.95 0.02 . 1 . . . . 43 VAL HB . 15338 1 462 . 1 1 43 43 VAL HG11 H 1 0.67 0.02 . 2 . . . . 43 VAL HG1 . 15338 1 463 . 1 1 43 43 VAL HG12 H 1 0.67 0.02 . 2 . . . . 43 VAL HG1 . 15338 1 464 . 1 1 43 43 VAL HG13 H 1 0.67 0.02 . 2 . . . . 43 VAL HG1 . 15338 1 465 . 1 1 43 43 VAL HG21 H 1 0.98 0.02 . 2 . . . . 43 VAL HG2 . 15338 1 466 . 1 1 43 43 VAL HG22 H 1 0.98 0.02 . 2 . . . . 43 VAL HG2 . 15338 1 467 . 1 1 43 43 VAL HG23 H 1 0.98 0.02 . 2 . . . . 43 VAL HG2 . 15338 1 468 . 1 1 43 43 VAL C C 13 175.5 0.2 . 1 . . . . 43 VAL C . 15338 1 469 . 1 1 43 43 VAL CA C 13 62.1 0.2 . 1 . . . . 43 VAL CA . 15338 1 470 . 1 1 43 43 VAL CB C 13 32.0 0.2 . 1 . . . . 43 VAL CB . 15338 1 471 . 1 1 43 43 VAL CG1 C 13 21.4 0.02 . 2 . . . . 43 VAL CG1 . 15338 1 472 . 1 1 43 43 VAL CG2 C 13 20.8 0.02 . 2 . . . . 43 VAL CG2 . 15338 1 473 . 1 1 43 43 VAL N N 15 126.4 0.2 . 1 . . . . 43 VAL N . 15338 1 474 . 1 1 44 44 LEU H H 1 8.94 0.02 . 1 . . . . 44 LEU H . 15338 1 475 . 1 1 44 44 LEU HA H 1 4.51 0.02 . 1 . . . . 44 LEU HA . 15338 1 476 . 1 1 44 44 LEU HB2 H 1 1.25 0.02 . 2 . . . . 44 LEU HB2 . 15338 1 477 . 1 1 44 44 LEU HB3 H 1 1.46 0.02 . 2 . . . . 44 LEU HB3 . 15338 1 478 . 1 1 44 44 LEU HD11 H 1 0.54 0.02 . 2 . . . . 44 LEU HD1 . 15338 1 479 . 1 1 44 44 LEU HD12 H 1 0.54 0.02 . 2 . . . . 44 LEU HD1 . 15338 1 480 . 1 1 44 44 LEU HD13 H 1 0.54 0.02 . 2 . . . . 44 LEU HD1 . 15338 1 481 . 1 1 44 44 LEU HD21 H 1 0.58 0.02 . 2 . . . . 44 LEU HD2 . 15338 1 482 . 1 1 44 44 LEU HD22 H 1 0.58 0.02 . 2 . . . . 44 LEU HD2 . 15338 1 483 . 1 1 44 44 LEU HD23 H 1 0.58 0.02 . 2 . . . . 44 LEU HD2 . 15338 1 484 . 1 1 44 44 LEU HG H 1 1.32 0.02 . 1 . . . . 44 LEU HG . 15338 1 485 . 1 1 44 44 LEU C C 13 175.5 0.2 . 1 . . . . 44 LEU C . 15338 1 486 . 1 1 44 44 LEU CA C 13 53.4 0.2 . 1 . . . . 44 LEU CA . 15338 1 487 . 1 1 44 44 LEU CB C 13 42.8 0.2 . 1 . . . . 44 LEU CB . 15338 1 488 . 1 1 44 44 LEU CD1 C 13 25.3 0.02 . 2 . . . . 44 LEU CD1 . 15338 1 489 . 1 1 44 44 LEU CD2 C 13 23.2 0.02 . 2 . . . . 44 LEU CD2 . 15338 1 490 . 1 1 44 44 LEU CG C 13 26.7 0.2 . 1 . . . . 44 LEU CG . 15338 1 491 . 1 1 44 44 LEU N N 15 130.2 0.2 . 1 . . . . 44 LEU N . 15338 1 492 . 1 1 45 45 LYS H H 1 8.52 0.02 . 1 . . . . 45 LYS H . 15338 1 493 . 1 1 45 45 LYS HA H 1 4.83 0.02 . 1 . . . . 45 LYS HA . 15338 1 494 . 1 1 45 45 LYS HB2 H 1 1.66 0.02 . 2 . . . . 45 LYS HB2 . 15338 1 495 . 1 1 45 45 LYS HB3 H 1 1.75 0.02 . 2 . . . . 45 LYS HB3 . 15338 1 496 . 1 1 45 45 LYS HD2 H 1 1.62 0.02 . 2 . . . . 45 LYS HD2 . 15338 1 497 . 1 1 45 45 LYS HD3 H 1 1.62 0.02 . 2 . . . . 45 LYS HD3 . 15338 1 498 . 1 1 45 45 LYS HE2 H 1 2.87 0.02 . 2 . . . . 45 LYS HE2 . 15338 1 499 . 1 1 45 45 LYS HE3 H 1 2.87 0.02 . 2 . . . . 45 LYS HE3 . 15338 1 500 . 1 1 45 45 LYS HG2 H 1 1.25 0.02 . 2 . . . . 45 LYS HG2 . 15338 1 501 . 1 1 45 45 LYS HG3 H 1 1.34 0.02 . 2 . . . . 45 LYS HG3 . 15338 1 502 . 1 1 45 45 LYS C C 13 175.6 0.2 . 1 . . . . 45 LYS C . 15338 1 503 . 1 1 45 45 LYS CA C 13 55.7 0.2 . 1 . . . . 45 LYS CA . 15338 1 504 . 1 1 45 45 LYS CB C 13 33.5 0.2 . 1 . . . . 45 LYS CB . 15338 1 505 . 1 1 45 45 LYS CD C 13 29.2 0.2 . 1 . . . . 45 LYS CD . 15338 1 506 . 1 1 45 45 LYS CE C 13 41.9 0.2 . 1 . . . . 45 LYS CE . 15338 1 507 . 1 1 45 45 LYS CG C 13 25.2 0.2 . 1 . . . . 45 LYS CG . 15338 1 508 . 1 1 45 45 LYS N N 15 123.7 0.2 . 1 . . . . 45 LYS N . 15338 1 509 . 1 1 46 46 ALA H H 1 8.22 0.02 . 1 . . . . 46 ALA H . 15338 1 510 . 1 1 46 46 ALA HA H 1 4.54 0.02 . 1 . . . . 46 ALA HA . 15338 1 511 . 1 1 46 46 ALA HB1 H 1 1.29 0.02 . 1 . . . . 46 ALA HB . 15338 1 512 . 1 1 46 46 ALA HB2 H 1 1.29 0.02 . 1 . . . . 46 ALA HB . 15338 1 513 . 1 1 46 46 ALA HB3 H 1 1.29 0.02 . 1 . . . . 46 ALA HB . 15338 1 514 . 1 1 46 46 ALA C C 13 176.9 0.2 . 1 . . . . 46 ALA C . 15338 1 515 . 1 1 46 46 ALA CA C 13 51.9 0.2 . 1 . . . . 46 ALA CA . 15338 1 516 . 1 1 46 46 ALA CB C 13 20.7 0.2 . 1 . . . . 46 ALA CB . 15338 1 517 . 1 1 46 46 ALA N N 15 126.4 0.2 . 1 . . . . 46 ALA N . 15338 1 518 . 1 1 47 47 CYS H H 1 9.20 0.02 . 1 . . . . 47 CYS H . 15338 1 519 . 1 1 47 47 CYS HA H 1 4.08 0.02 . 1 . . . . 47 CYS HA . 15338 1 520 . 1 1 47 47 CYS HB2 H 1 2.88 0.02 . 2 . . . . 47 CYS HB2 . 15338 1 521 . 1 1 47 47 CYS HB3 H 1 3.07 0.02 . 2 . . . . 47 CYS HB3 . 15338 1 522 . 1 1 47 47 CYS C C 13 175.1 0.2 . 1 . . . . 47 CYS C . 15338 1 523 . 1 1 47 47 CYS CA C 13 59.7 0.2 . 1 . . . . 47 CYS CA . 15338 1 524 . 1 1 47 47 CYS CB C 13 25.8 0.2 . 1 . . . . 47 CYS CB . 15338 1 525 . 1 1 47 47 CYS N N 15 120.4 0.2 . 1 . . . . 47 CYS N . 15338 1 526 . 1 1 48 48 GLY H H 1 8.62 0.02 . 1 . . . . 48 GLY H . 15338 1 527 . 1 1 48 48 GLY HA2 H 1 3.67 0.02 . 2 . . . . 48 GLY HA2 . 15338 1 528 . 1 1 48 48 GLY HA3 H 1 4.07 0.02 . 2 . . . . 48 GLY HA3 . 15338 1 529 . 1 1 48 48 GLY C C 13 173.1 0.2 . 1 . . . . 48 GLY C . 15338 1 530 . 1 1 48 48 GLY CA C 13 45.5 0.2 . 1 . . . . 48 GLY CA . 15338 1 531 . 1 1 48 48 GLY N N 15 109.0 0.2 . 1 . . . . 48 GLY N . 15338 1 532 . 1 1 49 49 ALA H H 1 7.82 0.02 . 1 . . . . 49 ALA H . 15338 1 533 . 1 1 49 49 ALA HA H 1 4.62 0.02 . 1 . . . . 49 ALA HA . 15338 1 534 . 1 1 49 49 ALA HB1 H 1 1.38 0.02 . 1 . . . . 49 ALA HB . 15338 1 535 . 1 1 49 49 ALA HB2 H 1 1.38 0.02 . 1 . . . . 49 ALA HB . 15338 1 536 . 1 1 49 49 ALA HB3 H 1 1.38 0.02 . 1 . . . . 49 ALA HB . 15338 1 537 . 1 1 49 49 ALA C C 13 176.0 0.2 . 1 . . . . 49 ALA C . 15338 1 538 . 1 1 49 49 ALA CA C 13 51.0 0.2 . 1 . . . . 49 ALA CA . 15338 1 539 . 1 1 49 49 ALA CB C 13 21.3 0.2 . 1 . . . . 49 ALA CB . 15338 1 540 . 1 1 49 49 ALA N N 15 124.0 0.2 . 1 . . . . 49 ALA N . 15338 1 541 . 1 1 50 50 VAL H H 1 8.10 0.02 . 1 . . . . 50 VAL H . 15338 1 542 . 1 1 50 50 VAL HA H 1 4.56 0.02 . 1 . . . . 50 VAL HA . 15338 1 543 . 1 1 50 50 VAL HB H 1 1.79 0.02 . 1 . . . . 50 VAL HB . 15338 1 544 . 1 1 50 50 VAL HG11 H 1 0.55 0.02 . 2 . . . . 50 VAL HG1 . 15338 1 545 . 1 1 50 50 VAL HG12 H 1 0.55 0.02 . 2 . . . . 50 VAL HG1 . 15338 1 546 . 1 1 50 50 VAL HG13 H 1 0.55 0.02 . 2 . . . . 50 VAL HG1 . 15338 1 547 . 1 1 50 50 VAL HG21 H 1 0.73 0.02 . 2 . . . . 50 VAL HG2 . 15338 1 548 . 1 1 50 50 VAL HG22 H 1 0.73 0.02 . 2 . . . . 50 VAL HG2 . 15338 1 549 . 1 1 50 50 VAL HG23 H 1 0.73 0.02 . 2 . . . . 50 VAL HG2 . 15338 1 550 . 1 1 50 50 VAL C C 13 174.3 0.2 . 1 . . . . 50 VAL C . 15338 1 551 . 1 1 50 50 VAL CA C 13 61.4 0.2 . 1 . . . . 50 VAL CA . 15338 1 552 . 1 1 50 50 VAL CB C 13 33.8 0.2 . 1 . . . . 50 VAL CB . 15338 1 553 . 1 1 50 50 VAL CG1 C 13 21.1 0.02 . 2 . . . . 50 VAL CG1 . 15338 1 554 . 1 1 50 50 VAL CG2 C 13 20.8 0.02 . 2 . . . . 50 VAL CG2 . 15338 1 555 . 1 1 50 50 VAL N N 15 119.6 0.2 . 1 . . . . 50 VAL N . 15338 1 556 . 1 1 51 51 ASP H H 1 8.64 0.02 . 1 . . . . 51 ASP H . 15338 1 557 . 1 1 51 51 ASP HA H 1 5.03 0.02 . 1 . . . . 51 ASP HA . 15338 1 558 . 1 1 51 51 ASP HB2 H 1 2.41 0.02 . 2 . . . . 51 ASP HB2 . 15338 1 559 . 1 1 51 51 ASP HB3 H 1 2.53 0.02 . 2 . . . . 51 ASP HB3 . 15338 1 560 . 1 1 51 51 ASP C C 13 173.0 0.2 . 1 . . . . 51 ASP C . 15338 1 561 . 1 1 51 51 ASP CA C 13 52.0 0.2 . 1 . . . . 51 ASP CA . 15338 1 562 . 1 1 51 51 ASP CB C 13 43.9 0.2 . 1 . . . . 51 ASP CB . 15338 1 563 . 1 1 51 51 ASP N N 15 124.9 0.2 . 1 . . . . 51 ASP N . 15338 1 564 . 1 1 52 52 TYR H H 1 8.95 0.02 . 1 . . . . 52 TYR H . 15338 1 565 . 1 1 52 52 TYR HA H 1 5.15 0.02 . 1 . . . . 52 TYR HA . 15338 1 566 . 1 1 52 52 TYR HB2 H 1 2.72 0.02 . 2 . . . . 52 TYR HB2 . 15338 1 567 . 1 1 52 52 TYR HB3 H 1 2.91 0.02 . 2 . . . . 52 TYR HB3 . 15338 1 568 . 1 1 52 52 TYR HD1 H 1 6.92 0.02 . 3 . . . . 52 TYR HD1 . 15338 1 569 . 1 1 52 52 TYR HD2 H 1 6.92 0.02 . 3 . . . . 52 TYR HD2 . 15338 1 570 . 1 1 52 52 TYR HE1 H 1 6.74 0.02 . 3 . . . . 52 TYR HE1 . 15338 1 571 . 1 1 52 52 TYR HE2 H 1 6.74 0.02 . 3 . . . . 52 TYR HE2 . 15338 1 572 . 1 1 52 52 TYR C C 13 174.5 0.2 . 1 . . . . 52 TYR C . 15338 1 573 . 1 1 52 52 TYR CA C 13 57.3 0.2 . 1 . . . . 52 TYR CA . 15338 1 574 . 1 1 52 52 TYR CB C 13 41.2 0.2 . 1 . . . . 52 TYR CB . 15338 1 575 . 1 1 52 52 TYR CD1 C 13 133.1 0.02 . 3 . . . . 52 TYR CD1 . 15338 1 576 . 1 1 52 52 TYR CD2 C 13 133.1 0.02 . 3 . . . . 52 TYR CD2 . 15338 1 577 . 1 1 52 52 TYR CE1 C 13 117.5 0.02 . 3 . . . . 52 TYR CE1 . 15338 1 578 . 1 1 52 52 TYR CE2 C 13 117.5 0.02 . 3 . . . . 52 TYR CE2 . 15338 1 579 . 1 1 52 52 TYR N N 15 118.5 0.2 . 1 . . . . 52 TYR N . 15338 1 580 . 1 1 53 53 PHE H H 1 9.25 0.02 . 1 . . . . 53 PHE H . 15338 1 581 . 1 1 53 53 PHE HA H 1 5.04 0.02 . 1 . . . . 53 PHE HA . 15338 1 582 . 1 1 53 53 PHE HB2 H 1 2.63 0.02 . 2 . . . . 53 PHE HB2 . 15338 1 583 . 1 1 53 53 PHE HB3 H 1 2.93 0.02 . 2 . . . . 53 PHE HB3 . 15338 1 584 . 1 1 53 53 PHE HD1 H 1 6.94 0.02 . 3 . . . . 53 PHE HD1 . 15338 1 585 . 1 1 53 53 PHE HD2 H 1 6.94 0.02 . 3 . . . . 53 PHE HD2 . 15338 1 586 . 1 1 53 53 PHE HE1 H 1 7.28 0.02 . 3 . . . . 53 PHE HE1 . 15338 1 587 . 1 1 53 53 PHE HE2 H 1 7.28 0.02 . 3 . . . . 53 PHE HE2 . 15338 1 588 . 1 1 53 53 PHE C C 13 173.2 0.2 . 1 . . . . 53 PHE C . 15338 1 589 . 1 1 53 53 PHE CA C 13 56.4 0.2 . 1 . . . . 53 PHE CA . 15338 1 590 . 1 1 53 53 PHE CB C 13 44.3 0.2 . 1 . . . . 53 PHE CB . 15338 1 591 . 1 1 53 53 PHE CD1 C 13 131.5 0.02 . 3 . . . . 53 PHE CD1 . 15338 1 592 . 1 1 53 53 PHE CD2 C 13 131.5 0.02 . 3 . . . . 53 PHE CD2 . 15338 1 593 . 1 1 53 53 PHE CE1 C 13 131.5 0.02 . 3 . . . . 53 PHE CE1 . 15338 1 594 . 1 1 53 53 PHE CE2 C 13 131.5 0.02 . 3 . . . . 53 PHE CE2 . 15338 1 595 . 1 1 53 53 PHE N N 15 123.1 0.2 . 1 . . . . 53 PHE N . 15338 1 596 . 1 1 54 54 CYS H H 1 9.16 0.02 . 1 . . . . 54 CYS H . 15338 1 597 . 1 1 54 54 CYS HA H 1 4.69 0.02 . 1 . . . . 54 CYS HA . 15338 1 598 . 1 1 54 54 CYS HB2 H 1 2.74 0.02 . 2 . . . . 54 CYS HB2 . 15338 1 599 . 1 1 54 54 CYS HB3 H 1 2.74 0.02 . 2 . . . . 54 CYS HB3 . 15338 1 600 . 1 1 54 54 CYS C C 13 175.7 0.2 . 1 . . . . 54 CYS C . 15338 1 601 . 1 1 54 54 CYS CA C 13 58.2 0.2 . 1 . . . . 54 CYS CA . 15338 1 602 . 1 1 54 54 CYS CB C 13 29.6 0.2 . 1 . . . . 54 CYS CB . 15338 1 603 . 1 1 54 54 CYS N N 15 130.8 0.2 . 1 . . . . 54 CYS N . 15338 1 604 . 1 1 55 55 GLN H H 1 9.26 0.02 . 1 . . . . 55 GLN H . 15338 1 605 . 1 1 55 55 GLN HA H 1 4.30 0.02 . 1 . . . . 55 GLN HA . 15338 1 606 . 1 1 55 55 GLN HB2 H 1 2.12 0.02 . 2 . . . . 55 GLN HB2 . 15338 1 607 . 1 1 55 55 GLN HB3 H 1 2.33 0.02 . 2 . . . . 55 GLN HB3 . 15338 1 608 . 1 1 55 55 GLN HG2 H 1 2.51 0.02 . 2 . . . . 55 GLN HG2 . 15338 1 609 . 1 1 55 55 GLN HG3 H 1 2.51 0.02 . 2 . . . . 55 GLN HG3 . 15338 1 610 . 1 1 55 55 GLN C C 13 174.4 0.2 . 1 . . . . 55 GLN C . 15338 1 611 . 1 1 55 55 GLN CA C 13 56.9 0.2 . 1 . . . . 55 GLN CA . 15338 1 612 . 1 1 55 55 GLN CB C 13 28.9 0.2 . 1 . . . . 55 GLN CB . 15338 1 613 . 1 1 55 55 GLN CG C 13 34.2 0.2 . 1 . . . . 55 GLN CG . 15338 1 614 . 1 1 55 55 GLN N N 15 129.0 0.2 . 1 . . . . 55 GLN N . 15338 1 615 . 1 1 56 56 ASN H H 1 9.10 0.02 . 1 . . . . 56 ASN H . 15338 1 616 . 1 1 56 56 ASN HA H 1 4.86 0.02 . 1 . . . . 56 ASN HA . 15338 1 617 . 1 1 56 56 ASN HB2 H 1 2.54 0.02 . 2 . . . . 56 ASN HB2 . 15338 1 618 . 1 1 56 56 ASN HB3 H 1 2.99 0.02 . 2 . . . . 56 ASN HB3 . 15338 1 619 . 1 1 56 56 ASN C C 13 174.1 0.2 . 1 . . . . 56 ASN C . 15338 1 620 . 1 1 56 56 ASN CA C 13 52.1 0.2 . 1 . . . . 56 ASN CA . 15338 1 621 . 1 1 56 56 ASN CB C 13 39.5 0.2 . 1 . . . . 56 ASN CB . 15338 1 622 . 1 1 56 56 ASN N N 15 122.3 0.2 . 1 . . . . 56 ASN N . 15338 1 623 . 1 1 57 57 GLY H H 1 7.18 0.02 . 1 . . . . 57 GLY H . 15338 1 624 . 1 1 57 57 GLY HA2 H 1 3.45 0.02 . 2 . . . . 57 GLY HA2 . 15338 1 625 . 1 1 57 57 GLY HA3 H 1 4.00 0.02 . 2 . . . . 57 GLY HA3 . 15338 1 626 . 1 1 57 57 GLY C C 13 175.8 0.2 . 1 . . . . 57 GLY C . 15338 1 627 . 1 1 57 57 GLY CA C 13 45.1 0.2 . 1 . . . . 57 GLY CA . 15338 1 628 . 1 1 57 57 GLY N N 15 104.2 0.2 . 1 . . . . 57 GLY N . 15338 1 629 . 1 1 58 58 HIS H H 1 7.38 0.02 . 1 . . . . 58 HIS H . 15338 1 630 . 1 1 58 58 HIS HA H 1 4.62 0.02 . 1 . . . . 58 HIS HA . 15338 1 631 . 1 1 58 58 HIS HB2 H 1 2.99 0.02 . 2 . . . . 58 HIS HB2 . 15338 1 632 . 1 1 58 58 HIS HB3 H 1 3.36 0.02 . 2 . . . . 58 HIS HB3 . 15338 1 633 . 1 1 58 58 HIS C C 13 174.1 0.2 . 1 . . . . 58 HIS C . 15338 1 634 . 1 1 58 58 HIS CA C 13 59.6 0.2 . 1 . . . . 58 HIS CA . 15338 1 635 . 1 1 58 58 HIS CB C 13 30.1 0.2 . 1 . . . . 58 HIS CB . 15338 1 636 . 1 1 58 58 HIS N N 15 116.0 0.2 . 1 . . . . 58 HIS N . 15338 1 637 . 1 1 59 59 GLY H H 1 7.61 0.02 . 1 . . . . 59 GLY H . 15338 1 638 . 1 1 59 59 GLY HA2 H 1 2.93 0.02 . 2 . . . . 59 GLY HA2 . 15338 1 639 . 1 1 59 59 GLY HA3 H 1 3.70 0.02 . 2 . . . . 59 GLY HA3 . 15338 1 640 . 1 1 59 59 GLY C C 13 173.1 0.2 . 1 . . . . 59 GLY C . 15338 1 641 . 1 1 59 59 GLY CA C 13 45.5 0.2 . 1 . . . . 59 GLY CA . 15338 1 642 . 1 1 59 59 GLY N N 15 108.0 0.2 . 1 . . . . 59 GLY N . 15338 1 643 . 1 1 60 60 LEU H H 1 8.45 0.02 . 1 . . . . 60 LEU H . 15338 1 644 . 1 1 60 60 LEU HA H 1 4.62 0.02 . 1 . . . . 60 LEU HA . 15338 1 645 . 1 1 60 60 LEU HB2 H 1 1.65 0.02 . 2 . . . . 60 LEU HB2 . 15338 1 646 . 1 1 60 60 LEU HB3 H 1 1.65 0.02 . 2 . . . . 60 LEU HB3 . 15338 1 647 . 1 1 60 60 LEU HD11 H 1 0.93 0.02 . 2 . . . . 60 LEU HD1 . 15338 1 648 . 1 1 60 60 LEU HD12 H 1 0.93 0.02 . 2 . . . . 60 LEU HD1 . 15338 1 649 . 1 1 60 60 LEU HD13 H 1 0.93 0.02 . 2 . . . . 60 LEU HD1 . 15338 1 650 . 1 1 60 60 LEU HD21 H 1 0.93 0.02 . 2 . . . . 60 LEU HD2 . 15338 1 651 . 1 1 60 60 LEU HD22 H 1 0.93 0.02 . 2 . . . . 60 LEU HD2 . 15338 1 652 . 1 1 60 60 LEU HD23 H 1 0.93 0.02 . 2 . . . . 60 LEU HD2 . 15338 1 653 . 1 1 60 60 LEU HG H 1 1.65 0.02 . 1 . . . . 60 LEU HG . 15338 1 654 . 1 1 60 60 LEU C C 13 176.8 0.2 . 1 . . . . 60 LEU C . 15338 1 655 . 1 1 60 60 LEU CA C 13 55.7 0.2 . 1 . . . . 60 LEU CA . 15338 1 656 . 1 1 60 60 LEU CB C 13 42.2 0.2 . 1 . . . . 60 LEU CB . 15338 1 657 . 1 1 60 60 LEU CD1 C 13 24.7 0.02 . 2 . . . . 60 LEU CD1 . 15338 1 658 . 1 1 60 60 LEU CD2 C 13 24.7 0.02 . 2 . . . . 60 LEU CD2 . 15338 1 659 . 1 1 60 60 LEU CG C 13 27.4 0.2 . 1 . . . . 60 LEU CG . 15338 1 660 . 1 1 60 60 LEU N N 15 124.3 0.2 . 1 . . . . 60 LEU N . 15338 1 661 . 1 1 61 61 ILE H H 1 8.74 0.02 . 1 . . . . 61 ILE H . 15338 1 662 . 1 1 61 61 ILE HA H 1 4.20 0.02 . 1 . . . . 61 ILE HA . 15338 1 663 . 1 1 61 61 ILE HB H 1 1.80 0.02 . 1 . . . . 61 ILE HB . 15338 1 664 . 1 1 61 61 ILE HD11 H 1 0.59 0.02 . 1 . . . . 61 ILE HD1 . 15338 1 665 . 1 1 61 61 ILE HD12 H 1 0.59 0.02 . 1 . . . . 61 ILE HD1 . 15338 1 666 . 1 1 61 61 ILE HD13 H 1 0.59 0.02 . 1 . . . . 61 ILE HD1 . 15338 1 667 . 1 1 61 61 ILE HG12 H 1 1.19 0.02 . 2 . . . . 61 ILE HG12 . 15338 1 668 . 1 1 61 61 ILE HG13 H 1 1.81 0.02 . 2 . . . . 61 ILE HG13 . 15338 1 669 . 1 1 61 61 ILE HG21 H 1 0.74 0.02 . 1 . . . . 61 ILE HG2 . 15338 1 670 . 1 1 61 61 ILE HG22 H 1 0.74 0.02 . 1 . . . . 61 ILE HG2 . 15338 1 671 . 1 1 61 61 ILE HG23 H 1 0.74 0.02 . 1 . . . . 61 ILE HG2 . 15338 1 672 . 1 1 61 61 ILE C C 13 175.5 0.2 . 1 . . . . 61 ILE C . 15338 1 673 . 1 1 61 61 ILE CA C 13 57.0 0.2 . 1 . . . . 61 ILE CA . 15338 1 674 . 1 1 61 61 ILE CB C 13 37.4 0.2 . 1 . . . . 61 ILE CB . 15338 1 675 . 1 1 61 61 ILE CD1 C 13 9.3 0.2 . 1 . . . . 61 ILE CD1 . 15338 1 676 . 1 1 61 61 ILE CG1 C 13 26.9 0.2 . 1 . . . . 61 ILE CG1 . 15338 1 677 . 1 1 61 61 ILE CG2 C 13 18.0 0.2 . 1 . . . . 61 ILE CG2 . 15338 1 678 . 1 1 61 61 ILE N N 15 128.5 0.2 . 1 . . . . 61 ILE N . 15338 1 679 . 1 1 62 62 SER H H 1 8.49 0.02 . 1 . . . . 62 SER H . 15338 1 680 . 1 1 62 62 SER HA H 1 4.38 0.02 . 1 . . . . 62 SER HA . 15338 1 681 . 1 1 62 62 SER HB2 H 1 3.79 0.02 . 2 . . . . 62 SER HB2 . 15338 1 682 . 1 1 62 62 SER HB3 H 1 4.08 0.02 . 2 . . . . 62 SER HB3 . 15338 1 683 . 1 1 62 62 SER C C 13 176.5 0.2 . 1 . . . . 62 SER C . 15338 1 684 . 1 1 62 62 SER CA C 13 58.3 0.2 . 1 . . . . 62 SER CA . 15338 1 685 . 1 1 62 62 SER CB C 13 63.5 0.2 . 1 . . . . 62 SER CB . 15338 1 686 . 1 1 62 62 SER N N 15 121.7 0.2 . 1 . . . . 62 SER N . 15338 1 687 . 1 1 63 63 LYS H H 1 9.04 0.02 . 1 . . . . 63 LYS H . 15338 1 688 . 1 1 63 63 LYS HA H 1 3.91 0.02 . 1 . . . . 63 LYS HA . 15338 1 689 . 1 1 63 63 LYS HB2 H 1 2.05 0.02 . 2 . . . . 63 LYS HB2 . 15338 1 690 . 1 1 63 63 LYS HB3 H 1 2.12 0.02 . 2 . . . . 63 LYS HB3 . 15338 1 691 . 1 1 63 63 LYS HD2 H 1 1.93 0.02 . 2 . . . . 63 LYS HD2 . 15338 1 692 . 1 1 63 63 LYS HD3 H 1 1.93 0.02 . 2 . . . . 63 LYS HD3 . 15338 1 693 . 1 1 63 63 LYS HE2 H 1 3.17 0.02 . 2 . . . . 63 LYS HE2 . 15338 1 694 . 1 1 63 63 LYS HE3 H 1 3.17 0.02 . 2 . . . . 63 LYS HE3 . 15338 1 695 . 1 1 63 63 LYS HG2 H 1 1.71 0.02 . 2 . . . . 63 LYS HG2 . 15338 1 696 . 1 1 63 63 LYS HG3 H 1 1.71 0.02 . 2 . . . . 63 LYS HG3 . 15338 1 697 . 1 1 63 63 LYS C C 13 178.2 0.2 . 1 . . . . 63 LYS C . 15338 1 698 . 1 1 63 63 LYS CA C 13 60.3 0.2 . 1 . . . . 63 LYS CA . 15338 1 699 . 1 1 63 63 LYS CB C 13 32.0 0.2 . 1 . . . . 63 LYS CB . 15338 1 700 . 1 1 63 63 LYS CD C 13 29.3 0.2 . 1 . . . . 63 LYS CD . 15338 1 701 . 1 1 63 63 LYS CE C 13 42.1 0.2 . 1 . . . . 63 LYS CE . 15338 1 702 . 1 1 63 63 LYS CG C 13 25.3 0.2 . 1 . . . . 63 LYS CG . 15338 1 703 . 1 1 63 63 LYS N N 15 126.0 0.2 . 1 . . . . 63 LYS N . 15338 1 704 . 1 1 64 64 LYS H H 1 8.09 0.02 . 1 . . . . 64 LYS H . 15338 1 705 . 1 1 64 64 LYS HA H 1 4.19 0.02 . 1 . . . . 64 LYS HA . 15338 1 706 . 1 1 64 64 LYS HB2 H 1 1.82 0.02 . 2 . . . . 64 LYS HB2 . 15338 1 707 . 1 1 64 64 LYS HB3 H 1 1.82 0.02 . 2 . . . . 64 LYS HB3 . 15338 1 708 . 1 1 64 64 LYS HD2 H 1 1.69 0.02 . 2 . . . . 64 LYS HD2 . 15338 1 709 . 1 1 64 64 LYS HD3 H 1 1.69 0.02 . 2 . . . . 64 LYS HD3 . 15338 1 710 . 1 1 64 64 LYS HE2 H 1 2.99 0.02 . 2 . . . . 64 LYS HE2 . 15338 1 711 . 1 1 64 64 LYS HE3 H 1 2.99 0.02 . 2 . . . . 64 LYS HE3 . 15338 1 712 . 1 1 64 64 LYS HG2 H 1 1.45 0.02 . 2 . . . . 64 LYS HG2 . 15338 1 713 . 1 1 64 64 LYS HG3 H 1 1.45 0.02 . 2 . . . . 64 LYS HG3 . 15338 1 714 . 1 1 64 64 LYS C C 13 177.0 0.2 . 1 . . . . 64 LYS C . 15338 1 715 . 1 1 64 64 LYS CA C 13 58.0 0.2 . 1 . . . . 64 LYS CA . 15338 1 716 . 1 1 64 64 LYS CB C 13 32.3 0.2 . 1 . . . . 64 LYS CB . 15338 1 717 . 1 1 64 64 LYS CD C 13 29.0 0.2 . 1 . . . . 64 LYS CD . 15338 1 718 . 1 1 64 64 LYS CE C 13 41.8 0.2 . 1 . . . . 64 LYS CE . 15338 1 719 . 1 1 64 64 LYS CG C 13 25.0 0.2 . 1 . . . . 64 LYS CG . 15338 1 720 . 1 1 64 64 LYS N N 15 115.4 0.2 . 1 . . . . 64 LYS N . 15338 1 721 . 1 1 65 65 ARG H H 1 7.96 0.02 . 1 . . . . 65 ARG H . 15338 1 722 . 1 1 65 65 ARG HA H 1 4.28 0.02 . 1 . . . . 65 ARG HA . 15338 1 723 . 1 1 65 65 ARG HB2 H 1 1.63 0.02 . 2 . . . . 65 ARG HB2 . 15338 1 724 . 1 1 65 65 ARG HB3 H 1 1.89 0.02 . 2 . . . . 65 ARG HB3 . 15338 1 725 . 1 1 65 65 ARG HD2 H 1 3.15 0.02 . 2 . . . . 65 ARG HD2 . 15338 1 726 . 1 1 65 65 ARG HD3 H 1 3.31 0.02 . 2 . . . . 65 ARG HD3 . 15338 1 727 . 1 1 65 65 ARG HG2 H 1 1.46 0.02 . 2 . . . . 65 ARG HG2 . 15338 1 728 . 1 1 65 65 ARG HG3 H 1 1.46 0.02 . 2 . . . . 65 ARG HG3 . 15338 1 729 . 1 1 65 65 ARG C C 13 176.0 0.2 . 1 . . . . 65 ARG C . 15338 1 730 . 1 1 65 65 ARG CA C 13 55.9 0.2 . 1 . . . . 65 ARG CA . 15338 1 731 . 1 1 65 65 ARG CB C 13 32.0 0.2 . 1 . . . . 65 ARG CB . 15338 1 732 . 1 1 65 65 ARG CD C 13 43.3 0.2 . 1 . . . . 65 ARG CD . 15338 1 733 . 1 1 65 65 ARG CG C 13 28.6 0.2 . 1 . . . . 65 ARG CG . 15338 1 734 . 1 1 65 65 ARG N N 15 116.6 0.2 . 1 . . . . 65 ARG N . 15338 1 735 . 1 1 66 66 VAL H H 1 6.81 0.02 . 1 . . . . 66 VAL H . 15338 1 736 . 1 1 66 66 VAL HA H 1 2.80 0.02 . 1 . . . . 66 VAL HA . 15338 1 737 . 1 1 66 66 VAL HB H 1 1.35 0.02 . 1 . . . . 66 VAL HB . 15338 1 738 . 1 1 66 66 VAL HG11 H 1 -0.60 0.02 . 2 . . . . 66 VAL HG1 . 15338 1 739 . 1 1 66 66 VAL HG12 H 1 -0.60 0.02 . 2 . . . . 66 VAL HG1 . 15338 1 740 . 1 1 66 66 VAL HG13 H 1 -0.60 0.02 . 2 . . . . 66 VAL HG1 . 15338 1 741 . 1 1 66 66 VAL HG21 H 1 0.23 0.02 . 2 . . . . 66 VAL HG2 . 15338 1 742 . 1 1 66 66 VAL HG22 H 1 0.23 0.02 . 2 . . . . 66 VAL HG2 . 15338 1 743 . 1 1 66 66 VAL HG23 H 1 0.23 0.02 . 2 . . . . 66 VAL HG2 . 15338 1 744 . 1 1 66 66 VAL C C 13 174.5 0.2 . 1 . . . . 66 VAL C . 15338 1 745 . 1 1 66 66 VAL CA C 13 65.0 0.2 . 1 . . . . 66 VAL CA . 15338 1 746 . 1 1 66 66 VAL CB C 13 32.0 0.2 . 1 . . . . 66 VAL CB . 15338 1 747 . 1 1 66 66 VAL CG1 C 13 20.9 0.02 . 2 . . . . 66 VAL CG1 . 15338 1 748 . 1 1 66 66 VAL CG2 C 13 22.6 0.02 . 2 . . . . 66 VAL CG2 . 15338 1 749 . 1 1 66 66 VAL N N 15 119.6 0.2 . 1 . . . . 66 VAL N . 15338 1 750 . 1 1 67 67 ASN H H 1 7.27 0.02 . 1 . . . . 67 ASN H . 15338 1 751 . 1 1 67 67 ASN HA H 1 4.84 0.02 . 1 . . . . 67 ASN HA . 15338 1 752 . 1 1 67 67 ASN HB2 H 1 2.35 0.02 . 2 . . . . 67 ASN HB2 . 15338 1 753 . 1 1 67 67 ASN HB3 H 1 2.56 0.02 . 2 . . . . 67 ASN HB3 . 15338 1 754 . 1 1 67 67 ASN HD21 H 1 6.78 0.02 . 2 . . . . 67 ASN HD21 . 15338 1 755 . 1 1 67 67 ASN HD22 H 1 7.14 0.02 . 2 . . . . 67 ASN HD22 . 15338 1 756 . 1 1 67 67 ASN C C 13 173.2 0.2 . 1 . . . . 67 ASN C . 15338 1 757 . 1 1 67 67 ASN CA C 13 51.2 0.2 . 1 . . . . 67 ASN CA . 15338 1 758 . 1 1 67 67 ASN CB C 13 39.1 0.2 . 1 . . . . 67 ASN CB . 15338 1 759 . 1 1 67 67 ASN N N 15 123.5 0.2 . 1 . . . . 67 ASN N . 15338 1 760 . 1 1 67 67 ASN ND2 N 15 109.2 0.2 . 1 . . . . 67 ASN ND2 . 15338 1 761 . 1 1 68 68 PHE H H 1 8.18 0.02 . 1 . . . . 68 PHE H . 15338 1 762 . 1 1 68 68 PHE HA H 1 5.17 0.02 . 1 . . . . 68 PHE HA . 15338 1 763 . 1 1 68 68 PHE HB2 H 1 2.71 0.02 . 2 . . . . 68 PHE HB2 . 15338 1 764 . 1 1 68 68 PHE HB3 H 1 2.71 0.02 . 2 . . . . 68 PHE HB3 . 15338 1 765 . 1 1 68 68 PHE HD1 H 1 6.95 0.02 . 3 . . . . 68 PHE HD1 . 15338 1 766 . 1 1 68 68 PHE HD2 H 1 6.95 0.02 . 3 . . . . 68 PHE HD2 . 15338 1 767 . 1 1 68 68 PHE HE1 H 1 7.22 0.02 . 3 . . . . 68 PHE HE1 . 15338 1 768 . 1 1 68 68 PHE HE2 H 1 7.22 0.02 . 3 . . . . 68 PHE HE2 . 15338 1 769 . 1 1 68 68 PHE HZ H 1 7.00 0.02 . 1 . . . . 68 PHE HZ . 15338 1 770 . 1 1 68 68 PHE C C 13 175.3 0.2 . 1 . . . . 68 PHE C . 15338 1 771 . 1 1 68 68 PHE CA C 13 58.0 0.2 . 1 . . . . 68 PHE CA . 15338 1 772 . 1 1 68 68 PHE CB C 13 41.1 0.2 . 1 . . . . 68 PHE CB . 15338 1 773 . 1 1 68 68 PHE CD1 C 13 131.5 0.02 . 3 . . . . 68 PHE CD1 . 15338 1 774 . 1 1 68 68 PHE CD2 C 13 131.5 0.02 . 3 . . . . 68 PHE CD2 . 15338 1 775 . 1 1 68 68 PHE CE1 C 13 131.5 0.02 . 3 . . . . 68 PHE CE1 . 15338 1 776 . 1 1 68 68 PHE CE2 C 13 131.5 0.02 . 3 . . . . 68 PHE CE2 . 15338 1 777 . 1 1 68 68 PHE CZ C 13 129.4 0.2 . 1 . . . . 68 PHE CZ . 15338 1 778 . 1 1 68 68 PHE N N 15 123.3 0.2 . 1 . . . . 68 PHE N . 15338 1 779 . 1 1 69 69 VAL H H 1 8.66 0.02 . 1 . . . . 69 VAL H . 15338 1 780 . 1 1 69 69 VAL HA H 1 4.52 0.02 . 1 . . . . 69 VAL HA . 15338 1 781 . 1 1 69 69 VAL HB H 1 2.07 0.02 . 1 . . . . 69 VAL HB . 15338 1 782 . 1 1 69 69 VAL HG11 H 1 0.80 0.02 . 2 . . . . 69 VAL HG1 . 15338 1 783 . 1 1 69 69 VAL HG12 H 1 0.80 0.02 . 2 . . . . 69 VAL HG1 . 15338 1 784 . 1 1 69 69 VAL HG13 H 1 0.80 0.02 . 2 . . . . 69 VAL HG1 . 15338 1 785 . 1 1 69 69 VAL HG21 H 1 0.78 0.02 . 2 . . . . 69 VAL HG2 . 15338 1 786 . 1 1 69 69 VAL HG22 H 1 0.78 0.02 . 2 . . . . 69 VAL HG2 . 15338 1 787 . 1 1 69 69 VAL HG23 H 1 0.78 0.02 . 2 . . . . 69 VAL HG2 . 15338 1 788 . 1 1 69 69 VAL C C 13 175.1 0.2 . 1 . . . . 69 VAL C . 15338 1 789 . 1 1 69 69 VAL CA C 13 59.2 0.2 . 1 . . . . 69 VAL CA . 15338 1 790 . 1 1 69 69 VAL CB C 13 35.1 0.2 . 1 . . . . 69 VAL CB . 15338 1 791 . 1 1 69 69 VAL CG1 C 13 21.4 0.02 . 2 . . . . 69 VAL CG1 . 15338 1 792 . 1 1 69 69 VAL CG2 C 13 19.5 0.02 . 2 . . . . 69 VAL CG2 . 15338 1 793 . 1 1 69 69 VAL N N 15 116.5 0.2 . 1 . . . . 69 VAL N . 15338 1 794 . 1 1 70 70 ILE H H 1 8.48 0.02 . 1 . . . . 70 ILE H . 15338 1 795 . 1 1 70 70 ILE HA H 1 4.35 0.02 . 1 . . . . 70 ILE HA . 15338 1 796 . 1 1 70 70 ILE HB H 1 1.68 0.02 . 1 . . . . 70 ILE HB . 15338 1 797 . 1 1 70 70 ILE HD11 H 1 0.38 0.02 . 1 . . . . 70 ILE HD1 . 15338 1 798 . 1 1 70 70 ILE HD12 H 1 0.38 0.02 . 1 . . . . 70 ILE HD1 . 15338 1 799 . 1 1 70 70 ILE HD13 H 1 0.38 0.02 . 1 . . . . 70 ILE HD1 . 15338 1 800 . 1 1 70 70 ILE HG12 H 1 0.84 0.02 . 2 . . . . 70 ILE HG12 . 15338 1 801 . 1 1 70 70 ILE HG13 H 1 1.35 0.02 . 2 . . . . 70 ILE HG13 . 15338 1 802 . 1 1 70 70 ILE HG21 H 1 0.83 0.02 . 1 . . . . 70 ILE HG2 . 15338 1 803 . 1 1 70 70 ILE HG22 H 1 0.83 0.02 . 1 . . . . 70 ILE HG2 . 15338 1 804 . 1 1 70 70 ILE HG23 H 1 0.83 0.02 . 1 . . . . 70 ILE HG2 . 15338 1 805 . 1 1 70 70 ILE C C 13 176.4 0.2 . 1 . . . . 70 ILE C . 15338 1 806 . 1 1 70 70 ILE CA C 13 61.3 0.2 . 1 . . . . 70 ILE CA . 15338 1 807 . 1 1 70 70 ILE CB C 13 38.2 0.2 . 1 . . . . 70 ILE CB . 15338 1 808 . 1 1 70 70 ILE CD1 C 13 13.0 0.2 . 1 . . . . 70 ILE CD1 . 15338 1 809 . 1 1 70 70 ILE CG1 C 13 27.8 0.2 . 1 . . . . 70 ILE CG1 . 15338 1 810 . 1 1 70 70 ILE CG2 C 13 17.8 0.2 . 1 . . . . 70 ILE CG2 . 15338 1 811 . 1 1 70 70 ILE N N 15 123.1 0.2 . 1 . . . . 70 ILE N . 15338 1 812 . 1 1 71 71 SER H H 1 8.77 0.02 . 1 . . . . 71 SER H . 15338 1 813 . 1 1 71 71 SER HA H 1 4.55 0.02 . 1 . . . . 71 SER HA . 15338 1 814 . 1 1 71 71 SER HB2 H 1 3.73 0.02 . 2 . . . . 71 SER HB2 . 15338 1 815 . 1 1 71 71 SER HB3 H 1 3.73 0.02 . 2 . . . . 71 SER HB3 . 15338 1 816 . 1 1 71 71 SER C C 13 174.2 0.2 . 1 . . . . 71 SER C . 15338 1 817 . 1 1 71 71 SER CA C 13 57.7 0.2 . 1 . . . . 71 SER CA . 15338 1 818 . 1 1 71 71 SER CB C 13 64.1 0.2 . 1 . . . . 71 SER CB . 15338 1 819 . 1 1 71 71 SER N N 15 122.2 0.2 . 1 . . . . 71 SER N . 15338 1 820 . 1 1 72 72 ASP H H 1 8.47 0.02 . 1 . . . . 72 ASP H . 15338 1 821 . 1 1 72 72 ASP HA H 1 4.72 0.02 . 1 . . . . 72 ASP HA . 15338 1 822 . 1 1 72 72 ASP HB2 H 1 2.73 0.02 . 2 . . . . 72 ASP HB2 . 15338 1 823 . 1 1 72 72 ASP HB3 H 1 2.73 0.02 . 2 . . . . 72 ASP HB3 . 15338 1 824 . 1 1 72 72 ASP C C 13 176.1 0.2 . 1 . . . . 72 ASP C . 15338 1 825 . 1 1 72 72 ASP CA C 13 54.2 0.2 . 1 . . . . 72 ASP CA . 15338 1 826 . 1 1 72 72 ASP CB C 13 41.2 0.2 . 1 . . . . 72 ASP CB . 15338 1 827 . 1 1 72 72 ASP N N 15 122.7 0.2 . 1 . . . . 72 ASP N . 15338 1 828 . 1 1 73 73 GLN H H 1 8.49 0.02 . 1 . . . . 73 GLN H . 15338 1 829 . 1 1 73 73 GLN HA H 1 4.31 0.02 . 1 . . . . 73 GLN HA . 15338 1 830 . 1 1 73 73 GLN HB2 H 1 1.95 0.02 . 2 . . . . 73 GLN HB2 . 15338 1 831 . 1 1 73 73 GLN HB3 H 1 2.07 0.02 . 2 . . . . 73 GLN HB3 . 15338 1 832 . 1 1 73 73 GLN HG2 H 1 2.30 0.02 . 2 . . . . 73 GLN HG2 . 15338 1 833 . 1 1 73 73 GLN HG3 H 1 2.30 0.02 . 2 . . . . 73 GLN HG3 . 15338 1 834 . 1 1 73 73 GLN C C 13 176.0 0.2 . 1 . . . . 73 GLN C . 15338 1 835 . 1 1 73 73 GLN CA C 13 56.1 0.2 . 1 . . . . 73 GLN CA . 15338 1 836 . 1 1 73 73 GLN CB C 13 29.2 0.2 . 1 . . . . 73 GLN CB . 15338 1 837 . 1 1 73 73 GLN CG C 13 33.8 0.2 . 1 . . . . 73 GLN CG . 15338 1 838 . 1 1 73 73 GLN N N 15 120.3 0.2 . 1 . . . . 73 GLN N . 15338 1 839 . 1 1 74 74 LEU H H 1 8.25 0.02 . 1 . . . . 74 LEU H . 15338 1 840 . 1 1 74 74 LEU HA H 1 4.25 0.02 . 1 . . . . 74 LEU HA . 15338 1 841 . 1 1 74 74 LEU HB2 H 1 1.45 0.02 . 2 . . . . 74 LEU HB2 . 15338 1 842 . 1 1 74 74 LEU HB3 H 1 1.54 0.02 . 2 . . . . 74 LEU HB3 . 15338 1 843 . 1 1 74 74 LEU HD11 H 1 0.85 0.02 . 2 . . . . 74 LEU HD1 . 15338 1 844 . 1 1 74 74 LEU HD12 H 1 0.85 0.02 . 2 . . . . 74 LEU HD1 . 15338 1 845 . 1 1 74 74 LEU HD13 H 1 0.85 0.02 . 2 . . . . 74 LEU HD1 . 15338 1 846 . 1 1 74 74 LEU HD21 H 1 0.81 0.02 . 2 . . . . 74 LEU HD2 . 15338 1 847 . 1 1 74 74 LEU HD22 H 1 0.81 0.02 . 2 . . . . 74 LEU HD2 . 15338 1 848 . 1 1 74 74 LEU HD23 H 1 0.81 0.02 . 2 . . . . 74 LEU HD2 . 15338 1 849 . 1 1 74 74 LEU HG H 1 1.53 0.02 . 1 . . . . 74 LEU HG . 15338 1 850 . 1 1 74 74 LEU C C 13 177.1 0.2 . 1 . . . . 74 LEU C . 15338 1 851 . 1 1 74 74 LEU CA C 13 55.2 0.2 . 1 . . . . 74 LEU CA . 15338 1 852 . 1 1 74 74 LEU CB C 13 42.1 0.2 . 1 . . . . 74 LEU CB . 15338 1 853 . 1 1 74 74 LEU CD1 C 13 24.9 0.02 . 2 . . . . 74 LEU CD1 . 15338 1 854 . 1 1 74 74 LEU CD2 C 13 23.3 0.02 . 2 . . . . 74 LEU CD2 . 15338 1 855 . 1 1 74 74 LEU CG C 13 27.0 0.2 . 1 . . . . 74 LEU CG . 15338 1 856 . 1 1 74 74 LEU N N 15 123.0 0.2 . 1 . . . . 74 LEU N . 15338 1 857 . 1 1 75 75 GLU H H 1 8.26 0.02 . 1 . . . . 75 GLU H . 15338 1 858 . 1 1 75 75 GLU HA H 1 4.17 0.02 . 1 . . . . 75 GLU HA . 15338 1 859 . 1 1 75 75 GLU HB2 H 1 1.87 0.02 . 2 . . . . 75 GLU HB2 . 15338 1 860 . 1 1 75 75 GLU HB3 H 1 1.87 0.02 . 2 . . . . 75 GLU HB3 . 15338 1 861 . 1 1 75 75 GLU HG2 H 1 2.16 0.02 . 2 . . . . 75 GLU HG2 . 15338 1 862 . 1 1 75 75 GLU HG3 H 1 2.21 0.02 . 2 . . . . 75 GLU HG3 . 15338 1 863 . 1 1 75 75 GLU C C 13 176.2 0.2 . 1 . . . . 75 GLU C . 15338 1 864 . 1 1 75 75 GLU CA C 13 56.3 0.2 . 1 . . . . 75 GLU CA . 15338 1 865 . 1 1 75 75 GLU CB C 13 29.8 0.2 . 1 . . . . 75 GLU CB . 15338 1 866 . 1 1 75 75 GLU CG C 13 35.3 0.2 . 1 . . . . 75 GLU CG . 15338 1 867 . 1 1 75 75 GLU N N 15 120.7 0.2 . 1 . . . . 75 GLU N . 15338 1 868 . 1 1 76 76 HIS H H 1 8.48 0.02 . 1 . . . . 76 HIS H . 15338 1 869 . 1 1 76 76 HIS HA H 1 4.61 0.02 . 1 . . . . 76 HIS HA . 15338 1 870 . 1 1 76 76 HIS HB2 H 1 3.11 0.02 . 2 . . . . 76 HIS HB2 . 15338 1 871 . 1 1 76 76 HIS HB3 H 1 3.11 0.02 . 2 . . . . 76 HIS HB3 . 15338 1 872 . 1 1 76 76 HIS C C 13 174.2 0.2 . 1 . . . . 76 HIS C . 15338 1 873 . 1 1 76 76 HIS CA C 13 55.1 0.2 . 1 . . . . 76 HIS CA . 15338 1 874 . 1 1 76 76 HIS CB C 13 28.7 0.2 . 1 . . . . 76 HIS CB . 15338 1 875 . 1 1 76 76 HIS N N 15 119.1 0.2 . 1 . . . . 76 HIS N . 15338 1 876 . 1 1 77 77 HIS H H 1 8.54 0.02 . 1 . . . . 77 HIS H . 15338 1 877 . 1 1 77 77 HIS HA H 1 4.62 0.02 . 1 . . . . 77 HIS HA . 15338 1 878 . 1 1 77 77 HIS HB2 H 1 3.15 0.02 . 2 . . . . 77 HIS HB2 . 15338 1 879 . 1 1 77 77 HIS HB3 H 1 3.15 0.02 . 2 . . . . 77 HIS HB3 . 15338 1 880 . 1 1 77 77 HIS C C 13 174.1 0.2 . 1 . . . . 77 HIS C . 15338 1 881 . 1 1 77 77 HIS CA C 13 55.3 0.2 . 1 . . . . 77 HIS CA . 15338 1 882 . 1 1 77 77 HIS CB C 13 28.9 0.2 . 1 . . . . 77 HIS CB . 15338 1 883 . 1 1 77 77 HIS N N 15 118.7 0.2 . 1 . . . . 77 HIS N . 15338 1 884 . 1 1 78 78 HIS H H 1 8.63 0.02 . 1 . . . . 78 HIS H . 15338 1 885 . 1 1 78 78 HIS HA H 1 4.66 0.02 . 1 . . . . 78 HIS HA . 15338 1 886 . 1 1 78 78 HIS HB2 H 1 3.16 0.02 . 2 . . . . 78 HIS HB2 . 15338 1 887 . 1 1 78 78 HIS HB3 H 1 3.16 0.02 . 2 . . . . 78 HIS HB3 . 15338 1 888 . 1 1 78 78 HIS C C 13 174.1 0.2 . 1 . . . . 78 HIS C . 15338 1 889 . 1 1 78 78 HIS CA C 13 55.2 0.2 . 1 . . . . 78 HIS CA . 15338 1 890 . 1 1 78 78 HIS CB C 13 29.1 0.2 . 1 . . . . 78 HIS CB . 15338 1 891 . 1 1 78 78 HIS N N 15 119.5 0.2 . 1 . . . . 78 HIS N . 15338 1 892 . 1 1 79 79 HIS H H 1 8.69 0.02 . 1 . . . . 79 HIS H . 15338 1 893 . 1 1 79 79 HIS HA H 1 4.66 0.02 . 1 . . . . 79 HIS HA . 15338 1 894 . 1 1 79 79 HIS HB2 H 1 3.15 0.02 . 2 . . . . 79 HIS HB2 . 15338 1 895 . 1 1 79 79 HIS HB3 H 1 3.15 0.02 . 2 . . . . 79 HIS HB3 . 15338 1 896 . 1 1 79 79 HIS C C 13 173.9 0.2 . 1 . . . . 79 HIS C . 15338 1 897 . 1 1 79 79 HIS CA C 13 55.2 0.2 . 1 . . . . 79 HIS CA . 15338 1 898 . 1 1 79 79 HIS CB C 13 29.1 0.2 . 1 . . . . 79 HIS CB . 15338 1 899 . 1 1 79 79 HIS N N 15 120.4 0.2 . 1 . . . . 79 HIS N . 15338 1 900 . 1 1 80 80 HIS H H 1 8.59 0.02 . 1 . . . . 80 HIS H . 15338 1 901 . 1 1 80 80 HIS HA H 1 4.63 0.02 . 1 . . . . 80 HIS HA . 15338 1 902 . 1 1 80 80 HIS HB2 H 1 3.21 0.02 . 2 . . . . 80 HIS HB2 . 15338 1 903 . 1 1 80 80 HIS HB3 H 1 3.21 0.02 . 2 . . . . 80 HIS HB3 . 15338 1 904 . 1 1 80 80 HIS C C 13 173.4 0.2 . 1 . . . . 80 HIS C . 15338 1 905 . 1 1 80 80 HIS CA C 13 55.4 0.2 . 1 . . . . 80 HIS CA . 15338 1 906 . 1 1 80 80 HIS CB C 13 29.3 0.2 . 1 . . . . 80 HIS CB . 15338 1 907 . 1 1 80 80 HIS N N 15 120.6 0.2 . 1 . . . . 80 HIS N . 15338 1 908 . 1 1 81 81 HIS H H 1 8.41 0.02 . 1 . . . . 81 HIS H . 15338 1 909 . 1 1 81 81 HIS HA H 1 4.43 0.02 . 1 . . . . 81 HIS HA . 15338 1 910 . 1 1 81 81 HIS CA C 13 57.0 0.2 . 1 . . . . 81 HIS CA . 15338 1 911 . 1 1 81 81 HIS CB C 13 29.4 0.2 . 1 . . . . 81 HIS CB . 15338 1 912 . 1 1 81 81 HIS N N 15 125.6 0.2 . 1 . . . . 81 HIS N . 15338 1 stop_ save_