################################### # 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 16640 _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 0.05 _Assigned_chem_shift_list.Chem_shift_13C_err 0.5 _Assigned_chem_shift_list.Chem_shift_15N_err 0.5 _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' . . . 16640 1 4 '3D CBCA(CO)NH' . . . 16640 1 5 '3D HNCACB' . . . 16640 1 7 '3D simutaneous 13C-aromatic,13C-aliphatic,15N edited 1H-1H NOESY' . . . 16640 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 4 $AutoAssign . . 16640 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 HIS HA H 1 4.64 0.05 . 1 . . . . . 3 HIS HA . 16640 1 2 . 1 1 3 3 HIS HB2 H 1 3.18 0.05 . 2 . . . . . 3 HIS HB2 . 16640 1 3 . 1 1 3 3 HIS HB3 H 1 3.10 0.05 . 2 . . . . . 3 HIS HB3 . 16640 1 4 . 1 1 3 3 HIS HD2 H 1 7.07 0.05 . 1 . . . . . 3 HIS HD2 . 16640 1 5 . 1 1 3 3 HIS CA C 13 55.8 0.5 . 1 . . . . . 3 HIS CA . 16640 1 6 . 1 1 3 3 HIS CB C 13 29.8 0.5 . 1 . . . . . 3 HIS CB . 16640 1 7 . 1 1 3 3 HIS CD2 C 13 119.5 0.5 . 1 . . . . . 3 HIS CD2 . 16640 1 8 . 1 1 4 4 HIS H H 1 8.27 0.05 . 1 . . . . . 4 HIS H . 16640 1 9 . 1 1 4 4 HIS HA H 1 4.78 0.05 . 1 . . . . . 4 HIS HA . 16640 1 10 . 1 1 4 4 HIS HB2 H 1 1.87 0.05 . 2 . . . . . 4 HIS HB2 . 16640 1 11 . 1 1 4 4 HIS HB3 H 1 1.98 0.05 . 2 . . . . . 4 HIS HB3 . 16640 1 12 . 1 1 4 4 HIS N N 15 122.7 0.5 . 1 . . . . . 4 HIS N . 16640 1 13 . 1 1 11 11 PRO HA H 1 4.42 0.05 . 1 . . . . . 11 PRO HA . 16640 1 14 . 1 1 11 11 PRO HB2 H 1 2.25 0.05 . 2 . . . . . 11 PRO HB2 . 16640 1 15 . 1 1 11 11 PRO HB3 H 1 1.89 0.05 . 2 . . . . . 11 PRO HB3 . 16640 1 16 . 1 1 11 11 PRO HD2 H 1 3.71 0.05 . 2 . . . . . 11 PRO HD2 . 16640 1 17 . 1 1 11 11 PRO HD3 H 1 4.03 0.05 . 2 . . . . . 11 PRO HD3 . 16640 1 18 . 1 1 11 11 PRO HG2 H 1 1.78 0.05 . 2 . . . . . 11 PRO HG2 . 16640 1 19 . 1 1 11 11 PRO HG3 H 1 1.95 0.05 . 2 . . . . . 11 PRO HG3 . 16640 1 20 . 1 1 11 11 PRO CA C 13 62.7 0.5 . 1 . . . . . 11 PRO CA . 16640 1 21 . 1 1 11 11 PRO CB C 13 31.6 0.5 . 1 . . . . . 11 PRO CB . 16640 1 22 . 1 1 11 11 PRO CD C 13 50.1 0.5 . 1 . . . . . 11 PRO CD . 16640 1 23 . 1 1 11 11 PRO CG C 13 27.2 0.5 . 1 . . . . . 11 PRO CG . 16640 1 24 . 1 1 12 12 ASN H H 1 8.55 0.05 . 1 . . . . . 12 ASN H . 16640 1 25 . 1 1 12 12 ASN HA H 1 4.58 0.05 . 1 . . . . . 12 ASN HA . 16640 1 26 . 1 1 12 12 ASN HB2 H 1 3.36 0.05 . 2 . . . . . 12 ASN HB2 . 16640 1 27 . 1 1 12 12 ASN HB3 H 1 3.01 0.05 . 2 . . . . . 12 ASN HB3 . 16640 1 28 . 1 1 12 12 ASN HD21 H 1 6.80 0.05 . 2 . . . . . 12 ASN HD21 . 16640 1 29 . 1 1 12 12 ASN HD22 H 1 7.61 0.05 . 2 . . . . . 12 ASN HD22 . 16640 1 30 . 1 1 12 12 ASN CA C 13 51.7 0.5 . 1 . . . . . 12 ASN CA . 16640 1 31 . 1 1 12 12 ASN CB C 13 37.5 0.5 . 1 . . . . . 12 ASN CB . 16640 1 32 . 1 1 12 12 ASN N N 15 121.8 0.5 . 1 . . . . . 12 ASN N . 16640 1 33 . 1 1 12 12 ASN ND2 N 15 110.7 0.5 . 1 . . . . . 12 ASN ND2 . 16640 1 34 . 1 1 13 13 GLU H H 1 8.66 0.05 . 1 . . . . . 13 GLU H . 16640 1 35 . 1 1 13 13 GLU HA H 1 3.56 0.05 . 1 . . . . . 13 GLU HA . 16640 1 36 . 1 1 13 13 GLU HB2 H 1 1.98 0.05 . 2 . . . . . 13 GLU HB2 . 16640 1 37 . 1 1 13 13 GLU HB3 H 1 2.09 0.05 . 2 . . . . . 13 GLU HB3 . 16640 1 38 . 1 1 13 13 GLU HG2 H 1 1.97 0.05 . 2 . . . . . 13 GLU HG2 . 16640 1 39 . 1 1 13 13 GLU HG3 H 1 2.07 0.05 . 2 . . . . . 13 GLU HG3 . 16640 1 40 . 1 1 13 13 GLU CA C 13 61.1 0.5 . 1 . . . . . 13 GLU CA . 16640 1 41 . 1 1 13 13 GLU CB C 13 29.9 0.5 . 1 . . . . . 13 GLU CB . 16640 1 42 . 1 1 13 13 GLU CG C 13 36.8 0.5 . 1 . . . . . 13 GLU CG . 16640 1 43 . 1 1 13 13 GLU N N 15 119.6 0.5 . 1 . . . . . 13 GLU N . 16640 1 44 . 1 1 14 14 GLU H H 1 8.09 0.05 . 1 . . . . . 14 GLU H . 16640 1 45 . 1 1 14 14 GLU HA H 1 3.89 0.05 . 1 . . . . . 14 GLU HA . 16640 1 46 . 1 1 14 14 GLU HB2 H 1 1.99 0.05 . 2 . . . . . 14 GLU HB2 . 16640 1 47 . 1 1 14 14 GLU HB3 H 1 2.00 0.05 . 2 . . . . . 14 GLU HB3 . 16640 1 48 . 1 1 14 14 GLU HG2 H 1 2.31 0.05 . 2 . . . . . 14 GLU HG2 . 16640 1 49 . 1 1 14 14 GLU HG3 H 1 2.31 0.05 . 2 . . . . . 14 GLU HG3 . 16640 1 50 . 1 1 14 14 GLU CA C 13 58.8 0.5 . 1 . . . . . 14 GLU CA . 16640 1 51 . 1 1 14 14 GLU CB C 13 28.8 0.5 . 1 . . . . . 14 GLU CB . 16640 1 52 . 1 1 14 14 GLU CG C 13 35.9 0.5 . 1 . . . . . 14 GLU CG . 16640 1 53 . 1 1 14 14 GLU N N 15 118.3 0.5 . 1 . . . . . 14 GLU N . 16640 1 54 . 1 1 15 15 ALA H H 1 8.13 0.05 . 1 . . . . . 15 ALA H . 16640 1 55 . 1 1 15 15 ALA HA H 1 4.26 0.05 . 1 . . . . . 15 ALA HA . 16640 1 56 . 1 1 15 15 ALA HB1 H 1 1.51 0.05 . 1 . . . . . 15 ALA HB . 16640 1 57 . 1 1 15 15 ALA HB2 H 1 1.51 0.05 . 1 . . . . . 15 ALA HB . 16640 1 58 . 1 1 15 15 ALA HB3 H 1 1.51 0.05 . 1 . . . . . 15 ALA HB . 16640 1 59 . 1 1 15 15 ALA CA C 13 54.4 0.5 . 1 . . . . . 15 ALA CA . 16640 1 60 . 1 1 15 15 ALA CB C 13 18.3 0.5 . 1 . . . . . 15 ALA CB . 16640 1 61 . 1 1 15 15 ALA N N 15 122.2 0.5 . 1 . . . . . 15 ALA N . 16640 1 62 . 1 1 16 16 ARG H H 1 8.73 0.05 . 1 . . . . . 16 ARG H . 16640 1 63 . 1 1 16 16 ARG HA H 1 3.93 0.05 . 1 . . . . . 16 ARG HA . 16640 1 64 . 1 1 16 16 ARG HB2 H 1 2.22 0.05 . 2 . . . . . 16 ARG HB2 . 16640 1 65 . 1 1 16 16 ARG HB3 H 1 1.45 0.05 . 2 . . . . . 16 ARG HB3 . 16640 1 66 . 1 1 16 16 ARG HD2 H 1 2.96 0.05 . 2 . . . . . 16 ARG HD2 . 16640 1 67 . 1 1 16 16 ARG HD3 H 1 3.67 0.05 . 2 . . . . . 16 ARG HD3 . 16640 1 68 . 1 1 16 16 ARG HE H 1 7.23 0.05 . 1 . . . . . 16 ARG HE . 16640 1 69 . 1 1 16 16 ARG HG2 H 1 2.14 0.05 . 2 . . . . . 16 ARG HG2 . 16640 1 70 . 1 1 16 16 ARG HG3 H 1 1.13 0.05 . 2 . . . . . 16 ARG HG3 . 16640 1 71 . 1 1 16 16 ARG CA C 13 60.3 0.5 . 1 . . . . . 16 ARG CA . 16640 1 72 . 1 1 16 16 ARG CB C 13 30.5 0.5 . 1 . . . . . 16 ARG CB . 16640 1 73 . 1 1 16 16 ARG CD C 13 44.6 0.5 . 1 . . . . . 16 ARG CD . 16640 1 74 . 1 1 16 16 ARG CG C 13 29.0 0.5 . 1 . . . . . 16 ARG CG . 16640 1 75 . 1 1 16 16 ARG N N 15 118.0 0.5 . 1 . . . . . 16 ARG N . 16640 1 76 . 1 1 16 16 ARG NE N 15 80.3 0.5 . 1 . . . . . 16 ARG NE . 16640 1 77 . 1 1 17 17 LEU H H 1 8.05 0.05 . 1 . . . . . 17 LEU H . 16640 1 78 . 1 1 17 17 LEU HA H 1 3.95 0.05 . 1 . . . . . 17 LEU HA . 16640 1 79 . 1 1 17 17 LEU HB2 H 1 1.17 0.05 . 2 . . . . . 17 LEU HB2 . 16640 1 80 . 1 1 17 17 LEU HB3 H 1 2.17 0.05 . 2 . . . . . 17 LEU HB3 . 16640 1 81 . 1 1 17 17 LEU HD11 H 1 0.74 0.05 . 2 . . . . . 17 LEU HD1 . 16640 1 82 . 1 1 17 17 LEU HD12 H 1 0.74 0.05 . 2 . . . . . 17 LEU HD1 . 16640 1 83 . 1 1 17 17 LEU HD13 H 1 0.74 0.05 . 2 . . . . . 17 LEU HD1 . 16640 1 84 . 1 1 17 17 LEU HD21 H 1 0.85 0.05 . 2 . . . . . 17 LEU HD2 . 16640 1 85 . 1 1 17 17 LEU HD22 H 1 0.85 0.05 . 2 . . . . . 17 LEU HD2 . 16640 1 86 . 1 1 17 17 LEU HD23 H 1 0.85 0.05 . 2 . . . . . 17 LEU HD2 . 16640 1 87 . 1 1 17 17 LEU HG H 1 1.49 0.05 . 1 . . . . . 17 LEU HG . 16640 1 88 . 1 1 17 17 LEU CA C 13 57.8 0.5 . 1 . . . . . 17 LEU CA . 16640 1 89 . 1 1 17 17 LEU CB C 13 40.8 0.5 . 1 . . . . . 17 LEU CB . 16640 1 90 . 1 1 17 17 LEU CD1 C 13 23.2 0.5 . 1 . . . . . 17 LEU CD1 . 16640 1 91 . 1 1 17 17 LEU CD2 C 13 25.9 0.5 . 1 . . . . . 17 LEU CD2 . 16640 1 92 . 1 1 17 17 LEU CG C 13 26.6 0.5 . 1 . . . . . 17 LEU CG . 16640 1 93 . 1 1 17 17 LEU N N 15 120.2 0.5 . 1 . . . . . 17 LEU N . 16640 1 94 . 1 1 18 18 ASP H H 1 8.07 0.05 . 1 . . . . . 18 ASP H . 16640 1 95 . 1 1 18 18 ASP HA H 1 4.34 0.05 . 1 . . . . . 18 ASP HA . 16640 1 96 . 1 1 18 18 ASP HB2 H 1 2.65 0.05 . 2 . . . . . 18 ASP HB2 . 16640 1 97 . 1 1 18 18 ASP HB3 H 1 2.82 0.05 . 2 . . . . . 18 ASP HB3 . 16640 1 98 . 1 1 18 18 ASP CA C 13 57.8 0.5 . 1 . . . . . 18 ASP CA . 16640 1 99 . 1 1 18 18 ASP CB C 13 40.3 0.5 . 1 . . . . . 18 ASP CB . 16640 1 100 . 1 1 18 18 ASP N N 15 119.4 0.5 . 1 . . . . . 18 ASP N . 16640 1 101 . 1 1 19 19 ILE H H 1 7.77 0.05 . 1 . . . . . 19 ILE H . 16640 1 102 . 1 1 19 19 ILE HA H 1 3.74 0.05 . 1 . . . . . 19 ILE HA . 16640 1 103 . 1 1 19 19 ILE HB H 1 1.98 0.05 . 1 . . . . . 19 ILE HB . 16640 1 104 . 1 1 19 19 ILE HD11 H 1 0.89 0.05 . 1 . . . . . 19 ILE HD1 . 16640 1 105 . 1 1 19 19 ILE HD12 H 1 0.89 0.05 . 1 . . . . . 19 ILE HD1 . 16640 1 106 . 1 1 19 19 ILE HD13 H 1 0.89 0.05 . 1 . . . . . 19 ILE HD1 . 16640 1 107 . 1 1 19 19 ILE HG12 H 1 1.98 0.05 . 2 . . . . . 19 ILE HG12 . 16640 1 108 . 1 1 19 19 ILE HG13 H 1 1.10 0.05 . 2 . . . . . 19 ILE HG13 . 16640 1 109 . 1 1 19 19 ILE HG21 H 1 1.00 0.05 . 1 . . . . . 19 ILE HG2 . 16640 1 110 . 1 1 19 19 ILE HG22 H 1 1.00 0.05 . 1 . . . . . 19 ILE HG2 . 16640 1 111 . 1 1 19 19 ILE HG23 H 1 1.00 0.05 . 1 . . . . . 19 ILE HG2 . 16640 1 112 . 1 1 19 19 ILE CA C 13 65.4 0.5 . 1 . . . . . 19 ILE CA . 16640 1 113 . 1 1 19 19 ILE CB C 13 38.0 0.5 . 1 . . . . . 19 ILE CB . 16640 1 114 . 1 1 19 19 ILE CD1 C 13 13.6 0.5 . 1 . . . . . 19 ILE CD1 . 16640 1 115 . 1 1 19 19 ILE CG1 C 13 28.7 0.5 . 1 . . . . . 19 ILE CG1 . 16640 1 116 . 1 1 19 19 ILE CG2 C 13 18.6 0.5 . 1 . . . . . 19 ILE CG2 . 16640 1 117 . 1 1 19 19 ILE N N 15 119.2 0.5 . 1 . . . . . 19 ILE N . 16640 1 118 . 1 1 20 20 LEU H H 1 8.21 0.05 . 1 . . . . . 20 LEU H . 16640 1 119 . 1 1 20 20 LEU HA H 1 3.89 0.05 . 1 . . . . . 20 LEU HA . 16640 1 120 . 1 1 20 20 LEU HB2 H 1 2.00 0.05 . 2 . . . . . 20 LEU HB2 . 16640 1 121 . 1 1 20 20 LEU HB3 H 1 1.37 0.05 . 2 . . . . . 20 LEU HB3 . 16640 1 122 . 1 1 20 20 LEU HD11 H 1 0.72 0.05 . 2 . . . . . 20 LEU HD1 . 16640 1 123 . 1 1 20 20 LEU HD12 H 1 0.72 0.05 . 2 . . . . . 20 LEU HD1 . 16640 1 124 . 1 1 20 20 LEU HD13 H 1 0.72 0.05 . 2 . . . . . 20 LEU HD1 . 16640 1 125 . 1 1 20 20 LEU HD21 H 1 0.76 0.05 . 2 . . . . . 20 LEU HD2 . 16640 1 126 . 1 1 20 20 LEU HD22 H 1 0.76 0.05 . 2 . . . . . 20 LEU HD2 . 16640 1 127 . 1 1 20 20 LEU HD23 H 1 0.76 0.05 . 2 . . . . . 20 LEU HD2 . 16640 1 128 . 1 1 20 20 LEU HG H 1 1.62 0.05 . 1 . . . . . 20 LEU HG . 16640 1 129 . 1 1 20 20 LEU CA C 13 57.8 0.5 . 1 . . . . . 20 LEU CA . 16640 1 130 . 1 1 20 20 LEU CB C 13 42.4 0.5 . 1 . . . . . 20 LEU CB . 16640 1 131 . 1 1 20 20 LEU CD1 C 13 26.1 0.5 . 1 . . . . . 20 LEU CD1 . 16640 1 132 . 1 1 20 20 LEU CD2 C 13 25.0 0.5 . 1 . . . . . 20 LEU CD2 . 16640 1 133 . 1 1 20 20 LEU CG C 13 26.3 0.5 . 1 . . . . . 20 LEU CG . 16640 1 134 . 1 1 20 20 LEU N N 15 120.8 0.5 . 1 . . . . . 20 LEU N . 16640 1 135 . 1 1 21 21 LYS H H 1 8.69 0.05 . 1 . . . . . 21 LYS H . 16640 1 136 . 1 1 21 21 LYS HA H 1 3.62 0.05 . 1 . . . . . 21 LYS HA . 16640 1 137 . 1 1 21 21 LYS HB2 H 1 1.98 0.05 . 2 . . . . . 21 LYS HB2 . 16640 1 138 . 1 1 21 21 LYS HB3 H 1 1.79 0.05 . 2 . . . . . 21 LYS HB3 . 16640 1 139 . 1 1 21 21 LYS HD2 H 1 1.63 0.05 . 2 . . . . . 21 LYS HD2 . 16640 1 140 . 1 1 21 21 LYS HD3 H 1 1.63 0.05 . 2 . . . . . 21 LYS HD3 . 16640 1 141 . 1 1 21 21 LYS HE2 H 1 2.91 0.05 . 2 . . . . . 21 LYS HE2 . 16640 1 142 . 1 1 21 21 LYS HE3 H 1 2.76 0.05 . 2 . . . . . 21 LYS HE3 . 16640 1 143 . 1 1 21 21 LYS HG2 H 1 1.25 0.05 . 2 . . . . . 21 LYS HG2 . 16640 1 144 . 1 1 21 21 LYS HG3 H 1 1.59 0.05 . 2 . . . . . 21 LYS HG3 . 16640 1 145 . 1 1 21 21 LYS CA C 13 60.1 0.5 . 1 . . . . . 21 LYS CA . 16640 1 146 . 1 1 21 21 LYS CB C 13 32.0 0.5 . 1 . . . . . 21 LYS CB . 16640 1 147 . 1 1 21 21 LYS CD C 13 29.4 0.5 . 1 . . . . . 21 LYS CD . 16640 1 148 . 1 1 21 21 LYS CE C 13 41.5 0.5 . 1 . . . . . 21 LYS CE . 16640 1 149 . 1 1 21 21 LYS CG C 13 26.0 0.5 . 1 . . . . . 21 LYS CG . 16640 1 150 . 1 1 21 21 LYS N N 15 120.5 0.5 . 1 . . . . . 21 LYS N . 16640 1 151 . 1 1 22 22 ILE H H 1 7.92 0.05 . 1 . . . . . 22 ILE H . 16640 1 152 . 1 1 22 22 ILE HA H 1 3.61 0.05 . 1 . . . . . 22 ILE HA . 16640 1 153 . 1 1 22 22 ILE HB H 1 1.73 0.05 . 1 . . . . . 22 ILE HB . 16640 1 154 . 1 1 22 22 ILE HD11 H 1 0.76 0.05 . 1 . . . . . 22 ILE HD1 . 16640 1 155 . 1 1 22 22 ILE HD12 H 1 0.76 0.05 . 1 . . . . . 22 ILE HD1 . 16640 1 156 . 1 1 22 22 ILE HD13 H 1 0.76 0.05 . 1 . . . . . 22 ILE HD1 . 16640 1 157 . 1 1 22 22 ILE HG12 H 1 1.66 0.05 . 2 . . . . . 22 ILE HG12 . 16640 1 158 . 1 1 22 22 ILE HG13 H 1 1.01 0.05 . 2 . . . . . 22 ILE HG13 . 16640 1 159 . 1 1 22 22 ILE HG21 H 1 0.39 0.05 . 1 . . . . . 22 ILE HG2 . 16640 1 160 . 1 1 22 22 ILE HG22 H 1 0.39 0.05 . 1 . . . . . 22 ILE HG2 . 16640 1 161 . 1 1 22 22 ILE HG23 H 1 0.39 0.05 . 1 . . . . . 22 ILE HG2 . 16640 1 162 . 1 1 22 22 ILE CA C 13 64.8 0.5 . 1 . . . . . 22 ILE CA . 16640 1 163 . 1 1 22 22 ILE CB C 13 38.2 0.5 . 1 . . . . . 22 ILE CB . 16640 1 164 . 1 1 22 22 ILE CD1 C 13 12.9 0.5 . 1 . . . . . 22 ILE CD1 . 16640 1 165 . 1 1 22 22 ILE CG1 C 13 28.8 0.5 . 1 . . . . . 22 ILE CG1 . 16640 1 166 . 1 1 22 22 ILE CG2 C 13 16.2 0.5 . 1 . . . . . 22 ILE CG2 . 16640 1 167 . 1 1 22 22 ILE N N 15 119.4 0.5 . 1 . . . . . 22 ILE N . 16640 1 168 . 1 1 23 23 HIS H H 1 8.14 0.05 . 1 . . . . . 23 HIS H . 16640 1 169 . 1 1 23 23 HIS HA H 1 4.49 0.05 . 1 . . . . . 23 HIS HA . 16640 1 170 . 1 1 23 23 HIS HB2 H 1 3.31 0.05 . 2 . . . . . 23 HIS HB2 . 16640 1 171 . 1 1 23 23 HIS HB3 H 1 3.31 0.05 . 2 . . . . . 23 HIS HB3 . 16640 1 172 . 1 1 23 23 HIS HD2 H 1 7.16 0.05 . 1 . . . . . 23 HIS HD2 . 16640 1 173 . 1 1 23 23 HIS HE1 H 1 7.80 0.05 . 1 . . . . . 23 HIS HE1 . 16640 1 174 . 1 1 23 23 HIS CA C 13 59.1 0.5 . 1 . . . . . 23 HIS CA . 16640 1 175 . 1 1 23 23 HIS CB C 13 29.9 0.5 . 1 . . . . . 23 HIS CB . 16640 1 176 . 1 1 23 23 HIS CD2 C 13 120.7 0.5 . 1 . . . . . 23 HIS CD2 . 16640 1 177 . 1 1 23 23 HIS CE1 C 13 138.7 0.5 . 1 . . . . . 23 HIS CE1 . 16640 1 178 . 1 1 23 23 HIS N N 15 116.3 0.5 . 1 . . . . . 23 HIS N . 16640 1 179 . 1 1 24 24 SER H H 1 8.16 0.05 . 1 . . . . . 24 SER H . 16640 1 180 . 1 1 24 24 SER HA H 1 4.74 0.05 . 1 . . . . . 24 SER HA . 16640 1 181 . 1 1 24 24 SER HB2 H 1 4.35 0.05 . 2 . . . . . 24 SER HB2 . 16640 1 182 . 1 1 24 24 SER HB3 H 1 4.06 0.05 . 2 . . . . . 24 SER HB3 . 16640 1 183 . 1 1 24 24 SER HG H 1 5.27 0.05 . 1 . . . . . 24 SER HG . 16640 1 184 . 1 1 24 24 SER CA C 13 59.1 0.5 . 1 . . . . . 24 SER CA . 16640 1 185 . 1 1 24 24 SER CB C 13 64.3 0.5 . 1 . . . . . 24 SER CB . 16640 1 186 . 1 1 24 24 SER N N 15 113.8 0.5 . 1 . . . . . 24 SER N . 16640 1 187 . 1 1 25 25 ARG H H 1 7.16 0.05 . 1 . . . . . 25 ARG H . 16640 1 188 . 1 1 25 25 ARG HA H 1 4.18 0.05 . 1 . . . . . 25 ARG HA . 16640 1 189 . 1 1 25 25 ARG HB2 H 1 1.92 0.05 . 2 . . . . . 25 ARG HB2 . 16640 1 190 . 1 1 25 25 ARG HB3 H 1 2.03 0.05 . 2 . . . . . 25 ARG HB3 . 16640 1 191 . 1 1 25 25 ARG HD2 H 1 3.22 0.05 . 2 . . . . . 25 ARG HD2 . 16640 1 192 . 1 1 25 25 ARG HD3 H 1 3.22 0.05 . 2 . . . . . 25 ARG HD3 . 16640 1 193 . 1 1 25 25 ARG HG2 H 1 1.80 0.05 . 2 . . . . . 25 ARG HG2 . 16640 1 194 . 1 1 25 25 ARG HG3 H 1 1.80 0.05 . 2 . . . . . 25 ARG HG3 . 16640 1 195 . 1 1 25 25 ARG CA C 13 58.9 0.5 . 1 . . . . . 25 ARG CA . 16640 1 196 . 1 1 25 25 ARG CB C 13 30.1 0.5 . 1 . . . . . 25 ARG CB . 16640 1 197 . 1 1 25 25 ARG CD C 13 43.4 0.5 . 1 . . . . . 25 ARG CD . 16640 1 198 . 1 1 25 25 ARG CG C 13 27.0 0.5 . 1 . . . . . 25 ARG CG . 16640 1 199 . 1 1 25 25 ARG N N 15 122.4 0.5 . 1 . . . . . 25 ARG N . 16640 1 200 . 1 1 26 26 LYS H H 1 8.06 0.05 . 1 . . . . . 26 LYS H . 16640 1 201 . 1 1 26 26 LYS HA H 1 4.47 0.05 . 1 . . . . . 26 LYS HA . 16640 1 202 . 1 1 26 26 LYS HB2 H 1 1.69 0.05 . 2 . . . . . 26 LYS HB2 . 16640 1 203 . 1 1 26 26 LYS HB3 H 1 2.05 0.05 . 2 . . . . . 26 LYS HB3 . 16640 1 204 . 1 1 26 26 LYS HD2 H 1 1.67 0.05 . 2 . . . . . 26 LYS HD2 . 16640 1 205 . 1 1 26 26 LYS HD3 H 1 1.67 0.05 . 2 . . . . . 26 LYS HD3 . 16640 1 206 . 1 1 26 26 LYS HE2 H 1 2.98 0.05 . 2 . . . . . 26 LYS HE2 . 16640 1 207 . 1 1 26 26 LYS HE3 H 1 2.98 0.05 . 2 . . . . . 26 LYS HE3 . 16640 1 208 . 1 1 26 26 LYS HG2 H 1 1.41 0.05 . 2 . . . . . 26 LYS HG2 . 16640 1 209 . 1 1 26 26 LYS HG3 H 1 1.41 0.05 . 2 . . . . . 26 LYS HG3 . 16640 1 210 . 1 1 26 26 LYS CA C 13 55.4 0.5 . 1 . . . . . 26 LYS CA . 16640 1 211 . 1 1 26 26 LYS CB C 13 31.6 0.5 . 1 . . . . . 26 LYS CB . 16640 1 212 . 1 1 26 26 LYS CD C 13 28.9 0.5 . 1 . . . . . 26 LYS CD . 16640 1 213 . 1 1 26 26 LYS CE C 13 41.8 0.5 . 1 . . . . . 26 LYS CE . 16640 1 214 . 1 1 26 26 LYS CG C 13 24.7 0.5 . 1 . . . . . 26 LYS CG . 16640 1 215 . 1 1 26 26 LYS N N 15 115.3 0.5 . 1 . . . . . 26 LYS N . 16640 1 216 . 1 1 27 27 MET H H 1 7.62 0.05 . 1 . . . . . 27 MET H . 16640 1 217 . 1 1 27 27 MET HA H 1 4.33 0.05 . 1 . . . . . 27 MET HA . 16640 1 218 . 1 1 27 27 MET HB2 H 1 2.13 0.05 . 2 . . . . . 27 MET HB2 . 16640 1 219 . 1 1 27 27 MET HB3 H 1 2.03 0.05 . 2 . . . . . 27 MET HB3 . 16640 1 220 . 1 1 27 27 MET HE1 H 1 2.10 0.05 . 1 . . . . . 27 MET HE . 16640 1 221 . 1 1 27 27 MET HE2 H 1 2.10 0.05 . 1 . . . . . 27 MET HE . 16640 1 222 . 1 1 27 27 MET HE3 H 1 2.10 0.05 . 1 . . . . . 27 MET HE . 16640 1 223 . 1 1 27 27 MET HG2 H 1 2.54 0.05 . 2 . . . . . 27 MET HG2 . 16640 1 224 . 1 1 27 27 MET HG3 H 1 2.54 0.05 . 2 . . . . . 27 MET HG3 . 16640 1 225 . 1 1 27 27 MET CA C 13 55.2 0.5 . 1 . . . . . 27 MET CA . 16640 1 226 . 1 1 27 27 MET CB C 13 35.3 0.5 . 1 . . . . . 27 MET CB . 16640 1 227 . 1 1 27 27 MET CE C 13 17.4 0.5 . 1 . . . . . 27 MET CE . 16640 1 228 . 1 1 27 27 MET CG C 13 31.8 0.5 . 1 . . . . . 27 MET CG . 16640 1 229 . 1 1 27 27 MET N N 15 119.0 0.5 . 1 . . . . . 27 MET N . 16640 1 230 . 1 1 28 28 ASN H H 1 8.93 0.05 . 1 . . . . . 28 ASN H . 16640 1 231 . 1 1 28 28 ASN HA H 1 4.89 0.05 . 1 . . . . . 28 ASN HA . 16640 1 232 . 1 1 28 28 ASN HB2 H 1 3.02 0.05 . 2 . . . . . 28 ASN HB2 . 16640 1 233 . 1 1 28 28 ASN HB3 H 1 2.75 0.05 . 2 . . . . . 28 ASN HB3 . 16640 1 234 . 1 1 28 28 ASN HD21 H 1 6.83 0.05 . 2 . . . . . 28 ASN HD21 . 16640 1 235 . 1 1 28 28 ASN HD22 H 1 7.26 0.05 . 2 . . . . . 28 ASN HD22 . 16640 1 236 . 1 1 28 28 ASN CA C 13 51.7 0.5 . 1 . . . . . 28 ASN CA . 16640 1 237 . 1 1 28 28 ASN CB C 13 37.4 0.5 . 1 . . . . . 28 ASN CB . 16640 1 238 . 1 1 28 28 ASN N N 15 121.0 0.5 . 1 . . . . . 28 ASN N . 16640 1 239 . 1 1 28 28 ASN ND2 N 15 112.5 0.5 . 1 . . . . . 28 ASN ND2 . 16640 1 240 . 1 1 29 29 LEU H H 1 8.34 0.05 . 1 . . . . . 29 LEU H . 16640 1 241 . 1 1 29 29 LEU HA H 1 4.75 0.05 . 1 . . . . . 29 LEU HA . 16640 1 242 . 1 1 29 29 LEU HB2 H 1 1.85 0.05 . 2 . . . . . 29 LEU HB2 . 16640 1 243 . 1 1 29 29 LEU HB3 H 1 1.59 0.05 . 2 . . . . . 29 LEU HB3 . 16640 1 244 . 1 1 29 29 LEU HD11 H 1 1.00 0.05 . 2 . . . . . 29 LEU HD1 . 16640 1 245 . 1 1 29 29 LEU HD12 H 1 1.00 0.05 . 2 . . . . . 29 LEU HD1 . 16640 1 246 . 1 1 29 29 LEU HD13 H 1 1.00 0.05 . 2 . . . . . 29 LEU HD1 . 16640 1 247 . 1 1 29 29 LEU HD21 H 1 1.04 0.05 . 2 . . . . . 29 LEU HD2 . 16640 1 248 . 1 1 29 29 LEU HD22 H 1 1.04 0.05 . 2 . . . . . 29 LEU HD2 . 16640 1 249 . 1 1 29 29 LEU HD23 H 1 1.04 0.05 . 2 . . . . . 29 LEU HD2 . 16640 1 250 . 1 1 29 29 LEU HG H 1 1.85 0.05 . 1 . . . . . 29 LEU HG . 16640 1 251 . 1 1 29 29 LEU CA C 13 54.2 0.5 . 1 . . . . . 29 LEU CA . 16640 1 252 . 1 1 29 29 LEU CB C 13 42.3 0.5 . 1 . . . . . 29 LEU CB . 16640 1 253 . 1 1 29 29 LEU CD1 C 13 25.4 0.5 . 1 . . . . . 29 LEU CD1 . 16640 1 254 . 1 1 29 29 LEU CD2 C 13 23.9 0.5 . 1 . . . . . 29 LEU CD2 . 16640 1 255 . 1 1 29 29 LEU CG C 13 27.0 0.5 . 1 . . . . . 29 LEU CG . 16640 1 256 . 1 1 29 29 LEU N N 15 123.4 0.5 . 1 . . . . . 29 LEU N . 16640 1 257 . 1 1 30 30 THR H H 1 8.18 0.05 . 1 . . . . . 30 THR H . 16640 1 258 . 1 1 30 30 THR HA H 1 4.03 0.05 . 1 . . . . . 30 THR HA . 16640 1 259 . 1 1 30 30 THR HB H 1 4.12 0.05 . 1 . . . . . 30 THR HB . 16640 1 260 . 1 1 30 30 THR HG21 H 1 1.28 0.05 . 1 . . . . . 30 THR HG2 . 16640 1 261 . 1 1 30 30 THR HG22 H 1 1.28 0.05 . 1 . . . . . 30 THR HG2 . 16640 1 262 . 1 1 30 30 THR HG23 H 1 1.28 0.05 . 1 . . . . . 30 THR HG2 . 16640 1 263 . 1 1 30 30 THR CA C 13 62.7 0.5 . 1 . . . . . 30 THR CA . 16640 1 264 . 1 1 30 30 THR CB C 13 69.7 0.5 . 1 . . . . . 30 THR CB . 16640 1 265 . 1 1 30 30 THR CG2 C 13 21.7 0.5 . 1 . . . . . 30 THR CG2 . 16640 1 266 . 1 1 30 30 THR N N 15 116.3 0.5 . 1 . . . . . 30 THR N . 16640 1 267 . 1 1 31 31 ARG H H 1 8.43 0.05 . 1 . . . . . 31 ARG H . 16640 1 268 . 1 1 31 31 ARG HA H 1 4.12 0.05 . 1 . . . . . 31 ARG HA . 16640 1 269 . 1 1 31 31 ARG HB2 H 1 1.79 0.05 . 2 . . . . . 31 ARG HB2 . 16640 1 270 . 1 1 31 31 ARG HB3 H 1 1.79 0.05 . 2 . . . . . 31 ARG HB3 . 16640 1 271 . 1 1 31 31 ARG HD2 H 1 3.19 0.05 . 2 . . . . . 31 ARG HD2 . 16640 1 272 . 1 1 31 31 ARG HD3 H 1 3.18 0.05 . 2 . . . . . 31 ARG HD3 . 16640 1 273 . 1 1 31 31 ARG HG2 H 1 1.71 0.05 . 2 . . . . . 31 ARG HG2 . 16640 1 274 . 1 1 31 31 ARG HG3 H 1 1.62 0.05 . 2 . . . . . 31 ARG HG3 . 16640 1 275 . 1 1 31 31 ARG CA C 13 57.5 0.5 . 1 . . . . . 31 ARG CA . 16640 1 276 . 1 1 31 31 ARG CB C 13 29.7 0.5 . 1 . . . . . 31 ARG CB . 16640 1 277 . 1 1 31 31 ARG CD C 13 43.3 0.5 . 1 . . . . . 31 ARG CD . 16640 1 278 . 1 1 31 31 ARG CG C 13 27.1 0.5 . 1 . . . . . 31 ARG CG . 16640 1 279 . 1 1 31 31 ARG N N 15 124.6 0.5 . 1 . . . . . 31 ARG N . 16640 1 280 . 1 1 32 32 GLY H H 1 8.70 0.05 . 1 . . . . . 32 GLY H . 16640 1 281 . 1 1 32 32 GLY HA2 H 1 4.02 0.05 . 2 . . . . . 32 GLY HA2 . 16640 1 282 . 1 1 32 32 GLY HA3 H 1 3.78 0.05 . 2 . . . . . 32 GLY HA3 . 16640 1 283 . 1 1 32 32 GLY CA C 13 45.2 0.5 . 1 . . . . . 32 GLY CA . 16640 1 284 . 1 1 32 32 GLY N N 15 110.7 0.5 . 1 . . . . . 32 GLY N . 16640 1 285 . 1 1 33 33 ILE H H 1 7.26 0.05 . 1 . . . . . 33 ILE H . 16640 1 286 . 1 1 33 33 ILE HA H 1 4.03 0.05 . 1 . . . . . 33 ILE HA . 16640 1 287 . 1 1 33 33 ILE HB H 1 1.90 0.05 . 1 . . . . . 33 ILE HB . 16640 1 288 . 1 1 33 33 ILE HD11 H 1 0.91 0.05 . 1 . . . . . 33 ILE HD1 . 16640 1 289 . 1 1 33 33 ILE HD12 H 1 0.91 0.05 . 1 . . . . . 33 ILE HD1 . 16640 1 290 . 1 1 33 33 ILE HD13 H 1 0.91 0.05 . 1 . . . . . 33 ILE HD1 . 16640 1 291 . 1 1 33 33 ILE HG12 H 1 1.11 0.05 . 2 . . . . . 33 ILE HG12 . 16640 1 292 . 1 1 33 33 ILE HG13 H 1 1.51 0.05 . 2 . . . . . 33 ILE HG13 . 16640 1 293 . 1 1 33 33 ILE HG21 H 1 0.67 0.05 . 1 . . . . . 33 ILE HG2 . 16640 1 294 . 1 1 33 33 ILE HG22 H 1 0.67 0.05 . 1 . . . . . 33 ILE HG2 . 16640 1 295 . 1 1 33 33 ILE HG23 H 1 0.67 0.05 . 1 . . . . . 33 ILE HG2 . 16640 1 296 . 1 1 33 33 ILE CA C 13 61.1 0.5 . 1 . . . . . 33 ILE CA . 16640 1 297 . 1 1 33 33 ILE CB C 13 37.8 0.5 . 1 . . . . . 33 ILE CB . 16640 1 298 . 1 1 33 33 ILE CD1 C 13 13.9 0.5 . 1 . . . . . 33 ILE CD1 . 16640 1 299 . 1 1 33 33 ILE CG1 C 13 28.8 0.5 . 1 . . . . . 33 ILE CG1 . 16640 1 300 . 1 1 33 33 ILE CG2 C 13 17.1 0.5 . 1 . . . . . 33 ILE CG2 . 16640 1 301 . 1 1 33 33 ILE N N 15 121.9 0.5 . 1 . . . . . 33 ILE N . 16640 1 302 . 1 1 34 34 ASN H H 1 9.21 0.05 . 1 . . . . . 34 ASN H . 16640 1 303 . 1 1 34 34 ASN HA H 1 4.82 0.05 . 1 . . . . . 34 ASN HA . 16640 1 304 . 1 1 34 34 ASN HB2 H 1 2.98 0.05 . 2 . . . . . 34 ASN HB2 . 16640 1 305 . 1 1 34 34 ASN HB3 H 1 2.59 0.05 . 2 . . . . . 34 ASN HB3 . 16640 1 306 . 1 1 34 34 ASN HD21 H 1 7.73 0.05 . 2 . . . . . 34 ASN HD21 . 16640 1 307 . 1 1 34 34 ASN HD22 H 1 7.00 0.05 . 2 . . . . . 34 ASN HD22 . 16640 1 308 . 1 1 34 34 ASN CA C 13 50.6 0.5 . 1 . . . . . 34 ASN CA . 16640 1 309 . 1 1 34 34 ASN CB C 13 38.1 0.5 . 1 . . . . . 34 ASN CB . 16640 1 310 . 1 1 34 34 ASN N N 15 126.9 0.5 . 1 . . . . . 34 ASN N . 16640 1 311 . 1 1 34 34 ASN ND2 N 15 111.8 0.5 . 1 . . . . . 34 ASN ND2 . 16640 1 312 . 1 1 35 35 LEU H H 1 8.56 0.05 . 1 . . . . . 35 LEU H . 16640 1 313 . 1 1 35 35 LEU HA H 1 3.75 0.05 . 1 . . . . . 35 LEU HA . 16640 1 314 . 1 1 35 35 LEU HB2 H 1 1.06 0.05 . 2 . . . . . 35 LEU HB2 . 16640 1 315 . 1 1 35 35 LEU HB3 H 1 1.58 0.05 . 2 . . . . . 35 LEU HB3 . 16640 1 316 . 1 1 35 35 LEU HD11 H 1 0.60 0.05 . 2 . . . . . 35 LEU HD1 . 16640 1 317 . 1 1 35 35 LEU HD12 H 1 0.60 0.05 . 2 . . . . . 35 LEU HD1 . 16640 1 318 . 1 1 35 35 LEU HD13 H 1 0.60 0.05 . 2 . . . . . 35 LEU HD1 . 16640 1 319 . 1 1 35 35 LEU HD21 H 1 0.07 0.05 . 2 . . . . . 35 LEU HD2 . 16640 1 320 . 1 1 35 35 LEU HD22 H 1 0.07 0.05 . 2 . . . . . 35 LEU HD2 . 16640 1 321 . 1 1 35 35 LEU HD23 H 1 0.07 0.05 . 2 . . . . . 35 LEU HD2 . 16640 1 322 . 1 1 35 35 LEU HG H 1 1.42 0.05 . 1 . . . . . 35 LEU HG . 16640 1 323 . 1 1 35 35 LEU CA C 13 56.6 0.5 . 1 . . . . . 35 LEU CA . 16640 1 324 . 1 1 35 35 LEU CB C 13 41.4 0.5 . 1 . . . . . 35 LEU CB . 16640 1 325 . 1 1 35 35 LEU CD1 C 13 25.4 0.5 . 1 . . . . . 35 LEU CD1 . 16640 1 326 . 1 1 35 35 LEU CD2 C 13 20.8 0.5 . 1 . . . . . 35 LEU CD2 . 16640 1 327 . 1 1 35 35 LEU CG C 13 26.3 0.5 . 1 . . . . . 35 LEU CG . 16640 1 328 . 1 1 35 35 LEU N N 15 123.0 0.5 . 1 . . . . . 35 LEU N . 16640 1 329 . 1 1 36 36 ARG H H 1 8.25 0.05 . 1 . . . . . 36 ARG H . 16640 1 330 . 1 1 36 36 ARG HA H 1 3.75 0.05 . 1 . . . . . 36 ARG HA . 16640 1 331 . 1 1 36 36 ARG HB2 H 1 1.83 0.05 . 2 . . . . . 36 ARG HB2 . 16640 1 332 . 1 1 36 36 ARG HB3 H 1 1.92 0.05 . 2 . . . . . 36 ARG HB3 . 16640 1 333 . 1 1 36 36 ARG HD2 H 1 3.06 0.05 . 2 . . . . . 36 ARG HD2 . 16640 1 334 . 1 1 36 36 ARG HD3 H 1 3.21 0.05 . 2 . . . . . 36 ARG HD3 . 16640 1 335 . 1 1 36 36 ARG HE H 1 7.33 0.05 . 1 . . . . . 36 ARG HE . 16640 1 336 . 1 1 36 36 ARG HG2 H 1 1.54 0.05 . 2 . . . . . 36 ARG HG2 . 16640 1 337 . 1 1 36 36 ARG HG3 H 1 1.54 0.05 . 2 . . . . . 36 ARG HG3 . 16640 1 338 . 1 1 36 36 ARG CA C 13 59.9 0.5 . 1 . . . . . 36 ARG CA . 16640 1 339 . 1 1 36 36 ARG CB C 13 28.3 0.5 . 1 . . . . . 36 ARG CB . 16640 1 340 . 1 1 36 36 ARG CD C 13 42.5 0.5 . 1 . . . . . 36 ARG CD . 16640 1 341 . 1 1 36 36 ARG CG C 13 27.2 0.5 . 1 . . . . . 36 ARG CG . 16640 1 342 . 1 1 36 36 ARG N N 15 121.6 0.5 . 1 . . . . . 36 ARG N . 16640 1 343 . 1 1 36 36 ARG NE N 15 82.8 0.5 . 1 . . . . . 36 ARG NE . 16640 1 344 . 1 1 37 37 LYS H H 1 7.19 0.05 . 1 . . . . . 37 LYS H . 16640 1 345 . 1 1 37 37 LYS HA H 1 3.94 0.05 . 1 . . . . . 37 LYS HA . 16640 1 346 . 1 1 37 37 LYS HB2 H 1 1.67 0.05 . 2 . . . . . 37 LYS HB2 . 16640 1 347 . 1 1 37 37 LYS HB3 H 1 1.66 0.05 . 2 . . . . . 37 LYS HB3 . 16640 1 348 . 1 1 37 37 LYS HD2 H 1 1.59 0.05 . 2 . . . . . 37 LYS HD2 . 16640 1 349 . 1 1 37 37 LYS HD3 H 1 1.61 0.05 . 2 . . . . . 37 LYS HD3 . 16640 1 350 . 1 1 37 37 LYS HE2 H 1 2.84 0.05 . 2 . . . . . 37 LYS HE2 . 16640 1 351 . 1 1 37 37 LYS HE3 H 1 2.90 0.05 . 2 . . . . . 37 LYS HE3 . 16640 1 352 . 1 1 37 37 LYS HG2 H 1 1.28 0.05 . 2 . . . . . 37 LYS HG2 . 16640 1 353 . 1 1 37 37 LYS HG3 H 1 1.36 0.05 . 2 . . . . . 37 LYS HG3 . 16640 1 354 . 1 1 37 37 LYS CA C 13 58.0 0.5 . 1 . . . . . 37 LYS CA . 16640 1 355 . 1 1 37 37 LYS CB C 13 32.0 0.5 . 1 . . . . . 37 LYS CB . 16640 1 356 . 1 1 37 37 LYS CD C 13 28.9 0.5 . 1 . . . . . 37 LYS CD . 16640 1 357 . 1 1 37 37 LYS CE C 13 41.8 0.5 . 1 . . . . . 37 LYS CE . 16640 1 358 . 1 1 37 37 LYS CG C 13 24.8 0.5 . 1 . . . . . 37 LYS CG . 16640 1 359 . 1 1 37 37 LYS N N 15 118.1 0.5 . 1 . . . . . 37 LYS N . 16640 1 360 . 1 1 38 38 ILE H H 1 6.76 0.05 . 1 . . . . . 38 ILE H . 16640 1 361 . 1 1 38 38 ILE HA H 1 3.62 0.05 . 1 . . . . . 38 ILE HA . 16640 1 362 . 1 1 38 38 ILE HB H 1 2.11 0.05 . 1 . . . . . 38 ILE HB . 16640 1 363 . 1 1 38 38 ILE HD11 H 1 0.57 0.05 . 1 . . . . . 38 ILE HD1 . 16640 1 364 . 1 1 38 38 ILE HD12 H 1 0.57 0.05 . 1 . . . . . 38 ILE HD1 . 16640 1 365 . 1 1 38 38 ILE HD13 H 1 0.57 0.05 . 1 . . . . . 38 ILE HD1 . 16640 1 366 . 1 1 38 38 ILE HG12 H 1 1.62 0.05 . 2 . . . . . 38 ILE HG12 . 16640 1 367 . 1 1 38 38 ILE HG13 H 1 0.99 0.05 . 2 . . . . . 38 ILE HG13 . 16640 1 368 . 1 1 38 38 ILE HG21 H 1 0.77 0.05 . 1 . . . . . 38 ILE HG2 . 16640 1 369 . 1 1 38 38 ILE HG22 H 1 0.77 0.05 . 1 . . . . . 38 ILE HG2 . 16640 1 370 . 1 1 38 38 ILE HG23 H 1 0.77 0.05 . 1 . . . . . 38 ILE HG2 . 16640 1 371 . 1 1 38 38 ILE CA C 13 62.0 0.5 . 1 . . . . . 38 ILE CA . 16640 1 372 . 1 1 38 38 ILE CB C 13 34.1 0.5 . 1 . . . . . 38 ILE CB . 16640 1 373 . 1 1 38 38 ILE CD1 C 13 10.6 0.5 . 1 . . . . . 38 ILE CD1 . 16640 1 374 . 1 1 38 38 ILE CG1 C 13 26.1 0.5 . 1 . . . . . 38 ILE CG1 . 16640 1 375 . 1 1 38 38 ILE CG2 C 13 17.6 0.5 . 1 . . . . . 38 ILE CG2 . 16640 1 376 . 1 1 38 38 ILE N N 15 115.5 0.5 . 1 . . . . . 38 ILE N . 16640 1 377 . 1 1 39 39 ALA H H 1 8.12 0.05 . 1 . . . . . 39 ALA H . 16640 1 378 . 1 1 39 39 ALA HA H 1 3.70 0.05 . 1 . . . . . 39 ALA HA . 16640 1 379 . 1 1 39 39 ALA HB1 H 1 1.44 0.05 . 1 . . . . . 39 ALA HB . 16640 1 380 . 1 1 39 39 ALA HB2 H 1 1.44 0.05 . 1 . . . . . 39 ALA HB . 16640 1 381 . 1 1 39 39 ALA HB3 H 1 1.44 0.05 . 1 . . . . . 39 ALA HB . 16640 1 382 . 1 1 39 39 ALA CA C 13 55.9 0.5 . 1 . . . . . 39 ALA CA . 16640 1 383 . 1 1 39 39 ALA CB C 13 17.4 0.5 . 1 . . . . . 39 ALA CB . 16640 1 384 . 1 1 39 39 ALA N N 15 120.9 0.5 . 1 . . . . . 39 ALA N . 16640 1 385 . 1 1 40 40 GLU H H 1 8.39 0.05 . 1 . . . . . 40 GLU H . 16640 1 386 . 1 1 40 40 GLU HA H 1 3.87 0.05 . 1 . . . . . 40 GLU HA . 16640 1 387 . 1 1 40 40 GLU HB2 H 1 2.20 0.05 . 2 . . . . . 40 GLU HB2 . 16640 1 388 . 1 1 40 40 GLU HB3 H 1 2.04 0.05 . 2 . . . . . 40 GLU HB3 . 16640 1 389 . 1 1 40 40 GLU HG2 H 1 2.20 0.05 . 2 . . . . . 40 GLU HG2 . 16640 1 390 . 1 1 40 40 GLU HG3 H 1 2.42 0.05 . 2 . . . . . 40 GLU HG3 . 16640 1 391 . 1 1 40 40 GLU CA C 13 58.6 0.5 . 1 . . . . . 40 GLU CA . 16640 1 392 . 1 1 40 40 GLU CB C 13 29.5 0.5 . 1 . . . . . 40 GLU CB . 16640 1 393 . 1 1 40 40 GLU CG C 13 36.0 0.5 . 1 . . . . . 40 GLU CG . 16640 1 394 . 1 1 40 40 GLU N N 15 120.2 0.5 . 1 . . . . . 40 GLU N . 16640 1 395 . 1 1 41 41 LEU H H 1 7.48 0.05 . 1 . . . . . 41 LEU H . 16640 1 396 . 1 1 41 41 LEU HA H 1 4.23 0.05 . 1 . . . . . 41 LEU HA . 16640 1 397 . 1 1 41 41 LEU HB2 H 1 2.11 0.05 . 2 . . . . . 41 LEU HB2 . 16640 1 398 . 1 1 41 41 LEU HB3 H 1 1.74 0.05 . 2 . . . . . 41 LEU HB3 . 16640 1 399 . 1 1 41 41 LEU HD11 H 1 0.90 0.05 . 2 . . . . . 41 LEU HD1 . 16640 1 400 . 1 1 41 41 LEU HD12 H 1 0.90 0.05 . 2 . . . . . 41 LEU HD1 . 16640 1 401 . 1 1 41 41 LEU HD13 H 1 0.90 0.05 . 2 . . . . . 41 LEU HD1 . 16640 1 402 . 1 1 41 41 LEU HD21 H 1 0.87 0.05 . 2 . . . . . 41 LEU HD2 . 16640 1 403 . 1 1 41 41 LEU HD22 H 1 0.87 0.05 . 2 . . . . . 41 LEU HD2 . 16640 1 404 . 1 1 41 41 LEU HD23 H 1 0.87 0.05 . 2 . . . . . 41 LEU HD2 . 16640 1 405 . 1 1 41 41 LEU HG H 1 2.04 0.05 . 1 . . . . . 41 LEU HG . 16640 1 406 . 1 1 41 41 LEU CA C 13 55.0 0.5 . 1 . . . . . 41 LEU CA . 16640 1 407 . 1 1 41 41 LEU CB C 13 43.5 0.5 . 1 . . . . . 41 LEU CB . 16640 1 408 . 1 1 41 41 LEU CD1 C 13 25.3 0.5 . 1 . . . . . 41 LEU CD1 . 16640 1 409 . 1 1 41 41 LEU CD2 C 13 22.2 0.5 . 1 . . . . . 41 LEU CD2 . 16640 1 410 . 1 1 41 41 LEU CG C 13 25.9 0.5 . 1 . . . . . 41 LEU CG . 16640 1 411 . 1 1 41 41 LEU N N 15 117.6 0.5 . 1 . . . . . 41 LEU N . 16640 1 412 . 1 1 42 42 MET H H 1 7.00 0.05 . 1 . . . . . 42 MET H . 16640 1 413 . 1 1 42 42 MET HA H 1 4.85 0.05 . 1 . . . . . 42 MET HA . 16640 1 414 . 1 1 42 42 MET HB2 H 1 1.71 0.05 . 2 . . . . . 42 MET HB2 . 16640 1 415 . 1 1 42 42 MET HB3 H 1 2.27 0.05 . 2 . . . . . 42 MET HB3 . 16640 1 416 . 1 1 42 42 MET HE1 H 1 1.91 0.05 . 1 . . . . . 42 MET HE . 16640 1 417 . 1 1 42 42 MET HE2 H 1 1.91 0.05 . 1 . . . . . 42 MET HE . 16640 1 418 . 1 1 42 42 MET HE3 H 1 1.91 0.05 . 1 . . . . . 42 MET HE . 16640 1 419 . 1 1 42 42 MET HG2 H 1 2.29 0.05 . 2 . . . . . 42 MET HG2 . 16640 1 420 . 1 1 42 42 MET HG3 H 1 2.86 0.05 . 2 . . . . . 42 MET HG3 . 16640 1 421 . 1 1 42 42 MET CA C 13 53.3 0.5 . 1 . . . . . 42 MET CA . 16640 1 422 . 1 1 42 42 MET CB C 13 34.7 0.5 . 1 . . . . . 42 MET CB . 16640 1 423 . 1 1 42 42 MET CE C 13 18.4 0.5 . 1 . . . . . 42 MET CE . 16640 1 424 . 1 1 42 42 MET CG C 13 32.2 0.5 . 1 . . . . . 42 MET CG . 16640 1 425 . 1 1 42 42 MET N N 15 114.9 0.5 . 1 . . . . . 42 MET N . 16640 1 426 . 1 1 43 43 PRO HA H 1 4.17 0.05 . 1 . . . . . 43 PRO HA . 16640 1 427 . 1 1 43 43 PRO HB2 H 1 1.91 0.05 . 2 . . . . . 43 PRO HB2 . 16640 1 428 . 1 1 43 43 PRO HB3 H 1 2.08 0.05 . 2 . . . . . 43 PRO HB3 . 16640 1 429 . 1 1 43 43 PRO HD2 H 1 3.49 0.05 . 2 . . . . . 43 PRO HD2 . 16640 1 430 . 1 1 43 43 PRO HD3 H 1 3.43 0.05 . 2 . . . . . 43 PRO HD3 . 16640 1 431 . 1 1 43 43 PRO HG2 H 1 2.06 0.05 . 2 . . . . . 43 PRO HG2 . 16640 1 432 . 1 1 43 43 PRO HG3 H 1 1.95 0.05 . 2 . . . . . 43 PRO HG3 . 16640 1 433 . 1 1 43 43 PRO CA C 13 64.3 0.5 . 1 . . . . . 43 PRO CA . 16640 1 434 . 1 1 43 43 PRO CB C 13 30.5 0.5 . 1 . . . . . 43 PRO CB . 16640 1 435 . 1 1 43 43 PRO CD C 13 49.6 0.5 . 1 . . . . . 43 PRO CD . 16640 1 436 . 1 1 43 43 PRO CG C 13 27.7 0.5 . 1 . . . . . 43 PRO CG . 16640 1 437 . 1 1 44 44 GLY H H 1 8.00 0.05 . 1 . . . . . 44 GLY H . 16640 1 438 . 1 1 44 44 GLY HA2 H 1 3.64 0.05 . 2 . . . . . 44 GLY HA2 . 16640 1 439 . 1 1 44 44 GLY HA3 H 1 4.01 0.05 . 2 . . . . . 44 GLY HA3 . 16640 1 440 . 1 1 44 44 GLY CA C 13 45.2 0.5 . 1 . . . . . 44 GLY CA . 16640 1 441 . 1 1 44 44 GLY N N 15 110.6 0.5 . 1 . . . . . 44 GLY N . 16640 1 442 . 1 1 45 45 ALA H H 1 7.40 0.05 . 1 . . . . . 45 ALA H . 16640 1 443 . 1 1 45 45 ALA HA H 1 4.49 0.05 . 1 . . . . . 45 ALA HA . 16640 1 444 . 1 1 45 45 ALA HB1 H 1 1.46 0.05 . 1 . . . . . 45 ALA HB . 16640 1 445 . 1 1 45 45 ALA HB2 H 1 1.46 0.05 . 1 . . . . . 45 ALA HB . 16640 1 446 . 1 1 45 45 ALA HB3 H 1 1.46 0.05 . 1 . . . . . 45 ALA HB . 16640 1 447 . 1 1 45 45 ALA CA C 13 51.7 0.5 . 1 . . . . . 45 ALA CA . 16640 1 448 . 1 1 45 45 ALA CB C 13 21.4 0.5 . 1 . . . . . 45 ALA CB . 16640 1 449 . 1 1 45 45 ALA N N 15 122.0 0.5 . 1 . . . . . 45 ALA N . 16640 1 450 . 1 1 46 46 SER H H 1 9.32 0.05 . 1 . . . . . 46 SER H . 16640 1 451 . 1 1 46 46 SER HA H 1 4.66 0.05 . 1 . . . . . 46 SER HA . 16640 1 452 . 1 1 46 46 SER HB2 H 1 3.91 0.05 . 2 . . . . . 46 SER HB2 . 16640 1 453 . 1 1 46 46 SER HB3 H 1 4.36 0.05 . 2 . . . . . 46 SER HB3 . 16640 1 454 . 1 1 46 46 SER CA C 13 56.3 0.5 . 1 . . . . . 46 SER CA . 16640 1 455 . 1 1 46 46 SER CB C 13 65.5 0.5 . 1 . . . . . 46 SER CB . 16640 1 456 . 1 1 46 46 SER N N 15 117.0 0.5 . 1 . . . . . 46 SER N . 16640 1 457 . 1 1 47 47 GLY H H 1 9.16 0.05 . 1 . . . . . 47 GLY H . 16640 1 458 . 1 1 47 47 GLY HA2 H 1 3.64 0.05 . 2 . . . . . 47 GLY HA2 . 16640 1 459 . 1 1 47 47 GLY HA3 H 1 4.09 0.05 . 2 . . . . . 47 GLY HA3 . 16640 1 460 . 1 1 47 47 GLY CA C 13 47.8 0.5 . 1 . . . . . 47 GLY CA . 16640 1 461 . 1 1 47 47 GLY N N 15 108.2 0.5 . 1 . . . . . 47 GLY N . 16640 1 462 . 1 1 48 48 ALA H H 1 8.30 0.05 . 1 . . . . . 48 ALA H . 16640 1 463 . 1 1 48 48 ALA HA H 1 4.04 0.05 . 1 . . . . . 48 ALA HA . 16640 1 464 . 1 1 48 48 ALA HB1 H 1 1.38 0.05 . 1 . . . . . 48 ALA HB . 16640 1 465 . 1 1 48 48 ALA HB2 H 1 1.38 0.05 . 1 . . . . . 48 ALA HB . 16640 1 466 . 1 1 48 48 ALA HB3 H 1 1.38 0.05 . 1 . . . . . 48 ALA HB . 16640 1 467 . 1 1 48 48 ALA CA C 13 54.8 0.5 . 1 . . . . . 48 ALA CA . 16640 1 468 . 1 1 48 48 ALA CB C 13 18.0 0.5 . 1 . . . . . 48 ALA CB . 16640 1 469 . 1 1 48 48 ALA N N 15 123.1 0.5 . 1 . . . . . 48 ALA N . 16640 1 470 . 1 1 49 49 GLU H H 1 7.83 0.05 . 1 . . . . . 49 GLU H . 16640 1 471 . 1 1 49 49 GLU HA H 1 3.96 0.05 . 1 . . . . . 49 GLU HA . 16640 1 472 . 1 1 49 49 GLU HB2 H 1 2.48 0.05 . 2 . . . . . 49 GLU HB2 . 16640 1 473 . 1 1 49 49 GLU HB3 H 1 1.78 0.05 . 2 . . . . . 49 GLU HB3 . 16640 1 474 . 1 1 49 49 GLU HG2 H 1 2.20 0.05 . 2 . . . . . 49 GLU HG2 . 16640 1 475 . 1 1 49 49 GLU HG3 H 1 2.27 0.05 . 2 . . . . . 49 GLU HG3 . 16640 1 476 . 1 1 49 49 GLU CA C 13 59.0 0.5 . 1 . . . . . 49 GLU CA . 16640 1 477 . 1 1 49 49 GLU CB C 13 29.3 0.5 . 1 . . . . . 49 GLU CB . 16640 1 478 . 1 1 49 49 GLU CG C 13 37.6 0.5 . 1 . . . . . 49 GLU CG . 16640 1 479 . 1 1 49 49 GLU N N 15 121.3 0.5 . 1 . . . . . 49 GLU N . 16640 1 480 . 1 1 50 50 VAL H H 1 8.05 0.05 . 1 . . . . . 50 VAL H . 16640 1 481 . 1 1 50 50 VAL HA H 1 3.43 0.05 . 1 . . . . . 50 VAL HA . 16640 1 482 . 1 1 50 50 VAL HB H 1 2.22 0.05 . 1 . . . . . 50 VAL HB . 16640 1 483 . 1 1 50 50 VAL HG11 H 1 0.99 0.05 . 2 . . . . . 50 VAL HG1 . 16640 1 484 . 1 1 50 50 VAL HG12 H 1 0.99 0.05 . 2 . . . . . 50 VAL HG1 . 16640 1 485 . 1 1 50 50 VAL HG13 H 1 0.99 0.05 . 2 . . . . . 50 VAL HG1 . 16640 1 486 . 1 1 50 50 VAL HG21 H 1 1.07 0.05 . 2 . . . . . 50 VAL HG2 . 16640 1 487 . 1 1 50 50 VAL HG22 H 1 1.07 0.05 . 2 . . . . . 50 VAL HG2 . 16640 1 488 . 1 1 50 50 VAL HG23 H 1 1.07 0.05 . 2 . . . . . 50 VAL HG2 . 16640 1 489 . 1 1 50 50 VAL CA C 13 66.9 0.5 . 1 . . . . . 50 VAL CA . 16640 1 490 . 1 1 50 50 VAL CB C 13 30.8 0.5 . 1 . . . . . 50 VAL CB . 16640 1 491 . 1 1 50 50 VAL CG1 C 13 23.0 0.5 . 1 . . . . . 50 VAL CG1 . 16640 1 492 . 1 1 50 50 VAL CG2 C 13 21.8 0.5 . 1 . . . . . 50 VAL CG2 . 16640 1 493 . 1 1 50 50 VAL N N 15 119.3 0.5 . 1 . . . . . 50 VAL N . 16640 1 494 . 1 1 51 51 LYS H H 1 7.91 0.05 . 1 . . . . . 51 LYS H . 16640 1 495 . 1 1 51 51 LYS HA H 1 3.52 0.05 . 1 . . . . . 51 LYS HA . 16640 1 496 . 1 1 51 51 LYS HB2 H 1 1.64 0.05 . 2 . . . . . 51 LYS HB2 . 16640 1 497 . 1 1 51 51 LYS HB3 H 1 1.32 0.05 . 2 . . . . . 51 LYS HB3 . 16640 1 498 . 1 1 51 51 LYS HD2 H 1 1.30 0.05 . 2 . . . . . 51 LYS HD2 . 16640 1 499 . 1 1 51 51 LYS HD3 H 1 1.30 0.05 . 2 . . . . . 51 LYS HD3 . 16640 1 500 . 1 1 51 51 LYS HE2 H 1 2.71 0.05 . 2 . . . . . 51 LYS HE2 . 16640 1 501 . 1 1 51 51 LYS HE3 H 1 2.71 0.05 . 2 . . . . . 51 LYS HE3 . 16640 1 502 . 1 1 51 51 LYS HG2 H 1 0.76 0.05 . 2 . . . . . 51 LYS HG2 . 16640 1 503 . 1 1 51 51 LYS HG3 H 1 0.76 0.05 . 2 . . . . . 51 LYS HG3 . 16640 1 504 . 1 1 51 51 LYS CA C 13 60.3 0.5 . 1 . . . . . 51 LYS CA . 16640 1 505 . 1 1 51 51 LYS CB C 13 31.9 0.5 . 1 . . . . . 51 LYS CB . 16640 1 506 . 1 1 51 51 LYS CD C 13 29.2 0.5 . 1 . . . . . 51 LYS CD . 16640 1 507 . 1 1 51 51 LYS CE C 13 41.8 0.5 . 1 . . . . . 51 LYS CE . 16640 1 508 . 1 1 51 51 LYS CG C 13 24.6 0.5 . 1 . . . . . 51 LYS CG . 16640 1 509 . 1 1 51 51 LYS N N 15 119.0 0.5 . 1 . . . . . 51 LYS N . 16640 1 510 . 1 1 52 52 GLY H H 1 8.20 0.05 . 1 . . . . . 52 GLY H . 16640 1 511 . 1 1 52 52 GLY HA2 H 1 3.87 0.05 . 2 . . . . . 52 GLY HA2 . 16640 1 512 . 1 1 52 52 GLY HA3 H 1 3.81 0.05 . 2 . . . . . 52 GLY HA3 . 16640 1 513 . 1 1 52 52 GLY CA C 13 46.6 0.5 . 1 . . . . . 52 GLY CA . 16640 1 514 . 1 1 52 52 GLY N N 15 107.5 0.5 . 1 . . . . . 52 GLY N . 16640 1 515 . 1 1 53 53 VAL H H 1 8.17 0.05 . 1 . . . . . 53 VAL H . 16640 1 516 . 1 1 53 53 VAL HA H 1 3.57 0.05 . 1 . . . . . 53 VAL HA . 16640 1 517 . 1 1 53 53 VAL HB H 1 2.47 0.05 . 1 . . . . . 53 VAL HB . 16640 1 518 . 1 1 53 53 VAL HG11 H 1 1.09 0.05 . 2 . . . . . 53 VAL HG1 . 16640 1 519 . 1 1 53 53 VAL HG12 H 1 1.09 0.05 . 2 . . . . . 53 VAL HG1 . 16640 1 520 . 1 1 53 53 VAL HG13 H 1 1.09 0.05 . 2 . . . . . 53 VAL HG1 . 16640 1 521 . 1 1 53 53 VAL HG21 H 1 1.16 0.05 . 2 . . . . . 53 VAL HG2 . 16640 1 522 . 1 1 53 53 VAL HG22 H 1 1.16 0.05 . 2 . . . . . 53 VAL HG2 . 16640 1 523 . 1 1 53 53 VAL HG23 H 1 1.16 0.05 . 2 . . . . . 53 VAL HG2 . 16640 1 524 . 1 1 53 53 VAL CA C 13 66.6 0.5 . 1 . . . . . 53 VAL CA . 16640 1 525 . 1 1 53 53 VAL CB C 13 31.3 0.5 . 1 . . . . . 53 VAL CB . 16640 1 526 . 1 1 53 53 VAL CG1 C 13 21.3 0.5 . 1 . . . . . 53 VAL CG1 . 16640 1 527 . 1 1 53 53 VAL CG2 C 13 24.3 0.5 . 1 . . . . . 53 VAL CG2 . 16640 1 528 . 1 1 53 53 VAL N N 15 123.2 0.5 . 1 . . . . . 53 VAL N . 16640 1 529 . 1 1 54 54 CYS H H 1 7.42 0.05 . 1 . . . . . 54 CYS H . 16640 1 530 . 1 1 54 54 CYS HA H 1 3.96 0.05 . 1 . . . . . 54 CYS HA . 16640 1 531 . 1 1 54 54 CYS HB2 H 1 2.91 0.05 . 2 . . . . . 54 CYS HB2 . 16640 1 532 . 1 1 54 54 CYS HB3 H 1 3.35 0.05 . 2 . . . . . 54 CYS HB3 . 16640 1 533 . 1 1 54 54 CYS HG H 1 2.44 0.05 . 1 . . . . . 54 CYS HG . 16640 1 534 . 1 1 54 54 CYS CA C 13 63.8 0.5 . 1 . . . . . 54 CYS CA . 16640 1 535 . 1 1 54 54 CYS CB C 13 26.6 0.5 . 1 . . . . . 54 CYS CB . 16640 1 536 . 1 1 54 54 CYS N N 15 117.5 0.5 . 1 . . . . . 54 CYS N . 16640 1 537 . 1 1 55 55 THR H H 1 7.94 0.05 . 1 . . . . . 55 THR H . 16640 1 538 . 1 1 55 55 THR HA H 1 3.82 0.05 . 1 . . . . . 55 THR HA . 16640 1 539 . 1 1 55 55 THR HB H 1 4.20 0.05 . 1 . . . . . 55 THR HB . 16640 1 540 . 1 1 55 55 THR HG21 H 1 1.15 0.05 . 1 . . . . . 55 THR HG2 . 16640 1 541 . 1 1 55 55 THR HG22 H 1 1.15 0.05 . 1 . . . . . 55 THR HG2 . 16640 1 542 . 1 1 55 55 THR HG23 H 1 1.15 0.05 . 1 . . . . . 55 THR HG2 . 16640 1 543 . 1 1 55 55 THR CA C 13 65.5 0.5 . 1 . . . . . 55 THR CA . 16640 1 544 . 1 1 55 55 THR CB C 13 68.5 0.5 . 1 . . . . . 55 THR CB . 16640 1 545 . 1 1 55 55 THR CG2 C 13 21.7 0.5 . 1 . . . . . 55 THR CG2 . 16640 1 546 . 1 1 55 55 THR N N 15 115.5 0.5 . 1 . . . . . 55 THR N . 16640 1 547 . 1 1 56 56 GLU H H 1 8.43 0.05 . 1 . . . . . 56 GLU H . 16640 1 548 . 1 1 56 56 GLU HA H 1 3.88 0.05 . 1 . . . . . 56 GLU HA . 16640 1 549 . 1 1 56 56 GLU HB2 H 1 1.92 0.05 . 2 . . . . . 56 GLU HB2 . 16640 1 550 . 1 1 56 56 GLU HB3 H 1 1.84 0.05 . 2 . . . . . 56 GLU HB3 . 16640 1 551 . 1 1 56 56 GLU HG2 H 1 2.25 0.05 . 2 . . . . . 56 GLU HG2 . 16640 1 552 . 1 1 56 56 GLU HG3 H 1 2.04 0.05 . 2 . . . . . 56 GLU HG3 . 16640 1 553 . 1 1 56 56 GLU CA C 13 58.3 0.5 . 1 . . . . . 56 GLU CA . 16640 1 554 . 1 1 56 56 GLU CB C 13 28.5 0.5 . 1 . . . . . 56 GLU CB . 16640 1 555 . 1 1 56 56 GLU CG C 13 34.8 0.5 . 1 . . . . . 56 GLU CG . 16640 1 556 . 1 1 56 56 GLU N N 15 121.9 0.5 . 1 . . . . . 56 GLU N . 16640 1 557 . 1 1 57 57 ALA H H 1 8.36 0.05 . 1 . . . . . 57 ALA H . 16640 1 558 . 1 1 57 57 ALA HA H 1 3.76 0.05 . 1 . . . . . 57 ALA HA . 16640 1 559 . 1 1 57 57 ALA HB1 H 1 0.43 0.05 . 1 . . . . . 57 ALA HB . 16640 1 560 . 1 1 57 57 ALA HB2 H 1 0.43 0.05 . 1 . . . . . 57 ALA HB . 16640 1 561 . 1 1 57 57 ALA HB3 H 1 0.43 0.05 . 1 . . . . . 57 ALA HB . 16640 1 562 . 1 1 57 57 ALA CA C 13 55.2 0.5 . 1 . . . . . 57 ALA CA . 16640 1 563 . 1 1 57 57 ALA CB C 13 16.1 0.5 . 1 . . . . . 57 ALA CB . 16640 1 564 . 1 1 57 57 ALA N N 15 122.3 0.5 . 1 . . . . . 57 ALA N . 16640 1 565 . 1 1 58 58 GLY H H 1 7.36 0.05 . 1 . . . . . 58 GLY H . 16640 1 566 . 1 1 58 58 GLY HA2 H 1 3.70 0.05 . 2 . . . . . 58 GLY HA2 . 16640 1 567 . 1 1 58 58 GLY HA3 H 1 3.84 0.05 . 2 . . . . . 58 GLY HA3 . 16640 1 568 . 1 1 58 58 GLY CA C 13 46.5 0.5 . 1 . . . . . 58 GLY CA . 16640 1 569 . 1 1 58 58 GLY N N 15 99.8 0.5 . 1 . . . . . 58 GLY N . 16640 1 570 . 1 1 59 59 MET H H 1 7.61 0.05 . 1 . . . . . 59 MET H . 16640 1 571 . 1 1 59 59 MET HA H 1 4.26 0.05 . 1 . . . . . 59 MET HA . 16640 1 572 . 1 1 59 59 MET HB2 H 1 1.90 0.05 . 2 . . . . . 59 MET HB2 . 16640 1 573 . 1 1 59 59 MET HB3 H 1 2.14 0.05 . 2 . . . . . 59 MET HB3 . 16640 1 574 . 1 1 59 59 MET HE1 H 1 1.94 0.05 . 1 . . . . . 59 MET HE . 16640 1 575 . 1 1 59 59 MET HE2 H 1 1.94 0.05 . 1 . . . . . 59 MET HE . 16640 1 576 . 1 1 59 59 MET HE3 H 1 1.94 0.05 . 1 . . . . . 59 MET HE . 16640 1 577 . 1 1 59 59 MET HG2 H 1 2.53 0.05 . 2 . . . . . 59 MET HG2 . 16640 1 578 . 1 1 59 59 MET HG3 H 1 2.59 0.05 . 2 . . . . . 59 MET HG3 . 16640 1 579 . 1 1 59 59 MET CA C 13 57.3 0.5 . 1 . . . . . 59 MET CA . 16640 1 580 . 1 1 59 59 MET CB C 13 30.8 0.5 . 1 . . . . . 59 MET CB . 16640 1 581 . 1 1 59 59 MET CE C 13 16.6 0.5 . 1 . . . . . 59 MET CE . 16640 1 582 . 1 1 59 59 MET CG C 13 31.8 0.5 . 1 . . . . . 59 MET CG . 16640 1 583 . 1 1 59 59 MET N N 15 121.5 0.5 . 1 . . . . . 59 MET N . 16640 1 584 . 1 1 60 60 TYR H H 1 7.98 0.05 . 1 . . . . . 60 TYR H . 16640 1 585 . 1 1 60 60 TYR HA H 1 4.14 0.05 . 1 . . . . . 60 TYR HA . 16640 1 586 . 1 1 60 60 TYR HB2 H 1 3.01 0.05 . 2 . . . . . 60 TYR HB2 . 16640 1 587 . 1 1 60 60 TYR HB3 H 1 3.10 0.05 . 2 . . . . . 60 TYR HB3 . 16640 1 588 . 1 1 60 60 TYR HD1 H 1 7.17 0.05 . 3 . . . . . 60 TYR HD1 . 16640 1 589 . 1 1 60 60 TYR HD2 H 1 7.17 0.05 . 3 . . . . . 60 TYR HD2 . 16640 1 590 . 1 1 60 60 TYR HE1 H 1 6.60 0.05 . 3 . . . . . 60 TYR HE1 . 16640 1 591 . 1 1 60 60 TYR HE2 H 1 6.60 0.05 . 3 . . . . . 60 TYR HE2 . 16640 1 592 . 1 1 60 60 TYR CA C 13 61.6 0.5 . 1 . . . . . 60 TYR CA . 16640 1 593 . 1 1 60 60 TYR CB C 13 37.0 0.5 . 1 . . . . . 60 TYR CB . 16640 1 594 . 1 1 60 60 TYR CD1 C 13 132.8 0.5 . 1 . . . . . 60 TYR CD1 . 16640 1 595 . 1 1 60 60 TYR CE1 C 13 118.9 0.5 . 1 . . . . . 60 TYR CE1 . 16640 1 596 . 1 1 60 60 TYR N N 15 121.1 0.5 . 1 . . . . . 60 TYR N . 16640 1 597 . 1 1 61 61 ALA H H 1 7.21 0.05 . 1 . . . . . 61 ALA H . 16640 1 598 . 1 1 61 61 ALA HA H 1 4.01 0.05 . 1 . . . . . 61 ALA HA . 16640 1 599 . 1 1 61 61 ALA HB1 H 1 1.39 0.05 . 1 . . . . . 61 ALA HB . 16640 1 600 . 1 1 61 61 ALA HB2 H 1 1.39 0.05 . 1 . . . . . 61 ALA HB . 16640 1 601 . 1 1 61 61 ALA HB3 H 1 1.39 0.05 . 1 . . . . . 61 ALA HB . 16640 1 602 . 1 1 61 61 ALA CA C 13 55.4 0.5 . 1 . . . . . 61 ALA CA . 16640 1 603 . 1 1 61 61 ALA CB C 13 18.3 0.5 . 1 . . . . . 61 ALA CB . 16640 1 604 . 1 1 61 61 ALA N N 15 120.4 0.5 . 1 . . . . . 61 ALA N . 16640 1 605 . 1 1 62 62 LEU H H 1 7.71 0.05 . 1 . . . . . 62 LEU H . 16640 1 606 . 1 1 62 62 LEU HA H 1 4.14 0.05 . 1 . . . . . 62 LEU HA . 16640 1 607 . 1 1 62 62 LEU HB2 H 1 1.74 0.05 . 2 . . . . . 62 LEU HB2 . 16640 1 608 . 1 1 62 62 LEU HB3 H 1 1.74 0.05 . 2 . . . . . 62 LEU HB3 . 16640 1 609 . 1 1 62 62 LEU HD11 H 1 0.89 0.05 . 2 . . . . . 62 LEU HD1 . 16640 1 610 . 1 1 62 62 LEU HD12 H 1 0.89 0.05 . 2 . . . . . 62 LEU HD1 . 16640 1 611 . 1 1 62 62 LEU HD13 H 1 0.89 0.05 . 2 . . . . . 62 LEU HD1 . 16640 1 612 . 1 1 62 62 LEU HD21 H 1 0.87 0.05 . 2 . . . . . 62 LEU HD2 . 16640 1 613 . 1 1 62 62 LEU HD22 H 1 0.87 0.05 . 2 . . . . . 62 LEU HD2 . 16640 1 614 . 1 1 62 62 LEU HD23 H 1 0.87 0.05 . 2 . . . . . 62 LEU HD2 . 16640 1 615 . 1 1 62 62 LEU HG H 1 1.63 0.05 . 1 . . . . . 62 LEU HG . 16640 1 616 . 1 1 62 62 LEU CA C 13 57.9 0.5 . 1 . . . . . 62 LEU CA . 16640 1 617 . 1 1 62 62 LEU CB C 13 41.8 0.5 . 1 . . . . . 62 LEU CB . 16640 1 618 . 1 1 62 62 LEU CD1 C 13 24.0 0.5 . 1 . . . . . 62 LEU CD1 . 16640 1 619 . 1 1 62 62 LEU CD2 C 13 24.4 0.5 . 1 . . . . . 62 LEU CD2 . 16640 1 620 . 1 1 62 62 LEU CG C 13 26.8 0.5 . 1 . . . . . 62 LEU CG . 16640 1 621 . 1 1 62 62 LEU N N 15 118.1 0.5 . 1 . . . . . 62 LEU N . 16640 1 622 . 1 1 63 63 ARG H H 1 8.43 0.05 . 1 . . . . . 63 ARG H . 16640 1 623 . 1 1 63 63 ARG HA H 1 4.03 0.05 . 1 . . . . . 63 ARG HA . 16640 1 624 . 1 1 63 63 ARG HB2 H 1 1.98 0.05 . 2 . . . . . 63 ARG HB2 . 16640 1 625 . 1 1 63 63 ARG HB3 H 1 1.98 0.05 . 2 . . . . . 63 ARG HB3 . 16640 1 626 . 1 1 63 63 ARG HD2 H 1 3.09 0.05 . 2 . . . . . 63 ARG HD2 . 16640 1 627 . 1 1 63 63 ARG HD3 H 1 3.19 0.05 . 2 . . . . . 63 ARG HD3 . 16640 1 628 . 1 1 63 63 ARG HE H 1 7.27 0.05 . 1 . . . . . 63 ARG HE . 16640 1 629 . 1 1 63 63 ARG HG2 H 1 1.82 0.05 . 2 . . . . . 63 ARG HG2 . 16640 1 630 . 1 1 63 63 ARG HG3 H 1 1.70 0.05 . 2 . . . . . 63 ARG HG3 . 16640 1 631 . 1 1 63 63 ARG CA C 13 59.0 0.5 . 1 . . . . . 63 ARG CA . 16640 1 632 . 1 1 63 63 ARG CB C 13 30.0 0.5 . 1 . . . . . 63 ARG CB . 16640 1 633 . 1 1 63 63 ARG CD C 13 43.5 0.5 . 1 . . . . . 63 ARG CD . 16640 1 634 . 1 1 63 63 ARG CG C 13 27.9 0.5 . 1 . . . . . 63 ARG CG . 16640 1 635 . 1 1 63 63 ARG N N 15 120.8 0.5 . 1 . . . . . 63 ARG N . 16640 1 636 . 1 1 63 63 ARG NE N 15 84.4 0.5 . 1 . . . . . 63 ARG NE . 16640 1 637 . 1 1 64 64 GLU H H 1 7.34 0.05 . 1 . . . . . 64 GLU H . 16640 1 638 . 1 1 64 64 GLU HA H 1 4.33 0.05 . 1 . . . . . 64 GLU HA . 16640 1 639 . 1 1 64 64 GLU HB2 H 1 2.39 0.05 . 2 . . . . . 64 GLU HB2 . 16640 1 640 . 1 1 64 64 GLU HB3 H 1 1.86 0.05 . 2 . . . . . 64 GLU HB3 . 16640 1 641 . 1 1 64 64 GLU HG2 H 1 2.28 0.05 . 2 . . . . . 64 GLU HG2 . 16640 1 642 . 1 1 64 64 GLU HG3 H 1 2.52 0.05 . 2 . . . . . 64 GLU HG3 . 16640 1 643 . 1 1 64 64 GLU CA C 13 55.6 0.5 . 1 . . . . . 64 GLU CA . 16640 1 644 . 1 1 64 64 GLU CB C 13 29.8 0.5 . 1 . . . . . 64 GLU CB . 16640 1 645 . 1 1 64 64 GLU CG C 13 37.1 0.5 . 1 . . . . . 64 GLU CG . 16640 1 646 . 1 1 64 64 GLU N N 15 116.8 0.5 . 1 . . . . . 64 GLU N . 16640 1 647 . 1 1 65 65 ARG H H 1 8.10 0.05 . 1 . . . . . 65 ARG H . 16640 1 648 . 1 1 65 65 ARG HA H 1 3.84 0.05 . 1 . . . . . 65 ARG HA . 16640 1 649 . 1 1 65 65 ARG HB2 H 1 1.95 0.05 . 2 . . . . . 65 ARG HB2 . 16640 1 650 . 1 1 65 65 ARG HB3 H 1 2.06 0.05 . 2 . . . . . 65 ARG HB3 . 16640 1 651 . 1 1 65 65 ARG HD2 H 1 3.23 0.05 . 2 . . . . . 65 ARG HD2 . 16640 1 652 . 1 1 65 65 ARG HD3 H 1 3.19 0.05 . 2 . . . . . 65 ARG HD3 . 16640 1 653 . 1 1 65 65 ARG HG2 H 1 1.56 0.05 . 2 . . . . . 65 ARG HG2 . 16640 1 654 . 1 1 65 65 ARG HG3 H 1 1.56 0.05 . 2 . . . . . 65 ARG HG3 . 16640 1 655 . 1 1 65 65 ARG CA C 13 56.7 0.5 . 1 . . . . . 65 ARG CA . 16640 1 656 . 1 1 65 65 ARG CB C 13 26.1 0.5 . 1 . . . . . 65 ARG CB . 16640 1 657 . 1 1 65 65 ARG CD C 13 43.1 0.5 . 1 . . . . . 65 ARG CD . 16640 1 658 . 1 1 65 65 ARG CG C 13 27.3 0.5 . 1 . . . . . 65 ARG CG . 16640 1 659 . 1 1 65 65 ARG N N 15 115.9 0.5 . 1 . . . . . 65 ARG N . 16640 1 660 . 1 1 66 66 ARG H H 1 8.20 0.05 . 1 . . . . . 66 ARG H . 16640 1 661 . 1 1 66 66 ARG HA H 1 4.58 0.05 . 1 . . . . . 66 ARG HA . 16640 1 662 . 1 1 66 66 ARG HB2 H 1 1.79 0.05 . 2 . . . . . 66 ARG HB2 . 16640 1 663 . 1 1 66 66 ARG HB3 H 1 1.87 0.05 . 2 . . . . . 66 ARG HB3 . 16640 1 664 . 1 1 66 66 ARG HD2 H 1 3.19 0.05 . 2 . . . . . 66 ARG HD2 . 16640 1 665 . 1 1 66 66 ARG HD3 H 1 3.34 0.05 . 2 . . . . . 66 ARG HD3 . 16640 1 666 . 1 1 66 66 ARG HE H 1 7.38 0.05 . 1 . . . . . 66 ARG HE . 16640 1 667 . 1 1 66 66 ARG HG2 H 1 1.63 0.05 . 2 . . . . . 66 ARG HG2 . 16640 1 668 . 1 1 66 66 ARG HG3 H 1 1.63 0.05 . 2 . . . . . 66 ARG HG3 . 16640 1 669 . 1 1 66 66 ARG CA C 13 55.0 0.5 . 1 . . . . . 66 ARG CA . 16640 1 670 . 1 1 66 66 ARG CB C 13 33.3 0.5 . 1 . . . . . 66 ARG CB . 16640 1 671 . 1 1 66 66 ARG CD C 13 43.0 0.5 . 1 . . . . . 66 ARG CD . 16640 1 672 . 1 1 66 66 ARG CG C 13 30.5 0.5 . 1 . . . . . 66 ARG CG . 16640 1 673 . 1 1 66 66 ARG N N 15 118.0 0.5 . 1 . . . . . 66 ARG N . 16640 1 674 . 1 1 66 66 ARG NE N 15 83.2 0.5 . 1 . . . . . 66 ARG NE . 16640 1 675 . 1 1 67 67 VAL H H 1 8.25 0.05 . 1 . . . . . 67 VAL H . 16640 1 676 . 1 1 67 67 VAL HA H 1 3.89 0.05 . 1 . . . . . 67 VAL HA . 16640 1 677 . 1 1 67 67 VAL HB H 1 1.90 0.05 . 1 . . . . . 67 VAL HB . 16640 1 678 . 1 1 67 67 VAL HG11 H 1 0.59 0.05 . 2 . . . . . 67 VAL HG1 . 16640 1 679 . 1 1 67 67 VAL HG12 H 1 0.59 0.05 . 2 . . . . . 67 VAL HG1 . 16640 1 680 . 1 1 67 67 VAL HG13 H 1 0.59 0.05 . 2 . . . . . 67 VAL HG1 . 16640 1 681 . 1 1 67 67 VAL HG21 H 1 0.80 0.05 . 2 . . . . . 67 VAL HG2 . 16640 1 682 . 1 1 67 67 VAL HG22 H 1 0.80 0.05 . 2 . . . . . 67 VAL HG2 . 16640 1 683 . 1 1 67 67 VAL HG23 H 1 0.80 0.05 . 2 . . . . . 67 VAL HG2 . 16640 1 684 . 1 1 67 67 VAL CA C 13 63.0 0.5 . 1 . . . . . 67 VAL CA . 16640 1 685 . 1 1 67 67 VAL CB C 13 32.1 0.5 . 1 . . . . . 67 VAL CB . 16640 1 686 . 1 1 67 67 VAL CG1 C 13 20.6 0.5 . 1 . . . . . 67 VAL CG1 . 16640 1 687 . 1 1 67 67 VAL CG2 C 13 20.3 0.5 . 1 . . . . . 67 VAL CG2 . 16640 1 688 . 1 1 67 67 VAL N N 15 117.6 0.5 . 1 . . . . . 67 VAL N . 16640 1 689 . 1 1 68 68 HIS H H 1 7.50 0.05 . 1 . . . . . 68 HIS H . 16640 1 690 . 1 1 68 68 HIS HA H 1 5.08 0.05 . 1 . . . . . 68 HIS HA . 16640 1 691 . 1 1 68 68 HIS HB2 H 1 2.89 0.05 . 2 . . . . . 68 HIS HB2 . 16640 1 692 . 1 1 68 68 HIS HB3 H 1 2.89 0.05 . 2 . . . . . 68 HIS HB3 . 16640 1 693 . 1 1 68 68 HIS HD2 H 1 6.81 0.05 . 1 . . . . . 68 HIS HD2 . 16640 1 694 . 1 1 68 68 HIS CA C 13 54.9 0.5 . 1 . . . . . 68 HIS CA . 16640 1 695 . 1 1 68 68 HIS CB C 13 31.5 0.5 . 1 . . . . . 68 HIS CB . 16640 1 696 . 1 1 68 68 HIS CD2 C 13 119.8 0.5 . 1 . . . . . 68 HIS CD2 . 16640 1 697 . 1 1 68 68 HIS N N 15 116.5 0.5 . 1 . . . . . 68 HIS N . 16640 1 698 . 1 1 69 69 VAL H H 1 8.56 0.05 . 1 . . . . . 69 VAL H . 16640 1 699 . 1 1 69 69 VAL HA H 1 4.33 0.05 . 1 . . . . . 69 VAL HA . 16640 1 700 . 1 1 69 69 VAL HB H 1 1.94 0.05 . 1 . . . . . 69 VAL HB . 16640 1 701 . 1 1 69 69 VAL HG11 H 1 0.95 0.05 . 2 . . . . . 69 VAL HG1 . 16640 1 702 . 1 1 69 69 VAL HG12 H 1 0.95 0.05 . 2 . . . . . 69 VAL HG1 . 16640 1 703 . 1 1 69 69 VAL HG13 H 1 0.95 0.05 . 2 . . . . . 69 VAL HG1 . 16640 1 704 . 1 1 69 69 VAL HG21 H 1 0.97 0.05 . 2 . . . . . 69 VAL HG2 . 16640 1 705 . 1 1 69 69 VAL HG22 H 1 0.97 0.05 . 2 . . . . . 69 VAL HG2 . 16640 1 706 . 1 1 69 69 VAL HG23 H 1 0.97 0.05 . 2 . . . . . 69 VAL HG2 . 16640 1 707 . 1 1 69 69 VAL CA C 13 61.5 0.5 . 1 . . . . . 69 VAL CA . 16640 1 708 . 1 1 69 69 VAL CB C 13 32.8 0.5 . 1 . . . . . 69 VAL CB . 16640 1 709 . 1 1 69 69 VAL CG1 C 13 22.7 0.5 . 1 . . . . . 69 VAL CG1 . 16640 1 710 . 1 1 69 69 VAL CG2 C 13 21.9 0.5 . 1 . . . . . 69 VAL CG2 . 16640 1 711 . 1 1 69 69 VAL N N 15 123.6 0.5 . 1 . . . . . 69 VAL N . 16640 1 712 . 1 1 70 70 THR H H 1 9.72 0.05 . 1 . . . . . 70 THR H . 16640 1 713 . 1 1 70 70 THR HA H 1 4.79 0.05 . 1 . . . . . 70 THR HA . 16640 1 714 . 1 1 70 70 THR HB H 1 4.77 0.05 . 1 . . . . . 70 THR HB . 16640 1 715 . 1 1 70 70 THR HG21 H 1 1.26 0.05 . 1 . . . . . 70 THR HG2 . 16640 1 716 . 1 1 70 70 THR HG22 H 1 1.26 0.05 . 1 . . . . . 70 THR HG2 . 16640 1 717 . 1 1 70 70 THR HG23 H 1 1.26 0.05 . 1 . . . . . 70 THR HG2 . 16640 1 718 . 1 1 70 70 THR CA C 13 60.2 0.5 . 1 . . . . . 70 THR CA . 16640 1 719 . 1 1 70 70 THR CB C 13 72.5 0.5 . 1 . . . . . 70 THR CB . 16640 1 720 . 1 1 70 70 THR CG2 C 13 21.7 0.5 . 1 . . . . . 70 THR CG2 . 16640 1 721 . 1 1 70 70 THR N N 15 119.1 0.5 . 1 . . . . . 70 THR N . 16640 1 722 . 1 1 71 71 GLN H H 1 9.12 0.05 . 1 . . . . . 71 GLN H . 16640 1 723 . 1 1 71 71 GLN HA H 1 3.83 0.05 . 1 . . . . . 71 GLN HA . 16640 1 724 . 1 1 71 71 GLN HB2 H 1 1.88 0.05 . 2 . . . . . 71 GLN HB2 . 16640 1 725 . 1 1 71 71 GLN HB3 H 1 2.35 0.05 . 2 . . . . . 71 GLN HB3 . 16640 1 726 . 1 1 71 71 GLN HE21 H 1 6.51 0.05 . 2 . . . . . 71 GLN HE21 . 16640 1 727 . 1 1 71 71 GLN HE22 H 1 8.18 0.05 . 2 . . . . . 71 GLN HE22 . 16640 1 728 . 1 1 71 71 GLN HG2 H 1 2.23 0.05 . 2 . . . . . 71 GLN HG2 . 16640 1 729 . 1 1 71 71 GLN HG3 H 1 2.47 0.05 . 2 . . . . . 71 GLN HG3 . 16640 1 730 . 1 1 71 71 GLN CA C 13 59.4 0.5 . 1 . . . . . 71 GLN CA . 16640 1 731 . 1 1 71 71 GLN CB C 13 27.8 0.5 . 1 . . . . . 71 GLN CB . 16640 1 732 . 1 1 71 71 GLN CG C 13 31.5 0.5 . 1 . . . . . 71 GLN CG . 16640 1 733 . 1 1 71 71 GLN N N 15 121.2 0.5 . 1 . . . . . 71 GLN N . 16640 1 734 . 1 1 71 71 GLN NE2 N 15 109.1 0.5 . 1 . . . . . 71 GLN NE2 . 16640 1 735 . 1 1 72 72 GLU H H 1 8.51 0.05 . 1 . . . . . 72 GLU H . 16640 1 736 . 1 1 72 72 GLU HA H 1 3.94 0.05 . 1 . . . . . 72 GLU HA . 16640 1 737 . 1 1 72 72 GLU HB2 H 1 2.05 0.05 . 2 . . . . . 72 GLU HB2 . 16640 1 738 . 1 1 72 72 GLU HB3 H 1 1.88 0.05 . 2 . . . . . 72 GLU HB3 . 16640 1 739 . 1 1 72 72 GLU HG2 H 1 2.21 0.05 . 2 . . . . . 72 GLU HG2 . 16640 1 740 . 1 1 72 72 GLU HG3 H 1 2.38 0.05 . 2 . . . . . 72 GLU HG3 . 16640 1 741 . 1 1 72 72 GLU CA C 13 60.1 0.5 . 1 . . . . . 72 GLU CA . 16640 1 742 . 1 1 72 72 GLU CB C 13 28.7 0.5 . 1 . . . . . 72 GLU CB . 16640 1 743 . 1 1 72 72 GLU CG C 13 37.2 0.5 . 1 . . . . . 72 GLU CG . 16640 1 744 . 1 1 72 72 GLU N N 15 117.9 0.5 . 1 . . . . . 72 GLU N . 16640 1 745 . 1 1 73 73 ASP H H 1 7.83 0.05 . 1 . . . . . 73 ASP H . 16640 1 746 . 1 1 73 73 ASP HA H 1 4.12 0.05 . 1 . . . . . 73 ASP HA . 16640 1 747 . 1 1 73 73 ASP HB2 H 1 3.14 0.05 . 2 . . . . . 73 ASP HB2 . 16640 1 748 . 1 1 73 73 ASP HB3 H 1 2.89 0.05 . 2 . . . . . 73 ASP HB3 . 16640 1 749 . 1 1 73 73 ASP CA C 13 58.0 0.5 . 1 . . . . . 73 ASP CA . 16640 1 750 . 1 1 73 73 ASP CB C 13 40.2 0.5 . 1 . . . . . 73 ASP CB . 16640 1 751 . 1 1 73 73 ASP N N 15 121.4 0.5 . 1 . . . . . 73 ASP N . 16640 1 752 . 1 1 74 74 PHE H H 1 7.48 0.05 . 1 . . . . . 74 PHE H . 16640 1 753 . 1 1 74 74 PHE HA H 1 4.03 0.05 . 1 . . . . . 74 PHE HA . 16640 1 754 . 1 1 74 74 PHE HB2 H 1 2.76 0.05 . 2 . . . . . 74 PHE HB2 . 16640 1 755 . 1 1 74 74 PHE HB3 H 1 3.13 0.05 . 2 . . . . . 74 PHE HB3 . 16640 1 756 . 1 1 74 74 PHE HD1 H 1 7.15 0.05 . 3 . . . . . 74 PHE HD1 . 16640 1 757 . 1 1 74 74 PHE HD2 H 1 7.15 0.05 . 3 . . . . . 74 PHE HD2 . 16640 1 758 . 1 1 74 74 PHE HE1 H 1 7.24 0.05 . 3 . . . . . 74 PHE HE1 . 16640 1 759 . 1 1 74 74 PHE HE2 H 1 7.24 0.05 . 3 . . . . . 74 PHE HE2 . 16640 1 760 . 1 1 74 74 PHE HZ H 1 7.15 0.05 . 1 . . . . . 74 PHE HZ . 16640 1 761 . 1 1 74 74 PHE CA C 13 62.6 0.5 . 1 . . . . . 74 PHE CA . 16640 1 762 . 1 1 74 74 PHE CB C 13 40.3 0.5 . 1 . . . . . 74 PHE CB . 16640 1 763 . 1 1 74 74 PHE CD1 C 13 131.4 0.5 . 1 . . . . . 74 PHE CD1 . 16640 1 764 . 1 1 74 74 PHE CE1 C 13 131.3 0.5 . 1 . . . . . 74 PHE CE1 . 16640 1 765 . 1 1 74 74 PHE CZ C 13 128.4 0.5 . 1 . . . . . 74 PHE CZ . 16640 1 766 . 1 1 74 74 PHE N N 15 116.0 0.5 . 1 . . . . . 74 PHE N . 16640 1 767 . 1 1 75 75 GLU H H 1 8.62 0.05 . 1 . . . . . 75 GLU H . 16640 1 768 . 1 1 75 75 GLU HA H 1 3.73 0.05 . 1 . . . . . 75 GLU HA . 16640 1 769 . 1 1 75 75 GLU HB2 H 1 1.97 0.05 . 2 . . . . . 75 GLU HB2 . 16640 1 770 . 1 1 75 75 GLU HB3 H 1 2.11 0.05 . 2 . . . . . 75 GLU HB3 . 16640 1 771 . 1 1 75 75 GLU HG2 H 1 1.96 0.05 . 2 . . . . . 75 GLU HG2 . 16640 1 772 . 1 1 75 75 GLU HG3 H 1 2.57 0.05 . 2 . . . . . 75 GLU HG3 . 16640 1 773 . 1 1 75 75 GLU CA C 13 60.6 0.5 . 1 . . . . . 75 GLU CA . 16640 1 774 . 1 1 75 75 GLU CB C 13 28.8 0.5 . 1 . . . . . 75 GLU CB . 16640 1 775 . 1 1 75 75 GLU CG C 13 37.4 0.5 . 1 . . . . . 75 GLU CG . 16640 1 776 . 1 1 75 75 GLU N N 15 119.5 0.5 . 1 . . . . . 75 GLU N . 16640 1 777 . 1 1 76 76 MET H H 1 8.71 0.05 . 1 . . . . . 76 MET H . 16640 1 778 . 1 1 76 76 MET HA H 1 4.07 0.05 . 1 . . . . . 76 MET HA . 16640 1 779 . 1 1 76 76 MET HB2 H 1 1.72 0.05 . 2 . . . . . 76 MET HB2 . 16640 1 780 . 1 1 76 76 MET HB3 H 1 1.63 0.05 . 2 . . . . . 76 MET HB3 . 16640 1 781 . 1 1 76 76 MET HE1 H 1 1.79 0.05 . 1 . . . . . 76 MET HE . 16640 1 782 . 1 1 76 76 MET HE2 H 1 1.79 0.05 . 1 . . . . . 76 MET HE . 16640 1 783 . 1 1 76 76 MET HE3 H 1 1.79 0.05 . 1 . . . . . 76 MET HE . 16640 1 784 . 1 1 76 76 MET HG2 H 1 2.31 0.05 . 2 . . . . . 76 MET HG2 . 16640 1 785 . 1 1 76 76 MET HG3 H 1 2.53 0.05 . 2 . . . . . 76 MET HG3 . 16640 1 786 . 1 1 76 76 MET CA C 13 58.3 0.5 . 1 . . . . . 76 MET CA . 16640 1 787 . 1 1 76 76 MET CB C 13 31.9 0.5 . 1 . . . . . 76 MET CB . 16640 1 788 . 1 1 76 76 MET CE C 13 16.3 0.5 . 1 . . . . . 76 MET CE . 16640 1 789 . 1 1 76 76 MET CG C 13 32.1 0.5 . 1 . . . . . 76 MET CG . 16640 1 790 . 1 1 76 76 MET N N 15 120.3 0.5 . 1 . . . . . 76 MET N . 16640 1 791 . 1 1 77 77 ALA H H 1 8.00 0.05 . 1 . . . . . 77 ALA H . 16640 1 792 . 1 1 77 77 ALA HA H 1 4.20 0.05 . 1 . . . . . 77 ALA HA . 16640 1 793 . 1 1 77 77 ALA HB1 H 1 1.67 0.05 . 1 . . . . . 77 ALA HB . 16640 1 794 . 1 1 77 77 ALA HB2 H 1 1.67 0.05 . 1 . . . . . 77 ALA HB . 16640 1 795 . 1 1 77 77 ALA HB3 H 1 1.67 0.05 . 1 . . . . . 77 ALA HB . 16640 1 796 . 1 1 77 77 ALA CA C 13 55.4 0.5 . 1 . . . . . 77 ALA CA . 16640 1 797 . 1 1 77 77 ALA CB C 13 20.5 0.5 . 1 . . . . . 77 ALA CB . 16640 1 798 . 1 1 77 77 ALA N N 15 123.4 0.5 . 1 . . . . . 77 ALA N . 16640 1 799 . 1 1 78 78 VAL H H 1 8.60 0.05 . 1 . . . . . 78 VAL H . 16640 1 800 . 1 1 78 78 VAL HA H 1 3.42 0.05 . 1 . . . . . 78 VAL HA . 16640 1 801 . 1 1 78 78 VAL HB H 1 2.23 0.05 . 1 . . . . . 78 VAL HB . 16640 1 802 . 1 1 78 78 VAL HG11 H 1 0.91 0.05 . 2 . . . . . 78 VAL HG1 . 16640 1 803 . 1 1 78 78 VAL HG12 H 1 0.91 0.05 . 2 . . . . . 78 VAL HG1 . 16640 1 804 . 1 1 78 78 VAL HG13 H 1 0.91 0.05 . 2 . . . . . 78 VAL HG1 . 16640 1 805 . 1 1 78 78 VAL HG21 H 1 1.28 0.05 . 2 . . . . . 78 VAL HG2 . 16640 1 806 . 1 1 78 78 VAL HG22 H 1 1.28 0.05 . 2 . . . . . 78 VAL HG2 . 16640 1 807 . 1 1 78 78 VAL HG23 H 1 1.28 0.05 . 2 . . . . . 78 VAL HG2 . 16640 1 808 . 1 1 78 78 VAL CA C 13 67.0 0.5 . 1 . . . . . 78 VAL CA . 16640 1 809 . 1 1 78 78 VAL CB C 13 31.3 0.5 . 1 . . . . . 78 VAL CB . 16640 1 810 . 1 1 78 78 VAL CG1 C 13 22.2 0.5 . 1 . . . . . 78 VAL CG1 . 16640 1 811 . 1 1 78 78 VAL CG2 C 13 24.3 0.5 . 1 . . . . . 78 VAL CG2 . 16640 1 812 . 1 1 78 78 VAL N N 15 118.9 0.5 . 1 . . . . . 78 VAL N . 16640 1 813 . 1 1 79 79 ALA H H 1 7.29 0.05 . 1 . . . . . 79 ALA H . 16640 1 814 . 1 1 79 79 ALA HA H 1 4.03 0.05 . 1 . . . . . 79 ALA HA . 16640 1 815 . 1 1 79 79 ALA HB1 H 1 1.47 0.05 . 1 . . . . . 79 ALA HB . 16640 1 816 . 1 1 79 79 ALA HB2 H 1 1.47 0.05 . 1 . . . . . 79 ALA HB . 16640 1 817 . 1 1 79 79 ALA HB3 H 1 1.47 0.05 . 1 . . . . . 79 ALA HB . 16640 1 818 . 1 1 79 79 ALA CA C 13 54.7 0.5 . 1 . . . . . 79 ALA CA . 16640 1 819 . 1 1 79 79 ALA CB C 13 17.5 0.5 . 1 . . . . . 79 ALA CB . 16640 1 820 . 1 1 79 79 ALA N N 15 119.6 0.5 . 1 . . . . . 79 ALA N . 16640 1 821 . 1 1 80 80 LYS H H 1 7.69 0.05 . 1 . . . . . 80 LYS H . 16640 1 822 . 1 1 80 80 LYS HA H 1 4.09 0.05 . 1 . . . . . 80 LYS HA . 16640 1 823 . 1 1 80 80 LYS HB2 H 1 2.05 0.05 . 2 . . . . . 80 LYS HB2 . 16640 1 824 . 1 1 80 80 LYS HB3 H 1 1.94 0.05 . 2 . . . . . 80 LYS HB3 . 16640 1 825 . 1 1 80 80 LYS HD2 H 1 1.56 0.05 . 2 . . . . . 80 LYS HD2 . 16640 1 826 . 1 1 80 80 LYS HD3 H 1 1.70 0.05 . 2 . . . . . 80 LYS HD3 . 16640 1 827 . 1 1 80 80 LYS HE2 H 1 2.90 0.05 . 2 . . . . . 80 LYS HE2 . 16640 1 828 . 1 1 80 80 LYS HE3 H 1 2.92 0.05 . 2 . . . . . 80 LYS HE3 . 16640 1 829 . 1 1 80 80 LYS HG2 H 1 1.40 0.05 . 2 . . . . . 80 LYS HG2 . 16640 1 830 . 1 1 80 80 LYS HG3 H 1 1.45 0.05 . 2 . . . . . 80 LYS HG3 . 16640 1 831 . 1 1 80 80 LYS CA C 13 58.4 0.5 . 1 . . . . . 80 LYS CA . 16640 1 832 . 1 1 80 80 LYS CB C 13 32.8 0.5 . 1 . . . . . 80 LYS CB . 16640 1 833 . 1 1 80 80 LYS CD C 13 28.9 0.5 . 1 . . . . . 80 LYS CD . 16640 1 834 . 1 1 80 80 LYS CE C 13 41.8 0.5 . 1 . . . . . 80 LYS CE . 16640 1 835 . 1 1 80 80 LYS CG C 13 24.5 0.5 . 1 . . . . . 80 LYS CG . 16640 1 836 . 1 1 80 80 LYS N N 15 116.9 0.5 . 1 . . . . . 80 LYS N . 16640 1 837 . 1 1 81 81 VAL H H 1 8.38 0.05 . 1 . . . . . 81 VAL H . 16640 1 838 . 1 1 81 81 VAL HA H 1 3.73 0.05 . 1 . . . . . 81 VAL HA . 16640 1 839 . 1 1 81 81 VAL HB H 1 1.93 0.05 . 1 . . . . . 81 VAL HB . 16640 1 840 . 1 1 81 81 VAL HG11 H 1 0.96 0.05 . 2 . . . . . 81 VAL HG1 . 16640 1 841 . 1 1 81 81 VAL HG12 H 1 0.96 0.05 . 2 . . . . . 81 VAL HG1 . 16640 1 842 . 1 1 81 81 VAL HG13 H 1 0.96 0.05 . 2 . . . . . 81 VAL HG1 . 16640 1 843 . 1 1 81 81 VAL HG21 H 1 0.94 0.05 . 2 . . . . . 81 VAL HG2 . 16640 1 844 . 1 1 81 81 VAL HG22 H 1 0.94 0.05 . 2 . . . . . 81 VAL HG2 . 16640 1 845 . 1 1 81 81 VAL HG23 H 1 0.94 0.05 . 2 . . . . . 81 VAL HG2 . 16640 1 846 . 1 1 81 81 VAL CA C 13 65.2 0.5 . 1 . . . . . 81 VAL CA . 16640 1 847 . 1 1 81 81 VAL CB C 13 32.4 0.5 . 1 . . . . . 81 VAL CB . 16640 1 848 . 1 1 81 81 VAL CG1 C 13 20.6 0.5 . 1 . . . . . 81 VAL CG1 . 16640 1 849 . 1 1 81 81 VAL CG2 C 13 22.4 0.5 . 1 . . . . . 81 VAL CG2 . 16640 1 850 . 1 1 81 81 VAL N N 15 118.8 0.5 . 1 . . . . . 81 VAL N . 16640 1 851 . 1 1 82 82 MET H H 1 8.34 0.05 . 1 . . . . . 82 MET H . 16640 1 852 . 1 1 82 82 MET HA H 1 4.58 0.05 . 1 . . . . . 82 MET HA . 16640 1 853 . 1 1 82 82 MET HB2 H 1 2.09 0.05 . 2 . . . . . 82 MET HB2 . 16640 1 854 . 1 1 82 82 MET HB3 H 1 2.12 0.05 . 2 . . . . . 82 MET HB3 . 16640 1 855 . 1 1 82 82 MET HE1 H 1 1.92 0.05 . 1 . . . . . 82 MET HE . 16640 1 856 . 1 1 82 82 MET HE2 H 1 1.92 0.05 . 1 . . . . . 82 MET HE . 16640 1 857 . 1 1 82 82 MET HE3 H 1 1.92 0.05 . 1 . . . . . 82 MET HE . 16640 1 858 . 1 1 82 82 MET HG2 H 1 2.48 0.05 . 2 . . . . . 82 MET HG2 . 16640 1 859 . 1 1 82 82 MET HG3 H 1 2.71 0.05 . 2 . . . . . 82 MET HG3 . 16640 1 860 . 1 1 82 82 MET CA C 13 54.2 0.5 . 1 . . . . . 82 MET CA . 16640 1 861 . 1 1 82 82 MET CB C 13 29.8 0.5 . 1 . . . . . 82 MET CB . 16640 1 862 . 1 1 82 82 MET CE C 13 15.7 0.5 . 1 . . . . . 82 MET CE . 16640 1 863 . 1 1 82 82 MET CG C 13 32.3 0.5 . 1 . . . . . 82 MET CG . 16640 1 864 . 1 1 82 82 MET N N 15 114.8 0.5 . 1 . . . . . 82 MET N . 16640 1 865 . 1 1 83 83 GLN H H 1 7.50 0.05 . 1 . . . . . 83 GLN H . 16640 1 866 . 1 1 83 83 GLN HA H 1 4.25 0.05 . 1 . . . . . 83 GLN HA . 16640 1 867 . 1 1 83 83 GLN HB2 H 1 2.15 0.05 . 2 . . . . . 83 GLN HB2 . 16640 1 868 . 1 1 83 83 GLN HB3 H 1 2.15 0.05 . 2 . . . . . 83 GLN HB3 . 16640 1 869 . 1 1 83 83 GLN HE21 H 1 6.81 0.05 . 2 . . . . . 83 GLN HE21 . 16640 1 870 . 1 1 83 83 GLN HE22 H 1 7.60 0.05 . 2 . . . . . 83 GLN HE22 . 16640 1 871 . 1 1 83 83 GLN HG2 H 1 2.38 0.05 . 2 . . . . . 83 GLN HG2 . 16640 1 872 . 1 1 83 83 GLN HG3 H 1 2.38 0.05 . 2 . . . . . 83 GLN HG3 . 16640 1 873 . 1 1 83 83 GLN CA C 13 56.0 0.5 . 1 . . . . . 83 GLN CA . 16640 1 874 . 1 1 83 83 GLN CB C 13 28.0 0.5 . 1 . . . . . 83 GLN CB . 16640 1 875 . 1 1 83 83 GLN CG C 13 33.7 0.5 . 1 . . . . . 83 GLN CG . 16640 1 876 . 1 1 83 83 GLN N N 15 119.1 0.5 . 1 . . . . . 83 GLN N . 16640 1 877 . 1 1 83 83 GLN NE2 N 15 112.3 0.5 . 1 . . . . . 83 GLN NE2 . 16640 1 878 . 1 1 84 84 LYS H H 1 8.20 0.05 . 1 . . . . . 84 LYS H . 16640 1 879 . 1 1 84 84 LYS HA H 1 4.35 0.05 . 1 . . . . . 84 LYS HA . 16640 1 880 . 1 1 84 84 LYS HB2 H 1 1.77 0.05 . 2 . . . . . 84 LYS HB2 . 16640 1 881 . 1 1 84 84 LYS HB3 H 1 1.87 0.05 . 2 . . . . . 84 LYS HB3 . 16640 1 882 . 1 1 84 84 LYS HD2 H 1 1.66 0.05 . 2 . . . . . 84 LYS HD2 . 16640 1 883 . 1 1 84 84 LYS HD3 H 1 1.66 0.05 . 2 . . . . . 84 LYS HD3 . 16640 1 884 . 1 1 84 84 LYS HE2 H 1 2.98 0.05 . 2 . . . . . 84 LYS HE2 . 16640 1 885 . 1 1 84 84 LYS HE3 H 1 2.97 0.05 . 2 . . . . . 84 LYS HE3 . 16640 1 886 . 1 1 84 84 LYS HG2 H 1 1.43 0.05 . 2 . . . . . 84 LYS HG2 . 16640 1 887 . 1 1 84 84 LYS HG3 H 1 1.43 0.05 . 2 . . . . . 84 LYS HG3 . 16640 1 888 . 1 1 84 84 LYS CA C 13 55.9 0.5 . 1 . . . . . 84 LYS CA . 16640 1 889 . 1 1 84 84 LYS CB C 13 33.0 0.5 . 1 . . . . . 84 LYS CB . 16640 1 890 . 1 1 84 84 LYS CD C 13 28.9 0.5 . 1 . . . . . 84 LYS CD . 16640 1 891 . 1 1 84 84 LYS CE C 13 41.8 0.5 . 1 . . . . . 84 LYS CE . 16640 1 892 . 1 1 84 84 LYS CG C 13 24.4 0.5 . 1 . . . . . 84 LYS CG . 16640 1 893 . 1 1 84 84 LYS N N 15 122.1 0.5 . 1 . . . . . 84 LYS N . 16640 1 894 . 1 1 85 85 ASP H H 1 8.45 0.05 . 1 . . . . . 85 ASP H . 16640 1 895 . 1 1 85 85 ASP HA H 1 4.66 0.05 . 1 . . . . . 85 ASP HA . 16640 1 896 . 1 1 85 85 ASP HB2 H 1 2.61 0.05 . 2 . . . . . 85 ASP HB2 . 16640 1 897 . 1 1 85 85 ASP HB3 H 1 2.72 0.05 . 2 . . . . . 85 ASP HB3 . 16640 1 898 . 1 1 85 85 ASP CA C 13 54.1 0.5 . 1 . . . . . 85 ASP CA . 16640 1 899 . 1 1 85 85 ASP CB C 13 41.0 0.5 . 1 . . . . . 85 ASP CB . 16640 1 900 . 1 1 85 85 ASP N N 15 121.8 0.5 . 1 . . . . . 85 ASP N . 16640 1 901 . 1 1 86 86 SER H H 1 7.86 0.05 . 1 . . . . . 86 SER H . 16640 1 902 . 1 1 86 86 SER HA H 1 4.21 0.05 . 1 . . . . . 86 SER HA . 16640 1 903 . 1 1 86 86 SER HB2 H 1 3.82 0.05 . 2 . . . . . 86 SER HB2 . 16640 1 904 . 1 1 86 86 SER HB3 H 1 3.82 0.05 . 2 . . . . . 86 SER HB3 . 16640 1 905 . 1 1 86 86 SER CA C 13 59.5 0.5 . 1 . . . . . 86 SER CA . 16640 1 906 . 1 1 86 86 SER CB C 13 64.7 0.5 . 1 . . . . . 86 SER CB . 16640 1 907 . 1 1 86 86 SER N N 15 121.0 0.5 . 1 . . . . . 86 SER N . 16640 1 stop_ save_