################################### # 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 17020 _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 . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 17020 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 7 $SPARKY . . 17020 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 HE1 H 1 1.99 0.02 . 1 . . . . 1 MET HE . 17020 1 2 . 1 1 1 1 MET HE2 H 1 1.99 0.02 . 1 . . . . 1 MET HE . 17020 1 3 . 1 1 1 1 MET HE3 H 1 1.99 0.02 . 1 . . . . 1 MET HE . 17020 1 4 . 1 1 1 1 MET CE C 13 18.4 0.2 . 1 . . . . 1 MET CE . 17020 1 5 . 1 1 2 2 PRO HA H 1 4.39 0.02 . 1 . . . . 2 PRO HA . 17020 1 6 . 1 1 2 2 PRO HB2 H 1 2.44 0.02 . 2 . . . . 2 PRO HB2 . 17020 1 7 . 1 1 2 2 PRO HB3 H 1 2.00 0.02 . 2 . . . . 2 PRO HB3 . 17020 1 8 . 1 1 2 2 PRO HD2 H 1 3.43 0.02 . 2 . . . . 2 PRO HD2 . 17020 1 9 . 1 1 2 2 PRO HD3 H 1 3.39 0.02 . 2 . . . . 2 PRO HD3 . 17020 1 10 . 1 1 2 2 PRO HG2 H 1 2.06 0.02 . 2 . . . . 2 PRO HG2 . 17020 1 11 . 1 1 2 2 PRO HG3 H 1 2.01 0.02 . 2 . . . . 2 PRO HG3 . 17020 1 12 . 1 1 2 2 PRO CA C 13 62.5 0.2 . 1 . . . . 2 PRO CA . 17020 1 13 . 1 1 2 2 PRO CB C 13 32.6 0.2 . 1 . . . . 2 PRO CB . 17020 1 14 . 1 1 2 2 PRO CD C 13 49.4 0.2 . 1 . . . . 2 PRO CD . 17020 1 15 . 1 1 2 2 PRO CG C 13 26.5 0.2 . 1 . . . . 2 PRO CG . 17020 1 16 . 1 1 3 3 HIS HA H 1 4.73 0.02 . 1 . . . . 3 HIS HA . 17020 1 17 . 1 1 3 3 HIS HB2 H 1 3.23 0.02 . 2 . . . . 3 HIS HB2 . 17020 1 18 . 1 1 3 3 HIS HB3 H 1 3.23 0.02 . 2 . . . . 3 HIS HB3 . 17020 1 19 . 1 1 3 3 HIS C C 13 173.9 0.2 . 1 . . . . 3 HIS C . 17020 1 20 . 1 1 3 3 HIS CA C 13 55.7 0.2 . 1 . . . . 3 HIS CA . 17020 1 21 . 1 1 3 3 HIS CB C 13 29.2 0.2 . 1 . . . . 3 HIS CB . 17020 1 22 . 1 1 4 4 LYS H H 1 8.53 0.02 . 1 . . . . 4 LYS H . 17020 1 23 . 1 1 4 4 LYS HA H 1 4.31 0.02 . 1 . . . . 4 LYS HA . 17020 1 24 . 1 1 4 4 LYS HB2 H 1 1.78 0.02 . 2 . . . . 4 LYS HB2 . 17020 1 25 . 1 1 4 4 LYS HB3 H 1 1.71 0.02 . 2 . . . . 4 LYS HB3 . 17020 1 26 . 1 1 4 4 LYS HD2 H 1 1.68 0.02 . 2 . . . . 4 LYS HD2 . 17020 1 27 . 1 1 4 4 LYS HD3 H 1 1.68 0.02 . 2 . . . . 4 LYS HD3 . 17020 1 28 . 1 1 4 4 LYS HE2 H 1 2.99 0.02 . 2 . . . . 4 LYS HE2 . 17020 1 29 . 1 1 4 4 LYS HE3 H 1 2.99 0.02 . 2 . . . . 4 LYS HE3 . 17020 1 30 . 1 1 4 4 LYS HG2 H 1 1.41 0.02 . 2 . . . . 4 LYS HG2 . 17020 1 31 . 1 1 4 4 LYS HG3 H 1 1.41 0.02 . 2 . . . . 4 LYS HG3 . 17020 1 32 . 1 1 4 4 LYS C C 13 176.1 0.2 . 1 . . . . 4 LYS C . 17020 1 33 . 1 1 4 4 LYS CA C 13 56.4 0.2 . 1 . . . . 4 LYS CA . 17020 1 34 . 1 1 4 4 LYS CB C 13 33.2 0.2 . 1 . . . . 4 LYS CB . 17020 1 35 . 1 1 4 4 LYS CD C 13 29.1 0.2 . 1 . . . . 4 LYS CD . 17020 1 36 . 1 1 4 4 LYS CE C 13 42 0.2 . 1 . . . . 4 LYS CE . 17020 1 37 . 1 1 4 4 LYS CG C 13 24.8 0.2 . 1 . . . . 4 LYS CG . 17020 1 38 . 1 1 4 4 LYS N N 15 124.2 0.2 . 1 . . . . 4 LYS N . 17020 1 39 . 1 1 5 5 GLU H H 1 8.58 0.02 . 1 . . . . 5 GLU H . 17020 1 40 . 1 1 5 5 GLU HA H 1 4.3 0.02 . 1 . . . . 5 GLU HA . 17020 1 41 . 1 1 5 5 GLU HB2 H 1 2.01 0.02 . 2 . . . . 5 GLU HB2 . 17020 1 42 . 1 1 5 5 GLU HB3 H 1 1.9 0.02 . 2 . . . . 5 GLU HB3 . 17020 1 43 . 1 1 5 5 GLU HG2 H 1 2.3 0.02 . 2 . . . . 5 GLU HG2 . 17020 1 44 . 1 1 5 5 GLU HG3 H 1 2.3 0.02 . 2 . . . . 5 GLU HG3 . 17020 1 45 . 1 1 5 5 GLU C C 13 176.0 0.2 . 1 . . . . 5 GLU C . 17020 1 46 . 1 1 5 5 GLU CA C 13 56.2 0.2 . 1 . . . . 5 GLU CA . 17020 1 47 . 1 1 5 5 GLU CB C 13 30.4 0.2 . 1 . . . . 5 GLU CB . 17020 1 48 . 1 1 5 5 GLU CG C 13 35.6 0.2 . 1 . . . . 5 GLU CG . 17020 1 49 . 1 1 5 5 GLU N N 15 123.3 0.2 . 1 . . . . 5 GLU N . 17020 1 50 . 1 1 6 6 LYS H H 1 8.43 0.02 . 1 . . . . 6 LYS H . 17020 1 51 . 1 1 6 6 LYS HA H 1 4.22 0.02 . 1 . . . . 6 LYS HA . 17020 1 52 . 1 1 6 6 LYS HB2 H 1 1.67 0.02 . 2 . . . . 6 LYS HB2 . 17020 1 53 . 1 1 6 6 LYS HB3 H 1 1.67 0.02 . 2 . . . . 6 LYS HB3 . 17020 1 54 . 1 1 6 6 LYS HD2 H 1 1.63 0.02 . 2 . . . . 6 LYS HD2 . 17020 1 55 . 1 1 6 6 LYS HD3 H 1 1.63 0.02 . 2 . . . . 6 LYS HD3 . 17020 1 56 . 1 1 6 6 LYS HE2 H 1 2.92 0.02 . 2 . . . . 6 LYS HE2 . 17020 1 57 . 1 1 6 6 LYS HE3 H 1 2.92 0.02 . 2 . . . . 6 LYS HE3 . 17020 1 58 . 1 1 6 6 LYS HG2 H 1 1.39 0.02 . 2 . . . . 6 LYS HG2 . 17020 1 59 . 1 1 6 6 LYS HG3 H 1 1.32 0.02 . 2 . . . . 6 LYS HG3 . 17020 1 60 . 1 1 6 6 LYS C C 13 176.1 0.2 . 1 . . . . 6 LYS C . 17020 1 61 . 1 1 6 6 LYS CA C 13 56.4 0.2 . 1 . . . . 6 LYS CA . 17020 1 62 . 1 1 6 6 LYS CB C 13 33.5 0.2 . 1 . . . . 6 LYS CB . 17020 1 63 . 1 1 6 6 LYS CD C 13 29.4 0.2 . 1 . . . . 6 LYS CD . 17020 1 64 . 1 1 6 6 LYS CE C 13 41.9 0.2 . 1 . . . . 6 LYS CE . 17020 1 65 . 1 1 6 6 LYS CG C 13 24.9 0.2 . 1 . . . . 6 LYS CG . 17020 1 66 . 1 1 6 6 LYS N N 15 122.9 0.2 . 1 . . . . 6 LYS N . 17020 1 67 . 1 1 7 7 HIS H H 1 8.76 0.02 . 1 . . . . 7 HIS H . 17020 1 68 . 1 1 7 7 HIS HA H 1 4.97 0.02 . 1 . . . . 7 HIS HA . 17020 1 69 . 1 1 7 7 HIS HB2 H 1 3.25 0.02 . 2 . . . . 7 HIS HB2 . 17020 1 70 . 1 1 7 7 HIS HB3 H 1 3.11 0.02 . 2 . . . . 7 HIS HB3 . 17020 1 71 . 1 1 7 7 HIS CA C 13 54.3 0.2 . 1 . . . . 7 HIS CA . 17020 1 72 . 1 1 7 7 HIS CB C 13 30.0 0.2 . 1 . . . . 7 HIS CB . 17020 1 73 . 1 1 7 7 HIS N N 15 121.5 0.2 . 1 . . . . 7 HIS N . 17020 1 74 . 1 1 8 8 PRO HA H 1 4.43 0.02 . 1 . . . . 8 PRO HA . 17020 1 75 . 1 1 8 8 PRO HB2 H 1 2.45 0.02 . 2 . . . . 8 PRO HB2 . 17020 1 76 . 1 1 8 8 PRO HB3 H 1 2.03 0.02 . 2 . . . . 8 PRO HB3 . 17020 1 77 . 1 1 8 8 PRO HD2 H 1 3.63 0.02 . 2 . . . . 8 PRO HD2 . 17020 1 78 . 1 1 8 8 PRO HD3 H 1 3.38 0.02 . 2 . . . . 8 PRO HD3 . 17020 1 79 . 1 1 8 8 PRO HG2 H 1 2.08 0.02 . 2 . . . . 8 PRO HG2 . 17020 1 80 . 1 1 8 8 PRO HG3 H 1 2.08 0.02 . 2 . . . . 8 PRO HG3 . 17020 1 81 . 1 1 8 8 PRO CA C 13 64.9 0.2 . 1 . . . . 8 PRO CA . 17020 1 82 . 1 1 8 8 PRO CB C 13 32.3 0.2 . 1 . . . . 8 PRO CB . 17020 1 83 . 1 1 8 8 PRO CD C 13 50.8 0.2 . 1 . . . . 8 PRO CD . 17020 1 84 . 1 1 8 8 PRO CG C 13 27.8 0.2 . 1 . . . . 8 PRO CG . 17020 1 85 . 1 1 9 9 LEU H H 1 9.38 0.02 . 1 . . . . 9 LEU H . 17020 1 86 . 1 1 9 9 LEU HA H 1 4.39 0.02 . 1 . . . . 9 LEU HA . 17020 1 87 . 1 1 9 9 LEU HB2 H 1 1.96 0.02 . 2 . . . . 9 LEU HB2 . 17020 1 88 . 1 1 9 9 LEU HB3 H 1 1.75 0.02 . 2 . . . . 9 LEU HB3 . 17020 1 89 . 1 1 9 9 LEU HD11 H 1 0.74 0.02 . 2 . . . . 9 LEU HD1 . 17020 1 90 . 1 1 9 9 LEU HD12 H 1 0.74 0.02 . 2 . . . . 9 LEU HD1 . 17020 1 91 . 1 1 9 9 LEU HD13 H 1 0.74 0.02 . 2 . . . . 9 LEU HD1 . 17020 1 92 . 1 1 9 9 LEU HD21 H 1 0.86 0.02 . 2 . . . . 9 LEU HD2 . 17020 1 93 . 1 1 9 9 LEU HD22 H 1 0.86 0.02 . 2 . . . . 9 LEU HD2 . 17020 1 94 . 1 1 9 9 LEU HD23 H 1 0.86 0.02 . 2 . . . . 9 LEU HD2 . 17020 1 95 . 1 1 9 9 LEU HG H 1 1.64 0.02 . 1 . . . . 9 LEU HG . 17020 1 96 . 1 1 9 9 LEU C C 13 178.3 0.2 . 1 . . . . 9 LEU C . 17020 1 97 . 1 1 9 9 LEU CA C 13 56.9 0.2 . 1 . . . . 9 LEU CA . 17020 1 98 . 1 1 9 9 LEU CB C 13 42.2 0.2 . 1 . . . . 9 LEU CB . 17020 1 99 . 1 1 9 9 LEU CD1 C 13 25.5 0.2 . 2 . . . . 9 LEU CD1 . 17020 1 100 . 1 1 9 9 LEU CD2 C 13 23.7 0.2 . 2 . . . . 9 LEU CD2 . 17020 1 101 . 1 1 9 9 LEU CG C 13 27.2 0.2 . 1 . . . . 9 LEU CG . 17020 1 102 . 1 1 9 9 LEU N N 15 125.5 0.2 . 1 . . . . 9 LEU N . 17020 1 103 . 1 1 10 10 GLN H H 1 8.28 0.02 . 1 . . . . 10 GLN H . 17020 1 104 . 1 1 10 10 GLN HA H 1 3.22 0.02 . 1 . . . . 10 GLN HA . 17020 1 105 . 1 1 10 10 GLN HB2 H 1 1.70 0.02 . 2 . . . . 10 GLN HB2 . 17020 1 106 . 1 1 10 10 GLN HB3 H 1 1.64 0.02 . 2 . . . . 10 GLN HB3 . 17020 1 107 . 1 1 10 10 GLN HE21 H 1 7.39 0.02 . 2 . . . . 10 GLN HE21 . 17020 1 108 . 1 1 10 10 GLN HE22 H 1 6.71 0.02 . 2 . . . . 10 GLN HE22 . 17020 1 109 . 1 1 10 10 GLN HG2 H 1 1.82 0.02 . 2 . . . . 10 GLN HG2 . 17020 1 110 . 1 1 10 10 GLN HG3 H 1 1.82 0.02 . 2 . . . . 10 GLN HG3 . 17020 1 111 . 1 1 10 10 GLN C C 13 179.2 0.2 . 1 . . . . 10 GLN C . 17020 1 112 . 1 1 10 10 GLN CA C 13 60.0 0.2 . 1 . . . . 10 GLN CA . 17020 1 113 . 1 1 10 10 GLN CB C 13 27.8 0.2 . 1 . . . . 10 GLN CB . 17020 1 114 . 1 1 10 10 GLN CG C 13 32.6 0.2 . 1 . . . . 10 GLN CG . 17020 1 115 . 1 1 10 10 GLN N N 15 120.6 0.2 . 1 . . . . 10 GLN N . 17020 1 116 . 1 1 10 10 GLN NE2 N 15 110.2 0.2 . 1 . . . . 10 GLN NE2 . 17020 1 117 . 1 1 11 11 ASP H H 1 8.53 0.02 . 1 . . . . 11 ASP H . 17020 1 118 . 1 1 11 11 ASP HA H 1 4.32 0.02 . 1 . . . . 11 ASP HA . 17020 1 119 . 1 1 11 11 ASP HB2 H 1 2.72 0.02 . 2 . . . . 11 ASP HB2 . 17020 1 120 . 1 1 11 11 ASP HB3 H 1 2.72 0.02 . 2 . . . . 11 ASP HB3 . 17020 1 121 . 1 1 11 11 ASP C C 13 178.2 0.2 . 1 . . . . 11 ASP C . 17020 1 122 . 1 1 11 11 ASP CA C 13 57.9 0.2 . 1 . . . . 11 ASP CA . 17020 1 123 . 1 1 11 11 ASP CB C 13 39.6 0.2 . 1 . . . . 11 ASP CB . 17020 1 124 . 1 1 11 11 ASP N N 15 122.9 0.2 . 1 . . . . 11 ASP N . 17020 1 125 . 1 1 12 12 MET H H 1 8.19 0.02 . 1 . . . . 12 MET H . 17020 1 126 . 1 1 12 12 MET HA H 1 4.14 0.02 . 1 . . . . 12 MET HA . 17020 1 127 . 1 1 12 12 MET HB2 H 1 2.1 0.02 . 2 . . . . 12 MET HB2 . 17020 1 128 . 1 1 12 12 MET HB3 H 1 1.92 0.02 . 2 . . . . 12 MET HB3 . 17020 1 129 . 1 1 12 12 MET HE1 H 1 1.49 0.02 . 1 . . . . 12 MET HE . 17020 1 130 . 1 1 12 12 MET HE2 H 1 1.49 0.02 . 1 . . . . 12 MET HE . 17020 1 131 . 1 1 12 12 MET HE3 H 1 1.49 0.02 . 1 . . . . 12 MET HE . 17020 1 132 . 1 1 12 12 MET HG2 H 1 2.4 0.02 . 2 . . . . 12 MET HG2 . 17020 1 133 . 1 1 12 12 MET HG3 H 1 2.09 0.02 . 2 . . . . 12 MET HG3 . 17020 1 134 . 1 1 12 12 MET C C 13 179.0 0.2 . 1 . . . . 12 MET C . 17020 1 135 . 1 1 12 12 MET CA C 13 59.0 0.2 . 1 . . . . 12 MET CA . 17020 1 136 . 1 1 12 12 MET CB C 13 32.6 0.2 . 1 . . . . 12 MET CB . 17020 1 137 . 1 1 12 12 MET CE C 13 16.8 0.2 . 1 . . . . 12 MET CE . 17020 1 138 . 1 1 12 12 MET CG C 13 31.7 0.2 . 1 . . . . 12 MET CG . 17020 1 139 . 1 1 12 12 MET N N 15 120.8 0.2 . 1 . . . . 12 MET N . 17020 1 140 . 1 1 13 13 PHE H H 1 8.37 0.02 . 1 . . . . 13 PHE H . 17020 1 141 . 1 1 13 13 PHE HA H 1 3.89 0.02 . 1 . . . . 13 PHE HA . 17020 1 142 . 1 1 13 13 PHE HB2 H 1 3.26 0.02 . 2 . . . . 13 PHE HB2 . 17020 1 143 . 1 1 13 13 PHE HB3 H 1 2.89 0.02 . 2 . . . . 13 PHE HB3 . 17020 1 144 . 1 1 13 13 PHE HD1 H 1 7.23 0.02 . 3 . . . . 13 PHE HD1 . 17020 1 145 . 1 1 13 13 PHE HD2 H 1 7.23 0.02 . 3 . . . . 13 PHE HD2 . 17020 1 146 . 1 1 13 13 PHE HE1 H 1 7.10 0.02 . 3 . . . . 13 PHE HE1 . 17020 1 147 . 1 1 13 13 PHE HE2 H 1 7.10 0.02 . 3 . . . . 13 PHE HE2 . 17020 1 148 . 1 1 13 13 PHE C C 13 177.7 0.2 . 1 . . . . 13 PHE C . 17020 1 149 . 1 1 13 13 PHE CA C 13 63.7 0.2 . 1 . . . . 13 PHE CA . 17020 1 150 . 1 1 13 13 PHE CB C 13 39.8 0.2 . 1 . . . . 13 PHE CB . 17020 1 151 . 1 1 13 13 PHE CD1 C 13 130.6 0.2 . 3 . . . . 13 PHE CD1 . 17020 1 152 . 1 1 13 13 PHE CD2 C 13 130.6 0.2 . 3 . . . . 13 PHE CD2 . 17020 1 153 . 1 1 13 13 PHE CE1 C 13 131.7 0.2 . 3 . . . . 13 PHE CE1 . 17020 1 154 . 1 1 13 13 PHE CE2 C 13 131.7 0.2 . 3 . . . . 13 PHE CE2 . 17020 1 155 . 1 1 13 13 PHE N N 15 116.3 0.2 . 1 . . . . 13 PHE N . 17020 1 156 . 1 1 14 14 THR H H 1 8.45 0.02 . 1 . . . . 14 THR H . 17020 1 157 . 1 1 14 14 THR HA H 1 4.36 0.02 . 1 . . . . 14 THR HA . 17020 1 158 . 1 1 14 14 THR HB H 1 3.86 0.02 . 1 . . . . 14 THR HB . 17020 1 159 . 1 1 14 14 THR HG21 H 1 1.19 0.02 . 1 . . . . 14 THR HG2 . 17020 1 160 . 1 1 14 14 THR HG22 H 1 1.19 0.02 . 1 . . . . 14 THR HG2 . 17020 1 161 . 1 1 14 14 THR HG23 H 1 1.19 0.02 . 1 . . . . 14 THR HG2 . 17020 1 162 . 1 1 14 14 THR C C 13 175.5 0.2 . 1 . . . . 14 THR C . 17020 1 163 . 1 1 14 14 THR CA C 13 68.5 0.2 . 1 . . . . 14 THR CA . 17020 1 164 . 1 1 14 14 THR CB C 13 68.4 0.2 . 1 . . . . 14 THR CB . 17020 1 165 . 1 1 14 14 THR CG2 C 13 20.7 0.2 . 1 . . . . 14 THR CG2 . 17020 1 166 . 1 1 14 14 THR N N 15 116.9 0.2 . 1 . . . . 14 THR N . 17020 1 167 . 1 1 15 15 SER H H 1 7.94 0.02 . 1 . . . . 15 SER H . 17020 1 168 . 1 1 15 15 SER HA H 1 4.08 0.02 . 1 . . . . 15 SER HA . 17020 1 169 . 1 1 15 15 SER HB2 H 1 3.93 0.02 . 2 . . . . 15 SER HB2 . 17020 1 170 . 1 1 15 15 SER HB3 H 1 3.93 0.02 . 2 . . . . 15 SER HB3 . 17020 1 171 . 1 1 15 15 SER HG H 1 6.69 0.02 . 1 . . . . 15 SER HG . 17020 1 172 . 1 1 15 15 SER C C 13 176.0 0.2 . 1 . . . . 15 SER C . 17020 1 173 . 1 1 15 15 SER CA C 13 62.1 0.2 . 1 . . . . 15 SER CA . 17020 1 174 . 1 1 15 15 SER CB C 13 62.8 0.2 . 1 . . . . 15 SER CB . 17020 1 175 . 1 1 15 15 SER N N 15 116.3 0.2 . 1 . . . . 15 SER N . 17020 1 176 . 1 1 16 16 ALA H H 1 7.48 0.02 . 1 . . . . 16 ALA H . 17020 1 177 . 1 1 16 16 ALA HA H 1 2.78 0.02 . 1 . . . . 16 ALA HA . 17020 1 178 . 1 1 16 16 ALA HB1 H 1 1.21 0.02 . 1 . . . . 16 ALA HB . 17020 1 179 . 1 1 16 16 ALA HB2 H 1 1.21 0.02 . 1 . . . . 16 ALA HB . 17020 1 180 . 1 1 16 16 ALA HB3 H 1 1.21 0.02 . 1 . . . . 16 ALA HB . 17020 1 181 . 1 1 16 16 ALA C C 13 178.0 0.2 . 1 . . . . 16 ALA C . 17020 1 182 . 1 1 16 16 ALA CA C 13 54.4 0.2 . 1 . . . . 16 ALA CA . 17020 1 183 . 1 1 16 16 ALA CB C 13 20.2 0.2 . 1 . . . . 16 ALA CB . 17020 1 184 . 1 1 16 16 ALA N N 15 122.9 0.2 . 1 . . . . 16 ALA N . 17020 1 185 . 1 1 17 17 ILE H H 1 8.40 0.02 . 1 . . . . 17 ILE H . 17020 1 186 . 1 1 17 17 ILE HA H 1 3.22 0.02 . 1 . . . . 17 ILE HA . 17020 1 187 . 1 1 17 17 ILE HB H 1 1.83 0.02 . 1 . . . . 17 ILE HB . 17020 1 188 . 1 1 17 17 ILE HD11 H 1 0.8 0.02 . 1 . . . . 17 ILE HD1 . 17020 1 189 . 1 1 17 17 ILE HD12 H 1 0.8 0.02 . 1 . . . . 17 ILE HD1 . 17020 1 190 . 1 1 17 17 ILE HD13 H 1 0.8 0.02 . 1 . . . . 17 ILE HD1 . 17020 1 191 . 1 1 17 17 ILE HG12 H 1 0.72 0.02 . 2 . . . . 17 ILE HG12 . 17020 1 192 . 1 1 17 17 ILE HG13 H 1 0.72 0.02 . 2 . . . . 17 ILE HG13 . 17020 1 193 . 1 1 17 17 ILE HG21 H 1 0.92 0.02 . 1 . . . . 17 ILE HG2 . 17020 1 194 . 1 1 17 17 ILE HG22 H 1 0.92 0.02 . 1 . . . . 17 ILE HG2 . 17020 1 195 . 1 1 17 17 ILE HG23 H 1 0.92 0.02 . 1 . . . . 17 ILE HG2 . 17020 1 196 . 1 1 17 17 ILE C C 13 177.5 0.2 . 1 . . . . 17 ILE C . 17020 1 197 . 1 1 17 17 ILE CA C 13 66.0 0.2 . 1 . . . . 17 ILE CA . 17020 1 198 . 1 1 17 17 ILE CB C 13 38.5 0.2 . 1 . . . . 17 ILE CB . 17020 1 199 . 1 1 17 17 ILE CD1 C 13 14.8 0.2 . 1 . . . . 17 ILE CD1 . 17020 1 200 . 1 1 17 17 ILE CG1 C 13 31.2 0.2 . 1 . . . . 17 ILE CG1 . 17020 1 201 . 1 1 17 17 ILE CG2 C 13 17.5 0.2 . 1 . . . . 17 ILE CG2 . 17020 1 202 . 1 1 17 17 ILE N N 15 116.8 0.2 . 1 . . . . 17 ILE N . 17020 1 203 . 1 1 18 18 GLU H H 1 8.14 0.02 . 1 . . . . 18 GLU H . 17020 1 204 . 1 1 18 18 GLU HA H 1 3.93 0.02 . 1 . . . . 18 GLU HA . 17020 1 205 . 1 1 18 18 GLU HB2 H 1 2.05 0.02 . 2 . . . . 18 GLU HB2 . 17020 1 206 . 1 1 18 18 GLU HB3 H 1 1.95 0.02 . 2 . . . . 18 GLU HB3 . 17020 1 207 . 1 1 18 18 GLU HG2 H 1 2.56 0.02 . 2 . . . . 18 GLU HG2 . 17020 1 208 . 1 1 18 18 GLU HG3 H 1 2.33 0.02 . 2 . . . . 18 GLU HG3 . 17020 1 209 . 1 1 18 18 GLU C C 13 178.5 0.2 . 1 . . . . 18 GLU C . 17020 1 210 . 1 1 18 18 GLU CA C 13 59.0 0.2 . 1 . . . . 18 GLU CA . 17020 1 211 . 1 1 18 18 GLU CB C 13 28.5 0.2 . 1 . . . . 18 GLU CB . 17020 1 212 . 1 1 18 18 GLU CG C 13 35.5 0.2 . 1 . . . . 18 GLU CG . 17020 1 213 . 1 1 18 18 GLU N N 15 116.0 0.2 . 1 . . . . 18 GLU N . 17020 1 214 . 1 1 19 19 ALA H H 1 7.30 0.02 . 1 . . . . 19 ALA H . 17020 1 215 . 1 1 19 19 ALA HA H 1 4.17 0.02 . 1 . . . . 19 ALA HA . 17020 1 216 . 1 1 19 19 ALA HB1 H 1 1.25 0.02 . 1 . . . . 19 ALA HB . 17020 1 217 . 1 1 19 19 ALA HB2 H 1 1.25 0.02 . 1 . . . . 19 ALA HB . 17020 1 218 . 1 1 19 19 ALA HB3 H 1 1.25 0.02 . 1 . . . . 19 ALA HB . 17020 1 219 . 1 1 19 19 ALA C C 13 180.0 0.2 . 1 . . . . 19 ALA C . 17020 1 220 . 1 1 19 19 ALA CA C 13 54.7 0.2 . 1 . . . . 19 ALA CA . 17020 1 221 . 1 1 19 19 ALA CB C 13 20.0 0.2 . 1 . . . . 19 ALA CB . 17020 1 222 . 1 1 19 19 ALA N N 15 118.5 0.2 . 1 . . . . 19 ALA N . 17020 1 223 . 1 1 20 20 VAL H H 1 7.43 0.02 . 1 . . . . 20 VAL H . 17020 1 224 . 1 1 20 20 VAL HA H 1 4.64 0.02 . 1 . . . . 20 VAL HA . 17020 1 225 . 1 1 20 20 VAL HB H 1 2.38 0.02 . 1 . . . . 20 VAL HB . 17020 1 226 . 1 1 20 20 VAL HG11 H 1 0.88 0.02 . 1 . . . . 20 VAL HG1 . 17020 1 227 . 1 1 20 20 VAL HG12 H 1 0.88 0.02 . 1 . . . . 20 VAL HG1 . 17020 1 228 . 1 1 20 20 VAL HG13 H 1 0.88 0.02 . 1 . . . . 20 VAL HG1 . 17020 1 229 . 1 1 20 20 VAL HG21 H 1 0.77 0.02 . 1 . . . . 20 VAL HG2 . 17020 1 230 . 1 1 20 20 VAL HG22 H 1 0.77 0.02 . 1 . . . . 20 VAL HG2 . 17020 1 231 . 1 1 20 20 VAL HG23 H 1 0.77 0.02 . 1 . . . . 20 VAL HG2 . 17020 1 232 . 1 1 20 20 VAL C C 13 176.9 0.2 . 1 . . . . 20 VAL C . 17020 1 233 . 1 1 20 20 VAL CA C 13 60.8 0.2 . 1 . . . . 20 VAL CA . 17020 1 234 . 1 1 20 20 VAL CB C 13 32.9 0.2 . 1 . . . . 20 VAL CB . 17020 1 235 . 1 1 20 20 VAL CG1 C 13 21 0.2 . 1 . . . . 20 VAL CG1 . 17020 1 236 . 1 1 20 20 VAL CG2 C 13 19.5 0.2 . 1 . . . . 20 VAL CG2 . 17020 1 237 . 1 1 20 20 VAL N N 15 107.8 0.2 . 1 . . . . 20 VAL N . 17020 1 238 . 1 1 21 21 ALA H H 1 8.47 0.02 . 1 . . . . 21 ALA H . 17020 1 239 . 1 1 21 21 ALA HA H 1 4.17 0.02 . 1 . . . . 21 ALA HA . 17020 1 240 . 1 1 21 21 ALA HB1 H 1 1.3 0.02 . 1 . . . . 21 ALA HB . 17020 1 241 . 1 1 21 21 ALA HB2 H 1 1.3 0.02 . 1 . . . . 21 ALA HB . 17020 1 242 . 1 1 21 21 ALA HB3 H 1 1.3 0.02 . 1 . . . . 21 ALA HB . 17020 1 243 . 1 1 21 21 ALA C C 13 178.5 0.2 . 1 . . . . 21 ALA C . 17020 1 244 . 1 1 21 21 ALA CA C 13 53.6 0.2 . 1 . . . . 21 ALA CA . 17020 1 245 . 1 1 21 21 ALA CB C 13 19.2 0.2 . 1 . . . . 21 ALA CB . 17020 1 246 . 1 1 21 21 ALA N N 15 125.9 0.2 . 1 . . . . 21 ALA N . 17020 1 247 . 1 1 22 22 ARG H H 1 8.14 0.02 . 1 . . . . 22 ARG H . 17020 1 248 . 1 1 22 22 ARG HA H 1 4.57 0.02 . 1 . . . . 22 ARG HA . 17020 1 249 . 1 1 22 22 ARG HB2 H 1 2.26 0.02 . 2 . . . . 22 ARG HB2 . 17020 1 250 . 1 1 22 22 ARG HB3 H 1 2.05 0.02 . 2 . . . . 22 ARG HB3 . 17020 1 251 . 1 1 22 22 ARG HD2 H 1 3.38 0.02 . 2 . . . . 22 ARG HD2 . 17020 1 252 . 1 1 22 22 ARG HD3 H 1 3.31 0.02 . 2 . . . . 22 ARG HD3 . 17020 1 253 . 1 1 22 22 ARG HE H 1 7.32 0.02 . 1 . . . . 22 ARG HE . 17020 1 254 . 1 1 22 22 ARG HG2 H 1 2.03 0.02 . 2 . . . . 22 ARG HG2 . 17020 1 255 . 1 1 22 22 ARG HG3 H 1 1.87 0.02 . 2 . . . . 22 ARG HG3 . 17020 1 256 . 1 1 22 22 ARG C C 13 178.0 0.2 . 1 . . . . 22 ARG C . 17020 1 257 . 1 1 22 22 ARG CA C 13 55.7 0.2 . 1 . . . . 22 ARG CA . 17020 1 258 . 1 1 22 22 ARG CB C 13 31.5 0.2 . 1 . . . . 22 ARG CB . 17020 1 259 . 1 1 22 22 ARG CD C 13 43.6 0.2 . 1 . . . . 22 ARG CD . 17020 1 260 . 1 1 22 22 ARG CG C 13 28.4 0.2 . 1 . . . . 22 ARG CG . 17020 1 261 . 1 1 22 22 ARG N N 15 118.4 0.2 . 1 . . . . 22 ARG N . 17020 1 262 . 1 1 22 22 ARG NE N 15 84.6 0.2 . 1 . . . . 22 ARG NE . 17020 1 263 . 1 1 23 23 ASP H H 1 8.89 0.02 . 1 . . . . 23 ASP H . 17020 1 264 . 1 1 23 23 ASP HA H 1 4.36 0.02 . 1 . . . . 23 ASP HA . 17020 1 265 . 1 1 23 23 ASP HB2 H 1 2.77 0.02 . 2 . . . . 23 ASP HB2 . 17020 1 266 . 1 1 23 23 ASP HB3 H 1 2.77 0.02 . 2 . . . . 23 ASP HB3 . 17020 1 267 . 1 1 23 23 ASP C C 13 176.6 0.2 . 1 . . . . 23 ASP C . 17020 1 268 . 1 1 23 23 ASP CA C 13 57.1 0.2 . 1 . . . . 23 ASP CA . 17020 1 269 . 1 1 23 23 ASP CB C 13 40.1 0.2 . 1 . . . . 23 ASP CB . 17020 1 270 . 1 1 23 23 ASP N N 15 122.0 0.2 . 1 . . . . 23 ASP N . 17020 1 271 . 1 1 24 24 SER H H 1 7.84 0.02 . 1 . . . . 24 SER H . 17020 1 272 . 1 1 24 24 SER HA H 1 4.32 0.02 . 1 . . . . 24 SER HA . 17020 1 273 . 1 1 24 24 SER HB2 H 1 4.26 0.02 . 2 . . . . 24 SER HB2 . 17020 1 274 . 1 1 24 24 SER HB3 H 1 4.09 0.02 . 2 . . . . 24 SER HB3 . 17020 1 275 . 1 1 24 24 SER C C 13 175.5 0.2 . 1 . . . . 24 SER C . 17020 1 276 . 1 1 24 24 SER CA C 13 58.6 0.2 . 1 . . . . 24 SER CA . 17020 1 277 . 1 1 24 24 SER CB C 13 64.0 0.2 . 1 . . . . 24 SER CB . 17020 1 278 . 1 1 24 24 SER N N 15 112.2 0.2 . 1 . . . . 24 SER N . 17020 1 279 . 1 1 25 25 GLY H H 1 8.36 0.02 . 1 . . . . 25 GLY H . 17020 1 280 . 1 1 25 25 GLY HA2 H 1 4.12 0.02 . 2 . . . . 25 GLY HA2 . 17020 1 281 . 1 1 25 25 GLY HA3 H 1 3.48 0.02 . 2 . . . . 25 GLY HA3 . 17020 1 282 . 1 1 25 25 GLY C C 13 172.5 0.2 . 1 . . . . 25 GLY C . 17020 1 283 . 1 1 25 25 GLY CA C 13 45.0 0.2 . 1 . . . . 25 GLY CA . 17020 1 284 . 1 1 25 25 GLY N N 15 110.8 0.2 . 1 . . . . 25 GLY N . 17020 1 285 . 1 1 26 26 TRP H H 1 7.38 0.02 . 1 . . . . 26 TRP H . 17020 1 286 . 1 1 26 26 TRP HA H 1 4.64 0.02 . 1 . . . . 26 TRP HA . 17020 1 287 . 1 1 26 26 TRP HB2 H 1 3.06 0.02 . 2 . . . . 26 TRP HB2 . 17020 1 288 . 1 1 26 26 TRP HB3 H 1 2.85 0.02 . 2 . . . . 26 TRP HB3 . 17020 1 289 . 1 1 26 26 TRP HD1 H 1 7.09 0.02 . 1 . . . . 26 TRP HD1 . 17020 1 290 . 1 1 26 26 TRP HE1 H 1 10.11 0.02 . 1 . . . . 26 TRP HE1 . 17020 1 291 . 1 1 26 26 TRP HH2 H 1 6.88 0.02 . 1 . . . . 26 TRP HH2 . 17020 1 292 . 1 1 26 26 TRP HZ2 H 1 7.37 0.02 . 1 . . . . 26 TRP HZ2 . 17020 1 293 . 1 1 26 26 TRP HZ3 H 1 6.89 0.02 . 1 . . . . 26 TRP HZ3 . 17020 1 294 . 1 1 26 26 TRP C C 13 175.5 0.2 . 1 . . . . 26 TRP C . 17020 1 295 . 1 1 26 26 TRP CA C 13 57.0 0.2 . 1 . . . . 26 TRP CA . 17020 1 296 . 1 1 26 26 TRP CB C 13 31.3 0.2 . 1 . . . . 26 TRP CB . 17020 1 297 . 1 1 26 26 TRP CD1 C 13 127.7 0.2 . 1 . . . . 26 TRP CD1 . 17020 1 298 . 1 1 26 26 TRP CH2 C 13 124.5 0.2 . 1 . . . . 26 TRP CH2 . 17020 1 299 . 1 1 26 26 TRP CZ2 C 13 115.5 0.2 . 1 . . . . 26 TRP CZ2 . 17020 1 300 . 1 1 26 26 TRP CZ3 C 13 122.9 0.2 . 1 . . . . 26 TRP CZ3 . 17020 1 301 . 1 1 26 26 TRP N N 15 118.1 0.2 . 1 . . . . 26 TRP N . 17020 1 302 . 1 1 26 26 TRP NE1 N 15 129 0.2 . 1 . . . . 26 TRP NE1 . 17020 1 303 . 1 1 27 27 ALA H H 1 9.80 0.02 . 1 . . . . 27 ALA H . 17020 1 304 . 1 1 27 27 ALA HA H 1 4.97 0.02 . 1 . . . . 27 ALA HA . 17020 1 305 . 1 1 27 27 ALA HB1 H 1 1.26 0.02 . 1 . . . . 27 ALA HB . 17020 1 306 . 1 1 27 27 ALA HB2 H 1 1.26 0.02 . 1 . . . . 27 ALA HB . 17020 1 307 . 1 1 27 27 ALA HB3 H 1 1.26 0.02 . 1 . . . . 27 ALA HB . 17020 1 308 . 1 1 27 27 ALA C C 13 176.2 0.2 . 1 . . . . 27 ALA C . 17020 1 309 . 1 1 27 27 ALA CA C 13 49.6 0.2 . 1 . . . . 27 ALA CA . 17020 1 310 . 1 1 27 27 ALA CB C 13 22.9 0.2 . 1 . . . . 27 ALA CB . 17020 1 311 . 1 1 27 27 ALA N N 15 125.1 0.2 . 1 . . . . 27 ALA N . 17020 1 312 . 1 1 28 28 GLU H H 1 9.20 0.02 . 1 . . . . 28 GLU H . 17020 1 313 . 1 1 28 28 GLU HA H 1 4.42 0.02 . 1 . . . . 28 GLU HA . 17020 1 314 . 1 1 28 28 GLU HB2 H 1 2.38 0.02 . 2 . . . . 28 GLU HB2 . 17020 1 315 . 1 1 28 28 GLU HB3 H 1 2.06 0.02 . 2 . . . . 28 GLU HB3 . 17020 1 316 . 1 1 28 28 GLU HG2 H 1 2.59 0.02 . 2 . . . . 28 GLU HG2 . 17020 1 317 . 1 1 28 28 GLU HG3 H 1 2.43 0.02 . 2 . . . . 28 GLU HG3 . 17020 1 318 . 1 1 28 28 GLU C C 13 177.9 0.2 . 1 . . . . 28 GLU C . 17020 1 319 . 1 1 28 28 GLU CA C 13 57.5 0.2 . 1 . . . . 28 GLU CA . 17020 1 320 . 1 1 28 28 GLU CB C 13 29.7 0.2 . 1 . . . . 28 GLU CB . 17020 1 321 . 1 1 28 28 GLU CG C 13 36.5 0.2 . 1 . . . . 28 GLU CG . 17020 1 322 . 1 1 28 28 GLU N N 15 124.8 0.2 . 1 . . . . 28 GLU N . 17020 1 323 . 1 1 29 29 LEU H H 1 8.78 0.02 . 1 . . . . 29 LEU H . 17020 1 324 . 1 1 29 29 LEU HA H 1 3.95 0.02 . 1 . . . . 29 LEU HA . 17020 1 325 . 1 1 29 29 LEU HB2 H 1 2.05 0.02 . 2 . . . . 29 LEU HB2 . 17020 1 326 . 1 1 29 29 LEU HB3 H 1 1.28 0.02 . 2 . . . . 29 LEU HB3 . 17020 1 327 . 1 1 29 29 LEU HD11 H 1 0.93 0.02 . 1 . . . . 29 LEU HD1 . 17020 1 328 . 1 1 29 29 LEU HD12 H 1 0.93 0.02 . 1 . . . . 29 LEU HD1 . 17020 1 329 . 1 1 29 29 LEU HD13 H 1 0.93 0.02 . 1 . . . . 29 LEU HD1 . 17020 1 330 . 1 1 29 29 LEU HD21 H 1 0.86 0.02 . 1 . . . . 29 LEU HD2 . 17020 1 331 . 1 1 29 29 LEU HD22 H 1 0.86 0.02 . 1 . . . . 29 LEU HD2 . 17020 1 332 . 1 1 29 29 LEU HD23 H 1 0.86 0.02 . 1 . . . . 29 LEU HD2 . 17020 1 333 . 1 1 29 29 LEU C C 13 178.6 0.2 . 1 . . . . 29 LEU C . 17020 1 334 . 1 1 29 29 LEU CA C 13 58.8 0.2 . 1 . . . . 29 LEU CA . 17020 1 335 . 1 1 29 29 LEU CB C 13 41.8 0.2 . 1 . . . . 29 LEU CB . 17020 1 336 . 1 1 29 29 LEU CD1 C 13 24.3 0.2 . 1 . . . . 29 LEU CD1 . 17020 1 337 . 1 1 29 29 LEU CD2 C 13 26 0.2 . 1 . . . . 29 LEU CD2 . 17020 1 338 . 1 1 29 29 LEU N N 15 128.0 0.2 . 1 . . . . 29 LEU N . 17020 1 339 . 1 1 30 30 SER H H 1 9.13 0.02 . 1 . . . . 30 SER H . 17020 1 340 . 1 1 30 30 SER HA H 1 4.25 0.02 . 1 . . . . 30 SER HA . 17020 1 341 . 1 1 30 30 SER HB2 H 1 4.05 0.02 . 2 . . . . 30 SER HB2 . 17020 1 342 . 1 1 30 30 SER HB3 H 1 4.05 0.02 . 2 . . . . 30 SER HB3 . 17020 1 343 . 1 1 30 30 SER C C 13 177.0 0.2 . 1 . . . . 30 SER C . 17020 1 344 . 1 1 30 30 SER CA C 13 61.4 0.2 . 1 . . . . 30 SER CA . 17020 1 345 . 1 1 30 30 SER CB C 13 61.8 0.2 . 1 . . . . 30 SER CB . 17020 1 346 . 1 1 30 30 SER N N 15 114.5 0.2 . 1 . . . . 30 SER N . 17020 1 347 . 1 1 31 31 ALA H H 1 7.19 0.02 . 1 . . . . 31 ALA H . 17020 1 348 . 1 1 31 31 ALA HA H 1 4.37 0.02 . 1 . . . . 31 ALA HA . 17020 1 349 . 1 1 31 31 ALA HB1 H 1 1.66 0.02 . 1 . . . . 31 ALA HB . 17020 1 350 . 1 1 31 31 ALA HB2 H 1 1.66 0.02 . 1 . . . . 31 ALA HB . 17020 1 351 . 1 1 31 31 ALA HB3 H 1 1.66 0.02 . 1 . . . . 31 ALA HB . 17020 1 352 . 1 1 31 31 ALA C C 13 180.8 0.2 . 1 . . . . 31 ALA C . 17020 1 353 . 1 1 31 31 ALA CA C 13 54.8 0.2 . 1 . . . . 31 ALA CA . 17020 1 354 . 1 1 31 31 ALA CB C 13 18.4 0.2 . 1 . . . . 31 ALA CB . 17020 1 355 . 1 1 31 31 ALA N N 15 126.4 0.2 . 1 . . . . 31 ALA N . 17020 1 356 . 1 1 32 32 VAL H H 1 8.05 0.02 . 1 . . . . 32 VAL H . 17020 1 357 . 1 1 32 32 VAL HA H 1 3.43 0.02 . 1 . . . . 32 VAL HA . 17020 1 358 . 1 1 32 32 VAL HB H 1 2.39 0.02 . 1 . . . . 32 VAL HB . 17020 1 359 . 1 1 32 32 VAL HG11 H 1 0.77 0.02 . 1 . . . . 32 VAL HG1 . 17020 1 360 . 1 1 32 32 VAL HG12 H 1 0.77 0.02 . 1 . . . . 32 VAL HG1 . 17020 1 361 . 1 1 32 32 VAL HG13 H 1 0.77 0.02 . 1 . . . . 32 VAL HG1 . 17020 1 362 . 1 1 32 32 VAL HG21 H 1 0.83 0.02 . 1 . . . . 32 VAL HG2 . 17020 1 363 . 1 1 32 32 VAL HG22 H 1 0.83 0.02 . 1 . . . . 32 VAL HG2 . 17020 1 364 . 1 1 32 32 VAL HG23 H 1 0.83 0.02 . 1 . . . . 32 VAL HG2 . 17020 1 365 . 1 1 32 32 VAL C C 13 177.7 0.2 . 1 . . . . 32 VAL C . 17020 1 366 . 1 1 32 32 VAL CA C 13 67.0 0.2 . 1 . . . . 32 VAL CA . 17020 1 367 . 1 1 32 32 VAL CB C 13 31.7 0.2 . 1 . . . . 32 VAL CB . 17020 1 368 . 1 1 32 32 VAL CG1 C 13 20.5 0.2 . 1 . . . . 32 VAL CG1 . 17020 1 369 . 1 1 32 32 VAL CG2 C 13 24.1 0.2 . 1 . . . . 32 VAL CG2 . 17020 1 370 . 1 1 32 32 VAL N N 15 121.5 0.2 . 1 . . . . 32 VAL N . 17020 1 371 . 1 1 33 33 GLY H H 1 9.05 0.02 . 1 . . . . 33 GLY H . 17020 1 372 . 1 1 33 33 GLY HA2 H 1 4 0.02 . 2 . . . . 33 GLY HA2 . 17020 1 373 . 1 1 33 33 GLY HA3 H 1 3.54 0.02 . 2 . . . . 33 GLY HA3 . 17020 1 374 . 1 1 33 33 GLY C C 13 176.3 0.2 . 1 . . . . 33 GLY C . 17020 1 375 . 1 1 33 33 GLY CA C 13 47.8 0.2 . 1 . . . . 33 GLY CA . 17020 1 376 . 1 1 33 33 GLY N N 15 106.7 0.2 . 1 . . . . 33 GLY N . 17020 1 377 . 1 1 34 34 SER H H 1 8.14 0.02 . 1 . . . . 34 SER H . 17020 1 378 . 1 1 34 34 SER HA H 1 4.29 0.02 . 1 . . . . 34 SER HA . 17020 1 379 . 1 1 34 34 SER HB2 H 1 4.02 0.02 . 2 . . . . 34 SER HB2 . 17020 1 380 . 1 1 34 34 SER HB3 H 1 4.02 0.02 . 2 . . . . 34 SER HB3 . 17020 1 381 . 1 1 34 34 SER HG H 1 5.97 0.02 . 1 . . . . 34 SER HG . 17020 1 382 . 1 1 34 34 SER C C 13 176.4 0.2 . 1 . . . . 34 SER C . 17020 1 383 . 1 1 34 34 SER CA C 13 61.8 0.2 . 1 . . . . 34 SER CA . 17020 1 384 . 1 1 34 34 SER CB C 13 62.9 0.2 . 1 . . . . 34 SER CB . 17020 1 385 . 1 1 34 34 SER N N 15 117.4 0.2 . 1 . . . . 34 SER N . 17020 1 386 . 1 1 35 35 TYR H H 1 7.95 0.02 . 1 . . . . 35 TYR H . 17020 1 387 . 1 1 35 35 TYR HA H 1 3.98 0.02 . 1 . . . . 35 TYR HA . 17020 1 388 . 1 1 35 35 TYR HB2 H 1 3.23 0.02 . 2 . . . . 35 TYR HB2 . 17020 1 389 . 1 1 35 35 TYR HB3 H 1 3.01 0.02 . 2 . . . . 35 TYR HB3 . 17020 1 390 . 1 1 35 35 TYR HD1 H 1 6.86 0.02 . 3 . . . . 35 TYR HD1 . 17020 1 391 . 1 1 35 35 TYR HD2 H 1 6.86 0.02 . 3 . . . . 35 TYR HD2 . 17020 1 392 . 1 1 35 35 TYR HE1 H 1 6.68 0.02 . 3 . . . . 35 TYR HE1 . 17020 1 393 . 1 1 35 35 TYR HE2 H 1 6.68 0.02 . 3 . . . . 35 TYR HE2 . 17020 1 394 . 1 1 35 35 TYR C C 13 179.1 0.2 . 1 . . . . 35 TYR C . 17020 1 395 . 1 1 35 35 TYR CA C 13 62.2 0.2 . 1 . . . . 35 TYR CA . 17020 1 396 . 1 1 35 35 TYR CB C 13 38.2 0.2 . 1 . . . . 35 TYR CB . 17020 1 397 . 1 1 35 35 TYR CD1 C 13 133.1 0.2 . 3 . . . . 35 TYR CD1 . 17020 1 398 . 1 1 35 35 TYR CD2 C 13 133.1 0.2 . 3 . . . . 35 TYR CD2 . 17020 1 399 . 1 1 35 35 TYR CE1 C 13 118.3 0.2 . 3 . . . . 35 TYR CE1 . 17020 1 400 . 1 1 35 35 TYR CE2 C 13 118.3 0.2 . 3 . . . . 35 TYR CE2 . 17020 1 401 . 1 1 35 35 TYR N N 15 123.6 0.2 . 1 . . . . 35 TYR N . 17020 1 402 . 1 1 36 36 LEU H H 1 8.66 0.02 . 1 . . . . 36 LEU H . 17020 1 403 . 1 1 36 36 LEU HA H 1 3.89 0.02 . 1 . . . . 36 LEU HA . 17020 1 404 . 1 1 36 36 LEU HB2 H 1 1.62 0.02 . 2 . . . . 36 LEU HB2 . 17020 1 405 . 1 1 36 36 LEU HB3 H 1 0.9 0.02 . 2 . . . . 36 LEU HB3 . 17020 1 406 . 1 1 36 36 LEU HD11 H 1 -0.03 0.02 . 1 . . . . 36 LEU HD1 . 17020 1 407 . 1 1 36 36 LEU HD12 H 1 -0.03 0.02 . 1 . . . . 36 LEU HD1 . 17020 1 408 . 1 1 36 36 LEU HD13 H 1 -0.03 0.02 . 1 . . . . 36 LEU HD1 . 17020 1 409 . 1 1 36 36 LEU HD21 H 1 0.39 0.02 . 1 . . . . 36 LEU HD2 . 17020 1 410 . 1 1 36 36 LEU HD22 H 1 0.39 0.02 . 1 . . . . 36 LEU HD2 . 17020 1 411 . 1 1 36 36 LEU HD23 H 1 0.39 0.02 . 1 . . . . 36 LEU HD2 . 17020 1 412 . 1 1 36 36 LEU HG H 1 1.61 0.02 . 1 . . . . 36 LEU HG . 17020 1 413 . 1 1 36 36 LEU C C 13 178.6 0.2 . 1 . . . . 36 LEU C . 17020 1 414 . 1 1 36 36 LEU CA C 13 57.7 0.2 . 1 . . . . 36 LEU CA . 17020 1 415 . 1 1 36 36 LEU CB C 13 41.3 0.2 . 1 . . . . 36 LEU CB . 17020 1 416 . 1 1 36 36 LEU CD1 C 13 25.9 0.2 . 1 . . . . 36 LEU CD1 . 17020 1 417 . 1 1 36 36 LEU CD2 C 13 22.7 0.2 . 1 . . . . 36 LEU CD2 . 17020 1 418 . 1 1 36 36 LEU CG C 13 26.1 0.2 . 1 . . . . 36 LEU CG . 17020 1 419 . 1 1 36 36 LEU N N 15 121.0 0.2 . 1 . . . . 36 LEU N . 17020 1 420 . 1 1 37 37 ALA H H 1 7.97 0.02 . 1 . . . . 37 ALA H . 17020 1 421 . 1 1 37 37 ALA HA H 1 4.08 0.02 . 1 . . . . 37 ALA HA . 17020 1 422 . 1 1 37 37 ALA HB1 H 1 1.48 0.02 . 1 . . . . 37 ALA HB . 17020 1 423 . 1 1 37 37 ALA HB2 H 1 1.48 0.02 . 1 . . . . 37 ALA HB . 17020 1 424 . 1 1 37 37 ALA HB3 H 1 1.48 0.02 . 1 . . . . 37 ALA HB . 17020 1 425 . 1 1 37 37 ALA C C 13 179.3 0.2 . 1 . . . . 37 ALA C . 17020 1 426 . 1 1 37 37 ALA CA C 13 54.7 0.2 . 1 . . . . 37 ALA CA . 17020 1 427 . 1 1 37 37 ALA CB C 13 18.4 0.2 . 1 . . . . 37 ALA CB . 17020 1 428 . 1 1 37 37 ALA N N 15 119.9 0.2 . 1 . . . . 37 ALA N . 17020 1 429 . 1 1 38 38 LYS H H 1 7.23 0.02 . 1 . . . . 38 LYS H . 17020 1 430 . 1 1 38 38 LYS HA H 1 4.11 0.02 . 1 . . . . 38 LYS HA . 17020 1 431 . 1 1 38 38 LYS HB2 H 1 1.7 0.02 . 2 . . . . 38 LYS HB2 . 17020 1 432 . 1 1 38 38 LYS HB3 H 1 1.65 0.02 . 2 . . . . 38 LYS HB3 . 17020 1 433 . 1 1 38 38 LYS HD2 H 1 1.57 0.02 . 2 . . . . 38 LYS HD2 . 17020 1 434 . 1 1 38 38 LYS HD3 H 1 1.57 0.02 . 2 . . . . 38 LYS HD3 . 17020 1 435 . 1 1 38 38 LYS HE2 H 1 2.92 0.02 . 2 . . . . 38 LYS HE2 . 17020 1 436 . 1 1 38 38 LYS HE3 H 1 2.92 0.02 . 2 . . . . 38 LYS HE3 . 17020 1 437 . 1 1 38 38 LYS HG2 H 1 1.38 0.02 . 2 . . . . 38 LYS HG2 . 17020 1 438 . 1 1 38 38 LYS HG3 H 1 1.29 0.02 . 2 . . . . 38 LYS HG3 . 17020 1 439 . 1 1 38 38 LYS C C 13 177.6 0.2 . 1 . . . . 38 LYS C . 17020 1 440 . 1 1 38 38 LYS CA C 13 57.8 0.2 . 1 . . . . 38 LYS CA . 17020 1 441 . 1 1 38 38 LYS CB C 13 33.4 0.2 . 1 . . . . 38 LYS CB . 17020 1 442 . 1 1 38 38 LYS CD C 13 28.9 0.2 . 1 . . . . 38 LYS CD . 17020 1 443 . 1 1 38 38 LYS CE C 13 42 0.2 . 1 . . . . 38 LYS CE . 17020 1 444 . 1 1 38 38 LYS CG C 13 24.8 0.2 . 1 . . . . 38 LYS CG . 17020 1 445 . 1 1 38 38 LYS N N 15 114.4 0.2 . 1 . . . . 38 LYS N . 17020 1 446 . 1 1 39 39 ASN H H 1 7.83 0.02 . 1 . . . . 39 ASN H . 17020 1 447 . 1 1 39 39 ASN HA H 1 4.59 0.02 . 1 . . . . 39 ASN HA . 17020 1 448 . 1 1 39 39 ASN HB2 H 1 2.45 0.02 . 2 . . . . 39 ASN HB2 . 17020 1 449 . 1 1 39 39 ASN HB3 H 1 2.03 0.02 . 2 . . . . 39 ASN HB3 . 17020 1 450 . 1 1 39 39 ASN HD21 H 1 6.72 0.02 . 2 . . . . 39 ASN HD21 . 17020 1 451 . 1 1 39 39 ASN HD22 H 1 5.8 0.02 . 2 . . . . 39 ASN HD22 . 17020 1 452 . 1 1 39 39 ASN C C 13 174.5 0.2 . 1 . . . . 39 ASN C . 17020 1 453 . 1 1 39 39 ASN CA C 13 54.9 0.2 . 1 . . . . 39 ASN CA . 17020 1 454 . 1 1 39 39 ASN CB C 13 40.7 0.2 . 1 . . . . 39 ASN CB . 17020 1 455 . 1 1 39 39 ASN N N 15 113.6 0.2 . 1 . . . . 39 ASN N . 17020 1 456 . 1 1 39 39 ASN ND2 N 15 115.2 0.2 . 1 . . . . 39 ASN ND2 . 17020 1 457 . 1 1 40 40 ASP H H 1 8.45 0.02 . 1 . . . . 40 ASP H . 17020 1 458 . 1 1 40 40 ASP HA H 1 5.23 0.02 . 1 . . . . 40 ASP HA . 17020 1 459 . 1 1 40 40 ASP HB2 H 1 2.98 0.02 . 2 . . . . 40 ASP HB2 . 17020 1 460 . 1 1 40 40 ASP HB3 H 1 2.69 0.02 . 2 . . . . 40 ASP HB3 . 17020 1 461 . 1 1 40 40 ASP CA C 13 51.6 0.2 . 1 . . . . 40 ASP CA . 17020 1 462 . 1 1 40 40 ASP CB C 13 41.1 0.2 . 1 . . . . 40 ASP CB . 17020 1 463 . 1 1 40 40 ASP N N 15 119.3 0.2 . 1 . . . . 40 ASP N . 17020 1 464 . 1 1 41 41 PRO HA H 1 4.49 0.02 . 1 . . . . 41 PRO HA . 17020 1 465 . 1 1 41 41 PRO HB2 H 1 2.42 0.02 . 2 . . . . 41 PRO HB2 . 17020 1 466 . 1 1 41 41 PRO HB3 H 1 2.05 0.02 . 2 . . . . 41 PRO HB3 . 17020 1 467 . 1 1 41 41 PRO HD2 H 1 3.78 0.02 . 2 . . . . 41 PRO HD2 . 17020 1 468 . 1 1 41 41 PRO HD3 H 1 3.51 0.02 . 2 . . . . 41 PRO HD3 . 17020 1 469 . 1 1 41 41 PRO HG2 H 1 2.02 0.02 . 2 . . . . 41 PRO HG2 . 17020 1 470 . 1 1 41 41 PRO HG3 H 1 2.02 0.02 . 2 . . . . 41 PRO HG3 . 17020 1 471 . 1 1 41 41 PRO C C 13 177.4 0.2 . 1 . . . . 41 PRO C . 17020 1 472 . 1 1 41 41 PRO CA C 13 64.6 0.2 . 1 . . . . 41 PRO CA . 17020 1 473 . 1 1 41 41 PRO CB C 13 32.1 0.2 . 1 . . . . 41 PRO CB . 17020 1 474 . 1 1 41 41 PRO CD C 13 51.1 0.2 . 1 . . . . 41 PRO CD . 17020 1 475 . 1 1 41 41 PRO CG C 13 27.2 0.2 . 1 . . . . 41 PRO CG . 17020 1 476 . 1 1 42 42 SER H H 1 8.37 0.02 . 1 . . . . 42 SER H . 17020 1 477 . 1 1 42 42 SER HA H 1 4.41 0.02 . 1 . . . . 42 SER HA . 17020 1 478 . 1 1 42 42 SER HB2 H 1 3.98 0.02 . 2 . . . . 42 SER HB2 . 17020 1 479 . 1 1 42 42 SER HB3 H 1 3.89 0.02 . 2 . . . . 42 SER HB3 . 17020 1 480 . 1 1 42 42 SER C C 13 174.8 0.2 . 1 . . . . 42 SER C . 17020 1 481 . 1 1 42 42 SER CA C 13 59.5 0.2 . 1 . . . . 42 SER CA . 17020 1 482 . 1 1 42 42 SER CB C 13 63.5 0.2 . 1 . . . . 42 SER CB . 17020 1 483 . 1 1 42 42 SER N N 15 113.1 0.2 . 1 . . . . 42 SER N . 17020 1 484 . 1 1 43 43 PHE H H 1 8.13 0.02 . 1 . . . . 43 PHE H . 17020 1 485 . 1 1 43 43 PHE HA H 1 4.51 0.02 . 1 . . . . 43 PHE HA . 17020 1 486 . 1 1 43 43 PHE HB2 H 1 3.17 0.02 . 2 . . . . 43 PHE HB2 . 17020 1 487 . 1 1 43 43 PHE HB3 H 1 2.96 0.02 . 2 . . . . 43 PHE HB3 . 17020 1 488 . 1 1 43 43 PHE HD1 H 1 7.06 0.02 . 3 . . . . 43 PHE HD1 . 17020 1 489 . 1 1 43 43 PHE HD2 H 1 7.06 0.02 . 3 . . . . 43 PHE HD2 . 17020 1 490 . 1 1 43 43 PHE HE1 H 1 6.91 0.02 . 3 . . . . 43 PHE HE1 . 17020 1 491 . 1 1 43 43 PHE HE2 H 1 6.91 0.02 . 3 . . . . 43 PHE HE2 . 17020 1 492 . 1 1 43 43 PHE HZ H 1 6.84 0.02 . 1 . . . . 43 PHE HZ . 17020 1 493 . 1 1 43 43 PHE C C 13 173.8 0.2 . 1 . . . . 43 PHE C . 17020 1 494 . 1 1 43 43 PHE CA C 13 58.9 0.2 . 1 . . . . 43 PHE CA . 17020 1 495 . 1 1 43 43 PHE CB C 13 39.0 0.2 . 1 . . . . 43 PHE CB . 17020 1 496 . 1 1 43 43 PHE CD1 C 13 132.2 0.2 . 3 . . . . 43 PHE CD1 . 17020 1 497 . 1 1 43 43 PHE CD2 C 13 132.2 0.2 . 3 . . . . 43 PHE CD2 . 17020 1 498 . 1 1 43 43 PHE CE1 C 13 131.1 0.2 . 3 . . . . 43 PHE CE1 . 17020 1 499 . 1 1 43 43 PHE CE2 C 13 131.1 0.2 . 3 . . . . 43 PHE CE2 . 17020 1 500 . 1 1 43 43 PHE CZ C 13 130.0 0.2 . 1 . . . . 43 PHE CZ . 17020 1 501 . 1 1 43 43 PHE N N 15 124.1 0.2 . 1 . . . . 43 PHE N . 17020 1 502 . 1 1 44 44 ASP H H 1 7.60 0.02 . 1 . . . . 44 ASP H . 17020 1 503 . 1 1 44 44 ASP HA H 1 4.76 0.02 . 1 . . . . 44 ASP HA . 17020 1 504 . 1 1 44 44 ASP HB2 H 1 2.79 0.02 . 2 . . . . 44 ASP HB2 . 17020 1 505 . 1 1 44 44 ASP HB3 H 1 2.55 0.02 . 2 . . . . 44 ASP HB3 . 17020 1 506 . 1 1 44 44 ASP CA C 13 50.9 0.2 . 1 . . . . 44 ASP CA . 17020 1 507 . 1 1 44 44 ASP CB C 13 42.9 0.2 . 1 . . . . 44 ASP CB . 17020 1 508 . 1 1 44 44 ASP N N 15 126.6 0.2 . 1 . . . . 44 ASP N . 17020 1 509 . 1 1 45 45 PRO HA H 1 4.12 0.02 . 1 . . . . 45 PRO HA . 17020 1 510 . 1 1 45 45 PRO HB2 H 1 2.28 0.02 . 2 . . . . 45 PRO HB2 . 17020 1 511 . 1 1 45 45 PRO HB3 H 1 2.00 0.02 . 2 . . . . 45 PRO HB3 . 17020 1 512 . 1 1 45 45 PRO HD2 H 1 3.95 0.02 . 2 . . . . 45 PRO HD2 . 17020 1 513 . 1 1 45 45 PRO HD3 H 1 3.61 0.02 . 2 . . . . 45 PRO HD3 . 17020 1 514 . 1 1 45 45 PRO HG2 H 1 2.05 0.02 . 2 . . . . 45 PRO HG2 . 17020 1 515 . 1 1 45 45 PRO HG3 H 1 1.99 0.02 . 2 . . . . 45 PRO HG3 . 17020 1 516 . 1 1 45 45 PRO C C 13 178.3 0.2 . 1 . . . . 45 PRO C . 17020 1 517 . 1 1 45 45 PRO CA C 13 64.9 0.2 . 1 . . . . 45 PRO CA . 17020 1 518 . 1 1 45 45 PRO CB C 13 32.2 0.2 . 1 . . . . 45 PRO CB . 17020 1 519 . 1 1 45 45 PRO CD C 13 51.4 0.2 . 1 . . . . 45 PRO CD . 17020 1 520 . 1 1 45 45 PRO CG C 13 27.3 0.2 . 1 . . . . 45 PRO CG . 17020 1 521 . 1 1 46 46 ARG H H 1 8.53 0.02 . 1 . . . . 46 ARG H . 17020 1 522 . 1 1 46 46 ARG HA H 1 4.14 0.02 . 1 . . . . 46 ARG HA . 17020 1 523 . 1 1 46 46 ARG HB2 H 1 1.76 0.02 . 2 . . . . 46 ARG HB2 . 17020 1 524 . 1 1 46 46 ARG HB3 H 1 1.76 0.02 . 2 . . . . 46 ARG HB3 . 17020 1 525 . 1 1 46 46 ARG HD2 H 1 3.26 0.02 . 2 . . . . 46 ARG HD2 . 17020 1 526 . 1 1 46 46 ARG HD3 H 1 3.16 0.02 . 2 . . . . 46 ARG HD3 . 17020 1 527 . 1 1 46 46 ARG HE H 1 7.58 0.02 . 1 . . . . 46 ARG HE . 17020 1 528 . 1 1 46 46 ARG HG2 H 1 1.69 0.02 . 2 . . . . 46 ARG HG2 . 17020 1 529 . 1 1 46 46 ARG HG3 H 1 1.69 0.02 . 2 . . . . 46 ARG HG3 . 17020 1 530 . 1 1 46 46 ARG C C 13 178.9 0.2 . 1 . . . . 46 ARG C . 17020 1 531 . 1 1 46 46 ARG CA C 13 58.7 0.2 . 1 . . . . 46 ARG CA . 17020 1 532 . 1 1 46 46 ARG CB C 13 29.8 0.2 . 1 . . . . 46 ARG CB . 17020 1 533 . 1 1 46 46 ARG CD C 13 43.5 0.2 . 1 . . . . 46 ARG CD . 17020 1 534 . 1 1 46 46 ARG CG C 13 27.3 0.2 . 1 . . . . 46 ARG CG . 17020 1 535 . 1 1 46 46 ARG N N 15 118.4 0.2 . 1 . . . . 46 ARG N . 17020 1 536 . 1 1 46 46 ARG NE N 15 84.7 0.2 . 1 . . . . 46 ARG NE . 17020 1 537 . 1 1 47 47 ASN H H 1 8.01 0.02 . 1 . . . . 47 ASN H . 17020 1 538 . 1 1 47 47 ASN HA H 1 4.57 0.02 . 1 . . . . 47 ASN HA . 17020 1 539 . 1 1 47 47 ASN HB2 H 1 2.55 0.02 . 2 . . . . 47 ASN HB2 . 17020 1 540 . 1 1 47 47 ASN HB3 H 1 2.55 0.02 . 2 . . . . 47 ASN HB3 . 17020 1 541 . 1 1 47 47 ASN HD21 H 1 7.56 0.02 . 2 . . . . 47 ASN HD21 . 17020 1 542 . 1 1 47 47 ASN HD22 H 1 7.01 0.02 . 2 . . . . 47 ASN HD22 . 17020 1 543 . 1 1 47 47 ASN C C 13 175.2 0.2 . 1 . . . . 47 ASN C . 17020 1 544 . 1 1 47 47 ASN CA C 13 54.1 0.2 . 1 . . . . 47 ASN CA . 17020 1 545 . 1 1 47 47 ASN CB C 13 38.5 0.2 . 1 . . . . 47 ASN CB . 17020 1 546 . 1 1 47 47 ASN N N 15 116.2 0.2 . 1 . . . . 47 ASN N . 17020 1 547 . 1 1 47 47 ASN ND2 N 15 113.2 0.2 . 1 . . . . 47 ASN ND2 . 17020 1 548 . 1 1 48 48 TRP H H 1 7.75 0.02 . 1 . . . . 48 TRP H . 17020 1 549 . 1 1 48 48 TRP HA H 1 4.66 0.02 . 1 . . . . 48 TRP HA . 17020 1 550 . 1 1 48 48 TRP HB2 H 1 3.69 0.02 . 2 . . . . 48 TRP HB2 . 17020 1 551 . 1 1 48 48 TRP HB3 H 1 3.02 0.02 . 2 . . . . 48 TRP HB3 . 17020 1 552 . 1 1 48 48 TRP HD1 H 1 7.21 0.02 . 1 . . . . 48 TRP HD1 . 17020 1 553 . 1 1 48 48 TRP HE1 H 1 10.27 0.02 . 1 . . . . 48 TRP HE1 . 17020 1 554 . 1 1 48 48 TRP HE3 H 1 7.62 0.02 . 1 . . . . 48 TRP HE3 . 17020 1 555 . 1 1 48 48 TRP HH2 H 1 7.22 0.02 . 1 . . . . 48 TRP HH2 . 17020 1 556 . 1 1 48 48 TRP HZ2 H 1 7.5 0.02 . 1 . . . . 48 TRP HZ2 . 17020 1 557 . 1 1 48 48 TRP HZ3 H 1 7.09 0.02 . 1 . . . . 48 TRP HZ3 . 17020 1 558 . 1 1 48 48 TRP C C 13 176.0 0.2 . 1 . . . . 48 TRP C . 17020 1 559 . 1 1 48 48 TRP CA C 13 57.2 0.2 . 1 . . . . 48 TRP CA . 17020 1 560 . 1 1 48 48 TRP CB C 13 30.2 0.2 . 1 . . . . 48 TRP CB . 17020 1 561 . 1 1 48 48 TRP CD1 C 13 127.3 0.2 . 1 . . . . 48 TRP CD1 . 17020 1 562 . 1 1 48 48 TRP CE3 C 13 120.5 0.2 . 1 . . . . 48 TRP CE3 . 17020 1 563 . 1 1 48 48 TRP CH2 C 13 124.5 0.2 . 1 . . . . 48 TRP CH2 . 17020 1 564 . 1 1 48 48 TRP CZ2 C 13 114.9 0.2 . 1 . . . . 48 TRP CZ2 . 17020 1 565 . 1 1 48 48 TRP CZ3 C 13 122.1 0.2 . 1 . . . . 48 TRP CZ3 . 17020 1 566 . 1 1 48 48 TRP N N 15 119.4 0.2 . 1 . . . . 48 TRP N . 17020 1 567 . 1 1 48 48 TRP NE1 N 15 129.3 0.2 . 1 . . . . 48 TRP NE1 . 17020 1 568 . 1 1 49 49 GLY H H 1 7.78 0.02 . 1 . . . . 49 GLY H . 17020 1 569 . 1 1 49 49 GLY HA2 H 1 3.95 0.02 . 2 . . . . 49 GLY HA2 . 17020 1 570 . 1 1 49 49 GLY HA3 H 1 3.95 0.02 . 2 . . . . 49 GLY HA3 . 17020 1 571 . 1 1 49 49 GLY C C 13 173.9 0.2 . 1 . . . . 49 GLY C . 17020 1 572 . 1 1 49 49 GLY CA C 13 45.6 0.2 . 1 . . . . 49 GLY CA . 17020 1 573 . 1 1 49 49 GLY N N 15 107.3 0.2 . 1 . . . . 49 GLY N . 17020 1 574 . 1 1 50 50 HIS H H 1 8.33 0.02 . 1 . . . . 50 HIS H . 17020 1 575 . 1 1 50 50 HIS HA H 1 4.62 0.02 . 1 . . . . 50 HIS HA . 17020 1 576 . 1 1 50 50 HIS HB2 H 1 3.28 0.02 . 2 . . . . 50 HIS HB2 . 17020 1 577 . 1 1 50 50 HIS HB3 H 1 3.04 0.02 . 2 . . . . 50 HIS HB3 . 17020 1 578 . 1 1 50 50 HIS C C 13 174.9 0.2 . 1 . . . . 50 HIS C . 17020 1 579 . 1 1 50 50 HIS CA C 13 56.1 0.2 . 1 . . . . 50 HIS CA . 17020 1 580 . 1 1 50 50 HIS CB C 13 29.9 0.2 . 1 . . . . 50 HIS CB . 17020 1 581 . 1 1 50 50 HIS N N 15 116.5 0.2 . 1 . . . . 50 HIS N . 17020 1 582 . 1 1 51 51 GLY H H 1 8.59 0.02 . 1 . . . . 51 GLY H . 17020 1 583 . 1 1 51 51 GLY HA2 H 1 4.06 0.02 . 2 . . . . 51 GLY HA2 . 17020 1 584 . 1 1 51 51 GLY HA3 H 1 3.95 0.02 . 2 . . . . 51 GLY HA3 . 17020 1 585 . 1 1 51 51 GLY C C 13 174.9 0.2 . 1 . . . . 51 GLY C . 17020 1 586 . 1 1 51 51 GLY CA C 13 46.1 0.2 . 1 . . . . 51 GLY CA . 17020 1 587 . 1 1 51 51 GLY N N 15 107.7 0.2 . 1 . . . . 51 GLY N . 17020 1 588 . 1 1 52 52 ARG H H 1 7.82 0.02 . 1 . . . . 52 ARG H . 17020 1 589 . 1 1 52 52 ARG HA H 1 4.75 0.02 . 1 . . . . 52 ARG HA . 17020 1 590 . 1 1 52 52 ARG HB2 H 1 2.00 0.02 . 2 . . . . 52 ARG HB2 . 17020 1 591 . 1 1 52 52 ARG HB3 H 1 1.82 0.02 . 2 . . . . 52 ARG HB3 . 17020 1 592 . 1 1 52 52 ARG HD2 H 1 3.13 0.02 . 2 . . . . 52 ARG HD2 . 17020 1 593 . 1 1 52 52 ARG HD3 H 1 3.07 0.02 . 2 . . . . 52 ARG HD3 . 17020 1 594 . 1 1 52 52 ARG HE H 1 7.03 0.02 . 1 . . . . 52 ARG HE . 17020 1 595 . 1 1 52 52 ARG HG2 H 1 1.69 0.02 . 2 . . . . 52 ARG HG2 . 17020 1 596 . 1 1 52 52 ARG HG3 H 1 1.69 0.02 . 2 . . . . 52 ARG HG3 . 17020 1 597 . 1 1 52 52 ARG C C 13 177.9 0.2 . 1 . . . . 52 ARG C . 17020 1 598 . 1 1 52 52 ARG CA C 13 55.8 0.2 . 1 . . . . 52 ARG CA . 17020 1 599 . 1 1 52 52 ARG CB C 13 32.0 0.2 . 1 . . . . 52 ARG CB . 17020 1 600 . 1 1 52 52 ARG CD C 13 43.4 0.2 . 1 . . . . 52 ARG CD . 17020 1 601 . 1 1 52 52 ARG CG C 13 27.4 0.2 . 1 . . . . 52 ARG CG . 17020 1 602 . 1 1 52 52 ARG N N 15 117.8 0.2 . 1 . . . . 52 ARG N . 17020 1 603 . 1 1 52 52 ARG NE N 15 84.6 0.2 . 1 . . . . 52 ARG NE . 17020 1 604 . 1 1 53 53 LEU H H 1 8.91 0.02 . 1 . . . . 53 LEU H . 17020 1 605 . 1 1 53 53 LEU HA H 1 4.21 0.02 . 1 . . . . 53 LEU HA . 17020 1 606 . 1 1 53 53 LEU HB2 H 1 2.05 0.02 . 2 . . . . 53 LEU HB2 . 17020 1 607 . 1 1 53 53 LEU HB3 H 1 1.83 0.02 . 2 . . . . 53 LEU HB3 . 17020 1 608 . 1 1 53 53 LEU HD11 H 1 1.07 0.02 . 1 . . . . 53 LEU HD1 . 17020 1 609 . 1 1 53 53 LEU HD12 H 1 1.07 0.02 . 1 . . . . 53 LEU HD1 . 17020 1 610 . 1 1 53 53 LEU HD13 H 1 1.07 0.02 . 1 . . . . 53 LEU HD1 . 17020 1 611 . 1 1 53 53 LEU HD21 H 1 0.95 0.02 . 1 . . . . 53 LEU HD2 . 17020 1 612 . 1 1 53 53 LEU HD22 H 1 0.95 0.02 . 1 . . . . 53 LEU HD2 . 17020 1 613 . 1 1 53 53 LEU HD23 H 1 0.95 0.02 . 1 . . . . 53 LEU HD2 . 17020 1 614 . 1 1 53 53 LEU HG H 1 1.47 0.02 . 1 . . . . 53 LEU HG . 17020 1 615 . 1 1 53 53 LEU C C 13 177.9 0.2 . 1 . . . . 53 LEU C . 17020 1 616 . 1 1 53 53 LEU CA C 13 58.8 0.2 . 1 . . . . 53 LEU CA . 17020 1 617 . 1 1 53 53 LEU CB C 13 41.7 0.2 . 1 . . . . 53 LEU CB . 17020 1 618 . 1 1 53 53 LEU CD1 C 13 23.9 0.2 . 1 . . . . 53 LEU CD1 . 17020 1 619 . 1 1 53 53 LEU CD2 C 13 25.8 0.2 . 1 . . . . 53 LEU CD2 . 17020 1 620 . 1 1 53 53 LEU CG C 13 27.5 0.2 . 1 . . . . 53 LEU CG . 17020 1 621 . 1 1 53 53 LEU N N 15 123.8 0.2 . 1 . . . . 53 LEU N . 17020 1 622 . 1 1 54 54 SER H H 1 8.50 0.02 . 1 . . . . 54 SER H . 17020 1 623 . 1 1 54 54 SER HA H 1 4.24 0.02 . 1 . . . . 54 SER HA . 17020 1 624 . 1 1 54 54 SER HB2 H 1 3.88 0.02 . 2 . . . . 54 SER HB2 . 17020 1 625 . 1 1 54 54 SER HB3 H 1 3.84 0.02 . 2 . . . . 54 SER HB3 . 17020 1 626 . 1 1 54 54 SER C C 13 175.3 0.2 . 1 . . . . 54 SER C . 17020 1 627 . 1 1 54 54 SER CA C 13 61.3 0.2 . 1 . . . . 54 SER CA . 17020 1 628 . 1 1 54 54 SER CB C 13 62.1 0.2 . 1 . . . . 54 SER CB . 17020 1 629 . 1 1 54 54 SER N N 15 112.3 0.2 . 1 . . . . 54 SER N . 17020 1 630 . 1 1 55 55 GLN H H 1 7.18 0.02 . 1 . . . . 55 GLN H . 17020 1 631 . 1 1 55 55 GLN HA H 1 4.13 0.02 . 1 . . . . 55 GLN HA . 17020 1 632 . 1 1 55 55 GLN HB2 H 1 2.18 0.02 . 2 . . . . 55 GLN HB2 . 17020 1 633 . 1 1 55 55 GLN HB3 H 1 2.18 0.02 . 2 . . . . 55 GLN HB3 . 17020 1 634 . 1 1 55 55 GLN HE21 H 1 7.53 0.02 . 2 . . . . 55 GLN HE21 . 17020 1 635 . 1 1 55 55 GLN HE22 H 1 6.96 0.02 . 2 . . . . 55 GLN HE22 . 17020 1 636 . 1 1 55 55 GLN HG2 H 1 2.43 0.02 . 2 . . . . 55 GLN HG2 . 17020 1 637 . 1 1 55 55 GLN HG3 H 1 2.43 0.02 . 2 . . . . 55 GLN HG3 . 17020 1 638 . 1 1 55 55 GLN C C 13 178.2 0.2 . 1 . . . . 55 GLN C . 17020 1 639 . 1 1 55 55 GLN CA C 13 57.8 0.2 . 1 . . . . 55 GLN CA . 17020 1 640 . 1 1 55 55 GLN CB C 13 29.3 0.2 . 1 . . . . 55 GLN CB . 17020 1 641 . 1 1 55 55 GLN CG C 13 34.2 0.2 . 1 . . . . 55 GLN CG . 17020 1 642 . 1 1 55 55 GLN N N 15 117.9 0.2 . 1 . . . . 55 GLN N . 17020 1 643 . 1 1 55 55 GLN NE2 N 15 112.3 0.2 . 1 . . . . 55 GLN NE2 . 17020 1 644 . 1 1 56 56 MET H H 1 7.96 0.02 . 1 . . . . 56 MET H . 17020 1 645 . 1 1 56 56 MET HA H 1 3.65 0.02 . 1 . . . . 56 MET HA . 17020 1 646 . 1 1 56 56 MET HB2 H 1 2.15 0.02 . 2 . . . . 56 MET HB2 . 17020 1 647 . 1 1 56 56 MET HB3 H 1 2.15 0.02 . 2 . . . . 56 MET HB3 . 17020 1 648 . 1 1 56 56 MET HE1 H 1 1.94 0.02 . 1 . . . . 56 MET HE . 17020 1 649 . 1 1 56 56 MET HE2 H 1 1.94 0.02 . 1 . . . . 56 MET HE . 17020 1 650 . 1 1 56 56 MET HE3 H 1 1.94 0.02 . 1 . . . . 56 MET HE . 17020 1 651 . 1 1 56 56 MET HG2 H 1 2.48 0.02 . 2 . . . . 56 MET HG2 . 17020 1 652 . 1 1 56 56 MET HG3 H 1 2.17 0.02 . 2 . . . . 56 MET HG3 . 17020 1 653 . 1 1 56 56 MET C C 13 179.2 0.2 . 1 . . . . 56 MET C . 17020 1 654 . 1 1 56 56 MET CA C 13 59.1 0.2 . 1 . . . . 56 MET CA . 17020 1 655 . 1 1 56 56 MET CB C 13 33.0 0.2 . 1 . . . . 56 MET CB . 17020 1 656 . 1 1 56 56 MET CE C 13 16.8 0.2 . 1 . . . . 56 MET CE . 17020 1 657 . 1 1 56 56 MET CG C 13 32.1 0.2 . 1 . . . . 56 MET CG . 17020 1 658 . 1 1 56 56 MET N N 15 119.1 0.2 . 1 . . . . 56 MET N . 17020 1 659 . 1 1 57 57 VAL H H 1 8.00 0.02 . 1 . . . . 57 VAL H . 17020 1 660 . 1 1 57 57 VAL HA H 1 3.53 0.02 . 1 . . . . 57 VAL HA . 17020 1 661 . 1 1 57 57 VAL HB H 1 1.97 0.02 . 1 . . . . 57 VAL HB . 17020 1 662 . 1 1 57 57 VAL HG11 H 1 0.84 0.02 . 1 . . . . 57 VAL HG1 . 17020 1 663 . 1 1 57 57 VAL HG12 H 1 0.84 0.02 . 1 . . . . 57 VAL HG1 . 17020 1 664 . 1 1 57 57 VAL HG13 H 1 0.84 0.02 . 1 . . . . 57 VAL HG1 . 17020 1 665 . 1 1 57 57 VAL HG21 H 1 0.98 0.02 . 1 . . . . 57 VAL HG2 . 17020 1 666 . 1 1 57 57 VAL HG22 H 1 0.98 0.02 . 1 . . . . 57 VAL HG2 . 17020 1 667 . 1 1 57 57 VAL HG23 H 1 0.98 0.02 . 1 . . . . 57 VAL HG2 . 17020 1 668 . 1 1 57 57 VAL C C 13 176.8 0.2 . 1 . . . . 57 VAL C . 17020 1 669 . 1 1 57 57 VAL CA C 13 65.2 0.2 . 1 . . . . 57 VAL CA . 17020 1 670 . 1 1 57 57 VAL CB C 13 31.0 0.2 . 1 . . . . 57 VAL CB . 17020 1 671 . 1 1 57 57 VAL CG1 C 13 22.3 0.2 . 1 . . . . 57 VAL CG1 . 17020 1 672 . 1 1 57 57 VAL CG2 C 13 19 0.2 . 1 . . . . 57 VAL CG2 . 17020 1 673 . 1 1 57 57 VAL N N 15 108.9 0.2 . 1 . . . . 57 VAL N . 17020 1 674 . 1 1 58 58 LYS H H 1 6.86 0.02 . 1 . . . . 58 LYS H . 17020 1 675 . 1 1 58 58 LYS HA H 1 3.9 0.02 . 1 . . . . 58 LYS HA . 17020 1 676 . 1 1 58 58 LYS HB2 H 1 1.96 0.02 . 2 . . . . 58 LYS HB2 . 17020 1 677 . 1 1 58 58 LYS HB3 H 1 1.73 0.02 . 2 . . . . 58 LYS HB3 . 17020 1 678 . 1 1 58 58 LYS HD2 H 1 1.58 0.02 . 2 . . . . 58 LYS HD2 . 17020 1 679 . 1 1 58 58 LYS HD3 H 1 1.58 0.02 . 2 . . . . 58 LYS HD3 . 17020 1 680 . 1 1 58 58 LYS HE2 H 1 2.91 0.02 . 2 . . . . 58 LYS HE2 . 17020 1 681 . 1 1 58 58 LYS HE3 H 1 2.91 0.02 . 2 . . . . 58 LYS HE3 . 17020 1 682 . 1 1 58 58 LYS HG2 H 1 1.38 0.02 . 2 . . . . 58 LYS HG2 . 17020 1 683 . 1 1 58 58 LYS HG3 H 1 1.38 0.02 . 2 . . . . 58 LYS HG3 . 17020 1 684 . 1 1 58 58 LYS C C 13 176.4 0.2 . 1 . . . . 58 LYS C . 17020 1 685 . 1 1 58 58 LYS CA C 13 58.6 0.2 . 1 . . . . 58 LYS CA . 17020 1 686 . 1 1 58 58 LYS CB C 13 32.6 0.2 . 1 . . . . 58 LYS CB . 17020 1 687 . 1 1 58 58 LYS CD C 13 29 0.2 . 1 . . . . 58 LYS CD . 17020 1 688 . 1 1 58 58 LYS CE C 13 42.1 0.2 . 1 . . . . 58 LYS CE . 17020 1 689 . 1 1 58 58 LYS CG C 13 24.8 0.2 . 1 . . . . 58 LYS CG . 17020 1 690 . 1 1 58 58 LYS N N 15 116.9 0.2 . 1 . . . . 58 LYS N . 17020 1 691 . 1 1 59 59 LYS H H 1 7.34 0.02 . 1 . . . . 59 LYS H . 17020 1 692 . 1 1 59 59 LYS HA H 1 4.43 0.02 . 1 . . . . 59 LYS HA . 17020 1 693 . 1 1 59 59 LYS HB2 H 1 2.08 0.02 . 2 . . . . 59 LYS HB2 . 17020 1 694 . 1 1 59 59 LYS HB3 H 1 1.71 0.02 . 2 . . . . 59 LYS HB3 . 17020 1 695 . 1 1 59 59 LYS HD2 H 1 1.68 0.02 . 2 . . . . 59 LYS HD2 . 17020 1 696 . 1 1 59 59 LYS HD3 H 1 1.68 0.02 . 2 . . . . 59 LYS HD3 . 17020 1 697 . 1 1 59 59 LYS HE2 H 1 3.01 0.02 . 2 . . . . 59 LYS HE2 . 17020 1 698 . 1 1 59 59 LYS HE3 H 1 3.01 0.02 . 2 . . . . 59 LYS HE3 . 17020 1 699 . 1 1 59 59 LYS HG2 H 1 1.46 0.02 . 2 . . . . 59 LYS HG2 . 17020 1 700 . 1 1 59 59 LYS HG3 H 1 1.46 0.02 . 2 . . . . 59 LYS HG3 . 17020 1 701 . 1 1 59 59 LYS C C 13 175.9 0.2 . 1 . . . . 59 LYS C . 17020 1 702 . 1 1 59 59 LYS CA C 13 54.9 0.2 . 1 . . . . 59 LYS CA . 17020 1 703 . 1 1 59 59 LYS CB C 13 32.6 0.2 . 1 . . . . 59 LYS CB . 17020 1 704 . 1 1 59 59 LYS CD C 13 29 0.2 . 1 . . . . 59 LYS CD . 17020 1 705 . 1 1 59 59 LYS CE C 13 42.1 0.2 . 1 . . . . 59 LYS CE . 17020 1 706 . 1 1 59 59 LYS CG C 13 24.9 0.2 . 1 . . . . 59 LYS CG . 17020 1 707 . 1 1 59 59 LYS N N 15 115.6 0.2 . 1 . . . . 59 LYS N . 17020 1 708 . 1 1 60 60 LEU H H 1 6.68 0.02 . 1 . . . . 60 LEU H . 17020 1 709 . 1 1 60 60 LEU HA H 1 4.37 0.02 . 1 . . . . 60 LEU HA . 17020 1 710 . 1 1 60 60 LEU HB2 H 1 1.13 0.02 . 2 . . . . 60 LEU HB2 . 17020 1 711 . 1 1 60 60 LEU HB3 H 1 -0.08 0.02 . 2 . . . . 60 LEU HB3 . 17020 1 712 . 1 1 60 60 LEU HD11 H 1 0.17 0.02 . 1 . . . . 60 LEU HD1 . 17020 1 713 . 1 1 60 60 LEU HD12 H 1 0.17 0.02 . 1 . . . . 60 LEU HD1 . 17020 1 714 . 1 1 60 60 LEU HD13 H 1 0.17 0.02 . 1 . . . . 60 LEU HD1 . 17020 1 715 . 1 1 60 60 LEU HD21 H 1 0.58 0.02 . 1 . . . . 60 LEU HD2 . 17020 1 716 . 1 1 60 60 LEU HD22 H 1 0.58 0.02 . 1 . . . . 60 LEU HD2 . 17020 1 717 . 1 1 60 60 LEU HD23 H 1 0.58 0.02 . 1 . . . . 60 LEU HD2 . 17020 1 718 . 1 1 60 60 LEU HG H 1 1.55 0.02 . 1 . . . . 60 LEU HG . 17020 1 719 . 1 1 60 60 LEU C C 13 176.7 0.2 . 1 . . . . 60 LEU C . 17020 1 720 . 1 1 60 60 LEU CA C 13 53.3 0.2 . 1 . . . . 60 LEU CA . 17020 1 721 . 1 1 60 60 LEU CB C 13 40.0 0.2 . 1 . . . . 60 LEU CB . 17020 1 722 . 1 1 60 60 LEU CD1 C 13 26 0.2 . 1 . . . . 60 LEU CD1 . 17020 1 723 . 1 1 60 60 LEU CD2 C 13 22.3 0.2 . 1 . . . . 60 LEU CD2 . 17020 1 724 . 1 1 60 60 LEU CG C 13 25 0.2 . 1 . . . . 60 LEU CG . 17020 1 725 . 1 1 60 60 LEU N N 15 120.0 0.2 . 1 . . . . 60 LEU N . 17020 1 726 . 1 1 61 61 ASP H H 1 8.68 0.02 . 1 . . . . 61 ASP H . 17020 1 727 . 1 1 61 61 ASP HA H 1 4.3 0.02 . 1 . . . . 61 ASP HA . 17020 1 728 . 1 1 61 61 ASP HB2 H 1 2.87 0.02 . 2 . . . . 61 ASP HB2 . 17020 1 729 . 1 1 61 61 ASP HB3 H 1 2.72 0.02 . 2 . . . . 61 ASP HB3 . 17020 1 730 . 1 1 61 61 ASP C C 13 175.5 0.2 . 1 . . . . 61 ASP C . 17020 1 731 . 1 1 61 61 ASP CA C 13 56.2 0.2 . 1 . . . . 61 ASP CA . 17020 1 732 . 1 1 61 61 ASP CB C 13 40.4 0.2 . 1 . . . . 61 ASP CB . 17020 1 733 . 1 1 61 61 ASP N N 15 123.4 0.2 . 1 . . . . 61 ASP N . 17020 1 734 . 1 1 62 62 PHE H H 1 6.36 0.02 . 1 . . . . 62 PHE H . 17020 1 735 . 1 1 62 62 PHE HA H 1 4.77 0.02 . 1 . . . . 62 PHE HA . 17020 1 736 . 1 1 62 62 PHE HB2 H 1 3.5 0.02 . 2 . . . . 62 PHE HB2 . 17020 1 737 . 1 1 62 62 PHE HB3 H 1 2.89 0.02 . 2 . . . . 62 PHE HB3 . 17020 1 738 . 1 1 62 62 PHE HD1 H 1 7.17 0.02 . 3 . . . . 62 PHE HD1 . 17020 1 739 . 1 1 62 62 PHE HD2 H 1 7.17 0.02 . 3 . . . . 62 PHE HD2 . 17020 1 740 . 1 1 62 62 PHE HE1 H 1 7.05 0.02 . 3 . . . . 62 PHE HE1 . 17020 1 741 . 1 1 62 62 PHE HE2 H 1 7.05 0.02 . 3 . . . . 62 PHE HE2 . 17020 1 742 . 1 1 62 62 PHE HZ H 1 6.86 0.02 . 1 . . . . 62 PHE HZ . 17020 1 743 . 1 1 62 62 PHE C C 13 174.6 0.2 . 1 . . . . 62 PHE C . 17020 1 744 . 1 1 62 62 PHE CA C 13 55.3 0.2 . 1 . . . . 62 PHE CA . 17020 1 745 . 1 1 62 62 PHE CB C 13 37.7 0.2 . 1 . . . . 62 PHE CB . 17020 1 746 . 1 1 62 62 PHE CD1 C 13 132.7 0.2 . 3 . . . . 62 PHE CD1 . 17020 1 747 . 1 1 62 62 PHE CD2 C 13 132.7 0.2 . 3 . . . . 62 PHE CD2 . 17020 1 748 . 1 1 62 62 PHE CE1 C 13 131.7 0.2 . 3 . . . . 62 PHE CE1 . 17020 1 749 . 1 1 62 62 PHE CE2 C 13 131.7 0.2 . 3 . . . . 62 PHE CE2 . 17020 1 750 . 1 1 62 62 PHE CZ C 13 129.3 0.2 . 1 . . . . 62 PHE CZ . 17020 1 751 . 1 1 62 62 PHE N N 15 110.0 0.2 . 1 . . . . 62 PHE N . 17020 1 752 . 1 1 63 63 LEU H H 1 7.37 0.02 . 1 . . . . 63 LEU H . 17020 1 753 . 1 1 63 63 LEU HA H 1 5.12 0.02 . 1 . . . . 63 LEU HA . 17020 1 754 . 1 1 63 63 LEU HB2 H 1 1.58 0.02 . 2 . . . . 63 LEU HB2 . 17020 1 755 . 1 1 63 63 LEU HB3 H 1 1.02 0.02 . 2 . . . . 63 LEU HB3 . 17020 1 756 . 1 1 63 63 LEU HD11 H 1 0.28 0.02 . 1 . . . . 63 LEU HD1 . 17020 1 757 . 1 1 63 63 LEU HD12 H 1 0.28 0.02 . 1 . . . . 63 LEU HD1 . 17020 1 758 . 1 1 63 63 LEU HD13 H 1 0.28 0.02 . 1 . . . . 63 LEU HD1 . 17020 1 759 . 1 1 63 63 LEU HD21 H 1 0.65 0.02 . 1 . . . . 63 LEU HD2 . 17020 1 760 . 1 1 63 63 LEU HD22 H 1 0.65 0.02 . 1 . . . . 63 LEU HD2 . 17020 1 761 . 1 1 63 63 LEU HD23 H 1 0.65 0.02 . 1 . . . . 63 LEU HD2 . 17020 1 762 . 1 1 63 63 LEU HG H 1 0.61 0.02 . 1 . . . . 63 LEU HG . 17020 1 763 . 1 1 63 63 LEU C C 13 175.8 0.2 . 1 . . . . 63 LEU C . 17020 1 764 . 1 1 63 63 LEU CA C 13 53.3 0.2 . 1 . . . . 63 LEU CA . 17020 1 765 . 1 1 63 63 LEU CB C 13 45.1 0.2 . 1 . . . . 63 LEU CB . 17020 1 766 . 1 1 63 63 LEU CD1 C 13 26.9 0.2 . 1 . . . . 63 LEU CD1 . 17020 1 767 . 1 1 63 63 LEU CD2 C 13 24.8 0.2 . 1 . . . . 63 LEU CD2 . 17020 1 768 . 1 1 63 63 LEU CG C 13 25.7 0.2 . 1 . . . . 63 LEU CG . 17020 1 769 . 1 1 63 63 LEU N N 15 122.8 0.2 . 1 . . . . 63 LEU N . 17020 1 770 . 1 1 64 64 THR H H 1 8.67 0.02 . 1 . . . . 64 THR H . 17020 1 771 . 1 1 64 64 THR HA H 1 4.56 0.02 . 1 . . . . 64 THR HA . 17020 1 772 . 1 1 64 64 THR HB H 1 3.56 0.02 . 1 . . . . 64 THR HB . 17020 1 773 . 1 1 64 64 THR HG1 H 1 6.89 0.02 . 1 . . . . 64 THR HG1 . 17020 1 774 . 1 1 64 64 THR HG21 H 1 1.26 0.02 . 1 . . . . 64 THR HG2 . 17020 1 775 . 1 1 64 64 THR HG22 H 1 1.26 0.02 . 1 . . . . 64 THR HG2 . 17020 1 776 . 1 1 64 64 THR HG23 H 1 1.26 0.02 . 1 . . . . 64 THR HG2 . 17020 1 777 . 1 1 64 64 THR C C 13 172.7 0.2 . 1 . . . . 64 THR C . 17020 1 778 . 1 1 64 64 THR CA C 13 62.1 0.2 . 1 . . . . 64 THR CA . 17020 1 779 . 1 1 64 64 THR CB C 13 70.9 0.2 . 1 . . . . 64 THR CB . 17020 1 780 . 1 1 64 64 THR CG2 C 13 22.6 0.2 . 1 . . . . 64 THR CG2 . 17020 1 781 . 1 1 64 64 THR N N 15 117.9 0.2 . 1 . . . . 64 THR N . 17020 1 782 . 1 1 65 65 VAL H H 1 8.61 0.02 . 1 . . . . 65 VAL H . 17020 1 783 . 1 1 65 65 VAL HA H 1 5.09 0.02 . 1 . . . . 65 VAL HA . 17020 1 784 . 1 1 65 65 VAL HB H 1 1.95 0.02 . 1 . . . . 65 VAL HB . 17020 1 785 . 1 1 65 65 VAL HG11 H 1 0.88 0.02 . 1 . . . . 65 VAL HG1 . 17020 1 786 . 1 1 65 65 VAL HG12 H 1 0.88 0.02 . 1 . . . . 65 VAL HG1 . 17020 1 787 . 1 1 65 65 VAL HG13 H 1 0.88 0.02 . 1 . . . . 65 VAL HG1 . 17020 1 788 . 1 1 65 65 VAL HG21 H 1 0.75 0.02 . 1 . . . . 65 VAL HG2 . 17020 1 789 . 1 1 65 65 VAL HG22 H 1 0.75 0.02 . 1 . . . . 65 VAL HG2 . 17020 1 790 . 1 1 65 65 VAL HG23 H 1 0.75 0.02 . 1 . . . . 65 VAL HG2 . 17020 1 791 . 1 1 65 65 VAL C C 13 175.4 0.2 . 1 . . . . 65 VAL C . 17020 1 792 . 1 1 65 65 VAL CA C 13 60.8 0.2 . 1 . . . . 65 VAL CA . 17020 1 793 . 1 1 65 65 VAL CB C 13 34.6 0.2 . 1 . . . . 65 VAL CB . 17020 1 794 . 1 1 65 65 VAL CG1 C 13 21 0.2 . 1 . . . . 65 VAL CG1 . 17020 1 795 . 1 1 65 65 VAL CG2 C 13 21.7 0.2 . 1 . . . . 65 VAL CG2 . 17020 1 796 . 1 1 65 65 VAL N N 15 125.6 0.2 . 1 . . . . 65 VAL N . 17020 1 797 . 1 1 66 66 GLN H H 1 9.20 0.02 . 1 . . . . 66 GLN H . 17020 1 798 . 1 1 66 66 GLN HA H 1 4.7 0.02 . 1 . . . . 66 GLN HA . 17020 1 799 . 1 1 66 66 GLN HB2 H 1 1.55 0.02 . 2 . . . . 66 GLN HB2 . 17020 1 800 . 1 1 66 66 GLN HB3 H 1 1.45 0.02 . 2 . . . . 66 GLN HB3 . 17020 1 801 . 1 1 66 66 GLN HE21 H 1 6.48 0.02 . 2 . . . . 66 GLN HE21 . 17020 1 802 . 1 1 66 66 GLN HE22 H 1 5.98 0.02 . 2 . . . . 66 GLN HE22 . 17020 1 803 . 1 1 66 66 GLN HG2 H 1 1.78 0.02 . 2 . . . . 66 GLN HG2 . 17020 1 804 . 1 1 66 66 GLN HG3 H 1 1.61 0.02 . 2 . . . . 66 GLN HG3 . 17020 1 805 . 1 1 66 66 GLN C C 13 173.8 0.2 . 1 . . . . 66 GLN C . 17020 1 806 . 1 1 66 66 GLN CA C 13 54.7 0.2 . 1 . . . . 66 GLN CA . 17020 1 807 . 1 1 66 66 GLN CB C 13 31.9 0.2 . 1 . . . . 66 GLN CB . 17020 1 808 . 1 1 66 66 GLN CG C 13 32.9 0.2 . 1 . . . . 66 GLN CG . 17020 1 809 . 1 1 66 66 GLN N N 15 126.8 0.2 . 1 . . . . 66 GLN N . 17020 1 810 . 1 1 66 66 GLN NE2 N 15 109.8 0.2 . 1 . . . . 66 GLN NE2 . 17020 1 811 . 1 1 67 67 GLU H H 1 8.72 0.02 . 1 . . . . 67 GLU H . 17020 1 812 . 1 1 67 67 GLU HA H 1 5.07 0.02 . 1 . . . . 67 GLU HA . 17020 1 813 . 1 1 67 67 GLU HB2 H 1 1.91 0.02 . 2 . . . . 67 GLU HB2 . 17020 1 814 . 1 1 67 67 GLU HB3 H 1 1.85 0.02 . 2 . . . . 67 GLU HB3 . 17020 1 815 . 1 1 67 67 GLU HG2 H 1 2.15 0.02 . 2 . . . . 67 GLU HG2 . 17020 1 816 . 1 1 67 67 GLU HG3 H 1 2.1 0.02 . 2 . . . . 67 GLU HG3 . 17020 1 817 . 1 1 67 67 GLU C C 13 175.5 0.2 . 1 . . . . 67 GLU C . 17020 1 818 . 1 1 67 67 GLU CA C 13 55.0 0.2 . 1 . . . . 67 GLU CA . 17020 1 819 . 1 1 67 67 GLU CB C 13 32.1 0.2 . 1 . . . . 67 GLU CB . 17020 1 820 . 1 1 67 67 GLU CG C 13 36.4 0.2 . 1 . . . . 67 GLU CG . 17020 1 821 . 1 1 67 67 GLU N N 15 125.2 0.2 . 1 . . . . 67 GLU N . 17020 1 822 . 1 1 68 68 SER H H 1 8.67 0.02 . 1 . . . . 68 SER H . 17020 1 823 . 1 1 68 68 SER HA H 1 4.56 0.02 . 1 . . . . 68 SER HA . 17020 1 824 . 1 1 68 68 SER HB2 H 1 3.59 0.02 . 2 . . . . 68 SER HB2 . 17020 1 825 . 1 1 68 68 SER HB3 H 1 3.59 0.02 . 2 . . . . 68 SER HB3 . 17020 1 826 . 1 1 68 68 SER HG H 1 6.36 0.02 . 1 . . . . 68 SER HG . 17020 1 827 . 1 1 68 68 SER C C 13 173.0 0.2 . 1 . . . . 68 SER C . 17020 1 828 . 1 1 68 68 SER CA C 13 57.2 0.2 . 1 . . . . 68 SER CA . 17020 1 829 . 1 1 68 68 SER CB C 13 65.1 0.2 . 1 . . . . 68 SER CB . 17020 1 830 . 1 1 68 68 SER N N 15 117.8 0.2 . 1 . . . . 68 SER N . 17020 1 831 . 1 1 69 69 ARG H H 1 8.67 0.02 . 1 . . . . 69 ARG H . 17020 1 832 . 1 1 69 69 ARG HA H 1 4.81 0.02 . 1 . . . . 69 ARG HA . 17020 1 833 . 1 1 69 69 ARG HB2 H 1 1.81 0.02 . 2 . . . . 69 ARG HB2 . 17020 1 834 . 1 1 69 69 ARG HB3 H 1 1.64 0.02 . 2 . . . . 69 ARG HB3 . 17020 1 835 . 1 1 69 69 ARG HD2 H 1 2.99 0.02 . 2 . . . . 69 ARG HD2 . 17020 1 836 . 1 1 69 69 ARG HD3 H 1 2.91 0.02 . 2 . . . . 69 ARG HD3 . 17020 1 837 . 1 1 69 69 ARG HE H 1 7.19 0.02 . 1 . . . . 69 ARG HE . 17020 1 838 . 1 1 69 69 ARG HG2 H 1 1.68 0.02 . 2 . . . . 69 ARG HG2 . 17020 1 839 . 1 1 69 69 ARG HG3 H 1 1.36 0.02 . 2 . . . . 69 ARG HG3 . 17020 1 840 . 1 1 69 69 ARG C C 13 175.7 0.2 . 1 . . . . 69 ARG C . 17020 1 841 . 1 1 69 69 ARG CA C 13 55.4 0.2 . 1 . . . . 69 ARG CA . 17020 1 842 . 1 1 69 69 ARG CB C 13 31.8 0.2 . 1 . . . . 69 ARG CB . 17020 1 843 . 1 1 69 69 ARG CD C 13 43.4 0.2 . 1 . . . . 69 ARG CD . 17020 1 844 . 1 1 69 69 ARG CG C 13 26.5 0.2 . 1 . . . . 69 ARG CG . 17020 1 845 . 1 1 69 69 ARG N N 15 122.9 0.2 . 1 . . . . 69 ARG N . 17020 1 846 . 1 1 69 69 ARG NE N 15 84.6 0.2 . 1 . . . . 69 ARG NE . 17020 1 847 . 1 1 70 70 ASN H H 1 8.52 0.02 . 1 . . . . 70 ASN H . 17020 1 848 . 1 1 70 70 ASN HA H 1 4.81 0.02 . 1 . . . . 70 ASN HA . 17020 1 849 . 1 1 70 70 ASN HB2 H 1 2.75 0.02 . 2 . . . . 70 ASN HB2 . 17020 1 850 . 1 1 70 70 ASN HB3 H 1 2.62 0.02 . 2 . . . . 70 ASN HB3 . 17020 1 851 . 1 1 70 70 ASN HD21 H 1 7.51 0.02 . 2 . . . . 70 ASN HD21 . 17020 1 852 . 1 1 70 70 ASN HD22 H 1 6.87 0.02 . 2 . . . . 70 ASN HD22 . 17020 1 853 . 1 1 70 70 ASN C C 13 175.4 0.2 . 1 . . . . 70 ASN C . 17020 1 854 . 1 1 70 70 ASN CA C 13 52.6 0.2 . 1 . . . . 70 ASN CA . 17020 1 855 . 1 1 70 70 ASN CB C 13 39.3 0.2 . 1 . . . . 70 ASN CB . 17020 1 856 . 1 1 70 70 ASN N N 15 122.6 0.2 . 1 . . . . 70 ASN N . 17020 1 857 . 1 1 70 70 ASN ND2 N 15 112.1 0.2 . 1 . . . . 70 ASN ND2 . 17020 1 858 . 1 1 71 71 GLY H H 1 8.90 0.02 . 1 . . . . 71 GLY H . 17020 1 859 . 1 1 71 71 GLY HA2 H 1 4.07 0.02 . 2 . . . . 71 GLY HA2 . 17020 1 860 . 1 1 71 71 GLY HA3 H 1 3.71 0.02 . 2 . . . . 71 GLY HA3 . 17020 1 861 . 1 1 71 71 GLY C C 13 174.7 0.2 . 1 . . . . 71 GLY C . 17020 1 862 . 1 1 71 71 GLY CA C 13 46.7 0.2 . 1 . . . . 71 GLY CA . 17020 1 863 . 1 1 71 71 GLY N N 15 114.4 0.2 . 1 . . . . 71 GLY N . 17020 1 864 . 1 1 72 72 SER H H 1 8.76 0.02 . 1 . . . . 72 SER H . 17020 1 865 . 1 1 72 72 SER HA H 1 4.41 0.02 . 1 . . . . 72 SER HA . 17020 1 866 . 1 1 72 72 SER HB2 H 1 4.01 0.02 . 2 . . . . 72 SER HB2 . 17020 1 867 . 1 1 72 72 SER HB3 H 1 3.9 0.02 . 2 . . . . 72 SER HB3 . 17020 1 868 . 1 1 72 72 SER C C 13 174.1 0.2 . 1 . . . . 72 SER C . 17020 1 869 . 1 1 72 72 SER CA C 13 58.9 0.2 . 1 . . . . 72 SER CA . 17020 1 870 . 1 1 72 72 SER CB C 13 63.8 0.2 . 1 . . . . 72 SER CB . 17020 1 871 . 1 1 72 72 SER N N 15 120.2 0.2 . 1 . . . . 72 SER N . 17020 1 872 . 1 1 73 73 LYS H H 1 7.89 0.02 . 1 . . . . 73 LYS H . 17020 1 873 . 1 1 73 73 LYS HA H 1 4.52 0.02 . 1 . . . . 73 LYS HA . 17020 1 874 . 1 1 73 73 LYS HB2 H 1 1.85 0.02 . 2 . . . . 73 LYS HB2 . 17020 1 875 . 1 1 73 73 LYS HB3 H 1 1.85 0.02 . 2 . . . . 73 LYS HB3 . 17020 1 876 . 1 1 73 73 LYS HD2 H 1 1.68 0.02 . 2 . . . . 73 LYS HD2 . 17020 1 877 . 1 1 73 73 LYS HD3 H 1 1.68 0.02 . 2 . . . . 73 LYS HD3 . 17020 1 878 . 1 1 73 73 LYS HE2 H 1 2.91 0.02 . 2 . . . . 73 LYS HE2 . 17020 1 879 . 1 1 73 73 LYS HE3 H 1 2.91 0.02 . 2 . . . . 73 LYS HE3 . 17020 1 880 . 1 1 73 73 LYS HG2 H 1 1.45 0.02 . 2 . . . . 73 LYS HG2 . 17020 1 881 . 1 1 73 73 LYS HG3 H 1 1.45 0.02 . 2 . . . . 73 LYS HG3 . 17020 1 882 . 1 1 73 73 LYS C C 13 175.3 0.2 . 1 . . . . 73 LYS C . 17020 1 883 . 1 1 73 73 LYS CA C 13 55.6 0.2 . 1 . . . . 73 LYS CA . 17020 1 884 . 1 1 73 73 LYS CB C 13 34.1 0.2 . 1 . . . . 73 LYS CB . 17020 1 885 . 1 1 73 73 LYS CD C 13 29.3 0.2 . 1 . . . . 73 LYS CD . 17020 1 886 . 1 1 73 73 LYS CE C 13 42 0.2 . 1 . . . . 73 LYS CE . 17020 1 887 . 1 1 73 73 LYS CG C 13 24.8 0.2 . 1 . . . . 73 LYS CG . 17020 1 888 . 1 1 73 73 LYS N N 15 121.8 0.2 . 1 . . . . 73 LYS N . 17020 1 889 . 1 1 74 74 LEU H H 1 8.51 0.02 . 1 . . . . 74 LEU H . 17020 1 890 . 1 1 74 74 LEU HA H 1 4.89 0.02 . 1 . . . . 74 LEU HA . 17020 1 891 . 1 1 74 74 LEU HB2 H 1 1.58 0.02 . 2 . . . . 74 LEU HB2 . 17020 1 892 . 1 1 74 74 LEU HB3 H 1 1.48 0.02 . 2 . . . . 74 LEU HB3 . 17020 1 893 . 1 1 74 74 LEU HD11 H 1 0.78 0.02 . 2 . . . . 74 LEU HD1 . 17020 1 894 . 1 1 74 74 LEU HD12 H 1 0.78 0.02 . 2 . . . . 74 LEU HD1 . 17020 1 895 . 1 1 74 74 LEU HD13 H 1 0.78 0.02 . 2 . . . . 74 LEU HD1 . 17020 1 896 . 1 1 74 74 LEU HD21 H 1 0.78 0.02 . 2 . . . . 74 LEU HD2 . 17020 1 897 . 1 1 74 74 LEU HD22 H 1 0.78 0.02 . 2 . . . . 74 LEU HD2 . 17020 1 898 . 1 1 74 74 LEU HD23 H 1 0.78 0.02 . 2 . . . . 74 LEU HD2 . 17020 1 899 . 1 1 74 74 LEU HG H 1 1.64 0.02 . 1 . . . . 74 LEU HG . 17020 1 900 . 1 1 74 74 LEU C C 13 176.4 0.2 . 1 . . . . 74 LEU C . 17020 1 901 . 1 1 74 74 LEU CA C 13 54.8 0.2 . 1 . . . . 74 LEU CA . 17020 1 902 . 1 1 74 74 LEU CB C 13 43.5 0.2 . 1 . . . . 74 LEU CB . 17020 1 903 . 1 1 74 74 LEU CD1 C 13 24.5 0.2 . 2 . . . . 74 LEU CD1 . 17020 1 904 . 1 1 74 74 LEU CD2 C 13 24.5 0.2 . 2 . . . . 74 LEU CD2 . 17020 1 905 . 1 1 74 74 LEU CG C 13 27.3 0.2 . 1 . . . . 74 LEU CG . 17020 1 906 . 1 1 74 74 LEU N N 15 125.5 0.2 . 1 . . . . 74 LEU N . 17020 1 907 . 1 1 75 75 HIS H H 1 8.91 0.02 . 1 . . . . 75 HIS H . 17020 1 908 . 1 1 75 75 HIS HA H 1 5.02 0.02 . 1 . . . . 75 HIS HA . 17020 1 909 . 1 1 75 75 HIS HB2 H 1 3.31 0.02 . 2 . . . . 75 HIS HB2 . 17020 1 910 . 1 1 75 75 HIS HB3 H 1 3.18 0.02 . 2 . . . . 75 HIS HB3 . 17020 1 911 . 1 1 75 75 HIS HD1 H 1 7.24 0.02 . 1 . . . . 75 HIS HD1 . 17020 1 912 . 1 1 75 75 HIS C C 13 173.2 0.2 . 1 . . . . 75 HIS C . 17020 1 913 . 1 1 75 75 HIS CA C 13 54.9 0.2 . 1 . . . . 75 HIS CA . 17020 1 914 . 1 1 75 75 HIS CB C 13 30.8 0.2 . 1 . . . . 75 HIS CB . 17020 1 915 . 1 1 75 75 HIS N N 15 122.7 0.2 . 1 . . . . 75 HIS N . 17020 1 916 . 1 1 76 76 SER H H 1 8.81 0.02 . 1 . . . . 76 SER H . 17020 1 917 . 1 1 76 76 SER HA H 1 5.16 0.02 . 1 . . . . 76 SER HA . 17020 1 918 . 1 1 76 76 SER HB2 H 1 3.72 0.02 . 2 . . . . 76 SER HB2 . 17020 1 919 . 1 1 76 76 SER HB3 H 1 3.66 0.02 . 2 . . . . 76 SER HB3 . 17020 1 920 . 1 1 76 76 SER C C 13 173.1 0.2 . 1 . . . . 76 SER C . 17020 1 921 . 1 1 76 76 SER CA C 13 58.1 0.2 . 1 . . . . 76 SER CA . 17020 1 922 . 1 1 76 76 SER CB C 13 64.6 0.2 . 1 . . . . 76 SER CB . 17020 1 923 . 1 1 76 76 SER N N 15 119.4 0.2 . 1 . . . . 76 SER N . 17020 1 924 . 1 1 77 77 GLU H H 1 8.89 0.02 . 1 . . . . 77 GLU H . 17020 1 925 . 1 1 77 77 GLU HA H 1 5.31 0.02 . 1 . . . . 77 GLU HA . 17020 1 926 . 1 1 77 77 GLU HB2 H 1 2.13 0.02 . 2 . . . . 77 GLU HB2 . 17020 1 927 . 1 1 77 77 GLU HB3 H 1 1.6 0.02 . 2 . . . . 77 GLU HB3 . 17020 1 928 . 1 1 77 77 GLU HG2 H 1 2.08 0.02 . 2 . . . . 77 GLU HG2 . 17020 1 929 . 1 1 77 77 GLU HG3 H 1 2.08 0.02 . 2 . . . . 77 GLU HG3 . 17020 1 930 . 1 1 77 77 GLU C C 13 174.6 0.2 . 1 . . . . 77 GLU C . 17020 1 931 . 1 1 77 77 GLU CA C 13 54.4 0.2 . 1 . . . . 77 GLU CA . 17020 1 932 . 1 1 77 77 GLU CB C 13 34.0 0.2 . 1 . . . . 77 GLU CB . 17020 1 933 . 1 1 77 77 GLU CG C 13 35.3 0.2 . 1 . . . . 77 GLU CG . 17020 1 934 . 1 1 77 77 GLU N N 15 123.7 0.2 . 1 . . . . 77 GLU N . 17020 1 935 . 1 1 78 78 ILE H H 1 9.57 0.02 . 1 . . . . 78 ILE H . 17020 1 936 . 1 1 78 78 ILE HA H 1 6.06 0.02 . 1 . . . . 78 ILE HA . 17020 1 937 . 1 1 78 78 ILE HB H 1 1.89 0.02 . 1 . . . . 78 ILE HB . 17020 1 938 . 1 1 78 78 ILE HD11 H 1 0.94 0.02 . 1 . . . . 78 ILE HD1 . 17020 1 939 . 1 1 78 78 ILE HD12 H 1 0.94 0.02 . 1 . . . . 78 ILE HD1 . 17020 1 940 . 1 1 78 78 ILE HD13 H 1 0.94 0.02 . 1 . . . . 78 ILE HD1 . 17020 1 941 . 1 1 78 78 ILE HG12 H 1 1.52 0.02 . 2 . . . . 78 ILE HG12 . 17020 1 942 . 1 1 78 78 ILE HG13 H 1 1.17 0.02 . 2 . . . . 78 ILE HG13 . 17020 1 943 . 1 1 78 78 ILE HG21 H 1 0.98 0.02 . 1 . . . . 78 ILE HG2 . 17020 1 944 . 1 1 78 78 ILE HG22 H 1 0.98 0.02 . 1 . . . . 78 ILE HG2 . 17020 1 945 . 1 1 78 78 ILE HG23 H 1 0.98 0.02 . 1 . . . . 78 ILE HG2 . 17020 1 946 . 1 1 78 78 ILE C C 13 173.7 0.2 . 1 . . . . 78 ILE C . 17020 1 947 . 1 1 78 78 ILE CA C 13 58.9 0.2 . 1 . . . . 78 ILE CA . 17020 1 948 . 1 1 78 78 ILE CB C 13 43.1 0.2 . 1 . . . . 78 ILE CB . 17020 1 949 . 1 1 78 78 ILE CD1 C 13 14.9 0.2 . 1 . . . . 78 ILE CD1 . 17020 1 950 . 1 1 78 78 ILE CG1 C 13 25.1 0.2 . 1 . . . . 78 ILE CG1 . 17020 1 951 . 1 1 78 78 ILE CG2 C 13 19.2 0.2 . 1 . . . . 78 ILE CG2 . 17020 1 952 . 1 1 78 78 ILE N N 15 113.2 0.2 . 1 . . . . 78 ILE N . 17020 1 953 . 1 1 79 79 ARG H H 1 8.57 0.02 . 1 . . . . 79 ARG H . 17020 1 954 . 1 1 79 79 ARG HA H 1 4.64 0.02 . 1 . . . . 79 ARG HA . 17020 1 955 . 1 1 79 79 ARG HB2 H 1 1.19 0.02 . 2 . . . . 79 ARG HB2 . 17020 1 956 . 1 1 79 79 ARG HB3 H 1 0.86 0.02 . 2 . . . . 79 ARG HB3 . 17020 1 957 . 1 1 79 79 ARG HD2 H 1 1.85 0.02 . 2 . . . . 79 ARG HD2 . 17020 1 958 . 1 1 79 79 ARG HD3 H 1 0.93 0.02 . 2 . . . . 79 ARG HD3 . 17020 1 959 . 1 1 79 79 ARG HE H 1 6.43 0.02 . 1 . . . . 79 ARG HE . 17020 1 960 . 1 1 79 79 ARG HG2 H 1 0.65 0.02 . 2 . . . . 79 ARG HG2 . 17020 1 961 . 1 1 79 79 ARG HG3 H 1 0.65 0.02 . 2 . . . . 79 ARG HG3 . 17020 1 962 . 1 1 79 79 ARG C C 13 174.4 0.2 . 1 . . . . 79 ARG C . 17020 1 963 . 1 1 79 79 ARG CA C 13 54.4 0.2 . 1 . . . . 79 ARG CA . 17020 1 964 . 1 1 79 79 ARG CB C 13 33.0 0.2 . 1 . . . . 79 ARG CB . 17020 1 965 . 1 1 79 79 ARG CD C 13 42.9 0.2 . 1 . . . . 79 ARG CD . 17020 1 966 . 1 1 79 79 ARG CG C 13 25.3 0.2 . 1 . . . . 79 ARG CG . 17020 1 967 . 1 1 79 79 ARG N N 15 117.5 0.2 . 1 . . . . 79 ARG N . 17020 1 968 . 1 1 79 79 ARG NE N 15 85.1 0.2 . 1 . . . . 79 ARG NE . 17020 1 969 . 1 1 80 80 LEU H H 1 8.63 0.02 . 1 . . . . 80 LEU H . 17020 1 970 . 1 1 80 80 LEU HA H 1 4.49 0.02 . 1 . . . . 80 LEU HA . 17020 1 971 . 1 1 80 80 LEU HB2 H 1 1.57 0.02 . 2 . . . . 80 LEU HB2 . 17020 1 972 . 1 1 80 80 LEU HB3 H 1 1.47 0.02 . 2 . . . . 80 LEU HB3 . 17020 1 973 . 1 1 80 80 LEU HD11 H 1 0.65 0.02 . 1 . . . . 80 LEU HD1 . 17020 1 974 . 1 1 80 80 LEU HD12 H 1 0.65 0.02 . 1 . . . . 80 LEU HD1 . 17020 1 975 . 1 1 80 80 LEU HD13 H 1 0.65 0.02 . 1 . . . . 80 LEU HD1 . 17020 1 976 . 1 1 80 80 LEU HD21 H 1 1 0.02 . 1 . . . . 80 LEU HD2 . 17020 1 977 . 1 1 80 80 LEU HD22 H 1 1 0.02 . 1 . . . . 80 LEU HD2 . 17020 1 978 . 1 1 80 80 LEU HD23 H 1 1 0.02 . 1 . . . . 80 LEU HD2 . 17020 1 979 . 1 1 80 80 LEU HG H 1 1.07 0.02 . 1 . . . . 80 LEU HG . 17020 1 980 . 1 1 80 80 LEU C C 13 177.3 0.2 . 1 . . . . 80 LEU C . 17020 1 981 . 1 1 80 80 LEU CA C 13 55.4 0.2 . 1 . . . . 80 LEU CA . 17020 1 982 . 1 1 80 80 LEU CB C 13 41.6 0.2 . 1 . . . . 80 LEU CB . 17020 1 983 . 1 1 80 80 LEU CD1 C 13 24.9 0.2 . 1 . . . . 80 LEU CD1 . 17020 1 984 . 1 1 80 80 LEU CD2 C 13 23.3 0.2 . 1 . . . . 80 LEU CD2 . 17020 1 985 . 1 1 80 80 LEU CG C 13 25.9 0.2 . 1 . . . . 80 LEU CG . 17020 1 986 . 1 1 80 80 LEU N N 15 121.1 0.2 . 1 . . . . 80 LEU N . 17020 1 987 . 1 1 81 81 ARG H H 1 8.20 0.02 . 1 . . . . 81 ARG H . 17020 1 988 . 1 1 81 81 ARG HA H 1 3.91 0.02 . 1 . . . . 81 ARG HA . 17020 1 989 . 1 1 81 81 ARG HB2 H 1 1.44 0.02 . 2 . . . . 81 ARG HB2 . 17020 1 990 . 1 1 81 81 ARG HB3 H 1 1.35 0.02 . 2 . . . . 81 ARG HB3 . 17020 1 991 . 1 1 81 81 ARG HD2 H 1 3.13 0.02 . 2 . . . . 81 ARG HD2 . 17020 1 992 . 1 1 81 81 ARG HD3 H 1 3.08 0.02 . 2 . . . . 81 ARG HD3 . 17020 1 993 . 1 1 81 81 ARG HE H 1 6.76 0.02 . 1 . . . . 81 ARG HE . 17020 1 994 . 1 1 81 81 ARG HG2 H 1 1.3 0.02 . 2 . . . . 81 ARG HG2 . 17020 1 995 . 1 1 81 81 ARG HG3 H 1 1.3 0.02 . 2 . . . . 81 ARG HG3 . 17020 1 996 . 1 1 81 81 ARG C C 13 176.2 0.2 . 1 . . . . 81 ARG C . 17020 1 997 . 1 1 81 81 ARG CA C 13 57.5 0.2 . 1 . . . . 81 ARG CA . 17020 1 998 . 1 1 81 81 ARG CB C 13 30.9 0.2 . 1 . . . . 81 ARG CB . 17020 1 999 . 1 1 81 81 ARG CD C 13 43.4 0.2 . 1 . . . . 81 ARG CD . 17020 1 1000 . 1 1 81 81 ARG CG C 13 27.2 0.2 . 1 . . . . 81 ARG CG . 17020 1 1001 . 1 1 81 81 ARG N N 15 124.1 0.2 . 1 . . . . 81 ARG N . 17020 1 1002 . 1 1 81 81 ARG NE N 15 83.9 0.2 . 1 . . . . 81 ARG NE . 17020 1 1003 . 1 1 82 82 HIS H H 1 8.61 0.02 . 1 . . . . 82 HIS H . 17020 1 1004 . 1 1 82 82 HIS HA H 1 4.71 0.02 . 1 . . . . 82 HIS HA . 17020 1 1005 . 1 1 82 82 HIS HB2 H 1 3.21 0.02 . 2 . . . . 82 HIS HB2 . 17020 1 1006 . 1 1 82 82 HIS HB3 H 1 3.08 0.02 . 2 . . . . 82 HIS HB3 . 17020 1 1007 . 1 1 82 82 HIS C C 13 173.7 0.2 . 1 . . . . 82 HIS C . 17020 1 1008 . 1 1 82 82 HIS CA C 13 55.0 0.2 . 1 . . . . 82 HIS CA . 17020 1 1009 . 1 1 82 82 HIS CB C 13 29.3 0.2 . 1 . . . . 82 HIS CB . 17020 1 1010 . 1 1 82 82 HIS N N 15 119.0 0.2 . 1 . . . . 82 HIS N . 17020 1 1011 . 1 1 83 83 ASP H H 1 8.35 0.02 . 1 . . . . 83 ASP H . 17020 1 1012 . 1 1 83 83 ASP HA H 1 4.58 0.02 . 1 . . . . 83 ASP HA . 17020 1 1013 . 1 1 83 83 ASP HB2 H 1 2.66 0.02 . 2 . . . . 83 ASP HB2 . 17020 1 1014 . 1 1 83 83 ASP HB3 H 1 2.66 0.02 . 2 . . . . 83 ASP HB3 . 17020 1 1015 . 1 1 83 83 ASP C C 13 176.5 0.2 . 1 . . . . 83 ASP C . 17020 1 1016 . 1 1 83 83 ASP CA C 13 54.4 0.2 . 1 . . . . 83 ASP CA . 17020 1 1017 . 1 1 83 83 ASP CB C 13 41.3 0.2 . 1 . . . . 83 ASP CB . 17020 1 1018 . 1 1 83 83 ASP N N 15 122.2 0.2 . 1 . . . . 83 ASP N . 17020 1 1019 . 1 1 84 84 GLY H H 1 8.43 0.02 . 1 . . . . 84 GLY H . 17020 1 1020 . 1 1 84 84 GLY HA2 H 1 3.96 0.02 . 2 . . . . 84 GLY HA2 . 17020 1 1021 . 1 1 84 84 GLY HA3 H 1 3.9 0.02 . 2 . . . . 84 GLY HA3 . 17020 1 1022 . 1 1 84 84 GLY C C 13 174.3 0.2 . 1 . . . . 84 GLY C . 17020 1 1023 . 1 1 84 84 GLY CA C 13 45.6 0.2 . 1 . . . . 84 GLY CA . 17020 1 1024 . 1 1 84 84 GLY N N 15 109.7 0.2 . 1 . . . . 84 GLY N . 17020 1 1025 . 1 1 85 85 LEU H H 1 8.12 0.02 . 1 . . . . 85 LEU H . 17020 1 1026 . 1 1 85 85 LEU HA H 1 4.22 0.02 . 1 . . . . 85 LEU HA . 17020 1 1027 . 1 1 85 85 LEU HB2 H 1 1.53 0.02 . 2 . . . . 85 LEU HB2 . 17020 1 1028 . 1 1 85 85 LEU HB3 H 1 1.47 0.02 . 2 . . . . 85 LEU HB3 . 17020 1 1029 . 1 1 85 85 LEU HD11 H 1 0.84 0.02 . 1 . . . . 85 LEU HD1 . 17020 1 1030 . 1 1 85 85 LEU HD12 H 1 0.84 0.02 . 1 . . . . 85 LEU HD1 . 17020 1 1031 . 1 1 85 85 LEU HD13 H 1 0.84 0.02 . 1 . . . . 85 LEU HD1 . 17020 1 1032 . 1 1 85 85 LEU HD21 H 1 0.79 0.02 . 1 . . . . 85 LEU HD2 . 17020 1 1033 . 1 1 85 85 LEU HD22 H 1 0.79 0.02 . 1 . . . . 85 LEU HD2 . 17020 1 1034 . 1 1 85 85 LEU HD23 H 1 0.79 0.02 . 1 . . . . 85 LEU HD2 . 17020 1 1035 . 1 1 85 85 LEU HG H 1 1.52 0.02 . 1 . . . . 85 LEU HG . 17020 1 1036 . 1 1 85 85 LEU C C 13 177.4 0.2 . 1 . . . . 85 LEU C . 17020 1 1037 . 1 1 85 85 LEU CA C 13 55.3 0.2 . 1 . . . . 85 LEU CA . 17020 1 1038 . 1 1 85 85 LEU CB C 13 42.1 0.2 . 1 . . . . 85 LEU CB . 17020 1 1039 . 1 1 85 85 LEU CD1 C 13 25 0.2 . 1 . . . . 85 LEU CD1 . 17020 1 1040 . 1 1 85 85 LEU CD2 C 13 23.3 0.2 . 1 . . . . 85 LEU CD2 . 17020 1 1041 . 1 1 85 85 LEU CG C 13 27 0.2 . 1 . . . . 85 LEU CG . 17020 1 1042 . 1 1 85 85 LEU N N 15 121.2 0.2 . 1 . . . . 85 LEU N . 17020 1 1043 . 1 1 86 86 GLU H H 1 8.33 0.02 . 1 . . . . 86 GLU H . 17020 1 1044 . 1 1 86 86 GLU HA H 1 4.13 0.02 . 1 . . . . 86 GLU HA . 17020 1 1045 . 1 1 86 86 GLU HB2 H 1 1.86 0.02 . 2 . . . . 86 GLU HB2 . 17020 1 1046 . 1 1 86 86 GLU HB3 H 1 1.86 0.02 . 2 . . . . 86 GLU HB3 . 17020 1 1047 . 1 1 86 86 GLU HG2 H 1 2.19 0.02 . 2 . . . . 86 GLU HG2 . 17020 1 1048 . 1 1 86 86 GLU HG3 H 1 2.12 0.02 . 2 . . . . 86 GLU HG3 . 17020 1 1049 . 1 1 86 86 GLU C C 13 176.2 0.2 . 1 . . . . 86 GLU C . 17020 1 1050 . 1 1 86 86 GLU CA C 13 56.7 0.2 . 1 . . . . 86 GLU CA . 17020 1 1051 . 1 1 86 86 GLU CB C 13 29.8 0.2 . 1 . . . . 86 GLU CB . 17020 1 1052 . 1 1 86 86 GLU CG C 13 35.6 0.2 . 1 . . . . 86 GLU CG . 17020 1 1053 . 1 1 86 86 GLU N N 15 120.4 0.2 . 1 . . . . 86 GLU N . 17020 1 1054 . 1 1 87 87 HIS H H 1 8.41 0.02 . 1 . . . . 87 HIS H . 17020 1 1055 . 1 1 87 87 HIS HA H 1 4.61 0.02 . 1 . . . . 87 HIS HA . 17020 1 1056 . 1 1 87 87 HIS HB2 H 1 3.16 0.02 . 2 . . . . 87 HIS HB2 . 17020 1 1057 . 1 1 87 87 HIS HB3 H 1 3.06 0.02 . 2 . . . . 87 HIS HB3 . 17020 1 1058 . 1 1 87 87 HIS C C 13 174.2 0.2 . 1 . . . . 87 HIS C . 17020 1 1059 . 1 1 87 87 HIS CA C 13 55.3 0.2 . 1 . . . . 87 HIS CA . 17020 1 1060 . 1 1 87 87 HIS CB C 13 28.7 0.2 . 1 . . . . 87 HIS CB . 17020 1 1061 . 1 1 87 87 HIS N N 15 118.9 0.2 . 1 . . . . 87 HIS N . 17020 1 1062 . 1 1 88 88 HIS H H 1 8.49 0.02 . 1 . . . . 88 HIS H . 17020 1 1063 . 1 1 88 88 HIS HA H 1 4.66 0.02 . 1 . . . . 88 HIS HA . 17020 1 1064 . 1 1 88 88 HIS HB2 H 1 3.15 0.02 . 2 . . . . 88 HIS HB2 . 17020 1 1065 . 1 1 88 88 HIS HB3 H 1 3.15 0.02 . 2 . . . . 88 HIS HB3 . 17020 1 1066 . 1 1 88 88 HIS C C 13 173.5 0.2 . 1 . . . . 88 HIS C . 17020 1 1067 . 1 1 88 88 HIS CA C 13 55.5 0.2 . 1 . . . . 88 HIS CA . 17020 1 1068 . 1 1 88 88 HIS CB C 13 29.6 0.2 . 1 . . . . 88 HIS CB . 17020 1 1069 . 1 1 88 88 HIS N N 15 118.9 0.2 . 1 . . . . 88 HIS N . 17020 1 1070 . 1 1 89 89 HIS H H 1 8.68 0.02 . 1 . . . . 89 HIS H . 17020 1 1071 . 1 1 89 89 HIS HA H 1 4.63 0.02 . 1 . . . . 89 HIS HA . 17020 1 1072 . 1 1 89 89 HIS HB2 H 1 3.18 0.02 . 2 . . . . 89 HIS HB2 . 17020 1 1073 . 1 1 89 89 HIS HB3 H 1 3.09 0.02 . 2 . . . . 89 HIS HB3 . 17020 1 1074 . 1 1 89 89 HIS C C 13 174.2 0.2 . 1 . . . . 89 HIS C . 17020 1 1075 . 1 1 89 89 HIS CA C 13 55.2 0.2 . 1 . . . . 89 HIS CA . 17020 1 1076 . 1 1 89 89 HIS CB C 13 29.0 0.2 . 1 . . . . 89 HIS CB . 17020 1 1077 . 1 1 89 89 HIS N N 15 120.3 0.2 . 1 . . . . 89 HIS N . 17020 1 1078 . 1 1 90 90 HIS H H 1 8.62 0.02 . 1 . . . . 90 HIS H . 17020 1 1079 . 1 1 90 90 HIS HA H 1 4.67 0.02 . 1 . . . . 90 HIS HA . 17020 1 1080 . 1 1 90 90 HIS HB2 H 1 3.17 0.02 . 2 . . . . 90 HIS HB2 . 17020 1 1081 . 1 1 90 90 HIS HB3 H 1 3.17 0.02 . 2 . . . . 90 HIS HB3 . 17020 1 1082 . 1 1 90 90 HIS C C 13 174.0 0.2 . 1 . . . . 90 HIS C . 17020 1 1083 . 1 1 90 90 HIS CA C 13 55.2 0.2 . 1 . . . . 90 HIS CA . 17020 1 1084 . 1 1 90 90 HIS CB C 13 29.2 0.2 . 1 . . . . 90 HIS CB . 17020 1 1085 . 1 1 90 90 HIS N N 15 119.6 0.2 . 1 . . . . 90 HIS N . 17020 1 1086 . 1 1 91 91 HIS H H 1 8.58 0.02 . 1 . . . . 91 HIS H . 17020 1 1087 . 1 1 91 91 HIS HA H 1 4.65 0.02 . 1 . . . . 91 HIS HA . 17020 1 1088 . 1 1 91 91 HIS HB2 H 1 3.23 0.02 . 2 . . . . 91 HIS HB2 . 17020 1 1089 . 1 1 91 91 HIS HB3 H 1 3.23 0.02 . 2 . . . . 91 HIS HB3 . 17020 1 1090 . 1 1 91 91 HIS C C 13 173.5 0.2 . 1 . . . . 91 HIS C . 17020 1 1091 . 1 1 91 91 HIS CA C 13 55.5 0.2 . 1 . . . . 91 HIS CA . 17020 1 1092 . 1 1 91 91 HIS CB C 13 29.4 0.2 . 1 . . . . 91 HIS CB . 17020 1 1093 . 1 1 91 91 HIS N N 15 120.6 0.2 . 1 . . . . 91 HIS N . 17020 1 1094 . 1 1 92 92 HIS H H 1 8.40 0.02 . 1 . . . . 92 HIS H . 17020 1 1095 . 1 1 92 92 HIS HA H 1 4.65 0.02 . 1 . . . . 92 HIS HA . 17020 1 1096 . 1 1 92 92 HIS HB2 H 1 3.23 0.02 . 2 . . . . 92 HIS HB2 . 17020 1 1097 . 1 1 92 92 HIS HB3 H 1 3.14 0.02 . 2 . . . . 92 HIS HB3 . 17020 1 1098 . 1 1 92 92 HIS CA C 13 57.2 0.2 . 1 . . . . 92 HIS CA . 17020 1 1099 . 1 1 92 92 HIS CB C 13 29.6 0.2 . 1 . . . . 92 HIS CB . 17020 1 1100 . 1 1 92 92 HIS N N 15 125.6 0.2 . 1 . . . . 92 HIS N . 17020 1 stop_ save_