################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 36447 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' 1 $sample_1 isotropic 36447 1 5 '3D 1H-13C NOESY aromatic' 1 $sample_1 isotropic 36447 1 6 '3D 1H-15N NOESY' 1 $sample_1 isotropic 36447 1 7 '3D 1H-13C NOESY aliphatic' 1 $sample_1 isotropic 36447 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 5 5 GLN HA H 1 4.199 0 . 1 . . . . X 2 GLN HA . 36447 1 2 . 1 . 1 5 5 GLN HB2 H 1 2.056 0 . 1 . . . . X 2 GLN HB2 . 36447 1 3 . 1 . 1 5 5 GLN HB3 H 1 2.425 0 . 1 . . . . X 2 GLN HB3 . 36447 1 4 . 1 . 1 5 5 GLN C C 13 177.817 0 . 1 . . . . X 2 GLN C . 36447 1 5 . 1 . 1 5 5 GLN CA C 13 58.372 0 . 1 . . . . X 2 GLN CA . 36447 1 6 . 1 . 1 5 5 GLN CB C 13 28.54 0 . 1 . . . . X 2 GLN CB . 36447 1 7 . 1 . 1 6 6 ASP H H 1 8.098 0 . 1 . . . . X 3 ASP H . 36447 1 8 . 1 . 1 6 6 ASP HA H 1 4.428 0 . 1 . . . . X 3 ASP HA . 36447 1 9 . 1 . 1 6 6 ASP HB3 H 1 2.667 0 . 1 . . . . X 3 ASP HB3 . 36447 1 10 . 1 . 1 6 6 ASP C C 13 178.67 0 . 1 . . . . X 3 ASP C . 36447 1 11 . 1 . 1 6 6 ASP CA C 13 56.603 0.03 . 1 . . . . X 3 ASP CA . 36447 1 12 . 1 . 1 6 6 ASP CB C 13 40.417 0 . 1 . . . . X 3 ASP CB . 36447 1 13 . 1 . 1 6 6 ASP N N 15 120.615 0 . 1 . . . . X 3 ASP N . 36447 1 14 . 1 . 1 7 7 ARG H H 1 8.164 0 . 1 . . . . X 4 ARG H . 36447 1 15 . 1 . 1 7 7 ARG HA H 1 4.051 0 . 1 . . . . X 4 ARG HA . 36447 1 16 . 1 . 1 7 7 ARG HB2 H 1 1.857 0 . 1 . . . . X 4 ARG HB2 . 36447 1 17 . 1 . 1 7 7 ARG HB3 H 1 1.797 0 . 1 . . . . X 4 ARG HB3 . 36447 1 18 . 1 . 1 7 7 ARG HG3 H 1 1.302 0 . 1 . . . . X 4 ARG HG3 . 36447 1 19 . 1 . 1 7 7 ARG HD3 H 1 3.152 0 . 1 . . . . X 4 ARG HD3 . 36447 1 20 . 1 . 1 7 7 ARG C C 13 178.292 0 . 1 . . . . X 4 ARG C . 36447 1 21 . 1 . 1 7 7 ARG CA C 13 58.64 0.04 . 1 . . . . X 4 ARG CA . 36447 1 22 . 1 . 1 7 7 ARG CB C 13 30.26 0 . 1 . . . . X 4 ARG CB . 36447 1 23 . 1 . 1 7 7 ARG CG C 13 21.893 0 . 1 . . . . X 4 ARG CG . 36447 1 24 . 1 . 1 7 7 ARG CD C 13 43.465 0 . 1 . . . . X 4 ARG CD . 36447 1 25 . 1 . 1 7 7 ARG N N 15 121.009 0 . 1 . . . . X 4 ARG N . 36447 1 26 . 1 . 1 8 8 GLU H H 1 8.319 0 . 1 . . . . X 5 GLU H . 36447 1 27 . 1 . 1 8 8 GLU HA H 1 4.035 0 . 1 . . . . X 5 GLU HA . 36447 1 28 . 1 . 1 8 8 GLU HB2 H 1 1.54 0 . 1 . . . . X 5 GLU HB2 . 36447 1 29 . 1 . 1 8 8 GLU HB3 H 1 2.119 0 . 1 . . . . X 5 GLU HB3 . 36447 1 30 . 1 . 1 8 8 GLU C C 13 178.507 0 . 1 . . . . X 5 GLU C . 36447 1 31 . 1 . 1 8 8 GLU CA C 13 59.182 0.05 . 1 . . . . X 5 GLU CA . 36447 1 32 . 1 . 1 8 8 GLU CB C 13 29.648 0 . 1 . . . . X 5 GLU CB . 36447 1 33 . 1 . 1 8 8 GLU N N 15 119.599 0 . 1 . . . . X 5 GLU N . 36447 1 34 . 1 . 1 9 9 LYS H H 1 8.051 0 . 1 . . . . X 6 LYS H . 36447 1 35 . 1 . 1 9 9 LYS HA H 1 4.119 0 . 1 . . . . X 6 LYS HA . 36447 1 36 . 1 . 1 9 9 LYS HB2 H 1 1.878 0 . 1 . . . . X 6 LYS HB2 . 36447 1 37 . 1 . 1 9 9 LYS HB3 H 1 2.3 0 . 1 . . . . X 6 LYS HB3 . 36447 1 38 . 1 . 1 9 9 LYS HG2 H 1 1.585 0 . 1 . . . . X 6 LYS HG2 . 36447 1 39 . 1 . 1 9 9 LYS HG3 H 1 1.452 0 . 1 . . . . X 6 LYS HG3 . 36447 1 40 . 1 . 1 9 9 LYS HE2 H 1 2.892 0 . 1 . . . . X 6 LYS HE2 . 36447 1 41 . 1 . 1 9 9 LYS HE3 H 1 2.965 0 . 1 . . . . X 6 LYS HE3 . 36447 1 42 . 1 . 1 9 9 LYS C C 13 178.502 0 . 1 . . . . X 6 LYS C . 36447 1 43 . 1 . 1 9 9 LYS CA C 13 58.511 0.04 . 1 . . . . X 6 LYS CA . 36447 1 44 . 1 . 1 9 9 LYS CB C 13 32.273 0 . 1 . . . . X 6 LYS CB . 36447 1 45 . 1 . 1 9 9 LYS CG C 13 24.964 0 . 1 . . . . X 6 LYS CG . 36447 1 46 . 1 . 1 9 9 LYS CE C 13 42.051 0 . 1 . . . . X 6 LYS CE . 36447 1 47 . 1 . 1 9 9 LYS N N 15 119.809 0 . 1 . . . . X 6 LYS N . 36447 1 48 . 1 . 1 10 10 ALA H H 1 7.809 0 . 1 . . . . X 7 ALA H . 36447 1 49 . 1 . 1 10 10 ALA HA H 1 4.128 0 . 1 . . . . X 7 ALA HA . 36447 1 50 . 1 . 1 10 10 ALA HB1 H 1 1.294 0 . 1 . . . . X 7 ALA HB1 . 36447 1 51 . 1 . 1 10 10 ALA HB2 H 1 1.294 0 . 1 . . . . X 7 ALA HB2 . 36447 1 52 . 1 . 1 10 10 ALA HB3 H 1 1.294 0 . 1 . . . . X 7 ALA HB3 . 36447 1 53 . 1 . 1 10 10 ALA C C 13 179.883 0 . 1 . . . . X 7 ALA C . 36447 1 54 . 1 . 1 10 10 ALA CA C 13 54.379 0.03 . 1 . . . . X 7 ALA CA . 36447 1 55 . 1 . 1 10 10 ALA CB C 13 18.091 0 . 1 . . . . X 7 ALA CB . 36447 1 56 . 1 . 1 10 10 ALA N N 15 122.101 0 . 1 . . . . X 7 ALA N . 36447 1 57 . 1 . 1 11 11 PHE H H 1 7.829 0 . 1 . . . . X 8 PHE H . 36447 1 58 . 1 . 1 11 11 PHE HA H 1 4.141 0 . 1 . . . . X 8 PHE HA . 36447 1 59 . 1 . 1 11 11 PHE HB2 H 1 2.744 0 . 1 . . . . X 8 PHE HB2 . 36447 1 60 . 1 . 1 11 11 PHE HB3 H 1 2.902 0 . 1 . . . . X 8 PHE HB3 . 36447 1 61 . 1 . 1 11 11 PHE HD1 H 1 7.089 0 . 3 . . . . X 8 PHE HD1 . 36447 1 62 . 1 . 1 11 11 PHE HD2 H 1 7.089 0 . 3 . . . . X 8 PHE HD2 . 36447 1 63 . 1 . 1 11 11 PHE C C 13 176.587 0 . 1 . . . . X 8 PHE C . 36447 1 64 . 1 . 1 11 11 PHE CA C 13 59.947 0.03 . 1 . . . . X 8 PHE CA . 36447 1 65 . 1 . 1 11 11 PHE CB C 13 38.46 0 . 1 . . . . X 8 PHE CB . 36447 1 66 . 1 . 1 11 11 PHE CD1 C 13 131.583 0 . 1 . . . . X 8 PHE CD1 . 36447 1 67 . 1 . 1 11 11 PHE N N 15 117.201 0 . 1 . . . . X 8 PHE N . 36447 1 68 . 1 . 1 12 12 GLU H H 1 8.043 0 . 1 . . . . X 9 GLU H . 36447 1 69 . 1 . 1 12 12 GLU HA H 1 3.997 0 . 1 . . . . X 9 GLU HA . 36447 1 70 . 1 . 1 12 12 GLU HB2 H 1 2.104 0 . 1 . . . . X 9 GLU HB2 . 36447 1 71 . 1 . 1 12 12 GLU HB3 H 1 2.381 0 . 1 . . . . X 9 GLU HB3 . 36447 1 72 . 1 . 1 12 12 GLU C C 13 178.229 0 . 1 . . . . X 9 GLU C . 36447 1 73 . 1 . 1 12 12 GLU CA C 13 59.091 0.03 . 1 . . . . X 9 GLU CA . 36447 1 74 . 1 . 1 12 12 GLU CB C 13 29.284 0 . 1 . . . . X 9 GLU CB . 36447 1 75 . 1 . 1 12 12 GLU N N 15 119.653 0 . 1 . . . . X 9 GLU N . 36447 1 76 . 1 . 1 13 13 ALA H H 1 7.927 0 . 1 . . . . X 10 ALA H . 36447 1 77 . 1 . 1 13 13 ALA HA H 1 4.179 0 . 1 . . . . X 10 ALA HA . 36447 1 78 . 1 . 1 13 13 ALA HB1 H 1 0.842 0 . 1 . . . . X 10 ALA HB1 . 36447 1 79 . 1 . 1 13 13 ALA HB2 H 1 0.842 0 . 1 . . . . X 10 ALA HB2 . 36447 1 80 . 1 . 1 13 13 ALA HB3 H 1 0.842 0 . 1 . . . . X 10 ALA HB3 . 36447 1 81 . 1 . 1 13 13 ALA C C 13 179.827 0 . 1 . . . . X 10 ALA C . 36447 1 82 . 1 . 1 13 13 ALA CA C 13 54.439 0.04 . 1 . . . . X 10 ALA CA . 36447 1 83 . 1 . 1 13 13 ALA CB C 13 18.091 0 . 1 . . . . X 10 ALA CB . 36447 1 84 . 1 . 1 13 13 ALA N N 15 120.863 0 . 1 . . . . X 10 ALA N . 36447 1 85 . 1 . 1 14 14 LYS H H 1 7.535 0 . 1 . . . . X 11 LYS H . 36447 1 86 . 1 . 1 14 14 LYS HA H 1 4.091 0 . 1 . . . . X 11 LYS HA . 36447 1 87 . 1 . 1 14 14 LYS HB2 H 1 1.695 0 . 1 . . . . X 11 LYS HB2 . 36447 1 88 . 1 . 1 14 14 LYS HB3 H 1 1.74 0 . 1 . . . . X 11 LYS HB3 . 36447 1 89 . 1 . 1 14 14 LYS HG3 H 1 1.055 0 . 1 . . . . X 11 LYS HG3 . 36447 1 90 . 1 . 1 14 14 LYS HD2 H 1 1.284 0 . 1 . . . . X 11 LYS HD2 . 36447 1 91 . 1 . 1 14 14 LYS HD3 H 1 1.423 0 . 1 . . . . X 11 LYS HD3 . 36447 1 92 . 1 . 1 14 14 LYS C C 13 178.807 0 . 1 . . . . X 11 LYS C . 36447 1 93 . 1 . 1 14 14 LYS CA C 13 58.271 0.02 . 1 . . . . X 11 LYS CA . 36447 1 94 . 1 . 1 14 14 LYS CB C 13 32.445 0 . 1 . . . . X 11 LYS CB . 36447 1 95 . 1 . 1 14 14 LYS CG C 13 28.144 0 . 1 . . . . X 11 LYS CG . 36447 1 96 . 1 . 1 14 14 LYS CD C 13 24.785 0 . 1 . . . . X 11 LYS CD . 36447 1 97 . 1 . 1 14 14 LYS N N 15 117.74 0 . 1 . . . . X 11 LYS N . 36447 1 98 . 1 . 1 15 15 PHE H H 1 8.234 0 . 1 . . . . X 12 PHE H . 36447 1 99 . 1 . 1 15 15 PHE HA H 1 4.636 0.01 . 1 . . . . X 12 PHE HA . 36447 1 100 . 1 . 1 15 15 PHE HB3 H 1 3.119 0 . 1 . . . . X 12 PHE HB3 . 36447 1 101 . 1 . 1 15 15 PHE C C 13 176.847 0 . 1 . . . . X 12 PHE C . 36447 1 102 . 1 . 1 15 15 PHE CA C 13 56.522 0.01 . 1 . . . . X 12 PHE CA . 36447 1 103 . 1 . 1 15 15 PHE CB C 13 37.984 0 . 1 . . . . X 12 PHE CB . 36447 1 104 . 1 . 1 15 15 PHE N N 15 118.379 0 . 1 . . . . X 12 PHE N . 36447 1 105 . 1 . 1 16 16 ALA H H 1 8.101 0 . 1 . . . . X 13 ALA H . 36447 1 106 . 1 . 1 16 16 ALA HA H 1 4.201 0 . 1 . . . . X 13 ALA HA . 36447 1 107 . 1 . 1 16 16 ALA HB1 H 1 1.471 0 . 1 . . . . X 13 ALA HB1 . 36447 1 108 . 1 . 1 16 16 ALA HB2 H 1 1.471 0 . 1 . . . . X 13 ALA HB2 . 36447 1 109 . 1 . 1 16 16 ALA HB3 H 1 1.471 0 . 1 . . . . X 13 ALA HB3 . 36447 1 110 . 1 . 1 16 16 ALA C C 13 178.648 0 . 1 . . . . X 13 ALA C . 36447 1 111 . 1 . 1 16 16 ALA CA C 13 53.921 0.02 . 1 . . . . X 13 ALA CA . 36447 1 112 . 1 . 1 16 16 ALA CB C 13 18.224 0 . 1 . . . . X 13 ALA CB . 36447 1 113 . 1 . 1 16 16 ALA N N 15 121.627 0 . 1 . . . . X 13 ALA N . 36447 1 114 . 1 . 1 17 17 LEU H H 1 7.457 0 . 1 . . . . X 14 LEU H . 36447 1 115 . 1 . 1 17 17 LEU HA H 1 4.416 0 . 1 . . . . X 14 LEU HA . 36447 1 116 . 1 . 1 17 17 LEU HB2 H 1 1.688 0 . 1 . . . . X 14 LEU HB2 . 36447 1 117 . 1 . 1 17 17 LEU HB3 H 1 1.761 0 . 1 . . . . X 14 LEU HB3 . 36447 1 118 . 1 . 1 17 17 LEU HG H 1 2.072 0 . 1 . . . . X 14 LEU HG . 36447 1 119 . 1 . 1 17 17 LEU HD11 H 1 1.066 0 . 1 . . . . X 14 LEU HD11 . 36447 1 120 . 1 . 1 17 17 LEU HD12 H 1 1.066 0 . 1 . . . . X 14 LEU HD12 . 36447 1 121 . 1 . 1 17 17 LEU HD13 H 1 1.066 0 . 1 . . . . X 14 LEU HD13 . 36447 1 122 . 1 . 1 17 17 LEU HD21 H 1 0.91 0 . 1 . . . . X 14 LEU HD21 . 36447 1 123 . 1 . 1 17 17 LEU HD22 H 1 0.91 0 . 1 . . . . X 14 LEU HD22 . 36447 1 124 . 1 . 1 17 17 LEU HD23 H 1 0.91 0 . 1 . . . . X 14 LEU HD23 . 36447 1 125 . 1 . 1 17 17 LEU C C 13 176.926 0 . 1 . . . . X 14 LEU C . 36447 1 126 . 1 . 1 17 17 LEU CA C 13 54.902 0.03 . 1 . . . . X 14 LEU CA . 36447 1 127 . 1 . 1 17 17 LEU CB C 13 42.929 0 . 1 . . . . X 14 LEU CB . 36447 1 128 . 1 . 1 17 17 LEU CG C 13 28.32 0 . 1 . . . . X 14 LEU CG . 36447 1 129 . 1 . 1 17 17 LEU CD1 C 13 25.709 0 . 1 . . . . X 14 LEU CD1 . 36447 1 130 . 1 . 1 17 17 LEU CD2 C 13 23.512 0 . 1 . . . . X 14 LEU CD2 . 36447 1 131 . 1 . 1 17 17 LEU N N 15 116.374 0 . 1 . . . . X 14 LEU N . 36447 1 132 . 1 . 1 18 18 ASP H H 1 7.735 0 . 1 . . . . X 15 ASP H . 36447 1 133 . 1 . 1 18 18 ASP HA H 1 4.751 0 . 1 . . . . X 15 ASP HA . 36447 1 134 . 1 . 1 18 18 ASP HB2 H 1 2.617 0 . 1 . . . . X 15 ASP HB2 . 36447 1 135 . 1 . 1 18 18 ASP HB3 H 1 2.94 0 . 1 . . . . X 15 ASP HB3 . 36447 1 136 . 1 . 1 18 18 ASP C C 13 175.072 0 . 1 . . . . X 15 ASP C . 36447 1 137 . 1 . 1 18 18 ASP CA C 13 53.375 0.02 . 1 . . . . X 15 ASP CA . 36447 1 138 . 1 . 1 18 18 ASP CB C 13 41.374 0 . 1 . . . . X 15 ASP CB . 36447 1 139 . 1 . 1 18 18 ASP N N 15 120.632 0 . 1 . . . . X 15 ASP N . 36447 1 140 . 1 . 1 19 19 GLU H H 1 8.736 0 . 1 . . . . X 16 GLU H . 36447 1 141 . 1 . 1 19 19 GLU HA H 1 4.094 0 . 1 . . . . X 16 GLU HA . 36447 1 142 . 1 . 1 19 19 GLU HB2 H 1 2.055 0 . 1 . . . . X 16 GLU HB2 . 36447 1 143 . 1 . 1 19 19 GLU HB3 H 1 1.736 0 . 1 . . . . X 16 GLU HB3 . 36447 1 144 . 1 . 1 19 19 GLU C C 13 178.569 0 . 1 . . . . X 16 GLU C . 36447 1 145 . 1 . 1 19 19 GLU CA C 13 59.109 0.04 . 1 . . . . X 16 GLU CA . 36447 1 146 . 1 . 1 19 19 GLU CB C 13 29.534 0 . 1 . . . . X 16 GLU CB . 36447 1 147 . 1 . 1 19 19 GLU N N 15 123.836 0 . 1 . . . . X 16 GLU N . 36447 1 148 . 1 . 1 20 20 GLU H H 1 8.274 0 . 1 . . . . X 17 GLU H . 36447 1 149 . 1 . 1 20 20 GLU HA H 1 4.202 0 . 1 . . . . X 17 GLU HA . 36447 1 150 . 1 . 1 20 20 GLU HB3 H 1 2.141 0 . 1 . . . . X 17 GLU HB3 . 36447 1 151 . 1 . 1 20 20 GLU C C 13 178.675 0 . 1 . . . . X 17 GLU C . 36447 1 152 . 1 . 1 20 20 GLU CA C 13 59.295 0.04 . 1 . . . . X 17 GLU CA . 36447 1 153 . 1 . 1 20 20 GLU CB C 13 29.338 0 . 1 . . . . X 17 GLU CB . 36447 1 154 . 1 . 1 20 20 GLU N N 15 119.492 0 . 1 . . . . X 17 GLU N . 36447 1 155 . 1 . 1 21 21 LEU H H 1 7.815 0 . 1 . . . . X 18 LEU H . 36447 1 156 . 1 . 1 21 21 LEU HA H 1 4.103 0 . 1 . . . . X 18 LEU HA . 36447 1 157 . 1 . 1 21 21 LEU HB2 H 1 1.941 0 . 1 . . . . X 18 LEU HB2 . 36447 1 158 . 1 . 1 21 21 LEU HB3 H 1 1.713 0 . 1 . . . . X 18 LEU HB3 . 36447 1 159 . 1 . 1 21 21 LEU HD21 H 1 1.036 0 . 1 . . . . X 18 LEU HD21 . 36447 1 160 . 1 . 1 21 21 LEU HD22 H 1 1.036 0 . 1 . . . . X 18 LEU HD22 . 36447 1 161 . 1 . 1 21 21 LEU HD23 H 1 1.036 0 . 1 . . . . X 18 LEU HD23 . 36447 1 162 . 1 . 1 21 21 LEU C C 13 178.209 0 . 1 . . . . X 18 LEU C . 36447 1 163 . 1 . 1 21 21 LEU CA C 13 57.584 0.03 . 1 . . . . X 18 LEU CA . 36447 1 164 . 1 . 1 21 21 LEU CB C 13 41.304 0 . 1 . . . . X 18 LEU CB . 36447 1 165 . 1 . 1 21 21 LEU CD2 C 13 23.675 0 . 1 . . . . X 18 LEU CD2 . 36447 1 166 . 1 . 1 21 21 LEU N N 15 121.051 0 . 1 . . . . X 18 LEU N . 36447 1 167 . 1 . 1 22 22 ARG H H 1 8.016 0 . 1 . . . . X 19 ARG H . 36447 1 168 . 1 . 1 22 22 ARG HA H 1 2.816 0 . 1 . . . . X 19 ARG HA . 36447 1 169 . 1 . 1 22 22 ARG HB2 H 1 1.778 0 . 1 . . . . X 19 ARG HB2 . 36447 1 170 . 1 . 1 22 22 ARG HB3 H 1 1.531 0 . 1 . . . . X 19 ARG HB3 . 36447 1 171 . 1 . 1 22 22 ARG C C 13 179.275 0 . 1 . . . . X 19 ARG C . 36447 1 172 . 1 . 1 22 22 ARG CA C 13 60.204 0.03 . 1 . . . . X 19 ARG CA . 36447 1 173 . 1 . 1 22 22 ARG CB C 13 29.954 0 . 1 . . . . X 19 ARG CB . 36447 1 174 . 1 . 1 22 22 ARG N N 15 118.561 0 . 1 . . . . X 19 ARG N . 36447 1 175 . 1 . 1 23 23 PHE H H 1 8.145 0 . 1 . . . . X 20 PHE H . 36447 1 176 . 1 . 1 23 23 PHE HA H 1 4.231 0 . 1 . . . . X 20 PHE HA . 36447 1 177 . 1 . 1 23 23 PHE HB3 H 1 3.252 0 . 1 . . . . X 20 PHE HB3 . 36447 1 178 . 1 . 1 23 23 PHE C C 13 178.584 0 . 1 . . . . X 20 PHE C . 36447 1 179 . 1 . 1 23 23 PHE CA C 13 61.094 0.04 . 1 . . . . X 20 PHE CA . 36447 1 180 . 1 . 1 23 23 PHE CB C 13 38.666 0 . 1 . . . . X 20 PHE CB . 36447 1 181 . 1 . 1 23 23 PHE N N 15 119.909 0 . 1 . . . . X 20 PHE N . 36447 1 182 . 1 . 1 24 24 LYS H H 1 8.432 0 . 1 . . . . X 21 LYS H . 36447 1 183 . 1 . 1 24 24 LYS HA H 1 3.992 0 . 1 . . . . X 21 LYS HA . 36447 1 184 . 1 . 1 24 24 LYS HB2 H 1 1.931 0 . 1 . . . . X 21 LYS HB2 . 36447 1 185 . 1 . 1 24 24 LYS HB3 H 1 1.853 0 . 1 . . . . X 21 LYS HB3 . 36447 1 186 . 1 . 1 24 24 LYS HE2 H 1 3 0 . 1 . . . . X 21 LYS HE2 . 36447 1 187 . 1 . 1 24 24 LYS HE3 H 1 2.617 0 . 1 . . . . X 21 LYS HE3 . 36447 1 188 . 1 . 1 24 24 LYS C C 13 179.94 0 . 1 . . . . X 21 LYS C . 36447 1 189 . 1 . 1 24 24 LYS CA C 13 59.664 0.03 . 1 . . . . X 21 LYS CA . 36447 1 190 . 1 . 1 24 24 LYS CB C 13 33.303 0 . 1 . . . . X 21 LYS CB . 36447 1 191 . 1 . 1 24 24 LYS CE C 13 41.209 0 . 1 . . . . X 21 LYS CE . 36447 1 192 . 1 . 1 24 24 LYS N N 15 119.448 0 . 1 . . . . X 21 LYS N . 36447 1 193 . 1 . 1 25 25 ALA H H 1 9.343 0 . 1 . . . . X 22 ALA H . 36447 1 194 . 1 . 1 25 25 ALA HA H 1 3.896 0 . 1 . . . . X 22 ALA HA . 36447 1 195 . 1 . 1 25 25 ALA HB1 H 1 1.343 0 . 1 . . . . X 22 ALA HB1 . 36447 1 196 . 1 . 1 25 25 ALA HB2 H 1 1.343 0 . 1 . . . . X 22 ALA HB2 . 36447 1 197 . 1 . 1 25 25 ALA HB3 H 1 1.343 0 . 1 . . . . X 22 ALA HB3 . 36447 1 198 . 1 . 1 25 25 ALA C C 13 179.044 0 . 1 . . . . X 22 ALA C . 36447 1 199 . 1 . 1 25 25 ALA CA C 13 55.171 0.03 . 1 . . . . X 22 ALA CA . 36447 1 200 . 1 . 1 25 25 ALA CB C 13 18.408 0 . 1 . . . . X 22 ALA CB . 36447 1 201 . 1 . 1 25 25 ALA N N 15 121.873 0 . 1 . . . . X 22 ALA N . 36447 1 202 . 1 . 1 26 26 THR H H 1 7.911 0 . 1 . . . . X 23 THR H . 36447 1 203 . 1 . 1 26 26 THR HA H 1 3.51 0 . 1 . . . . X 23 THR HA . 36447 1 204 . 1 . 1 26 26 THR HB H 1 4.139 0 . 1 . . . . X 23 THR HB . 36447 1 205 . 1 . 1 26 26 THR HG21 H 1 1.11 0 . 1 . . . . X 23 THR HG21 . 36447 1 206 . 1 . 1 26 26 THR HG22 H 1 1.11 0 . 1 . . . . X 23 THR HG22 . 36447 1 207 . 1 . 1 26 26 THR HG23 H 1 1.11 0 . 1 . . . . X 23 THR HG23 . 36447 1 208 . 1 . 1 26 26 THR C C 13 175.48 0 . 1 . . . . X 23 THR C . 36447 1 209 . 1 . 1 26 26 THR CA C 13 67.512 0.04 . 1 . . . . X 23 THR CA . 36447 1 210 . 1 . 1 26 26 THR CB C 13 68.25 0 . 1 . . . . X 23 THR CB . 36447 1 211 . 1 . 1 26 26 THR CG2 C 13 21.592 0 . 1 . . . . X 23 THR CG2 . 36447 1 212 . 1 . 1 26 26 THR N N 15 114.763 0 . 1 . . . . X 23 THR N . 36447 1 213 . 1 . 1 27 27 ALA H H 1 7.644 0 . 1 . . . . X 24 ALA H . 36447 1 214 . 1 . 1 27 27 ALA HA H 1 4.12 0 . 1 . . . . X 24 ALA HA . 36447 1 215 . 1 . 1 27 27 ALA HB1 H 1 1.355 0 . 1 . . . . X 24 ALA HB1 . 36447 1 216 . 1 . 1 27 27 ALA HB2 H 1 1.355 0 . 1 . . . . X 24 ALA HB2 . 36447 1 217 . 1 . 1 27 27 ALA HB3 H 1 1.355 0 . 1 . . . . X 24 ALA HB3 . 36447 1 218 . 1 . 1 27 27 ALA C C 13 180.952 0 . 1 . . . . X 24 ALA C . 36447 1 219 . 1 . 1 27 27 ALA CA C 13 55.626 0.03 . 1 . . . . X 24 ALA CA . 36447 1 220 . 1 . 1 27 27 ALA CB C 13 17.79 0 . 1 . . . . X 24 ALA CB . 36447 1 221 . 1 . 1 27 27 ALA N N 15 123.517 0 . 1 . . . . X 24 ALA N . 36447 1 222 . 1 . 1 28 28 ARG H H 1 7.878 0 . 1 . . . . X 25 ARG H . 36447 1 223 . 1 . 1 28 28 ARG HA H 1 4.183 0 . 1 . . . . X 25 ARG HA . 36447 1 224 . 1 . 1 28 28 ARG HB2 H 1 1.909 0 . 1 . . . . X 25 ARG HB2 . 36447 1 225 . 1 . 1 28 28 ARG HB3 H 1 1.522 0 . 1 . . . . X 25 ARG HB3 . 36447 1 226 . 1 . 1 28 28 ARG HG3 H 1 1.728 0 . 1 . . . . X 25 ARG HG3 . 36447 1 227 . 1 . 1 28 28 ARG HD2 H 1 3.262 0 . 1 . . . . X 25 ARG HD2 . 36447 1 228 . 1 . 1 28 28 ARG HD3 H 1 3.375 0 . 1 . . . . X 25 ARG HD3 . 36447 1 229 . 1 . 1 28 28 ARG C C 13 177.605 0 . 1 . . . . X 25 ARG C . 36447 1 230 . 1 . 1 28 28 ARG CA C 13 57.997 0.04 . 1 . . . . X 25 ARG CA . 36447 1 231 . 1 . 1 28 28 ARG CB C 13 28.84 0 . 1 . . . . X 25 ARG CB . 36447 1 232 . 1 . 1 28 28 ARG CG C 13 29.297 0 . 1 . . . . X 25 ARG CG . 36447 1 233 . 1 . 1 28 28 ARG CD C 13 41.735 0 . 1 . . . . X 25 ARG CD . 36447 1 234 . 1 . 1 28 28 ARG N N 15 118.683 0 . 1 . . . . X 25 ARG N . 36447 1 235 . 1 . 1 29 29 ARG H H 1 8.76 0 . 1 . . . . X 26 ARG H . 36447 1 236 . 1 . 1 29 29 ARG HA H 1 3.646 0 . 1 . . . . X 26 ARG HA . 36447 1 237 . 1 . 1 29 29 ARG HB2 H 1 1.903 0 . 1 . . . . X 26 ARG HB2 . 36447 1 238 . 1 . 1 29 29 ARG HB3 H 1 1.75 0 . 1 . . . . X 26 ARG HB3 . 36447 1 239 . 1 . 1 29 29 ARG HG2 H 1 1.33 0 . 1 . . . . X 26 ARG HG2 . 36447 1 240 . 1 . 1 29 29 ARG HG3 H 1 0.906 0 . 1 . . . . X 26 ARG HG3 . 36447 1 241 . 1 . 1 29 29 ARG C C 13 178.582 0 . 1 . . . . X 26 ARG C . 36447 1 242 . 1 . 1 29 29 ARG CA C 13 60.066 0.03 . 1 . . . . X 26 ARG CA . 36447 1 243 . 1 . 1 29 29 ARG CB C 13 27.036 0 . 1 . . . . X 26 ARG CB . 36447 1 244 . 1 . 1 29 29 ARG CG C 13 24.788 0 . 1 . . . . X 26 ARG CG . 36447 1 245 . 1 . 1 29 29 ARG N N 15 120.413 0 . 1 . . . . X 26 ARG N . 36447 1 246 . 1 . 1 30 30 ASN H H 1 8.547 0 . 1 . . . . X 27 ASN H . 36447 1 247 . 1 . 1 30 30 ASN HA H 1 4.322 0 . 1 . . . . X 27 ASN HA . 36447 1 248 . 1 . 1 30 30 ASN HB2 H 1 3.037 0 . 1 . . . . X 27 ASN HB2 . 36447 1 249 . 1 . 1 30 30 ASN HB3 H 1 2.492 0 . 1 . . . . X 27 ASN HB3 . 36447 1 250 . 1 . 1 30 30 ASN C C 13 176.585 0 . 1 . . . . X 27 ASN C . 36447 1 251 . 1 . 1 30 30 ASN CA C 13 55.924 0.02 . 1 . . . . X 27 ASN CA . 36447 1 252 . 1 . 1 30 30 ASN CB C 13 36.887 0 . 1 . . . . X 27 ASN CB . 36447 1 253 . 1 . 1 30 30 ASN N N 15 119.154 0 . 1 . . . . X 27 ASN N . 36447 1 254 . 1 . 1 31 31 LYS H H 1 7.809 0 . 1 . . . . X 28 LYS H . 36447 1 255 . 1 . 1 31 31 LYS HA H 1 3.984 0 . 1 . . . . X 28 LYS HA . 36447 1 256 . 1 . 1 31 31 LYS HB2 H 1 2.111 0 . 1 . . . . X 28 LYS HB2 . 36447 1 257 . 1 . 1 31 31 LYS HB3 H 1 1.897 0 . 1 . . . . X 28 LYS HB3 . 36447 1 258 . 1 . 1 31 31 LYS HG3 H 1 1.009 0 . 1 . . . . X 28 LYS HG3 . 36447 1 259 . 1 . 1 31 31 LYS HD3 H 1 1.385 0 . 1 . . . . X 28 LYS HD3 . 36447 1 260 . 1 . 1 31 31 LYS HE2 H 1 2.367 0 . 1 . . . . X 28 LYS HE2 . 36447 1 261 . 1 . 1 31 31 LYS HE3 H 1 2.608 0 . 1 . . . . X 28 LYS HE3 . 36447 1 262 . 1 . 1 31 31 LYS C C 13 178.276 0 . 1 . . . . X 28 LYS C . 36447 1 263 . 1 . 1 31 31 LYS CA C 13 59.862 0.04 . 1 . . . . X 28 LYS CA . 36447 1 264 . 1 . 1 31 31 LYS CB C 13 31.794 0 . 1 . . . . X 28 LYS CB . 36447 1 265 . 1 . 1 31 31 LYS CG C 13 21.062 0 . 1 . . . . X 28 LYS CG . 36447 1 266 . 1 . 1 31 31 LYS CD C 13 24.967 0 . 1 . . . . X 28 LYS CD . 36447 1 267 . 1 . 1 31 31 LYS CE C 13 41.192 0 . 1 . . . . X 28 LYS CE . 36447 1 268 . 1 . 1 31 31 LYS N N 15 122.269 0 . 1 . . . . X 28 LYS N . 36447 1 269 . 1 . 1 32 32 LEU H H 1 8.452 0 . 1 . . . . X 29 LEU H . 36447 1 270 . 1 . 1 32 32 LEU HA H 1 4.069 0 . 1 . . . . X 29 LEU HA . 36447 1 271 . 1 . 1 32 32 LEU HB2 H 1 2.071 0 . 1 . . . . X 29 LEU HB2 . 36447 1 272 . 1 . 1 32 32 LEU HB3 H 1 0.923 0 . 1 . . . . X 29 LEU HB3 . 36447 1 273 . 1 . 1 32 32 LEU C C 13 180.627 0 . 1 . . . . X 29 LEU C . 36447 1 274 . 1 . 1 32 32 LEU CA C 13 58.092 0.03 . 1 . . . . X 29 LEU CA . 36447 1 275 . 1 . 1 32 32 LEU CB C 13 42.066 0 . 1 . . . . X 29 LEU CB . 36447 1 276 . 1 . 1 32 32 LEU N N 15 117.919 0 . 1 . . . . X 29 LEU N . 36447 1 277 . 1 . 1 33 33 LEU H H 1 9.244 0 . 1 . . . . X 30 LEU H . 36447 1 278 . 1 . 1 33 33 LEU HA H 1 4.103 0 . 1 . . . . X 30 LEU HA . 36447 1 279 . 1 . 1 33 33 LEU HB2 H 1 1.426 0 . 1 . . . . X 30 LEU HB2 . 36447 1 280 . 1 . 1 33 33 LEU HB3 H 1 2.243 0 . 1 . . . . X 30 LEU HB3 . 36447 1 281 . 1 . 1 33 33 LEU HG H 1 1.764 0 . 1 . . . . X 30 LEU HG . 36447 1 282 . 1 . 1 33 33 LEU HD11 H 1 0.839 0 . 1 . . . . X 30 LEU HD11 . 36447 1 283 . 1 . 1 33 33 LEU HD12 H 1 0.839 0 . 1 . . . . X 30 LEU HD12 . 36447 1 284 . 1 . 1 33 33 LEU HD13 H 1 0.839 0 . 1 . . . . X 30 LEU HD13 . 36447 1 285 . 1 . 1 33 33 LEU HD21 H 1 0.579 0 . 1 . . . . X 30 LEU HD21 . 36447 1 286 . 1 . 1 33 33 LEU HD22 H 1 0.579 0 . 1 . . . . X 30 LEU HD22 . 36447 1 287 . 1 . 1 33 33 LEU HD23 H 1 0.579 0 . 1 . . . . X 30 LEU HD23 . 36447 1 288 . 1 . 1 33 33 LEU C C 13 178.715 0 . 1 . . . . X 30 LEU C . 36447 1 289 . 1 . 1 33 33 LEU CA C 13 57.81 0.03 . 1 . . . . X 30 LEU CA . 36447 1 290 . 1 . 1 33 33 LEU CB C 13 43.461 0 . 1 . . . . X 30 LEU CB . 36447 1 291 . 1 . 1 33 33 LEU CG C 13 26.463 0 . 1 . . . . X 30 LEU CG . 36447 1 292 . 1 . 1 33 33 LEU CD1 C 13 27.536 0 . 1 . . . . X 30 LEU CD1 . 36447 1 293 . 1 . 1 33 33 LEU CD2 C 13 25.645 0 . 1 . . . . X 30 LEU CD2 . 36447 1 294 . 1 . 1 33 33 LEU N N 15 123.435 0 . 1 . . . . X 30 LEU N . 36447 1 295 . 1 . 1 34 34 GLY H H 1 8.702 0 . 1 . . . . X 31 GLY H . 36447 1 296 . 1 . 1 34 34 GLY HA2 H 1 3.785 0 . 1 . . . . X 31 GLY HA2 . 36447 1 297 . 1 . 1 34 34 GLY HA3 H 1 3.992 0 . 1 . . . . X 31 GLY HA3 . 36447 1 298 . 1 . 1 34 34 GLY C C 13 175.194 0 . 1 . . . . X 31 GLY C . 36447 1 299 . 1 . 1 34 34 GLY CA C 13 48 0.01 . 1 . . . . X 31 GLY CA . 36447 1 300 . 1 . 1 34 34 GLY N N 15 107.231 0 . 1 . . . . X 31 GLY N . 36447 1 301 . 1 . 1 35 35 LEU H H 1 8.713 0 . 1 . . . . X 32 LEU H . 36447 1 302 . 1 . 1 35 35 LEU HA H 1 4.175 0 . 1 . . . . X 32 LEU HA . 36447 1 303 . 1 . 1 35 35 LEU HB2 H 1 1.575 0 . 1 . . . . X 32 LEU HB2 . 36447 1 304 . 1 . 1 35 35 LEU HB3 H 1 2.055 0 . 1 . . . . X 32 LEU HB3 . 36447 1 305 . 1 . 1 35 35 LEU HD11 H 1 0.933 0 . 1 . . . . X 32 LEU HD11 . 36447 1 306 . 1 . 1 35 35 LEU HD12 H 1 0.933 0 . 1 . . . . X 32 LEU HD12 . 36447 1 307 . 1 . 1 35 35 LEU HD13 H 1 0.933 0 . 1 . . . . X 32 LEU HD13 . 36447 1 308 . 1 . 1 35 35 LEU HD21 H 1 0.809 0 . 1 . . . . X 32 LEU HD21 . 36447 1 309 . 1 . 1 35 35 LEU HD22 H 1 0.809 0 . 1 . . . . X 32 LEU HD22 . 36447 1 310 . 1 . 1 35 35 LEU HD23 H 1 0.809 0 . 1 . . . . X 32 LEU HD23 . 36447 1 311 . 1 . 1 35 35 LEU C C 13 180.055 0 . 1 . . . . X 32 LEU C . 36447 1 312 . 1 . 1 35 35 LEU CA C 13 58.434 0.03 . 1 . . . . X 32 LEU CA . 36447 1 313 . 1 . 1 35 35 LEU CB C 13 41.63 0 . 1 . . . . X 32 LEU CB . 36447 1 314 . 1 . 1 35 35 LEU CD1 C 13 25.871 0 . 1 . . . . X 32 LEU CD1 . 36447 1 315 . 1 . 1 35 35 LEU CD2 C 13 22.072 0 . 1 . . . . X 32 LEU CD2 . 36447 1 316 . 1 . 1 35 35 LEU N N 15 122.321 0 . 1 . . . . X 32 LEU N . 36447 1 317 . 1 . 1 36 36 TRP H H 1 8.408 0 . 1 . . . . X 33 TRP H . 36447 1 318 . 1 . 1 36 36 TRP HA H 1 4.454 0 . 1 . . . . X 33 TRP HA . 36447 1 319 . 1 . 1 36 36 TRP HB2 H 1 3.546 0 . 1 . . . . X 33 TRP HB2 . 36447 1 320 . 1 . 1 36 36 TRP HB3 H 1 3.875 0 . 1 . . . . X 33 TRP HB3 . 36447 1 321 . 1 . 1 36 36 TRP HD1 H 1 7.534 0 . 1 . . . . X 33 TRP HD1 . 36447 1 322 . 1 . 1 36 36 TRP C C 13 178.691 0 . 1 . . . . X 33 TRP C . 36447 1 323 . 1 . 1 36 36 TRP CA C 13 60.5 0.03 . 1 . . . . X 33 TRP CA . 36447 1 324 . 1 . 1 36 36 TRP CB C 13 27.171 0 . 1 . . . . X 33 TRP CB . 36447 1 325 . 1 . 1 36 36 TRP CD1 C 13 127.142 0 . 1 . . . . X 33 TRP CD1 . 36447 1 326 . 1 . 1 36 36 TRP N N 15 123.38 0 . 1 . . . . X 33 TRP N . 36447 1 327 . 1 . 1 37 37 ALA H H 1 8.968 0 . 1 . . . . X 34 ALA H . 36447 1 328 . 1 . 1 37 37 ALA HA H 1 3.482 0 . 1 . . . . X 34 ALA HA . 36447 1 329 . 1 . 1 37 37 ALA HB1 H 1 1.653 0 . 1 . . . . X 34 ALA HB1 . 36447 1 330 . 1 . 1 37 37 ALA HB2 H 1 1.653 0 . 1 . . . . X 34 ALA HB2 . 36447 1 331 . 1 . 1 37 37 ALA HB3 H 1 1.653 0 . 1 . . . . X 34 ALA HB3 . 36447 1 332 . 1 . 1 37 37 ALA C C 13 178.606 0 . 1 . . . . X 34 ALA C . 36447 1 333 . 1 . 1 37 37 ALA CA C 13 55.087 0.02 . 1 . . . . X 34 ALA CA . 36447 1 334 . 1 . 1 37 37 ALA CB C 13 19.052 0 . 1 . . . . X 34 ALA CB . 36447 1 335 . 1 . 1 37 37 ALA N N 15 122.541 0 . 1 . . . . X 34 ALA N . 36447 1 336 . 1 . 1 38 38 ALA H H 1 8.874 0 . 1 . . . . X 35 ALA H . 36447 1 337 . 1 . 1 38 38 ALA HA H 1 3.399 0 . 1 . . . . X 35 ALA HA . 36447 1 338 . 1 . 1 38 38 ALA HB1 H 1 1.61 0 . 1 . . . . X 35 ALA HB1 . 36447 1 339 . 1 . 1 38 38 ALA HB2 H 1 1.61 0 . 1 . . . . X 35 ALA HB2 . 36447 1 340 . 1 . 1 38 38 ALA HB3 H 1 1.61 0 . 1 . . . . X 35 ALA HB3 . 36447 1 341 . 1 . 1 38 38 ALA C C 13 180.036 0 . 1 . . . . X 35 ALA C . 36447 1 342 . 1 . 1 38 38 ALA CA C 13 54.807 0.03 . 1 . . . . X 35 ALA CA . 36447 1 343 . 1 . 1 38 38 ALA CB C 13 19.238 0 . 1 . . . . X 35 ALA CB . 36447 1 344 . 1 . 1 38 38 ALA N N 15 117.67 0 . 1 . . . . X 35 ALA N . 36447 1 345 . 1 . 1 39 39 GLY H H 1 7.786 0 . 1 . . . . X 36 GLY H . 36447 1 346 . 1 . 1 39 39 GLY HA2 H 1 3.803 0 . 2 . . . . X 36 GLY HA2 . 36447 1 347 . 1 . 1 39 39 GLY HA3 H 1 3.803 0 . 2 . . . . X 36 GLY HA3 . 36447 1 348 . 1 . 1 39 39 GLY C C 13 177.215 0 . 1 . . . . X 36 GLY C . 36447 1 349 . 1 . 1 39 39 GLY CA C 13 46.805 0.01 . 1 . . . . X 36 GLY CA . 36447 1 350 . 1 . 1 39 39 GLY N N 15 103.788 0 . 1 . . . . X 36 GLY N . 36447 1 351 . 1 . 1 40 40 LEU H H 1 7.048 0 . 1 . . . . X 37 LEU H . 36447 1 352 . 1 . 1 40 40 LEU HA H 1 3.933 0 . 1 . . . . X 37 LEU HA . 36447 1 353 . 1 . 1 40 40 LEU HB2 H 1 1.494 0 . 1 . . . . X 37 LEU HB2 . 36447 1 354 . 1 . 1 40 40 LEU HB3 H 1 0.932 0 . 1 . . . . X 37 LEU HB3 . 36447 1 355 . 1 . 1 40 40 LEU HG H 1 1.166 0 . 1 . . . . X 37 LEU HG . 36447 1 356 . 1 . 1 40 40 LEU HD11 H 1 0.027 0 . 1 . . . . X 37 LEU HD11 . 36447 1 357 . 1 . 1 40 40 LEU HD12 H 1 0.027 0 . 1 . . . . X 37 LEU HD12 . 36447 1 358 . 1 . 1 40 40 LEU HD13 H 1 0.027 0 . 1 . . . . X 37 LEU HD13 . 36447 1 359 . 1 . 1 40 40 LEU HD21 H 1 0.61 0 . 1 . . . . X 37 LEU HD21 . 36447 1 360 . 1 . 1 40 40 LEU HD22 H 1 0.61 0 . 1 . . . . X 37 LEU HD22 . 36447 1 361 . 1 . 1 40 40 LEU HD23 H 1 0.61 0 . 1 . . . . X 37 LEU HD23 . 36447 1 362 . 1 . 1 40 40 LEU C C 13 178.618 0 . 1 . . . . X 37 LEU C . 36447 1 363 . 1 . 1 40 40 LEU CA C 13 57.435 0.03 . 1 . . . . X 37 LEU CA . 36447 1 364 . 1 . 1 40 40 LEU CB C 13 41.699 0 . 1 . . . . X 37 LEU CB . 36447 1 365 . 1 . 1 40 40 LEU CG C 13 27.398 0 . 1 . . . . X 37 LEU CG . 36447 1 366 . 1 . 1 40 40 LEU CD1 C 13 25.396 0 . 1 . . . . X 37 LEU CD1 . 36447 1 367 . 1 . 1 40 40 LEU CD2 C 13 22.654 0 . 1 . . . . X 37 LEU CD2 . 36447 1 368 . 1 . 1 40 40 LEU N N 15 123.687 0 . 1 . . . . X 37 LEU N . 36447 1 369 . 1 . 1 41 41 LEU H H 1 7.656 0 . 1 . . . . X 38 LEU H . 36447 1 370 . 1 . 1 41 41 LEU HA H 1 3.857 0 . 1 . . . . X 38 LEU HA . 36447 1 371 . 1 . 1 41 41 LEU HB2 H 1 0.903 0 . 1 . . . . X 38 LEU HB2 . 36447 1 372 . 1 . 1 41 41 LEU HB3 H 1 1.345 0 . 1 . . . . X 38 LEU HB3 . 36447 1 373 . 1 . 1 41 41 LEU HG H 1 1.46 0 . 1 . . . . X 38 LEU HG . 36447 1 374 . 1 . 1 41 41 LEU HD11 H 1 0.392 0 . 1 . . . . X 38 LEU HD11 . 36447 1 375 . 1 . 1 41 41 LEU HD12 H 1 0.392 0 . 1 . . . . X 38 LEU HD12 . 36447 1 376 . 1 . 1 41 41 LEU HD13 H 1 0.392 0 . 1 . . . . X 38 LEU HD13 . 36447 1 377 . 1 . 1 41 41 LEU HD21 H 1 1.13 0 . 1 . . . . X 38 LEU HD21 . 36447 1 378 . 1 . 1 41 41 LEU HD22 H 1 1.13 0 . 1 . . . . X 38 LEU HD22 . 36447 1 379 . 1 . 1 41 41 LEU HD23 H 1 1.13 0 . 1 . . . . X 38 LEU HD23 . 36447 1 380 . 1 . 1 41 41 LEU C C 13 175.054 0 . 1 . . . . X 38 LEU C . 36447 1 381 . 1 . 1 41 41 LEU CA C 13 54.679 0.03 . 1 . . . . X 38 LEU CA . 36447 1 382 . 1 . 1 41 41 LEU CB C 13 43.568 0 . 1 . . . . X 38 LEU CB . 36447 1 383 . 1 . 1 41 41 LEU CG C 13 21.41 0 . 1 . . . . X 38 LEU CG . 36447 1 384 . 1 . 1 41 41 LEU CD1 C 13 25.744 0 . 1 . . . . X 38 LEU CD1 . 36447 1 385 . 1 . 1 41 41 LEU CD2 C 13 21.535 0 . 1 . . . . X 38 LEU CD2 . 36447 1 386 . 1 . 1 41 41 LEU N N 15 116.367 0 . 1 . . . . X 38 LEU N . 36447 1 387 . 1 . 1 42 42 ALA H H 1 7.663 0 . 1 . . . . X 39 ALA H . 36447 1 388 . 1 . 1 42 42 ALA HA H 1 3.976 0 . 1 . . . . X 39 ALA HA . 36447 1 389 . 1 . 1 42 42 ALA HB1 H 1 1.324 0 . 1 . . . . X 39 ALA HB1 . 36447 1 390 . 1 . 1 42 42 ALA HB2 H 1 1.324 0 . 1 . . . . X 39 ALA HB2 . 36447 1 391 . 1 . 1 42 42 ALA HB3 H 1 1.324 0 . 1 . . . . X 39 ALA HB3 . 36447 1 392 . 1 . 1 42 42 ALA C C 13 177.358 0 . 1 . . . . X 39 ALA C . 36447 1 393 . 1 . 1 42 42 ALA CA C 13 52.569 0.02 . 1 . . . . X 39 ALA CA . 36447 1 394 . 1 . 1 42 42 ALA CB C 13 16.169 0 . 1 . . . . X 39 ALA CB . 36447 1 395 . 1 . 1 42 42 ALA N N 15 121.139 0 . 1 . . . . X 39 ALA N . 36447 1 396 . 1 . 1 43 43 LYS H H 1 7.703 0 . 1 . . . . X 40 LYS H . 36447 1 397 . 1 . 1 43 43 LYS HA H 1 4.125 0.01 . 1 . . . . X 40 LYS HA . 36447 1 398 . 1 . 1 43 43 LYS HB2 H 1 1.712 0 . 1 . . . . X 40 LYS HB2 . 36447 1 399 . 1 . 1 43 43 LYS HB3 H 1 1.348 0 . 1 . . . . X 40 LYS HB3 . 36447 1 400 . 1 . 1 43 43 LYS HG2 H 1 0.861 0 . 1 . . . . X 40 LYS HG2 . 36447 1 401 . 1 . 1 43 43 LYS HG3 H 1 1.118 0 . 1 . . . . X 40 LYS HG3 . 36447 1 402 . 1 . 1 43 43 LYS HD2 H 1 2.01 0 . 1 . . . . X 40 LYS HD2 . 36447 1 403 . 1 . 1 43 43 LYS HD3 H 1 1.599 0 . 1 . . . . X 40 LYS HD3 . 36447 1 404 . 1 . 1 43 43 LYS HE2 H 1 2.596 0 . 1 . . . . X 40 LYS HE2 . 36447 1 405 . 1 . 1 43 43 LYS HE3 H 1 2.543 0 . 1 . . . . X 40 LYS HE3 . 36447 1 406 . 1 . 1 43 43 LYS C C 13 177.963 0 . 1 . . . . X 40 LYS C . 36447 1 407 . 1 . 1 43 43 LYS CA C 13 54.748 0.02 . 1 . . . . X 40 LYS CA . 36447 1 408 . 1 . 1 43 43 LYS CB C 13 31.558 0 . 1 . . . . X 40 LYS CB . 36447 1 409 . 1 . 1 43 43 LYS CG C 13 24.38 0 . 1 . . . . X 40 LYS CG . 36447 1 410 . 1 . 1 43 43 LYS CD C 13 29.203 0 . 1 . . . . X 40 LYS CD . 36447 1 411 . 1 . 1 43 43 LYS CE C 13 41.95 0 . 1 . . . . X 40 LYS CE . 36447 1 412 . 1 . 1 43 43 LYS N N 15 115.859 0 . 1 . . . . X 40 LYS N . 36447 1 413 . 1 . 1 44 44 SER H H 1 8.709 0 . 1 . . . . X 41 SER H . 36447 1 414 . 1 . 1 44 44 SER HA H 1 4.177 0 . 1 . . . . X 41 SER HA . 36447 1 415 . 1 . 1 44 44 SER HB3 H 1 3.937 0 . 1 . . . . X 41 SER HB3 . 36447 1 416 . 1 . 1 44 44 SER C C 13 174.579 0 . 1 . . . . X 41 SER C . 36447 1 417 . 1 . 1 44 44 SER CA C 13 60.5 0.04 . 1 . . . . X 41 SER CA . 36447 1 418 . 1 . 1 44 44 SER CB C 13 62.978 0 . 1 . . . . X 41 SER CB . 36447 1 419 . 1 . 1 44 44 SER N N 15 118.228 0 . 1 . . . . X 41 SER N . 36447 1 420 . 1 . 1 45 45 ASP H H 1 8.123 0 . 1 . . . . X 42 ASP H . 36447 1 421 . 1 . 1 45 45 ASP HA H 1 5.118 0 . 1 . . . . X 42 ASP HA . 36447 1 422 . 1 . 1 45 45 ASP CA C 13 50.372 0 . 1 . . . . X 42 ASP CA . 36447 1 423 . 1 . 1 45 45 ASP N N 15 118.416 0 . 1 . . . . X 42 ASP N . 36447 1 424 . 1 . 1 46 46 PRO HA H 1 3.949 0 . 1 . . . . X 43 PRO HA . 36447 1 425 . 1 . 1 46 46 PRO HB2 H 1 2.035 0 . 1 . . . . X 43 PRO HB2 . 36447 1 426 . 1 . 1 46 46 PRO HB3 H 1 2.273 0 . 1 . . . . X 43 PRO HB3 . 36447 1 427 . 1 . 1 46 46 PRO HG3 H 1 1.605 0 . 1 . . . . X 43 PRO HG3 . 36447 1 428 . 1 . 1 46 46 PRO HD2 H 1 3.97 0 . 1 . . . . X 43 PRO HD2 . 36447 1 429 . 1 . 1 46 46 PRO HD3 H 1 3.489 0 . 1 . . . . X 43 PRO HD3 . 36447 1 430 . 1 . 1 46 46 PRO C C 13 177.857 0 . 1 . . . . X 43 PRO C . 36447 1 431 . 1 . 1 46 46 PRO CA C 13 65.414 0 . 1 . . . . X 43 PRO CA . 36447 1 432 . 1 . 1 46 46 PRO CB C 13 32.808 0 . 1 . . . . X 43 PRO CB . 36447 1 433 . 1 . 1 46 46 PRO CG C 13 28.787 0 . 1 . . . . X 43 PRO CG . 36447 1 434 . 1 . 1 46 46 PRO CD C 13 50.751 0 . 1 . . . . X 43 PRO CD . 36447 1 435 . 1 . 1 47 47 GLU H H 1 8.1 0 . 1 . . . . X 44 GLU H . 36447 1 436 . 1 . 1 47 47 GLU HA H 1 3.924 0 . 1 . . . . X 44 GLU HA . 36447 1 437 . 1 . 1 47 47 GLU HB2 H 1 2.086 0 . 1 . . . . X 44 GLU HB2 . 36447 1 438 . 1 . 1 47 47 GLU HB3 H 1 1.676 0 . 1 . . . . X 44 GLU HB3 . 36447 1 439 . 1 . 1 47 47 GLU HG3 H 1 2.298 0 . 1 . . . . X 44 GLU HG3 . 36447 1 440 . 1 . 1 47 47 GLU C C 13 179.295 0 . 1 . . . . X 44 GLU C . 36447 1 441 . 1 . 1 47 47 GLU CA C 13 59.744 0.04 . 1 . . . . X 44 GLU CA . 36447 1 442 . 1 . 1 47 47 GLU CB C 13 28.81 0 . 1 . . . . X 44 GLU CB . 36447 1 443 . 1 . 1 47 47 GLU CG C 13 36.215 0 . 1 . . . . X 44 GLU CG . 36447 1 444 . 1 . 1 47 47 GLU N N 15 116.631 0 . 1 . . . . X 44 GLU N . 36447 1 445 . 1 . 1 48 48 ALA H H 1 7.645 0 . 1 . . . . X 45 ALA H . 36447 1 446 . 1 . 1 48 48 ALA HA H 1 4.144 0 . 1 . . . . X 45 ALA HA . 36447 1 447 . 1 . 1 48 48 ALA HB1 H 1 1.446 0 . 1 . . . . X 45 ALA HB1 . 36447 1 448 . 1 . 1 48 48 ALA HB2 H 1 1.446 0 . 1 . . . . X 45 ALA HB2 . 36447 1 449 . 1 . 1 48 48 ALA HB3 H 1 1.446 0 . 1 . . . . X 45 ALA HB3 . 36447 1 450 . 1 . 1 48 48 ALA C C 13 180.889 0 . 1 . . . . X 45 ALA C . 36447 1 451 . 1 . 1 48 48 ALA CA C 13 54.693 0.02 . 1 . . . . X 45 ALA CA . 36447 1 452 . 1 . 1 48 48 ALA CB C 13 18.046 0 . 1 . . . . X 45 ALA CB . 36447 1 453 . 1 . 1 48 48 ALA N N 15 123.058 0 . 1 . . . . X 45 ALA N . 36447 1 454 . 1 . 1 49 49 TYR H H 1 7.524 0 . 1 . . . . X 46 TYR H . 36447 1 455 . 1 . 1 49 49 TYR HA H 1 4.153 0 . 1 . . . . X 46 TYR HA . 36447 1 456 . 1 . 1 49 49 TYR HB2 H 1 3.07 0 . 1 . . . . X 46 TYR HB2 . 36447 1 457 . 1 . 1 49 49 TYR HB3 H 1 2.886 0 . 1 . . . . X 46 TYR HB3 . 36447 1 458 . 1 . 1 49 49 TYR HD1 H 1 7.073 0 . 3 . . . . X 46 TYR HD1 . 36447 1 459 . 1 . 1 49 49 TYR HD2 H 1 7.073 0 . 3 . . . . X 46 TYR HD2 . 36447 1 460 . 1 . 1 49 49 TYR HE1 H 1 6.605 0 . 3 . . . . X 46 TYR HE1 . 36447 1 461 . 1 . 1 49 49 TYR HE2 H 1 6.605 0 . 3 . . . . X 46 TYR HE2 . 36447 1 462 . 1 . 1 49 49 TYR C C 13 177.772 0 . 1 . . . . X 46 TYR C . 36447 1 463 . 1 . 1 49 49 TYR CA C 13 61.979 0.03 . 1 . . . . X 46 TYR CA . 36447 1 464 . 1 . 1 49 49 TYR CB C 13 38.093 0 . 1 . . . . X 46 TYR CB . 36447 1 465 . 1 . 1 49 49 TYR CD1 C 13 132.866 0 . 1 . . . . X 46 TYR CD1 . 36447 1 466 . 1 . 1 49 49 TYR CE1 C 13 117.828 0 . 1 . . . . X 46 TYR CE1 . 36447 1 467 . 1 . 1 49 49 TYR N N 15 119.564 0 . 1 . . . . X 46 TYR N . 36447 1 468 . 1 . 1 50 50 ALA H H 1 8.672 0 . 1 . . . . X 47 ALA H . 36447 1 469 . 1 . 1 50 50 ALA HA H 1 3.862 0 . 1 . . . . X 47 ALA HA . 36447 1 470 . 1 . 1 50 50 ALA HB1 H 1 1.61 0 . 1 . . . . X 47 ALA HB1 . 36447 1 471 . 1 . 1 50 50 ALA HB2 H 1 1.61 0 . 1 . . . . X 47 ALA HB2 . 36447 1 472 . 1 . 1 50 50 ALA HB3 H 1 1.61 0 . 1 . . . . X 47 ALA HB3 . 36447 1 473 . 1 . 1 50 50 ALA C C 13 179.545 0 . 1 . . . . X 47 ALA C . 36447 1 474 . 1 . 1 50 50 ALA CA C 13 55.911 0.03 . 1 . . . . X 47 ALA CA . 36447 1 475 . 1 . 1 50 50 ALA CB C 13 18.032 0 . 1 . . . . X 47 ALA CB . 36447 1 476 . 1 . 1 50 50 ALA N N 15 120.068 0 . 1 . . . . X 47 ALA N . 36447 1 477 . 1 . 1 51 51 SER H H 1 8.111 0 . 1 . . . . X 48 SER H . 36447 1 478 . 1 . 1 51 51 SER HA H 1 4.154 0 . 1 . . . . X 48 SER HA . 36447 1 479 . 1 . 1 51 51 SER HB2 H 1 4.044 0 . 1 . . . . X 48 SER HB2 . 36447 1 480 . 1 . 1 51 51 SER HB3 H 1 3.963 0 . 1 . . . . X 48 SER HB3 . 36447 1 481 . 1 . 1 51 51 SER C C 13 176.425 0 . 1 . . . . X 48 SER C . 36447 1 482 . 1 . 1 51 51 SER CA C 13 62.048 0.03 . 1 . . . . X 48 SER CA . 36447 1 483 . 1 . 1 51 51 SER CB C 13 62.73 0 . 1 . . . . X 48 SER CB . 36447 1 484 . 1 . 1 51 51 SER N N 15 112.705 0 . 1 . . . . X 48 SER N . 36447 1 485 . 1 . 1 52 52 GLU H H 1 7.608 0 . 1 . . . . X 49 GLU H . 36447 1 486 . 1 . 1 52 52 GLU HA H 1 4.025 0 . 1 . . . . X 49 GLU HA . 36447 1 487 . 1 . 1 52 52 GLU HB2 H 1 2.037 0 . 1 . . . . X 49 GLU HB2 . 36447 1 488 . 1 . 1 52 52 GLU HB3 H 1 2.144 0 . 1 . . . . X 49 GLU HB3 . 36447 1 489 . 1 . 1 52 52 GLU HG3 H 1 2.429 0 . 1 . . . . X 49 GLU HG3 . 36447 1 490 . 1 . 1 52 52 GLU C C 13 178.85 0 . 1 . . . . X 49 GLU C . 36447 1 491 . 1 . 1 52 52 GLU CA C 13 58.935 0.03 . 1 . . . . X 49 GLU CA . 36447 1 492 . 1 . 1 52 52 GLU CB C 13 29.289 0 . 1 . . . . X 49 GLU CB . 36447 1 493 . 1 . 1 52 52 GLU CG C 13 34.273 0 . 1 . . . . X 49 GLU CG . 36447 1 494 . 1 . 1 52 52 GLU N N 15 122.346 0 . 1 . . . . X 49 GLU N . 36447 1 495 . 1 . 1 53 53 ILE H H 1 7.373 0 . 1 . . . . X 50 ILE H . 36447 1 496 . 1 . 1 53 53 ILE HA H 1 3.66 0 . 1 . . . . X 50 ILE HA . 36447 1 497 . 1 . 1 53 53 ILE HB H 1 2.196 0 . 1 . . . . X 50 ILE HB . 36447 1 498 . 1 . 1 53 53 ILE HG12 H 1 1.08 0 . 1 . . . . X 50 ILE HG12 . 36447 1 499 . 1 . 1 53 53 ILE HG13 H 1 1.334 0 . 1 . . . . X 50 ILE HG13 . 36447 1 500 . 1 . 1 53 53 ILE HG21 H 1 0.815 0 . 1 . . . . X 50 ILE HG21 . 36447 1 501 . 1 . 1 53 53 ILE HG22 H 1 0.815 0 . 1 . . . . X 50 ILE HG22 . 36447 1 502 . 1 . 1 53 53 ILE HG23 H 1 0.815 0 . 1 . . . . X 50 ILE HG23 . 36447 1 503 . 1 . 1 53 53 ILE HD11 H 1 0.503 0 . 1 . . . . X 50 ILE HD11 . 36447 1 504 . 1 . 1 53 53 ILE HD12 H 1 0.503 0 . 1 . . . . X 50 ILE HD12 . 36447 1 505 . 1 . 1 53 53 ILE HD13 H 1 0.503 0 . 1 . . . . X 50 ILE HD13 . 36447 1 506 . 1 . 1 53 53 ILE C C 13 176.991 0 . 1 . . . . X 50 ILE C . 36447 1 507 . 1 . 1 53 53 ILE CA C 13 62.106 0.03 . 1 . . . . X 50 ILE CA . 36447 1 508 . 1 . 1 53 53 ILE CB C 13 35.081 0 . 1 . . . . X 50 ILE CB . 36447 1 509 . 1 . 1 53 53 ILE CG1 C 13 27.983 0 . 1 . . . . X 50 ILE CG1 . 36447 1 510 . 1 . 1 53 53 ILE CG2 C 13 18.452 0 . 1 . . . . X 50 ILE CG2 . 36447 1 511 . 1 . 1 53 53 ILE CD1 C 13 10.237 0 . 1 . . . . X 50 ILE CD1 . 36447 1 512 . 1 . 1 53 53 ILE N N 15 119.361 0 . 1 . . . . X 50 ILE N . 36447 1 513 . 1 . 1 54 54 VAL H H 1 7.763 0 . 1 . . . . X 51 VAL H . 36447 1 514 . 1 . 1 54 54 VAL HA H 1 3.63 0 . 1 . . . . X 51 VAL HA . 36447 1 515 . 1 . 1 54 54 VAL HB H 1 2.136 0 . 1 . . . . X 51 VAL HB . 36447 1 516 . 1 . 1 54 54 VAL HG21 H 1 1.001 0 . 1 . . . . X 51 VAL HG21 . 36447 1 517 . 1 . 1 54 54 VAL HG22 H 1 1.001 0 . 1 . . . . X 51 VAL HG22 . 36447 1 518 . 1 . 1 54 54 VAL HG23 H 1 1.001 0 . 1 . . . . X 51 VAL HG23 . 36447 1 519 . 1 . 1 54 54 VAL C C 13 177.826 0 . 1 . . . . X 51 VAL C . 36447 1 520 . 1 . 1 54 54 VAL CA C 13 65.373 0.04 . 1 . . . . X 51 VAL CA . 36447 1 521 . 1 . 1 54 54 VAL CB C 13 32.045 0 . 1 . . . . X 51 VAL CB . 36447 1 522 . 1 . 1 54 54 VAL CG2 C 13 21.098 0 . 1 . . . . X 51 VAL CG2 . 36447 1 523 . 1 . 1 54 54 VAL N N 15 118.3 0 . 1 . . . . X 51 VAL N . 36447 1 524 . 1 . 1 55 55 ALA H H 1 7.646 0 . 1 . . . . X 52 ALA H . 36447 1 525 . 1 . 1 55 55 ALA HA H 1 4.141 0.01 . 1 . . . . X 52 ALA HA . 36447 1 526 . 1 . 1 55 55 ALA HB1 H 1 1.405 0 . 1 . . . . X 52 ALA HB1 . 36447 1 527 . 1 . 1 55 55 ALA HB2 H 1 1.405 0 . 1 . . . . X 52 ALA HB2 . 36447 1 528 . 1 . 1 55 55 ALA HB3 H 1 1.405 0 . 1 . . . . X 52 ALA HB3 . 36447 1 529 . 1 . 1 55 55 ALA C C 13 178.373 0 . 1 . . . . X 52 ALA C . 36447 1 530 . 1 . 1 55 55 ALA CA C 13 53.453 0.02 . 1 . . . . X 52 ALA CA . 36447 1 531 . 1 . 1 55 55 ALA CB C 13 18.587 0 . 1 . . . . X 52 ALA CB . 36447 1 532 . 1 . 1 55 55 ALA N N 15 120.216 0 . 1 . . . . X 52 ALA N . 36447 1 533 . 1 . 1 56 56 ALA H H 1 7.669 0 . 1 . . . . X 53 ALA H . 36447 1 534 . 1 . 1 56 56 ALA HA H 1 4.116 0 . 1 . . . . X 53 ALA HA . 36447 1 535 . 1 . 1 56 56 ALA HB1 H 1 1.344 0 . 1 . . . . X 53 ALA HB1 . 36447 1 536 . 1 . 1 56 56 ALA HB2 H 1 1.344 0 . 1 . . . . X 53 ALA HB2 . 36447 1 537 . 1 . 1 56 56 ALA HB3 H 1 1.344 0 . 1 . . . . X 53 ALA HB3 . 36447 1 538 . 1 . 1 56 56 ALA C C 13 177.381 0 . 1 . . . . X 53 ALA C . 36447 1 539 . 1 . 1 56 56 ALA CA C 13 53.221 0.02 . 1 . . . . X 53 ALA CA . 36447 1 540 . 1 . 1 56 56 ALA CB C 13 18.281 0 . 1 . . . . X 53 ALA CB . 36447 1 541 . 1 . 1 56 56 ALA N N 15 120.571 0 . 1 . . . . X 53 ALA N . 36447 1 542 . 1 . 1 57 57 ASP H H 1 7.413 0 . 1 . . . . X 54 ASP H . 36447 1 543 . 1 . 1 57 57 ASP HA H 1 4.615 0 . 1 . . . . X 54 ASP HA . 36447 1 544 . 1 . 1 57 57 ASP HB2 H 1 2.622 0 . 1 . . . . X 54 ASP HB2 . 36447 1 545 . 1 . 1 57 57 ASP HB3 H 1 2.351 0 . 1 . . . . X 54 ASP HB3 . 36447 1 546 . 1 . 1 57 57 ASP C C 13 176.177 0 . 1 . . . . X 54 ASP C . 36447 1 547 . 1 . 1 57 57 ASP CA C 13 54.055 0.02 . 1 . . . . X 54 ASP CA . 36447 1 548 . 1 . 1 57 57 ASP CB C 13 41.202 0 . 1 . . . . X 54 ASP CB . 36447 1 549 . 1 . 1 57 57 ASP N N 15 116.031 0 . 1 . . . . X 54 ASP N . 36447 1 550 . 1 . 1 58 58 PHE H H 1 7.907 0 . 1 . . . . X 55 PHE H . 36447 1 551 . 1 . 1 58 58 PHE HA H 1 4.618 0 . 1 . . . . X 55 PHE HA . 36447 1 552 . 1 . 1 58 58 PHE HB2 H 1 3.038 0 . 1 . . . . X 55 PHE HB2 . 36447 1 553 . 1 . 1 58 58 PHE HB3 H 1 3.256 0 . 1 . . . . X 55 PHE HB3 . 36447 1 554 . 1 . 1 58 58 PHE HD1 H 1 7.27 0 . 3 . . . . X 55 PHE HD1 . 36447 1 555 . 1 . 1 58 58 PHE HD2 H 1 7.27 0 . 3 . . . . X 55 PHE HD2 . 36447 1 556 . 1 . 1 58 58 PHE C C 13 176.242 0 . 1 . . . . X 55 PHE C . 36447 1 557 . 1 . 1 58 58 PHE CA C 13 57.8 0.02 . 1 . . . . X 55 PHE CA . 36447 1 558 . 1 . 1 58 58 PHE CB C 13 39.16 0 . 1 . . . . X 55 PHE CB . 36447 1 559 . 1 . 1 58 58 PHE CD1 C 13 131.631 0 . 1 . . . . X 55 PHE CD1 . 36447 1 560 . 1 . 1 58 58 PHE N N 15 119.435 0 . 1 . . . . X 55 PHE N . 36447 1 561 . 1 . 1 59 59 GLU H H 1 8.221 0 . 1 . . . . X 56 GLU H . 36447 1 562 . 1 . 1 59 59 GLU HA H 1 4.138 0 . 1 . . . . X 56 GLU HA . 36447 1 563 . 1 . 1 59 59 GLU C C 13 176.74 0 . 1 . . . . X 56 GLU C . 36447 1 564 . 1 . 1 59 59 GLU CA C 13 57.576 0.02 . 1 . . . . X 56 GLU CA . 36447 1 565 . 1 . 1 59 59 GLU CB C 13 29.713 0 . 1 . . . . X 56 GLU CB . 36447 1 566 . 1 . 1 59 59 GLU N N 15 120.42 0 . 1 . . . . X 56 GLU N . 36447 1 567 . 1 . 1 60 60 GLU H H 1 8.413 0 . 1 . . . . X 57 GLU H . 36447 1 568 . 1 . 1 60 60 GLU HA H 1 4.228 0 . 1 . . . . X 57 GLU HA . 36447 1 569 . 1 . 1 60 60 GLU HB2 H 1 1.992 0 . 1 . . . . X 57 GLU HB2 . 36447 1 570 . 1 . 1 60 60 GLU HB3 H 1 1.418 0 . 1 . . . . X 57 GLU HB3 . 36447 1 571 . 1 . 1 60 60 GLU HG3 H 1 2.264 0 . 1 . . . . X 57 GLU HG3 . 36447 1 572 . 1 . 1 60 60 GLU C C 13 176.636 0 . 1 . . . . X 57 GLU C . 36447 1 573 . 1 . 1 60 60 GLU CA C 13 57.164 0.03 . 1 . . . . X 57 GLU CA . 36447 1 574 . 1 . 1 60 60 GLU CB C 13 30.248 0 . 1 . . . . X 57 GLU CB . 36447 1 575 . 1 . 1 60 60 GLU CG C 13 36.257 0 . 1 . . . . X 57 GLU CG . 36447 1 576 . 1 . 1 60 60 GLU N N 15 119.824 0 . 1 . . . . X 57 GLU N . 36447 1 577 . 1 . 1 61 61 ALA H H 1 8.359 0 . 1 . . . . X 58 ALA H . 36447 1 578 . 1 . 1 61 61 ALA HA H 1 4.285 0 . 1 . . . . X 58 ALA HA . 36447 1 579 . 1 . 1 61 61 ALA HB1 H 1 1.382 0 . 1 . . . . X 58 ALA HB1 . 36447 1 580 . 1 . 1 61 61 ALA HB2 H 1 1.382 0 . 1 . . . . X 58 ALA HB2 . 36447 1 581 . 1 . 1 61 61 ALA HB3 H 1 1.382 0 . 1 . . . . X 58 ALA HB3 . 36447 1 582 . 1 . 1 61 61 ALA C C 13 178.784 0 . 1 . . . . X 58 ALA C . 36447 1 583 . 1 . 1 61 61 ALA CA C 13 53.042 0.03 . 1 . . . . X 58 ALA CA . 36447 1 584 . 1 . 1 61 61 ALA CB C 13 18.738 0 . 1 . . . . X 58 ALA CB . 36447 1 585 . 1 . 1 61 61 ALA N N 15 123.445 0 . 1 . . . . X 58 ALA N . 36447 1 586 . 1 . 1 62 62 GLY H H 1 8.345 0 . 1 . . . . X 59 GLY H . 36447 1 587 . 1 . 1 62 62 GLY HA2 H 1 3.834 0 . 1 . . . . X 59 GLY HA2 . 36447 1 588 . 1 . 1 62 62 GLY HA3 H 1 4.002 0 . 1 . . . . X 59 GLY HA3 . 36447 1 589 . 1 . 1 62 62 GLY CA C 13 45.686 0 . 1 . . . . X 59 GLY CA . 36447 1 590 . 1 . 1 62 62 GLY N N 15 108.374 0 . 1 . . . . X 59 GLY N . 36447 1 591 . 1 . 1 64 64 GLU HA H 1 4.087 0 . 1 . . . . X 61 GLU HA . 36447 1 592 . 1 . 1 64 64 GLU C C 13 177.688 0 . 1 . . . . X 61 GLU C . 36447 1 593 . 1 . 1 64 64 GLU CA C 13 58.058 0 . 1 . . . . X 61 GLU CA . 36447 1 594 . 1 . 1 65 65 ASP H H 1 8.427 0 . 1 . . . . X 62 ASP H . 36447 1 595 . 1 . 1 65 65 ASP HA H 1 4.405 0 . 1 . . . . X 62 ASP HA . 36447 1 596 . 1 . 1 65 65 ASP HB3 H 1 2.835 0 . 1 . . . . X 62 ASP HB3 . 36447 1 597 . 1 . 1 65 65 ASP C C 13 178.681 0 . 1 . . . . X 62 ASP C . 36447 1 598 . 1 . 1 65 65 ASP CA C 13 56.293 0.04 . 1 . . . . X 62 ASP CA . 36447 1 599 . 1 . 1 65 65 ASP CB C 13 40.29 0 . 1 . . . . X 62 ASP CB . 36447 1 600 . 1 . 1 65 65 ASP N N 15 120.131 0 . 1 . . . . X 62 ASP N . 36447 1 601 . 1 . 1 66 66 VAL H H 1 8.117 0 . 1 . . . . X 63 VAL H . 36447 1 602 . 1 . 1 66 66 VAL HA H 1 3.501 0 . 1 . . . . X 63 VAL HA . 36447 1 603 . 1 . 1 66 66 VAL HB H 1 2.097 0 . 1 . . . . X 63 VAL HB . 36447 1 604 . 1 . 1 66 66 VAL HG11 H 1 0.906 0 . 1 . . . . X 63 VAL HG11 . 36447 1 605 . 1 . 1 66 66 VAL HG12 H 1 0.906 0 . 1 . . . . X 63 VAL HG12 . 36447 1 606 . 1 . 1 66 66 VAL HG13 H 1 0.906 0 . 1 . . . . X 63 VAL HG13 . 36447 1 607 . 1 . 1 66 66 VAL HG21 H 1 1.34 0 . 1 . . . . X 63 VAL HG21 . 36447 1 608 . 1 . 1 66 66 VAL HG22 H 1 1.34 0 . 1 . . . . X 63 VAL HG22 . 36447 1 609 . 1 . 1 66 66 VAL HG23 H 1 1.34 0 . 1 . . . . X 63 VAL HG23 . 36447 1 610 . 1 . 1 66 66 VAL C C 13 176.642 0 . 1 . . . . X 63 VAL C . 36447 1 611 . 1 . 1 66 66 VAL CA C 13 66.516 0.02 . 1 . . . . X 63 VAL CA . 36447 1 612 . 1 . 1 66 66 VAL CB C 13 31.549 0 . 1 . . . . X 63 VAL CB . 36447 1 613 . 1 . 1 66 66 VAL CG1 C 13 22.56 0 . 1 . . . . X 63 VAL CG1 . 36447 1 614 . 1 . 1 66 66 VAL CG2 C 13 21.352 0 . 1 . . . . X 63 VAL CG2 . 36447 1 615 . 1 . 1 66 66 VAL N N 15 122.148 0 . 1 . . . . X 63 VAL N . 36447 1 616 . 1 . 1 67 67 VAL H H 1 7.424 0 . 1 . . . . X 64 VAL H . 36447 1 617 . 1 . 1 67 67 VAL HA H 1 3.36 0 . 1 . . . . X 64 VAL HA . 36447 1 618 . 1 . 1 67 67 VAL HB H 1 2.18 0 . 1 . . . . X 64 VAL HB . 36447 1 619 . 1 . 1 67 67 VAL HG11 H 1 1.032 0 . 1 . . . . X 64 VAL HG11 . 36447 1 620 . 1 . 1 67 67 VAL HG12 H 1 1.032 0 . 1 . . . . X 64 VAL HG12 . 36447 1 621 . 1 . 1 67 67 VAL HG13 H 1 1.032 0 . 1 . . . . X 64 VAL HG13 . 36447 1 622 . 1 . 1 67 67 VAL C C 13 177.173 0 . 1 . . . . X 64 VAL C . 36447 1 623 . 1 . 1 67 67 VAL CA C 13 67.223 0.06 . 1 . . . . X 64 VAL CA . 36447 1 624 . 1 . 1 67 67 VAL CB C 13 31.527 0 . 1 . . . . X 64 VAL CB . 36447 1 625 . 1 . 1 67 67 VAL CG1 C 13 23.652 0 . 1 . . . . X 64 VAL CG1 . 36447 1 626 . 1 . 1 67 67 VAL N N 15 118.901 0 . 1 . . . . X 64 VAL N . 36447 1 627 . 1 . 1 68 68 ARG H H 1 7.928 0 . 1 . . . . X 65 ARG H . 36447 1 628 . 1 . 1 68 68 ARG HA H 1 3.974 0 . 1 . . . . X 65 ARG HA . 36447 1 629 . 1 . 1 68 68 ARG HB2 H 1 1.89 0 . 1 . . . . X 65 ARG HB2 . 36447 1 630 . 1 . 1 68 68 ARG HB3 H 1 2.151 0 . 1 . . . . X 65 ARG HB3 . 36447 1 631 . 1 . 1 68 68 ARG C C 13 179.159 0 . 1 . . . . X 65 ARG C . 36447 1 632 . 1 . 1 68 68 ARG CA C 13 59.093 0.03 . 1 . . . . X 65 ARG CA . 36447 1 633 . 1 . 1 68 68 ARG CB C 13 29.994 0 . 1 . . . . X 65 ARG CB . 36447 1 634 . 1 . 1 68 68 ARG N N 15 116.754 0 . 1 . . . . X 65 ARG N . 36447 1 635 . 1 . 1 69 69 LYS H H 1 7.925 0 . 1 . . . . X 66 LYS H . 36447 1 636 . 1 . 1 69 69 LYS HA H 1 3.954 0 . 1 . . . . X 66 LYS HA . 36447 1 637 . 1 . 1 69 69 LYS HB2 H 1 1.971 0 . 1 . . . . X 66 LYS HB2 . 36447 1 638 . 1 . 1 69 69 LYS HB3 H 1 1.874 0 . 1 . . . . X 66 LYS HB3 . 36447 1 639 . 1 . 1 69 69 LYS C C 13 177.886 0 . 1 . . . . X 66 LYS C . 36447 1 640 . 1 . 1 69 69 LYS CA C 13 59.759 0.02 . 1 . . . . X 66 LYS CA . 36447 1 641 . 1 . 1 69 69 LYS CB C 13 32.406 0 . 1 . . . . X 66 LYS CB . 36447 1 642 . 1 . 1 69 69 LYS N N 15 122.416 0 . 1 . . . . X 66 LYS N . 36447 1 643 . 1 . 1 70 70 ILE H H 1 7.915 0 . 1 . . . . X 67 ILE H . 36447 1 644 . 1 . 1 70 70 ILE HA H 1 3.476 0 . 1 . . . . X 67 ILE HA . 36447 1 645 . 1 . 1 70 70 ILE HB H 1 1.687 0 . 1 . . . . X 67 ILE HB . 36447 1 646 . 1 . 1 70 70 ILE HG12 H 1 1.126 0 . 1 . . . . X 67 ILE HG12 . 36447 1 647 . 1 . 1 70 70 ILE HG13 H 1 1.802 0 . 1 . . . . X 67 ILE HG13 . 36447 1 648 . 1 . 1 70 70 ILE HG21 H 1 0.293 0 . 1 . . . . X 67 ILE HG21 . 36447 1 649 . 1 . 1 70 70 ILE HG22 H 1 0.293 0 . 1 . . . . X 67 ILE HG22 . 36447 1 650 . 1 . 1 70 70 ILE HG23 H 1 0.293 0 . 1 . . . . X 67 ILE HG23 . 36447 1 651 . 1 . 1 70 70 ILE HD11 H 1 0.829 0 . 1 . . . . X 67 ILE HD11 . 36447 1 652 . 1 . 1 70 70 ILE HD12 H 1 0.829 0 . 1 . . . . X 67 ILE HD12 . 36447 1 653 . 1 . 1 70 70 ILE HD13 H 1 0.829 0 . 1 . . . . X 67 ILE HD13 . 36447 1 654 . 1 . 1 70 70 ILE C C 13 177.298 0 . 1 . . . . X 67 ILE C . 36447 1 655 . 1 . 1 70 70 ILE CA C 13 65.131 0.03 . 1 . . . . X 67 ILE CA . 36447 1 656 . 1 . 1 70 70 ILE CB C 13 37.467 0 . 1 . . . . X 67 ILE CB . 36447 1 657 . 1 . 1 70 70 ILE CG1 C 13 29.114 0 . 1 . . . . X 67 ILE CG1 . 36447 1 658 . 1 . 1 70 70 ILE CG2 C 13 17.82 0 . 1 . . . . X 67 ILE CG2 . 36447 1 659 . 1 . 1 70 70 ILE CD1 C 13 13.435 0 . 1 . . . . X 67 ILE CD1 . 36447 1 660 . 1 . 1 70 70 ILE N N 15 118.169 0 . 1 . . . . X 67 ILE N . 36447 1 661 . 1 . 1 71 71 LYS H H 1 8.723 0 . 1 . . . . X 68 LYS H . 36447 1 662 . 1 . 1 71 71 LYS HA H 1 3.861 0 . 1 . . . . X 68 LYS HA . 36447 1 663 . 1 . 1 71 71 LYS HB2 H 1 2.148 0 . 1 . . . . X 68 LYS HB2 . 36447 1 664 . 1 . 1 71 71 LYS HB3 H 1 1.702 0 . 1 . . . . X 68 LYS HB3 . 36447 1 665 . 1 . 1 71 71 LYS HD2 H 1 2.104 0 . 1 . . . . X 68 LYS HD2 . 36447 1 666 . 1 . 1 71 71 LYS HD3 H 1 1.557 0 . 1 . . . . X 68 LYS HD3 . 36447 1 667 . 1 . 1 71 71 LYS C C 13 177.889 0 . 1 . . . . X 68 LYS C . 36447 1 668 . 1 . 1 71 71 LYS CA C 13 59.006 0.04 . 1 . . . . X 68 LYS CA . 36447 1 669 . 1 . 1 71 71 LYS CB C 13 32.236 0 . 1 . . . . X 68 LYS CB . 36447 1 670 . 1 . 1 71 71 LYS CD C 13 32.13 0 . 1 . . . . X 68 LYS CD . 36447 1 671 . 1 . 1 71 71 LYS N N 15 119.147 0 . 1 . . . . X 68 LYS N . 36447 1 672 . 1 . 1 72 72 THR H H 1 8.348 0 . 1 . . . . X 69 THR H . 36447 1 673 . 1 . 1 72 72 THR HA H 1 4.021 0 . 1 . . . . X 69 THR HA . 36447 1 674 . 1 . 1 72 72 THR HB H 1 4.435 0 . 1 . . . . X 69 THR HB . 36447 1 675 . 1 . 1 72 72 THR HG21 H 1 1.322 0 . 1 . . . . X 69 THR HG21 . 36447 1 676 . 1 . 1 72 72 THR HG22 H 1 1.322 0 . 1 . . . . X 69 THR HG22 . 36447 1 677 . 1 . 1 72 72 THR HG23 H 1 1.322 0 . 1 . . . . X 69 THR HG23 . 36447 1 678 . 1 . 1 72 72 THR C C 13 177.195 0 . 1 . . . . X 69 THR C . 36447 1 679 . 1 . 1 72 72 THR CA C 13 67.096 0.04 . 1 . . . . X 69 THR CA . 36447 1 680 . 1 . 1 72 72 THR CB C 13 68.93 0 . 1 . . . . X 69 THR CB . 36447 1 681 . 1 . 1 72 72 THR CG2 C 13 21.346 0 . 1 . . . . X 69 THR CG2 . 36447 1 682 . 1 . 1 72 72 THR N N 15 114.837 0 . 1 . . . . X 69 THR N . 36447 1 683 . 1 . 1 73 73 ASP H H 1 7.967 0 . 1 . . . . X 70 ASP H . 36447 1 684 . 1 . 1 73 73 ASP HA H 1 4.537 0 . 1 . . . . X 70 ASP HA . 36447 1 685 . 1 . 1 73 73 ASP HB2 H 1 2.613 0 . 1 . . . . X 70 ASP HB2 . 36447 1 686 . 1 . 1 73 73 ASP HB3 H 1 2.916 0 . 1 . . . . X 70 ASP HB3 . 36447 1 687 . 1 . 1 73 73 ASP C C 13 179.896 0 . 1 . . . . X 70 ASP C . 36447 1 688 . 1 . 1 73 73 ASP CA C 13 57.709 0.03 . 1 . . . . X 70 ASP CA . 36447 1 689 . 1 . 1 73 73 ASP CB C 13 39.247 0 . 1 . . . . X 70 ASP CB . 36447 1 690 . 1 . 1 73 73 ASP N N 15 124.16 0 . 1 . . . . X 70 ASP N . 36447 1 691 . 1 . 1 74 74 PHE H H 1 9.217 0 . 1 . . . . X 71 PHE H . 36447 1 692 . 1 . 1 74 74 PHE HA H 1 4.405 0 . 1 . . . . X 71 PHE HA . 36447 1 693 . 1 . 1 74 74 PHE HB2 H 1 3.714 0 . 1 . . . . X 71 PHE HB2 . 36447 1 694 . 1 . 1 74 74 PHE HB3 H 1 3.512 0 . 1 . . . . X 71 PHE HB3 . 36447 1 695 . 1 . 1 74 74 PHE HE1 H 1 6.992 0 . 3 . . . . X 71 PHE HE1 . 36447 1 696 . 1 . 1 74 74 PHE HE2 H 1 6.992 0 . 3 . . . . X 71 PHE HE2 . 36447 1 697 . 1 . 1 74 74 PHE HZ H 1 7.008 0 . 1 . . . . X 71 PHE HZ . 36447 1 698 . 1 . 1 74 74 PHE C C 13 178.892 0 . 1 . . . . X 71 PHE C . 36447 1 699 . 1 . 1 74 74 PHE CA C 13 58.808 0.04 . 1 . . . . X 71 PHE CA . 36447 1 700 . 1 . 1 74 74 PHE CB C 13 36.271 0 . 1 . . . . X 71 PHE CB . 36447 1 701 . 1 . 1 74 74 PHE CE1 C 13 130.681 0 . 1 . . . . X 71 PHE CE1 . 36447 1 702 . 1 . 1 74 74 PHE CZ C 13 129.56 0 . 1 . . . . X 71 PHE CZ . 36447 1 703 . 1 . 1 74 74 PHE N N 15 122.522 0 . 1 . . . . X 71 PHE N . 36447 1 704 . 1 . 1 75 75 ASP H H 1 9.203 0 . 1 . . . . X 72 ASP H . 36447 1 705 . 1 . 1 75 75 ASP HA H 1 4.47 0 . 1 . . . . X 72 ASP HA . 36447 1 706 . 1 . 1 75 75 ASP HB2 H 1 2.73 0 . 1 . . . . X 72 ASP HB2 . 36447 1 707 . 1 . 1 75 75 ASP HB3 H 1 2.947 0 . 1 . . . . X 72 ASP HB3 . 36447 1 708 . 1 . 1 75 75 ASP C C 13 179.921 0 . 1 . . . . X 72 ASP C . 36447 1 709 . 1 . 1 75 75 ASP CA C 13 57.499 0.03 . 1 . . . . X 72 ASP CA . 36447 1 710 . 1 . 1 75 75 ASP CB C 13 39.636 0 . 1 . . . . X 72 ASP CB . 36447 1 711 . 1 . 1 75 75 ASP N N 15 121.251 0 . 1 . . . . X 72 ASP N . 36447 1 712 . 1 . 1 76 76 ALA H H 1 8.042 0 . 1 . . . . X 73 ALA H . 36447 1 713 . 1 . 1 76 76 ALA HA H 1 4.204 0 . 1 . . . . X 73 ALA HA . 36447 1 714 . 1 . 1 76 76 ALA HB1 H 1 1.596 0 . 1 . . . . X 73 ALA HB1 . 36447 1 715 . 1 . 1 76 76 ALA HB2 H 1 1.596 0 . 1 . . . . X 73 ALA HB2 . 36447 1 716 . 1 . 1 76 76 ALA HB3 H 1 1.596 0 . 1 . . . . X 73 ALA HB3 . 36447 1 717 . 1 . 1 76 76 ALA C C 13 178.737 0 . 1 . . . . X 73 ALA C . 36447 1 718 . 1 . 1 76 76 ALA CA C 13 54.658 0.03 . 1 . . . . X 73 ALA CA . 36447 1 719 . 1 . 1 76 76 ALA CB C 13 18.112 0 . 1 . . . . X 73 ALA CB . 36447 1 720 . 1 . 1 76 76 ALA N N 15 121.995 0 . 1 . . . . X 73 ALA N . 36447 1 721 . 1 . 1 77 77 ALA H H 1 7.485 0 . 1 . . . . X 74 ALA H . 36447 1 722 . 1 . 1 77 77 ALA HA H 1 4.468 0 . 1 . . . . X 74 ALA HA . 36447 1 723 . 1 . 1 77 77 ALA HB1 H 1 1.48 0 . 1 . . . . X 74 ALA HB1 . 36447 1 724 . 1 . 1 77 77 ALA HB2 H 1 1.48 0 . 1 . . . . X 74 ALA HB2 . 36447 1 725 . 1 . 1 77 77 ALA HB3 H 1 1.48 0 . 1 . . . . X 74 ALA HB3 . 36447 1 726 . 1 . 1 77 77 ALA C C 13 177.597 0 . 1 . . . . X 74 ALA C . 36447 1 727 . 1 . 1 77 77 ALA CA C 13 51.806 0.02 . 1 . . . . X 74 ALA CA . 36447 1 728 . 1 . 1 77 77 ALA CB C 13 20.777 0 . 1 . . . . X 74 ALA CB . 36447 1 729 . 1 . 1 77 77 ALA N N 15 117.845 0 . 1 . . . . X 74 ALA N . 36447 1 730 . 1 . 1 78 78 GLY H H 1 7.855 0 . 1 . . . . X 75 GLY H . 36447 1 731 . 1 . 1 78 78 GLY HA2 H 1 3.863 0 . 1 . . . . X 75 GLY HA2 . 36447 1 732 . 1 . 1 78 78 GLY HA3 H 1 4.038 0 . 1 . . . . X 75 GLY HA3 . 36447 1 733 . 1 . 1 78 78 GLY C C 13 174.638 0 . 1 . . . . X 75 GLY C . 36447 1 734 . 1 . 1 78 78 GLY CA C 13 46.289 0 . 1 . . . . X 75 GLY CA . 36447 1 735 . 1 . 1 78 78 GLY N N 15 108.323 0 . 1 . . . . X 75 GLY N . 36447 1 736 . 1 . 1 79 79 VAL H H 1 8.199 0 . 1 . . . . X 76 VAL H . 36447 1 737 . 1 . 1 79 79 VAL HA H 1 3.81 0 . 1 . . . . X 76 VAL HA . 36447 1 738 . 1 . 1 79 79 VAL HB H 1 1.559 0 . 1 . . . . X 76 VAL HB . 36447 1 739 . 1 . 1 79 79 VAL HG11 H 1 0.185 0 . 1 . . . . X 76 VAL HG11 . 36447 1 740 . 1 . 1 79 79 VAL HG12 H 1 0.185 0 . 1 . . . . X 76 VAL HG12 . 36447 1 741 . 1 . 1 79 79 VAL HG13 H 1 0.185 0 . 1 . . . . X 76 VAL HG13 . 36447 1 742 . 1 . 1 79 79 VAL HG21 H 1 0.626 0 . 1 . . . . X 76 VAL HG21 . 36447 1 743 . 1 . 1 79 79 VAL HG22 H 1 0.626 0 . 1 . . . . X 76 VAL HG22 . 36447 1 744 . 1 . 1 79 79 VAL HG23 H 1 0.626 0 . 1 . . . . X 76 VAL HG23 . 36447 1 745 . 1 . 1 79 79 VAL C C 13 175.798 0 . 1 . . . . X 76 VAL C . 36447 1 746 . 1 . 1 79 79 VAL CA C 13 62.185 0.04 . 1 . . . . X 76 VAL CA . 36447 1 747 . 1 . 1 79 79 VAL CB C 13 31.782 0 . 1 . . . . X 76 VAL CB . 36447 1 748 . 1 . 1 79 79 VAL CG1 C 13 20.795 0 . 1 . . . . X 76 VAL CG1 . 36447 1 749 . 1 . 1 79 79 VAL CG2 C 13 20.955 0 . 1 . . . . X 76 VAL CG2 . 36447 1 750 . 1 . 1 79 79 VAL N N 15 122.162 0 . 1 . . . . X 76 VAL N . 36447 1 751 . 1 . 1 80 80 ALA H H 1 8.643 0 . 1 . . . . X 77 ALA H . 36447 1 752 . 1 . 1 80 80 ALA HA H 1 4.34 0 . 1 . . . . X 77 ALA HA . 36447 1 753 . 1 . 1 80 80 ALA HB1 H 1 1.29 0 . 1 . . . . X 77 ALA HB1 . 36447 1 754 . 1 . 1 80 80 ALA HB2 H 1 1.29 0 . 1 . . . . X 77 ALA HB2 . 36447 1 755 . 1 . 1 80 80 ALA HB3 H 1 1.29 0 . 1 . . . . X 77 ALA HB3 . 36447 1 756 . 1 . 1 80 80 ALA C C 13 175.712 0 . 1 . . . . X 77 ALA C . 36447 1 757 . 1 . 1 80 80 ALA CA C 13 52.105 0.03 . 1 . . . . X 77 ALA CA . 36447 1 758 . 1 . 1 80 80 ALA CB C 13 17.378 0 . 1 . . . . X 77 ALA CB . 36447 1 759 . 1 . 1 80 80 ALA N N 15 133.994 0 . 1 . . . . X 77 ALA N . 36447 1 760 . 1 . 1 81 81 ILE H H 1 7.527 0 . 1 . . . . X 78 ILE H . 36447 1 761 . 1 . 1 81 81 ILE HA H 1 4.39 0 . 1 . . . . X 78 ILE HA . 36447 1 762 . 1 . 1 81 81 ILE HB H 1 1.527 0 . 1 . . . . X 78 ILE HB . 36447 1 763 . 1 . 1 81 81 ILE HG12 H 1 1.164 0 . 1 . . . . X 78 ILE HG12 . 36447 1 764 . 1 . 1 81 81 ILE HG13 H 1 1.069 0 . 1 . . . . X 78 ILE HG13 . 36447 1 765 . 1 . 1 81 81 ILE HG21 H 1 1.078 0 . 1 . . . . X 78 ILE HG21 . 36447 1 766 . 1 . 1 81 81 ILE HG22 H 1 1.078 0 . 1 . . . . X 78 ILE HG22 . 36447 1 767 . 1 . 1 81 81 ILE HG23 H 1 1.078 0 . 1 . . . . X 78 ILE HG23 . 36447 1 768 . 1 . 1 81 81 ILE HD11 H 1 0.617 0 . 1 . . . . X 78 ILE HD11 . 36447 1 769 . 1 . 1 81 81 ILE HD12 H 1 0.617 0 . 1 . . . . X 78 ILE HD12 . 36447 1 770 . 1 . 1 81 81 ILE HD13 H 1 0.617 0 . 1 . . . . X 78 ILE HD13 . 36447 1 771 . 1 . 1 81 81 ILE C C 13 174.479 0 . 1 . . . . X 78 ILE C . 36447 1 772 . 1 . 1 81 81 ILE CA C 13 60.125 0.02 . 1 . . . . X 78 ILE CA . 36447 1 773 . 1 . 1 81 81 ILE CB C 13 40.269 0 . 1 . . . . X 78 ILE CB . 36447 1 774 . 1 . 1 81 81 ILE CG1 C 13 28.145 0 . 1 . . . . X 78 ILE CG1 . 36447 1 775 . 1 . 1 81 81 ILE CG2 C 13 17.983 0 . 1 . . . . X 78 ILE CG2 . 36447 1 776 . 1 . 1 81 81 ILE CD1 C 13 12.793 0 . 1 . . . . X 78 ILE CD1 . 36447 1 777 . 1 . 1 81 81 ILE N N 15 124.85 0 . 1 . . . . X 78 ILE N . 36447 1 778 . 1 . 1 82 82 SER H H 1 8.988 0 . 1 . . . . X 79 SER H . 36447 1 779 . 1 . 1 82 82 SER HA H 1 4.633 0 . 1 . . . . X 79 SER HA . 36447 1 780 . 1 . 1 82 82 SER HB2 H 1 4.041 0 . 1 . . . . X 79 SER HB2 . 36447 1 781 . 1 . 1 82 82 SER HB3 H 1 4.798 0 . 1 . . . . X 79 SER HB3 . 36447 1 782 . 1 . 1 82 82 SER C C 13 175.16 0 . 1 . . . . X 79 SER C . 36447 1 783 . 1 . 1 82 82 SER CA C 13 57.143 0.03 . 1 . . . . X 79 SER CA . 36447 1 784 . 1 . 1 82 82 SER CB C 13 66.319 0 . 1 . . . . X 79 SER CB . 36447 1 785 . 1 . 1 82 82 SER N N 15 122.553 0 . 1 . . . . X 79 SER N . 36447 1 786 . 1 . 1 83 83 GLU H H 1 9.474 0 . 1 . . . . X 80 GLU H . 36447 1 787 . 1 . 1 83 83 GLU HA H 1 3.904 0 . 1 . . . . X 80 GLU HA . 36447 1 788 . 1 . 1 83 83 GLU HB3 H 1 2.053 0 . 1 . . . . X 80 GLU HB3 . 36447 1 789 . 1 . 1 83 83 GLU C C 13 178.616 0 . 1 . . . . X 80 GLU C . 36447 1 790 . 1 . 1 83 83 GLU CA C 13 61.219 0.05 . 1 . . . . X 80 GLU CA . 36447 1 791 . 1 . 1 83 83 GLU CB C 13 29.398 0 . 1 . . . . X 80 GLU CB . 36447 1 792 . 1 . 1 83 83 GLU N N 15 120.294 0 . 1 . . . . X 80 GLU N . 36447 1 793 . 1 . 1 84 84 ASP H H 1 8.415 0 . 1 . . . . X 81 ASP H . 36447 1 794 . 1 . 1 84 84 ASP HA H 1 4.394 0 . 1 . . . . X 81 ASP HA . 36447 1 795 . 1 . 1 84 84 ASP HB2 H 1 2.576 0 . 1 . . . . X 81 ASP HB2 . 36447 1 796 . 1 . 1 84 84 ASP HB3 H 1 2.206 0 . 1 . . . . X 81 ASP HB3 . 36447 1 797 . 1 . 1 84 84 ASP C C 13 178.092 0 . 1 . . . . X 81 ASP C . 36447 1 798 . 1 . 1 84 84 ASP CA C 13 57.916 0.01 . 1 . . . . X 81 ASP CA . 36447 1 799 . 1 . 1 84 84 ASP CB C 13 40.343 0 . 1 . . . . X 81 ASP CB . 36447 1 800 . 1 . 1 84 84 ASP N N 15 117.745 0 . 1 . . . . X 81 ASP N . 36447 1 801 . 1 . 1 85 85 ASP H H 1 7.998 0 . 1 . . . . X 82 ASP H . 36447 1 802 . 1 . 1 85 85 ASP HA H 1 4.42 0 . 1 . . . . X 82 ASP HA . 36447 1 803 . 1 . 1 85 85 ASP HB2 H 1 3.264 0 . 1 . . . . X 82 ASP HB2 . 36447 1 804 . 1 . 1 85 85 ASP HB3 H 1 2.676 0 . 1 . . . . X 82 ASP HB3 . 36447 1 805 . 1 . 1 85 85 ASP C C 13 180.142 0 . 1 . . . . X 82 ASP C . 36447 1 806 . 1 . 1 85 85 ASP CA C 13 57.479 0.03 . 1 . . . . X 82 ASP CA . 36447 1 807 . 1 . 1 85 85 ASP CB C 13 40.736 0 . 1 . . . . X 82 ASP CB . 36447 1 808 . 1 . 1 85 85 ASP N N 15 119.886 0 . 1 . . . . X 82 ASP N . 36447 1 809 . 1 . 1 86 86 ILE H H 1 8 0 . 1 . . . . X 83 ILE H . 36447 1 810 . 1 . 1 86 86 ILE HA H 1 3.631 0 . 1 . . . . X 83 ILE HA . 36447 1 811 . 1 . 1 86 86 ILE HB H 1 2.214 0 . 1 . . . . X 83 ILE HB . 36447 1 812 . 1 . 1 86 86 ILE HG12 H 1 0.932 0 . 1 . . . . X 83 ILE HG12 . 36447 1 813 . 1 . 1 86 86 ILE HG13 H 1 1.696 0 . 1 . . . . X 83 ILE HG13 . 36447 1 814 . 1 . 1 86 86 ILE HG21 H 1 1.067 0 . 1 . . . . X 83 ILE HG21 . 36447 1 815 . 1 . 1 86 86 ILE HG22 H 1 1.067 0 . 1 . . . . X 83 ILE HG22 . 36447 1 816 . 1 . 1 86 86 ILE HG23 H 1 1.067 0 . 1 . . . . X 83 ILE HG23 . 36447 1 817 . 1 . 1 86 86 ILE HD11 H 1 1.482 0 . 1 . . . . X 83 ILE HD11 . 36447 1 818 . 1 . 1 86 86 ILE HD12 H 1 1.482 0 . 1 . . . . X 83 ILE HD12 . 36447 1 819 . 1 . 1 86 86 ILE HD13 H 1 1.482 0 . 1 . . . . X 83 ILE HD13 . 36447 1 820 . 1 . 1 86 86 ILE CA C 13 66.084 0 . 1 . . . . X 83 ILE CA . 36447 1 821 . 1 . 1 86 86 ILE CB C 13 38.112 0 . 1 . . . . X 83 ILE CB . 36447 1 822 . 1 . 1 86 86 ILE CG1 C 13 27.446 0 . 1 . . . . X 83 ILE CG1 . 36447 1 823 . 1 . 1 86 86 ILE CG2 C 13 18.717 0 . 1 . . . . X 83 ILE CG2 . 36447 1 824 . 1 . 1 86 86 ILE CD1 C 13 10.625 0 . 1 . . . . X 83 ILE CD1 . 36447 1 825 . 1 . 1 86 86 ILE N N 15 122.056 0 . 1 . . . . X 83 ILE N . 36447 1 826 . 1 . 1 87 87 ARG HA H 1 3.945 0 . 1 . . . . X 84 ARG HA . 36447 1 827 . 1 . 1 87 87 ARG HB2 H 1 1.893 0 . 1 . . . . X 84 ARG HB2 . 36447 1 828 . 1 . 1 87 87 ARG HB3 H 1 1.634 0 . 1 . . . . X 84 ARG HB3 . 36447 1 829 . 1 . 1 87 87 ARG HD2 H 1 3.276 0 . 1 . . . . X 84 ARG HD2 . 36447 1 830 . 1 . 1 87 87 ARG HD3 H 1 3.226 0 . 1 . . . . X 84 ARG HD3 . 36447 1 831 . 1 . 1 87 87 ARG HE H 1 8.25 0 . 1 . . . . X 84 ARG HE . 36447 1 832 . 1 . 1 87 87 ARG C C 13 179.523 0 . 1 . . . . X 84 ARG C . 36447 1 833 . 1 . 1 87 87 ARG CA C 13 60.842 0 . 1 . . . . X 84 ARG CA . 36447 1 834 . 1 . 1 87 87 ARG CB C 13 29.854 0 . 1 . . . . X 84 ARG CB . 36447 1 835 . 1 . 1 87 87 ARG CD C 13 43.077 0 . 1 . . . . X 84 ARG CD . 36447 1 836 . 1 . 1 87 87 ARG NE N 15 84.485 0 . 1 . . . . X 84 ARG NE . 36447 1 837 . 1 . 1 88 88 VAL H H 1 8.178 0 . 1 . . . . X 85 VAL H . 36447 1 838 . 1 . 1 88 88 VAL HA H 1 3.633 0.01 . 1 . . . . X 85 VAL HA . 36447 1 839 . 1 . 1 88 88 VAL HB H 1 2.098 0 . 1 . . . . X 85 VAL HB . 36447 1 840 . 1 . 1 88 88 VAL HG11 H 1 1.081 0 . 1 . . . . X 85 VAL HG11 . 36447 1 841 . 1 . 1 88 88 VAL HG12 H 1 1.081 0 . 1 . . . . X 85 VAL HG12 . 36447 1 842 . 1 . 1 88 88 VAL HG13 H 1 1.081 0 . 1 . . . . X 85 VAL HG13 . 36447 1 843 . 1 . 1 88 88 VAL HG21 H 1 0.882 0 . 1 . . . . X 85 VAL HG21 . 36447 1 844 . 1 . 1 88 88 VAL HG22 H 1 0.882 0 . 1 . . . . X 85 VAL HG22 . 36447 1 845 . 1 . 1 88 88 VAL HG23 H 1 0.882 0 . 1 . . . . X 85 VAL HG23 . 36447 1 846 . 1 . 1 88 88 VAL C C 13 178.433 0 . 1 . . . . X 85 VAL C . 36447 1 847 . 1 . 1 88 88 VAL CA C 13 66.866 0.05 . 1 . . . . X 85 VAL CA . 36447 1 848 . 1 . 1 88 88 VAL CB C 13 31.72 0 . 1 . . . . X 85 VAL CB . 36447 1 849 . 1 . 1 88 88 VAL CG1 C 13 23.185 0 . 1 . . . . X 85 VAL CG1 . 36447 1 850 . 1 . 1 88 88 VAL CG2 C 13 21.168 0 . 1 . . . . X 85 VAL CG2 . 36447 1 851 . 1 . 1 88 88 VAL N N 15 119.423 0 . 1 . . . . X 85 VAL N . 36447 1 852 . 1 . 1 89 89 ARG H H 1 7.666 0 . 1 . . . . X 86 ARG H . 36447 1 853 . 1 . 1 89 89 ARG HA H 1 3.824 0 . 1 . . . . X 86 ARG HA . 36447 1 854 . 1 . 1 89 89 ARG HB2 H 1 1.314 0 . 1 . . . . X 86 ARG HB2 . 36447 1 855 . 1 . 1 89 89 ARG HB3 H 1 1.961 0 . 1 . . . . X 86 ARG HB3 . 36447 1 856 . 1 . 1 89 89 ARG HG3 H 1 0.653 0 . 1 . . . . X 86 ARG HG3 . 36447 1 857 . 1 . 1 89 89 ARG HE H 1 8.245 0 . 1 . . . . X 86 ARG HE . 36447 1 858 . 1 . 1 89 89 ARG C C 13 178.672 0 . 1 . . . . X 86 ARG C . 36447 1 859 . 1 . 1 89 89 ARG CA C 13 58.045 0.03 . 1 . . . . X 86 ARG CA . 36447 1 860 . 1 . 1 89 89 ARG CB C 13 28.997 0 . 1 . . . . X 86 ARG CB . 36447 1 861 . 1 . 1 89 89 ARG CG C 13 25.162 0 . 1 . . . . X 86 ARG CG . 36447 1 862 . 1 . 1 89 89 ARG N N 15 121.288 0 . 1 . . . . X 86 ARG N . 36447 1 863 . 1 . 1 89 89 ARG NE N 15 84.539 0 . 1 . . . . X 86 ARG NE . 36447 1 864 . 1 . 1 90 90 MET H H 1 8.427 0 . 1 . . . . X 87 MET H . 36447 1 865 . 1 . 1 90 90 MET HA H 1 3.635 0 . 1 . . . . X 87 MET HA . 36447 1 866 . 1 . 1 90 90 MET HB2 H 1 2.263 0 . 1 . . . . X 87 MET HB2 . 36447 1 867 . 1 . 1 90 90 MET HB3 H 1 2.154 0 . 1 . . . . X 87 MET HB3 . 36447 1 868 . 1 . 1 90 90 MET HG3 H 1 2.694 0 . 1 . . . . X 87 MET HG3 . 36447 1 869 . 1 . 1 90 90 MET HE1 H 1 1.864 0 . 1 . . . . X 87 MET HE1 . 36447 1 870 . 1 . 1 90 90 MET HE2 H 1 1.864 0 . 1 . . . . X 87 MET HE2 . 36447 1 871 . 1 . 1 90 90 MET HE3 H 1 1.864 0 . 1 . . . . X 87 MET HE3 . 36447 1 872 . 1 . 1 90 90 MET C C 13 178.497 0 . 1 . . . . X 87 MET C . 36447 1 873 . 1 . 1 90 90 MET CA C 13 60.653 0.03 . 1 . . . . X 87 MET CA . 36447 1 874 . 1 . 1 90 90 MET CB C 13 33.013 0 . 1 . . . . X 87 MET CB . 36447 1 875 . 1 . 1 90 90 MET CG C 13 34.082 0 . 1 . . . . X 87 MET CG . 36447 1 876 . 1 . 1 90 90 MET CE C 13 16.455 0 . 1 . . . . X 87 MET CE . 36447 1 877 . 1 . 1 90 90 MET N N 15 115.898 0 . 1 . . . . X 87 MET N . 36447 1 878 . 1 . 1 91 91 ILE H H 1 7.583 0 . 1 . . . . X 88 ILE H . 36447 1 879 . 1 . 1 91 91 ILE HA H 1 3.927 0 . 1 . . . . X 88 ILE HA . 36447 1 880 . 1 . 1 91 91 ILE HB H 1 2.107 0 . 1 . . . . X 88 ILE HB . 36447 1 881 . 1 . 1 91 91 ILE HG12 H 1 1.677 0 . 1 . . . . X 88 ILE HG12 . 36447 1 882 . 1 . 1 91 91 ILE HG13 H 1 1.348 0 . 1 . . . . X 88 ILE HG13 . 36447 1 883 . 1 . 1 91 91 ILE HG21 H 1 1.014 0 . 1 . . . . X 88 ILE HG21 . 36447 1 884 . 1 . 1 91 91 ILE HG22 H 1 1.014 0 . 1 . . . . X 88 ILE HG22 . 36447 1 885 . 1 . 1 91 91 ILE HG23 H 1 1.014 0 . 1 . . . . X 88 ILE HG23 . 36447 1 886 . 1 . 1 91 91 ILE HD11 H 1 0.859 0 . 1 . . . . X 88 ILE HD11 . 36447 1 887 . 1 . 1 91 91 ILE HD12 H 1 0.859 0 . 1 . . . . X 88 ILE HD12 . 36447 1 888 . 1 . 1 91 91 ILE HD13 H 1 0.859 0 . 1 . . . . X 88 ILE HD13 . 36447 1 889 . 1 . 1 91 91 ILE C C 13 178.648 0 . 1 . . . . X 88 ILE C . 36447 1 890 . 1 . 1 91 91 ILE CA C 13 63.532 0.03 . 1 . . . . X 88 ILE CA . 36447 1 891 . 1 . 1 91 91 ILE CB C 13 37.423 0 . 1 . . . . X 88 ILE CB . 36447 1 892 . 1 . 1 91 91 ILE CG1 C 13 28.822 0 . 1 . . . . X 88 ILE CG1 . 36447 1 893 . 1 . 1 91 91 ILE CG2 C 13 17.736 0 . 1 . . . . X 88 ILE CG2 . 36447 1 894 . 1 . 1 91 91 ILE CD1 C 13 12.646 0 . 1 . . . . X 88 ILE CD1 . 36447 1 895 . 1 . 1 91 91 ILE N N 15 121.467 0 . 1 . . . . X 88 ILE N . 36447 1 896 . 1 . 1 92 92 GLU H H 1 8.353 0 . 1 . . . . X 89 GLU H . 36447 1 897 . 1 . 1 92 92 GLU HA H 1 4.04 0 . 1 . . . . X 89 GLU HA . 36447 1 898 . 1 . 1 92 92 GLU HB2 H 1 1.931 0 . 1 . . . . X 89 GLU HB2 . 36447 1 899 . 1 . 1 92 92 GLU HB3 H 1 1.672 0 . 1 . . . . X 89 GLU HB3 . 36447 1 900 . 1 . 1 92 92 GLU HG2 H 1 2.189 0 . 1 . . . . X 89 GLU HG2 . 36447 1 901 . 1 . 1 92 92 GLU HG3 H 1 2.453 0 . 1 . . . . X 89 GLU HG3 . 36447 1 902 . 1 . 1 92 92 GLU C C 13 180.766 0 . 1 . . . . X 89 GLU C . 36447 1 903 . 1 . 1 92 92 GLU CA C 13 59.585 0.03 . 1 . . . . X 89 GLU CA . 36447 1 904 . 1 . 1 92 92 GLU CB C 13 29.672 0 . 1 . . . . X 89 GLU CB . 36447 1 905 . 1 . 1 92 92 GLU CG C 13 36.279 0 . 1 . . . . X 89 GLU CG . 36447 1 906 . 1 . 1 92 92 GLU N N 15 122.935 0 . 1 . . . . X 89 GLU N . 36447 1 907 . 1 . 1 93 93 LEU H H 1 8.64 0 . 1 . . . . X 90 LEU H . 36447 1 908 . 1 . 1 93 93 LEU HA H 1 4.182 0 . 1 . . . . X 90 LEU HA . 36447 1 909 . 1 . 1 93 93 LEU HB3 H 1 1.457 0 . 1 . . . . X 90 LEU HB3 . 36447 1 910 . 1 . 1 93 93 LEU C C 13 178.561 0 . 1 . . . . X 90 LEU C . 36447 1 911 . 1 . 1 93 93 LEU CA C 13 56.636 0.04 . 1 . . . . X 90 LEU CA . 36447 1 912 . 1 . 1 93 93 LEU CB C 13 42.678 0 . 1 . . . . X 90 LEU CB . 36447 1 913 . 1 . 1 93 93 LEU N N 15 116.694 0 . 1 . . . . X 90 LEU N . 36447 1 914 . 1 . 1 94 94 LEU H H 1 7.671 0 . 1 . . . . X 91 LEU H . 36447 1 915 . 1 . 1 94 94 LEU HA H 1 3.981 0 . 1 . . . . X 91 LEU HA . 36447 1 916 . 1 . 1 94 94 LEU HB2 H 1 1.953 0 . 1 . . . . X 91 LEU HB2 . 36447 1 917 . 1 . 1 94 94 LEU HB3 H 1 1.455 0 . 1 . . . . X 91 LEU HB3 . 36447 1 918 . 1 . 1 94 94 LEU HG H 1 1.231 0 . 1 . . . . X 91 LEU HG . 36447 1 919 . 1 . 1 94 94 LEU HD11 H 1 0.7 0 . 1 . . . . X 91 LEU HD11 . 36447 1 920 . 1 . 1 94 94 LEU HD12 H 1 0.7 0 . 1 . . . . X 91 LEU HD12 . 36447 1 921 . 1 . 1 94 94 LEU HD13 H 1 0.7 0 . 1 . . . . X 91 LEU HD13 . 36447 1 922 . 1 . 1 94 94 LEU HD21 H 1 1.751 0 . 1 . . . . X 91 LEU HD21 . 36447 1 923 . 1 . 1 94 94 LEU HD22 H 1 1.751 0 . 1 . . . . X 91 LEU HD22 . 36447 1 924 . 1 . 1 94 94 LEU HD23 H 1 1.751 0 . 1 . . . . X 91 LEU HD23 . 36447 1 925 . 1 . 1 94 94 LEU C C 13 177.788 0 . 1 . . . . X 91 LEU C . 36447 1 926 . 1 . 1 94 94 LEU CA C 13 57.859 0.03 . 1 . . . . X 91 LEU CA . 36447 1 927 . 1 . 1 94 94 LEU CB C 13 41.162 0 . 1 . . . . X 91 LEU CB . 36447 1 928 . 1 . 1 94 94 LEU CG C 13 26.485 0 . 1 . . . . X 91 LEU CG . 36447 1 929 . 1 . 1 94 94 LEU CD1 C 13 25.627 0 . 1 . . . . X 91 LEU CD1 . 36447 1 930 . 1 . 1 94 94 LEU N N 15 123.576 0 . 1 . . . . X 91 LEU N . 36447 1 931 . 1 . 1 95 95 SER H H 1 7.711 0 . 1 . . . . X 92 SER H . 36447 1 932 . 1 . 1 95 95 SER HA H 1 4.155 0 . 1 . . . . X 92 SER HA . 36447 1 933 . 1 . 1 95 95 SER HB3 H 1 4.117 0 . 1 . . . . X 92 SER HB3 . 36447 1 934 . 1 . 1 95 95 SER C C 13 177.472 0 . 1 . . . . X 92 SER C . 36447 1 935 . 1 . 1 95 95 SER CA C 13 62.103 0.01 . 1 . . . . X 92 SER CA . 36447 1 936 . 1 . 1 95 95 SER CB C 13 62.661 0 . 1 . . . . X 92 SER CB . 36447 1 937 . 1 . 1 95 95 SER N N 15 113.073 0 . 1 . . . . X 92 SER N . 36447 1 938 . 1 . 1 96 96 GLU H H 1 7.503 0 . 1 . . . . X 93 GLU H . 36447 1 939 . 1 . 1 96 96 GLU HA H 1 4.103 0 . 1 . . . . X 93 GLU HA . 36447 1 940 . 1 . 1 96 96 GLU HB2 H 1 2.056 0 . 1 . . . . X 93 GLU HB2 . 36447 1 941 . 1 . 1 96 96 GLU HG2 H 1 2.203 0 . 1 . . . . X 93 GLU HG2 . 36447 1 942 . 1 . 1 96 96 GLU HG3 H 1 2.301 0 . 1 . . . . X 93 GLU HG3 . 36447 1 943 . 1 . 1 96 96 GLU C C 13 177.984 0 . 1 . . . . X 93 GLU C . 36447 1 944 . 1 . 1 96 96 GLU CA C 13 59.303 0.03 . 1 . . . . X 93 GLU CA . 36447 1 945 . 1 . 1 96 96 GLU CB C 13 29.364 0 . 1 . . . . X 93 GLU CB . 36447 1 946 . 1 . 1 96 96 GLU CG C 13 35.936 0 . 1 . . . . X 93 GLU CG . 36447 1 947 . 1 . 1 96 96 GLU N N 15 121.491 0 . 1 . . . . X 93 GLU N . 36447 1 948 . 1 . 1 97 97 ALA H H 1 8.32 0 . 1 . . . . X 94 ALA H . 36447 1 949 . 1 . 1 97 97 ALA HA H 1 3.85 0 . 1 . . . . X 94 ALA HA . 36447 1 950 . 1 . 1 97 97 ALA HB1 H 1 1.52 0 . 1 . . . . X 94 ALA HB1 . 36447 1 951 . 1 . 1 97 97 ALA HB2 H 1 1.52 0 . 1 . . . . X 94 ALA HB2 . 36447 1 952 . 1 . 1 97 97 ALA HB3 H 1 1.52 0 . 1 . . . . X 94 ALA HB3 . 36447 1 953 . 1 . 1 97 97 ALA C C 13 179.298 0 . 1 . . . . X 94 ALA C . 36447 1 954 . 1 . 1 97 97 ALA CA C 13 55.587 0.03 . 1 . . . . X 94 ALA CA . 36447 1 955 . 1 . 1 97 97 ALA CB C 13 19.23 0 . 1 . . . . X 94 ALA CB . 36447 1 956 . 1 . 1 97 97 ALA N N 15 121.691 0 . 1 . . . . X 94 ALA N . 36447 1 957 . 1 . 1 98 98 VAL H H 1 8.346 0 . 1 . . . . X 95 VAL H . 36447 1 958 . 1 . 1 98 98 VAL HA H 1 3.413 0 . 1 . . . . X 95 VAL HA . 36447 1 959 . 1 . 1 98 98 VAL HB H 1 2.071 0 . 1 . . . . X 95 VAL HB . 36447 1 960 . 1 . 1 98 98 VAL HG11 H 1 1.345 0 . 1 . . . . X 95 VAL HG11 . 36447 1 961 . 1 . 1 98 98 VAL HG12 H 1 1.345 0 . 1 . . . . X 95 VAL HG12 . 36447 1 962 . 1 . 1 98 98 VAL HG13 H 1 1.345 0 . 1 . . . . X 95 VAL HG13 . 36447 1 963 . 1 . 1 98 98 VAL HG21 H 1 0.921 0 . 1 . . . . X 95 VAL HG21 . 36447 1 964 . 1 . 1 98 98 VAL HG22 H 1 0.921 0 . 1 . . . . X 95 VAL HG22 . 36447 1 965 . 1 . 1 98 98 VAL HG23 H 1 0.921 0 . 1 . . . . X 95 VAL HG23 . 36447 1 966 . 1 . 1 98 98 VAL CA C 13 67.392 0 . 1 . . . . X 95 VAL CA . 36447 1 967 . 1 . 1 98 98 VAL CB C 13 31.72 0 . 1 . . . . X 95 VAL CB . 36447 1 968 . 1 . 1 98 98 VAL CG1 C 13 18.467 0 . 1 . . . . X 95 VAL CG1 . 36447 1 969 . 1 . 1 98 98 VAL CG2 C 13 21.595 0 . 1 . . . . X 95 VAL CG2 . 36447 1 970 . 1 . 1 98 98 VAL N N 15 116.074 0 . 1 . . . . X 95 VAL N . 36447 1 971 . 1 . 1 99 99 ALA HA H 1 4.157 0 . 1 . . . . X 96 ALA HA . 36447 1 972 . 1 . 1 99 99 ALA HB1 H 1 1.524 0 . 1 . . . . X 96 ALA HB1 . 36447 1 973 . 1 . 1 99 99 ALA HB2 H 1 1.524 0 . 1 . . . . X 96 ALA HB2 . 36447 1 974 . 1 . 1 99 99 ALA HB3 H 1 1.524 0 . 1 . . . . X 96 ALA HB3 . 36447 1 975 . 1 . 1 99 99 ALA C C 13 180.873 0 . 1 . . . . X 96 ALA C . 36447 1 976 . 1 . 1 99 99 ALA CA C 13 55.066 0 . 1 . . . . X 96 ALA CA . 36447 1 977 . 1 . 1 99 99 ALA CB C 13 17.889 0 . 1 . . . . X 96 ALA CB . 36447 1 978 . 1 . 1 100 100 GLN H H 1 8 0 . 1 . . . . X 97 GLN H . 36447 1 979 . 1 . 1 100 100 GLN HA H 1 4.08 0 . 1 . . . . X 97 GLN HA . 36447 1 980 . 1 . 1 100 100 GLN HB2 H 1 2.196 0 . 1 . . . . X 97 GLN HB2 . 36447 1 981 . 1 . 1 100 100 GLN HB3 H 1 2.076 0 . 1 . . . . X 97 GLN HB3 . 36447 1 982 . 1 . 1 100 100 GLN HG2 H 1 2.478 0 . 1 . . . . X 97 GLN HG2 . 36447 1 983 . 1 . 1 100 100 GLN HG3 H 1 2.761 0 . 1 . . . . X 97 GLN HG3 . 36447 1 984 . 1 . 1 100 100 GLN HE21 H 1 6.482 0 . 1 . . . . X 97 GLN HE21 . 36447 1 985 . 1 . 1 100 100 GLN HE22 H 1 7.734 0 . 1 . . . . X 97 GLN HE22 . 36447 1 986 . 1 . 1 100 100 GLN C C 13 178.555 0 . 1 . . . . X 97 GLN C . 36447 1 987 . 1 . 1 100 100 GLN CA C 13 58.232 0.03 . 1 . . . . X 97 GLN CA . 36447 1 988 . 1 . 1 100 100 GLN CB C 13 28.279 0 . 1 . . . . X 97 GLN CB . 36447 1 989 . 1 . 1 100 100 GLN CG C 13 33.688 0 . 1 . . . . X 97 GLN CG . 36447 1 990 . 1 . 1 100 100 GLN N N 15 115.797 0 . 1 . . . . X 97 GLN N . 36447 1 991 . 1 . 1 100 100 GLN NE2 N 15 110.226 0 . 1 . . . . X 97 GLN NE2 . 36447 1 992 . 1 . 1 101 101 LEU H H 1 7.771 0 . 1 . . . . X 98 LEU H . 36447 1 993 . 1 . 1 101 101 LEU HA H 1 4.282 0 . 1 . . . . X 98 LEU HA . 36447 1 994 . 1 . 1 101 101 LEU HB2 H 1 1.549 0 . 1 . . . . X 98 LEU HB2 . 36447 1 995 . 1 . 1 101 101 LEU HB3 H 1 1.811 0 . 1 . . . . X 98 LEU HB3 . 36447 1 996 . 1 . 1 101 101 LEU HD11 H 1 0.759 0 . 1 . . . . X 98 LEU HD11 . 36447 1 997 . 1 . 1 101 101 LEU HD12 H 1 0.759 0 . 1 . . . . X 98 LEU HD12 . 36447 1 998 . 1 . 1 101 101 LEU HD13 H 1 0.759 0 . 1 . . . . X 98 LEU HD13 . 36447 1 999 . 1 . 1 101 101 LEU HD21 H 1 0.885 0 . 1 . . . . X 98 LEU HD21 . 36447 1 1000 . 1 . 1 101 101 LEU HD22 H 1 0.885 0 . 1 . . . . X 98 LEU HD22 . 36447 1 1001 . 1 . 1 101 101 LEU HD23 H 1 0.885 0 . 1 . . . . X 98 LEU HD23 . 36447 1 1002 . 1 . 1 101 101 LEU C C 13 177.959 0 . 1 . . . . X 98 LEU C . 36447 1 1003 . 1 . 1 101 101 LEU CA C 13 56.031 0.03 . 1 . . . . X 98 LEU CA . 36447 1 1004 . 1 . 1 101 101 LEU CB C 13 42.632 0 . 1 . . . . X 98 LEU CB . 36447 1 1005 . 1 . 1 101 101 LEU CD1 C 13 25.854 0 . 1 . . . . X 98 LEU CD1 . 36447 1 1006 . 1 . 1 101 101 LEU CD2 C 13 23.029 0 . 1 . . . . X 98 LEU CD2 . 36447 1 1007 . 1 . 1 101 101 LEU N N 15 118.754 0 . 1 . . . . X 98 LEU N . 36447 1 1008 . 1 . 1 102 102 GLN H H 1 7.884 0 . 1 . . . . X 99 GLN H . 36447 1 1009 . 1 . 1 102 102 GLN HA H 1 4.33 0 . 1 . . . . X 99 GLN HA . 36447 1 1010 . 1 . 1 102 102 GLN HB2 H 1 1.827 0 . 1 . . . . X 99 GLN HB2 . 36447 1 1011 . 1 . 1 102 102 GLN HB3 H 1 2.087 0 . 1 . . . . X 99 GLN HB3 . 36447 1 1012 . 1 . 1 102 102 GLN HG3 H 1 2.373 0 . 1 . . . . X 99 GLN HG3 . 36447 1 1013 . 1 . 1 102 102 GLN C C 13 175.52 0 . 1 . . . . X 99 GLN C . 36447 1 1014 . 1 . 1 102 102 GLN CA C 13 56.456 0.05 . 1 . . . . X 99 GLN CA . 36447 1 1015 . 1 . 1 102 102 GLN CB C 13 32.895 0 . 1 . . . . X 99 GLN CB . 36447 1 1016 . 1 . 1 102 102 GLN CG C 13 34.015 0 . 1 . . . . X 99 GLN CG . 36447 1 1017 . 1 . 1 102 102 GLN N N 15 118.321 0 . 1 . . . . X 99 GLN N . 36447 1 1018 . 1 . 1 103 103 LYS H H 1 8.024 0 . 1 . . . . X 100 LYS H . 36447 1 1019 . 1 . 1 103 103 LYS N N 15 125.216 0 . 1 . . . . X 100 LYS N . 36447 1 stop_ save_