################################### # 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 36486 _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 $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' 1 $sample_1 isotropic 36486 1 2 '2D 1H-13C HSQC' 1 $sample_1 isotropic 36486 1 3 '3D CBCA(CO)NH' 1 $sample_1 isotropic 36486 1 4 '3D HNCACB' 1 $sample_1 isotropic 36486 1 5 '3D HNCO' 1 $sample_1 isotropic 36486 1 6 '3D 1H-13C NOESY' 1 $sample_1 isotropic 36486 1 7 '3D 1H-15N NOESY' 1 $sample_1 isotropic 36486 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 1 1 CYS H H 1 8.267 0.001 . . . . . . A 1 CYS H1 . 36486 1 2 . 1 . 1 1 1 CYS HA H 1 4.406 0.008 . 1 . . . . A 1 CYS HA . 36486 1 3 . 1 . 1 1 1 CYS HB2 H 1 2.808 0.003 . . . . . . A 1 CYS HB2 . 36486 1 4 . 1 . 1 1 1 CYS C C 13 174.321 0.020 . 1 . . . . A 1 CYS C . 36486 1 5 . 1 . 1 1 1 CYS CA C 13 58.252 0.022 . 1 . . . . A 1 CYS CA . 36486 1 6 . 1 . 1 1 1 CYS CB C 13 28.079 0.049 . 1 . . . . A 1 CYS CB . 36486 1 7 . 1 . 1 1 1 CYS N N 15 120.524 0.047 . 1 . . . . A 1 CYS N . 36486 1 8 . 1 . 1 2 2 ARG H H 1 8.455 0.003 . 1 . . . . A 2 ARG H . 36486 1 9 . 1 . 1 2 2 ARG HA H 1 4.255 0.004 . 1 . . . . A 2 ARG HA . 36486 1 10 . 1 . 1 2 2 ARG HB2 H 1 1.786 0.000 . . . . . . A 2 ARG HB2 . 36486 1 11 . 1 . 1 2 2 ARG HB3 H 1 1.665 0.000 . . . . . . A 2 ARG HB3 . 36486 1 12 . 1 . 1 2 2 ARG HG2 H 1 1.525 0.000 . . . . . . A 2 ARG HG2 . 36486 1 13 . 1 . 1 2 2 ARG HD2 H 1 3.084 0.000 . . . . . . A 2 ARG HD2 . 36486 1 14 . 1 . 1 2 2 ARG C C 13 176.612 0.026 . 1 . . . . A 2 ARG C . 36486 1 15 . 1 . 1 2 2 ARG CA C 13 56.258 0.036 . 1 . . . . A 2 ARG CA . 36486 1 16 . 1 . 1 2 2 ARG CB C 13 30.687 0.037 . 1 . . . . A 2 ARG CB . 36486 1 17 . 1 . 1 2 2 ARG CG C 13 27.009 0.000 . 1 . . . . A 2 ARG CG . 36486 1 18 . 1 . 1 2 2 ARG CD C 13 43.245 0.000 . 1 . . . . A 2 ARG CD . 36486 1 19 . 1 . 1 2 2 ARG N N 15 123.582 0.022 . 1 . . . . A 2 ARG N . 36486 1 20 . 1 . 1 3 3 GLY H H 1 8.415 0.002 . 1 . . . . A 3 GLY H . 36486 1 21 . 1 . 1 3 3 GLY HA2 H 1 3.880 0.005 . . . . . . A 3 GLY HA2 . 36486 1 22 . 1 . 1 3 3 GLY C C 13 174.470 0.000 . 1 . . . . A 3 GLY C . 36486 1 23 . 1 . 1 3 3 GLY CA C 13 45.285 0.025 . 1 . . . . A 3 GLY CA . 36486 1 24 . 1 . 1 3 3 GLY N N 15 110.314 0.039 . 1 . . . . A 3 GLY N . 36486 1 25 . 1 . 1 4 4 GLY H H 1 8.249 0.005 . 1 . . . . A 4 GLY H . 36486 1 26 . 1 . 1 4 4 GLY HA2 H 1 3.878 0.003 . . . . . . A 4 GLY HA2 . 36486 1 27 . 1 . 1 4 4 GLY C C 13 174.048 0.000 . 1 . . . . A 4 GLY C . 36486 1 28 . 1 . 1 4 4 GLY CA C 13 45.285 0.037 . 1 . . . . A 4 GLY CA . 36486 1 29 . 1 . 1 4 4 GLY N N 15 108.876 0.037 . 1 . . . . A 4 GLY N . 36486 1 30 . 1 . 1 5 5 ASP H H 1 8.229 0.002 . 1 . . . . A 5 ASP H . 36486 1 31 . 1 . 1 5 5 ASP HA H 1 4.533 0.004 . 1 . . . . A 5 ASP HA . 36486 1 32 . 1 . 1 5 5 ASP HB2 H 1 2.654 0.000 . . . . . . A 5 ASP HB2 . 36486 1 33 . 1 . 1 5 5 ASP C C 13 176.301 0.000 . 1 . . . . A 5 ASP C . 36486 1 34 . 1 . 1 5 5 ASP CA C 13 54.029 0.075 . 1 . . . . A 5 ASP CA . 36486 1 35 . 1 . 1 5 5 ASP CB C 13 40.158 0.003 . 1 . . . . A 5 ASP CB . 36486 1 36 . 1 . 1 5 5 ASP N N 15 119.889 0.051 . 1 . . . . A 5 ASP N . 36486 1 37 . 1 . 1 6 6 GLU H H 1 8.420 0.005 . 1 . . . . A 6 GLU H . 36486 1 38 . 1 . 1 6 6 GLU HA H 1 4.091 0.004 . 1 . . . . A 6 GLU HA . 36486 1 39 . 1 . 1 6 6 GLU HB2 H 1 1.961 0.000 . . . . . . A 6 GLU HB2 . 36486 1 40 . 1 . 1 6 6 GLU HG2 H 1 2.275 0.000 . . . . . . A 6 GLU HG2 . 36486 1 41 . 1 . 1 6 6 GLU C C 13 177.024 0.000 . 1 . . . . A 6 GLU C . 36486 1 42 . 1 . 1 6 6 GLU CA C 13 57.609 0.007 . 1 . . . . A 6 GLU CA . 36486 1 43 . 1 . 1 6 6 GLU CB C 13 28.857 0.015 . 1 . . . . A 6 GLU CB . 36486 1 44 . 1 . 1 6 6 GLU CG C 13 34.658 0.000 . 1 . . . . A 6 GLU CG . 36486 1 45 . 1 . 1 6 6 GLU N N 15 120.927 0.019 . 1 . . . . A 6 GLU N . 36486 1 46 . 1 . 1 7 7 ASP H H 1 8.234 0.015 . 1 . . . . A 7 ASP H . 36486 1 47 . 1 . 1 7 7 ASP HA H 1 4.428 0.012 . 1 . . . . A 7 ASP HA . 36486 1 48 . 1 . 1 7 7 ASP HB2 H 1 2.628 0.000 . . . . . . A 7 ASP HB2 . 36486 1 49 . 1 . 1 7 7 ASP C C 13 176.962 0.000 . 1 . . . . A 7 ASP C . 36486 1 50 . 1 . 1 7 7 ASP CA C 13 55.326 0.054 . 1 . . . . A 7 ASP CA . 36486 1 51 . 1 . 1 7 7 ASP CB C 13 40.036 0.025 . 1 . . . . A 7 ASP CB . 36486 1 52 . 1 . 1 7 7 ASP N N 15 120.061 0.047 . 1 . . . . A 7 ASP N . 36486 1 53 . 1 . 1 8 8 ALA H H 1 8.046 0.003 . 1 . . . . A 8 ALA H . 36486 1 54 . 1 . 1 8 8 ALA HA H 1 4.076 0.005 . 1 . . . . A 8 ALA HA . 36486 1 55 . 1 . 1 8 8 ALA HB1 H 1 1.333 0.000 . 1 . . . . A 8 ALA HB1 . 36486 1 56 . 1 . 1 8 8 ALA HB2 H 1 1.333 0.000 . 1 . . . . A 8 ALA HB2 . 36486 1 57 . 1 . 1 8 8 ALA HB3 H 1 1.333 0.000 . 1 . . . . A 8 ALA HB3 . 36486 1 58 . 1 . 1 8 8 ALA C C 13 179.191 0.000 . 1 . . . . A 8 ALA C . 36486 1 59 . 1 . 1 8 8 ALA CA C 13 53.931 0.019 . 1 . . . . A 8 ALA CA . 36486 1 60 . 1 . 1 8 8 ALA CB C 13 18.549 0.001 . 1 . . . . A 8 ALA CB . 36486 1 61 . 1 . 1 8 8 ALA N N 15 124.050 0.037 . 1 . . . . A 8 ALA N . 36486 1 62 . 1 . 1 9 9 LEU H H 1 7.905 0.003 . 1 . . . . A 9 LEU H . 36486 1 63 . 1 . 1 9 9 LEU HA H 1 4.114 0.002 . 1 . . . . A 9 LEU HA . 36486 1 64 . 1 . 1 9 9 LEU HB2 H 1 1.659 0.000 . . . . . . A 9 LEU HB2 . 36486 1 65 . 1 . 1 9 9 LEU HB3 H 1 1.499 0.000 . . . . . . A 9 LEU HB3 . 36486 1 66 . 1 . 1 9 9 LEU HG H 1 0.783 0.000 . 1 . . . . A 9 LEU HG . 36486 1 67 . 1 . 1 9 9 LEU C C 13 178.508 0.017 . 1 . . . . A 9 LEU C . 36486 1 68 . 1 . 1 9 9 LEU CA C 13 56.399 0.024 . 1 . . . . A 9 LEU CA . 36486 1 69 . 1 . 1 9 9 LEU CB C 13 41.648 0.017 . 1 . . . . A 9 LEU CB . 36486 1 70 . 1 . 1 9 9 LEU CG C 13 26.927 0.000 . 1 . . . . A 9 LEU CG . 36486 1 71 . 1 . 1 9 9 LEU N N 15 119.494 0.044 . 1 . . . . A 9 LEU N . 36486 1 72 . 1 . 1 10 10 LYS H H 1 7.866 0.002 . 1 . . . . A 10 LYS H . 36486 1 73 . 1 . 1 10 10 LYS HA H 1 3.986 0.005 . 1 . . . . A 10 LYS HA . 36486 1 74 . 1 . 1 10 10 LYS HB2 H 1 1.747 0.000 . . . . . . A 10 LYS HB2 . 36486 1 75 . 1 . 1 10 10 LYS HG2 H 1 1.303 0.000 . . . . . . A 10 LYS HG2 . 36486 1 76 . 1 . 1 10 10 LYS HD2 H 1 1.438 0.000 . . . . . . A 10 LYS HD2 . 36486 1 77 . 1 . 1 10 10 LYS HE2 H 1 3.723 0.000 . . . . . . A 10 LYS HE2 . 36486 1 78 . 1 . 1 10 10 LYS C C 13 177.730 0.003 . 1 . . . . A 10 LYS C . 36486 1 79 . 1 . 1 10 10 LYS CA C 13 57.958 0.000 . 1 . . . . A 10 LYS CA . 36486 1 80 . 1 . 1 10 10 LYS CB C 13 32.524 0.001 . 1 . . . . A 10 LYS CB . 36486 1 81 . 1 . 1 10 10 LYS CG C 13 25.075 0.000 . 1 . . . . A 10 LYS CG . 36486 1 82 . 1 . 1 10 10 LYS CD C 13 29.275 0.000 . 1 . . . . A 10 LYS CD . 36486 1 83 . 1 . 1 10 10 LYS CE C 13 42.229 0.000 . 1 . . . . A 10 LYS CE . 36486 1 84 . 1 . 1 10 10 LYS N N 15 120.203 0.013 . 1 . . . . A 10 LYS N . 36486 1 85 . 1 . 1 11 11 ALA H H 1 7.911 0.002 . 1 . . . . A 11 ALA H . 36486 1 86 . 1 . 1 11 11 ALA HA H 1 4.111 0.001 . 1 . . . . A 11 ALA HA . 36486 1 87 . 1 . 1 11 11 ALA HB1 H 1 1.320 0.000 . 1 . . . . A 11 ALA HB1 . 36486 1 88 . 1 . 1 11 11 ALA HB2 H 1 1.320 0.000 . 1 . . . . A 11 ALA HB2 . 36486 1 89 . 1 . 1 11 11 ALA HB3 H 1 1.320 0.000 . 1 . . . . A 11 ALA HB3 . 36486 1 90 . 1 . 1 11 11 ALA C C 13 178.374 0.000 . 1 . . . . A 11 ALA C . 36486 1 91 . 1 . 1 11 11 ALA CA C 13 53.425 0.001 . 1 . . . . A 11 ALA CA . 36486 1 92 . 1 . 1 11 11 ALA CB C 13 18.601 0.039 . 1 . . . . A 11 ALA CB . 36486 1 93 . 1 . 1 11 11 ALA N N 15 122.810 0.027 . 1 . . . . A 11 ALA N . 36486 1 94 . 1 . 1 12 12 ALA H H 1 7.876 0.002 . 1 . . . . A 12 ALA H . 36486 1 95 . 1 . 1 12 12 ALA HA H 1 4.115 0.002 . 1 . . . . A 12 ALA HA . 36486 1 96 . 1 . 1 12 12 ALA HB1 H 1 1.345 0.000 . 1 . . . . A 12 ALA HB1 . 36486 1 97 . 1 . 1 12 12 ALA HB2 H 1 1.345 0.000 . 1 . . . . A 12 ALA HB2 . 36486 1 98 . 1 . 1 12 12 ALA HB3 H 1 1.345 0.000 . 1 . . . . A 12 ALA HB3 . 36486 1 99 . 1 . 1 12 12 ALA C C 13 178.573 0.000 . 1 . . . . A 12 ALA C . 36486 1 100 . 1 . 1 12 12 ALA CA C 13 53.319 0.038 . 1 . . . . A 12 ALA CA . 36486 1 101 . 1 . 1 12 12 ALA CB C 13 18.596 0.038 . 1 . . . . A 12 ALA CB . 36486 1 102 . 1 . 1 12 12 ALA N N 15 121.473 0.023 . 1 . . . . A 12 ALA N . 36486 1 103 . 1 . 1 13 13 ARG H H 1 7.908 0.002 . 1 . . . . A 13 ARG H . 36486 1 104 . 1 . 1 13 13 ARG HA H 1 4.098 0.005 . 1 . . . . A 13 ARG HA . 36486 1 105 . 1 . 1 13 13 ARG HB2 H 1 1.748 0.000 . . . . . . A 13 ARG HB2 . 36486 1 106 . 1 . 1 13 13 ARG HG2 H 1 1.556 0.000 . . . . . . A 13 ARG HG2 . 36486 1 107 . 1 . 1 13 13 ARG HD2 H 1 3.049 0.000 . . . . . . A 13 ARG HD2 . 36486 1 108 . 1 . 1 13 13 ARG C C 13 176.441 0.000 . 1 . . . . A 13 ARG C . 36486 1 109 . 1 . 1 13 13 ARG CA C 13 56.862 0.029 . 1 . . . . A 13 ARG CA . 36486 1 110 . 1 . 1 13 13 ARG CB C 13 30.491 0.027 . 1 . . . . A 13 ARG CB . 36486 1 111 . 1 . 1 13 13 ARG CG C 13 27.276 0.000 . 1 . . . . A 13 ARG CG . 36486 1 112 . 1 . 1 13 13 ARG CD C 13 43.435 0.000 . 1 . . . . A 13 ARG CD . 36486 1 113 . 1 . 1 13 13 ARG N N 15 118.512 0.015 . 1 . . . . A 13 ARG N . 36486 1 114 . 1 . 1 14 14 ALA H H 1 7.875 0.002 . 1 . . . . A 14 ALA H . 36486 1 115 . 1 . 1 14 14 ALA HA H 1 4.179 0.001 . 1 . . . . A 14 ALA HA . 36486 1 116 . 1 . 1 14 14 ALA HB1 H 1 1.315 0.000 . 1 . . . . A 14 ALA HB1 . 36486 1 117 . 1 . 1 14 14 ALA HB2 H 1 1.315 0.000 . 1 . . . . A 14 ALA HB2 . 36486 1 118 . 1 . 1 14 14 ALA HB3 H 1 1.315 0.000 . 1 . . . . A 14 ALA HB3 . 36486 1 119 . 1 . 1 14 14 ALA C C 13 178.032 0.000 . 1 . . . . A 14 ALA C . 36486 1 120 . 1 . 1 14 14 ALA CA C 13 52.916 0.030 . 1 . . . . A 14 ALA CA . 36486 1 121 . 1 . 1 14 14 ALA CB C 13 18.813 0.007 . 1 . . . . A 14 ALA CB . 36486 1 122 . 1 . 1 14 14 ALA N N 15 123.319 0.022 . 1 . . . . A 14 ALA N . 36486 1 123 . 1 . 1 15 15 ILE H H 1 7.764 0.002 . 1 . . . . A 15 ILE H . 36486 1 124 . 1 . 1 15 15 ILE HA H 1 3.923 0.003 . 1 . . . . A 15 ILE HA . 36486 1 125 . 1 . 1 15 15 ILE HB H 1 1.744 0.004 . 1 . . . . A 15 ILE HB . 36486 1 126 . 1 . 1 15 15 ILE HG12 H 1 1.402 0.000 . . . . . . A 15 ILE HG12 . 36486 1 127 . 1 . 1 15 15 ILE HG21 H 1 1.089 0.000 . 1 . . . . A 15 ILE HG21 . 36486 1 128 . 1 . 1 15 15 ILE HG22 H 1 1.089 0.000 . 1 . . . . A 15 ILE HG22 . 36486 1 129 . 1 . 1 15 15 ILE HG23 H 1 1.089 0.000 . 1 . . . . A 15 ILE HG23 . 36486 1 130 . 1 . 1 15 15 ILE HD11 H 1 0.732 0.000 . 1 . . . . A 15 ILE HD11 . 36486 1 131 . 1 . 1 15 15 ILE HD12 H 1 0.732 0.000 . 1 . . . . A 15 ILE HD12 . 36486 1 132 . 1 . 1 15 15 ILE HD13 H 1 0.732 0.000 . 1 . . . . A 15 ILE HD13 . 36486 1 133 . 1 . 1 15 15 ILE C C 13 176.254 0.000 . 1 . . . . A 15 ILE C . 36486 1 134 . 1 . 1 15 15 ILE CA C 13 61.735 0.012 . 1 . . . . A 15 ILE CA . 36486 1 135 . 1 . 1 15 15 ILE CB C 13 38.412 0.001 . 1 . . . . A 15 ILE CB . 36486 1 136 . 1 . 1 15 15 ILE CG1 C 13 27.592 0.000 . 1 . . . . A 15 ILE CG1 . 36486 1 137 . 1 . 1 15 15 ILE CG2 C 13 17.499 0.000 . 1 . . . . A 15 ILE CG2 . 36486 1 138 . 1 . 1 15 15 ILE N N 15 119.238 0.018 . 1 . . . . A 15 ILE N . 36486 1 139 . 1 . 1 16 16 LYS H H 1 7.948 0.008 . 1 . . . . A 16 LYS H . 36486 1 140 . 1 . 1 16 16 LYS HA H 1 4.080 0.005 . 1 . . . . A 16 LYS HA . 36486 1 141 . 1 . 1 16 16 LYS HB2 H 1 1.566 0.000 . . . . . . A 16 LYS HB2 . 36486 1 142 . 1 . 1 16 16 LYS HG2 H 1 1.155 0.000 . . . . . . A 16 LYS HG2 . 36486 1 143 . 1 . 1 16 16 LYS HD2 H 1 1.238 0.000 . . . . . . A 16 LYS HD2 . 36486 1 144 . 1 . 1 16 16 LYS C C 13 176.315 0.000 . 1 . . . . A 16 LYS C . 36486 1 145 . 1 . 1 16 16 LYS CA C 13 56.743 0.032 . 1 . . . . A 16 LYS CA . 36486 1 146 . 1 . 1 16 16 LYS CB C 13 32.761 0.020 . 1 . . . . A 16 LYS CB . 36486 1 147 . 1 . 1 16 16 LYS CG C 13 24.604 0.000 . 1 . . . . A 16 LYS CG . 36486 1 148 . 1 . 1 16 16 LYS CD C 13 28.978 0.000 . 1 . . . . A 16 LYS CD . 36486 1 149 . 1 . 1 16 16 LYS CE C 13 42.011 0.000 . 1 . . . . A 16 LYS CE . 36486 1 150 . 1 . 1 16 16 LYS N N 15 123.474 0.056 . 1 . . . . A 16 LYS N . 36486 1 151 . 1 . 1 17 17 PHE H H 1 7.962 0.001 . 1 . . . . A 17 PHE H . 36486 1 152 . 1 . 1 17 17 PHE HA H 1 4.445 0.006 . 1 . . . . A 17 PHE HA . 36486 1 153 . 1 . 1 17 17 PHE HB2 H 1 2.972 0.000 . . . . . . A 17 PHE HB2 . 36486 1 154 . 1 . 1 17 17 PHE HB3 H 1 2.837 0.000 . . . . . . A 17 PHE HB3 . 36486 1 155 . 1 . 1 17 17 PHE C C 13 175.544 0.000 . 1 . . . . A 17 PHE C . 36486 1 156 . 1 . 1 17 17 PHE CA C 13 57.890 0.016 . 1 . . . . A 17 PHE CA . 36486 1 157 . 1 . 1 17 17 PHE CB C 13 39.424 0.009 . 1 . . . . A 17 PHE CB . 36486 1 158 . 1 . 1 17 17 PHE N N 15 120.099 0.024 . 1 . . . . A 17 PHE N . 36486 1 159 . 1 . 1 18 18 LEU H H 1 7.897 0.003 . 1 . . . . A 18 LEU H . 36486 1 160 . 1 . 1 18 18 LEU HA H 1 4.115 0.007 . 1 . . . . A 18 LEU HA . 36486 1 161 . 1 . 1 18 18 LEU HB2 H 1 1.402 0.004 . . . . . . A 18 LEU HB2 . 36486 1 162 . 1 . 1 18 18 LEU HB3 H 1 1.282 0.004 . . . . . . A 18 LEU HB3 . 36486 1 163 . 1 . 1 18 18 LEU HG H 1 1.348 0.000 . 1 . . . . A 18 LEU HG . 36486 1 164 . 1 . 1 18 18 LEU HD11 H 1 0.730 0.000 . . . . . . A 18 LEU HD11 . 36486 1 165 . 1 . 1 18 18 LEU HD12 H 1 0.730 0.000 . . . . . . A 18 LEU HD12 . 36486 1 166 . 1 . 1 18 18 LEU HD13 H 1 0.730 0.000 . . . . . . A 18 LEU HD13 . 36486 1 167 . 1 . 1 18 18 LEU C C 13 176.796 0.000 . 1 . . . . A 18 LEU C . 36486 1 168 . 1 . 1 18 18 LEU CA C 13 55.390 0.025 . 1 . . . . A 18 LEU CA . 36486 1 169 . 1 . 1 18 18 LEU CB C 13 42.360 0.029 . 1 . . . . A 18 LEU CB . 36486 1 170 . 1 . 1 18 18 LEU CG C 13 26.701 0.000 . 1 . . . . A 18 LEU CG . 36486 1 171 . 1 . 1 18 18 LEU N N 15 122.999 0.029 . 1 . . . . A 18 LEU N . 36486 1 172 . 1 . 1 19 19 TYR H H 1 7.922 0.002 . 1 . . . . A 19 TYR H . 36486 1 173 . 1 . 1 19 19 TYR HA H 1 4.414 0.008 . 1 . . . . A 19 TYR HA . 36486 1 174 . 1 . 1 19 19 TYR HB2 H 1 2.948 0.000 . . . . . . A 19 TYR HB2 . 36486 1 175 . 1 . 1 19 19 TYR HB3 H 1 2.850 0.000 . . . . . . A 19 TYR HB3 . 36486 1 176 . 1 . 1 19 19 TYR C C 13 175.671 0.021 . 1 . . . . A 19 TYR C . 36486 1 177 . 1 . 1 19 19 TYR CA C 13 57.933 0.012 . 1 . . . . A 19 TYR CA . 36486 1 178 . 1 . 1 19 19 TYR CB C 13 38.381 0.000 . 1 . . . . A 19 TYR CB . 36486 1 179 . 1 . 1 19 19 TYR N N 15 119.842 0.045 . 1 . . . . A 19 TYR N . 36486 1 180 . 1 . 1 20 20 GLN H H 1 8.021 0.012 . 1 . . . . A 20 GLN H . 36486 1 181 . 1 . 1 20 20 GLN HA H 1 4.205 0.001 . 1 . . . . A 20 GLN HA . 36486 1 182 . 1 . 1 20 20 GLN HB2 H 1 1.928 0.000 . . . . . . A 20 GLN HB2 . 36486 1 183 . 1 . 1 20 20 GLN HB3 H 1 1.893 0.000 . . . . . . A 20 GLN HB3 . 36486 1 184 . 1 . 1 20 20 GLN HG2 H 1 2.177 0.000 . . . . . . A 20 GLN HG2 . 36486 1 185 . 1 . 1 20 20 GLN HE21 H 1 6.729 0.004 . . . . . . A 20 GLN HE21 . 36486 1 186 . 1 . 1 20 20 GLN HE22 H 1 7.396 0.003 . . . . . . A 20 GLN HE22 . 36486 1 187 . 1 . 1 20 20 GLN C C 13 175.422 0.006 . 1 . . . . A 20 GLN C . 36486 1 188 . 1 . 1 20 20 GLN CA C 13 55.712 0.002 . 1 . . . . A 20 GLN CA . 36486 1 189 . 1 . 1 20 20 GLN CB C 13 29.578 0.014 . 1 . . . . A 20 GLN CB . 36486 1 190 . 1 . 1 20 20 GLN CG C 13 33.691 0.035 . 1 . . . . A 20 GLN CG . 36486 1 191 . 1 . 1 20 20 GLN CD C 13 180.369 0.007 . 1 . . . . A 20 GLN CD . 36486 1 192 . 1 . 1 20 20 GLN N N 15 121.398 0.047 . 1 . . . . A 20 GLN N . 36486 1 193 . 1 . 1 20 20 GLN NE2 N 15 112.011 0.028 . 1 . . . . A 20 GLN NE2 . 36486 1 194 . 1 . 1 21 21 SER H H 1 8.139 0.003 . 1 . . . . A 21 SER H . 36486 1 195 . 1 . 1 21 21 SER HA H 1 4.273 0.005 . 1 . . . . A 21 SER HA . 36486 1 196 . 1 . 1 21 21 SER HB2 H 1 3.730 0.000 . . . . . . A 21 SER HB2 . 36486 1 197 . 1 . 1 21 21 SER C C 13 173.699 0.000 . 1 . . . . A 21 SER C . 36486 1 198 . 1 . 1 21 21 SER CA C 13 58.379 0.018 . 1 . . . . A 21 SER CA . 36486 1 199 . 1 . 1 21 21 SER CB C 13 63.749 0.003 . 1 . . . . A 21 SER CB . 36486 1 200 . 1 . 1 21 21 SER N N 15 116.603 0.032 . 1 . . . . A 21 SER N . 36486 1 201 . 1 . 1 22 22 ASN H H 1 8.303 0.002 . 1 . . . . A 22 ASN H . 36486 1 202 . 1 . 1 22 22 ASN HA H 1 4.878 0.000 . 1 . . . . A 22 ASN HA . 36486 1 203 . 1 . 1 22 22 ASN HD21 H 1 6.788 0.006 . . . . . . A 22 ASN HD21 . 36486 1 204 . 1 . 1 22 22 ASN HD22 H 1 7.474 0.002 . . . . . . A 22 ASN HD22 . 36486 1 205 . 1 . 1 22 22 ASN C C 13 172.082 0.000 . 1 . . . . A 22 ASN C . 36486 1 206 . 1 . 1 22 22 ASN CA C 13 51.484 0.002 . 1 . . . . A 22 ASN CA . 36486 1 207 . 1 . 1 22 22 ASN CB C 13 38.726 0.012 . 1 . . . . A 22 ASN CB . 36486 1 208 . 1 . 1 22 22 ASN CG C 13 177.032 0.000 . 1 . . . . A 22 ASN CG . 36486 1 209 . 1 . 1 22 22 ASN N N 15 120.883 0.019 . 1 . . . . A 22 ASN N . 36486 1 210 . 1 . 1 22 22 ASN ND2 N 15 113.250 0.030 . 1 . . . . A 22 ASN ND2 . 36486 1 211 . 1 . 1 25 25 PRO HA H 1 4.266 0.000 . 1 . . . . A 25 PRO HA . 36486 1 212 . 1 . 1 25 25 PRO HB2 H 1 2.148 0.000 . . . . . . A 25 PRO HB2 . 36486 1 213 . 1 . 1 25 25 PRO HB3 H 1 1.755 0.000 . . . . . . A 25 PRO HB3 . 36486 1 214 . 1 . 1 25 25 PRO HG2 H 1 1.898 0.000 . . . . . . A 25 PRO HG2 . 36486 1 215 . 1 . 1 25 25 PRO C C 13 176.267 0.000 . 1 . . . . A 25 PRO C . 36486 1 216 . 1 . 1 25 25 PRO CA C 13 62.756 0.000 . 1 . . . . A 25 PRO CA . 36486 1 217 . 1 . 1 25 25 PRO CB C 13 31.843 0.000 . 1 . . . . A 25 PRO CB . 36486 1 218 . 1 . 1 25 25 PRO CG C 13 27.198 0.000 . 1 . . . . A 25 PRO CG . 36486 1 219 . 1 . 1 25 25 PRO CD C 13 50.212 0.000 . 1 . . . . A 25 PRO CD . 36486 1 220 . 1 . 1 26 26 ASN H H 1 8.389 0.002 . 1 . . . . A 26 ASN H . 36486 1 221 . 1 . 1 26 26 ASN HA H 1 4.828 0.000 . 1 . . . . A 26 ASN HA . 36486 1 222 . 1 . 1 26 26 ASN HD21 H 1 6.865 0.002 . . . . . . A 26 ASN HD21 . 36486 1 223 . 1 . 1 26 26 ASN HD22 H 1 7.547 0.002 . . . . . . A 26 ASN HD22 . 36486 1 224 . 1 . 1 26 26 ASN C C 13 173.796 0.000 . 1 . . . . A 26 ASN C . 36486 1 225 . 1 . 1 26 26 ASN CA C 13 51.175 0.005 . 1 . . . . A 26 ASN CA . 36486 1 226 . 1 . 1 26 26 ASN CB C 13 38.674 0.009 . 1 . . . . A 26 ASN CB . 36486 1 227 . 1 . 1 26 26 ASN CG C 13 177.113 0.000 . 1 . . . . A 26 ASN CG . 36486 1 228 . 1 . 1 26 26 ASN N N 15 118.603 1.984 . 1 . . . . A 26 ASN N . 36486 1 229 . 1 . 1 26 26 ASN ND2 N 15 112.822 0.029 . 1 . . . . A 26 ASN ND2 . 36486 1 230 . 1 . 1 27 27 PRO HA H 1 4.294 0.000 . 1 . . . . A 27 PRO HA . 36486 1 231 . 1 . 1 27 27 PRO HB2 H 1 2.195 0.000 . . . . . . A 27 PRO HB2 . 36486 1 232 . 1 . 1 27 27 PRO HB3 H 1 1.857 0.000 . . . . . . A 27 PRO HB3 . 36486 1 233 . 1 . 1 27 27 PRO HG2 H 1 1.920 0.000 . . . . . . A 27 PRO HG2 . 36486 1 234 . 1 . 1 27 27 PRO HD2 H 1 3.682 0.000 . . . . . . A 27 PRO HD2 . 36486 1 235 . 1 . 1 27 27 PRO C C 13 177.327 0.000 . 1 . . . . A 27 PRO C . 36486 1 236 . 1 . 1 27 27 PRO CA C 13 63.873 0.000 . 1 . . . . A 27 PRO CA . 36486 1 237 . 1 . 1 27 27 PRO CB C 13 31.863 0.000 . 1 . . . . A 27 PRO CB . 36486 1 238 . 1 . 1 27 27 PRO CG C 13 27.177 0.000 . 1 . . . . A 27 PRO CG . 36486 1 239 . 1 . 1 27 27 PRO CD C 13 50.642 0.000 . 1 . . . . A 27 PRO CD . 36486 1 240 . 1 . 1 28 28 GLU H H 1 8.345 0.005 . 1 . . . . A 28 GLU H . 36486 1 241 . 1 . 1 28 28 GLU HA H 1 4.162 0.006 . 1 . . . . A 28 GLU HA . 36486 1 242 . 1 . 1 28 28 GLU HB2 H 1 1.965 0.000 . . . . . . A 28 GLU HB2 . 36486 1 243 . 1 . 1 28 28 GLU HB3 H 1 1.849 0.000 . . . . . . A 28 GLU HB3 . 36486 1 244 . 1 . 1 28 28 GLU HG2 H 1 2.260 0.000 . . . . . . A 28 GLU HG2 . 36486 1 245 . 1 . 1 28 28 GLU C C 13 177.187 0.015 . 1 . . . . A 28 GLU C . 36486 1 246 . 1 . 1 28 28 GLU CA C 13 56.836 0.029 . 1 . . . . A 28 GLU CA . 36486 1 247 . 1 . 1 28 28 GLU CB C 13 29.214 0.007 . 1 . . . . A 28 GLU CB . 36486 1 248 . 1 . 1 28 28 GLU CG C 13 35.029 0.000 . 1 . . . . A 28 GLU CG . 36486 1 249 . 1 . 1 28 28 GLU N N 15 119.530 0.030 . 1 . . . . A 28 GLU N . 36486 1 250 . 1 . 1 29 29 GLY H H 1 8.171 0.003 . 1 . . . . A 29 GLY H . 36486 1 251 . 1 . 1 29 29 GLY HA2 H 1 3.895 0.006 . . . . . . A 29 GLY HA2 . 36486 1 252 . 1 . 1 29 29 GLY C C 13 174.803 0.000 . 1 . . . . A 29 GLY C . 36486 1 253 . 1 . 1 29 29 GLY CA C 13 45.598 0.023 . 1 . . . . A 29 GLY CA . 36486 1 254 . 1 . 1 29 29 GLY N N 15 108.803 0.013 . 1 . . . . A 29 GLY N . 36486 1 255 . 1 . 1 30 30 THR H H 1 7.918 0.002 . 1 . . . . A 30 THR H . 36486 1 256 . 1 . 1 30 30 THR HA H 1 4.196 0.008 . 1 . . . . A 30 THR HA . 36486 1 257 . 1 . 1 30 30 THR HG21 H 1 1.123 0.000 . 1 . . . . A 30 THR HG21 . 36486 1 258 . 1 . 1 30 30 THR HG22 H 1 1.123 0.000 . 1 . . . . A 30 THR HG22 . 36486 1 259 . 1 . 1 30 30 THR HG23 H 1 1.123 0.000 . 1 . . . . A 30 THR HG23 . 36486 1 260 . 1 . 1 30 30 THR C C 13 175.084 0.000 . 1 . . . . A 30 THR C . 36486 1 261 . 1 . 1 30 30 THR CA C 13 62.477 0.015 . 1 . . . . A 30 THR CA . 36486 1 262 . 1 . 1 30 30 THR CB C 13 69.732 0.004 . 1 . . . . A 30 THR CB . 36486 1 263 . 1 . 1 30 30 THR CG2 C 13 21.539 0.000 . 1 . . . . A 30 THR CG2 . 36486 1 264 . 1 . 1 30 30 THR N N 15 113.461 0.030 . 1 . . . . A 30 THR N . 36486 1 265 . 1 . 1 31 31 ARG H H 1 8.284 0.003 . 1 . . . . A 31 ARG H . 36486 1 266 . 1 . 1 31 31 ARG HA H 1 4.085 0.003 . 1 . . . . A 31 ARG HA . 36486 1 267 . 1 . 1 31 31 ARG HB2 H 1 1.728 0.000 . . . . . . A 31 ARG HB2 . 36486 1 268 . 1 . 1 31 31 ARG HG2 H 1 1.518 0.000 . . . . . . A 31 ARG HG2 . 36486 1 269 . 1 . 1 31 31 ARG HD2 H 1 3.098 0.000 . . . . . . A 31 ARG HD2 . 36486 1 270 . 1 . 1 31 31 ARG C C 13 177.068 0.000 . 1 . . . . A 31 ARG C . 36486 1 271 . 1 . 1 31 31 ARG CA C 13 57.470 0.004 . 1 . . . . A 31 ARG CA . 36486 1 272 . 1 . 1 31 31 ARG CB C 13 30.153 0.012 . 1 . . . . A 31 ARG CB . 36486 1 273 . 1 . 1 31 31 ARG CG C 13 27.241 0.000 . 1 . . . . A 31 ARG CG . 36486 1 274 . 1 . 1 31 31 ARG CD C 13 43.333 0.000 . 1 . . . . A 31 ARG CD . 36486 1 275 . 1 . 1 31 31 ARG N N 15 122.543 0.017 . 1 . . . . A 31 ARG N . 36486 1 276 . 1 . 1 32 32 GLN H H 1 8.235 0.003 . 1 . . . . A 32 GLN H . 36486 1 277 . 1 . 1 32 32 GLN HA H 1 4.085 0.007 . 1 . . . . A 32 GLN HA . 36486 1 278 . 1 . 1 32 32 GLN HB2 H 1 1.931 0.000 . . . . . . A 32 GLN HB2 . 36486 1 279 . 1 . 1 32 32 GLN HG2 H 1 2.280 0.000 . . . . . . A 32 GLN HG2 . 36486 1 280 . 1 . 1 32 32 GLN HE21 H 1 6.777 0.012 . . . . . . A 32 GLN HE21 . 36486 1 281 . 1 . 1 32 32 GLN HE22 H 1 7.431 0.002 . . . . . . A 32 GLN HE22 . 36486 1 282 . 1 . 1 32 32 GLN C C 13 176.270 0.013 . 1 . . . . A 32 GLN C . 36486 1 283 . 1 . 1 32 32 GLN CA C 13 56.580 0.003 . 1 . . . . A 32 GLN CA . 36486 1 284 . 1 . 1 32 32 GLN CB C 13 28.911 0.044 . 1 . . . . A 32 GLN CB . 36486 1 285 . 1 . 1 32 32 GLN CG C 13 33.643 0.017 . 1 . . . . A 32 GLN CG . 36486 1 286 . 1 . 1 32 32 GLN CD C 13 180.359 0.000 . 1 . . . . A 32 GLN CD . 36486 1 287 . 1 . 1 32 32 GLN N N 15 120.006 0.029 . 1 . . . . A 32 GLN N . 36486 1 288 . 1 . 1 32 32 GLN NE2 N 15 112.272 0.031 . 1 . . . . A 32 GLN NE2 . 36486 1 289 . 1 . 1 33 33 ALA H H 1 8.103 0.002 . 1 . . . . A 33 ALA H . 36486 1 290 . 1 . 1 33 33 ALA HA H 1 4.133 0.000 . 1 . . . . A 33 ALA HA . 36486 1 291 . 1 . 1 33 33 ALA HB1 H 1 1.310 0.000 . 1 . . . . A 33 ALA HB1 . 36486 1 292 . 1 . 1 33 33 ALA HB2 H 1 1.310 0.000 . 1 . . . . A 33 ALA HB2 . 36486 1 293 . 1 . 1 33 33 ALA HB3 H 1 1.310 0.000 . 1 . . . . A 33 ALA HB3 . 36486 1 294 . 1 . 1 33 33 ALA C C 13 178.473 0.005 . 1 . . . . A 33 ALA C . 36486 1 295 . 1 . 1 33 33 ALA CA C 13 53.213 0.034 . 1 . . . . A 33 ALA CA . 36486 1 296 . 1 . 1 33 33 ALA CB C 13 18.751 0.023 . 1 . . . . A 33 ALA CB . 36486 1 297 . 1 . 1 33 33 ALA N N 15 124.377 0.024 . 1 . . . . A 33 ALA N . 36486 1 298 . 1 . 1 34 34 ARG H H 1 8.132 0.011 . 1 . . . . A 34 ARG H . 36486 1 299 . 1 . 1 34 34 ARG HA H 1 4.098 0.004 . 1 . . . . A 34 ARG HA . 36486 1 300 . 1 . 1 34 34 ARG HB2 H 1 1.719 0.000 . . . . . . A 34 ARG HB2 . 36486 1 301 . 1 . 1 34 34 ARG HG2 H 1 1.562 0.000 . . . . . . A 34 ARG HG2 . 36486 1 302 . 1 . 1 34 34 ARG HD2 H 1 3.059 0.000 . . . . . . A 34 ARG HD2 . 36486 1 303 . 1 . 1 34 34 ARG C C 13 176.984 0.000 . 1 . . . . A 34 ARG C . 36486 1 304 . 1 . 1 34 34 ARG CA C 13 57.001 0.003 . 1 . . . . A 34 ARG CA . 36486 1 305 . 1 . 1 34 34 ARG CB C 13 30.354 0.000 . 1 . . . . A 34 ARG CB . 36486 1 306 . 1 . 1 34 34 ARG CG C 13 27.276 0.000 . 1 . . . . A 34 ARG CG . 36486 1 307 . 1 . 1 34 34 ARG CD C 13 43.364 0.000 . 1 . . . . A 34 ARG CD . 36486 1 308 . 1 . 1 34 34 ARG N N 15 119.403 0.020 . 1 . . . . A 34 ARG N . 36486 1 309 . 1 . 1 35 35 ARG H H 1 8.122 0.003 . 1 . . . . A 35 ARG H . 36486 1 310 . 1 . 1 35 35 ARG HA H 1 4.118 0.009 . 1 . . . . A 35 ARG HA . 36486 1 311 . 1 . 1 35 35 ARG HB2 H 1 1.725 0.000 . . . . . . A 35 ARG HB2 . 36486 1 312 . 1 . 1 35 35 ARG HG2 H 1 1.551 0.000 . . . . . . A 35 ARG HG2 . 36486 1 313 . 1 . 1 35 35 ARG HG3 H 1 1.505 0.000 . . . . . . A 35 ARG HG3 . 36486 1 314 . 1 . 1 35 35 ARG HD2 H 1 3.067 0.000 . . . . . . A 35 ARG HD2 . 36486 1 315 . 1 . 1 35 35 ARG C C 13 176.542 0.018 . 1 . . . . A 35 ARG C . 36486 1 316 . 1 . 1 35 35 ARG CA C 13 56.864 0.000 . 1 . . . . A 35 ARG CA . 36486 1 317 . 1 . 1 35 35 ARG CB C 13 30.457 0.000 . 1 . . . . A 35 ARG CB . 36486 1 318 . 1 . 1 35 35 ARG CG C 13 27.099 0.000 . 1 . . . . A 35 ARG CG . 36486 1 319 . 1 . 1 35 35 ARG CD C 13 43.342 0.000 . 1 . . . . A 35 ARG CD . 36486 1 320 . 1 . 1 35 35 ARG N N 15 120.976 0.020 . 1 . . . . A 35 ARG N . 36486 1 321 . 1 . 1 36 36 ASN H H 1 8.281 0.007 . 1 . . . . A 36 ASN H . 36486 1 322 . 1 . 1 36 36 ASN HA H 1 4.543 0.001 . 1 . . . . A 36 ASN HA . 36486 1 323 . 1 . 1 36 36 ASN HB2 H 1 2.711 0.000 . . . . . . A 36 ASN HB2 . 36486 1 324 . 1 . 1 36 36 ASN HD21 H 1 7.529 0.003 . . . . . . A 36 ASN HD21 . 36486 1 325 . 1 . 1 36 36 ASN HD22 H 1 6.842 0.002 . . . . . . A 36 ASN HD22 . 36486 1 326 . 1 . 1 36 36 ASN C C 13 175.531 0.010 . 1 . . . . A 36 ASN C . 36486 1 327 . 1 . 1 36 36 ASN CA C 13 53.631 0.034 . 1 . . . . A 36 ASN CA . 36486 1 328 . 1 . 1 36 36 ASN CB C 13 38.526 0.022 . 1 . . . . A 36 ASN CB . 36486 1 329 . 1 . 1 36 36 ASN CG C 13 176.701 0.000 . 1 . . . . A 36 ASN CG . 36486 1 330 . 1 . 1 36 36 ASN N N 15 119.164 0.029 . 1 . . . . A 36 ASN N . 36486 1 331 . 1 . 1 36 36 ASN ND2 N 15 112.520 0.029 . 1 . . . . A 36 ASN ND2 . 36486 1 332 . 1 . 1 37 37 ARG H H 1 8.157 0.002 . 1 . . . . A 37 ARG H . 36486 1 333 . 1 . 1 37 37 ARG HA H 1 4.145 0.011 . 1 . . . . A 37 ARG HA . 36486 1 334 . 1 . 1 37 37 ARG HB2 H 1 1.730 0.000 . . . . . . A 37 ARG HB2 . 36486 1 335 . 1 . 1 37 37 ARG HG2 H 1 1.528 0.000 . . . . . . A 37 ARG HG2 . 36486 1 336 . 1 . 1 37 37 ARG HD2 H 1 3.069 0.000 . . . . . . A 37 ARG HD2 . 36486 1 337 . 1 . 1 37 37 ARG C C 13 176.642 0.021 . 1 . . . . A 37 ARG C . 36486 1 338 . 1 . 1 37 37 ARG CA C 13 56.902 0.004 . 1 . . . . A 37 ARG CA . 36486 1 339 . 1 . 1 37 37 ARG CB C 13 30.480 0.029 . 1 . . . . A 37 ARG CB . 36486 1 340 . 1 . 1 37 37 ARG CG C 13 27.120 0.000 . 1 . . . . A 37 ARG CG . 36486 1 341 . 1 . 1 37 37 ARG CD C 13 43.329 0.000 . 1 . . . . A 37 ARG CD . 36486 1 342 . 1 . 1 37 37 ARG N N 15 121.339 0.032 . 1 . . . . A 37 ARG N . 36486 1 343 . 1 . 1 38 38 ARG H H 1 8.191 0.003 . 1 . . . . A 38 ARG H . 36486 1 344 . 1 . 1 38 38 ARG HA H 1 4.159 0.007 . 1 . . . . A 38 ARG HA . 36486 1 345 . 1 . 1 38 38 ARG HB2 H 1 1.691 0.000 . . . . . . A 38 ARG HB2 . 36486 1 346 . 1 . 1 38 38 ARG HG2 H 1 1.503 0.000 . . . . . . A 38 ARG HG2 . 36486 1 347 . 1 . 1 38 38 ARG HD2 H 1 3.048 0.000 . . . . . . A 38 ARG HD2 . 36486 1 348 . 1 . 1 38 38 ARG C C 13 176.588 0.004 . 1 . . . . A 38 ARG C . 36486 1 349 . 1 . 1 38 38 ARG CA C 13 56.781 0.031 . 1 . . . . A 38 ARG CA . 36486 1 350 . 1 . 1 38 38 ARG CB C 13 30.457 0.083 . 1 . . . . A 38 ARG CB . 36486 1 351 . 1 . 1 38 38 ARG CG C 13 27.094 0.000 . 1 . . . . A 38 ARG CG . 36486 1 352 . 1 . 1 38 38 ARG CD C 13 43.307 0.000 . 1 . . . . A 38 ARG CD . 36486 1 353 . 1 . 1 38 38 ARG N N 15 121.316 0.025 . 1 . . . . A 38 ARG N . 36486 1 354 . 1 . 1 39 39 ARG H H 1 8.259 0.002 . 1 . . . . A 39 ARG H . 36486 1 355 . 1 . 1 39 39 ARG HA H 1 4.138 0.008 . 1 . . . . A 39 ARG HA . 36486 1 356 . 1 . 1 39 39 ARG HD2 H 1 3.051 0.000 . . . . . . A 39 ARG HD2 . 36486 1 357 . 1 . 1 39 39 ARG C C 13 176.467 0.018 . 1 . . . . A 39 ARG C . 36486 1 358 . 1 . 1 39 39 ARG CA C 13 56.684 0.003 . 1 . . . . A 39 ARG CA . 36486 1 359 . 1 . 1 39 39 ARG CB C 13 30.349 0.071 . 1 . . . . A 39 ARG CB . 36486 1 360 . 1 . 1 39 39 ARG CG C 13 27.258 0.000 . 1 . . . . A 39 ARG CG . 36486 1 361 . 1 . 1 39 39 ARG CD C 13 43.326 0.000 . 1 . . . . A 39 ARG CD . 36486 1 362 . 1 . 1 39 39 ARG N N 15 121.358 0.049 . 1 . . . . A 39 ARG N . 36486 1 363 . 1 . 1 40 40 ARG H H 1 8.175 0.002 . 1 . . . . A 40 ARG H . 36486 1 364 . 1 . 1 40 40 ARG HA H 1 3.956 0.000 . 1 . . . . A 40 ARG HA . 36486 1 365 . 1 . 1 40 40 ARG HB2 H 1 1.606 0.000 . . . . . . A 40 ARG HB2 . 36486 1 366 . 1 . 1 40 40 ARG HG2 H 1 1.369 0.000 . . . . . . A 40 ARG HG2 . 36486 1 367 . 1 . 1 40 40 ARG HD2 H 1 3.026 0.000 . . . . . . A 40 ARG HD2 . 36486 1 368 . 1 . 1 40 40 ARG C C 13 176.457 0.080 . 1 . . . . A 40 ARG C . 36486 1 369 . 1 . 1 40 40 ARG CA C 13 56.776 0.000 . 1 . . . . A 40 ARG CA . 36486 1 370 . 1 . 1 40 40 ARG CB C 13 30.526 0.032 . 1 . . . . A 40 ARG CB . 36486 1 371 . 1 . 1 40 40 ARG CG C 13 27.035 0.000 . 1 . . . . A 40 ARG CG . 36486 1 372 . 1 . 1 40 40 ARG CD C 13 43.302 0.000 . 1 . . . . A 40 ARG CD . 36486 1 373 . 1 . 1 40 40 ARG N N 15 121.611 0.000 . 1 . . . . A 40 ARG N . 36486 1 374 . 1 . 1 41 41 TRP H H 1 8.106 0.011 . 1 . . . . A 41 TRP H . 36486 1 375 . 1 . 1 41 41 TRP HA H 1 4.085 0.024 . 1 . . . . A 41 TRP HA . 36486 1 376 . 1 . 1 41 41 TRP HB2 H 1 1.699 0.000 . . . . . . A 41 TRP HB2 . 36486 1 377 . 1 . 1 41 41 TRP C C 13 176.652 0.069 . 1 . . . . A 41 TRP C . 36486 1 378 . 1 . 1 41 41 TRP CA C 13 56.923 0.000 . 1 . . . . A 41 TRP CA . 36486 1 379 . 1 . 1 41 41 TRP CB C 13 29.769 0.000 . 1 . . . . A 41 TRP CB . 36486 1 380 . 1 . 1 41 41 TRP N N 15 120.931 0.010 . 1 . . . . A 41 TRP N . 36486 1 381 . 1 . 1 42 42 ARG H H 1 8.182 0.003 . 1 . . . . A 42 ARG H . 36486 1 382 . 1 . 1 42 42 ARG HA H 1 4.093 0.019 . 1 . . . . A 42 ARG HA . 36486 1 383 . 1 . 1 42 42 ARG HB2 H 1 1.753 0.000 . . . . . . A 42 ARG HB2 . 36486 1 384 . 1 . 1 42 42 ARG HG2 H 1 1.525 0.000 . . . . . . A 42 ARG HG2 . 36486 1 385 . 1 . 1 42 42 ARG HD2 H 1 3.046 0.000 . . . . . . A 42 ARG HD2 . 36486 1 386 . 1 . 1 42 42 ARG C C 13 176.134 0.027 . 1 . . . . A 42 ARG C . 36486 1 387 . 1 . 1 42 42 ARG CA C 13 56.208 0.000 . 1 . . . . A 42 ARG CA . 36486 1 388 . 1 . 1 42 42 ARG CB C 13 29.184 0.031 . 1 . . . . A 42 ARG CB . 36486 1 389 . 1 . 1 42 42 ARG CG C 13 27.119 0.000 . 1 . . . . A 42 ARG CG . 36486 1 390 . 1 . 1 42 42 ARG CD C 13 43.273 0.000 . 1 . . . . A 42 ARG CD . 36486 1 391 . 1 . 1 42 42 ARG N N 15 120.688 0.068 . 1 . . . . A 42 ARG N . 36486 1 392 . 1 . 1 43 43 GLU H H 1 8.184 0.002 . 1 . . . . A 43 GLU H . 36486 1 393 . 1 . 1 43 43 GLU HA H 1 4.126 0.003 . 1 . . . . A 43 GLU HA . 36486 1 394 . 1 . 1 43 43 GLU HB2 H 1 1.863 0.000 . . . . . . A 43 GLU HB2 . 36486 1 395 . 1 . 1 43 43 GLU HG2 H 1 1.516 0.000 . . . . . . A 43 GLU HG2 . 36486 1 396 . 1 . 1 43 43 GLU HG3 H 1 1.711 0.000 . . . . . . A 43 GLU HG3 . 36486 1 397 . 1 . 1 43 43 GLU C C 13 176.561 0.012 . 1 . . . . A 43 GLU C . 36486 1 398 . 1 . 1 43 43 GLU CA C 13 56.714 0.068 . 1 . . . . A 43 GLU CA . 36486 1 399 . 1 . 1 43 43 GLU CB C 13 30.531 0.000 . 1 . . . . A 43 GLU CB . 36486 1 400 . 1 . 1 43 43 GLU CG C 13 33.603 0.000 . 1 . . . . A 43 GLU CG . 36486 1 401 . 1 . 1 43 43 GLU N N 15 121.844 0.011 . 1 . . . . A 43 GLU N . 36486 1 402 . 1 . 1 44 44 ARG H H 1 8.215 0.003 . 1 . . . . A 44 ARG H . 36486 1 403 . 1 . 1 44 44 ARG HA H 1 4.163 0.000 . 1 . . . . A 44 ARG HA . 36486 1 404 . 1 . 1 44 44 ARG HB2 H 1 1.666 0.000 . . . . . . A 44 ARG HB2 . 36486 1 405 . 1 . 1 44 44 ARG HG2 H 1 1.455 0.000 . . . . . . A 44 ARG HG2 . 36486 1 406 . 1 . 1 44 44 ARG HD2 H 1 3.039 0.000 . . . . . . A 44 ARG HD2 . 36486 1 407 . 1 . 1 44 44 ARG C C 13 176.402 0.042 . 1 . . . . A 44 ARG C . 36486 1 408 . 1 . 1 44 44 ARG CA C 13 56.654 0.023 . 1 . . . . A 44 ARG CA . 36486 1 409 . 1 . 1 44 44 ARG CB C 13 30.414 0.084 . 1 . . . . A 44 ARG CB . 36486 1 410 . 1 . 1 44 44 ARG CG C 13 27.100 0.000 . 1 . . . . A 44 ARG CG . 36486 1 411 . 1 . 1 44 44 ARG CD C 13 43.298 0.000 . 1 . . . . A 44 ARG CD . 36486 1 412 . 1 . 1 44 44 ARG N N 15 122.151 0.033 . 1 . . . . A 44 ARG N . 36486 1 413 . 1 . 1 45 45 GLN H H 1 8.091 0.002 . 1 . . . . A 45 GLN H . 36486 1 414 . 1 . 1 45 45 GLN HA H 1 4.460 0.009 . 1 . . . . A 45 GLN HA . 36486 1 415 . 1 . 1 45 45 GLN HB2 H 1 2.889 0.000 . . . . . . A 45 GLN HB2 . 36486 1 416 . 1 . 1 45 45 GLN HB3 H 1 3.187 0.000 . . . . . . A 45 GLN HB3 . 36486 1 417 . 1 . 1 45 45 GLN HE21 H 1 7.410 0.003 . . . . . . A 45 GLN HE21 . 36486 1 418 . 1 . 1 45 45 GLN HE22 H 1 6.758 0.000 . . . . . . A 45 GLN HE22 . 36486 1 419 . 1 . 1 45 45 GLN C C 13 176.377 0.029 . 1 . . . . A 45 GLN C . 36486 1 420 . 1 . 1 45 45 GLN CA C 13 58.071 0.070 . 1 . . . . A 45 GLN CA . 36486 1 421 . 1 . 1 45 45 GLN CB C 13 29.428 0.056 . 1 . . . . A 45 GLN CB . 36486 1 422 . 1 . 1 45 45 GLN CG C 13 33.639 0.031 . 1 . . . . A 45 GLN CG . 36486 1 423 . 1 . 1 45 45 GLN CD C 13 180.336 0.000 . 1 . . . . A 45 GLN CD . 36486 1 424 . 1 . 1 45 45 GLN N N 15 122.043 0.019 . 1 . . . . A 45 GLN N . 36486 1 425 . 1 . 1 45 45 GLN NE2 N 15 112.197 0.025 . 1 . . . . A 45 GLN NE2 . 36486 1 426 . 1 . 1 46 46 ARG H H 1 8.046 0.003 . 1 . . . . A 46 ARG H . 36486 1 427 . 1 . 1 46 46 ARG HA H 1 4.136 0.000 . 1 . . . . A 46 ARG HA . 36486 1 428 . 1 . 1 46 46 ARG HB2 H 1 1.688 0.000 . . . . . . A 46 ARG HB2 . 36486 1 429 . 1 . 1 46 46 ARG HG2 H 1 1.500 0.000 . . . . . . A 46 ARG HG2 . 36486 1 430 . 1 . 1 46 46 ARG HD2 H 1 3.046 0.000 . . . . . . A 46 ARG HD2 . 36486 1 431 . 1 . 1 46 46 ARG C C 13 176.306 0.013 . 1 . . . . A 46 ARG C . 36486 1 432 . 1 . 1 46 46 ARG CA C 13 56.712 0.096 . 1 . . . . A 46 ARG CA . 36486 1 433 . 1 . 1 46 46 ARG CB C 13 30.611 0.009 . 1 . . . . A 46 ARG CB . 36486 1 434 . 1 . 1 46 46 ARG CG C 13 27.123 0.000 . 1 . . . . A 46 ARG CG . 36486 1 435 . 1 . 1 46 46 ARG CD C 13 43.293 0.000 . 1 . . . . A 46 ARG CD . 36486 1 436 . 1 . 1 46 46 ARG N N 15 121.727 0.027 . 1 . . . . A 46 ARG N . 36486 1 437 . 1 . 1 47 47 GLN H H 1 8.215 0.003 . 1 . . . . A 47 GLN H . 36486 1 438 . 1 . 1 47 47 GLN HA H 1 4.183 0.007 . 1 . . . . A 47 GLN HA . 36486 1 439 . 1 . 1 47 47 GLN HB2 H 1 1.882 0.000 . . . . . . A 47 GLN HB2 . 36486 1 440 . 1 . 1 47 47 GLN HG2 H 1 2.222 0.000 . . . . . . A 47 GLN HG2 . 36486 1 441 . 1 . 1 47 47 GLN HE21 H 1 6.708 0.002 . . . . . . A 47 GLN HE21 . 36486 1 442 . 1 . 1 47 47 GLN HE22 H 1 7.267 0.002 . . . . . . A 47 GLN HE22 . 36486 1 443 . 1 . 1 47 47 GLN C C 13 175.907 0.004 . 1 . . . . A 47 GLN C . 36486 1 444 . 1 . 1 47 47 GLN CA C 13 55.849 0.036 . 1 . . . . A 47 GLN CA . 36486 1 445 . 1 . 1 47 47 GLN CB C 13 29.184 0.034 . 1 . . . . A 47 GLN CB . 36486 1 446 . 1 . 1 47 47 GLN CG C 13 33.580 0.057 . 1 . . . . A 47 GLN CG . 36486 1 447 . 1 . 1 47 47 GLN CD C 13 180.222 0.000 . 1 . . . . A 47 GLN CD . 36486 1 448 . 1 . 1 47 47 GLN N N 15 121.379 0.027 . 1 . . . . A 47 GLN N . 36486 1 449 . 1 . 1 47 47 GLN NE2 N 15 112.286 0.009 . 1 . . . . A 47 GLN NE2 . 36486 1 450 . 1 . 1 48 48 ILE H H 1 8.069 0.002 . 1 . . . . A 48 ILE H . 36486 1 451 . 1 . 1 48 48 ILE HA H 1 3.967 0.006 . 1 . . . . A 48 ILE HA . 36486 1 452 . 1 . 1 48 48 ILE HB H 1 1.676 0.000 . 1 . . . . A 48 ILE HB . 36486 1 453 . 1 . 1 48 48 ILE HG12 H 1 1.265 0.000 . . . . . . A 48 ILE HG12 . 36486 1 454 . 1 . 1 48 48 ILE HG21 H 1 1.017 0.000 . 1 . . . . A 48 ILE HG21 . 36486 1 455 . 1 . 1 48 48 ILE HG22 H 1 1.017 0.000 . 1 . . . . A 48 ILE HG22 . 36486 1 456 . 1 . 1 48 48 ILE HG23 H 1 1.017 0.000 . 1 . . . . A 48 ILE HG23 . 36486 1 457 . 1 . 1 48 48 ILE HD11 H 1 0.697 0.000 . 1 . . . . A 48 ILE HD11 . 36486 1 458 . 1 . 1 48 48 ILE HD12 H 1 0.697 0.000 . 1 . . . . A 48 ILE HD12 . 36486 1 459 . 1 . 1 48 48 ILE HD13 H 1 0.697 0.000 . 1 . . . . A 48 ILE HD13 . 36486 1 460 . 1 . 1 48 48 ILE C C 13 176.096 0.036 . 1 . . . . A 48 ILE C . 36486 1 461 . 1 . 1 48 48 ILE CA C 13 61.400 0.010 . 1 . . . . A 48 ILE CA . 36486 1 462 . 1 . 1 48 48 ILE CB C 13 38.577 0.014 . 1 . . . . A 48 ILE CB . 36486 1 463 . 1 . 1 48 48 ILE CG1 C 13 27.171 0.000 . 1 . . . . A 48 ILE CG1 . 36486 1 464 . 1 . 1 48 48 ILE CG2 C 13 17.251 0.000 . 1 . . . . A 48 ILE CG2 . 36486 1 465 . 1 . 1 48 48 ILE N N 15 121.865 0.015 . 1 . . . . A 48 ILE N . 36486 1 466 . 1 . 1 49 49 HIS H H 1 8.490 0.003 . 1 . . . . A 49 HIS H . 36486 1 467 . 1 . 1 49 49 HIS HA H 1 4.655 0.003 . 1 . . . . A 49 HIS HA . 36486 1 468 . 1 . 1 49 49 HIS HB2 H 1 3.149 0.000 . . . . . . A 49 HIS HB2 . 36486 1 469 . 1 . 1 49 49 HIS HB3 H 1 3.079 0.000 . . . . . . A 49 HIS HB3 . 36486 1 470 . 1 . 1 49 49 HIS C C 13 174.321 0.025 . 1 . . . . A 49 HIS C . 36486 1 471 . 1 . 1 49 49 HIS CA C 13 55.214 0.022 . 1 . . . . A 49 HIS CA . 36486 1 472 . 1 . 1 49 49 HIS CB C 13 28.928 0.007 . 1 . . . . A 49 HIS CB . 36486 1 473 . 1 . 1 49 49 HIS N N 15 122.025 0.041 . 1 . . . . A 49 HIS N . 36486 1 474 . 1 . 1 50 50 SER H H 1 8.256 0.004 . 1 . . . . A 50 SER H . 36486 1 475 . 1 . 1 50 50 SER HA H 1 4.344 0.008 . 1 . . . . A 50 SER HA . 36486 1 476 . 1 . 1 50 50 SER HB2 H 1 3.780 0.000 . . . . . . A 50 SER HB2 . 36486 1 477 . 1 . 1 50 50 SER C C 13 174.459 0.000 . 1 . . . . A 50 SER C . 36486 1 478 . 1 . 1 50 50 SER CA C 13 58.218 0.030 . 1 . . . . A 50 SER CA . 36486 1 479 . 1 . 1 50 50 SER CB C 13 63.979 0.004 . 1 . . . . A 50 SER CB . 36486 1 480 . 1 . 1 50 50 SER N N 15 117.402 0.046 . 1 . . . . A 50 SER N . 36486 1 481 . 1 . 1 51 51 ALA H H 1 8.481 0.003 . 1 . . . . A 51 ALA H . 36486 1 482 . 1 . 1 51 51 ALA HA H 1 4.212 0.004 . 1 . . . . A 51 ALA HA . 36486 1 483 . 1 . 1 51 51 ALA HB1 H 1 1.331 0.000 . 1 . . . . A 51 ALA HB1 . 36486 1 484 . 1 . 1 51 51 ALA HB2 H 1 1.331 0.000 . 1 . . . . A 51 ALA HB2 . 36486 1 485 . 1 . 1 51 51 ALA HB3 H 1 1.331 0.000 . 1 . . . . A 51 ALA HB3 . 36486 1 486 . 1 . 1 51 51 ALA C C 13 178.090 0.013 . 1 . . . . A 51 ALA C . 36486 1 487 . 1 . 1 51 51 ALA CA C 13 53.186 0.025 . 1 . . . . A 51 ALA CA . 36486 1 488 . 1 . 1 51 51 ALA CB C 13 18.870 0.003 . 1 . . . . A 51 ALA CB . 36486 1 489 . 1 . 1 51 51 ALA N N 15 126.153 0.015 . 1 . . . . A 51 ALA N . 36486 1 490 . 1 . 1 52 52 SER H H 1 8.132 0.003 . 1 . . . . A 52 SER H . 36486 1 491 . 1 . 1 52 52 SER HA H 1 4.273 0.003 . 1 . . . . A 52 SER HA . 36486 1 492 . 1 . 1 52 52 SER HB2 H 1 3.770 0.000 . . . . . . A 52 SER HB2 . 36486 1 493 . 1 . 1 52 52 SER C C 13 174.705 0.010 . 1 . . . . A 52 SER C . 36486 1 494 . 1 . 1 52 52 SER CA C 13 58.739 0.011 . 1 . . . . A 52 SER CA . 36486 1 495 . 1 . 1 52 52 SER CB C 13 63.479 0.001 . 1 . . . . A 52 SER CB . 36486 1 496 . 1 . 1 52 52 SER N N 15 113.838 0.022 . 1 . . . . A 52 SER N . 36486 1 497 . 1 . 1 53 53 GLU H H 1 8.047 0.002 . 1 . . . . A 53 GLU H . 36486 1 498 . 1 . 1 53 53 GLU HA H 1 4.180 0.009 . 1 . . . . A 53 GLU HA . 36486 1 499 . 1 . 1 53 53 GLU HB2 H 1 1.929 0.000 . . . . . . A 53 GLU HB2 . 36486 1 500 . 1 . 1 53 53 GLU HG2 H 1 2.228 0.000 . . . . . . A 53 GLU HG2 . 36486 1 501 . 1 . 1 53 53 GLU C C 13 176.233 0.011 . 1 . . . . A 53 GLU C . 36486 1 502 . 1 . 1 53 53 GLU CA C 13 56.484 0.011 . 1 . . . . A 53 GLU CA . 36486 1 503 . 1 . 1 53 53 GLU CB C 13 29.646 0.002 . 1 . . . . A 53 GLU CB . 36486 1 504 . 1 . 1 53 53 GLU CG C 13 35.081 0.000 . 1 . . . . A 53 GLU CG . 36486 1 505 . 1 . 1 53 53 GLU N N 15 122.312 0.015 . 1 . . . . A 53 GLU N . 36486 1 506 . 1 . 1 54 54 ARG H H 1 8.158 0.003 . 1 . . . . A 54 ARG H . 36486 1 507 . 1 . 1 54 54 ARG HA H 1 4.187 0.006 . 1 . . . . A 54 ARG HA . 36486 1 508 . 1 . 1 54 54 ARG HB2 H 1 1.690 0.000 . . . . . . A 54 ARG HB2 . 36486 1 509 . 1 . 1 54 54 ARG HG2 H 1 1.489 0.000 . . . . . . A 54 ARG HG2 . 36486 1 510 . 1 . 1 54 54 ARG HD2 H 1 3.075 0.000 . . . . . . A 54 ARG HD2 . 36486 1 511 . 1 . 1 54 54 ARG C C 13 176.298 0.000 . 1 . . . . A 54 ARG C . 36486 1 512 . 1 . 1 54 54 ARG CA C 13 56.313 0.031 . 1 . . . . A 54 ARG CA . 36486 1 513 . 1 . 1 54 54 ARG CB C 13 30.452 0.002 . 1 . . . . A 54 ARG CB . 36486 1 514 . 1 . 1 54 54 ARG CG C 13 27.069 0.000 . 1 . . . . A 54 ARG CG . 36486 1 515 . 1 . 1 54 54 ARG CD C 13 43.262 0.000 . 1 . . . . A 54 ARG CD . 36486 1 516 . 1 . 1 54 54 ARG N N 15 121.768 0.032 . 1 . . . . A 54 ARG N . 36486 1 517 . 1 . 1 55 55 ILE H H 1 8.014 0.003 . 1 . . . . A 55 ILE H . 36486 1 518 . 1 . 1 55 55 ILE HA H 1 4.019 0.004 . 1 . . . . A 55 ILE HA . 36486 1 519 . 1 . 1 55 55 ILE HB H 1 1.743 0.000 . 1 . . . . A 55 ILE HB . 36486 1 520 . 1 . 1 55 55 ILE HG12 H 1 1.381 0.000 . . . . . . A 55 ILE HG12 . 36486 1 521 . 1 . 1 55 55 ILE HG21 H 1 1.066 0.000 . 1 . . . . A 55 ILE HG21 . 36486 1 522 . 1 . 1 55 55 ILE HG22 H 1 1.066 0.000 . 1 . . . . A 55 ILE HG22 . 36486 1 523 . 1 . 1 55 55 ILE HG23 H 1 1.066 0.000 . 1 . . . . A 55 ILE HG23 . 36486 1 524 . 1 . 1 55 55 ILE HD11 H 1 0.803 0.000 . 1 . . . . A 55 ILE HD11 . 36486 1 525 . 1 . 1 55 55 ILE HD12 H 1 0.803 0.000 . 1 . . . . A 55 ILE HD12 . 36486 1 526 . 1 . 1 55 55 ILE HD13 H 1 0.803 0.000 . 1 . . . . A 55 ILE HD13 . 36486 1 527 . 1 . 1 55 55 ILE C C 13 176.083 0.025 . 1 . . . . A 55 ILE C . 36486 1 528 . 1 . 1 55 55 ILE CA C 13 61.190 0.015 . 1 . . . . A 55 ILE CA . 36486 1 529 . 1 . 1 55 55 ILE CB C 13 38.570 0.015 . 1 . . . . A 55 ILE CB . 36486 1 530 . 1 . 1 55 55 ILE CG1 C 13 27.308 0.000 . 1 . . . . A 55 ILE CG1 . 36486 1 531 . 1 . 1 55 55 ILE CG2 C 13 17.374 0.000 . 1 . . . . A 55 ILE CG2 . 36486 1 532 . 1 . 1 55 55 ILE CD1 C 13 12.758 0.000 . 1 . . . . A 55 ILE CD1 . 36486 1 533 . 1 . 1 55 55 ILE N N 15 122.053 0.021 . 1 . . . . A 55 ILE N . 36486 1 534 . 1 . 1 56 56 ALA H H 1 8.285 0.003 . 1 . . . . A 56 ALA H . 36486 1 535 . 1 . 1 56 56 ALA HA H 1 4.212 0.003 . 1 . . . . A 56 ALA HA . 36486 1 536 . 1 . 1 56 56 ALA HB1 H 1 1.305 0.000 . 1 . . . . A 56 ALA HB1 . 36486 1 537 . 1 . 1 56 56 ALA HB2 H 1 1.305 0.000 . 1 . . . . A 56 ALA HB2 . 36486 1 538 . 1 . 1 56 56 ALA HB3 H 1 1.305 0.000 . 1 . . . . A 56 ALA HB3 . 36486 1 539 . 1 . 1 56 56 ALA C C 13 177.804 0.026 . 1 . . . . A 56 ALA C . 36486 1 540 . 1 . 1 56 56 ALA CA C 13 52.700 0.028 . 1 . . . . A 56 ALA CA . 36486 1 541 . 1 . 1 56 56 ALA CB C 13 19.115 0.002 . 1 . . . . A 56 ALA CB . 36486 1 542 . 1 . 1 56 56 ALA N N 15 127.818 0.027 . 1 . . . . A 56 ALA N . 36486 1 543 . 1 . 1 57 57 SER H H 1 8.177 0.005 . 1 . . . . A 57 SER H . 36486 1 544 . 1 . 1 57 57 SER HA H 1 4.339 0.005 . 1 . . . . A 57 SER HA . 36486 1 545 . 1 . 1 57 57 SER HB2 H 1 3.769 0.000 . . . . . . A 57 SER HB2 . 36486 1 546 . 1 . 1 57 57 SER C C 13 174.791 0.005 . 1 . . . . A 57 SER C . 36486 1 547 . 1 . 1 57 57 SER CA C 13 58.656 0.020 . 1 . . . . A 57 SER CA . 36486 1 548 . 1 . 1 57 57 SER CB C 13 63.677 0.001 . 1 . . . . A 57 SER CB . 36486 1 549 . 1 . 1 57 57 SER N N 15 114.793 0.026 . 1 . . . . A 57 SER N . 36486 1 550 . 1 . 1 58 58 THR H H 1 7.930 0.002 . 1 . . . . A 58 THR H . 36486 1 551 . 1 . 1 58 58 THR HA H 1 4.192 0.007 . 1 . . . . A 58 THR HA . 36486 1 552 . 1 . 1 58 58 THR HB H 1 4.061 0.000 . 1 . . . . A 58 THR HB . 36486 1 553 . 1 . 1 58 58 THR HG21 H 1 1.036 0.000 . 1 . . . . A 58 THR HG21 . 36486 1 554 . 1 . 1 58 58 THR HG22 H 1 1.036 0.000 . 1 . . . . A 58 THR HG22 . 36486 1 555 . 1 . 1 58 58 THR HG23 H 1 1.036 0.000 . 1 . . . . A 58 THR HG23 . 36486 1 556 . 1 . 1 58 58 THR C C 13 174.193 0.017 . 1 . . . . A 58 THR C . 36486 1 557 . 1 . 1 58 58 THR CA C 13 62.146 0.001 . 1 . . . . A 58 THR CA . 36486 1 558 . 1 . 1 58 58 THR CB C 13 69.731 0.003 . 1 . . . . A 58 THR CB . 36486 1 559 . 1 . 1 58 58 THR CG2 C 13 21.407 0.000 . 1 . . . . A 58 THR CG2 . 36486 1 560 . 1 . 1 58 58 THR N N 15 115.250 0.026 . 1 . . . . A 58 THR N . 36486 1 561 . 1 . 1 59 59 TYR H H 1 8.076 0.003 . 1 . . . . A 59 TYR H . 36486 1 562 . 1 . 1 59 59 TYR HA H 1 4.484 0.007 . 1 . . . . A 59 TYR HA . 36486 1 563 . 1 . 1 59 59 TYR HB2 H 1 2.881 0.000 . . . . . . A 59 TYR HB2 . 36486 1 564 . 1 . 1 59 59 TYR C C 13 175.741 0.015 . 1 . . . . A 59 TYR C . 36486 1 565 . 1 . 1 59 59 TYR CA C 13 58.088 0.014 . 1 . . . . A 59 TYR CA . 36486 1 566 . 1 . 1 59 59 TYR CB C 13 38.627 0.005 . 1 . . . . A 59 TYR CB . 36486 1 567 . 1 . 1 59 59 TYR N N 15 122.568 0.019 . 1 . . . . A 59 TYR N . 36486 1 568 . 1 . 1 60 60 LEU H H 1 8.109 0.002 . 1 . . . . A 60 LEU H . 36486 1 569 . 1 . 1 60 60 LEU HA H 1 4.164 0.009 . 1 . . . . A 60 LEU HA . 36486 1 570 . 1 . 1 60 60 LEU HB2 H 1 1.457 0.000 . . . . . . A 60 LEU HB2 . 36486 1 571 . 1 . 1 60 60 LEU HG H 1 1.401 0.000 . 1 . . . . A 60 LEU HG . 36486 1 572 . 1 . 1 60 60 LEU HD11 H 1 0.758 0.000 . . . . . . A 60 LEU HD11 . 36486 1 573 . 1 . 1 60 60 LEU HD12 H 1 0.758 0.000 . . . . . . A 60 LEU HD12 . 36486 1 574 . 1 . 1 60 60 LEU HD13 H 1 0.758 0.000 . . . . . . A 60 LEU HD13 . 36486 1 575 . 1 . 1 60 60 LEU C C 13 177.561 0.020 . 1 . . . . A 60 LEU C . 36486 1 576 . 1 . 1 60 60 LEU CA C 13 55.166 0.045 . 1 . . . . A 60 LEU CA . 36486 1 577 . 1 . 1 60 60 LEU CB C 13 42.157 0.028 . 1 . . . . A 60 LEU CB . 36486 1 578 . 1 . 1 60 60 LEU CG C 13 26.613 0.000 . 1 . . . . A 60 LEU CG . 36486 1 579 . 1 . 1 60 60 LEU CD1 C 13 24.895 0.000 . . . . . . A 60 LEU CD1 . 36486 1 580 . 1 . 1 60 60 LEU CD2 C 13 23.263 0.000 . . . . . . A 60 LEU CD2 . 36486 1 581 . 1 . 1 60 60 LEU N N 15 124.480 0.016 . 1 . . . . A 60 LEU N . 36486 1 582 . 1 . 1 61 61 GLY H H 1 7.721 0.002 . 1 . . . . A 61 GLY H . 36486 1 583 . 1 . 1 61 61 GLY HA2 H 1 3.778 0.004 . . . . . . A 61 GLY HA2 . 36486 1 584 . 1 . 1 61 61 GLY C C 13 174.569 0.003 . 1 . . . . A 61 GLY C . 36486 1 585 . 1 . 1 61 61 GLY CA C 13 45.512 0.024 . 1 . . . . A 61 GLY CA . 36486 1 586 . 1 . 1 61 61 GLY N N 15 108.539 0.017 . 1 . . . . A 61 GLY N . 36486 1 587 . 1 . 1 62 62 GLY H H 1 8.091 0.002 . 1 . . . . A 62 GLY H . 36486 1 588 . 1 . 1 62 62 GLY HA2 H 1 3.848 0.005 . . . . . . A 62 GLY HA2 . 36486 1 589 . 1 . 1 62 62 GLY C C 13 174.172 0.036 . 1 . . . . A 62 GLY C . 36486 1 590 . 1 . 1 62 62 GLY CA C 13 45.222 0.013 . 1 . . . . A 62 GLY CA . 36486 1 591 . 1 . 1 62 62 GLY N N 15 108.201 0.010 . 1 . . . . A 62 GLY N . 36486 1 592 . 1 . 1 63 63 MET H H 1 8.066 0.003 . 1 . . . . A 63 MET H . 36486 1 593 . 1 . 1 63 63 MET HA H 1 4.344 0.003 . 1 . . . . A 63 MET HA . 36486 1 594 . 1 . 1 63 63 MET HB2 H 1 1.937 0.000 . . . . . . A 63 MET HB2 . 36486 1 595 . 1 . 1 63 63 MET HG2 H 1 2.433 0.000 . . . . . . A 63 MET HG2 . 36486 1 596 . 1 . 1 63 63 MET C C 13 176.132 0.022 . 1 . . . . A 63 MET C . 36486 1 597 . 1 . 1 63 63 MET CA C 13 55.642 0.019 . 1 . . . . A 63 MET CA . 36486 1 598 . 1 . 1 63 63 MET CB C 13 32.784 0.000 . 1 . . . . A 63 MET CB . 36486 1 599 . 1 . 1 63 63 MET CG C 13 31.884 0.000 . 1 . . . . A 63 MET CG . 36486 1 600 . 1 . 1 63 63 MET CE C 13 17.300 0.000 . 1 . . . . A 63 MET CE . 36486 1 601 . 1 . 1 63 63 MET N N 15 119.692 0.019 . 1 . . . . A 63 MET N . 36486 1 602 . 1 . 1 64 64 ARG H H 1 8.249 0.003 . 1 . . . . A 64 ARG H . 36486 1 603 . 1 . 1 64 64 ARG HA H 1 4.170 0.008 . 1 . . . . A 64 ARG HA . 36486 1 604 . 1 . 1 64 64 ARG HB2 H 1 1.654 0.000 . . . . . . A 64 ARG HB2 . 36486 1 605 . 1 . 1 64 64 ARG HG2 H 1 1.468 0.000 . . . . . . A 64 ARG HG2 . 36486 1 606 . 1 . 1 64 64 ARG HD2 H 1 3.030 0.004 . . . . . . A 64 ARG HD2 . 36486 1 607 . 1 . 1 64 64 ARG C C 13 176.041 0.012 . 1 . . . . A 64 ARG C . 36486 1 608 . 1 . 1 64 64 ARG CA C 13 56.198 0.006 . 1 . . . . A 64 ARG CA . 36486 1 609 . 1 . 1 64 64 ARG CB C 13 30.546 0.025 . 1 . . . . A 64 ARG CB . 36486 1 610 . 1 . 1 64 64 ARG CG C 13 27.274 0.000 . 1 . . . . A 64 ARG CG . 36486 1 611 . 1 . 1 64 64 ARG CD C 13 43.307 0.000 . 1 . . . . A 64 ARG CD . 36486 1 612 . 1 . 1 64 64 ARG N N 15 121.881 0.022 . 1 . . . . A 64 ARG N . 36486 1 613 . 1 . 1 65 65 MET H H 1 8.260 0.002 . 1 . . . . A 65 MET H . 36486 1 614 . 1 . 1 65 65 MET HA H 1 4.387 0.006 . 1 . . . . A 65 MET HA . 36486 1 615 . 1 . 1 65 65 MET HB2 H 1 1.947 0.000 . . . . . . A 65 MET HB2 . 36486 1 616 . 1 . 1 65 65 MET HG2 H 1 2.437 0.000 . . . . . . A 65 MET HG2 . 36486 1 617 . 1 . 1 65 65 MET C C 13 175.871 0.002 . 1 . . . . A 65 MET C . 36486 1 618 . 1 . 1 65 65 MET CA C 13 55.309 0.030 . 1 . . . . A 65 MET CA . 36486 1 619 . 1 . 1 65 65 MET CB C 13 32.660 0.017 . 1 . . . . A 65 MET CB . 36486 1 620 . 1 . 1 65 65 MET CG C 13 31.916 0.000 . 1 . . . . A 65 MET CG . 36486 1 621 . 1 . 1 65 65 MET N N 15 121.256 0.046 . 1 . . . . A 65 MET N . 36486 1 stop_ save_