################################### # 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 10231 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 '3D 13C-separated NOESY' 1 $sample_1 isotropic 10231 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10231 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 7 7 GLY HA2 H 1 3.943 0.030 . 1 . . . . 7 GLY HA2 . 10231 1 2 . 1 1 7 7 GLY HA3 H 1 3.943 0.030 . 1 . . . . 7 GLY HA3 . 10231 1 3 . 1 1 7 7 GLY C C 13 174.561 0.300 . 1 . . . . 7 GLY C . 10231 1 4 . 1 1 7 7 GLY CA C 13 45.444 0.300 . 1 . . . . 7 GLY CA . 10231 1 5 . 1 1 8 8 GLY H H 1 8.198 0.030 . 1 . . . . 8 GLY H . 10231 1 6 . 1 1 8 8 GLY HA2 H 1 3.922 0.030 . 1 . . . . 8 GLY HA2 . 10231 1 7 . 1 1 8 8 GLY HA3 H 1 3.922 0.030 . 1 . . . . 8 GLY HA3 . 10231 1 8 . 1 1 8 8 GLY C C 13 174.018 0.300 . 1 . . . . 8 GLY C . 10231 1 9 . 1 1 8 8 GLY CA C 13 45.107 0.300 . 1 . . . . 8 GLY CA . 10231 1 10 . 1 1 8 8 GLY N N 15 108.415 0.300 . 1 . . . . 8 GLY N . 10231 1 11 . 1 1 9 9 GLU H H 1 8.350 0.030 . 1 . . . . 9 GLU H . 10231 1 12 . 1 1 9 9 GLU HA H 1 4.173 0.030 . 1 . . . . 9 GLU HA . 10231 1 13 . 1 1 9 9 GLU HB2 H 1 1.929 0.030 . 1 . . . . 9 GLU HB2 . 10231 1 14 . 1 1 9 9 GLU HB3 H 1 1.929 0.030 . 1 . . . . 9 GLU HB3 . 10231 1 15 . 1 1 9 9 GLU HG2 H 1 2.240 0.030 . 2 . . . . 9 GLU HG2 . 10231 1 16 . 1 1 9 9 GLU HG3 H 1 2.196 0.030 . 2 . . . . 9 GLU HG3 . 10231 1 17 . 1 1 9 9 GLU C C 13 176.393 0.300 . 1 . . . . 9 GLU C . 10231 1 18 . 1 1 9 9 GLU CA C 13 56.942 0.300 . 1 . . . . 9 GLU CA . 10231 1 19 . 1 1 9 9 GLU CB C 13 30.240 0.300 . 1 . . . . 9 GLU CB . 10231 1 20 . 1 1 9 9 GLU CG C 13 36.208 0.300 . 1 . . . . 9 GLU CG . 10231 1 21 . 1 1 9 9 GLU N N 15 120.444 0.300 . 1 . . . . 9 GLU N . 10231 1 22 . 1 1 10 10 LYS H H 1 8.332 0.030 . 1 . . . . 10 LYS H . 10231 1 23 . 1 1 10 10 LYS HA H 1 4.543 0.030 . 1 . . . . 10 LYS HA . 10231 1 24 . 1 1 10 10 LYS HB2 H 1 1.394 0.030 . 2 . . . . 10 LYS HB2 . 10231 1 25 . 1 1 10 10 LYS HB3 H 1 1.624 0.030 . 2 . . . . 10 LYS HB3 . 10231 1 26 . 1 1 10 10 LYS HD2 H 1 1.433 0.030 . 1 . . . . 10 LYS HD2 . 10231 1 27 . 1 1 10 10 LYS HD3 H 1 1.433 0.030 . 1 . . . . 10 LYS HD3 . 10231 1 28 . 1 1 10 10 LYS HE2 H 1 2.876 0.030 . 1 . . . . 10 LYS HE2 . 10231 1 29 . 1 1 10 10 LYS HE3 H 1 2.876 0.030 . 1 . . . . 10 LYS HE3 . 10231 1 30 . 1 1 10 10 LYS HG2 H 1 1.357 0.030 . 2 . . . . 10 LYS HG2 . 10231 1 31 . 1 1 10 10 LYS HG3 H 1 1.169 0.030 . 2 . . . . 10 LYS HG3 . 10231 1 32 . 1 1 10 10 LYS C C 13 174.428 0.300 . 1 . . . . 10 LYS C . 10231 1 33 . 1 1 10 10 LYS CA C 13 53.930 0.300 . 1 . . . . 10 LYS CA . 10231 1 34 . 1 1 10 10 LYS CB C 13 33.487 0.300 . 1 . . . . 10 LYS CB . 10231 1 35 . 1 1 10 10 LYS CD C 13 29.825 0.300 . 1 . . . . 10 LYS CD . 10231 1 36 . 1 1 10 10 LYS CE C 13 42.299 0.300 . 1 . . . . 10 LYS CE . 10231 1 37 . 1 1 10 10 LYS CG C 13 25.146 0.300 . 1 . . . . 10 LYS CG . 10231 1 38 . 1 1 10 10 LYS N N 15 121.692 0.300 . 1 . . . . 10 LYS N . 10231 1 39 . 1 1 11 11 PRO HA H 1 4.207 0.030 . 1 . . . . 11 PRO HA . 10231 1 40 . 1 1 11 11 PRO HB2 H 1 2.009 0.030 . 2 . . . . 11 PRO HB2 . 10231 1 41 . 1 1 11 11 PRO HB3 H 1 1.083 0.030 . 2 . . . . 11 PRO HB3 . 10231 1 42 . 1 1 11 11 PRO HD2 H 1 3.734 0.030 . 1 . . . . 11 PRO HD2 . 10231 1 43 . 1 1 11 11 PRO HD3 H 1 3.734 0.030 . 1 . . . . 11 PRO HD3 . 10231 1 44 . 1 1 11 11 PRO HG2 H 1 1.582 0.030 . 2 . . . . 11 PRO HG2 . 10231 1 45 . 1 1 11 11 PRO HG3 H 1 1.794 0.030 . 2 . . . . 11 PRO HG3 . 10231 1 46 . 1 1 11 11 PRO C C 13 176.513 0.300 . 1 . . . . 11 PRO C . 10231 1 47 . 1 1 11 11 PRO CA C 13 63.793 0.300 . 1 . . . . 11 PRO CA . 10231 1 48 . 1 1 11 11 PRO CB C 13 32.413 0.300 . 1 . . . . 11 PRO CB . 10231 1 49 . 1 1 11 11 PRO CD C 13 50.702 0.300 . 1 . . . . 11 PRO CD . 10231 1 50 . 1 1 11 11 PRO CG C 13 26.676 0.300 . 1 . . . . 11 PRO CG . 10231 1 51 . 1 1 12 12 TYR H H 1 7.673 0.030 . 1 . . . . 12 TYR H . 10231 1 52 . 1 1 12 12 TYR HA H 1 4.713 0.030 . 1 . . . . 12 TYR HA . 10231 1 53 . 1 1 12 12 TYR HB2 H 1 2.750 0.030 . 2 . . . . 12 TYR HB2 . 10231 1 54 . 1 1 12 12 TYR HB3 H 1 3.056 0.030 . 2 . . . . 12 TYR HB3 . 10231 1 55 . 1 1 12 12 TYR HD1 H 1 6.975 0.030 . 1 . . . . 12 TYR HD1 . 10231 1 56 . 1 1 12 12 TYR HD2 H 1 6.975 0.030 . 1 . . . . 12 TYR HD2 . 10231 1 57 . 1 1 12 12 TYR HE1 H 1 6.869 0.030 . 1 . . . . 12 TYR HE1 . 10231 1 58 . 1 1 12 12 TYR HE2 H 1 6.869 0.030 . 1 . . . . 12 TYR HE2 . 10231 1 59 . 1 1 12 12 TYR C C 13 174.235 0.300 . 1 . . . . 12 TYR C . 10231 1 60 . 1 1 12 12 TYR CA C 13 57.962 0.300 . 1 . . . . 12 TYR CA . 10231 1 61 . 1 1 12 12 TYR CB C 13 39.042 0.300 . 1 . . . . 12 TYR CB . 10231 1 62 . 1 1 12 12 TYR CD1 C 13 132.994 0.300 . 1 . . . . 12 TYR CD1 . 10231 1 63 . 1 1 12 12 TYR CD2 C 13 132.994 0.300 . 1 . . . . 12 TYR CD2 . 10231 1 64 . 1 1 12 12 TYR CE1 C 13 118.526 0.300 . 1 . . . . 12 TYR CE1 . 10231 1 65 . 1 1 12 12 TYR CE2 C 13 118.526 0.300 . 1 . . . . 12 TYR CE2 . 10231 1 66 . 1 1 12 12 TYR N N 15 117.472 0.300 . 1 . . . . 12 TYR N . 10231 1 67 . 1 1 13 13 LYS H H 1 8.748 0.030 . 1 . . . . 13 LYS H . 10231 1 68 . 1 1 13 13 LYS HA H 1 5.148 0.030 . 1 . . . . 13 LYS HA . 10231 1 69 . 1 1 13 13 LYS HB2 H 1 1.471 0.030 . 2 . . . . 13 LYS HB2 . 10231 1 70 . 1 1 13 13 LYS HB3 H 1 1.721 0.030 . 2 . . . . 13 LYS HB3 . 10231 1 71 . 1 1 13 13 LYS HD2 H 1 1.616 0.030 . 2 . . . . 13 LYS HD2 . 10231 1 72 . 1 1 13 13 LYS HD3 H 1 1.525 0.030 . 2 . . . . 13 LYS HD3 . 10231 1 73 . 1 1 13 13 LYS HE2 H 1 2.883 0.030 . 1 . . . . 13 LYS HE2 . 10231 1 74 . 1 1 13 13 LYS HE3 H 1 2.883 0.030 . 1 . . . . 13 LYS HE3 . 10231 1 75 . 1 1 13 13 LYS HG2 H 1 1.166 0.030 . 2 . . . . 13 LYS HG2 . 10231 1 76 . 1 1 13 13 LYS HG3 H 1 1.056 0.030 . 2 . . . . 13 LYS HG3 . 10231 1 77 . 1 1 13 13 LYS C C 13 174.652 0.300 . 1 . . . . 13 LYS C . 10231 1 78 . 1 1 13 13 LYS CA C 13 54.661 0.300 . 1 . . . . 13 LYS CA . 10231 1 79 . 1 1 13 13 LYS CB C 13 36.500 0.300 . 1 . . . . 13 LYS CB . 10231 1 80 . 1 1 13 13 LYS CD C 13 29.646 0.300 . 1 . . . . 13 LYS CD . 10231 1 81 . 1 1 13 13 LYS CE C 13 41.978 0.300 . 1 . . . . 13 LYS CE . 10231 1 82 . 1 1 13 13 LYS CG C 13 24.260 0.300 . 1 . . . . 13 LYS CG . 10231 1 83 . 1 1 13 13 LYS N N 15 124.877 0.300 . 1 . . . . 13 LYS N . 10231 1 84 . 1 1 14 14 CYS H H 1 9.450 0.030 . 1 . . . . 14 CYS H . 10231 1 85 . 1 1 14 14 CYS HA H 1 4.588 0.030 . 1 . . . . 14 CYS HA . 10231 1 86 . 1 1 14 14 CYS HB2 H 1 2.841 0.030 . 2 . . . . 14 CYS HB2 . 10231 1 87 . 1 1 14 14 CYS HB3 H 1 3.398 0.030 . 2 . . . . 14 CYS HB3 . 10231 1 88 . 1 1 14 14 CYS C C 13 177.307 0.300 . 1 . . . . 14 CYS C . 10231 1 89 . 1 1 14 14 CYS CA C 13 59.198 0.300 . 1 . . . . 14 CYS CA . 10231 1 90 . 1 1 14 14 CYS CB C 13 29.918 0.300 . 1 . . . . 14 CYS CB . 10231 1 91 . 1 1 14 14 CYS N N 15 128.056 0.300 . 1 . . . . 14 CYS N . 10231 1 92 . 1 1 15 15 GLU H H 1 9.541 0.030 . 1 . . . . 15 GLU H . 10231 1 93 . 1 1 15 15 GLU HA H 1 4.161 0.030 . 1 . . . . 15 GLU HA . 10231 1 94 . 1 1 15 15 GLU HB2 H 1 2.213 0.030 . 2 . . . . 15 GLU HB2 . 10231 1 95 . 1 1 15 15 GLU HB3 H 1 2.062 0.030 . 2 . . . . 15 GLU HB3 . 10231 1 96 . 1 1 15 15 GLU HG2 H 1 2.454 0.030 . 2 . . . . 15 GLU HG2 . 10231 1 97 . 1 1 15 15 GLU HG3 H 1 2.393 0.030 . 2 . . . . 15 GLU HG3 . 10231 1 98 . 1 1 15 15 GLU C C 13 176.855 0.300 . 1 . . . . 15 GLU C . 10231 1 99 . 1 1 15 15 GLU CA C 13 58.462 0.300 . 1 . . . . 15 GLU CA . 10231 1 100 . 1 1 15 15 GLU CB C 13 29.612 0.300 . 1 . . . . 15 GLU CB . 10231 1 101 . 1 1 15 15 GLU CG C 13 36.024 0.300 . 1 . . . . 15 GLU CG . 10231 1 102 . 1 1 15 15 GLU N N 15 131.947 0.300 . 1 . . . . 15 GLU N . 10231 1 103 . 1 1 16 16 THR H H 1 8.761 0.030 . 1 . . . . 16 THR H . 10231 1 104 . 1 1 16 16 THR HA H 1 4.016 0.030 . 1 . . . . 16 THR HA . 10231 1 105 . 1 1 16 16 THR HB H 1 3.333 0.030 . 1 . . . . 16 THR HB . 10231 1 106 . 1 1 16 16 THR HG21 H 1 0.582 0.030 . 1 . . . . 16 THR HG2 . 10231 1 107 . 1 1 16 16 THR HG22 H 1 0.582 0.030 . 1 . . . . 16 THR HG2 . 10231 1 108 . 1 1 16 16 THR HG23 H 1 0.582 0.030 . 1 . . . . 16 THR HG2 . 10231 1 109 . 1 1 16 16 THR C C 13 174.867 0.300 . 1 . . . . 16 THR C . 10231 1 110 . 1 1 16 16 THR CA C 13 66.144 0.300 . 1 . . . . 16 THR CA . 10231 1 111 . 1 1 16 16 THR CB C 13 68.802 0.300 . 1 . . . . 16 THR CB . 10231 1 112 . 1 1 16 16 THR CG2 C 13 20.382 0.300 . 1 . . . . 16 THR CG2 . 10231 1 113 . 1 1 16 16 THR N N 15 118.440 0.300 . 1 . . . . 16 THR N . 10231 1 114 . 1 1 17 17 CYS H H 1 8.259 0.030 . 1 . . . . 17 CYS H . 10231 1 115 . 1 1 17 17 CYS HA H 1 5.198 0.030 . 1 . . . . 17 CYS HA . 10231 1 116 . 1 1 17 17 CYS HB2 H 1 2.720 0.030 . 2 . . . . 17 CYS HB2 . 10231 1 117 . 1 1 17 17 CYS HB3 H 1 3.463 0.030 . 2 . . . . 17 CYS HB3 . 10231 1 118 . 1 1 17 17 CYS C C 13 176.245 0.300 . 1 . . . . 17 CYS C . 10231 1 119 . 1 1 17 17 CYS CA C 13 58.242 0.300 . 1 . . . . 17 CYS CA . 10231 1 120 . 1 1 17 17 CYS CB C 13 32.889 0.300 . 1 . . . . 17 CYS CB . 10231 1 121 . 1 1 17 17 CYS N N 15 118.012 0.300 . 1 . . . . 17 CYS N . 10231 1 122 . 1 1 18 18 GLY H H 1 8.142 0.030 . 1 . . . . 18 GLY H . 10231 1 123 . 1 1 18 18 GLY HA2 H 1 3.685 0.030 . 2 . . . . 18 GLY HA2 . 10231 1 124 . 1 1 18 18 GLY HA3 H 1 4.275 0.030 . 2 . . . . 18 GLY HA3 . 10231 1 125 . 1 1 18 18 GLY C C 13 173.304 0.300 . 1 . . . . 18 GLY C . 10231 1 126 . 1 1 18 18 GLY CA C 13 46.166 0.300 . 1 . . . . 18 GLY CA . 10231 1 127 . 1 1 18 18 GLY N N 15 113.635 0.300 . 1 . . . . 18 GLY N . 10231 1 128 . 1 1 19 19 ALA H H 1 8.257 0.030 . 1 . . . . 19 ALA H . 10231 1 129 . 1 1 19 19 ALA HA H 1 4.006 0.030 . 1 . . . . 19 ALA HA . 10231 1 130 . 1 1 19 19 ALA HB1 H 1 0.984 0.030 . 1 . . . . 19 ALA HB . 10231 1 131 . 1 1 19 19 ALA HB2 H 1 0.984 0.030 . 1 . . . . 19 ALA HB . 10231 1 132 . 1 1 19 19 ALA HB3 H 1 0.984 0.030 . 1 . . . . 19 ALA HB . 10231 1 133 . 1 1 19 19 ALA C C 13 175.055 0.300 . 1 . . . . 19 ALA C . 10231 1 134 . 1 1 19 19 ALA CA C 13 53.537 0.300 . 1 . . . . 19 ALA CA . 10231 1 135 . 1 1 19 19 ALA CB C 13 19.738 0.300 . 1 . . . . 19 ALA CB . 10231 1 136 . 1 1 19 19 ALA N N 15 125.690 0.300 . 1 . . . . 19 ALA N . 10231 1 137 . 1 1 20 20 ARG H H 1 7.669 0.030 . 1 . . . . 20 ARG H . 10231 1 138 . 1 1 20 20 ARG HA H 1 5.257 0.030 . 1 . . . . 20 ARG HA . 10231 1 139 . 1 1 20 20 ARG HB2 H 1 1.380 0.030 . 2 . . . . 20 ARG HB2 . 10231 1 140 . 1 1 20 20 ARG HB3 H 1 1.748 0.030 . 2 . . . . 20 ARG HB3 . 10231 1 141 . 1 1 20 20 ARG HD2 H 1 3.190 0.030 . 1 . . . . 20 ARG HD2 . 10231 1 142 . 1 1 20 20 ARG HD3 H 1 3.190 0.030 . 1 . . . . 20 ARG HD3 . 10231 1 143 . 1 1 20 20 ARG HG2 H 1 1.304 0.030 . 2 . . . . 20 ARG HG2 . 10231 1 144 . 1 1 20 20 ARG HG3 H 1 1.751 0.030 . 2 . . . . 20 ARG HG3 . 10231 1 145 . 1 1 20 20 ARG C C 13 175.609 0.300 . 1 . . . . 20 ARG C . 10231 1 146 . 1 1 20 20 ARG CA C 13 54.238 0.300 . 1 . . . . 20 ARG CA . 10231 1 147 . 1 1 20 20 ARG CB C 13 34.243 0.300 . 1 . . . . 20 ARG CB . 10231 1 148 . 1 1 20 20 ARG CD C 13 43.340 0.300 . 1 . . . . 20 ARG CD . 10231 1 149 . 1 1 20 20 ARG CG C 13 28.103 0.300 . 1 . . . . 20 ARG CG . 10231 1 150 . 1 1 20 20 ARG N N 15 117.237 0.300 . 1 . . . . 20 ARG N . 10231 1 151 . 1 1 21 21 PHE H H 1 8.754 0.030 . 1 . . . . 21 PHE H . 10231 1 152 . 1 1 21 21 PHE HA H 1 4.856 0.030 . 1 . . . . 21 PHE HA . 10231 1 153 . 1 1 21 21 PHE HB2 H 1 2.559 0.030 . 2 . . . . 21 PHE HB2 . 10231 1 154 . 1 1 21 21 PHE HB3 H 1 3.577 0.030 . 2 . . . . 21 PHE HB3 . 10231 1 155 . 1 1 21 21 PHE HD1 H 1 7.206 0.030 . 1 . . . . 21 PHE HD1 . 10231 1 156 . 1 1 21 21 PHE HD2 H 1 7.206 0.030 . 1 . . . . 21 PHE HD2 . 10231 1 157 . 1 1 21 21 PHE HE1 H 1 6.846 0.030 . 1 . . . . 21 PHE HE1 . 10231 1 158 . 1 1 21 21 PHE HE2 H 1 6.846 0.030 . 1 . . . . 21 PHE HE2 . 10231 1 159 . 1 1 21 21 PHE HZ H 1 6.238 0.030 . 1 . . . . 21 PHE HZ . 10231 1 160 . 1 1 21 21 PHE C C 13 175.009 0.300 . 1 . . . . 21 PHE C . 10231 1 161 . 1 1 21 21 PHE CA C 13 57.344 0.300 . 1 . . . . 21 PHE CA . 10231 1 162 . 1 1 21 21 PHE CB C 13 44.452 0.300 . 1 . . . . 21 PHE CB . 10231 1 163 . 1 1 21 21 PHE CD1 C 13 132.338 0.300 . 1 . . . . 21 PHE CD1 . 10231 1 164 . 1 1 21 21 PHE CD2 C 13 132.338 0.300 . 1 . . . . 21 PHE CD2 . 10231 1 165 . 1 1 21 21 PHE CE1 C 13 130.868 0.300 . 1 . . . . 21 PHE CE1 . 10231 1 166 . 1 1 21 21 PHE CE2 C 13 130.868 0.300 . 1 . . . . 21 PHE CE2 . 10231 1 167 . 1 1 21 21 PHE CZ C 13 129.313 0.300 . 1 . . . . 21 PHE CZ . 10231 1 168 . 1 1 21 21 PHE N N 15 116.093 0.300 . 1 . . . . 21 PHE N . 10231 1 169 . 1 1 22 22 VAL H H 1 9.432 0.030 . 1 . . . . 22 VAL H . 10231 1 170 . 1 1 22 22 VAL HA H 1 4.298 0.030 . 1 . . . . 22 VAL HA . 10231 1 171 . 1 1 22 22 VAL HB H 1 2.315 0.030 . 1 . . . . 22 VAL HB . 10231 1 172 . 1 1 22 22 VAL HG11 H 1 1.174 0.030 . 1 . . . . 22 VAL HG1 . 10231 1 173 . 1 1 22 22 VAL HG12 H 1 1.174 0.030 . 1 . . . . 22 VAL HG1 . 10231 1 174 . 1 1 22 22 VAL HG13 H 1 1.174 0.030 . 1 . . . . 22 VAL HG1 . 10231 1 175 . 1 1 22 22 VAL HG21 H 1 1.238 0.030 . 1 . . . . 22 VAL HG2 . 10231 1 176 . 1 1 22 22 VAL HG22 H 1 1.238 0.030 . 1 . . . . 22 VAL HG2 . 10231 1 177 . 1 1 22 22 VAL HG23 H 1 1.238 0.030 . 1 . . . . 22 VAL HG2 . 10231 1 178 . 1 1 22 22 VAL C C 13 175.477 0.300 . 1 . . . . 22 VAL C . 10231 1 179 . 1 1 22 22 VAL CA C 13 64.474 0.300 . 1 . . . . 22 VAL CA . 10231 1 180 . 1 1 22 22 VAL CB C 13 33.259 0.300 . 1 . . . . 22 VAL CB . 10231 1 181 . 1 1 22 22 VAL CG1 C 13 21.812 0.300 . 2 . . . . 22 VAL CG1 . 10231 1 182 . 1 1 22 22 VAL CG2 C 13 22.169 0.300 . 2 . . . . 22 VAL CG2 . 10231 1 183 . 1 1 22 22 VAL N N 15 119.283 0.300 . 1 . . . . 22 VAL N . 10231 1 184 . 1 1 23 23 GLN H H 1 7.243 0.030 . 1 . . . . 23 GLN H . 10231 1 185 . 1 1 23 23 GLN HA H 1 4.810 0.030 . 1 . . . . 23 GLN HA . 10231 1 186 . 1 1 23 23 GLN HB2 H 1 1.991 0.030 . 2 . . . . 23 GLN HB2 . 10231 1 187 . 1 1 23 23 GLN HB3 H 1 0.838 0.030 . 2 . . . . 23 GLN HB3 . 10231 1 188 . 1 1 23 23 GLN HE21 H 1 6.877 0.030 . 2 . . . . 23 GLN HE21 . 10231 1 189 . 1 1 23 23 GLN HE22 H 1 7.452 0.030 . 2 . . . . 23 GLN HE22 . 10231 1 190 . 1 1 23 23 GLN HG2 H 1 2.250 0.030 . 2 . . . . 23 GLN HG2 . 10231 1 191 . 1 1 23 23 GLN HG3 H 1 2.141 0.030 . 2 . . . . 23 GLN HG3 . 10231 1 192 . 1 1 23 23 GLN C C 13 176.882 0.300 . 1 . . . . 23 GLN C . 10231 1 193 . 1 1 23 23 GLN CA C 13 53.454 0.300 . 1 . . . . 23 GLN CA . 10231 1 194 . 1 1 23 23 GLN CB C 13 30.682 0.300 . 1 . . . . 23 GLN CB . 10231 1 195 . 1 1 23 23 GLN CG C 13 33.495 0.300 . 1 . . . . 23 GLN CG . 10231 1 196 . 1 1 23 23 GLN N N 15 113.909 0.300 . 1 . . . . 23 GLN N . 10231 1 197 . 1 1 23 23 GLN NE2 N 15 111.659 0.300 . 1 . . . . 23 GLN NE2 . 10231 1 198 . 1 1 24 24 VAL H H 1 8.554 0.030 . 1 . . . . 24 VAL H . 10231 1 199 . 1 1 24 24 VAL HA H 1 2.960 0.030 . 1 . . . . 24 VAL HA . 10231 1 200 . 1 1 24 24 VAL HB H 1 1.284 0.030 . 1 . . . . 24 VAL HB . 10231 1 201 . 1 1 24 24 VAL HG11 H 1 0.728 0.030 . 1 . . . . 24 VAL HG1 . 10231 1 202 . 1 1 24 24 VAL HG12 H 1 0.728 0.030 . 1 . . . . 24 VAL HG1 . 10231 1 203 . 1 1 24 24 VAL HG13 H 1 0.728 0.030 . 1 . . . . 24 VAL HG1 . 10231 1 204 . 1 1 24 24 VAL HG21 H 1 0.613 0.030 . 1 . . . . 24 VAL HG2 . 10231 1 205 . 1 1 24 24 VAL HG22 H 1 0.613 0.030 . 1 . . . . 24 VAL HG2 . 10231 1 206 . 1 1 24 24 VAL HG23 H 1 0.613 0.030 . 1 . . . . 24 VAL HG2 . 10231 1 207 . 1 1 24 24 VAL C C 13 177.337 0.300 . 1 . . . . 24 VAL C . 10231 1 208 . 1 1 24 24 VAL CA C 13 65.388 0.300 . 1 . . . . 24 VAL CA . 10231 1 209 . 1 1 24 24 VAL CB C 13 30.927 0.300 . 1 . . . . 24 VAL CB . 10231 1 210 . 1 1 24 24 VAL CG1 C 13 19.772 0.300 . 2 . . . . 24 VAL CG1 . 10231 1 211 . 1 1 24 24 VAL CG2 C 13 22.322 0.300 . 2 . . . . 24 VAL CG2 . 10231 1 212 . 1 1 24 24 VAL N N 15 126.915 0.300 . 1 . . . . 24 VAL N . 10231 1 213 . 1 1 25 25 ALA H H 1 8.531 0.030 . 1 . . . . 25 ALA H . 10231 1 214 . 1 1 25 25 ALA HA H 1 3.933 0.030 . 1 . . . . 25 ALA HA . 10231 1 215 . 1 1 25 25 ALA HB1 H 1 1.317 0.030 . 1 . . . . 25 ALA HB . 10231 1 216 . 1 1 25 25 ALA HB2 H 1 1.317 0.030 . 1 . . . . 25 ALA HB . 10231 1 217 . 1 1 25 25 ALA HB3 H 1 1.317 0.030 . 1 . . . . 25 ALA HB . 10231 1 218 . 1 1 25 25 ALA C C 13 180.524 0.300 . 1 . . . . 25 ALA C . 10231 1 219 . 1 1 25 25 ALA CA C 13 55.073 0.300 . 1 . . . . 25 ALA CA . 10231 1 220 . 1 1 25 25 ALA CB C 13 18.311 0.300 . 1 . . . . 25 ALA CB . 10231 1 221 . 1 1 25 25 ALA N N 15 122.114 0.300 . 1 . . . . 25 ALA N . 10231 1 222 . 1 1 26 26 HIS H H 1 6.892 0.030 . 1 . . . . 26 HIS H . 10231 1 223 . 1 1 26 26 HIS HA H 1 4.436 0.030 . 1 . . . . 26 HIS HA . 10231 1 224 . 1 1 26 26 HIS HB2 H 1 3.246 0.030 . 2 . . . . 26 HIS HB2 . 10231 1 225 . 1 1 26 26 HIS HB3 H 1 3.433 0.030 . 2 . . . . 26 HIS HB3 . 10231 1 226 . 1 1 26 26 HIS HD2 H 1 6.867 0.030 . 1 . . . . 26 HIS HD2 . 10231 1 227 . 1 1 26 26 HIS HE1 H 1 7.832 0.030 . 1 . . . . 26 HIS HE1 . 10231 1 228 . 1 1 26 26 HIS C C 13 178.267 0.300 . 1 . . . . 26 HIS C . 10231 1 229 . 1 1 26 26 HIS CA C 13 56.426 0.300 . 1 . . . . 26 HIS CA . 10231 1 230 . 1 1 26 26 HIS CB C 13 31.750 0.300 . 1 . . . . 26 HIS CB . 10231 1 231 . 1 1 26 26 HIS CD2 C 13 116.173 0.300 . 1 . . . . 26 HIS CD2 . 10231 1 232 . 1 1 26 26 HIS CE1 C 13 139.144 0.300 . 1 . . . . 26 HIS CE1 . 10231 1 233 . 1 1 26 26 HIS N N 15 115.625 0.300 . 1 . . . . 26 HIS N . 10231 1 234 . 1 1 27 27 LEU H H 1 6.854 0.030 . 1 . . . . 27 LEU H . 10231 1 235 . 1 1 27 27 LEU HA H 1 3.189 0.030 . 1 . . . . 27 LEU HA . 10231 1 236 . 1 1 27 27 LEU HB2 H 1 1.993 0.030 . 2 . . . . 27 LEU HB2 . 10231 1 237 . 1 1 27 27 LEU HB3 H 1 1.168 0.030 . 2 . . . . 27 LEU HB3 . 10231 1 238 . 1 1 27 27 LEU HD11 H 1 1.027 0.030 . 1 . . . . 27 LEU HD1 . 10231 1 239 . 1 1 27 27 LEU HD12 H 1 1.027 0.030 . 1 . . . . 27 LEU HD1 . 10231 1 240 . 1 1 27 27 LEU HD13 H 1 1.027 0.030 . 1 . . . . 27 LEU HD1 . 10231 1 241 . 1 1 27 27 LEU HD21 H 1 0.963 0.030 . 1 . . . . 27 LEU HD2 . 10231 1 242 . 1 1 27 27 LEU HD22 H 1 0.963 0.030 . 1 . . . . 27 LEU HD2 . 10231 1 243 . 1 1 27 27 LEU HD23 H 1 0.963 0.030 . 1 . . . . 27 LEU HD2 . 10231 1 244 . 1 1 27 27 LEU HG H 1 1.600 0.030 . 1 . . . . 27 LEU HG . 10231 1 245 . 1 1 27 27 LEU C C 13 177.246 0.300 . 1 . . . . 27 LEU C . 10231 1 246 . 1 1 27 27 LEU CA C 13 57.874 0.300 . 1 . . . . 27 LEU CA . 10231 1 247 . 1 1 27 27 LEU CB C 13 40.685 0.300 . 1 . . . . 27 LEU CB . 10231 1 248 . 1 1 27 27 LEU CD1 C 13 26.466 0.300 . 2 . . . . 27 LEU CD1 . 10231 1 249 . 1 1 27 27 LEU CD2 C 13 23.156 0.300 . 2 . . . . 27 LEU CD2 . 10231 1 250 . 1 1 27 27 LEU CG C 13 27.290 0.300 . 1 . . . . 27 LEU CG . 10231 1 251 . 1 1 27 27 LEU N N 15 122.027 0.300 . 1 . . . . 27 LEU N . 10231 1 252 . 1 1 28 28 ARG H H 1 8.252 0.030 . 1 . . . . 28 ARG H . 10231 1 253 . 1 1 28 28 ARG HA H 1 3.867 0.030 . 1 . . . . 28 ARG HA . 10231 1 254 . 1 1 28 28 ARG HB2 H 1 1.782 0.030 . 2 . . . . 28 ARG HB2 . 10231 1 255 . 1 1 28 28 ARG HB3 H 1 1.735 0.030 . 2 . . . . 28 ARG HB3 . 10231 1 256 . 1 1 28 28 ARG HD2 H 1 3.133 0.030 . 2 . . . . 28 ARG HD2 . 10231 1 257 . 1 1 28 28 ARG HD3 H 1 3.044 0.030 . 2 . . . . 28 ARG HD3 . 10231 1 258 . 1 1 28 28 ARG HG2 H 1 1.594 0.030 . 2 . . . . 28 ARG HG2 . 10231 1 259 . 1 1 28 28 ARG HG3 H 1 1.709 0.030 . 2 . . . . 28 ARG HG3 . 10231 1 260 . 1 1 28 28 ARG C C 13 178.248 0.300 . 1 . . . . 28 ARG C . 10231 1 261 . 1 1 28 28 ARG CA C 13 59.410 0.300 . 1 . . . . 28 ARG CA . 10231 1 262 . 1 1 28 28 ARG CB C 13 29.762 0.300 . 1 . . . . 28 ARG CB . 10231 1 263 . 1 1 28 28 ARG CD C 13 43.333 0.300 . 1 . . . . 28 ARG CD . 10231 1 264 . 1 1 28 28 ARG CG C 13 27.782 0.300 . 1 . . . . 28 ARG CG . 10231 1 265 . 1 1 28 28 ARG N N 15 117.010 0.300 . 1 . . . . 28 ARG N . 10231 1 266 . 1 1 29 29 ALA H H 1 7.223 0.030 . 1 . . . . 29 ALA H . 10231 1 267 . 1 1 29 29 ALA HA H 1 4.146 0.030 . 1 . . . . 29 ALA HA . 10231 1 268 . 1 1 29 29 ALA HB1 H 1 1.402 0.030 . 1 . . . . 29 ALA HB . 10231 1 269 . 1 1 29 29 ALA HB2 H 1 1.402 0.030 . 1 . . . . 29 ALA HB . 10231 1 270 . 1 1 29 29 ALA HB3 H 1 1.402 0.030 . 1 . . . . 29 ALA HB . 10231 1 271 . 1 1 29 29 ALA C C 13 179.428 0.300 . 1 . . . . 29 ALA C . 10231 1 272 . 1 1 29 29 ALA CA C 13 54.170 0.300 . 1 . . . . 29 ALA CA . 10231 1 273 . 1 1 29 29 ALA CB C 13 18.345 0.300 . 1 . . . . 29 ALA CB . 10231 1 274 . 1 1 29 29 ALA N N 15 118.170 0.300 . 1 . . . . 29 ALA N . 10231 1 275 . 1 1 30 30 HIS H H 1 7.527 0.030 . 1 . . . . 30 HIS H . 10231 1 276 . 1 1 30 30 HIS HA H 1 4.166 0.030 . 1 . . . . 30 HIS HA . 10231 1 277 . 1 1 30 30 HIS HB2 H 1 2.863 0.030 . 2 . . . . 30 HIS HB2 . 10231 1 278 . 1 1 30 30 HIS HB3 H 1 3.144 0.030 . 2 . . . . 30 HIS HB3 . 10231 1 279 . 1 1 30 30 HIS HD2 H 1 7.012 0.030 . 1 . . . . 30 HIS HD2 . 10231 1 280 . 1 1 30 30 HIS HE1 H 1 7.981 0.030 . 1 . . . . 30 HIS HE1 . 10231 1 281 . 1 1 30 30 HIS C C 13 176.978 0.300 . 1 . . . . 30 HIS C . 10231 1 282 . 1 1 30 30 HIS CA C 13 59.490 0.300 . 1 . . . . 30 HIS CA . 10231 1 283 . 1 1 30 30 HIS CB C 13 28.889 0.300 . 1 . . . . 30 HIS CB . 10231 1 284 . 1 1 30 30 HIS CD2 C 13 127.192 0.300 . 1 . . . . 30 HIS CD2 . 10231 1 285 . 1 1 30 30 HIS CE1 C 13 139.625 0.300 . 1 . . . . 30 HIS CE1 . 10231 1 286 . 1 1 30 30 HIS N N 15 118.012 0.300 . 1 . . . . 30 HIS N . 10231 1 287 . 1 1 31 31 VAL H H 1 8.251 0.030 . 1 . . . . 31 VAL H . 10231 1 288 . 1 1 31 31 VAL HA H 1 3.659 0.030 . 1 . . . . 31 VAL HA . 10231 1 289 . 1 1 31 31 VAL HB H 1 2.432 0.030 . 1 . . . . 31 VAL HB . 10231 1 290 . 1 1 31 31 VAL HG11 H 1 1.397 0.030 . 1 . . . . 31 VAL HG1 . 10231 1 291 . 1 1 31 31 VAL HG12 H 1 1.397 0.030 . 1 . . . . 31 VAL HG1 . 10231 1 292 . 1 1 31 31 VAL HG13 H 1 1.397 0.030 . 1 . . . . 31 VAL HG1 . 10231 1 293 . 1 1 31 31 VAL HG21 H 1 1.195 0.030 . 1 . . . . 31 VAL HG2 . 10231 1 294 . 1 1 31 31 VAL HG22 H 1 1.195 0.030 . 1 . . . . 31 VAL HG2 . 10231 1 295 . 1 1 31 31 VAL HG23 H 1 1.195 0.030 . 1 . . . . 31 VAL HG2 . 10231 1 296 . 1 1 31 31 VAL C C 13 177.594 0.300 . 1 . . . . 31 VAL C . 10231 1 297 . 1 1 31 31 VAL CA C 13 65.958 0.300 . 1 . . . . 31 VAL CA . 10231 1 298 . 1 1 31 31 VAL CB C 13 31.636 0.300 . 1 . . . . 31 VAL CB . 10231 1 299 . 1 1 31 31 VAL CG1 C 13 22.169 0.300 . 2 . . . . 31 VAL CG1 . 10231 1 300 . 1 1 31 31 VAL CG2 C 13 20.716 0.300 . 2 . . . . 31 VAL CG2 . 10231 1 301 . 1 1 31 31 VAL N N 15 112.141 0.300 . 1 . . . . 31 VAL N . 10231 1 302 . 1 1 32 32 LEU H H 1 6.906 0.030 . 1 . . . . 32 LEU H . 10231 1 303 . 1 1 32 32 LEU HA H 1 4.135 0.030 . 1 . . . . 32 LEU HA . 10231 1 304 . 1 1 32 32 LEU HB2 H 1 1.490 0.030 . 2 . . . . 32 LEU HB2 . 10231 1 305 . 1 1 32 32 LEU HB3 H 1 1.719 0.030 . 2 . . . . 32 LEU HB3 . 10231 1 306 . 1 1 32 32 LEU HD11 H 1 0.931 0.030 . 1 . . . . 32 LEU HD1 . 10231 1 307 . 1 1 32 32 LEU HD12 H 1 0.931 0.030 . 1 . . . . 32 LEU HD1 . 10231 1 308 . 1 1 32 32 LEU HD13 H 1 0.931 0.030 . 1 . . . . 32 LEU HD1 . 10231 1 309 . 1 1 32 32 LEU HD21 H 1 0.841 0.030 . 1 . . . . 32 LEU HD2 . 10231 1 310 . 1 1 32 32 LEU HD22 H 1 0.841 0.030 . 1 . . . . 32 LEU HD2 . 10231 1 311 . 1 1 32 32 LEU HD23 H 1 0.841 0.030 . 1 . . . . 32 LEU HD2 . 10231 1 312 . 1 1 32 32 LEU HG H 1 1.827 0.030 . 1 . . . . 32 LEU HG . 10231 1 313 . 1 1 32 32 LEU C C 13 179.626 0.300 . 1 . . . . 32 LEU C . 10231 1 314 . 1 1 32 32 LEU CA C 13 56.826 0.300 . 1 . . . . 32 LEU CA . 10231 1 315 . 1 1 32 32 LEU CB C 13 41.476 0.300 . 1 . . . . 32 LEU CB . 10231 1 316 . 1 1 32 32 LEU CD1 C 13 25.147 0.300 . 2 . . . . 32 LEU CD1 . 10231 1 317 . 1 1 32 32 LEU CD2 C 13 22.621 0.300 . 2 . . . . 32 LEU CD2 . 10231 1 318 . 1 1 32 32 LEU CG C 13 26.640 0.300 . 1 . . . . 32 LEU CG . 10231 1 319 . 1 1 32 32 LEU N N 15 119.239 0.300 . 1 . . . . 32 LEU N . 10231 1 320 . 1 1 33 33 ILE H H 1 7.880 0.030 . 1 . . . . 33 ILE H . 10231 1 321 . 1 1 33 33 ILE HA H 1 3.971 0.030 . 1 . . . . 33 ILE HA . 10231 1 322 . 1 1 33 33 ILE HB H 1 1.711 0.030 . 1 . . . . 33 ILE HB . 10231 1 323 . 1 1 33 33 ILE HD11 H 1 0.676 0.030 . 1 . . . . 33 ILE HD1 . 10231 1 324 . 1 1 33 33 ILE HD12 H 1 0.676 0.030 . 1 . . . . 33 ILE HD1 . 10231 1 325 . 1 1 33 33 ILE HD13 H 1 0.676 0.030 . 1 . . . . 33 ILE HD1 . 10231 1 326 . 1 1 33 33 ILE HG12 H 1 0.707 0.030 . 2 . . . . 33 ILE HG12 . 10231 1 327 . 1 1 33 33 ILE HG13 H 1 0.913 0.030 . 2 . . . . 33 ILE HG13 . 10231 1 328 . 1 1 33 33 ILE HG21 H 1 0.595 0.030 . 1 . . . . 33 ILE HG2 . 10231 1 329 . 1 1 33 33 ILE HG22 H 1 0.595 0.030 . 1 . . . . 33 ILE HG2 . 10231 1 330 . 1 1 33 33 ILE HG23 H 1 0.595 0.030 . 1 . . . . 33 ILE HG2 . 10231 1 331 . 1 1 33 33 ILE C C 13 177.546 0.300 . 1 . . . . 33 ILE C . 10231 1 332 . 1 1 33 33 ILE CA C 13 63.138 0.300 . 1 . . . . 33 ILE CA . 10231 1 333 . 1 1 33 33 ILE CB C 13 37.587 0.300 . 1 . . . . 33 ILE CB . 10231 1 334 . 1 1 33 33 ILE CD1 C 13 14.274 0.300 . 1 . . . . 33 ILE CD1 . 10231 1 335 . 1 1 33 33 ILE CG1 C 13 26.298 0.300 . 1 . . . . 33 ILE CG1 . 10231 1 336 . 1 1 33 33 ILE CG2 C 13 16.261 0.300 . 1 . . . . 33 ILE CG2 . 10231 1 337 . 1 1 33 33 ILE N N 15 116.394 0.300 . 1 . . . . 33 ILE N . 10231 1 338 . 1 1 34 34 HIS H H 1 7.360 0.030 . 1 . . . . 34 HIS H . 10231 1 339 . 1 1 34 34 HIS HA H 1 4.882 0.030 . 1 . . . . 34 HIS HA . 10231 1 340 . 1 1 34 34 HIS HB2 H 1 3.361 0.030 . 1 . . . . 34 HIS HB2 . 10231 1 341 . 1 1 34 34 HIS HB3 H 1 3.361 0.030 . 1 . . . . 34 HIS HB3 . 10231 1 342 . 1 1 34 34 HIS HD2 H 1 6.877 0.030 . 1 . . . . 34 HIS HD2 . 10231 1 343 . 1 1 34 34 HIS HE1 H 1 8.116 0.030 . 1 . . . . 34 HIS HE1 . 10231 1 344 . 1 1 34 34 HIS C C 13 175.699 0.300 . 1 . . . . 34 HIS C . 10231 1 345 . 1 1 34 34 HIS CA C 13 55.093 0.300 . 1 . . . . 34 HIS CA . 10231 1 346 . 1 1 34 34 HIS CB C 13 28.461 0.300 . 1 . . . . 34 HIS CB . 10231 1 347 . 1 1 34 34 HIS CD2 C 13 127.821 0.300 . 1 . . . . 34 HIS CD2 . 10231 1 348 . 1 1 34 34 HIS CE1 C 13 140.367 0.300 . 1 . . . . 34 HIS CE1 . 10231 1 349 . 1 1 34 34 HIS N N 15 117.627 0.300 . 1 . . . . 34 HIS N . 10231 1 350 . 1 1 35 35 THR H H 1 7.805 0.030 . 1 . . . . 35 THR H . 10231 1 351 . 1 1 35 35 THR HA H 1 4.368 0.030 . 1 . . . . 35 THR HA . 10231 1 352 . 1 1 35 35 THR HB H 1 4.323 0.030 . 1 . . . . 35 THR HB . 10231 1 353 . 1 1 35 35 THR HG21 H 1 1.253 0.030 . 1 . . . . 35 THR HG2 . 10231 1 354 . 1 1 35 35 THR HG22 H 1 1.253 0.030 . 1 . . . . 35 THR HG2 . 10231 1 355 . 1 1 35 35 THR HG23 H 1 1.253 0.030 . 1 . . . . 35 THR HG2 . 10231 1 356 . 1 1 35 35 THR C C 13 175.388 0.300 . 1 . . . . 35 THR C . 10231 1 357 . 1 1 35 35 THR CA C 13 62.548 0.300 . 1 . . . . 35 THR CA . 10231 1 358 . 1 1 35 35 THR CB C 13 69.779 0.300 . 1 . . . . 35 THR CB . 10231 1 359 . 1 1 35 35 THR CG2 C 13 21.479 0.300 . 1 . . . . 35 THR CG2 . 10231 1 360 . 1 1 35 35 THR N N 15 112.000 0.300 . 1 . . . . 35 THR N . 10231 1 361 . 1 1 36 36 GLY H H 1 8.335 0.030 . 1 . . . . 36 GLY H . 10231 1 362 . 1 1 36 36 GLY HA2 H 1 4.049 0.030 . 1 . . . . 36 GLY HA2 . 10231 1 363 . 1 1 36 36 GLY HA3 H 1 4.049 0.030 . 1 . . . . 36 GLY HA3 . 10231 1 364 . 1 1 36 36 GLY C C 13 174.188 0.300 . 1 . . . . 36 GLY C . 10231 1 365 . 1 1 36 36 GLY CA C 13 45.444 0.300 . 1 . . . . 36 GLY CA . 10231 1 366 . 1 1 36 36 GLY N N 15 111.103 0.300 . 1 . . . . 36 GLY N . 10231 1 367 . 1 1 37 37 SER H H 1 8.231 0.030 . 1 . . . . 37 SER H . 10231 1 368 . 1 1 37 37 SER HA H 1 4.521 0.030 . 1 . . . . 37 SER HA . 10231 1 369 . 1 1 37 37 SER HB2 H 1 3.885 0.030 . 1 . . . . 37 SER HB2 . 10231 1 370 . 1 1 37 37 SER HB3 H 1 3.885 0.030 . 1 . . . . 37 SER HB3 . 10231 1 371 . 1 1 37 37 SER C C 13 174.567 0.300 . 1 . . . . 37 SER C . 10231 1 372 . 1 1 37 37 SER CA C 13 58.242 0.300 . 1 . . . . 37 SER CA . 10231 1 373 . 1 1 37 37 SER CB C 13 64.018 0.300 . 1 . . . . 37 SER CB . 10231 1 374 . 1 1 37 37 SER N N 15 115.371 0.300 . 1 . . . . 37 SER N . 10231 1 375 . 1 1 38 38 GLY H H 1 8.310 0.030 . 1 . . . . 38 GLY H . 10231 1 376 . 1 1 38 38 GLY HA2 H 1 4.158 0.030 . 2 . . . . 38 GLY HA2 . 10231 1 377 . 1 1 38 38 GLY HA3 H 1 4.094 0.030 . 2 . . . . 38 GLY HA3 . 10231 1 378 . 1 1 38 38 GLY C C 13 171.799 0.300 . 1 . . . . 38 GLY C . 10231 1 379 . 1 1 38 38 GLY CA C 13 44.671 0.300 . 1 . . . . 38 GLY CA . 10231 1 380 . 1 1 38 38 GLY N N 15 110.735 0.300 . 1 . . . . 38 GLY N . 10231 1 381 . 1 1 39 39 PRO HA H 1 4.476 0.030 . 1 . . . . 39 PRO HA . 10231 1 382 . 1 1 39 39 PRO HB2 H 1 1.978 0.030 . 2 . . . . 39 PRO HB2 . 10231 1 383 . 1 1 39 39 PRO HB3 H 1 2.292 0.030 . 2 . . . . 39 PRO HB3 . 10231 1 384 . 1 1 39 39 PRO HD2 H 1 3.629 0.030 . 1 . . . . 39 PRO HD2 . 10231 1 385 . 1 1 39 39 PRO HD3 H 1 3.629 0.030 . 1 . . . . 39 PRO HD3 . 10231 1 386 . 1 1 39 39 PRO HG2 H 1 2.012 0.030 . 1 . . . . 39 PRO HG2 . 10231 1 387 . 1 1 39 39 PRO HG3 H 1 2.012 0.030 . 1 . . . . 39 PRO HG3 . 10231 1 388 . 1 1 39 39 PRO C C 13 177.307 0.300 . 1 . . . . 39 PRO C . 10231 1 389 . 1 1 39 39 PRO CA C 13 63.131 0.300 . 1 . . . . 39 PRO CA . 10231 1 390 . 1 1 39 39 PRO CB C 13 32.207 0.300 . 1 . . . . 39 PRO CB . 10231 1 391 . 1 1 39 39 PRO CD C 13 49.805 0.300 . 1 . . . . 39 PRO CD . 10231 1 392 . 1 1 39 39 PRO CG C 13 27.177 0.300 . 1 . . . . 39 PRO CG . 10231 1 393 . 1 1 40 40 SER H H 1 8.520 0.030 . 1 . . . . 40 SER H . 10231 1 394 . 1 1 40 40 SER C C 13 174.611 0.300 . 1 . . . . 40 SER C . 10231 1 395 . 1 1 40 40 SER CA C 13 58.516 0.300 . 1 . . . . 40 SER CA . 10231 1 396 . 1 1 40 40 SER CB C 13 64.203 0.300 . 1 . . . . 40 SER CB . 10231 1 397 . 1 1 40 40 SER N N 15 116.387 0.300 . 1 . . . . 40 SER N . 10231 1 stop_ save_