################################### # 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 10174 _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 10174 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10174 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 CA C 13 45.463 0.300 . 1 . . . . 7 GLY CA . 10174 1 2 . 1 1 7 7 GLY HA2 H 1 4.028 0.030 . 1 . . . . 7 GLY HA2 . 10174 1 3 . 1 1 7 7 GLY HA3 H 1 4.028 0.030 . 1 . . . . 7 GLY HA3 . 10174 1 4 . 1 1 7 7 GLY C C 13 174.552 0.300 . 1 . . . . 7 GLY C . 10174 1 5 . 1 1 8 8 THR N N 15 112.866 0.300 . 1 . . . . 8 THR N . 10174 1 6 . 1 1 8 8 THR H H 1 8.147 0.030 . 1 . . . . 8 THR H . 10174 1 7 . 1 1 8 8 THR CA C 13 61.817 0.300 . 1 . . . . 8 THR CA . 10174 1 8 . 1 1 8 8 THR HA H 1 4.339 0.030 . 1 . . . . 8 THR HA . 10174 1 9 . 1 1 8 8 THR CB C 13 69.759 0.300 . 1 . . . . 8 THR CB . 10174 1 10 . 1 1 8 8 THR HB H 1 4.277 0.030 . 1 . . . . 8 THR HB . 10174 1 11 . 1 1 8 8 THR CG2 C 13 21.493 0.300 . 1 . . . . 8 THR CG2 . 10174 1 12 . 1 1 8 8 THR HG21 H 1 1.169 0.030 . 1 . . . . 8 THR HG2 . 10174 1 13 . 1 1 8 8 THR HG22 H 1 1.169 0.030 . 1 . . . . 8 THR HG2 . 10174 1 14 . 1 1 8 8 THR HG23 H 1 1.169 0.030 . 1 . . . . 8 THR HG2 . 10174 1 15 . 1 1 8 8 THR C C 13 175.264 0.300 . 1 . . . . 8 THR C . 10174 1 16 . 1 1 9 9 GLY N N 15 111.067 0.300 . 1 . . . . 9 GLY N . 10174 1 17 . 1 1 9 9 GLY H H 1 8.443 0.030 . 1 . . . . 9 GLY H . 10174 1 18 . 1 1 9 9 GLY CA C 13 45.274 0.300 . 1 . . . . 9 GLY CA . 10174 1 19 . 1 1 9 9 GLY HA2 H 1 3.943 0.030 . 1 . . . . 9 GLY HA2 . 10174 1 20 . 1 1 9 9 GLY HA3 H 1 3.943 0.030 . 1 . . . . 9 GLY HA3 . 10174 1 21 . 1 1 9 9 GLY C C 13 174.030 0.300 . 1 . . . . 9 GLY C . 10174 1 22 . 1 1 10 10 GLU N N 15 120.578 0.300 . 1 . . . . 10 GLU N . 10174 1 23 . 1 1 10 10 GLU H H 1 8.208 0.030 . 1 . . . . 10 GLU H . 10174 1 24 . 1 1 10 10 GLU CA C 13 56.472 0.300 . 1 . . . . 10 GLU CA . 10174 1 25 . 1 1 10 10 GLU HA H 1 4.219 0.030 . 1 . . . . 10 GLU HA . 10174 1 26 . 1 1 10 10 GLU CB C 13 30.440 0.300 . 1 . . . . 10 GLU CB . 10174 1 27 . 1 1 10 10 GLU HB2 H 1 1.928 0.030 . 1 . . . . 10 GLU HB2 . 10174 1 28 . 1 1 10 10 GLU HB3 H 1 1.928 0.030 . 1 . . . . 10 GLU HB3 . 10174 1 29 . 1 1 10 10 GLU CG C 13 36.179 0.300 . 1 . . . . 10 GLU CG . 10174 1 30 . 1 1 10 10 GLU HG2 H 1 2.218 0.030 . 2 . . . . 10 GLU HG2 . 10174 1 31 . 1 1 10 10 GLU C C 13 176.263 0.300 . 1 . . . . 10 GLU C . 10174 1 32 . 1 1 11 11 LYS N N 15 123.011 0.300 . 1 . . . . 11 LYS N . 10174 1 33 . 1 1 11 11 LYS H H 1 8.294 0.030 . 1 . . . . 11 LYS H . 10174 1 34 . 1 1 11 11 LYS CA C 13 53.808 0.300 . 1 . . . . 11 LYS CA . 10174 1 35 . 1 1 11 11 LYS HA H 1 4.507 0.030 . 1 . . . . 11 LYS HA . 10174 1 36 . 1 1 11 11 LYS CB C 13 32.578 0.300 . 1 . . . . 11 LYS CB . 10174 1 37 . 1 1 11 11 LYS HB2 H 1 1.608 0.030 . 1 . . . . 11 LYS HB2 . 10174 1 38 . 1 1 11 11 LYS HB3 H 1 1.608 0.030 . 1 . . . . 11 LYS HB3 . 10174 1 39 . 1 1 11 11 LYS CG C 13 24.640 0.300 . 1 . . . . 11 LYS CG . 10174 1 40 . 1 1 11 11 LYS HG2 H 1 1.324 0.030 . 2 . . . . 11 LYS HG2 . 10174 1 41 . 1 1 11 11 LYS HG3 H 1 1.268 0.030 . 2 . . . . 11 LYS HG3 . 10174 1 42 . 1 1 11 11 LYS CD C 13 29.416 0.300 . 1 . . . . 11 LYS CD . 10174 1 43 . 1 1 11 11 LYS HD2 H 1 1.559 0.030 . 1 . . . . 11 LYS HD2 . 10174 1 44 . 1 1 11 11 LYS HD3 H 1 1.559 0.030 . 1 . . . . 11 LYS HD3 . 10174 1 45 . 1 1 11 11 LYS CE C 13 42.262 0.300 . 1 . . . . 11 LYS CE . 10174 1 46 . 1 1 11 11 LYS HE2 H 1 2.906 0.030 . 1 . . . . 11 LYS HE2 . 10174 1 47 . 1 1 11 11 LYS HE3 H 1 2.906 0.030 . 1 . . . . 11 LYS HE3 . 10174 1 48 . 1 1 11 11 LYS C C 13 174.019 0.300 . 1 . . . . 11 LYS C . 10174 1 49 . 1 1 12 12 PRO CA C 13 62.899 0.300 . 1 . . . . 12 PRO CA . 10174 1 50 . 1 1 12 12 PRO HA H 1 4.290 0.030 . 1 . . . . 12 PRO HA . 10174 1 51 . 1 1 12 12 PRO CB C 13 32.252 0.300 . 1 . . . . 12 PRO CB . 10174 1 52 . 1 1 12 12 PRO HB2 H 1 1.450 0.030 . 2 . . . . 12 PRO HB2 . 10174 1 53 . 1 1 12 12 PRO HB3 H 1 2.038 0.030 . 2 . . . . 12 PRO HB3 . 10174 1 54 . 1 1 12 12 PRO CG C 13 26.800 0.300 . 1 . . . . 12 PRO CG . 10174 1 55 . 1 1 12 12 PRO HG2 H 1 1.846 0.030 . 2 . . . . 12 PRO HG2 . 10174 1 56 . 1 1 12 12 PRO HG3 H 1 1.690 0.030 . 2 . . . . 12 PRO HG3 . 10174 1 57 . 1 1 12 12 PRO CD C 13 50.220 0.300 . 1 . . . . 12 PRO CD . 10174 1 58 . 1 1 12 12 PRO HD2 H 1 3.617 0.030 . 2 . . . . 12 PRO HD2 . 10174 1 59 . 1 1 12 12 PRO HD3 H 1 3.530 0.030 . 2 . . . . 12 PRO HD3 . 10174 1 60 . 1 1 12 12 PRO C C 13 176.475 0.300 . 1 . . . . 12 PRO C . 10174 1 61 . 1 1 13 13 TYR N N 15 119.889 0.300 . 1 . . . . 13 TYR N . 10174 1 62 . 1 1 13 13 TYR H H 1 8.093 0.030 . 1 . . . . 13 TYR H . 10174 1 63 . 1 1 13 13 TYR CA C 13 57.162 0.300 . 1 . . . . 13 TYR CA . 10174 1 64 . 1 1 13 13 TYR HA H 1 4.587 0.030 . 1 . . . . 13 TYR HA . 10174 1 65 . 1 1 13 13 TYR CB C 13 38.013 0.300 . 1 . . . . 13 TYR CB . 10174 1 66 . 1 1 13 13 TYR HB2 H 1 2.900 0.030 . 1 . . . . 13 TYR HB2 . 10174 1 67 . 1 1 13 13 TYR HB3 H 1 2.900 0.030 . 1 . . . . 13 TYR HB3 . 10174 1 68 . 1 1 13 13 TYR CD1 C 13 133.151 0.300 . 1 . . . . 13 TYR CD1 . 10174 1 69 . 1 1 13 13 TYR HD1 H 1 6.958 0.030 . 1 . . . . 13 TYR HD1 . 10174 1 70 . 1 1 13 13 TYR CD2 C 13 133.151 0.300 . 1 . . . . 13 TYR CD2 . 10174 1 71 . 1 1 13 13 TYR HD2 H 1 6.958 0.030 . 1 . . . . 13 TYR HD2 . 10174 1 72 . 1 1 13 13 TYR CE1 C 13 118.278 0.300 . 1 . . . . 13 TYR CE1 . 10174 1 73 . 1 1 13 13 TYR HE1 H 1 6.798 0.030 . 1 . . . . 13 TYR HE1 . 10174 1 74 . 1 1 13 13 TYR CE2 C 13 118.278 0.300 . 1 . . . . 13 TYR CE2 . 10174 1 75 . 1 1 13 13 TYR HE2 H 1 6.798 0.030 . 1 . . . . 13 TYR HE2 . 10174 1 76 . 1 1 13 13 TYR C C 13 174.036 0.300 . 1 . . . . 13 TYR C . 10174 1 77 . 1 1 14 14 LYS N N 15 124.683 0.300 . 1 . . . . 14 LYS N . 10174 1 78 . 1 1 14 14 LYS H H 1 8.350 0.030 . 1 . . . . 14 LYS H . 10174 1 79 . 1 1 14 14 LYS CA C 13 54.699 0.300 . 1 . . . . 14 LYS CA . 10174 1 80 . 1 1 14 14 LYS HA H 1 5.082 0.030 . 1 . . . . 14 LYS HA . 10174 1 81 . 1 1 14 14 LYS CB C 13 36.077 0.300 . 1 . . . . 14 LYS CB . 10174 1 82 . 1 1 14 14 LYS HB2 H 1 1.469 0.030 . 2 . . . . 14 LYS HB2 . 10174 1 83 . 1 1 14 14 LYS HB3 H 1 1.696 0.030 . 2 . . . . 14 LYS HB3 . 10174 1 84 . 1 1 14 14 LYS CG C 13 24.396 0.300 . 1 . . . . 14 LYS CG . 10174 1 85 . 1 1 14 14 LYS HG2 H 1 1.113 0.030 . 2 . . . . 14 LYS HG2 . 10174 1 86 . 1 1 14 14 LYS HG3 H 1 1.019 0.030 . 2 . . . . 14 LYS HG3 . 10174 1 87 . 1 1 14 14 LYS CD C 13 29.532 0.300 . 1 . . . . 14 LYS CD . 10174 1 88 . 1 1 14 14 LYS HD2 H 1 1.542 0.030 . 1 . . . . 14 LYS HD2 . 10174 1 89 . 1 1 14 14 LYS HD3 H 1 1.542 0.030 . 1 . . . . 14 LYS HD3 . 10174 1 90 . 1 1 14 14 LYS CE C 13 41.975 0.300 . 1 . . . . 14 LYS CE . 10174 1 91 . 1 1 14 14 LYS HE2 H 1 2.883 0.030 . 1 . . . . 14 LYS HE2 . 10174 1 92 . 1 1 14 14 LYS HE3 H 1 2.883 0.030 . 1 . . . . 14 LYS HE3 . 10174 1 93 . 1 1 14 14 LYS C C 13 175.154 0.300 . 1 . . . . 14 LYS C . 10174 1 94 . 1 1 15 15 CYS N N 15 127.993 0.300 . 1 . . . . 15 CYS N . 10174 1 95 . 1 1 15 15 CYS H H 1 9.322 0.030 . 1 . . . . 15 CYS H . 10174 1 96 . 1 1 15 15 CYS CA C 13 59.441 0.300 . 1 . . . . 15 CYS CA . 10174 1 97 . 1 1 15 15 CYS HA H 1 4.526 0.030 . 1 . . . . 15 CYS HA . 10174 1 98 . 1 1 15 15 CYS CB C 13 29.639 0.300 . 1 . . . . 15 CYS CB . 10174 1 99 . 1 1 15 15 CYS HB2 H 1 3.360 0.030 . 2 . . . . 15 CYS HB2 . 10174 1 100 . 1 1 15 15 CYS HB3 H 1 2.829 0.030 . 2 . . . . 15 CYS HB3 . 10174 1 101 . 1 1 15 15 CYS C C 13 176.800 0.300 . 1 . . . . 15 CYS C . 10174 1 102 . 1 1 16 16 ASN CA C 13 55.581 0.300 . 1 . . . . 16 ASN CA . 10174 1 103 . 1 1 16 16 ASN HA H 1 4.498 0.030 . 1 . . . . 16 ASN HA . 10174 1 104 . 1 1 16 16 ASN CB C 13 38.278 0.300 . 1 . . . . 16 ASN CB . 10174 1 105 . 1 1 16 16 ASN HB2 H 1 2.857 0.030 . 1 . . . . 16 ASN HB2 . 10174 1 106 . 1 1 16 16 ASN HB3 H 1 2.857 0.030 . 1 . . . . 16 ASN HB3 . 10174 1 107 . 1 1 16 16 ASN ND2 N 15 113.546 0.300 . 1 . . . . 16 ASN ND2 . 10174 1 108 . 1 1 16 16 ASN HD21 H 1 6.986 0.030 . 2 . . . . 16 ASN HD21 . 10174 1 109 . 1 1 16 16 ASN HD22 H 1 7.676 0.030 . 2 . . . . 16 ASN HD22 . 10174 1 110 . 1 1 16 16 ASN C C 13 175.404 0.300 . 1 . . . . 16 ASN C . 10174 1 111 . 1 1 17 17 GLU N N 15 120.838 0.300 . 1 . . . . 17 GLU N . 10174 1 112 . 1 1 17 17 GLU H H 1 8.709 0.030 . 1 . . . . 17 GLU H . 10174 1 113 . 1 1 17 17 GLU CA C 13 58.732 0.300 . 1 . . . . 17 GLU CA . 10174 1 114 . 1 1 17 17 GLU HA H 1 4.180 0.030 . 1 . . . . 17 GLU HA . 10174 1 115 . 1 1 17 17 GLU CB C 13 29.321 0.300 . 1 . . . . 17 GLU CB . 10174 1 116 . 1 1 17 17 GLU HB2 H 1 1.299 0.030 . 1 . . . . 17 GLU HB2 . 10174 1 117 . 1 1 17 17 GLU HB3 H 1 1.299 0.030 . 1 . . . . 17 GLU HB3 . 10174 1 118 . 1 1 17 17 GLU CG C 13 36.192 0.300 . 1 . . . . 17 GLU CG . 10174 1 119 . 1 1 17 17 GLU HG2 H 1 1.903 0.030 . 2 . . . . 17 GLU HG2 . 10174 1 120 . 1 1 17 17 GLU HG3 H 1 1.844 0.030 . 2 . . . . 17 GLU HG3 . 10174 1 121 . 1 1 17 17 GLU C C 13 177.142 0.300 . 1 . . . . 17 GLU C . 10174 1 122 . 1 1 18 18 CYS N N 15 114.657 0.300 . 1 . . . . 18 CYS N . 10174 1 123 . 1 1 18 18 CYS H H 1 7.916 0.030 . 1 . . . . 18 CYS H . 10174 1 124 . 1 1 18 18 CYS CA C 13 58.276 0.300 . 1 . . . . 18 CYS CA . 10174 1 125 . 1 1 18 18 CYS HA H 1 5.140 0.030 . 1 . . . . 18 CYS HA . 10174 1 126 . 1 1 18 18 CYS CB C 13 32.360 0.300 . 1 . . . . 18 CYS CB . 10174 1 127 . 1 1 18 18 CYS HB2 H 1 2.859 0.030 . 2 . . . . 18 CYS HB2 . 10174 1 128 . 1 1 18 18 CYS HB3 H 1 3.415 0.030 . 2 . . . . 18 CYS HB3 . 10174 1 129 . 1 1 18 18 CYS C C 13 176.225 0.300 . 1 . . . . 18 CYS C . 10174 1 130 . 1 1 19 19 GLY N N 15 113.624 0.300 . 1 . . . . 19 GLY N . 10174 1 131 . 1 1 19 19 GLY H H 1 8.162 0.030 . 1 . . . . 19 GLY H . 10174 1 132 . 1 1 19 19 GLY CA C 13 46.220 0.300 . 1 . . . . 19 GLY CA . 10174 1 133 . 1 1 19 19 GLY HA2 H 1 3.703 0.030 . 2 . . . . 19 GLY HA2 . 10174 1 134 . 1 1 19 19 GLY HA3 H 1 4.211 0.030 . 2 . . . . 19 GLY HA3 . 10174 1 135 . 1 1 19 19 GLY C C 13 173.525 0.300 . 1 . . . . 19 GLY C . 10174 1 136 . 1 1 20 20 LYS N N 15 122.667 0.300 . 1 . . . . 20 LYS N . 10174 1 137 . 1 1 20 20 LYS H H 1 7.889 0.030 . 1 . . . . 20 LYS H . 10174 1 138 . 1 1 20 20 LYS CA C 13 58.257 0.300 . 1 . . . . 20 LYS CA . 10174 1 139 . 1 1 20 20 LYS HA H 1 3.946 0.030 . 1 . . . . 20 LYS HA . 10174 1 140 . 1 1 20 20 LYS CB C 13 33.797 0.300 . 1 . . . . 20 LYS CB . 10174 1 141 . 1 1 20 20 LYS HB2 H 1 1.152 0.030 . 2 . . . . 20 LYS HB2 . 10174 1 142 . 1 1 20 20 LYS HB3 H 1 1.385 0.030 . 2 . . . . 20 LYS HB3 . 10174 1 143 . 1 1 20 20 LYS CG C 13 26.341 0.300 . 1 . . . . 20 LYS CG . 10174 1 144 . 1 1 20 20 LYS HG2 H 1 0.993 0.030 . 2 . . . . 20 LYS HG2 . 10174 1 145 . 1 1 20 20 LYS HG3 H 1 1.397 0.030 . 2 . . . . 20 LYS HG3 . 10174 1 146 . 1 1 20 20 LYS CD C 13 29.297 0.300 . 1 . . . . 20 LYS CD . 10174 1 147 . 1 1 20 20 LYS HD2 H 1 1.482 0.030 . 2 . . . . 20 LYS HD2 . 10174 1 148 . 1 1 20 20 LYS HD3 H 1 1.407 0.030 . 2 . . . . 20 LYS HD3 . 10174 1 149 . 1 1 20 20 LYS CE C 13 42.144 0.300 . 1 . . . . 20 LYS CE . 10174 1 150 . 1 1 20 20 LYS HE2 H 1 2.955 0.030 . 2 . . . . 20 LYS HE2 . 10174 1 151 . 1 1 20 20 LYS HE3 H 1 2.883 0.030 . 2 . . . . 20 LYS HE3 . 10174 1 152 . 1 1 20 20 LYS C C 13 174.228 0.300 . 1 . . . . 20 LYS C . 10174 1 153 . 1 1 21 21 VAL N N 15 117.585 0.300 . 1 . . . . 21 VAL N . 10174 1 154 . 1 1 21 21 VAL H H 1 7.598 0.030 . 1 . . . . 21 VAL H . 10174 1 155 . 1 1 21 21 VAL CA C 13 60.474 0.300 . 1 . . . . 21 VAL CA . 10174 1 156 . 1 1 21 21 VAL HA H 1 4.740 0.030 . 1 . . . . 21 VAL HA . 10174 1 157 . 1 1 21 21 VAL CB C 13 33.927 0.300 . 1 . . . . 21 VAL CB . 10174 1 158 . 1 1 21 21 VAL HB H 1 1.826 0.030 . 1 . . . . 21 VAL HB . 10174 1 159 . 1 1 21 21 VAL CG1 C 13 21.928 0.300 . 2 . . . . 21 VAL CG1 . 10174 1 160 . 1 1 21 21 VAL HG11 H 1 0.808 0.030 . 1 . . . . 21 VAL HG1 . 10174 1 161 . 1 1 21 21 VAL HG12 H 1 0.808 0.030 . 1 . . . . 21 VAL HG1 . 10174 1 162 . 1 1 21 21 VAL HG13 H 1 0.808 0.030 . 1 . . . . 21 VAL HG1 . 10174 1 163 . 1 1 21 21 VAL CG2 C 13 20.430 0.300 . 2 . . . . 21 VAL CG2 . 10174 1 164 . 1 1 21 21 VAL HG21 H 1 0.795 0.030 . 1 . . . . 21 VAL HG2 . 10174 1 165 . 1 1 21 21 VAL HG22 H 1 0.795 0.030 . 1 . . . . 21 VAL HG2 . 10174 1 166 . 1 1 21 21 VAL HG23 H 1 0.795 0.030 . 1 . . . . 21 VAL HG2 . 10174 1 167 . 1 1 21 21 VAL C C 13 175.205 0.300 . 1 . . . . 21 VAL C . 10174 1 168 . 1 1 22 22 PHE N N 15 121.649 0.300 . 1 . . . . 22 PHE N . 10174 1 169 . 1 1 22 22 PHE H H 1 8.733 0.030 . 1 . . . . 22 PHE H . 10174 1 170 . 1 1 22 22 PHE CA C 13 56.779 0.300 . 1 . . . . 22 PHE CA . 10174 1 171 . 1 1 22 22 PHE HA H 1 4.897 0.030 . 1 . . . . 22 PHE HA . 10174 1 172 . 1 1 22 22 PHE CB C 13 43.417 0.300 . 1 . . . . 22 PHE CB . 10174 1 173 . 1 1 22 22 PHE HB2 H 1 2.727 0.030 . 2 . . . . 22 PHE HB2 . 10174 1 174 . 1 1 22 22 PHE HB3 H 1 3.495 0.030 . 2 . . . . 22 PHE HB3 . 10174 1 175 . 1 1 22 22 PHE CD1 C 13 132.465 0.300 . 1 . . . . 22 PHE CD1 . 10174 1 176 . 1 1 22 22 PHE HD1 H 1 7.261 0.030 . 1 . . . . 22 PHE HD1 . 10174 1 177 . 1 1 22 22 PHE CD2 C 13 132.465 0.300 . 1 . . . . 22 PHE CD2 . 10174 1 178 . 1 1 22 22 PHE HD2 H 1 7.261 0.030 . 1 . . . . 22 PHE HD2 . 10174 1 179 . 1 1 22 22 PHE CE1 C 13 130.578 0.300 . 1 . . . . 22 PHE CE1 . 10174 1 180 . 1 1 22 22 PHE HE1 H 1 6.832 0.030 . 1 . . . . 22 PHE HE1 . 10174 1 181 . 1 1 22 22 PHE CE2 C 13 130.578 0.300 . 1 . . . . 22 PHE CE2 . 10174 1 182 . 1 1 22 22 PHE HE2 H 1 6.832 0.030 . 1 . . . . 22 PHE HE2 . 10174 1 183 . 1 1 22 22 PHE CZ C 13 128.626 0.300 . 1 . . . . 22 PHE CZ . 10174 1 184 . 1 1 22 22 PHE HZ H 1 6.080 0.030 . 1 . . . . 22 PHE HZ . 10174 1 185 . 1 1 22 22 PHE C C 13 175.652 0.300 . 1 . . . . 22 PHE C . 10174 1 186 . 1 1 23 23 THR N N 15 111.274 0.300 . 1 . . . . 23 THR N . 10174 1 187 . 1 1 23 23 THR H H 1 9.494 0.030 . 1 . . . . 23 THR H . 10174 1 188 . 1 1 23 23 THR CA C 13 63.213 0.300 . 1 . . . . 23 THR CA . 10174 1 189 . 1 1 23 23 THR HA H 1 4.528 0.030 . 1 . . . . 23 THR HA . 10174 1 190 . 1 1 23 23 THR CB C 13 69.708 0.300 . 1 . . . . 23 THR CB . 10174 1 191 . 1 1 23 23 THR HB H 1 4.458 0.030 . 1 . . . . 23 THR HB . 10174 1 192 . 1 1 23 23 THR CG2 C 13 22.365 0.300 . 1 . . . . 23 THR CG2 . 10174 1 193 . 1 1 23 23 THR HG21 H 1 1.325 0.030 . 1 . . . . 23 THR HG2 . 10174 1 194 . 1 1 23 23 THR HG22 H 1 1.325 0.030 . 1 . . . . 23 THR HG2 . 10174 1 195 . 1 1 23 23 THR HG23 H 1 1.325 0.030 . 1 . . . . 23 THR HG2 . 10174 1 196 . 1 1 23 23 THR C C 13 174.881 0.300 . 1 . . . . 23 THR C . 10174 1 197 . 1 1 24 24 GLN N N 15 115.450 0.300 . 1 . . . . 24 GLN N . 10174 1 198 . 1 1 24 24 GLN H H 1 7.058 0.030 . 1 . . . . 24 GLN H . 10174 1 199 . 1 1 24 24 GLN CA C 13 53.963 0.300 . 1 . . . . 24 GLN CA . 10174 1 200 . 1 1 24 24 GLN HA H 1 4.452 0.030 . 1 . . . . 24 GLN HA . 10174 1 201 . 1 1 24 24 GLN CB C 13 31.851 0.300 . 1 . . . . 24 GLN CB . 10174 1 202 . 1 1 24 24 GLN HB2 H 1 0.949 0.030 . 2 . . . . 24 GLN HB2 . 10174 1 203 . 1 1 24 24 GLN HB3 H 1 1.902 0.030 . 2 . . . . 24 GLN HB3 . 10174 1 204 . 1 1 24 24 GLN CG C 13 33.155 0.300 . 1 . . . . 24 GLN CG . 10174 1 205 . 1 1 24 24 GLN HG2 H 1 2.072 0.030 . 2 . . . . 24 GLN HG2 . 10174 1 206 . 1 1 24 24 GLN HG3 H 1 1.995 0.030 . 2 . . . . 24 GLN HG3 . 10174 1 207 . 1 1 24 24 GLN NE2 N 15 111.924 0.300 . 1 . . . . 24 GLN NE2 . 10174 1 208 . 1 1 24 24 GLN HE21 H 1 6.812 0.030 . 2 . . . . 24 GLN HE21 . 10174 1 209 . 1 1 24 24 GLN HE22 H 1 7.296 0.030 . 2 . . . . 24 GLN HE22 . 10174 1 210 . 1 1 24 24 GLN C C 13 175.682 0.300 . 1 . . . . 24 GLN C . 10174 1 211 . 1 1 25 25 ASN CA C 13 56.596 0.300 . 1 . . . . 25 ASN CA . 10174 1 212 . 1 1 25 25 ASN HA H 1 3.560 0.030 . 1 . . . . 25 ASN HA . 10174 1 213 . 1 1 25 25 ASN CB C 13 38.675 0.300 . 1 . . . . 25 ASN CB . 10174 1 214 . 1 1 25 25 ASN HB2 H 1 2.137 0.030 . 2 . . . . 25 ASN HB2 . 10174 1 215 . 1 1 25 25 ASN HB3 H 1 2.376 0.030 . 2 . . . . 25 ASN HB3 . 10174 1 216 . 1 1 25 25 ASN ND2 N 15 113.044 0.300 . 1 . . . . 25 ASN ND2 . 10174 1 217 . 1 1 25 25 ASN HD21 H 1 6.667 0.030 . 2 . . . . 25 ASN HD21 . 10174 1 218 . 1 1 25 25 ASN HD22 H 1 7.288 0.030 . 2 . . . . 25 ASN HD22 . 10174 1 219 . 1 1 26 26 SER CA C 13 61.163 0.300 . 1 . . . . 26 SER CA . 10174 1 220 . 1 1 26 26 SER HA H 1 3.881 0.030 . 1 . . . . 26 SER HA . 10174 1 221 . 1 1 26 26 SER CB C 13 61.444 0.300 . 1 . . . . 26 SER CB . 10174 1 222 . 1 1 26 26 SER HB2 H 1 3.815 0.030 . 1 . . . . 26 SER HB2 . 10174 1 223 . 1 1 26 26 SER HB3 H 1 3.815 0.030 . 1 . . . . 26 SER HB3 . 10174 1 224 . 1 1 26 26 SER C C 13 177.103 0.300 . 1 . . . . 26 SER C . 10174 1 225 . 1 1 27 27 HIS N N 15 120.980 0.300 . 1 . . . . 27 HIS N . 10174 1 226 . 1 1 27 27 HIS H H 1 6.699 0.030 . 1 . . . . 27 HIS H . 10174 1 227 . 1 1 27 27 HIS CA C 13 56.939 0.300 . 1 . . . . 27 HIS CA . 10174 1 228 . 1 1 27 27 HIS HA H 1 4.344 0.030 . 1 . . . . 27 HIS HA . 10174 1 229 . 1 1 27 27 HIS CB C 13 31.831 0.300 . 1 . . . . 27 HIS CB . 10174 1 230 . 1 1 27 27 HIS HB2 H 1 3.254 0.030 . 2 . . . . 27 HIS HB2 . 10174 1 231 . 1 1 27 27 HIS HB3 H 1 3.190 0.030 . 2 . . . . 27 HIS HB3 . 10174 1 232 . 1 1 27 27 HIS CD2 C 13 116.714 0.300 . 1 . . . . 27 HIS CD2 . 10174 1 233 . 1 1 27 27 HIS HD2 H 1 6.903 0.030 . 1 . . . . 27 HIS HD2 . 10174 1 234 . 1 1 27 27 HIS CE1 C 13 139.177 0.300 . 1 . . . . 27 HIS CE1 . 10174 1 235 . 1 1 27 27 HIS HE1 H 1 7.716 0.030 . 1 . . . . 27 HIS HE1 . 10174 1 236 . 1 1 27 27 HIS C C 13 177.849 0.300 . 1 . . . . 27 HIS C . 10174 1 237 . 1 1 28 28 LEU N N 15 122.679 0.300 . 1 . . . . 28 LEU N . 10174 1 238 . 1 1 28 28 LEU H H 1 6.876 0.030 . 1 . . . . 28 LEU H . 10174 1 239 . 1 1 28 28 LEU CA C 13 57.700 0.300 . 1 . . . . 28 LEU CA . 10174 1 240 . 1 1 28 28 LEU HA H 1 3.175 0.030 . 1 . . . . 28 LEU HA . 10174 1 241 . 1 1 28 28 LEU CB C 13 40.513 0.300 . 1 . . . . 28 LEU CB . 10174 1 242 . 1 1 28 28 LEU HB2 H 1 1.164 0.030 . 2 . . . . 28 LEU HB2 . 10174 1 243 . 1 1 28 28 LEU HB3 H 1 2.105 0.030 . 2 . . . . 28 LEU HB3 . 10174 1 244 . 1 1 28 28 LEU CG C 13 27.663 0.300 . 1 . . . . 28 LEU CG . 10174 1 245 . 1 1 28 28 LEU HG H 1 1.470 0.030 . 1 . . . . 28 LEU HG . 10174 1 246 . 1 1 28 28 LEU CD1 C 13 22.564 0.300 . 2 . . . . 28 LEU CD1 . 10174 1 247 . 1 1 28 28 LEU HD11 H 1 0.979 0.030 . 1 . . . . 28 LEU HD1 . 10174 1 248 . 1 1 28 28 LEU HD12 H 1 0.979 0.030 . 1 . . . . 28 LEU HD1 . 10174 1 249 . 1 1 28 28 LEU HD13 H 1 0.979 0.030 . 1 . . . . 28 LEU HD1 . 10174 1 250 . 1 1 28 28 LEU CD2 C 13 26.591 0.300 . 2 . . . . 28 LEU CD2 . 10174 1 251 . 1 1 28 28 LEU HD21 H 1 1.042 0.030 . 1 . . . . 28 LEU HD2 . 10174 1 252 . 1 1 28 28 LEU HD22 H 1 1.042 0.030 . 1 . . . . 28 LEU HD2 . 10174 1 253 . 1 1 28 28 LEU HD23 H 1 1.042 0.030 . 1 . . . . 28 LEU HD2 . 10174 1 254 . 1 1 28 28 LEU C C 13 177.396 0.300 . 1 . . . . 28 LEU C . 10174 1 255 . 1 1 29 29 VAL N N 15 119.083 0.300 . 1 . . . . 29 VAL N . 10174 1 256 . 1 1 29 29 VAL H H 1 8.251 0.030 . 1 . . . . 29 VAL H . 10174 1 257 . 1 1 29 29 VAL CA C 13 66.791 0.300 . 1 . . . . 29 VAL CA . 10174 1 258 . 1 1 29 29 VAL HA H 1 3.372 0.030 . 1 . . . . 29 VAL HA . 10174 1 259 . 1 1 29 29 VAL CB C 13 31.749 0.300 . 1 . . . . 29 VAL CB . 10174 1 260 . 1 1 29 29 VAL HB H 1 1.904 0.030 . 1 . . . . 29 VAL HB . 10174 1 261 . 1 1 29 29 VAL CG1 C 13 22.552 0.300 . 2 . . . . 29 VAL CG1 . 10174 1 262 . 1 1 29 29 VAL HG11 H 1 0.899 0.030 . 1 . . . . 29 VAL HG1 . 10174 1 263 . 1 1 29 29 VAL HG12 H 1 0.899 0.030 . 1 . . . . 29 VAL HG1 . 10174 1 264 . 1 1 29 29 VAL HG13 H 1 0.899 0.030 . 1 . . . . 29 VAL HG1 . 10174 1 265 . 1 1 29 29 VAL CG2 C 13 20.902 0.300 . 2 . . . . 29 VAL CG2 . 10174 1 266 . 1 1 29 29 VAL HG21 H 1 0.837 0.030 . 1 . . . . 29 VAL HG2 . 10174 1 267 . 1 1 29 29 VAL HG22 H 1 0.837 0.030 . 1 . . . . 29 VAL HG2 . 10174 1 268 . 1 1 29 29 VAL HG23 H 1 0.837 0.030 . 1 . . . . 29 VAL HG2 . 10174 1 269 . 1 1 29 29 VAL C C 13 178.979 0.300 . 1 . . . . 29 VAL C . 10174 1 270 . 1 1 30 30 ARG N N 15 118.008 0.300 . 1 . . . . 30 ARG N . 10174 1 271 . 1 1 30 30 ARG H H 1 7.431 0.030 . 1 . . . . 30 ARG H . 10174 1 272 . 1 1 30 30 ARG CA C 13 58.827 0.300 . 1 . . . . 30 ARG CA . 10174 1 273 . 1 1 30 30 ARG HA H 1 3.988 0.030 . 1 . . . . 30 ARG HA . 10174 1 274 . 1 1 30 30 ARG CB C 13 30.154 0.300 . 1 . . . . 30 ARG CB . 10174 1 275 . 1 1 30 30 ARG HB2 H 1 1.810 0.030 . 1 . . . . 30 ARG HB2 . 10174 1 276 . 1 1 30 30 ARG HB3 H 1 1.810 0.030 . 1 . . . . 30 ARG HB3 . 10174 1 277 . 1 1 30 30 ARG CG C 13 27.201 0.300 . 1 . . . . 30 ARG CG . 10174 1 278 . 1 1 30 30 ARG HG2 H 1 1.687 0.030 . 2 . . . . 30 ARG HG2 . 10174 1 279 . 1 1 30 30 ARG HG3 H 1 1.593 0.030 . 2 . . . . 30 ARG HG3 . 10174 1 280 . 1 1 30 30 ARG CD C 13 43.337 0.300 . 1 . . . . 30 ARG CD . 10174 1 281 . 1 1 30 30 ARG HD2 H 1 3.154 0.030 . 1 . . . . 30 ARG HD2 . 10174 1 282 . 1 1 30 30 ARG HD3 H 1 3.154 0.030 . 1 . . . . 30 ARG HD3 . 10174 1 283 . 1 1 30 30 ARG C C 13 178.629 0.300 . 1 . . . . 30 ARG C . 10174 1 284 . 1 1 31 31 HIS N N 15 119.261 0.300 . 1 . . . . 31 HIS N . 10174 1 285 . 1 1 31 31 HIS H H 1 7.645 0.030 . 1 . . . . 31 HIS H . 10174 1 286 . 1 1 31 31 HIS CA C 13 58.859 0.300 . 1 . . . . 31 HIS CA . 10174 1 287 . 1 1 31 31 HIS HA H 1 4.182 0.030 . 1 . . . . 31 HIS HA . 10174 1 288 . 1 1 31 31 HIS CB C 13 28.757 0.300 . 1 . . . . 31 HIS CB . 10174 1 289 . 1 1 31 31 HIS HB2 H 1 2.874 0.030 . 2 . . . . 31 HIS HB2 . 10174 1 290 . 1 1 31 31 HIS HB3 H 1 3.150 0.030 . 2 . . . . 31 HIS HB3 . 10174 1 291 . 1 1 31 31 HIS CD2 C 13 127.317 0.300 . 1 . . . . 31 HIS CD2 . 10174 1 292 . 1 1 31 31 HIS HD2 H 1 6.951 0.030 . 1 . . . . 31 HIS HD2 . 10174 1 293 . 1 1 31 31 HIS CE1 C 13 139.663 0.300 . 1 . . . . 31 HIS CE1 . 10174 1 294 . 1 1 31 31 HIS HE1 H 1 8.038 0.030 . 1 . . . . 31 HIS HE1 . 10174 1 295 . 1 1 31 31 HIS C C 13 175.828 0.300 . 1 . . . . 31 HIS C . 10174 1 296 . 1 1 32 32 ARG N N 15 115.529 0.300 . 1 . . . . 32 ARG N . 10174 1 297 . 1 1 32 32 ARG H H 1 8.072 0.030 . 1 . . . . 32 ARG H . 10174 1 298 . 1 1 32 32 ARG CA C 13 59.996 0.300 . 1 . . . . 32 ARG CA . 10174 1 299 . 1 1 32 32 ARG HA H 1 3.724 0.030 . 1 . . . . 32 ARG HA . 10174 1 300 . 1 1 32 32 ARG CB C 13 29.913 0.300 . 1 . . . . 32 ARG CB . 10174 1 301 . 1 1 32 32 ARG HB2 H 1 1.983 0.030 . 1 . . . . 32 ARG HB2 . 10174 1 302 . 1 1 32 32 ARG HB3 H 1 1.983 0.030 . 1 . . . . 32 ARG HB3 . 10174 1 303 . 1 1 32 32 ARG CG C 13 28.350 0.300 . 1 . . . . 32 ARG CG . 10174 1 304 . 1 1 32 32 ARG HG2 H 1 2.030 0.030 . 1 . . . . 32 ARG HG2 . 10174 1 305 . 1 1 32 32 ARG HG3 H 1 2.030 0.030 . 1 . . . . 32 ARG HG3 . 10174 1 306 . 1 1 32 32 ARG CD C 13 43.779 0.300 . 1 . . . . 32 ARG CD . 10174 1 307 . 1 1 32 32 ARG HD2 H 1 3.341 0.030 . 2 . . . . 32 ARG HD2 . 10174 1 308 . 1 1 32 32 ARG HD3 H 1 3.278 0.030 . 2 . . . . 32 ARG HD3 . 10174 1 309 . 1 1 32 32 ARG C C 13 178.047 0.300 . 1 . . . . 32 ARG C . 10174 1 310 . 1 1 33 33 GLY N N 15 105.489 0.300 . 1 . . . . 33 GLY N . 10174 1 311 . 1 1 33 33 GLY H H 1 7.514 0.030 . 1 . . . . 33 GLY H . 10174 1 312 . 1 1 33 33 GLY CA C 13 46.567 0.300 . 1 . . . . 33 GLY CA . 10174 1 313 . 1 1 33 33 GLY HA2 H 1 3.988 0.030 . 2 . . . . 33 GLY HA2 . 10174 1 314 . 1 1 33 33 GLY HA3 H 1 3.867 0.030 . 2 . . . . 33 GLY HA3 . 10174 1 315 . 1 1 33 33 GLY C C 13 175.858 0.300 . 1 . . . . 33 GLY C . 10174 1 316 . 1 1 34 34 ILE N N 15 118.370 0.300 . 1 . . . . 34 ILE N . 10174 1 317 . 1 1 34 34 ILE H H 1 7.808 0.030 . 1 . . . . 34 ILE H . 10174 1 318 . 1 1 34 34 ILE CA C 13 62.704 0.300 . 1 . . . . 34 ILE CA . 10174 1 319 . 1 1 34 34 ILE HA H 1 4.015 0.030 . 1 . . . . 34 ILE HA . 10174 1 320 . 1 1 34 34 ILE CB C 13 37.645 0.300 . 1 . . . . 34 ILE CB . 10174 1 321 . 1 1 34 34 ILE HB H 1 1.633 0.030 . 1 . . . . 34 ILE HB . 10174 1 322 . 1 1 34 34 ILE CG1 C 13 26.749 0.300 . 1 . . . . 34 ILE CG1 . 10174 1 323 . 1 1 34 34 ILE HG12 H 1 0.914 0.030 . 2 . . . . 34 ILE HG12 . 10174 1 324 . 1 1 34 34 ILE HG13 H 1 0.734 0.030 . 2 . . . . 34 ILE HG13 . 10174 1 325 . 1 1 34 34 ILE CG2 C 13 16.483 0.300 . 1 . . . . 34 ILE CG2 . 10174 1 326 . 1 1 34 34 ILE HG21 H 1 0.488 0.030 . 1 . . . . 34 ILE HG2 . 10174 1 327 . 1 1 34 34 ILE HG22 H 1 0.488 0.030 . 1 . . . . 34 ILE HG2 . 10174 1 328 . 1 1 34 34 ILE HG23 H 1 0.488 0.030 . 1 . . . . 34 ILE HG2 . 10174 1 329 . 1 1 34 34 ILE CD1 C 13 14.296 0.300 . 1 . . . . 34 ILE CD1 . 10174 1 330 . 1 1 34 34 ILE HD11 H 1 0.675 0.030 . 1 . . . . 34 ILE HD1 . 10174 1 331 . 1 1 34 34 ILE HD12 H 1 0.675 0.030 . 1 . . . . 34 ILE HD1 . 10174 1 332 . 1 1 34 34 ILE HD13 H 1 0.675 0.030 . 1 . . . . 34 ILE HD1 . 10174 1 333 . 1 1 34 34 ILE C C 13 177.413 0.300 . 1 . . . . 34 ILE C . 10174 1 334 . 1 1 35 35 HIS N N 15 117.927 0.300 . 1 . . . . 35 HIS N . 10174 1 335 . 1 1 35 35 HIS H H 1 7.318 0.030 . 1 . . . . 35 HIS H . 10174 1 336 . 1 1 35 35 HIS CA C 13 55.214 0.300 . 1 . . . . 35 HIS CA . 10174 1 337 . 1 1 35 35 HIS HA H 1 4.843 0.030 . 1 . . . . 35 HIS HA . 10174 1 338 . 1 1 35 35 HIS CB C 13 28.625 0.300 . 1 . . . . 35 HIS CB . 10174 1 339 . 1 1 35 35 HIS HB2 H 1 3.333 0.030 . 2 . . . . 35 HIS HB2 . 10174 1 340 . 1 1 35 35 HIS HB3 H 1 3.176 0.030 . 2 . . . . 35 HIS HB3 . 10174 1 341 . 1 1 35 35 HIS CD2 C 13 127.704 0.300 . 1 . . . . 35 HIS CD2 . 10174 1 342 . 1 1 35 35 HIS HD2 H 1 6.724 0.030 . 1 . . . . 35 HIS HD2 . 10174 1 343 . 1 1 35 35 HIS CE1 C 13 140.057 0.300 . 1 . . . . 35 HIS CE1 . 10174 1 344 . 1 1 35 35 HIS HE1 H 1 8.033 0.030 . 1 . . . . 35 HIS HE1 . 10174 1 345 . 1 1 35 35 HIS C C 13 175.767 0.300 . 1 . . . . 35 HIS C . 10174 1 346 . 1 1 36 36 THR N N 15 111.953 0.300 . 1 . . . . 36 THR N . 10174 1 347 . 1 1 36 36 THR H H 1 7.787 0.030 . 1 . . . . 36 THR H . 10174 1 348 . 1 1 36 36 THR CA C 13 62.359 0.300 . 1 . . . . 36 THR CA . 10174 1 349 . 1 1 36 36 THR HA H 1 4.329 0.030 . 1 . . . . 36 THR HA . 10174 1 350 . 1 1 36 36 THR CB C 13 69.674 0.300 . 1 . . . . 36 THR CB . 10174 1 351 . 1 1 36 36 THR HB H 1 4.311 0.030 . 1 . . . . 36 THR HB . 10174 1 352 . 1 1 36 36 THR CG2 C 13 21.561 0.300 . 1 . . . . 36 THR CG2 . 10174 1 353 . 1 1 36 36 THR HG21 H 1 1.206 0.030 . 1 . . . . 36 THR HG2 . 10174 1 354 . 1 1 36 36 THR HG22 H 1 1.206 0.030 . 1 . . . . 36 THR HG2 . 10174 1 355 . 1 1 36 36 THR HG23 H 1 1.206 0.030 . 1 . . . . 36 THR HG2 . 10174 1 356 . 1 1 36 36 THR C C 13 175.402 0.300 . 1 . . . . 36 THR C . 10174 1 357 . 1 1 37 37 GLY N N 15 110.854 0.300 . 1 . . . . 37 GLY N . 10174 1 358 . 1 1 37 37 GLY H H 1 8.240 0.030 . 1 . . . . 37 GLY H . 10174 1 359 . 1 1 37 37 GLY CA C 13 45.374 0.300 . 1 . . . . 37 GLY CA . 10174 1 360 . 1 1 37 37 GLY HA2 H 1 3.969 0.030 . 1 . . . . 37 GLY HA2 . 10174 1 361 . 1 1 37 37 GLY HA3 H 1 3.969 0.030 . 1 . . . . 37 GLY HA3 . 10174 1 362 . 1 1 37 37 GLY C C 13 174.095 0.300 . 1 . . . . 37 GLY C . 10174 1 363 . 1 1 38 38 GLU N N 15 120.594 0.300 . 1 . . . . 38 GLU N . 10174 1 364 . 1 1 38 38 GLU H H 1 8.078 0.030 . 1 . . . . 38 GLU H . 10174 1 365 . 1 1 38 38 GLU CA C 13 56.370 0.300 . 1 . . . . 38 GLU CA . 10174 1 366 . 1 1 38 38 GLU HA H 1 4.216 0.030 . 1 . . . . 38 GLU HA . 10174 1 367 . 1 1 38 38 GLU CB C 13 30.465 0.300 . 1 . . . . 38 GLU CB . 10174 1 368 . 1 1 38 38 GLU HB2 H 1 1.964 0.030 . 2 . . . . 38 GLU HB2 . 10174 1 369 . 1 1 38 38 GLU HB3 H 1 1.868 0.030 . 2 . . . . 38 GLU HB3 . 10174 1 370 . 1 1 38 38 GLU CG C 13 36.168 0.300 . 1 . . . . 38 GLU CG . 10174 1 371 . 1 1 38 38 GLU HG2 H 1 2.235 0.030 . 2 . . . . 38 GLU HG2 . 10174 1 372 . 1 1 38 38 GLU HG3 H 1 2.187 0.030 . 2 . . . . 38 GLU HG3 . 10174 1 373 . 1 1 38 38 GLU C C 13 176.250 0.300 . 1 . . . . 38 GLU C . 10174 1 374 . 1 1 39 39 LYS N N 15 123.816 0.300 . 1 . . . . 39 LYS N . 10174 1 375 . 1 1 39 39 LYS H H 1 8.397 0.030 . 1 . . . . 39 LYS H . 10174 1 376 . 1 1 39 39 LYS CA C 13 54.085 0.300 . 1 . . . . 39 LYS CA . 10174 1 377 . 1 1 39 39 LYS HA H 1 4.574 0.030 . 1 . . . . 39 LYS HA . 10174 1 378 . 1 1 39 39 LYS CB C 13 32.412 0.300 . 1 . . . . 39 LYS CB . 10174 1 379 . 1 1 39 39 LYS HB2 H 1 1.781 0.030 . 2 . . . . 39 LYS HB2 . 10174 1 380 . 1 1 39 39 LYS HB3 H 1 1.693 0.030 . 2 . . . . 39 LYS HB3 . 10174 1 381 . 1 1 39 39 LYS CG C 13 24.472 0.300 . 1 . . . . 39 LYS CG . 10174 1 382 . 1 1 39 39 LYS HG2 H 1 1.437 0.030 . 2 . . . . 39 LYS HG2 . 10174 1 383 . 1 1 39 39 LYS CE C 13 42.151 0.300 . 1 . . . . 39 LYS CE . 10174 1 384 . 1 1 39 39 LYS HE2 H 1 2.979 0.030 . 2 . . . . 39 LYS HE2 . 10174 1 385 . 1 1 39 39 LYS C C 13 174.477 0.300 . 1 . . . . 39 LYS C . 10174 1 386 . 1 1 40 40 PRO CA C 13 63.185 0.300 . 1 . . . . 40 PRO CA . 10174 1 387 . 1 1 40 40 PRO HA H 1 4.439 0.030 . 1 . . . . 40 PRO HA . 10174 1 388 . 1 1 40 40 PRO CB C 13 32.140 0.300 . 1 . . . . 40 PRO CB . 10174 1 389 . 1 1 40 40 PRO HB2 H 1 2.277 0.030 . 1 . . . . 40 PRO HB2 . 10174 1 390 . 1 1 40 40 PRO HB3 H 1 2.277 0.030 . 1 . . . . 40 PRO HB3 . 10174 1 391 . 1 1 40 40 PRO CG C 13 27.484 0.300 . 1 . . . . 40 PRO CG . 10174 1 392 . 1 1 40 40 PRO HG2 H 1 1.991 0.030 . 1 . . . . 40 PRO HG2 . 10174 1 393 . 1 1 40 40 PRO HG3 H 1 1.991 0.030 . 1 . . . . 40 PRO HG3 . 10174 1 394 . 1 1 40 40 PRO CD C 13 50.638 0.300 . 1 . . . . 40 PRO CD . 10174 1 395 . 1 1 40 40 PRO HD2 H 1 3.611 0.030 . 2 . . . . 40 PRO HD2 . 10174 1 396 . 1 1 40 40 PRO HD3 H 1 3.791 0.030 . 2 . . . . 40 PRO HD3 . 10174 1 stop_ save_