################################### # 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 10230 _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 10230 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10230 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 9 9 GLY H H 1 8.233 0.030 . 1 . . . . 9 GLY H . 10230 1 2 . 1 1 9 9 GLY HA2 H 1 4.025 0.030 . 2 . . . . 9 GLY HA2 . 10230 1 3 . 1 1 9 9 GLY HA3 H 1 3.948 0.030 . 2 . . . . 9 GLY HA3 . 10230 1 4 . 1 1 9 9 GLY C C 13 174.022 0.300 . 1 . . . . 9 GLY C . 10230 1 5 . 1 1 9 9 GLY CA C 13 45.367 0.300 . 1 . . . . 9 GLY CA . 10230 1 6 . 1 1 9 9 GLY N N 15 110.543 0.300 . 1 . . . . 9 GLY N . 10230 1 7 . 1 1 10 10 GLU H H 1 8.175 0.030 . 1 . . . . 10 GLU H . 10230 1 8 . 1 1 10 10 GLU HA H 1 4.187 0.030 . 1 . . . . 10 GLU HA . 10230 1 9 . 1 1 10 10 GLU HB2 H 1 1.954 0.030 . 2 . . . . 10 GLU HB2 . 10230 1 10 . 1 1 10 10 GLU HB3 H 1 1.885 0.030 . 2 . . . . 10 GLU HB3 . 10230 1 11 . 1 1 10 10 GLU HG2 H 1 2.216 0.030 . 2 . . . . 10 GLU HG2 . 10230 1 12 . 1 1 10 10 GLU HG3 H 1 2.177 0.030 . 2 . . . . 10 GLU HG3 . 10230 1 13 . 1 1 10 10 GLU C C 13 176.220 0.300 . 1 . . . . 10 GLU C . 10230 1 14 . 1 1 10 10 GLU CA C 13 56.730 0.300 . 1 . . . . 10 GLU CA . 10230 1 15 . 1 1 10 10 GLU CB C 13 30.395 0.300 . 1 . . . . 10 GLU CB . 10230 1 16 . 1 1 10 10 GLU CG C 13 36.269 0.300 . 1 . . . . 10 GLU CG . 10230 1 17 . 1 1 10 10 GLU N N 15 120.194 0.300 . 1 . . . . 10 GLU N . 10230 1 18 . 1 1 11 11 LYS H H 1 8.391 0.030 . 1 . . . . 11 LYS H . 10230 1 19 . 1 1 11 11 LYS HA H 1 4.528 0.030 . 1 . . . . 11 LYS HA . 10230 1 20 . 1 1 11 11 LYS HB2 H 1 1.600 0.030 . 2 . . . . 11 LYS HB2 . 10230 1 21 . 1 1 11 11 LYS HB3 H 1 1.389 0.030 . 2 . . . . 11 LYS HB3 . 10230 1 22 . 1 1 11 11 LYS HD2 H 1 1.430 0.030 . 1 . . . . 11 LYS HD2 . 10230 1 23 . 1 1 11 11 LYS HD3 H 1 1.430 0.030 . 1 . . . . 11 LYS HD3 . 10230 1 24 . 1 1 11 11 LYS HE2 H 1 2.876 0.030 . 1 . . . . 11 LYS HE2 . 10230 1 25 . 1 1 11 11 LYS HE3 H 1 2.876 0.030 . 1 . . . . 11 LYS HE3 . 10230 1 26 . 1 1 11 11 LYS HG2 H 1 1.337 0.030 . 2 . . . . 11 LYS HG2 . 10230 1 27 . 1 1 11 11 LYS HG3 H 1 1.193 0.030 . 2 . . . . 11 LYS HG3 . 10230 1 28 . 1 1 11 11 LYS C C 13 174.468 0.300 . 1 . . . . 11 LYS C . 10230 1 29 . 1 1 11 11 LYS CA C 13 54.112 0.300 . 1 . . . . 11 LYS CA . 10230 1 30 . 1 1 11 11 LYS CB C 13 33.635 0.300 . 1 . . . . 11 LYS CB . 10230 1 31 . 1 1 11 11 LYS CD C 13 29.843 0.300 . 1 . . . . 11 LYS CD . 10230 1 32 . 1 1 11 11 LYS CE C 13 42.367 0.300 . 1 . . . . 11 LYS CE . 10230 1 33 . 1 1 11 11 LYS CG C 13 25.038 0.300 . 1 . . . . 11 LYS CG . 10230 1 34 . 1 1 11 11 LYS N N 15 121.933 0.300 . 1 . . . . 11 LYS N . 10230 1 35 . 1 1 12 12 PRO HA H 1 4.229 0.030 . 1 . . . . 12 PRO HA . 10230 1 36 . 1 1 12 12 PRO HB2 H 1 1.993 0.030 . 2 . . . . 12 PRO HB2 . 10230 1 37 . 1 1 12 12 PRO HB3 H 1 1.120 0.030 . 2 . . . . 12 PRO HB3 . 10230 1 38 . 1 1 12 12 PRO HD2 H 1 3.768 0.030 . 2 . . . . 12 PRO HD2 . 10230 1 39 . 1 1 12 12 PRO HD3 H 1 3.712 0.030 . 2 . . . . 12 PRO HD3 . 10230 1 40 . 1 1 12 12 PRO HG2 H 1 1.792 0.030 . 2 . . . . 12 PRO HG2 . 10230 1 41 . 1 1 12 12 PRO HG3 H 1 1.615 0.030 . 2 . . . . 12 PRO HG3 . 10230 1 42 . 1 1 12 12 PRO C C 13 176.420 0.300 . 1 . . . . 12 PRO C . 10230 1 43 . 1 1 12 12 PRO CA C 13 63.948 0.300 . 1 . . . . 12 PRO CA . 10230 1 44 . 1 1 12 12 PRO CB C 13 32.366 0.300 . 1 . . . . 12 PRO CB . 10230 1 45 . 1 1 12 12 PRO CD C 13 50.640 0.300 . 1 . . . . 12 PRO CD . 10230 1 46 . 1 1 12 12 PRO CG C 13 26.692 0.300 . 1 . . . . 12 PRO CG . 10230 1 47 . 1 1 13 13 PHE H H 1 7.694 0.030 . 1 . . . . 13 PHE H . 10230 1 48 . 1 1 13 13 PHE HA H 1 4.700 0.030 . 1 . . . . 13 PHE HA . 10230 1 49 . 1 1 13 13 PHE HB2 H 1 3.046 0.030 . 2 . . . . 13 PHE HB2 . 10230 1 50 . 1 1 13 13 PHE HB3 H 1 2.853 0.030 . 2 . . . . 13 PHE HB3 . 10230 1 51 . 1 1 13 13 PHE HD1 H 1 7.112 0.030 . 1 . . . . 13 PHE HD1 . 10230 1 52 . 1 1 13 13 PHE HD2 H 1 7.112 0.030 . 1 . . . . 13 PHE HD2 . 10230 1 53 . 1 1 13 13 PHE HE1 H 1 7.430 0.030 . 1 . . . . 13 PHE HE1 . 10230 1 54 . 1 1 13 13 PHE HE2 H 1 7.430 0.030 . 1 . . . . 13 PHE HE2 . 10230 1 55 . 1 1 13 13 PHE HZ H 1 7.396 0.030 . 1 . . . . 13 PHE HZ . 10230 1 56 . 1 1 13 13 PHE C C 13 174.071 0.300 . 1 . . . . 13 PHE C . 10230 1 57 . 1 1 13 13 PHE CA C 13 57.784 0.300 . 1 . . . . 13 PHE CA . 10230 1 58 . 1 1 13 13 PHE CB C 13 39.605 0.300 . 1 . . . . 13 PHE CB . 10230 1 59 . 1 1 13 13 PHE CD1 C 13 131.834 0.300 . 1 . . . . 13 PHE CD1 . 10230 1 60 . 1 1 13 13 PHE CD2 C 13 131.834 0.300 . 1 . . . . 13 PHE CD2 . 10230 1 61 . 1 1 13 13 PHE CE1 C 13 131.711 0.300 . 1 . . . . 13 PHE CE1 . 10230 1 62 . 1 1 13 13 PHE CE2 C 13 131.711 0.300 . 1 . . . . 13 PHE CE2 . 10230 1 63 . 1 1 13 13 PHE CZ C 13 130.199 0.300 . 1 . . . . 13 PHE CZ . 10230 1 64 . 1 1 13 13 PHE N N 15 117.427 0.300 . 1 . . . . 13 PHE N . 10230 1 65 . 1 1 14 14 LYS H H 1 8.784 0.030 . 1 . . . . 14 LYS H . 10230 1 66 . 1 1 14 14 LYS HA H 1 4.976 0.030 . 1 . . . . 14 LYS HA . 10230 1 67 . 1 1 14 14 LYS HB2 H 1 1.740 0.030 . 2 . . . . 14 LYS HB2 . 10230 1 68 . 1 1 14 14 LYS HB3 H 1 1.453 0.030 . 2 . . . . 14 LYS HB3 . 10230 1 69 . 1 1 14 14 LYS HD2 H 1 1.602 0.030 . 2 . . . . 14 LYS HD2 . 10230 1 70 . 1 1 14 14 LYS HD3 H 1 1.522 0.030 . 2 . . . . 14 LYS HD3 . 10230 1 71 . 1 1 14 14 LYS HE2 H 1 2.874 0.030 . 1 . . . . 14 LYS HE2 . 10230 1 72 . 1 1 14 14 LYS HE3 H 1 2.874 0.030 . 1 . . . . 14 LYS HE3 . 10230 1 73 . 1 1 14 14 LYS HG2 H 1 0.985 0.030 . 2 . . . . 14 LYS HG2 . 10230 1 74 . 1 1 14 14 LYS HG3 H 1 1.127 0.030 . 2 . . . . 14 LYS HG3 . 10230 1 75 . 1 1 14 14 LYS C C 13 174.467 0.300 . 1 . . . . 14 LYS C . 10230 1 76 . 1 1 14 14 LYS CA C 13 54.862 0.300 . 1 . . . . 14 LYS CA . 10230 1 77 . 1 1 14 14 LYS CB C 13 36.253 0.300 . 1 . . . . 14 LYS CB . 10230 1 78 . 1 1 14 14 LYS CD C 13 29.661 0.300 . 1 . . . . 14 LYS CD . 10230 1 79 . 1 1 14 14 LYS CE C 13 42.052 0.300 . 1 . . . . 14 LYS CE . 10230 1 80 . 1 1 14 14 LYS CG C 13 24.332 0.300 . 1 . . . . 14 LYS CG . 10230 1 81 . 1 1 14 14 LYS N N 15 125.268 0.300 . 1 . . . . 14 LYS N . 10230 1 82 . 1 1 15 15 CYS H H 1 9.301 0.030 . 1 . . . . 15 CYS H . 10230 1 83 . 1 1 15 15 CYS HA H 1 4.615 0.030 . 1 . . . . 15 CYS HA . 10230 1 84 . 1 1 15 15 CYS HB2 H 1 3.408 0.030 . 2 . . . . 15 CYS HB2 . 10230 1 85 . 1 1 15 15 CYS HB3 H 1 2.856 0.030 . 2 . . . . 15 CYS HB3 . 10230 1 86 . 1 1 15 15 CYS C C 13 177.056 0.300 . 1 . . . . 15 CYS C . 10230 1 87 . 1 1 15 15 CYS CA C 13 59.312 0.300 . 1 . . . . 15 CYS CA . 10230 1 88 . 1 1 15 15 CYS CB C 13 29.488 0.300 . 1 . . . . 15 CYS CB . 10230 1 89 . 1 1 15 15 CYS N N 15 128.099 0.300 . 1 . . . . 15 CYS N . 10230 1 90 . 1 1 16 16 GLU H H 1 9.566 0.030 . 1 . . . . 16 GLU H . 10230 1 91 . 1 1 16 16 GLU HA H 1 4.132 0.030 . 1 . . . . 16 GLU HA . 10230 1 92 . 1 1 16 16 GLU HB2 H 1 2.181 0.030 . 2 . . . . 16 GLU HB2 . 10230 1 93 . 1 1 16 16 GLU HB3 H 1 2.029 0.030 . 2 . . . . 16 GLU HB3 . 10230 1 94 . 1 1 16 16 GLU HG2 H 1 2.462 0.030 . 2 . . . . 16 GLU HG2 . 10230 1 95 . 1 1 16 16 GLU HG3 H 1 2.367 0.030 . 2 . . . . 16 GLU HG3 . 10230 1 96 . 1 1 16 16 GLU C C 13 177.004 0.300 . 1 . . . . 16 GLU C . 10230 1 97 . 1 1 16 16 GLU CA C 13 58.483 0.300 . 1 . . . . 16 GLU CA . 10230 1 98 . 1 1 16 16 GLU CB C 13 29.405 0.300 . 1 . . . . 16 GLU CB . 10230 1 99 . 1 1 16 16 GLU CG C 13 35.971 0.300 . 1 . . . . 16 GLU CG . 10230 1 100 . 1 1 16 16 GLU N N 15 132.079 0.300 . 1 . . . . 16 GLU N . 10230 1 101 . 1 1 17 17 GLU H H 1 8.515 0.030 . 1 . . . . 17 GLU H . 10230 1 102 . 1 1 17 17 GLU HA H 1 4.166 0.030 . 1 . . . . 17 GLU HA . 10230 1 103 . 1 1 17 17 GLU HB2 H 1 1.450 0.030 . 2 . . . . 17 GLU HB2 . 10230 1 104 . 1 1 17 17 GLU HB3 H 1 1.313 0.030 . 2 . . . . 17 GLU HB3 . 10230 1 105 . 1 1 17 17 GLU HG2 H 1 1.715 0.030 . 2 . . . . 17 GLU HG2 . 10230 1 106 . 1 1 17 17 GLU HG3 H 1 1.871 0.030 . 2 . . . . 17 GLU HG3 . 10230 1 107 . 1 1 17 17 GLU C C 13 177.263 0.300 . 1 . . . . 17 GLU C . 10230 1 108 . 1 1 17 17 GLU CA C 13 58.536 0.300 . 1 . . . . 17 GLU CA . 10230 1 109 . 1 1 17 17 GLU CB C 13 29.369 0.300 . 1 . . . . 17 GLU CB . 10230 1 110 . 1 1 17 17 GLU CG C 13 35.504 0.300 . 1 . . . . 17 GLU CG . 10230 1 111 . 1 1 17 17 GLU N N 15 119.982 0.300 . 1 . . . . 17 GLU N . 10230 1 112 . 1 1 18 18 CYS H H 1 7.938 0.030 . 1 . . . . 18 CYS H . 10230 1 113 . 1 1 18 18 CYS HA H 1 5.196 0.030 . 1 . . . . 18 CYS HA . 10230 1 114 . 1 1 18 18 CYS HB2 H 1 3.448 0.030 . 2 . . . . 18 CYS HB2 . 10230 1 115 . 1 1 18 18 CYS HB3 H 1 2.858 0.030 . 2 . . . . 18 CYS HB3 . 10230 1 116 . 1 1 18 18 CYS C C 13 176.278 0.300 . 1 . . . . 18 CYS C . 10230 1 117 . 1 1 18 18 CYS CA C 13 58.263 0.300 . 1 . . . . 18 CYS CA . 10230 1 118 . 1 1 18 18 CYS CB C 13 32.587 0.300 . 1 . . . . 18 CYS CB . 10230 1 119 . 1 1 18 18 CYS N N 15 114.272 0.300 . 1 . . . . 18 CYS N . 10230 1 120 . 1 1 19 19 GLY H H 1 8.314 0.030 . 1 . . . . 19 GLY H . 10230 1 121 . 1 1 19 19 GLY HA2 H 1 4.268 0.030 . 2 . . . . 19 GLY HA2 . 10230 1 122 . 1 1 19 19 GLY HA3 H 1 3.673 0.030 . 2 . . . . 19 GLY HA3 . 10230 1 123 . 1 1 19 19 GLY C C 13 173.616 0.300 . 1 . . . . 19 GLY C . 10230 1 124 . 1 1 19 19 GLY CA C 13 46.257 0.300 . 1 . . . . 19 GLY CA . 10230 1 125 . 1 1 19 19 GLY N N 15 114.021 0.300 . 1 . . . . 19 GLY N . 10230 1 126 . 1 1 20 20 LYS H H 1 7.978 0.030 . 1 . . . . 20 LYS H . 10230 1 127 . 1 1 20 20 LYS HA H 1 3.931 0.030 . 1 . . . . 20 LYS HA . 10230 1 128 . 1 1 20 20 LYS HB2 H 1 1.382 0.030 . 2 . . . . 20 LYS HB2 . 10230 1 129 . 1 1 20 20 LYS HB3 H 1 1.200 0.030 . 2 . . . . 20 LYS HB3 . 10230 1 130 . 1 1 20 20 LYS HD2 H 1 1.479 0.030 . 2 . . . . 20 LYS HD2 . 10230 1 131 . 1 1 20 20 LYS HD3 H 1 1.433 0.030 . 2 . . . . 20 LYS HD3 . 10230 1 132 . 1 1 20 20 LYS HE2 H 1 2.980 0.030 . 2 . . . . 20 LYS HE2 . 10230 1 133 . 1 1 20 20 LYS HE3 H 1 2.931 0.030 . 2 . . . . 20 LYS HE3 . 10230 1 134 . 1 1 20 20 LYS HG2 H 1 1.448 0.030 . 2 . . . . 20 LYS HG2 . 10230 1 135 . 1 1 20 20 LYS HG3 H 1 1.066 0.030 . 2 . . . . 20 LYS HG3 . 10230 1 136 . 1 1 20 20 LYS C C 13 174.188 0.300 . 1 . . . . 20 LYS C . 10230 1 137 . 1 1 20 20 LYS CA C 13 58.366 0.300 . 1 . . . . 20 LYS CA . 10230 1 138 . 1 1 20 20 LYS CB C 13 33.708 0.300 . 1 . . . . 20 LYS CB . 10230 1 139 . 1 1 20 20 LYS CD C 13 29.528 0.300 . 1 . . . . 20 LYS CD . 10230 1 140 . 1 1 20 20 LYS CE C 13 42.181 0.300 . 1 . . . . 20 LYS CE . 10230 1 141 . 1 1 20 20 LYS CG C 13 26.489 0.300 . 1 . . . . 20 LYS CG . 10230 1 142 . 1 1 20 20 LYS N N 15 122.893 0.300 . 1 . . . . 20 LYS N . 10230 1 143 . 1 1 21 21 ARG H H 1 7.701 0.030 . 1 . . . . 21 ARG H . 10230 1 144 . 1 1 21 21 ARG HA H 1 5.225 0.030 . 1 . . . . 21 ARG HA . 10230 1 145 . 1 1 21 21 ARG HB2 H 1 1.817 0.030 . 2 . . . . 21 ARG HB2 . 10230 1 146 . 1 1 21 21 ARG HB3 H 1 1.379 0.030 . 2 . . . . 21 ARG HB3 . 10230 1 147 . 1 1 21 21 ARG HD2 H 1 3.203 0.030 . 1 . . . . 21 ARG HD2 . 10230 1 148 . 1 1 21 21 ARG HD3 H 1 3.203 0.030 . 1 . . . . 21 ARG HD3 . 10230 1 149 . 1 1 21 21 ARG HG2 H 1 1.258 0.030 . 2 . . . . 21 ARG HG2 . 10230 1 150 . 1 1 21 21 ARG HG3 H 1 1.724 0.030 . 2 . . . . 21 ARG HG3 . 10230 1 151 . 1 1 21 21 ARG C C 13 175.407 0.300 . 1 . . . . 21 ARG C . 10230 1 152 . 1 1 21 21 ARG CA C 13 54.329 0.300 . 1 . . . . 21 ARG CA . 10230 1 153 . 1 1 21 21 ARG CB C 13 33.812 0.300 . 1 . . . . 21 ARG CB . 10230 1 154 . 1 1 21 21 ARG CD C 13 43.326 0.300 . 1 . . . . 21 ARG CD . 10230 1 155 . 1 1 21 21 ARG CG C 13 28.363 0.300 . 1 . . . . 21 ARG CG . 10230 1 156 . 1 1 21 21 ARG N N 15 118.953 0.300 . 1 . . . . 21 ARG N . 10230 1 157 . 1 1 22 22 PHE H H 1 8.809 0.030 . 1 . . . . 22 PHE H . 10230 1 158 . 1 1 22 22 PHE HA H 1 4.843 0.030 . 1 . . . . 22 PHE HA . 10230 1 159 . 1 1 22 22 PHE HB2 H 1 3.544 0.030 . 2 . . . . 22 PHE HB2 . 10230 1 160 . 1 1 22 22 PHE HB3 H 1 2.548 0.030 . 2 . . . . 22 PHE HB3 . 10230 1 161 . 1 1 22 22 PHE HD1 H 1 7.119 0.030 . 1 . . . . 22 PHE HD1 . 10230 1 162 . 1 1 22 22 PHE HD2 H 1 7.119 0.030 . 1 . . . . 22 PHE HD2 . 10230 1 163 . 1 1 22 22 PHE HE1 H 1 6.862 0.030 . 1 . . . . 22 PHE HE1 . 10230 1 164 . 1 1 22 22 PHE HE2 H 1 6.862 0.030 . 1 . . . . 22 PHE HE2 . 10230 1 165 . 1 1 22 22 PHE HZ H 1 6.123 0.030 . 1 . . . . 22 PHE HZ . 10230 1 166 . 1 1 22 22 PHE C C 13 175.443 0.300 . 1 . . . . 22 PHE C . 10230 1 167 . 1 1 22 22 PHE CA C 13 57.033 0.300 . 1 . . . . 22 PHE CA . 10230 1 168 . 1 1 22 22 PHE CB C 13 43.947 0.300 . 1 . . . . 22 PHE CB . 10230 1 169 . 1 1 22 22 PHE CD1 C 13 132.369 0.300 . 1 . . . . 22 PHE CD1 . 10230 1 170 . 1 1 22 22 PHE CD2 C 13 132.369 0.300 . 1 . . . . 22 PHE CD2 . 10230 1 171 . 1 1 22 22 PHE CE1 C 13 130.707 0.300 . 1 . . . . 22 PHE CE1 . 10230 1 172 . 1 1 22 22 PHE CE2 C 13 130.707 0.300 . 1 . . . . 22 PHE CE2 . 10230 1 173 . 1 1 22 22 PHE CZ C 13 128.720 0.300 . 1 . . . . 22 PHE CZ . 10230 1 174 . 1 1 22 22 PHE N N 15 116.286 0.300 . 1 . . . . 22 PHE N . 10230 1 175 . 1 1 23 23 THR H H 1 8.980 0.030 . 1 . . . . 23 THR H . 10230 1 176 . 1 1 23 23 THR HA H 1 4.463 0.030 . 1 . . . . 23 THR HA . 10230 1 177 . 1 1 23 23 THR HB H 1 4.467 0.030 . 1 . . . . 23 THR HB . 10230 1 178 . 1 1 23 23 THR HG21 H 1 1.453 0.030 . 1 . . . . 23 THR HG2 . 10230 1 179 . 1 1 23 23 THR HG22 H 1 1.453 0.030 . 1 . . . . 23 THR HG2 . 10230 1 180 . 1 1 23 23 THR HG23 H 1 1.453 0.030 . 1 . . . . 23 THR HG2 . 10230 1 181 . 1 1 23 23 THR C C 13 174.420 0.300 . 1 . . . . 23 THR C . 10230 1 182 . 1 1 23 23 THR CA C 13 64.989 0.300 . 1 . . . . 23 THR CA . 10230 1 183 . 1 1 23 23 THR CB C 13 69.648 0.300 . 1 . . . . 23 THR CB . 10230 1 184 . 1 1 23 23 THR CG2 C 13 22.815 0.300 . 1 . . . . 23 THR CG2 . 10230 1 185 . 1 1 23 23 THR N N 15 114.709 0.300 . 1 . . . . 23 THR N . 10230 1 186 . 1 1 24 24 GLN H H 1 7.526 0.030 . 1 . . . . 24 GLN H . 10230 1 187 . 1 1 24 24 GLN HA H 1 4.809 0.030 . 1 . . . . 24 GLN HA . 10230 1 188 . 1 1 24 24 GLN HB2 H 1 2.230 0.030 . 2 . . . . 24 GLN HB2 . 10230 1 189 . 1 1 24 24 GLN HB3 H 1 1.658 0.030 . 2 . . . . 24 GLN HB3 . 10230 1 190 . 1 1 24 24 GLN HE21 H 1 7.126 0.030 . 2 . . . . 24 GLN HE21 . 10230 1 191 . 1 1 24 24 GLN HE22 H 1 6.691 0.030 . 2 . . . . 24 GLN HE22 . 10230 1 192 . 1 1 24 24 GLN HG2 H 1 2.396 0.030 . 1 . . . . 24 GLN HG2 . 10230 1 193 . 1 1 24 24 GLN HG3 H 1 2.396 0.030 . 1 . . . . 24 GLN HG3 . 10230 1 194 . 1 1 24 24 GLN C C 13 176.247 0.300 . 1 . . . . 24 GLN C . 10230 1 195 . 1 1 24 24 GLN CA C 13 53.833 0.300 . 1 . . . . 24 GLN CA . 10230 1 196 . 1 1 24 24 GLN CB C 13 32.628 0.300 . 1 . . . . 24 GLN CB . 10230 1 197 . 1 1 24 24 GLN CG C 13 33.391 0.300 . 1 . . . . 24 GLN CG . 10230 1 198 . 1 1 24 24 GLN N N 15 115.299 0.300 . 1 . . . . 24 GLN N . 10230 1 199 . 1 1 24 24 GLN NE2 N 15 111.005 0.300 . 1 . . . . 24 GLN NE2 . 10230 1 200 . 1 1 25 25 ASN HA H 1 3.359 0.030 . 1 . . . . 25 ASN HA . 10230 1 201 . 1 1 25 25 ASN HB2 H 1 2.251 0.030 . 2 . . . . 25 ASN HB2 . 10230 1 202 . 1 1 25 25 ASN HB3 H 1 1.951 0.030 . 2 . . . . 25 ASN HB3 . 10230 1 203 . 1 1 25 25 ASN HD21 H 1 7.410 0.030 . 2 . . . . 25 ASN HD21 . 10230 1 204 . 1 1 25 25 ASN HD22 H 1 6.877 0.030 . 2 . . . . 25 ASN HD22 . 10230 1 205 . 1 1 25 25 ASN CA C 13 55.668 0.300 . 1 . . . . 25 ASN CA . 10230 1 206 . 1 1 25 25 ASN CB C 13 37.930 0.300 . 1 . . . . 25 ASN CB . 10230 1 207 . 1 1 25 25 ASN N N 15 119.000 0.300 . 1 . . . . 25 ASN N . 10230 1 208 . 1 1 25 25 ASN ND2 N 15 111.529 0.300 . 1 . . . . 25 ASN ND2 . 10230 1 209 . 1 1 26 26 SER HA H 1 4.003 0.030 . 1 . . . . 26 SER HA . 10230 1 210 . 1 1 26 26 SER HB2 H 1 3.840 0.030 . 1 . . . . 26 SER HB2 . 10230 1 211 . 1 1 26 26 SER HB3 H 1 3.840 0.030 . 1 . . . . 26 SER HB3 . 10230 1 212 . 1 1 26 26 SER C C 13 177.207 0.300 . 1 . . . . 26 SER C . 10230 1 213 . 1 1 26 26 SER CA C 13 60.851 0.300 . 1 . . . . 26 SER CA . 10230 1 214 . 1 1 26 26 SER CB C 13 61.368 0.300 . 1 . . . . 26 SER CB . 10230 1 215 . 1 1 26 26 SER N N 15 118.833 0.300 . 1 . . . . 26 SER N . 10230 1 216 . 1 1 27 27 GLN H H 1 6.685 0.030 . 1 . . . . 27 GLN H . 10230 1 217 . 1 1 27 27 GLN HA H 1 4.060 0.030 . 1 . . . . 27 GLN HA . 10230 1 218 . 1 1 27 27 GLN HB2 H 1 2.080 0.030 . 2 . . . . 27 GLN HB2 . 10230 1 219 . 1 1 27 27 GLN HB3 H 1 2.399 0.030 . 2 . . . . 27 GLN HB3 . 10230 1 220 . 1 1 27 27 GLN HE21 H 1 7.627 0.030 . 2 . . . . 27 GLN HE21 . 10230 1 221 . 1 1 27 27 GLN HE22 H 1 6.966 0.030 . 2 . . . . 27 GLN HE22 . 10230 1 222 . 1 1 27 27 GLN HG2 H 1 2.511 0.030 . 2 . . . . 27 GLN HG2 . 10230 1 223 . 1 1 27 27 GLN HG3 H 1 2.368 0.030 . 2 . . . . 27 GLN HG3 . 10230 1 224 . 1 1 27 27 GLN C C 13 178.447 0.300 . 1 . . . . 27 GLN C . 10230 1 225 . 1 1 27 27 GLN CA C 13 57.550 0.300 . 1 . . . . 27 GLN CA . 10230 1 226 . 1 1 27 27 GLN CB C 13 28.617 0.300 . 1 . . . . 27 GLN CB . 10230 1 227 . 1 1 27 27 GLN CG C 13 34.009 0.300 . 1 . . . . 27 GLN CG . 10230 1 228 . 1 1 27 27 GLN N N 15 121.169 0.300 . 1 . . . . 27 GLN N . 10230 1 229 . 1 1 27 27 GLN NE2 N 15 111.671 0.300 . 1 . . . . 27 GLN NE2 . 10230 1 230 . 1 1 28 28 LEU H H 1 6.836 0.030 . 1 . . . . 28 LEU H . 10230 1 231 . 1 1 28 28 LEU HA H 1 3.150 0.030 . 1 . . . . 28 LEU HA . 10230 1 232 . 1 1 28 28 LEU HB2 H 1 1.983 0.030 . 2 . . . . 28 LEU HB2 . 10230 1 233 . 1 1 28 28 LEU HB3 H 1 1.117 0.030 . 2 . . . . 28 LEU HB3 . 10230 1 234 . 1 1 28 28 LEU HD11 H 1 1.064 0.030 . 1 . . . . 28 LEU HD1 . 10230 1 235 . 1 1 28 28 LEU HD12 H 1 1.064 0.030 . 1 . . . . 28 LEU HD1 . 10230 1 236 . 1 1 28 28 LEU HD13 H 1 1.064 0.030 . 1 . . . . 28 LEU HD1 . 10230 1 237 . 1 1 28 28 LEU HD21 H 1 1.013 0.030 . 1 . . . . 28 LEU HD2 . 10230 1 238 . 1 1 28 28 LEU HD22 H 1 1.013 0.030 . 1 . . . . 28 LEU HD2 . 10230 1 239 . 1 1 28 28 LEU HD23 H 1 1.013 0.030 . 1 . . . . 28 LEU HD2 . 10230 1 240 . 1 1 28 28 LEU HG H 1 1.475 0.030 . 1 . . . . 28 LEU HG . 10230 1 241 . 1 1 28 28 LEU C C 13 177.696 0.300 . 1 . . . . 28 LEU C . 10230 1 242 . 1 1 28 28 LEU CA C 13 57.849 0.300 . 1 . . . . 28 LEU CA . 10230 1 243 . 1 1 28 28 LEU CB C 13 40.265 0.300 . 1 . . . . 28 LEU CB . 10230 1 244 . 1 1 28 28 LEU CD1 C 13 26.220 0.300 . 2 . . . . 28 LEU CD1 . 10230 1 245 . 1 1 28 28 LEU CD2 C 13 23.148 0.300 . 2 . . . . 28 LEU CD2 . 10230 1 246 . 1 1 28 28 LEU CG C 13 27.559 0.300 . 1 . . . . 28 LEU CG . 10230 1 247 . 1 1 28 28 LEU N N 15 121.952 0.300 . 1 . . . . 28 LEU N . 10230 1 248 . 1 1 29 29 HIS H H 1 8.184 0.030 . 1 . . . . 29 HIS H . 10230 1 249 . 1 1 29 29 HIS HA H 1 4.354 0.030 . 1 . . . . 29 HIS HA . 10230 1 250 . 1 1 29 29 HIS HB2 H 1 3.047 0.030 . 1 . . . . 29 HIS HB2 . 10230 1 251 . 1 1 29 29 HIS HB3 H 1 3.047 0.030 . 1 . . . . 29 HIS HB3 . 10230 1 252 . 1 1 29 29 HIS HD2 H 1 6.907 0.030 . 1 . . . . 29 HIS HD2 . 10230 1 253 . 1 1 29 29 HIS HE1 H 1 7.747 0.030 . 1 . . . . 29 HIS HE1 . 10230 1 254 . 1 1 29 29 HIS C C 13 178.575 0.300 . 1 . . . . 29 HIS C . 10230 1 255 . 1 1 29 29 HIS CA C 13 59.335 0.300 . 1 . . . . 29 HIS CA . 10230 1 256 . 1 1 29 29 HIS CB C 13 30.003 0.300 . 1 . . . . 29 HIS CB . 10230 1 257 . 1 1 29 29 HIS CD2 C 13 119.226 0.300 . 1 . . . . 29 HIS CD2 . 10230 1 258 . 1 1 29 29 HIS CE1 C 13 138.205 0.300 . 1 . . . . 29 HIS CE1 . 10230 1 259 . 1 1 29 29 HIS N N 15 118.076 0.300 . 1 . . . . 29 HIS N . 10230 1 260 . 1 1 30 30 SER H H 1 7.774 0.030 . 1 . . . . 30 SER H . 10230 1 261 . 1 1 30 30 SER HA H 1 4.114 0.030 . 1 . . . . 30 SER HA . 10230 1 262 . 1 1 30 30 SER HB2 H 1 3.882 0.030 . 1 . . . . 30 SER HB2 . 10230 1 263 . 1 1 30 30 SER HB3 H 1 3.882 0.030 . 1 . . . . 30 SER HB3 . 10230 1 264 . 1 1 30 30 SER C C 13 176.995 0.300 . 1 . . . . 30 SER C . 10230 1 265 . 1 1 30 30 SER CA C 13 61.403 0.300 . 1 . . . . 30 SER CA . 10230 1 266 . 1 1 30 30 SER CB C 13 62.700 0.300 . 1 . . . . 30 SER CB . 10230 1 267 . 1 1 30 30 SER N N 15 113.416 0.300 . 1 . . . . 30 SER N . 10230 1 268 . 1 1 31 31 HIS H H 1 7.674 0.030 . 1 . . . . 31 HIS H . 10230 1 269 . 1 1 31 31 HIS HA H 1 4.244 0.030 . 1 . . . . 31 HIS HA . 10230 1 270 . 1 1 31 31 HIS HB2 H 1 3.144 0.030 . 2 . . . . 31 HIS HB2 . 10230 1 271 . 1 1 31 31 HIS HB3 H 1 2.916 0.030 . 2 . . . . 31 HIS HB3 . 10230 1 272 . 1 1 31 31 HIS HD2 H 1 6.962 0.030 . 1 . . . . 31 HIS HD2 . 10230 1 273 . 1 1 31 31 HIS HE1 H 1 8.029 0.030 . 1 . . . . 31 HIS HE1 . 10230 1 274 . 1 1 31 31 HIS C C 13 175.921 0.300 . 1 . . . . 31 HIS C . 10230 1 275 . 1 1 31 31 HIS CA C 13 58.808 0.300 . 1 . . . . 31 HIS CA . 10230 1 276 . 1 1 31 31 HIS CB C 13 28.456 0.300 . 1 . . . . 31 HIS CB . 10230 1 277 . 1 1 31 31 HIS CD2 C 13 127.250 0.300 . 1 . . . . 31 HIS CD2 . 10230 1 278 . 1 1 31 31 HIS CE1 C 13 139.865 0.300 . 1 . . . . 31 HIS CE1 . 10230 1 279 . 1 1 31 31 HIS N N 15 121.035 0.300 . 1 . . . . 31 HIS N . 10230 1 280 . 1 1 32 32 GLN H H 1 8.120 0.030 . 1 . . . . 32 GLN H . 10230 1 281 . 1 1 32 32 GLN HA H 1 3.662 0.030 . 1 . . . . 32 GLN HA . 10230 1 282 . 1 1 32 32 GLN HB2 H 1 2.268 0.030 . 2 . . . . 32 GLN HB2 . 10230 1 283 . 1 1 32 32 GLN HB3 H 1 2.195 0.030 . 2 . . . . 32 GLN HB3 . 10230 1 284 . 1 1 32 32 GLN HE21 H 1 7.533 0.030 . 2 . . . . 32 GLN HE21 . 10230 1 285 . 1 1 32 32 GLN HE22 H 1 7.108 0.030 . 2 . . . . 32 GLN HE22 . 10230 1 286 . 1 1 32 32 GLN HG2 H 1 2.801 0.030 . 1 . . . . 32 GLN HG2 . 10230 1 287 . 1 1 32 32 GLN HG3 H 1 2.801 0.030 . 1 . . . . 32 GLN HG3 . 10230 1 288 . 1 1 32 32 GLN C C 13 177.273 0.300 . 1 . . . . 32 GLN C . 10230 1 289 . 1 1 32 32 GLN CA C 13 59.264 0.300 . 1 . . . . 32 GLN CA . 10230 1 290 . 1 1 32 32 GLN CB C 13 28.135 0.300 . 1 . . . . 32 GLN CB . 10230 1 291 . 1 1 32 32 GLN CG C 13 35.106 0.300 . 1 . . . . 32 GLN CG . 10230 1 292 . 1 1 32 32 GLN N N 15 115.343 0.300 . 1 . . . . 32 GLN N . 10230 1 293 . 1 1 32 32 GLN NE2 N 15 112.644 0.300 . 1 . . . . 32 GLN NE2 . 10230 1 294 . 1 1 33 33 ARG H H 1 7.065 0.030 . 1 . . . . 33 ARG H . 10230 1 295 . 1 1 33 33 ARG HA H 1 4.124 0.030 . 1 . . . . 33 ARG HA . 10230 1 296 . 1 1 33 33 ARG HB2 H 1 1.847 0.030 . 2 . . . . 33 ARG HB2 . 10230 1 297 . 1 1 33 33 ARG HB3 H 1 1.790 0.030 . 2 . . . . 33 ARG HB3 . 10230 1 298 . 1 1 33 33 ARG HD2 H 1 3.185 0.030 . 1 . . . . 33 ARG HD2 . 10230 1 299 . 1 1 33 33 ARG HD3 H 1 3.185 0.030 . 1 . . . . 33 ARG HD3 . 10230 1 300 . 1 1 33 33 ARG HG2 H 1 1.739 0.030 . 2 . . . . 33 ARG HG2 . 10230 1 301 . 1 1 33 33 ARG HG3 H 1 1.649 0.030 . 2 . . . . 33 ARG HG3 . 10230 1 302 . 1 1 33 33 ARG C C 13 178.476 0.300 . 1 . . . . 33 ARG C . 10230 1 303 . 1 1 33 33 ARG CA C 13 58.372 0.300 . 1 . . . . 33 ARG CA . 10230 1 304 . 1 1 33 33 ARG CB C 13 29.919 0.300 . 1 . . . . 33 ARG CB . 10230 1 305 . 1 1 33 33 ARG CD C 13 43.331 0.300 . 1 . . . . 33 ARG CD . 10230 1 306 . 1 1 33 33 ARG CG C 13 27.323 0.300 . 1 . . . . 33 ARG CG . 10230 1 307 . 1 1 33 33 ARG N N 15 117.435 0.300 . 1 . . . . 33 ARG N . 10230 1 308 . 1 1 34 34 VAL H H 1 7.882 0.030 . 1 . . . . 34 VAL H . 10230 1 309 . 1 1 34 34 VAL HA H 1 3.899 0.030 . 1 . . . . 34 VAL HA . 10230 1 310 . 1 1 34 34 VAL HB H 1 1.888 0.030 . 1 . . . . 34 VAL HB . 10230 1 311 . 1 1 34 34 VAL HG11 H 1 0.632 0.030 . 1 . . . . 34 VAL HG1 . 10230 1 312 . 1 1 34 34 VAL HG12 H 1 0.632 0.030 . 1 . . . . 34 VAL HG1 . 10230 1 313 . 1 1 34 34 VAL HG13 H 1 0.632 0.030 . 1 . . . . 34 VAL HG1 . 10230 1 314 . 1 1 34 34 VAL HG21 H 1 0.495 0.030 . 1 . . . . 34 VAL HG2 . 10230 1 315 . 1 1 34 34 VAL HG22 H 1 0.495 0.030 . 1 . . . . 34 VAL HG2 . 10230 1 316 . 1 1 34 34 VAL HG23 H 1 0.495 0.030 . 1 . . . . 34 VAL HG2 . 10230 1 317 . 1 1 34 34 VAL C C 13 177.238 0.300 . 1 . . . . 34 VAL C . 10230 1 318 . 1 1 34 34 VAL CA C 13 63.969 0.300 . 1 . . . . 34 VAL CA . 10230 1 319 . 1 1 34 34 VAL CB C 13 31.000 0.300 . 1 . . . . 34 VAL CB . 10230 1 320 . 1 1 34 34 VAL CG1 C 13 19.882 0.300 . 2 . . . . 34 VAL CG1 . 10230 1 321 . 1 1 34 34 VAL CG2 C 13 19.642 0.300 . 2 . . . . 34 VAL CG2 . 10230 1 322 . 1 1 34 34 VAL N N 15 116.190 0.300 . 1 . . . . 34 VAL N . 10230 1 323 . 1 1 35 35 HIS H H 1 7.203 0.030 . 1 . . . . 35 HIS H . 10230 1 324 . 1 1 35 35 HIS HA H 1 4.877 0.030 . 1 . . . . 35 HIS HA . 10230 1 325 . 1 1 35 35 HIS HB2 H 1 3.365 0.030 . 2 . . . . 35 HIS HB2 . 10230 1 326 . 1 1 35 35 HIS HB3 H 1 3.196 0.030 . 2 . . . . 35 HIS HB3 . 10230 1 327 . 1 1 35 35 HIS HD2 H 1 6.731 0.030 . 1 . . . . 35 HIS HD2 . 10230 1 328 . 1 1 35 35 HIS HE1 H 1 8.038 0.030 . 1 . . . . 35 HIS HE1 . 10230 1 329 . 1 1 35 35 HIS C C 13 175.781 0.300 . 1 . . . . 35 HIS C . 10230 1 330 . 1 1 35 35 HIS CA C 13 55.155 0.300 . 1 . . . . 35 HIS CA . 10230 1 331 . 1 1 35 35 HIS CB C 13 28.648 0.300 . 1 . . . . 35 HIS CB . 10230 1 332 . 1 1 35 35 HIS CD2 C 13 127.568 0.300 . 1 . . . . 35 HIS CD2 . 10230 1 333 . 1 1 35 35 HIS CE1 C 13 139.865 0.300 . 1 . . . . 35 HIS CE1 . 10230 1 334 . 1 1 35 35 HIS N N 15 117.199 0.300 . 1 . . . . 35 HIS N . 10230 1 335 . 1 1 36 36 THR H H 1 7.779 0.030 . 1 . . . . 36 THR H . 10230 1 336 . 1 1 36 36 THR HA H 1 4.353 0.030 . 1 . . . . 36 THR HA . 10230 1 337 . 1 1 36 36 THR HB H 1 4.314 0.030 . 1 . . . . 36 THR HB . 10230 1 338 . 1 1 36 36 THR HG21 H 1 1.231 0.030 . 1 . . . . 36 THR HG2 . 10230 1 339 . 1 1 36 36 THR HG22 H 1 1.231 0.030 . 1 . . . . 36 THR HG2 . 10230 1 340 . 1 1 36 36 THR HG23 H 1 1.231 0.030 . 1 . . . . 36 THR HG2 . 10230 1 341 . 1 1 36 36 THR C C 13 175.511 0.300 . 1 . . . . 36 THR C . 10230 1 342 . 1 1 36 36 THR CA C 13 62.495 0.300 . 1 . . . . 36 THR CA . 10230 1 343 . 1 1 36 36 THR CB C 13 69.840 0.300 . 1 . . . . 36 THR CB . 10230 1 344 . 1 1 36 36 THR CG2 C 13 21.573 0.300 . 1 . . . . 36 THR CG2 . 10230 1 345 . 1 1 36 36 THR N N 15 111.736 0.300 . 1 . . . . 36 THR N . 10230 1 346 . 1 1 37 37 GLY H H 1 8.231 0.030 . 1 . . . . 37 GLY H . 10230 1 347 . 1 1 37 37 GLY HA2 H 1 4.026 0.030 . 2 . . . . 37 GLY HA2 . 10230 1 348 . 1 1 37 37 GLY HA3 H 1 3.951 0.030 . 2 . . . . 37 GLY HA3 . 10230 1 349 . 1 1 37 37 GLY C C 13 174.029 0.300 . 1 . . . . 37 GLY C . 10230 1 350 . 1 1 37 37 GLY CA C 13 45.277 0.300 . 1 . . . . 37 GLY CA . 10230 1 351 . 1 1 37 37 GLY N N 15 110.634 0.300 . 1 . . . . 37 GLY N . 10230 1 352 . 1 1 38 38 GLU H H 1 8.089 0.030 . 1 . . . . 38 GLU H . 10230 1 353 . 1 1 38 38 GLU HA H 1 4.246 0.030 . 1 . . . . 38 GLU HA . 10230 1 354 . 1 1 38 38 GLU HB2 H 1 1.988 0.030 . 2 . . . . 38 GLU HB2 . 10230 1 355 . 1 1 38 38 GLU HB3 H 1 1.898 0.030 . 2 . . . . 38 GLU HB3 . 10230 1 356 . 1 1 38 38 GLU HG2 H 1 2.270 0.030 . 2 . . . . 38 GLU HG2 . 10230 1 357 . 1 1 38 38 GLU HG3 H 1 2.219 0.030 . 2 . . . . 38 GLU HG3 . 10230 1 358 . 1 1 38 38 GLU C C 13 176.458 0.300 . 1 . . . . 38 GLU C . 10230 1 359 . 1 1 38 38 GLU CA C 13 56.489 0.300 . 1 . . . . 38 GLU CA . 10230 1 360 . 1 1 38 38 GLU CB C 13 30.515 0.300 . 1 . . . . 38 GLU CB . 10230 1 361 . 1 1 38 38 GLU CG C 13 36.266 0.300 . 1 . . . . 38 GLU CG . 10230 1 362 . 1 1 38 38 GLU N N 15 120.563 0.300 . 1 . . . . 38 GLU N . 10230 1 363 . 1 1 39 39 LYS H H 1 8.395 0.030 . 1 . . . . 39 LYS H . 10230 1 364 . 1 1 39 39 LYS HA H 1 4.604 0.030 . 1 . . . . 39 LYS HA . 10230 1 365 . 1 1 39 39 LYS HB2 H 1 1.816 0.030 . 2 . . . . 39 LYS HB2 . 10230 1 366 . 1 1 39 39 LYS HB3 H 1 1.725 0.030 . 2 . . . . 39 LYS HB3 . 10230 1 367 . 1 1 39 39 LYS HD2 H 1 1.683 0.030 . 1 . . . . 39 LYS HD2 . 10230 1 368 . 1 1 39 39 LYS HD3 H 1 1.683 0.030 . 1 . . . . 39 LYS HD3 . 10230 1 369 . 1 1 39 39 LYS HE2 H 1 2.996 0.030 . 1 . . . . 39 LYS HE2 . 10230 1 370 . 1 1 39 39 LYS HE3 H 1 2.996 0.030 . 1 . . . . 39 LYS HE3 . 10230 1 371 . 1 1 39 39 LYS HG2 H 1 1.466 0.030 . 1 . . . . 39 LYS HG2 . 10230 1 372 . 1 1 39 39 LYS HG3 H 1 1.466 0.030 . 1 . . . . 39 LYS HG3 . 10230 1 373 . 1 1 39 39 LYS C C 13 174.345 0.300 . 1 . . . . 39 LYS C . 10230 1 374 . 1 1 39 39 LYS CA C 13 54.144 0.300 . 1 . . . . 39 LYS CA . 10230 1 375 . 1 1 39 39 LYS CB C 13 32.504 0.300 . 1 . . . . 39 LYS CB . 10230 1 376 . 1 1 39 39 LYS CD C 13 29.134 0.300 . 1 . . . . 39 LYS CD . 10230 1 377 . 1 1 39 39 LYS CE C 13 42.194 0.300 . 1 . . . . 39 LYS CE . 10230 1 378 . 1 1 39 39 LYS CG C 13 24.566 0.300 . 1 . . . . 39 LYS CG . 10230 1 379 . 1 1 39 39 LYS N N 15 123.827 0.300 . 1 . . . . 39 LYS N . 10230 1 380 . 1 1 40 40 PRO HA H 1 4.456 0.030 . 1 . . . . 40 PRO HA . 10230 1 381 . 1 1 40 40 PRO HB2 H 1 2.305 0.030 . 2 . . . . 40 PRO HB2 . 10230 1 382 . 1 1 40 40 PRO HB3 H 1 1.936 0.030 . 2 . . . . 40 PRO HB3 . 10230 1 383 . 1 1 40 40 PRO HD2 H 1 3.819 0.030 . 2 . . . . 40 PRO HD2 . 10230 1 384 . 1 1 40 40 PRO HD3 H 1 3.644 0.030 . 2 . . . . 40 PRO HD3 . 10230 1 385 . 1 1 40 40 PRO HG2 H 1 2.028 0.030 . 2 . . . . 40 PRO HG2 . 10230 1 386 . 1 1 40 40 PRO HG3 H 1 2.001 0.030 . 2 . . . . 40 PRO HG3 . 10230 1 387 . 1 1 40 40 PRO CA C 13 63.186 0.300 . 1 . . . . 40 PRO CA . 10230 1 388 . 1 1 40 40 PRO CB C 13 32.177 0.300 . 1 . . . . 40 PRO CB . 10230 1 389 . 1 1 40 40 PRO CD C 13 50.661 0.300 . 1 . . . . 40 PRO CD . 10230 1 390 . 1 1 40 40 PRO CG C 13 27.323 0.300 . 1 . . . . 40 PRO CG . 10230 1 391 . 1 1 41 41 SER H H 1 8.483 0.030 . 1 . . . . 41 SER H . 10230 1 392 . 1 1 41 41 SER HA H 1 4.453 0.030 . 1 . . . . 41 SER HA . 10230 1 393 . 1 1 41 41 SER HB2 H 1 3.869 0.030 . 1 . . . . 41 SER HB2 . 10230 1 394 . 1 1 41 41 SER HB3 H 1 3.869 0.030 . 1 . . . . 41 SER HB3 . 10230 1 395 . 1 1 41 41 SER CA C 13 58.591 0.300 . 1 . . . . 41 SER CA . 10230 1 396 . 1 1 41 41 SER CB C 13 63.944 0.300 . 1 . . . . 41 SER CB . 10230 1 397 . 1 1 41 41 SER N N 15 116.550 0.300 . 1 . . . . 41 SER N . 10230 1 398 . 1 1 42 42 GLY H H 1 8.230 0.030 . 1 . . . . 42 GLY H . 10230 1 399 . 1 1 42 42 GLY HA2 H 1 4.159 0.030 . 2 . . . . 42 GLY HA2 . 10230 1 400 . 1 1 42 42 GLY HA3 H 1 4.111 0.030 . 2 . . . . 42 GLY HA3 . 10230 1 401 . 1 1 42 42 GLY CA C 13 44.656 0.300 . 1 . . . . 42 GLY CA . 10230 1 402 . 1 1 42 42 GLY N N 15 110.653 0.300 . 1 . . . . 42 GLY N . 10230 1 403 . 1 1 43 43 PRO HA H 1 4.466 0.030 . 1 . . . . 43 PRO HA . 10230 1 404 . 1 1 43 43 PRO HB2 H 1 2.302 0.030 . 2 . . . . 43 PRO HB2 . 10230 1 405 . 1 1 43 43 PRO HB3 H 1 1.941 0.030 . 2 . . . . 43 PRO HB3 . 10230 1 406 . 1 1 43 43 PRO HD2 H 1 3.626 0.030 . 1 . . . . 43 PRO HD2 . 10230 1 407 . 1 1 43 43 PRO HD3 H 1 3.626 0.030 . 1 . . . . 43 PRO HD3 . 10230 1 408 . 1 1 43 43 PRO HG2 H 1 2.016 0.030 . 1 . . . . 43 PRO HG2 . 10230 1 409 . 1 1 43 43 PRO HG3 H 1 2.016 0.030 . 1 . . . . 43 PRO HG3 . 10230 1 410 . 1 1 43 43 PRO CA C 13 63.318 0.300 . 1 . . . . 43 PRO CA . 10230 1 411 . 1 1 43 43 PRO CB C 13 32.206 0.300 . 1 . . . . 43 PRO CB . 10230 1 412 . 1 1 43 43 PRO CD C 13 49.796 0.300 . 1 . . . . 43 PRO CD . 10230 1 413 . 1 1 43 43 PRO CG C 13 27.244 0.300 . 1 . . . . 43 PRO CG . 10230 1 414 . 1 1 44 44 SER H H 1 8.485 0.030 . 1 . . . . 44 SER H . 10230 1 415 . 1 1 44 44 SER N N 15 116.542 0.300 . 1 . . . . 44 SER N . 10230 1 stop_ save_