################################### # 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 10192 _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 10192 1 2 '3D 15N-separated NOESY' 1 $sample_1 isotropic 10192 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 45.476 0.300 . 1 . . . . 7 GLY CA . 10192 1 2 . 1 1 7 7 GLY HA2 H 1 4.020 0.030 . 1 . . . . 7 GLY HA2 . 10192 1 3 . 1 1 7 7 GLY HA3 H 1 4.020 0.030 . 1 . . . . 7 GLY HA3 . 10192 1 4 . 1 1 7 7 GLY C C 13 174.552 0.300 . 1 . . . . 7 GLY C . 10192 1 5 . 1 1 8 8 THR N N 15 112.807 0.300 . 1 . . . . 8 THR N . 10192 1 6 . 1 1 8 8 THR H H 1 8.124 0.030 . 1 . . . . 8 THR H . 10192 1 7 . 1 1 8 8 THR CA C 13 61.837 0.300 . 1 . . . . 8 THR CA . 10192 1 8 . 1 1 8 8 THR HA H 1 4.310 0.030 . 1 . . . . 8 THR HA . 10192 1 9 . 1 1 8 8 THR CB C 13 69.739 0.300 . 1 . . . . 8 THR CB . 10192 1 10 . 1 1 8 8 THR HB H 1 4.251 0.030 . 1 . . . . 8 THR HB . 10192 1 11 . 1 1 8 8 THR CG2 C 13 21.513 0.300 . 1 . . . . 8 THR CG2 . 10192 1 12 . 1 1 8 8 THR HG21 H 1 1.141 0.030 . 1 . . . . 8 THR HG2 . 10192 1 13 . 1 1 8 8 THR HG22 H 1 1.141 0.030 . 1 . . . . 8 THR HG2 . 10192 1 14 . 1 1 8 8 THR HG23 H 1 1.141 0.030 . 1 . . . . 8 THR HG2 . 10192 1 15 . 1 1 8 8 THR C C 13 175.300 0.300 . 1 . . . . 8 THR C . 10192 1 16 . 1 1 9 9 GLY N N 15 111.107 0.300 . 1 . . . . 9 GLY N . 10192 1 17 . 1 1 9 9 GLY H H 1 8.427 0.030 . 1 . . . . 9 GLY H . 10192 1 18 . 1 1 9 9 GLY CA C 13 45.215 0.300 . 1 . . . . 9 GLY CA . 10192 1 19 . 1 1 9 9 GLY HA2 H 1 3.908 0.030 . 1 . . . . 9 GLY HA2 . 10192 1 20 . 1 1 9 9 GLY HA3 H 1 3.908 0.030 . 1 . . . . 9 GLY HA3 . 10192 1 21 . 1 1 9 9 GLY C C 13 174.012 0.300 . 1 . . . . 9 GLY C . 10192 1 22 . 1 1 10 10 GLU N N 15 120.447 0.300 . 1 . . . . 10 GLU N . 10192 1 23 . 1 1 10 10 GLU H H 1 8.157 0.030 . 1 . . . . 10 GLU H . 10192 1 24 . 1 1 10 10 GLU CA C 13 56.427 0.300 . 1 . . . . 10 GLU CA . 10192 1 25 . 1 1 10 10 GLU HA H 1 4.192 0.030 . 1 . . . . 10 GLU HA . 10192 1 26 . 1 1 10 10 GLU CB C 13 30.579 0.300 . 1 . . . . 10 GLU CB . 10192 1 27 . 1 1 10 10 GLU HB2 H 1 1.933 0.030 . 2 . . . . 10 GLU HB2 . 10192 1 28 . 1 1 10 10 GLU HB3 H 1 1.823 0.030 . 2 . . . . 10 GLU HB3 . 10192 1 29 . 1 1 10 10 GLU CG C 13 36.272 0.300 . 1 . . . . 10 GLU CG . 10192 1 30 . 1 1 10 10 GLU HG2 H 1 2.213 0.030 . 2 . . . . 10 GLU HG2 . 10192 1 31 . 1 1 10 10 GLU HG3 H 1 2.165 0.030 . 2 . . . . 10 GLU HG3 . 10192 1 32 . 1 1 10 10 GLU C C 13 176.190 0.300 . 1 . . . . 10 GLU C . 10192 1 33 . 1 1 11 11 LYS N N 15 123.159 0.300 . 1 . . . . 11 LYS N . 10192 1 34 . 1 1 11 11 LYS H H 1 8.316 0.030 . 1 . . . . 11 LYS H . 10192 1 35 . 1 1 11 11 LYS CA C 13 54.101 0.300 . 1 . . . . 11 LYS CA . 10192 1 36 . 1 1 11 11 LYS HA H 1 4.442 0.030 . 1 . . . . 11 LYS HA . 10192 1 37 . 1 1 11 11 LYS CB C 13 32.610 0.300 . 1 . . . . 11 LYS CB . 10192 1 38 . 1 1 11 11 LYS HB2 H 1 1.530 0.030 . 1 . . . . 11 LYS HB2 . 10192 1 39 . 1 1 11 11 LYS HB3 H 1 1.530 0.030 . 1 . . . . 11 LYS HB3 . 10192 1 40 . 1 1 11 11 LYS CG C 13 24.771 0.300 . 1 . . . . 11 LYS CG . 10192 1 41 . 1 1 11 11 LYS HG2 H 1 1.311 0.030 . 2 . . . . 11 LYS HG2 . 10192 1 42 . 1 1 11 11 LYS HG3 H 1 1.232 0.030 . 2 . . . . 11 LYS HG3 . 10192 1 43 . 1 1 11 11 LYS CD C 13 29.292 0.300 . 1 . . . . 11 LYS CD . 10192 1 44 . 1 1 11 11 LYS HD2 H 1 1.526 0.030 . 1 . . . . 11 LYS HD2 . 10192 1 45 . 1 1 11 11 LYS HD3 H 1 1.526 0.030 . 1 . . . . 11 LYS HD3 . 10192 1 46 . 1 1 11 11 LYS CE C 13 42.003 0.300 . 1 . . . . 11 LYS CE . 10192 1 47 . 1 1 11 11 LYS HE2 H 1 2.866 0.030 . 1 . . . . 11 LYS HE2 . 10192 1 48 . 1 1 11 11 LYS HE3 H 1 2.866 0.030 . 1 . . . . 11 LYS HE3 . 10192 1 49 . 1 1 11 11 LYS C C 13 174.187 0.300 . 1 . . . . 11 LYS C . 10192 1 50 . 1 1 12 12 PRO CA C 13 63.210 0.300 . 1 . . . . 12 PRO CA . 10192 1 51 . 1 1 12 12 PRO HA H 1 4.407 0.030 . 1 . . . . 12 PRO HA . 10192 1 52 . 1 1 12 12 PRO CB C 13 32.232 0.300 . 1 . . . . 12 PRO CB . 10192 1 53 . 1 1 12 12 PRO HB2 H 1 1.421 0.030 . 2 . . . . 12 PRO HB2 . 10192 1 54 . 1 1 12 12 PRO HB3 H 1 1.993 0.030 . 2 . . . . 12 PRO HB3 . 10192 1 55 . 1 1 12 12 PRO CG C 13 27.070 0.300 . 1 . . . . 12 PRO CG . 10192 1 56 . 1 1 12 12 PRO HG2 H 1 1.818 0.030 . 2 . . . . 12 PRO HG2 . 10192 1 57 . 1 1 12 12 PRO HG3 H 1 1.749 0.030 . 2 . . . . 12 PRO HG3 . 10192 1 58 . 1 1 12 12 PRO CD C 13 50.402 0.300 . 1 . . . . 12 PRO CD . 10192 1 59 . 1 1 12 12 PRO HD2 H 1 3.646 0.030 . 2 . . . . 12 PRO HD2 . 10192 1 60 . 1 1 12 12 PRO HD3 H 1 3.517 0.030 . 2 . . . . 12 PRO HD3 . 10192 1 61 . 1 1 12 12 PRO C C 13 176.447 0.300 . 1 . . . . 12 PRO C . 10192 1 62 . 1 1 13 13 PHE N N 15 119.708 0.300 . 1 . . . . 13 PHE N . 10192 1 63 . 1 1 13 13 PHE H H 1 8.425 0.030 . 1 . . . . 13 PHE H . 10192 1 64 . 1 1 13 13 PHE CA C 13 57.386 0.300 . 1 . . . . 13 PHE CA . 10192 1 65 . 1 1 13 13 PHE HA H 1 4.561 0.030 . 1 . . . . 13 PHE HA . 10192 1 66 . 1 1 13 13 PHE CB C 13 40.677 0.300 . 1 . . . . 13 PHE CB . 10192 1 67 . 1 1 13 13 PHE HB2 H 1 2.943 0.030 . 2 . . . . 13 PHE HB2 . 10192 1 68 . 1 1 13 13 PHE HB3 H 1 2.802 0.030 . 2 . . . . 13 PHE HB3 . 10192 1 69 . 1 1 13 13 PHE CD1 C 13 131.553 0.300 . 1 . . . . 13 PHE CD1 . 10192 1 70 . 1 1 13 13 PHE HD1 H 1 7.135 0.030 . 1 . . . . 13 PHE HD1 . 10192 1 71 . 1 1 13 13 PHE CD2 C 13 131.553 0.300 . 1 . . . . 13 PHE CD2 . 10192 1 72 . 1 1 13 13 PHE HD2 H 1 7.135 0.030 . 1 . . . . 13 PHE HD2 . 10192 1 73 . 1 1 13 13 PHE CE1 C 13 131.504 0.300 . 1 . . . . 13 PHE CE1 . 10192 1 74 . 1 1 13 13 PHE HE1 H 1 7.347 0.030 . 1 . . . . 13 PHE HE1 . 10192 1 75 . 1 1 13 13 PHE CE2 C 13 131.504 0.300 . 1 . . . . 13 PHE CE2 . 10192 1 76 . 1 1 13 13 PHE HE2 H 1 7.347 0.030 . 1 . . . . 13 PHE HE2 . 10192 1 77 . 1 1 13 13 PHE CZ C 13 129.945 0.300 . 1 . . . . 13 PHE CZ . 10192 1 78 . 1 1 13 13 PHE HZ H 1 7.321 0.030 . 1 . . . . 13 PHE HZ . 10192 1 79 . 1 1 13 13 PHE C C 13 174.289 0.300 . 1 . . . . 13 PHE C . 10192 1 80 . 1 1 14 14 LYS N N 15 124.280 0.300 . 1 . . . . 14 LYS N . 10192 1 81 . 1 1 14 14 LYS H H 1 8.599 0.030 . 1 . . . . 14 LYS H . 10192 1 82 . 1 1 14 14 LYS CA C 13 55.128 0.300 . 1 . . . . 14 LYS CA . 10192 1 83 . 1 1 14 14 LYS HA H 1 4.876 0.030 . 1 . . . . 14 LYS HA . 10192 1 84 . 1 1 14 14 LYS CB C 13 35.217 0.300 . 1 . . . . 14 LYS CB . 10192 1 85 . 1 1 14 14 LYS HB2 H 1 1.580 0.030 . 2 . . . . 14 LYS HB2 . 10192 1 86 . 1 1 14 14 LYS HB3 H 1 1.503 0.030 . 2 . . . . 14 LYS HB3 . 10192 1 87 . 1 1 14 14 LYS CG C 13 24.546 0.300 . 1 . . . . 14 LYS CG . 10192 1 88 . 1 1 14 14 LYS HG2 H 1 1.094 0.030 . 1 . . . . 14 LYS HG2 . 10192 1 89 . 1 1 14 14 LYS HG3 H 1 1.094 0.030 . 1 . . . . 14 LYS HG3 . 10192 1 90 . 1 1 14 14 LYS CD C 13 29.330 0.300 . 1 . . . . 14 LYS CD . 10192 1 91 . 1 1 14 14 LYS HD2 H 1 1.512 0.030 . 1 . . . . 14 LYS HD2 . 10192 1 92 . 1 1 14 14 LYS HD3 H 1 1.512 0.030 . 1 . . . . 14 LYS HD3 . 10192 1 93 . 1 1 14 14 LYS CE C 13 41.875 0.300 . 1 . . . . 14 LYS CE . 10192 1 94 . 1 1 14 14 LYS HE2 H 1 2.868 0.030 . 1 . . . . 14 LYS HE2 . 10192 1 95 . 1 1 14 14 LYS HE3 H 1 2.868 0.030 . 1 . . . . 14 LYS HE3 . 10192 1 96 . 1 1 14 14 LYS C C 13 175.445 0.300 . 1 . . . . 14 LYS C . 10192 1 97 . 1 1 15 15 CYS N N 15 126.829 0.300 . 1 . . . . 15 CYS N . 10192 1 98 . 1 1 15 15 CYS H H 1 9.153 0.030 . 1 . . . . 15 CYS H . 10192 1 99 . 1 1 15 15 CYS CA C 13 59.229 0.300 . 1 . . . . 15 CYS CA . 10192 1 100 . 1 1 15 15 CYS HA H 1 4.498 0.030 . 1 . . . . 15 CYS HA . 10192 1 101 . 1 1 15 15 CYS CB C 13 29.719 0.300 . 1 . . . . 15 CYS CB . 10192 1 102 . 1 1 15 15 CYS HB2 H 1 2.816 0.030 . 2 . . . . 15 CYS HB2 . 10192 1 103 . 1 1 15 15 CYS HB3 H 1 3.344 0.030 . 2 . . . . 15 CYS HB3 . 10192 1 104 . 1 1 15 15 CYS C C 13 176.812 0.300 . 1 . . . . 15 CYS C . 10192 1 105 . 1 1 16 16 ASP N N 15 131.329 0.300 . 1 . . . . 16 ASP N . 10192 1 106 . 1 1 16 16 ASP H H 1 9.242 0.030 . 1 . . . . 16 ASP H . 10192 1 107 . 1 1 16 16 ASP CA C 13 56.451 0.300 . 1 . . . . 16 ASP CA . 10192 1 108 . 1 1 16 16 ASP HA H 1 4.402 0.030 . 1 . . . . 16 ASP HA . 10192 1 109 . 1 1 16 16 ASP CB C 13 40.727 0.300 . 1 . . . . 16 ASP CB . 10192 1 110 . 1 1 16 16 ASP HB2 H 1 2.696 0.030 . 2 . . . . 16 ASP HB2 . 10192 1 111 . 1 1 16 16 ASP HB3 H 1 2.633 0.030 . 2 . . . . 16 ASP HB3 . 10192 1 112 . 1 1 16 16 ASP C C 13 176.032 0.300 . 1 . . . . 16 ASP C . 10192 1 113 . 1 1 17 17 ILE N N 15 121.275 0.300 . 1 . . . . 17 ILE N . 10192 1 114 . 1 1 17 17 ILE H H 1 8.635 0.030 . 1 . . . . 17 ILE H . 10192 1 115 . 1 1 17 17 ILE CA C 13 63.212 0.300 . 1 . . . . 17 ILE CA . 10192 1 116 . 1 1 17 17 ILE HA H 1 3.821 0.030 . 1 . . . . 17 ILE HA . 10192 1 117 . 1 1 17 17 ILE CB C 13 38.137 0.300 . 1 . . . . 17 ILE CB . 10192 1 118 . 1 1 17 17 ILE HB H 1 1.033 0.030 . 1 . . . . 17 ILE HB . 10192 1 119 . 1 1 17 17 ILE CG1 C 13 27.850 0.300 . 1 . . . . 17 ILE CG1 . 10192 1 120 . 1 1 17 17 ILE HG12 H 1 1.035 0.030 . 2 . . . . 17 ILE HG12 . 10192 1 121 . 1 1 17 17 ILE HG13 H 1 1.318 0.030 . 2 . . . . 17 ILE HG13 . 10192 1 122 . 1 1 17 17 ILE CG2 C 13 16.303 0.300 . 1 . . . . 17 ILE CG2 . 10192 1 123 . 1 1 17 17 ILE HG21 H 1 0.237 0.030 . 1 . . . . 17 ILE HG2 . 10192 1 124 . 1 1 17 17 ILE HG22 H 1 0.237 0.030 . 1 . . . . 17 ILE HG2 . 10192 1 125 . 1 1 17 17 ILE HG23 H 1 0.237 0.030 . 1 . . . . 17 ILE HG2 . 10192 1 126 . 1 1 17 17 ILE CD1 C 13 11.836 0.300 . 1 . . . . 17 ILE CD1 . 10192 1 127 . 1 1 17 17 ILE HD11 H 1 0.608 0.030 . 1 . . . . 17 ILE HD1 . 10192 1 128 . 1 1 17 17 ILE HD12 H 1 0.608 0.030 . 1 . . . . 17 ILE HD1 . 10192 1 129 . 1 1 17 17 ILE HD13 H 1 0.608 0.030 . 1 . . . . 17 ILE HD1 . 10192 1 130 . 1 1 17 17 ILE C C 13 177.086 0.300 . 1 . . . . 17 ILE C . 10192 1 131 . 1 1 18 18 CYS N N 15 115.895 0.300 . 1 . . . . 18 CYS N . 10192 1 132 . 1 1 18 18 CYS H H 1 8.067 0.030 . 1 . . . . 18 CYS H . 10192 1 133 . 1 1 18 18 CYS CA C 13 58.167 0.300 . 1 . . . . 18 CYS CA . 10192 1 134 . 1 1 18 18 CYS HA H 1 5.107 0.030 . 1 . . . . 18 CYS HA . 10192 1 135 . 1 1 18 18 CYS CB C 13 32.381 0.300 . 1 . . . . 18 CYS CB . 10192 1 136 . 1 1 18 18 CYS HB2 H 1 2.847 0.030 . 2 . . . . 18 CYS HB2 . 10192 1 137 . 1 1 18 18 CYS HB3 H 1 3.424 0.030 . 2 . . . . 18 CYS HB3 . 10192 1 138 . 1 1 18 18 CYS C C 13 176.599 0.300 . 1 . . . . 18 CYS C . 10192 1 139 . 1 1 19 19 GLY N N 15 113.203 0.300 . 1 . . . . 19 GLY N . 10192 1 140 . 1 1 19 19 GLY H H 1 8.004 0.030 . 1 . . . . 19 GLY H . 10192 1 141 . 1 1 19 19 GLY CA C 13 46.439 0.300 . 1 . . . . 19 GLY CA . 10192 1 142 . 1 1 19 19 GLY HA2 H 1 3.769 0.030 . 2 . . . . 19 GLY HA2 . 10192 1 143 . 1 1 19 19 GLY HA3 H 1 4.167 0.030 . 2 . . . . 19 GLY HA3 . 10192 1 144 . 1 1 19 19 GLY C C 13 173.734 0.300 . 1 . . . . 19 GLY C . 10192 1 145 . 1 1 20 20 LYS N N 15 122.356 0.300 . 1 . . . . 20 LYS N . 10192 1 146 . 1 1 20 20 LYS H H 1 7.822 0.030 . 1 . . . . 20 LYS H . 10192 1 147 . 1 1 20 20 LYS CA C 13 57.737 0.300 . 1 . . . . 20 LYS CA . 10192 1 148 . 1 1 20 20 LYS HA H 1 4.045 0.030 . 1 . . . . 20 LYS HA . 10192 1 149 . 1 1 20 20 LYS CB C 13 33.982 0.300 . 1 . . . . 20 LYS CB . 10192 1 150 . 1 1 20 20 LYS HB2 H 1 1.381 0.030 . 2 . . . . 20 LYS HB2 . 10192 1 151 . 1 1 20 20 LYS HB3 H 1 1.318 0.030 . 2 . . . . 20 LYS HB3 . 10192 1 152 . 1 1 20 20 LYS CG C 13 29.334 0.300 . 1 . . . . 20 LYS CG . 10192 1 153 . 1 1 20 20 LYS HG2 H 1 1.532 0.030 . 1 . . . . 20 LYS HG2 . 10192 1 154 . 1 1 20 20 LYS HG3 H 1 1.532 0.030 . 1 . . . . 20 LYS HG3 . 10192 1 155 . 1 1 20 20 LYS CD C 13 26.448 0.300 . 1 . . . . 20 LYS CD . 10192 1 156 . 1 1 20 20 LYS HD2 H 1 1.529 0.030 . 2 . . . . 20 LYS HD2 . 10192 1 157 . 1 1 20 20 LYS HD3 H 1 1.188 0.030 . 2 . . . . 20 LYS HD3 . 10192 1 158 . 1 1 20 20 LYS CE C 13 42.321 0.300 . 1 . . . . 20 LYS CE . 10192 1 159 . 1 1 20 20 LYS HE2 H 1 2.954 0.030 . 1 . . . . 20 LYS HE2 . 10192 1 160 . 1 1 20 20 LYS HE3 H 1 2.954 0.030 . 1 . . . . 20 LYS HE3 . 10192 1 161 . 1 1 20 20 LYS C C 13 174.356 0.300 . 1 . . . . 20 LYS C . 10192 1 162 . 1 1 21 21 SER N N 15 114.802 0.300 . 1 . . . . 21 SER N . 10192 1 163 . 1 1 21 21 SER H H 1 7.870 0.030 . 1 . . . . 21 SER H . 10192 1 164 . 1 1 21 21 SER CA C 13 57.281 0.300 . 1 . . . . 21 SER CA . 10192 1 165 . 1 1 21 21 SER HA H 1 5.187 0.030 . 1 . . . . 21 SER HA . 10192 1 166 . 1 1 21 21 SER CB C 13 65.661 0.300 . 1 . . . . 21 SER CB . 10192 1 167 . 1 1 21 21 SER HB2 H 1 3.489 0.030 . 1 . . . . 21 SER HB2 . 10192 1 168 . 1 1 21 21 SER HB3 H 1 3.489 0.030 . 1 . . . . 21 SER HB3 . 10192 1 169 . 1 1 21 21 SER C C 13 173.041 0.300 . 1 . . . . 21 SER C . 10192 1 170 . 1 1 22 22 PHE N N 15 118.519 0.300 . 1 . . . . 22 PHE N . 10192 1 171 . 1 1 22 22 PHE H H 1 8.795 0.030 . 1 . . . . 22 PHE H . 10192 1 172 . 1 1 22 22 PHE CA C 13 58.014 0.300 . 1 . . . . 22 PHE CA . 10192 1 173 . 1 1 22 22 PHE HA H 1 3.364 0.030 . 1 . . . . 22 PHE HA . 10192 1 174 . 1 1 22 22 PHE CB C 13 44.178 0.300 . 1 . . . . 22 PHE CB . 10192 1 175 . 1 1 22 22 PHE HB2 H 1 2.548 0.030 . 2 . . . . 22 PHE HB2 . 10192 1 176 . 1 1 22 22 PHE HB3 H 1 3.031 0.030 . 2 . . . . 22 PHE HB3 . 10192 1 177 . 1 1 22 22 PHE CD1 C 13 131.891 0.300 . 1 . . . . 22 PHE CD1 . 10192 1 178 . 1 1 22 22 PHE HD1 H 1 7.077 0.030 . 1 . . . . 22 PHE HD1 . 10192 1 179 . 1 1 22 22 PHE CD2 C 13 131.891 0.300 . 1 . . . . 22 PHE CD2 . 10192 1 180 . 1 1 22 22 PHE HD2 H 1 7.077 0.030 . 1 . . . . 22 PHE HD2 . 10192 1 181 . 1 1 22 22 PHE CE1 C 13 130.750 0.300 . 1 . . . . 22 PHE CE1 . 10192 1 182 . 1 1 22 22 PHE HE1 H 1 6.701 0.030 . 1 . . . . 22 PHE HE1 . 10192 1 183 . 1 1 22 22 PHE CE2 C 13 130.750 0.300 . 1 . . . . 22 PHE CE2 . 10192 1 184 . 1 1 22 22 PHE HE2 H 1 6.701 0.030 . 1 . . . . 22 PHE HE2 . 10192 1 185 . 1 1 22 22 PHE CZ C 13 128.723 0.300 . 1 . . . . 22 PHE CZ . 10192 1 186 . 1 1 22 22 PHE HZ H 1 6.133 0.030 . 1 . . . . 22 PHE HZ . 10192 1 187 . 1 1 22 22 PHE C C 13 175.163 0.300 . 1 . . . . 22 PHE C . 10192 1 188 . 1 1 23 23 CYS CA C 13 59.537 0.300 . 1 . . . . 23 CYS CA . 10192 1 189 . 1 1 23 23 CYS HA H 1 4.584 0.030 . 1 . . . . 23 CYS HA . 10192 1 190 . 1 1 23 23 CYS CB C 13 27.668 0.300 . 1 . . . . 23 CYS CB . 10192 1 191 . 1 1 23 23 CYS HB2 H 1 3.001 0.030 . 2 . . . . 23 CYS HB2 . 10192 1 192 . 1 1 23 23 CYS HB3 H 1 2.946 0.030 . 2 . . . . 23 CYS HB3 . 10192 1 193 . 1 1 23 23 CYS C C 13 174.498 0.300 . 1 . . . . 23 CYS C . 10192 1 194 . 1 1 24 24 GLY N N 15 110.238 0.300 . 1 . . . . 24 GLY N . 10192 1 195 . 1 1 24 24 GLY H H 1 7.698 0.030 . 1 . . . . 24 GLY H . 10192 1 196 . 1 1 24 24 GLY CA C 13 44.739 0.300 . 1 . . . . 24 GLY CA . 10192 1 197 . 1 1 24 24 GLY HA2 H 1 4.165 0.030 . 2 . . . . 24 GLY HA2 . 10192 1 198 . 1 1 24 24 GLY HA3 H 1 3.964 0.030 . 2 . . . . 24 GLY HA3 . 10192 1 199 . 1 1 24 24 GLY C C 13 172.746 0.300 . 1 . . . . 24 GLY C . 10192 1 200 . 1 1 25 25 ARG N N 15 123.007 0.300 . 1 . . . . 25 ARG N . 10192 1 201 . 1 1 25 25 ARG H H 1 8.249 0.030 . 1 . . . . 25 ARG H . 10192 1 202 . 1 1 25 25 ARG CA C 13 58.734 0.300 . 1 . . . . 25 ARG CA . 10192 1 203 . 1 1 25 25 ARG HA H 1 3.118 0.030 . 1 . . . . 25 ARG HA . 10192 1 204 . 1 1 25 25 ARG CB C 13 29.705 0.300 . 1 . . . . 25 ARG CB . 10192 1 205 . 1 1 25 25 ARG HB2 H 1 1.478 0.030 . 2 . . . . 25 ARG HB2 . 10192 1 206 . 1 1 25 25 ARG HB3 H 1 1.347 0.030 . 2 . . . . 25 ARG HB3 . 10192 1 207 . 1 1 25 25 ARG CG C 13 26.908 0.300 . 1 . . . . 25 ARG CG . 10192 1 208 . 1 1 25 25 ARG HG2 H 1 1.324 0.030 . 2 . . . . 25 ARG HG2 . 10192 1 209 . 1 1 25 25 ARG HG3 H 1 1.259 0.030 . 2 . . . . 25 ARG HG3 . 10192 1 210 . 1 1 25 25 ARG CD C 13 42.678 0.300 . 1 . . . . 25 ARG CD . 10192 1 211 . 1 1 25 25 ARG HD2 H 1 3.044 0.030 . 2 . . . . 25 ARG HD2 . 10192 1 212 . 1 1 25 25 ARG HD3 H 1 2.982 0.030 . 2 . . . . 25 ARG HD3 . 10192 1 213 . 1 1 25 25 ARG C C 13 178.108 0.300 . 1 . . . . 25 ARG C . 10192 1 214 . 1 1 26 26 SER CA C 13 61.773 0.300 . 1 . . . . 26 SER CA . 10192 1 215 . 1 1 26 26 SER HA H 1 3.836 0.030 . 1 . . . . 26 SER HA . 10192 1 216 . 1 1 26 26 SER CB C 13 61.872 0.300 . 1 . . . . 26 SER CB . 10192 1 217 . 1 1 26 26 SER HB2 H 1 3.829 0.030 . 1 . . . . 26 SER HB2 . 10192 1 218 . 1 1 26 26 SER HB3 H 1 3.829 0.030 . 1 . . . . 26 SER HB3 . 10192 1 219 . 1 1 26 26 SER C C 13 177.394 0.300 . 1 . . . . 26 SER C . 10192 1 220 . 1 1 27 27 ARG N N 15 121.358 0.300 . 1 . . . . 27 ARG N . 10192 1 221 . 1 1 27 27 ARG H H 1 7.581 0.030 . 1 . . . . 27 ARG H . 10192 1 222 . 1 1 27 27 ARG CA C 13 58.837 0.300 . 1 . . . . 27 ARG CA . 10192 1 223 . 1 1 27 27 ARG HA H 1 3.924 0.030 . 1 . . . . 27 ARG HA . 10192 1 224 . 1 1 27 27 ARG CB C 13 29.724 0.300 . 1 . . . . 27 ARG CB . 10192 1 225 . 1 1 27 27 ARG HB2 H 1 1.820 0.030 . 1 . . . . 27 ARG HB2 . 10192 1 226 . 1 1 27 27 ARG HB3 H 1 1.820 0.030 . 1 . . . . 27 ARG HB3 . 10192 1 227 . 1 1 27 27 ARG CG C 13 28.630 0.300 . 1 . . . . 27 ARG CG . 10192 1 228 . 1 1 27 27 ARG HG2 H 1 1.783 0.030 . 2 . . . . 27 ARG HG2 . 10192 1 229 . 1 1 27 27 ARG HG3 H 1 1.704 0.030 . 2 . . . . 27 ARG HG3 . 10192 1 230 . 1 1 27 27 ARG CD C 13 43.283 0.300 . 1 . . . . 27 ARG CD . 10192 1 231 . 1 1 27 27 ARG HD2 H 1 3.339 0.030 . 1 . . . . 27 ARG HD2 . 10192 1 232 . 1 1 27 27 ARG HD3 H 1 3.339 0.030 . 1 . . . . 27 ARG HD3 . 10192 1 233 . 1 1 27 27 ARG C C 13 179.126 0.300 . 1 . . . . 27 ARG C . 10192 1 234 . 1 1 28 28 LEU N N 15 121.828 0.300 . 1 . . . . 28 LEU N . 10192 1 235 . 1 1 28 28 LEU H H 1 7.259 0.030 . 1 . . . . 28 LEU H . 10192 1 236 . 1 1 28 28 LEU CA C 13 57.978 0.300 . 1 . . . . 28 LEU CA . 10192 1 237 . 1 1 28 28 LEU HA H 1 3.366 0.030 . 1 . . . . 28 LEU HA . 10192 1 238 . 1 1 28 28 LEU CB C 13 40.695 0.300 . 1 . . . . 28 LEU CB . 10192 1 239 . 1 1 28 28 LEU HB2 H 1 1.271 0.030 . 2 . . . . 28 LEU HB2 . 10192 1 240 . 1 1 28 28 LEU HB3 H 1 1.829 0.030 . 2 . . . . 28 LEU HB3 . 10192 1 241 . 1 1 28 28 LEU CG C 13 27.257 0.300 . 1 . . . . 28 LEU CG . 10192 1 242 . 1 1 28 28 LEU HG H 1 1.571 0.030 . 1 . . . . 28 LEU HG . 10192 1 243 . 1 1 28 28 LEU CD1 C 13 22.499 0.300 . 2 . . . . 28 LEU CD1 . 10192 1 244 . 1 1 28 28 LEU HD11 H 1 0.903 0.030 . 1 . . . . 28 LEU HD1 . 10192 1 245 . 1 1 28 28 LEU HD12 H 1 0.903 0.030 . 1 . . . . 28 LEU HD1 . 10192 1 246 . 1 1 28 28 LEU HD13 H 1 0.903 0.030 . 1 . . . . 28 LEU HD1 . 10192 1 247 . 1 1 28 28 LEU CD2 C 13 26.381 0.300 . 2 . . . . 28 LEU CD2 . 10192 1 248 . 1 1 28 28 LEU HD21 H 1 0.920 0.030 . 1 . . . . 28 LEU HD2 . 10192 1 249 . 1 1 28 28 LEU HD22 H 1 0.920 0.030 . 1 . . . . 28 LEU HD2 . 10192 1 250 . 1 1 28 28 LEU HD23 H 1 0.920 0.030 . 1 . . . . 28 LEU HD2 . 10192 1 251 . 1 1 28 28 LEU C C 13 177.702 0.300 . 1 . . . . 28 LEU C . 10192 1 252 . 1 1 29 29 ASN N N 15 118.482 0.300 . 1 . . . . 29 ASN N . 10192 1 253 . 1 1 29 29 ASN H H 1 8.579 0.030 . 1 . . . . 29 ASN H . 10192 1 254 . 1 1 29 29 ASN CA C 13 56.000 0.300 . 1 . . . . 29 ASN CA . 10192 1 255 . 1 1 29 29 ASN HA H 1 4.264 0.030 . 1 . . . . 29 ASN HA . 10192 1 256 . 1 1 29 29 ASN CB C 13 37.394 0.300 . 1 . . . . 29 ASN CB . 10192 1 257 . 1 1 29 29 ASN HB2 H 1 2.781 0.030 . 2 . . . . 29 ASN HB2 . 10192 1 258 . 1 1 29 29 ASN HB3 H 1 2.741 0.030 . 2 . . . . 29 ASN HB3 . 10192 1 259 . 1 1 29 29 ASN ND2 N 15 110.559 0.300 . 1 . . . . 29 ASN ND2 . 10192 1 260 . 1 1 29 29 ASN HD21 H 1 7.550 0.030 . 2 . . . . 29 ASN HD21 . 10192 1 261 . 1 1 29 29 ASN HD22 H 1 6.717 0.030 . 2 . . . . 29 ASN HD22 . 10192 1 262 . 1 1 29 29 ASN C C 13 178.386 0.300 . 1 . . . . 29 ASN C . 10192 1 263 . 1 1 30 30 ARG N N 15 119.681 0.300 . 1 . . . . 30 ARG N . 10192 1 264 . 1 1 30 30 ARG H H 1 7.752 0.030 . 1 . . . . 30 ARG H . 10192 1 265 . 1 1 30 30 ARG CA C 13 58.915 0.300 . 1 . . . . 30 ARG CA . 10192 1 266 . 1 1 30 30 ARG HA H 1 4.000 0.030 . 1 . . . . 30 ARG HA . 10192 1 267 . 1 1 30 30 ARG CB C 13 29.883 0.300 . 1 . . . . 30 ARG CB . 10192 1 268 . 1 1 30 30 ARG HB2 H 1 1.773 0.030 . 1 . . . . 30 ARG HB2 . 10192 1 269 . 1 1 30 30 ARG HB3 H 1 1.773 0.030 . 1 . . . . 30 ARG HB3 . 10192 1 270 . 1 1 30 30 ARG CG C 13 27.199 0.300 . 1 . . . . 30 ARG CG . 10192 1 271 . 1 1 30 30 ARG HG2 H 1 1.662 0.030 . 2 . . . . 30 ARG HG2 . 10192 1 272 . 1 1 30 30 ARG HG3 H 1 1.578 0.030 . 2 . . . . 30 ARG HG3 . 10192 1 273 . 1 1 30 30 ARG CD C 13 43.141 0.300 . 1 . . . . 30 ARG CD . 10192 1 274 . 1 1 30 30 ARG HD2 H 1 3.137 0.030 . 1 . . . . 30 ARG HD2 . 10192 1 275 . 1 1 30 30 ARG HD3 H 1 3.137 0.030 . 1 . . . . 30 ARG HD3 . 10192 1 276 . 1 1 30 30 ARG C C 13 178.773 0.300 . 1 . . . . 30 ARG C . 10192 1 277 . 1 1 31 31 HIS N N 15 119.307 0.300 . 1 . . . . 31 HIS N . 10192 1 278 . 1 1 31 31 HIS H H 1 7.577 0.030 . 1 . . . . 31 HIS H . 10192 1 279 . 1 1 31 31 HIS CA C 13 58.939 0.300 . 1 . . . . 31 HIS CA . 10192 1 280 . 1 1 31 31 HIS HA H 1 4.111 0.030 . 1 . . . . 31 HIS HA . 10192 1 281 . 1 1 31 31 HIS CB C 13 27.639 0.300 . 1 . . . . 31 HIS CB . 10192 1 282 . 1 1 31 31 HIS HB2 H 1 2.474 0.030 . 2 . . . . 31 HIS HB2 . 10192 1 283 . 1 1 31 31 HIS HB3 H 1 2.942 0.030 . 2 . . . . 31 HIS HB3 . 10192 1 284 . 1 1 31 31 HIS CD2 C 13 126.950 0.300 . 1 . . . . 31 HIS CD2 . 10192 1 285 . 1 1 31 31 HIS HD2 H 1 6.718 0.030 . 1 . . . . 31 HIS HD2 . 10192 1 286 . 1 1 31 31 HIS CE1 C 13 139.467 0.300 . 1 . . . . 31 HIS CE1 . 10192 1 287 . 1 1 31 31 HIS HE1 H 1 7.980 0.030 . 1 . . . . 31 HIS HE1 . 10192 1 288 . 1 1 31 31 HIS C C 13 176.358 0.300 . 1 . . . . 31 HIS C . 10192 1 289 . 1 1 32 32 SER N N 15 113.043 0.300 . 1 . . . . 32 SER N . 10192 1 290 . 1 1 32 32 SER H H 1 8.442 0.030 . 1 . . . . 32 SER H . 10192 1 291 . 1 1 32 32 SER CA C 13 62.184 0.300 . 1 . . . . 32 SER CA . 10192 1 292 . 1 1 32 32 SER HA H 1 3.814 0.030 . 1 . . . . 32 SER HA . 10192 1 293 . 1 1 32 32 SER CB C 13 63.027 0.300 . 1 . . . . 32 SER CB . 10192 1 294 . 1 1 32 32 SER HB2 H 1 4.006 0.030 . 2 . . . . 32 SER HB2 . 10192 1 295 . 1 1 32 32 SER HB3 H 1 3.964 0.030 . 2 . . . . 32 SER HB3 . 10192 1 296 . 1 1 32 32 SER C C 13 175.520 0.300 . 1 . . . . 32 SER C . 10192 1 297 . 1 1 33 33 MET N N 15 118.839 0.300 . 1 . . . . 33 MET N . 10192 1 298 . 1 1 33 33 MET H H 1 7.002 0.030 . 1 . . . . 33 MET H . 10192 1 299 . 1 1 33 33 MET CA C 13 57.473 0.300 . 1 . . . . 33 MET CA . 10192 1 300 . 1 1 33 33 MET HA H 1 4.176 0.030 . 1 . . . . 33 MET HA . 10192 1 301 . 1 1 33 33 MET CB C 13 32.277 0.300 . 1 . . . . 33 MET CB . 10192 1 302 . 1 1 33 33 MET HB2 H 1 2.055 0.030 . 2 . . . . 33 MET HB2 . 10192 1 303 . 1 1 33 33 MET HB3 H 1 1.970 0.030 . 2 . . . . 33 MET HB3 . 10192 1 304 . 1 1 33 33 MET CG C 13 31.915 0.300 . 1 . . . . 33 MET CG . 10192 1 305 . 1 1 33 33 MET HG2 H 1 2.675 0.030 . 2 . . . . 33 MET HG2 . 10192 1 306 . 1 1 33 33 MET HG3 H 1 2.528 0.030 . 2 . . . . 33 MET HG3 . 10192 1 307 . 1 1 33 33 MET CE C 13 16.833 0.300 . 1 . . . . 33 MET CE . 10192 1 308 . 1 1 33 33 MET HE1 H 1 2.009 0.030 . 1 . . . . 33 MET HE . 10192 1 309 . 1 1 33 33 MET HE2 H 1 2.009 0.030 . 1 . . . . 33 MET HE . 10192 1 310 . 1 1 33 33 MET HE3 H 1 2.009 0.030 . 1 . . . . 33 MET HE . 10192 1 311 . 1 1 33 33 MET C C 13 178.211 0.300 . 1 . . . . 33 MET C . 10192 1 312 . 1 1 34 34 VAL N N 15 116.464 0.300 . 1 . . . . 34 VAL N . 10192 1 313 . 1 1 34 34 VAL H H 1 7.961 0.030 . 1 . . . . 34 VAL H . 10192 1 314 . 1 1 34 34 VAL CA C 13 63.927 0.300 . 1 . . . . 34 VAL CA . 10192 1 315 . 1 1 34 34 VAL HA H 1 3.845 0.030 . 1 . . . . 34 VAL HA . 10192 1 316 . 1 1 34 34 VAL CB C 13 30.987 0.300 . 1 . . . . 34 VAL CB . 10192 1 317 . 1 1 34 34 VAL HB H 1 1.838 0.030 . 1 . . . . 34 VAL HB . 10192 1 318 . 1 1 34 34 VAL CG1 C 13 19.769 0.300 . 2 . . . . 34 VAL CG1 . 10192 1 319 . 1 1 34 34 VAL HG11 H 1 0.569 0.030 . 1 . . . . 34 VAL HG1 . 10192 1 320 . 1 1 34 34 VAL HG12 H 1 0.569 0.030 . 1 . . . . 34 VAL HG1 . 10192 1 321 . 1 1 34 34 VAL HG13 H 1 0.569 0.030 . 1 . . . . 34 VAL HG1 . 10192 1 322 . 1 1 34 34 VAL CG2 C 13 19.442 0.300 . 2 . . . . 34 VAL CG2 . 10192 1 323 . 1 1 34 34 VAL HG21 H 1 0.409 0.030 . 1 . . . . 34 VAL HG2 . 10192 1 324 . 1 1 34 34 VAL HG22 H 1 0.409 0.030 . 1 . . . . 34 VAL HG2 . 10192 1 325 . 1 1 34 34 VAL HG23 H 1 0.409 0.030 . 1 . . . . 34 VAL HG2 . 10192 1 326 . 1 1 34 34 VAL C C 13 177.249 0.300 . 1 . . . . 34 VAL C . 10192 1 327 . 1 1 35 35 HIS N N 15 116.579 0.300 . 1 . . . . 35 HIS N . 10192 1 328 . 1 1 35 35 HIS H H 1 7.050 0.030 . 1 . . . . 35 HIS H . 10192 1 329 . 1 1 35 35 HIS CA C 13 55.032 0.300 . 1 . . . . 35 HIS CA . 10192 1 330 . 1 1 35 35 HIS HA H 1 4.866 0.030 . 1 . . . . 35 HIS HA . 10192 1 331 . 1 1 35 35 HIS CB C 13 28.597 0.300 . 1 . . . . 35 HIS CB . 10192 1 332 . 1 1 35 35 HIS HB2 H 1 3.286 0.030 . 2 . . . . 35 HIS HB2 . 10192 1 333 . 1 1 35 35 HIS HB3 H 1 3.168 0.030 . 2 . . . . 35 HIS HB3 . 10192 1 334 . 1 1 35 35 HIS CD2 C 13 127.796 0.300 . 1 . . . . 35 HIS CD2 . 10192 1 335 . 1 1 35 35 HIS HD2 H 1 6.679 0.030 . 1 . . . . 35 HIS HD2 . 10192 1 336 . 1 1 35 35 HIS CE1 C 13 140.135 0.300 . 1 . . . . 35 HIS CE1 . 10192 1 337 . 1 1 35 35 HIS HE1 H 1 8.038 0.030 . 1 . . . . 35 HIS HE1 . 10192 1 338 . 1 1 35 35 HIS C C 13 175.442 0.300 . 1 . . . . 35 HIS C . 10192 1 339 . 1 1 36 36 THR N N 15 113.320 0.300 . 1 . . . . 36 THR N . 10192 1 340 . 1 1 36 36 THR H H 1 7.617 0.030 . 1 . . . . 36 THR H . 10192 1 341 . 1 1 36 36 THR CA C 13 62.572 0.300 . 1 . . . . 36 THR CA . 10192 1 342 . 1 1 36 36 THR HA H 1 4.228 0.030 . 1 . . . . 36 THR HA . 10192 1 343 . 1 1 36 36 THR CB C 13 69.623 0.300 . 1 . . . . 36 THR CB . 10192 1 344 . 1 1 36 36 THR HB H 1 4.203 0.030 . 1 . . . . 36 THR HB . 10192 1 345 . 1 1 36 36 THR CG2 C 13 21.600 0.300 . 1 . . . . 36 THR CG2 . 10192 1 346 . 1 1 36 36 THR HG21 H 1 1.164 0.030 . 1 . . . . 36 THR HG2 . 10192 1 347 . 1 1 36 36 THR HG22 H 1 1.164 0.030 . 1 . . . . 36 THR HG2 . 10192 1 348 . 1 1 36 36 THR HG23 H 1 1.164 0.030 . 1 . . . . 36 THR HG2 . 10192 1 349 . 1 1 36 36 THR C C 13 174.335 0.300 . 1 . . . . 36 THR C . 10192 1 350 . 1 1 37 37 ALA N N 15 125.356 0.300 . 1 . . . . 37 ALA N . 10192 1 351 . 1 1 37 37 ALA H H 1 8.086 0.030 . 1 . . . . 37 ALA H . 10192 1 352 . 1 1 37 37 ALA CA C 13 52.577 0.300 . 1 . . . . 37 ALA CA . 10192 1 353 . 1 1 37 37 ALA HA H 1 4.279 0.030 . 1 . . . . 37 ALA HA . 10192 1 354 . 1 1 37 37 ALA CB C 13 19.131 0.300 . 1 . . . . 37 ALA CB . 10192 1 355 . 1 1 37 37 ALA HB1 H 1 1.341 0.030 . 1 . . . . 37 ALA HB . 10192 1 356 . 1 1 37 37 ALA HB2 H 1 1.341 0.030 . 1 . . . . 37 ALA HB . 10192 1 357 . 1 1 37 37 ALA HB3 H 1 1.341 0.030 . 1 . . . . 37 ALA HB . 10192 1 358 . 1 1 37 37 ALA C C 13 177.556 0.300 . 1 . . . . 37 ALA C . 10192 1 359 . 1 1 38 38 GLU N N 15 119.877 0.300 . 1 . . . . 38 GLU N . 10192 1 360 . 1 1 38 38 GLU H H 1 8.105 0.030 . 1 . . . . 38 GLU H . 10192 1 361 . 1 1 38 38 GLU CA C 13 56.451 0.300 . 1 . . . . 38 GLU CA . 10192 1 362 . 1 1 38 38 GLU HA H 1 4.163 0.030 . 1 . . . . 38 GLU HA . 10192 1 363 . 1 1 38 38 GLU CB C 13 30.357 0.300 . 1 . . . . 38 GLU CB . 10192 1 364 . 1 1 38 38 GLU HB2 H 1 1.949 0.030 . 2 . . . . 38 GLU HB2 . 10192 1 365 . 1 1 38 38 GLU HB3 H 1 1.896 0.030 . 2 . . . . 38 GLU HB3 . 10192 1 366 . 1 1 38 38 GLU CG C 13 36.314 0.300 . 1 . . . . 38 GLU CG . 10192 1 367 . 1 1 38 38 GLU HG2 H 1 2.246 0.030 . 2 . . . . 38 GLU HG2 . 10192 1 368 . 1 1 38 38 GLU HG3 H 1 2.186 0.030 . 2 . . . . 38 GLU HG3 . 10192 1 369 . 1 1 38 38 GLU C C 13 176.160 0.300 . 1 . . . . 38 GLU C . 10192 1 370 . 1 1 39 39 LYS N N 15 123.534 0.300 . 1 . . . . 39 LYS N . 10192 1 371 . 1 1 39 39 LYS H H 1 8.259 0.030 . 1 . . . . 39 LYS H . 10192 1 372 . 1 1 39 39 LYS CA C 13 54.110 0.300 . 1 . . . . 39 LYS CA . 10192 1 373 . 1 1 39 39 LYS HA H 1 4.547 0.030 . 1 . . . . 39 LYS HA . 10192 1 374 . 1 1 39 39 LYS CB C 13 32.486 0.300 . 1 . . . . 39 LYS CB . 10192 1 375 . 1 1 39 39 LYS HB2 H 1 1.758 0.030 . 2 . . . . 39 LYS HB2 . 10192 1 376 . 1 1 39 39 LYS HB3 H 1 1.672 0.030 . 2 . . . . 39 LYS HB3 . 10192 1 377 . 1 1 39 39 LYS CG C 13 24.441 0.300 . 1 . . . . 39 LYS CG . 10192 1 378 . 1 1 39 39 LYS HG2 H 1 1.401 0.030 . 1 . . . . 39 LYS HG2 . 10192 1 379 . 1 1 39 39 LYS HG3 H 1 1.401 0.030 . 1 . . . . 39 LYS HG3 . 10192 1 380 . 1 1 39 39 LYS CD C 13 29.134 0.300 . 1 . . . . 39 LYS CD . 10192 1 381 . 1 1 39 39 LYS HD2 H 1 1.640 0.030 . 1 . . . . 39 LYS HD2 . 10192 1 382 . 1 1 39 39 LYS HD3 H 1 1.640 0.030 . 1 . . . . 39 LYS HD3 . 10192 1 383 . 1 1 39 39 LYS CE C 13 42.152 0.300 . 1 . . . . 39 LYS CE . 10192 1 384 . 1 1 39 39 LYS HE2 H 1 2.944 0.030 . 1 . . . . 39 LYS HE2 . 10192 1 385 . 1 1 39 39 LYS HE3 H 1 2.944 0.030 . 1 . . . . 39 LYS HE3 . 10192 1 386 . 1 1 39 39 LYS C C 13 174.387 0.300 . 1 . . . . 39 LYS C . 10192 1 387 . 1 1 40 40 PRO CA C 13 63.170 0.300 . 1 . . . . 40 PRO CA . 10192 1 388 . 1 1 40 40 PRO HA H 1 4.405 0.030 . 1 . . . . 40 PRO HA . 10192 1 389 . 1 1 40 40 PRO CB C 13 32.153 0.300 . 1 . . . . 40 PRO CB . 10192 1 390 . 1 1 40 40 PRO HB2 H 1 2.247 0.030 . 2 . . . . 40 PRO HB2 . 10192 1 391 . 1 1 40 40 PRO HB3 H 1 1.881 0.030 . 2 . . . . 40 PRO HB3 . 10192 1 392 . 1 1 40 40 PRO CG C 13 27.480 0.300 . 1 . . . . 40 PRO CG . 10192 1 393 . 1 1 40 40 PRO HG2 H 1 1.958 0.030 . 1 . . . . 40 PRO HG2 . 10192 1 394 . 1 1 40 40 PRO HG3 H 1 1.958 0.030 . 1 . . . . 40 PRO HG3 . 10192 1 395 . 1 1 40 40 PRO CD C 13 50.643 0.300 . 1 . . . . 40 PRO CD . 10192 1 396 . 1 1 40 40 PRO HD2 H 1 3.764 0.030 . 2 . . . . 40 PRO HD2 . 10192 1 397 . 1 1 40 40 PRO HD3 H 1 3.584 0.030 . 2 . . . . 40 PRO HD3 . 10192 1 398 . 1 1 41 41 SER N N 15 116.460 0.300 . 1 . . . . 41 SER N . 10192 1 399 . 1 1 41 41 SER H H 1 8.499 0.030 . 1 . . . . 41 SER H . 10192 1 400 . 1 1 42 42 GLY CA C 13 44.629 0.300 . 1 . . . . 42 GLY CA . 10192 1 401 . 1 1 42 42 GLY HA2 H 1 4.100 0.030 . 2 . . . . 42 GLY HA2 . 10192 1 402 . 1 1 42 42 GLY HA3 H 1 4.051 0.030 . 2 . . . . 42 GLY HA3 . 10192 1 403 . 1 1 43 43 PRO CA C 13 63.255 0.300 . 1 . . . . 43 PRO CA . 10192 1 404 . 1 1 43 43 PRO HA H 1 4.417 0.030 . 1 . . . . 43 PRO HA . 10192 1 405 . 1 1 43 43 PRO CB C 13 32.137 0.300 . 1 . . . . 43 PRO CB . 10192 1 406 . 1 1 43 43 PRO HB2 H 1 2.251 0.030 . 2 . . . . 43 PRO HB2 . 10192 1 407 . 1 1 43 43 PRO HB3 H 1 1.880 0.030 . 2 . . . . 43 PRO HB3 . 10192 1 408 . 1 1 43 43 PRO CG C 13 27.192 0.300 . 1 . . . . 43 PRO CG . 10192 1 409 . 1 1 43 43 PRO HG2 H 1 1.957 0.030 . 1 . . . . 43 PRO HG2 . 10192 1 410 . 1 1 43 43 PRO HG3 H 1 1.957 0.030 . 1 . . . . 43 PRO HG3 . 10192 1 411 . 1 1 43 43 PRO CD C 13 49.761 0.300 . 1 . . . . 43 PRO CD . 10192 1 412 . 1 1 43 43 PRO HD2 H 1 3.567 0.030 . 1 . . . . 43 PRO HD2 . 10192 1 413 . 1 1 43 43 PRO HD3 H 1 3.567 0.030 . 1 . . . . 43 PRO HD3 . 10192 1 414 . 1 1 44 44 SER N N 15 116.517 0.300 . 1 . . . . 44 SER N . 10192 1 415 . 1 1 44 44 SER H H 1 8.453 0.030 . 1 . . . . 44 SER H . 10192 1 416 . 1 1 44 44 SER CB C 13 61.760 0.300 . 1 . . . . 44 SER CB . 10192 1 417 . 1 1 44 44 SER HB2 H 1 3.813 0.030 . 1 . . . . 44 SER HB2 . 10192 1 418 . 1 1 44 44 SER HB3 H 1 3.813 0.030 . 1 . . . . 44 SER HB3 . 10192 1 stop_ save_