################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 19327 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 3 '3D HNCO' . . . 19327 1 4 '(4,3)D GFT CABCA(CO)NHN' . . . 19327 1 5 '(4,3)D GFT HNHNCABCA' . . . 19327 1 6 '(4,3)D GFT HABCAB(CO)NHN' . . . 19327 1 7 '3D 1H-15N,13C NOESY' . . . 19327 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 1 1 ALA HA H 1 4.130 0.02 . 1 . . . . A 22 ALA HA . 19327 1 2 . 1 1 1 1 ALA HB1 H 1 1.184 0.02 . 1 . . . . A 22 ALA HB1 . 19327 1 3 . 1 1 1 1 ALA HB2 H 1 1.184 0.02 . 1 . . . . A 22 ALA HB2 . 19327 1 4 . 1 1 1 1 ALA HB3 H 1 1.184 0.02 . 1 . . . . A 22 ALA HB3 . 19327 1 5 . 1 1 1 1 ALA C C 13 172.939 0.20 . 1 . . . . A 22 ALA C . 19327 1 6 . 1 1 1 1 ALA CA C 13 50.956 0.20 . 1 . . . . A 22 ALA CA . 19327 1 7 . 1 1 1 1 ALA CB C 13 20.400 0.20 . 1 . . . . A 22 ALA CB . 19327 1 8 . 1 1 2 2 GLU H H 1 7.921 0.02 . 1 . . . . A 23 GLU H . 19327 1 9 . 1 1 2 2 GLU HA H 1 4.713 0.02 . 1 . . . . A 23 GLU HA . 19327 1 10 . 1 1 2 2 GLU HB2 H 1 1.979 0.02 . 2 . . . . A 23 GLU HB2 . 19327 1 11 . 1 1 2 2 GLU HB3 H 1 2.050 0.02 . 2 . . . . A 23 GLU HB3 . 19327 1 12 . 1 1 2 2 GLU HG2 H 1 2.270 0.02 . 1 . . . . A 23 GLU HG2 . 19327 1 13 . 1 1 2 2 GLU HG3 H 1 2.270 0.02 . 1 . . . . A 23 GLU HG3 . 19327 1 14 . 1 1 2 2 GLU C C 13 174.825 0.20 . 1 . . . . A 23 GLU C . 19327 1 15 . 1 1 2 2 GLU CA C 13 54.363 0.20 . 1 . . . . A 23 GLU CA . 19327 1 16 . 1 1 2 2 GLU CB C 13 32.640 0.20 . 1 . . . . A 23 GLU CB . 19327 1 17 . 1 1 2 2 GLU CG C 13 35.103 0.20 . 1 . . . . A 23 GLU CG . 19327 1 18 . 1 1 2 2 GLU N N 15 117.829 0.20 . 1 . . . . A 23 GLU N . 19327 1 19 . 1 1 3 3 ILE H H 1 8.873 0.02 . 1 . . . . A 24 ILE H . 19327 1 20 . 1 1 3 3 ILE HA H 1 4.871 0.02 . 1 . . . . A 24 ILE HA . 19327 1 21 . 1 1 3 3 ILE HB H 1 1.672 0.02 . 1 . . . . A 24 ILE HB . 19327 1 22 . 1 1 3 3 ILE HG12 H 1 1.522 0.02 . 2 . . . . A 24 ILE HG12 . 19327 1 23 . 1 1 3 3 ILE HG13 H 1 0.774 0.02 . 2 . . . . A 24 ILE HG13 . 19327 1 24 . 1 1 3 3 ILE HG21 H 1 0.847 0.02 . 1 . . . . A 24 ILE HG21 . 19327 1 25 . 1 1 3 3 ILE HG22 H 1 0.847 0.02 . 1 . . . . A 24 ILE HG22 . 19327 1 26 . 1 1 3 3 ILE HG23 H 1 0.847 0.02 . 1 . . . . A 24 ILE HG23 . 19327 1 27 . 1 1 3 3 ILE HD11 H 1 0.785 0.02 . 1 . . . . A 24 ILE HD11 . 19327 1 28 . 1 1 3 3 ILE HD12 H 1 0.785 0.02 . 1 . . . . A 24 ILE HD12 . 19327 1 29 . 1 1 3 3 ILE HD13 H 1 0.785 0.02 . 1 . . . . A 24 ILE HD13 . 19327 1 30 . 1 1 3 3 ILE C C 13 176.427 0.20 . 1 . . . . A 24 ILE C . 19327 1 31 . 1 1 3 3 ILE CA C 13 60.288 0.20 . 1 . . . . A 24 ILE CA . 19327 1 32 . 1 1 3 3 ILE CB C 13 38.258 0.20 . 1 . . . . A 24 ILE CB . 19327 1 33 . 1 1 3 3 ILE CG1 C 13 28.133 0.20 . 1 . . . . A 24 ILE CG1 . 19327 1 34 . 1 1 3 3 ILE CG2 C 13 13.445 0.20 . 1 . . . . A 24 ILE CG2 . 19327 1 35 . 1 1 3 3 ILE CD1 C 13 17.463 0.20 . 1 . . . . A 24 ILE CD1 . 19327 1 36 . 1 1 3 3 ILE N N 15 123.913 0.20 . 1 . . . . A 24 ILE N . 19327 1 37 . 1 1 4 4 MET H H 1 8.727 0.02 . 1 . . . . A 25 MET H . 19327 1 38 . 1 1 4 4 MET HA H 1 4.761 0.02 . 1 . . . . A 25 MET HA . 19327 1 39 . 1 1 4 4 MET HB2 H 1 1.568 0.02 . 1 . . . . A 25 MET HB2 . 19327 1 40 . 1 1 4 4 MET HB3 H 1 1.911 0.02 . 1 . . . . A 25 MET HB3 . 19327 1 41 . 1 1 4 4 MET HG2 H 1 2.615 0.02 . 1 . . . . A 25 MET HG2 . 19327 1 42 . 1 1 4 4 MET HG3 H 1 2.429 0.02 . 1 . . . . A 25 MET HG3 . 19327 1 43 . 1 1 4 4 MET HE1 H 1 1.973 0.02 . 1 . . . . A 25 MET HE1 . 19327 1 44 . 1 1 4 4 MET HE2 H 1 1.973 0.02 . 1 . . . . A 25 MET HE2 . 19327 1 45 . 1 1 4 4 MET HE3 H 1 1.973 0.02 . 1 . . . . A 25 MET HE3 . 19327 1 46 . 1 1 4 4 MET C C 13 175.735 0.20 . 1 . . . . A 25 MET C . 19327 1 47 . 1 1 4 4 MET CA C 13 54.339 0.20 . 1 . . . . A 25 MET CA . 19327 1 48 . 1 1 4 4 MET CB C 13 37.347 0.20 . 1 . . . . A 25 MET CB . 19327 1 49 . 1 1 4 4 MET CG C 13 32.662 0.20 . 1 . . . . A 25 MET CG . 19327 1 50 . 1 1 4 4 MET CE C 13 16.745 0.20 . 1 . . . . A 25 MET CE . 19327 1 51 . 1 1 4 4 MET N N 15 127.256 0.20 . 1 . . . . A 25 MET N . 19327 1 52 . 1 1 5 5 LYS H H 1 9.189 0.02 . 1 . . . . A 26 LYS H . 19327 1 53 . 1 1 5 5 LYS HA H 1 4.315 0.02 . 1 . . . . A 26 LYS HA . 19327 1 54 . 1 1 5 5 LYS HB2 H 1 1.826 0.02 . 1 . . . . A 26 LYS HB2 . 19327 1 55 . 1 1 5 5 LYS HB3 H 1 2.028 0.02 . 1 . . . . A 26 LYS HB3 . 19327 1 56 . 1 1 5 5 LYS HG2 H 1 1.588 0.02 . 2 . . . . A 26 LYS HG2 . 19327 1 57 . 1 1 5 5 LYS HG3 H 1 1.643 0.02 . 2 . . . . A 26 LYS HG3 . 19327 1 58 . 1 1 5 5 LYS HD2 H 1 1.748 0.02 . 1 . . . . A 26 LYS HD2 . 19327 1 59 . 1 1 5 5 LYS HD3 H 1 1.748 0.02 . 1 . . . . A 26 LYS HD3 . 19327 1 60 . 1 1 5 5 LYS HE2 H 1 3.025 0.02 . 1 . . . . A 26 LYS HE2 . 19327 1 61 . 1 1 5 5 LYS HE3 H 1 3.025 0.02 . 1 . . . . A 26 LYS HE3 . 19327 1 62 . 1 1 5 5 LYS C C 13 178.259 0.20 . 1 . . . . A 26 LYS C . 19327 1 63 . 1 1 5 5 LYS CA C 13 56.725 0.20 . 1 . . . . A 26 LYS CA . 19327 1 64 . 1 1 5 5 LYS CB C 13 32.963 0.20 . 1 . . . . A 26 LYS CB . 19327 1 65 . 1 1 5 5 LYS CG C 13 25.504 0.20 . 1 . . . . A 26 LYS CG . 19327 1 66 . 1 1 5 5 LYS CD C 13 29.336 0.20 . 1 . . . . A 26 LYS CD . 19327 1 67 . 1 1 5 5 LYS CE C 13 41.884 0.20 . 1 . . . . A 26 LYS CE . 19327 1 68 . 1 1 5 5 LYS N N 15 123.671 0.20 . 1 . . . . A 26 LYS N . 19327 1 69 . 1 1 6 6 LYS H H 1 8.871 0.02 . 1 . . . . A 27 LYS H . 19327 1 70 . 1 1 6 6 LYS HA H 1 3.864 0.02 . 1 . . . . A 27 LYS HA . 19327 1 71 . 1 1 6 6 LYS HB2 H 1 1.965 0.02 . 1 . . . . A 27 LYS HB2 . 19327 1 72 . 1 1 6 6 LYS HB3 H 1 1.965 0.02 . 1 . . . . A 27 LYS HB3 . 19327 1 73 . 1 1 6 6 LYS HG2 H 1 1.520 0.02 . 2 . . . . A 27 LYS HG2 . 19327 1 74 . 1 1 6 6 LYS HG3 H 1 1.480 0.02 . 2 . . . . A 27 LYS HG3 . 19327 1 75 . 1 1 6 6 LYS HD2 H 1 1.626 0.02 . 2 . . . . A 27 LYS HD2 . 19327 1 76 . 1 1 6 6 LYS HD3 H 1 1.833 0.02 . 2 . . . . A 27 LYS HD3 . 19327 1 77 . 1 1 6 6 LYS HE2 H 1 3.089 0.02 . 1 . . . . A 27 LYS HE2 . 19327 1 78 . 1 1 6 6 LYS HE3 H 1 3.089 0.02 . 1 . . . . A 27 LYS HE3 . 19327 1 79 . 1 1 6 6 LYS C C 13 177.241 0.20 . 1 . . . . A 27 LYS C . 19327 1 80 . 1 1 6 6 LYS CA C 13 60.587 0.20 . 1 . . . . A 27 LYS CA . 19327 1 81 . 1 1 6 6 LYS CB C 13 32.359 0.20 . 1 . . . . A 27 LYS CB . 19327 1 82 . 1 1 6 6 LYS CG C 13 24.800 0.20 . 1 . . . . A 27 LYS CG . 19327 1 83 . 1 1 6 6 LYS CD C 13 28.777 0.20 . 1 . . . . A 27 LYS CD . 19327 1 84 . 1 1 6 6 LYS CE C 13 42.149 0.20 . 1 . . . . A 27 LYS CE . 19327 1 85 . 1 1 6 6 LYS N N 15 126.369 0.20 . 1 . . . . A 27 LYS N . 19327 1 86 . 1 1 7 7 THR H H 1 8.110 0.02 . 1 . . . . A 28 THR H . 19327 1 87 . 1 1 7 7 THR HA H 1 4.135 0.02 . 1 . . . . A 28 THR HA . 19327 1 88 . 1 1 7 7 THR HB H 1 4.177 0.02 . 1 . . . . A 28 THR HB . 19327 1 89 . 1 1 7 7 THR HG21 H 1 1.304 0.02 . 1 . . . . A 28 THR HG21 . 19327 1 90 . 1 1 7 7 THR HG22 H 1 1.304 0.02 . 1 . . . . A 28 THR HG22 . 19327 1 91 . 1 1 7 7 THR HG23 H 1 1.304 0.02 . 1 . . . . A 28 THR HG23 . 19327 1 92 . 1 1 7 7 THR CA C 13 64.757 0.20 . 1 . . . . A 28 THR CA . 19327 1 93 . 1 1 7 7 THR CB C 13 68.084 0.20 . 1 . . . . A 28 THR CB . 19327 1 94 . 1 1 7 7 THR CG2 C 13 22.214 0.20 . 1 . . . . A 28 THR CG2 . 19327 1 95 . 1 1 7 7 THR C C 13 176.847 0.20 . 1 . . . . A 28 THR C . 19327 1 96 . 1 1 7 7 THR N N 15 107.099 0.20 . 1 . . . . A 28 THR N . 19327 1 97 . 1 1 8 8 ASP H H 1 6.779 0.02 . 1 . . . . A 29 ASP H . 19327 1 98 . 1 1 8 8 ASP HA H 1 4.586 0.02 . 1 . . . . A 29 ASP HA . 19327 1 99 . 1 1 8 8 ASP HB2 H 1 2.730 0.02 . 1 . . . . A 29 ASP HB2 . 19327 1 100 . 1 1 8 8 ASP HB3 H 1 2.730 0.02 . 1 . . . . A 29 ASP HB3 . 19327 1 101 . 1 1 8 8 ASP CA C 13 56.656 0.20 . 1 . . . . A 29 ASP CA . 19327 1 102 . 1 1 8 8 ASP CB C 13 40.727 0.20 . 1 . . . . A 29 ASP CB . 19327 1 103 . 1 1 8 8 ASP C C 13 178.416 0.20 . 1 . . . . A 29 ASP C . 19327 1 104 . 1 1 8 8 ASP N N 15 119.543 0.20 . 1 . . . . A 29 ASP N . 19327 1 105 . 1 1 9 9 PHE H H 1 8.633 0.02 . 1 . . . . A 30 PHE H . 19327 1 106 . 1 1 9 9 PHE HA H 1 3.936 0.02 . 1 . . . . A 30 PHE HA . 19327 1 107 . 1 1 9 9 PHE HB2 H 1 2.665 0.02 . 1 . . . . A 30 PHE HB2 . 19327 1 108 . 1 1 9 9 PHE HB3 H 1 2.769 0.02 . 1 . . . . A 30 PHE HB3 . 19327 1 109 . 1 1 9 9 PHE HD1 H 1 6.732 0.02 . 1 . . . . A 30 PHE HD1 . 19327 1 110 . 1 1 9 9 PHE HD2 H 1 6.732 0.02 . 1 . . . . A 30 PHE HD2 . 19327 1 111 . 1 1 9 9 PHE HE1 H 1 6.043 0.02 . 1 . . . . A 30 PHE HE1 . 19327 1 112 . 1 1 9 9 PHE HE2 H 1 6.043 0.02 . 1 . . . . A 30 PHE HE2 . 19327 1 113 . 1 1 9 9 PHE HZ H 1 5.944 0.02 . 1 . . . . A 30 PHE HZ . 19327 1 114 . 1 1 9 9 PHE CA C 13 60.862 0.20 . 1 . . . . A 30 PHE CA . 19327 1 115 . 1 1 9 9 PHE CB C 13 39.030 0.20 . 1 . . . . A 30 PHE CB . 19327 1 116 . 1 1 9 9 PHE CD1 C 13 130.158 0.20 . 1 . . . . A 30 PHE CD1 . 19327 1 117 . 1 1 9 9 PHE CE1 C 13 129.275 0.20 . 1 . . . . A 30 PHE CE1 . 19327 1 118 . 1 1 9 9 PHE CZ C 13 128.457 0.20 . 1 . . . . A 30 PHE CZ . 19327 1 119 . 1 1 9 9 PHE C C 13 177.257 0.20 . 1 . . . . A 30 PHE C . 19327 1 120 . 1 1 9 9 PHE N N 15 123.437 0.20 . 1 . . . . A 30 PHE N . 19327 1 121 . 1 1 10 10 ASP H H 1 8.650 0.02 . 1 . . . . A 31 ASP H . 19327 1 122 . 1 1 10 10 ASP HA H 1 4.150 0.02 . 1 . . . . A 31 ASP HA . 19327 1 123 . 1 1 10 10 ASP HB2 H 1 2.593 0.02 . 1 . . . . A 31 ASP HB2 . 19327 1 124 . 1 1 10 10 ASP HB3 H 1 2.593 0.02 . 1 . . . . A 31 ASP HB3 . 19327 1 125 . 1 1 10 10 ASP CA C 13 57.075 0.20 . 1 . . . . A 31 ASP CA . 19327 1 126 . 1 1 10 10 ASP CB C 13 39.986 0.20 . 1 . . . . A 31 ASP CB . 19327 1 127 . 1 1 10 10 ASP C C 13 178.427 0.20 . 1 . . . . A 31 ASP C . 19327 1 128 . 1 1 10 10 ASP N N 15 117.040 0.20 . 1 . . . . A 31 ASP N . 19327 1 129 . 1 1 11 11 LYS H H 1 6.927 0.02 . 1 . . . . A 32 LYS H . 19327 1 130 . 1 1 11 11 LYS HA H 1 4.114 0.02 . 1 . . . . A 32 LYS HA . 19327 1 131 . 1 1 11 11 LYS HB2 H 1 1.909 0.02 . 1 . . . . A 32 LYS HB2 . 19327 1 132 . 1 1 11 11 LYS HB3 H 1 1.993 0.02 . 1 . . . . A 32 LYS HB3 . 19327 1 133 . 1 1 11 11 LYS HG2 H 1 1.511 0.02 . 1 . . . . A 32 LYS HG2 . 19327 1 134 . 1 1 11 11 LYS HG3 H 1 1.715 0.02 . 1 . . . . A 32 LYS HG3 . 19327 1 135 . 1 1 11 11 LYS HD2 H 1 1.766 0.02 . 1 . . . . A 32 LYS HD2 . 19327 1 136 . 1 1 11 11 LYS HD3 H 1 1.766 0.02 . 1 . . . . A 32 LYS HD3 . 19327 1 137 . 1 1 11 11 LYS HE2 H 1 3.046 0.02 . 1 . . . . A 32 LYS HE2 . 19327 1 138 . 1 1 11 11 LYS HE3 H 1 3.046 0.02 . 1 . . . . A 32 LYS HE3 . 19327 1 139 . 1 1 11 11 LYS CA C 13 58.387 0.20 . 1 . . . . A 32 LYS CA . 19327 1 140 . 1 1 11 11 LYS CB C 13 33.255 0.20 . 1 . . . . A 32 LYS CB . 19327 1 141 . 1 1 11 11 LYS CG C 13 25.285 0.20 . 1 . . . . A 32 LYS CG . 19327 1 142 . 1 1 11 11 LYS CD C 13 29.323 0.20 . 1 . . . . A 32 LYS CD . 19327 1 143 . 1 1 11 11 LYS CE C 13 42.197 0.20 . 1 . . . . A 32 LYS CE . 19327 1 144 . 1 1 11 11 LYS C C 13 178.076 0.20 . 1 . . . . A 32 LYS C . 19327 1 145 . 1 1 11 11 LYS N N 15 114.800 0.20 . 1 . . . . A 32 LYS N . 19327 1 146 . 1 1 12 12 VAL H H 1 7.404 0.02 . 1 . . . . A 33 VAL H . 19327 1 147 . 1 1 12 12 VAL HA H 1 4.619 0.02 . 1 . . . . A 33 VAL HA . 19327 1 148 . 1 1 12 12 VAL HB H 1 2.643 0.02 . 1 . . . . A 33 VAL HB . 19327 1 149 . 1 1 12 12 VAL HG11 H 1 0.824 0.02 . 1 . . . . A 33 VAL HG11 . 19327 1 150 . 1 1 12 12 VAL HG12 H 1 0.824 0.02 . 1 . . . . A 33 VAL HG12 . 19327 1 151 . 1 1 12 12 VAL HG13 H 1 0.824 0.02 . 1 . . . . A 33 VAL HG13 . 19327 1 152 . 1 1 12 12 VAL HG21 H 1 0.689 0.02 . 1 . . . . A 33 VAL HG21 . 19327 1 153 . 1 1 12 12 VAL HG22 H 1 0.689 0.02 . 1 . . . . A 33 VAL HG22 . 19327 1 154 . 1 1 12 12 VAL HG23 H 1 0.689 0.02 . 1 . . . . A 33 VAL HG23 . 19327 1 155 . 1 1 12 12 VAL CA C 13 60.060 0.20 . 1 . . . . A 33 VAL CA . 19327 1 156 . 1 1 12 12 VAL CB C 13 32.434 0.20 . 1 . . . . A 33 VAL CB . 19327 1 157 . 1 1 12 12 VAL CG1 C 13 21.586 0.20 . 1 . . . . A 33 VAL CG1 . 19327 1 158 . 1 1 12 12 VAL CG2 C 13 18.975 0.20 . 1 . . . . A 33 VAL CG2 . 19327 1 159 . 1 1 12 12 VAL C C 13 176.414 0.20 . 1 . . . . A 33 VAL C . 19327 1 160 . 1 1 12 12 VAL N N 15 109.380 0.20 . 1 . . . . A 33 VAL N . 19327 1 161 . 1 1 13 13 ALA H H 1 6.714 0.02 . 1 . . . . A 34 ALA H . 19327 1 162 . 1 1 13 13 ALA HA H 1 3.016 0.02 . 1 . . . . A 34 ALA HA . 19327 1 163 . 1 1 13 13 ALA HB1 H 1 1.049 0.02 . 1 . . . . A 34 ALA HB1 . 19327 1 164 . 1 1 13 13 ALA HB2 H 1 1.049 0.02 . 1 . . . . A 34 ALA HB2 . 19327 1 165 . 1 1 13 13 ALA HB3 H 1 1.049 0.02 . 1 . . . . A 34 ALA HB3 . 19327 1 166 . 1 1 13 13 ALA CA C 13 55.264 0.20 . 1 . . . . A 34 ALA CA . 19327 1 167 . 1 1 13 13 ALA CB C 13 19.394 0.20 . 1 . . . . A 34 ALA CB . 19327 1 168 . 1 1 13 13 ALA C C 13 179.434 0.20 . 1 . . . . A 34 ALA C . 19327 1 169 . 1 1 13 13 ALA N N 15 124.530 0.20 . 1 . . . . A 34 ALA N . 19327 1 170 . 1 1 14 14 SER H H 1 8.121 0.02 . 1 . . . . A 35 SER H . 19327 1 171 . 1 1 14 14 SER HA H 1 4.324 0.02 . 1 . . . . A 35 SER HA . 19327 1 172 . 1 1 14 14 SER HB2 H 1 4.010 0.02 . 2 . . . . A 35 SER HB2 . 19327 1 173 . 1 1 14 14 SER HB3 H 1 3.885 0.02 . 2 . . . . A 35 SER HB3 . 19327 1 174 . 1 1 14 14 SER CA C 13 60.456 0.20 . 1 . . . . A 35 SER CA . 19327 1 175 . 1 1 14 14 SER CB C 13 62.536 0.20 . 1 . . . . A 35 SER CB . 19327 1 176 . 1 1 14 14 SER C C 13 175.490 0.20 . 1 . . . . A 35 SER C . 19327 1 177 . 1 1 14 14 SER N N 15 110.547 0.20 . 1 . . . . A 35 SER N . 19327 1 178 . 1 1 15 15 GLU H H 1 8.305 0.02 . 1 . . . . A 36 GLU H . 19327 1 179 . 1 1 15 15 GLU HA H 1 4.273 0.02 . 1 . . . . A 36 GLU HA . 19327 1 180 . 1 1 15 15 GLU HB2 H 1 1.966 0.02 . 2 . . . . A 36 GLU HB2 . 19327 1 181 . 1 1 15 15 GLU HB3 H 1 2.032 0.02 . 2 . . . . A 36 GLU HB3 . 19327 1 182 . 1 1 15 15 GLU HG2 H 1 2.267 0.02 . 2 . . . . A 36 GLU HG2 . 19327 1 183 . 1 1 15 15 GLU HG3 H 1 2.170 0.02 . 2 . . . . A 36 GLU HG3 . 19327 1 184 . 1 1 15 15 GLU CA C 13 55.787 0.20 . 1 . . . . A 36 GLU CA . 19327 1 185 . 1 1 15 15 GLU CB C 13 29.085 0.20 . 1 . . . . A 36 GLU CB . 19327 1 186 . 1 1 15 15 GLU CG C 13 35.223 0.20 . 1 . . . . A 36 GLU CG . 19327 1 187 . 1 1 15 15 GLU C C 13 174.975 0.20 . 1 . . . . A 36 GLU C . 19327 1 188 . 1 1 15 15 GLU N N 15 119.216 0.20 . 1 . . . . A 36 GLU N . 19327 1 189 . 1 1 16 16 TYR H H 1 7.922 0.02 . 1 . . . . A 37 TYR H . 19327 1 190 . 1 1 16 16 TYR HA H 1 5.150 0.02 . 1 . . . . A 37 TYR HA . 19327 1 191 . 1 1 16 16 TYR HB2 H 1 2.882 0.02 . 1 . . . . A 37 TYR HB2 . 19327 1 192 . 1 1 16 16 TYR HB3 H 1 3.141 0.02 . 1 . . . . A 37 TYR HB3 . 19327 1 193 . 1 1 16 16 TYR HD1 H 1 6.902 0.02 . 1 . . . . A 37 TYR HD1 . 19327 1 194 . 1 1 16 16 TYR HD2 H 1 6.902 0.02 . 1 . . . . A 37 TYR HD2 . 19327 1 195 . 1 1 16 16 TYR HE1 H 1 6.630 0.02 . 1 . . . . A 37 TYR HE1 . 19327 1 196 . 1 1 16 16 TYR HE2 H 1 6.630 0.02 . 1 . . . . A 37 TYR HE2 . 19327 1 197 . 1 1 16 16 TYR CA C 13 57.956 0.20 . 1 . . . . A 37 TYR CA . 19327 1 198 . 1 1 16 16 TYR CB C 13 44.240 0.20 . 1 . . . . A 37 TYR CB . 19327 1 199 . 1 1 16 16 TYR CD2 C 13 132.471 0.20 . 1 . . . . A 37 TYR CD2 . 19327 1 200 . 1 1 16 16 TYR CE2 C 13 117.735 0.20 . 1 . . . . A 37 TYR CE2 . 19327 1 201 . 1 1 16 16 TYR C C 13 174.389 0.20 . 1 . . . . A 37 TYR C . 19327 1 202 . 1 1 16 16 TYR N N 15 117.179 0.20 . 1 . . . . A 37 TYR N . 19327 1 203 . 1 1 17 17 THR H H 1 9.483 0.02 . 1 . . . . A 38 THR H . 19327 1 204 . 1 1 17 17 THR HA H 1 4.843 0.02 . 1 . . . . A 38 THR HA . 19327 1 205 . 1 1 17 17 THR HB H 1 3.958 0.02 . 1 . . . . A 38 THR HB . 19327 1 206 . 1 1 17 17 THR HG21 H 1 1.262 0.02 . 1 . . . . A 38 THR HG21 . 19327 1 207 . 1 1 17 17 THR HG22 H 1 1.262 0.02 . 1 . . . . A 38 THR HG22 . 19327 1 208 . 1 1 17 17 THR HG23 H 1 1.262 0.02 . 1 . . . . A 38 THR HG23 . 19327 1 209 . 1 1 17 17 THR CA C 13 60.454 0.20 . 1 . . . . A 38 THR CA . 19327 1 210 . 1 1 17 17 THR CB C 13 71.300 0.20 . 1 . . . . A 38 THR CB . 19327 1 211 . 1 1 17 17 THR CG2 C 13 21.601 0.20 . 1 . . . . A 38 THR CG2 . 19327 1 212 . 1 1 17 17 THR C C 13 173.863 0.20 . 1 . . . . A 38 THR C . 19327 1 213 . 1 1 17 17 THR N N 15 115.546 0.20 . 1 . . . . A 38 THR N . 19327 1 214 . 1 1 18 18 LYS H H 1 9.290 0.02 . 1 . . . . A 39 LYS H . 19327 1 215 . 1 1 18 18 LYS HA H 1 3.883 0.02 . 1 . . . . A 39 LYS HA . 19327 1 216 . 1 1 18 18 LYS HB2 H 1 1.694 0.02 . 2 . . . . A 39 LYS HB2 . 19327 1 217 . 1 1 18 18 LYS HB3 H 1 1.841 0.02 . 2 . . . . A 39 LYS HB3 . 19327 1 218 . 1 1 18 18 LYS HG2 H 1 1.060 0.02 . 1 . . . . A 39 LYS HG2 . 19327 1 219 . 1 1 18 18 LYS HG3 H 1 0.786 0.02 . 1 . . . . A 39 LYS HG3 . 19327 1 220 . 1 1 18 18 LYS HD2 H 1 1.503 0.02 . 1 . . . . A 39 LYS HD2 . 19327 1 221 . 1 1 18 18 LYS HD3 H 1 1.503 0.02 . 1 . . . . A 39 LYS HD3 . 19327 1 222 . 1 1 18 18 LYS HE2 H 1 2.695 0.02 . 1 . . . . A 39 LYS HE2 . 19327 1 223 . 1 1 18 18 LYS HE3 H 1 2.695 0.02 . 1 . . . . A 39 LYS HE3 . 19327 1 224 . 1 1 18 18 LYS CA C 13 57.615 0.20 . 1 . . . . A 39 LYS CA . 19327 1 225 . 1 1 18 18 LYS CB C 13 32.590 0.20 . 1 . . . . A 39 LYS CB . 19327 1 226 . 1 1 18 18 LYS CG C 13 25.434 0.20 . 1 . . . . A 39 LYS CG . 19327 1 227 . 1 1 18 18 LYS CD C 13 29.541 0.20 . 1 . . . . A 39 LYS CD . 19327 1 228 . 1 1 18 18 LYS CE C 13 41.847 0.20 . 1 . . . . A 39 LYS CE . 19327 1 229 . 1 1 18 18 LYS C C 13 176.918 0.20 . 1 . . . . A 39 LYS C . 19327 1 230 . 1 1 18 18 LYS N N 15 130.415 0.20 . 1 . . . . A 39 LYS N . 19327 1 231 . 1 1 19 19 ILE H H 1 8.819 0.02 . 1 . . . . A 40 ILE H . 19327 1 232 . 1 1 19 19 ILE HA H 1 4.558 0.02 . 1 . . . . A 40 ILE HA . 19327 1 233 . 1 1 19 19 ILE HB H 1 1.950 0.02 . 1 . . . . A 40 ILE HB . 19327 1 234 . 1 1 19 19 ILE HG12 H 1 0.774 0.02 . 2 . . . . A 40 ILE HG12 . 19327 1 235 . 1 1 19 19 ILE HG13 H 1 1.140 0.02 . 2 . . . . A 40 ILE HG13 . 19327 1 236 . 1 1 19 19 ILE HG21 H 1 0.924 0.02 . 1 . . . . A 40 ILE HG21 . 19327 1 237 . 1 1 19 19 ILE HG22 H 1 0.924 0.02 . 1 . . . . A 40 ILE HG22 . 19327 1 238 . 1 1 19 19 ILE HG23 H 1 0.924 0.02 . 1 . . . . A 40 ILE HG23 . 19327 1 239 . 1 1 19 19 ILE HD11 H 1 0.748 0.02 . 1 . . . . A 40 ILE HD11 . 19327 1 240 . 1 1 19 19 ILE HD12 H 1 0.748 0.02 . 1 . . . . A 40 ILE HD12 . 19327 1 241 . 1 1 19 19 ILE HD13 H 1 0.748 0.02 . 1 . . . . A 40 ILE HD13 . 19327 1 242 . 1 1 19 19 ILE CA C 13 61.052 0.20 . 1 . . . . A 40 ILE CA . 19327 1 243 . 1 1 19 19 ILE CB C 13 39.357 0.20 . 1 . . . . A 40 ILE CB . 19327 1 244 . 1 1 19 19 ILE CG1 C 13 26.807 0.20 . 1 . . . . A 40 ILE CG1 . 19327 1 245 . 1 1 19 19 ILE CG2 C 13 17.918 0.20 . 1 . . . . A 40 ILE CG2 . 19327 1 246 . 1 1 19 19 ILE CD1 C 13 14.505 0.20 . 1 . . . . A 40 ILE CD1 . 19327 1 247 . 1 1 19 19 ILE C C 13 14.505 0.20 . 1 . . . . A 40 ILE C . 19327 1 248 . 1 1 19 19 ILE N N 15 122.004 0.20 . 1 . . . . A 40 ILE N . 19327 1 249 . 1 1 20 20 GLY H H 1 7.136 0.02 . 1 . . . . A 41 GLY H . 19327 1 250 . 1 1 20 20 GLY HA2 H 1 3.954 0.02 . 1 . . . . A 41 GLY HA2 . 19327 1 251 . 1 1 20 20 GLY HA3 H 1 4.261 0.02 . 1 . . . . A 41 GLY HA3 . 19327 1 252 . 1 1 20 20 GLY CA C 13 45.206 0.20 . 1 . . . . A 41 GLY CA . 19327 1 253 . 1 1 20 20 GLY C C 13 170.679 0.20 . 1 . . . . A 41 GLY C . 19327 1 254 . 1 1 20 20 GLY N N 15 107.582 0.20 . 1 . . . . A 41 GLY N . 19327 1 255 . 1 1 21 21 THR H H 1 8.218 0.02 . 1 . . . . A 42 THR H . 19327 1 256 . 1 1 21 21 THR HA H 1 5.237 0.02 . 1 . . . . A 42 THR HA . 19327 1 257 . 1 1 21 21 THR HB H 1 3.902 0.02 . 1 . . . . A 42 THR HB . 19327 1 258 . 1 1 21 21 THR HG21 H 1 1.209 0.02 . 1 . . . . A 42 THR HG21 . 19327 1 259 . 1 1 21 21 THR HG22 H 1 1.209 0.02 . 1 . . . . A 42 THR HG22 . 19327 1 260 . 1 1 21 21 THR HG23 H 1 1.209 0.02 . 1 . . . . A 42 THR HG23 . 19327 1 261 . 1 1 21 21 THR CA C 13 60.959 0.20 . 1 . . . . A 42 THR CA . 19327 1 262 . 1 1 21 21 THR CB C 13 72.255 0.20 . 1 . . . . A 42 THR CB . 19327 1 263 . 1 1 21 21 THR CG2 C 13 21.241 0.20 . 1 . . . . A 42 THR CG2 . 19327 1 264 . 1 1 21 21 THR C C 13 173.547 0.20 . 1 . . . . A 42 THR C . 19327 1 265 . 1 1 21 21 THR N N 15 115.052 0.20 . 1 . . . . A 42 THR N . 19327 1 266 . 1 1 22 22 ILE H H 1 9.129 0.02 . 1 . . . . A 43 ILE H . 19327 1 267 . 1 1 22 22 ILE HA H 1 4.787 0.02 . 1 . . . . A 43 ILE HA . 19327 1 268 . 1 1 22 22 ILE HB H 1 1.769 0.02 . 1 . . . . A 43 ILE HB . 19327 1 269 . 1 1 22 22 ILE HG12 H 1 1.249 0.02 . 2 . . . . A 43 ILE HG12 . 19327 1 270 . 1 1 22 22 ILE HG13 H 1 0.872 0.02 . 2 . . . . A 43 ILE HG13 . 19327 1 271 . 1 1 22 22 ILE HG21 H 1 0.759 0.02 . 1 . . . . A 43 ILE HG21 . 19327 1 272 . 1 1 22 22 ILE HG22 H 1 0.759 0.02 . 1 . . . . A 43 ILE HG22 . 19327 1 273 . 1 1 22 22 ILE HG23 H 1 0.759 0.02 . 1 . . . . A 43 ILE HG23 . 19327 1 274 . 1 1 22 22 ILE HD11 H 1 0.709 0.02 . 1 . . . . A 43 ILE HD11 . 19327 1 275 . 1 1 22 22 ILE HD12 H 1 0.709 0.02 . 1 . . . . A 43 ILE HD12 . 19327 1 276 . 1 1 22 22 ILE HD13 H 1 0.709 0.02 . 1 . . . . A 43 ILE HD13 . 19327 1 277 . 1 1 22 22 ILE CA C 13 59.552 0.20 . 1 . . . . A 43 ILE CA . 19327 1 278 . 1 1 22 22 ILE CB C 13 42.701 0.20 . 1 . . . . A 43 ILE CB . 19327 1 279 . 1 1 22 22 ILE CG1 C 13 25.322 0.20 . 1 . . . . A 43 ILE CG1 . 19327 1 280 . 1 1 22 22 ILE CG2 C 13 18.171 0.20 . 1 . . . . A 43 ILE CG2 . 19327 1 281 . 1 1 22 22 ILE CD1 C 13 16.529 0.20 . 1 . . . . A 43 ILE CD1 . 19327 1 282 . 1 1 22 22 ILE C C 13 16.529 0.20 . 1 . . . . A 43 ILE C . 19327 1 283 . 1 1 22 22 ILE N N 15 118.029 0.20 . 1 . . . . A 43 ILE N . 19327 1 284 . 1 1 23 23 SER H H 1 8.335 0.02 . 1 . . . . A 44 SER H . 19327 1 285 . 1 1 23 23 SER HA H 1 5.252 0.02 . 1 . . . . A 44 SER HA . 19327 1 286 . 1 1 23 23 SER HB2 H 1 3.751 0.02 . 2 . . . . A 44 SER HB2 . 19327 1 287 . 1 1 23 23 SER HB3 H 1 3.684 0.02 . 2 . . . . A 44 SER HB3 . 19327 1 288 . 1 1 23 23 SER CA C 13 56.792 0.20 . 1 . . . . A 44 SER CA . 19327 1 289 . 1 1 23 23 SER CB C 13 66.063 0.20 . 1 . . . . A 44 SER CB . 19327 1 290 . 1 1 23 23 SER C C 13 173.804 0.20 . 1 . . . . A 44 SER C . 19327 1 291 . 1 1 23 23 SER N N 15 113.484 0.20 . 1 . . . . A 44 SER N . 19327 1 292 . 1 1 24 24 THR H H 1 8.375 0.02 . 1 . . . . A 45 THR H . 19327 1 293 . 1 1 24 24 THR HA H 1 4.555 0.02 . 1 . . . . A 45 THR HA . 19327 1 294 . 1 1 24 24 THR HB H 1 4.305 0.02 . 1 . . . . A 45 THR HB . 19327 1 295 . 1 1 24 24 THR HG21 H 1 1.226 0.02 . 1 . . . . A 45 THR HG21 . 19327 1 296 . 1 1 24 24 THR HG22 H 1 1.226 0.02 . 1 . . . . A 45 THR HG22 . 19327 1 297 . 1 1 24 24 THR HG23 H 1 1.226 0.02 . 1 . . . . A 45 THR HG23 . 19327 1 298 . 1 1 24 24 THR CA C 13 60.871 0.20 . 1 . . . . A 45 THR CA . 19327 1 299 . 1 1 24 24 THR CB C 13 70.060 0.20 . 1 . . . . A 45 THR CB . 19327 1 300 . 1 1 24 24 THR CG2 C 13 21.691 0.20 . 1 . . . . A 45 THR CG2 . 19327 1 301 . 1 1 24 24 THR C C 13 174.717 0.20 . 1 . . . . A 45 THR C . 19327 1 302 . 1 1 24 24 THR N N 15 113.454 0.20 . 1 . . . . A 45 THR N . 19327 1 303 . 1 1 25 25 THR H H 1 8.542 0.02 . 1 . . . . A 46 THR H . 19327 1 304 . 1 1 25 25 THR HA H 1 4.401 0.02 . 1 . . . . A 46 THR HA . 19327 1 305 . 1 1 25 25 THR HB H 1 4.158 0.02 . 1 . . . . A 46 THR HB . 19327 1 306 . 1 1 25 25 THR HG21 H 1 1.189 0.02 . 1 . . . . A 46 THR HG21 . 19327 1 307 . 1 1 25 25 THR HG22 H 1 1.189 0.02 . 1 . . . . A 46 THR HG22 . 19327 1 308 . 1 1 25 25 THR HG23 H 1 1.189 0.02 . 1 . . . . A 46 THR HG23 . 19327 1 309 . 1 1 25 25 THR CA C 13 62.097 0.20 . 1 . . . . A 46 THR CA . 19327 1 310 . 1 1 25 25 THR CB C 13 69.387 0.20 . 1 . . . . A 46 THR CB . 19327 1 311 . 1 1 25 25 THR CG2 C 13 21.702 0.20 . 1 . . . . A 46 THR CG2 . 19327 1 312 . 1 1 25 25 THR C C 13 174.729 0.20 . 1 . . . . A 46 THR C . 19327 1 313 . 1 1 25 25 THR N N 15 117.848 0.20 . 1 . . . . A 46 THR N . 19327 1 314 . 1 1 26 26 GLY H H 1 8.325 0.02 . 1 . . . . A 47 GLY H . 19327 1 315 . 1 1 26 26 GLY HA2 H 1 3.897 0.02 . 2 . . . . A 47 GLY HA2 . 19327 1 316 . 1 1 26 26 GLY HA3 H 1 3.990 0.02 . 2 . . . . A 47 GLY HA3 . 19327 1 317 . 1 1 26 26 GLY CA C 13 44.883 0.20 . 1 . . . . A 47 GLY CA . 19327 1 318 . 1 1 26 26 GLY C C 13 173.664 0.20 . 1 . . . . A 47 GLY C . 19327 1 319 . 1 1 26 26 GLY N N 15 111.660 0.20 . 1 . . . . A 47 GLY N . 19327 1 320 . 1 1 27 27 GLU H H 1 8.437 0.02 . 1 . . . . A 48 GLU H . 19327 1 321 . 1 1 27 27 GLU HA H 1 4.396 0.02 . 1 . . . . A 48 GLU HA . 19327 1 322 . 1 1 27 27 GLU HB2 H 1 1.856 0.02 . 1 . . . . A 48 GLU HB2 . 19327 1 323 . 1 1 27 27 GLU HB3 H 1 1.856 0.02 . 1 . . . . A 48 GLU HB3 . 19327 1 324 . 1 1 27 27 GLU HG2 H 1 2.117 0.02 . 2 . . . . A 48 GLU HG2 . 19327 1 325 . 1 1 27 27 GLU HG3 H 1 2.184 0.02 . 2 . . . . A 48 GLU HG3 . 19327 1 326 . 1 1 27 27 GLU CA C 13 55.704 0.20 . 1 . . . . A 48 GLU CA . 19327 1 327 . 1 1 27 27 GLU CB C 13 29.594 0.20 . 1 . . . . A 48 GLU CB . 19327 1 328 . 1 1 27 27 GLU CG C 13 35.381 0.20 . 1 . . . . A 48 GLU CG . 19327 1 329 . 1 1 27 27 GLU C C 13 176.169 0.20 . 1 . . . . A 48 GLU C . 19327 1 330 . 1 1 27 27 GLU N N 15 120.153 0.20 . 1 . . . . A 48 GLU N . 19327 1 331 . 1 1 28 28 MET H H 1 8.390 0.02 . 1 . . . . A 49 MET H . 19327 1 332 . 1 1 28 28 MET HA H 1 4.696 0.02 . 1 . . . . A 49 MET HA . 19327 1 333 . 1 1 28 28 MET HB2 H 1 2.262 0.02 . 2 . . . . A 49 MET HB2 . 19327 1 334 . 1 1 28 28 MET HB3 H 1 1.905 0.02 . 2 . . . . A 49 MET HB3 . 19327 1 335 . 1 1 28 28 MET HG2 H 1 2.518 0.02 . 1 . . . . A 49 MET HG2 . 19327 1 336 . 1 1 28 28 MET HG3 H 1 2.518 0.02 . 1 . . . . A 49 MET HG3 . 19327 1 337 . 1 1 28 28 MET HE1 H 1 2.064 0.02 . 1 . . . . A 49 MET HE1 . 19327 1 338 . 1 1 28 28 MET HE2 H 1 2.064 0.02 . 1 . . . . A 49 MET HE2 . 19327 1 339 . 1 1 28 28 MET HE3 H 1 2.064 0.02 . 1 . . . . A 49 MET HE3 . 19327 1 340 . 1 1 28 28 MET CA C 13 55.028 0.20 . 1 . . . . A 49 MET CA . 19327 1 341 . 1 1 28 28 MET CB C 13 36.079 0.20 . 1 . . . . A 49 MET CB . 19327 1 342 . 1 1 28 28 MET CG C 13 32.182 0.20 . 1 . . . . A 49 MET CG . 19327 1 343 . 1 1 28 28 MET CE C 13 17.646 0.20 . 1 . . . . A 49 MET CE . 19327 1 344 . 1 1 28 28 MET C C 13 175.490 0.20 . 1 . . . . A 49 MET C . 19327 1 345 . 1 1 28 28 MET N N 15 120.146 0.20 . 1 . . . . A 49 MET N . 19327 1 346 . 1 1 29 29 SER H H 1 9.023 0.02 . 1 . . . . A 50 SER H . 19327 1 347 . 1 1 29 29 SER HA H 1 4.780 0.02 . 1 . . . . A 50 SER HA . 19327 1 348 . 1 1 29 29 SER HB2 H 1 4.269 0.02 . 2 . . . . A 50 SER HB2 . 19327 1 349 . 1 1 29 29 SER HB3 H 1 4.060 0.02 . 2 . . . . A 50 SER HB3 . 19327 1 350 . 1 1 29 29 SER CA C 13 56.822 0.20 . 1 . . . . A 50 SER CA . 19327 1 351 . 1 1 29 29 SER CB C 13 62.631 0.20 . 1 . . . . A 50 SER CB . 19327 1 352 . 1 1 29 29 SER N N 15 118.105 0.20 . 1 . . . . A 50 SER N . 19327 1 353 . 1 1 30 30 PRO HA H 1 4.241 0.02 . 1 . . . . A 51 PRO HA . 19327 1 354 . 1 1 30 30 PRO HB2 H 1 1.983 0.02 . 2 . . . . A 51 PRO HB2 . 19327 1 355 . 1 1 30 30 PRO HB3 H 1 2.402 0.02 . 2 . . . . A 51 PRO HB3 . 19327 1 356 . 1 1 30 30 PRO HG2 H 1 2.203 0.02 . 2 . . . . A 51 PRO HG2 . 19327 1 357 . 1 1 30 30 PRO HG3 H 1 2.018 0.02 . 2 . . . . A 51 PRO HG3 . 19327 1 358 . 1 1 30 30 PRO HD2 H 1 3.898 0.02 . 1 . . . . A 51 PRO HD2 . 19327 1 359 . 1 1 30 30 PRO HD3 H 1 3.898 0.02 . 1 . . . . A 51 PRO HD3 . 19327 1 360 . 1 1 30 30 PRO CA C 13 66.078 0.20 . 1 . . . . A 51 PRO CA . 19327 1 361 . 1 1 30 30 PRO CB C 13 32.007 0.20 . 1 . . . . A 51 PRO CB . 19327 1 362 . 1 1 30 30 PRO CG C 13 28.017 0.20 . 1 . . . . A 51 PRO CG . 19327 1 363 . 1 1 30 30 PRO CD C 13 50.235 0.20 . 1 . . . . A 51 PRO CD . 19327 1 364 . 1 1 30 30 PRO C C 13 178.966 0.20 . 1 . . . . A 51 PRO C . 19327 1 365 . 1 1 31 31 LEU H H 1 8.169 0.02 . 1 . . . . A 52 LEU H . 19327 1 366 . 1 1 31 31 LEU HA H 1 4.112 0.02 . 1 . . . . A 52 LEU HA . 19327 1 367 . 1 1 31 31 LEU HB2 H 1 1.674 0.02 . 2 . . . . A 52 LEU HB2 . 19327 1 368 . 1 1 31 31 LEU HB3 H 1 1.575 0.02 . 2 . . . . A 52 LEU HB3 . 19327 1 369 . 1 1 31 31 LEU HG H 1 1.660 0.02 . 1 . . . . A 52 LEU HG . 19327 1 370 . 1 1 31 31 LEU HD11 H 1 0.946 0.02 . 1 . . . . A 52 LEU HD11 . 19327 1 371 . 1 1 31 31 LEU HD12 H 1 0.946 0.02 . 1 . . . . A 52 LEU HD12 . 19327 1 372 . 1 1 31 31 LEU HD13 H 1 0.946 0.02 . 1 . . . . A 52 LEU HD13 . 19327 1 373 . 1 1 31 31 LEU HD21 H 1 0.885 0.02 . 1 . . . . A 52 LEU HD21 . 19327 1 374 . 1 1 31 31 LEU HD22 H 1 0.885 0.02 . 1 . . . . A 52 LEU HD22 . 19327 1 375 . 1 1 31 31 LEU HD23 H 1 0.885 0.02 . 1 . . . . A 52 LEU HD23 . 19327 1 376 . 1 1 31 31 LEU CA C 13 57.948 0.20 . 1 . . . . A 52 LEU CA . 19327 1 377 . 1 1 31 31 LEU CB C 13 41.592 0.20 . 1 . . . . A 52 LEU CB . 19327 1 378 . 1 1 31 31 LEU CG C 13 27.125 0.20 . 1 . . . . A 52 LEU CG . 19327 1 379 . 1 1 31 31 LEU CD1 C 13 24.405 0.20 . 1 . . . . A 52 LEU CD1 . 19327 1 380 . 1 1 31 31 LEU CD2 C 13 24.070 0.20 . 1 . . . . A 52 LEU CD2 . 19327 1 381 . 1 1 31 31 LEU C C 13 179.024 0.20 . 1 . . . . A 52 LEU C . 19327 1 382 . 1 1 31 31 LEU N N 15 117.624 0.20 . 1 . . . . A 52 LEU N . 19327 1 383 . 1 1 32 32 ASP H H 1 7.515 0.02 . 1 . . . . A 53 ASP H . 19327 1 384 . 1 1 32 32 ASP HA H 1 4.422 0.02 . 1 . . . . A 53 ASP HA . 19327 1 385 . 1 1 32 32 ASP HB2 H 1 2.782 0.02 . 1 . . . . A 53 ASP HB2 . 19327 1 386 . 1 1 32 32 ASP HB3 H 1 2.782 0.02 . 1 . . . . A 53 ASP HB3 . 19327 1 387 . 1 1 32 32 ASP CA C 13 56.748 0.20 . 1 . . . . A 53 ASP CA . 19327 1 388 . 1 1 32 32 ASP CB C 13 39.840 0.20 . 1 . . . . A 53 ASP CB . 19327 1 389 . 1 1 32 32 ASP C C 13 178.802 0.20 . 1 . . . . A 53 ASP C . 19327 1 390 . 1 1 32 32 ASP N N 15 120.042 0.20 . 1 . . . . A 53 ASP N . 19327 1 391 . 1 1 33 33 ALA H H 1 8.806 0.02 . 1 . . . . A 54 ALA H . 19327 1 392 . 1 1 33 33 ALA HA H 1 4.210 0.02 . 1 . . . . A 54 ALA HA . 19327 1 393 . 1 1 33 33 ALA HB1 H 1 1.384 0.02 . 1 . . . . A 54 ALA HB1 . 19327 1 394 . 1 1 33 33 ALA HB2 H 1 1.384 0.02 . 1 . . . . A 54 ALA HB2 . 19327 1 395 . 1 1 33 33 ALA HB3 H 1 1.384 0.02 . 1 . . . . A 54 ALA HB3 . 19327 1 396 . 1 1 33 33 ALA CA C 13 54.800 0.20 . 1 . . . . A 54 ALA CA . 19327 1 397 . 1 1 33 33 ALA CB C 13 18.442 0.20 . 1 . . . . A 54 ALA CB . 19327 1 398 . 1 1 33 33 ALA C C 13 179.059 0.20 . 1 . . . . A 54 ALA C . 19327 1 399 . 1 1 33 33 ALA N N 15 123.542 0.20 . 1 . . . . A 54 ALA N . 19327 1 400 . 1 1 34 34 ARG H H 1 7.869 0.02 . 1 . . . . A 55 ARG H . 19327 1 401 . 1 1 34 34 ARG HA H 1 3.742 0.02 . 1 . . . . A 55 ARG HA . 19327 1 402 . 1 1 34 34 ARG HB2 H 1 1.972 0.02 . 1 . . . . A 55 ARG HB2 . 19327 1 403 . 1 1 34 34 ARG HB3 H 1 1.920 0.02 . 1 . . . . A 55 ARG HB3 . 19327 1 404 . 1 1 34 34 ARG HG2 H 1 1.805 0.02 . 1 . . . . A 55 ARG HG2 . 19327 1 405 . 1 1 34 34 ARG HG3 H 1 1.469 0.02 . 1 . . . . A 55 ARG HG3 . 19327 1 406 . 1 1 34 34 ARG HD2 H 1 3.251 0.02 . 2 . . . . A 55 ARG HD2 . 19327 1 407 . 1 1 34 34 ARG HD3 H 1 3.200 0.02 . 2 . . . . A 55 ARG HD3 . 19327 1 408 . 1 1 34 34 ARG HE H 1 7.461 0.02 . 1 . . . . A 55 ARG HE . 19327 1 409 . 1 1 34 34 ARG CA C 13 60.301 0.20 . 1 . . . . A 55 ARG CA . 19327 1 410 . 1 1 34 34 ARG CB C 13 30.267 0.20 . 1 . . . . A 55 ARG CB . 19327 1 411 . 1 1 34 34 ARG CG C 13 28.346 0.20 . 1 . . . . A 55 ARG CG . 19327 1 412 . 1 1 34 34 ARG CD C 13 43.620 0.20 . 1 . . . . A 55 ARG CD . 19327 1 413 . 1 1 34 34 ARG C C 13 177.526 0.20 . 1 . . . . A 55 ARG C . 19327 1 414 . 1 1 34 34 ARG N N 15 117.281 0.20 . 1 . . . . A 55 ARG N . 19327 1 415 . 1 1 34 34 ARG NE N 15 83.920 0.20 . 1 . . . . A 55 ARG NE . 19327 1 416 . 1 1 35 35 GLU H H 1 7.638 0.02 . 1 . . . . A 56 GLU H . 19327 1 417 . 1 1 35 35 GLU HA H 1 4.009 0.02 . 1 . . . . A 56 GLU HA . 19327 1 418 . 1 1 35 35 GLU HB2 H 1 2.132 0.02 . 1 . . . . A 56 GLU HB2 . 19327 1 419 . 1 1 35 35 GLU HB3 H 1 2.132 0.02 . 1 . . . . A 56 GLU HB3 . 19327 1 420 . 1 1 35 35 GLU HG2 H 1 2.534 0.02 . 2 . . . . A 56 GLU HG2 . 19327 1 421 . 1 1 35 35 GLU HG3 H 1 2.420 0.02 . 2 . . . . A 56 GLU HG3 . 19327 1 422 . 1 1 35 35 GLU CA C 13 58.840 0.20 . 1 . . . . A 56 GLU CA . 19327 1 423 . 1 1 35 35 GLU CB C 13 28.690 0.20 . 1 . . . . A 56 GLU CB . 19327 1 424 . 1 1 35 35 GLU CG C 13 34.969 0.20 . 1 . . . . A 56 GLU CG . 19327 1 425 . 1 1 35 35 GLU C C 13 178.755 0.20 . 1 . . . . A 56 GLU C . 19327 1 426 . 1 1 35 35 GLU N N 15 116.048 0.20 . 1 . . . . A 56 GLU N . 19327 1 427 . 1 1 36 36 ASP H H 1 8.126 0.02 . 1 . . . . A 57 ASP H . 19327 1 428 . 1 1 36 36 ASP HA H 1 4.384 0.02 . 1 . . . . A 57 ASP HA . 19327 1 429 . 1 1 36 36 ASP HB2 H 1 2.782 0.02 . 2 . . . . A 57 ASP HB2 . 19327 1 430 . 1 1 36 36 ASP HB3 H 1 2.696 0.02 . 2 . . . . A 57 ASP HB3 . 19327 1 431 . 1 1 36 36 ASP CA C 13 57.474 0.20 . 1 . . . . A 57 ASP CA . 19327 1 432 . 1 1 36 36 ASP CB C 13 42.532 0.20 . 1 . . . . A 57 ASP CB . 19327 1 433 . 1 1 36 36 ASP C C 13 42.532 0.20 . 1 . . . . A 57 ASP C . 19327 1 434 . 1 1 36 36 ASP N N 15 120.238 0.20 . 1 . . . . A 57 ASP N . 19327 1 435 . 1 1 37 37 LEU H H 1 8.172 0.02 . 1 . . . . A 58 LEU H . 19327 1 436 . 1 1 37 37 LEU HA H 1 3.861 0.02 . 1 . . . . A 58 LEU HA . 19327 1 437 . 1 1 37 37 LEU HB2 H 1 1.915 0.02 . 1 . . . . A 58 LEU HB2 . 19327 1 438 . 1 1 37 37 LEU HB3 H 1 1.082 0.02 . 1 . . . . A 58 LEU HB3 . 19327 1 439 . 1 1 37 37 LEU HG H 1 1.800 0.02 . 1 . . . . A 58 LEU HG . 19327 1 440 . 1 1 37 37 LEU HD11 H 1 0.580 0.02 . 1 . . . . A 58 LEU HD11 . 19327 1 441 . 1 1 37 37 LEU HD12 H 1 0.580 0.02 . 1 . . . . A 58 LEU HD12 . 19327 1 442 . 1 1 37 37 LEU HD13 H 1 0.580 0.02 . 1 . . . . A 58 LEU HD13 . 19327 1 443 . 1 1 37 37 LEU HD21 H 1 0.530 0.02 . 1 . . . . A 58 LEU HD21 . 19327 1 444 . 1 1 37 37 LEU HD22 H 1 0.530 0.02 . 1 . . . . A 58 LEU HD22 . 19327 1 445 . 1 1 37 37 LEU HD23 H 1 0.530 0.02 . 1 . . . . A 58 LEU HD23 . 19327 1 446 . 1 1 37 37 LEU CA C 13 57.596 0.20 . 1 . . . . A 58 LEU CA . 19327 1 447 . 1 1 37 37 LEU CB C 13 41.614 0.20 . 1 . . . . A 58 LEU CB . 19327 1 448 . 1 1 37 37 LEU CG C 13 26.179 0.20 . 1 . . . . A 58 LEU CG . 19327 1 449 . 1 1 37 37 LEU CD1 C 13 26.004 0.20 . 1 . . . . A 58 LEU CD1 . 19327 1 450 . 1 1 37 37 LEU CD2 C 13 22.431 0.20 . 1 . . . . A 58 LEU CD2 . 19327 1 451 . 1 1 37 37 LEU C C 13 178.767 0.20 . 1 . . . . A 58 LEU C . 19327 1 452 . 1 1 37 37 LEU N N 15 117.410 0.20 . 1 . . . . A 58 LEU N . 19327 1 453 . 1 1 38 38 ILE H H 1 8.028 0.02 . 1 . . . . A 59 ILE H . 19327 1 454 . 1 1 38 38 ILE HA H 1 3.303 0.02 . 1 . . . . A 59 ILE HA . 19327 1 455 . 1 1 38 38 ILE HB H 1 1.869 0.02 . 1 . . . . A 59 ILE HB . 19327 1 456 . 1 1 38 38 ILE HG12 H 1 0.854 0.02 . 1 . . . . A 59 ILE HG12 . 19327 1 457 . 1 1 38 38 ILE HG13 H 1 1.698 0.02 . 1 . . . . A 59 ILE HG13 . 19327 1 458 . 1 1 38 38 ILE HG21 H 1 0.891 0.02 . 1 . . . . A 59 ILE HG21 . 19327 1 459 . 1 1 38 38 ILE HG22 H 1 0.891 0.02 . 1 . . . . A 59 ILE HG22 . 19327 1 460 . 1 1 38 38 ILE HG23 H 1 0.891 0.02 . 1 . . . . A 59 ILE HG23 . 19327 1 461 . 1 1 38 38 ILE HD11 H 1 0.808 0.02 . 1 . . . . A 59 ILE HD11 . 19327 1 462 . 1 1 38 38 ILE HD12 H 1 0.808 0.02 . 1 . . . . A 59 ILE HD12 . 19327 1 463 . 1 1 38 38 ILE HD13 H 1 0.808 0.02 . 1 . . . . A 59 ILE HD13 . 19327 1 464 . 1 1 38 38 ILE CA C 13 65.757 0.20 . 1 . . . . A 59 ILE CA . 19327 1 465 . 1 1 38 38 ILE CB C 13 37.563 0.20 . 1 . . . . A 59 ILE CB . 19327 1 466 . 1 1 38 38 ILE CG1 C 13 29.743 0.20 . 1 . . . . A 59 ILE CG1 . 19327 1 467 . 1 1 38 38 ILE CG2 C 13 17.825 0.20 . 1 . . . . A 59 ILE CG2 . 19327 1 468 . 1 1 38 38 ILE CD1 C 13 12.994 0.20 . 1 . . . . A 59 ILE CD1 . 19327 1 469 . 1 1 38 38 ILE C C 13 177.234 0.20 . 1 . . . . A 59 ILE C . 19327 1 470 . 1 1 38 38 ILE N N 15 118.841 0.20 . 1 . . . . A 59 ILE N . 19327 1 471 . 1 1 39 39 LYS H H 1 7.895 0.02 . 1 . . . . A 60 LYS H . 19327 1 472 . 1 1 39 39 LYS HA H 1 4.094 0.02 . 1 . . . . A 60 LYS HA . 19327 1 473 . 1 1 39 39 LYS HB2 H 1 1.978 0.02 . 1 . . . . A 60 LYS HB2 . 19327 1 474 . 1 1 39 39 LYS HB3 H 1 1.978 0.02 . 1 . . . . A 60 LYS HB3 . 19327 1 475 . 1 1 39 39 LYS HG2 H 1 1.617 0.02 . 2 . . . . A 60 LYS HG2 . 19327 1 476 . 1 1 39 39 LYS HG3 H 1 1.430 0.02 . 2 . . . . A 60 LYS HG3 . 19327 1 477 . 1 1 39 39 LYS HD2 H 1 1.737 0.02 . 1 . . . . A 60 LYS HD2 . 19327 1 478 . 1 1 39 39 LYS HD3 H 1 1.737 0.02 . 1 . . . . A 60 LYS HD3 . 19327 1 479 . 1 1 39 39 LYS HE2 H 1 3.002 0.02 . 1 . . . . A 60 LYS HE2 . 19327 1 480 . 1 1 39 39 LYS HE3 H 1 3.002 0.02 . 1 . . . . A 60 LYS HE3 . 19327 1 481 . 1 1 39 39 LYS CA C 13 59.753 0.20 . 1 . . . . A 60 LYS CA . 19327 1 482 . 1 1 39 39 LYS CB C 13 32.135 0.20 . 1 . . . . A 60 LYS CB . 19327 1 483 . 1 1 39 39 LYS CG C 13 25.085 0.20 . 1 . . . . A 60 LYS CG . 19327 1 484 . 1 1 39 39 LYS CD C 13 29.359 0.20 . 1 . . . . A 60 LYS CD . 19327 1 485 . 1 1 39 39 LYS CE C 13 42.072 0.20 . 1 . . . . A 60 LYS CE . 19327 1 486 . 1 1 39 39 LYS C C 13 180.277 0.20 . 1 . . . . A 60 LYS C . 19327 1 487 . 1 1 39 39 LYS N N 15 119.525 0.20 . 1 . . . . A 60 LYS N . 19327 1 488 . 1 1 40 40 LYS H H 1 8.086 0.02 . 1 . . . . A 61 LYS H . 19327 1 489 . 1 1 40 40 LYS HA H 1 3.987 0.02 . 1 . . . . A 61 LYS HA . 19327 1 490 . 1 1 40 40 LYS HB2 H 1 1.830 0.02 . 1 . . . . A 61 LYS HB2 . 19327 1 491 . 1 1 40 40 LYS HB3 H 1 1.695 0.02 . 1 . . . . A 61 LYS HB3 . 19327 1 492 . 1 1 40 40 LYS HG2 H 1 1.415 0.02 . 1 . . . . A 61 LYS HG2 . 19327 1 493 . 1 1 40 40 LYS HG3 H 1 1.636 0.02 . 1 . . . . A 61 LYS HG3 . 19327 1 494 . 1 1 40 40 LYS HD2 H 1 1.630 0.02 . 2 . . . . A 61 LYS HD2 . 19327 1 495 . 1 1 40 40 LYS HD3 H 1 1.467 0.02 . 2 . . . . A 61 LYS HD3 . 19327 1 496 . 1 1 40 40 LYS HE2 H 1 3.088 0.02 . 2 . . . . A 61 LYS HE2 . 19327 1 497 . 1 1 40 40 LYS HE3 H 1 3.009 0.02 . 2 . . . . A 61 LYS HE3 . 19327 1 498 . 1 1 40 40 LYS CA C 13 59.274 0.20 . 1 . . . . A 61 LYS CA . 19327 1 499 . 1 1 40 40 LYS CB C 13 33.544 0.20 . 1 . . . . A 61 LYS CB . 19327 1 500 . 1 1 40 40 LYS CG C 13 26.757 0.20 . 1 . . . . A 61 LYS CG . 19327 1 501 . 1 1 40 40 LYS CD C 13 29.269 0.20 . 1 . . . . A 61 LYS CD . 19327 1 502 . 1 1 40 40 LYS CE C 13 42.114 0.20 . 1 . . . . A 61 LYS CE . 19327 1 503 . 1 1 40 40 LYS C C 13 179.364 0.20 . 1 . . . . A 61 LYS C . 19327 1 504 . 1 1 40 40 LYS N N 15 119.257 0.20 . 1 . . . . A 61 LYS N . 19327 1 505 . 1 1 41 41 ALA H H 1 8.489 0.02 . 1 . . . . A 62 ALA H . 19327 1 506 . 1 1 41 41 ALA HA H 1 3.773 0.02 . 1 . . . . A 62 ALA HA . 19327 1 507 . 1 1 41 41 ALA HB1 H 1 1.197 0.02 . 1 . . . . A 62 ALA HB1 . 19327 1 508 . 1 1 41 41 ALA HB2 H 1 1.197 0.02 . 1 . . . . A 62 ALA HB2 . 19327 1 509 . 1 1 41 41 ALA HB3 H 1 1.197 0.02 . 1 . . . . A 62 ALA HB3 . 19327 1 510 . 1 1 41 41 ALA CA C 13 55.037 0.20 . 1 . . . . A 62 ALA CA . 19327 1 511 . 1 1 41 41 ALA CB C 13 19.102 0.20 . 1 . . . . A 62 ALA CB . 19327 1 512 . 1 1 41 41 ALA C C 13 179.773 0.20 . 1 . . . . A 62 ALA C . 19327 1 513 . 1 1 41 41 ALA N N 15 122.326 0.20 . 1 . . . . A 62 ALA N . 19327 1 514 . 1 1 42 42 ASP H H 1 8.855 0.02 . 1 . . . . A 63 ASP H . 19327 1 515 . 1 1 42 42 ASP HA H 1 4.595 0.02 . 1 . . . . A 63 ASP HA . 19327 1 516 . 1 1 42 42 ASP HB2 H 1 2.883 0.02 . 2 . . . . A 63 ASP HB2 . 19327 1 517 . 1 1 42 42 ASP HB3 H 1 2.705 0.02 . 2 . . . . A 63 ASP HB3 . 19327 1 518 . 1 1 42 42 ASP CA C 13 57.080 0.20 . 1 . . . . A 63 ASP CA . 19327 1 519 . 1 1 42 42 ASP CB C 13 39.029 0.20 . 1 . . . . A 63 ASP CB . 19327 1 520 . 1 1 42 42 ASP C C 13 180.757 0.20 . 1 . . . . A 63 ASP C . 19327 1 521 . 1 1 42 42 ASP N N 15 120.381 0.20 . 1 . . . . A 63 ASP N . 19327 1 522 . 1 1 43 43 GLU H H 1 8.053 0.02 . 1 . . . . A 64 GLU H . 19327 1 523 . 1 1 43 43 GLU HA H 1 4.077 0.02 . 1 . . . . A 64 GLU HA . 19327 1 524 . 1 1 43 43 GLU HB2 H 1 2.233 0.02 . 1 . . . . A 64 GLU HB2 . 19327 1 525 . 1 1 43 43 GLU HB3 H 1 2.132 0.02 . 1 . . . . A 64 GLU HB3 . 19327 1 526 . 1 1 43 43 GLU HG2 H 1 2.360 0.02 . 2 . . . . A 64 GLU HG2 . 19327 1 527 . 1 1 43 43 GLU HG3 H 1 2.566 0.02 . 2 . . . . A 64 GLU HG3 . 19327 1 528 . 1 1 43 43 GLU CA C 13 58.895 0.20 . 1 . . . . A 64 GLU CA . 19327 1 529 . 1 1 43 43 GLU CB C 13 29.124 0.20 . 1 . . . . A 64 GLU CB . 19327 1 530 . 1 1 43 43 GLU CG C 13 35.804 0.20 . 1 . . . . A 64 GLU CG . 19327 1 531 . 1 1 43 43 GLU C C 13 178.146 0.20 . 1 . . . . A 64 GLU C . 19327 1 532 . 1 1 43 43 GLU N N 15 121.428 0.20 . 1 . . . . A 64 GLU N . 19327 1 533 . 1 1 44 44 LYS H H 1 7.186 0.02 . 1 . . . . A 65 LYS H . 19327 1 534 . 1 1 44 44 LYS HA H 1 4.320 0.02 . 1 . . . . A 65 LYS HA . 19327 1 535 . 1 1 44 44 LYS HB2 H 1 1.661 0.02 . 1 . . . . A 65 LYS HB2 . 19327 1 536 . 1 1 44 44 LYS HB3 H 1 1.944 0.02 . 1 . . . . A 65 LYS HB3 . 19327 1 537 . 1 1 44 44 LYS HG2 H 1 1.380 0.02 . 2 . . . . A 65 LYS HG2 . 19327 1 538 . 1 1 44 44 LYS HG3 H 1 1.529 0.02 . 2 . . . . A 65 LYS HG3 . 19327 1 539 . 1 1 44 44 LYS HD2 H 1 1.497 0.02 . 2 . . . . A 65 LYS HD2 . 19327 1 540 . 1 1 44 44 LYS HD3 H 1 1.614 0.02 . 2 . . . . A 65 LYS HD3 . 19327 1 541 . 1 1 44 44 LYS HE2 H 1 2.958 0.02 . 2 . . . . A 65 LYS HE2 . 19327 1 542 . 1 1 44 44 LYS HE3 H 1 2.997 0.02 . 2 . . . . A 65 LYS HE3 . 19327 1 543 . 1 1 44 44 LYS CA C 13 54.830 0.20 . 1 . . . . A 65 LYS CA . 19327 1 544 . 1 1 44 44 LYS CB C 13 33.019 0.20 . 1 . . . . A 65 LYS CB . 19327 1 545 . 1 1 44 44 LYS CG C 13 24.869 0.20 . 1 . . . . A 65 LYS CG . 19327 1 546 . 1 1 44 44 LYS CD C 13 28.367 0.20 . 1 . . . . A 65 LYS CD . 19327 1 547 . 1 1 44 44 LYS CE C 13 42.092 0.20 . 1 . . . . A 65 LYS CE . 19327 1 548 . 1 1 44 44 LYS C C 13 176.169 0.20 . 1 . . . . A 65 LYS C . 19327 1 549 . 1 1 44 44 LYS N N 15 115.778 0.20 . 1 . . . . A 65 LYS N . 19327 1 550 . 1 1 45 45 GLY H H 1 7.873 0.02 . 1 . . . . A 66 GLY H . 19327 1 551 . 1 1 45 45 GLY HA2 H 1 3.864 0.02 . 2 . . . . A 66 GLY HA2 . 19327 1 552 . 1 1 45 45 GLY HA3 H 1 3.977 0.02 . 2 . . . . A 66 GLY HA3 . 19327 1 553 . 1 1 45 45 GLY CA C 13 45.822 0.20 . 1 . . . . A 66 GLY CA . 19327 1 554 . 1 1 45 45 GLY C C 13 174.413 0.20 . 1 . . . . A 66 GLY C . 19327 1 555 . 1 1 45 45 GLY N N 15 107.578 0.20 . 1 . . . . A 66 GLY N . 19327 1 556 . 1 1 46 46 ALA H H 1 7.927 0.02 . 1 . . . . A 67 ALA H . 19327 1 557 . 1 1 46 46 ALA HA H 1 4.022 0.02 . 1 . . . . A 67 ALA HA . 19327 1 558 . 1 1 46 46 ALA HB1 H 1 1.266 0.02 . 1 . . . . A 67 ALA HB1 . 19327 1 559 . 1 1 46 46 ALA HB2 H 1 1.266 0.02 . 1 . . . . A 67 ALA HB2 . 19327 1 560 . 1 1 46 46 ALA HB3 H 1 1.266 0.02 . 1 . . . . A 67 ALA HB3 . 19327 1 561 . 1 1 46 46 ALA CA C 13 51.699 0.20 . 1 . . . . A 67 ALA CA . 19327 1 562 . 1 1 46 46 ALA CB C 13 21.210 0.20 . 1 . . . . A 67 ALA CB . 19327 1 563 . 1 1 46 46 ALA C C 13 175.771 0.20 . 1 . . . . A 67 ALA C . 19327 1 564 . 1 1 46 46 ALA N N 15 119.025 0.20 . 1 . . . . A 67 ALA N . 19327 1 565 . 1 1 47 47 ASP H H 1 8.793 0.02 . 1 . . . . A 68 ASP H . 19327 1 566 . 1 1 47 47 ASP HA H 1 5.071 0.02 . 1 . . . . A 68 ASP HA . 19327 1 567 . 1 1 47 47 ASP HB2 H 1 3.247 0.02 . 1 . . . . A 68 ASP HB2 . 19327 1 568 . 1 1 47 47 ASP HB3 H 1 2.669 0.02 . 1 . . . . A 68 ASP HB3 . 19327 1 569 . 1 1 47 47 ASP CA C 13 56.601 0.20 . 1 . . . . A 68 ASP CA . 19327 1 570 . 1 1 47 47 ASP CB C 13 45.008 0.20 . 1 . . . . A 68 ASP CB . 19327 1 571 . 1 1 47 47 ASP C C 13 177.117 0.20 . 1 . . . . A 68 ASP C . 19327 1 572 . 1 1 47 47 ASP N N 15 116.686 0.20 . 1 . . . . A 68 ASP N . 19327 1 573 . 1 1 48 48 VAL H H 1 8.076 0.02 . 1 . . . . A 69 VAL H . 19327 1 574 . 1 1 48 48 VAL HA H 1 5.130 0.02 . 1 . . . . A 69 VAL HA . 19327 1 575 . 1 1 48 48 VAL HB H 1 1.436 0.02 . 1 . . . . A 69 VAL HB . 19327 1 576 . 1 1 48 48 VAL HG11 H 1 0.575 0.02 . 1 . . . . A 69 VAL HG11 . 19327 1 577 . 1 1 48 48 VAL HG12 H 1 0.575 0.02 . 1 . . . . A 69 VAL HG12 . 19327 1 578 . 1 1 48 48 VAL HG13 H 1 0.575 0.02 . 1 . . . . A 69 VAL HG13 . 19327 1 579 . 1 1 48 48 VAL HG21 H 1 0.715 0.02 . 1 . . . . A 69 VAL HG21 . 19327 1 580 . 1 1 48 48 VAL HG22 H 1 0.715 0.02 . 1 . . . . A 69 VAL HG22 . 19327 1 581 . 1 1 48 48 VAL HG23 H 1 0.715 0.02 . 1 . . . . A 69 VAL HG23 . 19327 1 582 . 1 1 48 48 VAL CA C 13 60.430 0.20 . 1 . . . . A 69 VAL CA . 19327 1 583 . 1 1 48 48 VAL CB C 13 37.603 0.20 . 1 . . . . A 69 VAL CB . 19327 1 584 . 1 1 48 48 VAL CG1 C 13 22.506 0.20 . 1 . . . . A 69 VAL CG1 . 19327 1 585 . 1 1 48 48 VAL CG2 C 13 23.522 0.20 . 1 . . . . A 69 VAL CG2 . 19327 1 586 . 1 1 48 48 VAL C C 13 173.044 0.20 . 1 . . . . A 69 VAL C . 19327 1 587 . 1 1 48 48 VAL N N 15 118.623 0.20 . 1 . . . . A 69 VAL N . 19327 1 588 . 1 1 49 49 VAL H H 1 8.724 0.02 . 1 . . . . A 70 VAL H . 19327 1 589 . 1 1 49 49 VAL HA H 1 4.560 0.02 . 1 . . . . A 70 VAL HA . 19327 1 590 . 1 1 49 49 VAL HB H 1 1.738 0.02 . 1 . . . . A 70 VAL HB . 19327 1 591 . 1 1 49 49 VAL HG11 H 1 0.618 0.02 . 1 . . . . A 70 VAL HG11 . 19327 1 592 . 1 1 49 49 VAL HG12 H 1 0.618 0.02 . 1 . . . . A 70 VAL HG12 . 19327 1 593 . 1 1 49 49 VAL HG13 H 1 0.618 0.02 . 1 . . . . A 70 VAL HG13 . 19327 1 594 . 1 1 49 49 VAL HG21 H 1 0.553 0.02 . 1 . . . . A 70 VAL HG21 . 19327 1 595 . 1 1 49 49 VAL HG22 H 1 0.553 0.02 . 1 . . . . A 70 VAL HG22 . 19327 1 596 . 1 1 49 49 VAL HG23 H 1 0.553 0.02 . 1 . . . . A 70 VAL HG23 . 19327 1 597 . 1 1 49 49 VAL CA C 13 59.943 0.20 . 1 . . . . A 70 VAL CA . 19327 1 598 . 1 1 49 49 VAL CB C 13 34.433 0.20 . 1 . . . . A 70 VAL CB . 19327 1 599 . 1 1 49 49 VAL CG1 C 13 21.718 0.20 . 1 . . . . A 70 VAL CG1 . 19327 1 600 . 1 1 49 49 VAL CG2 C 13 22.158 0.20 . 1 . . . . A 70 VAL CG2 . 19327 1 601 . 1 1 49 49 VAL C C 13 173.336 0.20 . 1 . . . . A 70 VAL C . 19327 1 602 . 1 1 49 49 VAL N N 15 127.358 0.20 . 1 . . . . A 70 VAL N . 19327 1 603 . 1 1 50 50 VAL H H 1 8.891 0.02 . 1 . . . . A 71 VAL H . 19327 1 604 . 1 1 50 50 VAL HA H 1 4.556 0.02 . 1 . . . . A 71 VAL HA . 19327 1 605 . 1 1 50 50 VAL HB H 1 1.794 0.02 . 1 . . . . A 71 VAL HB . 19327 1 606 . 1 1 50 50 VAL HG11 H 1 0.759 0.02 . 1 . . . . A 71 VAL HG11 . 19327 1 607 . 1 1 50 50 VAL HG12 H 1 0.759 0.02 . 1 . . . . A 71 VAL HG12 . 19327 1 608 . 1 1 50 50 VAL HG13 H 1 0.759 0.02 . 1 . . . . A 71 VAL HG13 . 19327 1 609 . 1 1 50 50 VAL HG21 H 1 0.025 0.02 . 1 . . . . A 71 VAL HG21 . 19327 1 610 . 1 1 50 50 VAL HG22 H 1 0.025 0.02 . 1 . . . . A 71 VAL HG22 . 19327 1 611 . 1 1 50 50 VAL HG23 H 1 0.025 0.02 . 1 . . . . A 71 VAL HG23 . 19327 1 612 . 1 1 50 50 VAL CA C 13 60.852 0.20 . 1 . . . . A 71 VAL CA . 19327 1 613 . 1 1 50 50 VAL CB C 13 34.062 0.20 . 1 . . . . A 71 VAL CB . 19327 1 614 . 1 1 50 50 VAL CG1 C 13 20.445 0.20 . 1 . . . . A 71 VAL CG1 . 19327 1 615 . 1 1 50 50 VAL CG2 C 13 20.712 0.20 . 1 . . . . A 71 VAL CG2 . 19327 1 616 . 1 1 50 50 VAL C C 13 175.970 0.20 . 1 . . . . A 71 VAL C . 19327 1 617 . 1 1 50 50 VAL N N 15 126.739 0.20 . 1 . . . . A 71 VAL N . 19327 1 618 . 1 1 51 51 LEU H H 1 8.802 0.02 . 1 . . . . A 72 LEU H . 19327 1 619 . 1 1 51 51 LEU HA H 1 4.448 0.02 . 1 . . . . A 72 LEU HA . 19327 1 620 . 1 1 51 51 LEU HB2 H 1 1.739 0.02 . 1 . . . . A 72 LEU HB2 . 19327 1 621 . 1 1 51 51 LEU HB3 H 1 1.636 0.02 . 1 . . . . A 72 LEU HB3 . 19327 1 622 . 1 1 51 51 LEU HG H 1 1.680 0.02 . 1 . . . . A 72 LEU HG . 19327 1 623 . 1 1 51 51 LEU HD11 H 1 0.851 0.02 . 1 . . . . A 72 LEU HD11 . 19327 1 624 . 1 1 51 51 LEU HD12 H 1 0.851 0.02 . 1 . . . . A 72 LEU HD12 . 19327 1 625 . 1 1 51 51 LEU HD13 H 1 0.851 0.02 . 1 . . . . A 72 LEU HD13 . 19327 1 626 . 1 1 51 51 LEU HD21 H 1 0.765 0.02 . 1 . . . . A 72 LEU HD21 . 19327 1 627 . 1 1 51 51 LEU HD22 H 1 0.765 0.02 . 1 . . . . A 72 LEU HD22 . 19327 1 628 . 1 1 51 51 LEU HD23 H 1 0.765 0.02 . 1 . . . . A 72 LEU HD23 . 19327 1 629 . 1 1 51 51 LEU CA C 13 55.720 0.20 . 1 . . . . A 72 LEU CA . 19327 1 630 . 1 1 51 51 LEU CB C 13 41.631 0.20 . 1 . . . . A 72 LEU CB . 19327 1 631 . 1 1 51 51 LEU CG C 13 27.748 0.20 . 1 . . . . A 72 LEU CG . 19327 1 632 . 1 1 51 51 LEU CD1 C 13 25.361 0.20 . 1 . . . . A 72 LEU CD1 . 19327 1 633 . 1 1 51 51 LEU CD2 C 13 23.512 0.20 . 1 . . . . A 72 LEU CD2 . 19327 1 634 . 1 1 51 51 LEU C C 13 178.158 0.20 . 1 . . . . A 72 LEU C . 19327 1 635 . 1 1 51 51 LEU N N 15 127.581 0.20 . 1 . . . . A 72 LEU N . 19327 1 636 . 1 1 52 52 THR H H 1 8.631 0.02 . 1 . . . . A 73 THR H . 19327 1 637 . 1 1 52 52 THR HA H 1 4.420 0.02 . 1 . . . . A 73 THR HA . 19327 1 638 . 1 1 52 52 THR HB H 1 4.346 0.02 . 1 . . . . A 73 THR HB . 19327 1 639 . 1 1 52 52 THR HG21 H 1 1.188 0.02 . 1 . . . . A 73 THR HG21 . 19327 1 640 . 1 1 52 52 THR HG22 H 1 1.188 0.02 . 1 . . . . A 73 THR HG22 . 19327 1 641 . 1 1 52 52 THR HG23 H 1 1.188 0.02 . 1 . . . . A 73 THR HG23 . 19327 1 642 . 1 1 52 52 THR CA C 13 61.516 0.20 . 1 . . . . A 73 THR CA . 19327 1 643 . 1 1 52 52 THR CB C 13 69.462 0.20 . 1 . . . . A 73 THR CB . 19327 1 644 . 1 1 52 52 THR CG2 C 13 21.934 0.20 . 1 . . . . A 73 THR CG2 . 19327 1 645 . 1 1 52 52 THR C C 13 174.951 0.20 . 1 . . . . A 73 THR C . 19327 1 646 . 1 1 52 52 THR N N 15 114.207 0.20 . 1 . . . . A 73 THR N . 19327 1 647 . 1 1 53 53 SER H H 1 8.137 0.02 . 1 . . . . A 74 SER H . 19327 1 648 . 1 1 53 53 SER HA H 1 4.542 0.02 . 1 . . . . A 74 SER HA . 19327 1 649 . 1 1 53 53 SER HB2 H 1 4.013 0.02 . 1 . . . . A 74 SER HB2 . 19327 1 650 . 1 1 53 53 SER HB3 H 1 4.013 0.02 . 1 . . . . A 74 SER HB3 . 19327 1 651 . 1 1 53 53 SER CA C 13 58.066 0.20 . 1 . . . . A 74 SER CA . 19327 1 652 . 1 1 53 53 SER CB C 13 63.962 0.20 . 1 . . . . A 74 SER CB . 19327 1 653 . 1 1 53 53 SER C C 13 175.057 0.20 . 1 . . . . A 74 SER C . 19327 1 654 . 1 1 53 53 SER N N 15 116.164 0.20 . 1 . . . . A 74 SER N . 19327 1 655 . 1 1 54 54 GLY H H 1 8.574 0.02 . 1 . . . . A 75 GLY H . 19327 1 656 . 1 1 54 54 GLY HA2 H 1 4.034 0.02 . 1 . . . . A 75 GLY HA2 . 19327 1 657 . 1 1 54 54 GLY HA3 H 1 4.034 0.02 . 1 . . . . A 75 GLY HA3 . 19327 1 658 . 1 1 54 54 GLY CA C 13 45.284 0.20 . 1 . . . . A 75 GLY CA . 19327 1 659 . 1 1 54 54 GLY C C 13 174.237 0.20 . 1 . . . . A 75 GLY C . 19327 1 660 . 1 1 54 54 GLY N N 15 110.048 0.20 . 1 . . . . A 75 GLY N . 19327 1 661 . 1 1 55 55 GLN H H 1 8.393 0.02 . 1 . . . . A 76 GLN H . 19327 1 662 . 1 1 55 55 GLN HA H 1 4.499 0.02 . 1 . . . . A 76 GLN HA . 19327 1 663 . 1 1 55 55 GLN HB2 H 1 2.198 0.02 . 2 . . . . A 76 GLN HB2 . 19327 1 664 . 1 1 55 55 GLN HB3 H 1 2.018 0.02 . 2 . . . . A 76 GLN HB3 . 19327 1 665 . 1 1 55 55 GLN HG2 H 1 2.359 0.02 . 1 . . . . A 76 GLN HG2 . 19327 1 666 . 1 1 55 55 GLN HG3 H 1 2.359 0.02 . 1 . . . . A 76 GLN HG3 . 19327 1 667 . 1 1 55 55 GLN HE21 H 1 7.522 0.02 . 1 . . . . A 76 GLN HE21 . 19327 1 668 . 1 1 55 55 GLN HE22 H 1 6.845 0.02 . 1 . . . . A 76 GLN HE22 . 19327 1 669 . 1 1 55 55 GLN CA C 13 55.969 0.20 . 1 . . . . A 76 GLN CA . 19327 1 670 . 1 1 55 55 GLN CB C 13 29.761 0.20 . 1 . . . . A 76 GLN CB . 19327 1 671 . 1 1 55 55 GLN CG C 13 34.036 0.20 . 1 . . . . A 76 GLN CG . 19327 1 672 . 1 1 55 55 GLN C C 13 176.239 0.20 . 1 . . . . A 76 GLN C . 19327 1 673 . 1 1 55 55 GLN N N 15 119.520 0.20 . 1 . . . . A 76 GLN N . 19327 1 674 . 1 1 55 55 GLN NE2 N 15 111.980 0.20 . 1 . . . . A 76 GLN NE2 . 19327 1 675 . 1 1 56 56 THR H H 1 8.105 0.02 . 1 . . . . A 77 THR H . 19327 1 676 . 1 1 56 56 THR HA H 1 4.432 0.02 . 1 . . . . A 77 THR HA . 19327 1 677 . 1 1 56 56 THR HB H 1 4.342 0.02 . 1 . . . . A 77 THR HB . 19327 1 678 . 1 1 56 56 THR HG21 H 1 1.184 0.02 . 1 . . . . A 77 THR HG21 . 19327 1 679 . 1 1 56 56 THR HG22 H 1 1.184 0.02 . 1 . . . . A 77 THR HG22 . 19327 1 680 . 1 1 56 56 THR HG23 H 1 1.184 0.02 . 1 . . . . A 77 THR HG23 . 19327 1 681 . 1 1 56 56 THR CA C 13 61.408 0.20 . 1 . . . . A 77 THR CA . 19327 1 682 . 1 1 56 56 THR CB C 13 69.786 0.20 . 1 . . . . A 77 THR CB . 19327 1 683 . 1 1 56 56 THR CG2 C 13 21.672 0.20 . 1 . . . . A 77 THR CG2 . 19327 1 684 . 1 1 56 56 THR C C 13 174.483 0.20 . 1 . . . . A 77 THR C . 19327 1 685 . 1 1 56 56 THR N N 15 113.213 0.20 . 1 . . . . A 77 THR N . 19327 1 686 . 1 1 57 57 GLU H H 1 8.454 0.02 . 1 . . . . A 78 GLU H . 19327 1 687 . 1 1 57 57 GLU HA H 1 4.248 0.02 . 1 . . . . A 78 GLU HA . 19327 1 688 . 1 1 57 57 GLU HB2 H 1 2.124 0.02 . 2 . . . . A 78 GLU HB2 . 19327 1 689 . 1 1 57 57 GLU HB3 H 1 1.955 0.02 . 2 . . . . A 78 GLU HB3 . 19327 1 690 . 1 1 57 57 GLU HG2 H 1 2.312 0.02 . 1 . . . . A 78 GLU HG2 . 19327 1 691 . 1 1 57 57 GLU HG3 H 1 2.312 0.02 . 1 . . . . A 78 GLU HG3 . 19327 1 692 . 1 1 57 57 GLU CA C 13 56.990 0.20 . 1 . . . . A 78 GLU CA . 19327 1 693 . 1 1 57 57 GLU CB C 13 29.789 0.20 . 1 . . . . A 78 GLU CB . 19327 1 694 . 1 1 57 57 GLU CG C 13 35.823 0.20 . 1 . . . . A 78 GLU CG . 19327 1 695 . 1 1 57 57 GLU C C 13 175.946 0.20 . 1 . . . . A 78 GLU C . 19327 1 696 . 1 1 57 57 GLU N N 15 120.912 0.20 . 1 . . . . A 78 GLU N . 19327 1 697 . 1 1 58 58 ASN H H 1 8.329 0.02 . 1 . . . . A 79 ASN H . 19327 1 698 . 1 1 58 58 ASN HA H 1 4.605 0.02 . 1 . . . . A 79 ASN HA . 19327 1 699 . 1 1 58 58 ASN HB2 H 1 2.858 0.02 . 2 . . . . A 79 ASN HB2 . 19327 1 700 . 1 1 58 58 ASN HB3 H 1 2.782 0.02 . 2 . . . . A 79 ASN HB3 . 19327 1 701 . 1 1 58 58 ASN HD21 H 1 7.615 0.02 . 1 . . . . A 79 ASN HD21 . 19327 1 702 . 1 1 58 58 ASN HD22 H 1 6.964 0.02 . 1 . . . . A 79 ASN HD22 . 19327 1 703 . 1 1 58 58 ASN CA C 13 53.760 0.20 . 1 . . . . A 79 ASN CA . 19327 1 704 . 1 1 58 58 ASN CB C 13 38.731 0.20 . 1 . . . . A 79 ASN CB . 19327 1 705 . 1 1 58 58 ASN C C 13 174.694 0.20 . 1 . . . . A 79 ASN C . 19327 1 706 . 1 1 58 58 ASN N N 15 117.094 0.20 . 1 . . . . A 79 ASN N . 19327 1 707 . 1 1 58 58 ASN ND2 N 15 112.901 0.20 . 1 . . . . A 79 ASN ND2 . 19327 1 708 . 1 1 59 59 LYS H H 1 7.910 0.02 . 1 . . . . A 80 LYS H . 19327 1 709 . 1 1 59 59 LYS HA H 1 4.307 0.02 . 1 . . . . A 80 LYS HA . 19327 1 710 . 1 1 59 59 LYS HB2 H 1 1.680 0.02 . 1 . . . . A 80 LYS HB2 . 19327 1 711 . 1 1 59 59 LYS HB3 H 1 1.680 0.02 . 1 . . . . A 80 LYS HB3 . 19327 1 712 . 1 1 59 59 LYS HG2 H 1 1.385 0.02 . 2 . . . . A 80 LYS HG2 . 19327 1 713 . 1 1 59 59 LYS HG3 H 1 1.269 0.02 . 2 . . . . A 80 LYS HG3 . 19327 1 714 . 1 1 59 59 LYS HD2 H 1 1.631 0.02 . 1 . . . . A 80 LYS HD2 . 19327 1 715 . 1 1 59 59 LYS HD3 H 1 1.631 0.02 . 1 . . . . A 80 LYS HD3 . 19327 1 716 . 1 1 59 59 LYS HE2 H 1 2.958 0.02 . 1 . . . . A 80 LYS HE2 . 19327 1 717 . 1 1 59 59 LYS HE3 H 1 2.958 0.02 . 1 . . . . A 80 LYS HE3 . 19327 1 718 . 1 1 59 59 LYS CA C 13 56.116 0.20 . 1 . . . . A 80 LYS CA . 19327 1 719 . 1 1 59 59 LYS CB C 13 33.378 0.20 . 1 . . . . A 80 LYS CB . 19327 1 720 . 1 1 59 59 LYS CG C 13 24.902 0.20 . 1 . . . . A 80 LYS CG . 19327 1 721 . 1 1 59 59 LYS CD C 13 29.315 0.20 . 1 . . . . A 80 LYS CD . 19327 1 722 . 1 1 59 59 LYS CE C 13 42.065 0.20 . 1 . . . . A 80 LYS CE . 19327 1 723 . 1 1 59 59 LYS C C 13 175.501 0.20 . 1 . . . . A 80 LYS C . 19327 1 724 . 1 1 59 59 LYS N N 15 118.942 0.20 . 1 . . . . A 80 LYS N . 19327 1 725 . 1 1 60 60 ILE H H 1 8.341 0.02 . 1 . . . . A 81 ILE H . 19327 1 726 . 1 1 60 60 ILE HA H 1 4.306 0.02 . 1 . . . . A 81 ILE HA . 19327 1 727 . 1 1 60 60 ILE HB H 1 1.749 0.02 . 1 . . . . A 81 ILE HB . 19327 1 728 . 1 1 60 60 ILE HG12 H 1 1.375 0.02 . 2 . . . . A 81 ILE HG12 . 19327 1 729 . 1 1 60 60 ILE HG13 H 1 1.051 0.02 . 2 . . . . A 81 ILE HG13 . 19327 1 730 . 1 1 60 60 ILE HG21 H 1 0.766 0.02 . 1 . . . . A 81 ILE HG21 . 19327 1 731 . 1 1 60 60 ILE HG22 H 1 0.766 0.02 . 1 . . . . A 81 ILE HG22 . 19327 1 732 . 1 1 60 60 ILE HG23 H 1 0.766 0.02 . 1 . . . . A 81 ILE HG23 . 19327 1 733 . 1 1 60 60 ILE HD11 H 1 0.809 0.02 . 1 . . . . A 81 ILE HD11 . 19327 1 734 . 1 1 60 60 ILE HD12 H 1 0.809 0.02 . 1 . . . . A 81 ILE HD12 . 19327 1 735 . 1 1 60 60 ILE HD13 H 1 0.809 0.02 . 1 . . . . A 81 ILE HD13 . 19327 1 736 . 1 1 60 60 ILE CA C 13 60.526 0.20 . 1 . . . . A 81 ILE CA . 19327 1 737 . 1 1 60 60 ILE CB C 13 40.050 0.20 . 1 . . . . A 81 ILE CB . 19327 1 738 . 1 1 60 60 ILE CG1 C 13 27.116 0.20 . 1 . . . . A 81 ILE CG1 . 19327 1 739 . 1 1 60 60 ILE CG2 C 13 17.711 0.20 . 1 . . . . A 81 ILE CG2 . 19327 1 740 . 1 1 60 60 ILE CD1 C 13 13.483 0.20 . 1 . . . . A 81 ILE CD1 . 19327 1 741 . 1 1 60 60 ILE C C 13 175.408 0.20 . 1 . . . . A 81 ILE C . 19327 1 742 . 1 1 60 60 ILE N N 15 119.677 0.20 . 1 . . . . A 81 ILE N . 19327 1 743 . 1 1 61 61 HIS H H 1 8.472 0.02 . 1 . . . . A 82 HIS H . 19327 1 744 . 1 1 61 61 HIS HA H 1 4.776 0.02 . 1 . . . . A 82 HIS HA . 19327 1 745 . 1 1 61 61 HIS HB2 H 1 3.276 0.02 . 2 . . . . A 82 HIS HB2 . 19327 1 746 . 1 1 61 61 HIS HB3 H 1 3.123 0.02 . 2 . . . . A 82 HIS HB3 . 19327 1 747 . 1 1 61 61 HIS HD2 H 1 7.270 0.02 . 1 . . . . A 82 HIS HD2 . 19327 1 748 . 1 1 61 61 HIS CA C 13 54.684 0.20 . 1 . . . . A 82 HIS CA . 19327 1 749 . 1 1 61 61 HIS CB C 13 28.930 0.20 . 1 . . . . A 82 HIS CB . 19327 1 750 . 1 1 61 61 HIS CD2 C 13 119.642 0.20 . 1 . . . . A 82 HIS CD2 . 19327 1 751 . 1 1 61 61 HIS C C 13 174.015 0.20 . 1 . . . . A 82 HIS C . 19327 1 752 . 1 1 61 61 HIS N N 15 121.812 0.20 . 1 . . . . A 82 HIS N . 19327 1 753 . 1 1 62 62 GLY H H 1 8.334 0.02 . 1 . . . . A 83 GLY H . 19327 1 754 . 1 1 62 62 GLY HA2 H 1 4.187 0.02 . 1 . . . . A 83 GLY HA2 . 19327 1 755 . 1 1 62 62 GLY HA3 H 1 3.692 0.02 . 1 . . . . A 83 GLY HA3 . 19327 1 756 . 1 1 62 62 GLY CA C 13 45.124 0.20 . 1 . . . . A 83 GLY CA . 19327 1 757 . 1 1 62 62 GLY C C 13 172.903 0.20 . 1 . . . . A 83 GLY C . 19327 1 758 . 1 1 62 62 GLY N N 15 111.641 0.20 . 1 . . . . A 83 GLY N . 19327 1 759 . 1 1 63 63 THR H H 1 8.125 0.02 . 1 . . . . A 84 THR H . 19327 1 760 . 1 1 63 63 THR HA H 1 5.037 0.02 . 1 . . . . A 84 THR HA . 19327 1 761 . 1 1 63 63 THR HB H 1 4.071 0.02 . 1 . . . . A 84 THR HB . 19327 1 762 . 1 1 63 63 THR HG21 H 1 1.069 0.02 . 1 . . . . A 84 THR HG21 . 19327 1 763 . 1 1 63 63 THR HG22 H 1 1.069 0.02 . 1 . . . . A 84 THR HG22 . 19327 1 764 . 1 1 63 63 THR HG23 H 1 1.069 0.02 . 1 . . . . A 84 THR HG23 . 19327 1 765 . 1 1 63 63 THR CA C 13 60.301 0.20 . 1 . . . . A 84 THR CA . 19327 1 766 . 1 1 63 63 THR CB C 13 72.048 0.20 . 1 . . . . A 84 THR CB . 19327 1 767 . 1 1 63 63 THR CG2 C 13 21.549 0.20 . 1 . . . . A 84 THR CG2 . 19327 1 768 . 1 1 63 63 THR C C 13 173.676 0.20 . 1 . . . . A 84 THR C . 19327 1 769 . 1 1 63 63 THR N N 15 112.460 0.20 . 1 . . . . A 84 THR N . 19327 1 770 . 1 1 64 64 ALA H H 1 8.841 0.02 . 1 . . . . A 85 ALA H . 19327 1 771 . 1 1 64 64 ALA HA H 1 4.959 0.02 . 1 . . . . A 85 ALA HA . 19327 1 772 . 1 1 64 64 ALA HB1 H 1 1.099 0.02 . 1 . . . . A 85 ALA HB1 . 19327 1 773 . 1 1 64 64 ALA HB2 H 1 1.099 0.02 . 1 . . . . A 85 ALA HB2 . 19327 1 774 . 1 1 64 64 ALA HB3 H 1 1.099 0.02 . 1 . . . . A 85 ALA HB3 . 19327 1 775 . 1 1 64 64 ALA CA C 13 51.270 0.20 . 1 . . . . A 85 ALA CA . 19327 1 776 . 1 1 64 64 ALA CB C 13 23.843 0.20 . 1 . . . . A 85 ALA CB . 19327 1 777 . 1 1 64 64 ALA C C 13 175.092 0.20 . 1 . . . . A 85 ALA C . 19327 1 778 . 1 1 64 64 ALA N N 15 122.513 0.20 . 1 . . . . A 85 ALA N . 19327 1 779 . 1 1 65 65 ASP H H 1 8.506 0.02 . 1 . . . . A 86 ASP H . 19327 1 780 . 1 1 65 65 ASP HA H 1 5.198 0.02 . 1 . . . . A 86 ASP HA . 19327 1 781 . 1 1 65 65 ASP HB2 H 1 2.540 0.02 . 1 . . . . A 86 ASP HB2 . 19327 1 782 . 1 1 65 65 ASP HB3 H 1 2.139 0.02 . 1 . . . . A 86 ASP HB3 . 19327 1 783 . 1 1 65 65 ASP CA C 13 53.477 0.20 . 1 . . . . A 86 ASP CA . 19327 1 784 . 1 1 65 65 ASP CB C 13 43.329 0.20 . 1 . . . . A 86 ASP CB . 19327 1 785 . 1 1 65 65 ASP C C 13 175.139 0.20 . 1 . . . . A 86 ASP C . 19327 1 786 . 1 1 65 65 ASP N N 15 121.651 0.20 . 1 . . . . A 86 ASP N . 19327 1 787 . 1 1 66 66 ILE H H 1 7.966 0.02 . 1 . . . . A 87 ILE H . 19327 1 788 . 1 1 66 66 ILE HA H 1 5.379 0.02 . 1 . . . . A 87 ILE HA . 19327 1 789 . 1 1 66 66 ILE HB H 1 1.528 0.02 . 1 . . . . A 87 ILE HB . 19327 1 790 . 1 1 66 66 ILE HG12 H 1 0.550 0.02 . 1 . . . . A 87 ILE HG12 . 19327 1 791 . 1 1 66 66 ILE HG13 H 1 1.378 0.02 . 1 . . . . A 87 ILE HG13 . 19327 1 792 . 1 1 66 66 ILE HG21 H 1 0.757 0.02 . 1 . . . . A 87 ILE HG21 . 19327 1 793 . 1 1 66 66 ILE HG22 H 1 0.757 0.02 . 1 . . . . A 87 ILE HG22 . 19327 1 794 . 1 1 66 66 ILE HG23 H 1 0.757 0.02 . 1 . . . . A 87 ILE HG23 . 19327 1 795 . 1 1 66 66 ILE HD11 H 1 0.635 0.02 . 1 . . . . A 87 ILE HD11 . 19327 1 796 . 1 1 66 66 ILE HD12 H 1 0.635 0.02 . 1 . . . . A 87 ILE HD12 . 19327 1 797 . 1 1 66 66 ILE HD13 H 1 0.635 0.02 . 1 . . . . A 87 ILE HD13 . 19327 1 798 . 1 1 66 66 ILE CA C 13 58.189 0.20 . 1 . . . . A 87 ILE CA . 19327 1 799 . 1 1 66 66 ILE CB C 13 41.389 0.20 . 1 . . . . A 87 ILE CB . 19327 1 800 . 1 1 66 66 ILE CG1 C 13 25.917 0.20 . 1 . . . . A 87 ILE CG1 . 19327 1 801 . 1 1 66 66 ILE CG2 C 13 19.912 0.20 . 1 . . . . A 87 ILE CG2 . 19327 1 802 . 1 1 66 66 ILE CD1 C 13 14.787 0.20 . 1 . . . . A 87 ILE CD1 . 19327 1 803 . 1 1 66 66 ILE C C 13 175.162 0.20 . 1 . . . . A 87 ILE C . 19327 1 804 . 1 1 66 66 ILE N N 15 111.376 0.20 . 1 . . . . A 87 ILE N . 19327 1 805 . 1 1 67 67 TYR H H 1 8.754 0.02 . 1 . . . . A 88 TYR H . 19327 1 806 . 1 1 67 67 TYR HA H 1 5.443 0.02 . 1 . . . . A 88 TYR HA . 19327 1 807 . 1 1 67 67 TYR HB2 H 1 2.467 0.02 . 1 . . . . A 88 TYR HB2 . 19327 1 808 . 1 1 67 67 TYR HB3 H 1 3.061 0.02 . 1 . . . . A 88 TYR HB3 . 19327 1 809 . 1 1 67 67 TYR HD1 H 1 6.505 0.02 . 1 . . . . A 88 TYR HD1 . 19327 1 810 . 1 1 67 67 TYR HD2 H 1 6.505 0.02 . 1 . . . . A 88 TYR HD2 . 19327 1 811 . 1 1 67 67 TYR CA C 13 57.017 0.20 . 1 . . . . A 88 TYR CA . 19327 1 812 . 1 1 67 67 TYR CB C 13 44.174 0.20 . 1 . . . . A 88 TYR CB . 19327 1 813 . 1 1 67 67 TYR CD2 C 13 131.921 0.20 . 1 . . . . A 88 TYR CD2 . 19327 1 814 . 1 1 67 67 TYR C C 13 175.572 0.20 . 1 . . . . A 88 TYR C . 19327 1 815 . 1 1 67 67 TYR N N 15 118.138 0.20 . 1 . . . . A 88 TYR N . 19327 1 816 . 1 1 68 68 LYS H H 1 9.595 0.02 . 1 . . . . A 89 LYS H . 19327 1 817 . 1 1 68 68 LYS HA H 1 5.177 0.02 . 1 . . . . A 89 LYS HA . 19327 1 818 . 1 1 68 68 LYS HB2 H 1 2.010 0.02 . 2 . . . . A 89 LYS HB2 . 19327 1 819 . 1 1 68 68 LYS HB3 H 1 1.746 0.02 . 2 . . . . A 89 LYS HB3 . 19327 1 820 . 1 1 68 68 LYS HG2 H 1 1.616 0.02 . 1 . . . . A 89 LYS HG2 . 19327 1 821 . 1 1 68 68 LYS HG3 H 1 1.616 0.02 . 1 . . . . A 89 LYS HG3 . 19327 1 822 . 1 1 68 68 LYS HD2 H 1 1.844 0.02 . 2 . . . . A 89 LYS HD2 . 19327 1 823 . 1 1 68 68 LYS HD3 H 1 1.769 0.02 . 2 . . . . A 89 LYS HD3 . 19327 1 824 . 1 1 68 68 LYS HE2 H 1 3.091 0.02 . 1 . . . . A 89 LYS HE2 . 19327 1 825 . 1 1 68 68 LYS HE3 H 1 3.091 0.02 . 1 . . . . A 89 LYS HE3 . 19327 1 826 . 1 1 68 68 LYS CA C 13 54.466 0.20 . 1 . . . . A 89 LYS CA . 19327 1 827 . 1 1 68 68 LYS CB C 13 37.138 0.20 . 1 . . . . A 89 LYS CB . 19327 1 828 . 1 1 68 68 LYS CG C 13 24.831 0.20 . 1 . . . . A 89 LYS CG . 19327 1 829 . 1 1 68 68 LYS CD C 13 29.436 0.20 . 1 . . . . A 89 LYS CD . 19327 1 830 . 1 1 68 68 LYS CE C 13 42.090 0.20 . 1 . . . . A 89 LYS CE . 19327 1 831 . 1 1 68 68 LYS C C 13 175.197 0.20 . 1 . . . . A 89 LYS C . 19327 1 832 . 1 1 68 68 LYS N N 15 123.705 0.20 . 1 . . . . A 89 LYS N . 19327 1 833 . 1 1 69 69 LYS H H 1 10.195 0.02 . 1 . . . . A 90 LYS H . 19327 1 834 . 1 1 69 69 LYS HA H 1 3.820 0.02 . 1 . . . . A 90 LYS HA . 19327 1 835 . 1 1 69 69 LYS HB2 H 1 1.572 0.02 . 1 . . . . A 90 LYS HB2 . 19327 1 836 . 1 1 69 69 LYS HB3 H 1 1.747 0.02 . 1 . . . . A 90 LYS HB3 . 19327 1 837 . 1 1 69 69 LYS HG2 H 1 1.015 0.02 . 2 . . . . A 90 LYS HG2 . 19327 1 838 . 1 1 69 69 LYS HG3 H 1 1.349 0.02 . 2 . . . . A 90 LYS HG3 . 19327 1 839 . 1 1 69 69 LYS HD2 H 1 1.496 0.02 . 1 . . . . A 90 LYS HD2 . 19327 1 840 . 1 1 69 69 LYS HD3 H 1 1.496 0.02 . 1 . . . . A 90 LYS HD3 . 19327 1 841 . 1 1 69 69 LYS HE2 H 1 2.888 0.02 . 1 . . . . A 90 LYS HE2 . 19327 1 842 . 1 1 69 69 LYS HE3 H 1 2.888 0.02 . 1 . . . . A 90 LYS HE3 . 19327 1 843 . 1 1 69 69 LYS CA C 13 57.666 0.20 . 1 . . . . A 90 LYS CA . 19327 1 844 . 1 1 69 69 LYS CB C 13 32.827 0.20 . 1 . . . . A 90 LYS CB . 19327 1 845 . 1 1 69 69 LYS CG C 13 25.572 0.20 . 1 . . . . A 90 LYS CG . 19327 1 846 . 1 1 69 69 LYS CD C 13 29.107 0.20 . 1 . . . . A 90 LYS CD . 19327 1 847 . 1 1 69 69 LYS CE C 13 42.204 0.20 . 1 . . . . A 90 LYS CE . 19327 1 848 . 1 1 69 69 LYS C C 13 176.953 0.20 . 1 . . . . A 91 LYS C . 19327 1 849 . 1 1 69 69 LYS N N 15 129.328 0.20 . 1 . . . . A 90 LYS N . 19327 1 850 . 1 1 70 70 LYS H H 1 8.459 0.02 . 1 . . . . A 91 LYS H . 19327 1 851 . 1 1 70 70 LYS HA H 1 4.110 0.02 . 1 . . . . A 91 LYS HA . 19327 1 852 . 1 1 70 70 LYS HB2 H 1 1.692 0.02 . 2 . . . . A 91 LYS HB2 . 19327 1 853 . 1 1 70 70 LYS HB3 H 1 1.464 0.02 . 2 . . . . A 91 LYS HB3 . 19327 1 854 . 1 1 70 70 LYS HG2 H 1 1.345 0.02 . 1 . . . . A 91 LYS HG2 . 19327 1 855 . 1 1 70 70 LYS HG3 H 1 1.154 0.02 . 1 . . . . A 91 LYS HG3 . 19327 1 856 . 1 1 70 70 LYS HD2 H 1 1.609 0.02 . 2 . . . . A 91 LYS HD2 . 19327 1 857 . 1 1 70 70 LYS HD3 H 1 1.572 0.02 . 2 . . . . A 91 LYS HD3 . 19327 1 858 . 1 1 70 70 LYS HE2 H 1 2.872 0.02 . 1 . . . . A 91 LYS HE2 . 19327 1 859 . 1 1 70 70 LYS HE3 H 1 2.872 0.02 . 1 . . . . A 91 LYS HE3 . 19327 1 860 . 1 1 70 70 LYS CA C 13 57.325 0.20 . 1 . . . . A 91 LYS CA . 19327 1 861 . 1 1 70 70 LYS CB C 13 33.325 0.20 . 1 . . . . A 91 LYS CB . 19327 1 862 . 1 1 70 70 LYS CG C 13 25.984 0.20 . 1 . . . . A 91 LYS CG . 19327 1 863 . 1 1 70 70 LYS CD C 13 29.574 0.20 . 1 . . . . A 91 LYS CD . 19327 1 864 . 1 1 70 70 LYS CE C 13 42.130 0.20 . 1 . . . . A 91 LYS CE . 19327 1 865 . 1 1 70 70 LYS C C 13 176.543 0.20 . 1 . . . . A 91 LYS C . 19327 1 866 . 1 1 70 70 LYS N N 15 126.034 0.20 . 1 . . . . A 91 LYS N . 19327 1 867 . 1 1 71 71 LEU H H 1 8.266 0.02 . 1 . . . . A 92 LEU H . 19327 1 868 . 1 1 71 71 LEU HA H 1 4.285 0.02 . 1 . . . . A 92 LEU HA . 19327 1 869 . 1 1 71 71 LEU HB2 H 1 1.548 0.02 . 2 . . . . A 92 LEU HB2 . 19327 1 870 . 1 1 71 71 LEU HB3 H 1 1.465 0.02 . 2 . . . . A 92 LEU HB3 . 19327 1 871 . 1 1 71 71 LEU HG H 1 1.550 0.02 . 1 . . . . A 92 LEU HG . 19327 1 872 . 1 1 71 71 LEU HD11 H 1 0.831 0.02 . 1 . . . . A 92 LEU HD11 . 19327 1 873 . 1 1 71 71 LEU HD12 H 1 0.831 0.02 . 1 . . . . A 92 LEU HD12 . 19327 1 874 . 1 1 71 71 LEU HD13 H 1 0.831 0.02 . 1 . . . . A 92 LEU HD13 . 19327 1 875 . 1 1 71 71 LEU HD21 H 1 0.896 0.02 . 1 . . . . A 92 LEU HD21 . 19327 1 876 . 1 1 71 71 LEU HD22 H 1 0.896 0.02 . 1 . . . . A 92 LEU HD22 . 19327 1 877 . 1 1 71 71 LEU HD23 H 1 0.896 0.02 . 1 . . . . A 92 LEU HD23 . 19327 1 878 . 1 1 71 71 LEU CA C 13 54.817 0.20 . 1 . . . . A 92 LEU CA . 19327 1 879 . 1 1 71 71 LEU CB C 13 42.315 0.20 . 1 . . . . A 92 LEU CB . 19327 1 880 . 1 1 71 71 LEU CG C 13 26.901 0.20 . 1 . . . . A 92 LEU CG . 19327 1 881 . 1 1 71 71 LEU CD1 C 13 23.626 0.20 . 1 . . . . A 92 LEU CD1 . 19327 1 882 . 1 1 71 71 LEU CD2 C 13 24.770 0.20 . 1 . . . . A 92 LEU CD2 . 19327 1 883 . 1 1 71 71 LEU C C 13 176.742 0.20 . 1 . . . . A 92 LEU C . 19327 1 884 . 1 1 71 71 LEU N N 15 123.360 0.20 . 1 . . . . A 92 LEU N . 19327 1 885 . 1 1 72 72 GLU H H 1 8.311 0.02 . 1 . . . . A 93 GLU H . 19327 1 886 . 1 1 72 72 GLU HA H 1 4.224 0.02 . 1 . . . . A 93 GLU HA . 19327 1 887 . 1 1 72 72 GLU HB2 H 1 1.869 0.02 . 2 . . . . A 93 GLU HB2 . 19327 1 888 . 1 1 72 72 GLU HB3 H 1 1.832 0.02 . 2 . . . . A 93 GLU HB3 . 19327 1 889 . 1 1 72 72 GLU HG2 H 1 2.142 0.02 . 2 . . . . A 93 GLU HG2 . 19327 1 890 . 1 1 72 72 GLU HG3 H 1 2.177 0.02 . 2 . . . . A 93 GLU HG3 . 19327 1 891 . 1 1 72 72 GLU CA C 13 55.832 0.20 . 1 . . . . A 93 GLU CA . 19327 1 892 . 1 1 72 72 GLU CB C 13 30.425 0.20 . 1 . . . . A 93 GLU CB . 19327 1 893 . 1 1 72 72 GLU CG C 13 35.508 0.20 . 1 . . . . A 93 GLU CG . 19327 1 894 . 1 1 72 72 GLU C C 13 175.934 0.20 . 1 . . . . A 93 GLU C . 19327 1 895 . 1 1 72 72 GLU N N 15 121.993 0.20 . 1 . . . . A 93 GLU N . 19327 1 896 . 1 1 73 73 HIS H H 1 8.567 0.02 . 1 . . . . A 94 HIS H . 19327 1 897 . 1 1 73 73 HIS HA H 1 4.636 0.02 . 1 . . . . A 94 HIS HA . 19327 1 898 . 1 1 73 73 HIS HB2 H 1 3.056 0.02 . 2 . . . . A 94 HIS HB2 . 19327 1 899 . 1 1 73 73 HIS HB3 H 1 3.149 0.02 . 2 . . . . A 94 HIS HB3 . 19327 1 900 . 1 1 73 73 HIS HD2 H 1 7.211 0.02 . 1 . . . . A 94 HIS HD2 . 19327 1 901 . 1 1 73 73 HIS CA C 13 55.059 0.20 . 1 . . . . A 94 HIS CA . 19327 1 902 . 1 1 73 73 HIS CB C 13 29.131 0.20 . 1 . . . . A 94 HIS CB . 19327 1 903 . 1 1 73 73 HIS CD2 C 13 119.427 0.20 . 1 . . . . A 94 HIS CD2 . 19327 1 904 . 1 1 73 73 HIS C C 13 174.261 0.20 . 1 . . . . A 94 HIS C . 19327 1 905 . 1 1 73 73 HIS N N 15 119.802 0.20 . 1 . . . . A 94 HIS N . 19327 1 906 . 1 1 74 74 HIS H H 1 8.600 0.02 . 1 . . . . A 95 HIS H . 19327 1 907 . 1 1 74 74 HIS HA H 1 4.637 0.02 . 1 . . . . A 95 HIS HA . 19327 1 908 . 1 1 74 74 HIS HB2 H 1 3.066 0.02 . 2 . . . . A 95 HIS HB2 . 19327 1 909 . 1 1 74 74 HIS HB3 H 1 3.165 0.02 . 2 . . . . A 95 HIS HB3 . 19327 1 910 . 1 1 74 74 HIS CA C 13 55.174 0.20 . 1 . . . . A 95 HIS CA . 19327 1 911 . 1 1 74 74 HIS CB C 13 29.082 0.20 . 1 . . . . A 95 HIS CB . 19327 1 912 . 1 1 74 74 HIS N N 15 119.430 0.20 . 1 . . . . A 95 HIS N . 19327 1 stop_ save_