################################### # 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 18545 _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 . _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 '2D 1H-15N HSQC' . . . 18545 1 2 '2D 1H-13C HSQC aliphatic' . . . 18545 1 3 '2D 1H-13C HSQC aromatic' . . . 18545 1 4 '3D 1H-15N NOESY' . . . 18545 1 5 '3D 1H-13C NOESY aliphatic' . . . 18545 1 6 '3D 1H-13C NOESY aromatic' . . . 18545 1 7 '3D CBCA(CO)NH' . . . 18545 1 8 '3D HNCO' . . . 18545 1 9 '3D HBHA(CO)NH' . . . 18545 1 10 '3D HN(CO)CA' . . . 18545 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 1 1 GLY HA2 H 1 3.910 0.020 . 2 . . . A 1 GLY HA2 . 18545 1 2 . 1 1 1 1 GLY HA3 H 1 3.911 0.020 . 2 . . . A 1 GLY HA3 . 18545 1 3 . 1 1 1 1 GLY CA C 13 43.261 0.3 . 1 . . . A 1 GLY CA . 18545 1 4 . 1 1 2 2 SER HA H 1 4.730 0.020 . 1 . . . A 2 SER HA . 18545 1 5 . 1 1 2 2 SER HB2 H 1 4.040 0.020 . 2 . . . A 2 SER HB2 . 18545 1 6 . 1 1 2 2 SER HB3 H 1 4.698 0.020 . 2 . . . A 2 SER HB3 . 18545 1 7 . 1 1 2 2 SER C C 13 175.229 0.3 . 1 . . . A 2 SER C . 18545 1 8 . 1 1 2 2 SER CA C 13 57.378 0.3 . 1 . . . A 2 SER CA . 18545 1 9 . 1 1 2 2 SER CB C 13 65.034 0.3 . 1 . . . A 2 SER CB . 18545 1 10 . 1 1 3 3 GLU H H 1 9.471 0.020 . 1 . . . A 3 GLU H . 18545 1 11 . 1 1 3 3 GLU HA H 1 4.117 0.020 . 1 . . . A 3 GLU HA . 18545 1 12 . 1 1 3 3 GLU HB2 H 1 2.182 0.020 . 2 . . . A 3 GLU HB2 . 18545 1 13 . 1 1 3 3 GLU HB3 H 1 2.033 0.020 . 2 . . . A 3 GLU HB3 . 18545 1 14 . 1 1 3 3 GLU HG2 H 1 2.448 0.020 . 2 . . . A 3 GLU HG2 . 18545 1 15 . 1 1 3 3 GLU HG3 H 1 2.315 0.020 . 2 . . . A 3 GLU HG3 . 18545 1 16 . 1 1 3 3 GLU C C 13 179.399 0.3 . 1 . . . A 3 GLU C . 18545 1 17 . 1 1 3 3 GLU CA C 13 60.354 0.3 . 1 . . . A 3 GLU CA . 18545 1 18 . 1 1 3 3 GLU CB C 13 29.5 0.3 . 1 . . . A 3 GLU CB . 18545 1 19 . 1 1 3 3 GLU CG C 13 37.205 0.3 . 1 . . . A 3 GLU CG . 18545 1 20 . 1 1 3 3 GLU N N 15 123.610 0.3 . 1 . . . A 3 GLU N . 18545 1 21 . 1 1 4 4 LEU H H 1 8.801 0.020 . 1 . . . A 4 LEU H . 18545 1 22 . 1 1 4 4 LEU HA H 1 4.086 0.020 . 1 . . . A 4 LEU HA . 18545 1 23 . 1 1 4 4 LEU HB2 H 1 1.692 0.020 . 2 . . . A 4 LEU HB2 . 18545 1 24 . 1 1 4 4 LEU HB3 H 1 1.878 0.020 . 2 . . . A 4 LEU HB3 . 18545 1 25 . 1 1 4 4 LEU HG H 1 1.751 0.020 . 1 . . . A 4 LEU HG . 18545 1 26 . 1 1 4 4 LEU HD11 H 1 0.863 0.020 . 2 . . . A 4 LEU HD11 . 18545 1 27 . 1 1 4 4 LEU HD12 H 1 0.863 0.020 . 2 . . . A 4 LEU HD12 . 18545 1 28 . 1 1 4 4 LEU HD13 H 1 0.863 0.020 . 2 . . . A 4 LEU HD13 . 18545 1 29 . 1 1 4 4 LEU HD21 H 1 0.977 0.020 . 2 . . . A 4 LEU HD21 . 18545 1 30 . 1 1 4 4 LEU HD22 H 1 0.977 0.020 . 2 . . . A 4 LEU HD22 . 18545 1 31 . 1 1 4 4 LEU HD23 H 1 0.977 0.020 . 2 . . . A 4 LEU HD23 . 18545 1 32 . 1 1 4 4 LEU C C 13 178.328 0.3 . 1 . . . A 4 LEU C . 18545 1 33 . 1 1 4 4 LEU CA C 13 58.08 0.3 . 1 . . . A 4 LEU CA . 18545 1 34 . 1 1 4 4 LEU CB C 13 42.693 0.3 . 1 . . . A 4 LEU CB . 18545 1 35 . 1 1 4 4 LEU CG C 13 27.319 0.3 . 1 . . . A 4 LEU CG . 18545 1 36 . 1 1 4 4 LEU CD1 C 13 25.041 0.3 . 1 . . . A 4 LEU CD1 . 18545 1 37 . 1 1 4 4 LEU CD2 C 13 24.22 0.3 . 1 . . . A 4 LEU CD2 . 18545 1 38 . 1 1 4 4 LEU N N 15 119.878 0.3 . 1 . . . A 4 LEU N . 18545 1 39 . 1 1 5 5 GLU H H 1 8.285 0.020 . 1 . . . A 5 GLU H . 18545 1 40 . 1 1 5 5 GLU HA H 1 3.996 0.020 . 1 . . . A 5 GLU HA . 18545 1 41 . 1 1 5 5 GLU HB2 H 1 2.274 0.020 . 2 . . . A 5 GLU HB2 . 18545 1 42 . 1 1 5 5 GLU HB3 H 1 2.092 0.020 . 2 . . . A 5 GLU HB3 . 18545 1 43 . 1 1 5 5 GLU HG2 H 1 2.163 0.020 . 2 . . . A 5 GLU HG2 . 18545 1 44 . 1 1 5 5 GLU HG3 H 1 2.565 0.020 . 2 . . . A 5 GLU HG3 . 18545 1 45 . 1 1 5 5 GLU C C 13 179.039 0.3 . 1 . . . A 5 GLU C . 18545 1 46 . 1 1 5 5 GLU CA C 13 60.008 0.3 . 1 . . . A 5 GLU CA . 18545 1 47 . 1 1 5 5 GLU CB C 13 29.486 0.3 . 1 . . . A 5 GLU CB . 18545 1 48 . 1 1 5 5 GLU CG C 13 37.688 0.3 . 1 . . . A 5 GLU CG . 18545 1 49 . 1 1 5 5 GLU N N 15 118.960 0.3 . 1 . . . A 5 GLU N . 18545 1 50 . 1 1 6 6 THR H H 1 8.361 0.020 . 1 . . . A 6 THR H . 18545 1 51 . 1 1 6 6 THR HA H 1 3.998 0.020 . 1 . . . A 6 THR HA . 18545 1 52 . 1 1 6 6 THR HB H 1 4.374 0.020 . 1 . . . A 6 THR HB . 18545 1 53 . 1 1 6 6 THR HG21 H 1 1.249 0.020 . 1 . . . A 6 THR HG21 . 18545 1 54 . 1 1 6 6 THR HG22 H 1 1.249 0.020 . 1 . . . A 6 THR HG22 . 18545 1 55 . 1 1 6 6 THR HG23 H 1 1.249 0.020 . 1 . . . A 6 THR HG23 . 18545 1 56 . 1 1 6 6 THR C C 13 176.342 0.3 . 1 . . . A 6 THR C . 18545 1 57 . 1 1 6 6 THR CA C 13 66.497 0.3 . 1 . . . A 6 THR CA . 18545 1 58 . 1 1 6 6 THR CB C 13 68.598 0.3 . 1 . . . A 6 THR CB . 18545 1 59 . 1 1 6 6 THR CG2 C 13 21.69 0.3 . 1 . . . A 6 THR CG2 . 18545 1 60 . 1 1 6 6 THR N N 15 116.120 0.3 . 1 . . . A 6 THR N . 18545 1 61 . 1 1 7 7 ALA H H 1 8.093 0.020 . 1 . . . A 7 ALA H . 18545 1 62 . 1 1 7 7 ALA HA H 1 4.199 0.020 . 1 . . . A 7 ALA HA . 18545 1 63 . 1 1 7 7 ALA HB1 H 1 1.628 0.020 . 1 . . . A 7 ALA HB1 . 18545 1 64 . 1 1 7 7 ALA HB2 H 1 1.628 0.020 . 1 . . . A 7 ALA HB2 . 18545 1 65 . 1 1 7 7 ALA HB3 H 1 1.628 0.020 . 1 . . . A 7 ALA HB3 . 18545 1 66 . 1 1 7 7 ALA CA C 13 55.685 0.3 . 1 . . . A 7 ALA CA . 18545 1 67 . 1 1 7 7 ALA CB C 13 18.083 0.3 . 1 . . . A 7 ALA CB . 18545 1 68 . 1 1 7 7 ALA N N 15 126.233 0.3 . 1 . . . A 7 ALA N . 18545 1 69 . 1 1 8 8 MET H H 1 8.260 0.020 . 1 . . . A 8 MET H . 18545 1 70 . 1 1 8 8 MET HA H 1 3.819 0.020 . 1 . . . A 8 MET HA . 18545 1 71 . 1 1 8 8 MET HB2 H 1 2.202 0.020 . 2 . . . A 8 MET HB2 . 18545 1 72 . 1 1 8 8 MET HB3 H 1 2.264 0.020 . 2 . . . A 8 MET HB3 . 18545 1 73 . 1 1 8 8 MET HG2 H 1 2.652 0.020 . 2 . . . A 8 MET HG2 . 18545 1 74 . 1 1 8 8 MET HG3 H 1 2.466 0.020 . 2 . . . A 8 MET HG3 . 18545 1 75 . 1 1 8 8 MET HE1 H 1 1.869 0.020 . 1 . . . A 8 MET HE1 . 18545 1 76 . 1 1 8 8 MET HE2 H 1 1.869 0.020 . 1 . . . A 8 MET HE2 . 18545 1 77 . 1 1 8 8 MET HE3 H 1 1.869 0.020 . 1 . . . A 8 MET HE3 . 18545 1 78 . 1 1 8 8 MET CA C 13 60.88 0.3 . 1 . . . A 8 MET CA . 18545 1 79 . 1 1 8 8 MET CB C 13 34.27 0.3 . 1 . . . A 8 MET CB . 18545 1 80 . 1 1 8 8 MET CG C 13 31.532 0.3 . 1 . . . A 8 MET CG . 18545 1 81 . 1 1 8 8 MET CE C 13 17.172 0.3 . 1 . . . A 8 MET CE . 18545 1 82 . 1 1 8 8 MET N N 15 117.521 0.3 . 1 . . . A 8 MET N . 18545 1 83 . 1 1 9 9 GLU H H 1 8.277 0.020 . 1 . . . A 9 GLU H . 18545 1 84 . 1 1 9 9 GLU HA H 1 3.911 0.020 . 1 . . . A 9 GLU HA . 18545 1 85 . 1 1 9 9 GLU HB2 H 1 2.273 0.020 . 2 . . . A 9 GLU HB2 . 18545 1 86 . 1 1 9 9 GLU HB3 H 1 2.100 0.020 . 2 . . . A 9 GLU HB3 . 18545 1 87 . 1 1 9 9 GLU HG2 H 1 2.273 0.020 . 2 . . . A 9 GLU HG2 . 18545 1 88 . 1 1 9 9 GLU HG3 H 1 2.504 0.020 . 2 . . . A 9 GLU HG3 . 18545 1 89 . 1 1 9 9 GLU C C 13 178.952 0.3 . 1 . . . A 9 GLU C . 18545 1 90 . 1 1 9 9 GLU CA C 13 59.875 0.3 . 1 . . . A 9 GLU CA . 18545 1 91 . 1 1 9 9 GLU CB C 13 29.65 0.3 . 1 . . . A 9 GLU CB . 18545 1 92 . 1 1 9 9 GLU CG C 13 36.908 0.3 . 1 . . . A 9 GLU CG . 18545 1 93 . 1 1 9 9 GLU N N 15 117.889 0.3 . 1 . . . A 9 GLU N . 18545 1 94 . 1 1 10 10 THR H H 1 8.386 0.020 . 1 . . . A 10 THR H . 18545 1 95 . 1 1 10 10 THR HA H 1 4.074 0.020 . 1 . . . A 10 THR HA . 18545 1 96 . 1 1 10 10 THR HB H 1 4.587 0.020 . 1 . . . A 10 THR HB . 18545 1 97 . 1 1 10 10 THR HG21 H 1 1.246 0.020 . 1 . . . A 10 THR HG21 . 18545 1 98 . 1 1 10 10 THR HG22 H 1 1.246 0.020 . 1 . . . A 10 THR HG22 . 18545 1 99 . 1 1 10 10 THR HG23 H 1 1.246 0.020 . 1 . . . A 10 THR HG23 . 18545 1 100 . 1 1 10 10 THR C C 13 175.547 0.3 . 1 . . . A 10 THR C . 18545 1 101 . 1 1 10 10 THR CA C 13 67.39 0.3 . 1 . . . A 10 THR CA . 18545 1 102 . 1 1 10 10 THR CB C 13 68.717 0.3 . 1 . . . A 10 THR CB . 18545 1 103 . 1 1 10 10 THR CG2 C 13 22.789 0.3 . 1 . . . A 10 THR CG2 . 18545 1 104 . 1 1 10 10 THR N N 15 118.101 0.3 . 1 . . . A 10 THR N . 18545 1 105 . 1 1 11 11 LEU H H 1 8.133 0.020 . 1 . . . A 11 LEU H . 18545 1 106 . 1 1 11 11 LEU HA H 1 3.942 0.020 . 1 . . . A 11 LEU HA . 18545 1 107 . 1 1 11 11 LEU HB2 H 1 2.585 0.020 . 2 . . . A 11 LEU HB2 . 18545 1 108 . 1 1 11 11 LEU HB3 H 1 1.447 0.020 . 2 . . . A 11 LEU HB3 . 18545 1 109 . 1 1 11 11 LEU HG H 1 2.246 0.020 . 1 . . . A 11 LEU HG . 18545 1 110 . 1 1 11 11 LEU HD11 H 1 0.758 0.020 . 2 . . . A 11 LEU HD11 . 18545 1 111 . 1 1 11 11 LEU HD12 H 1 0.758 0.020 . 2 . . . A 11 LEU HD12 . 18545 1 112 . 1 1 11 11 LEU HD13 H 1 0.758 0.020 . 2 . . . A 11 LEU HD13 . 18545 1 113 . 1 1 11 11 LEU HD21 H 1 0.818 0.020 . 2 . . . A 11 LEU HD21 . 18545 1 114 . 1 1 11 11 LEU HD22 H 1 0.818 0.020 . 2 . . . A 11 LEU HD22 . 18545 1 115 . 1 1 11 11 LEU HD23 H 1 0.818 0.020 . 2 . . . A 11 LEU HD23 . 18545 1 116 . 1 1 11 11 LEU C C 13 180.890 0.3 . 1 . . . A 11 LEU C . 18545 1 117 . 1 1 11 11 LEU CA C 13 59.187 0.3 . 1 . . . A 11 LEU CA . 18545 1 118 . 1 1 11 11 LEU CB C 13 41.81 0.3 . 1 . . . A 11 LEU CB . 18545 1 119 . 1 1 11 11 LEU CG C 13 27.211 0.3 . 1 . . . A 11 LEU CG . 18545 1 120 . 1 1 11 11 LEU CD1 C 13 24.351 0.3 . 1 . . . A 11 LEU CD1 . 18545 1 121 . 1 1 11 11 LEU CD2 C 13 24.676 0.3 . 1 . . . A 11 LEU CD2 . 18545 1 122 . 1 1 11 11 LEU N N 15 119.752 0.3 . 1 . . . A 11 LEU N . 18545 1 123 . 1 1 12 12 ILE H H 1 7.707 0.020 . 1 . . . A 12 ILE H . 18545 1 124 . 1 1 12 12 ILE HA H 1 3.930 0.020 . 1 . . . A 12 ILE HA . 18545 1 125 . 1 1 12 12 ILE HB H 1 2.070 0.020 . 1 . . . A 12 ILE HB . 18545 1 126 . 1 1 12 12 ILE HG12 H 1 0.873 0.020 . 2 . . . A 12 ILE HG12 . 18545 1 127 . 1 1 12 12 ILE HG13 H 1 0.972 0.020 . 2 . . . A 12 ILE HG13 . 18545 1 128 . 1 1 12 12 ILE HG21 H 1 0.855 0.020 . 1 . . . A 12 ILE HG21 . 18545 1 129 . 1 1 12 12 ILE HG22 H 1 0.855 0.020 . 1 . . . A 12 ILE HG22 . 18545 1 130 . 1 1 12 12 ILE HG23 H 1 0.855 0.020 . 1 . . . A 12 ILE HG23 . 18545 1 131 . 1 1 12 12 ILE HD11 H 1 0.858 0.020 . 1 . . . A 12 ILE HD11 . 18545 1 132 . 1 1 12 12 ILE HD12 H 1 0.858 0.020 . 1 . . . A 12 ILE HD12 . 18545 1 133 . 1 1 12 12 ILE HD13 H 1 0.858 0.020 . 1 . . . A 12 ILE HD13 . 18545 1 134 . 1 1 12 12 ILE C C 13 177.898 0.3 . 1 . . . A 12 ILE C . 18545 1 135 . 1 1 12 12 ILE CA C 13 65.627 0.3 . 1 . . . A 12 ILE CA . 18545 1 136 . 1 1 12 12 ILE CB C 13 39.408 0.3 . 1 . . . A 12 ILE CB . 18545 1 137 . 1 1 12 12 ILE CG1 C 13 30.965 0.3 . 1 . . . A 12 ILE CG1 . 18545 1 138 . 1 1 12 12 ILE CG2 C 13 17.897 0.3 . 1 . . . A 12 ILE CG2 . 18545 1 139 . 1 1 12 12 ILE CD1 C 13 14.339 0.3 . 1 . . . A 12 ILE CD1 . 18545 1 140 . 1 1 12 12 ILE N N 15 119.545 0.3 . 1 . . . A 12 ILE N . 18545 1 141 . 1 1 13 13 ASN H H 1 9.099 0.020 . 1 . . . A 13 ASN H . 18545 1 142 . 1 1 13 13 ASN HA H 1 4.556 0.020 . 1 . . . A 13 ASN HA . 18545 1 143 . 1 1 13 13 ASN HB2 H 1 3.015 0.020 . 2 . . . A 13 ASN HB2 . 18545 1 144 . 1 1 13 13 ASN HB3 H 1 2.910 0.020 . 2 . . . A 13 ASN HB3 . 18545 1 145 . 1 1 13 13 ASN HD21 H 1 7.715 0.020 . 1 . . . A 13 ASN HD21 . 18545 1 146 . 1 1 13 13 ASN HD22 H 1 6.975 0.020 . 1 . . . A 13 ASN HD22 . 18545 1 147 . 1 1 13 13 ASN C C 13 178.891 0.3 . 1 . . . A 13 ASN C . 18545 1 148 . 1 1 13 13 ASN CA C 13 56.39 0.3 . 1 . . . A 13 ASN CA . 18545 1 149 . 1 1 13 13 ASN CB C 13 37.952 0.3 . 1 . . . A 13 ASN CB . 18545 1 150 . 1 1 13 13 ASN N N 15 121.759 0.3 . 1 . . . A 13 ASN N . 18545 1 151 . 1 1 13 13 ASN ND2 N 15 111.629 0.3 . 1 . . . A 13 ASN ND2 . 18545 1 152 . 1 1 14 14 VAL H H 1 8.982 0.020 . 1 . . . A 14 VAL H . 18545 1 153 . 1 1 14 14 VAL HA H 1 3.815 0.020 . 1 . . . A 14 VAL HA . 18545 1 154 . 1 1 14 14 VAL HB H 1 2.148 0.020 . 1 . . . A 14 VAL HB . 18545 1 155 . 1 1 14 14 VAL HG11 H 1 1.095 0.020 . 2 . . . A 14 VAL HG11 . 18545 1 156 . 1 1 14 14 VAL HG12 H 1 1.095 0.020 . 2 . . . A 14 VAL HG12 . 18545 1 157 . 1 1 14 14 VAL HG13 H 1 1.095 0.020 . 2 . . . A 14 VAL HG13 . 18545 1 158 . 1 1 14 14 VAL HG21 H 1 1.079 0.020 . 2 . . . A 14 VAL HG21 . 18545 1 159 . 1 1 14 14 VAL HG22 H 1 1.079 0.020 . 2 . . . A 14 VAL HG22 . 18545 1 160 . 1 1 14 14 VAL HG23 H 1 1.079 0.020 . 2 . . . A 14 VAL HG23 . 18545 1 161 . 1 1 14 14 VAL C C 13 177.122 0.3 . 1 . . . A 14 VAL C . 18545 1 162 . 1 1 14 14 VAL CA C 13 66.438 0.3 . 1 . . . A 14 VAL CA . 18545 1 163 . 1 1 14 14 VAL CB C 13 31.745 0.3 . 1 . . . A 14 VAL CB . 18545 1 164 . 1 1 14 14 VAL CG1 C 13 23.558 0.3 . 1 . . . A 14 VAL CG1 . 18545 1 165 . 1 1 14 14 VAL CG2 C 13 22.403 0.3 . 1 . . . A 14 VAL CG2 . 18545 1 166 . 1 1 14 14 VAL N N 15 120.595 0.3 . 1 . . . A 14 VAL N . 18545 1 167 . 1 1 15 15 PHE H H 1 6.989 0.020 . 1 . . . A 15 PHE H . 18545 1 168 . 1 1 15 15 PHE HA H 1 3.464 0.020 . 1 . . . A 15 PHE HA . 18545 1 169 . 1 1 15 15 PHE HB2 H 1 2.390 0.020 . 2 . . . A 15 PHE HB2 . 18545 1 170 . 1 1 15 15 PHE HB3 H 1 3.021 0.020 . 2 . . . A 15 PHE HB3 . 18545 1 171 . 1 1 15 15 PHE HD1 H 1 5.484 0.020 . 1 . . . A 15 PHE HD1 . 18545 1 172 . 1 1 15 15 PHE HD2 H 1 5.484 0.020 . 1 . . . A 15 PHE HD2 . 18545 1 173 . 1 1 15 15 PHE HE1 H 1 6.719 0.020 . 1 . . . A 15 PHE HE1 . 18545 1 174 . 1 1 15 15 PHE HZ H 1 7.299 0.020 . 1 . . . A 15 PHE HZ . 18545 1 175 . 1 1 15 15 PHE C C 13 177.288 0.3 . 1 . . . A 15 PHE C . 18545 1 176 . 1 1 15 15 PHE CA C 13 62.665 0.3 . 1 . . . A 15 PHE CA . 18545 1 177 . 1 1 15 15 PHE CB C 13 39.294 0.3 . 1 . . . A 15 PHE CB . 18545 1 178 . 1 1 15 15 PHE CD1 C 13 131.533 0.3 . 1 . . . A 15 PHE CD1 . 18545 1 179 . 1 1 15 15 PHE CD2 C 13 131.533 0.3 . 1 . . . A 15 PHE CD2 . 18545 1 180 . 1 1 15 15 PHE CE1 C 13 131.309 0.3 . 1 . . . A 15 PHE CE1 . 18545 1 181 . 1 1 15 15 PHE CZ C 13 129.305 0.3 . 1 . . . A 15 PHE CZ . 18545 1 182 . 1 1 15 15 PHE N N 15 117.585 0.3 . 1 . . . A 15 PHE N . 18545 1 183 . 1 1 16 16 HIS H H 1 7.815 0.020 . 1 . . . A 16 HIS H . 18545 1 184 . 1 1 16 16 HIS HA H 1 4.792 0.020 . 1 . . . A 16 HIS HA . 18545 1 185 . 1 1 16 16 HIS HB2 H 1 2.881 0.020 . 2 . . . A 16 HIS HB2 . 18545 1 186 . 1 1 16 16 HIS HB3 H 1 3.059 0.020 . 2 . . . A 16 HIS HB3 . 18545 1 187 . 1 1 16 16 HIS HD2 H 1 7.076 0.020 . 1 . . . A 16 HIS HD2 . 18545 1 188 . 1 1 16 16 HIS C C 13 177.242 0.3 . 1 . . . A 16 HIS C . 18545 1 189 . 1 1 16 16 HIS CA C 13 58.296 0.3 . 1 . . . A 16 HIS CA . 18545 1 190 . 1 1 16 16 HIS CB C 13 28.385 0.3 . 1 . . . A 16 HIS CB . 18545 1 191 . 1 1 16 16 HIS CD2 C 13 124.152 0.3 . 1 . . . A 16 HIS CD2 . 18545 1 192 . 1 1 16 16 HIS N N 15 114.928 0.3 . 1 . . . A 16 HIS N . 18545 1 193 . 1 1 17 17 ALA H H 1 8.109 0.020 . 1 . . . A 17 ALA H . 18545 1 194 . 1 1 17 17 ALA HA H 1 4.029 0.020 . 1 . . . A 17 ALA HA . 18545 1 195 . 1 1 17 17 ALA HB1 H 1 1.309 0.020 . 1 . . . A 17 ALA HB1 . 18545 1 196 . 1 1 17 17 ALA HB2 H 1 1.309 0.020 . 1 . . . A 17 ALA HB2 . 18545 1 197 . 1 1 17 17 ALA HB3 H 1 1.309 0.020 . 1 . . . A 17 ALA HB3 . 18545 1 198 . 1 1 17 17 ALA C C 13 178.803 0.3 . 1 . . . A 17 ALA C . 18545 1 199 . 1 1 17 17 ALA CA C 13 54.061 0.3 . 1 . . . A 17 ALA CA . 18545 1 200 . 1 1 17 17 ALA CB C 13 17.78 0.3 . 1 . . . A 17 ALA CB . 18545 1 201 . 1 1 17 17 ALA N N 15 123.335 0.3 . 1 . . . A 17 ALA N . 18545 1 202 . 1 1 18 18 HIS H H 1 7.049 0.020 . 1 . . . A 18 HIS H . 18545 1 203 . 1 1 18 18 HIS HA H 1 4.378 0.020 . 1 . . . A 18 HIS HA . 18545 1 204 . 1 1 18 18 HIS HB2 H 1 2.861 0.020 . 2 . . . A 18 HIS HB2 . 18545 1 205 . 1 1 18 18 HIS HB3 H 1 2.479 0.020 . 2 . . . A 18 HIS HB3 . 18545 1 206 . 1 1 18 18 HIS HD2 H 1 6.837 0.020 . 1 . . . A 18 HIS HD2 . 18545 1 207 . 1 1 18 18 HIS C C 13 175.536 0.3 . 1 . . . A 18 HIS C . 18545 1 208 . 1 1 18 18 HIS CA C 13 57.392 0.3 . 1 . . . A 18 HIS CA . 18545 1 209 . 1 1 18 18 HIS CB C 13 32.54 0.3 . 1 . . . A 18 HIS CB . 18545 1 210 . 1 1 18 18 HIS CD2 C 13 127.881 0.3 . 1 . . . A 18 HIS CD2 . 18545 1 211 . 1 1 18 18 HIS N N 15 113.591 0.3 . 1 . . . A 18 HIS N . 18545 1 212 . 1 1 19 19 SER H H 1 8.465 0.020 . 1 . . . A 19 SER H . 18545 1 213 . 1 1 19 19 SER HA H 1 3.656 0.020 . 1 . . . A 19 SER HA . 18545 1 214 . 1 1 19 19 SER HB2 H 1 2.083 0.020 . 2 . . . A 19 SER HB2 . 18545 1 215 . 1 1 19 19 SER HB3 H 1 3.037 0.020 . 2 . . . A 19 SER HB3 . 18545 1 216 . 1 1 19 19 SER C C 13 176.740 0.3 . 1 . . . A 19 SER C . 18545 1 217 . 1 1 19 19 SER CA C 13 61.272 0.3 . 1 . . . A 19 SER CA . 18545 1 218 . 1 1 19 19 SER CB C 13 61.235 0.3 . 1 . . . A 19 SER CB . 18545 1 219 . 1 1 19 19 SER N N 15 113.634 0.3 . 1 . . . A 19 SER N . 18545 1 220 . 1 1 20 20 GLY H H 1 7.756 0.020 . 1 . . . A 20 GLY H . 18545 1 221 . 1 1 20 20 GLY HA2 H 1 4.094 0.020 . 2 . . . A 20 GLY HA2 . 18545 1 222 . 1 1 20 20 GLY HA3 H 1 3.749 0.020 . 2 . . . A 20 GLY HA3 . 18545 1 223 . 1 1 20 20 GLY C C 13 173.486 0.3 . 1 . . . A 20 GLY C . 18545 1 224 . 1 1 20 20 GLY CA C 13 45.321 0.3 . 1 . . . A 20 GLY CA . 18545 1 225 . 1 1 20 20 GLY N N 15 111.629 0.3 . 1 . . . A 20 GLY N . 18545 1 226 . 1 1 21 21 LYS H H 1 7.206 0.020 . 1 . . . A 21 LYS H . 18545 1 227 . 1 1 21 21 LYS HA H 1 3.908 0.020 . 1 . . . A 21 LYS HA . 18545 1 228 . 1 1 21 21 LYS HB2 H 1 1.858 0.020 . 2 . . . A 21 LYS HB2 . 18545 1 229 . 1 1 21 21 LYS HB3 H 1 2.113 0.020 . 2 . . . A 21 LYS HB3 . 18545 1 230 . 1 1 21 21 LYS HG2 H 1 1.427 0.020 . 2 . . . A 21 LYS HG2 . 18545 1 231 . 1 1 21 21 LYS HG3 H 1 1.322 0.020 . 2 . . . A 21 LYS HG3 . 18545 1 232 . 1 1 21 21 LYS HD2 H 1 1.582 0.020 . 2 . . . A 21 LYS HD2 . 18545 1 233 . 1 1 21 21 LYS HD3 H 1 1.787 0.020 . 2 . . . A 21 LYS HD3 . 18545 1 234 . 1 1 21 21 LYS HE2 H 1 2.928 0.020 . 2 . . . A 21 LYS HE2 . 18545 1 235 . 1 1 21 21 LYS HE3 H 1 2.928 0.020 . 2 . . . A 21 LYS HE3 . 18545 1 236 . 1 1 21 21 LYS C C 13 177.124 0.3 . 1 . . . A 21 LYS C . 18545 1 237 . 1 1 21 21 LYS CA C 13 59.398 0.3 . 1 . . . A 21 LYS CA . 18545 1 238 . 1 1 21 21 LYS CB C 13 32.631 0.3 . 1 . . . A 21 LYS CB . 18545 1 239 . 1 1 21 21 LYS CG C 13 25.334 0.3 . 1 . . . A 21 LYS CG . 18545 1 240 . 1 1 21 21 LYS CD C 13 29.186 0.3 . 1 . . . A 21 LYS CD . 18545 1 241 . 1 1 21 21 LYS CE C 13 41.998 0.3 . 1 . . . A 21 LYS CE . 18545 1 242 . 1 1 21 21 LYS N N 15 122.117 0.3 . 1 . . . A 21 LYS N . 18545 1 243 . 1 1 22 22 GLU H H 1 9.370 0.020 . 1 . . . A 22 GLU H . 18545 1 244 . 1 1 22 22 GLU HA H 1 4.656 0.020 . 1 . . . A 22 GLU HA . 18545 1 245 . 1 1 22 22 GLU HB2 H 1 1.801 0.020 . 2 . . . A 22 GLU HB2 . 18545 1 246 . 1 1 22 22 GLU HB3 H 1 1.990 0.020 . 2 . . . A 22 GLU HB3 . 18545 1 247 . 1 1 22 22 GLU HG2 H 1 2.096 0.020 . 2 . . . A 22 GLU HG2 . 18545 1 248 . 1 1 22 22 GLU HG3 H 1 1.880 0.020 . 2 . . . A 22 GLU HG3 . 18545 1 249 . 1 1 22 22 GLU CA C 13 54.156 0.3 . 1 . . . A 22 GLU CA . 18545 1 250 . 1 1 22 22 GLU CB C 13 33.103 0.3 . 1 . . . A 22 GLU CB . 18545 1 251 . 1 1 22 22 GLU CG C 13 34.712 0.3 . 1 . . . A 22 GLU CG . 18545 1 252 . 1 1 22 22 GLU N N 15 115.840 0.3 . 1 . . . A 22 GLU N . 18545 1 253 . 1 1 23 23 GLY HA2 H 1 3.935 0.020 . 2 . . . A 23 GLY HA2 . 18545 1 254 . 1 1 23 23 GLY HA3 H 1 3.672 0.020 . 2 . . . A 23 GLY HA3 . 18545 1 255 . 1 1 23 23 GLY CA C 13 45.829 0.3 . 1 . . . A 23 GLY CA . 18545 1 256 . 1 1 25 25 LYS HA H 1 4.285 0.020 . 1 . . . A 25 LYS HA . 18545 1 257 . 1 1 25 25 LYS HB2 H 1 1.467 0.020 . 2 . . . A 25 LYS HB2 . 18545 1 258 . 1 1 25 25 LYS HB3 H 1 1.386 0.020 . 2 . . . A 25 LYS HB3 . 18545 1 259 . 1 1 25 25 LYS HG2 H 1 1.070 0.020 . 2 . . . A 25 LYS HG2 . 18545 1 260 . 1 1 25 25 LYS HG3 H 1 1.142 0.020 . 2 . . . A 25 LYS HG3 . 18545 1 261 . 1 1 25 25 LYS HD2 H 1 1.534 0.020 . 2 . . . A 25 LYS HD2 . 18545 1 262 . 1 1 25 25 LYS HD3 H 1 1.533 0.020 . 2 . . . A 25 LYS HD3 . 18545 1 263 . 1 1 25 25 LYS HE2 H 1 2.879 0.020 . 1 . . . A 25 LYS HE2 . 18545 1 264 . 1 1 25 25 LYS HE3 H 1 2.879 0.020 . 1 . . . A 25 LYS HE3 . 18545 1 265 . 1 1 25 25 LYS C C 13 176.297 0.3 . 1 . . . A 25 LYS C . 18545 1 266 . 1 1 25 25 LYS CA C 13 57.916 0.3 . 1 . . . A 25 LYS CA . 18545 1 267 . 1 1 25 25 LYS CB C 13 31.257 0.3 . 1 . . . A 25 LYS CB . 18545 1 268 . 1 1 25 25 LYS CG C 13 24.754 0.3 . 1 . . . A 25 LYS CG . 18545 1 269 . 1 1 25 25 LYS CD C 13 29.1 0.3 . 1 . . . A 25 LYS CD . 18545 1 270 . 1 1 25 25 LYS CE C 13 41.761 0.3 . 1 . . . A 25 LYS CE . 18545 1 271 . 1 1 26 26 TYR H H 1 9.450 0.020 . 1 . . . A 26 TYR H . 18545 1 272 . 1 1 26 26 TYR HA H 1 4.663 0.020 . 1 . . . A 26 TYR HA . 18545 1 273 . 1 1 26 26 TYR HB2 H 1 2.974 0.020 . 2 . . . A 26 TYR HB2 . 18545 1 274 . 1 1 26 26 TYR HB3 H 1 3.531 0.020 . 2 . . . A 26 TYR HB3 . 18545 1 275 . 1 1 26 26 TYR HD1 H 1 7.213 0.020 . 1 . . . A 26 TYR HD1 . 18545 1 276 . 1 1 26 26 TYR HE1 H 1 6.764 0.020 . 1 . . . A 26 TYR HE1 . 18545 1 277 . 1 1 26 26 TYR C C 13 173.587 0.3 . 1 . . . A 26 TYR C . 18545 1 278 . 1 1 26 26 TYR CA C 13 56.23 0.3 . 1 . . . A 26 TYR CA . 18545 1 279 . 1 1 26 26 TYR CB C 13 37.961 0.3 . 1 . . . A 26 TYR CB . 18545 1 280 . 1 1 26 26 TYR CD1 C 13 132.833 0.3 . 1 . . . A 26 TYR CD2 . 18545 1 281 . 1 1 26 26 TYR CE1 C 13 118.164 0.3 . 1 . . . A 26 TYR CE2 . 18545 1 282 . 1 1 26 26 TYR N N 15 119.946 0.3 . 1 . . . A 26 TYR N . 18545 1 283 . 1 1 27 27 LYS H H 1 7.104 0.020 . 1 . . . A 27 LYS H . 18545 1 284 . 1 1 27 27 LYS HA H 1 5.106 0.020 . 1 . . . A 27 LYS HA . 18545 1 285 . 1 1 27 27 LYS HB2 H 1 1.677 0.020 . 2 . . . A 27 LYS HB2 . 18545 1 286 . 1 1 27 27 LYS HB3 H 1 1.519 0.020 . 2 . . . A 27 LYS HB3 . 18545 1 287 . 1 1 27 27 LYS HG2 H 1 1.215 0.020 . 2 . . . A 27 LYS HG2 . 18545 1 288 . 1 1 27 27 LYS HG3 H 1 1.414 0.020 . 2 . . . A 27 LYS HG3 . 18545 1 289 . 1 1 27 27 LYS HD2 H 1 1.455 0.020 . 2 . . . A 27 LYS HD2 . 18545 1 290 . 1 1 27 27 LYS HD3 H 1 1.458 0.020 . 2 . . . A 27 LYS HD3 . 18545 1 291 . 1 1 27 27 LYS HE2 H 1 2.986 0.020 . 1 . . . A 27 LYS HE2 . 18545 1 292 . 1 1 27 27 LYS HE3 H 1 2.986 0.020 . 1 . . . A 27 LYS HE3 . 18545 1 293 . 1 1 27 27 LYS C C 13 174.574 0.3 . 1 . . . A 27 LYS C . 18545 1 294 . 1 1 27 27 LYS CA C 13 54.987 0.3 . 1 . . . A 27 LYS CA . 18545 1 295 . 1 1 27 27 LYS CB C 13 38.777 0.3 . 1 . . . A 27 LYS CB . 18545 1 296 . 1 1 27 27 LYS CG C 13 25.995 0.3 . 1 . . . A 27 LYS CG . 18545 1 297 . 1 1 27 27 LYS CD C 13 29.932 0.3 . 1 . . . A 27 LYS CD . 18545 1 298 . 1 1 27 27 LYS CE C 13 41.882 0.3 . 1 . . . A 27 LYS CE . 18545 1 299 . 1 1 27 27 LYS N N 15 114.809 0.3 . 1 . . . A 27 LYS N . 18545 1 300 . 1 1 28 28 LEU H H 1 9.759 0.020 . 1 . . . A 28 LEU H . 18545 1 301 . 1 1 28 28 LEU HA H 1 5.162 0.020 . 1 . . . A 28 LEU HA . 18545 1 302 . 1 1 28 28 LEU HB2 H 1 2.013 0.020 . 2 . . . A 28 LEU HB2 . 18545 1 303 . 1 1 28 28 LEU HB3 H 1 1.190 0.020 . 2 . . . A 28 LEU HB3 . 18545 1 304 . 1 1 28 28 LEU HD11 H 1 0.643 0.020 . 2 . . . A 28 LEU HD11 . 18545 1 305 . 1 1 28 28 LEU HD12 H 1 0.643 0.020 . 2 . . . A 28 LEU HD12 . 18545 1 306 . 1 1 28 28 LEU HD13 H 1 0.643 0.020 . 2 . . . A 28 LEU HD13 . 18545 1 307 . 1 1 28 28 LEU HD21 H 1 0.120 0.020 . 2 . . . A 28 LEU HD21 . 18545 1 308 . 1 1 28 28 LEU HD22 H 1 0.120 0.020 . 2 . . . A 28 LEU HD22 . 18545 1 309 . 1 1 28 28 LEU HD23 H 1 0.120 0.020 . 2 . . . A 28 LEU HD23 . 18545 1 310 . 1 1 28 28 LEU C C 13 175.852 0.3 . 1 . . . A 28 LEU C . 18545 1 311 . 1 1 28 28 LEU CA C 13 52.752 0.3 . 1 . . . A 28 LEU CA . 18545 1 312 . 1 1 28 28 LEU CB C 13 42.998 0.3 . 1 . . . A 28 LEU CB . 18545 1 313 . 1 1 28 28 LEU CD1 C 13 27.475 0.3 . 1 . . . A 28 LEU CD1 . 18545 1 314 . 1 1 28 28 LEU CD2 C 13 24.14 0.3 . 1 . . . A 28 LEU CD2 . 18545 1 315 . 1 1 28 28 LEU N N 15 125.814 0.3 . 1 . . . A 28 LEU N . 18545 1 316 . 1 1 29 29 SER H H 1 9.919 0.020 . 1 . . . A 29 SER H . 18545 1 317 . 1 1 29 29 SER HA H 1 4.552 0.020 . 1 . . . A 29 SER HA . 18545 1 318 . 1 1 29 29 SER HB2 H 1 4.277 0.020 . 2 . . . A 29 SER HB2 . 18545 1 319 . 1 1 29 29 SER HB3 H 1 4.060 0.020 . 2 . . . A 29 SER HB3 . 18545 1 320 . 1 1 29 29 SER C C 13 174.361 0.3 . 1 . . . A 29 SER C . 18545 1 321 . 1 1 29 29 SER CA C 13 56.29 0.3 . 1 . . . A 29 SER CA . 18545 1 322 . 1 1 29 29 SER CB C 13 65.304 0.3 . 1 . . . A 29 SER CB . 18545 1 323 . 1 1 29 29 SER N N 15 120.926 0.3 . 1 . . . A 29 SER N . 18545 1 324 . 1 1 30 30 LYS H H 1 8.874 0.020 . 1 . . . A 30 LYS H . 18545 1 325 . 1 1 30 30 LYS HA H 1 3.838 0.020 . 1 . . . A 30 LYS HA . 18545 1 326 . 1 1 30 30 LYS HB2 H 1 1.789 0.020 . 2 . . . A 30 LYS HB2 . 18545 1 327 . 1 1 30 30 LYS HB3 H 1 1.790 0.020 . 2 . . . A 30 LYS HB3 . 18545 1 328 . 1 1 30 30 LYS HG2 H 1 1.349 0.020 . 1 . . . A 30 LYS HG2 . 18545 1 329 . 1 1 30 30 LYS HG3 H 1 1.349 0.020 . 1 . . . A 30 LYS HG3 . 18545 1 330 . 1 1 30 30 LYS HD2 H 1 1.693 0.020 . 1 . . . A 30 LYS HD2 . 18545 1 331 . 1 1 30 30 LYS HD3 H 1 1.693 0.020 . 1 . . . A 30 LYS HD3 . 18545 1 332 . 1 1 30 30 LYS HE2 H 1 2.909 0.020 . 1 . . . A 30 LYS HE2 . 18545 1 333 . 1 1 30 30 LYS HE3 H 1 2.909 0.020 . 1 . . . A 30 LYS HE3 . 18545 1 334 . 1 1 30 30 LYS C C 13 177.758 0.3 . 1 . . . A 30 LYS C . 18545 1 335 . 1 1 30 30 LYS CA C 13 61.317 0.3 . 1 . . . A 30 LYS CA . 18545 1 336 . 1 1 30 30 LYS CB C 13 32.135 0.3 . 1 . . . A 30 LYS CB . 18545 1 337 . 1 1 30 30 LYS CG C 13 25.732 0.3 . 1 . . . A 30 LYS CG . 18545 1 338 . 1 1 30 30 LYS CD C 13 29.347 0.3 . 1 . . . A 30 LYS CD . 18545 1 339 . 1 1 30 30 LYS CE C 13 41.959 0.3 . 1 . . . A 30 LYS CE . 18545 1 340 . 1 1 30 30 LYS N N 15 120.307 0.3 . 1 . . . A 30 LYS N . 18545 1 341 . 1 1 31 31 LYS H H 1 7.940 0.020 . 1 . . . A 31 LYS H . 18545 1 342 . 1 1 31 31 LYS HA H 1 3.904 0.020 . 1 . . . A 31 LYS HA . 18545 1 343 . 1 1 31 31 LYS HB2 H 1 1.829 0.020 . 2 . . . A 31 LYS HB2 . 18545 1 344 . 1 1 31 31 LYS HB3 H 1 1.633 0.020 . 2 . . . A 31 LYS HB3 . 18545 1 345 . 1 1 31 31 LYS HG2 H 1 1.408 0.020 . 2 . . . A 31 LYS HG2 . 18545 1 346 . 1 1 31 31 LYS HG3 H 1 1.226 0.020 . 2 . . . A 31 LYS HG3 . 18545 1 347 . 1 1 31 31 LYS HD2 H 1 1.639 0.020 . 2 . . . A 31 LYS HD2 . 18545 1 348 . 1 1 31 31 LYS HD3 H 1 1.634 0.020 . 2 . . . A 31 LYS HD3 . 18545 1 349 . 1 1 31 31 LYS HE2 H 1 2.938 0.020 . 1 . . . A 31 LYS HE2 . 18545 1 350 . 1 1 31 31 LYS HE3 H 1 2.938 0.020 . 1 . . . A 31 LYS HE3 . 18545 1 351 . 1 1 31 31 LYS C C 13 178.651 0.3 . 1 . . . A 31 LYS C . 18545 1 352 . 1 1 31 31 LYS CA C 13 59.383 0.3 . 1 . . . A 31 LYS CA . 18545 1 353 . 1 1 31 31 LYS CB C 13 33.096 0.3 . 1 . . . A 31 LYS CB . 18545 1 354 . 1 1 31 31 LYS CG C 13 25.077 0.3 . 1 . . . A 31 LYS CG . 18545 1 355 . 1 1 31 31 LYS CD C 13 29.263 0.3 . 1 . . . A 31 LYS CD . 18545 1 356 . 1 1 31 31 LYS CE C 13 41.971 0.3 . 1 . . . A 31 LYS CE . 18545 1 357 . 1 1 31 31 LYS N N 15 118.292 0.3 . 1 . . . A 31 LYS N . 18545 1 358 . 1 1 32 32 GLU H H 1 7.535 0.020 . 1 . . . A 32 GLU H . 18545 1 359 . 1 1 32 32 GLU HA H 1 3.907 0.020 . 1 . . . A 32 GLU HA . 18545 1 360 . 1 1 32 32 GLU HB2 H 1 1.899 0.020 . 2 . . . A 32 GLU HB2 . 18545 1 361 . 1 1 32 32 GLU HB3 H 1 1.899 0.020 . 2 . . . A 32 GLU HB3 . 18545 1 362 . 1 1 32 32 GLU HG2 H 1 2.366 0.020 . 2 . . . A 32 GLU HG2 . 18545 1 363 . 1 1 32 32 GLU HG3 H 1 2.366 0.020 . 2 . . . A 32 GLU HG3 . 18545 1 364 . 1 1 32 32 GLU C C 13 178.422 0.3 . 1 . . . A 32 GLU C . 18545 1 365 . 1 1 32 32 GLU CA C 13 58.785 0.3 . 1 . . . A 32 GLU CA . 18545 1 366 . 1 1 32 32 GLU CB C 13 30.997 0.3 . 1 . . . A 32 GLU CB . 18545 1 367 . 1 1 32 32 GLU CG C 13 36.903 0.3 . 1 . . . A 32 GLU CG . 18545 1 368 . 1 1 32 32 GLU N N 15 119.337 0.3 . 1 . . . A 32 GLU N . 18545 1 369 . 1 1 33 33 LEU H H 1 9.098 0.020 . 1 . . . A 33 LEU H . 18545 1 370 . 1 1 33 33 LEU HA H 1 3.910 0.020 . 1 . . . A 33 LEU HA . 18545 1 371 . 1 1 33 33 LEU HB2 H 1 2.009 0.020 . 2 . . . A 33 LEU HB2 . 18545 1 372 . 1 1 33 33 LEU HB3 H 1 1.309 0.020 . 2 . . . A 33 LEU HB3 . 18545 1 373 . 1 1 33 33 LEU HG H 1 1.954 0.020 . 1 . . . A 33 LEU HG . 18545 1 374 . 1 1 33 33 LEU HD11 H 1 0.812 0.020 . 2 . . . A 33 LEU HD11 . 18545 1 375 . 1 1 33 33 LEU HD12 H 1 0.812 0.020 . 2 . . . A 33 LEU HD12 . 18545 1 376 . 1 1 33 33 LEU HD13 H 1 0.812 0.020 . 2 . . . A 33 LEU HD13 . 18545 1 377 . 1 1 33 33 LEU HD21 H 1 0.875 0.020 . 2 . . . A 33 LEU HD21 . 18545 1 378 . 1 1 33 33 LEU HD22 H 1 0.875 0.020 . 2 . . . A 33 LEU HD22 . 18545 1 379 . 1 1 33 33 LEU HD23 H 1 0.875 0.020 . 2 . . . A 33 LEU HD23 . 18545 1 380 . 1 1 33 33 LEU C C 13 177.573 0.3 . 1 . . . A 33 LEU C . 18545 1 381 . 1 1 33 33 LEU CA C 13 57.722 0.3 . 1 . . . A 33 LEU CA . 18545 1 382 . 1 1 33 33 LEU CB C 13 41.534 0.3 . 1 . . . A 33 LEU CB . 18545 1 383 . 1 1 33 33 LEU CG C 13 26.494 0.3 . 1 . . . A 33 LEU CG . 18545 1 384 . 1 1 33 33 LEU CD1 C 13 22.574 0.3 . 1 . . . A 33 LEU CD1 . 18545 1 385 . 1 1 33 33 LEU CD2 C 13 26.507 0.3 . 1 . . . A 33 LEU CD2 . 18545 1 386 . 1 1 33 33 LEU N N 15 119.503 0.3 . 1 . . . A 33 LEU N . 18545 1 387 . 1 1 34 34 LYS H H 1 8.276 0.020 . 1 . . . A 34 LYS H . 18545 1 388 . 1 1 34 34 LYS HA H 1 3.647 0.020 . 1 . . . A 34 LYS HA . 18545 1 389 . 1 1 34 34 LYS HB2 H 1 2.122 0.020 . 2 . . . A 34 LYS HB2 . 18545 1 390 . 1 1 34 34 LYS HB3 H 1 1.856 0.020 . 2 . . . A 34 LYS HB3 . 18545 1 391 . 1 1 34 34 LYS HG2 H 1 1.294 0.020 . 1 . . . A 34 LYS HG2 . 18545 1 392 . 1 1 34 34 LYS HD2 H 1 1.670 0.020 . 2 . . . A 34 LYS HD2 . 18545 1 393 . 1 1 34 34 LYS HD3 H 1 1.670 0.020 . 2 . . . A 34 LYS HD3 . 18545 1 394 . 1 1 34 34 LYS HE2 H 1 2.929 0.020 . 1 . . . A 34 LYS HE2 . 18545 1 395 . 1 1 34 34 LYS HE3 H 1 2.929 0.020 . 1 . . . A 34 LYS HE3 . 18545 1 396 . 1 1 34 34 LYS C C 13 177.325 0.3 . 1 . . . A 34 LYS C . 18545 1 397 . 1 1 34 34 LYS CA C 13 60.654 0.3 . 1 . . . A 34 LYS CA . 18545 1 398 . 1 1 34 34 LYS CB C 13 32.005 0.3 . 1 . . . A 34 LYS CB . 18545 1 399 . 1 1 34 34 LYS CD C 13 29.602 0.3 . 1 . . . A 34 LYS CD . 18545 1 400 . 1 1 34 34 LYS CE C 13 41.81 0.3 . 1 . . . A 34 LYS CE . 18545 1 401 . 1 1 34 34 LYS N N 15 119.138 0.3 . 1 . . . A 34 LYS N . 18545 1 402 . 1 1 35 35 GLU H H 1 7.757 0.020 . 1 . . . A 35 GLU H . 18545 1 403 . 1 1 35 35 GLU HA H 1 3.963 0.020 . 1 . . . A 35 GLU HA . 18545 1 404 . 1 1 35 35 GLU HB2 H 1 2.065 0.020 . 2 . . . A 35 GLU HB2 . 18545 1 405 . 1 1 35 35 GLU HB3 H 1 2.158 0.020 . 2 . . . A 35 GLU HB3 . 18545 1 406 . 1 1 35 35 GLU HG2 H 1 2.548 0.020 . 2 . . . A 35 GLU HG2 . 18545 1 407 . 1 1 35 35 GLU HG3 H 1 2.217 0.020 . 2 . . . A 35 GLU HG3 . 18545 1 408 . 1 1 35 35 GLU C C 13 178.742 0.3 . 1 . . . A 35 GLU C . 18545 1 409 . 1 1 35 35 GLU CA C 13 59.515 0.3 . 1 . . . A 35 GLU CA . 18545 1 410 . 1 1 35 35 GLU CB C 13 29.05 0.3 . 1 . . . A 35 GLU CB . 18545 1 411 . 1 1 35 35 GLU CG C 13 37.026 0.3 . 1 . . . A 35 GLU CG . 18545 1 412 . 1 1 35 35 GLU N N 15 117.517 0.3 . 1 . . . A 35 GLU N . 18545 1 413 . 1 1 36 36 LEU H H 1 8.336 0.020 . 1 . . . A 36 LEU H . 18545 1 414 . 1 1 36 36 LEU HA H 1 2.684 0.020 . 1 . . . A 36 LEU HA . 18545 1 415 . 1 1 36 36 LEU HB2 H 1 1.106 0.020 . 2 . . . A 36 LEU HB2 . 18545 1 416 . 1 1 36 36 LEU HB3 H 1 1.680 0.020 . 2 . . . A 36 LEU HB3 . 18545 1 417 . 1 1 36 36 LEU HG H 1 1.182 0.020 . 1 . . . A 36 LEU HG . 18545 1 418 . 1 1 36 36 LEU HD11 H 1 0.651 0.020 . 2 . . . A 36 LEU HD11 . 18545 1 419 . 1 1 36 36 LEU HD12 H 1 0.651 0.020 . 2 . . . A 36 LEU HD12 . 18545 1 420 . 1 1 36 36 LEU HD13 H 1 0.651 0.020 . 2 . . . A 36 LEU HD13 . 18545 1 421 . 1 1 36 36 LEU HD21 H 1 0.706 0.020 . 2 . . . A 36 LEU HD21 . 18545 1 422 . 1 1 36 36 LEU HD22 H 1 0.706 0.020 . 2 . . . A 36 LEU HD22 . 18545 1 423 . 1 1 36 36 LEU HD23 H 1 0.706 0.020 . 2 . . . A 36 LEU HD23 . 18545 1 424 . 1 1 36 36 LEU C C 13 178.503 0.3 . 1 . . . A 36 LEU C . 18545 1 425 . 1 1 36 36 LEU CA C 13 59.82 0.3 . 1 . . . A 36 LEU CA . 18545 1 426 . 1 1 36 36 LEU CB C 13 41.987 0.3 . 1 . . . A 36 LEU CB . 18545 1 427 . 1 1 36 36 LEU CG C 13 28.333 0.3 . 1 . . . A 36 LEU CG . 18545 1 428 . 1 1 36 36 LEU CD1 C 13 24.25 0.3 . 1 . . . A 36 LEU CD1 . 18545 1 429 . 1 1 36 36 LEU CD2 C 13 27.424 0.3 . 1 . . . A 36 LEU CD2 . 18545 1 430 . 1 1 36 36 LEU N N 15 124.513 0.3 . 1 . . . A 36 LEU N . 18545 1 431 . 1 1 37 37 LEU H H 1 8.696 0.020 . 1 . . . A 37 LEU H . 18545 1 432 . 1 1 37 37 LEU HA H 1 3.725 0.020 . 1 . . . A 37 LEU HA . 18545 1 433 . 1 1 37 37 LEU HB2 H 1 1.283 0.020 . 2 . . . A 37 LEU HB2 . 18545 1 434 . 1 1 37 37 LEU HB3 H 1 1.949 0.020 . 2 . . . A 37 LEU HB3 . 18545 1 435 . 1 1 37 37 LEU HD11 H 1 0.676 0.020 . 2 . . . A 37 LEU HD11 . 18545 1 436 . 1 1 37 37 LEU HD12 H 1 0.676 0.020 . 2 . . . A 37 LEU HD12 . 18545 1 437 . 1 1 37 37 LEU HD13 H 1 0.676 0.020 . 2 . . . A 37 LEU HD13 . 18545 1 438 . 1 1 37 37 LEU HD21 H 1 0.802 0.020 . 2 . . . A 37 LEU HD21 . 18545 1 439 . 1 1 37 37 LEU HD22 H 1 0.802 0.020 . 2 . . . A 37 LEU HD22 . 18545 1 440 . 1 1 37 37 LEU HD23 H 1 0.802 0.020 . 2 . . . A 37 LEU HD23 . 18545 1 441 . 1 1 37 37 LEU C C 13 178.529 0.3 . 1 . . . A 37 LEU C . 18545 1 442 . 1 1 37 37 LEU CA C 13 58.365 0.3 . 1 . . . A 37 LEU CA . 18545 1 443 . 1 1 37 37 LEU CB C 13 41.793 0.3 . 1 . . . A 37 LEU CB . 18545 1 444 . 1 1 37 37 LEU CD1 C 13 22.725 0.3 . 1 . . . A 37 LEU CD1 . 18545 1 445 . 1 1 37 37 LEU CD2 C 13 26.455 0.3 . 1 . . . A 37 LEU CD2 . 18545 1 446 . 1 1 37 37 LEU N N 15 118.901 0.3 . 1 . . . A 37 LEU N . 18545 1 447 . 1 1 38 38 GLN H H 1 8.535 0.020 . 1 . . . A 38 GLN H . 18545 1 448 . 1 1 38 38 GLN HA H 1 3.959 0.020 . 1 . . . A 38 GLN HA . 18545 1 449 . 1 1 38 38 GLN HB2 H 1 1.983 0.020 . 2 . . . A 38 GLN HB2 . 18545 1 450 . 1 1 38 38 GLN HB3 H 1 2.147 0.020 . 2 . . . A 38 GLN HB3 . 18545 1 451 . 1 1 38 38 GLN HG2 H 1 2.327 0.020 . 2 . . . A 38 GLN HG2 . 18545 1 452 . 1 1 38 38 GLN HG3 H 1 2.488 0.020 . 2 . . . A 38 GLN HG3 . 18545 1 453 . 1 1 38 38 GLN HE21 H 1 6.814 0.020 . 1 . . . A 38 GLN HE21 . 18545 1 454 . 1 1 38 38 GLN HE22 H 1 7.369 0.020 . 1 . . . A 38 GLN HE22 . 18545 1 455 . 1 1 38 38 GLN C C 13 177.534 0.3 . 1 . . . A 38 GLN C . 18545 1 456 . 1 1 38 38 GLN CA C 13 58.597 0.3 . 1 . . . A 38 GLN CA . 18545 1 457 . 1 1 38 38 GLN CB C 13 29.202 0.3 . 1 . . . A 38 GLN CB . 18545 1 458 . 1 1 38 38 GLN CG C 13 34.479 0.3 . 1 . . . A 38 GLN CG . 18545 1 459 . 1 1 38 38 GLN N N 15 114.582 0.3 . 1 . . . A 38 GLN N . 18545 1 460 . 1 1 38 38 GLN NE2 N 15 110.878 0.3 . 1 . . . A 38 GLN NE2 . 18545 1 461 . 1 1 39 39 THR H H 1 7.874 0.020 . 1 . . . A 39 THR H . 18545 1 462 . 1 1 39 39 THR HA H 1 4.241 0.020 . 1 . . . A 39 THR HA . 18545 1 463 . 1 1 39 39 THR HB H 1 4.219 0.020 . 1 . . . A 39 THR HB . 18545 1 464 . 1 1 39 39 THR HG21 H 1 1.406 0.020 . 1 . . . A 39 THR HG21 . 18545 1 465 . 1 1 39 39 THR HG22 H 1 1.406 0.020 . 1 . . . A 39 THR HG22 . 18545 1 466 . 1 1 39 39 THR HG23 H 1 1.406 0.020 . 1 . . . A 39 THR HG23 . 18545 1 467 . 1 1 39 39 THR C C 13 176.324 0.3 . 1 . . . A 39 THR C . 18545 1 468 . 1 1 39 39 THR CA C 13 64.792 0.3 . 1 . . . A 39 THR CA . 18545 1 469 . 1 1 39 39 THR CB C 13 70.02 0.3 . 1 . . . A 39 THR CB . 18545 1 470 . 1 1 39 39 THR CG2 C 13 21.723 0.3 . 1 . . . A 39 THR CG2 . 18545 1 471 . 1 1 39 39 THR N N 15 110.032 0.3 . 1 . . . A 39 THR N . 18545 1 472 . 1 1 40 40 GLU H H 1 8.453 0.020 . 1 . . . A 40 GLU H . 18545 1 473 . 1 1 40 40 GLU HA H 1 4.761 0.020 . 1 . . . A 40 GLU HA . 18545 1 474 . 1 1 40 40 GLU HB2 H 1 2.422 0.020 . 2 . . . A 40 GLU HB2 . 18545 1 475 . 1 1 40 40 GLU HB3 H 1 2.399 0.020 . 2 . . . A 40 GLU HB3 . 18545 1 476 . 1 1 40 40 GLU HG2 H 1 2.500 0.020 . 2 . . . A 40 GLU HG2 . 18545 1 477 . 1 1 40 40 GLU HG3 H 1 2.543 0.020 . 2 . . . A 40 GLU HG3 . 18545 1 478 . 1 1 40 40 GLU C C 13 177.746 0.3 . 1 . . . A 40 GLU C . 18545 1 479 . 1 1 40 40 GLU CA C 13 56.382 0.3 . 1 . . . A 40 GLU CA . 18545 1 480 . 1 1 40 40 GLU CB C 13 31.675 0.3 . 1 . . . A 40 GLU CB . 18545 1 481 . 1 1 40 40 GLU CG C 13 35.05 0.3 . 1 . . . A 40 GLU CG . 18545 1 482 . 1 1 40 40 GLU N N 15 117.312 0.3 . 1 . . . A 40 GLU N . 18545 1 483 . 1 1 41 41 LEU H H 1 7.676 0.020 . 1 . . . A 41 LEU H . 18545 1 484 . 1 1 41 41 LEU HA H 1 5.012 0.020 . 1 . . . A 41 LEU HA . 18545 1 485 . 1 1 41 41 LEU HB2 H 1 1.812 0.020 . 2 . . . A 41 LEU HB2 . 18545 1 486 . 1 1 41 41 LEU HB3 H 1 1.651 0.020 . 2 . . . A 41 LEU HB3 . 18545 1 487 . 1 1 41 41 LEU HG H 1 1.375 0.020 . 1 . . . A 41 LEU HG . 18545 1 488 . 1 1 41 41 LEU HD11 H 1 0.799 0.020 . 2 . . . A 41 LEU HD11 . 18545 1 489 . 1 1 41 41 LEU HD12 H 1 0.799 0.020 . 2 . . . A 41 LEU HD12 . 18545 1 490 . 1 1 41 41 LEU HD13 H 1 0.799 0.020 . 2 . . . A 41 LEU HD13 . 18545 1 491 . 1 1 41 41 LEU HD21 H 1 0.549 0.020 . 2 . . . A 41 LEU HD21 . 18545 1 492 . 1 1 41 41 LEU HD22 H 1 0.549 0.020 . 2 . . . A 41 LEU HD22 . 18545 1 493 . 1 1 41 41 LEU HD23 H 1 0.549 0.020 . 2 . . . A 41 LEU HD23 . 18545 1 494 . 1 1 41 41 LEU C C 13 176.802 0.3 . 1 . . . A 41 LEU C . 18545 1 495 . 1 1 41 41 LEU CA C 13 52.675 0.3 . 1 . . . A 41 LEU CA . 18545 1 496 . 1 1 41 41 LEU CB C 13 43.709 0.3 . 1 . . . A 41 LEU CB . 18545 1 497 . 1 1 41 41 LEU CG C 13 26.497 0.3 . 1 . . . A 41 LEU CG . 18545 1 498 . 1 1 41 41 LEU CD1 C 13 23.725 0.3 . 1 . . . A 41 LEU CD1 . 18545 1 499 . 1 1 41 41 LEU CD2 C 13 25.984 0.3 . 1 . . . A 41 LEU CD2 . 18545 1 500 . 1 1 41 41 LEU N N 15 121.084 0.3 . 1 . . . A 41 LEU N . 18545 1 501 . 1 1 42 42 SER H H 1 8.259 0.020 . 1 . . . A 42 SER H . 18545 1 502 . 1 1 42 42 SER HA H 1 4.042 0.020 . 1 . . . A 42 SER HA . 18545 1 503 . 1 1 42 42 SER HB2 H 1 3.999 0.020 . 2 . . . A 42 SER HB2 . 18545 1 504 . 1 1 42 42 SER HB3 H 1 3.952 0.020 . 2 . . . A 42 SER HB3 . 18545 1 505 . 1 1 42 42 SER CA C 13 61.686 0.3 . 1 . . . A 42 SER CA . 18545 1 506 . 1 1 42 42 SER CB C 13 62.736 0.3 . 1 . . . A 42 SER CB . 18545 1 507 . 1 1 42 42 SER N N 15 116.572 0.3 . 1 . . . A 42 SER N . 18545 1 508 . 1 1 43 43 GLY H H 1 8.856 0.020 . 1 . . . A 43 GLY H . 18545 1 509 . 1 1 43 43 GLY HA2 H 1 3.877 0.020 . 1 . . . A 43 GLY HA2 . 18545 1 510 . 1 1 43 43 GLY HA3 H 1 3.877 0.020 . 1 . . . A 43 GLY HA3 . 18545 1 511 . 1 1 43 43 GLY C C 13 175.539 0.3 . 1 . . . A 43 GLY C . 18545 1 512 . 1 1 43 43 GLY CA C 13 46.183 0.3 . 1 . . . A 43 GLY CA . 18545 1 513 . 1 1 43 43 GLY N N 15 111.411 0.3 . 1 . . . A 43 GLY N . 18545 1 514 . 1 1 44 44 PHE H H 1 7.966 0.020 . 1 . . . A 44 PHE H . 18545 1 515 . 1 1 44 44 PHE HA H 1 4.346 0.020 . 1 . . . A 44 PHE HA . 18545 1 516 . 1 1 44 44 PHE HB2 H 1 3.165 0.020 . 2 . . . A 44 PHE HB2 . 18545 1 517 . 1 1 44 44 PHE HB3 H 1 3.099 0.020 . 2 . . . A 44 PHE HB3 . 18545 1 518 . 1 1 44 44 PHE HD1 H 1 7.091 0.020 . 1 . . . A 44 PHE HD1 . 18545 1 519 . 1 1 44 44 PHE C C 13 176.886 0.3 . 1 . . . A 44 PHE C . 18545 1 520 . 1 1 44 44 PHE CA C 13 59.861 0.3 . 1 . . . A 44 PHE CA . 18545 1 521 . 1 1 44 44 PHE CB C 13 39.639 0.3 . 1 . . . A 44 PHE CB . 18545 1 522 . 1 1 44 44 PHE CD1 C 13 131.931 0.3 . 1 . . . A 44 PHE CD1 . 18545 1 523 . 1 1 44 44 PHE N N 15 122.411 0.3 . 1 . . . A 44 PHE N . 18545 1 524 . 1 1 45 45 LEU H H 1 8.175 0.020 . 1 . . . A 45 LEU H . 18545 1 525 . 1 1 45 45 LEU HA H 1 3.911 0.020 . 1 . . . A 45 LEU HA . 18545 1 526 . 1 1 45 45 LEU HB2 H 1 1.584 0.020 . 1 . . . A 45 LEU HB2 . 18545 1 527 . 1 1 45 45 LEU HB3 H 1 1.584 0.020 . 1 . . . A 45 LEU HB3 . 18545 1 528 . 1 1 45 45 LEU HG H 1 1.611 0.020 . 1 . . . A 45 LEU HG . 18545 1 529 . 1 1 45 45 LEU HD11 H 1 0.817 0.020 . 2 . . . A 45 LEU HD11 . 18545 1 530 . 1 1 45 45 LEU HD12 H 1 0.817 0.020 . 2 . . . A 45 LEU HD12 . 18545 1 531 . 1 1 45 45 LEU HD13 H 1 0.817 0.020 . 2 . . . A 45 LEU HD13 . 18545 1 532 . 1 1 45 45 LEU HD21 H 1 0.781 0.020 . 2 . . . A 45 LEU HD21 . 18545 1 533 . 1 1 45 45 LEU HD22 H 1 0.781 0.020 . 2 . . . A 45 LEU HD22 . 18545 1 534 . 1 1 45 45 LEU HD23 H 1 0.781 0.020 . 2 . . . A 45 LEU HD23 . 18545 1 535 . 1 1 45 45 LEU C C 13 178.141 0.3 . 1 . . . A 45 LEU C . 18545 1 536 . 1 1 45 45 LEU CA C 13 56.394 0.3 . 1 . . . A 45 LEU CA . 18545 1 537 . 1 1 45 45 LEU CB C 13 41.92 0.3 . 1 . . . A 45 LEU CB . 18545 1 538 . 1 1 45 45 LEU CG C 13 26.923 0.3 . 1 . . . A 45 LEU CG . 18545 1 539 . 1 1 45 45 LEU CD1 C 13 25.047 0.3 . 1 . . . A 45 LEU CD1 . 18545 1 540 . 1 1 45 45 LEU CD2 C 13 24.078 0.3 . 1 . . . A 45 LEU CD2 . 18545 1 541 . 1 1 45 45 LEU N N 15 119.373 0.3 . 1 . . . A 45 LEU N . 18545 1 542 . 1 1 46 46 ASP H H 1 8.305 0.020 . 1 . . . A 46 ASP H . 18545 1 543 . 1 1 46 46 ASP HA H 1 4.365 0.020 . 1 . . . A 46 ASP HA . 18545 1 544 . 1 1 46 46 ASP HB2 H 1 2.606 0.020 . 2 . . . A 46 ASP HB2 . 18545 1 545 . 1 1 46 46 ASP HB3 H 1 2.609 0.020 . 2 . . . A 46 ASP HB3 . 18545 1 546 . 1 1 46 46 ASP C C 13 176.755 0.3 . 1 . . . A 46 ASP C . 18545 1 547 . 1 1 46 46 ASP CA C 13 55.543 0.3 . 1 . . . A 46 ASP CA . 18545 1 548 . 1 1 46 46 ASP CB C 13 40.858 0.3 . 1 . . . A 46 ASP CB . 18545 1 549 . 1 1 46 46 ASP N N 15 119.841 0.3 . 1 . . . A 46 ASP N . 18545 1 550 . 1 1 47 47 ALA H H 1 7.569 0.020 . 1 . . . A 47 ALA H . 18545 1 551 . 1 1 47 47 ALA HA H 1 4.143 0.020 . 1 . . . A 47 ALA HA . 18545 1 552 . 1 1 47 47 ALA HB1 H 1 1.337 0.020 . 1 . . . A 47 ALA HB1 . 18545 1 553 . 1 1 47 47 ALA HB2 H 1 1.337 0.020 . 1 . . . A 47 ALA HB2 . 18545 1 554 . 1 1 47 47 ALA HB3 H 1 1.337 0.020 . 1 . . . A 47 ALA HB3 . 18545 1 555 . 1 1 47 47 ALA C C 13 177.771 0.3 . 1 . . . A 47 ALA C . 18545 1 556 . 1 1 47 47 ALA CA C 13 52.886 0.3 . 1 . . . A 47 ALA CA . 18545 1 557 . 1 1 47 47 ALA CB C 13 18.707 0.3 . 1 . . . A 47 ALA CB . 18545 1 558 . 1 1 47 47 ALA N N 15 120.823 0.3 . 1 . . . A 47 ALA N . 18545 1 559 . 1 1 48 48 GLN H H 1 7.630 0.020 . 1 . . . A 48 GLN H . 18545 1 560 . 1 1 48 48 GLN HA H 1 4.114 0.020 . 1 . . . A 48 GLN HA . 18545 1 561 . 1 1 48 48 GLN HB2 H 1 1.899 0.020 . 2 . . . A 48 GLN HB2 . 18545 1 562 . 1 1 48 48 GLN HB3 H 1 2.051 0.020 . 2 . . . A 48 GLN HB3 . 18545 1 563 . 1 1 48 48 GLN HG2 H 1 2.248 0.020 . 2 . . . A 48 GLN HG2 . 18545 1 564 . 1 1 48 48 GLN HG3 H 1 2.248 0.020 . 2 . . . A 48 GLN HG3 . 18545 1 565 . 1 1 48 48 GLN HE21 H 1 7.498 0.020 . 5 . . . A 48 GLN HE21 . 18545 1 566 . 1 1 48 48 GLN HE22 H 1 6.824 0.020 . 5 . . . A 48 GLN HE22 . 18545 1 567 . 1 1 48 48 GLN CA C 13 55.241 0.3 . 1 . . . A 48 GLN CA . 18545 1 568 . 1 1 48 48 GLN CB C 13 28.419 0.3 . 1 . . . A 48 GLN CB . 18545 1 569 . 1 1 48 48 GLN CG C 13 33.059 0.3 . 1 . . . A 48 GLN CG . 18545 1 570 . 1 1 48 48 GLN N N 15 116.276 0.3 . 1 . . . A 48 GLN N . 18545 1 571 . 1 1 48 48 GLN NE2 N 15 111.602 0.3 . 5 . . . A 48 GLN NE2 . 18545 1 572 . 1 1 49 49 LYS HA H 1 4.110 0.020 . 1 . . . A 49 LYS HA . 18545 1 573 . 1 1 49 49 LYS HB2 H 1 1.786 0.020 . 2 . . . A 49 LYS HB2 . 18545 1 574 . 1 1 49 49 LYS HB3 H 1 1.730 0.020 . 2 . . . A 49 LYS HB3 . 18545 1 575 . 1 1 49 49 LYS HG2 H 1 1.320 0.020 . 2 . . . A 49 LYS HG2 . 18545 1 576 . 1 1 49 49 LYS HG3 H 1 1.371 0.020 . 2 . . . A 49 LYS HG3 . 18545 1 577 . 1 1 49 49 LYS HD2 H 1 1.600 0.020 . 1 . . . A 49 LYS HD2 . 18545 1 578 . 1 1 49 49 LYS HE2 H 1 2.947 0.020 . 2 . . . A 49 LYS HE2 . 18545 1 579 . 1 1 49 49 LYS HE3 H 1 2.947 0.020 . 2 . . . A 49 LYS HE3 . 18545 1 580 . 1 1 49 49 LYS C C 13 176.043 0.3 . 1 . . . A 49 LYS C . 18545 1 581 . 1 1 49 49 LYS CA C 13 56.708 0.3 . 1 . . . A 49 LYS CA . 18545 1 582 . 1 1 49 49 LYS CB C 13 32.161 0.3 . 1 . . . A 49 LYS CB . 18545 1 583 . 1 1 49 49 LYS CG C 13 24.632 0.3 . 1 . . . A 49 LYS CG . 18545 1 584 . 1 1 49 49 LYS CD C 13 28.81 0.3 . 1 . . . A 49 LYS CD . 18545 1 585 . 1 1 49 49 LYS CE C 13 41.721 0.3 . 1 . . . A 49 LYS CE . 18545 1 586 . 1 1 50 50 ASP H H 1 8.000 0.020 . 1 . . . A 50 ASP H . 18545 1 587 . 1 1 50 50 ASP HA H 1 4.612 0.020 . 1 . . . A 50 ASP HA . 18545 1 588 . 1 1 50 50 ASP HB2 H 1 2.478 0.020 . 2 . . . A 50 ASP HB2 . 18545 1 589 . 1 1 50 50 ASP HB3 H 1 2.600 0.020 . 2 . . . A 50 ASP HB3 . 18545 1 590 . 1 1 50 50 ASP C C 13 176.379 0.3 . 1 . . . A 50 ASP C . 18545 1 591 . 1 1 50 50 ASP CA C 13 53.995 0.3 . 1 . . . A 50 ASP CA . 18545 1 592 . 1 1 50 50 ASP CB C 13 41.931 0.3 . 1 . . . A 50 ASP CB . 18545 1 593 . 1 1 50 50 ASP N N 15 118.661 0.3 . 1 . . . A 50 ASP N . 18545 1 594 . 1 1 51 51 VAL H H 1 8.241 0.020 . 1 . . . A 51 VAL H . 18545 1 595 . 1 1 51 51 VAL HA H 1 3.958 0.020 . 1 . . . A 51 VAL HA . 18545 1 596 . 1 1 51 51 VAL HB H 1 2.086 0.020 . 1 . . . A 51 VAL HB . 18545 1 597 . 1 1 51 51 VAL HG11 H 1 0.918 0.020 . 2 . . . A 51 VAL HG11 . 18545 1 598 . 1 1 51 51 VAL HG12 H 1 0.918 0.020 . 2 . . . A 51 VAL HG12 . 18545 1 599 . 1 1 51 51 VAL HG13 H 1 0.918 0.020 . 2 . . . A 51 VAL HG13 . 18545 1 600 . 1 1 51 51 VAL HG21 H 1 0.915 0.020 . 2 . . . A 51 VAL HG21 . 18545 1 601 . 1 1 51 51 VAL HG22 H 1 0.915 0.020 . 2 . . . A 51 VAL HG22 . 18545 1 602 . 1 1 51 51 VAL HG23 H 1 0.915 0.020 . 2 . . . A 51 VAL HG23 . 18545 1 603 . 1 1 51 51 VAL C C 13 176.124 0.3 . 1 . . . A 51 VAL C . 18545 1 604 . 1 1 51 51 VAL CA C 13 63.57 0.3 . 1 . . . A 51 VAL CA . 18545 1 605 . 1 1 51 51 VAL CB C 13 32.255 0.3 . 1 . . . A 51 VAL CB . 18545 1 606 . 1 1 51 51 VAL CG1 C 13 20.777 0.3 . 1 . . . A 51 VAL CG1 . 18545 1 607 . 1 1 51 51 VAL CG2 C 13 20.54 0.3 . 1 . . . A 51 VAL CG2 . 18545 1 608 . 1 1 51 51 VAL N N 15 121.056 0.3 . 1 . . . A 51 VAL N . 18545 1 609 . 1 1 52 52 ASP H H 1 8.436 0.020 . 1 . . . A 52 ASP H . 18545 1 610 . 1 1 52 52 ASP HA H 1 4.754 0.020 . 1 . . . A 52 ASP HA . 18545 1 611 . 1 1 52 52 ASP HB2 H 1 2.808 0.020 . 2 . . . A 52 ASP HB2 . 18545 1 612 . 1 1 52 52 ASP HB3 H 1 2.564 0.020 . 2 . . . A 52 ASP HB3 . 18545 1 613 . 1 1 52 52 ASP C C 13 176.362 0.3 . 1 . . . A 52 ASP C . 18545 1 614 . 1 1 52 52 ASP CA C 13 53.842 0.3 . 1 . . . A 52 ASP CA . 18545 1 615 . 1 1 52 52 ASP CB C 13 40.388 0.3 . 1 . . . A 52 ASP CB . 18545 1 616 . 1 1 52 52 ASP N N 15 121.216 0.3 . 1 . . . A 52 ASP N . 18545 1 617 . 1 1 53 53 ALA H H 1 7.781 0.020 . 1 . . . A 53 ALA H . 18545 1 618 . 1 1 53 53 ALA HA H 1 3.924 0.020 . 1 . . . A 53 ALA HA . 18545 1 619 . 1 1 53 53 ALA HB1 H 1 1.407 0.020 . 1 . . . A 53 ALA HB1 . 18545 1 620 . 1 1 53 53 ALA HB2 H 1 1.407 0.020 . 1 . . . A 53 ALA HB2 . 18545 1 621 . 1 1 53 53 ALA HB3 H 1 1.407 0.020 . 1 . . . A 53 ALA HB3 . 18545 1 622 . 1 1 53 53 ALA C C 13 179.199 0.3 . 1 . . . A 53 ALA C . 18545 1 623 . 1 1 53 53 ALA CA C 13 55.207 0.3 . 1 . . . A 53 ALA CA . 18545 1 624 . 1 1 53 53 ALA CB C 13 19.297 0.3 . 1 . . . A 53 ALA CB . 18545 1 625 . 1 1 53 53 ALA N N 15 123.401 0.3 . 1 . . . A 53 ALA N . 18545 1 626 . 1 1 54 54 VAL H H 1 8.306 0.020 . 1 . . . A 54 VAL H . 18545 1 627 . 1 1 54 54 VAL HA H 1 3.449 0.020 . 1 . . . A 54 VAL HA . 18545 1 628 . 1 1 54 54 VAL HB H 1 2.081 0.020 . 1 . . . A 54 VAL HB . 18545 1 629 . 1 1 54 54 VAL HG11 H 1 0.972 0.020 . 2 . . . A 54 VAL HG11 . 18545 1 630 . 1 1 54 54 VAL HG12 H 1 0.972 0.020 . 2 . . . A 54 VAL HG12 . 18545 1 631 . 1 1 54 54 VAL HG13 H 1 0.972 0.020 . 2 . . . A 54 VAL HG13 . 18545 1 632 . 1 1 54 54 VAL HG21 H 1 0.873 0.020 . 2 . . . A 54 VAL HG21 . 18545 1 633 . 1 1 54 54 VAL HG22 H 1 0.873 0.020 . 2 . . . A 54 VAL HG22 . 18545 1 634 . 1 1 54 54 VAL HG23 H 1 0.873 0.020 . 2 . . . A 54 VAL HG23 . 18545 1 635 . 1 1 54 54 VAL C C 13 176.334 0.3 . 1 . . . A 54 VAL C . 18545 1 636 . 1 1 54 54 VAL CA C 13 66.25 0.3 . 1 . . . A 54 VAL CA . 18545 1 637 . 1 1 54 54 VAL CB C 13 30.937 0.3 . 1 . . . A 54 VAL CB . 18545 1 638 . 1 1 54 54 VAL CG1 C 13 23.359 0.3 . 1 . . . A 54 VAL CG1 . 18545 1 639 . 1 1 54 54 VAL CG2 C 13 21.528 0.3 . 1 . . . A 54 VAL CG2 . 18545 1 640 . 1 1 54 54 VAL N N 15 116.110 0.3 . 1 . . . A 54 VAL N . 18545 1 641 . 1 1 55 55 ASP H H 1 7.689 0.020 . 1 . . . A 55 ASP H . 18545 1 642 . 1 1 55 55 ASP HA H 1 4.153 0.020 . 1 . . . A 55 ASP HA . 18545 1 643 . 1 1 55 55 ASP HB2 H 1 2.667 0.020 . 2 . . . A 55 ASP HB2 . 18545 1 644 . 1 1 55 55 ASP HB3 H 1 2.550 0.020 . 2 . . . A 55 ASP HB3 . 18545 1 645 . 1 1 55 55 ASP C C 13 178.319 0.3 . 1 . . . A 55 ASP C . 18545 1 646 . 1 1 55 55 ASP CA C 13 57.583 0.3 . 1 . . . A 55 ASP CA . 18545 1 647 . 1 1 55 55 ASP CB C 13 40.838 0.3 . 1 . . . A 55 ASP CB . 18545 1 648 . 1 1 55 55 ASP N N 15 120.466 0.3 . 1 . . . A 55 ASP N . 18545 1 649 . 1 1 56 56 LYS H H 1 7.645 0.020 . 1 . . . A 56 LYS H . 18545 1 650 . 1 1 56 56 LYS HA H 1 3.966 0.020 . 1 . . . A 56 LYS HA . 18545 1 651 . 1 1 56 56 LYS HB2 H 1 1.883 0.020 . 2 . . . A 56 LYS HB2 . 18545 1 652 . 1 1 56 56 LYS HB3 H 1 1.872 0.020 . 2 . . . A 56 LYS HB3 . 18545 1 653 . 1 1 56 56 LYS HG2 H 1 1.434 0.020 . 2 . . . A 56 LYS HG2 . 18545 1 654 . 1 1 56 56 LYS HG3 H 1 1.504 0.020 . 2 . . . A 56 LYS HG3 . 18545 1 655 . 1 1 56 56 LYS HD2 H 1 1.649 0.020 . 2 . . . A 56 LYS HD2 . 18545 1 656 . 1 1 56 56 LYS HD3 H 1 1.643 0.020 . 2 . . . A 56 LYS HD3 . 18545 1 657 . 1 1 56 56 LYS HE2 H 1 2.954 0.020 . 1 . . . A 56 LYS HE2 . 18545 1 658 . 1 1 56 56 LYS HE3 H 1 2.954 0.020 . 1 . . . A 56 LYS HE3 . 18545 1 659 . 1 1 56 56 LYS C C 13 178.703 0.3 . 1 . . . A 56 LYS C . 18545 1 660 . 1 1 56 56 LYS CA C 13 58.769 0.3 . 1 . . . A 56 LYS CA . 18545 1 661 . 1 1 56 56 LYS CB C 13 32.441 0.3 . 1 . . . A 56 LYS CB . 18545 1 662 . 1 1 56 56 LYS CG C 13 25.344 0.3 . 1 . . . A 56 LYS CG . 18545 1 663 . 1 1 56 56 LYS CD C 13 29.176 0.3 . 1 . . . A 56 LYS CD . 18545 1 664 . 1 1 56 56 LYS CE C 13 41.677 0.3 . 1 . . . A 56 LYS CE . 18545 1 665 . 1 1 56 56 LYS N N 15 119.074 0.3 . 1 . . . A 56 LYS N . 18545 1 666 . 1 1 57 57 VAL H H 1 7.933 0.020 . 1 . . . A 57 VAL H . 18545 1 667 . 1 1 57 57 VAL HA H 1 3.719 0.020 . 1 . . . A 57 VAL HA . 18545 1 668 . 1 1 57 57 VAL HB H 1 2.054 0.020 . 1 . . . A 57 VAL HB . 18545 1 669 . 1 1 57 57 VAL HG11 H 1 1.033 0.020 . 2 . . . A 57 VAL HG11 . 18545 1 670 . 1 1 57 57 VAL HG12 H 1 1.033 0.020 . 2 . . . A 57 VAL HG12 . 18545 1 671 . 1 1 57 57 VAL HG13 H 1 1.033 0.020 . 2 . . . A 57 VAL HG13 . 18545 1 672 . 1 1 57 57 VAL HG21 H 1 0.972 0.020 . 2 . . . A 57 VAL HG21 . 18545 1 673 . 1 1 57 57 VAL HG22 H 1 0.972 0.020 . 2 . . . A 57 VAL HG22 . 18545 1 674 . 1 1 57 57 VAL HG23 H 1 0.972 0.020 . 2 . . . A 57 VAL HG23 . 18545 1 675 . 1 1 57 57 VAL C C 13 177.546 0.3 . 1 . . . A 57 VAL C . 18545 1 676 . 1 1 57 57 VAL CA C 13 65.891 0.3 . 1 . . . A 57 VAL CA . 18545 1 677 . 1 1 57 57 VAL CB C 13 31.639 0.3 . 1 . . . A 57 VAL CB . 18545 1 678 . 1 1 57 57 VAL CG1 C 13 22.568 0.3 . 1 . . . A 57 VAL CG1 . 18545 1 679 . 1 1 57 57 VAL CG2 C 13 22.074 0.3 . 1 . . . A 57 VAL CG2 . 18545 1 680 . 1 1 57 57 VAL N N 15 119.756 0.3 . 1 . . . A 57 VAL N . 18545 1 681 . 1 1 58 58 MET H H 1 8.443 0.020 . 1 . . . A 58 MET H . 18545 1 682 . 1 1 58 58 MET HA H 1 3.928 0.020 . 1 . . . A 58 MET HA . 18545 1 683 . 1 1 58 58 MET HB2 H 1 2.166 0.020 . 2 . . . A 58 MET HB2 . 18545 1 684 . 1 1 58 58 MET HB3 H 1 1.895 0.020 . 2 . . . A 58 MET HB3 . 18545 1 685 . 1 1 58 58 MET HG2 H 1 2.496 0.020 . 2 . . . A 58 MET HG2 . 18545 1 686 . 1 1 58 58 MET HG3 H 1 2.368 0.020 . 2 . . . A 58 MET HG3 . 18545 1 687 . 1 1 58 58 MET HE1 H 1 1.895 0.020 . 1 . . . A 58 MET HE1 . 18545 1 688 . 1 1 58 58 MET HE2 H 1 1.895 0.020 . 1 . . . A 58 MET HE2 . 18545 1 689 . 1 1 58 58 MET HE3 H 1 1.895 0.020 . 1 . . . A 58 MET HE3 . 18545 1 690 . 1 1 58 58 MET C C 13 176.937 0.3 . 1 . . . A 58 MET C . 18545 1 691 . 1 1 58 58 MET CA C 13 58.527 0.3 . 1 . . . A 58 MET CA . 18545 1 692 . 1 1 58 58 MET CB C 13 31.33 0.3 . 1 . . . A 58 MET CB . 18545 1 693 . 1 1 58 58 MET CG C 13 32.322 0.3 . 1 . . . A 58 MET CG . 18545 1 694 . 1 1 58 58 MET CE C 13 17.872 0.3 . 1 . . . A 58 MET CE . 18545 1 695 . 1 1 58 58 MET N N 15 118.541 0.3 . 1 . . . A 58 MET N . 18545 1 696 . 1 1 59 59 LYS H H 1 7.639 0.020 . 1 . . . A 59 LYS H . 18545 1 697 . 1 1 59 59 LYS HA H 1 3.915 0.020 . 1 . . . A 59 LYS HA . 18545 1 698 . 1 1 59 59 LYS HB2 H 1 1.870 0.020 . 1 . . . A 59 LYS HB2 . 18545 1 699 . 1 1 59 59 LYS HB3 H 1 1.870 0.020 . 1 . . . A 59 LYS HB3 . 18545 1 700 . 1 1 59 59 LYS HG2 H 1 1.540 0.020 . 2 . . . A 59 LYS HG2 . 18545 1 701 . 1 1 59 59 LYS HG3 H 1 1.423 0.020 . 2 . . . A 59 LYS HG3 . 18545 1 702 . 1 1 59 59 LYS HD2 H 1 1.596 0.020 . 2 . . . A 59 LYS HD2 . 18545 1 703 . 1 1 59 59 LYS HD3 H 1 1.643 0.020 . 2 . . . A 59 LYS HD3 . 18545 1 704 . 1 1 59 59 LYS C C 13 178.797 0.3 . 1 . . . A 59 LYS C . 18545 1 705 . 1 1 59 59 LYS CA C 13 58.934 0.3 . 1 . . . A 59 LYS CA . 18545 1 706 . 1 1 59 59 LYS CB C 13 32.476 0.3 . 1 . . . A 59 LYS CB . 18545 1 707 . 1 1 59 59 LYS CG C 13 25.757 0.3 . 1 . . . A 59 LYS CG . 18545 1 708 . 1 1 59 59 LYS CD C 13 29.377 0.3 . 1 . . . A 59 LYS CD . 18545 1 709 . 1 1 59 59 LYS N N 15 116.084 0.3 . 1 . . . A 59 LYS N . 18545 1 710 . 1 1 60 60 GLU H H 1 7.615 0.020 . 1 . . . A 60 GLU H . 18545 1 711 . 1 1 60 60 GLU HA H 1 4.029 0.020 . 1 . . . A 60 GLU HA . 18545 1 712 . 1 1 60 60 GLU HB2 H 1 2.029 0.020 . 2 . . . A 60 GLU HB2 . 18545 1 713 . 1 1 60 60 GLU HB3 H 1 2.105 0.020 . 2 . . . A 60 GLU HB3 . 18545 1 714 . 1 1 60 60 GLU HG2 H 1 2.203 0.020 . 2 . . . A 60 GLU HG2 . 18545 1 715 . 1 1 60 60 GLU HG3 H 1 2.341 0.020 . 2 . . . A 60 GLU HG3 . 18545 1 716 . 1 1 60 60 GLU C C 13 178.130 0.3 . 1 . . . A 60 GLU C . 18545 1 717 . 1 1 60 60 GLU CA C 13 58.244 0.3 . 1 . . . A 60 GLU CA . 18545 1 718 . 1 1 60 60 GLU CB C 13 29.912 0.3 . 1 . . . A 60 GLU CB . 18545 1 719 . 1 1 60 60 GLU CG C 13 36.171 0.3 . 1 . . . A 60 GLU CG . 18545 1 720 . 1 1 60 60 GLU N N 15 117.190 0.3 . 1 . . . A 60 GLU N . 18545 1 721 . 1 1 61 61 LEU H H 1 8.051 0.020 . 1 . . . A 61 LEU H . 18545 1 722 . 1 1 61 61 LEU HA H 1 4.348 0.020 . 1 . . . A 61 LEU HA . 18545 1 723 . 1 1 61 61 LEU HB2 H 1 1.720 0.020 . 2 . . . A 61 LEU HB2 . 18545 1 724 . 1 1 61 61 LEU HB3 H 1 1.360 0.020 . 2 . . . A 61 LEU HB3 . 18545 1 725 . 1 1 61 61 LEU HG H 1 2.038 0.020 . 1 . . . A 61 LEU HG . 18545 1 726 . 1 1 61 61 LEU HD11 H 1 0.841 0.020 . 2 . . . A 61 LEU HD11 . 18545 1 727 . 1 1 61 61 LEU HD12 H 1 0.841 0.020 . 2 . . . A 61 LEU HD12 . 18545 1 728 . 1 1 61 61 LEU HD13 H 1 0.841 0.020 . 2 . . . A 61 LEU HD13 . 18545 1 729 . 1 1 61 61 LEU HD21 H 1 0.835 0.020 . 2 . . . A 61 LEU HD21 . 18545 1 730 . 1 1 61 61 LEU HD22 H 1 0.835 0.020 . 2 . . . A 61 LEU HD22 . 18545 1 731 . 1 1 61 61 LEU HD23 H 1 0.835 0.020 . 2 . . . A 61 LEU HD23 . 18545 1 732 . 1 1 61 61 LEU C C 13 178.840 0.3 . 1 . . . A 61 LEU C . 18545 1 733 . 1 1 61 61 LEU CA C 13 55.238 0.3 . 1 . . . A 61 LEU CA . 18545 1 734 . 1 1 61 61 LEU CB C 13 44.032 0.3 . 1 . . . A 61 LEU CB . 18545 1 735 . 1 1 61 61 LEU CG C 13 26.534 0.3 . 1 . . . A 61 LEU CG . 18545 1 736 . 1 1 61 61 LEU CD1 C 13 22.433 0.3 . 1 . . . A 61 LEU CD1 . 18545 1 737 . 1 1 61 61 LEU CD2 C 13 26.856 0.3 . 1 . . . A 61 LEU CD2 . 18545 1 738 . 1 1 61 61 LEU N N 15 116.051 0.3 . 1 . . . A 61 LEU N . 18545 1 739 . 1 1 62 62 ASP H H 1 8.037 0.020 . 1 . . . A 62 ASP H . 18545 1 740 . 1 1 62 62 ASP HA H 1 4.687 0.020 . 1 . . . A 62 ASP HA . 18545 1 741 . 1 1 62 62 ASP HB2 H 1 2.811 0.020 . 2 . . . A 62 ASP HB2 . 18545 1 742 . 1 1 62 62 ASP HB3 H 1 2.374 0.020 . 2 . . . A 62 ASP HB3 . 18545 1 743 . 1 1 62 62 ASP C C 13 176.520 0.3 . 1 . . . A 62 ASP C . 18545 1 744 . 1 1 62 62 ASP CA C 13 53.378 0.3 . 1 . . . A 62 ASP CA . 18545 1 745 . 1 1 62 62 ASP CB C 13 38.836 0.3 . 1 . . . A 62 ASP CB . 18545 1 746 . 1 1 62 62 ASP N N 15 116.893 0.3 . 1 . . . A 62 ASP N . 18545 1 747 . 1 1 63 63 GLU H H 1 8.367 0.020 . 1 . . . A 63 GLU H . 18545 1 748 . 1 1 63 63 GLU HA H 1 4.035 0.020 . 1 . . . A 63 GLU HA . 18545 1 749 . 1 1 63 63 GLU HB2 H 1 2.098 0.020 . 2 . . . A 63 GLU HB2 . 18545 1 750 . 1 1 63 63 GLU HB3 H 1 2.099 0.020 . 2 . . . A 63 GLU HB3 . 18545 1 751 . 1 1 63 63 GLU HG2 H 1 2.254 0.020 . 2 . . . A 63 GLU HG2 . 18545 1 752 . 1 1 63 63 GLU HG3 H 1 2.369 0.020 . 2 . . . A 63 GLU HG3 . 18545 1 753 . 1 1 63 63 GLU C C 13 177.453 0.3 . 1 . . . A 63 GLU C . 18545 1 754 . 1 1 63 63 GLU CA C 13 58.563 0.3 . 1 . . . A 63 GLU CA . 18545 1 755 . 1 1 63 63 GLU CB C 13 30.373 0.3 . 1 . . . A 63 GLU CB . 18545 1 756 . 1 1 63 63 GLU CG C 13 36.084 0.3 . 1 . . . A 63 GLU CG . 18545 1 757 . 1 1 63 63 GLU N N 15 129.208 0.3 . 1 . . . A 63 GLU N . 18545 1 758 . 1 1 64 64 ASN H H 1 8.003 0.020 . 1 . . . A 64 ASN H . 18545 1 759 . 1 1 64 64 ASN HA H 1 4.728 0.020 . 1 . . . A 64 ASN HA . 18545 1 760 . 1 1 64 64 ASN HB2 H 1 3.236 0.020 . 2 . . . A 64 ASN HB2 . 18545 1 761 . 1 1 64 64 ASN HB3 H 1 2.884 0.020 . 2 . . . A 64 ASN HB3 . 18545 1 762 . 1 1 64 64 ASN HD21 H 1 7.899 0.020 . 1 . . . A 64 ASN HD21 . 18545 1 763 . 1 1 64 64 ASN HD22 H 1 6.651 0.020 . 1 . . . A 64 ASN HD22 . 18545 1 764 . 1 1 64 64 ASN C C 13 176.408 0.3 . 1 . . . A 64 ASN C . 18545 1 765 . 1 1 64 64 ASN CA C 13 51.871 0.3 . 1 . . . A 64 ASN CA . 18545 1 766 . 1 1 64 64 ASN CB C 13 37.189 0.3 . 1 . . . A 64 ASN CB . 18545 1 767 . 1 1 64 64 ASN N N 15 112.618 0.3 . 1 . . . A 64 ASN N . 18545 1 768 . 1 1 64 64 ASN ND2 N 15 113.777 0.3 . 1 . . . A 64 ASN ND2 . 18545 1 769 . 1 1 65 65 GLY H H 1 7.559 0.020 . 1 . . . A 65 GLY H . 18545 1 770 . 1 1 65 65 GLY HA2 H 1 3.828 0.020 . 1 . . . A 65 GLY HA2 . 18545 1 771 . 1 1 65 65 GLY HA3 H 1 3.828 0.020 . 1 . . . A 65 GLY HA3 . 18545 1 772 . 1 1 65 65 GLY C C 13 174.875 0.3 . 1 . . . A 65 GLY C . 18545 1 773 . 1 1 65 65 GLY CA C 13 47.387 0.3 . 1 . . . A 65 GLY CA . 18545 1 774 . 1 1 65 65 GLY N N 15 109.111 0.3 . 1 . . . A 65 GLY N . 18545 1 775 . 1 1 66 66 ASP H H 1 8.130 0.020 . 1 . . . A 66 ASP H . 18545 1 776 . 1 1 66 66 ASP HA H 1 4.530 0.020 . 1 . . . A 66 ASP HA . 18545 1 777 . 1 1 66 66 ASP HB2 H 1 3.121 0.020 . 2 . . . A 66 ASP HB2 . 18545 1 778 . 1 1 66 66 ASP HB3 H 1 2.441 0.020 . 2 . . . A 66 ASP HB3 . 18545 1 779 . 1 1 66 66 ASP C C 13 177.275 0.3 . 1 . . . A 66 ASP C . 18545 1 780 . 1 1 66 66 ASP CA C 13 53.2 0.3 . 1 . . . A 66 ASP CA . 18545 1 781 . 1 1 66 66 ASP CB C 13 40.371 0.3 . 1 . . . A 66 ASP CB . 18545 1 782 . 1 1 66 66 ASP N N 15 119.196 0.3 . 1 . . . A 66 ASP N . 18545 1 783 . 1 1 67 67 GLY H H 1 10.301 0.020 . 1 . . . A 67 GLY H . 18545 1 784 . 1 1 67 67 GLY HA2 H 1 3.430 0.020 . 2 . . . A 67 GLY HA2 . 18545 1 785 . 1 1 67 67 GLY HA3 H 1 4.056 0.020 . 2 . . . A 67 GLY HA3 . 18545 1 786 . 1 1 67 67 GLY C C 13 172.520 0.3 . 1 . . . A 67 GLY C . 18545 1 787 . 1 1 67 67 GLY CA C 13 45.55 0.3 . 1 . . . A 67 GLY CA . 18545 1 788 . 1 1 67 67 GLY N N 15 113.254 0.3 . 1 . . . A 67 GLY N . 18545 1 789 . 1 1 68 68 GLU H H 1 7.739 0.020 . 1 . . . A 68 GLU H . 18545 1 790 . 1 1 68 68 GLU HA H 1 4.805 0.020 . 1 . . . A 68 GLU HA . 18545 1 791 . 1 1 68 68 GLU HB2 H 1 1.981 0.020 . 2 . . . A 68 GLU HB2 . 18545 1 792 . 1 1 68 68 GLU HB3 H 1 1.343 0.020 . 2 . . . A 68 GLU HB3 . 18545 1 793 . 1 1 68 68 GLU HG2 H 1 1.996 0.020 . 2 . . . A 68 GLU HG2 . 18545 1 794 . 1 1 68 68 GLU HG3 H 1 1.996 0.020 . 2 . . . A 68 GLU HG3 . 18545 1 795 . 1 1 68 68 GLU C C 13 175.151 0.3 . 1 . . . A 68 GLU C . 18545 1 796 . 1 1 68 68 GLU CA C 13 54.428 0.3 . 1 . . . A 68 GLU CA . 18545 1 797 . 1 1 68 68 GLU CB C 13 36.146 0.3 . 1 . . . A 68 GLU CB . 18545 1 798 . 1 1 68 68 GLU CG C 13 37.36 0.3 . 1 . . . A 68 GLU CG . 18545 1 799 . 1 1 68 68 GLU N N 15 117.002 0.3 . 1 . . . A 68 GLU N . 18545 1 800 . 1 1 69 69 VAL H H 1 9.408 0.020 . 1 . . . A 69 VAL H . 18545 1 801 . 1 1 69 69 VAL HA H 1 5.235 0.020 . 1 . . . A 69 VAL HA . 18545 1 802 . 1 1 69 69 VAL HG11 H 1 1.158 0.020 . 2 . . . A 69 VAL HG11 . 18545 1 803 . 1 1 69 69 VAL HG12 H 1 1.158 0.020 . 2 . . . A 69 VAL HG12 . 18545 1 804 . 1 1 69 69 VAL HG13 H 1 1.158 0.020 . 2 . . . A 69 VAL HG13 . 18545 1 805 . 1 1 69 69 VAL HG21 H 1 0.933 0.020 . 2 . . . A 69 VAL HG21 . 18545 1 806 . 1 1 69 69 VAL HG22 H 1 0.933 0.020 . 2 . . . A 69 VAL HG22 . 18545 1 807 . 1 1 69 69 VAL HG23 H 1 0.933 0.020 . 2 . . . A 69 VAL HG23 . 18545 1 808 . 1 1 69 69 VAL C C 13 175.901 0.3 . 1 . . . A 69 VAL C . 18545 1 809 . 1 1 69 69 VAL CA C 13 61.072 0.3 . 1 . . . A 69 VAL CA . 18545 1 810 . 1 1 69 69 VAL CG1 C 13 22.421 0.3 . 1 . . . A 69 VAL CG1 . 18545 1 811 . 1 1 69 69 VAL CG2 C 13 23.333 0.3 . 1 . . . A 69 VAL CG2 . 18545 1 812 . 1 1 69 69 VAL N N 15 125.146 0.3 . 1 . . . A 69 VAL N . 18545 1 813 . 1 1 70 70 ASP H H 1 9.119 0.020 . 1 . . . A 70 ASP H . 18545 1 814 . 1 1 70 70 ASP HA H 1 5.146 0.020 . 1 . . . A 70 ASP HA . 18545 1 815 . 1 1 70 70 ASP HB2 H 1 2.617 0.020 . 2 . . . A 70 ASP HB2 . 18545 1 816 . 1 1 70 70 ASP HB3 H 1 3.392 0.020 . 2 . . . A 70 ASP HB3 . 18545 1 817 . 1 1 70 70 ASP C C 13 174.952 0.3 . 1 . . . A 70 ASP C . 18545 1 818 . 1 1 70 70 ASP CA C 13 52.41 0.3 . 1 . . . A 70 ASP CA . 18545 1 819 . 1 1 70 70 ASP CB C 13 41.555 0.3 . 1 . . . A 70 ASP CB . 18545 1 820 . 1 1 70 70 ASP N N 15 129.208 0.3 . 1 . . . A 70 ASP N . 18545 1 821 . 1 1 71 71 PHE H H 1 8.963 0.020 . 1 . . . A 71 PHE H . 18545 1 822 . 1 1 71 71 PHE HA H 1 2.903 0.020 . 1 . . . A 71 PHE HA . 18545 1 823 . 1 1 71 71 PHE HB2 H 1 2.627 0.020 . 2 . . . A 71 PHE HB2 . 18545 1 824 . 1 1 71 71 PHE HB3 H 1 2.481 0.020 . 2 . . . A 71 PHE HB3 . 18545 1 825 . 1 1 71 71 PHE HD1 H 1 6.173 0.020 . 3 . . . A 71 PHE HD1 . 18545 1 826 . 1 1 71 71 PHE HD2 H 1 6.174 0.020 . 3 . . . A 71 PHE HD2 . 18545 1 827 . 1 1 71 71 PHE HE1 H 1 6.962 0.020 . 1 . . . A 71 PHE HE1 . 18545 1 828 . 1 1 71 71 PHE HE2 H 1 6.962 0.020 . 1 . . . A 71 PHE HE2 . 18545 1 829 . 1 1 71 71 PHE C C 13 176.522 0.3 . 1 . . . A 71 PHE C . 18545 1 830 . 1 1 71 71 PHE CA C 13 63.578 0.3 . 1 . . . A 71 PHE CA . 18545 1 831 . 1 1 71 71 PHE CB C 13 39.374 0.3 . 1 . . . A 71 PHE CB . 18545 1 832 . 1 1 71 71 PHE CD1 C 13 131.683 0.3 . 1 . . . A 71 PHE CD1 . 18545 1 833 . 1 1 71 71 PHE CD2 C 13 131.685 0.3 . 1 . . . A 71 PHE CD2 . 18545 1 834 . 1 1 71 71 PHE CE1 C 13 130.490 0.3 . 1 . . . A 71 PHE CE1 . 18545 1 835 . 1 1 71 71 PHE CE2 C 13 130.489 0.3 . 1 . . . A 71 PHE CE2 . 18545 1 836 . 1 1 71 71 PHE N N 15 118.382 0.3 . 1 . . . A 71 PHE N . 18545 1 837 . 1 1 72 72 GLN H H 1 8.037 0.020 . 1 . . . A 72 GLN H . 18545 1 838 . 1 1 72 72 GLN HA H 1 3.692 0.020 . 1 . . . A 72 GLN HA . 18545 1 839 . 1 1 72 72 GLN HB2 H 1 2.172 0.020 . 2 . . . A 72 GLN HB2 . 18545 1 840 . 1 1 72 72 GLN HB3 H 1 2.171 0.020 . 2 . . . A 72 GLN HB3 . 18545 1 841 . 1 1 72 72 GLN HG2 H 1 2.370 0.020 . 2 . . . A 72 GLN HG2 . 18545 1 842 . 1 1 72 72 GLN HG3 H 1 2.465 0.020 . 2 . . . A 72 GLN HG3 . 18545 1 843 . 1 1 72 72 GLN HE21 H 1 6.778 0.020 . 5 . . . A 72 GLN HE21 . 18545 1 844 . 1 1 72 72 GLN HE22 H 1 6.420 0.020 . 5 . . . A 72 GLN HE22 . 18545 1 845 . 1 1 72 72 GLN C C 13 178.083 0.3 . 1 . . . A 72 GLN C . 18545 1 846 . 1 1 72 72 GLN CA C 13 59.574 0.3 . 1 . . . A 72 GLN CA . 18545 1 847 . 1 1 72 72 GLN CB C 13 28.265 0.3 . 1 . . . A 72 GLN CB . 18545 1 848 . 1 1 72 72 GLN CG C 13 35.032 0.3 . 1 . . . A 72 GLN CG . 18545 1 849 . 1 1 72 72 GLN N N 15 116.673 0.3 . 1 . . . A 72 GLN N . 18545 1 850 . 1 1 72 72 GLN NE2 N 15 112.768 0.3 . 5 . . . A 72 GLN NE2 . 18545 1 851 . 1 1 73 73 GLU H H 1 8.309 0.020 . 1 . . . A 73 GLU H . 18545 1 852 . 1 1 73 73 GLU HA H 1 4.093 0.020 . 1 . . . A 73 GLU HA . 18545 1 853 . 1 1 73 73 GLU HB2 H 1 2.100 0.020 . 1 . . . A 73 GLU HB2 . 18545 1 854 . 1 1 73 73 GLU HB3 H 1 2.100 0.020 . 1 . . . A 73 GLU HB3 . 18545 1 855 . 1 1 73 73 GLU C C 13 178.561 0.3 . 1 . . . A 73 GLU C . 18545 1 856 . 1 1 73 73 GLU CA C 13 58.482 0.3 . 1 . . . A 73 GLU CA . 18545 1 857 . 1 1 73 73 GLU CB C 13 30.26 0.3 . 1 . . . A 73 GLU CB . 18545 1 858 . 1 1 73 73 GLU N N 15 120.169 0.3 . 1 . . . A 73 GLU N . 18545 1 859 . 1 1 74 74 TYR H H 1 8.343 0.020 . 1 . . . A 74 TYR H . 18545 1 860 . 1 1 74 74 TYR HA H 1 4.101 0.020 . 1 . . . A 74 TYR HA . 18545 1 861 . 1 1 74 74 TYR HB2 H 1 2.916 0.020 . 1 . . . A 74 TYR HB2 . 18545 1 862 . 1 1 74 74 TYR HB3 H 1 2.916 0.020 . 1 . . . A 74 TYR HB3 . 18545 1 863 . 1 1 74 74 TYR HE1 H 1 6.409 0.020 . 3 . . . A 74 TYR HE1 . 18545 1 864 . 1 1 74 74 TYR HE2 H 1 6.408 0.020 . 3 . . . A 74 TYR HE2 . 18545 1 865 . 1 1 74 74 TYR C C 13 176.482 0.3 . 1 . . . A 74 TYR C . 18545 1 866 . 1 1 74 74 TYR CA C 13 59.609 0.3 . 1 . . . A 74 TYR CA . 18545 1 867 . 1 1 74 74 TYR CB C 13 37.748 0.3 . 1 . . . A 74 TYR CB . 18545 1 868 . 1 1 74 74 TYR CE1 C 13 118.124 0.3 . 1 . . . A 74 TYR CE1 . 18545 1 869 . 1 1 74 74 TYR CE2 C 13 118.124 0.3 . 1 . . . A 74 TYR CE2 . 18545 1 870 . 1 1 74 74 TYR N N 15 121.466 0.3 . 1 . . . A 74 TYR N . 18545 1 871 . 1 1 75 75 VAL H H 1 8.091 0.020 . 1 . . . A 75 VAL H . 18545 1 872 . 1 1 75 75 VAL HA H 1 2.901 0.020 . 1 . . . A 75 VAL HA . 18545 1 873 . 1 1 75 75 VAL HB H 1 1.738 0.020 . 1 . . . A 75 VAL HB . 18545 1 874 . 1 1 75 75 VAL HG11 H 1 0.704 0.020 . 2 . . . A 75 VAL HG11 . 18545 1 875 . 1 1 75 75 VAL HG12 H 1 0.704 0.020 . 2 . . . A 75 VAL HG12 . 18545 1 876 . 1 1 75 75 VAL HG13 H 1 0.704 0.020 . 2 . . . A 75 VAL HG13 . 18545 1 877 . 1 1 75 75 VAL HG21 H 1 0.523 0.020 . 2 . . . A 75 VAL HG21 . 18545 1 878 . 1 1 75 75 VAL HG22 H 1 0.523 0.020 . 2 . . . A 75 VAL HG22 . 18545 1 879 . 1 1 75 75 VAL HG23 H 1 0.523 0.020 . 2 . . . A 75 VAL HG23 . 18545 1 880 . 1 1 75 75 VAL C C 13 176.555 0.3 . 1 . . . A 75 VAL C . 18545 1 881 . 1 1 75 75 VAL CA C 13 66.186 0.3 . 1 . . . A 75 VAL CA . 18545 1 882 . 1 1 75 75 VAL CB C 13 30.737 0.3 . 1 . . . A 75 VAL CB . 18545 1 883 . 1 1 75 75 VAL CG1 C 13 21.982 0.3 . 1 . . . A 75 VAL CG1 . 18545 1 884 . 1 1 75 75 VAL CG2 C 13 24.186 0.3 . 1 . . . A 75 VAL CG2 . 18545 1 885 . 1 1 75 75 VAL N N 15 120.342 0.3 . 1 . . . A 75 VAL N . 18545 1 886 . 1 1 76 76 VAL H H 1 7.112 0.020 . 1 . . . A 76 VAL H . 18545 1 887 . 1 1 76 76 VAL HA H 1 3.426 0.020 . 1 . . . A 76 VAL HA . 18545 1 888 . 1 1 76 76 VAL HB H 1 2.244 0.020 . 1 . . . A 76 VAL HB . 18545 1 889 . 1 1 76 76 VAL HG11 H 1 1.042 0.020 . 2 . . . A 76 VAL HG11 . 18545 1 890 . 1 1 76 76 VAL HG12 H 1 1.042 0.020 . 2 . . . A 76 VAL HG12 . 18545 1 891 . 1 1 76 76 VAL HG13 H 1 1.042 0.020 . 2 . . . A 76 VAL HG13 . 18545 1 892 . 1 1 76 76 VAL HG21 H 1 0.850 0.020 . 2 . . . A 76 VAL HG21 . 18545 1 893 . 1 1 76 76 VAL HG22 H 1 0.850 0.020 . 2 . . . A 76 VAL HG22 . 18545 1 894 . 1 1 76 76 VAL HG23 H 1 0.850 0.020 . 2 . . . A 76 VAL HG23 . 18545 1 895 . 1 1 76 76 VAL C C 13 178.699 0.3 . 1 . . . A 76 VAL C . 18545 1 896 . 1 1 76 76 VAL CA C 13 66.793 0.3 . 1 . . . A 76 VAL CA . 18545 1 897 . 1 1 76 76 VAL CB C 13 31.213 0.3 . 1 . . . A 76 VAL CB . 18545 1 898 . 1 1 76 76 VAL CG1 C 13 22.689 0.3 . 1 . . . A 76 VAL CG1 . 18545 1 899 . 1 1 76 76 VAL CG2 C 13 20.96 0.3 . 1 . . . A 76 VAL CG2 . 18545 1 900 . 1 1 76 76 VAL N N 15 120.251 0.3 . 1 . . . A 76 VAL N . 18545 1 901 . 1 1 77 77 LEU H H 1 6.855 0.020 . 1 . . . A 77 LEU H . 18545 1 902 . 1 1 77 77 LEU HA H 1 4.025 0.020 . 1 . . . A 77 LEU HA . 18545 1 903 . 1 1 77 77 LEU HB2 H 1 1.582 0.020 . 2 . . . A 77 LEU HB2 . 18545 1 904 . 1 1 77 77 LEU HB3 H 1 2.074 0.020 . 2 . . . A 77 LEU HB3 . 18545 1 905 . 1 1 77 77 LEU HG H 1 1.141 0.020 . 1 . . . A 77 LEU HG . 18545 1 906 . 1 1 77 77 LEU HD11 H 1 0.838 0.020 . 2 . . . A 77 LEU HD11 . 18545 1 907 . 1 1 77 77 LEU HD12 H 1 0.838 0.020 . 2 . . . A 77 LEU HD12 . 18545 1 908 . 1 1 77 77 LEU HD13 H 1 0.838 0.020 . 2 . . . A 77 LEU HD13 . 18545 1 909 . 1 1 77 77 LEU HD21 H 1 0.593 0.020 . 2 . . . A 77 LEU HD21 . 18545 1 910 . 1 1 77 77 LEU HD22 H 1 0.593 0.020 . 2 . . . A 77 LEU HD22 . 18545 1 911 . 1 1 77 77 LEU HD23 H 1 0.593 0.020 . 2 . . . A 77 LEU HD23 . 18545 1 912 . 1 1 77 77 LEU C C 13 177.341 0.3 . 1 . . . A 77 LEU C . 18545 1 913 . 1 1 77 77 LEU CA C 13 57.77 0.3 . 1 . . . A 77 LEU CA . 18545 1 914 . 1 1 77 77 LEU CB C 13 40.531 0.3 . 1 . . . A 77 LEU CB . 18545 1 915 . 1 1 77 77 LEU CG C 13 27.039 0.3 . 1 . . . A 77 LEU CG . 18545 1 916 . 1 1 77 77 LEU CD1 C 13 22.281 0.3 . 1 . . . A 77 LEU CD1 . 18545 1 917 . 1 1 77 77 LEU CD2 C 13 25.028 0.3 . 1 . . . A 77 LEU CD2 . 18545 1 918 . 1 1 77 77 LEU N N 15 120.890 0.3 . 1 . . . A 77 LEU N . 18545 1 919 . 1 1 78 78 VAL H H 1 7.537 0.020 . 1 . . . A 78 VAL H . 18545 1 920 . 1 1 78 78 VAL HA H 1 3.133 0.020 . 1 . . . A 78 VAL HA . 18545 1 921 . 1 1 78 78 VAL HB H 1 1.587 0.020 . 1 . . . A 78 VAL HB . 18545 1 922 . 1 1 78 78 VAL HG11 H 1 0.266 0.020 . 2 . . . A 78 VAL HG11 . 18545 1 923 . 1 1 78 78 VAL HG12 H 1 0.266 0.020 . 2 . . . A 78 VAL HG12 . 18545 1 924 . 1 1 78 78 VAL HG13 H 1 0.266 0.020 . 2 . . . A 78 VAL HG13 . 18545 1 925 . 1 1 78 78 VAL HG21 H 1 0.665 0.020 . 2 . . . A 78 VAL HG21 . 18545 1 926 . 1 1 78 78 VAL HG22 H 1 0.665 0.020 . 2 . . . A 78 VAL HG22 . 18545 1 927 . 1 1 78 78 VAL HG23 H 1 0.665 0.020 . 2 . . . A 78 VAL HG23 . 18545 1 928 . 1 1 78 78 VAL C C 13 179.122 0.3 . 1 . . . A 78 VAL C . 18545 1 929 . 1 1 78 78 VAL CA C 13 66.706 0.3 . 1 . . . A 78 VAL CA . 18545 1 930 . 1 1 78 78 VAL CB C 13 31.498 0.3 . 1 . . . A 78 VAL CB . 18545 1 931 . 1 1 78 78 VAL CG1 C 13 21.945 0.3 . 1 . . . A 78 VAL CG1 . 18545 1 932 . 1 1 78 78 VAL CG2 C 13 20.941 0.3 . 1 . . . A 78 VAL CG2 . 18545 1 933 . 1 1 78 78 VAL N N 15 116.928 0.3 . 1 . . . A 78 VAL N . 18545 1 934 . 1 1 79 79 ALA H H 1 8.957 0.020 . 1 . . . A 79 ALA H . 18545 1 935 . 1 1 79 79 ALA HA H 1 3.675 0.020 . 1 . . . A 79 ALA HA . 18545 1 936 . 1 1 79 79 ALA HB1 H 1 1.235 0.020 . 1 . . . A 79 ALA HB1 . 18545 1 937 . 1 1 79 79 ALA HB2 H 1 1.235 0.020 . 1 . . . A 79 ALA HB2 . 18545 1 938 . 1 1 79 79 ALA HB3 H 1 1.235 0.020 . 1 . . . A 79 ALA HB3 . 18545 1 939 . 1 1 79 79 ALA C C 13 178.181 0.3 . 1 . . . A 79 ALA C . 18545 1 940 . 1 1 79 79 ALA CA C 13 55.995 0.3 . 1 . . . A 79 ALA CA . 18545 1 941 . 1 1 79 79 ALA CB C 13 17.776 0.3 . 1 . . . A 79 ALA CB . 18545 1 942 . 1 1 79 79 ALA N N 15 124.419 0.3 . 1 . . . A 79 ALA N . 18545 1 943 . 1 1 80 80 ALA H H 1 7.741 0.020 . 1 . . . A 80 ALA H . 18545 1 944 . 1 1 80 80 ALA HA H 1 4.043 0.020 . 1 . . . A 80 ALA HA . 18545 1 945 . 1 1 80 80 ALA HB1 H 1 1.469 0.020 . 1 . . . A 80 ALA HB1 . 18545 1 946 . 1 1 80 80 ALA HB2 H 1 1.469 0.020 . 1 . . . A 80 ALA HB2 . 18545 1 947 . 1 1 80 80 ALA HB3 H 1 1.469 0.020 . 1 . . . A 80 ALA HB3 . 18545 1 948 . 1 1 80 80 ALA C C 13 181.807 0.3 . 1 . . . A 80 ALA C . 18545 1 949 . 1 1 80 80 ALA CA C 13 55.227 0.3 . 1 . . . A 80 ALA CA . 18545 1 950 . 1 1 80 80 ALA CB C 13 17.98 0.3 . 1 . . . A 80 ALA CB . 18545 1 951 . 1 1 80 80 ALA N N 15 120.115 0.3 . 1 . . . A 80 ALA N . 18545 1 952 . 1 1 81 81 LEU H H 1 8.560 0.020 . 1 . . . A 81 LEU H . 18545 1 953 . 1 1 81 81 LEU HA H 1 4.027 0.020 . 1 . . . A 81 LEU HA . 18545 1 954 . 1 1 81 81 LEU HB2 H 1 1.777 0.020 . 2 . . . A 81 LEU HB2 . 18545 1 955 . 1 1 81 81 LEU HB3 H 1 1.175 0.020 . 2 . . . A 81 LEU HB3 . 18545 1 956 . 1 1 81 81 LEU HG H 1 1.657 0.020 . 1 . . . A 81 LEU HG . 18545 1 957 . 1 1 81 81 LEU HD11 H 1 0.404 0.020 . 2 . . . A 81 LEU HD11 . 18545 1 958 . 1 1 81 81 LEU HD12 H 1 0.404 0.020 . 2 . . . A 81 LEU HD12 . 18545 1 959 . 1 1 81 81 LEU HD13 H 1 0.404 0.020 . 2 . . . A 81 LEU HD13 . 18545 1 960 . 1 1 81 81 LEU HD21 H 1 0.553 0.020 . 2 . . . A 81 LEU HD21 . 18545 1 961 . 1 1 81 81 LEU HD22 H 1 0.553 0.020 . 2 . . . A 81 LEU HD22 . 18545 1 962 . 1 1 81 81 LEU HD23 H 1 0.553 0.020 . 2 . . . A 81 LEU HD23 . 18545 1 963 . 1 1 81 81 LEU C C 13 179.136 0.3 . 1 . . . A 81 LEU C . 18545 1 964 . 1 1 81 81 LEU CA C 13 57.433 0.3 . 1 . . . A 81 LEU CA . 18545 1 965 . 1 1 81 81 LEU CB C 13 41.522 0.3 . 1 . . . A 81 LEU CB . 18545 1 966 . 1 1 81 81 LEU CG C 13 26.428 0.3 . 1 . . . A 81 LEU CG . 18545 1 967 . 1 1 81 81 LEU CD1 C 13 26.172 0.3 . 1 . . . A 81 LEU CD1 . 18545 1 968 . 1 1 81 81 LEU CD2 C 13 21.916 0.3 . 1 . . . A 81 LEU CD2 . 18545 1 969 . 1 1 81 81 LEU N N 15 119.224 0.3 . 1 . . . A 81 LEU N . 18545 1 970 . 1 1 82 82 THR H H 1 8.469 0.020 . 1 . . . A 82 THR H . 18545 1 971 . 1 1 82 82 THR HA H 1 3.872 0.020 . 1 . . . A 82 THR HA . 18545 1 972 . 1 1 82 82 THR HB H 1 4.318 0.020 . 1 . . . A 82 THR HB . 18545 1 973 . 1 1 82 82 THR HG21 H 1 1.426 0.020 . 1 . . . A 82 THR HG21 . 18545 1 974 . 1 1 82 82 THR HG22 H 1 1.426 0.020 . 1 . . . A 82 THR HG22 . 18545 1 975 . 1 1 82 82 THR HG23 H 1 1.426 0.020 . 1 . . . A 82 THR HG23 . 18545 1 976 . 1 1 82 82 THR C C 13 176.529 0.3 . 1 . . . A 82 THR C . 18545 1 977 . 1 1 82 82 THR CA C 13 68.249 0.3 . 1 . . . A 82 THR CA . 18545 1 978 . 1 1 82 82 THR CB C 13 67.693 0.3 . 1 . . . A 82 THR CB . 18545 1 979 . 1 1 82 82 THR CG2 C 13 22.368 0.3 . 1 . . . A 82 THR CG2 . 18545 1 980 . 1 1 82 82 THR N N 15 120.053 0.3 . 1 . . . A 82 THR N . 18545 1 981 . 1 1 83 83 VAL H H 1 8.166 0.020 . 1 . . . A 83 VAL H . 18545 1 982 . 1 1 83 83 VAL HA H 1 3.705 0.020 . 1 . . . A 83 VAL HA . 18545 1 983 . 1 1 83 83 VAL HB H 1 2.240 0.020 . 1 . . . A 83 VAL HB . 18545 1 984 . 1 1 83 83 VAL HG11 H 1 1.189 0.020 . 2 . . . A 83 VAL HG11 . 18545 1 985 . 1 1 83 83 VAL HG12 H 1 1.189 0.020 . 2 . . . A 83 VAL HG12 . 18545 1 986 . 1 1 83 83 VAL HG13 H 1 1.189 0.020 . 2 . . . A 83 VAL HG13 . 18545 1 987 . 1 1 83 83 VAL HG21 H 1 1.031 0.020 . 2 . . . A 83 VAL HG21 . 18545 1 988 . 1 1 83 83 VAL HG22 H 1 1.031 0.020 . 2 . . . A 83 VAL HG22 . 18545 1 989 . 1 1 83 83 VAL HG23 H 1 1.031 0.020 . 2 . . . A 83 VAL HG23 . 18545 1 990 . 1 1 83 83 VAL C C 13 177.733 0.3 . 1 . . . A 83 VAL C . 18545 1 991 . 1 1 83 83 VAL CA C 13 67.323 0.3 . 1 . . . A 83 VAL CA . 18545 1 992 . 1 1 83 83 VAL CB C 13 31.789 0.3 . 1 . . . A 83 VAL CB . 18545 1 993 . 1 1 83 83 VAL CG1 C 13 23.95 0.3 . 1 . . . A 83 VAL CG1 . 18545 1 994 . 1 1 83 83 VAL CG2 C 13 21.316 0.3 . 1 . . . A 83 VAL CG2 . 18545 1 995 . 1 1 83 83 VAL N N 15 122.690 0.3 . 1 . . . A 83 VAL N . 18545 1 996 . 1 1 84 84 ALA H H 1 7.801 0.020 . 1 . . . A 84 ALA H . 18545 1 997 . 1 1 84 84 ALA HA H 1 4.136 0.020 . 1 . . . A 84 ALA HA . 18545 1 998 . 1 1 84 84 ALA HB1 H 1 1.493 0.020 . 1 . . . A 84 ALA HB1 . 18545 1 999 . 1 1 84 84 ALA HB2 H 1 1.493 0.020 . 1 . . . A 84 ALA HB2 . 18545 1 1000 . 1 1 84 84 ALA HB3 H 1 1.493 0.020 . 1 . . . A 84 ALA HB3 . 18545 1 1001 . 1 1 84 84 ALA C C 13 180.067 0.3 . 1 . . . A 84 ALA C . 18545 1 1002 . 1 1 84 84 ALA CA C 13 55.212 0.3 . 1 . . . A 84 ALA CA . 18545 1 1003 . 1 1 84 84 ALA CB C 13 17.784 0.3 . 1 . . . A 84 ALA CB . 18545 1 1004 . 1 1 84 84 ALA N N 15 121.367 0.3 . 1 . . . A 84 ALA N . 18545 1 1005 . 1 1 85 85 MET H H 1 8.339 0.020 . 1 . . . A 85 MET H . 18545 1 1006 . 1 1 85 85 MET HA H 1 4.014 0.020 . 1 . . . A 85 MET HA . 18545 1 1007 . 1 1 85 85 MET HB2 H 1 2.262 0.020 . 2 . . . A 85 MET HB2 . 18545 1 1008 . 1 1 85 85 MET HB3 H 1 2.138 0.020 . 2 . . . A 85 MET HB3 . 18545 1 1009 . 1 1 85 85 MET HG2 H 1 2.535 0.020 . 2 . . . A 85 MET HG2 . 18545 1 1010 . 1 1 85 85 MET HG3 H 1 2.344 0.020 . 2 . . . A 85 MET HG3 . 18545 1 1011 . 1 1 85 85 MET HE1 H 1 2.112 0.020 . 1 . . . A 85 MET HE1 . 18545 1 1012 . 1 1 85 85 MET HE2 H 1 2.112 0.020 . 1 . . . A 85 MET HE2 . 18545 1 1013 . 1 1 85 85 MET HE3 H 1 2.112 0.020 . 1 . . . A 85 MET HE3 . 18545 1 1014 . 1 1 85 85 MET C C 13 177.664 0.3 . 1 . . . A 85 MET C . 18545 1 1015 . 1 1 85 85 MET CA C 13 58.977 0.3 . 1 . . . A 85 MET CA . 18545 1 1016 . 1 1 85 85 MET CB C 13 33.632 0.3 . 1 . . . A 85 MET CB . 18545 1 1017 . 1 1 85 85 MET CG C 13 31.97 0.3 . 1 . . . A 85 MET CG . 18545 1 1018 . 1 1 85 85 MET CE C 13 16.941 0.3 . 1 . . . A 85 MET CE . 18545 1 1019 . 1 1 85 85 MET N N 15 119.810 0.3 . 1 . . . A 85 MET N . 18545 1 1020 . 1 1 86 86 ASN H H 1 8.371 0.020 . 1 . . . A 86 ASN H . 18545 1 1021 . 1 1 86 86 ASN HA H 1 4.184 0.020 . 1 . . . A 86 ASN HA . 18545 1 1022 . 1 1 86 86 ASN HB2 H 1 2.516 0.020 . 2 . . . A 86 ASN HB2 . 18545 1 1023 . 1 1 86 86 ASN HB3 H 1 1.799 0.020 . 2 . . . A 86 ASN HB3 . 18545 1 1024 . 1 1 86 86 ASN HD21 H 1 7.479 0.020 . 5 . . . A 86 ASN HD21 . 18545 1 1025 . 1 1 86 86 ASN HD22 H 1 6.809 0.020 . 5 . . . A 86 ASN HD22 . 18545 1 1026 . 1 1 86 86 ASN C C 13 176.387 0.3 . 1 . . . A 86 ASN C . 18545 1 1027 . 1 1 86 86 ASN CA C 13 57.472 0.3 . 1 . . . A 86 ASN CA . 18545 1 1028 . 1 1 86 86 ASN CB C 13 39.739 0.3 . 1 . . . A 86 ASN CB . 18545 1 1029 . 1 1 86 86 ASN N N 15 119.167 0.3 . 1 . . . A 86 ASN N . 18545 1 1030 . 1 1 86 86 ASN ND2 N 15 111.715 0.3 . 5 . . . A 86 ASN ND2 . 18545 1 1031 . 1 1 87 87 ASN H H 1 8.117 0.020 . 1 . . . A 87 ASN H . 18545 1 1032 . 1 1 87 87 ASN HA H 1 4.402 0.020 . 1 . . . A 87 ASN HA . 18545 1 1033 . 1 1 87 87 ASN HB2 H 1 2.769 0.020 . 1 . . . A 87 ASN HB2 . 18545 1 1034 . 1 1 87 87 ASN HB3 H 1 2.769 0.020 . 1 . . . A 87 ASN HB3 . 18545 1 1035 . 1 1 87 87 ASN C C 13 176.573 0.3 . 1 . . . A 87 ASN C . 18545 1 1036 . 1 1 87 87 ASN CA C 13 55.092 0.3 . 1 . . . A 87 ASN CA . 18545 1 1037 . 1 1 87 87 ASN CB C 13 37.756 0.3 . 1 . . . A 87 ASN CB . 18545 1 1038 . 1 1 87 87 ASN N N 15 116.751 0.3 . 1 . . . A 87 ASN N . 18545 1 1039 . 1 1 88 88 PHE H H 1 7.894 0.020 . 1 . . . A 88 PHE H . 18545 1 1040 . 1 1 88 88 PHE HA H 1 4.287 0.020 . 1 . . . A 88 PHE HA . 18545 1 1041 . 1 1 88 88 PHE HB2 H 1 2.963 0.020 . 2 . . . A 88 PHE HB2 . 18545 1 1042 . 1 1 88 88 PHE HB3 H 1 3.019 0.020 . 2 . . . A 88 PHE HB3 . 18545 1 1043 . 1 1 88 88 PHE HD1 H 1 6.862 0.020 . 1 . . . A 88 PHE HD1 . 18545 1 1044 . 1 1 88 88 PHE HE1 H 1 7.165 0.020 . 1 . . . A 88 PHE HE1 . 18545 1 1045 . 1 1 88 88 PHE C C 13 176.952 0.3 . 1 . . . A 88 PHE C . 18545 1 1046 . 1 1 88 88 PHE CA C 13 59.797 0.3 . 1 . . . A 88 PHE CA . 18545 1 1047 . 1 1 88 88 PHE CB C 13 38.996 0.3 . 1 . . . A 88 PHE CB . 18545 1 1048 . 1 1 88 88 PHE CD1 C 13 131.653 0.3 . 1 . . . A 88 PHE CD1 . 18545 1 1049 . 1 1 88 88 PHE CE1 C 13 131.347 0.3 . 1 . . . A 88 PHE CE1 . 18545 1 1050 . 1 1 88 88 PHE N N 15 119.016 0.3 . 1 . . . A 88 PHE N . 18545 1 1051 . 1 1 89 89 PHE H H 1 7.992 0.020 . 1 . . . A 89 PHE H . 18545 1 1052 . 1 1 89 89 PHE HA H 1 4.202 0.020 . 1 . . . A 89 PHE HA . 18545 1 1053 . 1 1 89 89 PHE HB2 H 1 2.625 0.020 . 2 . . . A 89 PHE HB2 . 18545 1 1054 . 1 1 89 89 PHE HB3 H 1 2.909 0.020 . 2 . . . A 89 PHE HB3 . 18545 1 1055 . 1 1 89 89 PHE HD1 H 1 6.948 0.020 . 1 . . . A 89 PHE HD1 . 18545 1 1056 . 1 1 89 89 PHE HE1 H 1 7.156 0.020 . 1 . . . A 89 PHE HE1 . 18545 1 1057 . 1 1 89 89 PHE C C 13 176.774 0.3 . 1 . . . A 89 PHE C . 18545 1 1058 . 1 1 89 89 PHE CA C 13 59.363 0.3 . 1 . . . A 89 PHE CA . 18545 1 1059 . 1 1 89 89 PHE CB C 13 39.596 0.3 . 1 . . . A 89 PHE CB . 18545 1 1060 . 1 1 89 89 PHE CD1 C 13 131.372 0.3 . 1 . . . A 89 PHE CD1 . 18545 1 1061 . 1 1 89 89 PHE CE1 C 13 129.662 0.3 . 1 . . . A 89 PHE CE1 . 18545 1 1062 . 1 1 89 89 PHE N N 15 117.551 0.3 . 1 . . . A 89 PHE N . 18545 1 1063 . 1 1 90 90 TRP H H 1 7.940 0.020 . 1 . . . A 90 TRP H . 18545 1 1064 . 1 1 90 90 TRP HA H 1 4.508 0.020 . 1 . . . A 90 TRP HA . 18545 1 1065 . 1 1 90 90 TRP HB2 H 1 3.052 0.020 . 2 . . . A 90 TRP HB2 . 18545 1 1066 . 1 1 90 90 TRP HB3 H 1 3.155 0.020 . 2 . . . A 90 TRP HB3 . 18545 1 1067 . 1 1 90 90 TRP HD1 H 1 7.063 0.020 . 1 . . . A 90 TRP HD1 . 18545 1 1068 . 1 1 90 90 TRP HE1 H 1 9.601 0.020 . 1 . . . A 90 TRP HE1 . 18545 1 1069 . 1 1 90 90 TRP HE3 H 1 7.574 0.020 . 1 . . . A 90 TRP HE3 . 18545 1 1070 . 1 1 90 90 TRP HZ2 H 1 7.045 0.020 . 1 . . . A 90 TRP HZ2 . 18545 1 1071 . 1 1 90 90 TRP HZ3 H 1 7.052 0.020 . 1 . . . A 90 TRP HZ3 . 18545 1 1072 . 1 1 90 90 TRP C C 13 176.595 0.3 . 1 . . . A 90 TRP C . 18545 1 1073 . 1 1 90 90 TRP CA C 13 57.796 0.3 . 1 . . . A 90 TRP CA . 18545 1 1074 . 1 1 90 90 TRP CB C 13 29.647 0.3 . 1 . . . A 90 TRP CB . 18545 1 1075 . 1 1 90 90 TRP CD1 C 13 127.860 0.3 . 1 . . . A 90 TRP CD1 . 18545 1 1076 . 1 1 90 90 TRP CE2 C 13 137.815 0.3 . 1 . . . A 90 TRP CE2 . 18545 1 1077 . 1 1 90 90 TRP CE3 C 13 120.740 0.3 . 1 . . . A 90 TRP CE3 . 18545 1 1078 . 1 1 90 90 TRP CZ2 C 13 114.318 0.3 . 1 . . . A 90 TRP CZ2 . 18545 1 1079 . 1 1 90 90 TRP CZ3 C 13 121.692 0.3 . 1 . . . A 90 TRP CZ3 . 18545 1 1080 . 1 1 90 90 TRP N N 15 118.708 0.3 . 1 . . . A 90 TRP N . 18545 1 1081 . 1 1 90 90 TRP NE1 N 15 128.328 0.3 . 1 . . . A 90 TRP NE1 . 18545 1 1082 . 1 1 91 91 GLU H H 1 7.866 0.020 . 1 . . . A 91 GLU H . 18545 1 1083 . 1 1 91 91 GLU HA H 1 4.160 0.020 . 1 . . . A 91 GLU HA . 18545 1 1084 . 1 1 91 91 GLU HB2 H 1 1.954 0.020 . 2 . . . A 91 GLU HB2 . 18545 1 1085 . 1 1 91 91 GLU HB3 H 1 1.914 0.020 . 2 . . . A 91 GLU HB3 . 18545 1 1086 . 1 1 91 91 GLU HG2 H 1 2.047 0.020 . 2 . . . A 91 GLU HG2 . 18545 1 1087 . 1 1 91 91 GLU HG3 H 1 2.158 0.020 . 2 . . . A 91 GLU HG3 . 18545 1 1088 . 1 1 91 91 GLU CA C 13 57.098 0.3 . 1 . . . A 91 GLU CA . 18545 1 1089 . 1 1 91 91 GLU CB C 13 29.881 0.3 . 1 . . . A 91 GLU CB . 18545 1 1090 . 1 1 91 91 GLU CG C 13 36.253 0.3 . 1 . . . A 91 GLU CG . 18545 1 1091 . 1 1 91 91 GLU N N 15 120.380 0.3 . 1 . . . A 91 GLU N . 18545 1 1092 . 1 1 92 92 ASN HA H 1 4.664 0.020 . 1 . . . A 92 ASN HA . 18545 1 1093 . 1 1 92 92 ASN HB2 H 1 2.683 0.020 . 2 . . . A 92 ASN HB2 . 18545 1 1094 . 1 1 92 92 ASN HB3 H 1 2.484 0.020 . 2 . . . A 92 ASN HB3 . 18545 1 1095 . 1 1 92 92 ASN HD21 H 1 7.282 0.020 . 1 . . . A 92 ASN HD21 . 18545 1 1096 . 1 1 92 92 ASN HD22 H 1 6.674 0.020 . 1 . . . A 92 ASN HD22 . 18545 1 1097 . 1 1 92 92 ASN C C 13 173.973 0.3 . 1 . . . A 92 ASN C . 18545 1 1098 . 1 1 92 92 ASN CA C 13 53.122 0.3 . 1 . . . A 92 ASN CA . 18545 1 1099 . 1 1 92 92 ASN CB C 13 39.144 0.3 . 1 . . . A 92 ASN CB . 18545 1 1100 . 1 1 92 92 ASN ND2 N 15 113.224 0.3 . 1 . . . A 92 ASN ND2 . 18545 1 1101 . 1 1 93 93 SER H H 1 7.679 0.020 . 1 . . . A 93 SER H . 18545 1 1102 . 1 1 93 93 SER HA H 1 4.176 0.020 . 1 . . . A 93 SER HA . 18545 1 1103 . 1 1 93 93 SER HB2 H 1 3.749 0.020 . 2 . . . A 93 SER HB2 . 18545 1 1104 . 1 1 93 93 SER HB3 H 1 3.749 0.020 . 2 . . . A 93 SER HB3 . 18545 1 1105 . 1 1 93 93 SER CA C 13 60.13 0.3 . 1 . . . A 93 SER CA . 18545 1 1106 . 1 1 93 93 SER CB C 13 64.768 0.3 . 1 . . . A 93 SER CB . 18545 1 1107 . 1 1 93 93 SER N N 15 121.235 0.3 . 1 . . . A 93 SER N . 18545 1 stop_ loop_ _Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID _Ambiguous_atom_chem_shift.Atom_chem_shift_ID _Ambiguous_atom_chem_shift.Entry_ID _Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID 1 565 18545 1 1 566 18545 1 1 843 18545 1 1 844 18545 1 1 1024 18545 1 1 1025 18545 1 2 571 18545 1 2 850 18545 1 2 1030 18545 1 stop_ save_