################################### # 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 18917 _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 '3D HNCO' . . . 18917 1 2 '3D HNCA' . . . 18917 1 3 '3D CBCA(CO)NH' . . . 18917 1 4 '3D HBHA(CO)NH' . . . 18917 1 5 '3D HCCH-TOCSY' . . . 18917 1 6 '3D (H)CCH-TOCSY' . . . 18917 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 22 22 HIS HA H 1 4.481 0.04 . 1 . . . . 21 HIS HA . 18917 1 2 . 1 1 22 22 HIS HB2 H 1 2.985 0.04 . 2 . . . . 21 HIS HB2 . 18917 1 3 . 1 1 22 22 HIS HB3 H 1 2.917 0.04 . 2 . . . . 21 HIS HB3 . 18917 1 4 . 1 1 22 22 HIS C C 13 174.127 0.40 . 1 . . . . 21 HIS C . 18917 1 5 . 1 1 22 22 HIS CA C 13 56.003 0.40 . 1 . . . . 21 HIS CA . 18917 1 6 . 1 1 22 22 HIS CB C 13 30.635 0.40 . 1 . . . . 21 HIS CB . 18917 1 7 . 1 1 23 23 ALA H H 1 7.847 0.04 . 1 . . . . 22 ALA H . 18917 1 8 . 1 1 23 23 ALA N N 15 125.714 0.40 . 1 . . . . 22 ALA N . 18917 1 9 . 1 1 24 24 ALA HA H 1 4.092 0.04 . 1 . . . . 23 ALA HA . 18917 1 10 . 1 1 24 24 ALA HB1 H 1 1.410 0.04 . 1 . . . . 23 ALA HB . 18917 1 11 . 1 1 24 24 ALA HB2 H 1 1.410 0.04 . 1 . . . . 23 ALA HB . 18917 1 12 . 1 1 24 24 ALA HB3 H 1 1.410 0.04 . 1 . . . . 23 ALA HB . 18917 1 13 . 1 1 24 24 ALA C C 13 173.419 0.40 . 1 . . . . 23 ALA C . 18917 1 14 . 1 1 24 24 ALA CA C 13 51.518 0.40 . 1 . . . . 23 ALA CA . 18917 1 15 . 1 1 24 24 ALA CB C 13 20.627 0.40 . 1 . . . . 23 ALA CB . 18917 1 16 . 1 1 25 25 THR H H 1 8.348 0.04 . 1 . . . . 24 THR H . 18917 1 17 . 1 1 25 25 THR HA H 1 4.178 0.04 . 1 . . . . 24 THR HA . 18917 1 18 . 1 1 25 25 THR HB H 1 3.861 0.04 . 1 . . . . 24 THR HB . 18917 1 19 . 1 1 25 25 THR HG21 H 1 1.031 0.04 . 1 . . . . 24 THR HG2 . 18917 1 20 . 1 1 25 25 THR HG22 H 1 1.031 0.04 . 1 . . . . 24 THR HG2 . 18917 1 21 . 1 1 25 25 THR HG23 H 1 1.031 0.04 . 1 . . . . 24 THR HG2 . 18917 1 22 . 1 1 25 25 THR C C 13 172.092 0.40 . 1 . . . . 24 THR C . 18917 1 23 . 1 1 25 25 THR CA C 13 62.513 0.40 . 1 . . . . 24 THR CA . 18917 1 24 . 1 1 25 25 THR CB C 13 70.299 0.40 . 1 . . . . 24 THR CB . 18917 1 25 . 1 1 25 25 THR CG2 C 13 22.169 0.40 . 1 . . . . 24 THR CG2 . 18917 1 26 . 1 1 25 25 THR N N 15 116.995 0.40 . 1 . . . . 24 THR N . 18917 1 27 . 1 1 26 26 GLU H H 1 8.518 0.04 . 1 . . . . 25 GLU H . 18917 1 28 . 1 1 26 26 GLU HA H 1 2.971 0.04 . 1 . . . . 25 GLU HA . 18917 1 29 . 1 1 26 26 GLU HB2 H 1 1.630 0.04 . 2 . . . . 25 GLU HB2 . 18917 1 30 . 1 1 26 26 GLU HB3 H 1 1.358 0.04 . 2 . . . . 25 GLU HB3 . 18917 1 31 . 1 1 26 26 GLU HG2 H 1 1.935 0.04 . 2 . . . . 25 GLU HG2 . 18917 1 32 . 1 1 26 26 GLU HG3 H 1 1.638 0.04 . 2 . . . . 25 GLU HG3 . 18917 1 33 . 1 1 26 26 GLU C C 13 176.140 0.40 . 1 . . . . 25 GLU C . 18917 1 34 . 1 1 26 26 GLU CA C 13 55.053 0.40 . 1 . . . . 25 GLU CA . 18917 1 35 . 1 1 26 26 GLU CB C 13 29.593 0.40 . 1 . . . . 25 GLU CB . 18917 1 36 . 1 1 26 26 GLU CG C 13 35.630 0.40 . 1 . . . . 25 GLU CG . 18917 1 37 . 1 1 26 26 GLU N N 15 128.063 0.40 . 1 . . . . 25 GLU N . 18917 1 38 . 1 1 27 27 LEU H H 1 8.487 0.04 . 1 . . . . 26 LEU H . 18917 1 39 . 1 1 27 27 LEU HA H 1 4.376 0.04 . 1 . . . . 26 LEU HA . 18917 1 40 . 1 1 27 27 LEU HB2 H 1 1.429 0.04 . 2 . . . . 26 LEU HB2 . 18917 1 41 . 1 1 27 27 LEU HB3 H 1 1.291 0.04 . 2 . . . . 26 LEU HB3 . 18917 1 42 . 1 1 27 27 LEU HG H 1 1.283 0.04 . 1 . . . . 26 LEU HG . 18917 1 43 . 1 1 27 27 LEU HD11 H 1 -0.229 0.04 . 2 . . . . 26 LEU HD1 . 18917 1 44 . 1 1 27 27 LEU HD12 H 1 -0.229 0.04 . 2 . . . . 26 LEU HD1 . 18917 1 45 . 1 1 27 27 LEU HD13 H 1 -0.229 0.04 . 2 . . . . 26 LEU HD1 . 18917 1 46 . 1 1 27 27 LEU HD21 H 1 0.369 0.04 . 2 . . . . 26 LEU HD2 . 18917 1 47 . 1 1 27 27 LEU HD22 H 1 0.369 0.04 . 2 . . . . 26 LEU HD2 . 18917 1 48 . 1 1 27 27 LEU HD23 H 1 0.369 0.04 . 2 . . . . 26 LEU HD2 . 18917 1 49 . 1 1 27 27 LEU C C 13 177.240 0.40 . 1 . . . . 26 LEU C . 18917 1 50 . 1 1 27 27 LEU CA C 13 54.104 0.40 . 1 . . . . 26 LEU CA . 18917 1 51 . 1 1 27 27 LEU CB C 13 43.233 0.40 . 1 . . . . 26 LEU CB . 18917 1 52 . 1 1 27 27 LEU CG C 13 26.419 0.40 . 1 . . . . 26 LEU CG . 18917 1 53 . 1 1 27 27 LEU CD1 C 13 25.944 0.40 . 2 . . . . 26 LEU CD1 . 18917 1 54 . 1 1 27 27 LEU CD2 C 13 21.026 0.40 . 2 . . . . 26 LEU CD2 . 18917 1 55 . 1 1 27 27 LEU N N 15 128.014 0.40 . 1 . . . . 26 LEU N . 18917 1 56 . 1 1 28 28 THR H H 1 8.052 0.04 . 1 . . . . 27 THR H . 18917 1 57 . 1 1 28 28 THR N N 15 110.909 0.40 . 1 . . . . 27 THR N . 18917 1 58 . 1 1 29 29 PRO HA H 1 3.707 0.04 . 1 . . . . 28 PRO HA . 18917 1 59 . 1 1 29 29 PRO HB2 H 1 2.353 0.04 . 2 . . . . 28 PRO HB2 . 18917 1 60 . 1 1 29 29 PRO HB3 H 1 1.791 0.04 . 2 . . . . 28 PRO HB3 . 18917 1 61 . 1 1 29 29 PRO HG2 H 1 2.213 0.04 . 2 . . . . 28 PRO HG2 . 18917 1 62 . 1 1 29 29 PRO HG3 H 1 2.378 0.04 . 2 . . . . 28 PRO HG3 . 18917 1 63 . 1 1 29 29 PRO HD2 H 1 3.940 0.04 . 2 . . . . 28 PRO HD2 . 18917 1 64 . 1 1 29 29 PRO HD3 H 1 3.992 0.04 . 2 . . . . 28 PRO HD3 . 18917 1 65 . 1 1 29 29 PRO C C 13 179.595 0.40 . 1 . . . . 28 PRO C . 18917 1 66 . 1 1 29 29 PRO CA C 13 65.752 0.40 . 1 . . . . 28 PRO CA . 18917 1 67 . 1 1 29 29 PRO CB C 13 31.407 0.40 . 1 . . . . 28 PRO CB . 18917 1 68 . 1 1 29 29 PRO CG C 13 27.820 0.40 . 1 . . . . 28 PRO CG . 18917 1 69 . 1 1 29 29 PRO CD C 13 49.970 0.40 . 1 . . . . 28 PRO CD . 18917 1 70 . 1 1 30 30 GLU H H 1 8.449 0.04 . 1 . . . . 29 GLU H . 18917 1 71 . 1 1 30 30 GLU HA H 1 3.829 0.04 . 1 . . . . 29 GLU HA . 18917 1 72 . 1 1 30 30 GLU HB2 H 1 1.886 0.04 . 2 . . . . 29 GLU HB2 . 18917 1 73 . 1 1 30 30 GLU HB3 H 1 1.759 0.04 . 2 . . . . 29 GLU HB3 . 18917 1 74 . 1 1 30 30 GLU HG2 H 1 2.245 0.04 . 2 . . . . 29 GLU HG2 . 18917 1 75 . 1 1 30 30 GLU HG3 H 1 2.110 0.04 . 2 . . . . 29 GLU HG3 . 18917 1 76 . 1 1 30 30 GLU C C 13 179.461 0.40 . 1 . . . . 29 GLU C . 18917 1 77 . 1 1 30 30 GLU CA C 13 59.728 0.40 . 1 . . . . 29 GLU CA . 18917 1 78 . 1 1 30 30 GLU CB C 13 28.787 0.40 . 1 . . . . 29 GLU CB . 18917 1 79 . 1 1 30 30 GLU CG C 13 36.745 0.40 . 1 . . . . 29 GLU CG . 18917 1 80 . 1 1 30 30 GLU N N 15 116.083 0.40 . 1 . . . . 29 GLU N . 18917 1 81 . 1 1 31 31 GLN H H 1 7.383 0.04 . 1 . . . . 30 GLN H . 18917 1 82 . 1 1 31 31 GLN HA H 1 3.823 0.04 . 1 . . . . 30 GLN HA . 18917 1 83 . 1 1 31 31 GLN HB2 H 1 2.091 0.04 . 2 . . . . 30 GLN HB2 . 18917 1 84 . 1 1 31 31 GLN HB3 H 1 1.590 0.04 . 2 . . . . 30 GLN HB3 . 18917 1 85 . 1 1 31 31 GLN HG2 H 1 2.222 0.04 . 2 . . . . 30 GLN HG2 . 18917 1 86 . 1 1 31 31 GLN HG3 H 1 2.222 0.04 . 2 . . . . 30 GLN HG3 . 18917 1 87 . 1 1 31 31 GLN HE21 H 1 7.305 0.04 . 2 . . . . 30 GLN HE21 . 18917 1 88 . 1 1 31 31 GLN HE22 H 1 6.553 0.04 . 2 . . . . 30 GLN HE22 . 18917 1 89 . 1 1 31 31 GLN C C 13 178.660 0.40 . 1 . . . . 30 GLN C . 18917 1 90 . 1 1 31 31 GLN CA C 13 57.808 0.40 . 1 . . . . 30 GLN CA . 18917 1 91 . 1 1 31 31 GLN CB C 13 29.581 0.40 . 1 . . . . 30 GLN CB . 18917 1 92 . 1 1 31 31 GLN CG C 13 34.055 0.40 . 1 . . . . 30 GLN CG . 18917 1 93 . 1 1 31 31 GLN N N 15 119.269 0.40 . 1 . . . . 30 GLN N . 18917 1 94 . 1 1 31 31 GLN NE2 N 15 109.938 0.40 . 1 . . . . 30 GLN NE2 . 18917 1 95 . 1 1 32 32 ALA H H 1 8.037 0.04 . 1 . . . . 31 ALA H . 18917 1 96 . 1 1 32 32 ALA HA H 1 3.258 0.04 . 1 . . . . 31 ALA HA . 18917 1 97 . 1 1 32 32 ALA HB1 H 1 0.531 0.04 . 1 . . . . 31 ALA HB . 18917 1 98 . 1 1 32 32 ALA HB2 H 1 0.531 0.04 . 1 . . . . 31 ALA HB . 18917 1 99 . 1 1 32 32 ALA HB3 H 1 0.531 0.04 . 1 . . . . 31 ALA HB . 18917 1 100 . 1 1 32 32 ALA C C 13 179.172 0.40 . 1 . . . . 31 ALA C . 18917 1 101 . 1 1 32 32 ALA CA C 13 54.221 0.40 . 1 . . . . 31 ALA CA . 18917 1 102 . 1 1 32 32 ALA CB C 13 17.456 0.40 . 1 . . . . 31 ALA CB . 18917 1 103 . 1 1 32 32 ALA N N 15 120.163 0.40 . 1 . . . . 31 ALA N . 18917 1 104 . 1 1 33 33 ALA H H 1 7.231 0.04 . 1 . . . . 32 ALA H . 18917 1 105 . 1 1 33 33 ALA HA H 1 3.977 0.04 . 1 . . . . 32 ALA HA . 18917 1 106 . 1 1 33 33 ALA HB1 H 1 1.282 0.04 . 1 . . . . 32 ALA HB . 18917 1 107 . 1 1 33 33 ALA HB2 H 1 1.282 0.04 . 1 . . . . 32 ALA HB . 18917 1 108 . 1 1 33 33 ALA HB3 H 1 1.282 0.04 . 1 . . . . 32 ALA HB . 18917 1 109 . 1 1 33 33 ALA C C 13 178.159 0.40 . 1 . . . . 32 ALA C . 18917 1 110 . 1 1 33 33 ALA CA C 13 53.575 0.40 . 1 . . . . 32 ALA CA . 18917 1 111 . 1 1 33 33 ALA CB C 13 18.244 0.40 . 1 . . . . 32 ALA CB . 18917 1 112 . 1 1 33 33 ALA N N 15 116.614 0.40 . 1 . . . . 32 ALA N . 18917 1 113 . 1 1 34 34 ALA H H 1 6.941 0.04 . 1 . . . . 33 ALA H . 18917 1 114 . 1 1 34 34 ALA HA H 1 4.250 0.04 . 1 . . . . 33 ALA HA . 18917 1 115 . 1 1 34 34 ALA HB1 H 1 1.298 0.04 . 1 . . . . 33 ALA HB . 18917 1 116 . 1 1 34 34 ALA HB2 H 1 1.298 0.04 . 1 . . . . 33 ALA HB . 18917 1 117 . 1 1 34 34 ALA HB3 H 1 1.298 0.04 . 1 . . . . 33 ALA HB . 18917 1 118 . 1 1 34 34 ALA C C 13 176.862 0.40 . 1 . . . . 33 ALA C . 18917 1 119 . 1 1 34 34 ALA CA C 13 52.158 0.40 . 1 . . . . 33 ALA CA . 18917 1 120 . 1 1 34 34 ALA CB C 13 19.637 0.40 . 1 . . . . 33 ALA CB . 18917 1 121 . 1 1 34 34 ALA N N 15 118.162 0.40 . 1 . . . . 33 ALA N . 18917 1 122 . 1 1 35 35 LEU H H 1 7.353 0.04 . 1 . . . . 34 LEU H . 18917 1 123 . 1 1 35 35 LEU HA H 1 4.580 0.04 . 1 . . . . 34 LEU HA . 18917 1 124 . 1 1 35 35 LEU HB2 H 1 1.418 0.04 . 2 . . . . 34 LEU HB2 . 18917 1 125 . 1 1 35 35 LEU HB3 H 1 1.388 0.04 . 2 . . . . 34 LEU HB3 . 18917 1 126 . 1 1 35 35 LEU HG H 1 1.436 0.04 . 1 . . . . 34 LEU HG . 18917 1 127 . 1 1 35 35 LEU HD11 H 1 0.354 0.04 . 2 . . . . 34 LEU HD1 . 18917 1 128 . 1 1 35 35 LEU HD12 H 1 0.354 0.04 . 2 . . . . 34 LEU HD1 . 18917 1 129 . 1 1 35 35 LEU HD13 H 1 0.354 0.04 . 2 . . . . 34 LEU HD1 . 18917 1 130 . 1 1 35 35 LEU HD21 H 1 0.679 0.04 . 2 . . . . 34 LEU HD2 . 18917 1 131 . 1 1 35 35 LEU HD22 H 1 0.679 0.04 . 2 . . . . 34 LEU HD2 . 18917 1 132 . 1 1 35 35 LEU HD23 H 1 0.679 0.04 . 2 . . . . 34 LEU HD2 . 18917 1 133 . 1 1 35 35 LEU C C 13 175.517 0.40 . 1 . . . . 34 LEU C . 18917 1 134 . 1 1 35 35 LEU CA C 13 53.385 0.40 . 1 . . . . 34 LEU CA . 18917 1 135 . 1 1 35 35 LEU CB C 13 46.147 0.40 . 1 . . . . 34 LEU CB . 18917 1 136 . 1 1 35 35 LEU CG C 13 26.494 0.40 . 1 . . . . 34 LEU CG . 18917 1 137 . 1 1 35 35 LEU CD1 C 13 25.404 0.40 . 2 . . . . 34 LEU CD1 . 18917 1 138 . 1 1 35 35 LEU CD2 C 13 22.432 0.40 . 2 . . . . 34 LEU CD2 . 18917 1 139 . 1 1 35 35 LEU N N 15 119.497 0.40 . 1 . . . . 34 LEU N . 18917 1 140 . 1 1 36 36 LYS H H 1 8.474 0.04 . 1 . . . . 35 LYS H . 18917 1 141 . 1 1 36 36 LYS HA H 1 4.992 0.04 . 1 . . . . 35 LYS HA . 18917 1 142 . 1 1 36 36 LYS HB2 H 1 1.748 0.04 . 2 . . . . 35 LYS HB2 . 18917 1 143 . 1 1 36 36 LYS HB3 H 1 1.697 0.04 . 2 . . . . 35 LYS HB3 . 18917 1 144 . 1 1 36 36 LYS HG2 H 1 1.419 0.04 . 2 . . . . 35 LYS HG2 . 18917 1 145 . 1 1 36 36 LYS HG3 H 1 1.360 0.04 . 2 . . . . 35 LYS HG3 . 18917 1 146 . 1 1 36 36 LYS HD2 H 1 1.616 0.04 . 2 . . . . 35 LYS HD2 . 18917 1 147 . 1 1 36 36 LYS HD3 H 1 1.616 0.04 . 2 . . . . 35 LYS HD3 . 18917 1 148 . 1 1 36 36 LYS HE2 H 1 2.917 0.04 . 2 . . . . 35 LYS HE2 . 18917 1 149 . 1 1 36 36 LYS HE3 H 1 2.917 0.04 . 2 . . . . 35 LYS HE3 . 18917 1 150 . 1 1 36 36 LYS CA C 13 52.386 0.40 . 1 . . . . 35 LYS CA . 18917 1 151 . 1 1 36 36 LYS CB C 13 33.770 0.40 . 1 . . . . 35 LYS CB . 18917 1 152 . 1 1 36 36 LYS CG C 13 24.306 0.40 . 1 . . . . 35 LYS CG . 18917 1 153 . 1 1 36 36 LYS CD C 13 29.042 0.40 . 1 . . . . 35 LYS CD . 18917 1 154 . 1 1 36 36 LYS CE C 13 42.137 0.40 . 1 . . . . 35 LYS CE . 18917 1 155 . 1 1 36 36 LYS N N 15 120.623 0.40 . 1 . . . . 35 LYS N . 18917 1 156 . 1 1 37 37 PRO HA H 1 3.859 0.04 . 1 . . . . 36 PRO HA . 18917 1 157 . 1 1 37 37 PRO HB2 H 1 1.581 0.04 . 2 . . . . 36 PRO HB2 . 18917 1 158 . 1 1 37 37 PRO HB3 H 1 1.065 0.04 . 2 . . . . 36 PRO HB3 . 18917 1 159 . 1 1 37 37 PRO HG2 H 1 1.711 0.04 . 2 . . . . 36 PRO HG2 . 18917 1 160 . 1 1 37 37 PRO HG3 H 1 1.711 0.04 . 2 . . . . 36 PRO HG3 . 18917 1 161 . 1 1 37 37 PRO HD2 H 1 3.699 0.04 . 2 . . . . 36 PRO HD2 . 18917 1 162 . 1 1 37 37 PRO HD3 H 1 3.906 0.04 . 2 . . . . 36 PRO HD3 . 18917 1 163 . 1 1 37 37 PRO C C 13 176.599 0.40 . 1 . . . . 36 PRO C . 18917 1 164 . 1 1 37 37 PRO CA C 13 62.929 0.40 . 1 . . . . 36 PRO CA . 18917 1 165 . 1 1 37 37 PRO CB C 13 32.965 0.40 . 1 . . . . 36 PRO CB . 18917 1 166 . 1 1 37 37 PRO CG C 13 26.049 0.40 . 1 . . . . 36 PRO CG . 18917 1 167 . 1 1 37 37 PRO CD C 13 50.930 0.40 . 1 . . . . 36 PRO CD . 18917 1 168 . 1 1 38 38 TYR H H 1 8.514 0.04 . 1 . . . . 37 TYR H . 18917 1 169 . 1 1 38 38 TYR HA H 1 4.793 0.04 . 1 . . . . 37 TYR HA . 18917 1 170 . 1 1 38 38 TYR HB2 H 1 3.240 0.04 . 2 . . . . 37 TYR HB2 . 18917 1 171 . 1 1 38 38 TYR HB3 H 1 2.772 0.04 . 2 . . . . 37 TYR HB3 . 18917 1 172 . 1 1 38 38 TYR HD1 H 1 6.994 0.04 . 3 . . . . 37 TYR HD1 . 18917 1 173 . 1 1 38 38 TYR HD2 H 1 6.994 0.04 . 3 . . . . 37 TYR HD2 . 18917 1 174 . 1 1 38 38 TYR HE1 H 1 6.672 0.04 . 3 . . . . 37 TYR HE1 . 18917 1 175 . 1 1 38 38 TYR HE2 H 1 6.672 0.04 . 3 . . . . 37 TYR HE2 . 18917 1 176 . 1 1 38 38 TYR C C 13 174.043 0.40 . 1 . . . . 37 TYR C . 18917 1 177 . 1 1 38 38 TYR CA C 13 56.537 0.40 . 1 . . . . 37 TYR CA . 18917 1 178 . 1 1 38 38 TYR CB C 13 38.868 0.40 . 1 . . . . 37 TYR CB . 18917 1 179 . 1 1 38 38 TYR CD1 C 13 133.599 0.40 . 3 . . . . 37 TYR CD1 . 18917 1 180 . 1 1 38 38 TYR CE1 C 13 118.084 0.40 . 3 . . . . 37 TYR CE1 . 18917 1 181 . 1 1 38 38 TYR N N 15 117.338 0.40 . 1 . . . . 37 TYR N . 18917 1 182 . 1 1 39 39 ASP H H 1 7.146 0.04 . 1 . . . . 38 ASP H . 18917 1 183 . 1 1 39 39 ASP HA H 1 4.435 0.04 . 1 . . . . 38 ASP HA . 18917 1 184 . 1 1 39 39 ASP HB2 H 1 2.277 0.04 . 2 . . . . 38 ASP HB2 . 18917 1 185 . 1 1 39 39 ASP HB3 H 1 1.686 0.04 . 2 . . . . 38 ASP HB3 . 18917 1 186 . 1 1 39 39 ASP C C 13 172.619 0.40 . 1 . . . . 38 ASP C . 18917 1 187 . 1 1 39 39 ASP CA C 13 52.407 0.40 . 1 . . . . 38 ASP CA . 18917 1 188 . 1 1 39 39 ASP CB C 13 43.197 0.40 . 1 . . . . 38 ASP CB . 18917 1 189 . 1 1 39 39 ASP N N 15 118.814 0.40 . 1 . . . . 38 ASP N . 18917 1 190 . 1 1 40 40 ARG H H 1 8.683 0.04 . 1 . . . . 39 ARG H . 18917 1 191 . 1 1 40 40 ARG HA H 1 5.143 0.04 . 1 . . . . 39 ARG HA . 18917 1 192 . 1 1 40 40 ARG HB2 H 1 1.873 0.04 . 2 . . . . 39 ARG HB2 . 18917 1 193 . 1 1 40 40 ARG HB3 H 1 1.511 0.04 . 2 . . . . 39 ARG HB3 . 18917 1 194 . 1 1 40 40 ARG HG2 H 1 1.256 0.04 . 2 . . . . 39 ARG HG2 . 18917 1 195 . 1 1 40 40 ARG HG3 H 1 1.170 0.04 . 2 . . . . 39 ARG HG3 . 18917 1 196 . 1 1 40 40 ARG HD2 H 1 2.902 0.04 . 2 . . . . 39 ARG HD2 . 18917 1 197 . 1 1 40 40 ARG HD3 H 1 2.773 0.04 . 2 . . . . 39 ARG HD3 . 18917 1 198 . 1 1 40 40 ARG C C 13 175.199 0.40 . 1 . . . . 39 ARG C . 18917 1 199 . 1 1 40 40 ARG CA C 13 55.216 0.40 . 1 . . . . 39 ARG CA . 18917 1 200 . 1 1 40 40 ARG CB C 13 33.535 0.40 . 1 . . . . 39 ARG CB . 18917 1 201 . 1 1 40 40 ARG CG C 13 26.184 0.40 . 1 . . . . 39 ARG CG . 18917 1 202 . 1 1 40 40 ARG CD C 13 43.181 0.40 . 1 . . . . 39 ARG CD . 18917 1 203 . 1 1 40 40 ARG N N 15 121.789 0.40 . 1 . . . . 39 ARG N . 18917 1 204 . 1 1 41 41 ILE H H 1 9.407 0.04 . 1 . . . . 40 ILE H . 18917 1 205 . 1 1 41 41 ILE HA H 1 4.536 0.04 . 1 . . . . 40 ILE HA . 18917 1 206 . 1 1 41 41 ILE HB H 1 1.581 0.04 . 1 . . . . 40 ILE HB . 18917 1 207 . 1 1 41 41 ILE HG12 H 1 1.266 0.04 . 2 . . . . 40 ILE HG12 . 18917 1 208 . 1 1 41 41 ILE HG13 H 1 0.925 0.04 . 2 . . . . 40 ILE HG13 . 18917 1 209 . 1 1 41 41 ILE HG21 H 1 0.632 0.04 . 1 . . . . 40 ILE HG2 . 18917 1 210 . 1 1 41 41 ILE HG22 H 1 0.632 0.04 . 1 . . . . 40 ILE HG2 . 18917 1 211 . 1 1 41 41 ILE HG23 H 1 0.632 0.04 . 1 . . . . 40 ILE HG2 . 18917 1 212 . 1 1 41 41 ILE HD11 H 1 0.473 0.04 . 1 . . . . 40 ILE HD1 . 18917 1 213 . 1 1 41 41 ILE HD12 H 1 0.473 0.04 . 1 . . . . 40 ILE HD1 . 18917 1 214 . 1 1 41 41 ILE HD13 H 1 0.473 0.04 . 1 . . . . 40 ILE HD1 . 18917 1 215 . 1 1 41 41 ILE C C 13 173.378 0.40 . 1 . . . . 40 ILE C . 18917 1 216 . 1 1 41 41 ILE CA C 13 59.241 0.40 . 1 . . . . 40 ILE CA . 18917 1 217 . 1 1 41 41 ILE CB C 13 41.395 0.40 . 1 . . . . 40 ILE CB . 18917 1 218 . 1 1 41 41 ILE CG1 C 13 25.780 0.40 . 1 . . . . 40 ILE CG1 . 18917 1 219 . 1 1 41 41 ILE CG2 C 13 17.459 0.40 . 1 . . . . 40 ILE CG2 . 18917 1 220 . 1 1 41 41 ILE CD1 C 13 13.988 0.40 . 1 . . . . 40 ILE CD1 . 18917 1 221 . 1 1 41 41 ILE N N 15 122.495 0.40 . 1 . . . . 40 ILE N . 18917 1 222 . 1 1 42 42 VAL H H 1 8.162 0.04 . 1 . . . . 41 VAL H . 18917 1 223 . 1 1 42 42 VAL HA H 1 4.909 0.04 . 1 . . . . 41 VAL HA . 18917 1 224 . 1 1 42 42 VAL HB H 1 1.791 0.04 . 1 . . . . 41 VAL HB . 18917 1 225 . 1 1 42 42 VAL HG11 H 1 0.740 0.04 . 2 . . . . 41 VAL HG1 . 18917 1 226 . 1 1 42 42 VAL HG12 H 1 0.740 0.04 . 2 . . . . 41 VAL HG1 . 18917 1 227 . 1 1 42 42 VAL HG13 H 1 0.740 0.04 . 2 . . . . 41 VAL HG1 . 18917 1 228 . 1 1 42 42 VAL C C 13 175.964 0.40 . 1 . . . . 41 VAL C . 18917 1 229 . 1 1 42 42 VAL CA C 13 60.780 0.40 . 1 . . . . 41 VAL CA . 18917 1 230 . 1 1 42 42 VAL CB C 13 34.265 0.40 . 1 . . . . 41 VAL CB . 18917 1 231 . 1 1 42 42 VAL CG1 C 13 21.203 0.40 . 2 . . . . 41 VAL CG1 . 18917 1 232 . 1 1 42 42 VAL N N 15 121.345 0.40 . 1 . . . . 41 VAL N . 18917 1 233 . 1 1 43 43 ILE H H 1 9.216 0.04 . 1 . . . . 42 ILE H . 18917 1 234 . 1 1 43 43 ILE HA H 1 4.607 0.04 . 1 . . . . 42 ILE HA . 18917 1 235 . 1 1 43 43 ILE HB H 1 1.683 0.04 . 1 . . . . 42 ILE HB . 18917 1 236 . 1 1 43 43 ILE HG12 H 1 1.266 0.04 . 2 . . . . 42 ILE HG12 . 18917 1 237 . 1 1 43 43 ILE HG13 H 1 0.987 0.04 . 2 . . . . 42 ILE HG13 . 18917 1 238 . 1 1 43 43 ILE HG21 H 1 0.796 0.04 . 1 . . . . 42 ILE HG2 . 18917 1 239 . 1 1 43 43 ILE HG22 H 1 0.796 0.04 . 1 . . . . 42 ILE HG2 . 18917 1 240 . 1 1 43 43 ILE HG23 H 1 0.796 0.04 . 1 . . . . 42 ILE HG2 . 18917 1 241 . 1 1 43 43 ILE HD11 H 1 0.639 0.04 . 1 . . . . 42 ILE HD1 . 18917 1 242 . 1 1 43 43 ILE HD12 H 1 0.639 0.04 . 1 . . . . 42 ILE HD1 . 18917 1 243 . 1 1 43 43 ILE HD13 H 1 0.639 0.04 . 1 . . . . 42 ILE HD1 . 18917 1 244 . 1 1 43 43 ILE C C 13 174.602 0.40 . 1 . . . . 42 ILE C . 18917 1 245 . 1 1 43 43 ILE CA C 13 59.121 0.40 . 1 . . . . 42 ILE CA . 18917 1 246 . 1 1 43 43 ILE CB C 13 41.225 0.40 . 1 . . . . 42 ILE CB . 18917 1 247 . 1 1 43 43 ILE CG1 C 13 28.584 0.40 . 1 . . . . 42 ILE CG1 . 18917 1 248 . 1 1 43 43 ILE CG2 C 13 18.641 0.40 . 1 . . . . 42 ILE CG2 . 18917 1 249 . 1 1 43 43 ILE CD1 C 13 14.439 0.40 . 1 . . . . 42 ILE CD1 . 18917 1 250 . 1 1 43 43 ILE N N 15 127.439 0.40 . 1 . . . . 42 ILE N . 18917 1 251 . 1 1 44 44 THR H H 1 8.331 0.04 . 1 . . . . 43 THR H . 18917 1 252 . 1 1 44 44 THR HA H 1 5.709 0.04 . 1 . . . . 43 THR HA . 18917 1 253 . 1 1 44 44 THR HB H 1 4.114 0.04 . 1 . . . . 43 THR HB . 18917 1 254 . 1 1 44 44 THR HG21 H 1 1.067 0.04 . 1 . . . . 43 THR HG2 . 18917 1 255 . 1 1 44 44 THR HG22 H 1 1.067 0.04 . 1 . . . . 43 THR HG2 . 18917 1 256 . 1 1 44 44 THR HG23 H 1 1.067 0.04 . 1 . . . . 43 THR HG2 . 18917 1 257 . 1 1 44 44 THR C C 13 174.350 0.40 . 1 . . . . 43 THR C . 18917 1 258 . 1 1 44 44 THR CA C 13 59.016 0.40 . 1 . . . . 43 THR CA . 18917 1 259 . 1 1 44 44 THR CB C 13 71.587 0.40 . 1 . . . . 43 THR CB . 18917 1 260 . 1 1 44 44 THR CG2 C 13 21.252 0.40 . 1 . . . . 43 THR CG2 . 18917 1 261 . 1 1 44 44 THR N N 15 116.415 0.40 . 1 . . . . 43 THR N . 18917 1 262 . 1 1 45 45 GLY H H 1 8.301 0.04 . 1 . . . . 44 GLY H . 18917 1 263 . 1 1 45 45 GLY HA2 H 1 3.800 0.04 . 2 . . . . 44 GLY HA2 . 18917 1 264 . 1 1 45 45 GLY HA3 H 1 3.568 0.04 . 2 . . . . 44 GLY HA3 . 18917 1 265 . 1 1 45 45 GLY C C 13 182.523 0.40 . 1 . . . . 44 GLY C . 18917 1 266 . 1 1 45 45 GLY CA C 13 45.118 0.40 . 1 . . . . 44 GLY CA . 18917 1 267 . 1 1 45 45 GLY N N 15 108.844 0.40 . 1 . . . . 44 GLY N . 18917 1 268 . 1 1 46 46 ARG H H 1 7.834 0.04 . 1 . . . . 45 ARG H . 18917 1 269 . 1 1 46 46 ARG HA H 1 4.742 0.04 . 1 . . . . 45 ARG HA . 18917 1 270 . 1 1 46 46 ARG HB2 H 1 1.526 0.04 . 2 . . . . 45 ARG HB2 . 18917 1 271 . 1 1 46 46 ARG HB3 H 1 1.408 0.04 . 2 . . . . 45 ARG HB3 . 18917 1 272 . 1 1 46 46 ARG HG2 H 1 1.413 0.04 . 2 . . . . 45 ARG HG2 . 18917 1 273 . 1 1 46 46 ARG HG3 H 1 1.334 0.04 . 2 . . . . 45 ARG HG3 . 18917 1 274 . 1 1 46 46 ARG HD2 H 1 3.068 0.04 . 2 . . . . 45 ARG HD2 . 18917 1 275 . 1 1 46 46 ARG HD3 H 1 3.010 0.04 . 2 . . . . 45 ARG HD3 . 18917 1 276 . 1 1 46 46 ARG C C 13 175.296 0.40 . 1 . . . . 45 ARG C . 18917 1 277 . 1 1 46 46 ARG CA C 13 54.732 0.40 . 1 . . . . 45 ARG CA . 18917 1 278 . 1 1 46 46 ARG CB C 13 29.624 0.40 . 1 . . . . 45 ARG CB . 18917 1 279 . 1 1 46 46 ARG CG C 13 26.984 0.40 . 1 . . . . 45 ARG CG . 18917 1 280 . 1 1 46 46 ARG CD C 13 43.078 0.40 . 1 . . . . 45 ARG CD . 18917 1 281 . 1 1 46 46 ARG N N 15 120.984 0.40 . 1 . . . . 45 ARG N . 18917 1 282 . 1 1 47 47 PHE H H 1 7.522 0.04 . 1 . . . . 46 PHE H . 18917 1 283 . 1 1 47 47 PHE N N 15 121.772 0.40 . 1 . . . . 46 PHE N . 18917 1 284 . 1 1 48 48 ASN HA H 1 4.515 0.04 . 1 . . . . 47 ASN HA . 18917 1 285 . 1 1 48 48 ASN HB2 H 1 2.770 0.04 . 2 . . . . 47 ASN HB2 . 18917 1 286 . 1 1 48 48 ASN HB3 H 1 2.770 0.04 . 2 . . . . 47 ASN HB3 . 18917 1 287 . 1 1 48 48 ASN HD21 H 1 6.900 0.04 . 2 . . . . 47 ASN HD21 . 18917 1 288 . 1 1 48 48 ASN HD22 H 1 6.900 0.04 . 2 . . . . 47 ASN HD22 . 18917 1 289 . 1 1 48 48 ASN C C 13 174.756 0.40 . 1 . . . . 47 ASN C . 18917 1 290 . 1 1 48 48 ASN CA C 13 54.988 0.40 . 1 . . . . 47 ASN CA . 18917 1 291 . 1 1 48 48 ASN CB C 13 38.817 0.40 . 1 . . . . 47 ASN CB . 18917 1 292 . 1 1 48 48 ASN ND2 N 15 113.800 0.40 . 1 . . . . 47 ASN ND2 . 18917 1 293 . 1 1 49 49 ALA H H 1 7.765 0.04 . 1 . . . . 48 ALA H . 18917 1 294 . 1 1 49 49 ALA HA H 1 4.594 0.04 . 1 . . . . 48 ALA HA . 18917 1 295 . 1 1 49 49 ALA HB1 H 1 1.389 0.04 . 1 . . . . 48 ALA HB . 18917 1 296 . 1 1 49 49 ALA HB2 H 1 1.389 0.04 . 1 . . . . 48 ALA HB . 18917 1 297 . 1 1 49 49 ALA HB3 H 1 1.389 0.04 . 1 . . . . 48 ALA HB . 18917 1 298 . 1 1 49 49 ALA C C 13 177.503 0.40 . 1 . . . . 48 ALA C . 18917 1 299 . 1 1 49 49 ALA CA C 13 50.742 0.40 . 1 . . . . 48 ALA CA . 18917 1 300 . 1 1 49 49 ALA CB C 13 22.001 0.40 . 1 . . . . 48 ALA CB . 18917 1 301 . 1 1 49 49 ALA N N 15 118.980 0.40 . 1 . . . . 48 ALA N . 18917 1 302 . 1 1 50 50 ILE H H 1 8.755 0.04 . 1 . . . . 49 ILE H . 18917 1 303 . 1 1 50 50 ILE HA H 1 3.288 0.04 . 1 . . . . 49 ILE HA . 18917 1 304 . 1 1 50 50 ILE HB H 1 1.600 0.04 . 1 . . . . 49 ILE HB . 18917 1 305 . 1 1 50 50 ILE HG12 H 1 1.054 0.04 . 2 . . . . 49 ILE HG12 . 18917 1 306 . 1 1 50 50 ILE HG13 H 1 1.006 0.04 . 2 . . . . 49 ILE HG13 . 18917 1 307 . 1 1 50 50 ILE HG21 H 1 0.796 0.04 . 1 . . . . 49 ILE HG2 . 18917 1 308 . 1 1 50 50 ILE HG22 H 1 0.796 0.04 . 1 . . . . 49 ILE HG2 . 18917 1 309 . 1 1 50 50 ILE HG23 H 1 0.796 0.04 . 1 . . . . 49 ILE HG2 . 18917 1 310 . 1 1 50 50 ILE HD11 H 1 0.624 0.04 . 1 . . . . 49 ILE HD1 . 18917 1 311 . 1 1 50 50 ILE HD12 H 1 0.624 0.04 . 1 . . . . 49 ILE HD1 . 18917 1 312 . 1 1 50 50 ILE HD13 H 1 0.624 0.04 . 1 . . . . 49 ILE HD1 . 18917 1 313 . 1 1 50 50 ILE C C 13 176.947 0.40 . 1 . . . . 49 ILE C . 18917 1 314 . 1 1 50 50 ILE CA C 13 62.863 0.40 . 1 . . . . 49 ILE CA . 18917 1 315 . 1 1 50 50 ILE CB C 13 37.336 0.40 . 1 . . . . 49 ILE CB . 18917 1 316 . 1 1 50 50 ILE CG1 C 13 28.670 0.40 . 1 . . . . 49 ILE CG1 . 18917 1 317 . 1 1 50 50 ILE CG2 C 13 17.016 0.40 . 1 . . . . 49 ILE CG2 . 18917 1 318 . 1 1 50 50 ILE CD1 C 13 13.209 0.40 . 1 . . . . 49 ILE CD1 . 18917 1 319 . 1 1 50 50 ILE N N 15 122.249 0.40 . 1 . . . . 49 ILE N . 18917 1 320 . 1 1 51 51 GLY H H 1 8.445 0.04 . 1 . . . . 50 GLY H . 18917 1 321 . 1 1 51 51 GLY HA2 H 1 3.732 0.04 . 2 . . . . 50 GLY HA2 . 18917 1 322 . 1 1 51 51 GLY HA3 H 1 3.658 0.04 . 2 . . . . 50 GLY HA3 . 18917 1 323 . 1 1 51 51 GLY C C 13 176.605 0.40 . 1 . . . . 50 GLY C . 18917 1 324 . 1 1 51 51 GLY CA C 13 46.740 0.40 . 1 . . . . 50 GLY CA . 18917 1 325 . 1 1 51 51 GLY N N 15 108.009 0.40 . 1 . . . . 50 GLY N . 18917 1 326 . 1 1 52 52 ASP H H 1 7.254 0.04 . 1 . . . . 51 ASP H . 18917 1 327 . 1 1 52 52 ASP HA H 1 4.325 0.04 . 1 . . . . 51 ASP HA . 18917 1 328 . 1 1 52 52 ASP HB2 H 1 2.840 0.04 . 2 . . . . 51 ASP HB2 . 18917 1 329 . 1 1 52 52 ASP HB3 H 1 2.772 0.04 . 2 . . . . 51 ASP HB3 . 18917 1 330 . 1 1 52 52 ASP C C 13 178.001 0.40 . 1 . . . . 51 ASP C . 18917 1 331 . 1 1 52 52 ASP CA C 13 56.337 0.40 . 1 . . . . 51 ASP CA . 18917 1 332 . 1 1 52 52 ASP CB C 13 41.213 0.40 . 1 . . . . 51 ASP CB . 18917 1 333 . 1 1 52 52 ASP N N 15 119.967 0.40 . 1 . . . . 51 ASP N . 18917 1 334 . 1 1 53 53 ALA H H 1 6.887 0.04 . 1 . . . . 52 ALA H . 18917 1 335 . 1 1 53 53 ALA HA H 1 2.278 0.04 . 1 . . . . 52 ALA HA . 18917 1 336 . 1 1 53 53 ALA HB1 H 1 0.542 0.04 . 1 . . . . 52 ALA HB . 18917 1 337 . 1 1 53 53 ALA HB2 H 1 0.542 0.04 . 1 . . . . 52 ALA HB . 18917 1 338 . 1 1 53 53 ALA HB3 H 1 0.542 0.04 . 1 . . . . 52 ALA HB . 18917 1 339 . 1 1 53 53 ALA C C 13 178.538 0.40 . 1 . . . . 52 ALA C . 18917 1 340 . 1 1 53 53 ALA CA C 13 54.040 0.40 . 1 . . . . 52 ALA CA . 18917 1 341 . 1 1 53 53 ALA CB C 13 17.459 0.40 . 1 . . . . 52 ALA CB . 18917 1 342 . 1 1 53 53 ALA N N 15 124.625 0.40 . 1 . . . . 52 ALA N . 18917 1 343 . 1 1 54 54 VAL H H 1 7.969 0.04 . 1 . . . . 53 VAL H . 18917 1 344 . 1 1 54 54 VAL HA H 1 3.091 0.04 . 1 . . . . 53 VAL HA . 18917 1 345 . 1 1 54 54 VAL HB H 1 1.920 0.04 . 1 . . . . 53 VAL HB . 18917 1 346 . 1 1 54 54 VAL HG11 H 1 0.865 0.04 . 2 . . . . 53 VAL HG1 . 18917 1 347 . 1 1 54 54 VAL HG12 H 1 0.865 0.04 . 2 . . . . 53 VAL HG1 . 18917 1 348 . 1 1 54 54 VAL HG13 H 1 0.865 0.04 . 2 . . . . 53 VAL HG1 . 18917 1 349 . 1 1 54 54 VAL HG21 H 1 0.933 0.04 . 2 . . . . 53 VAL HG2 . 18917 1 350 . 1 1 54 54 VAL HG22 H 1 0.933 0.04 . 2 . . . . 53 VAL HG2 . 18917 1 351 . 1 1 54 54 VAL HG23 H 1 0.933 0.04 . 2 . . . . 53 VAL HG2 . 18917 1 352 . 1 1 54 54 VAL C C 13 178.081 0.40 . 1 . . . . 53 VAL C . 18917 1 353 . 1 1 54 54 VAL CA C 13 67.040 0.40 . 1 . . . . 53 VAL CA . 18917 1 354 . 1 1 54 54 VAL CB C 13 31.204 0.40 . 1 . . . . 53 VAL CB . 18917 1 355 . 1 1 54 54 VAL CG1 C 13 22.947 0.40 . 2 . . . . 53 VAL CG1 . 18917 1 356 . 1 1 54 54 VAL CG2 C 13 21.361 0.40 . 2 . . . . 53 VAL CG2 . 18917 1 357 . 1 1 54 54 VAL N N 15 117.327 0.40 . 1 . . . . 53 VAL N . 18917 1 358 . 1 1 55 55 SER H H 1 7.768 0.04 . 1 . . . . 54 SER H . 18917 1 359 . 1 1 55 55 SER HA H 1 4.059 0.04 . 1 . . . . 54 SER HA . 18917 1 360 . 1 1 55 55 SER HB2 H 1 3.886 0.04 . 2 . . . . 54 SER HB2 . 18917 1 361 . 1 1 55 55 SER HB3 H 1 3.816 0.04 . 2 . . . . 54 SER HB3 . 18917 1 362 . 1 1 55 55 SER C C 13 176.539 0.40 . 1 . . . . 54 SER C . 18917 1 363 . 1 1 55 55 SER CA C 13 61.625 0.40 . 1 . . . . 54 SER CA . 18917 1 364 . 1 1 55 55 SER CB C 13 62.402 0.40 . 1 . . . . 54 SER CB . 18917 1 365 . 1 1 55 55 SER N N 15 115.334 0.40 . 1 . . . . 54 SER N . 18917 1 366 . 1 1 56 56 ALA H H 1 7.195 0.04 . 1 . . . . 55 ALA H . 18917 1 367 . 1 1 56 56 ALA HA H 1 3.973 0.04 . 1 . . . . 55 ALA HA . 18917 1 368 . 1 1 56 56 ALA HB1 H 1 1.369 0.04 . 1 . . . . 55 ALA HB . 18917 1 369 . 1 1 56 56 ALA HB2 H 1 1.369 0.04 . 1 . . . . 55 ALA HB . 18917 1 370 . 1 1 56 56 ALA HB3 H 1 1.369 0.04 . 1 . . . . 55 ALA HB . 18917 1 371 . 1 1 56 56 ALA C C 13 180.700 0.40 . 1 . . . . 55 ALA C . 18917 1 372 . 1 1 56 56 ALA CA C 13 55.004 0.40 . 1 . . . . 55 ALA CA . 18917 1 373 . 1 1 56 56 ALA CB C 13 18.336 0.40 . 1 . . . . 55 ALA CB . 18917 1 374 . 1 1 56 56 ALA N N 15 123.563 0.40 . 1 . . . . 55 ALA N . 18917 1 375 . 1 1 57 57 VAL H H 1 7.686 0.04 . 1 . . . . 56 VAL H . 18917 1 376 . 1 1 57 57 VAL HA H 1 3.057 0.04 . 1 . . . . 56 VAL HA . 18917 1 377 . 1 1 57 57 VAL HB H 1 1.597 0.04 . 1 . . . . 56 VAL HB . 18917 1 378 . 1 1 57 57 VAL HG11 H 1 0.593 0.04 . 2 . . . . 56 VAL HG1 . 18917 1 379 . 1 1 57 57 VAL HG12 H 1 0.593 0.04 . 2 . . . . 56 VAL HG1 . 18917 1 380 . 1 1 57 57 VAL HG13 H 1 0.593 0.04 . 2 . . . . 56 VAL HG1 . 18917 1 381 . 1 1 57 57 VAL HG21 H 1 -0.064 0.04 . 2 . . . . 56 VAL HG2 . 18917 1 382 . 1 1 57 57 VAL HG22 H 1 -0.064 0.04 . 2 . . . . 56 VAL HG2 . 18917 1 383 . 1 1 57 57 VAL HG23 H 1 -0.064 0.04 . 2 . . . . 56 VAL HG2 . 18917 1 384 . 1 1 57 57 VAL C C 13 176.088 0.40 . 1 . . . . 56 VAL C . 18917 1 385 . 1 1 57 57 VAL CA C 13 65.917 0.40 . 1 . . . . 56 VAL CA . 18917 1 386 . 1 1 57 57 VAL CB C 13 30.315 0.40 . 1 . . . . 56 VAL CB . 18917 1 387 . 1 1 57 57 VAL CG1 C 13 23.168 0.40 . 2 . . . . 56 VAL CG1 . 18917 1 388 . 1 1 57 57 VAL CG2 C 13 22.151 0.40 . 2 . . . . 56 VAL CG2 . 18917 1 389 . 1 1 57 57 VAL N N 15 120.853 0.40 . 1 . . . . 56 VAL N . 18917 1 390 . 1 1 58 58 SER H H 1 7.738 0.04 . 1 . . . . 57 SER H . 18917 1 391 . 1 1 58 58 SER HA H 1 3.169 0.04 . 1 . . . . 57 SER HA . 18917 1 392 . 1 1 58 58 SER HB2 H 1 4.023 0.04 . 2 . . . . 57 SER HB2 . 18917 1 393 . 1 1 58 58 SER HB3 H 1 3.748 0.04 . 2 . . . . 57 SER HB3 . 18917 1 394 . 1 1 58 58 SER C C 13 176.321 0.40 . 1 . . . . 57 SER C . 18917 1 395 . 1 1 58 58 SER CA C 13 60.743 0.40 . 1 . . . . 57 SER CA . 18917 1 396 . 1 1 58 58 SER CB C 13 63.101 0.40 . 1 . . . . 57 SER CB . 18917 1 397 . 1 1 58 58 SER N N 15 113.822 0.40 . 1 . . . . 57 SER N . 18917 1 398 . 1 1 59 59 ARG H H 1 7.576 0.04 . 1 . . . . 58 ARG H . 18917 1 399 . 1 1 59 59 ARG HA H 1 4.018 0.04 . 1 . . . . 58 ARG HA . 18917 1 400 . 1 1 59 59 ARG HB2 H 1 1.800 0.04 . 2 . . . . 58 ARG HB2 . 18917 1 401 . 1 1 59 59 ARG HB3 H 1 1.769 0.04 . 2 . . . . 58 ARG HB3 . 18917 1 402 . 1 1 59 59 ARG HG2 H 1 1.744 0.04 . 2 . . . . 58 ARG HG2 . 18917 1 403 . 1 1 59 59 ARG HG3 H 1 1.527 0.04 . 2 . . . . 58 ARG HG3 . 18917 1 404 . 1 1 59 59 ARG HD2 H 1 3.192 0.04 . 2 . . . . 58 ARG HD2 . 18917 1 405 . 1 1 59 59 ARG HD3 H 1 3.130 0.04 . 2 . . . . 58 ARG HD3 . 18917 1 406 . 1 1 59 59 ARG C C 13 178.921 0.40 . 1 . . . . 58 ARG C . 18917 1 407 . 1 1 59 59 ARG CA C 13 59.084 0.40 . 1 . . . . 58 ARG CA . 18917 1 408 . 1 1 59 59 ARG CB C 13 30.055 0.40 . 1 . . . . 58 ARG CB . 18917 1 409 . 1 1 59 59 ARG CG C 13 27.511 0.40 . 1 . . . . 58 ARG CG . 18917 1 410 . 1 1 59 59 ARG CD C 13 43.309 0.40 . 1 . . . . 58 ARG CD . 18917 1 411 . 1 1 59 59 ARG N N 15 116.993 0.40 . 1 . . . . 58 ARG N . 18917 1 412 . 1 1 60 60 ARG H H 1 7.570 0.04 . 1 . . . . 59 ARG H . 18917 1 413 . 1 1 60 60 ARG HA H 1 4.090 0.04 . 1 . . . . 59 ARG HA . 18917 1 414 . 1 1 60 60 ARG HB2 H 1 1.739 0.04 . 2 . . . . 59 ARG HB2 . 18917 1 415 . 1 1 60 60 ARG HB3 H 1 1.701 0.04 . 2 . . . . 59 ARG HB3 . 18917 1 416 . 1 1 60 60 ARG HG2 H 1 1.582 0.04 . 2 . . . . 59 ARG HG2 . 18917 1 417 . 1 1 60 60 ARG HG3 H 1 1.363 0.04 . 2 . . . . 59 ARG HG3 . 18917 1 418 . 1 1 60 60 ARG HD2 H 1 3.357 0.04 . 2 . . . . 59 ARG HD2 . 18917 1 419 . 1 1 60 60 ARG HD3 H 1 3.113 0.04 . 2 . . . . 59 ARG HD3 . 18917 1 420 . 1 1 60 60 ARG C C 13 177.979 0.40 . 1 . . . . 59 ARG C . 18917 1 421 . 1 1 60 60 ARG CA C 13 57.444 0.40 . 1 . . . . 59 ARG CA . 18917 1 422 . 1 1 60 60 ARG CB C 13 28.379 0.40 . 1 . . . . 59 ARG CB . 18917 1 423 . 1 1 60 60 ARG CG C 13 27.044 0.40 . 1 . . . . 59 ARG CG . 18917 1 424 . 1 1 60 60 ARG CD C 13 41.683 0.40 . 1 . . . . 59 ARG CD . 18917 1 425 . 1 1 60 60 ARG N N 15 120.229 0.40 . 1 . . . . 59 ARG N . 18917 1 426 . 1 1 61 61 ALA H H 1 8.696 0.04 . 1 . . . . 60 ALA H . 18917 1 427 . 1 1 61 61 ALA HA H 1 3.671 0.04 . 1 . . . . 60 ALA HA . 18917 1 428 . 1 1 61 61 ALA HB1 H 1 1.137 0.04 . 1 . . . . 60 ALA HB . 18917 1 429 . 1 1 61 61 ALA HB2 H 1 1.137 0.04 . 1 . . . . 60 ALA HB . 18917 1 430 . 1 1 61 61 ALA HB3 H 1 1.137 0.04 . 1 . . . . 60 ALA HB . 18917 1 431 . 1 1 61 61 ALA C C 13 179.172 0.40 . 1 . . . . 60 ALA C . 18917 1 432 . 1 1 61 61 ALA CA C 13 55.524 0.40 . 1 . . . . 60 ALA CA . 18917 1 433 . 1 1 61 61 ALA CB C 13 16.703 0.40 . 1 . . . . 60 ALA CB . 18917 1 434 . 1 1 61 61 ALA N N 15 121.756 0.40 . 1 . . . . 60 ALA N . 18917 1 435 . 1 1 62 62 ASP H H 1 8.137 0.04 . 1 . . . . 61 ASP H . 18917 1 436 . 1 1 62 62 ASP HA H 1 4.385 0.04 . 1 . . . . 61 ASP HA . 18917 1 437 . 1 1 62 62 ASP HB2 H 1 3.003 0.04 . 2 . . . . 61 ASP HB2 . 18917 1 438 . 1 1 62 62 ASP HB3 H 1 2.673 0.04 . 2 . . . . 61 ASP HB3 . 18917 1 439 . 1 1 62 62 ASP C C 13 180.565 0.40 . 1 . . . . 61 ASP C . 18917 1 440 . 1 1 62 62 ASP CA C 13 57.523 0.40 . 1 . . . . 61 ASP CA . 18917 1 441 . 1 1 62 62 ASP CB C 13 39.649 0.40 . 1 . . . . 61 ASP CB . 18917 1 442 . 1 1 62 62 ASP N N 15 118.500 0.40 . 1 . . . . 61 ASP N . 18917 1 443 . 1 1 63 63 GLU H H 1 8.024 0.04 . 1 . . . . 62 GLU H . 18917 1 444 . 1 1 63 63 GLU HA H 1 3.952 0.04 . 1 . . . . 62 GLU HA . 18917 1 445 . 1 1 63 63 GLU HB2 H 1 2.059 0.04 . 2 . . . . 62 GLU HB2 . 18917 1 446 . 1 1 63 63 GLU HB3 H 1 2.297 0.04 . 2 . . . . 62 GLU HB3 . 18917 1 447 . 1 1 63 63 GLU HG2 H 1 2.479 0.04 . 2 . . . . 62 GLU HG2 . 18917 1 448 . 1 1 63 63 GLU HG3 H 1 2.250 0.04 . 2 . . . . 62 GLU HG3 . 18917 1 449 . 1 1 63 63 GLU C C 13 178.554 0.40 . 1 . . . . 62 GLU C . 18917 1 450 . 1 1 63 63 GLU CA C 13 59.099 0.40 . 1 . . . . 62 GLU CA . 18917 1 451 . 1 1 63 63 GLU CB C 13 29.473 0.40 . 1 . . . . 62 GLU CB . 18917 1 452 . 1 1 63 63 GLU CG C 13 36.337 0.40 . 1 . . . . 62 GLU CG . 18917 1 453 . 1 1 63 63 GLU N N 15 122.101 0.40 . 1 . . . . 62 GLU N . 18917 1 454 . 1 1 64 64 GLU H H 1 7.834 0.04 . 1 . . . . 63 GLU H . 18917 1 455 . 1 1 64 64 GLU HA H 1 4.344 0.04 . 1 . . . . 63 GLU HA . 18917 1 456 . 1 1 64 64 GLU HB2 H 1 1.877 0.04 . 2 . . . . 63 GLU HB2 . 18917 1 457 . 1 1 64 64 GLU HB3 H 1 2.392 0.04 . 2 . . . . 63 GLU HB3 . 18917 1 458 . 1 1 64 64 GLU HG2 H 1 2.384 0.04 . 2 . . . . 63 GLU HG2 . 18917 1 459 . 1 1 64 64 GLU HG3 H 1 2.190 0.04 . 2 . . . . 63 GLU HG3 . 18917 1 460 . 1 1 64 64 GLU C C 13 176.266 0.40 . 1 . . . . 63 GLU C . 18917 1 461 . 1 1 64 64 GLU CA C 13 55.750 0.40 . 1 . . . . 63 GLU CA . 18917 1 462 . 1 1 64 64 GLU CB C 13 29.418 0.40 . 1 . . . . 63 GLU CB . 18917 1 463 . 1 1 64 64 GLU CG C 13 35.765 0.40 . 1 . . . . 63 GLU CG . 18917 1 464 . 1 1 64 64 GLU N N 15 116.090 0.40 . 1 . . . . 63 GLU N . 18917 1 465 . 1 1 65 65 GLY H H 1 7.934 0.04 . 1 . . . . 64 GLY H . 18917 1 466 . 1 1 65 65 GLY HA2 H 1 4.041 0.04 . 2 . . . . 64 GLY HA2 . 18917 1 467 . 1 1 65 65 GLY HA3 H 1 3.764 0.04 . 2 . . . . 64 GLY HA3 . 18917 1 468 . 1 1 65 65 GLY C C 13 174.442 0.40 . 1 . . . . 64 GLY C . 18917 1 469 . 1 1 65 65 GLY CA C 13 45.605 0.40 . 1 . . . . 64 GLY CA . 18917 1 470 . 1 1 65 65 GLY N N 15 108.817 0.40 . 1 . . . . 64 GLY N . 18917 1 471 . 1 1 66 66 ALA H H 1 8.271 0.04 . 1 . . . . 65 ALA H . 18917 1 472 . 1 1 66 66 ALA HA H 1 4.380 0.04 . 1 . . . . 65 ALA HA . 18917 1 473 . 1 1 66 66 ALA HB1 H 1 1.615 0.04 . 1 . . . . 65 ALA HB . 18917 1 474 . 1 1 66 66 ALA HB2 H 1 1.615 0.04 . 1 . . . . 65 ALA HB . 18917 1 475 . 1 1 66 66 ALA HB3 H 1 1.615 0.04 . 1 . . . . 65 ALA HB . 18917 1 476 . 1 1 66 66 ALA C C 13 176.492 0.40 . 1 . . . . 65 ALA C . 18917 1 477 . 1 1 66 66 ALA CA C 13 52.121 0.40 . 1 . . . . 65 ALA CA . 18917 1 478 . 1 1 66 66 ALA CB C 13 20.247 0.40 . 1 . . . . 65 ALA CB . 18917 1 479 . 1 1 66 66 ALA N N 15 123.776 0.40 . 1 . . . . 65 ALA N . 18917 1 480 . 1 1 67 67 ALA H H 1 8.464 0.04 . 1 . . . . 66 ALA H . 18917 1 481 . 1 1 67 67 ALA HA H 1 4.412 0.04 . 1 . . . . 66 ALA HA . 18917 1 482 . 1 1 67 67 ALA HB1 H 1 1.426 0.04 . 1 . . . . 66 ALA HB . 18917 1 483 . 1 1 67 67 ALA HB2 H 1 1.426 0.04 . 1 . . . . 66 ALA HB . 18917 1 484 . 1 1 67 67 ALA HB3 H 1 1.426 0.04 . 1 . . . . 66 ALA HB . 18917 1 485 . 1 1 67 67 ALA C C 13 179.038 0.40 . 1 . . . . 66 ALA C . 18917 1 486 . 1 1 67 67 ALA CA C 13 53.490 0.40 . 1 . . . . 66 ALA CA . 18917 1 487 . 1 1 67 67 ALA CB C 13 20.555 0.40 . 1 . . . . 66 ALA CB . 18917 1 488 . 1 1 67 67 ALA N N 15 122.824 0.40 . 1 . . . . 66 ALA N . 18917 1 489 . 1 1 68 68 SER H H 1 8.034 0.04 . 1 . . . . 67 SER H . 18917 1 490 . 1 1 68 68 SER HA H 1 5.646 0.04 . 1 . . . . 67 SER HA . 18917 1 491 . 1 1 68 68 SER HB2 H 1 3.725 0.04 . 2 . . . . 67 SER HB2 . 18917 1 492 . 1 1 68 68 SER HB3 H 1 3.401 0.04 . 2 . . . . 67 SER HB3 . 18917 1 493 . 1 1 68 68 SER C C 13 172.183 0.40 . 1 . . . . 67 SER C . 18917 1 494 . 1 1 68 68 SER CA C 13 56.725 0.40 . 1 . . . . 67 SER CA . 18917 1 495 . 1 1 68 68 SER CB C 13 66.381 0.40 . 1 . . . . 67 SER CB . 18917 1 496 . 1 1 68 68 SER N N 15 109.756 0.40 . 1 . . . . 67 SER N . 18917 1 497 . 1 1 69 69 PHE H H 1 8.534 0.04 . 1 . . . . 68 PHE H . 18917 1 498 . 1 1 69 69 PHE HA H 1 6.023 0.04 . 1 . . . . 68 PHE HA . 18917 1 499 . 1 1 69 69 PHE HB2 H 1 2.786 0.04 . 2 . . . . 68 PHE HB2 . 18917 1 500 . 1 1 69 69 PHE HB3 H 1 2.658 0.04 . 2 . . . . 68 PHE HB3 . 18917 1 501 . 1 1 69 69 PHE HD1 H 1 6.584 0.04 . 3 . . . . 68 PHE HD1 . 18917 1 502 . 1 1 69 69 PHE HD2 H 1 6.584 0.04 . 3 . . . . 68 PHE HD2 . 18917 1 503 . 1 1 69 69 PHE HE1 H 1 6.992 0.04 . 3 . . . . 68 PHE HE1 . 18917 1 504 . 1 1 69 69 PHE HE2 H 1 6.992 0.04 . 3 . . . . 68 PHE HE2 . 18917 1 505 . 1 1 69 69 PHE HZ H 1 7.154 0.04 . 1 . . . . 68 PHE HZ . 18917 1 506 . 1 1 69 69 PHE C C 13 171.221 0.40 . 1 . . . . 68 PHE C . 18917 1 507 . 1 1 69 69 PHE CA C 13 55.671 0.40 . 1 . . . . 68 PHE CA . 18917 1 508 . 1 1 69 69 PHE CB C 13 42.915 0.40 . 1 . . . . 68 PHE CB . 18917 1 509 . 1 1 69 69 PHE CD1 C 13 131.481 0.40 . 3 . . . . 68 PHE CD1 . 18917 1 510 . 1 1 69 69 PHE CE1 C 13 131.689 0.40 . 3 . . . . 68 PHE CE1 . 18917 1 511 . 1 1 69 69 PHE CZ C 13 131.470 0.40 . 1 . . . . 68 PHE CZ . 18917 1 512 . 1 1 69 69 PHE N N 15 116.125 0.40 . 1 . . . . 68 PHE N . 18917 1 513 . 1 1 70 70 TYR H H 1 9.297 0.04 . 1 . . . . 69 TYR H . 18917 1 514 . 1 1 70 70 TYR HA H 1 4.764 0.04 . 1 . . . . 69 TYR HA . 18917 1 515 . 1 1 70 70 TYR HB2 H 1 3.053 0.04 . 2 . . . . 69 TYR HB2 . 18917 1 516 . 1 1 70 70 TYR HB3 H 1 2.794 0.04 . 2 . . . . 69 TYR HB3 . 18917 1 517 . 1 1 70 70 TYR HD1 H 1 6.983 0.04 . 3 . . . . 69 TYR HD1 . 18917 1 518 . 1 1 70 70 TYR HD2 H 1 6.983 0.04 . 3 . . . . 69 TYR HD2 . 18917 1 519 . 1 1 70 70 TYR HE1 H 1 6.539 0.04 . 3 . . . . 69 TYR HE1 . 18917 1 520 . 1 1 70 70 TYR HE2 H 1 6.539 0.04 . 3 . . . . 69 TYR HE2 . 18917 1 521 . 1 1 70 70 TYR C C 13 174.446 0.40 . 1 . . . . 69 TYR C . 18917 1 522 . 1 1 70 70 TYR CA C 13 57.026 0.40 . 1 . . . . 69 TYR CA . 18917 1 523 . 1 1 70 70 TYR CB C 13 43.495 0.40 . 1 . . . . 69 TYR CB . 18917 1 524 . 1 1 70 70 TYR CD1 C 13 133.572 0.40 . 3 . . . . 69 TYR CD1 . 18917 1 525 . 1 1 70 70 TYR CE1 C 13 118.228 0.40 . 3 . . . . 69 TYR CE1 . 18917 1 526 . 1 1 70 70 TYR N N 15 120.475 0.40 . 1 . . . . 69 TYR N . 18917 1 527 . 1 1 71 71 VAL H H 1 8.700 0.04 . 1 . . . . 70 VAL H . 18917 1 528 . 1 1 71 71 VAL HA H 1 3.725 0.04 . 1 . . . . 70 VAL HA . 18917 1 529 . 1 1 71 71 VAL HB H 1 1.869 0.04 . 1 . . . . 70 VAL HB . 18917 1 530 . 1 1 71 71 VAL HG11 H 1 0.884 0.04 . 2 . . . . 70 VAL HG1 . 18917 1 531 . 1 1 71 71 VAL HG12 H 1 0.884 0.04 . 2 . . . . 70 VAL HG1 . 18917 1 532 . 1 1 71 71 VAL HG13 H 1 0.884 0.04 . 2 . . . . 70 VAL HG1 . 18917 1 533 . 1 1 71 71 VAL HG21 H 1 0.640 0.04 . 2 . . . . 70 VAL HG2 . 18917 1 534 . 1 1 71 71 VAL HG22 H 1 0.640 0.04 . 2 . . . . 70 VAL HG2 . 18917 1 535 . 1 1 71 71 VAL HG23 H 1 0.640 0.04 . 2 . . . . 70 VAL HG2 . 18917 1 536 . 1 1 71 71 VAL C C 13 174.122 0.40 . 1 . . . . 70 VAL C . 18917 1 537 . 1 1 71 71 VAL CA C 13 64.325 0.40 . 1 . . . . 70 VAL CA . 18917 1 538 . 1 1 71 71 VAL CB C 13 30.659 0.40 . 1 . . . . 70 VAL CB . 18917 1 539 . 1 1 71 71 VAL CG1 C 13 22.315 0.40 . 2 . . . . 70 VAL CG1 . 18917 1 540 . 1 1 71 71 VAL CG2 C 13 21.802 0.40 . 2 . . . . 70 VAL CG2 . 18917 1 541 . 1 1 71 71 VAL N N 15 129.114 0.40 . 1 . . . . 70 VAL N . 18917 1 542 . 1 1 72 72 VAL H H 1 8.616 0.04 . 1 . . . . 71 VAL H . 18917 1 543 . 1 1 72 72 VAL HA H 1 3.801 0.04 . 1 . . . . 71 VAL HA . 18917 1 544 . 1 1 72 72 VAL HB H 1 1.711 0.04 . 1 . . . . 71 VAL HB . 18917 1 545 . 1 1 72 72 VAL HG11 H 1 0.850 0.04 . 2 . . . . 71 VAL HG1 . 18917 1 546 . 1 1 72 72 VAL HG12 H 1 0.850 0.04 . 2 . . . . 71 VAL HG1 . 18917 1 547 . 1 1 72 72 VAL HG13 H 1 0.850 0.04 . 2 . . . . 71 VAL HG1 . 18917 1 548 . 1 1 72 72 VAL C C 13 176.347 0.40 . 1 . . . . 71 VAL C . 18917 1 549 . 1 1 72 72 VAL CA C 13 62.922 0.40 . 1 . . . . 71 VAL CA . 18917 1 550 . 1 1 72 72 VAL CB C 13 33.335 0.40 . 1 . . . . 71 VAL CB . 18917 1 551 . 1 1 72 72 VAL CG1 C 13 21.033 0.40 . 2 . . . . 71 VAL CG1 . 18917 1 552 . 1 1 72 72 VAL N N 15 126.782 0.40 . 1 . . . . 71 VAL N . 18917 1 553 . 1 1 73 73 ASP H H 1 7.582 0.04 . 1 . . . . 72 ASP H . 18917 1 554 . 1 1 73 73 ASP HA H 1 4.762 0.04 . 1 . . . . 72 ASP HA . 18917 1 555 . 1 1 73 73 ASP HB2 H 1 2.592 0.04 . 2 . . . . 72 ASP HB2 . 18917 1 556 . 1 1 73 73 ASP HB3 H 1 2.240 0.04 . 2 . . . . 72 ASP HB3 . 18917 1 557 . 1 1 73 73 ASP C C 13 174.304 0.40 . 1 . . . . 72 ASP C . 18917 1 558 . 1 1 73 73 ASP CA C 13 54.801 0.40 . 1 . . . . 72 ASP CA . 18917 1 559 . 1 1 73 73 ASP CB C 13 45.056 0.40 . 1 . . . . 72 ASP CB . 18917 1 560 . 1 1 73 73 ASP N N 15 117.539 0.40 . 1 . . . . 72 ASP N . 18917 1 561 . 1 1 74 74 THR H H 1 8.015 0.04 . 1 . . . . 73 THR H . 18917 1 562 . 1 1 74 74 THR HA H 1 5.001 0.04 . 1 . . . . 73 THR HA . 18917 1 563 . 1 1 74 74 THR HB H 1 3.986 0.04 . 1 . . . . 73 THR HB . 18917 1 564 . 1 1 74 74 THR HG21 H 1 1.029 0.04 . 1 . . . . 73 THR HG2 . 18917 1 565 . 1 1 74 74 THR HG22 H 1 1.029 0.04 . 1 . . . . 73 THR HG2 . 18917 1 566 . 1 1 74 74 THR HG23 H 1 1.029 0.04 . 1 . . . . 73 THR HG2 . 18917 1 567 . 1 1 74 74 THR C C 13 173.416 0.40 . 1 . . . . 73 THR C . 18917 1 568 . 1 1 74 74 THR CA C 13 60.724 0.40 . 1 . . . . 73 THR CA . 18917 1 569 . 1 1 74 74 THR CB C 13 70.966 0.40 . 1 . . . . 73 THR CB . 18917 1 570 . 1 1 74 74 THR CG2 C 13 21.994 0.40 . 1 . . . . 73 THR CG2 . 18917 1 571 . 1 1 74 74 THR N N 15 116.553 0.40 . 1 . . . . 73 THR N . 18917 1 572 . 1 1 75 75 SER H H 1 8.669 0.04 . 1 . . . . 74 SER H . 18917 1 573 . 1 1 75 75 SER HA H 1 4.569 0.04 . 1 . . . . 74 SER HA . 18917 1 574 . 1 1 75 75 SER HB2 H 1 3.706 0.04 . 2 . . . . 74 SER HB2 . 18917 1 575 . 1 1 75 75 SER HB3 H 1 3.652 0.04 . 2 . . . . 74 SER HB3 . 18917 1 576 . 1 1 75 75 SER C C 13 172.077 0.40 . 1 . . . . 74 SER C . 18917 1 577 . 1 1 75 75 SER CA C 13 57.853 0.40 . 1 . . . . 74 SER CA . 18917 1 578 . 1 1 75 75 SER CB C 13 65.692 0.40 . 1 . . . . 74 SER CB . 18917 1 579 . 1 1 75 75 SER N N 15 117.369 0.40 . 1 . . . . 74 SER N . 18917 1 580 . 1 1 76 76 GLU H H 1 8.363 0.04 . 1 . . . . 75 GLU H . 18917 1 581 . 1 1 76 76 GLU HA H 1 4.028 0.04 . 1 . . . . 75 GLU HA . 18917 1 582 . 1 1 76 76 GLU HB2 H 1 1.418 0.04 . 2 . . . . 75 GLU HB2 . 18917 1 583 . 1 1 76 76 GLU HB3 H 1 0.806 0.04 . 2 . . . . 75 GLU HB3 . 18917 1 584 . 1 1 76 76 GLU HG2 H 1 1.327 0.04 . 2 . . . . 75 GLU HG2 . 18917 1 585 . 1 1 76 76 GLU HG3 H 1 1.195 0.04 . 2 . . . . 75 GLU HG3 . 18917 1 586 . 1 1 76 76 GLU C C 13 176.203 0.40 . 1 . . . . 75 GLU C . 18917 1 587 . 1 1 76 76 GLU CA C 13 55.403 0.40 . 1 . . . . 75 GLU CA . 18917 1 588 . 1 1 76 76 GLU CB C 13 30.490 0.40 . 1 . . . . 75 GLU CB . 18917 1 589 . 1 1 76 76 GLU CG C 13 35.897 0.40 . 1 . . . . 75 GLU CG . 18917 1 590 . 1 1 76 76 GLU N N 15 124.926 0.40 . 1 . . . . 75 GLU N . 18917 1 591 . 1 1 77 77 PHE H H 1 8.165 0.04 . 1 . . . . 76 PHE H . 18917 1 592 . 1 1 77 77 PHE HA H 1 4.548 0.04 . 1 . . . . 76 PHE HA . 18917 1 593 . 1 1 77 77 PHE HB2 H 1 2.818 0.04 . 2 . . . . 76 PHE HB2 . 18917 1 594 . 1 1 77 77 PHE HB3 H 1 2.722 0.04 . 2 . . . . 76 PHE HB3 . 18917 1 595 . 1 1 77 77 PHE CA C 13 56.539 0.40 . 1 . . . . 76 PHE CA . 18917 1 596 . 1 1 77 77 PHE CB C 13 39.520 0.40 . 1 . . . . 76 PHE CB . 18917 1 597 . 1 1 77 77 PHE N N 15 123.612 0.40 . 1 . . . . 76 PHE N . 18917 1 598 . 1 1 80 80 SER HA H 1 4.231 0.04 . 1 . . . . 79 SER HA . 18917 1 599 . 1 1 80 80 SER HB2 H 1 3.855 0.04 . 2 . . . . 79 SER HB2 . 18917 1 600 . 1 1 80 80 SER HB3 H 1 3.855 0.04 . 2 . . . . 79 SER HB3 . 18917 1 601 . 1 1 80 80 SER C C 13 175.491 0.40 . 1 . . . . 79 SER C . 18917 1 602 . 1 1 80 80 SER CA C 13 59.249 0.40 . 1 . . . . 79 SER CA . 18917 1 603 . 1 1 80 80 SER CB C 13 64.551 0.40 . 1 . . . . 79 SER CB . 18917 1 604 . 1 1 81 81 GLY H H 1 9.057 0.04 . 1 . . . . 80 GLY H . 18917 1 605 . 1 1 81 81 GLY HA2 H 1 4.119 0.04 . 2 . . . . 80 GLY HA2 . 18917 1 606 . 1 1 81 81 GLY HA3 H 1 3.745 0.04 . 2 . . . . 80 GLY HA3 . 18917 1 607 . 1 1 81 81 GLY C C 13 173.159 0.40 . 1 . . . . 80 GLY C . 18917 1 608 . 1 1 81 81 GLY CA C 13 45.591 0.40 . 1 . . . . 80 GLY CA . 18917 1 609 . 1 1 81 81 GLY N N 15 112.788 0.40 . 1 . . . . 80 GLY N . 18917 1 610 . 1 1 82 82 ASN H H 1 7.771 0.04 . 1 . . . . 81 ASN H . 18917 1 611 . 1 1 82 82 ASN HA H 1 5.014 0.04 . 1 . . . . 81 ASN HA . 18917 1 612 . 1 1 82 82 ASN HB2 H 1 2.513 0.04 . 2 . . . . 81 ASN HB2 . 18917 1 613 . 1 1 82 82 ASN HB3 H 1 2.413 0.04 . 2 . . . . 81 ASN HB3 . 18917 1 614 . 1 1 82 82 ASN HD21 H 1 7.021 0.04 . 2 . . . . 81 ASN HD21 . 18917 1 615 . 1 1 82 82 ASN HD22 H 1 6.674 0.04 . 2 . . . . 81 ASN HD22 . 18917 1 616 . 1 1 82 82 ASN C C 13 174.456 0.40 . 1 . . . . 81 ASN C . 18917 1 617 . 1 1 82 82 ASN CA C 13 52.749 0.40 . 1 . . . . 81 ASN CA . 18917 1 618 . 1 1 82 82 ASN CB C 13 39.791 0.40 . 1 . . . . 81 ASN CB . 18917 1 619 . 1 1 82 82 ASN N N 15 118.191 0.40 . 1 . . . . 81 ASN N . 18917 1 620 . 1 1 82 82 ASN ND2 N 15 112.184 0.40 . 1 . . . . 81 ASN ND2 . 18917 1 621 . 1 1 83 83 TRP H H 1 9.138 0.04 . 1 . . . . 82 TRP H . 18917 1 622 . 1 1 83 83 TRP HA H 1 5.224 0.04 . 1 . . . . 82 TRP HA . 18917 1 623 . 1 1 83 83 TRP HB2 H 1 3.109 0.04 . 2 . . . . 82 TRP HB2 . 18917 1 624 . 1 1 83 83 TRP HB3 H 1 3.059 0.04 . 2 . . . . 82 TRP HB3 . 18917 1 625 . 1 1 83 83 TRP HD1 H 1 7.346 0.04 . 1 . . . . 82 TRP HD1 . 18917 1 626 . 1 1 83 83 TRP HE1 H 1 9.963 0.04 . 1 . . . . 82 TRP HE1 . 18917 1 627 . 1 1 83 83 TRP HE3 H 1 7.102 0.04 . 1 . . . . 82 TRP HE3 . 18917 1 628 . 1 1 83 83 TRP HZ2 H 1 7.254 0.04 . 1 . . . . 82 TRP HZ2 . 18917 1 629 . 1 1 83 83 TRP HZ3 H 1 6.758 0.04 . 1 . . . . 82 TRP HZ3 . 18917 1 630 . 1 1 83 83 TRP HH2 H 1 6.957 0.04 . 1 . . . . 82 TRP HH2 . 18917 1 631 . 1 1 83 83 TRP C C 13 175.336 0.40 . 1 . . . . 82 TRP C . 18917 1 632 . 1 1 83 83 TRP CA C 13 56.205 0.40 . 1 . . . . 82 TRP CA . 18917 1 633 . 1 1 83 83 TRP CB C 13 32.840 0.40 . 1 . . . . 82 TRP CB . 18917 1 634 . 1 1 83 83 TRP CD1 C 13 126.023 0.40 . 1 . . . . 82 TRP CD1 . 18917 1 635 . 1 1 83 83 TRP CE3 C 13 119.446 0.40 . 1 . . . . 82 TRP CE3 . 18917 1 636 . 1 1 83 83 TRP CZ2 C 13 114.547 0.40 . 1 . . . . 82 TRP CZ2 . 18917 1 637 . 1 1 83 83 TRP CZ3 C 13 121.043 0.40 . 1 . . . . 82 TRP CZ3 . 18917 1 638 . 1 1 83 83 TRP CH2 C 13 124.292 0.40 . 1 . . . . 82 TRP CH2 . 18917 1 639 . 1 1 83 83 TRP N N 15 121.855 0.40 . 1 . . . . 82 TRP N . 18917 1 640 . 1 1 83 83 TRP NE1 N 15 129.477 0.40 . 1 . . . . 82 TRP NE1 . 18917 1 641 . 1 1 84 84 ARG H H 1 9.080 0.04 . 1 . . . . 83 ARG H . 18917 1 642 . 1 1 84 84 ARG HA H 1 5.163 0.04 . 1 . . . . 83 ARG HA . 18917 1 643 . 1 1 84 84 ARG HB2 H 1 1.645 0.04 . 2 . . . . 83 ARG HB2 . 18917 1 644 . 1 1 84 84 ARG HB3 H 1 1.416 0.04 . 2 . . . . 83 ARG HB3 . 18917 1 645 . 1 1 84 84 ARG HG2 H 1 1.269 0.04 . 2 . . . . 83 ARG HG2 . 18917 1 646 . 1 1 84 84 ARG HG3 H 1 1.132 0.04 . 2 . . . . 83 ARG HG3 . 18917 1 647 . 1 1 84 84 ARG HD2 H 1 2.840 0.04 . 2 . . . . 83 ARG HD2 . 18917 1 648 . 1 1 84 84 ARG HD3 H 1 2.840 0.04 . 2 . . . . 83 ARG HD3 . 18917 1 649 . 1 1 84 84 ARG C C 13 175.012 0.40 . 1 . . . . 83 ARG C . 18917 1 650 . 1 1 84 84 ARG CA C 13 55.111 0.40 . 1 . . . . 83 ARG CA . 18917 1 651 . 1 1 84 84 ARG CB C 13 32.912 0.40 . 1 . . . . 83 ARG CB . 18917 1 652 . 1 1 84 84 ARG CG C 13 27.894 0.40 . 1 . . . . 83 ARG CG . 18917 1 653 . 1 1 84 84 ARG CD C 13 43.293 0.40 . 1 . . . . 83 ARG CD . 18917 1 654 . 1 1 84 84 ARG N N 15 121.329 0.40 . 1 . . . . 83 ARG N . 18917 1 655 . 1 1 85 85 VAL H H 1 9.442 0.04 . 1 . . . . 84 VAL H . 18917 1 656 . 1 1 85 85 VAL HA H 1 4.746 0.04 . 1 . . . . 84 VAL HA . 18917 1 657 . 1 1 85 85 VAL HB H 1 1.771 0.04 . 1 . . . . 84 VAL HB . 18917 1 658 . 1 1 85 85 VAL HG11 H 1 0.857 0.04 . 2 . . . . 84 VAL HG1 . 18917 1 659 . 1 1 85 85 VAL HG12 H 1 0.857 0.04 . 2 . . . . 84 VAL HG1 . 18917 1 660 . 1 1 85 85 VAL HG13 H 1 0.857 0.04 . 2 . . . . 84 VAL HG1 . 18917 1 661 . 1 1 85 85 VAL HG21 H 1 0.703 0.04 . 2 . . . . 84 VAL HG2 . 18917 1 662 . 1 1 85 85 VAL HG22 H 1 0.703 0.04 . 2 . . . . 84 VAL HG2 . 18917 1 663 . 1 1 85 85 VAL HG23 H 1 0.703 0.04 . 2 . . . . 84 VAL HG2 . 18917 1 664 . 1 1 85 85 VAL C C 13 173.087 0.40 . 1 . . . . 84 VAL C . 18917 1 665 . 1 1 85 85 VAL CA C 13 60.910 0.40 . 1 . . . . 84 VAL CA . 18917 1 666 . 1 1 85 85 VAL CB C 13 34.156 0.40 . 1 . . . . 84 VAL CB . 18917 1 667 . 1 1 85 85 VAL CG1 C 13 20.858 0.40 . 2 . . . . 84 VAL CG1 . 18917 1 668 . 1 1 85 85 VAL CG2 C 13 21.040 0.40 . 2 . . . . 84 VAL CG2 . 18917 1 669 . 1 1 85 85 VAL N N 15 128.424 0.40 . 1 . . . . 84 VAL N . 18917 1 670 . 1 1 86 86 VAL H H 1 8.697 0.04 . 1 . . . . 85 VAL H . 18917 1 671 . 1 1 86 86 VAL HA H 1 4.742 0.04 . 1 . . . . 85 VAL HA . 18917 1 672 . 1 1 86 86 VAL HB H 1 1.786 0.04 . 1 . . . . 85 VAL HB . 18917 1 673 . 1 1 86 86 VAL HG11 H 1 0.720 0.04 . 2 . . . . 85 VAL HG1 . 18917 1 674 . 1 1 86 86 VAL HG12 H 1 0.720 0.04 . 2 . . . . 85 VAL HG1 . 18917 1 675 . 1 1 86 86 VAL HG13 H 1 0.720 0.04 . 2 . . . . 85 VAL HG1 . 18917 1 676 . 1 1 86 86 VAL C C 13 175.225 0.40 . 1 . . . . 85 VAL C . 18917 1 677 . 1 1 86 86 VAL CA C 13 60.627 0.40 . 1 . . . . 85 VAL CA . 18917 1 678 . 1 1 86 86 VAL CB C 13 33.577 0.40 . 1 . . . . 85 VAL CB . 18917 1 679 . 1 1 86 86 VAL CG1 C 13 22.037 0.40 . 2 . . . . 85 VAL CG1 . 18917 1 680 . 1 1 86 86 VAL N N 15 126.897 0.40 . 1 . . . . 85 VAL N . 18917 1 681 . 1 1 87 87 ALA H H 1 9.346 0.04 . 1 . . . . 86 ALA H . 18917 1 682 . 1 1 87 87 ALA HA H 1 5.353 0.04 . 1 . . . . 86 ALA HA . 18917 1 683 . 1 1 87 87 ALA HB1 H 1 1.071 0.04 . 1 . . . . 86 ALA HB . 18917 1 684 . 1 1 87 87 ALA HB2 H 1 1.071 0.04 . 1 . . . . 86 ALA HB . 18917 1 685 . 1 1 87 87 ALA HB3 H 1 1.071 0.04 . 1 . . . . 86 ALA HB . 18917 1 686 . 1 1 87 87 ALA C C 13 174.893 0.40 . 1 . . . . 86 ALA C . 18917 1 687 . 1 1 87 87 ALA CA C 13 50.509 0.40 . 1 . . . . 86 ALA CA . 18917 1 688 . 1 1 87 87 ALA CB C 13 23.493 0.40 . 1 . . . . 86 ALA CB . 18917 1 689 . 1 1 87 87 ALA N N 15 128.589 0.40 . 1 . . . . 86 ALA N . 18917 1 690 . 1 1 88 88 ASP H H 1 8.803 0.04 . 1 . . . . 87 ASP H . 18917 1 691 . 1 1 88 88 ASP HA H 1 5.532 0.04 . 1 . . . . 87 ASP HA . 18917 1 692 . 1 1 88 88 ASP HB2 H 1 2.593 0.04 . 2 . . . . 87 ASP HB2 . 18917 1 693 . 1 1 88 88 ASP HB3 H 1 2.138 0.04 . 2 . . . . 87 ASP HB3 . 18917 1 694 . 1 1 88 88 ASP C C 13 176.231 0.40 . 1 . . . . 87 ASP C . 18917 1 695 . 1 1 88 88 ASP CA C 13 54.220 0.40 . 1 . . . . 87 ASP CA . 18917 1 696 . 1 1 88 88 ASP CB C 13 42.819 0.40 . 1 . . . . 87 ASP CB . 18917 1 697 . 1 1 88 88 ASP N N 15 124.072 0.40 . 1 . . . . 87 ASP N . 18917 1 698 . 1 1 89 89 VAL H H 1 7.900 0.04 . 1 . . . . 88 VAL H . 18917 1 699 . 1 1 89 89 VAL HA H 1 5.172 0.04 . 1 . . . . 88 VAL HA . 18917 1 700 . 1 1 89 89 VAL HB H 1 2.049 0.04 . 1 . . . . 88 VAL HB . 18917 1 701 . 1 1 89 89 VAL HG11 H 1 0.681 0.04 . 2 . . . . 88 VAL HG1 . 18917 1 702 . 1 1 89 89 VAL HG12 H 1 0.681 0.04 . 2 . . . . 88 VAL HG1 . 18917 1 703 . 1 1 89 89 VAL HG13 H 1 0.681 0.04 . 2 . . . . 88 VAL HG1 . 18917 1 704 . 1 1 89 89 VAL HG21 H 1 0.119 0.04 . 2 . . . . 88 VAL HG2 . 18917 1 705 . 1 1 89 89 VAL HG22 H 1 0.119 0.04 . 2 . . . . 88 VAL HG2 . 18917 1 706 . 1 1 89 89 VAL HG23 H 1 0.119 0.04 . 2 . . . . 88 VAL HG2 . 18917 1 707 . 1 1 89 89 VAL C C 13 173.940 0.40 . 1 . . . . 88 VAL C . 18917 1 708 . 1 1 89 89 VAL CA C 13 59.203 0.40 . 1 . . . . 88 VAL CA . 18917 1 709 . 1 1 89 89 VAL CB C 13 34.159 0.40 . 1 . . . . 88 VAL CB . 18917 1 710 . 1 1 89 89 VAL CG1 C 13 22.363 0.40 . 2 . . . . 88 VAL CG1 . 18917 1 711 . 1 1 89 89 VAL CG2 C 13 18.509 0.40 . 2 . . . . 88 VAL CG2 . 18917 1 712 . 1 1 89 89 VAL N N 15 111.577 0.40 . 1 . . . . 88 VAL N . 18917 1 713 . 1 1 90 90 TYR H H 1 8.290 0.04 . 1 . . . . 89 TYR H . 18917 1 714 . 1 1 90 90 TYR HA H 1 4.999 0.04 . 1 . . . . 89 TYR HA . 18917 1 715 . 1 1 90 90 TYR HB2 H 1 2.917 0.04 . 2 . . . . 89 TYR HB2 . 18917 1 716 . 1 1 90 90 TYR HB3 H 1 2.844 0.04 . 2 . . . . 89 TYR HB3 . 18917 1 717 . 1 1 90 90 TYR HD1 H 1 6.701 0.04 . 3 . . . . 89 TYR HD1 . 18917 1 718 . 1 1 90 90 TYR HD2 H 1 6.701 0.04 . 3 . . . . 89 TYR HD2 . 18917 1 719 . 1 1 90 90 TYR HE1 H 1 6.348 0.04 . 3 . . . . 89 TYR HE1 . 18917 1 720 . 1 1 90 90 TYR HE2 H 1 6.348 0.04 . 3 . . . . 89 TYR HE2 . 18917 1 721 . 1 1 90 90 TYR C C 13 176.201 0.40 . 1 . . . . 89 TYR C . 18917 1 722 . 1 1 90 90 TYR CA C 13 57.535 0.40 . 1 . . . . 89 TYR CA . 18917 1 723 . 1 1 90 90 TYR CB C 13 41.235 0.40 . 1 . . . . 89 TYR CB . 18917 1 724 . 1 1 90 90 TYR CD1 C 13 133.558 0.40 . 3 . . . . 89 TYR CD1 . 18917 1 725 . 1 1 90 90 TYR CE1 C 13 117.917 0.40 . 3 . . . . 89 TYR CE1 . 18917 1 726 . 1 1 90 90 TYR N N 15 117.873 0.40 . 1 . . . . 89 TYR N . 18917 1 727 . 1 1 91 91 LYS H H 1 8.923 0.04 . 1 . . . . 90 LYS H . 18917 1 728 . 1 1 91 91 LYS HA H 1 4.519 0.04 . 1 . . . . 90 LYS HA . 18917 1 729 . 1 1 91 91 LYS HB2 H 1 1.839 0.04 . 2 . . . . 90 LYS HB2 . 18917 1 730 . 1 1 91 91 LYS HB3 H 1 1.670 0.04 . 2 . . . . 90 LYS HB3 . 18917 1 731 . 1 1 91 91 LYS HG2 H 1 1.177 0.04 . 2 . . . . 90 LYS HG2 . 18917 1 732 . 1 1 91 91 LYS HG3 H 1 1.115 0.04 . 2 . . . . 90 LYS HG3 . 18917 1 733 . 1 1 91 91 LYS HD2 H 1 1.230 0.04 . 2 . . . . 90 LYS HD2 . 18917 1 734 . 1 1 91 91 LYS HD3 H 1 0.982 0.04 . 2 . . . . 90 LYS HD3 . 18917 1 735 . 1 1 91 91 LYS HE2 H 1 2.164 0.04 . 2 . . . . 90 LYS HE2 . 18917 1 736 . 1 1 91 91 LYS HE3 H 1 2.000 0.04 . 2 . . . . 90 LYS HE3 . 18917 1 737 . 1 1 91 91 LYS C C 13 175.988 0.40 . 1 . . . . 90 LYS C . 18917 1 738 . 1 1 91 91 LYS CA C 13 55.007 0.40 . 1 . . . . 90 LYS CA . 18917 1 739 . 1 1 91 91 LYS CB C 13 34.091 0.40 . 1 . . . . 90 LYS CB . 18917 1 740 . 1 1 91 91 LYS CG C 13 24.960 0.40 . 1 . . . . 90 LYS CG . 18917 1 741 . 1 1 91 91 LYS CD C 13 28.644 0.40 . 1 . . . . 90 LYS CD . 18917 1 742 . 1 1 91 91 LYS CE C 13 41.458 0.40 . 1 . . . . 90 LYS CE . 18917 1 743 . 1 1 91 91 LYS N N 15 121.674 0.40 . 1 . . . . 90 LYS N . 18917 1 744 . 1 1 92 92 ALA H H 1 8.389 0.04 . 1 . . . . 91 ALA H . 18917 1 745 . 1 1 92 92 ALA HA H 1 4.181 0.04 . 1 . . . . 91 ALA HA . 18917 1 746 . 1 1 92 92 ALA HB1 H 1 1.263 0.04 . 1 . . . . 91 ALA HB . 18917 1 747 . 1 1 92 92 ALA HB2 H 1 1.263 0.04 . 1 . . . . 91 ALA HB . 18917 1 748 . 1 1 92 92 ALA HB3 H 1 1.263 0.04 . 1 . . . . 91 ALA HB . 18917 1 749 . 1 1 92 92 ALA CA C 13 52.206 0.40 . 1 . . . . 91 ALA CA . 18917 1 750 . 1 1 92 92 ALA CB C 13 19.205 0.40 . 1 . . . . 91 ALA CB . 18917 1 751 . 1 1 92 92 ALA N N 15 123.612 0.40 . 1 . . . . 91 ALA N . 18917 1 stop_ save_