################################### # 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 30493 _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 $chem_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 TROSY-HSQC' . . . 30493 1 2 '2D 1H-13C HSQC aliphatic' . . . 30493 1 3 '3D TROSY-HNCOCA' . . . 30493 1 4 '3D TROSY-HNCA' . . . 30493 1 5 '3D TROSY-HNCOCACB' . . . 30493 1 6 '3D TROSY-HBHACONH' . . . 30493 1 7 '3D TROSY-HNCACB' . . . 30493 1 8 '3D HCCH-TOCSY' . . . 30493 1 9 'AROMATIC CCH-TOCSY' . . . 30493 1 10 '3D CCH-TOCSY' . . . 30493 1 11 '3D 1H-13C NOESY' . . . 30493 1 12 '3D simultaneous 13C-aromatic,13C-aliphatic,15N edited 1H-1H NOESY' . . . 30493 1 13 '3D 1H-13C NOESY aromatic' . . . 30493 1 14 'X-filtered noesy (pulse sequence: noesyhsqcgpwgx13d)' . . . 30493 1 15 '3D TROSY-HNCO' . . . 30493 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 GLU H H 1 8.357 0.020 . 1 . . . . A 2 GLU H . 30493 1 2 . 1 1 2 2 GLU HA H 1 4.405 0.020 . 1 . . . . A 2 GLU HA . 30493 1 3 . 1 1 2 2 GLU CA C 13 56.699 0.400 . 1 . . . . A 2 GLU CA . 30493 1 4 . 1 1 2 2 GLU N N 15 120.606 0.400 . 1 . . . . A 2 GLU N . 30493 1 5 . 1 1 3 3 GLU H H 1 8.872 0.020 . 1 . . . . A 3 GLU H . 30493 1 6 . 1 1 3 3 GLU HA H 1 4.732 0.020 . 1 . . . . A 3 GLU HA . 30493 1 7 . 1 1 3 3 GLU HB2 H 1 2.159 0.020 . 2 . . . . A 3 GLU HB2 . 30493 1 8 . 1 1 3 3 GLU HB3 H 1 2.054 0.020 . 2 . . . . A 3 GLU HB3 . 30493 1 9 . 1 1 3 3 GLU HG2 H 1 2.388 0.020 . 2 . . . . A 3 GLU HG2 . 30493 1 10 . 1 1 3 3 GLU HG3 H 1 2.383 0.020 . 2 . . . . A 3 GLU HG3 . 30493 1 11 . 1 1 3 3 GLU CA C 13 56.710 0.400 . 1 . . . . A 3 GLU CA . 30493 1 12 . 1 1 3 3 GLU CB C 13 30.623 0.400 . 1 . . . . A 3 GLU CB . 30493 1 13 . 1 1 3 3 GLU CG C 13 36.516 0.400 . 1 . . . . A 3 GLU CG . 30493 1 14 . 1 1 3 3 GLU N N 15 124.200 0.400 . 1 . . . . A 3 GLU N . 30493 1 15 . 1 1 4 4 LEU H H 1 8.630 0.020 . 1 . . . . A 4 LEU H . 30493 1 16 . 1 1 4 4 LEU HA H 1 4.499 0.020 . 1 . . . . A 4 LEU HA . 30493 1 17 . 1 1 4 4 LEU HB2 H 1 1.804 0.020 . 2 . . . . A 4 LEU HB2 . 30493 1 18 . 1 1 4 4 LEU HB3 H 1 1.714 0.020 . 2 . . . . A 4 LEU HB3 . 30493 1 19 . 1 1 4 4 LEU HG H 1 1.759 0.020 . 1 . . . . A 4 LEU HG . 30493 1 20 . 1 1 4 4 LEU HD11 H 1 1.046 0.020 . 2 . . . . A 4 LEU HD11 . 30493 1 21 . 1 1 4 4 LEU HD12 H 1 1.046 0.020 . 2 . . . . A 4 LEU HD12 . 30493 1 22 . 1 1 4 4 LEU HD13 H 1 1.046 0.020 . 2 . . . . A 4 LEU HD13 . 30493 1 23 . 1 1 4 4 LEU HD21 H 1 0.986 0.020 . 2 . . . . A 4 LEU HD21 . 30493 1 24 . 1 1 4 4 LEU HD22 H 1 0.986 0.020 . 2 . . . . A 4 LEU HD22 . 30493 1 25 . 1 1 4 4 LEU HD23 H 1 0.986 0.020 . 2 . . . . A 4 LEU HD23 . 30493 1 26 . 1 1 4 4 LEU CA C 13 55.535 0.400 . 1 . . . . A 4 LEU CA . 30493 1 27 . 1 1 4 4 LEU CB C 13 42.328 0.400 . 1 . . . . A 4 LEU CB . 30493 1 28 . 1 1 4 4 LEU CG C 13 27.169 0.400 . 1 . . . . A 4 LEU CG . 30493 1 29 . 1 1 4 4 LEU CD1 C 13 25.237 0.400 . 1 . . . . A 4 LEU CD1 . 30493 1 30 . 1 1 4 4 LEU CD2 C 13 23.496 0.400 . 1 . . . . A 4 LEU CD2 . 30493 1 31 . 1 1 4 4 LEU N N 15 124.781 0.400 . 1 . . . . A 4 LEU N . 30493 1 32 . 1 1 5 5 SER H H 1 8.505 0.020 . 1 . . . . A 5 SER H . 30493 1 33 . 1 1 5 5 SER HA H 1 4.524 0.020 . 1 . . . . A 5 SER HA . 30493 1 34 . 1 1 5 5 SER HB2 H 1 4.021 0.020 . 2 . . . . A 5 SER HB2 . 30493 1 35 . 1 1 5 5 SER HB3 H 1 3.993 0.020 . 2 . . . . A 5 SER HB3 . 30493 1 36 . 1 1 5 5 SER CA C 13 58.824 0.400 . 1 . . . . A 5 SER CA . 30493 1 37 . 1 1 5 5 SER CB C 13 64.108 0.400 . 1 . . . . A 5 SER CB . 30493 1 38 . 1 1 5 5 SER N N 15 117.036 0.400 . 1 . . . . A 5 SER N . 30493 1 39 . 1 1 6 6 GLY H H 1 8.573 0.020 . 1 . . . . A 6 GLY H . 30493 1 40 . 1 1 6 6 GLY HA2 H 1 4.139 0.020 . 2 . . . . A 6 GLY HA2 . 30493 1 41 . 1 1 6 6 GLY HA3 H 1 4.021 0.020 . 2 . . . . A 6 GLY HA3 . 30493 1 42 . 1 1 6 6 GLY CA C 13 45.294 0.400 . 1 . . . . A 6 GLY CA . 30493 1 43 . 1 1 6 6 GLY N N 15 111.393 0.400 . 1 . . . . A 6 GLY N . 30493 1 44 . 1 1 7 7 LYS H H 1 8.149 0.020 . 1 . . . . A 7 LYS H . 30493 1 45 . 1 1 7 7 LYS HA H 1 4.737 0.020 . 1 . . . . A 7 LYS HA . 30493 1 46 . 1 1 7 7 LYS HB2 H 1 1.932 0.020 . 2 . . . . A 7 LYS HB2 . 30493 1 47 . 1 1 7 7 LYS HB3 H 1 1.843 0.020 . 2 . . . . A 7 LYS HB3 . 30493 1 48 . 1 1 7 7 LYS HG2 H 1 1.602 0.020 . 2 . . . . A 7 LYS HG2 . 30493 1 49 . 1 1 7 7 LYS HG3 H 1 1.600 0.020 . 2 . . . . A 7 LYS HG3 . 30493 1 50 . 1 1 7 7 LYS HD2 H 1 1.815 0.020 . 2 . . . . A 7 LYS HD2 . 30493 1 51 . 1 1 7 7 LYS HD3 H 1 1.808 0.020 . 2 . . . . A 7 LYS HD3 . 30493 1 52 . 1 1 7 7 LYS HE2 H 1 3.135 0.020 . 2 . . . . A 7 LYS HE2 . 30493 1 53 . 1 1 7 7 LYS HE3 H 1 3.138 0.020 . 2 . . . . A 7 LYS HE3 . 30493 1 54 . 1 1 7 7 LYS CA C 13 54.524 0.400 . 1 . . . . A 7 LYS CA . 30493 1 55 . 1 1 7 7 LYS CB C 13 32.781 0.400 . 1 . . . . A 7 LYS CB . 30493 1 56 . 1 1 7 7 LYS CG C 13 24.878 0.400 . 1 . . . . A 7 LYS CG . 30493 1 57 . 1 1 7 7 LYS CD C 13 29.445 0.400 . 1 . . . . A 7 LYS CD . 30493 1 58 . 1 1 7 7 LYS CE C 13 42.294 0.400 . 1 . . . . A 7 LYS CE . 30493 1 59 . 1 1 7 7 LYS N N 15 122.737 0.400 . 1 . . . . A 7 LYS N . 30493 1 60 . 1 1 8 8 PRO HA H 1 4.577 0.020 . 1 . . . . A 8 PRO HA . 30493 1 61 . 1 1 8 8 PRO HB2 H 1 2.399 0.020 . 2 . . . . A 8 PRO HB2 . 30493 1 62 . 1 1 8 8 PRO HB3 H 1 2.002 0.020 . 2 . . . . A 8 PRO HB3 . 30493 1 63 . 1 1 8 8 PRO HG2 H 1 2.166 0.020 . 2 . . . . A 8 PRO HG2 . 30493 1 64 . 1 1 8 8 PRO HG3 H 1 2.098 0.020 . 2 . . . . A 8 PRO HG3 . 30493 1 65 . 1 1 8 8 PRO HD2 H 1 3.980 0.020 . 2 . . . . A 8 PRO HD2 . 30493 1 66 . 1 1 8 8 PRO HD3 H 1 3.761 0.020 . 2 . . . . A 8 PRO HD3 . 30493 1 67 . 1 1 8 8 PRO CA C 13 63.217 0.400 . 1 . . . . A 8 PRO CA . 30493 1 68 . 1 1 8 8 PRO CB C 13 32.321 0.400 . 1 . . . . A 8 PRO CB . 30493 1 69 . 1 1 8 8 PRO CG C 13 27.600 0.400 . 1 . . . . A 8 PRO CG . 30493 1 70 . 1 1 8 8 PRO CD C 13 51.038 0.400 . 1 . . . . A 8 PRO CD . 30493 1 71 . 1 1 9 9 LEU H H 1 8.685 0.020 . 1 . . . . A 9 LEU H . 30493 1 72 . 1 1 9 9 LEU HA H 1 4.627 0.020 . 1 . . . . A 9 LEU HA . 30493 1 73 . 1 1 9 9 LEU HB2 H 1 1.668 0.020 . 2 . . . . A 9 LEU HB2 . 30493 1 74 . 1 1 9 9 LEU HB3 H 1 1.653 0.020 . 2 . . . . A 9 LEU HB3 . 30493 1 75 . 1 1 9 9 LEU HG H 1 1.862 0.020 . 1 . . . . A 9 LEU HG . 30493 1 76 . 1 1 9 9 LEU HD11 H 1 0.951 0.020 . 2 . . . . A 9 LEU HD11 . 30493 1 77 . 1 1 9 9 LEU HD12 H 1 0.951 0.020 . 2 . . . . A 9 LEU HD12 . 30493 1 78 . 1 1 9 9 LEU HD13 H 1 0.951 0.020 . 2 . . . . A 9 LEU HD13 . 30493 1 79 . 1 1 9 9 LEU HD21 H 1 0.945 0.020 . 2 . . . . A 9 LEU HD21 . 30493 1 80 . 1 1 9 9 LEU HD22 H 1 0.945 0.020 . 2 . . . . A 9 LEU HD22 . 30493 1 81 . 1 1 9 9 LEU HD23 H 1 0.945 0.020 . 2 . . . . A 9 LEU HD23 . 30493 1 82 . 1 1 9 9 LEU CA C 13 54.645 0.400 . 1 . . . . A 9 LEU CA . 30493 1 83 . 1 1 9 9 LEU CB C 13 44.155 0.400 . 1 . . . . A 9 LEU CB . 30493 1 84 . 1 1 9 9 LEU CG C 13 27.430 0.400 . 1 . . . . A 9 LEU CG . 30493 1 85 . 1 1 9 9 LEU CD1 C 13 24.102 0.400 . 1 . . . . A 9 LEU CD1 . 30493 1 86 . 1 1 9 9 LEU CD2 C 13 26.665 0.400 . 1 . . . . A 9 LEU CD2 . 30493 1 87 . 1 1 9 9 LEU N N 15 123.567 0.400 . 1 . . . . A 9 LEU N . 30493 1 88 . 1 1 10 10 SER H H 1 9.167 0.020 . 1 . . . . A 10 SER H . 30493 1 89 . 1 1 10 10 SER HA H 1 4.610 0.020 . 1 . . . . A 10 SER HA . 30493 1 90 . 1 1 10 10 SER HB2 H 1 4.520 0.020 . 2 . . . . A 10 SER HB2 . 30493 1 91 . 1 1 10 10 SER HB3 H 1 4.201 0.020 . 2 . . . . A 10 SER HB3 . 30493 1 92 . 1 1 10 10 SER CA C 13 57.516 0.400 . 1 . . . . A 10 SER CA . 30493 1 93 . 1 1 10 10 SER CB C 13 65.670 0.400 . 1 . . . . A 10 SER CB . 30493 1 94 . 1 1 10 10 SER N N 15 120.486 0.400 . 1 . . . . A 10 SER N . 30493 1 95 . 1 1 11 11 TYR H H 1 9.116 0.020 . 1 . . . . A 11 TYR H . 30493 1 96 . 1 1 11 11 TYR HA H 1 4.218 0.020 . 1 . . . . A 11 TYR HA . 30493 1 97 . 1 1 11 11 TYR HB2 H 1 3.370 0.020 . 2 . . . . A 11 TYR HB2 . 30493 1 98 . 1 1 11 11 TYR HB3 H 1 3.176 0.020 . 2 . . . . A 11 TYR HB3 . 30493 1 99 . 1 1 11 11 TYR HD1 H 1 7.276 0.020 . 1 . . . . A 11 TYR HD1 . 30493 1 100 . 1 1 11 11 TYR HD2 H 1 7.276 0.020 . 1 . . . . A 11 TYR HD2 . 30493 1 101 . 1 1 11 11 TYR HE1 H 1 6.950 0.020 . 1 . . . . A 11 TYR HE1 . 30493 1 102 . 1 1 11 11 TYR HE2 H 1 6.950 0.020 . 1 . . . . A 11 TYR HE2 . 30493 1 103 . 1 1 11 11 TYR CA C 13 62.608 0.400 . 1 . . . . A 11 TYR CA . 30493 1 104 . 1 1 11 11 TYR CB C 13 38.226 0.400 . 1 . . . . A 11 TYR CB . 30493 1 105 . 1 1 11 11 TYR CD1 C 13 134.904 0.400 . 1 . . . . A 11 TYR CD1 . 30493 1 106 . 1 1 11 11 TYR CD2 C 13 134.904 0.400 . 1 . . . . A 11 TYR CD2 . 30493 1 107 . 1 1 11 11 TYR CE1 C 13 120.143 0.400 . 1 . . . . A 11 TYR CE1 . 30493 1 108 . 1 1 11 11 TYR CE2 C 13 120.143 0.400 . 1 . . . . A 11 TYR CE2 . 30493 1 109 . 1 1 11 11 TYR N N 15 123.130 0.400 . 1 . . . . A 11 TYR N . 30493 1 110 . 1 1 12 12 ALA H H 1 8.779 0.020 . 1 . . . . A 12 ALA H . 30493 1 111 . 1 1 12 12 ALA HA H 1 4.135 0.020 . 1 . . . . A 12 ALA HA . 30493 1 112 . 1 1 12 12 ALA HB1 H 1 1.577 0.020 . 1 . . . . A 12 ALA HB1 . 30493 1 113 . 1 1 12 12 ALA HB2 H 1 1.577 0.020 . 1 . . . . A 12 ALA HB2 . 30493 1 114 . 1 1 12 12 ALA HB3 H 1 1.577 0.020 . 1 . . . . A 12 ALA HB3 . 30493 1 115 . 1 1 12 12 ALA CA C 13 55.117 0.400 . 1 . . . . A 12 ALA CA . 30493 1 116 . 1 1 12 12 ALA CB C 13 18.566 0.400 . 1 . . . . A 12 ALA CB . 30493 1 117 . 1 1 12 12 ALA N N 15 120.917 0.400 . 1 . . . . A 12 ALA N . 30493 1 118 . 1 1 13 13 GLU H H 1 8.047 0.020 . 1 . . . . A 13 GLU H . 30493 1 119 . 1 1 13 13 GLU HA H 1 4.081 0.020 . 1 . . . . A 13 GLU HA . 30493 1 120 . 1 1 13 13 GLU HB2 H 1 2.095 0.020 . 1 . . . . A 13 GLU HB2 . 30493 1 121 . 1 1 13 13 GLU HG2 H 1 2.500 0.020 . 2 . . . . A 13 GLU HG2 . 30493 1 122 . 1 1 13 13 GLU HG3 H 1 2.372 0.020 . 2 . . . . A 13 GLU HG3 . 30493 1 123 . 1 1 13 13 GLU CA C 13 59.327 0.400 . 1 . . . . A 13 GLU CA . 30493 1 124 . 1 1 13 13 GLU CB C 13 30.576 0.400 . 1 . . . . A 13 GLU CB . 30493 1 125 . 1 1 13 13 GLU CG C 13 37.323 0.400 . 1 . . . . A 13 GLU CG . 30493 1 126 . 1 1 13 13 GLU N N 15 119.527 0.400 . 1 . . . . A 13 GLU N . 30493 1 127 . 1 1 14 14 LYS H H 1 8.555 0.020 . 1 . . . . A 14 LYS H . 30493 1 128 . 1 1 14 14 LYS HA H 1 3.912 0.020 . 1 . . . . A 14 LYS HA . 30493 1 129 . 1 1 14 14 LYS HB2 H 1 2.042 0.020 . 2 . . . . A 14 LYS HB2 . 30493 1 130 . 1 1 14 14 LYS HB3 H 1 1.878 0.020 . 2 . . . . A 14 LYS HB3 . 30493 1 131 . 1 1 14 14 LYS HG2 H 1 1.670 0.020 . 2 . . . . A 14 LYS HG2 . 30493 1 132 . 1 1 14 14 LYS HG3 H 1 1.316 0.020 . 2 . . . . A 14 LYS HG3 . 30493 1 133 . 1 1 14 14 LYS HD2 H 1 1.763 0.020 . 1 . . . . A 14 LYS HD2 . 30493 1 134 . 1 1 14 14 LYS HD3 H 1 1.763 0.020 . 1 . . . . A 14 LYS HD3 . 30493 1 135 . 1 1 14 14 LYS HE2 H 1 3.031 0.020 . 2 . . . . A 14 LYS HE2 . 30493 1 136 . 1 1 14 14 LYS HE3 H 1 2.952 0.020 . 2 . . . . A 14 LYS HE3 . 30493 1 137 . 1 1 14 14 LYS CA C 13 61.060 0.400 . 1 . . . . A 14 LYS CA . 30493 1 138 . 1 1 14 14 LYS CB C 13 32.276 0.400 . 1 . . . . A 14 LYS CB . 30493 1 139 . 1 1 14 14 LYS CG C 13 26.907 0.400 . 1 . . . . A 14 LYS CG . 30493 1 140 . 1 1 14 14 LYS CD C 13 29.909 0.400 . 1 . . . . A 14 LYS CD . 30493 1 141 . 1 1 14 14 LYS CE C 13 42.058 0.400 . 1 . . . . A 14 LYS CE . 30493 1 142 . 1 1 14 14 LYS N N 15 121.561 0.400 . 1 . . . . A 14 LYS N . 30493 1 143 . 1 1 15 15 GLU H H 1 8.310 0.020 . 1 . . . . A 15 GLU H . 30493 1 144 . 1 1 15 15 GLU HA H 1 3.979 0.020 . 1 . . . . A 15 GLU HA . 30493 1 145 . 1 1 15 15 GLU HB2 H 1 2.145 0.020 . 2 . . . . A 15 GLU HB2 . 30493 1 146 . 1 1 15 15 GLU HB3 H 1 2.040 0.020 . 2 . . . . A 15 GLU HB3 . 30493 1 147 . 1 1 15 15 GLU HG2 H 1 1.985 0.020 . 2 . . . . A 15 GLU HG2 . 30493 1 148 . 1 1 15 15 GLU HG3 H 1 2.165 0.020 . 2 . . . . A 15 GLU HG3 . 30493 1 149 . 1 1 15 15 GLU CA C 13 59.347 0.400 . 1 . . . . A 15 GLU CA . 30493 1 150 . 1 1 15 15 GLU CB C 13 29.487 0.400 . 1 . . . . A 15 GLU CB . 30493 1 151 . 1 1 15 15 GLU CG C 13 36.592 0.400 . 1 . . . . A 15 GLU CG . 30493 1 152 . 1 1 15 15 GLU N N 15 119.171 0.400 . 1 . . . . A 15 GLU N . 30493 1 153 . 1 1 16 16 LYS H H 1 7.899 0.020 . 1 . . . . A 16 LYS H . 30493 1 154 . 1 1 16 16 LYS HA H 1 4.230 0.020 . 1 . . . . A 16 LYS HA . 30493 1 155 . 1 1 16 16 LYS HB2 H 1 2.093 0.020 . 2 . . . . A 16 LYS HB2 . 30493 1 156 . 1 1 16 16 LYS HB3 H 1 2.022 0.020 . 2 . . . . A 16 LYS HB3 . 30493 1 157 . 1 1 16 16 LYS HG2 H 1 1.729 0.020 . 2 . . . . A 16 LYS HG2 . 30493 1 158 . 1 1 16 16 LYS HG3 H 1 1.611 0.020 . 2 . . . . A 16 LYS HG3 . 30493 1 159 . 1 1 16 16 LYS HD2 H 1 1.873 0.020 . 2 . . . . A 16 LYS HD2 . 30493 1 160 . 1 1 16 16 LYS HD3 H 1 1.879 0.020 . 2 . . . . A 16 LYS HD3 . 30493 1 161 . 1 1 16 16 LYS HE2 H 1 3.072 0.020 . 2 . . . . A 16 LYS HE2 . 30493 1 162 . 1 1 16 16 LYS HE3 H 1 3.077 0.020 . 2 . . . . A 16 LYS HE3 . 30493 1 163 . 1 1 16 16 LYS CA C 13 59.522 0.400 . 1 . . . . A 16 LYS CA . 30493 1 164 . 1 1 16 16 LYS CB C 13 32.416 0.400 . 1 . . . . A 16 LYS CB . 30493 1 165 . 1 1 16 16 LYS CG C 13 25.446 0.400 . 1 . . . . A 16 LYS CG . 30493 1 166 . 1 1 16 16 LYS CD C 13 29.520 0.400 . 1 . . . . A 16 LYS CD . 30493 1 167 . 1 1 16 16 LYS CE C 13 42.159 0.400 . 1 . . . . A 16 LYS CE . 30493 1 168 . 1 1 16 16 LYS N N 15 120.436 0.400 . 1 . . . . A 16 LYS N . 30493 1 169 . 1 1 17 17 LEU H H 1 8.074 0.020 . 1 . . . . A 17 LEU H . 30493 1 170 . 1 1 17 17 LEU HA H 1 4.232 0.020 . 1 . . . . A 17 LEU HA . 30493 1 171 . 1 1 17 17 LEU HB2 H 1 2.238 0.020 . 2 . . . . A 17 LEU HB2 . 30493 1 172 . 1 1 17 17 LEU HB3 H 1 1.843 0.020 . 2 . . . . A 17 LEU HB3 . 30493 1 173 . 1 1 17 17 LEU HG H 1 2.046 0.020 . 1 . . . . A 17 LEU HG . 30493 1 174 . 1 1 17 17 LEU HD11 H 1 1.038 0.020 . 2 . . . . A 17 LEU HD11 . 30493 1 175 . 1 1 17 17 LEU HD12 H 1 1.038 0.020 . 2 . . . . A 17 LEU HD12 . 30493 1 176 . 1 1 17 17 LEU HD13 H 1 1.038 0.020 . 2 . . . . A 17 LEU HD13 . 30493 1 177 . 1 1 17 17 LEU HD21 H 1 0.950 0.020 . 2 . . . . A 17 LEU HD21 . 30493 1 178 . 1 1 17 17 LEU HD22 H 1 0.950 0.020 . 2 . . . . A 17 LEU HD22 . 30493 1 179 . 1 1 17 17 LEU HD23 H 1 0.950 0.020 . 2 . . . . A 17 LEU HD23 . 30493 1 180 . 1 1 17 17 LEU CA C 13 58.427 0.400 . 1 . . . . A 17 LEU CA . 30493 1 181 . 1 1 17 17 LEU CB C 13 41.880 0.400 . 1 . . . . A 17 LEU CB . 30493 1 182 . 1 1 17 17 LEU CG C 13 27.290 0.400 . 1 . . . . A 17 LEU CG . 30493 1 183 . 1 1 17 17 LEU CD1 C 13 23.555 0.400 . 1 . . . . A 17 LEU CD1 . 30493 1 184 . 1 1 17 17 LEU CD2 C 13 26.697 0.400 . 1 . . . . A 17 LEU CD2 . 30493 1 185 . 1 1 17 17 LEU N N 15 121.929 0.400 . 1 . . . . A 17 LEU N . 30493 1 186 . 1 1 18 18 LYS H H 1 8.330 0.020 . 1 . . . . A 18 LYS H . 30493 1 187 . 1 1 18 18 LYS HA H 1 3.957 0.020 . 1 . . . . A 18 LYS HA . 30493 1 188 . 1 1 18 18 LYS HB2 H 1 2.043 0.020 . 1 . . . . A 18 LYS HB2 . 30493 1 189 . 1 1 18 18 LYS HG2 H 1 1.782 0.020 . 2 . . . . A 18 LYS HG2 . 30493 1 190 . 1 1 18 18 LYS HG3 H 1 1.487 0.020 . 2 . . . . A 18 LYS HG3 . 30493 1 191 . 1 1 18 18 LYS HD2 H 1 1.826 0.020 . 1 . . . . A 18 LYS HD2 . 30493 1 192 . 1 1 18 18 LYS HE2 H 1 3.046 0.020 . 1 . . . . A 18 LYS HE2 . 30493 1 193 . 1 1 18 18 LYS CA C 13 60.749 0.400 . 1 . . . . A 18 LYS CA . 30493 1 194 . 1 1 18 18 LYS CB C 13 32.145 0.400 . 1 . . . . A 18 LYS CB . 30493 1 195 . 1 1 18 18 LYS CG C 13 26.233 0.400 . 1 . . . . A 18 LYS CG . 30493 1 196 . 1 1 18 18 LYS CD C 13 30.018 0.400 . 1 . . . . A 18 LYS CD . 30493 1 197 . 1 1 18 18 LYS CE C 13 42.296 0.400 . 1 . . . . A 18 LYS CE . 30493 1 198 . 1 1 18 18 LYS N N 15 120.452 0.400 . 1 . . . . A 18 LYS N . 30493 1 199 . 1 1 19 19 GLU H H 1 8.287 0.020 . 1 . . . . A 19 GLU H . 30493 1 200 . 1 1 19 19 GLU HA H 1 4.264 0.020 . 1 . . . . A 19 GLU HA . 30493 1 201 . 1 1 19 19 GLU HB2 H 1 2.322 0.020 . 2 . . . . A 19 GLU HB2 . 30493 1 202 . 1 1 19 19 GLU HB3 H 1 2.265 0.020 . 2 . . . . A 19 GLU HB3 . 30493 1 203 . 1 1 19 19 GLU HG2 H 1 2.588 0.020 . 2 . . . . A 19 GLU HG2 . 30493 1 204 . 1 1 19 19 GLU HG3 H 1 2.373 0.020 . 2 . . . . A 19 GLU HG3 . 30493 1 205 . 1 1 19 19 GLU CA C 13 59.410 0.400 . 1 . . . . A 19 GLU CA . 30493 1 206 . 1 1 19 19 GLU CB C 13 29.853 0.400 . 1 . . . . A 19 GLU CB . 30493 1 207 . 1 1 19 19 GLU CG C 13 36.727 0.400 . 1 . . . . A 19 GLU CG . 30493 1 208 . 1 1 19 19 GLU N N 15 121.852 0.400 . 1 . . . . A 19 GLU N . 30493 1 209 . 1 1 20 20 LYS H H 1 8.202 0.020 . 1 . . . . A 20 LYS H . 30493 1 210 . 1 1 20 20 LYS HA H 1 4.492 0.020 . 1 . . . . A 20 LYS HA . 30493 1 211 . 1 1 20 20 LYS HB2 H 1 2.297 0.020 . 2 . . . . A 20 LYS HB2 . 30493 1 212 . 1 1 20 20 LYS HB3 H 1 2.126 0.020 . 2 . . . . A 20 LYS HB3 . 30493 1 213 . 1 1 20 20 LYS HG2 H 1 1.559 0.020 . 2 . . . . A 20 LYS HG2 . 30493 1 214 . 1 1 20 20 LYS HG3 H 1 1.742 0.020 . 2 . . . . A 20 LYS HG3 . 30493 1 215 . 1 1 20 20 LYS HD2 H 1 1.898 0.020 . 2 . . . . A 20 LYS HD2 . 30493 1 216 . 1 1 20 20 LYS HD3 H 1 1.863 0.020 . 2 . . . . A 20 LYS HD3 . 30493 1 217 . 1 1 20 20 LYS HE2 H 1 3.087 0.020 . 2 . . . . A 20 LYS HE2 . 30493 1 218 . 1 1 20 20 LYS HE3 H 1 3.092 0.020 . 2 . . . . A 20 LYS HE3 . 30493 1 219 . 1 1 20 20 LYS CA C 13 59.636 0.400 . 1 . . . . A 20 LYS CA . 30493 1 220 . 1 1 20 20 LYS CB C 13 32.203 0.400 . 1 . . . . A 20 LYS CB . 30493 1 221 . 1 1 20 20 LYS CG C 13 25.302 0.400 . 1 . . . . A 20 LYS CG . 30493 1 222 . 1 1 20 20 LYS CD C 13 29.885 0.400 . 1 . . . . A 20 LYS CD . 30493 1 223 . 1 1 20 20 LYS CE C 13 42.297 0.400 . 1 . . . . A 20 LYS CE . 30493 1 224 . 1 1 20 20 LYS N N 15 123.716 0.400 . 1 . . . . A 20 LYS N . 30493 1 225 . 1 1 21 21 LEU H H 1 8.560 0.020 . 1 . . . . A 21 LEU H . 30493 1 226 . 1 1 21 21 LEU HA H 1 4.104 0.020 . 1 . . . . A 21 LEU HA . 30493 1 227 . 1 1 21 21 LEU HB2 H 1 2.055 0.020 . 2 . . . . A 21 LEU HB2 . 30493 1 228 . 1 1 21 21 LEU HB3 H 1 1.713 0.020 . 2 . . . . A 21 LEU HB3 . 30493 1 229 . 1 1 21 21 LEU HG H 1 1.903 0.020 . 1 . . . . A 21 LEU HG . 30493 1 230 . 1 1 21 21 LEU HD11 H 1 0.721 0.020 . 2 . . . . A 21 LEU HD11 . 30493 1 231 . 1 1 21 21 LEU HD12 H 1 0.721 0.020 . 2 . . . . A 21 LEU HD12 . 30493 1 232 . 1 1 21 21 LEU HD13 H 1 0.721 0.020 . 2 . . . . A 21 LEU HD13 . 30493 1 233 . 1 1 21 21 LEU HD21 H 1 0.434 0.020 . 2 . . . . A 21 LEU HD21 . 30493 1 234 . 1 1 21 21 LEU HD22 H 1 0.434 0.020 . 2 . . . . A 21 LEU HD22 . 30493 1 235 . 1 1 21 21 LEU HD23 H 1 0.434 0.020 . 2 . . . . A 21 LEU HD23 . 30493 1 236 . 1 1 21 21 LEU CA C 13 59.087 0.400 . 1 . . . . A 21 LEU CA . 30493 1 237 . 1 1 21 21 LEU CB C 13 41.755 0.400 . 1 . . . . A 21 LEU CB . 30493 1 238 . 1 1 21 21 LEU CG C 13 26.644 0.400 . 1 . . . . A 21 LEU CG . 30493 1 239 . 1 1 21 21 LEU CD1 C 13 26.861 0.400 . 1 . . . . A 21 LEU CD1 . 30493 1 240 . 1 1 21 21 LEU CD2 C 13 24.635 0.400 . 1 . . . . A 21 LEU CD2 . 30493 1 241 . 1 1 21 21 LEU N N 15 119.982 0.400 . 1 . . . . A 21 LEU N . 30493 1 242 . 1 1 22 22 ALA H H 1 7.791 0.020 . 1 . . . . A 22 ALA H . 30493 1 243 . 1 1 22 22 ALA HA H 1 4.340 0.020 . 1 . . . . A 22 ALA HA . 30493 1 244 . 1 1 22 22 ALA HB1 H 1 1.726 0.020 . 1 . . . . A 22 ALA HB1 . 30493 1 245 . 1 1 22 22 ALA HB2 H 1 1.726 0.020 . 1 . . . . A 22 ALA HB2 . 30493 1 246 . 1 1 22 22 ALA HB3 H 1 1.726 0.020 . 1 . . . . A 22 ALA HB3 . 30493 1 247 . 1 1 22 22 ALA CA C 13 55.519 0.400 . 1 . . . . A 22 ALA CA . 30493 1 248 . 1 1 22 22 ALA CB C 13 18.213 0.400 . 1 . . . . A 22 ALA CB . 30493 1 249 . 1 1 22 22 ALA N N 15 120.436 0.400 . 1 . . . . A 22 ALA N . 30493 1 250 . 1 1 23 23 PHE H H 1 8.474 0.020 . 1 . . . . A 23 PHE H . 30493 1 251 . 1 1 23 23 PHE HA H 1 4.503 0.020 . 1 . . . . A 23 PHE HA . 30493 1 252 . 1 1 23 23 PHE HB2 H 1 3.556 0.020 . 1 . . . . A 23 PHE HB2 . 30493 1 253 . 1 1 23 23 PHE HB3 H 1 3.556 0.020 . 1 . . . . A 23 PHE HB3 . 30493 1 254 . 1 1 23 23 PHE HD1 H 1 7.428 0.020 . 1 . . . . A 23 PHE HD1 . 30493 1 255 . 1 1 23 23 PHE HD2 H 1 7.428 0.020 . 1 . . . . A 23 PHE HD2 . 30493 1 256 . 1 1 23 23 PHE HE1 H 1 7.492 0.020 . 1 . . . . A 23 PHE HE1 . 30493 1 257 . 1 1 23 23 PHE HE2 H 1 7.492 0.020 . 1 . . . . A 23 PHE HE2 . 30493 1 258 . 1 1 23 23 PHE HZ H 1 7.433 0.020 . 1 . . . . A 23 PHE HZ . 30493 1 259 . 1 1 23 23 PHE CA C 13 61.439 0.400 . 1 . . . . A 23 PHE CA . 30493 1 260 . 1 1 23 23 PHE CB C 13 39.175 0.400 . 1 . . . . A 23 PHE CB . 30493 1 261 . 1 1 23 23 PHE CD1 C 13 133.767 0.400 . 1 . . . . A 23 PHE CD1 . 30493 1 262 . 1 1 23 23 PHE CD2 C 13 133.767 0.400 . 1 . . . . A 23 PHE CD2 . 30493 1 263 . 1 1 23 23 PHE CE1 C 13 133.738 0.400 . 1 . . . . A 23 PHE CE1 . 30493 1 264 . 1 1 23 23 PHE CE2 C 13 133.738 0.400 . 1 . . . . A 23 PHE CE2 . 30493 1 265 . 1 1 23 23 PHE CZ C 13 131.862 0.400 . 1 . . . . A 23 PHE CZ . 30493 1 266 . 1 1 23 23 PHE N N 15 121.906 0.400 . 1 . . . . A 23 PHE N . 30493 1 267 . 1 1 24 24 LEU H H 1 9.200 0.020 . 1 . . . . A 24 LEU H . 30493 1 268 . 1 1 24 24 LEU HA H 1 3.993 0.020 . 1 . . . . A 24 LEU HA . 30493 1 269 . 1 1 24 24 LEU HB2 H 1 2.536 0.020 . 2 . . . . A 24 LEU HB2 . 30493 1 270 . 1 1 24 24 LEU HB3 H 1 1.574 0.020 . 2 . . . . A 24 LEU HB3 . 30493 1 271 . 1 1 24 24 LEU HG H 1 2.474 0.020 . 1 . . . . A 24 LEU HG . 30493 1 272 . 1 1 24 24 LEU HD11 H 1 1.237 0.020 . 2 . . . . A 24 LEU HD11 . 30493 1 273 . 1 1 24 24 LEU HD12 H 1 1.237 0.020 . 2 . . . . A 24 LEU HD12 . 30493 1 274 . 1 1 24 24 LEU HD13 H 1 1.237 0.020 . 2 . . . . A 24 LEU HD13 . 30493 1 275 . 1 1 24 24 LEU HD21 H 1 1.029 0.020 . 2 . . . . A 24 LEU HD21 . 30493 1 276 . 1 1 24 24 LEU HD22 H 1 1.029 0.020 . 2 . . . . A 24 LEU HD22 . 30493 1 277 . 1 1 24 24 LEU HD23 H 1 1.029 0.020 . 2 . . . . A 24 LEU HD23 . 30493 1 278 . 1 1 24 24 LEU CA C 13 58.269 0.400 . 1 . . . . A 24 LEU CA . 30493 1 279 . 1 1 24 24 LEU CB C 13 43.473 0.400 . 1 . . . . A 24 LEU CB . 30493 1 280 . 1 1 24 24 LEU CG C 13 26.968 0.400 . 1 . . . . A 24 LEU CG . 30493 1 281 . 1 1 24 24 LEU CD1 C 13 23.348 0.400 . 1 . . . . A 24 LEU CD1 . 30493 1 282 . 1 1 24 24 LEU CD2 C 13 26.890 0.400 . 1 . . . . A 24 LEU CD2 . 30493 1 283 . 1 1 24 24 LEU N N 15 121.381 0.400 . 1 . . . . A 24 LEU N . 30493 1 284 . 1 1 25 25 LYS H H 1 8.517 0.020 . 1 . . . . A 25 LYS H . 30493 1 285 . 1 1 25 25 LYS HA H 1 3.985 0.020 . 1 . . . . A 25 LYS HA . 30493 1 286 . 1 1 25 25 LYS HB2 H 1 2.117 0.020 . 1 . . . . A 25 LYS HB2 . 30493 1 287 . 1 1 25 25 LYS HB3 H 1 2.118 0.020 . 1 . . . . A 25 LYS HB3 . 30493 1 288 . 1 1 25 25 LYS HG2 H 1 1.495 0.020 . 2 . . . . A 25 LYS HG2 . 30493 1 289 . 1 1 25 25 LYS HG3 H 1 1.696 0.020 . 2 . . . . A 25 LYS HG3 . 30493 1 290 . 1 1 25 25 LYS HD2 H 1 1.828 0.020 . 2 . . . . A 25 LYS HD2 . 30493 1 291 . 1 1 25 25 LYS HD3 H 1 1.811 0.020 . 2 . . . . A 25 LYS HD3 . 30493 1 292 . 1 1 25 25 LYS HE2 H 1 3.052 0.020 . 1 . . . . A 25 LYS HE2 . 30493 1 293 . 1 1 25 25 LYS HE3 H 1 3.052 0.020 . 1 . . . . A 25 LYS HE3 . 30493 1 294 . 1 1 25 25 LYS CA C 13 60.576 0.400 . 1 . . . . A 25 LYS CA . 30493 1 295 . 1 1 25 25 LYS CB C 13 32.926 0.400 . 1 . . . . A 25 LYS CB . 30493 1 296 . 1 1 25 25 LYS CG C 13 25.753 0.400 . 1 . . . . A 25 LYS CG . 30493 1 297 . 1 1 25 25 LYS CD C 13 29.679 0.400 . 1 . . . . A 25 LYS CD . 30493 1 298 . 1 1 25 25 LYS CE C 13 42.282 0.400 . 1 . . . . A 25 LYS CE . 30493 1 299 . 1 1 25 25 LYS N N 15 119.630 0.400 . 1 . . . . A 25 LYS N . 30493 1 300 . 1 1 26 26 LYS H H 1 7.917 0.020 . 1 . . . . A 26 LYS H . 30493 1 301 . 1 1 26 26 LYS HA H 1 4.247 0.020 . 1 . . . . A 26 LYS HA . 30493 1 302 . 1 1 26 26 LYS HB2 H 1 2.022 0.020 . 2 . . . . A 26 LYS HB2 . 30493 1 303 . 1 1 26 26 LYS HB3 H 1 2.096 0.020 . 2 . . . . A 26 LYS HB3 . 30493 1 304 . 1 1 26 26 LYS HG2 H 1 1.739 0.020 . 2 . . . . A 26 LYS HG2 . 30493 1 305 . 1 1 26 26 LYS HG3 H 1 1.579 0.020 . 2 . . . . A 26 LYS HG3 . 30493 1 306 . 1 1 26 26 LYS HD2 H 1 1.850 0.020 . 1 . . . . A 26 LYS HD2 . 30493 1 307 . 1 1 26 26 LYS HD3 H 1 1.849 0.020 . 1 . . . . A 26 LYS HD3 . 30493 1 308 . 1 1 26 26 LYS HE2 H 1 3.098 0.020 . 1 . . . . A 26 LYS HE2 . 30493 1 309 . 1 1 26 26 LYS HE3 H 1 3.098 0.020 . 1 . . . . A 26 LYS HE3 . 30493 1 310 . 1 1 26 26 LYS CA C 13 59.718 0.400 . 1 . . . . A 26 LYS CA . 30493 1 311 . 1 1 26 26 LYS CB C 13 32.219 0.400 . 1 . . . . A 26 LYS CB . 30493 1 312 . 1 1 26 26 LYS CG C 13 25.225 0.400 . 1 . . . . A 26 LYS CG . 30493 1 313 . 1 1 26 26 LYS CD C 13 29.645 0.400 . 1 . . . . A 26 LYS CD . 30493 1 314 . 1 1 26 26 LYS CE C 13 42.206 0.400 . 1 . . . . A 26 LYS CE . 30493 1 315 . 1 1 26 26 LYS N N 15 121.758 0.400 . 1 . . . . A 26 LYS N . 30493 1 316 . 1 1 27 27 GLU H H 1 8.828 0.020 . 1 . . . . A 27 GLU H . 30493 1 317 . 1 1 27 27 GLU HA H 1 4.191 0.020 . 1 . . . . A 27 GLU HA . 30493 1 318 . 1 1 27 27 GLU HB2 H 1 1.883 0.020 . 1 . . . . A 27 GLU HB2 . 30493 1 319 . 1 1 27 27 GLU HB3 H 1 1.882 0.020 . 1 . . . . A 27 GLU HB3 . 30493 1 320 . 1 1 27 27 GLU HG2 H 1 2.115 0.020 . 2 . . . . A 27 GLU HG2 . 30493 1 321 . 1 1 27 27 GLU HG3 H 1 2.000 0.020 . 2 . . . . A 27 GLU HG3 . 30493 1 322 . 1 1 27 27 GLU CA C 13 58.807 0.400 . 1 . . . . A 27 GLU CA . 30493 1 323 . 1 1 27 27 GLU CB C 13 29.939 0.400 . 1 . . . . A 27 GLU CB . 30493 1 324 . 1 1 27 27 GLU CG C 13 36.355 0.400 . 1 . . . . A 27 GLU CG . 30493 1 325 . 1 1 27 27 GLU N N 15 121.947 0.400 . 1 . . . . A 27 GLU N . 30493 1 326 . 1 1 28 28 TYR H H 1 9.180 0.020 . 1 . . . . A 28 TYR H . 30493 1 327 . 1 1 28 28 TYR HA H 1 3.910 0.020 . 1 . . . . A 28 TYR HA . 30493 1 328 . 1 1 28 28 TYR HB2 H 1 3.367 0.020 . 2 . . . . A 28 TYR HB2 . 30493 1 329 . 1 1 28 28 TYR HB3 H 1 3.080 0.020 . 2 . . . . A 28 TYR HB3 . 30493 1 330 . 1 1 28 28 TYR HD1 H 1 7.081 0.020 . 1 . . . . A 28 TYR HD1 . 30493 1 331 . 1 1 28 28 TYR HD2 H 1 7.081 0.020 . 1 . . . . A 28 TYR HD2 . 30493 1 332 . 1 1 28 28 TYR HE1 H 1 6.916 0.020 . 1 . . . . A 28 TYR HE1 . 30493 1 333 . 1 1 28 28 TYR HE2 H 1 6.916 0.020 . 1 . . . . A 28 TYR HE2 . 30493 1 334 . 1 1 28 28 TYR CA C 13 62.913 0.400 . 1 . . . . A 28 TYR CA . 30493 1 335 . 1 1 28 28 TYR CB C 13 38.768 0.400 . 1 . . . . A 28 TYR CB . 30493 1 336 . 1 1 28 28 TYR CD1 C 13 135.022 0.400 . 1 . . . . A 28 TYR CD1 . 30493 1 337 . 1 1 28 28 TYR CD2 C 13 135.022 0.400 . 1 . . . . A 28 TYR CD2 . 30493 1 338 . 1 1 28 28 TYR CE1 C 13 120.375 0.400 . 1 . . . . A 28 TYR CE1 . 30493 1 339 . 1 1 28 28 TYR CE2 C 13 120.375 0.400 . 1 . . . . A 28 TYR CE2 . 30493 1 340 . 1 1 28 28 TYR N N 15 125.885 0.400 . 1 . . . . A 28 TYR N . 30493 1 341 . 1 1 29 29 SER H H 1 8.386 0.020 . 1 . . . . A 29 SER H . 30493 1 342 . 1 1 29 29 SER HA H 1 4.230 0.020 . 1 . . . . A 29 SER HA . 30493 1 343 . 1 1 29 29 SER CA C 13 62.841 0.400 . 1 . . . . A 29 SER CA . 30493 1 344 . 1 1 29 29 SER N N 15 115.549 0.400 . 1 . . . . A 29 SER N . 30493 1 345 . 1 1 30 30 ARG H H 1 8.458 0.020 . 1 . . . . A 30 ARG H . 30493 1 346 . 1 1 30 30 ARG HA H 1 4.221 0.020 . 1 . . . . A 30 ARG HA . 30493 1 347 . 1 1 30 30 ARG HB2 H 1 2.038 0.020 . 2 . . . . A 30 ARG HB2 . 30493 1 348 . 1 1 30 30 ARG HB3 H 1 1.971 0.020 . 2 . . . . A 30 ARG HB3 . 30493 1 349 . 1 1 30 30 ARG HG2 H 1 1.890 0.020 . 2 . . . . A 30 ARG HG2 . 30493 1 350 . 1 1 30 30 ARG HG3 H 1 1.751 0.020 . 2 . . . . A 30 ARG HG3 . 30493 1 351 . 1 1 30 30 ARG HD2 H 1 3.320 0.020 . 1 . . . . A 30 ARG HD2 . 30493 1 352 . 1 1 30 30 ARG HD3 H 1 3.321 0.020 . 1 . . . . A 30 ARG HD3 . 30493 1 353 . 1 1 30 30 ARG CA C 13 59.790 0.400 . 1 . . . . A 30 ARG CA . 30493 1 354 . 1 1 30 30 ARG CB C 13 30.905 0.400 . 1 . . . . A 30 ARG CB . 30493 1 355 . 1 1 30 30 ARG CG C 13 28.011 0.400 . 1 . . . . A 30 ARG CG . 30493 1 356 . 1 1 30 30 ARG CD C 13 43.803 0.400 . 1 . . . . A 30 ARG CD . 30493 1 357 . 1 1 30 30 ARG N N 15 122.330 0.400 . 1 . . . . A 30 ARG N . 30493 1 358 . 1 1 31 31 THR H H 1 8.127 0.020 . 1 . . . . A 31 THR H . 30493 1 359 . 1 1 31 31 THR HB H 1 3.878 0.020 . 1 . . . . A 31 THR HB . 30493 1 360 . 1 1 31 31 THR CB C 13 67.795 0.400 . 1 . . . . A 31 THR CB . 30493 1 361 . 1 1 31 31 THR N N 15 119.674 0.400 . 1 . . . . A 31 THR N . 30493 1 362 . 1 1 32 32 LEU H H 1 8.691 0.020 . 1 . . . . A 32 LEU H . 30493 1 363 . 1 1 32 32 LEU HA H 1 3.952 0.020 . 1 . . . . A 32 LEU HA . 30493 1 364 . 1 1 32 32 LEU HB2 H 1 1.776 0.020 . 2 . . . . A 32 LEU HB2 . 30493 1 365 . 1 1 32 32 LEU HB3 H 1 1.345 0.020 . 2 . . . . A 32 LEU HB3 . 30493 1 366 . 1 1 32 32 LEU HG H 1 1.524 0.020 . 1 . . . . A 32 LEU HG . 30493 1 367 . 1 1 32 32 LEU HD11 H 1 0.950 0.020 . 2 . . . . A 32 LEU HD11 . 30493 1 368 . 1 1 32 32 LEU HD12 H 1 0.950 0.020 . 2 . . . . A 32 LEU HD12 . 30493 1 369 . 1 1 32 32 LEU HD13 H 1 0.950 0.020 . 2 . . . . A 32 LEU HD13 . 30493 1 370 . 1 1 32 32 LEU HD21 H 1 0.999 0.020 . 2 . . . . A 32 LEU HD21 . 30493 1 371 . 1 1 32 32 LEU HD22 H 1 0.999 0.020 . 2 . . . . A 32 LEU HD22 . 30493 1 372 . 1 1 32 32 LEU HD23 H 1 0.999 0.020 . 2 . . . . A 32 LEU HD23 . 30493 1 373 . 1 1 32 32 LEU CA C 13 58.185 0.400 . 1 . . . . A 32 LEU CA . 30493 1 374 . 1 1 32 32 LEU CB C 13 41.913 0.400 . 1 . . . . A 32 LEU CB . 30493 1 375 . 1 1 32 32 LEU CG C 13 26.580 0.400 . 1 . . . . A 32 LEU CG . 30493 1 376 . 1 1 32 32 LEU CD1 C 13 24.092 0.400 . 1 . . . . A 32 LEU CD1 . 30493 1 377 . 1 1 32 32 LEU CD2 C 13 25.847 0.400 . 1 . . . . A 32 LEU CD2 . 30493 1 378 . 1 1 32 32 LEU N N 15 123.831 0.400 . 1 . . . . A 32 LEU N . 30493 1 379 . 1 1 33 33 ALA H H 1 8.022 0.020 . 1 . . . . A 33 ALA H . 30493 1 380 . 1 1 33 33 ALA HA H 1 4.282 0.020 . 1 . . . . A 33 ALA HA . 30493 1 381 . 1 1 33 33 ALA HB1 H 1 1.610 0.020 . 1 . . . . A 33 ALA HB1 . 30493 1 382 . 1 1 33 33 ALA HB2 H 1 1.610 0.020 . 1 . . . . A 33 ALA HB2 . 30493 1 383 . 1 1 33 33 ALA HB3 H 1 1.610 0.020 . 1 . . . . A 33 ALA HB3 . 30493 1 384 . 1 1 33 33 ALA CA C 13 55.180 0.400 . 1 . . . . A 33 ALA CA . 30493 1 385 . 1 1 33 33 ALA CB C 13 18.018 0.400 . 1 . . . . A 33 ALA CB . 30493 1 386 . 1 1 33 33 ALA N N 15 120.337 0.400 . 1 . . . . A 33 ALA N . 30493 1 387 . 1 1 34 34 ARG H H 1 7.655 0.020 . 1 . . . . A 34 ARG H . 30493 1 388 . 1 1 34 34 ARG HA H 1 4.194 0.020 . 1 . . . . A 34 ARG HA . 30493 1 389 . 1 1 34 34 ARG HB2 H 1 2.125 0.020 . 2 . . . . A 34 ARG HB2 . 30493 1 390 . 1 1 34 34 ARG HB3 H 1 2.119 0.020 . 2 . . . . A 34 ARG HB3 . 30493 1 391 . 1 1 34 34 ARG HG2 H 1 1.980 0.020 . 2 . . . . A 34 ARG HG2 . 30493 1 392 . 1 1 34 34 ARG HG3 H 1 1.810 0.020 . 2 . . . . A 34 ARG HG3 . 30493 1 393 . 1 1 34 34 ARG HD2 H 1 3.295 0.020 . 2 . . . . A 34 ARG HD2 . 30493 1 394 . 1 1 34 34 ARG HD3 H 1 3.377 0.020 . 2 . . . . A 34 ARG HD3 . 30493 1 395 . 1 1 34 34 ARG CA C 13 59.275 0.400 . 1 . . . . A 34 ARG CA . 30493 1 396 . 1 1 34 34 ARG CB C 13 30.327 0.400 . 1 . . . . A 34 ARG CB . 30493 1 397 . 1 1 34 34 ARG CG C 13 27.931 0.400 . 1 . . . . A 34 ARG CG . 30493 1 398 . 1 1 34 34 ARG CD C 13 43.800 0.400 . 1 . . . . A 34 ARG CD . 30493 1 399 . 1 1 34 34 ARG N N 15 118.698 0.400 . 1 . . . . A 34 ARG N . 30493 1 400 . 1 1 35 35 LEU H H 1 7.911 0.020 . 1 . . . . A 35 LEU H . 30493 1 401 . 1 1 35 35 LEU HA H 1 4.148 0.020 . 1 . . . . A 35 LEU HA . 30493 1 402 . 1 1 35 35 LEU HB2 H 1 1.934 0.020 . 2 . . . . A 35 LEU HB2 . 30493 1 403 . 1 1 35 35 LEU HB3 H 1 1.811 0.020 . 2 . . . . A 35 LEU HB3 . 30493 1 404 . 1 1 35 35 LEU HG H 1 1.716 0.020 . 1 . . . . A 35 LEU HG . 30493 1 405 . 1 1 35 35 LEU HD11 H 1 0.992 0.020 . 2 . . . . A 35 LEU HD11 . 30493 1 406 . 1 1 35 35 LEU HD12 H 1 0.992 0.020 . 2 . . . . A 35 LEU HD12 . 30493 1 407 . 1 1 35 35 LEU HD13 H 1 0.992 0.020 . 2 . . . . A 35 LEU HD13 . 30493 1 408 . 1 1 35 35 LEU HD21 H 1 0.985 0.020 . 2 . . . . A 35 LEU HD21 . 30493 1 409 . 1 1 35 35 LEU HD22 H 1 0.985 0.020 . 2 . . . . A 35 LEU HD22 . 30493 1 410 . 1 1 35 35 LEU HD23 H 1 0.985 0.020 . 2 . . . . A 35 LEU HD23 . 30493 1 411 . 1 1 35 35 LEU CA C 13 57.753 0.400 . 1 . . . . A 35 LEU CA . 30493 1 412 . 1 1 35 35 LEU CB C 13 42.340 0.400 . 1 . . . . A 35 LEU CB . 30493 1 413 . 1 1 35 35 LEU CG C 13 27.442 0.400 . 1 . . . . A 35 LEU CG . 30493 1 414 . 1 1 35 35 LEU CD1 C 13 25.534 0.400 . 1 . . . . A 35 LEU CD1 . 30493 1 415 . 1 1 35 35 LEU CD2 C 13 24.840 0.400 . 1 . . . . A 35 LEU CD2 . 30493 1 416 . 1 1 35 35 LEU N N 15 120.860 0.400 . 1 . . . . A 35 LEU N . 30493 1 417 . 1 1 36 36 GLN H H 1 8.620 0.020 . 1 . . . . A 36 GLN H . 30493 1 418 . 1 1 36 36 GLN HA H 1 4.227 0.020 . 1 . . . . A 36 GLN HA . 30493 1 419 . 1 1 36 36 GLN HB2 H 1 2.281 0.020 . 2 . . . . A 36 GLN HB2 . 30493 1 420 . 1 1 36 36 GLN HB3 H 1 2.203 0.020 . 2 . . . . A 36 GLN HB3 . 30493 1 421 . 1 1 36 36 GLN HG2 H 1 2.633 0.020 . 2 . . . . A 36 GLN HG2 . 30493 1 422 . 1 1 36 36 GLN HG3 H 1 2.496 0.020 . 2 . . . . A 36 GLN HG3 . 30493 1 423 . 1 1 36 36 GLN HE21 H 1 7.575 0.020 . 2 . . . . A 36 GLN HE21 . 30493 1 424 . 1 1 36 36 GLN HE22 H 1 7.087 0.020 . 2 . . . . A 36 GLN HE22 . 30493 1 425 . 1 1 36 36 GLN CA C 13 58.193 0.400 . 1 . . . . A 36 GLN CA . 30493 1 426 . 1 1 36 36 GLN CB C 13 28.855 0.400 . 1 . . . . A 36 GLN CB . 30493 1 427 . 1 1 36 36 GLN CG C 13 34.126 0.400 . 1 . . . . A 36 GLN CG . 30493 1 428 . 1 1 36 36 GLN N N 15 119.011 0.400 . 1 . . . . A 36 GLN N . 30493 1 429 . 1 1 36 36 GLN NE2 N 15 112.209 0.400 . 1 . . . . A 36 GLN NE2 . 30493 1 430 . 1 1 37 37 ARG H H 1 8.207 0.020 . 1 . . . . A 37 ARG H . 30493 1 431 . 1 1 37 37 ARG HA H 1 4.224 0.020 . 1 . . . . A 37 ARG HA . 30493 1 432 . 1 1 37 37 ARG HB2 H 1 2.063 0.020 . 2 . . . . A 37 ARG HB2 . 30493 1 433 . 1 1 37 37 ARG HB3 H 1 2.068 0.020 . 2 . . . . A 37 ARG HB3 . 30493 1 434 . 1 1 37 37 ARG HG2 H 1 1.931 0.020 . 2 . . . . A 37 ARG HG2 . 30493 1 435 . 1 1 37 37 ARG HG3 H 1 1.784 0.020 . 2 . . . . A 37 ARG HG3 . 30493 1 436 . 1 1 37 37 ARG HD2 H 1 3.338 0.020 . 1 . . . . A 37 ARG HD2 . 30493 1 437 . 1 1 37 37 ARG HD3 H 1 3.338 0.020 . 1 . . . . A 37 ARG HD3 . 30493 1 438 . 1 1 37 37 ARG CA C 13 58.750 0.400 . 1 . . . . A 37 ARG CA . 30493 1 439 . 1 1 37 37 ARG CB C 13 30.582 0.400 . 1 . . . . A 37 ARG CB . 30493 1 440 . 1 1 37 37 ARG CG C 13 27.701 0.400 . 1 . . . . A 37 ARG CG . 30493 1 441 . 1 1 37 37 ARG CD C 13 43.861 0.400 . 1 . . . . A 37 ARG CD . 30493 1 442 . 1 1 37 37 ARG N N 15 120.475 0.400 . 1 . . . . A 37 ARG N . 30493 1 443 . 1 1 38 38 ALA H H 1 7.965 0.020 . 1 . . . . A 38 ALA H . 30493 1 444 . 1 1 38 38 ALA HA H 1 4.418 0.020 . 1 . . . . A 38 ALA HA . 30493 1 445 . 1 1 38 38 ALA HB1 H 1 1.635 0.020 . 1 . . . . A 38 ALA HB1 . 30493 1 446 . 1 1 38 38 ALA HB2 H 1 1.635 0.020 . 1 . . . . A 38 ALA HB2 . 30493 1 447 . 1 1 38 38 ALA HB3 H 1 1.635 0.020 . 1 . . . . A 38 ALA HB3 . 30493 1 448 . 1 1 38 38 ALA CA C 13 53.823 0.400 . 1 . . . . A 38 ALA CA . 30493 1 449 . 1 1 38 38 ALA CB C 13 18.963 0.400 . 1 . . . . A 38 ALA CB . 30493 1 450 . 1 1 38 38 ALA N N 15 123.306 0.400 . 1 . . . . A 38 ALA N . 30493 1 451 . 1 1 39 39 LYS H H 1 8.211 0.020 . 1 . . . . A 39 LYS H . 30493 1 452 . 1 1 39 39 LYS HA H 1 4.305 0.020 . 1 . . . . A 39 LYS HA . 30493 1 453 . 1 1 39 39 LYS HB2 H 1 2.000 0.020 . 2 . . . . A 39 LYS HB2 . 30493 1 454 . 1 1 39 39 LYS HB3 H 1 2.011 0.020 . 2 . . . . A 39 LYS HB3 . 30493 1 455 . 1 1 39 39 LYS HG2 H 1 1.651 0.020 . 2 . . . . A 39 LYS HG2 . 30493 1 456 . 1 1 39 39 LYS HG3 H 1 1.557 0.020 . 2 . . . . A 39 LYS HG3 . 30493 1 457 . 1 1 39 39 LYS HD2 H 1 1.801 0.020 . 2 . . . . A 39 LYS HD2 . 30493 1 458 . 1 1 39 39 LYS HD3 H 1 1.795 0.020 . 2 . . . . A 39 LYS HD3 . 30493 1 459 . 1 1 39 39 LYS HE2 H 1 3.115 0.020 . 1 . . . . A 39 LYS HE2 . 30493 1 460 . 1 1 39 39 LYS HE3 H 1 3.114 0.020 . 1 . . . . A 39 LYS HE3 . 30493 1 461 . 1 1 39 39 LYS CA C 13 58.158 0.400 . 1 . . . . A 39 LYS CA . 30493 1 462 . 1 1 39 39 LYS CB C 13 32.681 0.400 . 1 . . . . A 39 LYS CB . 30493 1 463 . 1 1 39 39 LYS CG C 13 25.199 0.400 . 1 . . . . A 39 LYS CG . 30493 1 464 . 1 1 39 39 LYS CD C 13 29.333 0.400 . 1 . . . . A 39 LYS CD . 30493 1 465 . 1 1 39 39 LYS CE C 13 42.135 0.400 . 1 . . . . A 39 LYS CE . 30493 1 466 . 1 1 39 39 LYS N N 15 120.730 0.400 . 1 . . . . A 39 LYS N . 30493 1 467 . 1 1 40 40 ARG H H 1 8.256 0.020 . 1 . . . . A 40 ARG H . 30493 1 468 . 1 1 40 40 ARG HA H 1 4.319 0.020 . 1 . . . . A 40 ARG HA . 30493 1 469 . 1 1 40 40 ARG HB2 H 1 1.998 0.020 . 2 . . . . A 40 ARG HB2 . 30493 1 470 . 1 1 40 40 ARG HB3 H 1 1.993 0.020 . 2 . . . . A 40 ARG HB3 . 30493 1 471 . 1 1 40 40 ARG HG2 H 1 1.882 0.020 . 2 . . . . A 40 ARG HG2 . 30493 1 472 . 1 1 40 40 ARG HG3 H 1 1.777 0.020 . 2 . . . . A 40 ARG HG3 . 30493 1 473 . 1 1 40 40 ARG HD2 H 1 3.336 0.020 . 2 . . . . A 40 ARG HD2 . 30493 1 474 . 1 1 40 40 ARG HD3 H 1 3.327 0.020 . 2 . . . . A 40 ARG HD3 . 30493 1 475 . 1 1 40 40 ARG CA C 13 57.850 0.400 . 1 . . . . A 40 ARG CA . 30493 1 476 . 1 1 40 40 ARG CB C 13 30.856 0.400 . 1 . . . . A 40 ARG CB . 30493 1 477 . 1 1 40 40 ARG CG C 13 27.694 0.400 . 1 . . . . A 40 ARG CG . 30493 1 478 . 1 1 40 40 ARG CD C 13 43.733 0.400 . 1 . . . . A 40 ARG CD . 30493 1 479 . 1 1 40 40 ARG N N 15 121.725 0.400 . 1 . . . . A 40 ARG N . 30493 1 480 . 1 1 41 41 ALA H H 1 8.224 0.020 . 1 . . . . A 41 ALA H . 30493 1 481 . 1 1 41 41 ALA HA H 1 4.416 0.020 . 1 . . . . A 41 ALA HA . 30493 1 482 . 1 1 41 41 ALA HB1 H 1 1.538 0.020 . 1 . . . . A 41 ALA HB1 . 30493 1 483 . 1 1 41 41 ALA HB2 H 1 1.538 0.020 . 1 . . . . A 41 ALA HB2 . 30493 1 484 . 1 1 41 41 ALA HB3 H 1 1.538 0.020 . 1 . . . . A 41 ALA HB3 . 30493 1 485 . 1 1 41 41 ALA CA C 13 53.284 0.400 . 1 . . . . A 41 ALA CA . 30493 1 486 . 1 1 41 41 ALA CB C 13 18.910 0.400 . 1 . . . . A 41 ALA CB . 30493 1 487 . 1 1 41 41 ALA N N 15 124.078 0.400 . 1 . . . . A 41 ALA N . 30493 1 488 . 1 1 42 42 GLU H H 1 8.159 0.020 . 1 . . . . A 42 GLU H . 30493 1 489 . 1 1 42 42 GLU HA H 1 4.336 0.020 . 1 . . . . A 42 GLU HA . 30493 1 490 . 1 1 42 42 GLU HB2 H 1 2.183 0.020 . 2 . . . . A 42 GLU HB2 . 30493 1 491 . 1 1 42 42 GLU HB3 H 1 2.169 0.020 . 2 . . . . A 42 GLU HB3 . 30493 1 492 . 1 1 42 42 GLU HG2 H 1 2.530 0.020 . 2 . . . . A 42 GLU HG2 . 30493 1 493 . 1 1 42 42 GLU HG3 H 1 2.429 0.020 . 2 . . . . A 42 GLU HG3 . 30493 1 494 . 1 1 42 42 GLU CA C 13 57.206 0.400 . 1 . . . . A 42 GLU CA . 30493 1 495 . 1 1 42 42 GLU CB C 13 30.473 0.400 . 1 . . . . A 42 GLU CB . 30493 1 496 . 1 1 42 42 GLU CG C 13 36.445 0.400 . 1 . . . . A 42 GLU CG . 30493 1 497 . 1 1 42 42 GLU N N 15 120.340 0.400 . 1 . . . . A 42 GLU N . 30493 1 498 . 1 1 43 43 LYS H H 1 8.323 0.020 . 1 . . . . A 43 LYS H . 30493 1 499 . 1 1 43 43 LYS HA H 1 4.375 0.020 . 1 . . . . A 43 LYS HA . 30493 1 500 . 1 1 43 43 LYS HB2 H 1 1.922 0.020 . 2 . . . . A 43 LYS HB2 . 30493 1 501 . 1 1 43 43 LYS HB3 H 1 1.985 0.020 . 2 . . . . A 43 LYS HB3 . 30493 1 502 . 1 1 43 43 LYS HG2 H 1 1.609 0.020 . 2 . . . . A 43 LYS HG2 . 30493 1 503 . 1 1 43 43 LYS HG3 H 1 1.576 0.020 . 2 . . . . A 43 LYS HG3 . 30493 1 504 . 1 1 43 43 LYS HD2 H 1 1.826 0.020 . 2 . . . . A 43 LYS HD2 . 30493 1 505 . 1 1 43 43 LYS HD3 H 1 1.822 0.020 . 2 . . . . A 43 LYS HD3 . 30493 1 506 . 1 1 43 43 LYS HE2 H 1 3.112 0.020 . 1 . . . . A 43 LYS HE2 . 30493 1 507 . 1 1 43 43 LYS HE3 H 1 3.112 0.020 . 1 . . . . A 43 LYS HE3 . 30493 1 508 . 1 1 43 43 LYS CA C 13 56.903 0.400 . 1 . . . . A 43 LYS CA . 30493 1 509 . 1 1 43 43 LYS CB C 13 33.089 0.400 . 1 . . . . A 43 LYS CB . 30493 1 510 . 1 1 43 43 LYS CG C 13 25.034 0.400 . 1 . . . . A 43 LYS CG . 30493 1 511 . 1 1 43 43 LYS CD C 13 29.429 0.400 . 1 . . . . A 43 LYS CD . 30493 1 512 . 1 1 43 43 LYS CE C 13 42.357 0.400 . 1 . . . . A 43 LYS CE . 30493 1 513 . 1 1 43 43 LYS N N 15 122.426 0.400 . 1 . . . . A 43 LYS N . 30493 1 514 . 1 1 44 44 ALA H H 1 8.392 0.020 . 1 . . . . A 44 ALA H . 30493 1 515 . 1 1 44 44 ALA HA H 1 4.399 0.020 . 1 . . . . A 44 ALA HA . 30493 1 516 . 1 1 44 44 ALA HB1 H 1 1.544 0.020 . 1 . . . . A 44 ALA HB1 . 30493 1 517 . 1 1 44 44 ALA HB2 H 1 1.544 0.020 . 1 . . . . A 44 ALA HB2 . 30493 1 518 . 1 1 44 44 ALA HB3 H 1 1.544 0.020 . 1 . . . . A 44 ALA HB3 . 30493 1 519 . 1 1 44 44 ALA CA C 13 52.934 0.400 . 1 . . . . A 44 ALA CA . 30493 1 520 . 1 1 44 44 ALA CB C 13 19.255 0.400 . 1 . . . . A 44 ALA CB . 30493 1 521 . 1 1 44 44 ALA N N 15 125.529 0.400 . 1 . . . . A 44 ALA N . 30493 1 522 . 1 1 45 45 LYS H H 1 8.447 0.020 . 1 . . . . A 45 LYS H . 30493 1 523 . 1 1 45 45 LYS HA H 1 4.373 0.020 . 1 . . . . A 45 LYS HA . 30493 1 524 . 1 1 45 45 LYS HB2 H 1 1.944 0.020 . 1 . . . . A 45 LYS HB2 . 30493 1 525 . 1 1 45 45 LYS HB3 H 1 1.945 0.020 . 1 . . . . A 45 LYS HB3 . 30493 1 526 . 1 1 45 45 LYS HG2 H 1 1.550 0.020 . 1 . . . . A 45 LYS HG2 . 30493 1 527 . 1 1 45 45 LYS HG3 H 1 1.551 0.020 . 1 . . . . A 45 LYS HG3 . 30493 1 528 . 1 1 45 45 LYS HD2 H 1 1.811 0.020 . 1 . . . . A 45 LYS HD2 . 30493 1 529 . 1 1 45 45 LYS HD3 H 1 1.811 0.020 . 1 . . . . A 45 LYS HD3 . 30493 1 530 . 1 1 45 45 LYS HE2 H 1 3.123 0.020 . 1 . . . . A 45 LYS HE2 . 30493 1 531 . 1 1 45 45 LYS HE3 H 1 3.124 0.020 . 1 . . . . A 45 LYS HE3 . 30493 1 532 . 1 1 45 45 LYS CA C 13 56.967 0.400 . 1 . . . . A 45 LYS CA . 30493 1 533 . 1 1 45 45 LYS CB C 13 32.984 0.400 . 1 . . . . A 45 LYS CB . 30493 1 534 . 1 1 45 45 LYS CG C 13 24.868 0.400 . 1 . . . . A 45 LYS CG . 30493 1 535 . 1 1 45 45 LYS CD C 13 29.525 0.400 . 1 . . . . A 45 LYS CD . 30493 1 536 . 1 1 45 45 LYS CE C 13 42.399 0.400 . 1 . . . . A 45 LYS CE . 30493 1 537 . 1 1 45 45 LYS N N 15 121.367 0.400 . 1 . . . . A 45 LYS N . 30493 1 538 . 1 1 46 46 ASN H H 1 8.546 0.020 . 1 . . . . A 46 ASN H . 30493 1 539 . 1 1 46 46 ASN HA H 1 4.850 0.020 . 1 . . . . A 46 ASN HA . 30493 1 540 . 1 1 46 46 ASN HB2 H 1 3.005 0.020 . 2 . . . . A 46 ASN HB2 . 30493 1 541 . 1 1 46 46 ASN HB3 H 1 2.932 0.020 . 2 . . . . A 46 ASN HB3 . 30493 1 542 . 1 1 46 46 ASN HD21 H 1 7.818 0.020 . 2 . . . . A 46 ASN HD21 . 30493 1 543 . 1 1 46 46 ASN HD22 H 1 7.133 0.020 . 2 . . . . A 46 ASN HD22 . 30493 1 544 . 1 1 46 46 ASN CA C 13 53.387 0.400 . 1 . . . . A 46 ASN CA . 30493 1 545 . 1 1 46 46 ASN CB C 13 38.980 0.400 . 1 . . . . A 46 ASN CB . 30493 1 546 . 1 1 46 46 ASN N N 15 119.609 0.400 . 1 . . . . A 46 ASN N . 30493 1 547 . 1 1 46 46 ASN ND2 N 15 113.697 0.400 . 1 . . . . A 46 ASN ND2 . 30493 1 548 . 1 1 47 47 SER H H 1 8.389 0.020 . 1 . . . . A 47 SER H . 30493 1 549 . 1 1 47 47 SER HA H 1 4.538 0.020 . 1 . . . . A 47 SER HA . 30493 1 550 . 1 1 47 47 SER HB2 H 1 4.038 0.020 . 2 . . . . A 47 SER HB2 . 30493 1 551 . 1 1 47 47 SER HB3 H 1 4.020 0.020 . 2 . . . . A 47 SER HB3 . 30493 1 552 . 1 1 47 47 SER CA C 13 58.852 0.400 . 1 . . . . A 47 SER CA . 30493 1 553 . 1 1 47 47 SER CB C 13 64.131 0.400 . 1 . . . . A 47 SER CB . 30493 1 554 . 1 1 47 47 SER N N 15 117.199 0.400 . 1 . . . . A 47 SER N . 30493 1 555 . 1 1 48 48 LYS H H 1 8.500 0.020 . 1 . . . . A 48 LYS H . 30493 1 556 . 1 1 48 48 LYS HA H 1 4.436 0.020 . 1 . . . . A 48 LYS HA . 30493 1 557 . 1 1 48 48 LYS HB2 H 1 1.977 0.020 . 2 . . . . A 48 LYS HB2 . 30493 1 558 . 1 1 48 48 LYS HB3 H 1 1.857 0.020 . 2 . . . . A 48 LYS HB3 . 30493 1 559 . 1 1 48 48 LYS HG2 H 1 1.581 0.020 . 1 . . . . A 48 LYS HG2 . 30493 1 560 . 1 1 48 48 LYS HG3 H 1 1.580 0.020 . 1 . . . . A 48 LYS HG3 . 30493 1 561 . 1 1 48 48 LYS HD2 H 1 1.812 0.020 . 2 . . . . A 48 LYS HD2 . 30493 1 562 . 1 1 48 48 LYS HD3 H 1 1.809 0.020 . 2 . . . . A 48 LYS HD3 . 30493 1 563 . 1 1 48 48 LYS HE2 H 1 3.123 0.020 . 1 . . . . A 48 LYS HE2 . 30493 1 564 . 1 1 48 48 LYS HE3 H 1 3.124 0.020 . 1 . . . . A 48 LYS HE3 . 30493 1 565 . 1 1 48 48 LYS CA C 13 56.793 0.400 . 1 . . . . A 48 LYS CA . 30493 1 566 . 1 1 48 48 LYS CB C 13 33.389 0.400 . 1 . . . . A 48 LYS CB . 30493 1 567 . 1 1 48 48 LYS CG C 13 25.230 0.400 . 1 . . . . A 48 LYS CG . 30493 1 568 . 1 1 48 48 LYS CD C 13 29.163 0.400 . 1 . . . . A 48 LYS CD . 30493 1 569 . 1 1 48 48 LYS CE C 13 42.240 0.400 . 1 . . . . A 48 LYS CE . 30493 1 570 . 1 1 48 48 LYS N N 15 123.867 0.400 . 1 . . . . A 48 LYS N . 30493 1 571 . 1 1 49 49 LYS H H 1 8.383 0.020 . 1 . . . . A 49 LYS H . 30493 1 572 . 1 1 49 49 LYS HA H 1 4.402 0.020 . 1 . . . . A 49 LYS HA . 30493 1 573 . 1 1 49 49 LYS HB2 H 1 1.871 0.020 . 2 . . . . A 49 LYS HB2 . 30493 1 574 . 1 1 49 49 LYS HB3 H 1 1.929 0.020 . 2 . . . . A 49 LYS HB3 . 30493 1 575 . 1 1 49 49 LYS HG2 H 1 1.565 0.020 . 1 . . . . A 49 LYS HG2 . 30493 1 576 . 1 1 49 49 LYS HG3 H 1 1.565 0.020 . 1 . . . . A 49 LYS HG3 . 30493 1 577 . 1 1 49 49 LYS HD2 H 1 1.811 0.020 . 1 . . . . A 49 LYS HD2 . 30493 1 578 . 1 1 49 49 LYS HD3 H 1 1.811 0.020 . 1 . . . . A 49 LYS HD3 . 30493 1 579 . 1 1 49 49 LYS HE2 H 1 3.124 0.020 . 2 . . . . A 49 LYS HE2 . 30493 1 580 . 1 1 49 49 LYS HE3 H 1 3.120 0.020 . 2 . . . . A 49 LYS HE3 . 30493 1 581 . 1 1 49 49 LYS CA C 13 56.742 0.400 . 1 . . . . A 49 LYS CA . 30493 1 582 . 1 1 49 49 LYS CB C 13 33.172 0.400 . 1 . . . . A 49 LYS CB . 30493 1 583 . 1 1 49 49 LYS CG C 13 24.935 0.400 . 1 . . . . A 49 LYS CG . 30493 1 584 . 1 1 49 49 LYS CD C 13 29.278 0.400 . 1 . . . . A 49 LYS CD . 30493 1 585 . 1 1 49 49 LYS CE C 13 42.393 0.400 . 1 . . . . A 49 LYS CE . 30493 1 586 . 1 1 49 49 LYS N N 15 123.149 0.400 . 1 . . . . A 49 LYS N . 30493 1 587 . 1 1 50 50 ALA H H 1 8.515 0.020 . 1 . . . . A 50 ALA H . 30493 1 588 . 1 1 50 50 ALA HA H 1 4.420 0.020 . 1 . . . . A 50 ALA HA . 30493 1 589 . 1 1 50 50 ALA HB1 H 1 1.515 0.020 . 1 . . . . A 50 ALA HB1 . 30493 1 590 . 1 1 50 50 ALA HB2 H 1 1.515 0.020 . 1 . . . . A 50 ALA HB2 . 30493 1 591 . 1 1 50 50 ALA HB3 H 1 1.515 0.020 . 1 . . . . A 50 ALA HB3 . 30493 1 592 . 1 1 50 50 ALA CA C 13 52.893 0.400 . 1 . . . . A 50 ALA CA . 30493 1 593 . 1 1 50 50 ALA CB C 13 19.396 0.400 . 1 . . . . A 50 ALA CB . 30493 1 594 . 1 1 50 50 ALA N N 15 126.568 0.400 . 1 . . . . A 50 ALA N . 30493 1 595 . 1 1 51 51 ILE H H 1 8.262 0.020 . 1 . . . . A 51 ILE H . 30493 1 596 . 1 1 51 51 ILE HA H 1 4.203 0.020 . 1 . . . . A 51 ILE HA . 30493 1 597 . 1 1 51 51 ILE HB H 1 1.949 0.020 . 1 . . . . A 51 ILE HB . 30493 1 598 . 1 1 51 51 ILE HG12 H 1 1.592 0.020 . 2 . . . . A 51 ILE HG12 . 30493 1 599 . 1 1 51 51 ILE HG13 H 1 1.302 0.020 . 2 . . . . A 51 ILE HG13 . 30493 1 600 . 1 1 51 51 ILE HG21 H 1 1.004 0.020 . 1 . . . . A 51 ILE HG21 . 30493 1 601 . 1 1 51 51 ILE HG22 H 1 1.004 0.020 . 1 . . . . A 51 ILE HG22 . 30493 1 602 . 1 1 51 51 ILE HG23 H 1 1.004 0.020 . 1 . . . . A 51 ILE HG23 . 30493 1 603 . 1 1 51 51 ILE HD11 H 1 0.978 0.020 . 1 . . . . A 51 ILE HD11 . 30493 1 604 . 1 1 51 51 ILE HD12 H 1 0.978 0.020 . 1 . . . . A 51 ILE HD12 . 30493 1 605 . 1 1 51 51 ILE HD13 H 1 0.978 0.020 . 1 . . . . A 51 ILE HD13 . 30493 1 606 . 1 1 51 51 ILE CA C 13 61.637 0.400 . 1 . . . . A 51 ILE CA . 30493 1 607 . 1 1 51 51 ILE CB C 13 38.849 0.400 . 1 . . . . A 51 ILE CB . 30493 1 608 . 1 1 51 51 ILE CG1 C 13 27.726 0.400 . 1 . . . . A 51 ILE CG1 . 30493 1 609 . 1 1 51 51 ILE CG2 C 13 17.648 0.400 . 1 . . . . A 51 ILE CG2 . 30493 1 610 . 1 1 51 51 ILE CD1 C 13 13.205 0.400 . 1 . . . . A 51 ILE CD1 . 30493 1 611 . 1 1 51 51 ILE N N 15 120.799 0.400 . 1 . . . . A 51 ILE N . 30493 1 612 . 1 1 52 52 GLU H H 1 8.661 0.020 . 1 . . . . A 52 GLU H . 30493 1 613 . 1 1 52 52 GLU HA H 1 4.417 0.020 . 1 . . . . A 52 GLU HA . 30493 1 614 . 1 1 52 52 GLU HB2 H 1 2.173 0.020 . 2 . . . . A 52 GLU HB2 . 30493 1 615 . 1 1 52 52 GLU HB3 H 1 2.060 0.020 . 2 . . . . A 52 GLU HB3 . 30493 1 616 . 1 1 52 52 GLU CA C 13 56.826 0.400 . 1 . . . . A 52 GLU CA . 30493 1 617 . 1 1 52 52 GLU CB C 13 30.429 0.400 . 1 . . . . A 52 GLU CB . 30493 1 618 . 1 1 52 52 GLU N N 15 125.334 0.400 . 1 . . . . A 52 GLU N . 30493 1 619 . 1 1 53 53 ASP H H 1 8.472 0.020 . 1 . . . . A 53 ASP H . 30493 1 620 . 1 1 53 53 ASP HA H 1 4.705 0.020 . 1 . . . . A 53 ASP HA . 30493 1 621 . 1 1 53 53 ASP HB2 H 1 2.798 0.020 . 1 . . . . A 53 ASP HB2 . 30493 1 622 . 1 1 53 53 ASP CA C 13 54.786 0.400 . 1 . . . . A 53 ASP CA . 30493 1 623 . 1 1 53 53 ASP CB C 13 41.437 0.400 . 1 . . . . A 53 ASP CB . 30493 1 624 . 1 1 53 53 ASP N N 15 122.576 0.400 . 1 . . . . A 53 ASP N . 30493 1 625 . 1 1 54 54 GLY H H 1 8.469 0.020 . 1 . . . . A 54 GLY H . 30493 1 626 . 1 1 54 54 GLY HA2 H 1 4.057 0.020 . 1 . . . . A 54 GLY HA2 . 30493 1 627 . 1 1 54 54 GLY HA3 H 1 4.057 0.020 . 1 . . . . A 54 GLY HA3 . 30493 1 628 . 1 1 54 54 GLY CA C 13 45.477 0.400 . 1 . . . . A 54 GLY CA . 30493 1 629 . 1 1 54 54 GLY N N 15 109.757 0.400 . 1 . . . . A 54 GLY N . 30493 1 630 . 1 1 55 55 VAL H H 1 8.111 0.020 . 1 . . . . A 55 VAL H . 30493 1 631 . 1 1 55 55 VAL HA H 1 4.504 0.020 . 1 . . . . A 55 VAL HA . 30493 1 632 . 1 1 55 55 VAL HB H 1 2.174 0.020 . 1 . . . . A 55 VAL HB . 30493 1 633 . 1 1 55 55 VAL HG11 H 1 1.071 0.020 . 2 . . . . A 55 VAL HG11 . 30493 1 634 . 1 1 55 55 VAL HG12 H 1 1.071 0.020 . 2 . . . . A 55 VAL HG12 . 30493 1 635 . 1 1 55 55 VAL HG13 H 1 1.071 0.020 . 2 . . . . A 55 VAL HG13 . 30493 1 636 . 1 1 55 55 VAL HG21 H 1 1.021 0.020 . 2 . . . . A 55 VAL HG21 . 30493 1 637 . 1 1 55 55 VAL HG22 H 1 1.021 0.020 . 2 . . . . A 55 VAL HG22 . 30493 1 638 . 1 1 55 55 VAL HG23 H 1 1.021 0.020 . 2 . . . . A 55 VAL HG23 . 30493 1 639 . 1 1 55 55 VAL CA C 13 60.048 0.400 . 1 . . . . A 55 VAL CA . 30493 1 640 . 1 1 55 55 VAL CB C 13 32.695 0.400 . 1 . . . . A 55 VAL CB . 30493 1 641 . 1 1 55 55 VAL CG1 C 13 21.111 0.400 . 1 . . . . A 55 VAL CG1 . 30493 1 642 . 1 1 55 55 VAL CG2 C 13 20.746 0.400 . 1 . . . . A 55 VAL CG2 . 30493 1 643 . 1 1 55 55 VAL N N 15 121.904 0.400 . 1 . . . . A 55 VAL N . 30493 1 644 . 1 1 56 56 PRO HA H 1 4.523 0.020 . 1 . . . . A 56 PRO HA . 30493 1 645 . 1 1 56 56 PRO HB2 H 1 2.389 0.020 . 2 . . . . A 56 PRO HB2 . 30493 1 646 . 1 1 56 56 PRO HB3 H 1 1.971 0.020 . 2 . . . . A 56 PRO HB3 . 30493 1 647 . 1 1 56 56 PRO HG2 H 1 2.134 0.020 . 2 . . . . A 56 PRO HG2 . 30493 1 648 . 1 1 56 56 PRO HG3 H 1 2.089 0.020 . 2 . . . . A 56 PRO HG3 . 30493 1 649 . 1 1 56 56 PRO HD2 H 1 4.008 0.020 . 2 . . . . A 56 PRO HD2 . 30493 1 650 . 1 1 56 56 PRO HD3 H 1 3.766 0.020 . 2 . . . . A 56 PRO HD3 . 30493 1 651 . 1 1 56 56 PRO CA C 13 63.339 0.400 . 1 . . . . A 56 PRO CA . 30493 1 652 . 1 1 56 56 PRO CB C 13 32.390 0.400 . 1 . . . . A 56 PRO CB . 30493 1 653 . 1 1 56 56 PRO CG C 13 27.652 0.400 . 1 . . . . A 56 PRO CG . 30493 1 654 . 1 1 56 56 PRO CD C 13 51.227 0.400 . 1 . . . . A 56 PRO CD . 30493 1 655 . 1 1 57 57 GLN H H 1 8.675 0.020 . 1 . . . . A 57 GLN H . 30493 1 656 . 1 1 57 57 GLN HA H 1 4.710 0.020 . 1 . . . . A 57 GLN HA . 30493 1 657 . 1 1 57 57 GLN HB2 H 1 2.250 0.020 . 2 . . . . A 57 GLN HB2 . 30493 1 658 . 1 1 57 57 GLN HB3 H 1 2.013 0.020 . 2 . . . . A 57 GLN HB3 . 30493 1 659 . 1 1 57 57 GLN HG2 H 1 2.548 0.020 . 1 . . . . A 57 GLN HG2 . 30493 1 660 . 1 1 57 57 GLN HG3 H 1 2.548 0.020 . 1 . . . . A 57 GLN HG3 . 30493 1 661 . 1 1 57 57 GLN HE21 H 1 7.750 0.020 . 2 . . . . A 57 GLN HE21 . 30493 1 662 . 1 1 57 57 GLN HE22 H 1 7.054 0.020 . 2 . . . . A 57 GLN HE22 . 30493 1 663 . 1 1 57 57 GLN CA C 13 53.745 0.400 . 1 . . . . A 57 GLN CA . 30493 1 664 . 1 1 57 57 GLN CB C 13 29.061 0.400 . 1 . . . . A 57 GLN CB . 30493 1 665 . 1 1 57 57 GLN CG C 13 33.652 0.400 . 1 . . . . A 57 GLN CG . 30493 1 666 . 1 1 57 57 GLN N N 15 122.484 0.400 . 1 . . . . A 57 GLN N . 30493 1 667 . 1 1 57 57 GLN NE2 N 15 113.999 0.400 . 1 . . . . A 57 GLN NE2 . 30493 1 668 . 1 1 58 58 PRO HA H 1 4.481 0.020 . 1 . . . . A 58 PRO HA . 30493 1 669 . 1 1 58 58 PRO HB2 H 1 2.405 0.020 . 2 . . . . A 58 PRO HB2 . 30493 1 670 . 1 1 58 58 PRO HB3 H 1 2.010 0.020 . 2 . . . . A 58 PRO HB3 . 30493 1 671 . 1 1 58 58 PRO HG2 H 1 2.140 0.020 . 2 . . . . A 58 PRO HG2 . 30493 1 672 . 1 1 58 58 PRO HG3 H 1 2.101 0.020 . 2 . . . . A 58 PRO HG3 . 30493 1 673 . 1 1 58 58 PRO HD2 H 1 3.901 0.020 . 2 . . . . A 58 PRO HD2 . 30493 1 674 . 1 1 58 58 PRO HD3 H 1 3.784 0.020 . 2 . . . . A 58 PRO HD3 . 30493 1 675 . 1 1 58 58 PRO CA C 13 63.619 0.400 . 1 . . . . A 58 PRO CA . 30493 1 676 . 1 1 58 58 PRO CB C 13 32.119 0.400 . 1 . . . . A 58 PRO CB . 30493 1 677 . 1 1 58 58 PRO CG C 13 27.679 0.400 . 1 . . . . A 58 PRO CG . 30493 1 678 . 1 1 58 58 PRO CD C 13 50.830 0.400 . 1 . . . . A 58 PRO CD . 30493 1 679 . 1 1 59 59 GLU H H 1 8.758 0.020 . 1 . . . . A 59 GLU H . 30493 1 680 . 1 1 59 59 GLU HA H 1 4.334 0.020 . 1 . . . . A 59 GLU HA . 30493 1 681 . 1 1 59 59 GLU HB2 H 1 2.148 0.020 . 2 . . . . A 59 GLU HB2 . 30493 1 682 . 1 1 59 59 GLU HB3 H 1 2.052 0.020 . 2 . . . . A 59 GLU HB3 . 30493 1 683 . 1 1 59 59 GLU HG2 H 1 2.392 0.020 . 2 . . . . A 59 GLU HG2 . 30493 1 684 . 1 1 59 59 GLU HG3 H 1 2.405 0.020 . 2 . . . . A 59 GLU HG3 . 30493 1 685 . 1 1 59 59 GLU CA C 13 56.972 0.400 . 1 . . . . A 59 GLU CA . 30493 1 686 . 1 1 59 59 GLU CB C 13 30.461 0.400 . 1 . . . . A 59 GLU CB . 30493 1 687 . 1 1 59 59 GLU CG C 13 36.497 0.400 . 1 . . . . A 59 GLU CG . 30493 1 688 . 1 1 59 59 GLU N N 15 121.689 0.400 . 1 . . . . A 59 GLU N . 30493 1 689 . 1 1 60 60 ALA H H 1 8.425 0.020 . 1 . . . . A 60 ALA H . 30493 1 690 . 1 1 60 60 ALA HA H 1 4.403 0.020 . 1 . . . . A 60 ALA HA . 30493 1 691 . 1 1 60 60 ALA HB1 H 1 1.496 0.020 . 1 . . . . A 60 ALA HB1 . 30493 1 692 . 1 1 60 60 ALA HB2 H 1 1.496 0.020 . 1 . . . . A 60 ALA HB2 . 30493 1 693 . 1 1 60 60 ALA HB3 H 1 1.496 0.020 . 1 . . . . A 60 ALA HB3 . 30493 1 694 . 1 1 60 60 ALA CA C 13 52.676 0.400 . 1 . . . . A 60 ALA CA . 30493 1 695 . 1 1 60 60 ALA CB C 13 19.416 0.400 . 1 . . . . A 60 ALA CB . 30493 1 696 . 1 1 60 60 ALA N N 15 125.534 0.400 . 1 . . . . A 60 ALA N . 30493 1 stop_ save_