################################### # 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 6572 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_referencing _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 $sample_1 isotropic 6572 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 3 3 LYS H H 1 6.56 0.02 . 1 . . . . 3 LYS H . 6572 1 2 . 1 1 3 3 LYS N N 15 117.97 0.05 . 1 . . . . 3 LYS N . 6572 1 3 . 1 1 4 4 ALA H H 1 6.56 0.02 . 1 . . . . 4 ALA H . 6572 1 4 . 1 1 4 4 ALA N N 15 124.13 0.05 . 1 . . . . 4 ALA N . 6572 1 5 . 1 1 6 6 ALA H H 1 8.58 0.02 . 1 . . . . 6 ALA H . 6572 1 6 . 1 1 6 6 ALA N N 15 120.99 0.05 . 1 . . . . 6 ALA N . 6572 1 7 . 1 1 7 7 ASP H H 1 9.43 0.02 . 1 . . . . 7 ASP H . 6572 1 8 . 1 1 7 7 ASP N N 15 122.87 0.05 . 1 . . . . 7 ASP N . 6572 1 9 . 1 1 8 8 GLY H H 1 8.99 0.02 . 1 . . . . 8 GLY H . 6572 1 10 . 1 1 8 8 GLY N N 15 106.27 0.05 . 1 . . . . 8 GLY N . 6572 1 11 . 1 1 9 9 LEU H H 1 7.62 0.02 . 1 . . . . 9 LEU H . 6572 1 12 . 1 1 9 9 LEU N N 15 122.47 0.05 . 1 . . . . 9 LEU N . 6572 1 13 . 1 1 10 10 LYS H H 1 8.61 0.02 . 1 . . . . 10 LYS H . 6572 1 14 . 1 1 10 10 LYS N N 15 125.38 0.05 . 1 . . . . 10 LYS N . 6572 1 15 . 1 1 11 11 MET H H 1 8.42 0.02 . 1 . . . . 11 MET H . 6572 1 16 . 1 1 11 11 MET N N 15 128.51 0.05 . 1 . . . . 11 MET N . 6572 1 17 . 1 1 12 12 ASP H H 1 7.57 0.02 . 1 . . . . 12 ASP H . 6572 1 18 . 1 1 12 12 ASP N N 15 124.44 0.05 . 1 . . . . 12 ASP N . 6572 1 19 . 1 1 13 13 LYS H H 1 9.94 0.02 . 1 . . . . 13 LYS H . 6572 1 20 . 1 1 13 13 LYS N N 15 122.25 0.05 . 1 . . . . 13 LYS N . 6572 1 21 . 1 1 14 14 THR H H 1 10.35 0.02 . 1 . . . . 14 THR H . 6572 1 22 . 1 1 14 14 THR N N 15 114.73 0.05 . 1 . . . . 14 THR N . 6572 1 23 . 1 1 15 15 LYS H H 1 8.53 0.02 . 1 . . . . 15 LYS H . 6572 1 24 . 1 1 15 15 LYS N N 15 115.35 0.05 . 1 . . . . 15 LYS N . 6572 1 25 . 1 1 16 16 GLN H H 1 9.3 0.02 . 1 . . . . 16 GLN H . 6572 1 26 . 1 1 16 16 GLN N N 15 122.25 0.05 . 1 . . . . 16 GLN N . 6572 1 27 . 1 1 18 18 VAL H H 1 7.82 0.02 . 1 . . . . 18 VAL H . 6572 1 28 . 1 1 18 18 VAL N N 15 120.63 0.05 . 1 . . . . 18 VAL N . 6572 1 29 . 1 1 19 19 VAL H H 1 7.49 0.02 . 1 . . . . 19 VAL H . 6572 1 30 . 1 1 19 19 VAL N N 15 125.08 0.05 . 1 . . . . 19 VAL N . 6572 1 31 . 1 1 20 20 PHE H H 1 8.98 0.02 . 1 . . . . 20 PHE H . 6572 1 32 . 1 1 20 20 PHE N N 15 126.97 0.05 . 1 . . . . 20 PHE N . 6572 1 33 . 1 1 21 21 ASN H H 1 9.02 0.02 . 1 . . . . 21 ASN H . 6572 1 34 . 1 1 21 21 ASN N N 15 130.39 0.05 . 1 . . . . 21 ASN N . 6572 1 35 . 1 1 22 22 HIS H H 1 11.86 0.02 . 1 . . . . 22 HIS H . 6572 1 36 . 1 1 22 22 HIS N N 15 128.86 0.05 . 1 . . . . 22 HIS N . 6572 1 37 . 1 1 23 23 SER H H 1 11.98 0.02 . 1 . . . . 23 SER H . 6572 1 38 . 1 1 23 23 SER N N 15 122.47 0.05 . 1 . . . . 23 SER N . 6572 1 39 . 1 1 24 24 THR H H 1 8.06 0.02 . 1 . . . . 24 THR H . 6572 1 40 . 1 1 24 24 THR N N 15 112.9 0.05 . 1 . . . . 24 THR N . 6572 1 41 . 1 1 25 25 HIS H H 1 10.3 0.02 . 1 . . . . 25 HIS H . 6572 1 42 . 1 1 25 25 HIS N N 15 119.74 0.05 . 1 . . . . 25 HIS N . 6572 1 43 . 1 1 26 26 LYS H H 1 8.6 0.02 . 1 . . . . 26 LYS H . 6572 1 44 . 1 1 26 26 LYS N N 15 122.62 0.05 . 1 . . . . 26 LYS N . 6572 1 45 . 1 1 27 27 ALA H H 1 9.34 0.02 . 1 . . . . 27 ALA H . 6572 1 46 . 1 1 27 27 ALA N N 15 120.99 0.05 . 1 . . . . 27 ALA N . 6572 1 47 . 1 1 28 28 VAL H H 1 8.68 0.02 . 1 . . . . 28 VAL H . 6572 1 48 . 1 1 28 28 VAL N N 15 122.6 0.05 . 1 . . . . 28 VAL N . 6572 1 49 . 1 1 29 29 LYS H H 1 8.6 0.02 . 1 . . . . 29 LYS H . 6572 1 50 . 1 1 29 29 LYS N N 15 126.45 0.05 . 1 . . . . 29 LYS N . 6572 1 51 . 1 1 30 30 CYS H H 1 8.34 0.02 . 1 . . . . 30 CYS H . 6572 1 52 . 1 1 30 30 CYS N N 15 117.61 0.05 . 1 . . . . 30 CYS N . 6572 1 53 . 1 1 31 31 GLY H H 1 9.23 0.02 . 1 . . . . 31 GLY H . 6572 1 54 . 1 1 31 31 GLY N N 15 103.94 0.05 . 1 . . . . 31 GLY N . 6572 1 55 . 1 1 32 32 ASP H H 1 8.13 0.02 . 1 . . . . 32 ASP H . 6572 1 56 . 1 1 32 32 ASP N N 15 120.56 0.05 . 1 . . . . 32 ASP N . 6572 1 57 . 1 1 33 33 CYS H H 1 7.02 0.02 . 1 . . . . 33 CYS H . 6572 1 58 . 1 1 33 33 CYS N N 15 114.6 0.05 . 1 . . . . 33 CYS N . 6572 1 59 . 1 1 34 34 HIS H H 1 10.58 0.02 . 1 . . . . 34 HIS H . 6572 1 60 . 1 1 34 34 HIS N N 15 120.04 0.05 . 1 . . . . 34 HIS N . 6572 1 61 . 1 1 35 35 HIS H H 1 8.76 0.02 . 1 . . . . 35 HIS H . 6572 1 62 . 1 1 35 35 HIS N N 15 121.07 0.05 . 1 . . . . 35 HIS N . 6572 1 63 . 1 1 37 37 VAL H H 1 10.56 0.02 . 1 . . . . 37 VAL H . 6572 1 64 . 1 1 37 37 VAL N N 15 127.81 0.05 . 1 . . . . 37 VAL N . 6572 1 65 . 1 1 38 38 ASN H H 1 9.97 0.02 . 1 . . . . 38 ASN H . 6572 1 66 . 1 1 38 38 ASN N N 15 126.48 0.05 . 1 . . . . 38 ASN N . 6572 1 67 . 1 1 39 39 GLY H H 1 9.32 0.02 . 1 . . . . 39 GLY H . 6572 1 68 . 1 1 39 39 GLY N N 15 103.39 0.05 . 1 . . . . 39 GLY N . 6572 1 69 . 1 1 40 40 LYS H H 1 8.27 0.02 . 1 . . . . 40 LYS H . 6572 1 70 . 1 1 40 40 LYS N N 15 120.25 0.05 . 1 . . . . 40 LYS N . 6572 1 71 . 1 1 41 41 GLU H H 1 9.73 0.02 . 1 . . . . 41 GLU H . 6572 1 72 . 1 1 41 41 GLU N N 15 126.82 0.05 . 1 . . . . 41 GLU N . 6572 1 73 . 1 1 42 42 ASP H H 1 9.6 0.02 . 1 . . . . 42 ASP H . 6572 1 74 . 1 1 42 42 ASP N N 15 127.3 0.05 . 1 . . . . 42 ASP N . 6572 1 75 . 1 1 43 43 TYR H H 1 9.4 0.02 . 1 . . . . 43 TYR H . 6572 1 76 . 1 1 43 43 TYR N N 15 123.82 0.05 . 1 . . . . 43 TYR N . 6572 1 77 . 1 1 44 44 GLN H H 1 8.91 0.02 . 1 . . . . 44 GLN H . 6572 1 78 . 1 1 44 44 GLN N N 15 119.3 0.05 . 1 . . . . 44 GLN N . 6572 1 79 . 1 1 45 45 LYS H H 1 8.31 0.02 . 1 . . . . 45 LYS H . 6572 1 80 . 1 1 45 45 LYS N N 15 118.14 0.05 . 1 . . . . 45 LYS N . 6572 1 81 . 1 1 46 46 CYS H H 1 8.05 0.02 . 1 . . . . 46 CYS H . 6572 1 82 . 1 1 46 46 CYS N N 15 120.04 0.05 . 1 . . . . 46 CYS N . 6572 1 83 . 1 1 47 47 ALA H H 1 8.26 0.02 . 1 . . . . 47 ALA H . 6572 1 84 . 1 1 47 47 ALA N N 15 115.47 0.05 . 1 . . . . 47 ALA N . 6572 1 85 . 1 1 48 48 THR H H 1 7.07 0.02 . 1 . . . . 48 THR H . 6572 1 86 . 1 1 48 48 THR N N 15 116.77 0.05 . 1 . . . . 48 THR N . 6572 1 87 . 1 1 49 49 ALA H H 1 8.42 0.02 . 1 . . . . 49 ALA H . 6572 1 88 . 1 1 49 49 ALA N N 15 128.51 0.05 . 1 . . . . 49 ALA N . 6572 1 89 . 1 1 50 50 GLY H H 1 8.94 0.02 . 1 . . . . 50 GLY H . 6572 1 90 . 1 1 50 50 GLY N N 15 112.02 0.05 . 1 . . . . 50 GLY N . 6572 1 91 . 1 1 51 51 CYS H H 1 8.84 0.02 . 1 . . . . 51 CYS H . 6572 1 92 . 1 1 51 51 CYS N N 15 127.19 0.05 . 1 . . . . 51 CYS N . 6572 1 93 . 1 1 52 52 HIS H H 1 12.22 0.02 . 1 . . . . 52 HIS H . 6572 1 94 . 1 1 52 52 HIS N N 15 126.54 0.05 . 1 . . . . 52 HIS N . 6572 1 95 . 1 1 53 53 ASP H H 1 9.52 0.02 . 1 . . . . 53 ASP H . 6572 1 96 . 1 1 53 53 ASP N N 15 117.92 0.05 . 1 . . . . 53 ASP N . 6572 1 97 . 1 1 54 54 ASN H H 1 10.25 0.02 . 1 . . . . 54 ASN H . 6572 1 98 . 1 1 54 54 ASN N N 15 119.82 0.05 . 1 . . . . 54 ASN N . 6572 1 99 . 1 1 55 55 MET H H 1 9.68 0.02 . 1 . . . . 55 MET H . 6572 1 100 . 1 1 55 55 MET N N 15 127.23 0.05 . 1 . . . . 55 MET N . 6572 1 101 . 1 1 56 56 ASP H H 1 8.52 0.02 . 1 . . . . 56 ASP H . 6572 1 102 . 1 1 56 56 ASP N N 15 121.64 0.05 . 1 . . . . 56 ASP N . 6572 1 103 . 1 1 57 57 LYS H H 1 9.08 0.02 . 1 . . . . 57 LYS H . 6572 1 104 . 1 1 57 57 LYS N N 15 128.48 0.05 . 1 . . . . 57 LYS N . 6572 1 105 . 1 1 58 58 LYS H H 1 8.75 0.02 . 1 . . . . 58 LYS H . 6572 1 106 . 1 1 58 58 LYS N N 15 118.87 0.05 . 1 . . . . 58 LYS N . 6572 1 107 . 1 1 59 59 ASP H H 1 8.28 0.02 . 1 . . . . 59 ASP H . 6572 1 108 . 1 1 59 59 ASP N N 15 120.47 0.05 . 1 . . . . 59 ASP N . 6572 1 109 . 1 1 60 60 LYS H H 1 9.07 0.02 . 1 . . . . 60 LYS H . 6572 1 110 . 1 1 60 60 LYS N N 15 127.35 0.05 . 1 . . . . 60 LYS N . 6572 1 111 . 1 1 61 61 SER H H 1 8.9 0.02 . 1 . . . . 61 SER H . 6572 1 112 . 1 1 61 61 SER N N 15 118 0.05 . 1 . . . . 61 SER N . 6572 1 113 . 1 1 62 62 ALA H H 1 8.45 0.02 . 1 . . . . 62 ALA H . 6572 1 114 . 1 1 62 62 ALA N N 15 119.8 0.05 . 1 . . . . 62 ALA N . 6572 1 115 . 1 1 63 63 LYS H H 1 8.46 0.02 . 1 . . . . 63 LYS H . 6572 1 116 . 1 1 63 63 LYS N N 15 114.06 0.05 . 1 . . . . 63 LYS N . 6572 1 117 . 1 1 64 64 GLY H H 1 9.86 0.02 . 1 . . . . 64 GLY H . 6572 1 118 . 1 1 64 64 GLY N N 15 110.56 0.05 . 1 . . . . 64 GLY N . 6572 1 119 . 1 1 65 65 TYR H H 1 10.39 0.02 . 1 . . . . 65 TYR H . 6572 1 120 . 1 1 65 65 TYR N N 15 134.27 0.05 . 1 . . . . 65 TYR N . 6572 1 121 . 1 1 66 66 TYR H H 1 11.5 0.02 . 1 . . . . 66 TYR H . 6572 1 122 . 1 1 66 66 TYR N N 15 122.01 0.05 . 1 . . . . 66 TYR N . 6572 1 123 . 1 1 67 67 HIS H H 1 11.03 0.02 . 1 . . . . 67 HIS H . 6572 1 124 . 1 1 67 67 HIS N N 15 123.47 0.05 . 1 . . . . 67 HIS N . 6572 1 125 . 1 1 68 68 ALA H H 1 10.29 0.02 . 1 . . . . 68 ALA H . 6572 1 126 . 1 1 68 68 ALA N N 15 121.43 0.05 . 1 . . . . 68 ALA N . 6572 1 127 . 1 1 69 69 MET H H 1 8.52 0.02 . 1 . . . . 69 MET H . 6572 1 128 . 1 1 69 69 MET N N 15 107.91 0.05 . 1 . . . . 69 MET N . 6572 1 129 . 1 1 70 70 HIS H H 1 10.09 0.02 . 1 . . . . 70 HIS H . 6572 1 130 . 1 1 70 70 HIS N N 15 115.29 0.05 . 1 . . . . 70 HIS N . 6572 1 131 . 1 1 71 71 ASP H H 1 9.1 0.02 . 1 . . . . 71 ASP H . 6572 1 132 . 1 1 71 71 ASP N N 15 118.84 0.05 . 1 . . . . 71 ASP N . 6572 1 133 . 1 1 72 72 LYS H H 1 8.88 0.02 . 1 . . . . 72 LYS H . 6572 1 134 . 1 1 72 72 LYS N N 15 119.72 0.05 . 1 . . . . 72 LYS N . 6572 1 135 . 1 1 74 74 THR H H 1 6.87 0.02 . 1 . . . . 74 THR H . 6572 1 136 . 1 1 74 74 THR N N 15 107.6 0.05 . 1 . . . . 74 THR N . 6572 1 137 . 1 1 75 75 LYS H H 1 8.47 0.02 . 1 . . . . 75 LYS H . 6572 1 138 . 1 1 75 75 LYS N N 15 122.13 0.05 . 1 . . . . 75 LYS N . 6572 1 139 . 1 1 76 76 PHE H H 1 5.6 0.02 . 1 . . . . 76 PHE H . 6572 1 140 . 1 1 76 76 PHE N N 15 113.35 0.05 . 1 . . . . 76 PHE N . 6572 1 141 . 1 1 77 77 LYS H H 1 8.03 0.02 . 1 . . . . 77 LYS H . 6572 1 142 . 1 1 77 77 LYS N N 15 121.91 0.05 . 1 . . . . 77 LYS N . 6572 1 143 . 1 1 78 78 SER H H 1 7.15 0.02 . 1 . . . . 78 SER H . 6572 1 144 . 1 1 78 78 SER N N 15 115.18 0.05 . 1 . . . . 78 SER N . 6572 1 145 . 1 1 79 79 CYS H H 1 4.91 0.02 . 1 . . . . 79 CYS H . 6572 1 146 . 1 1 79 79 CYS N N 15 114.22 0.05 . 1 . . . . 79 CYS N . 6572 1 147 . 1 1 80 80 VAL H H 1 6.6 0.02 . 1 . . . . 80 VAL H . 6572 1 148 . 1 1 80 80 VAL N N 15 113.05 0.05 . 1 . . . . 80 VAL N . 6572 1 149 . 1 1 81 81 GLY H H 1 7.82 0.02 . 1 . . . . 81 GLY H . 6572 1 150 . 1 1 81 81 GLY N N 15 107.5 0.05 . 1 . . . . 81 GLY N . 6572 1 151 . 1 1 82 82 CYS H H 1 7.25 0.02 . 1 . . . . 82 CYS H . 6572 1 152 . 1 1 82 82 CYS N N 15 117.85 0.05 . 1 . . . . 82 CYS N . 6572 1 153 . 1 1 83 83 HIS H H 1 11.97 0.02 . 1 . . . . 83 HIS H . 6572 1 154 . 1 1 83 83 HIS N N 15 121.39 0.05 . 1 . . . . 83 HIS N . 6572 1 155 . 1 1 84 84 LEU H H 1 9.67 0.02 . 1 . . . . 84 LEU H . 6572 1 156 . 1 1 84 84 LEU N N 15 121.17 0.05 . 1 . . . . 84 LEU N . 6572 1 157 . 1 1 85 85 GLU H H 1 7.26 0.02 . 1 . . . . 85 GLU H . 6572 1 158 . 1 1 85 85 GLU N N 15 119.04 0.05 . 1 . . . . 85 GLU N . 6572 1 159 . 1 1 86 86 THR H H 1 8.43 0.02 . 1 . . . . 86 THR H . 6572 1 160 . 1 1 86 86 THR N N 15 115.85 0.05 . 1 . . . . 86 THR N . 6572 1 161 . 1 1 87 87 ALA H H 1 8.76 0.02 . 1 . . . . 87 ALA H . 6572 1 162 . 1 1 87 87 ALA N N 15 121.76 0.05 . 1 . . . . 87 ALA N . 6572 1 163 . 1 1 88 88 GLY H H 1 7.49 0.02 . 1 . . . . 88 GLY H . 6572 1 164 . 1 1 88 88 GLY N N 15 102.82 0.05 . 1 . . . . 88 GLY N . 6572 1 165 . 1 1 89 89 ALA H H 1 8.66 0.02 . 1 . . . . 89 ALA H . 6572 1 166 . 1 1 89 89 ALA N N 15 126.69 0.05 . 1 . . . . 89 ALA N . 6572 1 167 . 1 1 90 90 ASP H H 1 7.66 0.02 . 1 . . . . 90 ASP H . 6572 1 168 . 1 1 90 90 ASP N N 15 120.44 0.05 . 1 . . . . 90 ASP N . 6572 1 169 . 1 1 91 91 ALA H H 1 8.78 0.02 . 1 . . . . 91 ALA H . 6572 1 170 . 1 1 91 91 ALA N N 15 129.91 0.05 . 1 . . . . 91 ALA N . 6572 1 171 . 1 1 92 92 ALA H H 1 8.2 0.02 . 1 . . . . 92 ALA H . 6572 1 172 . 1 1 92 92 ALA N N 15 121.83 0.05 . 1 . . . . 92 ALA N . 6572 1 173 . 1 1 93 93 LYS H H 1 8.16 0.02 . 1 . . . . 93 LYS H . 6572 1 174 . 1 1 93 93 LYS N N 15 119.52 0.05 . 1 . . . . 93 LYS N . 6572 1 175 . 1 1 94 94 LYS H H 1 8.85 0.02 . 1 . . . . 94 LYS H . 6572 1 176 . 1 1 94 94 LYS N N 15 119.3 0.05 . 1 . . . . 94 LYS N . 6572 1 177 . 1 1 95 95 LYS H H 1 7.97 0.02 . 1 . . . . 95 LYS H . 6572 1 178 . 1 1 95 95 LYS N N 15 123.66 0.05 . 1 . . . . 95 LYS N . 6572 1 179 . 1 1 96 96 GLU H H 1 7.92 0.02 . 1 . . . . 96 GLU H . 6572 1 180 . 1 1 96 96 GLU N N 15 116.06 0.05 . 1 . . . . 96 GLU N . 6572 1 181 . 1 1 97 97 LEU H H 1 8.7 0.02 . 1 . . . . 97 LEU H . 6572 1 182 . 1 1 97 97 LEU N N 15 110.8 0.05 . 1 . . . . 97 LEU N . 6572 1 183 . 1 1 98 98 THR H H 1 8.96 0.02 . 1 . . . . 98 THR H . 6572 1 184 . 1 1 98 98 THR N N 15 108.89 0.05 . 1 . . . . 98 THR N . 6572 1 185 . 1 1 99 99 GLY H H 1 8.25 0.02 . 1 . . . . 99 GLY H . 6572 1 186 . 1 1 99 99 GLY N N 15 109.39 0.05 . 1 . . . . 99 GLY N . 6572 1 187 . 1 1 100 100 CYS H H 1 8.62 0.02 . 1 . . . . 100 CYS H . 6572 1 188 . 1 1 100 100 CYS N N 15 120.82 0.05 . 1 . . . . 100 CYS N . 6572 1 189 . 1 1 101 101 LYS H H 1 7.53 0.02 . 1 . . . . 101 LYS H . 6572 1 190 . 1 1 101 101 LYS N N 15 113.35 0.05 . 1 . . . . 101 LYS N . 6572 1 191 . 1 1 102 102 GLY H H 1 9.23 0.02 . 1 . . . . 102 GLY H . 6572 1 192 . 1 1 102 102 GLY N N 15 114.36 0.05 . 1 . . . . 102 GLY N . 6572 1 193 . 1 1 103 103 SER H H 1 9.15 0.02 . 1 . . . . 103 SER H . 6572 1 194 . 1 1 103 103 SER N N 15 115.38 0.05 . 1 . . . . 103 SER N . 6572 1 195 . 1 1 104 104 LYS H H 1 9.43 0.02 . 1 . . . . 104 LYS H . 6572 1 196 . 1 1 104 104 LYS N N 15 115.18 0.05 . 1 . . . . 104 LYS N . 6572 1 197 . 1 1 105 105 CYS H H 1 7.64 0.02 . 1 . . . . 105 CYS H . 6572 1 198 . 1 1 105 105 CYS N N 15 111.39 0.05 . 1 . . . . 105 CYS N . 6572 1 199 . 1 1 106 106 HIS H H 1 9.51 0.02 . 1 . . . . 106 HIS H . 6572 1 200 . 1 1 106 106 HIS N N 15 117 0.05 . 1 . . . . 106 HIS N . 6572 1 201 . 1 1 107 107 SER H H 1 10.01 0.02 . 1 . . . . 107 SER H . 6572 1 202 . 1 1 107 107 SER N N 15 127.7 0.05 . 1 . . . . 107 SER N . 6572 1 stop_ save_