################################### # 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_chemical_shift_assignment_data_set_one _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_assignment_data_set_one _Assigned_chem_shift_list.Entry_ID 1581 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_condition_set_one _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_par_set_one _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_one . 1581 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 13 13 LYS H H 1 8.1 0.02 . 1 . . . . . . . . 1581 1 2 . 1 1 13 13 LYS N N 15 121.8 0.02 . 1 . . . . . . . . 1581 1 3 . 1 1 14 14 LEU H H 1 8.26 0.02 . 1 . . . . . . . . 1581 1 4 . 1 1 14 14 LEU N N 15 122 0.02 . 1 . . . . . . . . 1581 1 5 . 1 1 15 15 HIS H H 1 8.79 0.02 . 1 . . . . . . . . 1581 1 6 . 1 1 15 15 HIS N N 15 119.1 0.02 . 1 . . . . . . . . 1581 1 7 . 1 1 16 16 LYS H H 1 8.4 0.02 . 1 . . . . . . . . 1581 1 8 . 1 1 16 16 LYS N N 15 123.8 0.02 . 1 . . . . . . . . 1581 1 9 . 1 1 17 17 GLU H H 1 9.36 0.02 . 1 . . . . . . . . 1581 1 10 . 1 1 17 17 GLU N N 15 123 0.02 . 1 . . . . . . . . 1581 1 11 . 1 1 19 19 ALA H H 1 8.08 0.02 . 1 . . . . . . . . 1581 1 12 . 1 1 19 19 ALA N N 15 119.9 0.02 . 1 . . . . . . . . 1581 1 13 . 1 1 20 20 THR H H 1 8.08 0.02 . 1 . . . . . . . . 1581 1 14 . 1 1 20 20 THR N N 15 108.7 0.02 . 1 . . . . . . . . 1581 1 15 . 1 1 21 21 LEU H H 1 9.12 0.02 . 1 . . . . . . . . 1581 1 16 . 1 1 21 21 LEU N N 15 124.9 0.02 . 1 . . . . . . . . 1581 1 17 . 1 1 22 22 ILE H H 1 8.34 0.02 . 1 . . . . . . . . 1581 1 18 . 1 1 22 22 ILE N N 15 124.7 0.02 . 1 . . . . . . . . 1581 1 19 . 1 1 23 23 LYS H H 1 8.04 0.02 . 1 . . . . . . . . 1581 1 20 . 1 1 23 23 LYS N N 15 114.4 0.02 . 1 . . . . . . . . 1581 1 21 . 1 1 24 24 ALA H H 1 9.39 0.02 . 1 . . . . . . . . 1581 1 22 . 1 1 24 24 ALA N N 15 129.2 0.02 . 1 . . . . . . . . 1581 1 23 . 1 1 25 25 ILE H H 1 7.99 0.02 . 1 . . . . . . . . 1581 1 24 . 1 1 25 25 ILE N N 15 124.1 0.02 . 1 . . . . . . . . 1581 1 25 . 1 1 26 26 ASP H H 1 8.54 0.02 . 1 . . . . . . . . 1581 1 26 . 1 1 26 26 ASP N N 15 118.8 0.02 . 1 . . . . . . . . 1581 1 27 . 1 1 27 27 GLY H H 1 8.86 0.02 . 1 . . . . . . . . 1581 1 28 . 1 1 27 27 GLY N N 15 103.7 0.02 . 1 . . . . . . . . 1581 1 29 . 1 1 28 28 ASP H H 1 7.51 0.02 . 1 . . . . . . . . 1581 1 30 . 1 1 28 28 ASP N N 15 111.4 0.02 . 1 . . . . . . . . 1581 1 31 . 1 1 29 29 THR H H 1 7.65 0.02 . 1 . . . . . . . . 1581 1 32 . 1 1 29 29 THR N N 15 117.1 0.02 . 1 . . . . . . . . 1581 1 33 . 1 1 30 30 VAL H H 1 9.12 0.02 . 1 . . . . . . . . 1581 1 34 . 1 1 30 30 VAL N N 15 120.5 0.02 . 1 . . . . . . . . 1581 1 35 . 1 1 31 31 LYS H H 1 9.4 0.02 . 1 . . . . . . . . 1581 1 36 . 1 1 31 31 LYS N N 15 127.2 0.02 . 1 . . . . . . . . 1581 1 37 . 1 1 32 32 LEU H H 1 9.33 0.02 . 1 . . . . . . . . 1581 1 38 . 1 1 32 32 LEU N N 15 127.1 0.02 . 1 . . . . . . . . 1581 1 39 . 1 1 33 33 MET H H 1 9.53 0.02 . 1 . . . . . . . . 1581 1 40 . 1 1 33 33 MET N N 15 122 0.02 . 1 . . . . . . . . 1581 1 41 . 1 1 34 34 TYR H H 1 9.02 0.02 . 1 . . . . . . . . 1581 1 42 . 1 1 34 34 TYR N N 15 129.5 0.02 . 1 . . . . . . . . 1581 1 43 . 1 1 35 35 LYS H H 1 9.27 0.02 . 1 . . . . . . . . 1581 1 44 . 1 1 35 35 LYS N N 15 127.5 0.02 . 1 . . . . . . . . 1581 1 45 . 1 1 36 36 GLY H H 1 8.4 0.02 . 1 . . . . . . . . 1581 1 46 . 1 1 36 36 GLY N N 15 102.3 0.02 . 1 . . . . . . . . 1581 1 47 . 1 1 37 37 GLN H H 1 7.79 0.02 . 1 . . . . . . . . 1581 1 48 . 1 1 37 37 GLN N N 15 119.2 0.02 . 1 . . . . . . . . 1581 1 49 . 1 1 39 39 MET H H 1 9.54 0.02 . 1 . . . . . . . . 1581 1 50 . 1 1 39 39 MET N N 15 125.6 0.02 . 1 . . . . . . . . 1581 1 51 . 1 1 40 40 THR H H 1 8.88 0.02 . 1 . . . . . . . . 1581 1 52 . 1 1 40 40 THR N N 15 123.8 0.02 . 1 . . . . . . . . 1581 1 53 . 1 1 41 41 PHE H H 1 9.7 0.02 . 1 . . . . . . . . 1581 1 54 . 1 1 41 41 PHE N N 15 125.7 0.02 . 1 . . . . . . . . 1581 1 55 . 1 1 42 42 ARG H H 1 9.81 0.02 . 1 . . . . . . . . 1581 1 56 . 1 1 42 42 ARG N N 15 124.5 0.02 . 1 . . . . . . . . 1581 1 57 . 1 1 43 43 LEU H H 1 8.31 0.02 . 1 . . . . . . . . 1581 1 58 . 1 1 43 43 LEU N N 15 124.7 0.02 . 1 . . . . . . . . 1581 1 59 . 1 1 44 44 LEU H H 1 7.43 0.02 . 1 . . . . . . . . 1581 1 60 . 1 1 44 44 LEU N N 15 121.8 0.02 . 1 . . . . . . . . 1581 1 61 . 1 1 45 45 LEU H H 1 9.35 0.02 . 1 . . . . . . . . 1581 1 62 . 1 1 45 45 LEU N N 15 111.4 0.02 . 1 . . . . . . . . 1581 1 63 . 1 1 46 46 VAL H H 1 6.94 0.02 . 1 . . . . . . . . 1581 1 64 . 1 1 46 46 VAL N N 15 103.7 0.02 . 1 . . . . . . . . 1581 1 65 . 1 1 47 47 ASP H H 1 8.86 0.02 . 1 . . . . . . . . 1581 1 66 . 1 1 47 47 ASP N N 15 118.9 0.02 . 1 . . . . . . . . 1581 1 67 . 1 1 48 48 THR H H 1 9.4 0.02 . 1 . . . . . . . . 1581 1 68 . 1 1 48 48 THR N N 15 119.5 0.02 . 1 . . . . . . . . 1581 1 69 . 1 1 52 52 LYS H H 1 8.09 0.02 . 1 . . . . . . . . 1581 1 70 . 1 1 52 52 LYS N N 15 122.9 0.02 . 1 . . . . . . . . 1581 1 71 . 1 1 53 53 HIS H H 1 8.42 0.02 . 1 . . . . . . . . 1581 1 72 . 1 1 53 53 HIS N N 15 124.9 0.02 . 1 . . . . . . . . 1581 1 73 . 1 1 55 55 LYS H H 1 9.21 0.02 . 1 . . . . . . . . 1581 1 74 . 1 1 55 55 LYS N N 15 117.4 0.02 . 1 . . . . . . . . 1581 1 75 . 1 1 56 56 LYS H H 1 8.91 0.02 . 1 . . . . . . . . 1581 1 76 . 1 1 56 56 LYS N N 15 119.4 0.02 . 1 . . . . . . . . 1581 1 77 . 1 1 57 57 GLY H H 1 8.13 0.02 . 1 . . . . . . . . 1581 1 78 . 1 1 57 57 GLY N N 15 109 0.02 . 1 . . . . . . . . 1581 1 79 . 1 1 58 58 VAL H H 1 7.95 0.02 . 1 . . . . . . . . 1581 1 80 . 1 1 58 58 VAL N N 15 122.2 0.02 . 1 . . . . . . . . 1581 1 81 . 1 1 59 59 GLU H H 1 8.21 0.02 . 1 . . . . . . . . 1581 1 82 . 1 1 59 59 GLU N N 15 126.7 0.02 . 1 . . . . . . . . 1581 1 83 . 1 1 60 60 LYS H H 1 8.53 0.02 . 1 . . . . . . . . 1581 1 84 . 1 1 60 60 LYS N N 15 125.5 0.02 . 1 . . . . . . . . 1581 1 85 . 1 1 61 61 TYR H H 1 8.6 0.02 . 1 . . . . . . . . 1581 1 86 . 1 1 61 61 TYR N N 15 115.8 0.02 . 1 . . . . . . . . 1581 1 87 . 1 1 62 62 GLY H H 1 8.81 0.02 . 1 . . . . . . . . 1581 1 88 . 1 1 62 62 GLY N N 15 108.3 0.02 . 1 . . . . . . . . 1581 1 89 . 1 1 65 65 ALA H H 1 8.85 0.02 . 1 . . . . . . . . 1581 1 90 . 1 1 65 65 ALA N N 15 124.1 0.02 . 1 . . . . . . . . 1581 1 91 . 1 1 66 66 SER H H 1 8.28 0.02 . 1 . . . . . . . . 1581 1 92 . 1 1 66 66 SER N N 15 111.6 0.02 . 1 . . . . . . . . 1581 1 93 . 1 1 67 67 ALA H H 1 8.36 0.02 . 1 . . . . . . . . 1581 1 94 . 1 1 67 67 ALA N N 15 122.2 0.02 . 1 . . . . . . . . 1581 1 95 . 1 1 68 68 PHE H H 1 8.07 0.02 . 1 . . . . . . . . 1581 1 96 . 1 1 68 68 PHE N N 15 121.2 0.02 . 1 . . . . . . . . 1581 1 97 . 1 1 69 69 THR H H 1 8.58 0.02 . 1 . . . . . . . . 1581 1 98 . 1 1 69 69 THR N N 15 120.1 0.02 . 1 . . . . . . . . 1581 1 99 . 1 1 70 70 LYS H H 1 8.08 0.02 . 1 . . . . . . . . 1581 1 100 . 1 1 70 70 LYS N N 15 120 0.02 . 1 . . . . . . . . 1581 1 101 . 1 1 71 71 LYS H H 1 7.9 0.02 . 1 . . . . . . . . 1581 1 102 . 1 1 71 71 LYS N N 15 117.1 0.02 . 1 . . . . . . . . 1581 1 103 . 1 1 72 72 MET H H 1 7.62 0.02 . 1 . . . . . . . . 1581 1 104 . 1 1 72 72 MET N N 15 116.1 0.02 . 1 . . . . . . . . 1581 1 105 . 1 1 73 73 VAL H H 1 8.26 0.02 . 1 . . . . . . . . 1581 1 106 . 1 1 73 73 VAL N N 15 107.7 0.02 . 1 . . . . . . . . 1581 1 107 . 1 1 74 74 GLU H H 1 8.76 0.02 . 1 . . . . . . . . 1581 1 108 . 1 1 74 74 GLU N N 15 121 0.02 . 1 . . . . . . . . 1581 1 109 . 1 1 75 75 ASN H H 1 7.31 0.02 . 1 . . . . . . . . 1581 1 110 . 1 1 75 75 ASN N N 15 113.4 0.02 . 1 . . . . . . . . 1581 1 111 . 1 1 76 76 ALA H H 1 6.65 0.02 . 1 . . . . . . . . 1581 1 112 . 1 1 76 76 ALA N N 15 121.2 0.02 . 1 . . . . . . . . 1581 1 113 . 1 1 77 77 LYS H H 1 10.08 0.02 . 1 . . . . . . . . 1581 1 114 . 1 1 77 77 LYS N N 15 125.5 0.02 . 1 . . . . . . . . 1581 1 115 . 1 1 78 78 LYS H H 1 8.85 0.02 . 1 . . . . . . . . 1581 1 116 . 1 1 78 78 LYS N N 15 121.2 0.02 . 1 . . . . . . . . 1581 1 117 . 1 1 79 79 ILE H H 1 8.91 0.02 . 1 . . . . . . . . 1581 1 118 . 1 1 79 79 ILE N N 15 128.8 0.02 . 1 . . . . . . . . 1581 1 119 . 1 1 80 80 GLU H H 1 8.78 0.02 . 1 . . . . . . . . 1581 1 120 . 1 1 80 80 GLU N N 15 123.2 0.02 . 1 . . . . . . . . 1581 1 121 . 1 1 81 81 VAL H H 1 9.51 0.02 . 1 . . . . . . . . 1581 1 122 . 1 1 81 81 VAL N N 15 117 0.02 . 1 . . . . . . . . 1581 1 123 . 1 1 82 82 GLU H H 1 8.82 0.02 . 1 . . . . . . . . 1581 1 124 . 1 1 82 82 GLU N N 15 126.7 0.02 . 1 . . . . . . . . 1581 1 125 . 1 1 83 83 PHE H H 1 8.79 0.02 . 1 . . . . . . . . 1581 1 126 . 1 1 83 83 PHE N N 15 126.4 0.02 . 1 . . . . . . . . 1581 1 127 . 1 1 84 84 ASN H H 1 9.23 0.02 . 1 . . . . . . . . 1581 1 128 . 1 1 84 84 ASN N N 15 123 0.02 . 1 . . . . . . . . 1581 1 129 . 1 1 85 85 LYS H H 1 10.21 0.02 . 1 . . . . . . . . 1581 1 130 . 1 1 85 85 LYS N N 15 119.1 0.02 . 1 . . . . . . . . 1581 1 131 . 1 1 86 86 GLY H H 1 8.63 0.02 . 1 . . . . . . . . 1581 1 132 . 1 1 86 86 GLY N N 15 110.8 0.02 . 1 . . . . . . . . 1581 1 133 . 1 1 87 87 GLN H H 1 8.74 0.02 . 1 . . . . . . . . 1581 1 134 . 1 1 87 87 GLN N N 15 124.8 0.02 . 1 . . . . . . . . 1581 1 135 . 1 1 88 88 ARG H H 1 8.58 0.02 . 1 . . . . . . . . 1581 1 136 . 1 1 88 88 ARG N N 15 120.1 0.02 . 1 . . . . . . . . 1581 1 137 . 1 1 89 89 THR H H 1 7.31 0.02 . 1 . . . . . . . . 1581 1 138 . 1 1 89 89 THR N N 15 107.7 0.02 . 1 . . . . . . . . 1581 1 139 . 1 1 90 90 ASP H H 1 8.78 0.02 . 1 . . . . . . . . 1581 1 140 . 1 1 90 90 ASP N N 15 121.5 0.02 . 1 . . . . . . . . 1581 1 141 . 1 1 91 91 LYS H H 1 7.8 0.02 . 1 . . . . . . . . 1581 1 142 . 1 1 91 91 LYS N N 15 115.9 0.02 . 1 . . . . . . . . 1581 1 143 . 1 1 92 92 TYR H H 1 8.18 0.02 . 1 . . . . . . . . 1581 1 144 . 1 1 92 92 TYR N N 15 120.5 0.02 . 1 . . . . . . . . 1581 1 145 . 1 1 93 93 GLY H H 1 8.21 0.02 . 1 . . . . . . . . 1581 1 146 . 1 1 93 93 GLY N N 15 109.1 0.02 . 1 . . . . . . . . 1581 1 147 . 1 1 94 94 ARG H H 1 8.89 0.02 . 1 . . . . . . . . 1581 1 148 . 1 1 94 94 ARG N N 15 121.5 0.02 . 1 . . . . . . . . 1581 1 149 . 1 1 95 95 GLY H H 1 8.79 0.02 . 1 . . . . . . . . 1581 1 150 . 1 1 95 95 GLY N N 15 108.1 0.02 . 1 . . . . . . . . 1581 1 151 . 1 1 96 96 LEU H H 1 8.24 0.02 . 1 . . . . . . . . 1581 1 152 . 1 1 96 96 LEU N N 15 125.9 0.02 . 1 . . . . . . . . 1581 1 153 . 1 1 97 97 ALA H H 1 7.28 0.02 . 1 . . . . . . . . 1581 1 154 . 1 1 97 97 ALA N N 15 119.8 0.02 . 1 . . . . . . . . 1581 1 155 . 1 1 98 98 TYR H H 1 9.02 0.02 . 1 . . . . . . . . 1581 1 156 . 1 1 98 98 TYR N N 15 122.5 0.02 . 1 . . . . . . . . 1581 1 157 . 1 1 99 99 ILE H H 1 7.81 0.02 . 1 . . . . . . . . 1581 1 158 . 1 1 99 99 ILE N N 15 121.8 0.02 . 1 . . . . . . . . 1581 1 159 . 1 1 100 100 TYR H H 1 9.51 0.02 . 1 . . . . . . . . 1581 1 160 . 1 1 100 100 TYR N N 15 126.2 0.02 . 1 . . . . . . . . 1581 1 161 . 1 1 101 101 ALA H H 1 9.2 0.02 . 1 . . . . . . . . 1581 1 162 . 1 1 101 101 ALA N N 15 125.6 0.02 . 1 . . . . . . . . 1581 1 163 . 1 1 102 102 ASP H H 1 9.68 0.02 . 1 . . . . . . . . 1581 1 164 . 1 1 102 102 ASP N N 15 127.5 0.02 . 1 . . . . . . . . 1581 1 165 . 1 1 103 103 GLY H H 1 9.36 0.02 . 1 . . . . . . . . 1581 1 166 . 1 1 103 103 GLY N N 15 103 0.02 . 1 . . . . . . . . 1581 1 167 . 1 1 104 104 LYS H H 1 7.85 0.02 . 1 . . . . . . . . 1581 1 168 . 1 1 104 104 LYS N N 15 121.2 0.02 . 1 . . . . . . . . 1581 1 169 . 1 1 105 105 MET H H 1 9.2 0.02 . 1 . . . . . . . . 1581 1 170 . 1 1 105 105 MET N N 15 126.5 0.02 . 1 . . . . . . . . 1581 1 171 . 1 1 106 106 VAL H H 1 10.17 0.02 . 1 . . . . . . . . 1581 1 172 . 1 1 106 106 VAL N N 15 136 0.02 . 1 . . . . . . . . 1581 1 173 . 1 1 107 107 ASN H H 1 9.62 0.02 . 1 . . . . . . . . 1581 1 174 . 1 1 107 107 ASN N N 15 108.2 0.02 . 1 . . . . . . . . 1581 1 175 . 1 1 108 108 GLU H H 1 6.15 0.02 . 1 . . . . . . . . 1581 1 176 . 1 1 108 108 GLU N N 15 112.4 0.02 . 1 . . . . . . . . 1581 1 177 . 1 1 109 109 ALA H H 1 7.8 0.02 . 1 . . . . . . . . 1581 1 178 . 1 1 109 109 ALA N N 15 122.8 0.02 . 1 . . . . . . . . 1581 1 179 . 1 1 110 110 LEU H H 1 7.91 0.02 . 1 . . . . . . . . 1581 1 180 . 1 1 110 110 LEU N N 15 115.4 0.02 . 1 . . . . . . . . 1581 1 181 . 1 1 111 111 VAL H H 1 6.84 0.02 . 1 . . . . . . . . 1581 1 182 . 1 1 111 111 VAL N N 15 116.8 0.02 . 1 . . . . . . . . 1581 1 183 . 1 1 112 112 ARG H H 1 9.09 0.02 . 1 . . . . . . . . 1581 1 184 . 1 1 112 112 ARG N N 15 122.4 0.02 . 1 . . . . . . . . 1581 1 185 . 1 1 113 113 GLN H H 1 7.06 0.02 . 1 . . . . . . . . 1581 1 186 . 1 1 113 113 GLN N N 15 111.9 0.02 . 1 . . . . . . . . 1581 1 187 . 1 1 114 114 GLY H H 1 7.99 0.02 . 1 . . . . . . . . 1581 1 188 . 1 1 114 114 GLY N N 15 106.8 0.02 . 1 . . . . . . . . 1581 1 189 . 1 1 115 115 LEU H H 1 7.76 0.02 . 1 . . . . . . . . 1581 1 190 . 1 1 115 115 LEU N N 15 115.1 0.02 . 1 . . . . . . . . 1581 1 191 . 1 1 116 116 ALA H H 1 6.87 0.02 . 1 . . . . . . . . 1581 1 192 . 1 1 116 116 ALA N N 15 113.3 0.02 . 1 . . . . . . . . 1581 1 193 . 1 1 117 117 LYS H H 1 7.51 0.02 . 1 . . . . . . . . 1581 1 194 . 1 1 117 117 LYS N N 15 117.1 0.02 . 1 . . . . . . . . 1581 1 195 . 1 1 118 118 VAL H H 1 9.25 0.02 . 1 . . . . . . . . 1581 1 196 . 1 1 118 118 VAL N N 15 123.8 0.02 . 1 . . . . . . . . 1581 1 197 . 1 1 119 119 ALA H H 1 7.95 0.02 . 1 . . . . . . . . 1581 1 198 . 1 1 119 119 ALA N N 15 131.2 0.02 . 1 . . . . . . . . 1581 1 199 . 1 1 120 120 TYR H H 1 7.81 0.02 . 1 . . . . . . . . 1581 1 200 . 1 1 120 120 TYR N N 15 110.1 0.02 . 1 . . . . . . . . 1581 1 201 . 1 1 121 121 VAL H H 1 7.79 0.02 . 1 . . . . . . . . 1581 1 202 . 1 1 121 121 VAL N N 15 119.2 0.02 . 1 . . . . . . . . 1581 1 203 . 1 1 122 122 TYR H H 1 9.01 0.02 . 1 . . . . . . . . 1581 1 204 . 1 1 122 122 TYR N N 15 130.5 0.02 . 1 . . . . . . . . 1581 1 205 . 1 1 123 123 LYS H H 1 8.69 0.02 . 1 . . . . . . . . 1581 1 206 . 1 1 123 123 LYS N N 15 125.2 0.02 . 1 . . . . . . . . 1581 1 207 . 1 1 125 125 ASN H H 1 8.64 0.02 . 1 . . . . . . . . 1581 1 208 . 1 1 125 125 ASN N N 15 128.6 0.02 . 1 . . . . . . . . 1581 1 209 . 1 1 126 126 ASN H H 1 8.11 0.02 . 1 . . . . . . . . 1581 1 210 . 1 1 126 126 ASN N N 15 117.6 0.02 . 1 . . . . . . . . 1581 1 211 . 1 1 127 127 THR H H 1 10.62 0.02 . 1 . . . . . . . . 1581 1 212 . 1 1 127 127 THR N N 15 124.1 0.02 . 1 . . . . . . . . 1581 1 213 . 1 1 128 128 HIS H H 1 6.79 0.02 . 1 . . . . . . . . 1581 1 214 . 1 1 128 128 HIS N N 15 113 0.02 . 1 . . . . . . . . 1581 1 215 . 1 1 129 129 GLU H H 1 7.51 0.02 . 1 . . . . . . . . 1581 1 216 . 1 1 129 129 GLU N N 15 120.1 0.02 . 1 . . . . . . . . 1581 1 217 . 1 1 130 130 GLN H H 1 8.95 0.02 . 1 . . . . . . . . 1581 1 218 . 1 1 130 130 GLN N N 15 117.3 0.02 . 1 . . . . . . . . 1581 1 219 . 1 1 131 131 HIS H H 1 8.15 0.02 . 1 . . . . . . . . 1581 1 220 . 1 1 131 131 HIS N N 15 119.8 0.02 . 1 . . . . . . . . 1581 1 221 . 1 1 132 132 LEU H H 1 8.04 0.02 . 1 . . . . . . . . 1581 1 222 . 1 1 132 132 LEU N N 15 118.1 0.02 . 1 . . . . . . . . 1581 1 223 . 1 1 133 133 ARG H H 1 8.88 0.02 . 1 . . . . . . . . 1581 1 224 . 1 1 133 133 ARG N N 15 118.5 0.02 . 1 . . . . . . . . 1581 1 225 . 1 1 134 134 LYS H H 1 7.95 0.02 . 1 . . . . . . . . 1581 1 226 . 1 1 134 134 LYS N N 15 122.2 0.02 . 1 . . . . . . . . 1581 1 227 . 1 1 135 135 SER H H 1 7.58 0.02 . 1 . . . . . . . . 1581 1 228 . 1 1 135 135 SER N N 15 117.8 0.02 . 1 . . . . . . . . 1581 1 229 . 1 1 136 136 GLU H H 1 8.42 0.02 . 1 . . . . . . . . 1581 1 230 . 1 1 136 136 GLU N N 15 124.9 0.02 . 1 . . . . . . . . 1581 1 231 . 1 1 137 137 ALA H H 1 7.91 0.02 . 1 . . . . . . . . 1581 1 232 . 1 1 137 137 ALA N N 15 119.4 0.02 . 1 . . . . . . . . 1581 1 233 . 1 1 138 138 GLN H H 1 7.4 0.02 . 1 . . . . . . . . 1581 1 234 . 1 1 138 138 GLN N N 15 118.1 0.02 . 1 . . . . . . . . 1581 1 235 . 1 1 139 139 ALA H H 1 7.82 0.02 . 1 . . . . . . . . 1581 1 236 . 1 1 139 139 ALA N N 15 122.9 0.02 . 1 . . . . . . . . 1581 1 237 . 1 1 140 140 LYS H H 1 8.12 0.02 . 1 . . . . . . . . 1581 1 238 . 1 1 140 140 LYS N N 15 117.1 0.02 . 1 . . . . . . . . 1581 1 239 . 1 1 141 141 LYS H H 1 7.75 0.02 . 1 . . . . . . . . 1581 1 240 . 1 1 141 141 LYS N N 15 122.2 0.02 . 1 . . . . . . . . 1581 1 241 . 1 1 142 142 GLU H H 1 7.59 0.02 . 1 . . . . . . . . 1581 1 242 . 1 1 142 142 GLU N N 15 116.4 0.02 . 1 . . . . . . . . 1581 1 243 . 1 1 143 143 LYS H H 1 7.79 0.02 . 1 . . . . . . . . 1581 1 244 . 1 1 143 143 LYS N N 15 116.5 0.02 . 1 . . . . . . . . 1581 1 245 . 1 1 144 144 LEU H H 1 7.54 0.02 . 1 . . . . . . . . 1581 1 246 . 1 1 144 144 LEU N N 15 116.9 0.02 . 1 . . . . . . . . 1581 1 247 . 1 1 145 145 ASN H H 1 9.02 0.02 . 1 . . . . . . . . 1581 1 248 . 1 1 145 145 ASN N N 15 118.5 0.02 . 1 . . . . . . . . 1581 1 249 . 1 1 146 146 ILE H H 1 8.29 0.02 . 1 . . . . . . . . 1581 1 250 . 1 1 146 146 ILE N N 15 124.2 0.02 . 1 . . . . . . . . 1581 1 251 . 1 1 147 147 TRP H H 1 7.79 0.02 . 1 . . . . . . . . 1581 1 252 . 1 1 147 147 TRP N N 15 119.2 0.02 . 1 . . . . . . . . 1581 1 253 . 1 1 148 148 SER H H 1 8.05 0.02 . 1 . . . . . . . . 1581 1 254 . 1 1 148 148 SER N N 15 116.1 0.02 . 1 . . . . . . . . 1581 1 255 . 1 1 149 149 GLU H H 1 7.87 0.02 . 1 . . . . . . . . 1581 1 256 . 1 1 149 149 GLU N N 15 121.1 0.02 . 1 . . . . . . . . 1581 1 257 . 1 1 150 150 ASN H H 1 8.29 0.02 . 1 . . . . . . . . 1581 1 258 . 1 1 150 150 ASN N N 15 121.2 0.02 . 1 . . . . . . . . 1581 1 259 . 1 1 151 151 ASP H H 1 8.34 0.02 . 1 . . . . . . . . 1581 1 260 . 1 1 151 151 ASP N N 15 119.2 0.02 . 1 . . . . . . . . 1581 1 261 . 1 1 152 152 ALA H H 1 8.18 0.02 . 1 . . . . . . . . 1581 1 262 . 1 1 152 152 ALA N N 15 124 0.02 . 1 . . . . . . . . 1581 1 263 . 1 1 153 153 ASP H H 1 8.29 0.02 . 1 . . . . . . . . 1581 1 264 . 1 1 153 153 ASP N N 15 118.9 0.02 . 1 . . . . . . . . 1581 1 265 . 1 1 154 154 SER H H 1 8.16 0.02 . 1 . . . . . . . . 1581 1 266 . 1 1 154 154 SER N N 15 116.1 0.02 . 1 . . . . . . . . 1581 1 267 . 1 1 155 155 GLY H H 1 8.41 0.02 . 1 . . . . . . . . 1581 1 268 . 1 1 155 155 GLY N N 15 111 0.02 . 1 . . . . . . . . 1581 1 269 . 1 1 156 156 GLN H H 1 7.78 0.02 . 1 . . . . . . . . 1581 1 270 . 1 1 156 156 GLN N N 15 124.5 0.02 . 1 . . . . . . . . 1581 1 stop_ save_