################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 26998 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 3 '2D 1H-15N HSQC' . . . 26998 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 42 42 TYR H H 1 7.828 0.02 . . . . . . 127 TYR HN . 26998 1 2 . 1 1 42 42 TYR N N 15 117.941 0.2 . . . . . . 127 TYR N . 26998 1 3 . 1 1 43 43 MET H H 1 9.115 0.02 . . . . . . 128 MET HN . 26998 1 4 . 1 1 43 43 MET N N 15 121.408 0.2 . . . . . . 128 MET N . 26998 1 5 . 1 1 44 44 LEU H H 1 8.061 0.02 . . . . . . 129 LEU HN . 26998 1 6 . 1 1 44 44 LEU N N 15 121.263 0.2 . . . . . . 129 LEU N . 26998 1 7 . 1 1 45 45 GLY H H 1 9.348 0.02 . . . . . . 130 GLY HN . 26998 1 8 . 1 1 45 45 GLY N N 15 115.023 0.2 . . . . . . 130 GLY N . 26998 1 9 . 1 1 53 53 ILE H H 1 6.971 0.02 . . . . . . 138 ILE HN . 26998 1 10 . 1 1 53 53 ILE N N 15 122.164 0.2 . . . . . . 138 ILE N . 26998 1 11 . 1 1 60 60 GLU H H 1 8.310 0.02 . . . . . . 145 GLU HN . 26998 1 12 . 1 1 60 60 GLU N N 15 119.584 0.2 . . . . . . 145 GLU N . 26998 1 13 . 1 1 61 61 ASP H H 1 7.944 0.02 . . . . . . 146 ASP HN . 26998 1 14 . 1 1 61 61 ASP N N 15 118.209 0.2 . . . . . . 146 ASP N . 26998 1 15 . 1 1 62 62 ARG H H 1 8.049 0.02 . . . . . . 147 ARG HN . 26998 1 16 . 1 1 62 62 ARG N N 15 120.121 0.2 . . . . . . 147 ARG N . 26998 1 17 . 1 1 64 64 TYR H H 1 8.830 0.02 . . . . . . 149 TYR HN . 26998 1 18 . 1 1 64 64 TYR N N 15 119.234 0.2 . . . . . . 149 TYR N . 26998 1 19 . 1 1 65 65 ARG H H 1 7.667 0.02 . . . . . . 150 ARG HN . 26998 1 20 . 1 1 65 65 ARG N N 15 116.768 0.2 . . . . . . 150 ARG N . 26998 1 21 . 1 1 66 66 GLU H H 1 7.959 0.02 . . . . . . 151 GLU HN . 26998 1 22 . 1 1 66 66 GLU N N 15 115.628 0.2 . . . . . . 151 GLU N . 26998 1 23 . 1 1 67 67 ASN H H 1 7.545 0.02 . . . . . . 152 ASN HN . 26998 1 24 . 1 1 67 67 ASN N N 15 115.132 0.2 . . . . . . 152 ASN N . 26998 1 25 . 1 1 68 68 MET H H 1 7.516 0.02 . . . . . . 153 MET HN . 26998 1 26 . 1 1 68 68 MET N N 15 118.660 0.2 . . . . . . 153 MET N . 26998 1 27 . 1 1 70 70 ARG H H 1 7.582 0.02 . . . . . . 155 ARG HN . 26998 1 28 . 1 1 70 70 ARG N N 15 118.821 0.2 . . . . . . 155 ARG N . 26998 1 29 . 1 1 71 71 TYR H H 1 7.376 0.02 . . . . . . 156 TYR HN . 26998 1 30 . 1 1 71 71 TYR N N 15 120.139 0.2 . . . . . . 156 TYR N . 26998 1 31 . 1 1 74 74 GLN H H 1 7.183 0.02 . . . . . . 159 GLN HN . 26998 1 32 . 1 1 74 74 GLN N N 15 114.110 0.2 . . . . . . 159 GLN N . 26998 1 33 . 1 1 75 75 VAL H H 1 8.482 0.02 . . . . . . 160 VAL HN . 26998 1 34 . 1 1 75 75 VAL N N 15 112.659 0.2 . . . . . . 160 VAL N . 26998 1 35 . 1 1 76 76 TYR H H 1 8.461 0.02 . . . . . . 161 TYR HN . 26998 1 36 . 1 1 76 76 TYR N N 15 121.173 0.2 . . . . . . 161 TYR N . 26998 1 37 . 1 1 77 77 TYR H H 1 8.548 0.02 . . . . . . 162 TYR HN . 26998 1 38 . 1 1 77 77 TYR N N 15 111.083 0.2 . . . . . . 162 TYR N . 26998 1 39 . 1 1 78 78 ARG H H 1 7.901 0.02 . . . . . . 163 ARG HN . 26998 1 40 . 1 1 78 78 ARG N N 15 120.395 0.2 . . . . . . 163 ARG N . 26998 1 41 . 1 1 80 80 VAL H H 1 8.561 0.02 . . . . . . 165 VAL HN . 26998 1 42 . 1 1 80 80 VAL N N 15 118.412 0.2 . . . . . . 165 VAL N . 26998 1 43 . 1 1 81 81 ASP H H 1 8.266 0.02 . . . . . . 166 ASP HN . 26998 1 44 . 1 1 81 81 ASP N N 15 117.388 0.2 . . . . . . 166 ASP N . 26998 1 45 . 1 1 82 82 GLN H H 1 8.280 0.02 . . . . . . 167 GLN HN . 26998 1 46 . 1 1 82 82 GLN N N 15 117.874 0.2 . . . . . . 167 GLN N . 26998 1 47 . 1 1 83 83 TYR H H 1 7.870 0.02 . . . . . . 168 TYR HN . 26998 1 48 . 1 1 83 83 TYR N N 15 117.153 0.2 . . . . . . 168 TYR N . 26998 1 49 . 1 1 85 85 ASN H H 1 7.549 0.02 . . . . . . 170 ASN HN . 26998 1 50 . 1 1 85 85 ASN N N 15 113.548 0.2 . . . . . . 170 ASN N . 26998 1 51 . 1 1 87 87 ASN H H 1 8.467 0.02 . . . . . . 172 ASN HN . 26998 1 52 . 1 1 87 87 ASN N N 15 116.968 0.2 . . . . . . 172 ASN N . 26998 1 53 . 1 1 89 89 PHE H H 1 7.102 0.02 . . . . . . 174 PHE HN . 26998 1 54 . 1 1 89 89 PHE N N 15 123.501 0.2 . . . . . . 174 PHE N . 26998 1 55 . 1 1 90 90 VAL H H 1 8.867 0.02 . . . . . . 175 VAL HN . 26998 1 56 . 1 1 90 90 VAL N N 15 120.106 0.2 . . . . . . 175 VAL N . 26998 1 57 . 1 1 92 92 ASP H H 1 7.330 0.02 . . . . . . 177 ASP HN . 26998 1 58 . 1 1 92 92 ASP N N 15 118.412 0.2 . . . . . . 177 ASP N . 26998 1 59 . 1 1 93 93 CYS H H 1 8.106 0.02 . . . . . . 178 CYS HN . 26998 1 60 . 1 1 93 93 CYS N N 15 119.192 0.2 . . . . . . 178 CYS N . 26998 1 61 . 1 1 94 94 VAL H H 1 9.188 0.02 . . . . . . 179 VAL HN . 26998 1 62 . 1 1 94 94 VAL N N 15 124.161 0.2 . . . . . . 179 VAL N . 26998 1 63 . 1 1 95 95 ASN H H 1 7.589 0.02 . . . . . . 180 ASN HN . 26998 1 64 . 1 1 95 95 ASN N N 15 116.666 0.2 . . . . . . 180 ASN N . 26998 1 65 . 1 1 96 96 ILE H H 1 8.664 0.02 . . . . . . 181 ILE HN . 26998 1 66 . 1 1 96 96 ILE N N 15 118.043 0.2 . . . . . . 181 ILE N . 26998 1 67 . 1 1 98 98 VAL H H 1 8.783 0.02 . . . . . . 183 VAL HN . 26998 1 68 . 1 1 98 98 VAL N N 15 120.975 0.2 . . . . . . 183 VAL N . 26998 1 69 . 1 1 99 99 LYS H H 1 7.878 0.02 . . . . . . 184 LYS HN . 26998 1 70 . 1 1 99 99 LYS N N 15 121.624 0.2 . . . . . . 184 LYS N . 26998 1 71 . 1 1 103 103 VAL H H 1 8.057 0.02 . . . . . . 188 VAL HN . 26998 1 72 . 1 1 103 103 VAL N N 15 122.694 0.2 . . . . . . 188 VAL N . 26998 1 73 . 1 1 113 113 THR H H 1 9.626 0.02 . . . . . . 198 THR HN . 26998 1 74 . 1 1 113 113 THR N N 15 115.765 0.2 . . . . . . 198 THR N . 26998 1 75 . 1 1 116 116 ASP H H 1 7.453 0.02 . . . . . . 201 ASP HN . 26998 1 76 . 1 1 116 116 ASP N N 15 119.402 0.2 . . . . . . 201 ASP N . 26998 1 77 . 1 1 118 118 LYS H H 1 7.716 0.02 . . . . . . 203 LYS HN . 26998 1 78 . 1 1 118 118 LYS N N 15 119.313 0.2 . . . . . . 203 LYS N . 26998 1 79 . 1 1 119 119 ILE H H 1 7.967 0.02 . . . . . . 204 ILE HN . 26998 1 80 . 1 1 119 119 ILE N N 15 119.648 0.2 . . . . . . 204 ILE N . 26998 1 81 . 1 1 120 120 MET H H 1 8.791 0.02 . . . . . . 205 MET HN . 26998 1 82 . 1 1 120 120 MET N N 15 119.194 0.2 . . . . . . 205 MET N . 26998 1 83 . 1 1 121 121 GLU H H 1 8.534 0.02 . . . . . . 206 GLU HN . 26998 1 84 . 1 1 121 121 GLU N N 15 117.196 0.2 . . . . . . 206 GLU N . 26998 1 85 . 1 1 122 122 ARG H H 1 7.168 0.02 . . . . . . 207 ARG HN . 26998 1 86 . 1 1 122 122 ARG N N 15 117.938 0.2 . . . . . . 207 ARG N . 26998 1 87 . 1 1 123 123 VAL H H 1 8.251 0.02 . . . . . . 208 VAL HN . 26998 1 88 . 1 1 123 123 VAL N N 15 120.382 0.2 . . . . . . 208 VAL N . 26998 1 89 . 1 1 124 124 VAL H H 1 9.024 0.02 . . . . . . 209 VAL HN . 26998 1 90 . 1 1 124 124 VAL N N 15 119.339 0.2 . . . . . . 209 VAL N . 26998 1 91 . 1 1 125 125 GLU H H 1 8.101 0.02 . . . . . . 210 GLU HN . 26998 1 92 . 1 1 125 125 GLU N N 15 121.221 0.2 . . . . . . 210 GLU N . 26998 1 93 . 1 1 126 126 GLN H H 1 7.121 0.02 . . . . . . 211 GLN HN . 26998 1 94 . 1 1 126 126 GLN N N 15 114.782 0.2 . . . . . . 211 GLN N . 26998 1 95 . 1 1 127 127 MET H H 1 7.917 0.02 . . . . . . 212 MET HN . 26998 1 96 . 1 1 127 127 MET N N 15 119.426 0.2 . . . . . . 212 MET N . 26998 1 97 . 1 1 128 128 CYS H H 1 9.224 0.02 . . . . . . 213 CYS HN . 26998 1 98 . 1 1 128 128 CYS N N 15 118.960 0.2 . . . . . . 213 CYS N . 26998 1 99 . 1 1 129 129 ILE H H 1 8.319 0.02 . . . . . . 214 ILE HN . 26998 1 100 . 1 1 129 129 ILE N N 15 123.579 0.2 . . . . . . 214 ILE N . 26998 1 101 . 1 1 131 131 GLN H H 1 8.694 0.02 . . . . . . 216 GLN HN . 26998 1 102 . 1 1 131 131 GLN N N 15 122.497 0.2 . . . . . . 216 GLN N . 26998 1 103 . 1 1 132 132 TYR H H 1 8.466 0.02 . . . . . . 217 TYR HN . 26998 1 104 . 1 1 132 132 TYR N N 15 119.822 0.2 . . . . . . 217 TYR N . 26998 1 stop_ save_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 26998 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '3D CBCA(CO)NH' . . . 26998 2 2 '3D HNCACB' . . . 26998 2 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 60 60 GLU H H 1 8.302 0.02 . . . . . . 145 GLU HN . 26998 2 2 . 1 1 60 60 GLU N N 15 119.727 0.2 . . . . . . 145 GLU N . 26998 2 3 . 1 1 64 64 TYR H H 1 8.832 0.02 . . . . . . 149 TYR HN . 26998 2 4 . 1 1 64 64 TYR N N 15 119.392 0.2 . . . . . . 149 TYR N . 26998 2 5 . 1 1 66 66 GLU H H 1 7.952 0.02 . . . . . . 151 GLU HN . 26998 2 6 . 1 1 66 66 GLU N N 15 115.707 0.2 . . . . . . 151 GLU N . 26998 2 7 . 1 1 67 67 ASN H H 1 7.529 0.02 . . . . . . 152 ASN HN . 26998 2 8 . 1 1 67 67 ASN N N 15 115.044 0.2 . . . . . . 152 ASN N . 26998 2 9 . 1 1 71 71 TYR H H 1 7.412 0.02 . . . . . . 156 TYR HN . 26998 2 10 . 1 1 71 71 TYR N N 15 120.678 0.2 . . . . . . 156 TYR N . 26998 2 11 . 1 1 75 75 VAL H H 1 8.471 0.02 . . . . . . 160 VAL HN . 26998 2 12 . 1 1 75 75 VAL N N 15 112.673 0.2 . . . . . . 160 VAL N . 26998 2 13 . 1 1 76 76 TYR H H 1 8.433 0.02 . . . . . . 161 TYR HN . 26998 2 14 . 1 1 76 76 TYR N N 15 121.291 0.2 . . . . . . 161 TYR N . 26998 2 15 . 1 1 77 77 TYR H H 1 8.537 0.02 . . . . . . 162 TYR HN . 26998 2 16 . 1 1 77 77 TYR N N 15 111.187 0.2 . . . . . . 162 TYR N . 26998 2 17 . 1 1 78 78 ARG H H 1 7.878 0.02 . . . . . . 163 ARG HN . 26998 2 18 . 1 1 78 78 ARG N N 15 120.357 0.2 . . . . . . 163 ARG N . 26998 2 19 . 1 1 80 80 VAL H H 1 8.561 0.02 . . . . . . 165 VAL HN . 26998 2 20 . 1 1 80 80 VAL N N 15 118.412 0.2 . . . . . . 165 VAL N . 26998 2 21 . 1 1 92 92 ASP H H 1 7.241 0.02 . . . . . . 177 ASP HN . 26998 2 22 . 1 1 92 92 ASP N N 15 117.922 0.2 . . . . . . 177 ASP N . 26998 2 23 . 1 1 93 93 CYS H H 1 8.085 0.02 . . . . . . 178 CYS HN . 26998 2 24 . 1 1 93 93 CYS N N 15 118.954 0.2 . . . . . . 178 CYS N . 26998 2 25 . 1 1 94 94 VAL H H 1 9.281 0.02 . . . . . . 179 VAL HN . 26998 2 26 . 1 1 94 94 VAL N N 15 124.399 0.2 . . . . . . 179 VAL N . 26998 2 27 . 1 1 95 95 ASN H H 1 7.608 0.02 . . . . . . 180 ASN HN . 26998 2 28 . 1 1 95 95 ASN N N 15 116.682 0.2 . . . . . . 180 ASN N . 26998 2 29 . 1 1 96 96 ILE H H 1 8.677 0.02 . . . . . . 181 ILE HN . 26998 2 30 . 1 1 96 96 ILE N N 15 118.091 0.2 . . . . . . 181 ILE N . 26998 2 31 . 1 1 97 97 THR H H 1 8.106 0.02 . . . . . . 182 THR HN . 26998 2 32 . 1 1 97 97 THR N N 15 118.049 0.2 . . . . . . 182 THR N . 26998 2 33 . 1 1 98 98 VAL H H 1 8.777 0.02 . . . . . . 183 VAL HN . 26998 2 34 . 1 1 98 98 VAL N N 15 121.118 0.2 . . . . . . 183 VAL N . 26998 2 35 . 1 1 99 99 LYS H H 1 7.886 0.02 . . . . . . 184 LYS HN . 26998 2 36 . 1 1 99 99 LYS N N 15 121.773 0.2 . . . . . . 184 LYS N . 26998 2 37 . 1 1 118 118 LYS H H 1 7.698 0.02 . . . . . . 203 LYS HN . 26998 2 38 . 1 1 118 118 LYS N N 15 119.078 0.2 . . . . . . 203 LYS N . 26998 2 39 . 1 1 119 119 ILE H H 1 7.953 0.02 . . . . . . 204 ILE HN . 26998 2 40 . 1 1 119 119 ILE N N 15 119.505 0.2 . . . . . . 204 ILE N . 26998 2 41 . 1 1 120 120 MET H H 1 8.748 0.02 . . . . . . 205 MET HN . 26998 2 42 . 1 1 120 120 MET N N 15 119.226 0.2 . . . . . . 205 MET N . 26998 2 43 . 1 1 121 121 GLU H H 1 8.574 0.02 . . . . . . 206 GLU HN . 26998 2 44 . 1 1 121 121 GLU N N 15 117.354 0.2 . . . . . . 206 GLU N . 26998 2 45 . 1 1 122 122 ARG H H 1 7.155 0.02 . . . . . . 207 ARG HN . 26998 2 46 . 1 1 122 122 ARG N N 15 117.938 0.2 . . . . . . 207 ARG N . 26998 2 47 . 1 1 123 123 VAL H H 1 8.251 0.02 . . . . . . 208 VAL HN . 26998 2 48 . 1 1 123 123 VAL N N 15 120.382 0.2 . . . . . . 208 VAL N . 26998 2 49 . 1 1 124 124 VAL H H 1 9.055 0.02 . . . . . . 209 VAL HN . 26998 2 50 . 1 1 124 124 VAL N N 15 119.651 0.2 . . . . . . 209 VAL N . 26998 2 51 . 1 1 125 125 GLU H H 1 8.113 0.02 . . . . . . 210 GLU HN . 26998 2 52 . 1 1 125 125 GLU N N 15 121.412 0.2 . . . . . . 210 GLU N . 26998 2 53 . 1 1 126 126 GLN H H 1 7.064 0.02 . . . . . . 211 GLN HN . 26998 2 54 . 1 1 126 126 GLN N N 15 114.656 0.2 . . . . . . 211 GLN N . 26998 2 55 . 1 1 127 127 MET H H 1 7.885 0.02 . . . . . . 212 MET HN . 26998 2 56 . 1 1 127 127 MET N N 15 119.537 0.2 . . . . . . 212 MET N . 26998 2 57 . 1 1 128 128 CYS H H 1 9.245 0.02 . . . . . . 213 CYS HN . 26998 2 58 . 1 1 128 128 CYS N N 15 119.159 0.2 . . . . . . 213 CYS N . 26998 2 59 . 1 1 129 129 ILE H H 1 8.348 0.02 . . . . . . 214 ILE HN . 26998 2 60 . 1 1 129 129 ILE N N 15 123.650 0.2 . . . . . . 214 ILE N . 26998 2 61 . 1 1 130 130 THR H H 1 8.060 0.02 . . . . . . 215 THR HN . 26998 2 62 . 1 1 130 130 THR N N 15 118.255 0.2 . . . . . . 215 THR N . 26998 2 63 . 1 1 131 131 GLN H H 1 8.657 0.02 . . . . . . 216 GLN HN . 26998 2 64 . 1 1 131 131 GLN N N 15 122.622 0.2 . . . . . . 216 GLN N . 26998 2 65 . 1 1 132 132 TYR H H 1 8.492 0.02 . . . . . . 217 TYR HN . 26998 2 66 . 1 1 132 132 TYR N N 15 119.955 0.2 . . . . . . 217 TYR N . 26998 2 stop_ save_