################################### # 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 26588 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 26588 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 1 1 LEU H H 1 8.254 0.000 . 1 . . . . 171 Leu H . 26588 1 2 . 1 1 1 1 LEU N N 15 120.224 0.000 . 1 . . . . 171 Leu N . 26588 1 3 . 1 1 7 7 GLN H H 1 8.256 0.000 . 1 . . . . 177 Gln H . 26588 1 4 . 1 1 7 7 GLN N N 15 118.412 0.000 . 1 . . . . 177 Gln N . 26588 1 5 . 1 1 8 8 GLN H H 1 7.953 0.000 . 1 . . . . 178 Gln H . 26588 1 6 . 1 1 8 8 GLN N N 15 120.461 0.000 . 1 . . . . 178 Gln N . 26588 1 7 . 1 1 9 9 LEU H H 1 7.821 0.000 . 1 . . . . 179 Leu H . 26588 1 8 . 1 1 9 9 LEU N N 15 120.524 0.000 . 1 . . . . 179 Leu N . 26588 1 9 . 1 1 10 10 SER H H 1 7.933 0.000 . 1 . . . . 180 Ser H . 26588 1 10 . 1 1 10 10 SER N N 15 112.537 0.000 . 1 . . . . 180 Ser N . 26588 1 11 . 1 1 11 11 SER H H 1 7.650 0.000 . 1 . . . . 181 Ser H . 26588 1 12 . 1 1 11 11 SER N N 15 115.576 0.000 . 1 . . . . 181 Ser N . 26588 1 13 . 1 1 12 12 ASN H H 1 8.138 0.000 . 1 . . . . 182 Asn H . 26588 1 14 . 1 1 12 12 ASN N N 15 120.250 0.000 . 1 . . . . 182 Asn N . 26588 1 15 . 1 1 13 13 LEU H H 1 8.009 0.000 . 1 . . . . 183 Leu H . 26588 1 16 . 1 1 13 13 LEU N N 15 123.170 0.000 . 1 . . . . 183 Leu N . 26588 1 17 . 1 1 14 14 TRP H H 1 8.135 0.000 . 1 . . . . 184 Trp H . 26588 1 18 . 1 1 14 14 TRP HE1 H 1 10.181 0.000 . 1 . . . . 184 Trp HE1 . 26588 1 19 . 1 1 14 14 TRP N N 15 117.305 0.000 . 1 . . . . 184 Trp N . 26588 1 20 . 1 1 14 14 TRP NE1 N 15 128.720 0.000 . 1 . . . . 184 Trp NE1 . 26588 1 21 . 1 1 15 15 ALA H H 1 7.969 0.000 . 1 . . . . 185 Ala H . 26588 1 22 . 1 1 15 15 ALA N N 15 120.663 0.000 . 1 . . . . 185 Ala N . 26588 1 23 . 1 1 16 16 ALA H H 1 7.706 0.000 . 1 . . . . 186 Ala H . 26588 1 24 . 1 1 16 16 ALA N N 15 122.265 0.000 . 1 . . . . 186 Ala N . 26588 1 25 . 1 1 17 17 VAL H H 1 8.136 0.000 . 1 . . . . 187 Val H . 26588 1 26 . 1 1 17 17 VAL N N 15 118.860 0.000 . 1 . . . . 187 Val N . 26588 1 27 . 1 1 18 18 ARG H H 1 8.520 0.000 . 1 . . . . 188 Arg H . 26588 1 28 . 1 1 18 18 ARG N N 15 120.328 0.000 . 1 . . . . 188 Arg N . 26588 1 29 . 1 1 19 19 ALA H H 1 8.117 0.000 . 1 . . . . 189 Ala H . 26588 1 30 . 1 1 19 19 ALA N N 15 122.257 0.000 . 1 . . . . 189 Ala N . 26588 1 31 . 1 1 20 20 ARG H H 1 7.075 0.000 . 1 . . . . 190 Arg H . 26588 1 32 . 1 1 20 20 ARG N N 15 114.675 0.000 . 1 . . . . 190 Arg N . 26588 1 33 . 1 1 21 21 GLY H H 1 8.125 0.000 . 1 . . . . 191 Gly H . 26588 1 34 . 1 1 21 21 GLY N N 15 109.422 0.000 . 1 . . . . 191 Gly N . 26588 1 35 . 1 1 22 22 CYS H H 1 6.992 0.000 . 1 . . . . 192 Cys H . 26588 1 36 . 1 1 22 22 CYS N N 15 113.098 0.000 . 1 . . . . 192 Cys N . 26588 1 37 . 1 1 23 23 GLN H H 1 6.407 0.000 . 1 . . . . 193 Gln H . 26588 1 38 . 1 1 23 23 GLN N N 15 115.056 0.000 . 1 . . . . 193 Gln N . 26588 1 39 . 1 1 24 24 PHE H H 1 8.066 0.000 . 1 . . . . 194 Phe H . 26588 1 40 . 1 1 24 24 PHE N N 15 120.581 0.000 . 1 . . . . 194 Phe N . 26588 1 41 . 1 1 25 25 LEU H H 1 8.372 0.000 . 1 . . . . 195 Leu H . 26588 1 42 . 1 1 25 25 LEU N N 15 127.682 0.000 . 1 . . . . 195 Leu N . 26588 1 43 . 1 1 28 28 ALA H H 1 8.065 0.000 . 1 . . . . 198 Ala H . 26588 1 44 . 1 1 28 28 ALA N N 15 119.289 0.000 . 1 . . . . 198 Ala N . 26588 1 45 . 1 1 29 29 MET H H 1 8.245 0.000 . 1 . . . . 199 Met H . 26588 1 46 . 1 1 29 29 MET N N 15 118.235 0.000 . 1 . . . . 199 Met N . 26588 1 47 . 1 1 30 30 GLN H H 1 8.358 0.000 . 1 . . . . 200 Gln H . 26588 1 48 . 1 1 30 30 GLN N N 15 118.155 0.000 . 1 . . . . 200 Gln N . 26588 1 49 . 1 1 31 31 GLU H H 1 7.117 0.000 . 1 . . . . 201 Glu H . 26588 1 50 . 1 1 31 31 GLU N N 15 115.072 0.000 . 1 . . . . 201 Glu N . 26588 1 51 . 1 1 32 32 GLU H H 1 7.514 0.000 . 1 . . . . 202 Glu H . 26588 1 52 . 1 1 32 32 GLU N N 15 116.306 0.000 . 1 . . . . 202 Glu N . 26588 1 53 . 1 1 33 33 ALA H H 1 8.472 0.000 . 1 . . . . 203 Ala H . 26588 1 54 . 1 1 33 33 ALA N N 15 120.166 0.000 . 1 . . . . 203 Ala N . 26588 1 55 . 1 1 34 34 LEU H H 1 8.171 0.000 . 1 . . . . 204 Leu H . 26588 1 56 . 1 1 34 34 LEU N N 15 116.335 0.000 . 1 . . . . 204 Leu N . 26588 1 57 . 1 1 35 35 LYS H H 1 8.391 0.000 . 1 . . . . 205 Lys H . 26588 1 58 . 1 1 36 36 LEU H H 1 7.841 0.000 . 1 . . . . 206 Leu H . 26588 1 59 . 1 1 36 36 LEU N N 15 121.803 0.000 . 1 . . . . 206 Leu N . 26588 1 60 . 1 1 37 37 VAL H H 1 8.027 0.000 . 1 . . . . 207 Val H . 26588 1 61 . 1 1 37 37 VAL N N 15 121.719 0.000 . 1 . . . . 207 Val N . 26588 1 62 . 1 1 38 38 LEU H H 1 7.702 0.000 . 1 . . . . 208 Leu H . 26588 1 63 . 1 1 38 38 LEU N N 15 117.485 0.000 . 1 . . . . 208 Leu N . 26588 1 64 . 1 1 39 39 LEU H H 1 8.071 0.000 . 1 . . . . 209 Leu H . 26588 1 65 . 1 1 39 39 LEU N N 15 119.922 0.000 . 1 . . . . 209 Leu N . 26588 1 66 . 1 1 40 40 ALA H H 1 7.576 0.000 . 1 . . . . 210 Ala H . 26588 1 67 . 1 1 40 40 ALA N N 15 118.484 0.000 . 1 . . . . 210 Ala N . 26588 1 68 . 1 1 41 41 LEU H H 1 7.305 0.000 . 1 . . . . 211 Leu H . 26588 1 69 . 1 1 41 41 LEU N N 15 111.111 0.000 . 1 . . . . 211 Leu N . 26588 1 70 . 1 1 42 42 GLU H H 1 9.520 0.000 . 1 . . . . 212 Glu H . 26588 1 71 . 1 1 42 42 GLU N N 15 124.461 0.000 . 1 . . . . 212 Glu N . 26588 1 72 . 1 1 43 43 ASP H H 1 8.235 0.000 . 1 . . . . 213 Asp H . 26588 1 73 . 1 1 43 43 ASP N N 15 117.257 0.000 . 1 . . . . 213 Asp N . 26588 1 74 . 1 1 44 44 GLY H H 1 8.012 0.000 . 1 . . . . 214 Gly H . 26588 1 75 . 1 1 44 44 GLY N N 15 106.660 0.000 . 1 . . . . 214 Gly N . 26588 1 76 . 1 1 45 45 SER H H 1 7.991 0.000 . 1 . . . . 215 Ser H . 26588 1 77 . 1 1 45 45 SER N N 15 118.262 0.000 . 1 . . . . 215 Ser N . 26588 1 78 . 1 1 46 46 ALA H H 1 8.211 0.000 . 1 . . . . 216 Ala H . 26588 1 79 . 1 1 46 46 ALA N N 15 124.374 0.000 . 1 . . . . 216 Ala N . 26588 1 80 . 1 1 47 47 LEU H H 1 8.224 0.000 . 1 . . . . 217 Leu H . 26588 1 81 . 1 1 47 47 LEU N N 15 121.529 0.000 . 1 . . . . 217 Leu N . 26588 1 82 . 1 1 48 48 SER H H 1 8.440 0.000 . 1 . . . . 218 Ser H . 26588 1 83 . 1 1 48 48 SER N N 15 117.841 0.000 . 1 . . . . 218 Ser N . 26588 1 84 . 1 1 49 49 ARG H H 1 9.088 0.000 . 1 . . . . 219 Arg H . 26588 1 85 . 1 1 50 50 LYS H H 1 8.691 0.000 . 1 . . . . 220 Lys H . 26588 1 86 . 1 1 51 51 VAL H H 1 7.349 0.000 . 1 . . . . 221 Val H . 26588 1 87 . 1 1 52 52 LEU H H 1 8.588 0.000 . 1 . . . . 222 Leu H . 26588 1 88 . 1 1 53 53 VAL H H 1 8.719 0.000 . 1 . . . . 223 Val H . 26588 1 89 . 1 1 53 53 VAL N N 15 116.540 0.000 . 1 . . . . 223 Val N . 26588 1 90 . 1 1 54 54 LEU H H 1 7.666 0.000 . 1 . . . . 224 Leu H . 26588 1 91 . 1 1 56 56 VAL H H 1 7.854 0.000 . 1 . . . . 226 Val H . 26588 1 92 . 1 1 56 56 VAL N N 15 117.327 0.000 . 1 . . . . 226 Val N . 26588 1 93 . 1 1 57 57 VAL H H 1 9.005 0.000 . 1 . . . . 227 Val H . 26588 1 94 . 1 1 57 57 VAL N N 15 119.063 0.000 . 1 . . . . 227 Val N . 26588 1 95 . 1 1 58 58 GLN H H 1 8.366 0.000 . 1 . . . . 228 Gln H . 26588 1 96 . 1 1 58 58 GLN N N 15 114.852 0.000 . 1 . . . . 228 Gln N . 26588 1 97 . 1 1 59 59 ARG H H 1 6.901 0.000 . 1 . . . . 229 Arg H . 26588 1 98 . 1 1 59 59 ARG N N 15 114.920 0.000 . 1 . . . . 229 Arg N . 26588 1 99 . 1 1 60 60 LEU H H 1 8.256 0.000 . 1 . . . . 230 Leu H . 26588 1 100 . 1 1 60 60 LEU N N 15 121.661 0.000 . 1 . . . . 230 Leu N . 26588 1 101 . 1 1 61 61 GLU H H 1 8.045 0.000 . 1 . . . . 231 Glu H . 26588 1 102 . 1 1 61 61 GLU N N 15 120.044 0.000 . 1 . . . . 231 Glu N . 26588 1 103 . 1 1 63 63 ARG H H 1 7.205 0.000 . 1 . . . . 233 Arg H . 26588 1 104 . 1 1 63 63 ARG N N 15 112.815 0.000 . 1 . . . . 233 Arg N . 26588 1 105 . 1 1 64 64 PHE H H 1 8.213 0.000 . 1 . . . . 234 Phe H . 26588 1 106 . 1 1 64 64 PHE N N 15 117.652 0.000 . 1 . . . . 234 Phe N . 26588 1 107 . 1 1 66 66 GLN H H 1 9.008 0.000 . 1 . . . . 236 Gln H . 26588 1 108 . 1 1 66 66 GLN N N 15 115.639 0.000 . 1 . . . . 236 Gln N . 26588 1 109 . 1 1 67 67 ALA H H 1 8.173 0.000 . 1 . . . . 237 Ala H . 26588 1 110 . 1 1 67 67 ALA N N 15 125.189 0.000 . 1 . . . . 237 Ala N . 26588 1 111 . 1 1 68 68 SER H H 1 7.415 0.000 . 1 . . . . 238 Ser H . 26588 1 112 . 1 1 68 68 SER N N 15 114.236 0.000 . 1 . . . . 238 Ser N . 26588 1 113 . 1 1 69 69 LYS H H 1 9.174 0.000 . 1 . . . . 239 Lys H . 26588 1 114 . 1 1 69 69 LYS N N 15 120.868 0.000 . 1 . . . . 239 Lys N . 26588 1 115 . 1 1 70 70 THR H H 1 9.046 0.000 . 1 . . . . 240 Thr H . 26588 1 116 . 1 1 70 70 THR N N 15 118.173 0.000 . 1 . . . . 240 Thr N . 26588 1 117 . 1 1 71 71 SER H H 1 8.155 0.000 . 1 . . . . 241 Ser H . 26588 1 118 . 1 1 71 71 SER N N 15 118.783 0.000 . 1 . . . . 241 Ser N . 26588 1 119 . 1 1 72 72 ILE H H 1 8.225 0.000 . 1 . . . . 242 Ile H . 26588 1 120 . 1 1 72 72 ILE N N 15 120.511 0.000 . 1 . . . . 242 Ile N . 26588 1 121 . 1 1 73 73 GLY H H 1 8.443 0.000 . 1 . . . . 243 Gly H . 26588 1 122 . 1 1 73 73 GLY N N 15 110.888 0.000 . 1 . . . . 243 Gly N . 26588 1 123 . 1 1 75 75 VAL H H 1 7.659 0.000 . 1 . . . . 245 Val H . 26588 1 124 . 1 1 75 75 VAL N N 15 122.246 0.000 . 1 . . . . 245 Val N . 26588 1 125 . 1 1 76 76 VAL H H 1 8.310 0.000 . 1 . . . . 246 Val H . 26588 1 126 . 1 1 76 76 VAL N N 15 119.268 0.000 . 1 . . . . 246 Val N . 26588 1 127 . 1 1 77 77 GLN H H 1 8.127 0.000 . 1 . . . . 247 Gln H . 26588 1 128 . 1 1 77 77 GLN N N 15 119.020 0.000 . 1 . . . . 247 Gln N . 26588 1 129 . 1 1 78 78 LEU H H 1 7.590 0.000 . 1 . . . . 248 Leu H . 26588 1 130 . 1 1 78 78 LEU N N 15 121.930 0.000 . 1 . . . . 248 Leu N . 26588 1 131 . 1 1 79 79 LEU H H 1 7.195 0.000 . 1 . . . . 249 Leu H . 26588 1 132 . 1 1 79 79 LEU N N 15 115.398 0.000 . 1 . . . . 249 Leu N . 26588 1 133 . 1 1 80 80 TYR H H 1 8.446 0.000 . 1 . . . . 250 Tyr H . 26588 1 134 . 1 1 81 81 ARG H H 1 9.123 0.000 . 1 . . . . 251 Arg H . 26588 1 135 . 1 1 82 82 ALA H H 1 7.254 0.000 . 1 . . . . 252 Ala H . 26588 1 136 . 1 1 82 82 ALA N N 15 116.781 0.000 . 1 . . . . 252 Ala N . 26588 1 137 . 1 1 83 83 SER H H 1 7.753 0.000 . 1 . . . . 253 Ser H . 26588 1 138 . 1 1 84 84 CYS H H 1 7.663 0.000 . 1 . . . . 254 Cys H . 26588 1 139 . 1 1 85 85 PHE H H 1 8.501 0.000 . 1 . . . . 255 Phe H . 26588 1 140 . 1 1 85 85 PHE N N 15 113.631 0.000 . 1 . . . . 255 Phe N . 26588 1 141 . 1 1 86 86 LYS H H 1 9.405 0.000 . 1 . . . . 256 Lys H . 26588 1 142 . 1 1 86 86 LYS N N 15 121.854 0.000 . 1 . . . . 256 Lys N . 26588 1 143 . 1 1 87 87 VAL H H 1 8.967 0.000 . 1 . . . . 257 Val H . 26588 1 144 . 1 1 87 87 VAL N N 15 130.762 0.000 . 1 . . . . 257 Val N . 26588 1 145 . 1 1 88 88 THR H H 1 9.089 0.000 . 1 . . . . 258 Thr H . 26588 1 146 . 1 1 88 88 THR N N 15 125.560 0.000 . 1 . . . . 258 Thr N . 26588 1 147 . 1 1 89 89 LYS H H 1 8.635 0.000 . 1 . . . . 259 Lys H . 26588 1 148 . 1 1 89 89 LYS N N 15 127.082 0.000 . 1 . . . . 259 Lys N . 26588 1 149 . 1 1 90 90 ARG H H 1 8.708 0.000 . 1 . . . . 260 Arg H . 26588 1 150 . 1 1 91 91 ASP H H 1 8.346 0.000 . 1 . . . . 261 Asp H . 26588 1 151 . 1 1 91 91 ASP N N 15 121.125 0.000 . 1 . . . . 261 Asp N . 26588 1 152 . 1 1 92 92 GLU H H 1 8.715 0.000 . 1 . . . . 262 Glu H . 26588 1 153 . 1 1 93 93 ASP H H 1 7.516 0.000 . 1 . . . . 263 Asp H . 26588 1 154 . 1 1 94 94 SER H H 1 9.211 0.000 . 1 . . . . 264 Ser H . 26588 1 155 . 1 1 95 95 SER H H 1 7.647 0.000 . 1 . . . . 265 Ser H . 26588 1 156 . 1 1 95 95 SER N N 15 119.738 0.000 . 1 . . . . 265 Ser N . 26588 1 157 . 1 1 96 96 LEU H H 1 8.447 0.000 . 1 . . . . 266 Leu H . 26588 1 158 . 1 1 97 97 MET H H 1 8.588 0.000 . 1 . . . . 267 Met H . 26588 1 159 . 1 1 97 97 MET N N 15 118.134 0.000 . 1 . . . . 267 Met N . 26588 1 160 . 1 1 98 98 GLN H H 1 8.264 0.000 . 1 . . . . 268 Gln H . 26588 1 161 . 1 1 98 98 GLN N N 15 118.605 0.000 . 1 . . . . 268 Gln N . 26588 1 162 . 1 1 99 99 LEU H H 1 9.763 0.000 . 1 . . . . 269 Leu H . 26588 1 163 . 1 1 99 99 LEU N N 15 126.220 0.000 . 1 . . . . 269 Leu N . 26588 1 164 . 1 1 100 100 LYS H H 1 8.616 0.000 . 1 . . . . 270 Lys H . 26588 1 165 . 1 1 100 100 LYS N N 15 126.929 0.000 . 1 . . . . 270 Lys N . 26588 1 166 . 1 1 101 101 GLU H H 1 9.197 0.000 . 1 . . . . 271 Glu H . 26588 1 167 . 1 1 101 101 GLU N N 15 122.576 0.000 . 1 . . . . 271 Glu N . 26588 1 168 . 1 1 102 102 GLU H H 1 9.694 0.000 . 1 . . . . 272 Glu H . 26588 1 169 . 1 1 102 102 GLU N N 15 116.370 0.000 . 1 . . . . 272 Glu N . 26588 1 170 . 1 1 103 103 PHE H H 1 7.809 0.000 . 1 . . . . 273 Phe H . 26588 1 171 . 1 1 103 103 PHE N N 15 118.851 0.000 . 1 . . . . 273 Phe N . 26588 1 172 . 1 1 104 104 ARG H H 1 6.980 0.000 . 1 . . . . 274 Arg H . 26588 1 173 . 1 1 104 104 ARG N N 15 114.510 0.000 . 1 . . . . 274 Arg N . 26588 1 174 . 1 1 105 105 THR H H 1 7.315 0.000 . 1 . . . . 275 Thr H . 26588 1 175 . 1 1 105 105 THR N N 15 107.747 0.000 . 1 . . . . 275 Thr N . 26588 1 176 . 1 1 106 106 TYR H H 1 9.405 0.000 . 1 . . . . 276 Tyr H . 26588 1 177 . 1 1 106 106 TYR N N 15 123.922 0.000 . 1 . . . . 276 Tyr N . 26588 1 178 . 1 1 107 107 GLU H H 1 9.143 0.000 . 1 . . . . 277 Glu H . 26588 1 179 . 1 1 107 107 GLU N N 15 116.773 0.000 . 1 . . . . 277 Glu N . 26588 1 180 . 1 1 108 108 ALA H H 1 7.285 0.000 . 1 . . . . 278 Ala H . 26588 1 181 . 1 1 108 108 ALA N N 15 119.733 0.000 . 1 . . . . 278 Ala N . 26588 1 182 . 1 1 109 109 LEU H H 1 8.183 0.000 . 1 . . . . 279 Leu H . 26588 1 183 . 1 1 109 109 LEU N N 15 120.330 0.000 . 1 . . . . 279 Leu N . 26588 1 184 . 1 1 110 110 ARG H H 1 9.102 0.000 . 1 . . . . 280 Arg H . 26588 1 185 . 1 1 110 110 ARG N N 15 116.754 0.000 . 1 . . . . 280 Arg N . 26588 1 186 . 1 1 111 111 ARG H H 1 7.567 0.000 . 1 . . . . 281 Arg H . 26588 1 187 . 1 1 111 111 ARG N N 15 119.163 0.000 . 1 . . . . 281 Arg N . 26588 1 188 . 1 1 112 112 GLU H H 1 7.322 0.000 . 1 . . . . 282 Glu H . 26588 1 189 . 1 1 112 112 GLU N N 15 118.842 0.000 . 1 . . . . 282 Glu N . 26588 1 190 . 1 1 113 113 HIS H H 1 8.006 0.000 . 1 . . . . 283 His H . 26588 1 191 . 1 1 113 113 HIS N N 15 118.439 0.000 . 1 . . . . 283 His N . 26588 1 192 . 1 1 114 114 ASP H H 1 8.990 0.000 . 1 . . . . 284 Asp H . 26588 1 193 . 1 1 114 114 ASP N N 15 119.268 0.000 . 1 . . . . 284 Asp N . 26588 1 194 . 1 1 115 115 SER H H 1 8.184 0.000 . 1 . . . . 285 Ser H . 26588 1 195 . 1 1 115 115 SER N N 15 112.598 0.000 . 1 . . . . 285 Ser N . 26588 1 196 . 1 1 116 116 GLN H H 1 7.710 0.000 . 1 . . . . 286 Gln H . 26588 1 197 . 1 1 116 116 GLN N N 15 119.415 0.000 . 1 . . . . 286 Gln N . 26588 1 198 . 1 1 117 117 ILE H H 1 7.246 0.000 . 1 . . . . 287 Ile H . 26588 1 199 . 1 1 117 117 ILE N N 15 117.998 0.000 . 1 . . . . 287 Ile N . 26588 1 200 . 1 1 118 118 VAL H H 1 7.534 0.000 . 1 . . . . 288 Val H . 26588 1 201 . 1 1 118 118 VAL N N 15 119.080 0.000 . 1 . . . . 288 Val N . 26588 1 202 . 1 1 119 119 GLN H H 1 8.490 0.000 . 1 . . . . 289 Gln H . 26588 1 203 . 1 1 119 119 GLN N N 15 120.186 0.000 . 1 . . . . 289 Gln N . 26588 1 204 . 1 1 120 120 ILE H H 1 8.229 0.000 . 1 . . . . 290 Ile H . 26588 1 205 . 1 1 120 120 ILE N N 15 120.848 0.000 . 1 . . . . 290 Ile N . 26588 1 206 . 1 1 121 121 ALA H H 1 8.255 0.000 . 1 . . . . 291 Ala H . 26588 1 207 . 1 1 121 121 ALA N N 15 122.363 0.000 . 1 . . . . 291 Ala N . 26588 1 208 . 1 1 122 122 MET H H 1 8.944 0.000 . 1 . . . . 292 Met H . 26588 1 209 . 1 1 122 122 MET N N 15 117.809 0.000 . 1 . . . . 292 Met N . 26588 1 210 . 1 1 123 123 GLU H H 1 8.507 0.000 . 1 . . . . 293 Glu H . 26588 1 211 . 1 1 123 123 GLU N N 15 122.129 0.000 . 1 . . . . 293 Glu N . 26588 1 212 . 1 1 124 124 ALA H H 1 7.590 0.000 . 1 . . . . 294 Ala H . 26588 1 213 . 1 1 124 124 ALA N N 15 119.771 0.000 . 1 . . . . 294 Ala N . 26588 1 214 . 1 1 125 125 GLY H H 1 7.786 0.000 . 1 . . . . 295 Gly H . 26588 1 215 . 1 1 125 125 GLY N N 15 106.778 0.000 . 1 . . . . 295 Gly N . 26588 1 216 . 1 1 126 126 LEU H H 1 8.152 0.000 . 1 . . . . 296 Leu H . 26588 1 217 . 1 1 126 126 LEU N N 15 120.387 0.000 . 1 . . . . 296 Leu N . 26588 1 218 . 1 1 127 127 ARG H H 1 8.471 0.000 . 1 . . . . 297 Arg H . 26588 1 219 . 1 1 127 127 ARG N N 15 125.799 0.000 . 1 . . . . 297 Arg N . 26588 1 220 . 1 1 128 128 ILE H H 1 8.447 0.000 . 1 . . . . 298 Ile H . 26588 1 221 . 1 1 128 128 ILE N N 15 127.076 0.000 . 1 . . . . 298 Ile N . 26588 1 222 . 1 1 129 129 ALA H H 1 8.571 0.000 . 1 . . . . 299 Ala H . 26588 1 223 . 1 1 129 129 ALA N N 15 130.608 0.000 . 1 . . . . 299 Ala N . 26588 1 224 . 1 1 131 131 ASP H H 1 8.935 0.000 . 1 . . . . 301 Asp H . 26588 1 225 . 1 1 131 131 ASP N N 15 115.264 0.000 . 1 . . . . 301 Asp N . 26588 1 226 . 1 1 132 132 GLN H H 1 7.353 0.000 . 1 . . . . 302 Gln H . 26588 1 227 . 1 1 132 132 GLN N N 15 122.897 0.000 . 1 . . . . 302 Gln N . 26588 1 228 . 1 1 133 133 TRP H H 1 8.710 0.000 . 1 . . . . 303 Trp H . 26588 1 229 . 1 1 133 133 TRP HE1 H 1 9.520 0.000 . 1 . . . . 303 Trp HE1 . 26588 1 230 . 1 1 133 133 TRP N N 15 118.921 0.000 . 1 . . . . 303 Trp N . 26588 1 231 . 1 1 133 133 TRP NE1 N 15 129.545 0.000 . 1 . . . . 303 Trp NE1 . 26588 1 232 . 1 1 134 134 SER H H 1 8.068 0.000 . 1 . . . . 304 Ser H . 26588 1 233 . 1 1 134 134 SER N N 15 110.637 0.000 . 1 . . . . 304 Ser N . 26588 1 234 . 1 1 135 135 SER H H 1 7.742 0.000 . 1 . . . . 305 Ser H . 26588 1 235 . 1 1 135 135 SER N N 15 115.388 0.000 . 1 . . . . 305 Ser N . 26588 1 236 . 1 1 136 136 LEU H H 1 8.628 0.000 . 1 . . . . 306 Leu H . 26588 1 237 . 1 1 136 136 LEU N N 15 121.190 0.000 . 1 . . . . 306 Leu N . 26588 1 238 . 1 1 137 137 LEU H H 1 8.339 0.000 . 1 . . . . 307 Leu H . 26588 1 239 . 1 1 137 137 LEU N N 15 111.203 0.000 . 1 . . . . 307 Leu N . 26588 1 240 . 1 1 138 138 TYR H H 1 8.337 0.000 . 1 . . . . 308 Tyr H . 26588 1 241 . 1 1 138 138 TYR N N 15 112.515 0.000 . 1 . . . . 308 Tyr N . 26588 1 242 . 1 1 139 139 GLY H H 1 8.089 0.000 . 1 . . . . 309 Gly H . 26588 1 243 . 1 1 139 139 GLY N N 15 109.406 0.000 . 1 . . . . 309 Gly N . 26588 1 244 . 1 1 140 140 ASP H H 1 7.591 0.000 . 1 . . . . 310 Asp H . 26588 1 245 . 1 1 140 140 ASP N N 15 115.940 0.000 . 1 . . . . 310 Asp N . 26588 1 246 . 1 1 142 142 SER H H 1 8.594 0.000 . 1 . . . . 312 Ser H . 26588 1 247 . 1 1 142 142 SER N N 15 116.637 0.000 . 1 . . . . 312 Ser N . 26588 1 248 . 1 1 143 143 HIS H H 1 7.626 0.000 . 1 . . . . 313 His H . 26588 1 249 . 1 1 143 143 HIS N N 15 117.822 0.000 . 1 . . . . 313 His N . 26588 1 250 . 1 1 144 144 LYS H H 1 7.570 0.000 . 1 . . . . 314 Lys H . 26588 1 251 . 1 1 144 144 LYS N N 15 122.268 0.000 . 1 . . . . 314 Lys N . 26588 1 252 . 1 1 145 145 SER H H 1 7.569 0.000 . 1 . . . . 315 Ser H . 26588 1 253 . 1 1 145 145 SER N N 15 119.341 0.000 . 1 . . . . 315 Ser N . 26588 1 254 . 1 1 146 146 HIS H H 1 7.944 0.000 . 1 . . . . 316 His H . 26588 1 255 . 1 1 146 146 HIS N N 15 123.517 0.000 . 1 . . . . 316 His N . 26588 1 256 . 1 1 147 147 MET H H 1 8.027 0.000 . 1 . . . . 317 Met H . 26588 1 257 . 1 1 147 147 MET N N 15 115.172 0.000 . 1 . . . . 317 Met N . 26588 1 258 . 1 1 148 148 GLN H H 1 8.718 0.000 . 1 . . . . 318 Gln H . 26588 1 259 . 1 1 148 148 GLN N N 15 120.793 0.000 . 1 . . . . 318 Gln N . 26588 1 260 . 1 1 149 149 SER H H 1 7.974 0.000 . 1 . . . . 319 Ser H . 26588 1 261 . 1 1 149 149 SER N N 15 113.920 0.000 . 1 . . . . 319 Ser N . 26588 1 262 . 1 1 150 150 ILE H H 1 7.131 0.000 . 1 . . . . 320 Ile H . 26588 1 263 . 1 1 150 150 ILE N N 15 122.446 0.000 . 1 . . . . 320 Ile N . 26588 1 264 . 1 1 151 151 ILE H H 1 7.965 0.000 . 1 . . . . 321 Ile H . 26588 1 265 . 1 1 151 151 ILE N N 15 120.915 0.000 . 1 . . . . 321 Ile N . 26588 1 266 . 1 1 152 152 ASP H H 1 8.605 0.000 . 1 . . . . 322 Asp H . 26588 1 267 . 1 1 152 152 ASP N N 15 118.815 0.000 . 1 . . . . 322 Asp N . 26588 1 268 . 1 1 153 153 LYS H H 1 7.296 0.000 . 1 . . . . 323 Lys H . 26588 1 269 . 1 1 153 153 LYS N N 15 118.231 0.000 . 1 . . . . 323 Lys N . 26588 1 270 . 1 1 154 154 LEU H H 1 7.459 0.000 . 1 . . . . 324 Leu H . 26588 1 271 . 1 1 154 154 LEU N N 15 118.584 0.000 . 1 . . . . 324 Leu N . 26588 1 272 . 1 1 155 155 GLN H H 1 7.707 0.000 . 1 . . . . 325 Gln H . 26588 1 273 . 1 1 155 155 GLN N N 15 118.421 0.000 . 1 . . . . 325 Gln N . 26588 1 274 . 1 1 156 156 THR H H 1 7.570 0.000 . 1 . . . . 326 Thr H . 26588 1 275 . 1 1 156 156 THR N N 15 120.470 0.000 . 1 . . . . 326 Thr N . 26588 1 stop_ save_