################################### # 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 16243 _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 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.4 _Assigned_chem_shift_list.Chem_shift_15N_err 0.4 _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' . . . 16243 1 2 '3D CBCA(CO)NH' . . . 16243 1 3 '3D HNCACB' . . . 16243 1 4 '3D HNCA' . . . 16243 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 3 $SPARKY . . 16243 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 GLU H H 1 8.681 0.02 . 1 . . . . 116 E H . 16243 1 2 . 1 1 3 3 GLU N N 15 121.616 0.4 . 1 . . . . 116 E N . 16243 1 3 . 1 1 4 4 CYS H H 1 8.169 0.02 . 1 . . . . 117 C H . 16243 1 4 . 1 1 4 4 CYS N N 15 121.994 0.4 . 1 . . . . 117 C N . 16243 1 5 . 1 1 5 5 THR H H 1 8.361 0.02 . 1 . . . . 118 T H . 16243 1 6 . 1 1 5 5 THR N N 15 119.813 0.4 . 1 . . . . 118 T N . 16243 1 7 . 1 1 6 6 LEU H H 1 9.91 0.02 . 1 . . . . 119 L H . 16243 1 8 . 1 1 6 6 LEU N N 15 126.539 0.4 . 1 . . . . 119 L N . 16243 1 9 . 1 1 7 7 TRP H H 1 9.214 0.02 . 1 . . . . 120 W H . 16243 1 10 . 1 1 7 7 TRP N N 15 120.638 0.4 . 1 . . . . 120 W N . 16243 1 11 . 1 1 8 8 MET H H 1 8.86 0.02 . 1 . . . . 121 M H . 16243 1 12 . 1 1 8 8 MET N N 15 122.342 0.4 . 1 . . . . 121 M N . 16243 1 13 . 1 1 9 9 THR H H 1 8.809 0.02 . 1 . . . . 122 T H . 16243 1 14 . 1 1 9 9 THR N N 15 115.851 0.4 . 1 . . . . 122 T N . 16243 1 15 . 1 1 10 10 ASN H H 1 8.041 0.02 . 1 . . . . 123 N H . 16243 1 16 . 1 1 10 10 ASN N N 15 119.047 0.4 . 1 . . . . 123 N N . 16243 1 17 . 1 1 11 11 PHE H H 1 6.036 0.02 . 1 . . . . 124 F H . 16243 1 18 . 1 1 11 11 PHE N N 15 108.615 0.4 . 1 . . . . 124 F N . 16243 1 19 . 1 1 14 14 SER H H 1 7.535 0.02 . 1 . . . . 127 S H . 16243 1 20 . 1 1 14 14 SER N N 15 109.259 0.4 . 1 . . . . 127 S N . 16243 1 21 . 1 1 15 15 TYR H H 1 7.983 0.02 . 1 . . . . 128 Y H . 16243 1 22 . 1 1 15 15 TYR N N 15 124.407 0.4 . 1 . . . . 128 Y N . 16243 1 23 . 1 1 16 16 THR H H 1 8.774 0.02 . 1 . . . . 129 T H . 16243 1 24 . 1 1 16 16 THR N N 15 112.521 0.4 . 1 . . . . 129 T N . 16243 1 25 . 1 1 17 17 GLN H H 1 9.208 0.02 . 1 . . . . 130 Q H . 16243 1 26 . 1 1 17 17 GLN N N 15 118.806 0.4 . 1 . . . . 130 Q N . 16243 1 27 . 1 1 18 18 ARG H H 1 7.89 0.02 . 1 . . . . 131 R H . 16243 1 28 . 1 1 18 18 ARG N N 15 118.444 0.4 . 1 . . . . 131 R N . 16243 1 29 . 1 1 19 19 ASN H H 1 7.087 0.02 . 1 . . . . 132 N H . 16243 1 30 . 1 1 19 19 ASN N N 15 114.81 0.4 . 1 . . . . 132 N N . 16243 1 31 . 1 1 20 20 ILE H H 1 7.191 0.02 . 1 . . . . 133 I H . 16243 1 32 . 1 1 20 20 ILE N N 15 118.773 0.4 . 1 . . . . 133 I N . 16243 1 33 . 1 1 21 21 ARG H H 1 8.238 0.02 . 1 . . . . 134 R H . 16243 1 34 . 1 1 21 21 ARG N N 15 120.926 0.4 . 1 . . . . 134 R N . 16243 1 35 . 1 1 23 23 LEU H H 1 7.407 0.02 . 1 . . . . 136 L H . 16243 1 36 . 1 1 23 23 LEU N N 15 121.152 0.4 . 1 . . . . 136 L N . 16243 1 37 . 1 1 24 24 LEU H H 1 7.383 0.02 . 1 . . . . 137 L H . 16243 1 38 . 1 1 24 24 LEU N N 15 117.409 0.4 . 1 . . . . 137 L N . 16243 1 39 . 1 1 25 25 GLN H H 1 8.543 0.02 . 1 . . . . 138 Q H . 16243 1 40 . 1 1 25 25 GLN N N 15 121.2 0.4 . 1 . . . . 138 Q N . 16243 1 41 . 1 1 26 26 ASP H H 1 8.026 0.02 . 1 . . . . 139 D H . 16243 1 42 . 1 1 26 26 ASP N N 15 120.43 0.4 . 1 . . . . 139 D N . 16243 1 43 . 1 1 27 27 ILE H H 1 7.236 0.02 . 1 . . . . 140 I H . 16243 1 44 . 1 1 27 27 ILE N N 15 110.017 0.4 . 1 . . . . 140 I N . 16243 1 45 . 1 1 28 28 ASN H H 1 8.123 0.02 . 1 . . . . 141 N H . 16243 1 46 . 1 1 28 28 ASN N N 15 116.924 0.4 . 1 . . . . 141 N N . 16243 1 47 . 1 1 29 29 VAL H H 1 8.084 0.02 . 1 . . . . 142 V H . 16243 1 48 . 1 1 29 29 VAL N N 15 119.53 0.4 . 1 . . . . 142 V N . 16243 1 49 . 1 1 30 30 VAL H H 1 8.489 0.02 . 1 . . . . 143 V H . 16243 1 50 . 1 1 30 30 VAL N N 15 127.546 0.4 . 1 . . . . 143 V N . 16243 1 51 . 1 1 31 31 ALA H H 1 8.498 0.02 . 1 . . . . 144 A H . 16243 1 52 . 1 1 31 31 ALA N N 15 128.781 0.4 . 1 . . . . 144 A N . 16243 1 53 . 1 1 32 32 LEU H H 1 8.86 0.02 . 1 . . . . 145 L H . 16243 1 54 . 1 1 32 32 LEU N N 15 123.463 0.4 . 1 . . . . 145 L N . 16243 1 55 . 1 1 33 33 SER H H 1 7.246 0.02 . 1 . . . . 146 S H . 16243 1 56 . 1 1 33 33 SER N N 15 110.011 0.4 . 1 . . . . 146 S N . 16243 1 57 . 1 1 34 34 ILE H H 1 8.372 0.02 . 1 . . . . 147 I H . 16243 1 58 . 1 1 34 34 ILE N N 15 124.892 0.4 . 1 . . . . 147 I N . 16243 1 59 . 1 1 35 35 ARG H H 1 9.414 0.02 . 1 . . . . 148 R H . 16243 1 60 . 1 1 35 35 ARG N N 15 126.946 0.4 . 1 . . . . 148 R N . 16243 1 61 . 1 1 36 36 LEU H H 1 8.753 0.02 . 1 . . . . 149 L H . 16243 1 62 . 1 1 36 36 LEU N N 15 126.259 0.4 . 1 . . . . 149 L N . 16243 1 63 . 1 1 38 38 SER H H 1 8.573 0.02 . 1 . . . . 151 S H . 16243 1 64 . 1 1 38 38 SER N N 15 117.095 0.4 . 1 . . . . 151 S N . 16243 1 65 . 1 1 39 39 LEU H H 1 8.353 0.02 . 1 . . . . 152 L H . 16243 1 66 . 1 1 39 39 LEU N N 15 124.392 0.4 . 1 . . . . 152 L N . 16243 1 67 . 1 1 40 40 ARG H H 1 8.531 0.02 . 1 . . . . 153 R H . 16243 1 68 . 1 1 40 40 ARG N N 15 121.275 0.4 . 1 . . . . 153 R N . 16243 1 69 . 1 1 41 41 PHE H H 1 7.833 0.02 . 1 . . . . 154 F H . 16243 1 70 . 1 1 41 41 PHE N N 15 117.086 0.4 . 1 . . . . 154 F N . 16243 1 71 . 1 1 42 42 ASN H H 1 8.65 0.02 . 1 . . . . 155 N H . 16243 1 72 . 1 1 42 42 ASN N N 15 119.617 0.4 . 1 . . . . 155 N N . 16243 1 73 . 1 1 43 43 THR H H 1 7.809 0.02 . 1 . . . . 156 T H . 16243 1 74 . 1 1 43 43 THR N N 15 111.371 0.4 . 1 . . . . 156 T N . 16243 1 75 . 1 1 44 44 SER H H 1 8.175 0.02 . 1 . . . . 157 S H . 16243 1 76 . 1 1 44 44 SER N N 15 117.979 0.4 . 1 . . . . 157 S N . 16243 1 77 . 1 1 45 45 ARG H H 1 8.118 0.02 . 1 . . . . 158 R H . 16243 1 78 . 1 1 45 45 ARG N N 15 122.774 0.4 . 1 . . . . 158 R N . 16243 1 79 . 1 1 46 46 ARG H H 1 7.874 0.02 . 1 . . . . 159 R H . 16243 1 80 . 1 1 46 46 ARG N N 15 121.387 0.4 . 1 . . . . 159 R N . 16243 1 81 . 1 1 48 48 ALA H H 1 8.898 0.02 . 1 . . . . 161 A H . 16243 1 82 . 1 1 48 48 ALA N N 15 119.896 0.4 . 1 . . . . 161 A N . 16243 1 83 . 1 1 49 49 TYR H H 1 8.939 0.02 . 1 . . . . 162 Y H . 16243 1 84 . 1 1 49 49 TYR N N 15 118.028 0.4 . 1 . . . . 162 Y N . 16243 1 85 . 1 1 50 50 ILE H H 1 9.296 0.02 . 1 . . . . 163 I H . 16243 1 86 . 1 1 50 50 ILE N N 15 123.073 0.4 . 1 . . . . 163 I N . 16243 1 87 . 1 1 51 51 ASP H H 1 8.706 0.02 . 1 . . . . 164 D H . 16243 1 88 . 1 1 51 51 ASP N N 15 127.261 0.4 . 1 . . . . 164 D N . 16243 1 89 . 1 1 52 52 VAL H H 1 8.959 0.02 . 1 . . . . 165 V H . 16243 1 90 . 1 1 52 52 VAL N N 15 115.5 0.4 . 1 . . . . 165 V N . 16243 1 91 . 1 1 53 53 THR H H 1 9.268 0.02 . 1 . . . . 166 T H . 16243 1 92 . 1 1 53 53 THR N N 15 111.268 0.4 . 1 . . . . 166 T N . 16243 1 93 . 1 1 55 55 LYS H H 1 9.104 0.02 . 1 . . . . 168 K H . 16243 1 94 . 1 1 55 55 LYS N N 15 122.59 0.4 . 1 . . . . 168 K N . 16243 1 95 . 1 1 56 56 GLU H H 1 8.745 0.02 . 1 . . . . 169 E H . 16243 1 96 . 1 1 56 56 GLU N N 15 121.433 0.4 . 1 . . . . 169 E N . 16243 1 97 . 1 1 57 57 ASP H H 1 8.078 0.02 . 1 . . . . 170 D H . 16243 1 98 . 1 1 57 57 ASP N N 15 121.376 0.4 . 1 . . . . 170 D N . 16243 1 99 . 1 1 58 58 ALA H H 1 7.879 0.02 . 1 . . . . 171 A H . 16243 1 100 . 1 1 58 58 ALA N N 15 122.936 0.4 . 1 . . . . 171 A N . 16243 1 101 . 1 1 59 59 ARG H H 1 8.11 0.02 . 1 . . . . 172 R H . 16243 1 102 . 1 1 59 59 ARG N N 15 117.075 0.4 . 1 . . . . 172 R N . 16243 1 103 . 1 1 60 60 TYR H H 1 8.159 0.02 . 1 . . . . 173 Y H . 16243 1 104 . 1 1 60 60 TYR N N 15 121.421 0.4 . 1 . . . . 173 Y N . 16243 1 105 . 1 1 61 61 CYS H H 1 8.277 0.02 . 1 . . . . 174 C H . 16243 1 106 . 1 1 61 61 CYS N N 15 115.651 0.4 . 1 . . . . 174 C N . 16243 1 107 . 1 1 62 62 VAL H H 1 7.813 0.02 . 1 . . . . 175 V H . 16243 1 108 . 1 1 62 62 VAL N N 15 118.876 0.4 . 1 . . . . 175 V N . 16243 1 109 . 1 1 63 63 GLU H H 1 7.99 0.02 . 1 . . . . 176 E H . 16243 1 110 . 1 1 63 63 GLU N N 15 118.488 0.4 . 1 . . . . 176 E N . 16243 1 111 . 1 1 64 64 LYS H H 1 7.922 0.02 . 1 . . . . 177 K H . 16243 1 112 . 1 1 64 64 LYS N N 15 113.994 0.4 . 1 . . . . 177 K N . 16243 1 113 . 1 1 65 65 LEU H H 1 8.33 0.02 . 1 . . . . 178 L H . 16243 1 114 . 1 1 65 65 LEU N N 15 115.528 0.4 . 1 . . . . 178 L N . 16243 1 115 . 1 1 66 66 ASN H H 1 8.012 0.02 . 1 . . . . 179 N H . 16243 1 116 . 1 1 66 66 ASN N N 15 116.372 0.4 . 1 . . . . 179 N N . 16243 1 117 . 1 1 67 67 GLY H H 1 8.928 0.02 . 1 . . . . 180 G H . 16243 1 118 . 1 1 67 67 GLY N N 15 116.866 0.4 . 1 . . . . 180 G N . 16243 1 119 . 1 1 68 68 LEU H H 1 7.473 0.02 . 1 . . . . 181 L H . 16243 1 120 . 1 1 68 68 LEU N N 15 123.711 0.4 . 1 . . . . 181 L N . 16243 1 121 . 1 1 69 69 LYS H H 1 8.257 0.02 . 1 . . . . 182 K H . 16243 1 122 . 1 1 69 69 LYS N N 15 125.689 0.4 . 1 . . . . 182 K N . 16243 1 123 . 1 1 70 70 ILE H H 1 9.037 0.02 . 1 . . . . 183 I H . 16243 1 124 . 1 1 70 70 ILE N N 15 126.286 0.4 . 1 . . . . 183 I N . 16243 1 125 . 1 1 71 71 GLU H H 1 9.215 0.02 . 1 . . . . 184 E H . 16243 1 126 . 1 1 71 71 GLU N N 15 123.979 0.4 . 1 . . . . 184 E N . 16243 1 127 . 1 1 72 72 GLY H H 1 8.288 0.02 . 1 . . . . 185 G H . 16243 1 128 . 1 1 72 72 GLY N N 15 117.353 0.4 . 1 . . . . 185 G N . 16243 1 129 . 1 1 73 73 TYR H H 1 8.47 0.02 . 1 . . . . 186 Y H . 16243 1 130 . 1 1 73 73 TYR N N 15 123.141 0.4 . 1 . . . . 186 Y N . 16243 1 131 . 1 1 74 74 THR H H 1 8.24 0.02 . 1 . . . . 187 T H . 16243 1 132 . 1 1 74 74 THR N N 15 118.822 0.4 . 1 . . . . 187 T N . 16243 1 133 . 1 1 75 75 LEU H H 1 9.102 0.02 . 1 . . . . 188 L H . 16243 1 134 . 1 1 75 75 LEU N N 15 130.885 0.4 . 1 . . . . 188 L N . 16243 1 135 . 1 1 76 76 VAL H H 1 8.093 0.02 . 1 . . . . 189 V H . 16243 1 136 . 1 1 76 76 VAL N N 15 124.925 0.4 . 1 . . . . 189 V N . 16243 1 137 . 1 1 77 77 THR H H 1 8.651 0.02 . 1 . . . . 190 T H . 16243 1 138 . 1 1 77 77 THR N N 15 121.262 0.4 . 1 . . . . 190 T N . 16243 1 139 . 1 1 78 78 LYS H H 1 8.615 0.02 . 1 . . . . 191 K H . 16243 1 140 . 1 1 78 78 LYS N N 15 123.326 0.4 . 1 . . . . 191 K N . 16243 1 141 . 1 1 83 83 LEU H H 1 8.121 0.02 . 1 . . . . 196 L H . 16243 1 142 . 1 1 83 83 LEU N N 15 119.9 0.4 . 1 . . . . 196 L N . 16243 1 143 . 1 1 85 85 LYS H H 1 8.286 0.02 . 1 . . . . 198 K H . 16243 1 144 . 1 1 85 85 LYS N N 15 122.632 0.4 . 1 . . . . 198 K N . 16243 1 145 . 1 1 86 86 SER H H 1 8.243 0.02 . 1 . . . . 199 S H . 16243 1 146 . 1 1 86 86 SER N N 15 116.393 0.4 . 1 . . . . 199 S N . 16243 1 147 . 1 1 87 87 LYS H H 1 8.224 0.02 . 1 . . . . 200 K H . 16243 1 148 . 1 1 87 87 LYS N N 15 122.914 0.4 . 1 . . . . 200 K N . 16243 1 149 . 1 1 88 88 ARG H H 1 8.322 0.02 . 1 . . . . 201 R H . 16243 1 150 . 1 1 88 88 ARG N N 15 122.372 0.4 . 1 . . . . 201 R N . 16243 1 151 . 1 1 89 89 THR H H 1 8.3 0.02 . 1 . . . . 202 T H . 16243 1 152 . 1 1 89 89 THR N N 15 114.991 0.4 . 1 . . . . 202 T N . 16243 1 153 . 1 1 90 90 ASP H H 1 8.38 0.02 . 1 . . . . 203 D H . 16243 1 154 . 1 1 90 90 ASP N N 15 122.418 0.4 . 1 . . . . 203 D N . 16243 1 155 . 1 1 91 91 SER H H 1 8.223 0.02 . 1 . . . . 204 S H . 16243 1 156 . 1 1 91 91 SER N N 15 115.772 0.4 . 1 . . . . 204 S N . 16243 1 157 . 1 1 92 92 ALA H H 1 8.205 0.02 . 1 . . . . 205 A H . 16243 1 158 . 1 1 92 92 ALA N N 15 124.707 0.4 . 1 . . . . 205 A N . 16243 1 159 . 1 1 93 93 THR H H 1 7.947 0.02 . 1 . . . . 206 T H . 16243 1 160 . 1 1 93 93 THR N N 15 112.512 0.4 . 1 . . . . 206 T N . 16243 1 161 . 1 1 94 94 LEU H H 1 8.205 0.02 . 1 . . . . 207 L H . 16243 1 162 . 1 1 94 94 LEU N N 15 124.022 0.4 . 1 . . . . 207 L N . 16243 1 163 . 1 1 95 95 GLU H H 1 7.934 0.02 . 1 . . . . 208 E H . 16243 1 164 . 1 1 95 95 GLU N N 15 118.953 0.4 . 1 . . . . 208 E N . 16243 1 165 . 1 1 97 97 ARG H H 1 7.997 0.02 . 1 . . . . 210 R H . 16243 1 166 . 1 1 97 97 ARG N N 15 121.213 0.4 . 1 . . . . 210 R N . 16243 1 167 . 1 1 98 98 GLU H H 1 8.081 0.02 . 1 . . . . 211 E H . 16243 1 168 . 1 1 98 98 GLU N N 15 121.953 0.4 . 1 . . . . 211 E N . 16243 1 169 . 1 1 99 99 ILE H H 1 9.415 0.02 . 1 . . . . 212 I H . 16243 1 170 . 1 1 99 99 ILE N N 15 120.819 0.4 . 1 . . . . 212 I N . 16243 1 171 . 1 1 100 100 MET H H 1 9.338 0.02 . 1 . . . . 213 M H . 16243 1 172 . 1 1 100 100 MET N N 15 122.078 0.4 . 1 . . . . 213 M N . 16243 1 173 . 1 1 101 101 ILE H H 1 8.98 0.02 . 1 . . . . 214 I H . 16243 1 174 . 1 1 101 101 ILE N N 15 128.857 0.4 . 1 . . . . 214 I N . 16243 1 175 . 1 1 102 102 ARG H H 1 9.215 0.02 . 1 . . . . 215 R H . 16243 1 176 . 1 1 102 102 ARG N N 15 123.152 0.4 . 1 . . . . 215 R N . 16243 1 177 . 1 1 103 103 ASN H H 1 8.273 0.02 . 1 . . . . 216 N H . 16243 1 178 . 1 1 103 103 ASN N N 15 114.309 0.4 . 1 . . . . 216 N N . 16243 1 179 . 1 1 104 104 LEU H H 1 8.011 0.02 . 1 . . . . 217 L H . 16243 1 180 . 1 1 104 104 LEU N N 15 115.328 0.4 . 1 . . . . 217 L N . 16243 1 181 . 1 1 105 105 SER H H 1 6.511 0.02 . 1 . . . . 218 S H . 16243 1 182 . 1 1 105 105 SER N N 15 114.219 0.4 . 1 . . . . 218 S N . 16243 1 183 . 1 1 106 106 THR H H 1 8.93 0.02 . 1 . . . . 219 T H . 16243 1 184 . 1 1 106 106 THR N N 15 112.867 0.4 . 1 . . . . 219 T N . 16243 1 185 . 1 1 107 107 GLU H H 1 8.354 0.02 . 1 . . . . 220 E H . 16243 1 186 . 1 1 107 107 GLU N N 15 119.637 0.4 . 1 . . . . 220 E N . 16243 1 187 . 1 1 108 108 LEU H H 1 7.242 0.02 . 1 . . . . 221 L H . 16243 1 188 . 1 1 108 108 LEU N N 15 117.948 0.4 . 1 . . . . 221 L N . 16243 1 189 . 1 1 109 109 LEU H H 1 6.966 0.02 . 1 . . . . 222 L H . 16243 1 190 . 1 1 109 109 LEU N N 15 118.384 0.4 . 1 . . . . 222 L N . 16243 1 191 . 1 1 110 110 ASP H H 1 7.807 0.02 . 1 . . . . 223 D H . 16243 1 192 . 1 1 110 110 ASP N N 15 124.638 0.4 . 1 . . . . 223 D N . 16243 1 193 . 1 1 111 111 GLU H H 1 9.475 0.02 . 1 . . . . 224 E H . 16243 1 194 . 1 1 111 111 GLU N N 15 126.61 0.4 . 1 . . . . 224 E N . 16243 1 195 . 1 1 112 112 ASN H H 1 8.215 0.02 . 1 . . . . 225 N H . 16243 1 196 . 1 1 112 112 ASN N N 15 116.864 0.4 . 1 . . . . 225 N N . 16243 1 197 . 1 1 113 113 LEU H H 1 7.963 0.02 . 1 . . . . 226 L H . 16243 1 198 . 1 1 113 113 LEU N N 15 122.837 0.4 . 1 . . . . 226 L N . 16243 1 199 . 1 1 117 117 SER H H 1 7.816 0.02 . 1 . . . . 230 S H . 16243 1 200 . 1 1 117 117 SER N N 15 111.609 0.4 . 1 . . . . 230 S N . 16243 1 201 . 1 1 118 118 PHE H H 1 7.845 0.02 . 1 . . . . 231 F H . 16243 1 202 . 1 1 118 118 PHE N N 15 116.473 0.4 . 1 . . . . 231 F N . 16243 1 203 . 1 1 119 119 GLU H H 1 8.772 0.02 . 1 . . . . 232 E H . 16243 1 204 . 1 1 119 119 GLU N N 15 120.92 0.4 . 1 . . . . 232 E N . 16243 1 205 . 1 1 120 120 GLY H H 1 8.61 0.02 . 1 . . . . 233 G H . 16243 1 206 . 1 1 120 120 GLY N N 15 108.607 0.4 . 1 . . . . 233 G N . 16243 1 207 . 1 1 121 121 PHE H H 1 7.821 0.02 . 1 . . . . 234 F H . 16243 1 208 . 1 1 121 121 PHE N N 15 116.963 0.4 . 1 . . . . 234 F N . 16243 1 209 . 1 1 122 122 GLY H H 1 7.472 0.02 . 1 . . . . 235 G H . 16243 1 210 . 1 1 122 122 GLY N N 15 106.891 0.4 . 1 . . . . 235 G N . 16243 1 211 . 1 1 123 123 SER H H 1 7.94 0.02 . 1 . . . . 236 S H . 16243 1 212 . 1 1 123 123 SER N N 15 110.269 0.4 . 1 . . . . 236 S N . 16243 1 213 . 1 1 124 124 ILE H H 1 8.982 0.02 . 1 . . . . 237 I H . 16243 1 214 . 1 1 124 124 ILE N N 15 129.603 0.4 . 1 . . . . 237 I N . 16243 1 215 . 1 1 126 126 LYS H H 1 7.468 0.02 . 1 . . . . 239 K H . 16243 1 216 . 1 1 126 126 LYS N N 15 115.754 0.4 . 1 . . . . 239 K N . 16243 1 217 . 1 1 127 127 ILE H H 1 8.601 0.02 . 1 . . . . 240 I H . 16243 1 218 . 1 1 127 127 ILE N N 15 123.999 0.4 . 1 . . . . 240 I N . 16243 1 219 . 1 1 128 128 ASN H H 1 9.135 0.02 . 1 . . . . 241 N H . 16243 1 220 . 1 1 128 128 ASN N N 15 125.983 0.4 . 1 . . . . 241 N N . 16243 1 221 . 1 1 129 129 ILE H H 1 8.944 0.02 . 1 . . . . 242 I H . 16243 1 222 . 1 1 129 129 ILE N N 15 126.72 0.4 . 1 . . . . 242 I N . 16243 1 223 . 1 1 131 131 ALA H H 1 8.627 0.02 . 1 . . . . 244 A H . 16243 1 224 . 1 1 131 131 ALA N N 15 126.699 0.4 . 1 . . . . 244 A N . 16243 1 225 . 1 1 132 132 GLY H H 1 8.63 0.02 . 1 . . . . 245 G H . 16243 1 226 . 1 1 132 132 GLY N N 15 107.991 0.4 . 1 . . . . 245 G N . 16243 1 227 . 1 1 133 133 GLN H H 1 8.114 0.02 . 1 . . . . 246 Q H . 16243 1 228 . 1 1 133 133 GLN N N 15 118.252 0.4 . 1 . . . . 246 Q N . 16243 1 229 . 1 1 134 134 LYS H H 1 8.252 0.02 . 1 . . . . 247 K H . 16243 1 230 . 1 1 134 134 LYS N N 15 117.997 0.4 . 1 . . . . 247 K N . 16243 1 231 . 1 1 135 135 GLU H H 1 8.772 0.02 . 1 . . . . 248 E H . 16243 1 232 . 1 1 135 135 GLU N N 15 119.171 0.4 . 1 . . . . 248 E N . 16243 1 233 . 1 1 136 136 HIS H H 1 7.342 0.02 . 1 . . . . 249 H H . 16243 1 234 . 1 1 136 136 HIS N N 15 115.238 0.4 . 1 . . . . 249 H N . 16243 1 235 . 1 1 137 137 SER H H 1 8.009 0.02 . 1 . . . . 250 S H . 16243 1 236 . 1 1 137 137 SER N N 15 114.754 0.4 . 1 . . . . 250 S N . 16243 1 237 . 1 1 138 138 PHE H H 1 7.873 0.02 . 1 . . . . 251 F H . 16243 1 238 . 1 1 138 138 PHE N N 15 119.613 0.4 . 1 . . . . 251 F N . 16243 1 239 . 1 1 139 139 ASN H H 1 8.41 0.02 . 1 . . . . 252 N H . 16243 1 240 . 1 1 139 139 ASN N N 15 118.214 0.4 . 1 . . . . 252 N N . 16243 1 241 . 1 1 140 140 ASN H H 1 8.006 0.02 . 1 . . . . 253 N H . 16243 1 242 . 1 1 140 140 ASN N N 15 118.438 0.4 . 1 . . . . 253 N N . 16243 1 243 . 1 1 141 141 CYS H H 1 8.896 0.02 . 1 . . . . 254 C H . 16243 1 244 . 1 1 141 141 CYS N N 15 121.085 0.4 . 1 . . . . 254 C N . 16243 1 245 . 1 1 142 142 CYS H H 1 9.616 0.02 . 1 . . . . 255 C H . 16243 1 246 . 1 1 142 142 CYS N N 15 118.264 0.4 . 1 . . . . 255 C N . 16243 1 247 . 1 1 143 143 ALA H H 1 8.531 0.02 . 1 . . . . 256 A H . 16243 1 248 . 1 1 143 143 ALA N N 15 119.647 0.4 . 1 . . . . 256 A N . 16243 1 249 . 1 1 144 144 PHE H H 1 8.84 0.02 . 1 . . . . 257 F H . 16243 1 250 . 1 1 144 144 PHE N N 15 117.855 0.4 . 1 . . . . 257 F N . 16243 1 251 . 1 1 145 145 MET H H 1 8.807 0.02 . 1 . . . . 258 M H . 16243 1 252 . 1 1 145 145 MET N N 15 121.578 0.4 . 1 . . . . 258 M N . 16243 1 253 . 1 1 146 146 VAL H H 1 8.874 0.02 . 1 . . . . 259 V H . 16243 1 254 . 1 1 146 146 VAL N N 15 125.799 0.4 . 1 . . . . 259 V N . 16243 1 255 . 1 1 147 147 PHE H H 1 9.098 0.02 . 1 . . . . 260 F H . 16243 1 256 . 1 1 147 147 PHE N N 15 126.672 0.4 . 1 . . . . 260 F N . 16243 1 257 . 1 1 148 148 GLU H H 1 8.347 0.02 . 1 . . . . 261 E H . 16243 1 258 . 1 1 148 148 GLU N N 15 119.193 0.4 . 1 . . . . 261 E N . 16243 1 259 . 1 1 149 149 ASN H H 1 8.249 0.02 . 1 . . . . 262 N H . 16243 1 260 . 1 1 149 149 ASN N N 15 112.147 0.4 . 1 . . . . 262 N N . 16243 1 261 . 1 1 150 150 LYS H H 1 9.024 0.02 . 1 . . . . 263 K H . 16243 1 262 . 1 1 150 150 LYS N N 15 122.213 0.4 . 1 . . . . 263 K N . 16243 1 263 . 1 1 151 151 ASP H H 1 8.614 0.02 . 1 . . . . 264 D H . 16243 1 264 . 1 1 151 151 ASP N N 15 119.409 0.4 . 1 . . . . 264 D N . 16243 1 265 . 1 1 152 152 SER H H 1 7.648 0.02 . 1 . . . . 265 S H . 16243 1 266 . 1 1 152 152 SER N N 15 116.046 0.4 . 1 . . . . 265 S N . 16243 1 267 . 1 1 153 153 ALA H H 1 6.514 0.02 . 1 . . . . 266 A H . 16243 1 268 . 1 1 153 153 ALA N N 15 122.063 0.4 . 1 . . . . 266 A N . 16243 1 269 . 1 1 154 154 GLU H H 1 7.689 0.02 . 1 . . . . 267 E H . 16243 1 270 . 1 1 154 154 GLU N N 15 113.512 0.4 . 1 . . . . 267 E N . 16243 1 271 . 1 1 155 155 ARG H H 1 7.749 0.02 . 1 . . . . 268 R H . 16243 1 272 . 1 1 155 155 ARG N N 15 119.546 0.4 . 1 . . . . 268 R N . 16243 1 273 . 1 1 156 156 ALA H H 1 7.515 0.02 . 1 . . . . 269 A H . 16243 1 274 . 1 1 156 156 ALA N N 15 120.957 0.4 . 1 . . . . 269 A N . 16243 1 275 . 1 1 157 157 LEU H H 1 7.216 0.02 . 1 . . . . 270 L H . 16243 1 276 . 1 1 157 157 LEU N N 15 115.42 0.4 . 1 . . . . 270 L N . 16243 1 277 . 1 1 158 158 GLN H H 1 7.763 0.02 . 1 . . . . 271 Q H . 16243 1 278 . 1 1 158 158 GLN N N 15 118.632 0.4 . 1 . . . . 271 Q N . 16243 1 279 . 1 1 159 159 MET H H 1 7.698 0.02 . 1 . . . . 272 M H . 16243 1 280 . 1 1 159 159 MET N N 15 114.408 0.4 . 1 . . . . 272 M N . 16243 1 281 . 1 1 160 160 ASN H H 1 7.866 0.02 . 1 . . . . 273 N H . 16243 1 282 . 1 1 160 160 ASN N N 15 118.938 0.4 . 1 . . . . 273 N N . 16243 1 283 . 1 1 161 161 ARG H H 1 8.908 0.02 . 1 . . . . 274 R H . 16243 1 284 . 1 1 161 161 ARG N N 15 121.126 0.4 . 1 . . . . 274 R N . 16243 1 285 . 1 1 162 162 SER H H 1 7.853 0.02 . 1 . . . . 275 S H . 16243 1 286 . 1 1 162 162 SER N N 15 114.844 0.4 . 1 . . . . 275 S N . 16243 1 287 . 1 1 163 163 LEU H H 1 8.163 0.02 . 1 . . . . 276 L H . 16243 1 288 . 1 1 163 163 LEU N N 15 120.019 0.4 . 1 . . . . 276 L N . 16243 1 289 . 1 1 164 164 LEU H H 1 9.062 0.02 . 1 . . . . 277 L H . 16243 1 290 . 1 1 164 164 LEU N N 15 128.785 0.4 . 1 . . . . 277 L N . 16243 1 291 . 1 1 165 165 GLY H H 1 8.84 0.02 . 1 . . . . 278 G H . 16243 1 292 . 1 1 165 165 GLY N N 15 114.518 0.4 . 1 . . . . 278 G N . 16243 1 293 . 1 1 166 166 ASN H H 1 8.381 0.02 . 1 . . . . 279 N H . 16243 1 294 . 1 1 166 166 ASN N N 15 120.314 0.4 . 1 . . . . 279 N N . 16243 1 295 . 1 1 167 167 ARG H H 1 8.015 0.02 . 1 . . . . 280 R H . 16243 1 296 . 1 1 167 167 ARG N N 15 119.539 0.4 . 1 . . . . 280 R N . 16243 1 297 . 1 1 168 168 GLU H H 1 8.435 0.02 . 1 . . . . 281 E H . 16243 1 298 . 1 1 168 168 GLU N N 15 122.947 0.4 . 1 . . . . 281 E N . 16243 1 299 . 1 1 169 169 ILE H H 1 8.631 0.02 . 1 . . . . 282 I H . 16243 1 300 . 1 1 169 169 ILE N N 15 122.999 0.4 . 1 . . . . 282 I N . 16243 1 301 . 1 1 170 170 SER H H 1 8.025 0.02 . 1 . . . . 283 S H . 16243 1 302 . 1 1 170 170 SER N N 15 115.983 0.4 . 1 . . . . 283 S N . 16243 1 303 . 1 1 171 171 VAL H H 1 8.983 0.02 . 1 . . . . 284 V H . 16243 1 304 . 1 1 171 171 VAL N N 15 126.259 0.4 . 1 . . . . 284 V N . 16243 1 305 . 1 1 172 172 SER H H 1 8.517 0.02 . 1 . . . . 285 S H . 16243 1 306 . 1 1 172 172 SER N N 15 119.04 0.4 . 1 . . . . 285 S N . 16243 1 307 . 1 1 173 173 LEU H H 1 8.886 0.02 . 1 . . . . 286 L H . 16243 1 308 . 1 1 173 173 LEU N N 15 122.184 0.4 . 1 . . . . 286 L N . 16243 1 309 . 1 1 174 174 ALA H H 1 8.504 0.02 . 1 . . . . 287 A H . 16243 1 310 . 1 1 174 174 ALA N N 15 126.496 0.4 . 1 . . . . 287 A N . 16243 1 311 . 1 1 175 175 ASP H H 1 8.319 0.02 . 1 . . . . 288 D H . 16243 1 312 . 1 1 175 175 ASP N N 15 120.081 0.4 . 1 . . . . 288 D N . 16243 1 313 . 1 1 176 176 LYS H H 1 8.227 0.02 . 1 . . . . 289 K H . 16243 1 314 . 1 1 176 176 LYS N N 15 120.864 0.4 . 1 . . . . 289 K N . 16243 1 315 . 1 1 177 177 LYS H H 1 8.314 0.02 . 1 . . . . 290 K H . 16243 1 316 . 1 1 177 177 LYS N N 15 123.82 0.4 . 1 . . . . 290 K N . 16243 1 stop_ save_