################################### # 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_ADAPT_35C _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode ADAPT_35C _Assigned_chem_shift_list.Entry_ID 19065 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 3 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_3 _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_ _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 THR H H 1 8.322 . . . . . . . 3 T H . 19065 1 2 . 1 1 3 3 THR N N 15 116.488 . . . . . . . 3 T N . 19065 1 3 . 1 1 4 4 ALA H H 1 8.417 . . . . . . . 4 A H . 19065 1 4 . 1 1 4 4 ALA N N 15 126.580 . . . . . . . 4 A N . 19065 1 5 . 1 1 5 5 ALA H H 1 8.181 . . . . . . . 5 A H . 19065 1 6 . 1 1 5 5 ALA N N 15 122.909 . . . . . . . 5 A N . 19065 1 7 . 1 1 6 6 ALA H H 1 8.097 . . . . . . . 6 A H . 19065 1 8 . 1 1 6 6 ALA N N 15 122.969 . . . . . . . 6 A N . 19065 1 9 . 1 1 7 7 LYS H H 1 8.057 . . . . . . . 7 K H . 19065 1 10 . 1 1 7 7 LYS N N 15 119.812 . . . . . . . 7 K N . 19065 1 11 . 1 1 8 8 PHE H H 1 8.043 . . . . . . . 8 F H . 19065 1 12 . 1 1 8 8 PHE N N 15 120.167 . . . . . . . 8 F N . 19065 1 13 . 1 1 9 9 GLU H H 1 8.221 . . . . . . . 9 E H . 19065 1 14 . 1 1 9 9 GLU N N 15 122.165 . . . . . . . 9 E N . 19065 1 15 . 1 1 10 10 ARG H H 1 8.192 . . . . . . . 10 R H . 19065 1 16 . 1 1 10 10 ARG N N 15 121.416 . . . . . . . 10 R N . 19065 1 17 . 1 1 11 11 GLN H H 1 8.273 . . . . . . . 11 Q H . 19065 1 18 . 1 1 11 11 GLN N N 15 120.153 . . . . . . . 11 Q N . 19065 1 19 . 1 1 12 12 HIS H H 1 7.831 . . . . . . . 12 H H . 19065 1 20 . 1 1 12 12 HIS N N 15 105.376 . . . . . . . 12 H N . 19065 1 21 . 1 1 13 13 MET H H 1 8.114 . . . . . . . 13 M H . 19065 1 22 . 1 1 13 13 MET N N 15 117.080 . . . . . . . 13 M N . 19065 1 23 . 1 1 14 14 ASP H H 1 8.862 . . . . . . . 14 D H . 19065 1 24 . 1 1 14 14 ASP N N 15 121.270 . . . . . . . 14 D N . 19065 1 25 . 1 1 15 15 SER H H 1 8.965 . . . . . . . 15 S H . 19065 1 26 . 1 1 15 15 SER N N 15 119.387 . . . . . . . 15 S N . 19065 1 27 . 1 1 16 16 SER H H 1 8.068 . . . . . . . 16 S H . 19065 1 28 . 1 1 16 16 SER N N 15 115.438 . . . . . . . 16 S N . 19065 1 29 . 1 1 17 17 THR H H 1 7.436 . . . . . . . 17 T H . 19065 1 30 . 1 1 17 17 THR N N 15 113.234 . . . . . . . 17 T N . 19065 1 31 . 1 1 18 18 SER H H 1 8.504 . . . . . . . 18 S H . 19065 1 32 . 1 1 18 18 SER N N 15 118.279 . . . . . . . 18 S N . 19065 1 33 . 1 1 19 19 ALA H H 1 7.517 . . . . . . . 19 A H . 19065 1 34 . 1 1 19 19 ALA N N 15 122.391 . . . . . . . 19 A N . 19065 1 35 . 1 1 20 20 ALA H H 1 8.146 . . . . . . . 20 A H . 19065 1 36 . 1 1 20 20 ALA N N 15 122.575 . . . . . . . 20 A N . 19065 1 37 . 1 1 21 21 SER H H 1 7.922 . . . . . . . 21 S H . 19065 1 38 . 1 1 21 21 SER N N 15 115.199 . . . . . . . 21 S N . 19065 1 39 . 1 1 22 22 SER H H 1 7.708 . . . . . . . 22 S H . 19065 1 40 . 1 1 22 22 SER N N 15 114.354 . . . . . . . 22 S N . 19065 1 41 . 1 1 23 23 SER H H 1 7.698 . . . . . . . 23 S H . 19065 1 42 . 1 1 23 23 SER N N 15 114.699 . . . . . . . 23 S N . 19065 1 43 . 1 1 24 24 ASN H H 1 7.745 . . . . . . . 24 N H . 19065 1 44 . 1 1 24 24 ASN N N 15 123.708 . . . . . . . 24 N N . 19065 1 45 . 1 1 25 25 TYR H H 1 7.672 . . . . . . . 25 Y H . 19065 1 46 . 1 1 25 25 TYR N N 15 120.705 . . . . . . . 25 Y N . 19065 1 47 . 1 1 26 26 CYS H H 1 7.843 . . . . . . . 26 C H . 19065 1 48 . 1 1 26 26 CYS N N 15 114.752 . . . . . . . 26 C N . 19065 1 49 . 1 1 27 27 ASN H H 1 8.038 . . . . . . . 27 N H . 19065 1 50 . 1 1 27 27 ASN N N 15 119.881 . . . . . . . 27 N N . 19065 1 51 . 1 1 28 28 GLN H H 1 7.567 . . . . . . . 28 Q H . 19065 1 52 . 1 1 28 28 GLN N N 15 116.917 . . . . . . . 28 Q N . 19065 1 53 . 1 1 29 29 MET H H 1 8.499 . . . . . . . 29 M H . 19065 1 54 . 1 1 29 29 MET N N 15 119.866 . . . . . . . 29 M N . 19065 1 55 . 1 1 30 30 MET H H 1 8.694 . . . . . . . 30 M H . 19065 1 56 . 1 1 30 30 MET N N 15 116.053 . . . . . . . 30 M N . 19065 1 57 . 1 1 31 31 LYS H H 1 6.596 . . . . . . . 31 K H . 19065 1 58 . 1 1 31 31 LYS N N 15 115.896 . . . . . . . 31 K N . 19065 1 59 . 1 1 32 32 SER H H 1 8.597 . . . . . . . 32 S H . 19065 1 60 . 1 1 32 32 SER N N 15 117.182 . . . . . . . 32 S N . 19065 1 61 . 1 1 33 33 ARG H H 1 7.825 . . . . . . . 33 R H . 19065 1 62 . 1 1 33 33 ARG N N 15 116.570 . . . . . . . 33 R N . 19065 1 63 . 1 1 34 34 ASN H H 1 7.963 . . . . . . . 34 N H . 19065 1 64 . 1 1 34 34 ASN N N 15 113.218 . . . . . . . 34 N N . 19065 1 65 . 1 1 35 35 LEU H H 1 8.136 . . . . . . . 35 L H . 19065 1 66 . 1 1 35 35 LEU N N 15 115.635 . . . . . . . 35 L N . 19065 1 67 . 1 1 36 36 THR H H 1 7.643 . . . . . . . 36 T H . 19065 1 68 . 1 1 36 36 THR N N 15 107.210 . . . . . . . 36 T N . 19065 1 69 . 1 1 37 37 LYS H H 1 7.036 . . . . . . . 37 K H . 19065 1 70 . 1 1 37 37 LYS N N 15 121.912 . . . . . . . 37 K N . 19065 1 71 . 1 1 38 38 ASP H H 1 8.807 . . . . . . . 38 D H . 19065 1 72 . 1 1 38 38 ASP N N 15 119.700 . . . . . . . 38 D N . 19065 1 73 . 1 1 39 39 ARG H H 1 7.731 . . . . . . . 39 R H . 19065 1 74 . 1 1 39 39 ARG N N 15 115.810 . . . . . . . 39 R N . 19065 1 75 . 1 1 40 40 CYS H H 1 9.015 . . . . . . . 40 C H . 19065 1 76 . 1 1 40 40 CYS N N 15 117.536 . . . . . . . 40 C N . 19065 1 77 . 1 1 41 41 LYS H H 1 7.363 . . . . . . . 41 K H . 19065 1 78 . 1 1 41 41 LYS N N 15 129.079 . . . . . . . 41 K N . 19065 1 79 . 1 1 43 43 VAL H H 1 7.015 . . . . . . . 43 V H . 19065 1 80 . 1 1 43 43 VAL N N 15 111.313 . . . . . . . 43 V N . 19065 1 81 . 1 1 44 44 ASN H H 1 8.694 . . . . . . . 44 N H . 19065 1 82 . 1 1 44 44 ASN N N 15 120.149 . . . . . . . 44 N N . 19065 1 83 . 1 1 45 45 THR H H 1 7.366 . . . . . . . 45 T H . 19065 1 84 . 1 1 45 45 THR N N 15 121.193 . . . . . . . 45 T N . 19065 1 85 . 1 1 46 46 PHE H H 1 9.263 . . . . . . . 46 F H . 19065 1 86 . 1 1 46 46 PHE N N 15 124.482 . . . . . . . 46 F N . 19065 1 87 . 1 1 47 47 VAL H H 1 9.326 . . . . . . . 47 V H . 19065 1 88 . 1 1 47 47 VAL N N 15 121.349 . . . . . . . 47 V N . 19065 1 89 . 1 1 48 48 HIS H H 1 9.124 . . . . . . . 48 H H . 19065 1 90 . 1 1 48 48 HIS N N 15 128.688 . . . . . . . 48 H N . 19065 1 91 . 1 1 49 49 GLU H H 1 6.750 . . . . . . . 49 E H . 19065 1 92 . 1 1 49 49 GLU N N 15 115.776 . . . . . . . 49 E N . 19065 1 93 . 1 1 50 50 SER H H 1 9.606 . . . . . . . 50 S H . 19065 1 94 . 1 1 50 50 SER N N 15 116.479 . . . . . . . 50 S N . 19065 1 95 . 1 1 51 51 LEU H H 1 8.794 . . . . . . . 51 L H . 19065 1 96 . 1 1 51 51 LEU N N 15 123.860 . . . . . . . 51 L N . 19065 1 97 . 1 1 52 52 ALA H H 1 8.460 . . . . . . . 52 A H . 19065 1 98 . 1 1 52 52 ALA N N 15 119.562 . . . . . . . 52 A N . 19065 1 99 . 1 1 53 53 ASP H H 1 7.756 . . . . . . . 53 D H . 19065 1 100 . 1 1 53 53 ASP N N 15 118.799 . . . . . . . 53 D N . 19065 1 101 . 1 1 54 54 VAL H H 1 7.806 . . . . . . . 54 V H . 19065 1 102 . 1 1 54 54 VAL N N 15 120.744 . . . . . . . 54 V N . 19065 1 103 . 1 1 55 55 GLN H H 1 9.144 . . . . . . . 55 Q H . 19065 1 104 . 1 1 55 55 GLN N N 15 118.453 . . . . . . . 55 Q N . 19065 1 105 . 1 1 56 56 ALA H H 1 7.670 . . . . . . . 56 A H . 19065 1 106 . 1 1 56 56 ALA N N 15 119.357 . . . . . . . 56 A N . 19065 1 107 . 1 1 57 57 VAL H H 1 7.601 . . . . . . . 57 V H . 19065 1 108 . 1 1 57 57 VAL N N 15 120.084 . . . . . . . 57 V N . 19065 1 109 . 1 1 58 58 CYS H H 1 6.826 . . . . . . . 58 C H . 19065 1 110 . 1 1 58 58 CYS N N 15 112.694 . . . . . . . 58 C N . 19065 1 111 . 1 1 59 59 SER H H 1 7.472 . . . . . . . 59 S H . 19065 1 112 . 1 1 59 59 SER N N 15 111.236 . . . . . . . 59 S N . 19065 1 113 . 1 1 60 60 GLN H H 1 7.745 . . . . . . . 60 Q H . 19065 1 114 . 1 1 60 60 GLN N N 15 123.708 . . . . . . . 60 Q N . 19065 1 115 . 1 1 61 61 LYS H H 1 7.226 . . . . . . . 61 K H . 19065 1 116 . 1 1 61 61 LYS N N 15 122.053 . . . . . . . 61 K N . 19065 1 117 . 1 1 62 62 ASN H H 1 8.929 . . . . . . . 62 N H . 19065 1 118 . 1 1 62 62 ASN N N 15 128.693 . . . . . . . 62 N N . 19065 1 119 . 1 1 63 63 VAL H H 1 8.252 . . . . . . . 63 V H . 19065 1 120 . 1 1 63 63 VAL N N 15 121.977 . . . . . . . 63 V N . 19065 1 121 . 1 1 64 64 ALA H H 1 7.798 . . . . . . . 64 A H . 19065 1 122 . 1 1 64 64 ALA N N 15 120.286 . . . . . . . 64 A N . 19065 1 123 . 1 1 65 65 CYS H H 1 8.658 . . . . . . . 65 C H . 19065 1 124 . 1 1 65 65 CYS N N 15 119.302 . . . . . . . 65 C N . 19065 1 125 . 1 1 67 67 ASN H H 1 8.127 . . . . . . . 67 N H . 19065 1 126 . 1 1 67 67 ASN N N 15 114.302 . . . . . . . 67 N N . 19065 1 127 . 1 1 68 68 GLY H H 1 8.031 . . . . . . . 68 G H . 19065 1 128 . 1 1 68 68 GLY N N 15 108.101 . . . . . . . 68 G N . 19065 1 129 . 1 1 69 69 GLN H H 1 7.903 . . . . . . . 69 Q H . 19065 1 130 . 1 1 69 69 GLN N N 15 118.954 . . . . . . . 69 Q N . 19065 1 131 . 1 1 70 70 THR H H 1 8.452 . . . . . . . 70 T H . 19065 1 132 . 1 1 70 70 THR N N 15 106.829 . . . . . . . 70 T N . 19065 1 133 . 1 1 71 71 ASN H H 1 8.141 . . . . . . . 71 N H . 19065 1 134 . 1 1 71 71 ASN N N 15 121.996 . . . . . . . 71 N N . 19065 1 135 . 1 1 72 72 CYS H H 1 7.521 . . . . . . . 72 C H . 19065 1 136 . 1 1 72 72 CYS N N 15 112.159 . . . . . . . 72 C N . 19065 1 137 . 1 1 73 73 TYR H H 1 8.951 . . . . . . . 73 Y H . 19065 1 138 . 1 1 73 73 TYR N N 15 120.548 . . . . . . . 73 Y N . 19065 1 139 . 1 1 74 74 GLN H H 1 9.660 . . . . . . . 74 Q H . 19065 1 140 . 1 1 74 74 GLN N N 15 123.455 . . . . . . . 74 Q N . 19065 1 141 . 1 1 75 75 SER H H 1 9.115 . . . . . . . 75 S H . 19065 1 142 . 1 1 75 75 SER N N 15 121.280 . . . . . . . 75 S N . 19065 1 143 . 1 1 76 76 TYR H H 1 8.703 . . . . . . . 76 Y H . 19065 1 144 . 1 1 76 76 TYR N N 15 124.432 . . . . . . . 76 Y N . 19065 1 145 . 1 1 77 77 SER H H 1 8.903 . . . . . . . 77 S H . 19065 1 146 . 1 1 77 77 SER N N 15 113.183 . . . . . . . 77 S N . 19065 1 147 . 1 1 78 78 THR H H 1 8.276 . . . . . . . 78 T H . 19065 1 148 . 1 1 78 78 THR N N 15 113.915 . . . . . . . 78 T N . 19065 1 149 . 1 1 79 79 MET H H 1 8.677 . . . . . . . 79 M H . 19065 1 150 . 1 1 79 79 MET N N 15 121.823 . . . . . . . 79 M N . 19065 1 151 . 1 1 80 80 SER H H 1 9.221 . . . . . . . 80 S H . 19065 1 152 . 1 1 80 80 SER N N 15 115.932 . . . . . . . 80 S N . 19065 1 153 . 1 1 81 81 ILE H H 1 9.063 . . . . . . . 81 I H . 19065 1 154 . 1 1 81 81 ILE N N 15 122.255 . . . . . . . 81 I N . 19065 1 155 . 1 1 82 82 THR H H 1 9.363 . . . . . . . 82 T H . 19065 1 156 . 1 1 82 82 THR N N 15 116.813 . . . . . . . 82 T N . 19065 1 157 . 1 1 83 83 ASP H H 1 9.218 . . . . . . . 83 D H . 19065 1 158 . 1 1 83 83 ASP N N 15 127.679 . . . . . . . 83 D N . 19065 1 159 . 1 1 84 84 CYS H H 1 8.723 . . . . . . . 84 C H . 19065 1 160 . 1 1 84 84 CYS N N 15 121.344 . . . . . . . 84 C N . 19065 1 161 . 1 1 85 85 ARG H H 1 8.252 . . . . . . . 85 R H . 19065 1 162 . 1 1 85 85 ARG N N 15 121.977 . . . . . . . 85 R N . 19065 1 163 . 1 1 86 86 GLU H H 1 8.754 . . . . . . . 86 E H . 19065 1 164 . 1 1 86 86 GLU N N 15 127.806 . . . . . . . 86 E N . 19065 1 165 . 1 1 87 87 THR H H 1 8.083 . . . . . . . 87 T H . 19065 1 166 . 1 1 87 87 THR N N 15 115.017 . . . . . . . 87 T N . 19065 1 167 . 1 1 88 88 GLY H H 1 8.786 . . . . . . . 88 G H . 19065 1 168 . 1 1 88 88 GLY N N 15 107.221 . . . . . . . 88 G N . 19065 1 169 . 1 1 89 89 SER H H 1 7.649 . . . . . . . 89 S H . 19065 1 170 . 1 1 89 89 SER N N 15 112.435 . . . . . . . 89 S N . 19065 1 171 . 1 1 90 90 SER H H 1 7.021 . . . . . . . 90 S H . 19065 1 172 . 1 1 90 90 SER N N 15 117.333 . . . . . . . 90 S N . 19065 1 173 . 1 1 91 91 LYS H H 1 7.498 . . . . . . . 91 K H . 19065 1 174 . 1 1 91 91 LYS N N 15 128.842 . . . . . . . 91 K N . 19065 1 175 . 1 1 92 92 TYR H H 1 9.286 . . . . . . . 92 Y H . 19065 1 176 . 1 1 92 92 TYR N N 15 130.970 . . . . . . . 92 Y N . 19065 1 177 . 1 1 94 94 ASN H H 1 8.842 . . . . . . . 94 N H . 19065 1 178 . 1 1 94 94 ASN N N 15 130.658 . . . . . . . 94 N N . 19065 1 179 . 1 1 95 95 CYS H H 1 7.528 . . . . . . . 95 C H . 19065 1 180 . 1 1 95 95 CYS N N 15 121.205 . . . . . . . 95 C N . 19065 1 181 . 1 1 96 96 ALA H H 1 8.590 . . . . . . . 96 A H . 19065 1 182 . 1 1 96 96 ALA N N 15 127.987 . . . . . . . 96 A N . 19065 1 183 . 1 1 97 97 TYR H H 1 9.340 . . . . . . . 97 Y H . 19065 1 184 . 1 1 97 97 TYR N N 15 117.313 . . . . . . . 97 Y N . 19065 1 185 . 1 1 98 98 LYS H H 1 9.505 . . . . . . . 98 K H . 19065 1 186 . 1 1 98 98 LYS N N 15 125.132 . . . . . . . 98 K N . 19065 1 187 . 1 1 99 99 THR H H 1 9.120 . . . . . . . 99 T H . 19065 1 188 . 1 1 99 99 THR N N 15 125.501 . . . . . . . 99 T N . 19065 1 189 . 1 1 100 100 THR H H 1 8.873 . . . . . . . 100 T H . 19065 1 190 . 1 1 100 100 THR N N 15 123.208 . . . . . . . 100 T N . 19065 1 191 . 1 1 101 101 GLN H H 1 8.954 . . . . . . . 101 Q H . 19065 1 192 . 1 1 101 101 GLN N N 15 128.966 . . . . . . . 101 Q N . 19065 1 193 . 1 1 103 103 ASN H H 1 8.379 . . . . . . . 103 N H . 19065 1 194 . 1 1 103 103 ASN N N 15 119.112 . . . . . . . 103 N N . 19065 1 195 . 1 1 104 104 LYS H H 1 8.555 . . . . . . . 104 K H . 19065 1 196 . 1 1 104 104 LYS N N 15 120.550 . . . . . . . 104 K N . 19065 1 197 . 1 1 105 105 HIS H H 1 9.315 . . . . . . . 105 H H . 19065 1 198 . 1 1 105 105 HIS N N 15 119.104 . . . . . . . 105 H N . 19065 1 199 . 1 1 106 106 ILE H H 1 8.406 . . . . . . . 106 I H . 19065 1 200 . 1 1 106 106 ILE N N 15 114.519 . . . . . . . 106 I N . 19065 1 201 . 1 1 107 107 ILE H H 1 8.198 . . . . . . . 107 I H . 19065 1 202 . 1 1 107 107 ILE N N 15 120.739 . . . . . . . 107 I N . 19065 1 203 . 1 1 108 108 VAL H H 1 8.727 . . . . . . . 108 V H . 19065 1 204 . 1 1 108 108 VAL N N 15 117.217 . . . . . . . 108 V N . 19065 1 205 . 1 1 109 109 ALA H H 1 8.539 . . . . . . . 109 A H . 19065 1 206 . 1 1 109 109 ALA N N 15 122.677 . . . . . . . 109 A N . 19065 1 207 . 1 1 110 110 CYS H H 1 8.233 . . . . . . . 110 C H . 19065 1 208 . 1 1 110 110 CYS N N 15 119.243 . . . . . . . 110 C N . 19065 1 209 . 1 1 111 111 GLU H H 1 8.525 . . . . . . . 111 E H . 19065 1 210 . 1 1 111 111 GLU N N 15 120.132 . . . . . . . 111 E N . 19065 1 211 . 1 1 112 112 GLY H H 1 8.706 . . . . . . . 112 G H . 19065 1 212 . 1 1 112 112 GLY N N 15 109.127 . . . . . . . 112 G N . 19065 1 213 . 1 1 113 113 ASN H H 1 7.743 . . . . . . . 113 N H . 19065 1 214 . 1 1 113 113 ASN N N 15 114.227 . . . . . . . 113 N N . 19065 1 215 . 1 1 115 115 TYR H H 1 8.396 . . . . . . . 115 Y H . 19065 1 216 . 1 1 115 115 TYR N N 15 125.161 . . . . . . . 115 Y N . 19065 1 217 . 1 1 116 116 VAL H H 1 7.601 . . . . . . . 116 V H . 19065 1 218 . 1 1 116 116 VAL N N 15 118.946 . . . . . . . 116 V N . 19065 1 219 . 1 1 118 118 VAL H H 1 8.848 . . . . . . . 118 V H . 19065 1 220 . 1 1 118 118 VAL N N 15 109.925 . . . . . . . 118 V N . 19065 1 221 . 1 1 119 119 HIS H H 1 7.581 . . . . . . . 119 H H . 19065 1 222 . 1 1 119 119 HIS N N 15 119.497 . . . . . . . 119 H N . 19065 1 223 . 1 1 120 120 PHE H H 1 9.748 . . . . . . . 120 F H . 19065 1 224 . 1 1 120 120 PHE N N 15 130.153 . . . . . . . 120 F N . 19065 1 225 . 1 1 121 121 ASP H H 1 8.824 . . . . . . . 121 D H . 19065 1 226 . 1 1 121 121 ASP N N 15 131.264 . . . . . . . 121 D N . 19065 1 227 . 1 1 122 122 ALA H H 1 7.452 . . . . . . . 122 A H . 19065 1 228 . 1 1 122 122 ALA N N 15 116.039 . . . . . . . 122 A N . 19065 1 229 . 1 1 123 123 SER H H 1 8.100 . . . . . . . 123 S H . 19065 1 230 . 1 1 123 123 SER N N 15 111.588 . . . . . . . 123 S N . 19065 1 231 . 1 1 124 124 VAL H H 1 8.758 . . . . . . . 124 V H . 19065 1 232 . 1 1 124 124 VAL N N 15 123.494 . . . . . . . 124 V N . 19065 1 stop_ save_