################################### # 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 27741 _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 $chem_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' . . . 27741 1 2 '3D HNCO' . . . 27741 1 3 '3D HNCA' . . . 27741 1 4 '3D HN(CO)CA' . . . 27741 1 5 '3D HNCACB' . . . 27741 1 6 '3D CBCA(CO)NH' . . . 27741 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.Ambiguity_set_ID _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 5 5 VAL H H 1 8.562 . . . . . . . . 84 V H . 27741 1 2 . 1 1 5 5 VAL N N 15 124.153 . . . . . . . . 84 V N . 27741 1 3 . 1 1 6 6 GLY H H 1 9.160 . . . . . . . . 85 G H . 27741 1 4 . 1 1 6 6 GLY N N 15 117.570 . . . . . . . . 85 G N . 27741 1 5 . 1 1 7 7 SER H H 1 7.909 . . . . . . . . 86 S H . 27741 1 6 . 1 1 7 7 SER N N 15 118.064 . . . . . . . . 86 S N . 27741 1 7 . 1 1 8 8 GLN H H 1 8.540 . . . . . . . . 87 Q H . 27741 1 8 . 1 1 8 8 GLN N N 15 122.555 . . . . . . . . 87 Q N . 27741 1 9 . 1 1 9 9 VAL H H 1 8.802 . . . . . . . . 88 V H . 27741 1 10 . 1 1 9 9 VAL N N 15 117.399 . . . . . . . . 88 V N . 27741 1 11 . 1 1 10 10 ILE H H 1 8.780 . . . . . . . . 89 I H . 27741 1 12 . 1 1 10 10 ILE N N 15 121.316 . . . . . . . . 89 I N . 27741 1 13 . 1 1 11 11 ILE H H 1 8.469 . . . . . . . . 90 I H . 27741 1 14 . 1 1 11 11 ILE N N 15 125.749 . . . . . . . . 90 I N . 27741 1 15 . 1 1 12 12 ASN H H 1 8.949 . . . . . . . . 91 N H . 27741 1 16 . 1 1 12 12 ASN N N 15 128.116 . . . . . . . . 91 N N . 27741 1 17 . 1 1 13 13 THR H H 1 6.637 . . . . . . . . 92 T H . 27741 1 18 . 1 1 13 13 THR N N 15 113.629 . . . . . . . . 92 T N . 27741 1 19 . 1 1 14 14 SER H H 1 7.603 . . . . . . . . 93 S H . 27741 1 20 . 1 1 14 14 SER N N 15 113.598 . . . . . . . . 93 S N . 27741 1 21 . 1 1 16 16 MET H H 1 7.114 . . . . . . . . 95 M H . 27741 1 22 . 1 1 16 16 MET N N 15 111.886 . . . . . . . . 95 M N . 27741 1 23 . 1 1 19 19 MET H H 1 7.351 . . . . . . . . 98 M H . 27741 1 24 . 1 1 19 19 MET N N 15 117.291 . . . . . . . . 98 M N . 27741 1 25 . 1 1 20 20 LYS H H 1 8.079 . . . . . . . . 99 K H . 27741 1 26 . 1 1 20 20 LYS N N 15 121.010 . . . . . . . . 99 K N . 27741 1 27 . 1 1 21 21 GLY H H 1 9.233 . . . . . . . . 100 G H . 27741 1 28 . 1 1 21 21 GLY N N 15 118.489 . . . . . . . . 100 G N . 27741 1 29 . 1 1 22 22 ALA H H 1 8.170 . . . . . . . . 101 A H . 27741 1 30 . 1 1 22 22 ALA N N 15 124.703 . . . . . . . . 101 A N . 27741 1 31 . 1 1 23 23 GLU H H 1 8.480 . . . . . . . . 102 E H . 27741 1 32 . 1 1 23 23 GLU N N 15 120.916 . . . . . . . . 102 E N . 27741 1 33 . 1 1 24 24 ALA H H 1 9.109 . . . . . . . . 103 A H . 27741 1 34 . 1 1 24 24 ALA N N 15 128.681 . . . . . . . . 103 A N . 27741 1 35 . 1 1 25 25 THR H H 1 8.822 . . . . . . . . 104 T H . 27741 1 36 . 1 1 25 25 THR N N 15 115.940 . . . . . . . . 104 T N . 27741 1 37 . 1 1 26 26 VAL H H 1 8.513 . . . . . . . . 105 V H . 27741 1 38 . 1 1 26 26 VAL N N 15 126.103 . . . . . . . . 105 V N . 27741 1 39 . 1 1 27 27 THR H H 1 9.500 . . . . . . . . 106 T H . 27741 1 40 . 1 1 27 27 THR N N 15 121.915 . . . . . . . . 106 T N . 27741 1 41 . 1 1 28 28 GLY H H 1 7.815 . . . . . . . . 107 G H . 27741 1 42 . 1 1 28 28 GLY N N 15 110.920 . . . . . . . . 107 G N . 27741 1 43 . 1 1 29 29 ALA H H 1 7.763 . . . . . . . . 108 A H . 27741 1 44 . 1 1 29 29 ALA N N 15 127.879 . . . . . . . . 108 A N . 27741 1 45 . 1 1 30 30 TYR H H 1 8.646 . . . . . . . . 109 Y H . 27741 1 46 . 1 1 30 30 TYR N N 15 120.158 . . . . . . . . 109 Y N . 27741 1 47 . 1 1 31 31 ASP H H 1 8.585 . . . . . . . . 110 D H . 27741 1 48 . 1 1 31 31 ASP N N 15 126.278 . . . . . . . . 110 D N . 27741 1 49 . 1 1 32 32 THR H H 1 7.847 . . . . . . . . 111 T H . 27741 1 50 . 1 1 32 32 THR N N 15 121.985 . . . . . . . . 111 T N . 27741 1 51 . 1 1 33 33 THR H H 1 8.524 . . . . . . . . 112 T H . 27741 1 52 . 1 1 33 33 THR N N 15 119.106 . . . . . . . . 112 T N . 27741 1 53 . 1 1 34 34 ALA H H 1 8.763 . . . . . . . . 113 A H . 27741 1 54 . 1 1 34 34 ALA N N 15 130.136 . . . . . . . . 113 A N . 27741 1 55 . 1 1 35 35 TYR H H 1 9.517 . . . . . . . . 114 Y H . 27741 1 56 . 1 1 35 35 TYR N N 15 119.829 . . . . . . . . 114 Y N . 27741 1 57 . 1 1 36 36 VAL H H 1 8.164 . . . . . . . . 115 V H . 27741 1 58 . 1 1 36 36 VAL N N 15 124.668 . . . . . . . . 115 V N . 27741 1 59 . 1 1 37 37 VAL H H 1 8.391 . . . . . . . . 116 V H . 27741 1 60 . 1 1 37 37 VAL N N 15 118.280 . . . . . . . . 116 V N . 27741 1 61 . 1 1 38 38 SER H H 1 8.513 . . . . . . . . 117 S H . 27741 1 62 . 1 1 38 38 SER N N 15 118.988 . . . . . . . . 117 S N . 27741 1 63 . 1 1 39 39 TYR H H 1 8.851 . . . . . . . . 118 Y H . 27741 1 64 . 1 1 39 39 TYR N N 15 120.827 . . . . . . . . 118 Y N . 27741 1 65 . 1 1 40 40 THR H H 1 8.387 . . . . . . . . 119 T H . 27741 1 66 . 1 1 40 40 THR N N 15 121.187 . . . . . . . . 119 T N . 27741 1 67 . 1 1 42 42 THR H H 1 9.679 . . . . . . . . 121 T H . 27741 1 68 . 1 1 42 42 THR N N 15 114.892 . . . . . . . . 121 T N . 27741 1 69 . 1 1 43 43 ASN H H 1 7.797 . . . . . . . . 122 N H . 27741 1 70 . 1 1 43 43 ASN N N 15 116.551 . . . . . . . . 122 N N . 27741 1 71 . 1 1 44 44 GLY H H 1 7.684 . . . . . . . . 123 G H . 27741 1 72 . 1 1 44 44 GLY N N 15 108.851 . . . . . . . . 123 G N . 27741 1 73 . 1 1 45 45 GLY H H 1 7.464 . . . . . . . . 124 G H . 27741 1 74 . 1 1 45 45 GLY N N 15 105.727 . . . . . . . . 124 G N . 27741 1 75 . 1 1 46 46 GLN H H 1 7.940 . . . . . . . . 125 Q H . 27741 1 76 . 1 1 46 46 GLN N N 15 118.925 . . . . . . . . 125 Q N . 27741 1 77 . 1 1 47 47 ARG H H 1 8.218 . . . . . . . . 126 R H . 27741 1 78 . 1 1 47 47 ARG N N 15 121.653 . . . . . . . . 126 R N . 27741 1 79 . 1 1 48 48 VAL H H 1 8.505 . . . . . . . . 127 V H . 27741 1 80 . 1 1 48 48 VAL N N 15 130.406 . . . . . . . . 127 V N . 27741 1 81 . 1 1 49 49 ASP H H 1 7.930 . . . . . . . . 128 D H . 27741 1 82 . 1 1 49 49 ASP N N 15 125.806 . . . . . . . . 128 D N . 27741 1 83 . 1 1 50 50 HIS H H 1 9.389 . . . . . . . . 129 H H . 27741 1 84 . 1 1 50 50 HIS N N 15 123.323 . . . . . . . . 129 H N . 27741 1 85 . 1 1 51 51 HIS H H 1 9.418 . . . . . . . . 130 H H . 27741 1 86 . 1 1 51 51 HIS N N 15 119.087 . . . . . . . . 130 H N . 27741 1 87 . 1 1 52 52 LYS H H 1 6.988 . . . . . . . . 131 K H . 27741 1 88 . 1 1 52 52 LYS N N 15 129.917 . . . . . . . . 131 K N . 27741 1 89 . 1 1 54 54 VAL H H 1 9.023 . . . . . . . . 133 V H . 27741 1 90 . 1 1 54 54 VAL N N 15 115.839 . . . . . . . . 133 V N . 27741 1 91 . 1 1 55 55 ILE H H 1 8.744 . . . . . . . . 134 I H . 27741 1 92 . 1 1 55 55 ILE N N 15 116.857 . . . . . . . . 134 I N . 27741 1 93 . 1 1 56 56 GLN H H 1 7.838 . . . . . . . . 135 Q H . 27741 1 94 . 1 1 56 56 GLN N N 15 122.823 . . . . . . . . 135 Q N . 27741 1 95 . 1 1 57 57 GLU H H 1 9.077 . . . . . . . . 136 E H . 27741 1 96 . 1 1 57 57 GLU N N 15 114.266 . . . . . . . . 136 E N . 27741 1 97 . 1 1 58 58 GLU H H 1 8.256 . . . . . . . . 137 E H . 27741 1 98 . 1 1 58 58 GLU N N 15 118.186 . . . . . . . . 137 E N . 27741 1 99 . 1 1 59 59 ILE H H 1 7.410 . . . . . . . . 138 I H . 27741 1 100 . 1 1 59 59 ILE N N 15 122.782 . . . . . . . . 138 I N . 27741 1 101 . 1 1 60 60 LYS H H 1 8.475 . . . . . . . . 139 K H . 27741 1 102 . 1 1 60 60 LYS N N 15 130.471 . . . . . . . . 139 K N . 27741 1 103 . 1 1 61 61 ASP H H 1 9.098 . . . . . . . . 140 D H . 27741 1 104 . 1 1 61 61 ASP N N 15 122.637 . . . . . . . . 140 D N . 27741 1 105 . 1 1 62 62 ALA H H 1 7.338 . . . . . . . . 141 A H . 27741 1 106 . 1 1 62 62 ALA N N 15 121.741 . . . . . . . . 141 A N . 27741 1 107 . 1 1 63 63 GLY H H 1 8.321 . . . . . . . . 142 G H . 27741 1 108 . 1 1 63 63 GLY N N 15 105.320 . . . . . . . . 142 G N . 27741 1 109 . 1 1 64 64 ASP H H 1 8.490 . . . . . . . . 143 D H . 27741 1 110 . 1 1 64 64 ASP N N 15 125.702 . . . . . . . . 143 D N . 27741 1 111 . 1 1 65 65 LYS H H 1 7.729 . . . . . . . . 144 K H . 27741 1 112 . 1 1 65 65 LYS N N 15 121.359 . . . . . . . . 144 K N . 27741 1 113 . 1 1 66 66 THR H H 1 8.480 . . . . . . . . 145 T H . 27741 1 114 . 1 1 66 66 THR N N 15 120.916 . . . . . . . . 145 T N . 27741 1 115 . 1 1 67 67 LEU H H 1 8.221 . . . . . . . . 146 L H . 27741 1 116 . 1 1 67 67 LEU N N 15 131.557 . . . . . . . . 146 L N . 27741 1 117 . 1 1 68 68 GLN H H 1 8.657 . . . . . . . . 147 Q H . 27741 1 118 . 1 1 68 68 GLN N N 15 119.624 . . . . . . . . 147 Q N . 27741 1 119 . 1 1 70 70 GLY H H 1 9.448 . . . . . . . . 149 G H . 27741 1 120 . 1 1 70 70 GLY N N 15 115.914 . . . . . . . . 149 G N . 27741 1 121 . 1 1 71 71 ASP H H 1 8.295 . . . . . . . . 150 D H . 27741 1 122 . 1 1 71 71 ASP N N 15 124.057 . . . . . . . . 150 D N . 27741 1 123 . 1 1 72 72 GLN H H 1 8.266 . . . . . . . . 151 Q H . 27741 1 124 . 1 1 72 72 GLN N N 15 120.647 . . . . . . . . 151 Q N . 27741 1 125 . 1 1 73 73 VAL H H 1 9.041 . . . . . . . . 152 V H . 27741 1 126 . 1 1 73 73 VAL N N 15 118.358 . . . . . . . . 152 V N . 27741 1 127 . 1 1 74 74 ILE H H 1 8.735 . . . . . . . . 153 I H . 27741 1 128 . 1 1 74 74 ILE N N 15 121.797 . . . . . . . . 153 I N . 27741 1 129 . 1 1 75 75 LEU H H 1 8.342 . . . . . . . . 154 L H . 27741 1 130 . 1 1 75 75 LEU N N 15 123.982 . . . . . . . . 154 L N . 27741 1 131 . 1 1 76 76 GLU H H 1 8.854 . . . . . . . . 155 E H . 27741 1 132 . 1 1 76 76 GLU N N 15 122.152 . . . . . . . . 155 E N . 27741 1 133 . 1 1 77 77 ALA H H 1 6.217 . . . . . . . . 156 A H . 27741 1 134 . 1 1 77 77 ALA N N 15 121.362 . . . . . . . . 156 A N . 27741 1 135 . 1 1 78 78 SER H H 1 8.128 . . . . . . . . 157 S H . 27741 1 136 . 1 1 78 78 SER N N 15 111.186 . . . . . . . . 157 S N . 27741 1 137 . 1 1 79 79 HIS H H 1 6.996 . . . . . . . . 158 H H . 27741 1 138 . 1 1 79 79 HIS N N 15 120.293 . . . . . . . . 158 H N . 27741 1 139 . 1 1 80 80 MET H H 1 6.970 . . . . . . . . 159 M H . 27741 1 140 . 1 1 80 80 MET N N 15 110.815 . . . . . . . . 159 M N . 27741 1 141 . 1 1 83 83 MET H H 1 7.374 . . . . . . . . 162 M H . 27741 1 142 . 1 1 83 83 MET N N 15 119.647 . . . . . . . . 162 M N . 27741 1 143 . 1 1 84 84 LYS H H 1 8.082 . . . . . . . . 163 K H . 27741 1 144 . 1 1 84 84 LYS N N 15 120.318 . . . . . . . . 163 K N . 27741 1 145 . 1 1 85 85 GLY H H 1 8.918 . . . . . . . . 164 G H . 27741 1 146 . 1 1 85 85 GLY N N 15 117.191 . . . . . . . . 164 G N . 27741 1 147 . 1 1 86 86 ALA H H 1 8.149 . . . . . . . . 165 A H . 27741 1 148 . 1 1 86 86 ALA N N 15 124.991 . . . . . . . . 165 A N . 27741 1 149 . 1 1 87 87 THR H H 1 8.438 . . . . . . . . 166 T H . 27741 1 150 . 1 1 87 87 THR N N 15 117.370 . . . . . . . . 166 T N . 27741 1 151 . 1 1 88 88 ALA H H 1 9.538 . . . . . . . . 167 A H . 27741 1 152 . 1 1 88 88 ALA N N 15 131.581 . . . . . . . . 167 A N . 27741 1 153 . 1 1 89 89 GLU H H 1 8.942 . . . . . . . . 168 E H . 27741 1 154 . 1 1 89 89 GLU N N 15 120.260 . . . . . . . . 168 E N . 27741 1 155 . 1 1 90 90 ILE H H 1 8.316 . . . . . . . . 169 I H . 27741 1 156 . 1 1 90 90 ILE N N 15 123.333 . . . . . . . . 169 I N . 27741 1 157 . 1 1 91 91 ASP H H 1 9.619 . . . . . . . . 170 D H . 27741 1 158 . 1 1 91 91 ASP N N 15 129.987 . . . . . . . . 170 D N . 27741 1 159 . 1 1 92 92 SER H H 1 7.713 . . . . . . . . 171 S H . 27741 1 160 . 1 1 92 92 SER N N 15 111.374 . . . . . . . . 171 S N . 27741 1 161 . 1 1 93 93 ALA H H 1 8.473 . . . . . . . . 172 A H . 27741 1 162 . 1 1 93 93 ALA N N 15 124.450 . . . . . . . . 172 A N . 27741 1 163 . 1 1 94 94 GLU H H 1 8.840 . . . . . . . . 173 E H . 27741 1 164 . 1 1 94 94 GLU N N 15 121.530 . . . . . . . . 173 E N . 27741 1 165 . 1 1 95 95 LYS H H 1 8.604 . . . . . . . . 174 K H . 27741 1 166 . 1 1 95 95 LYS N N 15 128.370 . . . . . . . . 174 K N . 27741 1 167 . 1 1 96 96 THR H H 1 8.019 . . . . . . . . 175 T H . 27741 1 168 . 1 1 96 96 THR N N 15 123.104 . . . . . . . . 175 T N . 27741 1 169 . 1 1 97 97 THR H H 1 7.986 . . . . . . . . 176 T H . 27741 1 170 . 1 1 97 97 THR N N 15 119.548 . . . . . . . . 176 T N . 27741 1 171 . 1 1 98 98 VAL H H 1 8.613 . . . . . . . . 177 V H . 27741 1 172 . 1 1 98 98 VAL N N 15 121.995 . . . . . . . . 177 V N . 27741 1 173 . 1 1 100 100 MET H H 1 8.316 . . . . . . . . 179 M H . 27741 1 174 . 1 1 100 100 MET N N 15 123.333 . . . . . . . . 179 M N . 27741 1 175 . 1 1 101 101 VAL H H 1 7.947 . . . . . . . . 180 V H . 27741 1 176 . 1 1 101 101 VAL N N 15 113.771 . . . . . . . . 180 V N . 27741 1 177 . 1 1 102 102 ASP H H 1 8.468 . . . . . . . . 181 D H . 27741 1 178 . 1 1 102 102 ASP N N 15 123.578 . . . . . . . . 181 D N . 27741 1 179 . 1 1 103 103 TYR H H 1 8.776 . . . . . . . . 182 Y H . 27741 1 180 . 1 1 103 103 TYR N N 15 118.743 . . . . . . . . 182 Y N . 27741 1 181 . 1 1 104 104 THR H H 1 8.057 . . . . . . . . 183 T H . 27741 1 182 . 1 1 104 104 THR N N 15 118.070 . . . . . . . . 183 T N . 27741 1 183 . 1 1 105 105 SER H H 1 8.767 . . . . . . . . 184 S H . 27741 1 184 . 1 1 105 105 SER N N 15 122.821 . . . . . . . . 184 S N . 27741 1 185 . 1 1 106 106 THR H H 1 9.963 . . . . . . . . 185 T H . 27741 1 186 . 1 1 106 106 THR N N 15 122.069 . . . . . . . . 185 T N . 27741 1 187 . 1 1 107 107 THR H H 1 7.912 . . . . . . . . 186 T H . 27741 1 188 . 1 1 107 107 THR N N 15 112.460 . . . . . . . . 186 T N . 27741 1 189 . 1 1 109 109 GLY H H 1 7.534 . . . . . . . . 188 G H . 27741 1 190 . 1 1 109 109 GLY N N 15 111.676 . . . . . . . . 188 G N . 27741 1 191 . 1 1 110 110 GLU H H 1 7.876 . . . . . . . . 189 E H . 27741 1 192 . 1 1 110 110 GLU N N 15 121.368 . . . . . . . . 189 E N . 27741 1 193 . 1 1 111 111 LYS H H 1 8.461 . . . . . . . . 190 K H . 27741 1 194 . 1 1 111 111 LYS N N 15 124.882 . . . . . . . . 190 K N . 27741 1 195 . 1 1 112 112 VAL H H 1 8.867 . . . . . . . . 191 V H . 27741 1 196 . 1 1 112 112 VAL N N 15 131.279 . . . . . . . . 191 V N . 27741 1 197 . 1 1 113 113 LYS H H 1 8.297 . . . . . . . . 192 K H . 27741 1 198 . 1 1 113 113 LYS N N 15 126.668 . . . . . . . . 192 K N . 27741 1 199 . 1 1 114 114 ASN H H 1 9.696 . . . . . . . . 193 N H . 27741 1 200 . 1 1 114 114 ASN N N 15 121.271 . . . . . . . . 193 N N . 27741 1 201 . 1 1 115 115 HIS H H 1 9.176 . . . . . . . . 194 H H . 27741 1 202 . 1 1 115 115 HIS N N 15 117.234 . . . . . . . . 194 H N . 27741 1 203 . 1 1 116 116 LYS H H 1 6.767 . . . . . . . . 195 K H . 27741 1 204 . 1 1 116 116 LYS N N 15 130.442 . . . . . . . . 195 K N . 27741 1 205 . 1 1 120 120 GLU H H 1 8.190 . . . . . . . . 199 E H . 27741 1 206 . 1 1 120 120 GLU N N 15 120.686 . . . . . . . . 199 E N . 27741 1 207 . 1 1 121 121 ASP H H 1 7.947 . . . . . . . . 200 D H . 27741 1 208 . 1 1 121 121 ASP N N 15 113.771 . . . . . . . . 200 D N . 27741 1 209 . 1 1 122 122 GLU H H 1 7.813 . . . . . . . . 201 E H . 27741 1 210 . 1 1 122 122 GLU N N 15 119.205 . . . . . . . . 201 E N . 27741 1 211 . 1 1 123 123 LEU H H 1 7.325 . . . . . . . . 202 L H . 27741 1 212 . 1 1 123 123 LEU N N 15 118.285 . . . . . . . . 202 L N . 27741 1 213 . 1 1 124 124 SER H H 1 8.613 . . . . . . . . 203 S H . 27741 1 214 . 1 1 124 124 SER N N 15 114.962 . . . . . . . . 203 S N . 27741 1 215 . 1 1 125 125 ALA H H 1 8.597 . . . . . . . . 204 A H . 27741 1 216 . 1 1 125 125 ALA N N 15 127.146 . . . . . . . . 204 A N . 27741 1 217 . 1 1 126 126 LYS H H 1 8.165 . . . . . . . . 205 K H . 27741 1 218 . 1 1 126 126 LYS N N 15 122.985 . . . . . . . . 205 K N . 27741 1 219 . 1 1 127 127 LEU H H 1 8.141 . . . . . . . . 206 L H . 27741 1 220 . 1 1 127 127 LEU N N 15 126.312 . . . . . . . . 206 L N . 27741 1 221 . 1 1 128 128 GLU H H 1 8.249 . . . . . . . . 207 E H . 27741 1 222 . 1 1 128 128 GLU N N 15 122.843 . . . . . . . . 207 E N . 27741 1 stop_ save_