################################### # 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 27844 _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' . . . 27844 1 2 '3D HNCO' . . . 27844 1 3 '3D HNCA' . . . 27844 1 4 '3D HN(CO)CA' . . . 27844 1 5 '3D CBCA(CO)NH' . . . 27844 1 6 '3D HNCACB' . . . 27844 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 3 3 ASP H H 1 8.422 . . . . . . . . 3 D H . 27844 1 2 . 1 1 3 3 ASP N N 15 117.659 . . . . . . . . 3 D N . 27844 1 3 . 1 1 4 4 THR H H 1 7.904 . . . . . . . . 4 T H . 27844 1 4 . 1 1 4 4 THR N N 15 112.896 . . . . . . . . 4 T N . 27844 1 5 . 1 1 7 7 VAL H H 1 8.027 . . . . . . . . 7 V H . 27844 1 6 . 1 1 7 7 VAL N N 15 115.713 . . . . . . . . 7 V N . 27844 1 7 . 1 1 8 8 ILE H H 1 9.101 . . . . . . . . 8 I H . 27844 1 8 . 1 1 8 8 ILE N N 15 121.448 . . . . . . . . 8 I N . 27844 1 9 . 1 1 10 10 LYS H H 1 8.666 . . . . . . . . 10 K H . 27844 1 10 . 1 1 10 10 LYS N N 15 119.815 . . . . . . . . 10 K N . 27844 1 11 . 1 1 11 11 GLN H H 1 8.31 . . . . . . . . 11 Q H . 27844 1 12 . 1 1 11 11 GLN N N 15 112.236 . . . . . . . . 11 Q N . 27844 1 13 . 1 1 12 12 LYS H H 1 8.907 . . . . . . . . 12 K H . 27844 1 14 . 1 1 12 12 LYS N N 15 117.86 . . . . . . . . 12 K N . 27844 1 15 . 1 1 13 13 THR H H 1 9.268 . . . . . . . . 13 T H . 27844 1 16 . 1 1 13 13 THR N N 15 116.163 . . . . . . . . 13 T N . 27844 1 17 . 1 1 14 14 GLU H H 1 7.537 . . . . . . . . 14 E H . 27844 1 18 . 1 1 14 14 GLU N N 15 120.109 . . . . . . . . 14 E N . 27844 1 19 . 1 1 15 15 VAL H H 1 9.185 . . . . . . . . 15 V H . 27844 1 20 . 1 1 15 15 VAL N N 15 122.254 . . . . . . . . 15 V N . 27844 1 21 . 1 1 16 16 VAL H H 1 8.103 . . . . . . . . 16 V H . 27844 1 22 . 1 1 16 16 VAL N N 15 124.886 . . . . . . . . 16 V N . 27844 1 23 . 1 1 17 17 CYS H H 1 9.902 . . . . . . . . 17 C H . 27844 1 24 . 1 1 17 17 CYS N N 15 123.735 . . . . . . . . 17 C N . 27844 1 25 . 1 1 18 18 GLY H H 1 8.207 . . . . . . . . 18 G H . 27844 1 26 . 1 1 18 18 GLY N N 15 97.183 . . . . . . . . 18 G N . 27844 1 27 . 1 1 19 19 VAL H H 1 7.719 . . . . . . . . 19 V H . 27844 1 28 . 1 1 19 19 VAL N N 15 117.66 . . . . . . . . 19 V N . 27844 1 29 . 1 1 21 21 THR H H 1 8.597 . . . . . . . . 21 T H . 27844 1 30 . 1 1 21 21 THR N N 15 114.375 . . . . . . . . 21 T N . 27844 1 31 . 1 1 22 22 GLN H H 1 9.046 . . . . . . . . 22 Q H . 27844 1 32 . 1 1 22 22 GLN N N 15 121.533 . . . . . . . . 22 Q N . 27844 1 33 . 1 1 24 24 VAL H H 1 7.976 . . . . . . . . 24 V H . 27844 1 34 . 1 1 24 24 VAL N N 15 111.833 . . . . . . . . 24 V N . 27844 1 35 . 1 1 25 25 CYS H H 1 9.116 . . . . . . . . 25 C H . 27844 1 36 . 1 1 25 25 CYS N N 15 119.819 . . . . . . . . 25 C N . 27844 1 37 . 1 1 26 26 THR H H 1 9.318 . . . . . . . . 26 T H . 27844 1 38 . 1 1 26 26 THR N N 15 114.537 . . . . . . . . 26 T N . 27844 1 39 . 1 1 27 27 ALA H H 1 8.607 . . . . . . . . 27 A H . 27844 1 40 . 1 1 27 27 ALA N N 15 124.871 . . . . . . . . 27 A N . 27844 1 41 . 1 1 28 28 PHE H H 1 7.947 . . . . . . . . 28 F H . 27844 1 42 . 1 1 28 28 PHE N N 15 115.925 . . . . . . . . 28 F N . 27844 1 43 . 1 1 29 29 SER H H 1 8.023 . . . . . . . . 29 S H . 27844 1 44 . 1 1 29 29 SER N N 15 111.592 . . . . . . . . 29 S N . 27844 1 45 . 1 1 30 30 SER H H 1 8.889 . . . . . . . . 30 S H . 27844 1 46 . 1 1 30 30 SER N N 15 116.16 . . . . . . . . 30 S N . 27844 1 47 . 1 1 31 31 HIS H H 1 8.057 . . . . . . . . 31 H H . 27844 1 48 . 1 1 31 31 HIS N N 15 113.619 . . . . . . . . 31 H N . 27844 1 49 . 1 1 32 32 ILE H H 1 5.542 . . . . . . . . 32 I H . 27844 1 50 . 1 1 32 32 ILE N N 15 114.011 . . . . . . . . 32 I N . 27844 1 51 . 1 1 33 33 LEU H H 1 9.321 . . . . . . . . 33 L H . 27844 1 52 . 1 1 33 33 LEU N N 15 125.819 . . . . . . . . 33 L N . 27844 1 53 . 1 1 34 34 VAL H H 1 9.5 . . . . . . . . 34 V H . 27844 1 54 . 1 1 34 34 VAL N N 15 125.003 . . . . . . . . 34 V N . 27844 1 55 . 1 1 35 35 VAL H H 1 9.357 . . . . . . . . 35 V H . 27844 1 56 . 1 1 35 35 VAL N N 15 123.55 . . . . . . . . 35 V N . 27844 1 57 . 1 1 36 36 VAL H H 1 9.031 . . . . . . . . 36 V H . 27844 1 58 . 1 1 36 36 VAL N N 15 121.306 . . . . . . . . 36 V N . 27844 1 59 . 1 1 37 37 THR H H 1 9.112 . . . . . . . . 37 T H . 27844 1 60 . 1 1 37 37 THR N N 15 119.289 . . . . . . . . 37 T N . 27844 1 61 . 1 1 38 38 GLN H H 1 8.888 . . . . . . . . 38 Q H . 27844 1 62 . 1 1 38 38 GLN N N 15 122.218 . . . . . . . . 38 Q N . 27844 1 63 . 1 1 39 39 PHE H H 1 8.533 . . . . . . . . 39 F H . 27844 1 64 . 1 1 39 39 PHE N N 15 117.978 . . . . . . . . 39 F N . 27844 1 65 . 1 1 40 40 GLY H H 1 8.226 . . . . . . . . 40 G H . 27844 1 66 . 1 1 40 40 GLY N N 15 105.022 . . . . . . . . 40 G N . 27844 1 67 . 1 1 41 41 LYS H H 1 7.218 . . . . . . . . 41 K H . 27844 1 68 . 1 1 41 41 LYS N N 15 113.739 . . . . . . . . 41 K N . 27844 1 69 . 1 1 42 42 MET H H 1 7.862 . . . . . . . . 42 M H . 27844 1 70 . 1 1 42 42 MET N N 15 117.58 . . . . . . . . 42 M N . 27844 1 71 . 1 1 43 43 GLY H H 1 8.315 . . . . . . . . 43 G H . 27844 1 72 . 1 1 43 43 GLY N N 15 105.34 . . . . . . . . 43 G N . 27844 1 73 . 1 1 44 44 THR H H 1 8.038 . . . . . . . . 44 T H . 27844 1 74 . 1 1 44 44 THR N N 15 114.397 . . . . . . . . 44 T N . 27844 1 75 . 1 1 45 45 LEU H H 1 8.447 . . . . . . . . 45 L H . 27844 1 76 . 1 1 45 45 LEU N N 15 122.741 . . . . . . . . 45 L N . 27844 1 77 . 1 1 46 46 VAL H H 1 9.931 . . . . . . . . 46 V H . 27844 1 78 . 1 1 46 46 VAL N N 15 123.416 . . . . . . . . 46 V N . 27844 1 79 . 1 1 47 47 SER H H 1 9.065 . . . . . . . . 47 S H . 27844 1 80 . 1 1 47 47 SER N N 15 119.866 . . . . . . . . 47 S N . 27844 1 81 . 1 1 48 48 LEU H H 1 9.208 . . . . . . . . 48 L H . 27844 1 82 . 1 1 48 48 LEU N N 15 122.919 . . . . . . . . 48 L N . 27844 1 83 . 1 1 49 49 GLU H H 1 8.054 . . . . . . . . 49 E H . 27844 1 84 . 1 1 49 49 GLU N N 15 116.527 . . . . . . . . 49 E N . 27844 1 85 . 1 1 51 51 SER H H 1 8.587 . . . . . . . . 51 S H . 27844 1 86 . 1 1 51 51 SER N N 15 113.366 . . . . . . . . 51 S N . 27844 1 87 . 1 1 52 52 SER H H 1 8.259 . . . . . . . . 52 S H . 27844 1 88 . 1 1 52 52 SER N N 15 112.789 . . . . . . . . 52 S N . 27844 1 89 . 1 1 53 53 VAL H H 1 8.053 . . . . . . . . 53 V H . 27844 1 90 . 1 1 53 53 VAL N N 15 115.589 . . . . . . . . 53 V N . 27844 1 91 . 1 1 54 54 ALA H H 1 8.227 . . . . . . . . 54 A H . 27844 1 92 . 1 1 54 54 ALA N N 15 122.401 . . . . . . . . 54 A N . 27844 1 93 . 1 1 55 55 SER H H 1 8.112 . . . . . . . . 55 S H . 27844 1 94 . 1 1 55 55 SER N N 15 109.614 . . . . . . . . 55 S N . 27844 1 95 . 1 1 56 56 ASP H H 1 8.239 . . . . . . . . 56 D H . 27844 1 96 . 1 1 56 56 ASP N N 15 115.981 . . . . . . . . 56 D N . 27844 1 97 . 1 1 57 57 VAL H H 1 7.777 . . . . . . . . 57 V H . 27844 1 98 . 1 1 57 57 VAL N N 15 113.049 . . . . . . . . 57 V N . 27844 1 99 . 1 1 58 58 SER H H 1 8.094 . . . . . . . . 58 S H . 27844 1 100 . 1 1 58 58 SER N N 15 112.706 . . . . . . . . 58 S N . 27844 1 101 . 1 1 59 59 LYS H H 1 8.076 . . . . . . . . 59 K H . 27844 1 102 . 1 1 59 59 LYS N N 15 118.118 . . . . . . . . 59 K N . 27844 1 103 . 1 1 61 61 VAL H H 1 7.017 . . . . . . . . 61 V H . 27844 1 104 . 1 1 61 61 VAL N N 15 113.313 . . . . . . . . 61 V N . 27844 1 105 . 1 1 62 62 LEU H H 1 8.389 . . . . . . . . 62 L H . 27844 1 106 . 1 1 62 62 LEU N N 15 115.835 . . . . . . . . 62 L N . 27844 1 107 . 1 1 63 63 THR H H 1 8.255 . . . . . . . . 63 T H . 27844 1 108 . 1 1 63 63 THR N N 15 117.475 . . . . . . . . 63 T N . 27844 1 109 . 1 1 64 64 THR H H 1 8.198 . . . . . . . . 64 T H . 27844 1 110 . 1 1 64 64 THR N N 15 110.549 . . . . . . . . 64 T N . 27844 1 111 . 1 1 65 65 LYS H H 1 8.33 . . . . . . . . 65 K H . 27844 1 112 . 1 1 65 65 LYS N N 15 116.331 . . . . . . . . 65 K N . 27844 1 113 . 1 1 66 66 VAL H H 1 9.208 . . . . . . . . 66 V H . 27844 1 114 . 1 1 66 66 VAL N N 15 122.919 . . . . . . . . 66 V N . 27844 1 115 . 1 1 67 67 LEU H H 1 8.449 . . . . . . . . 67 L H . 27844 1 116 . 1 1 67 67 LEU N N 15 114.376 . . . . . . . . 67 L N . 27844 1 117 . 1 1 68 68 LEU H H 1 7.234 . . . . . . . . 68 L H . 27844 1 118 . 1 1 68 68 LEU N N 15 113.089 . . . . . . . . 68 L N . 27844 1 119 . 1 1 69 69 GLY H H 1 8.474 . . . . . . . . 69 G H . 27844 1 120 . 1 1 69 69 GLY N N 15 107.289 . . . . . . . . 69 G N . 27844 1 121 . 1 1 70 70 GLN H H 1 8.016 . . . . . . . . 70 Q H . 27844 1 122 . 1 1 70 70 GLN N N 15 112.236 . . . . . . . . 70 Q N . 27844 1 123 . 1 1 71 71 ASP H H 1 8.699 . . . . . . . . 71 D H . 27844 1 124 . 1 1 71 71 ASP N N 15 121.44 . . . . . . . . 71 D N . 27844 1 125 . 1 1 72 72 GLU H H 1 7.166 . . . . . . . . 72 E H . 27844 1 126 . 1 1 72 72 GLU N N 15 118.786 . . . . . . . . 72 E N . 27844 1 127 . 1 1 75 75 ILE H H 1 7.734 . . . . . . . . 75 I H . 27844 1 128 . 1 1 75 75 ILE N N 15 118.607 . . . . . . . . 75 I N . 27844 1 129 . 1 1 76 76 HIS H H 1 7.534 . . . . . . . . 76 H H . 27844 1 130 . 1 1 76 76 HIS N N 15 121.431 . . . . . . . . 76 H N . 27844 1 131 . 1 1 77 77 VAL H H 1 8.858 . . . . . . . . 77 V H . 27844 1 132 . 1 1 77 77 VAL N N 15 122.655 . . . . . . . . 77 V N . 27844 1 133 . 1 1 79 79 ALA H H 1 8.558 . . . . . . . . 79 A H . 27844 1 134 . 1 1 79 79 ALA N N 15 113.254 . . . . . . . . 79 A N . 27844 1 135 . 1 1 80 80 LYS H H 1 7.556 . . . . . . . . 80 K H . 27844 1 136 . 1 1 80 80 LYS N N 15 110.569 . . . . . . . . 80 K N . 27844 1 137 . 1 1 81 81 ASN H H 1 8.027 . . . . . . . . 81 N H . 27844 1 138 . 1 1 81 81 ASN N N 15 111.062 . . . . . . . . 81 N N . 27844 1 139 . 1 1 82 82 LEU H H 1 8.399 . . . . . . . . 82 L H . 27844 1 140 . 1 1 82 82 LEU N N 15 118.399 . . . . . . . . 82 L N . 27844 1 141 . 1 1 83 83 VAL H H 1 7.344 . . . . . . . . 83 V H . 27844 1 142 . 1 1 83 83 VAL N N 15 93.758 . . . . . . . . 83 V N . 27844 1 143 . 1 1 84 84 ALA H H 1 8.3 . . . . . . . . 84 A H . 27844 1 144 . 1 1 84 84 ALA N N 15 122.933 . . . . . . . . 84 A N . 27844 1 145 . 1 1 85 85 PHE H H 1 8.477 . . . . . . . . 85 F H . 27844 1 146 . 1 1 85 85 PHE N N 15 108.752 . . . . . . . . 85 F N . 27844 1 147 . 1 1 86 86 VAL H H 1 6.001 . . . . . . . . 86 V H . 27844 1 148 . 1 1 86 86 VAL N N 15 117.049 . . . . . . . . 86 V N . 27844 1 149 . 1 1 87 87 SER H H 1 6.298 . . . . . . . . 87 S H . 27844 1 150 . 1 1 87 87 SER N N 15 102.923 . . . . . . . . 87 S N . 27844 1 151 . 1 1 88 88 GLN H H 1 7.637 . . . . . . . . 88 Q H . 27844 1 152 . 1 1 88 88 GLN N N 15 110.683 . . . . . . . . 88 Q N . 27844 1 153 . 1 1 89 89 GLU H H 1 8.968 . . . . . . . . 89 E H . 27844 1 154 . 1 1 89 89 GLU N N 15 111.94 . . . . . . . . 89 E N . 27844 1 155 . 1 1 90 90 ALA H H 1 7.588 . . . . . . . . 90 A H . 27844 1 156 . 1 1 90 90 ALA N N 15 116.501 . . . . . . . . 90 A N . 27844 1 157 . 1 1 91 91 GLY H H 1 7.699 . . . . . . . . 91 G H . 27844 1 158 . 1 1 91 91 GLY N N 15 103.632 . . . . . . . . 91 G N . 27844 1 159 . 1 1 92 92 ASN H H 1 8.073 . . . . . . . . 92 N H . 27844 1 160 . 1 1 92 92 ASN N N 15 110.045 . . . . . . . . 92 N N . 27844 1 161 . 1 1 93 93 ARG H H 1 6.694 . . . . . . . . 93 R H . 27844 1 162 . 1 1 93 93 ARG N N 15 112.205 . . . . . . . . 93 R N . 27844 1 163 . 1 1 94 94 ALA H H 1 7.376 . . . . . . . . 94 A H . 27844 1 164 . 1 1 94 94 ALA N N 15 119.296 . . . . . . . . 94 A N . 27844 1 165 . 1 1 95 95 VAL H H 1 8.587 . . . . . . . . 95 V H . 27844 1 166 . 1 1 95 95 VAL N N 15 113.366 . . . . . . . . 95 V N . 27844 1 167 . 1 1 96 96 VAL H H 1 8.901 . . . . . . . . 96 V H . 27844 1 168 . 1 1 96 96 VAL N N 15 124.641 . . . . . . . . 96 V N . 27844 1 169 . 1 1 97 97 LEU H H 1 9.117 . . . . . . . . 97 L H . 27844 1 170 . 1 1 97 97 LEU N N 15 122.927 . . . . . . . . 97 L N . 27844 1 171 . 1 1 98 98 ALA H H 1 9.17 . . . . . . . . 98 A H . 27844 1 172 . 1 1 98 98 ALA N N 15 127.225 . . . . . . . . 98 A N . 27844 1 173 . 1 1 99 99 VAL H H 1 9.09 . . . . . . . . 99 V H . 27844 1 174 . 1 1 99 99 VAL N N 15 115.513 . . . . . . . . 99 V N . 27844 1 175 . 1 1 100 100 ALA H H 1 8.696 . . . . . . . . 100 A H . 27844 1 176 . 1 1 100 100 ALA N N 15 131.261 . . . . . . . . 100 A N . 27844 1 177 . 1 1 101 101 VAL H H 1 7.429 . . . . . . . . 101 V H . 27844 1 178 . 1 1 101 101 VAL N N 15 111.735 . . . . . . . . 101 V N . 27844 1 179 . 1 1 102 102 LYS H H 1 8.159 . . . . . . . . 102 K H . 27844 1 180 . 1 1 102 102 LYS N N 15 121.603 . . . . . . . . 102 K N . 27844 1 181 . 1 1 103 103 ASP H H 1 8.265 . . . . . . . . 103 D H . 27844 1 182 . 1 1 103 103 ASP N N 15 114.607 . . . . . . . . 103 D N . 27844 1 183 . 1 1 104 104 LYS H H 1 8.178 . . . . . . . . 104 K H . 27844 1 184 . 1 1 104 104 LYS N N 15 120.922 . . . . . . . . 104 K N . 27844 1 185 . 1 1 106 106 MET H H 1 7.005 . . . . . . . . 106 M H . 27844 1 186 . 1 1 106 106 MET N N 15 116.877 . . . . . . . . 106 M N . 27844 1 187 . 1 1 107 107 GLU H H 1 8.686 . . . . . . . . 107 E H . 27844 1 188 . 1 1 107 107 GLU N N 15 115.161 . . . . . . . . 107 E N . 27844 1 189 . 1 1 108 108 GLY H H 1 8.028 . . . . . . . . 108 G H . 27844 1 190 . 1 1 108 108 GLY N N 15 105.514 . . . . . . . . 108 G N . 27844 1 191 . 1 1 109 109 LEU H H 1 8.318 . . . . . . . . 109 L H . 27844 1 192 . 1 1 109 109 LEU N N 15 118.275 . . . . . . . . 109 L N . 27844 1 193 . 1 1 110 110 LYS H H 1 7.956 . . . . . . . . 110 K H . 27844 1 194 . 1 1 110 110 LYS N N 15 112.851 . . . . . . . . 110 K N . 27844 1 195 . 1 1 111 111 ALA H H 1 7.519 . . . . . . . . 111 A H . 27844 1 196 . 1 1 111 111 ALA N N 15 115.656 . . . . . . . . 111 A N . 27844 1 197 . 1 1 113 113 ARG H H 1 8.382 . . . . . . . . 113 R H . 27844 1 198 . 1 1 113 113 ARG N N 15 113.767 . . . . . . . . 113 R N . 27844 1 199 . 1 1 114 114 GLU H H 1 7.119 . . . . . . . . 114 E H . 27844 1 200 . 1 1 114 114 GLU N N 15 110.58 . . . . . . . . 114 E N . 27844 1 201 . 1 1 115 115 VAL H H 1 8.196 . . . . . . . . 115 V H . 27844 1 202 . 1 1 115 115 VAL N N 15 113.879 . . . . . . . . 115 V N . 27844 1 203 . 1 1 116 116 ILE H H 1 7.441 . . . . . . . . 116 I H . 27844 1 204 . 1 1 116 116 ILE N N 15 115.403 . . . . . . . . 116 I N . 27844 1 205 . 1 1 117 117 ARG H H 1 8.242 . . . . . . . . 117 R H . 27844 1 206 . 1 1 117 117 ARG N N 15 116.991 . . . . . . . . 117 R N . 27844 1 207 . 1 1 120 120 GLN H H 1 8.4 . . . . . . . . 120 Q H . 27844 1 208 . 1 1 120 120 GLN N N 15 117.014 . . . . . . . . 120 Q N . 27844 1 209 . 1 1 121 121 VAL H H 1 7.084 . . . . . . . . 121 V H . 27844 1 210 . 1 1 121 121 VAL N N 15 120.832 . . . . . . . . 121 V N . 27844 1 211 . 1 1 122 122 TRP H H 1 6.223 . . . . . . . . 122 W H . 27844 1 212 . 1 1 122 122 TRP N N 15 119.797 . . . . . . . . 122 W N . 27844 1 stop_ save_