################################### # 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 51224 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'Y99C MIF Mixed Trimers' _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' . . . 51224 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 1 $software_1 . . 51224 1 2 $software_2 . . 51224 1 3 $software_3 . . 51224 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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 . 2 . 2 2 2 MET H H 1 8.705 . . . . . . . . 2 M H . 51224 1 2 . 2 . 2 2 2 MET N N 15 119.524 . . . . . . . . 2 M N . 51224 1 3 . 2 . 2 3 3 PHE H H 1 8.886 . . . . . . . . 3 F H . 51224 1 4 . 2 . 2 3 3 PHE N N 15 126.154 . . . . . . . . 3 F N . 51224 1 5 . 2 . 2 4 4 ILE H H 1 8.259 . . . . . . . . 4 I H . 51224 1 6 . 2 . 2 4 4 ILE N N 15 128.981 . . . . . . . . 4 I N . 51224 1 7 . 2 . 2 5 5 VAL H H 1 8.309 . . . . . . . . 5 V H . 51224 1 8 . 2 . 2 5 5 VAL N N 15 123.445 . . . . . . . . 5 V N . 51224 1 9 . 2 . 2 6 6 ASN H H 1 8.286 . . . . . . . . 6 N H . 51224 1 10 . 2 . 2 6 6 ASN N N 15 127.358 . . . . . . . . 6 N N . 51224 1 11 . 2 . 2 7 7 THR H H 1 9.095 . . . . . . . . 7 T H . 51224 1 12 . 2 . 2 7 7 THR N N 15 118.128 . . . . . . . . 7 T N . 51224 1 13 . 2 . 2 11 11 ARG H H 1 9.046 . . . . . . . . 11 R H . 51224 1 14 . 2 . 2 11 11 ARG N N 15 124.938 . . . . . . . . 11 R N . 51224 1 15 . 2 . 2 12 12 ALA H H 1 8.642 . . . . . . . . 12 A H . 51224 1 16 . 2 . 2 12 12 ALA N N 15 119.385 . . . . . . . . 12 A N . 51224 1 17 . 2 . 2 13 13 SER H H 1 7.839 . . . . . . . . 13 S H . 51224 1 18 . 2 . 2 13 13 SER N N 15 113.36 . . . . . . . . 13 S N . 51224 1 19 . 2 . 2 14 14 VAL H H 1 7.498 . . . . . . . . 14 V H . 51224 1 20 . 2 . 2 14 14 VAL N N 15 124.425 . . . . . . . . 14 V N . 51224 1 21 . 2 . 2 16 16 ASP H H 1 8.751 . . . . . . . . 16 D H . 51224 1 22 . 2 . 2 16 16 ASP N N 15 124.612 . . . . . . . . 16 D N . 51224 1 23 . 2 . 2 18 18 PHE H H 1 7.798 . . . . . . . . 18 F H . 51224 1 24 . 2 . 2 18 18 PHE N N 15 122.371 . . . . . . . . 18 F N . 51224 1 25 . 2 . 2 19 19 LEU H H 1 8.276 . . . . . . . . 19 L H . 51224 1 26 . 2 . 2 19 19 LEU N N 15 116.861 . . . . . . . . 19 L N . 51224 1 27 . 2 . 2 20 20 SER H H 1 7.923 . . . . . . . . 20 S H . 51224 1 28 . 2 . 2 20 20 SER N N 15 118.882 . . . . . . . . 20 S N . 51224 1 29 . 2 . 2 21 21 GLU H H 1 8.134 . . . . . . . . 21 E H . 51224 1 30 . 2 . 2 21 21 GLU N N 15 125.206 . . . . . . . . 21 E N . 51224 1 31 . 2 . 2 22 22 LEU H H 1 8.23 . . . . . . . . 22 L H . 51224 1 32 . 2 . 2 22 22 LEU N N 15 118.499 . . . . . . . . 22 L N . 51224 1 33 . 2 . 2 23 23 THR H H 1 7.372 . . . . . . . . 23 T H . 51224 1 34 . 2 . 2 23 23 THR N N 15 115.231 . . . . . . . . 23 T N . 51224 1 35 . 2 . 2 24 24 GLN H H 1 7.799 . . . . . . . . 24 Q H . 51224 1 36 . 2 . 2 24 24 GLN N N 15 120.049 . . . . . . . . 24 Q N . 51224 1 37 . 2 . 2 25 25 GLN H H 1 8.501 . . . . . . . . 25 Q H . 51224 1 38 . 2 . 2 25 25 GLN N N 15 118.613 . . . . . . . . 25 Q N . 51224 1 39 . 2 . 2 26 26 LEU H H 1 8.369 . . . . . . . . 26 L H . 51224 1 40 . 2 . 2 26 26 LEU N N 15 119.924 . . . . . . . . 26 L N . 51224 1 41 . 2 . 2 27 27 ALA H H 1 8.193 . . . . . . . . 27 A H . 51224 1 42 . 2 . 2 27 27 ALA N N 15 128.069 . . . . . . . . 27 A N . 51224 1 43 . 2 . 2 28 28 GLN H H 1 7.484 . . . . . . . . 28 Q H . 51224 1 44 . 2 . 2 28 28 GLN N N 15 117.18 . . . . . . . . 28 Q N . 51224 1 45 . 2 . 2 29 29 ALA H H 1 7.939 . . . . . . . . 29 A H . 51224 1 46 . 2 . 2 29 29 ALA N N 15 119.993 . . . . . . . . 29 A N . 51224 1 47 . 2 . 2 30 30 THR H H 1 7.964 . . . . . . . . 30 T H . 51224 1 48 . 2 . 2 30 30 THR N N 15 104.909 . . . . . . . . 30 T N . 51224 1 49 . 2 . 2 31 31 GLY H H 1 7.621 . . . . . . . . 31 G H . 51224 1 50 . 2 . 2 31 31 GLY N N 15 110.89 . . . . . . . . 31 G N . 51224 1 51 . 2 . 2 32 32 LYS H H 1 7.596 . . . . . . . . 32 K H . 51224 1 52 . 2 . 2 32 32 LYS N N 15 122.195 . . . . . . . . 32 K N . 51224 1 53 . 2 . 2 35 35 GLN H H 1 8.419 . . . . . . . . 35 Q H . 51224 1 54 . 2 . 2 35 35 GLN N N 15 114.984 . . . . . . . . 35 Q N . 51224 1 55 . 2 . 2 36 36 TYR H H 1 7.336 . . . . . . . . 36 Y H . 51224 1 56 . 2 . 2 36 36 TYR N N 15 114.469 . . . . . . . . 36 Y N . 51224 1 57 . 2 . 2 37 37 ILE H H 1 7.614 . . . . . . . . 37 I H . 51224 1 58 . 2 . 2 37 37 ILE N N 15 122.242 . . . . . . . . 37 I N . 51224 1 59 . 2 . 2 38 38 ALA H H 1 9.069 . . . . . . . . 38 A H . 51224 1 60 . 2 . 2 38 38 ALA N N 15 135.684 . . . . . . . . 38 A N . 51224 1 61 . 2 . 2 39 39 VAL H H 1 8.678 . . . . . . . . 39 V H . 51224 1 62 . 2 . 2 39 39 VAL N N 15 117.802 . . . . . . . . 39 V N . 51224 1 63 . 2 . 2 40 40 HIS H H 1 8.617 . . . . . . . . 40 H H . 51224 1 64 . 2 . 2 40 40 HIS N N 15 127.775 . . . . . . . . 40 H N . 51224 1 65 . 2 . 2 41 41 VAL H H 1 8.673 . . . . . . . . 41 V H . 51224 1 66 . 2 . 2 41 41 VAL N N 15 127.166 . . . . . . . . 41 V N . 51224 1 67 . 2 . 2 42 42 VAL H H 1 9.212 . . . . . . . . 42 V H . 51224 1 68 . 2 . 2 42 42 VAL N N 15 130.16 . . . . . . . . 42 V N . 51224 1 69 . 2 . 2 44 44 ASP H H 1 8.644 . . . . . . . . 44 D H . 51224 1 70 . 2 . 2 44 44 ASP N N 15 113.312 . . . . . . . . 44 D N . 51224 1 71 . 2 . 2 45 45 GLN H H 1 8.603 . . . . . . . . 45 Q H . 51224 1 72 . 2 . 2 45 45 GLN N N 15 115.993 . . . . . . . . 45 Q N . 51224 1 73 . 2 . 2 47 47 MET H H 1 7.633 . . . . . . . . 47 M H . 51224 1 74 . 2 . 2 47 47 MET N N 15 123.218 . . . . . . . . 47 M N . 51224 1 75 . 2 . 2 48 48 ALA H H 1 8.902 . . . . . . . . 48 A H . 51224 1 76 . 2 . 2 48 48 ALA N N 15 122.725 . . . . . . . . 48 A N . 51224 1 77 . 2 . 2 49 49 PHE H H 1 8.314 . . . . . . . . 49 F H . 51224 1 78 . 2 . 2 49 49 PHE N N 15 122.423 . . . . . . . . 49 F N . 51224 1 79 . 2 . 2 50 50 GLY H H 1 9.002 . . . . . . . . 50 G H . 51224 1 80 . 2 . 2 50 50 GLY N N 15 120.899 . . . . . . . . 50 G N . 51224 1 81 . 2 . 2 51 51 GLY H H 1 9.571 . . . . . . . . 51 G H . 51224 1 82 . 2 . 2 51 51 GLY N N 15 107.403 . . . . . . . . 51 G N . 51224 1 83 . 2 . 2 52 52 SER H H 1 7.479 . . . . . . . . 52 S H . 51224 1 84 . 2 . 2 52 52 SER N N 15 115.004 . . . . . . . . 52 S N . 51224 1 85 . 2 . 2 54 54 GLU H H 1 7.588 . . . . . . . . 54 E H . 51224 1 86 . 2 . 2 54 54 GLU N N 15 120.863 . . . . . . . . 54 E N . 51224 1 87 . 2 . 2 56 56 CYS H H 1 9.483 . . . . . . . . 56 C H . 51224 1 88 . 2 . 2 56 56 CYS N N 15 123.187 . . . . . . . . 56 C N . 51224 1 89 . 2 . 2 57 57 ALA H H 1 8.776 . . . . . . . . 57 A H . 51224 1 90 . 2 . 2 57 57 ALA N N 15 120.903 . . . . . . . . 57 A N . 51224 1 91 . 2 . 2 58 58 LEU H H 1 8.631 . . . . . . . . 58 L H . 51224 1 92 . 2 . 2 58 58 LEU N N 15 120.267 . . . . . . . . 58 L N . 51224 1 93 . 2 . 2 59 59 CYS H H 1 9.06 . . . . . . . . 59 C H . 51224 1 94 . 2 . 2 59 59 CYS N N 15 122.334 . . . . . . . . 59 C N . 51224 1 95 . 2 . 2 62 62 HIS H H 1 9.084 . . . . . . . . 62 H H . 51224 1 96 . 2 . 2 62 62 HIS N N 15 125.526 . . . . . . . . 62 H N . 51224 1 97 . 2 . 2 63 63 SER H H 1 8.462 . . . . . . . . 63 S H . 51224 1 98 . 2 . 2 63 63 SER N N 15 116.015 . . . . . . . . 63 S N . 51224 1 99 . 2 . 2 64 64 ILE H H 1 7.844 . . . . . . . . 64 I H . 51224 1 100 . 2 . 2 64 64 ILE N N 15 129.258 . . . . . . . . 64 I N . 51224 1 101 . 2 . 2 65 65 GLY H H 1 7.917 . . . . . . . . 65 G H . 51224 1 102 . 2 . 2 65 65 GLY N N 15 119.343 . . . . . . . . 65 G N . 51224 1 103 . 2 . 2 66 66 LYS H H 1 8.299 . . . . . . . . 66 K H . 51224 1 104 . 2 . 2 66 66 LYS N N 15 110.827 . . . . . . . . 66 K N . 51224 1 105 . 2 . 2 67 67 ILE H H 1 7.371 . . . . . . . . 67 I H . 51224 1 106 . 2 . 2 67 67 ILE N N 15 118.588 . . . . . . . . 67 I N . 51224 1 107 . 2 . 2 68 68 GLY H H 1 7.647 . . . . . . . . 68 G H . 51224 1 108 . 2 . 2 68 68 GLY N N 15 115.077 . . . . . . . . 68 G N . 51224 1 109 . 2 . 2 72 72 ASN H H 1 7.971 . . . . . . . . 72 N H . 51224 1 110 . 2 . 2 72 72 ASN N N 15 118.145 . . . . . . . . 72 N N . 51224 1 111 . 2 . 2 73 73 ARG H H 1 7.43 . . . . . . . . 73 R H . 51224 1 112 . 2 . 2 73 73 ARG N N 15 122.452 . . . . . . . . 73 R N . 51224 1 113 . 2 . 2 74 74 SER H H 1 7.12 . . . . . . . . 74 S H . 51224 1 114 . 2 . 2 74 74 SER N N 15 116.56 . . . . . . . . 74 S N . 51224 1 115 . 2 . 2 75 75 TYR H H 1 8.506 . . . . . . . . 75 Y H . 51224 1 116 . 2 . 2 75 75 TYR N N 15 122.198 . . . . . . . . 75 Y N . 51224 1 117 . 2 . 2 76 76 SER H H 1 8.15 . . . . . . . . 76 S H . 51224 1 118 . 2 . 2 76 76 SER N N 15 116.965 . . . . . . . . 76 S N . 51224 1 119 . 2 . 2 77 77 LYS H H 1 7.524 . . . . . . . . 77 K H . 51224 1 120 . 2 . 2 77 77 LYS N N 15 124.875 . . . . . . . . 77 K N . 51224 1 121 . 2 . 2 78 78 LEU H H 1 7.47 . . . . . . . . 78 L H . 51224 1 122 . 2 . 2 78 78 LEU N N 15 120.74 . . . . . . . . 78 L N . 51224 1 123 . 2 . 2 79 79 LEU H H 1 8.932 . . . . . . . . 79 L H . 51224 1 124 . 2 . 2 79 79 LEU N N 15 118.932 . . . . . . . . 79 L N . 51224 1 125 . 2 . 2 80 80 CYS H H 1 8.644 . . . . . . . . 80 C H . 51224 1 126 . 2 . 2 80 80 CYS N N 15 116.69 . . . . . . . . 80 C N . 51224 1 127 . 2 . 2 81 81 GLY H H 1 7.637 . . . . . . . . 81 G H . 51224 1 128 . 2 . 2 81 81 GLY N N 15 108.525 . . . . . . . . 81 G N . 51224 1 129 . 2 . 2 82 82 LEU H H 1 7.74 . . . . . . . . 82 L H . 51224 1 130 . 2 . 2 82 82 LEU N N 15 123.675 . . . . . . . . 82 L N . 51224 1 131 . 2 . 2 83 83 LEU H H 1 8.289 . . . . . . . . 83 L H . 51224 1 132 . 2 . 2 83 83 LEU N N 15 119.731 . . . . . . . . 83 L N . 51224 1 133 . 2 . 2 84 84 ALA H H 1 8.112 . . . . . . . . 84 A H . 51224 1 134 . 2 . 2 84 84 ALA N N 15 123.621 . . . . . . . . 84 A N . 51224 1 135 . 2 . 2 85 85 GLU H H 1 8.11 . . . . . . . . 85 E H . 51224 1 136 . 2 . 2 85 85 GLU N N 15 118.257 . . . . . . . . 85 E N . 51224 1 137 . 2 . 2 86 86 ARG H H 1 8.398 . . . . . . . . 86 R H . 51224 1 138 . 2 . 2 86 86 ARG N N 15 112.342 . . . . . . . . 86 R N . 51224 1 139 . 2 . 2 87 87 LEU H H 1 7.027 . . . . . . . . 87 L H . 51224 1 140 . 2 . 2 87 87 LEU N N 15 114.537 . . . . . . . . 87 L N . 51224 1 141 . 2 . 2 88 88 ARG H H 1 6.947 . . . . . . . . 88 R H . 51224 1 142 . 2 . 2 88 88 ARG N N 15 113.746 . . . . . . . . 88 R N . 51224 1 143 . 2 . 2 89 89 ILE H H 1 6.821 . . . . . . . . 89 I H . 51224 1 144 . 2 . 2 89 89 ILE N N 15 119.874 . . . . . . . . 89 I N . 51224 1 145 . 2 . 2 90 90 SER H H 1 8.895 . . . . . . . . 90 S H . 51224 1 146 . 2 . 2 90 90 SER N N 15 125.122 . . . . . . . . 90 S N . 51224 1 147 . 2 . 2 92 92 ASP H H 1 7.21 . . . . . . . . 92 D H . 51224 1 148 . 2 . 2 92 92 ASP N N 15 112.217 . . . . . . . . 92 D N . 51224 1 149 . 2 . 2 93 93 ARG H H 1 8.063 . . . . . . . . 93 R H . 51224 1 150 . 2 . 2 93 93 ARG N N 15 124.582 . . . . . . . . 93 R N . 51224 1 151 . 2 . 2 95 95 TYR H H 1 7.825 . . . . . . . . 95 Y H . 51224 1 152 . 2 . 2 95 95 TYR N N 15 120 . . . . . . . . 95 Y N . 51224 1 153 . 2 . 2 96 96 ILE H H 1 8.841 . . . . . . . . 96 I H . 51224 1 154 . 2 . 2 96 96 ILE N N 15 120.756 . . . . . . . . 96 I N . 51224 1 155 . 2 . 2 97 97 ASN H H 1 8.198 . . . . . . . . 97 N H . 51224 1 156 . 2 . 2 97 97 ASN N N 15 126.872 . . . . . . . . 97 N N . 51224 1 157 . 2 . 2 98 98 TYR H H 1 8.45 . . . . . . . . 98 Y H . 51224 1 158 . 2 . 2 98 98 TYR N N 15 122.273 . . . . . . . . 98 Y N . 51224 1 159 . 2 . 2 99 99 TYR H H 1 8.682 . . . . . . . . 99 Y H . 51224 1 160 . 2 . 2 99 99 TYR N N 15 120.848 . . . . . . . . 99 Y N . 51224 1 161 . 2 . 2 100 100 ASP H H 1 8.615 . . . . . . . . 100 D H . 51224 1 162 . 2 . 2 100 100 ASP N N 15 125.322 . . . . . . . . 100 D N . 51224 1 163 . 2 . 2 101 101 MET H H 1 8.959 . . . . . . . . 101 M H . 51224 1 164 . 2 . 2 101 101 MET N N 15 126.694 . . . . . . . . 101 M N . 51224 1 165 . 2 . 2 102 102 ASN H H 1 8.679 . . . . . . . . 102 N H . 51224 1 166 . 2 . 2 102 102 ASN N N 15 123.242 . . . . . . . . 102 N N . 51224 1 167 . 2 . 2 103 103 ALA H H 1 9.019 . . . . . . . . 103 A H . 51224 1 168 . 2 . 2 103 103 ALA N N 15 131.346 . . . . . . . . 103 A N . 51224 1 169 . 2 . 2 104 104 ALA H H 1 8.209 . . . . . . . . 104 A H . 51224 1 170 . 2 . 2 104 104 ALA N N 15 115.487 . . . . . . . . 104 A N . 51224 1 171 . 2 . 2 105 105 ASN H H 1 8.16 . . . . . . . . 105 N H . 51224 1 172 . 2 . 2 105 105 ASN N N 15 115.071 . . . . . . . . 105 N N . 51224 1 173 . 2 . 2 106 106 VAL H H 1 7.257 . . . . . . . . 106 V H . 51224 1 174 . 2 . 2 106 106 VAL N N 15 120.43 . . . . . . . . 106 V N . 51224 1 175 . 2 . 2 107 107 GLY H H 1 10.448 . . . . . . . . 107 G H . 51224 1 176 . 2 . 2 107 107 GLY N N 15 114.126 . . . . . . . . 107 G N . 51224 1 177 . 2 . 2 108 108 TRP H H 1 8.504 . . . . . . . . 108 W H . 51224 1 178 . 2 . 2 108 108 TRP N N 15 122.95 . . . . . . . . 108 W N . 51224 1 179 . 2 . 2 109 109 ASN H H 1 7.056 . . . . . . . . 109 N H . 51224 1 180 . 2 . 2 109 109 ASN N N 15 127.459 . . . . . . . . 109 N N . 51224 1 181 . 2 . 2 110 110 ASN H H 1 7.114 . . . . . . . . 110 N H . 51224 1 182 . 2 . 2 110 110 ASN N N 15 105.622 . . . . . . . . 110 N N . 51224 1 183 . 2 . 2 111 111 SER H H 1 7.582 . . . . . . . . 111 S H . 51224 1 184 . 2 . 2 111 111 SER N N 15 114.8 . . . . . . . . 111 S N . 51224 1 185 . 2 . 2 112 112 THR H H 1 8.545 . . . . . . . . 112 T H . 51224 1 186 . 2 . 2 112 112 THR N N 15 112.238 . . . . . . . . 112 T N . 51224 1 187 . 2 . 2 113 113 PHE H H 1 8.077 . . . . . . . . 113 F H . 51224 1 188 . 2 . 2 113 113 PHE N N 15 119.215 . . . . . . . . 113 F N . 51224 1 189 . 2 . 2 114 114 ALA H H 1 7.301 . . . . . . . . 114 A H . 51224 1 190 . 2 . 2 114 114 ALA N N 15 127.586 . . . . . . . . 114 A N . 51224 1 stop_ save_