################################### # 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 27664 _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 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 'Assignments were made by comparing to BMRB 15498, 4769 and published literature.' _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' . . . 27664 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 4 $NMRView . . 27664 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 6 6 ARG H H 1 7.792 0.01 . . . . . . . 6 R H . 27664 1 2 . 1 1 6 6 ARG N N 15 120.084 0.2 . . . . . . . 6 R N . 27664 1 3 . 1 1 7 7 LEU H H 1 8.188 0.01 . . . . . . . 7 L H . 27664 1 4 . 1 1 7 7 LEU N N 15 117.758 0.2 . . . . . . . 7 L N . 27664 1 5 . 1 1 8 8 MET H H 1 8.361 0.01 . . . . . . . 8 M H . 27664 1 6 . 1 1 8 8 MET N N 15 117.861 0.2 . . . . . . . 8 M N . 27664 1 7 . 1 1 9 9 LYS H H 1 7.732 0.01 . . . . . . . 9 K H . 27664 1 8 . 1 1 9 9 LYS N N 15 120.017 0.2 . . . . . . . 9 K N . 27664 1 9 . 1 1 10 10 GLU H H 1 8.606 0.01 . . . . . . . 10 E H . 27664 1 10 . 1 1 10 10 GLU N N 15 119.762 0.2 . . . . . . . 10 E N . 27664 1 11 . 1 1 11 11 LEU H H 1 8.808 0.01 . . . . . . . 11 L H . 27664 1 12 . 1 1 11 11 LEU N N 15 120.762 0.2 . . . . . . . 11 L N . 27664 1 13 . 1 1 12 12 GLU H H 1 7.763 0.01 . . . . . . . 12 E H . 27664 1 14 . 1 1 12 12 GLU N N 15 118.602 0.2 . . . . . . . 12 E N . 27664 1 15 . 1 1 13 13 GLU H H 1 8.299 0.01 . . . . . . . 13 E H . 27664 1 16 . 1 1 13 13 GLU N N 15 118.481 0.2 . . . . . . . 13 E N . 27664 1 17 . 1 1 14 14 ILE H H 1 8.559 0.01 . . . . . . . 14 I H . 27664 1 18 . 1 1 14 14 ILE N N 15 121.779 0.2 . . . . . . . 14 I N . 27664 1 19 . 1 1 15 15 ARG H H 1 8.556 0.01 . . . . . . . 15 R H . 27664 1 20 . 1 1 15 15 ARG N N 15 121.201 0.2 . . . . . . . 15 R N . 27664 1 21 . 1 1 16 16 LYS H H 1 7.748 0.01 . . . . . . . 16 K H . 27664 1 22 . 1 1 16 16 LYS N N 15 117.443 0.2 . . . . . . . 16 K N . 27664 1 23 . 1 1 17 17 SER H H 1 7.786 0.01 . . . . . . . 17 S H . 27664 1 24 . 1 1 17 17 SER N N 15 114.220 0.2 . . . . . . . 17 S N . 27664 1 25 . 1 1 18 18 GLY H H 1 8.112 0.01 . . . . . . . 18 G H . 27664 1 26 . 1 1 18 18 GLY N N 15 110.559 0.2 . . . . . . . 18 G N . 27664 1 27 . 1 1 19 19 MET H H 1 8.392 0.01 . . . . . . . 19 M H . 27664 1 28 . 1 1 19 19 MET N N 15 119.321 0.2 . . . . . . . 19 M N . 27664 1 29 . 1 1 20 20 LYS H H 1 8.726 0.01 . . . . . . . 20 K H . 27664 1 30 . 1 1 20 20 LYS N N 15 122.538 0.2 . . . . . . . 20 K N . 27664 1 31 . 1 1 21 21 ASN H H 1 8.202 0.01 . . . . . . . 21 N H . 27664 1 32 . 1 1 21 21 ASN N N 15 111.901 0.2 . . . . . . . 21 N N . 27664 1 33 . 1 1 22 22 PHE H H 1 7.093 0.01 . . . . . . . 22 F H . 27664 1 34 . 1 1 22 22 PHE N N 15 120.390 0.2 . . . . . . . 22 F N . 27664 1 35 . 1 1 23 23 ARG H H 1 8.924 0.01 . . . . . . . 23 R H . 27664 1 36 . 1 1 23 23 ARG N N 15 122.321 0.2 . . . . . . . 23 R N . 27664 1 37 . 1 1 24 24 ASN H H 1 8.708 0.01 . . . . . . . 24 N H . 27664 1 38 . 1 1 24 24 ASN N N 15 116.926 0.2 . . . . . . . 24 N N . 27664 1 39 . 1 1 25 25 ILE H H 1 7.953 0.01 . . . . . . . 25 I H . 27664 1 40 . 1 1 25 25 ILE N N 15 118.159 0.2 . . . . . . . 25 I N . 27664 1 41 . 1 1 26 26 GLN H H 1 9.212 0.01 . . . . . . . 26 Q H . 27664 1 42 . 1 1 26 26 GLN N N 15 130.049 0.2 . . . . . . . 26 Q N . 27664 1 43 . 1 1 27 27 VAL H H 1 8.318 0.01 . . . . . . . 27 V H . 27664 1 44 . 1 1 27 27 VAL N N 15 123.003 0.2 . . . . . . . 27 V N . 27664 1 45 . 1 1 28 28 ASP H H 1 8.893 0.01 . . . . . . . 28 D H . 27664 1 46 . 1 1 28 28 ASP N N 15 127.249 0.2 . . . . . . . 28 D N . 27664 1 47 . 1 1 29 29 GLU H H 1 8.809 0.01 . . . . . . . 29 E H . 27664 1 48 . 1 1 29 29 GLU N N 15 125.575 0.2 . . . . . . . 29 E N . 27664 1 49 . 1 1 30 30 ALA H H 1 8.473 0.01 . . . . . . . 30 A H . 27664 1 50 . 1 1 30 30 ALA N N 15 119.973 0.2 . . . . . . . 30 A N . 27664 1 51 . 1 1 31 31 ASN H H 1 8.019 0.01 . . . . . . . 31 N H . 27664 1 52 . 1 1 31 31 ASN N N 15 115.248 0.2 . . . . . . . 31 N N . 27664 1 53 . 1 1 32 32 LEU H H 1 8.662 0.01 . . . . . . . 32 L H . 27664 1 54 . 1 1 32 32 LEU N N 15 121.738 0.2 . . . . . . . 32 L N . 27664 1 55 . 1 1 33 33 LEU H H 1 7.558 0.01 . . . . . . . 33 L H . 27664 1 56 . 1 1 33 33 LEU N N 15 112.507 0.2 . . . . . . . 33 L N . 27664 1 57 . 1 1 34 34 THR H H 1 7.405 0.01 . . . . . . . 34 T H . 27664 1 58 . 1 1 34 34 THR N N 15 114.037 0.2 . . . . . . . 34 T N . 27664 1 59 . 1 1 35 35 TRP H H 1 9.637 0.01 . . . . . . . 35 W H . 27664 1 60 . 1 1 35 35 TRP N N 15 127.297 0.2 . . . . . . . 35 W N . 27664 1 61 . 1 1 36 36 GLN H H 1 8.798 0.01 . . . . . . . 36 Q H . 27664 1 62 . 1 1 36 36 GLN N N 15 118.621 0.2 . . . . . . . 36 Q N . 27664 1 63 . 1 1 37 37 GLY H H 1 8.167 0.01 . . . . . . . 37 G H . 27664 1 64 . 1 1 37 37 GLY N N 15 103.744 0.2 . . . . . . . 37 G N . 27664 1 65 . 1 1 38 38 LEU H H 1 8.629 0.01 . . . . . . . 38 L H . 27664 1 66 . 1 1 38 38 LEU N N 15 120.695 0.2 . . . . . . . 38 L N . 27664 1 67 . 1 1 39 39 ILE H H 1 9.686 0.01 . . . . . . . 39 I H . 27664 1 68 . 1 1 39 39 ILE N N 15 124.519 0.2 . . . . . . . 39 I N . 27664 1 69 . 1 1 40 40 VAL H H 1 8.653 0.01 . . . . . . . 40 V H . 27664 1 70 . 1 1 40 40 VAL N N 15 129.175 0.2 . . . . . . . 40 V N . 27664 1 71 . 1 1 42 42 ASP N N 15 119.047 0.2 . . . . . . . 42 D N . 27664 1 72 . 1 1 43 43 ASN H H 1 7.853 0.01 . . . . . . . 43 N H . 27664 1 73 . 1 1 43 43 ASN N N 15 116.135 0.2 . . . . . . . 43 N N . 27664 1 74 . 1 1 46 46 TYR N N 15 121.252 0.2 . . . . . . . 46 Y N . 27664 1 75 . 1 1 47 47 ASP H H 1 8.123 0.01 . . . . . . . 47 D H . 27664 1 76 . 1 1 47 47 ASP N N 15 115.994 0.2 . . . . . . . 47 D N . 27664 1 77 . 1 1 48 48 LYS H H 1 8.099 0.01 . . . . . . . 48 K H . 27664 1 78 . 1 1 48 48 LYS N N 15 115.496 0.2 . . . . . . . 48 K N . 27664 1 79 . 1 1 49 49 GLY H H 1 7.742 0.01 . . . . . . . 49 G H . 27664 1 80 . 1 1 49 49 GLY N N 15 107.145 0.2 . . . . . . . 49 G N . 27664 1 81 . 1 1 50 50 ALA H H 1 7.638 0.01 . . . . . . . 50 A H . 27664 1 82 . 1 1 50 50 ALA N N 15 118.434 0.2 . . . . . . . 50 A N . 27664 1 83 . 1 1 51 51 PHE H H 1 8.853 0.01 . . . . . . . 51 F H . 27664 1 84 . 1 1 51 51 PHE N N 15 115.226 0.2 . . . . . . . 51 F N . 27664 1 85 . 1 1 52 52 ARG H H 1 10.045 0.01 . . . . . . . 52 R H . 27664 1 86 . 1 1 52 52 ARG N N 15 126.443 0.2 . . . . . . . 52 R N . 27664 1 87 . 1 1 53 53 ILE H H 1 8.931 0.01 . . . . . . . 53 I H . 27664 1 88 . 1 1 53 53 ILE N N 15 117.657 0.2 . . . . . . . 53 I N . 27664 1 89 . 1 1 54 54 GLU H H 1 8.997 0.01 . . . . . . . 54 E H . 27664 1 90 . 1 1 54 54 GLU N N 15 121.543 0.2 . . . . . . . 54 E N . 27664 1 91 . 1 1 55 55 ILE H H 1 9.410 0.01 . . . . . . . 55 I H . 27664 1 92 . 1 1 55 55 ILE N N 15 125.694 0.2 . . . . . . . 55 I N . 27664 1 93 . 1 1 56 56 ASN H H 1 8.691 0.01 . . . . . . . 56 N H . 27664 1 94 . 1 1 56 56 ASN N N 15 123.469 0.2 . . . . . . . 56 N N . 27664 1 95 . 1 1 57 57 PHE H H 1 9.664 0.01 . . . . . . . 57 F H . 27664 1 96 . 1 1 57 57 PHE N N 15 127.011 0.2 . . . . . . . 57 F N . 27664 1 97 . 1 1 59 59 ALA N N 15 122.401 0.2 . . . . . . . 59 A N . 27664 1 98 . 1 1 60 60 GLU H H 1 8.391 0.01 . . . . . . . 60 E H . 27664 1 99 . 1 1 60 60 GLU N N 15 110.663 0.2 . . . . . . . 60 E N . 27664 1 100 . 1 1 61 61 TYR H H 1 8.112 0.01 . . . . . . . 61 Y H . 27664 1 101 . 1 1 61 61 TYR N N 15 123.915 0.2 . . . . . . . 61 Y N . 27664 1 102 . 1 1 63 63 PHE N N 15 125.519 0.2 . . . . . . . 63 F N . 27664 1 103 . 1 1 64 64 LYS H H 1 7.011 0.01 . . . . . . . 64 K H . 27664 1 104 . 1 1 64 64 LYS N N 15 117.163 0.2 . . . . . . . 64 K N . 27664 1 105 . 1 1 67 67 LYS N N 15 116.935 0.2 . . . . . . . 67 K N . 27664 1 106 . 1 1 68 68 ILE H H 1 8.504 0.01 . . . . . . . 68 I H . 27664 1 107 . 1 1 68 68 ILE N N 15 124.545 0.2 . . . . . . . 68 I N . 27664 1 108 . 1 1 69 69 THR H H 1 8.713 0.01 . . . . . . . 69 T H . 27664 1 109 . 1 1 69 69 THR N N 15 120.523 0.2 . . . . . . . 69 T N . 27664 1 110 . 1 1 70 70 PHE H H 1 10.451 0.01 . . . . . . . 70 F H . 27664 1 111 . 1 1 70 70 PHE N N 15 126.908 0.2 . . . . . . . 70 F N . 27664 1 112 . 1 1 71 71 LYS H H 1 9.040 0.01 . . . . . . . 71 K H . 27664 1 113 . 1 1 71 71 LYS N N 15 123.834 0.2 . . . . . . . 71 K N . 27664 1 114 . 1 1 72 72 THR H H 1 7.477 0.01 . . . . . . . 72 T H . 27664 1 115 . 1 1 72 72 THR N N 15 118.849 0.2 . . . . . . . 72 T N . 27664 1 116 . 1 1 73 73 LYS H H 1 9.022 0.01 . . . . . . . 73 K H . 27664 1 117 . 1 1 73 73 LYS N N 15 126.708 0.2 . . . . . . . 73 K N . 27664 1 118 . 1 1 74 74 ILE H H 1 8.033 0.01 . . . . . . . 74 I H . 27664 1 119 . 1 1 74 74 ILE N N 15 118.898 0.2 . . . . . . . 74 I N . 27664 1 120 . 1 1 75 75 TYR H H 1 8.436 0.01 . . . . . . . 75 Y H . 27664 1 121 . 1 1 75 75 TYR N N 15 131.905 0.2 . . . . . . . 75 Y N . 27664 1 122 . 1 1 76 76 HIS H H 1 8.780 0.01 . . . . . . . 76 H H . 27664 1 123 . 1 1 76 76 HIS N N 15 128.809 0.2 . . . . . . . 76 H N . 27664 1 124 . 1 1 78 78 ASN N N 15 118.968 0.2 . . . . . . . 78 N N . 27664 1 125 . 1 1 79 79 ILE H H 1 7.268 0.01 . . . . . . . 79 I H . 27664 1 126 . 1 1 79 79 ILE N N 15 120.325 0.2 . . . . . . . 79 I N . 27664 1 127 . 1 1 80 80 ASP H H 1 8.671 0.01 . . . . . . . 80 D H . 27664 1 128 . 1 1 80 80 ASP N N 15 124.895 0.2 . . . . . . . 80 D N . 27664 1 129 . 1 1 81 81 GLU H H 1 9.149 0.01 . . . . . . . 81 E H . 27664 1 130 . 1 1 81 81 GLU N N 15 115.894 0.2 . . . . . . . 81 E N . 27664 1 131 . 1 1 82 82 LYS H H 1 8.112 0.01 . . . . . . . 82 K H . 27664 1 132 . 1 1 82 82 LYS N N 15 118.436 0.2 . . . . . . . 82 K N . 27664 1 133 . 1 1 83 83 GLY H H 1 8.140 0.01 . . . . . . . 83 G H . 27664 1 134 . 1 1 83 83 GLY N N 15 109.547 0.2 . . . . . . . 83 G N . 27664 1 135 . 1 1 84 84 GLN H H 1 8.673 0.01 . . . . . . . 84 Q H . 27664 1 136 . 1 1 84 84 GLN N N 15 120.657 0.2 . . . . . . . 84 Q N . 27664 1 137 . 1 1 85 85 VAL H H 1 8.186 0.01 . . . . . . . 85 V H . 27664 1 138 . 1 1 85 85 VAL N N 15 117.765 0.2 . . . . . . . 85 V N . 27664 1 139 . 1 1 86 86 LYS H H 1 8.108 0.01 . . . . . . . 86 K H . 27664 1 140 . 1 1 86 86 LYS N N 15 129.717 0.2 . . . . . . . 86 K N . 27664 1 141 . 1 1 87 87 LEU H H 1 7.651 0.01 . . . . . . . 87 L H . 27664 1 142 . 1 1 87 87 LEU N N 15 125.501 0.2 . . . . . . . 87 L N . 27664 1 143 . 1 1 89 89 VAL N N 15 113.872 0.2 . . . . . . . 89 V N . 27664 1 144 . 1 1 90 90 ILE H H 1 7.391 0.01 . . . . . . . 90 I H . 27664 1 145 . 1 1 90 90 ILE N N 15 107.145 0.2 . . . . . . . 90 I N . 27664 1 146 . 1 1 91 91 SER H H 1 7.772 0.01 . . . . . . . 91 S H . 27664 1 147 . 1 1 91 91 SER N N 15 118.428 0.2 . . . . . . . 91 S N . 27664 1 148 . 1 1 92 92 ALA H H 1 9.062 0.01 . . . . . . . 92 A H . 27664 1 149 . 1 1 92 92 ALA N N 15 126.532 0.2 . . . . . . . 92 A N . 27664 1 150 . 1 1 93 93 GLU H H 1 9.043 0.01 . . . . . . . 93 E H . 27664 1 151 . 1 1 93 93 GLU N N 15 114.369 0.2 . . . . . . . 93 E N . 27664 1 152 . 1 1 94 94 ASN H H 1 7.483 0.01 . . . . . . . 94 N H . 27664 1 153 . 1 1 94 94 ASN N N 15 114.690 0.2 . . . . . . . 94 N N . 27664 1 154 . 1 1 95 95 TRP H H 1 7.931 0.01 . . . . . . . 95 W H . 27664 1 155 . 1 1 95 95 TRP N N 15 121.710 0.2 . . . . . . . 95 W N . 27664 1 156 . 1 1 96 96 LYS H H 1 6.708 0.01 . . . . . . . 96 K H . 27664 1 157 . 1 1 96 96 LYS N N 15 126.486 0.2 . . . . . . . 96 K N . 27664 1 158 . 1 1 98 98 ALA N N 15 115.706 0.2 . . . . . . . 98 A N . 27664 1 159 . 1 1 99 99 THR H H 1 7.504 0.01 . . . . . . . 99 T H . 27664 1 160 . 1 1 99 99 THR N N 15 117.992 0.2 . . . . . . . 99 T N . 27664 1 161 . 1 1 100 100 LYS H H 1 8.169 0.01 . . . . . . . 100 K H . 27664 1 162 . 1 1 100 100 LYS N N 15 124.696 0.2 . . . . . . . 100 K N . 27664 1 163 . 1 1 101 101 THR H H 1 9.512 0.01 . . . . . . . 101 T H . 27664 1 164 . 1 1 101 101 THR N N 15 119.993 0.2 . . . . . . . 101 T N . 27664 1 165 . 1 1 102 102 ASP H H 1 9.427 0.01 . . . . . . . 102 D H . 27664 1 166 . 1 1 102 102 ASP N N 15 120.882 0.2 . . . . . . . 102 D N . 27664 1 167 . 1 1 103 103 GLN H H 1 7.436 0.01 . . . . . . . 103 Q H . 27664 1 168 . 1 1 103 103 GLN N N 15 120.640 0.2 . . . . . . . 103 Q N . 27664 1 169 . 1 1 104 104 VAL H H 1 7.740 0.01 . . . . . . . 104 V H . 27664 1 170 . 1 1 104 104 VAL N N 15 122.025 0.2 . . . . . . . 104 V N . 27664 1 171 . 1 1 105 105 ILE H H 1 8.468 0.01 . . . . . . . 105 I H . 27664 1 172 . 1 1 105 105 ILE N N 15 118.424 0.2 . . . . . . . 105 I N . 27664 1 173 . 1 1 106 106 GLN H H 1 8.310 0.01 . . . . . . . 106 Q H . 27664 1 174 . 1 1 106 106 GLN N N 15 118.438 0.2 . . . . . . . 106 Q N . 27664 1 175 . 1 1 107 107 SER H H 1 8.153 0.01 . . . . . . . 107 S H . 27664 1 176 . 1 1 107 107 SER N N 15 116.259 0.2 . . . . . . . 107 S N . 27664 1 177 . 1 1 108 108 LEU H H 1 8.274 0.01 . . . . . . . 108 L H . 27664 1 178 . 1 1 108 108 LEU N N 15 124.581 0.2 . . . . . . . 108 L N . 27664 1 179 . 1 1 109 109 ILE H H 1 8.582 0.01 . . . . . . . 109 I H . 27664 1 180 . 1 1 109 109 ILE N N 15 119.880 0.2 . . . . . . . 109 I N . 27664 1 181 . 1 1 110 110 ALA H H 1 7.890 0.01 . . . . . . . 110 A H . 27664 1 182 . 1 1 110 110 ALA N N 15 120.611 0.2 . . . . . . . 110 A N . 27664 1 183 . 1 1 111 111 LEU H H 1 7.564 0.01 . . . . . . . 111 L H . 27664 1 184 . 1 1 111 111 LEU N N 15 120.311 0.2 . . . . . . . 111 L N . 27664 1 185 . 1 1 112 112 VAL H H 1 7.985 0.01 . . . . . . . 112 V H . 27664 1 186 . 1 1 112 112 VAL N N 15 119.478 0.2 . . . . . . . 112 V N . 27664 1 187 . 1 1 113 113 ASN H H 1 7.930 0.01 . . . . . . . 113 N H . 27664 1 188 . 1 1 113 113 ASN N N 15 111.487 0.2 . . . . . . . 113 N N . 27664 1 189 . 1 1 114 114 ASP H H 1 8.032 0.01 . . . . . . . 114 D H . 27664 1 190 . 1 1 114 114 ASP N N 15 118.403 0.2 . . . . . . . 114 D N . 27664 1 191 . 1 1 116 116 GLN N N 15 118.597 0.2 . . . . . . . 116 Q N . 27664 1 192 . 1 1 118 118 GLU N N 15 117.875 0.2 . . . . . . . 118 E N . 27664 1 193 . 1 1 119 119 HIS H H 1 7.014 0.01 . . . . . . . 119 H H . 27664 1 194 . 1 1 119 119 HIS N N 15 115.054 0.2 . . . . . . . 119 H N . 27664 1 195 . 1 1 121 121 LEU N N 15 115.662 0.2 . . . . . . . 121 L N . 27664 1 196 . 1 1 122 122 ARG H H 1 7.636 0.01 . . . . . . . 122 R H . 27664 1 197 . 1 1 122 122 ARG N N 15 118.475 0.2 . . . . . . . 122 R N . 27664 1 198 . 1 1 124 124 ASP H H 1 9.253 0.01 . . . . . . . 124 D H . 27664 1 199 . 1 1 124 124 ASP N N 15 117.256 0.2 . . . . . . . 124 D N . 27664 1 200 . 1 1 125 125 LEU H H 1 7.547 0.01 . . . . . . . 125 L H . 27664 1 201 . 1 1 125 125 LEU N N 15 123.287 0.2 . . . . . . . 125 L N . 27664 1 202 . 1 1 126 126 ALA H H 1 8.021 0.01 . . . . . . . 126 A H . 27664 1 203 . 1 1 126 126 ALA N N 15 121.292 0.2 . . . . . . . 126 A N . 27664 1 204 . 1 1 127 127 GLU H H 1 7.868 0.01 . . . . . . . 127 E H . 27664 1 205 . 1 1 127 127 GLU N N 15 119.094 0.2 . . . . . . . 127 E N . 27664 1 206 . 1 1 128 128 GLU H H 1 7.778 0.01 . . . . . . . 128 E H . 27664 1 207 . 1 1 128 128 GLU N N 15 121.092 0.2 . . . . . . . 128 E N . 27664 1 208 . 1 1 129 129 TYR H H 1 8.512 0.01 . . . . . . . 129 Y H . 27664 1 209 . 1 1 129 129 TYR N N 15 116.867 0.2 . . . . . . . 129 Y N . 27664 1 210 . 1 1 130 130 SER H H 1 7.831 0.01 . . . . . . . 130 S H . 27664 1 211 . 1 1 130 130 SER N N 15 110.481 0.2 . . . . . . . 130 S N . 27664 1 212 . 1 1 131 131 LYS H H 1 8.506 0.01 . . . . . . . 131 K H . 27664 1 213 . 1 1 131 131 LYS N N 15 119.285 0.2 . . . . . . . 131 K N . 27664 1 214 . 1 1 132 132 ASP H H 1 8.521 0.01 . . . . . . . 132 D H . 27664 1 215 . 1 1 132 132 ASP N N 15 122.360 0.2 . . . . . . . 132 D N . 27664 1 216 . 1 1 133 133 ARG H H 1 8.505 0.01 . . . . . . . 133 R H . 27664 1 217 . 1 1 133 133 ARG N N 15 124.381 0.2 . . . . . . . 133 R N . 27664 1 218 . 1 1 134 134 LYS H H 1 8.442 0.01 . . . . . . . 134 K H . 27664 1 219 . 1 1 134 134 LYS N N 15 118.386 0.2 . . . . . . . 134 K N . 27664 1 220 . 1 1 135 135 LYS H H 1 7.541 0.01 . . . . . . . 135 K H . 27664 1 221 . 1 1 135 135 LYS N N 15 123.587 0.2 . . . . . . . 135 K N . 27664 1 222 . 1 1 136 136 PHE H H 1 8.511 0.01 . . . . . . . 136 F H . 27664 1 223 . 1 1 136 136 PHE N N 15 118.688 0.2 . . . . . . . 136 F N . 27664 1 224 . 1 1 137 137 SER H H 1 8.890 0.01 . . . . . . . 137 S H . 27664 1 225 . 1 1 137 137 SER N N 15 114.187 0.2 . . . . . . . 137 S N . 27664 1 226 . 1 1 138 138 LYS H H 1 7.679 0.01 . . . . . . . 138 K H . 27664 1 227 . 1 1 138 138 LYS N N 15 122.425 0.2 . . . . . . . 138 K N . 27664 1 228 . 1 1 139 139 ASN H H 1 8.113 0.01 . . . . . . . 139 N H . 27664 1 229 . 1 1 139 139 ASN N N 15 118.523 0.2 . . . . . . . 139 N N . 27664 1 230 . 1 1 140 140 ALA H H 1 8.960 0.01 . . . . . . . 140 A H . 27664 1 231 . 1 1 140 140 ALA N N 15 124.001 0.2 . . . . . . . 140 A N . 27664 1 232 . 1 1 141 141 GLU H H 1 8.781 0.01 . . . . . . . 141 E H . 27664 1 233 . 1 1 141 141 GLU N N 15 123.179 0.2 . . . . . . . 141 E N . 27664 1 234 . 1 1 142 142 GLU H H 1 8.104 0.01 . . . . . . . 142 E H . 27664 1 235 . 1 1 142 142 GLU N N 15 120.030 0.2 . . . . . . . 142 E N . 27664 1 236 . 1 1 143 143 PHE H H 1 8.363 0.01 . . . . . . . 143 F H . 27664 1 237 . 1 1 143 143 PHE N N 15 122.012 0.2 . . . . . . . 143 F N . 27664 1 238 . 1 1 144 144 THR H H 1 8.800 0.01 . . . . . . . 144 T H . 27664 1 239 . 1 1 144 144 THR N N 15 120.319 0.2 . . . . . . . 144 T N . 27664 1 240 . 1 1 145 145 LYS H H 1 8.090 0.01 . . . . . . . 145 K H . 27664 1 241 . 1 1 145 145 LYS N N 15 121.488 0.2 . . . . . . . 145 K N . 27664 1 242 . 1 1 146 146 LYS H H 1 7.789 0.01 . . . . . . . 146 K H . 27664 1 243 . 1 1 146 146 LYS N N 15 117.227 0.2 . . . . . . . 146 K N . 27664 1 244 . 1 1 147 147 TYR H H 1 7.898 0.01 . . . . . . . 147 Y H . 27664 1 245 . 1 1 147 147 TYR N N 15 112.571 0.2 . . . . . . . 147 Y N . 27664 1 246 . 1 1 148 148 GLY H H 1 8.193 0.01 . . . . . . . 148 G H . 27664 1 247 . 1 1 148 148 GLY N N 15 108.335 0.2 . . . . . . . 148 G N . 27664 1 248 . 1 1 149 149 GLU H H 1 8.128 0.01 . . . . . . . 149 E H . 27664 1 249 . 1 1 149 149 GLU N N 15 117.418 0.2 . . . . . . . 149 E N . 27664 1 250 . 1 1 150 150 LYS H H 1 8.319 0.01 . . . . . . . 150 K H . 27664 1 251 . 1 1 150 150 LYS N N 15 120.262 0.2 . . . . . . . 150 K N . 27664 1 252 . 1 1 151 151 ARG H H 1 8.498 0.01 . . . . . . . 151 R H . 27664 1 253 . 1 1 151 151 ARG N N 15 123.874 0.2 . . . . . . . 151 R N . 27664 1 254 . 1 1 153 153 VAL N N 15 119.039 0.2 . . . . . . . 153 V N . 27664 1 255 . 1 1 154 154 ASP H H 1 7.986 0.01 . . . . . . . 154 D H . 27664 1 256 . 1 1 154 154 ASP N N 15 128.448 0.2 . . . . . . . 154 D N . 27664 1 stop_ save_ ################################### # 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_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_2 _Assigned_chem_shift_list.Entry_ID 27664 _Assigned_chem_shift_list.ID 2 _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 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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 'Assignments were made by comparing to BMRB 15498, 4769 and published literature.' _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' . . . 27664 2 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 4 $NMRView . . 27664 2 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 . 2 2 1 1 MET H H 1 9.138 0.01 . . . . . . . 201 M H . 27664 2 2 . 2 2 1 1 MET N N 15 118.706 0.2 . . . . . . . 201 M N . 27664 2 3 . 2 2 2 2 GLN H H 1 8.288 0.01 . . . . . . . 202 Q H . 27664 2 4 . 2 2 2 2 GLN N N 15 120.090 0.2 . . . . . . . 202 Q N . 27664 2 5 . 2 2 3 3 ILE H H 1 8.354 0.01 . . . . . . . 203 I H . 27664 2 6 . 2 2 3 3 ILE N N 15 114.965 0.2 . . . . . . . 203 I N . 27664 2 7 . 2 2 4 4 PHE H H 1 8.619 0.01 . . . . . . . 204 F H . 27664 2 8 . 2 2 4 4 PHE N N 15 118.572 0.2 . . . . . . . 204 F N . 27664 2 9 . 2 2 5 5 VAL H H 1 9.297 0.01 . . . . . . . 205 V H . 27664 2 10 . 2 2 5 5 VAL N N 15 121.189 0.2 . . . . . . . 205 V N . 27664 2 11 . 2 2 6 6 LYS H H 1 8.996 0.01 . . . . . . . 206 K H . 27664 2 12 . 2 2 6 6 LYS N N 15 127.945 0.2 . . . . . . . 206 K N . 27664 2 13 . 2 2 7 7 THR H H 1 8.770 0.01 . . . . . . . 207 T H . 27664 2 14 . 2 2 7 7 THR N N 15 115.582 0.2 . . . . . . . 207 T N . 27664 2 15 . 2 2 8 8 LEU H H 1 9.142 0.01 . . . . . . . 208 L H . 27664 2 16 . 2 2 8 8 LEU N N 15 121.127 0.2 . . . . . . . 208 L N . 27664 2 17 . 2 2 9 9 THR H H 1 7.600 0.01 . . . . . . . 209 T H . 27664 2 18 . 2 2 9 9 THR N N 15 105.265 0.2 . . . . . . . 209 T N . 27664 2 19 . 2 2 10 10 GLY H H 1 7.831 0.01 . . . . . . . 210 G H . 27664 2 20 . 2 2 10 10 GLY N N 15 109.317 0.2 . . . . . . . 210 G N . 27664 2 21 . 2 2 11 11 LYS H H 1 7.281 0.01 . . . . . . . 211 K H . 27664 2 22 . 2 2 11 11 LYS N N 15 121.926 0.2 . . . . . . . 211 K N . 27664 2 23 . 2 2 12 12 THR H H 1 8.653 0.01 . . . . . . . 212 T H . 27664 2 24 . 2 2 12 12 THR N N 15 120.506 0.2 . . . . . . . 212 T N . 27664 2 25 . 2 2 13 13 ILE H H 1 9.579 0.01 . . . . . . . 213 I H . 27664 2 26 . 2 2 13 13 ILE N N 15 127.780 0.2 . . . . . . . 213 I N . 27664 2 27 . 2 2 14 14 THR H H 1 8.753 0.01 . . . . . . . 214 T H . 27664 2 28 . 2 2 14 14 THR N N 15 121.818 0.2 . . . . . . . 214 T N . 27664 2 29 . 2 2 15 15 LEU H H 1 8.852 0.01 . . . . . . . 215 L H . 27664 2 30 . 2 2 15 15 LEU N N 15 125.422 0.2 . . . . . . . 215 L N . 27664 2 31 . 2 2 16 16 GLU H H 1 8.173 0.01 . . . . . . . 216 E H . 27664 2 32 . 2 2 16 16 GLU N N 15 121.820 0.2 . . . . . . . 216 E N . 27664 2 33 . 2 2 17 17 VAL H H 1 8.775 0.01 . . . . . . . 217 V H . 27664 2 34 . 2 2 17 17 VAL N N 15 116.913 0.2 . . . . . . . 217 V N . 27664 2 35 . 2 2 18 18 GLU H H 1 8.554 0.01 . . . . . . . 218 E H . 27664 2 36 . 2 2 18 18 GLU N N 15 118.302 0.2 . . . . . . . 218 E N . 27664 2 37 . 2 2 19 19 SER H H 1 8.962 0.01 . . . . . . . 219 S H . 27664 2 38 . 2 2 19 19 SER N N 15 117.343 0.2 . . . . . . . 219 S N . 27664 2 39 . 2 2 20 20 SER H H 1 7.313 0.01 . . . . . . . 220 S H . 27664 2 40 . 2 2 20 20 SER N N 15 108.858 0.2 . . . . . . . 220 S N . 27664 2 41 . 2 2 21 21 ASP H H 1 7.914 0.01 . . . . . . . 221 D H . 27664 2 42 . 2 2 21 21 ASP N N 15 123.364 0.2 . . . . . . . 221 D N . 27664 2 43 . 2 2 22 22 THR H H 1 7.997 0.01 . . . . . . . 222 T H . 27664 2 44 . 2 2 22 22 THR N N 15 108.427 0.2 . . . . . . . 222 T N . 27664 2 45 . 2 2 23 23 ILE H H 1 8.705 0.01 . . . . . . . 223 I H . 27664 2 46 . 2 2 23 23 ILE N N 15 121.188 0.2 . . . . . . . 223 I N . 27664 2 47 . 2 2 24 24 ASP H H 1 9.446 0.01 . . . . . . . 224 D H . 27664 2 48 . 2 2 24 24 ASP N N 15 118.121 0.2 . . . . . . . 224 D N . 27664 2 49 . 2 2 25 25 ASN H H 1 8.025 0.01 . . . . . . . 225 N H . 27664 2 50 . 2 2 25 25 ASN N N 15 119.432 0.2 . . . . . . . 225 N N . 27664 2 51 . 2 2 26 26 VAL H H 1 8.106 0.01 . . . . . . . 226 V H . 27664 2 52 . 2 2 26 26 VAL N N 15 121.987 0.2 . . . . . . . 226 V N . 27664 2 53 . 2 2 27 27 LYS H H 1 8.569 0.01 . . . . . . . 227 K H . 27664 2 54 . 2 2 27 27 LYS N N 15 118.784 0.2 . . . . . . . 227 K N . 27664 2 55 . 2 2 28 28 SER H H 1 8.131 0.01 . . . . . . . 228 S H . 27664 2 56 . 2 2 28 28 SER N N 15 117.318 0.2 . . . . . . . 228 S N . 27664 2 57 . 2 2 29 29 LYS H H 1 7.953 0.01 . . . . . . . 229 K H . 27664 2 58 . 2 2 29 29 LYS N N 15 123.110 0.2 . . . . . . . 229 K N . 27664 2 59 . 2 2 30 30 ILE H H 1 8.339 0.01 . . . . . . . 230 I H . 27664 2 60 . 2 2 30 30 ILE N N 15 121.133 0.2 . . . . . . . 230 I N . 27664 2 61 . 2 2 31 31 GLN H H 1 8.515 0.01 . . . . . . . 231 Q H . 27664 2 62 . 2 2 31 31 GLN N N 15 123.491 0.2 . . . . . . . 231 Q N . 27664 2 63 . 2 2 32 32 ASP H H 1 8.054 0.01 . . . . . . . 232 D H . 27664 2 64 . 2 2 32 32 ASP N N 15 119.826 0.2 . . . . . . . 232 D N . 27664 2 65 . 2 2 33 33 LYS H H 1 7.471 0.01 . . . . . . . 233 K H . 27664 2 66 . 2 2 33 33 LYS N N 15 115.624 0.2 . . . . . . . 233 K N . 27664 2 67 . 2 2 34 34 GLU H H 1 8.747 0.01 . . . . . . . 234 E H . 27664 2 68 . 2 2 34 34 GLU N N 15 114.311 0.2 . . . . . . . 234 E N . 27664 2 69 . 2 2 35 35 GLY H H 1 8.498 0.01 . . . . . . . 235 G H . 27664 2 70 . 2 2 35 35 GLY N N 15 108.910 0.2 . . . . . . . 235 G N . 27664 2 71 . 2 2 36 36 ILE H H 1 6.160 0.01 . . . . . . . 236 I H . 27664 2 72 . 2 2 36 36 ILE N N 15 120.255 0.2 . . . . . . . 236 I N . 27664 2 73 . 2 2 39 39 ASP H H 1 8.511 0.01 . . . . . . . 239 D H . 27664 2 74 . 2 2 39 39 ASP N N 15 113.438 0.2 . . . . . . . 239 D N . 27664 2 75 . 2 2 40 40 GLN H H 1 7.848 0.01 . . . . . . . 240 Q H . 27664 2 76 . 2 2 40 40 GLN N N 15 116.925 0.2 . . . . . . . 240 Q N . 27664 2 77 . 2 2 41 41 GLN H H 1 7.503 0.01 . . . . . . . 241 Q H . 27664 2 78 . 2 2 41 41 GLN N N 15 118.058 0.2 . . . . . . . 241 Q N . 27664 2 79 . 2 2 42 42 ARG H H 1 8.538 0.01 . . . . . . . 242 R H . 27664 2 80 . 2 2 42 42 ARG N N 15 123.225 0.2 . . . . . . . 242 R N . 27664 2 81 . 2 2 43 43 LEU H H 1 8.783 0.01 . . . . . . . 243 L H . 27664 2 82 . 2 2 43 43 LEU N N 15 124.206 0.2 . . . . . . . 243 L N . 27664 2 83 . 2 2 44 44 ILE H H 1 9.159 0.01 . . . . . . . 244 I H . 27664 2 84 . 2 2 44 44 ILE N N 15 122.265 0.2 . . . . . . . 244 I N . 27664 2 85 . 2 2 45 45 PHE H H 1 8.869 0.01 . . . . . . . 245 F H . 27664 2 86 . 2 2 45 45 PHE N N 15 124.841 0.2 . . . . . . . 245 F N . 27664 2 87 . 2 2 46 46 ALA H H 1 9.020 0.01 . . . . . . . 246 A H . 27664 2 88 . 2 2 46 46 ALA N N 15 100.082 0.2 . . . . . . . 246 A N . 27664 2 89 . 2 2 47 47 GLY H H 1 8.161 0.01 . . . . . . . 247 G H . 27664 2 90 . 2 2 47 47 GLY N N 15 102.556 0.2 . . . . . . . 247 G N . 27664 2 91 . 2 2 48 48 LYS H H 1 7.927 0.01 . . . . . . . 248 K H . 27664 2 92 . 2 2 48 48 LYS N N 15 121.402 0.2 . . . . . . . 248 K N . 27664 2 93 . 2 2 49 49 GLN H H 1 8.852 0.01 . . . . . . . 249 Q H . 27664 2 94 . 2 2 49 49 GLN N N 15 123.265 0.2 . . . . . . . 249 Q N . 27664 2 95 . 2 2 50 50 LEU H H 1 8.580 0.01 . . . . . . . 250 L H . 27664 2 96 . 2 2 50 50 LEU N N 15 125.818 0.2 . . . . . . . 250 L N . 27664 2 97 . 2 2 51 51 GLU H H 1 8.409 0.01 . . . . . . . 251 E H . 27664 2 98 . 2 2 51 51 GLU N N 15 123.007 0.2 . . . . . . . 251 E N . 27664 2 99 . 2 2 52 52 ASP H H 1 8.104 0.01 . . . . . . . 252 D H . 27664 2 100 . 2 2 52 52 ASP N N 15 120.030 0.2 . . . . . . . 252 D N . 27664 2 101 . 2 2 53 53 GLY H H 1 9.528 0.01 . . . . . . . 253 G H . 27664 2 102 . 2 2 53 53 GLY N N 15 107.334 0.2 . . . . . . . 253 G N . 27664 2 103 . 2 2 54 54 ARG H H 1 7.413 0.01 . . . . . . . 254 R H . 27664 2 104 . 2 2 54 54 ARG N N 15 119.164 0.2 . . . . . . . 254 R N . 27664 2 105 . 2 2 55 55 THR H H 1 8.870 0.01 . . . . . . . 255 T H . 27664 2 106 . 2 2 55 55 THR N N 15 109.051 0.2 . . . . . . . 255 T N . 27664 2 107 . 2 2 56 56 LEU H H 1 8.213 0.01 . . . . . . . 256 L H . 27664 2 108 . 2 2 56 56 LEU N N 15 117.846 0.2 . . . . . . . 256 L N . 27664 2 109 . 2 2 57 57 SER H H 1 8.219 0.01 . . . . . . . 257 S H . 27664 2 110 . 2 2 57 57 SER N N 15 112.920 0.2 . . . . . . . 257 S N . 27664 2 111 . 2 2 58 58 ASP H H 1 7.937 0.01 . . . . . . . 258 D H . 27664 2 112 . 2 2 58 58 ASP N N 15 124.243 0.2 . . . . . . . 258 D N . 27664 2 113 . 2 2 59 59 TYR H H 1 7.234 0.01 . . . . . . . 259 Y H . 27664 2 114 . 2 2 59 59 TYR N N 15 115.535 0.2 . . . . . . . 259 Y N . 27664 2 115 . 2 2 60 60 ASN H H 1 8.152 0.01 . . . . . . . 260 N H . 27664 2 116 . 2 2 60 60 ASN N N 15 116.206 0.2 . . . . . . . 260 N N . 27664 2 117 . 2 2 61 61 ILE H H 1 7.258 0.01 . . . . . . . 261 I H . 27664 2 118 . 2 2 61 61 ILE N N 15 118.868 0.2 . . . . . . . 261 I N . 27664 2 119 . 2 2 62 62 GLN H H 1 7.665 0.01 . . . . . . . 262 Q H . 27664 2 120 . 2 2 62 62 GLN N N 15 124.908 0.2 . . . . . . . 262 Q N . 27664 2 121 . 2 2 63 63 LYS H H 1 8.454 0.01 . . . . . . . 263 K H . 27664 2 122 . 2 2 63 63 LYS N N 15 120.182 0.2 . . . . . . . 263 K N . 27664 2 123 . 2 2 64 64 GLU H H 1 9.246 0.01 . . . . . . . 264 E H . 27664 2 124 . 2 2 64 64 GLU N N 15 114.647 0.2 . . . . . . . 264 E N . 27664 2 125 . 2 2 65 65 SER H H 1 7.706 0.01 . . . . . . . 265 S H . 27664 2 126 . 2 2 65 65 SER N N 15 114.993 0.2 . . . . . . . 265 S N . 27664 2 127 . 2 2 66 66 THR H H 1 8.713 0.01 . . . . . . . 266 T H . 27664 2 128 . 2 2 66 66 THR N N 15 117.366 0.2 . . . . . . . 266 T N . 27664 2 129 . 2 2 67 67 LEU H H 1 9.421 0.01 . . . . . . . 267 L H . 27664 2 130 . 2 2 67 67 LEU N N 15 127.582 0.2 . . . . . . . 267 L N . 27664 2 131 . 2 2 68 68 HIS H H 1 9.261 0.01 . . . . . . . 268 H H . 27664 2 132 . 2 2 68 68 HIS N N 15 119.791 0.2 . . . . . . . 268 H N . 27664 2 133 . 2 2 69 69 LEU H H 1 8.292 0.01 . . . . . . . 269 L H . 27664 2 134 . 2 2 69 69 LEU N N 15 123.771 0.2 . . . . . . . 269 L N . 27664 2 135 . 2 2 70 70 VAL H H 1 9.175 0.01 . . . . . . . 270 V H . 27664 2 136 . 2 2 70 70 VAL N N 15 126.591 0.2 . . . . . . . 270 V N . 27664 2 137 . 2 2 71 71 LEU H H 1 8.127 0.01 . . . . . . . 271 L H . 27664 2 138 . 2 2 71 71 LEU N N 15 122.968 0.2 . . . . . . . 271 L N . 27664 2 139 . 2 2 72 72 ARG H H 1 8.515 0.01 . . . . . . . 272 R H . 27664 2 140 . 2 2 72 72 ARG N N 15 123.439 0.2 . . . . . . . 272 R N . 27664 2 141 . 2 2 73 73 LEU H H 1 8.341 0.01 . . . . . . . 273 L H . 27664 2 142 . 2 2 73 73 LEU N N 15 124.677 0.2 . . . . . . . 273 L N . 27664 2 143 . 2 2 74 74 ARG H H 1 8.570 0.01 . . . . . . . 274 R H . 27664 2 144 . 2 2 74 74 ARG N N 15 122.351 0.2 . . . . . . . 274 R N . 27664 2 145 . 2 2 75 75 GLY H H 1 8.487 0.01 . . . . . . . 275 G H . 27664 2 146 . 2 2 75 75 GLY N N 15 110.456 0.2 . . . . . . . 275 G N . 27664 2 147 . 2 2 76 76 GLY H H 1 7.977 0.01 . . . . . . . 276 G H . 27664 2 148 . 2 2 76 76 GLY N N 15 115.825 0.2 . . . . . . . 276 G N . 27664 2 stop_ save_