################################### # 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 17489 _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 CPMG . . . 17489 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.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 1 1 SER C C 13 174.276 . . 2 . . . . 2 SER C . 17489 1 2 . 1 1 2 2 GLN H H 1 8.446 . . 2 . . . . 3 GLN H . 17489 1 3 . 1 1 2 2 GLN HA H 1 4.671 . . 2 . . . . 3 GLN HA . 17489 1 4 . 1 1 2 2 GLN CA C 13 53.944 . . 2 . . . . 3 GLN CA . 17489 1 5 . 1 1 2 2 GLN N N 15 122.894 . . 2 . . . . 3 GLN N . 17489 1 6 . 1 1 3 3 PRO HA H 1 4.420 . . 2 . . . . 4 PRO HA . 17489 1 7 . 1 1 3 3 PRO C C 13 176.649 . . 2 . . . . 4 PRO C . 17489 1 8 . 1 1 3 3 PRO CA C 13 63.389 . . 2 . . . . 4 PRO CA . 17489 1 9 . 1 1 4 4 ALA H H 1 8.358 . . 2 . . . . 5 ALA H . 17489 1 10 . 1 1 4 4 ALA HA H 1 4.285 . . 2 . . . . 5 ALA HA . 17489 1 11 . 1 1 4 4 ALA C C 13 177.820 . . 2 . . . . 5 ALA C . 17489 1 12 . 1 1 4 4 ALA CA C 13 52.373 . . 2 . . . . 5 ALA CA . 17489 1 13 . 1 1 4 4 ALA N N 15 124.657 . . 2 . . . . 5 ALA N . 17489 1 14 . 1 1 5 5 LYS H H 1 8.203 . . 2 . . . . 6 LYS H . 17489 1 15 . 1 1 5 5 LYS HA H 1 4.291 . . 2 . . . . 6 LYS HA . 17489 1 16 . 1 1 5 5 LYS C C 13 176.515 . . 2 . . . . 6 LYS C . 17489 1 17 . 1 1 5 5 LYS CA C 13 56.215 . . 2 . . . . 6 LYS CA . 17489 1 18 . 1 1 5 5 LYS N N 15 121.077 . . 2 . . . . 6 LYS N . 17489 1 19 . 1 1 6 6 LYS H H 1 8.294 . . 2 . . . . 7 LYS H . 17489 1 20 . 1 1 6 6 LYS C C 13 176.320 . . 2 . . . . 7 LYS C . 17489 1 21 . 1 1 6 6 LYS N N 15 123.386 . . 2 . . . . 7 LYS N . 17489 1 22 . 1 1 7 7 THR H H 1 8.009 . . 2 . . . . 8 THR H . 17489 1 23 . 1 1 7 7 THR HA H 1 4.242 . . 2 . . . . 8 THR HA . 17489 1 24 . 1 1 7 7 THR C C 13 173.780 . . 2 . . . . 8 THR C . 17489 1 25 . 1 1 7 7 THR CA C 13 61.576 . . 2 . . . . 8 THR CA . 17489 1 26 . 1 1 7 7 THR N N 15 115.881 . . 2 . . . . 8 THR N . 17489 1 27 . 1 1 8 8 TYR H H 1 8.179 . . 2 . . . . 9 TYR H . 17489 1 28 . 1 1 8 8 TYR HA H 1 4.545 . . 2 . . . . 9 TYR HA . 17489 1 29 . 1 1 8 8 TYR C C 13 175.479 . . 2 . . . . 9 TYR C . 17489 1 30 . 1 1 8 8 TYR CA C 13 57.582 . . 2 . . . . 9 TYR CA . 17489 1 31 . 1 1 8 8 TYR N N 15 122.622 . . 2 . . . . 9 TYR N . 17489 1 32 . 1 1 9 9 THR H H 1 7.862 . . 2 . . . . 10 THR H . 17489 1 33 . 1 1 9 9 THR HA H 1 4.224 . . 2 . . . . 10 THR HA . 17489 1 34 . 1 1 9 9 THR CA C 13 61.570 . . 2 . . . . 10 THR CA . 17489 1 35 . 1 1 9 9 THR N N 15 115.758 . . 2 . . . . 10 THR N . 17489 1 36 . 1 1 10 10 TRP H H 1 7.948 . . 2 . . . . 11 TRP H . 17489 1 37 . 1 1 10 10 TRP HA H 1 4.659 . . 2 . . . A 11 TRP HA . 17489 1 38 . 1 1 10 10 TRP C C 13 175.885 . . 2 . . . A 11 TRP C . 17489 1 39 . 1 1 10 10 TRP CA C 13 57.305 . . 2 . . . A 11 TRP CA . 17489 1 40 . 1 1 10 10 TRP N N 15 122.316 . . 2 . . . A 11 TRP N . 17489 1 41 . 1 1 11 11 ASN H H 1 8.406 . . 2 . . . A 12 ASN H . 17489 1 42 . 1 1 11 11 ASN HA H 1 4.692 . . 2 . . . A 12 ASN HA . 17489 1 43 . 1 1 11 11 ASN CA C 13 53.862 . . 2 . . . A 12 ASN CA . 17489 1 44 . 1 1 11 11 ASN N N 15 119.980 . . 2 . . . A 12 ASN N . 17489 1 45 . 1 1 12 12 THR H H 1 7.868 . . 2 . . . A 13 THR H . 17489 1 46 . 1 1 12 12 THR HA H 1 4.435 . . 2 . . . A 13 THR HA . 17489 1 47 . 1 1 12 12 THR C C 13 174.968 . . 2 . . . A 13 THR C . 17489 1 48 . 1 1 12 12 THR CA C 13 61.114 . . 2 . . . A 13 THR CA . 17489 1 49 . 1 1 12 12 THR N N 15 112.320 . . 2 . . . A 13 THR N . 17489 1 50 . 1 1 13 13 LYS H H 1 9.495 . . 2 . . . A 14 LYS H . 17489 1 51 . 1 1 13 13 LYS HA H 1 4.220 . . 2 . . . A 14 LYS HA . 17489 1 52 . 1 1 13 13 LYS C C 13 177.768 . . 2 . . . A 14 LYS C . 17489 1 53 . 1 1 13 13 LYS CA C 13 58.108 . . 2 . . . A 14 LYS CA . 17489 1 54 . 1 1 13 13 LYS N N 15 122.764 . . 2 . . . A 14 LYS N . 17489 1 55 . 1 1 14 14 GLU H H 1 8.304 . . 2 . . . A 15 GLU H . 17489 1 56 . 1 1 14 14 GLU HA H 1 4.122 . . 2 . . . A 15 GLU HA . 17489 1 57 . 1 1 14 14 GLU C C 13 177.989 . . 2 . . . A 15 GLU C . 17489 1 58 . 1 1 14 14 GLU CA C 13 58.487 . . 2 . . . A 15 GLU CA . 17489 1 59 . 1 1 14 14 GLU N N 15 120.850 . . 2 . . . A 15 GLU N . 17489 1 60 . 1 1 15 15 GLU H H 1 8.165 . . 2 . . . A 16 GLU H . 17489 1 61 . 1 1 15 15 GLU HA H 1 4.195 . . 2 . . . A 16 GLU HA . 17489 1 62 . 1 1 15 15 GLU C C 13 177.809 . . 2 . . . A 16 GLU C . 17489 1 63 . 1 1 15 15 GLU CA C 13 58.063 . . 2 . . . A 16 GLU CA . 17489 1 64 . 1 1 15 15 GLU N N 15 121.042 . . 2 . . . A 16 GLU N . 17489 1 65 . 1 1 16 16 ALA H H 1 7.929 . . 2 . . . A 17 ALA H . 17489 1 66 . 1 1 16 16 ALA HA H 1 3.857 . . 2 . . . A 17 ALA HA . 17489 1 67 . 1 1 16 16 ALA C C 13 178.494 . . 2 . . . A 17 ALA C . 17489 1 68 . 1 1 16 16 ALA CA C 13 54.016 . . 2 . . . A 17 ALA CA . 17489 1 69 . 1 1 16 16 ALA N N 15 123.692 . . 2 . . . A 17 ALA N . 17489 1 70 . 1 1 17 17 LYS H H 1 7.962 . . 2 . . . A 18 LYS H . 17489 1 71 . 1 1 17 17 LYS HA H 1 4.063 . . 2 . . . A 18 LYS HA . 17489 1 72 . 1 1 17 17 LYS C C 13 178.031 . . 2 . . . A 18 LYS C . 17489 1 73 . 1 1 17 17 LYS CA C 13 58.710 . . 2 . . . A 18 LYS CA . 17489 1 74 . 1 1 17 17 LYS N N 15 119.118 . . 2 . . . A 18 LYS N . 17489 1 75 . 1 1 18 18 GLN H H 1 7.999 . . 2 . . . A 19 GLN H . 17489 1 76 . 1 1 18 18 GLN C C 13 176.953 . . 2 . . . A 19 GLN C . 17489 1 77 . 1 1 18 18 GLN CA C 13 57.371 . . 2 . . . A 19 GLN CA . 17489 1 78 . 1 1 18 18 GLN N N 15 119.841 . . 2 . . . A 19 GLN N . 17489 1 79 . 1 1 19 19 ALA H H 1 8.007 . . 2 . . . A 20 ALA H . 17489 1 80 . 1 1 19 19 ALA HA H 1 4.185 . . 2 . . . A 20 ALA HA . 17489 1 81 . 1 1 19 19 ALA C C 13 178.456 . . 2 . . . A 20 ALA C . 17489 1 82 . 1 1 19 19 ALA CA C 13 54.148 . . 2 . . . A 20 ALA CA . 17489 1 83 . 1 1 19 19 ALA N N 15 123.397 . . 2 . . . A 20 ALA N . 17489 1 84 . 1 1 20 20 PHE H H 1 8.049 . . 2 . . . A 21 PHE H . 17489 1 85 . 1 1 20 20 PHE HA H 1 4.327 . . 2 . . . A 21 PHE HA . 17489 1 86 . 1 1 20 20 PHE C C 13 176.183 . . 2 . . . A 21 PHE C . 17489 1 87 . 1 1 20 20 PHE CA C 13 59.670 . . 2 . . . A 21 PHE CA . 17489 1 88 . 1 1 20 20 PHE N N 15 119.266 . . 2 . . . A 21 PHE N . 17489 1 89 . 1 1 21 21 LYS H H 1 7.912 . . 2 . . . A 22 LYS H . 17489 1 90 . 1 1 21 21 LYS HA H 1 3.990 . . 2 . . . A 22 LYS HA . 17489 1 91 . 1 1 21 21 LYS C C 13 178.052 . . 2 . . . A 22 LYS C . 17489 1 92 . 1 1 21 21 LYS CA C 13 58.903 . . 2 . . . A 22 LYS CA . 17489 1 93 . 1 1 21 21 LYS N N 15 120.665 . . 2 . . . A 22 LYS N . 17489 1 94 . 1 1 22 22 GLU H H 1 8.073 . . 2 . . . A 23 GLU H . 17489 1 95 . 1 1 22 22 GLU HA H 1 4.132 . . 2 . . . A 23 GLU HA . 17489 1 96 . 1 1 22 22 GLU C C 13 177.367 . . 2 . . . A 23 GLU C . 17489 1 97 . 1 1 22 22 GLU CA C 13 58.106 . . 2 . . . A 23 GLU CA . 17489 1 98 . 1 1 22 22 GLU N N 15 120.435 . . 2 . . . A 23 GLU N . 17489 1 99 . 1 1 23 23 ALA H H 1 8.057 . . 2 . . . A 24 ALA H . 17489 1 100 . 1 1 23 23 ALA HA H 1 4.099 . . 2 . . . A 24 ALA HA . 17489 1 101 . 1 1 23 23 ALA C C 13 178.713 . . 2 . . . A 24 ALA C . 17489 1 102 . 1 1 23 23 ALA CA C 13 54.248 . . 2 . . . A 24 ALA CA . 17489 1 103 . 1 1 23 23 ALA N N 15 123.786 . . 2 . . . A 24 ALA N . 17489 1 104 . 1 1 24 24 LEU H H 1 7.892 . . 2 . . . A 25 LEU H . 17489 1 105 . 1 1 24 24 LEU C C 13 178.595 . . 2 . . . A 25 LEU C . 17489 1 106 . 1 1 24 24 LEU N N 15 119.319 . . 2 . . . A 25 LEU N . 17489 1 107 . 1 1 25 25 LYS H H 1 7.803 . . 2 . . . A 26 LYS H . 17489 1 108 . 1 1 25 25 LYS HA H 1 4.374 . . 2 . . . A 26 LYS HA . 17489 1 109 . 1 1 25 25 LYS C C 13 177.655 . . 2 . . . A 26 LYS C . 17489 1 110 . 1 1 25 25 LYS CA C 13 58.024 . . 2 . . . A 26 LYS CA . 17489 1 111 . 1 1 25 25 LYS N N 15 120.783 . . 2 . . . A 26 LYS N . 17489 1 112 . 1 1 26 26 GLU H H 1 8.016 . . 2 . . . A 27 GLU H . 17489 1 113 . 1 1 26 26 GLU HA H 1 4.212 . . 2 . . . A 27 GLU HA . 17489 1 114 . 1 1 26 26 GLU C C 13 176.628 . . 2 . . . A 27 GLU C . 17489 1 115 . 1 1 26 26 GLU CA C 13 57.339 . . 2 . . . A 27 GLU CA . 17489 1 116 . 1 1 26 26 GLU N N 15 120.184 . . 2 . . . A 27 GLU N . 17489 1 117 . 1 1 27 27 LYS H H 1 8.101 . . 2 . . . A 28 LYS H . 17489 1 118 . 1 1 27 27 LYS HA H 1 4.265 . . 2 . . . A 28 LYS HA . 17489 1 119 . 1 1 27 27 LYS C C 13 176.019 . . 2 . . . A 28 LYS C . 17489 1 120 . 1 1 27 27 LYS CA C 13 55.918 . . 2 . . . A 28 LYS CA . 17489 1 121 . 1 1 27 27 LYS N N 15 119.854 . . 2 . . . A 28 LYS N . 17489 1 122 . 1 1 28 28 ARG H H 1 8.170 . . 2 . . . A 29 ARG H . 17489 1 123 . 1 1 28 28 ARG HA H 1 4.252 . . 2 . . . A 29 ARG HA . 17489 1 124 . 1 1 28 28 ARG C C 13 176.036 . . 2 . . . A 29 ARG C . 17489 1 125 . 1 1 28 28 ARG CA C 13 56.321 . . 2 . . . A 29 ARG CA . 17489 1 126 . 1 1 28 28 ARG N N 15 120.694 . . 2 . . . A 29 ARG N . 17489 1 127 . 1 1 29 29 VAL H H 1 7.961 . . 2 . . . A 30 VAL H . 17489 1 128 . 1 1 29 29 VAL N N 15 121.196 . . 2 . . . A 30 VAL N . 17489 1 129 . 1 1 30 30 PRO HA H 1 4.416 . . 2 . . . A 31 PRO HA . 17489 1 130 . 1 1 30 30 PRO C C 13 177.177 . . 2 . . . A 31 PRO C . 17489 1 131 . 1 1 30 30 PRO CA C 13 62.849 . . 2 . . . A 31 PRO CA . 17489 1 132 . 1 1 31 31 SER H H 1 8.399 . . 2 . . . A 32 SER H . 17489 1 133 . 1 1 31 31 SER HA H 1 4.322 . . 2 . . . A 32 SER HA . 17489 1 134 . 1 1 31 31 SER C C 13 174.622 . . 2 . . . A 32 SER C . 17489 1 135 . 1 1 31 31 SER CA C 13 59.338 . . 2 . . . A 32 SER CA . 17489 1 136 . 1 1 31 31 SER N N 15 116.064 . . 2 . . . A 32 SER N . 17489 1 137 . 1 1 32 32 ASN H H 1 8.235 . . 2 . . . A 33 ASN H . 17489 1 138 . 1 1 32 32 ASN HA H 1 4.705 . . 2 . . . A 33 ASN HA . 17489 1 139 . 1 1 32 32 ASN C C 13 175.221 . . 2 . . . A 33 ASN C . 17489 1 140 . 1 1 32 32 ASN CA C 13 52.789 . . 2 . . . A 33 ASN CA . 17489 1 141 . 1 1 32 32 ASN N N 15 119.120 . . 2 . . . A 33 ASN N . 17489 1 142 . 1 1 33 33 ALA H H 1 7.948 . . 2 . . . A 34 ALA H . 17489 1 143 . 1 1 33 33 ALA HA H 1 4.289 . . 2 . . . A 34 ALA HA . 17489 1 144 . 1 1 33 33 ALA C C 13 178.235 . . 2 . . . A 34 ALA C . 17489 1 145 . 1 1 33 33 ALA CA C 13 52.847 . . 2 . . . A 34 ALA CA . 17489 1 146 . 1 1 33 33 ALA N N 15 123.533 . . 2 . . . A 34 ALA N . 17489 1 147 . 1 1 34 34 SER H H 1 8.255 . . 2 . . . A 35 SER H . 17489 1 148 . 1 1 34 34 SER HA H 1 4.535 . . 2 . . . A 35 SER HA . 17489 1 149 . 1 1 34 34 SER C C 13 175.129 . . 2 . . . A 35 SER C . 17489 1 150 . 1 1 34 34 SER CA C 13 57.986 . . 2 . . . A 35 SER CA . 17489 1 151 . 1 1 34 34 SER N N 15 115.510 . . 2 . . . A 35 SER N . 17489 1 152 . 1 1 35 35 TRP H H 1 8.083 . . 2 . . . A 36 TRP H . 17489 1 153 . 1 1 35 35 TRP HA H 1 4.313 . . 2 . . . A 36 TRP HA . 17489 1 154 . 1 1 35 35 TRP C C 13 177.081 . . 2 . . . A 36 TRP C . 17489 1 155 . 1 1 35 35 TRP CA C 13 59.360 . . 2 . . . A 36 TRP CA . 17489 1 156 . 1 1 35 35 TRP N N 15 123.351 . . 2 . . . A 36 TRP N . 17489 1 157 . 1 1 36 36 GLU H H 1 8.070 . . 2 . . . A 37 GLU H . 17489 1 158 . 1 1 36 36 GLU HA H 1 3.700 . . 2 . . . A 37 GLU HA . 17489 1 159 . 1 1 36 36 GLU C C 13 178.317 . . 2 . . . A 37 GLU C . 17489 1 160 . 1 1 36 36 GLU CA C 13 59.332 . . 2 . . . A 37 GLU CA . 17489 1 161 . 1 1 36 36 GLU N N 15 119.014 . . 2 . . . A 37 GLU N . 17489 1 162 . 1 1 37 37 GLN H H 1 7.822 . . 2 . . . A 38 GLN H . 17489 1 163 . 1 1 37 37 GLN HA H 1 4.101 . . 2 . . . A 38 GLN HA . 17489 1 164 . 1 1 37 37 GLN C C 13 177.593 . . 2 . . . A 38 GLN C . 17489 1 165 . 1 1 37 37 GLN N N 15 118.887 . . 2 . . . A 38 GLN N . 17489 1 166 . 1 1 38 38 ALA H H 1 8.118 . . 2 . . . A 39 ALA H . 17489 1 167 . 1 1 38 38 ALA HA H 1 4.056 . . 2 . . . A 39 ALA HA . 17489 1 168 . 1 1 38 38 ALA C C 13 179.122 . . 2 . . . A 39 ALA C . 17489 1 169 . 1 1 38 38 ALA CA C 13 54.470 . . 2 . . . A 39 ALA CA . 17489 1 170 . 1 1 38 38 ALA N N 15 122.732 . . 2 . . . A 39 ALA N . 17489 1 171 . 1 1 39 39 MET H H 1 8.003 . . 2 . . . A 40 MET H . 17489 1 172 . 1 1 39 39 MET HA H 1 4.116 . . 2 . . . A 40 MET HA . 17489 1 173 . 1 1 39 39 MET C C 13 177.425 . . 2 . . . A 40 MET C . 17489 1 174 . 1 1 39 39 MET CA C 13 56.856 . . 2 . . . A 40 MET CA . 17489 1 175 . 1 1 39 39 MET N N 15 116.548 . . 2 . . . A 40 MET N . 17489 1 176 . 1 1 40 40 LYS HA H 1 4.035 . . 2 . . . A 41 LYS HA . 17489 1 177 . 1 1 40 40 LYS C C 13 177.546 . . 2 . . . A 41 LYS C . 17489 1 178 . 1 1 40 40 LYS CA C 13 58.454 . . 2 . . . A 41 LYS CA . 17489 1 179 . 1 1 40 40 LYS N N 15 119.136 . . 2 . . . A 41 LYS N . 17489 1 180 . 1 1 41 41 MET H H 1 7.732 . . 2 . . . A 42 MET H . 17489 1 181 . 1 1 41 41 MET HA H 1 4.309 . . 2 . . . A 42 MET HA . 17489 1 182 . 1 1 41 41 MET C C 13 177.178 . . 2 . . . A 42 MET C . 17489 1 183 . 1 1 41 41 MET CA C 13 57.094 . . 2 . . . A 42 MET CA . 17489 1 184 . 1 1 41 41 MET N N 15 117.901 . . 2 . . . A 42 MET N . 17489 1 185 . 1 1 42 42 ILE H H 1 7.766 . . 2 . . . A 43 ILE H . 17489 1 186 . 1 1 42 42 ILE HA H 1 4.054 . . 2 . . . A 43 ILE HA . 17489 1 187 . 1 1 42 42 ILE C C 13 176.560 . . 2 . . . A 43 ILE C . 17489 1 188 . 1 1 42 42 ILE N N 15 119.588 . . 2 . . . A 43 ILE N . 17489 1 189 . 1 1 43 43 ILE H H 1 7.899 . . 2 . . . A 44 ILE H . 17489 1 190 . 1 1 43 43 ILE C C 13 176.056 . . 2 . . . A 44 ILE C . 17489 1 191 . 1 1 43 43 ILE N N 15 120.275 . . 2 . . . A 44 ILE N . 17489 1 192 . 1 1 44 44 ASN H H 1 7.900 . . 2 . . . A 45 ASN H . 17489 1 193 . 1 1 44 44 ASN HA H 1 4.711 . . 2 . . . A 45 ASN HA . 17489 1 194 . 1 1 44 44 ASN CA C 13 53.323 . . 2 . . . A 45 ASN CA . 17489 1 195 . 1 1 44 44 ASN N N 15 119.135 . . 2 . . . A 45 ASN N . 17489 1 196 . 1 1 45 45 ASP H H 1 7.854 . . 2 . . . A 46 ASP H . 17489 1 197 . 1 1 45 45 ASP HA H 1 4.997 . . 2 . . . A 46 ASP HA . 17489 1 198 . 1 1 45 45 ASP CA C 13 51.864 . . 2 . . . A 46 ASP CA . 17489 1 199 . 1 1 45 45 ASP N N 15 122.730 . . 2 . . . A 46 ASP N . 17489 1 200 . 1 1 46 46 PRO HA H 1 4.420 . . 2 . . . A 47 PRO HA . 17489 1 201 . 1 1 46 46 PRO C C 13 178.053 . . 2 . . . A 47 PRO C . 17489 1 202 . 1 1 46 46 PRO CA C 13 64.209 . . 2 . . . A 47 PRO CA . 17489 1 203 . 1 1 47 47 ARG H H 1 8.341 . . 2 . . . A 48 ARG H . 17489 1 204 . 1 1 47 47 ARG HA H 1 4.061 . . 2 . . . A 48 ARG HA . 17489 1 205 . 1 1 47 47 ARG C C 13 177.487 . . 2 . . . A 48 ARG C . 17489 1 206 . 1 1 47 47 ARG CA C 13 57.229 . . 2 . . . A 48 ARG CA . 17489 1 207 . 1 1 47 47 ARG N N 15 118.377 . . 2 . . . A 48 ARG N . 17489 1 208 . 1 1 48 48 TYR H H 1 7.706 . . 2 . . . A 49 TYR H . 17489 1 209 . 1 1 48 48 TYR HA H 1 4.604 . . 2 . . . A 49 TYR HA . 17489 1 210 . 1 1 48 48 TYR C C 13 176.515 . . 2 . . . A 49 TYR C . 17489 1 211 . 1 1 48 48 TYR CA C 13 58.172 . . 2 . . . A 49 TYR CA . 17489 1 212 . 1 1 48 48 TYR N N 15 117.876 . . 2 . . . A 49 TYR N . 17489 1 213 . 1 1 49 49 SER H H 1 7.865 . . 2 . . . A 50 SER H . 17489 1 214 . 1 1 49 49 SER HA H 1 4.275 . . 2 . . . A 50 SER HA . 17489 1 215 . 1 1 49 49 SER C C 13 175.374 . . 2 . . . A 50 SER C . 17489 1 216 . 1 1 49 49 SER CA C 13 60.656 . . 2 . . . A 50 SER CA . 17489 1 217 . 1 1 49 49 SER N N 15 115.731 . . 2 . . . A 50 SER N . 17489 1 218 . 1 1 50 50 ALA H H 1 8.236 . . 2 . . . A 51 ALA H . 17489 1 219 . 1 1 50 50 ALA HA H 1 4.240 . . 2 . . . A 51 ALA HA . 17489 1 220 . 1 1 50 50 ALA C C 13 178.939 . . 2 . . . A 51 ALA C . 17489 1 221 . 1 1 50 50 ALA CA C 13 53.898 . . 2 . . . A 51 ALA CA . 17489 1 222 . 1 1 50 50 ALA N N 15 124.648 . . 2 . . . A 51 ALA N . 17489 1 223 . 1 1 51 51 LEU H H 1 7.863 . . 2 . . . A 52 LEU H . 17489 1 224 . 1 1 51 51 LEU C C 13 178.032 . . 2 . . . A 52 LEU C . 17489 1 225 . 1 1 51 51 LEU N N 15 118.847 . . 2 . . . A 52 LEU N . 17489 1 226 . 1 1 52 52 ALA H H 1 7.812 . . 2 . . . A 53 ALA H . 17489 1 227 . 1 1 52 52 ALA HA H 1 4.187 . . 2 . . . A 53 ALA HA . 17489 1 228 . 1 1 52 52 ALA C C 13 178.553 . . 2 . . . A 53 ALA C . 17489 1 229 . 1 1 52 52 ALA CA C 13 53.690 . . 2 . . . A 53 ALA CA . 17489 1 230 . 1 1 52 52 ALA N N 15 122.637 . . 2 . . . A 53 ALA N . 17489 1 231 . 1 1 53 53 LYS H H 1 7.829 . . 2 . . . A 54 LYS H . 17489 1 232 . 1 1 53 53 LYS HA H 1 4.230 . . 2 . . . A 54 LYS HA . 17489 1 233 . 1 1 53 53 LYS C C 13 177.462 . . 2 . . . A 54 LYS C . 17489 1 234 . 1 1 53 53 LYS CA C 13 56.909 . . 2 . . . A 54 LYS CA . 17489 1 235 . 1 1 53 53 LYS N N 15 118.359 . . 2 . . . A 54 LYS N . 17489 1 236 . 1 1 54 54 LEU H H 1 7.740 . . 2 . . . A 55 LEU H . 17489 1 237 . 1 1 54 54 LEU C C 13 177.949 . . 2 . . . A 55 LEU C . 17489 1 238 . 1 1 54 54 LEU N N 15 121.619 . . 2 . . . A 55 LEU N . 17489 1 239 . 1 1 55 55 SER H H 1 7.965 . . 2 . . . A 56 SER H . 17489 1 240 . 1 1 55 55 SER HA H 1 4.233 . . 2 . . . A 56 SER HA . 17489 1 241 . 1 1 55 55 SER CA C 13 59.078 . . 2 . . . A 56 SER CA . 17489 1 242 . 1 1 55 55 SER N N 15 115.311 . . 2 . . . A 56 SER N . 17489 1 243 . 1 1 56 56 GLU H H 1 8.059 . . 2 . . . A 57 GLU H . 17489 1 244 . 1 1 56 56 GLU CA C 13 56.682 . . 2 . . . A 57 GLU CA . 17489 1 245 . 1 1 56 56 GLU N N 15 122.414 . . 2 . . . A 57 GLU N . 17489 1 246 . 1 1 57 57 LYS H H 1 8.097 . . 2 . . . A 58 LYS H . 17489 1 247 . 1 1 57 57 LYS C C 13 176.820 . . 2 . . . A 58 LYS C . 17489 1 248 . 1 1 57 57 LYS CA C 13 56.768 . . 2 . . . A 58 LYS CA . 17489 1 249 . 1 1 57 57 LYS N N 15 121.832 . . 2 . . . A 58 LYS N . 17489 1 250 . 1 1 58 58 LYS H H 1 8.205 . . 2 . . . A 59 LYS H . 17489 1 251 . 1 1 58 58 LYS HA H 1 4.309 . . 2 . . . A 59 LYS HA . 17489 1 252 . 1 1 58 58 LYS C C 13 177.035 . . 2 . . . A 59 LYS C . 17489 1 253 . 1 1 58 58 LYS CA C 13 56.998 . . 2 . . . A 59 LYS CA . 17489 1 254 . 1 1 58 58 LYS N N 15 122.051 . . 2 . . . A 59 LYS N . 17489 1 255 . 1 1 59 59 GLN H H 1 8.254 . . 2 . . . . 60 GLN H . 17489 1 256 . 1 1 59 59 GLN HA H 1 4.255 . . 2 . . . . 60 GLN HA . 17489 1 257 . 1 1 59 59 GLN C C 13 176.011 . . 2 . . . . 60 GLN C . 17489 1 258 . 1 1 59 59 GLN CA C 13 56.794 . . 2 . . . . 60 GLN CA . 17489 1 259 . 1 1 59 59 GLN N N 15 121.104 . . 2 . . . . 60 GLN N . 17489 1 260 . 1 1 60 60 ALA H H 1 8.231 . . 2 . . . . 61 ALA H . 17489 1 261 . 1 1 60 60 ALA HA H 1 4.300 . . 2 . . . . 61 ALA HA . 17489 1 262 . 1 1 60 60 ALA C C 13 177.717 . . 2 . . . . 61 ALA C . 17489 1 263 . 1 1 60 60 ALA CA C 13 52.834 . . 2 . . . . 61 ALA CA . 17489 1 264 . 1 1 60 60 ALA N N 15 124.802 . . 2 . . . . 61 ALA N . 17489 1 265 . 1 1 61 61 PHE H H 1 7.993 . . 2 . . . . 62 PHE H . 17489 1 266 . 1 1 61 61 PHE HA H 1 4.707 . . 2 . . . . 62 PHE HA . 17489 1 267 . 1 1 61 61 PHE C C 13 175.564 . . 2 . . . . 62 PHE C . 17489 1 268 . 1 1 61 61 PHE CA C 13 58.160 . . 2 . . . . 62 PHE CA . 17489 1 269 . 1 1 61 61 PHE N N 15 119.423 . . 2 . . . . 62 PHE N . 17489 1 270 . 1 1 62 62 ASN H H 1 8.107 . . 2 . . . . 63 ASN H . 17489 1 271 . 1 1 62 62 ASN HA H 1 4.564 . . 2 . . . . 63 ASN HA . 17489 1 272 . 1 1 62 62 ASN CA C 13 53.382 . . 2 . . . . 63 ASN CA . 17489 1 273 . 1 1 62 62 ASN N N 15 120.572 . . 2 . . . . 63 ASN N . 17489 1 274 . 1 1 63 63 ALA H H 1 7.983 . . 2 . . . . 64 ALA H . 17489 1 275 . 1 1 63 63 ALA HA H 1 4.189 . . 2 . . . . 64 ALA HA . 17489 1 276 . 1 1 63 63 ALA C C 13 177.560 . . 2 . . . . 64 ALA C . 17489 1 277 . 1 1 63 63 ALA CA C 13 52.942 . . 2 . . . . 64 ALA CA . 17489 1 278 . 1 1 63 63 ALA N N 15 124.013 . . 2 . . . . 64 ALA N . 17489 1 279 . 1 1 64 64 TYR H H 1 7.884 . . 2 . . . . 65 TYR H . 17489 1 280 . 1 1 64 64 TYR HA H 1 4.483 . . 2 . . . . 65 TYR HA . 17489 1 281 . 1 1 64 64 TYR C C 13 175.714 . . 2 . . . . 65 TYR C . 17489 1 282 . 1 1 64 64 TYR CA C 13 58.003 . . 2 . . . . 65 TYR CA . 17489 1 283 . 1 1 64 64 TYR N N 15 118.567 . . 2 . . . . 65 TYR N . 17489 1 284 . 1 1 65 65 LYS H H 1 7.838 . . 2 . . . . 66 LYS H . 17489 1 285 . 1 1 65 65 LYS HA H 1 4.287 . . 2 . . . . 66 LYS HA . 17489 1 286 . 1 1 65 65 LYS C C 13 176.091 . . 2 . . . . 66 LYS C . 17489 1 287 . 1 1 65 65 LYS CA C 13 56.331 . . 2 . . . . 66 LYS CA . 17489 1 288 . 1 1 65 65 LYS N N 15 123.002 . . 2 . . . . 66 LYS N . 17489 1 289 . 1 1 66 66 VAL H H 1 8.028 . . 2 . . . . 67 VAL H . 17489 1 290 . 1 1 66 66 VAL HA H 1 4.048 . . 2 . . . . 67 VAL HA . 17489 1 291 . 1 1 66 66 VAL C C 13 176.271 . . 2 . . . . 67 VAL C . 17489 1 292 . 1 1 66 66 VAL N N 15 121.481 . . 2 . . . . 67 VAL N . 17489 1 293 . 1 1 67 67 GLN H H 1 8.407 . . 2 . . . . 68 GLN H . 17489 1 294 . 1 1 67 67 GLN C C 13 176.014 . . 2 . . . . 68 GLN C . 17489 1 295 . 1 1 67 67 GLN CA C 13 55.833 . . 2 . . . . 68 GLN CA . 17489 1 296 . 1 1 67 67 GLN N N 15 124.246 . . 2 . . . . 68 GLN N . 17489 1 297 . 1 1 68 68 THR H H 1 8.116 . . 2 . . . . 69 THR H . 17489 1 298 . 1 1 68 68 THR HA H 1 4.319 . . 2 . . . . 69 THR HA . 17489 1 299 . 1 1 68 68 THR C C 13 174.445 . . 2 . . . . 69 THR C . 17489 1 300 . 1 1 68 68 THR CA C 13 61.701 . . 2 . . . . 69 THR CA . 17489 1 301 . 1 1 68 68 THR N N 15 115.678 . . 2 . . . . 69 THR N . 17489 1 302 . 1 1 69 69 GLU H H 1 8.346 . . 2 . . . . 70 GLU H . 17489 1 303 . 1 1 69 69 GLU C C 13 175.606 . . 2 . . . . 70 GLU C . 17489 1 304 . 1 1 69 69 GLU CA C 13 56.337 . . 2 . . . . 70 GLU CA . 17489 1 305 . 1 1 69 69 GLU N N 15 123.699 . . 2 . . . . 70 GLU N . 17489 1 306 . 1 1 70 70 LYS H H 1 7.599 . . 2 . . . . 71 LYS H . 17489 1 307 . 1 1 70 70 LYS HA H 1 4.146 . . 2 . . . . 71 LYS HA . 17489 1 308 . 1 1 70 70 LYS CA C 13 57.590 . . 2 . . . . 71 LYS CA . 17489 1 309 . 1 1 70 70 LYS N N 15 126.692 . . 2 . . . . 71 LYS N . 17489 1 stop_ save_