################################### # 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 15268 _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 CBCA(CO)NH . . . 15268 1 2 HNCACB . . . 15268 1 3 HNCO . . . 15268 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 CA C 13 57.541 0.30 . 1 . . . . 1 SER CA . 15268 1 2 . 1 1 1 1 SER CB C 13 63.320 0.30 . 1 . . . . 1 SER CB . 15268 1 3 . 1 1 2 2 GLU H H 1 8.776 0.02 . 1 . . . . 2 GLU HN . 15268 1 4 . 1 1 2 2 GLU HA H 1 4.415 0.02 . 1 . . . . 2 GLU HA . 15268 1 5 . 1 1 2 2 GLU C C 13 171.203 0.30 . 1 . . . . 2 GLU C . 15268 1 6 . 1 1 2 2 GLU CA C 13 56.971 0.30 . 1 . . . . 2 GLU CA . 15268 1 7 . 1 1 2 2 GLU CB C 13 29.269 0.30 . 1 . . . . 2 GLU CB . 15268 1 8 . 1 1 2 2 GLU N N 15 121.323 0.40 . 1 . . . . 2 GLU N . 15268 1 9 . 1 1 3 3 ALA H H 1 8.283 0.02 . 1 . . . . 3 ALA HN . 15268 1 10 . 1 1 3 3 ALA HA H 1 4.317 0.02 . 1 . . . . 3 ALA HA . 15268 1 11 . 1 1 3 3 ALA C C 13 176.007 0.30 . 1 . . . . 3 ALA C . 15268 1 12 . 1 1 3 3 ALA CA C 13 53.244 0.30 . 1 . . . . 3 ALA CA . 15268 1 13 . 1 1 3 3 ALA CB C 13 19.153 0.30 . 1 . . . . 3 ALA CB . 15268 1 14 . 1 1 3 3 ALA N N 15 123.378 0.40 . 1 . . . . 3 ALA N . 15268 1 15 . 1 1 4 4 GLU H H 1 8.109 0.02 . 1 . . . . 4 GLU HN . 15268 1 16 . 1 1 4 4 GLU HA H 1 4.366 0.02 . 1 . . . . 4 GLU HA . 15268 1 17 . 1 1 4 4 GLU C C 13 177.975 0.30 . 1 . . . . 4 GLU C . 15268 1 18 . 1 1 4 4 GLU CA C 13 56.850 0.30 . 1 . . . . 4 GLU CA . 15268 1 19 . 1 1 4 4 GLU CB C 13 29.078 0.30 . 1 . . . . 4 GLU CB . 15268 1 20 . 1 1 4 4 GLU N N 15 118.121 0.40 . 1 . . . . 4 GLU N . 15268 1 21 . 1 1 5 5 ASP H H 1 8.201 0.02 . 1 . . . . 5 ASP HN . 15268 1 22 . 1 1 5 5 ASP HA H 1 4.659 0.02 . 1 . . . . 5 ASP HA . 15268 1 23 . 1 1 5 5 ASP C C 13 176.393 0.30 . 1 . . . . 5 ASP C . 15268 1 24 . 1 1 5 5 ASP CA C 13 54.166 0.30 . 1 . . . . 5 ASP CA . 15268 1 25 . 1 1 5 5 ASP CB C 13 39.422 0.30 . 1 . . . . 5 ASP CB . 15268 1 26 . 1 1 5 5 ASP N N 15 119.089 0.40 . 1 . . . . 5 ASP N . 15268 1 27 . 1 1 6 6 ALA H H 1 8.045 0.02 . 1 . . . . 6 ALA HN . 15268 1 28 . 1 1 6 6 ALA HA H 1 4.376 0.02 . 1 . . . . 6 ALA HA . 15268 1 29 . 1 1 6 6 ALA C C 13 175.403 0.30 . 1 . . . . 6 ALA C . 15268 1 30 . 1 1 6 6 ALA CA C 13 53.166 0.30 . 1 . . . . 6 ALA CA . 15268 1 31 . 1 1 6 6 ALA CB C 13 19.232 0.30 . 1 . . . . 6 ALA CB . 15268 1 32 . 1 1 6 6 ALA N N 15 123.242 0.40 . 1 . . . . 6 ALA N . 15268 1 33 . 1 1 7 7 SER H H 1 8.168 0.02 . 1 . . . . 7 SER HN . 15268 1 34 . 1 1 7 7 SER HA H 1 4.543 0.02 . 1 . . . . 7 SER HA . 15268 1 35 . 1 1 7 7 SER C C 13 177.957 0.30 . 1 . . . . 7 SER C . 15268 1 36 . 1 1 7 7 SER CA C 13 59.090 0.30 . 1 . . . . 7 SER CA . 15268 1 37 . 1 1 7 7 SER CB C 13 64.084 0.30 . 1 . . . . 7 SER CB . 15268 1 38 . 1 1 7 7 SER N N 15 115.046 0.40 . 1 . . . . 7 SER N . 15268 1 39 . 1 1 8 8 LEU H H 1 8.410 0.02 . 1 . . . . 8 LEU HN . 15268 1 40 . 1 1 8 8 LEU HA H 1 4.297 0.02 . 1 . . . . 8 LEU HA . 15268 1 41 . 1 1 8 8 LEU C C 13 175.818 0.30 . 1 . . . . 8 LEU C . 15268 1 42 . 1 1 8 8 LEU CA C 13 58.225 0.30 . 1 . . . . 8 LEU CA . 15268 1 43 . 1 1 8 8 LEU CB C 13 42.057 0.30 . 1 . . . . 8 LEU CB . 15268 1 44 . 1 1 8 8 LEU N N 15 124.101 0.40 . 1 . . . . 8 LEU N . 15268 1 45 . 1 1 9 9 LEU H H 1 8.007 0.02 . 1 . . . . 9 LEU HN . 15268 1 46 . 1 1 9 9 LEU HA H 1 4.245 0.02 . 1 . . . . 9 LEU HA . 15268 1 47 . 1 1 9 9 LEU C C 13 178.573 0.30 . 1 . . . . 9 LEU C . 15268 1 48 . 1 1 9 9 LEU CA C 13 57.976 0.30 . 1 . . . . 9 LEU CA . 15268 1 49 . 1 1 9 9 LEU CB C 13 41.475 0.30 . 1 . . . . 9 LEU CB . 15268 1 50 . 1 1 9 9 LEU N N 15 117.546 0.40 . 1 . . . . 9 LEU N . 15268 1 51 . 1 1 10 10 SER H H 1 7.979 0.02 . 1 . . . . 10 SER HN . 15268 1 52 . 1 1 10 10 SER HA H 1 4.320 0.02 . 1 . . . . 10 SER HA . 15268 1 53 . 1 1 10 10 SER C C 13 178.812 0.30 . 1 . . . . 10 SER C . 15268 1 54 . 1 1 10 10 SER CA C 13 61.538 0.30 . 1 . . . . 10 SER CA . 15268 1 55 . 1 1 10 10 SER CB C 13 62.776 0.30 . 1 . . . . 10 SER CB . 15268 1 56 . 1 1 10 10 SER N N 15 114.105 0.40 . 1 . . . . 10 SER N . 15268 1 57 . 1 1 11 11 PHE H H 1 8.046 0.30 . 1 . . . . 11 PHE HN . 15268 1 58 . 1 1 11 11 PHE HA H 1 4.439 0.02 . 1 . . . . 11 PHE HA . 15268 1 59 . 1 1 11 11 PHE C C 13 177.370 0.30 . 1 . . . . 11 PHE C . 15268 1 60 . 1 1 11 11 PHE CA C 13 60.823 0.30 . 1 . . . . 11 PHE CA . 15268 1 61 . 1 1 11 11 PHE CB C 13 39.190 0.30 . 1 . . . . 11 PHE CB . 15268 1 62 . 1 1 11 11 PHE N N 15 122.342 0.40 . 1 . . . . 11 PHE N . 15268 1 63 . 1 1 12 12 MET H H 1 8.260 0.02 . 1 . . . . 12 MET HN . 15268 1 64 . 1 1 12 12 MET HA H 1 4.303 0.02 . 1 . . . . 12 MET HA . 15268 1 65 . 1 1 12 12 MET C C 13 177.760 0.30 . 1 . . . . 12 MET C . 15268 1 66 . 1 1 12 12 MET CA C 13 58.034 0.30 . 1 . . . . 12 MET CA . 15268 1 67 . 1 1 12 12 MET CB C 13 32.703 0.30 . 1 . . . . 12 MET CB . 15268 1 68 . 1 1 12 12 MET N N 15 118.124 0.40 . 1 . . . . 12 MET N . 15268 1 69 . 1 1 13 13 GLN H H 1 8.371 0.02 . 1 . . . . 13 GLN HN . 15268 1 70 . 1 1 13 13 GLN HA H 1 4.082 0.02 . 1 . . . . 13 GLN HA . 15268 1 71 . 1 1 13 13 GLN C C 13 177.866 0.30 . 1 . . . . 13 GLN C . 15268 1 72 . 1 1 13 13 GLN CA C 13 59.149 0.30 . 1 . . . . 13 GLN CA . 15268 1 73 . 1 1 13 13 GLN CB C 13 28.792 0.30 . 1 . . . . 13 GLN CB . 15268 1 74 . 1 1 13 13 GLN N N 15 118.154 0.40 . 1 . . . . 13 GLN N . 15268 1 75 . 1 1 14 14 GLY H H 1 8.029 0.02 . 1 . . . . 14 GLY HN . 15268 1 76 . 1 1 14 14 GLY HA2 H 1 3.916 0.02 . 1 . . . . 14 GLY HA2 . 15268 1 77 . 1 1 14 14 GLY C C 13 178.079 0.30 . 1 . . . . 14 GLY C . 15268 1 78 . 1 1 14 14 GLY CA C 13 46.795 0.30 . 1 . . . . 14 GLY CA . 15268 1 79 . 1 1 14 14 GLY N N 15 106.304 0.40 . 1 . . . . 14 GLY N . 15268 1 80 . 1 1 15 15 TYR H H 1 7.950 0.02 . 1 . . . . 15 TYR HN . 15268 1 81 . 1 1 15 15 TYR HA H 1 4.307 0.02 . 1 . . . . 15 TYR HA . 15268 1 82 . 1 1 15 15 TYR C C 13 175.811 0.30 . 1 . . . . 15 TYR C . 15268 1 83 . 1 1 15 15 TYR CA C 13 61.112 0.30 . 1 . . . . 15 TYR CA . 15268 1 84 . 1 1 15 15 TYR CB C 13 39.251 0.30 . 1 . . . . 15 TYR CB . 15268 1 85 . 1 1 15 15 TYR N N 15 121.528 0.40 . 1 . . . . 15 TYR N . 15268 1 86 . 1 1 16 16 MET H H 1 8.199 0.02 . 1 . . . . 16 MET HN . 15268 1 87 . 1 1 16 16 MET HA H 1 4.307 0.02 . 1 . . . . 16 MET HA . 15268 1 88 . 1 1 16 16 MET C C 13 177.685 0.30 . 1 . . . . 16 MET C . 15268 1 89 . 1 1 16 16 MET CA C 13 57.476 0.30 . 1 . . . . 16 MET CA . 15268 1 90 . 1 1 16 16 MET CB C 13 32.342 0.30 . 1 . . . . 16 MET CB . 15268 1 91 . 1 1 16 16 MET N N 15 117.173 0.40 . 1 . . . . 16 MET N . 15268 1 92 . 1 1 17 17 LYS H H 1 7.924 0.02 . 1 . . . . 17 LYS HN . 15268 1 93 . 1 1 17 17 LYS HA H 1 4.190 0.02 . 1 . . . . 17 LYS HA . 15268 1 94 . 1 1 17 17 LYS C C 13 177.849 0.30 . 1 . . . . 17 LYS C . 15268 1 95 . 1 1 17 17 LYS CA C 13 58.393 0.30 . 1 . . . . 17 LYS CA . 15268 1 96 . 1 1 17 17 LYS CB C 13 32.311 0.30 . 1 . . . . 17 LYS CB . 15268 1 97 . 1 1 17 17 LYS N N 15 118.640 0.40 . 1 . . . . 17 LYS N . 15268 1 98 . 1 1 18 18 HIS H H 1 7.889 0.02 . 1 . . . . 18 HIS HN . 15268 1 99 . 1 1 18 18 HIS HA H 1 4.542 0.02 . 1 . . . . 18 HIS HA . 15268 1 100 . 1 1 18 18 HIS C C 13 177.796 0.30 . 1 . . . . 18 HIS C . 15268 1 101 . 1 1 18 18 HIS CA C 13 56.698 0.30 . 1 . . . . 18 HIS CA . 15268 1 102 . 1 1 18 18 HIS CB C 13 28.505 0.30 . 1 . . . . 18 HIS CB . 15268 1 103 . 1 1 18 18 HIS N N 15 116.031 0.40 . 1 . . . . 18 HIS N . 15268 1 104 . 1 1 19 19 ALA H H 1 8.144 0.02 . 1 . . . . 19 ALA HN . 15268 1 105 . 1 1 19 19 ALA HA H 1 4.282 0.02 . 1 . . . . 19 ALA HA . 15268 1 106 . 1 1 19 19 ALA C C 13 178.213 0.30 . 1 . . . . 19 ALA C . 15268 1 107 . 1 1 19 19 ALA CA C 13 54.166 0.30 . 1 . . . . 19 ALA CA . 15268 1 108 . 1 1 19 19 ALA CB C 13 19.133 0.30 . 1 . . . . 19 ALA CB . 15268 1 109 . 1 1 19 19 ALA N N 15 123.402 0.40 . 1 . . . . 19 ALA N . 15268 1 110 . 1 1 20 20 THR H H 1 8.186 0.02 . 1 . . . . 20 THR HN . 15268 1 111 . 1 1 20 20 THR HA H 1 4.128 0.02 . 1 . . . . 20 THR HA . 15268 1 112 . 1 1 20 20 THR C C 13 178.380 0.30 . 1 . . . . 20 THR C . 15268 1 113 . 1 1 20 20 THR CA C 13 64.460 0.30 . 1 . . . . 20 THR CA . 15268 1 114 . 1 1 20 20 THR CB C 13 69.213 0.30 . 1 . . . . 20 THR CB . 15268 1 115 . 1 1 20 20 THR N N 15 111.155 0.40 . 1 . . . . 20 THR N . 15268 1 116 . 1 1 21 21 LYS H H 1 7.715 0.02 . 1 . . . . 21 LYS HN . 15268 1 117 . 1 1 21 21 LYS HA H 1 4.349 0.02 . 1 . . . . 21 LYS HA . 15268 1 118 . 1 1 21 21 LYS C C 13 175.517 0.30 . 1 . . . . 21 LYS C . 15268 1 119 . 1 1 21 21 LYS CA C 13 58.000 0.30 . 1 . . . . 21 LYS CA . 15268 1 120 . 1 1 21 21 LYS CB C 13 32.848 0.30 . 1 . . . . 21 LYS CB . 15268 1 121 . 1 1 21 21 LYS N N 15 121.662 0.40 . 1 . . . . 21 LYS N . 15268 1 122 . 1 1 22 22 THR H H 1 8.000 0.30 . 1 . . . . 22 THR HN . 15268 1 123 . 1 1 22 22 THR HA H 1 4.297 0.30 . 1 . . . . 22 THR HA . 15268 1 124 . 1 1 22 22 THR C C 13 177.240 0.30 . 1 . . . . 22 THR C . 15268 1 125 . 1 1 22 22 THR CA C 13 64.040 0.30 . 1 . . . . 22 THR CA . 15268 1 126 . 1 1 22 22 THR CB C 13 69.733 0.30 . 1 . . . . 22 THR CB . 15268 1 127 . 1 1 22 22 THR N N 15 113.812 0.40 . 1 . . . . 22 THR N . 15268 1 128 . 1 1 23 23 ALA H H 1 8.412 0.02 . 1 . . . . 23 ALA HN . 15268 1 129 . 1 1 23 23 ALA HA H 1 4.122 0.02 . 1 . . . . 23 ALA HA . 15268 1 130 . 1 1 23 23 ALA C C 13 175.964 0.30 . 1 . . . . 23 ALA C . 15268 1 131 . 1 1 23 23 ALA CA C 13 55.316 0.30 . 1 . . . . 23 ALA CA . 15268 1 132 . 1 1 23 23 ALA CB C 13 18.618 0.30 . 1 . . . . 23 ALA CB . 15268 1 133 . 1 1 23 23 ALA N N 15 123.778 0.40 . 1 . . . . 23 ALA N . 15268 1 134 . 1 1 24 24 LYS H H 1 8.205 0.02 . 1 . . . . 24 LYS HN . 15268 1 135 . 1 1 24 24 LYS HA H 1 3.975 0.02 . 1 . . . . 24 LYS HA . 15268 1 136 . 1 1 24 24 LYS C C 13 178.579 0.30 . 1 . . . . 24 LYS C . 15268 1 137 . 1 1 24 24 LYS CA C 13 59.821 0.30 . 1 . . . . 24 LYS CA . 15268 1 138 . 1 1 24 24 LYS CB C 13 32.287 0.30 . 1 . . . . 24 LYS CB . 15268 1 139 . 1 1 24 24 LYS N N 15 116.572 0.40 . 1 . . . . 24 LYS N . 15268 1 140 . 1 1 25 25 ASP H H 1 8.162 0.02 . 1 . . . . 25 ASP HN . 15268 1 141 . 1 1 25 25 ASP HA H 1 4.633 0.02 . 1 . . . . 25 ASP HA . 15268 1 142 . 1 1 25 25 ASP C C 13 178.849 0.30 . 1 . . . . 25 ASP C . 15268 1 143 . 1 1 25 25 ASP CA C 13 56.667 0.30 . 1 . . . . 25 ASP CA . 15268 1 144 . 1 1 25 25 ASP CB C 13 39.431 0.30 . 1 . . . . 25 ASP CB . 15268 1 145 . 1 1 25 25 ASP N N 15 119.217 0.40 . 1 . . . . 25 ASP N . 15268 1 146 . 1 1 26 26 ALA H H 1 8.144 0.02 . 1 . . . . 26 ALA HN . 15268 1 147 . 1 1 26 26 ALA HA H 1 4.297 0.02 . 1 . . . . 26 ALA HA . 15268 1 148 . 1 1 26 26 ALA C C 13 175.378 0.30 . 1 . . . . 26 ALA C . 15268 1 149 . 1 1 26 26 ALA CA C 13 54.877 0.30 . 1 . . . . 26 ALA CA . 15268 1 150 . 1 1 26 26 ALA CB C 13 18.648 0.30 . 1 . . . . 26 ALA CB . 15268 1 151 . 1 1 26 26 ALA N N 15 123.402 0.40 . 1 . . . . 26 ALA N . 15268 1 152 . 1 1 27 27 LEU H H 1 8.203 0.02 . 1 . . . . 27 LEU HN . 15268 1 153 . 1 1 27 27 LEU HA H 1 4.149 0.02 . 1 . . . . 27 LEU HA . 15268 1 154 . 1 1 27 27 LEU C C 13 179.408 0.30 . 1 . . . . 27 LEU C . 15268 1 155 . 1 1 27 27 LEU CA C 13 57.457 0.30 . 1 . . . . 27 LEU CA . 15268 1 156 . 1 1 27 27 LEU CB C 13 41.794 0.30 . 1 . . . . 27 LEU CB . 15268 1 157 . 1 1 27 27 LEU N N 15 117.567 0.40 . 1 . . . . 27 LEU N . 15268 1 158 . 1 1 28 28 SER H H 1 8.010 0.02 . 1 . . . . 28 SER HN . 15268 1 159 . 1 1 28 28 SER HA H 1 4.348 0.02 . 1 . . . . 28 SER HA . 15268 1 160 . 1 1 28 28 SER C C 13 178.515 0.30 . 1 . . . . 28 SER C . 15268 1 161 . 1 1 28 28 SER CA C 13 61.275 0.30 . 1 . . . . 28 SER CA . 15268 1 162 . 1 1 28 28 SER CB C 13 63.339 0.30 . 1 . . . . 28 SER CB . 15268 1 163 . 1 1 28 28 SER N N 15 113.313 0.40 . 1 . . . . 28 SER N . 15268 1 164 . 1 1 29 29 SER H H 1 7.899 0.02 . 1 . . . . 29 SER HN . 15268 1 165 . 1 1 29 29 SER HA H 1 4.483 0.02 . 1 . . . . 29 SER HA . 15268 1 166 . 1 1 29 29 SER C C 13 176.227 0.30 . 1 . . . . 29 SER C . 15268 1 167 . 1 1 29 29 SER CA C 13 60.684 0.30 . 1 . . . . 29 SER CA . 15268 1 168 . 1 1 29 29 SER CB C 13 63.720 0.30 . 1 . . . . 29 SER CB . 15268 1 169 . 1 1 29 29 SER N N 15 116.193 0.40 . 1 . . . . 29 SER N . 15268 1 170 . 1 1 30 30 VAL H H 1 7.832 0.02 . 1 . . . . 30 VAL HN . 15268 1 171 . 1 1 30 30 VAL HA H 1 4.131 0.02 . 1 . . . . 30 VAL HA . 15268 1 172 . 1 1 30 30 VAL C C 13 175.982 0.30 . 1 . . . . 30 VAL C . 15268 1 173 . 1 1 30 30 VAL CA C 13 64.518 0.30 . 1 . . . . 30 VAL CA . 15268 1 174 . 1 1 30 30 VAL CB C 13 32.102 0.30 . 1 . . . . 30 VAL CB . 15268 1 175 . 1 1 30 30 VAL N N 15 120.035 0.40 . 1 . . . . 30 VAL N . 15268 1 176 . 1 1 31 31 GLN H H 1 8.252 0.02 . 1 . . . . 31 GLN HN . 15268 1 177 . 1 1 31 31 GLN HA H 1 4.222 0.02 . 1 . . . . 31 GLN HA . 15268 1 178 . 1 1 31 31 GLN C C 13 177.403 0.30 . 1 . . . . 31 GLN C . 15268 1 179 . 1 1 31 31 GLN CA C 13 57.904 0.30 . 1 . . . . 31 GLN CA . 15268 1 180 . 1 1 31 31 GLN CB C 13 29.119 0.30 . 1 . . . . 31 GLN CB . 15268 1 181 . 1 1 31 31 GLN N N 15 120.710 0.40 . 1 . . . . 31 GLN N . 15268 1 182 . 1 1 32 32 GLU H H 1 8.049 0.02 . 1 . . . . 32 GLU HN . 15268 1 183 . 1 1 32 32 GLU HA H 1 4.320 0.02 . 1 . . . . 32 GLU HA . 15268 1 184 . 1 1 32 32 GLU C C 13 176.734 0.30 . 1 . . . . 32 GLU C . 15268 1 185 . 1 1 32 32 GLU CA C 13 57.116 0.30 . 1 . . . . 32 GLU CA . 15268 1 186 . 1 1 32 32 GLU CB C 13 28.505 0.30 . 1 . . . . 32 GLU CB . 15268 1 187 . 1 1 32 32 GLU N N 15 117.872 0.40 . 1 . . . . 32 GLU N . 15268 1 188 . 1 1 33 33 SER H H 1 7.973 0.02 . 1 . . . . 33 SER HN . 15268 1 189 . 1 1 33 33 SER HA H 1 4.454 0.02 . 1 . . . . 33 SER HA . 15268 1 190 . 1 1 33 33 SER C C 13 176.505 0.30 . 1 . . . . 33 SER C . 15268 1 191 . 1 1 33 33 SER CA C 13 59.379 0.30 . 1 . . . . 33 SER CA . 15268 1 192 . 1 1 33 33 SER CB C 13 64.359 0.30 . 1 . . . . 33 SER CB . 15268 1 193 . 1 1 33 33 SER N N 15 115.021 0.40 . 1 . . . . 33 SER N . 15268 1 194 . 1 1 34 34 GLN H H 1 8.379 0.02 . 1 . . . . 34 GLN HN . 15268 1 195 . 1 1 34 34 GLN HA H 1 4.249 0.02 . 1 . . . . 34 GLN HA . 15268 1 196 . 1 1 34 34 GLN C C 13 175.446 0.30 . 1 . . . . 34 GLN C . 15268 1 197 . 1 1 34 34 GLN CA C 13 58.287 0.30 . 1 . . . . 34 GLN CA . 15268 1 198 . 1 1 34 34 GLN CB C 13 28.507 0.30 . 1 . . . . 34 GLN CB . 15268 1 199 . 1 1 34 34 GLN N N 15 121.821 0.40 . 1 . . . . 34 GLN N . 15268 1 200 . 1 1 35 35 VAL H H 1 7.885 0.02 . 1 . . . . 35 VAL HN . 15268 1 201 . 1 1 35 35 VAL HA H 1 3.890 0.02 . 1 . . . . 35 VAL HA . 15268 1 202 . 1 1 35 35 VAL C C 13 178.220 0.30 . 1 . . . . 35 VAL C . 15268 1 203 . 1 1 35 35 VAL CA C 13 65.572 0.30 . 1 . . . . 35 VAL CA . 15268 1 204 . 1 1 35 35 VAL CB C 13 31.809 0.30 . 1 . . . . 35 VAL CB . 15268 1 205 . 1 1 35 35 VAL N N 15 118.193 0.40 . 1 . . . . 35 VAL N . 15268 1 206 . 1 1 36 36 ALA H H 1 7.941 0.02 . 1 . . . . 36 ALA HN . 15268 1 207 . 1 1 36 36 ALA HA H 1 4.017 0.02 . 1 . . . . 36 ALA HA . 15268 1 208 . 1 1 36 36 ALA C C 13 175.366 0.30 . 1 . . . . 36 ALA C . 15268 1 209 . 1 1 36 36 ALA CA C 13 55.299 0.30 . 1 . . . . 36 ALA CA . 15268 1 210 . 1 1 36 36 ALA CB C 13 18.710 0.30 . 1 . . . . 36 ALA CB . 15268 1 211 . 1 1 36 36 ALA N N 15 121.942 0.40 . 1 . . . . 36 ALA N . 15268 1 212 . 1 1 37 37 GLN H H 1 7.771 0.02 . 1 . . . . 37 GLN HN . 15268 1 213 . 1 1 37 37 GLN HA H 1 4.072 0.02 . 1 . . . . 37 GLN HA . 15268 1 214 . 1 1 37 37 GLN C C 13 179.036 0.30 . 1 . . . . 37 GLN C . 15268 1 215 . 1 1 37 37 GLN CA C 13 58.656 0.30 . 1 . . . . 37 GLN CA . 15268 1 216 . 1 1 37 37 GLN CB C 13 28.583 0.30 . 1 . . . . 37 GLN CB . 15268 1 217 . 1 1 37 37 GLN N N 15 115.154 0.40 . 1 . . . . 37 GLN N . 15268 1 218 . 1 1 38 38 GLN H H 1 8.057 0.02 . 1 . . . . 38 GLN HN . 15268 1 219 . 1 1 38 38 GLN HA H 1 4.161 0.02 . 1 . . . . 38 GLN HA . 15268 1 220 . 1 1 38 38 GLN C C 13 178.965 0.30 . 1 . . . . 38 GLN C . 15268 1 221 . 1 1 38 38 GLN CA C 13 57.879 0.30 . 1 . . . . 38 GLN CA . 15268 1 222 . 1 1 38 38 GLN CB C 13 28.936 0.30 . 1 . . . . 38 GLN CB . 15268 1 223 . 1 1 38 38 GLN N N 15 119.273 0.40 . 1 . . . . 38 GLN N . 15268 1 224 . 1 1 39 39 ALA H H 1 8.226 0.02 . 1 . . . . 39 ALA HN . 15268 1 225 . 1 1 39 39 ALA HA H 1 3.878 0.02 . 1 . . . . 39 ALA HA . 15268 1 226 . 1 1 39 39 ALA C C 13 178.002 0.30 . 1 . . . . 39 ALA C . 15268 1 227 . 1 1 39 39 ALA CA C 13 54.780 0.30 . 1 . . . . 39 ALA CA . 15268 1 228 . 1 1 39 39 ALA CB C 13 18.626 0.30 . 1 . . . . 39 ALA CB . 15268 1 229 . 1 1 39 39 ALA N N 15 121.849 0.40 . 1 . . . . 39 ALA N . 15268 1 230 . 1 1 40 40 ARG H H 1 8.078 0.02 . 1 . . . . 40 ARG HN . 15268 1 231 . 1 1 40 40 ARG HA H 1 4.519 0.02 . 1 . . . . 40 ARG HA . 15268 1 232 . 1 1 40 40 ARG C C 13 178.581 0.30 . 1 . . . . 40 ARG C . 15268 1 233 . 1 1 40 40 ARG CA C 13 59.438 0.30 . 1 . . . . 40 ARG CA . 15268 1 234 . 1 1 40 40 ARG CB C 13 30.064 0.30 . 1 . . . . 40 ARG CB . 15268 1 235 . 1 1 40 40 ARG N N 15 116.166 0.40 . 1 . . . . 40 ARG N . 15268 1 236 . 1 1 41 41 GLY H H 1 7.962 0.02 . 1 . . . . 41 GLY HN . 15268 1 237 . 1 1 41 41 GLY HA2 H 1 3.965 0.02 . 1 . . . . 41 GLY HA2 . 15268 1 238 . 1 1 41 41 GLY C C 13 178.678 0.30 . 1 . . . . 41 GLY C . 15268 1 239 . 1 1 41 41 GLY CA C 13 46.734 0.30 . 1 . . . . 41 GLY CA . 15268 1 240 . 1 1 41 41 GLY N N 15 106.758 0.30 . 1 . . . . 41 GLY N . 15268 1 241 . 1 1 42 42 TRP H H 1 7.941 0.40 . 1 . . . . 42 TRP HN . 15268 1 242 . 1 1 42 42 TRP HA H 1 4.027 0.02 . 1 . . . . 42 TRP HA . 15268 1 243 . 1 1 42 42 TRP C C 13 176.967 0.30 . 1 . . . . 42 TRP C . 15268 1 244 . 1 1 42 42 TRP CA C 13 59.749 0.30 . 1 . . . . 42 TRP CA . 15268 1 245 . 1 1 42 42 TRP CB C 13 29.555 0.30 . 1 . . . . 42 TRP CB . 15268 1 246 . 1 1 42 42 TRP N N 15 121.942 0.40 . 1 . . . . 42 TRP N . 15268 1 247 . 1 1 43 43 VAL H H 1 8.025 0.40 . 1 . . . . 43 VAL HN . 15268 1 248 . 1 1 43 43 VAL HA H 1 3.848 0.02 . 1 . . . . 43 VAL HA . 15268 1 249 . 1 1 43 43 VAL C C 13 178.333 0.30 . 1 . . . . 43 VAL C . 15268 1 250 . 1 1 43 43 VAL CA C 13 65.233 0.30 . 1 . . . . 43 VAL CA . 15268 1 251 . 1 1 43 43 VAL CB C 13 32.013 0.30 . 1 . . . . 43 VAL CB . 15268 1 252 . 1 1 43 43 VAL N N 15 116.325 0.40 . 1 . . . . 43 VAL N . 15268 1 253 . 1 1 44 44 THR H H 1 7.969 0.02 . 1 . . . . 44 THR HN . 15268 1 254 . 1 1 44 44 THR HA H 1 4.239 0.02 . 1 . . . . 44 THR HA . 15268 1 255 . 1 1 44 44 THR C C 13 177.224 0.30 . 1 . . . . 44 THR C . 15268 1 256 . 1 1 44 44 THR CA C 13 65.189 0.30 . 1 . . . . 44 THR CA . 15268 1 257 . 1 1 44 44 THR CB C 13 69.255 0.30 . 1 . . . . 44 THR CB . 15268 1 258 . 1 1 44 44 THR N N 15 113.656 0.40 . 1 . . . . 44 THR N . 15268 1 259 . 1 1 45 45 ASP H H 1 8.195 0.02 . 1 . . . . 45 ASP HN . 15268 1 260 . 1 1 45 45 ASP HA H 1 4.759 0.02 . 1 . . . . 45 ASP HA . 15268 1 261 . 1 1 45 45 ASP C C 13 176.240 0.30 . 1 . . . . 45 ASP C . 15268 1 262 . 1 1 45 45 ASP CA C 13 55.102 0.30 . 1 . . . . 45 ASP CA . 15268 1 263 . 1 1 45 45 ASP CB C 13 39.325 0.30 . 1 . . . . 45 ASP CB . 15268 1 264 . 1 1 45 45 ASP N N 15 120.741 0.40 . 1 . . . . 45 ASP N . 15268 1 265 . 1 1 46 46 GLY H H 1 8.193 0.02 . 1 . . . . 46 GLY HN . 15268 1 266 . 1 1 46 46 GLY HA2 H 1 3.809 0.02 . 1 . . . . 46 GLY HA2 . 15268 1 267 . 1 1 46 46 GLY C C 13 177.272 0.30 . 1 . . . . 46 GLY C . 15268 1 268 . 1 1 46 46 GLY CA C 13 46.513 0.30 . 1 . . . . 46 GLY CA . 15268 1 269 . 1 1 46 46 GLY N N 15 108.690 0.40 . 1 . . . . 46 GLY N . 15268 1 270 . 1 1 47 47 PHE H H 1 8.371 0.02 . 1 . . . . 47 PHE HN . 15268 1 271 . 1 1 47 47 PHE HA H 1 4.448 0.02 . 1 . . . . 47 PHE HA . 15268 1 272 . 1 1 47 47 PHE C C 13 174.681 0.30 . 1 . . . . 47 PHE C . 15268 1 273 . 1 1 47 47 PHE CA C 13 60.145 0.30 . 1 . . . . 47 PHE CA . 15268 1 274 . 1 1 47 47 PHE CB C 13 38.825 0.30 . 1 . . . . 47 PHE CB . 15268 1 275 . 1 1 47 47 PHE N N 15 119.504 0.40 . 1 . . . . 47 PHE N . 15268 1 276 . 1 1 48 48 SER H H 1 8.160 0.02 . 1 . . . . 48 SER HN . 15268 1 277 . 1 1 48 48 SER HA H 1 4.195 0.02 . 1 . . . . 48 SER HA . 15268 1 278 . 1 1 48 48 SER C C 13 177.055 0.30 . 1 . . . . 48 SER C . 15268 1 279 . 1 1 48 48 SER CA C 13 61.834 0.30 . 1 . . . . 48 SER CA . 15268 1 280 . 1 1 48 48 SER CB C 13 63.181 0.30 . 1 . . . . 48 SER CB . 15268 1 281 . 1 1 48 48 SER N N 15 113.986 0.40 . 1 . . . . 48 SER N . 15268 1 282 . 1 1 49 49 SER H H 1 8.050 0.02 . 1 . . . . 49 SER HN . 15268 1 283 . 1 1 49 49 SER HA H 1 4.454 0.02 . 1 . . . . 49 SER HA . 15268 1 284 . 1 1 49 49 SER C C 13 176.526 0.30 . 1 . . . . 49 SER C . 15268 1 285 . 1 1 49 49 SER CA C 13 61.217 0.30 . 1 . . . . 49 SER CA . 15268 1 286 . 1 1 49 49 SER CB C 13 63.302 0.30 . 1 . . . . 49 SER CB . 15268 1 287 . 1 1 49 49 SER N N 15 116.779 0.40 . 1 . . . . 49 SER N . 15268 1 288 . 1 1 50 50 LEU H H 1 8.003 0.02 . 1 . . . . 50 LEU HN . 15268 1 289 . 1 1 50 50 LEU HA H 1 4.293 0.02 . 1 . . . . 50 LEU HA . 15268 1 290 . 1 1 50 50 LEU C C 13 175.754 0.30 . 1 . . . . 50 LEU C . 15268 1 291 . 1 1 50 50 LEU CA C 13 58.134 0.30 . 1 . . . . 50 LEU CA . 15268 1 292 . 1 1 50 50 LEU CB C 13 41.976 0.30 . 1 . . . . 50 LEU CB . 15268 1 293 . 1 1 50 50 LEU N N 15 122.176 0.40 . 1 . . . . 50 LEU N . 15268 1 294 . 1 1 51 51 LYS H H 1 8.091 0.02 . 1 . . . . 51 LYS HN . 15268 1 295 . 1 1 51 51 LYS HA H 1 4.072 0.02 . 1 . . . . 51 LYS HA . 15268 1 296 . 1 1 51 51 LYS C C 13 178.459 0.30 . 1 . . . . 51 LYS C . 15268 1 297 . 1 1 51 51 LYS CA C 13 60.375 0.30 . 1 . . . . 51 LYS CA . 15268 1 298 . 1 1 51 51 LYS CB C 13 32.156 0.30 . 1 . . . . 51 LYS CB . 15268 1 299 . 1 1 51 51 LYS N N 15 117.526 0.40 . 1 . . . . 51 LYS N . 15268 1 300 . 1 1 52 52 ASP H H 1 7.915 0.02 . 1 . . . . 52 ASP HN . 15268 1 301 . 1 1 52 52 ASP HA H 1 4.594 0.02 . 1 . . . . 52 ASP HA . 15268 1 302 . 1 1 52 52 ASP C C 13 178.854 0.30 . 1 . . . . 52 ASP C . 15268 1 303 . 1 1 52 52 ASP CA C 13 56.696 0.30 . 1 . . . . 52 ASP CA . 15268 1 304 . 1 1 52 52 ASP CB C 13 39.194 0.30 . 1 . . . . 52 ASP CB . 15268 1 305 . 1 1 52 52 ASP N N 15 119.070 0.40 . 1 . . . . 52 ASP N . 15268 1 306 . 1 1 53 53 TYR H H 1 8.144 0.02 . 1 . . . . 53 TYR HN . 15268 1 307 . 1 1 53 53 TYR HA H 1 4.630 0.02 . 1 . . . . 53 TYR HA . 15268 1 308 . 1 1 53 53 TYR C C 13 178.269 0.30 . 1 . . . . 53 TYR C . 15268 1 309 . 1 1 53 53 TYR CA C 13 60.692 0.30 . 1 . . . . 53 TYR CA . 15268 1 310 . 1 1 53 53 TYR CB C 13 38.569 0.30 . 1 . . . . 53 TYR CB . 15268 1 311 . 1 1 53 53 TYR N N 15 120.243 0.40 . 1 . . . . 53 TYR N . 15268 1 312 . 1 1 54 54 TRP H H 1 8.591 0.02 . 1 . . . . 54 TRP HN . 15268 1 313 . 1 1 54 54 TRP HA H 1 4.494 0.02 . 1 . . . . 54 TRP HA . 15268 1 314 . 1 1 54 54 TRP C C 13 178.007 0.30 . 1 . . . . 54 TRP C . 15268 1 315 . 1 1 54 54 TRP CA C 13 59.747 0.30 . 1 . . . . 54 TRP CA . 15268 1 316 . 1 1 54 54 TRP CB C 13 30.447 0.30 . 1 . . . . 54 TRP CB . 15268 1 317 . 1 1 54 54 TRP N N 15 120.624 0.40 . 1 . . . . 54 TRP N . 15268 1 318 . 1 1 55 55 SER H H 1 8.223 0.02 . 1 . . . . 55 SER HN . 15268 1 319 . 1 1 55 55 SER HA H 1 3.906 0.02 . 1 . . . . 55 SER HA . 15268 1 320 . 1 1 55 55 SER C C 13 176.913 0.30 . 1 . . . . 55 SER C . 15268 1 321 . 1 1 55 55 SER CA C 13 62.150 0.30 . 1 . . . . 55 SER CA . 15268 1 322 . 1 1 55 55 SER CB C 13 63.019 0.30 . 1 . . . . 55 SER CB . 15268 1 323 . 1 1 55 55 SER N N 15 112.199 0.40 . 1 . . . . 55 SER N . 15268 1 324 . 1 1 56 56 THR H H 1 7.689 0.02 . 1 . . . . 56 THR HN . 15268 1 325 . 1 1 56 56 THR HA H 1 4.104 0.02 . 1 . . . . 56 THR HA . 15268 1 326 . 1 1 56 56 THR C C 13 176.440 0.30 . 1 . . . . 56 THR C . 15268 1 327 . 1 1 56 56 THR CA C 13 66.346 0.30 . 1 . . . . 56 THR CA . 15268 1 328 . 1 1 56 56 THR CB C 13 68.858 0.30 . 1 . . . . 56 THR CB . 15268 1 329 . 1 1 56 56 THR N N 15 117.331 0.40 . 1 . . . . 56 THR N . 15268 1 330 . 1 1 57 57 VAL H H 1 7.960 0.02 . 1 . . . . 57 VAL HN . 15268 1 331 . 1 1 57 57 VAL HA H 1 3.623 0.02 . 1 . . . . 57 VAL HA . 15268 1 332 . 1 1 57 57 VAL C C 13 176.128 0.30 . 1 . . . . 57 VAL C . 15268 1 333 . 1 1 57 57 VAL CA C 13 66.489 0.30 . 1 . . . . 57 VAL CA . 15268 1 334 . 1 1 57 57 VAL CB C 13 31.829 0.30 . 1 . . . . 57 VAL CB . 15268 1 335 . 1 1 57 57 VAL N N 15 121.777 0.40 . 1 . . . . 57 VAL N . 15268 1 336 . 1 1 58 58 LYS H H 1 8.100 0.02 . 1 . . . . 58 LYS HN . 15268 1 337 . 1 1 58 58 LYS HA H 1 3.554 0.02 . 1 . . . . 58 LYS HA . 15268 1 338 . 1 1 58 58 LYS C C 13 177.265 0.30 . 1 . . . . 58 LYS C . 15268 1 339 . 1 1 58 58 LYS CA C 13 60.174 0.30 . 1 . . . . 58 LYS CA . 15268 1 340 . 1 1 58 58 LYS CB C 13 31.373 0.30 . 1 . . . . 58 LYS CB . 15268 1 341 . 1 1 58 58 LYS N N 15 119.262 0.40 . 1 . . . . 58 LYS N . 15268 1 342 . 1 1 59 59 ASP H H 1 7.826 0.02 . 1 . . . . 59 ASP HN . 15268 1 343 . 1 1 59 59 ASP HA H 1 4.473 0.02 . 1 . . . . 59 ASP HA . 15268 1 344 . 1 1 59 59 ASP C C 13 178.762 0.30 . 1 . . . . 59 ASP C . 15268 1 345 . 1 1 59 59 ASP CA C 13 56.562 0.30 . 1 . . . . 59 ASP CA . 15268 1 346 . 1 1 59 59 ASP CB C 13 39.446 0.30 . 1 . . . . 59 ASP CB . 15268 1 347 . 1 1 59 59 ASP N N 15 117.771 0.40 . 1 . . . . 59 ASP N . 15268 1 348 . 1 1 60 60 LYS H H 1 8.052 0.02 . 1 . . . . 60 LYS HN . 15268 1 349 . 1 1 60 60 LYS HA H 1 4.141 0.02 . 1 . . . . 60 LYS HA . 15268 1 350 . 1 1 60 60 LYS C C 13 178.220 0.30 . 1 . . . . 60 LYS C . 15268 1 351 . 1 1 60 60 LYS CA C 13 58.383 0.30 . 1 . . . . 60 LYS CA . 15268 1 352 . 1 1 60 60 LYS CB C 13 32.095 0.30 . 1 . . . . 60 LYS CB . 15268 1 353 . 1 1 60 60 LYS N N 15 119.850 0.40 . 1 . . . . 60 LYS N . 15268 1 354 . 1 1 61 61 PHE H H 1 8.301 0.02 . 1 . . . . 61 PHE HN . 15268 1 355 . 1 1 61 61 PHE HA H 1 4.337 0.02 . 1 . . . . 61 PHE HA . 15268 1 356 . 1 1 61 61 PHE C C 13 178.462 0.30 . 1 . . . . 61 PHE C . 15268 1 357 . 1 1 61 61 PHE CA C 13 60.780 0.30 . 1 . . . . 61 PHE CA . 15268 1 358 . 1 1 61 61 PHE CB C 13 39.194 0.30 . 1 . . . . 61 PHE CB . 15268 1 359 . 1 1 61 61 PHE N N 15 118.056 0.40 . 1 . . . . 61 PHE N . 15268 1 360 . 1 1 62 62 SER H H 1 8.160 0.02 . 1 . . . . 62 SER HN . 15268 1 361 . 1 1 62 62 SER HA H 1 4.229 0.02 . 1 . . . . 62 SER HA . 15268 1 362 . 1 1 62 62 SER C C 13 177.060 0.30 . 1 . . . . 62 SER C . 15268 1 363 . 1 1 62 62 SER CA C 13 61.546 0.30 . 1 . . . . 62 SER CA . 15268 1 364 . 1 1 62 62 SER CB C 13 63.368 0.30 . 1 . . . . 62 SER CB . 15268 1 365 . 1 1 62 62 SER N N 15 113.635 0.40 . 1 . . . . 62 SER N . 15268 1 366 . 1 1 63 63 GLU H H 1 7.847 0.02 . 1 . . . . 63 GLU HN . 15268 1 367 . 1 1 63 63 GLU HA H 1 4.200 0.02 . 1 . . . . 63 GLU HA . 15268 1 368 . 1 1 63 63 GLU C C 13 175.917 0.30 . 1 . . . . 63 GLU C . 15268 1 369 . 1 1 63 63 GLU CA C 13 57.833 0.30 . 1 . . . . 63 GLU CA . 15268 1 370 . 1 1 63 63 GLU CB C 13 28.314 0.30 . 1 . . . . 63 GLU CB . 15268 1 371 . 1 1 63 63 GLU N N 15 119.485 0.40 . 1 . . . . 63 GLU N . 15268 1 372 . 1 1 64 64 PHE H H 1 7.792 0.02 . 1 . . . . 64 PHE HN . 15268 1 373 . 1 1 64 64 PHE HA H 1 4.448 0.02 . 1 . . . . 64 PHE HA . 15268 1 374 . 1 1 64 64 PHE C C 13 177.370 0.30 . 1 . . . . 64 PHE C . 15268 1 375 . 1 1 64 64 PHE CA C 13 59.714 0.30 . 1 . . . . 64 PHE CA . 15268 1 376 . 1 1 64 64 PHE CB C 13 39.825 0.30 . 1 . . . . 64 PHE CB . 15268 1 377 . 1 1 64 64 PHE N N 15 118.506 0.40 . 1 . . . . 64 PHE N . 15268 1 378 . 1 1 65 65 TRP H H 1 7.776 0.02 . 1 . . . . 65 TRP HN . 15268 1 379 . 1 1 65 65 TRP HA H 1 4.524 0.02 . 1 . . . . 65 TRP HA . 15268 1 380 . 1 1 65 65 TRP C C 13 175.868 0.30 . 1 . . . . 65 TRP C . 15268 1 381 . 1 1 65 65 TRP CA C 13 57.472 0.30 . 1 . . . . 65 TRP CA . 15268 1 382 . 1 1 65 65 TRP CB C 13 30.031 0.30 . 1 . . . . 65 TRP CB . 15268 1 383 . 1 1 65 65 TRP N N 15 118.247 0.40 . 1 . . . . 65 TRP N . 15268 1 384 . 1 1 66 66 ASP H H 1 7.832 0.02 . 1 . . . . 66 ASP HN . 15268 1 385 . 1 1 66 66 ASP HA H 1 4.708 0.02 . 1 . . . . 66 ASP HA . 15268 1 386 . 1 1 66 66 ASP C C 13 175.345 0.30 . 1 . . . . 66 ASP C . 15268 1 387 . 1 1 66 66 ASP CA C 13 53.378 0.30 . 1 . . . . 66 ASP CA . 15268 1 388 . 1 1 66 66 ASP CB C 13 38.672 0.30 . 1 . . . . 66 ASP CB . 15268 1 389 . 1 1 66 66 ASP N N 15 119.198 0.40 . 1 . . . . 66 ASP N . 15268 1 390 . 1 1 67 67 LEU H H 1 7.877 0.02 . 1 . . . . 67 LEU HN . 15268 1 391 . 1 1 67 67 LEU HA H 1 4.346 0.02 . 1 . . . . 67 LEU HA . 15268 1 392 . 1 1 67 67 LEU C C 13 175.060 0.30 . 1 . . . . 67 LEU C . 15268 1 393 . 1 1 67 67 LEU CA C 13 55.458 0.30 . 1 . . . . 67 LEU CA . 15268 1 394 . 1 1 67 67 LEU CB C 13 42.444 0.30 . 1 . . . . 67 LEU CB . 15268 1 395 . 1 1 67 67 LEU N N 15 121.856 0.40 . 1 . . . . 67 LEU N . 15268 1 396 . 1 1 68 68 ASP H H 1 7.939 0.02 . 1 . . . . 68 ASP HN . 15268 1 397 . 1 1 68 68 ASP HA H 1 4.571 0.02 . 1 . . . . 68 ASP HA . 15268 1 398 . 1 1 68 68 ASP C C 13 176.528 0.30 . 1 . . . . 68 ASP C . 15268 1 399 . 1 1 68 68 ASP CA C 13 54.086 0.30 . 1 . . . . 68 ASP CA . 15268 1 400 . 1 1 68 68 ASP CB C 13 40.423 0.30 . 1 . . . . 68 ASP CB . 15268 1 401 . 1 1 68 68 ASP N N 15 122.966 0.40 . 1 . . . . 68 ASP N . 15268 1 402 . 1 1 69 69 PRO CA C 13 62.556 0.30 . 1 . . . . 69 PRO CA . 15268 1 403 . 1 1 69 69 PRO CB C 13 32.514 0.30 . 1 . . . . 69 PRO CB . 15268 1 404 . 1 1 70 70 GLU H H 1 8.627 0.02 . 1 . . . . 70 GLU HN . 15268 1 405 . 1 1 70 70 GLU HA H 1 4.532 0.02 . 1 . . . . 70 GLU HA . 15268 1 406 . 1 1 70 70 GLU C C 13 172.210 0.30 . 1 . . . . 70 GLU C . 15268 1 407 . 1 1 70 70 GLU CA C 13 56.488 0.30 . 1 . . . . 70 GLU CA . 15268 1 408 . 1 1 70 70 GLU CB C 13 29.544 0.30 . 1 . . . . 70 GLU CB . 15268 1 409 . 1 1 70 70 GLU N N 15 120.105 0.40 . 1 . . . . 70 GLU N . 15268 1 410 . 1 1 71 71 VAL H H 1 7.826 0.02 . 1 . . . . 71 VAL HN . 15268 1 411 . 1 1 71 71 VAL HA H 1 4.210 0.02 . 1 . . . . 71 VAL HA . 15268 1 412 . 1 1 71 71 VAL C C 13 175.329 0.30 . 1 . . . . 71 VAL C . 15268 1 413 . 1 1 71 71 VAL CA C 13 61.895 0.30 . 1 . . . . 71 VAL CA . 15268 1 414 . 1 1 71 71 VAL CB C 13 33.096 0.30 . 1 . . . . 71 VAL CB . 15268 1 415 . 1 1 71 71 VAL N N 15 119.356 0.40 . 1 . . . . 71 VAL N . 15268 1 416 . 1 1 72 72 ARG H H 1 8.103 0.02 . 1 . . . . 72 ARG HN . 15268 1 417 . 1 1 72 72 ARG HA H 1 4.757 0.30 . 1 . . . . 72 ARG HA . 15268 1 418 . 1 1 72 72 ARG C C 13 174.732 0.30 . 1 . . . . 72 ARG C . 15268 1 419 . 1 1 72 72 ARG CA C 13 53.719 0.30 . 1 . . . . 72 ARG CA . 15268 1 420 . 1 1 72 72 ARG CB C 13 30.795 0.30 . 1 . . . . 72 ARG CB . 15268 1 421 . 1 1 72 72 ARG N N 15 122.861 0.40 . 1 . . . . 72 ARG N . 15268 1 422 . 1 1 73 73 PRO CA C 13 64.693 0.30 . 1 . . . . 73 PRO CA . 15268 1 423 . 1 1 73 73 PRO CB C 13 31.605 0.30 . 1 . . . . 73 PRO CB . 15268 1 424 . 1 1 74 74 THR H H 1 7.959 0.02 . 1 . . . . 74 THR HN . 15268 1 425 . 1 1 74 74 THR HA H 1 4.131 0.02 . 1 . . . . 74 THR HA . 15268 1 426 . 1 1 74 74 THR C C 13 176.913 0.30 . 1 . . . . 74 THR C . 15268 1 427 . 1 1 74 74 THR CA C 13 64.309 0.30 . 1 . . . . 74 THR CA . 15268 1 428 . 1 1 74 74 THR CB C 13 69.160 0.30 . 1 . . . . 74 THR CB . 15268 1 429 . 1 1 74 74 THR N N 15 110.152 0.40 . 1 . . . . 74 THR N . 15268 1 430 . 1 1 75 75 SER H H 1 7.997 0.02 . 1 . . . . 75 SER HN . 15268 1 431 . 1 1 75 75 SER HA H 1 4.483 0.02 . 1 . . . . 75 SER HA . 15268 1 432 . 1 1 75 75 SER C C 13 176.093 0.30 . 1 . . . . 75 SER C . 15268 1 433 . 1 1 75 75 SER CA C 13 60.300 0.30 . 1 . . . . 75 SER CA . 15268 1 434 . 1 1 75 75 SER CB C 13 63.327 0.30 . 1 . . . . 75 SER CB . 15268 1 435 . 1 1 75 75 SER N N 15 117.147 0.40 . 1 . . . . 75 SER N . 15268 1 436 . 1 1 76 76 ALA H H 1 8.109 0.02 . 1 . . . . 76 ALA HN . 15268 1 437 . 1 1 76 76 ALA HA H 1 4.219 0.02 . 1 . . . . 76 ALA HA . 15268 1 438 . 1 1 76 76 ALA C C 13 175.737 0.30 . 1 . . . . 76 ALA C . 15268 1 439 . 1 1 76 76 ALA CA C 13 54.932 0.30 . 1 . . . . 76 ALA CA . 15268 1 440 . 1 1 76 76 ALA CB C 13 18.773 0.30 . 1 . . . . 76 ALA CB . 15268 1 441 . 1 1 76 76 ALA N N 15 124.803 0.40 . 1 . . . . 76 ALA N . 15268 1 442 . 1 1 77 77 VAL H H 1 7.798 0.02 . 1 . . . . 77 VAL HN . 15268 1 443 . 1 1 77 77 VAL HA H 1 3.682 0.02 . 1 . . . . 77 VAL HA . 15268 1 444 . 1 1 77 77 VAL C C 13 178.536 0.30 . 1 . . . . 77 VAL C . 15268 1 445 . 1 1 77 77 VAL CA C 13 66.335 0.30 . 1 . . . . 77 VAL CA . 15268 1 446 . 1 1 77 77 VAL CB C 13 31.744 0.30 . 1 . . . . 77 VAL CB . 15268 1 447 . 1 1 77 77 VAL N N 15 115.730 0.40 . 1 . . . . 77 VAL N . 15268 1 448 . 1 1 78 78 ALA H H 1 7.832 0.02 . 1 . . . . 78 ALA HN . 15268 1 449 . 1 1 78 78 ALA HA H 1 4.115 0.02 . 1 . . . . 78 ALA HA . 15268 1 450 . 1 1 78 78 ALA C C 13 177.362 0.30 . 1 . . . . 78 ALA C . 15268 1 451 . 1 1 78 78 ALA CA C 13 54.902 0.30 . 1 . . . . 78 ALA CA . 15268 1 452 . 1 1 78 78 ALA CB C 13 18.311 0.30 . 1 . . . . 78 ALA CB . 15268 1 453 . 1 1 78 78 ALA N N 15 121.924 0.40 . 1 . . . . 78 ALA N . 15268 1 454 . 1 1 79 79 ALA H H 1 7.849 0.02 . 1 . . . . 79 ALA HN . 15268 1 455 . 1 1 79 79 ALA HA H 1 4.219 0.02 . 1 . . . . 79 ALA HA . 15268 1 456 . 1 1 79 79 ALA C C 13 179.830 0.30 . 1 . . . . 79 ALA C . 15268 1 457 . 1 1 79 79 ALA CA C 13 54.840 0.30 . 1 . . . . 79 ALA CA . 15268 1 458 . 1 1 79 79 ALA CB C 13 18.616 0.30 . 1 . . . . 79 ALA CB . 15268 1 459 . 1 1 79 79 ALA N N 15 119.912 0.40 . 1 . . . . 79 ALA N . 15268 1 stop_ save_