################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 52764 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name dsRBD34 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 2 '3D HNCA' . . . 52764 1 3 '3D HNCACB' . . . 52764 1 4 '3D CBCA(CO)NH' . . . 52764 1 5 '3D HNCO' . . . 52764 1 6 '3D HN(CA)CO' . . . 52764 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 52764 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 5 5 PRO CA C 13 65.198 . . 1 . . . . . 5 PRO CA . 52764 1 2 . 1 . 1 5 5 PRO CB C 13 31.815 . . 1 . . . . . 5 PRO CB . 52764 1 3 . 1 . 1 6 6 ILE H H 1 7.549 . . 1 . . . . . 6 ILE HN . 52764 1 4 . 1 . 1 6 6 ILE CA C 13 66.012 . . 1 . . . . . 6 ILE CA . 52764 1 5 . 1 . 1 6 6 ILE CB C 13 38.413 . . 1 . . . . . 6 ILE CB . 52764 1 6 . 1 . 1 6 6 ILE N N 15 116.950 . . 1 . . . . . 6 ILE N . 52764 1 7 . 1 . 1 7 7 SER H H 1 7.301 . . 1 . . . . . 7 SER HN . 52764 1 8 . 1 . 1 7 7 SER CA C 13 61.676 . . 1 . . . . . 7 SER CA . 52764 1 9 . 1 . 1 7 7 SER N N 15 114.833 . . 1 . . . . . 7 SER N . 52764 1 10 . 1 . 1 8 8 GLN CA C 13 59.676 . . 1 . . . . . 8 GLN CA . 52764 1 11 . 1 . 1 8 8 GLN CB C 13 29.883 . . 1 . . . . . 8 GLN CB . 52764 1 12 . 1 . 1 9 9 VAL H H 1 8.112 . . 1 . . . . . 9 VAL HN . 52764 1 13 . 1 . 1 9 9 VAL CA C 13 67.371 . . 1 . . . . . 9 VAL CA . 52764 1 14 . 1 . 1 9 9 VAL CB C 13 31.151 . . 1 . . . . . 9 VAL CB . 52764 1 15 . 1 . 1 9 9 VAL N N 15 119.490 . . 1 . . . . . 9 VAL N . 52764 1 16 . 1 . 1 10 10 HIS H H 1 7.821 . . 1 . . . . . 10 HIS HN . 52764 1 17 . 1 . 1 10 10 HIS CA C 13 61.157 . . 1 . . . . . 10 HIS CA . 52764 1 18 . 1 . 1 10 10 HIS CB C 13 29.594 . . 1 . . . . . 10 HIS CB . 52764 1 19 . 1 . 1 10 10 HIS N N 15 116.950 . . 1 . . . . . 10 HIS N . 52764 1 20 . 1 . 1 11 11 GLU H H 1 8.249 . . 1 . . . . . 11 GLU HN . 52764 1 21 . 1 . 1 11 11 GLU CA C 13 59.746 . . 1 . . . . . 11 GLU CA . 52764 1 22 . 1 . 1 11 11 GLU CB C 13 29.535 . . 1 . . . . . 11 GLU CB . 52764 1 23 . 1 . 1 11 11 GLU N N 15 119.279 . . 1 . . . . . 11 GLU N . 52764 1 24 . 1 . 1 12 12 ILE H H 1 8.098 . . 1 . . . . . 12 ILE HN . 52764 1 25 . 1 . 1 12 12 ILE CA C 13 65.639 . . 1 . . . . . 12 ILE CA . 52764 1 26 . 1 . 1 12 12 ILE CB C 13 37.494 . . 1 . . . . . 12 ILE CB . 52764 1 27 . 1 . 1 12 12 ILE N N 15 120.760 . . 1 . . . . . 12 ILE N . 52764 1 28 . 1 . 1 13 13 GLY H H 1 8.555 . . 1 . . . . . 13 GLY HN . 52764 1 29 . 1 . 1 13 13 GLY CA C 13 47.905 . . 1 . . . . . 13 GLY CA . 52764 1 30 . 1 . 1 13 13 GLY N N 15 107.000 . . 1 . . . . . 13 GLY N . 52764 1 31 . 1 . 1 14 14 ILE H H 1 8.029 . . 1 . . . . . 14 ILE HN . 52764 1 32 . 1 . 1 14 14 ILE CA C 13 64.539 . . 1 . . . . . 14 ILE CA . 52764 1 33 . 1 . 1 14 14 ILE CB C 13 37.486 . . 1 . . . . . 14 ILE CB . 52764 1 34 . 1 . 1 14 14 ILE N N 15 120.760 . . 1 . . . . . 14 ILE N . 52764 1 35 . 1 . 1 15 15 LYS H H 1 7.980 . . 1 . . . . . 15 LYS HN . 52764 1 36 . 1 . 1 15 15 LYS CA C 13 59.311 . . 1 . . . . . 15 LYS CA . 52764 1 37 . 1 . 1 15 15 LYS CB C 13 32.481 . . 1 . . . . . 15 LYS CB . 52764 1 38 . 1 . 1 15 15 LYS N N 15 120.972 . . 1 . . . . . 15 LYS N . 52764 1 39 . 1 . 1 16 16 ARG H H 1 8.242 . . 1 . . . . . 16 ARG HN . 52764 1 40 . 1 . 1 16 16 ARG CA C 13 55.622 . . 1 . . . . . 16 ARG CA . 52764 1 41 . 1 . 1 16 16 ARG CB C 13 30.389 . . 1 . . . . . 16 ARG CB . 52764 1 42 . 1 . 1 16 16 ARG N N 15 114.198 . . 1 . . . . . 16 ARG N . 52764 1 43 . 1 . 1 17 17 ASN H H 1 7.967 . . 1 . . . . . 17 ASN HN . 52764 1 44 . 1 . 1 17 17 ASN CA C 13 54.279 . . 1 . . . . . 17 ASN CA . 52764 1 45 . 1 . 1 17 17 ASN CB C 13 37.151 . . 1 . . . . . 17 ASN CB . 52764 1 46 . 1 . 1 17 17 ASN N N 15 118.432 . . 1 . . . . . 17 ASN N . 52764 1 47 . 1 . 1 18 18 MET H H 1 8.932 . . 1 . . . . . 18 MET HN . 52764 1 48 . 1 . 1 18 18 MET CA C 13 54.471 . . 1 . . . . . 18 MET CA . 52764 1 49 . 1 . 1 18 18 MET CB C 13 37.330 . . 1 . . . . . 18 MET CB . 52764 1 50 . 1 . 1 18 18 MET N N 15 117.585 . . 1 . . . . . 18 MET N . 52764 1 51 . 1 . 1 19 19 THR H H 1 8.445 . . 1 . . . . . 19 THR HN . 52764 1 52 . 1 . 1 19 19 THR CA C 13 62.845 . . 1 . . . . . 19 THR CA . 52764 1 53 . 1 . 1 19 19 THR CB C 13 69.493 . . 1 . . . . . 19 THR CB . 52764 1 54 . 1 . 1 19 19 THR N N 15 117.373 . . 1 . . . . . 19 THR N . 52764 1 55 . 1 . 1 20 20 VAL H H 1 8.147 . . 1 . . . . . 20 VAL HN . 52764 1 56 . 1 . 1 20 20 VAL CA C 13 61.062 . . 1 . . . . . 20 VAL CA . 52764 1 57 . 1 . 1 20 20 VAL CB C 13 33.842 . . 1 . . . . . 20 VAL CB . 52764 1 58 . 1 . 1 20 20 VAL N N 15 124.148 . . 1 . . . . . 20 VAL N . 52764 1 59 . 1 . 1 21 21 HIS H H 1 9.066 . . 1 . . . . . 21 HIS HN . 52764 1 60 . 1 . 1 21 21 HIS CA C 13 55.040 . . 1 . . . . . 21 HIS CA . 52764 1 61 . 1 . 1 21 21 HIS CB C 13 34.225 . . 1 . . . . . 21 HIS CB . 52764 1 62 . 1 . 1 21 21 HIS N N 15 125.206 . . 1 . . . . . 21 HIS N . 52764 1 63 . 1 . 1 22 22 PHE H H 1 8.580 . . 1 . . . . . 22 PHE HN . 52764 1 64 . 1 . 1 22 22 PHE CA C 13 56.283 . . 1 . . . . . 22 PHE CA . 52764 1 65 . 1 . 1 22 22 PHE CB C 13 42.256 . . 1 . . . . . 22 PHE CB . 52764 1 66 . 1 . 1 22 22 PHE N N 15 118.643 . . 1 . . . . . 22 PHE N . 52764 1 67 . 1 . 1 23 23 LYS H H 1 8.906 . . 1 . . . . . 23 LYS HN . 52764 1 68 . 1 . 1 23 23 LYS CA C 13 54.934 . . 1 . . . . . 23 LYS CA . 52764 1 69 . 1 . 1 23 23 LYS CB C 13 36.446 . . 1 . . . . . 23 LYS CB . 52764 1 70 . 1 . 1 23 23 LYS N N 15 120.337 . . 1 . . . . . 23 LYS N . 52764 1 71 . 1 . 1 24 24 VAL H H 1 9.110 . . 1 . . . . . 24 VAL HN . 52764 1 72 . 1 . 1 24 24 VAL CA C 13 63.877 . . 1 . . . . . 24 VAL CA . 52764 1 73 . 1 . 1 24 24 VAL CB C 13 31.212 . . 1 . . . . . 24 VAL CB . 52764 1 74 . 1 . 1 24 24 VAL N N 15 126.900 . . 1 . . . . . 24 VAL N . 52764 1 75 . 1 . 1 25 25 LEU H H 1 9.432 . . 1 . . . . . 25 LEU HN . 52764 1 76 . 1 . 1 25 25 LEU CA C 13 56.138 . . 1 . . . . . 25 LEU CA . 52764 1 77 . 1 . 1 25 25 LEU CB C 13 43.200 . . 1 . . . . . 25 LEU CB . 52764 1 78 . 1 . 1 25 25 LEU N N 15 129.864 . . 1 . . . . . 25 LEU N . 52764 1 79 . 1 . 1 26 26 ARG H H 1 7.696 . . 1 . . . . . 26 ARG HN . 52764 1 80 . 1 . 1 26 26 ARG CA C 13 55.534 . . 1 . . . . . 26 ARG CA . 52764 1 81 . 1 . 1 26 26 ARG CB C 13 33.510 . . 1 . . . . . 26 ARG CB . 52764 1 82 . 1 . 1 26 26 ARG N N 15 114.410 . . 1 . . . . . 26 ARG N . 52764 1 83 . 1 . 1 27 27 GLU CA C 13 54.345 . . 1 . . . . . 27 GLU CA . 52764 1 84 . 1 . 1 27 27 GLU CB C 13 31.538 . . 1 . . . . . 27 GLU CB . 52764 1 85 . 1 . 1 28 28 GLU H H 1 8.724 . . 1 . . . . . 28 GLU HN . 52764 1 86 . 1 . 1 28 28 GLU CA C 13 54.755 . . 1 . . . . . 28 GLU CA . 52764 1 87 . 1 . 1 28 28 GLU CB C 13 33.208 . . 1 . . . . . 28 GLU CB . 52764 1 88 . 1 . 1 28 28 GLU N N 15 122.956 . . 1 . . . . . 28 GLU N . 52764 1 89 . 1 . 1 29 29 GLY H H 1 8.339 . . 1 . . . . . 29 GLY HN . 52764 1 90 . 1 . 1 29 29 GLY CA C 13 44.120 . . 1 . . . . . 29 GLY CA . 52764 1 91 . 1 . 1 29 29 GLY N N 15 108.482 . . 1 . . . . . 29 GLY N . 52764 1 92 . 1 . 1 32 32 HIS CA C 13 56.297 . . 1 . . . . . 32 HIS CA . 52764 1 93 . 1 . 1 32 32 HIS CB C 13 29.958 . . 1 . . . . . 32 HIS CB . 52764 1 94 . 1 . 1 33 33 MET H H 1 7.654 . . 1 . . . . . 33 MET HN . 52764 1 95 . 1 . 1 33 33 MET CA C 13 54.487 . . 1 . . . . . 33 MET CA . 52764 1 96 . 1 . 1 33 33 MET CB C 13 32.744 . . 1 . . . . . 33 MET CB . 52764 1 97 . 1 . 1 33 33 MET N N 15 124.571 . . 1 . . . . . 33 MET N . 52764 1 98 . 1 . 1 34 34 LYS H H 1 8.067 . . 1 . . . . . 34 LYS HN . 52764 1 99 . 1 . 1 34 34 LYS CA C 13 55.574 . . 1 . . . . . 34 LYS CA . 52764 1 100 . 1 . 1 34 34 LYS CB C 13 33.746 . . 1 . . . . . 34 LYS CB . 52764 1 101 . 1 . 1 34 34 LYS N N 15 123.089 . . 1 . . . . . 34 LYS N . 52764 1 102 . 1 . 1 35 35 ASN H H 1 8.715 . . 1 . . . . . 35 ASN HN . 52764 1 103 . 1 . 1 35 35 ASN CA C 13 52.289 . . 1 . . . . . 35 ASN CA . 52764 1 104 . 1 . 1 35 35 ASN CB C 13 41.529 . . 1 . . . . . 35 ASN CB . 52764 1 105 . 1 . 1 35 35 ASN N N 15 119.631 . . 1 . . . . . 35 ASN N . 52764 1 106 . 1 . 1 36 36 PHE H H 1 9.061 . . 1 . . . . . 36 PHE HN . 52764 1 107 . 1 . 1 36 36 PHE CA C 13 57.291 . . 1 . . . . . 36 PHE CA . 52764 1 108 . 1 . 1 36 36 PHE CB C 13 41.173 . . 1 . . . . . 36 PHE CB . 52764 1 109 . 1 . 1 36 36 PHE N N 15 122.242 . . 1 . . . . . 36 PHE N . 52764 1 110 . 1 . 1 37 37 ILE H H 1 8.792 . . 1 . . . . . 37 ILE HN . 52764 1 111 . 1 . 1 37 37 ILE CA C 13 60.226 . . 1 . . . . . 37 ILE CA . 52764 1 112 . 1 . 1 37 37 ILE CB C 13 38.276 . . 1 . . . . . 37 ILE CB . 52764 1 113 . 1 . 1 37 37 ILE N N 15 124.783 . . 1 . . . . . 37 ILE N . 52764 1 114 . 1 . 1 38 38 THR H H 1 9.109 . . 1 . . . . . 38 THR HN . 52764 1 115 . 1 . 1 38 38 THR CA C 13 61.630 . . 1 . . . . . 38 THR CA . 52764 1 116 . 1 . 1 38 38 THR CB C 13 70.911 . . 1 . . . . . 38 THR CB . 52764 1 117 . 1 . 1 38 38 THR N N 15 123.936 . . 1 . . . . . 38 THR N . 52764 1 118 . 1 . 1 39 39 ALA H H 1 9.586 . . 1 . . . . . 39 ALA HN . 52764 1 119 . 1 . 1 39 39 ALA CA C 13 49.848 . . 1 . . . . . 39 ALA CA . 52764 1 120 . 1 . 1 39 39 ALA CB C 13 20.498 . . 1 . . . . . 39 ALA CB . 52764 1 121 . 1 . 1 39 39 ALA N N 15 126.900 . . 1 . . . . . 39 ALA N . 52764 1 122 . 1 . 1 40 40 CYS H H 1 9.065 . . 1 . . . . . 40 CYS HN . 52764 1 123 . 1 . 1 40 40 CYS CA C 13 57.475 . . 1 . . . . . 40 CYS CA . 52764 1 124 . 1 . 1 40 40 CYS CB C 13 28.030 . . 1 . . . . . 40 CYS CB . 52764 1 125 . 1 . 1 40 40 CYS N N 15 123.089 . . 1 . . . . . 40 CYS N . 52764 1 126 . 1 . 1 41 41 ILE H H 1 8.739 . . 1 . . . . . 41 ILE HN . 52764 1 127 . 1 . 1 41 41 ILE CA C 13 60.264 . . 1 . . . . . 41 ILE CA . 52764 1 128 . 1 . 1 41 41 ILE CB C 13 40.423 . . 1 . . . . . 41 ILE CB . 52764 1 129 . 1 . 1 41 41 ILE N N 15 129.228 . . 1 . . . . . 41 ILE N . 52764 1 130 . 1 . 1 42 42 VAL H H 1 8.715 . . 1 . . . . . 42 VAL HN . 52764 1 131 . 1 . 1 42 42 VAL CA C 13 60.465 . . 1 . . . . . 42 VAL CA . 52764 1 132 . 1 . 1 42 42 VAL CB C 13 33.742 . . 1 . . . . . 42 VAL CB . 52764 1 133 . 1 . 1 42 42 VAL N N 15 128.805 . . 1 . . . . . 42 VAL N . 52764 1 134 . 1 . 1 43 43 GLY H H 1 8.678 . . 1 . . . . . 43 GLY HN . 52764 1 135 . 1 . 1 43 43 GLY CA C 13 47.446 . . 1 . . . . . 43 GLY CA . 52764 1 136 . 1 . 1 43 43 GLY N N 15 113.986 . . 1 . . . . . 43 GLY N . 52764 1 137 . 1 . 1 44 44 SER H H 1 8.707 . . 1 . . . . . 44 SER HN . 52764 1 138 . 1 . 1 44 44 SER CA C 13 58.126 . . 1 . . . . . 44 SER CA . 52764 1 139 . 1 . 1 44 44 SER CB C 13 63.232 . . 1 . . . . . 44 SER CB . 52764 1 140 . 1 . 1 44 44 SER N N 15 122.242 . . 1 . . . . . 44 SER N . 52764 1 141 . 1 . 1 45 45 ILE H H 1 8.576 . . 1 . . . . . 45 ILE HN . 52764 1 142 . 1 . 1 45 45 ILE CA C 13 61.827 . . 1 . . . . . 45 ILE CA . 52764 1 143 . 1 . 1 45 45 ILE CB C 13 38.210 . . 1 . . . . . 45 ILE CB . 52764 1 144 . 1 . 1 45 45 ILE N N 15 126.900 . . 1 . . . . . 45 ILE N . 52764 1 145 . 1 . 1 46 46 VAL H H 1 8.094 . . 1 . . . . . 46 VAL HN . 52764 1 146 . 1 . 1 46 46 VAL CA C 13 60.445 . . 1 . . . . . 46 VAL CA . 52764 1 147 . 1 . 1 46 46 VAL CB C 13 34.873 . . 1 . . . . . 46 VAL CB . 52764 1 148 . 1 . 1 46 46 VAL N N 15 125.206 . . 1 . . . . . 46 VAL N . 52764 1 149 . 1 . 1 47 47 THR H H 1 9.264 . . 1 . . . . . 47 THR HN . 52764 1 150 . 1 . 1 47 47 THR CA C 13 59.842 . . 1 . . . . . 47 THR CA . 52764 1 151 . 1 . 1 47 47 THR CB C 13 72.019 . . 1 . . . . . 47 THR CB . 52764 1 152 . 1 . 1 47 47 THR N N 15 118.220 . . 1 . . . . . 47 THR N . 52764 1 153 . 1 . 1 48 48 GLU H H 1 8.442 . . 1 . . . . . 48 GLU HN . 52764 1 154 . 1 . 1 48 48 GLU CA C 13 54.557 . . 1 . . . . . 48 GLU CA . 52764 1 155 . 1 . 1 48 48 GLU CB C 13 33.688 . . 1 . . . . . 48 GLU CB . 52764 1 156 . 1 . 1 48 48 GLU N N 15 117.585 . . 1 . . . . . 48 GLU N . 52764 1 157 . 1 . 1 49 49 GLY H H 1 9.208 . . 1 . . . . . 49 GLY HN . 52764 1 158 . 1 . 1 49 49 GLY CA C 13 43.408 . . 1 . . . . . 49 GLY CA . 52764 1 159 . 1 . 1 49 49 GLY N N 15 108.482 . . 1 . . . . . 49 GLY N . 52764 1 160 . 1 . 1 50 50 GLU H H 1 8.330 . . 1 . . . . . 50 GLU HN . 52764 1 161 . 1 . 1 50 50 GLU CA C 13 53.924 . . 1 . . . . . 50 GLU CA . 52764 1 162 . 1 . 1 50 50 GLU CB C 13 33.117 . . 1 . . . . . 50 GLU CB . 52764 1 163 . 1 . 1 50 50 GLU N N 15 120.337 . . 1 . . . . . 50 GLU N . 52764 1 164 . 1 . 1 51 51 GLY H H 1 8.191 . . 1 . . . . . 51 GLY HN . 52764 1 165 . 1 . 1 51 51 GLY CA C 13 45.805 . . 1 . . . . . 51 GLY CA . 52764 1 166 . 1 . 1 51 51 GLY N N 15 106.153 . . 1 . . . . . 51 GLY N . 52764 1 167 . 1 . 1 52 52 ASN H H 1 8.826 . . 1 . . . . . 52 ASN HN . 52764 1 168 . 1 . 1 52 52 ASN CA C 13 53.626 . . 1 . . . . . 52 ASN CA . 52764 1 169 . 1 . 1 52 52 ASN CB C 13 37.645 . . 1 . . . . . 52 ASN CB . 52764 1 170 . 1 . 1 52 52 ASN N N 15 119.279 . . 1 . . . . . 52 ASN N . 52764 1 171 . 1 . 1 53 53 GLY H H 1 7.377 . . 1 . . . . . 53 GLY HN . 52764 1 172 . 1 . 1 53 53 GLY CA C 13 44.751 . . 1 . . . . . 53 GLY CA . 52764 1 173 . 1 . 1 53 53 GLY N N 15 105.730 . . 1 . . . . . 53 GLY N . 52764 1 174 . 1 . 1 61 61 ALA CA C 13 55.567 . . 1 . . . . . 61 ALA CA . 52764 1 175 . 1 . 1 61 61 ALA CB C 13 17.860 . . 1 . . . . . 61 ALA CB . 52764 1 176 . 1 . 1 62 62 ALA H H 1 8.529 . . 1 . . . . . 62 ALA HN . 52764 1 177 . 1 . 1 62 62 ALA CA C 13 54.901 . . 1 . . . . . 62 ALA CA . 52764 1 178 . 1 . 1 62 62 ALA CB C 13 18.234 . . 1 . . . . . 62 ALA CB . 52764 1 179 . 1 . 1 62 62 ALA N N 15 121.396 . . 1 . . . . . 62 ALA N . 52764 1 180 . 1 . 1 63 63 GLU H H 1 8.859 . . 1 . . . . . 63 GLU HN . 52764 1 181 . 1 . 1 63 63 GLU CA C 13 60.146 . . 1 . . . . . 63 GLU CA . 52764 1 182 . 1 . 1 63 63 GLU CB C 13 29.687 . . 1 . . . . . 63 GLU CB . 52764 1 183 . 1 . 1 63 63 GLU N N 15 118.848 . . 1 . . . . . 63 GLU N . 52764 1 184 . 1 . 1 64 64 LYS H H 1 7.744 . . 1 . . . . . 64 LYS HN . 52764 1 185 . 1 . 1 64 64 LYS CA C 13 59.476 . . 1 . . . . . 64 LYS CA . 52764 1 186 . 1 . 1 64 64 LYS CB C 13 32.955 . . 1 . . . . . 64 LYS CB . 52764 1 187 . 1 . 1 64 64 LYS N N 15 117.373 . . 1 . . . . . 64 LYS N . 52764 1 188 . 1 . 1 65 65 MET H H 1 8.012 . . 1 . . . . . 65 MET HN . 52764 1 189 . 1 . 1 65 65 MET CA C 13 56.331 . . 1 . . . . . 65 MET CA . 52764 1 190 . 1 . 1 65 65 MET CB C 13 28.587 . . 1 . . . . . 65 MET CB . 52764 1 191 . 1 . 1 65 65 MET N N 15 121.819 . . 1 . . . . . 65 MET N . 52764 1 192 . 1 . 1 66 66 LEU H H 1 8.412 . . 1 . . . . . 66 LEU HN . 52764 1 193 . 1 . 1 66 66 LEU CA C 13 58.489 . . 1 . . . . . 66 LEU CA . 52764 1 194 . 1 . 1 66 66 LEU CB C 13 41.030 . . 1 . . . . . 66 LEU CB . 52764 1 195 . 1 . 1 66 66 LEU N N 15 120.760 . . 1 . . . . . 66 LEU N . 52764 1 196 . 1 . 1 67 67 VAL H H 1 6.948 . . 1 . . . . . 67 VAL HN . 52764 1 197 . 1 . 1 67 67 VAL CA C 13 66.240 . . 1 . . . . . 67 VAL CA . 52764 1 198 . 1 . 1 67 67 VAL CB C 13 31.554 . . 1 . . . . . 67 VAL CB . 52764 1 199 . 1 . 1 67 67 VAL N N 15 116.950 . . 1 . . . . . 67 VAL N . 52764 1 200 . 1 . 1 68 68 GLU H H 1 7.265 . . 1 . . . . . 68 GLU HN . 52764 1 201 . 1 . 1 68 68 GLU CA C 13 58.386 . . 1 . . . . . 68 GLU CA . 52764 1 202 . 1 . 1 68 68 GLU CB C 13 28.925 . . 1 . . . . . 68 GLU CB . 52764 1 203 . 1 . 1 68 68 GLU N N 15 117.797 . . 1 . . . . . 68 GLU N . 52764 1 204 . 1 . 1 69 69 LEU H H 1 8.940 . . 1 . . . . . 69 LEU HN . 52764 1 205 . 1 . 1 69 69 LEU CA C 13 56.988 . . 1 . . . . . 69 LEU CA . 52764 1 206 . 1 . 1 69 69 LEU CB C 13 41.022 . . 1 . . . . . 69 LEU CB . 52764 1 207 . 1 . 1 69 69 LEU N N 15 118.697 . . 1 . . . . . 69 LEU N . 52764 1 208 . 1 . 1 70 70 GLN H H 1 7.800 . . 1 . . . . . 70 GLN HN . 52764 1 209 . 1 . 1 70 70 GLN CA C 13 57.403 . . 1 . . . . . 70 GLN CA . 52764 1 210 . 1 . 1 70 70 GLN CB C 13 28.243 . . 1 . . . . . 70 GLN CB . 52764 1 211 . 1 . 1 70 70 GLN N N 15 118.220 . . 1 . . . . . 70 GLN N . 52764 1 212 . 1 . 1 71 71 LYS H H 1 7.260 . . 1 . . . . . 71 LYS HN . 52764 1 213 . 1 . 1 71 71 LYS CA C 13 56.835 . . 1 . . . . . 71 LYS CA . 52764 1 214 . 1 . 1 71 71 LYS CB C 13 32.931 . . 1 . . . . . 71 LYS CB . 52764 1 215 . 1 . 1 71 71 LYS N N 15 116.103 . . 1 . . . . . 71 LYS N . 52764 1 216 . 1 . 1 72 72 LEU H H 1 7.134 . . 1 . . . . . 72 LEU HN . 52764 1 217 . 1 . 1 72 72 LEU CA C 13 53.612 . . 1 . . . . . 72 LEU CA . 52764 1 218 . 1 . 1 72 72 LEU CB C 13 40.129 . . 1 . . . . . 72 LEU CB . 52764 1 219 . 1 . 1 72 72 LEU N N 15 119.914 . . 1 . . . . . 72 LEU N . 52764 1 220 . 1 . 1 155 155 ILE CA C 13 59.820 . . 1 . . . . . 155 ILE CA . 52764 1 221 . 1 . 1 155 155 ILE CB C 13 36.976 . . 1 . . . . . 155 ILE CB . 52764 1 222 . 1 . 1 156 156 PHE H H 1 9.111 . . 1 . . . . . 156 PHE HN . 52764 1 223 . 1 . 1 156 156 PHE CA C 13 56.929 . . 1 . . . . . 156 PHE CA . 52764 1 224 . 1 . 1 156 156 PHE CB C 13 40.990 . . 1 . . . . . 156 PHE CB . 52764 1 225 . 1 . 1 156 156 PHE N N 15 126.900 . . 1 . . . . . 156 PHE N . 52764 1 226 . 1 . 1 157 157 GLU H H 1 9.498 . . 1 . . . . . 157 GLU HN . 52764 1 227 . 1 . 1 157 157 GLU CA C 13 55.349 . . 1 . . . . . 157 GLU CA . 52764 1 228 . 1 . 1 157 157 GLU CB C 13 33.858 . . 1 . . . . . 157 GLU CB . 52764 1 229 . 1 . 1 157 157 GLU N N 15 123.724 . . 1 . . . . . 157 GLU N . 52764 1 230 . 1 . 1 158 158 LEU H H 1 8.804 . . 1 . . . . . 158 LEU HN . 52764 1 231 . 1 . 1 158 158 LEU CA C 13 55.487 . . 1 . . . . . 158 LEU CA . 52764 1 232 . 1 . 1 158 158 LEU CB C 13 42.448 . . 1 . . . . . 158 LEU CB . 52764 1 233 . 1 . 1 158 158 LEU N N 15 128.593 . . 1 . . . . . 158 LEU N . 52764 1 234 . 1 . 1 159 159 ILE H H 1 8.802 . . 1 . . . . . 159 ILE HN . 52764 1 235 . 1 . 1 159 159 ILE CA C 13 59.407 . . 1 . . . . . 159 ILE CA . 52764 1 236 . 1 . 1 159 159 ILE CB C 13 36.612 . . 1 . . . . . 159 ILE CB . 52764 1 237 . 1 . 1 159 159 ILE N N 15 128.170 . . 1 . . . . . 159 ILE N . 52764 1 238 . 1 . 1 160 160 ALA H H 1 8.281 . . 1 . . . . . 160 ALA HN . 52764 1 239 . 1 . 1 160 160 ALA CA C 13 52.182 . . 1 . . . . . 160 ALA CA . 52764 1 240 . 1 . 1 160 160 ALA CB C 13 20.109 . . 1 . . . . . 160 ALA CB . 52764 1 241 . 1 . 1 160 160 ALA N N 15 126.900 . . 1 . . . . . 160 ALA N . 52764 1 242 . 1 . 1 173 173 VAL CA C 13 61.327 . . 1 . . . . . 173 VAL CA . 52764 1 243 . 1 . 1 173 173 VAL CB C 13 33.498 . . 1 . . . . . 173 VAL CB . 52764 1 244 . 1 . 1 174 174 MET H H 1 9.228 . . 1 . . . . . 174 MET HN . 52764 1 245 . 1 . 1 174 174 MET CA C 13 52.772 . . 1 . . . . . 174 MET CA . 52764 1 246 . 1 . 1 174 174 MET CB C 13 35.854 . . 1 . . . . . 174 MET CB . 52764 1 247 . 1 . 1 174 174 MET N N 15 125.630 . . 1 . . . . . 174 MET N . 52764 1 248 . 1 . 1 175 175 GLU H H 1 9.452 . . 1 . . . . . 175 GLU HN . 52764 1 249 . 1 . 1 175 175 GLU CA C 13 54.668 . . 1 . . . . . 175 GLU CA . 52764 1 250 . 1 . 1 175 175 GLU CB C 13 34.148 . . 1 . . . . . 175 GLU CB . 52764 1 251 . 1 . 1 175 175 GLU N N 15 124.571 . . 1 . . . . . 175 GLU N . 52764 1 252 . 1 . 1 178 178 ALA CA C 13 52.641 . . 1 . . . . . 178 ALA CA . 52764 1 253 . 1 . 1 178 178 ALA CB C 13 20.153 . . 1 . . . . . 178 ALA CB . 52764 1 254 . 1 . 1 179 179 SER H H 1 9.260 . . 1 . . . . . 179 SER HN . 52764 1 255 . 1 . 1 179 179 SER CA C 13 59.415 . . 1 . . . . . 179 SER CA . 52764 1 256 . 1 . 1 179 179 SER CB C 13 61.478 . . 1 . . . . . 179 SER CB . 52764 1 257 . 1 . 1 179 179 SER N N 15 114.410 . . 1 . . . . . 179 SER N . 52764 1 258 . 1 . 1 180 180 GLY H H 1 8.749 . . 1 . . . . . 180 GLY HN . 52764 1 259 . 1 . 1 180 180 GLY CA C 13 45.392 . . 1 . . . . . 180 GLY CA . 52764 1 260 . 1 . 1 180 180 GLY N N 15 106.365 . . 1 . . . . . 180 GLY N . 52764 1 261 . 1 . 1 181 181 SER H H 1 8.149 . . 1 . . . . . 181 SER HN . 52764 1 262 . 1 . 1 181 181 SER CA C 13 58.539 . . 1 . . . . . 181 SER CA . 52764 1 263 . 1 . 1 181 181 SER CB C 13 65.930 . . 1 . . . . . 181 SER CB . 52764 1 264 . 1 . 1 181 181 SER N N 15 118.432 . . 1 . . . . . 181 SER N . 52764 1 265 . 1 . 1 182 182 THR H H 1 8.290 . . 1 . . . . . 182 THR HN . 52764 1 266 . 1 . 1 182 182 THR CA C 13 60.747 . . 1 . . . . . 182 THR CA . 52764 1 267 . 1 . 1 182 182 THR CB C 13 72.493 . . 1 . . . . . 182 THR CB . 52764 1 268 . 1 . 1 182 182 THR N N 15 116.315 . . 1 . . . . . 182 THR N . 52764 1 269 . 1 . 1 184 184 ARG CA C 13 54.297 . . 1 . . . . . 184 ARG CA . 52764 1 270 . 1 . 1 184 184 ARG CB C 13 34.597 . . 1 . . . . . 184 ARG CB . 52764 1 271 . 1 . 1 185 185 GLY H H 1 9.036 . . 1 . . . . . 185 GLY HN . 52764 1 272 . 1 . 1 185 185 GLY CA C 13 44.065 . . 1 . . . . . 185 GLY CA . 52764 1 273 . 1 . 1 185 185 GLY N N 15 107.423 . . 1 . . . . . 185 GLY N . 52764 1 274 . 1 . 1 186 186 THR H H 1 8.716 . . 1 . . . . . 186 THR HN . 52764 1 275 . 1 . 1 186 186 THR CA C 13 59.435 . . 1 . . . . . 186 THR CA . 52764 1 276 . 1 . 1 186 186 THR CB C 13 71.886 . . 1 . . . . . 186 THR CB . 52764 1 277 . 1 . 1 186 186 THR N N 15 113.139 . . 1 . . . . . 186 THR N . 52764 1 278 . 1 . 1 187 187 GLY H H 1 8.521 . . 1 . . . . . 187 GLY HN . 52764 1 279 . 1 . 1 187 187 GLY CA C 13 45.566 . . 1 . . . . . 187 GLY CA . 52764 1 280 . 1 . 1 187 187 GLY N N 15 106.577 . . 1 . . . . . 187 GLY N . 52764 1 281 . 1 . 1 208 208 VAL CA C 13 62.187 . . 1 . . . . . 208 VAL CA . 52764 1 282 . 1 . 1 208 208 VAL CB C 13 32.532 . . 1 . . . . . 208 VAL CB . 52764 1 283 . 1 . 1 209 209 GLN H H 1 8.424 . . 1 . . . . . 209 GLN HN . 52764 1 284 . 1 . 1 209 209 GLN CA C 13 55.550 . . 1 . . . . . 209 GLN CA . 52764 1 285 . 1 . 1 209 209 GLN CB C 13 29.493 . . 1 . . . . . 209 GLN CB . 52764 1 286 . 1 . 1 209 209 GLN N N 15 125.206 . . 1 . . . . . 209 GLN N . 52764 1 287 . 1 . 1 210 210 VAL H H 1 7.821 . . 1 . . . . . 210 VAL HN . 52764 1 288 . 1 . 1 210 210 VAL CA C 13 63.636 . . 1 . . . . . 210 VAL CA . 52764 1 289 . 1 . 1 210 210 VAL CB C 13 32.940 . . 1 . . . . . 210 VAL CB . 52764 1 290 . 1 . 1 210 210 VAL N N 15 126.476 . . 1 . . . . . 210 VAL N . 52764 1 stop_ save_