################################### # 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 51056 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name '13C15N DREB2A + RCD1-RST' _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 51056 1 2 '3D HNCACB' . . . 51056 1 3 '3D HN(CO)CACB' . . . 51056 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 . . 51056 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 2 2 GLN C C 13 175.746 . . 1 . . . . . 1 GLN C . 51056 1 2 . 1 . 1 2 2 GLN CA C 13 56.277 . . 1 . . . . . 1 GLN CA . 51056 1 3 . 1 . 1 2 2 GLN CB C 13 29.487 . . 1 . . . . . 1 GLN CB . 51056 1 4 . 1 . 1 3 3 ASP H H 1 8.563 . . 1 . . . . . 2 ASP H . 51056 1 5 . 1 . 1 3 3 ASP C C 13 176.392 . . 1 . . . . . 2 ASP C . 51056 1 6 . 1 . 1 3 3 ASP CA C 13 54.510 . . 1 . . . . . 2 ASP CA . 51056 1 7 . 1 . 1 3 3 ASP CB C 13 41.198 . . 1 . . . . . 2 ASP CB . 51056 1 8 . 1 . 1 3 3 ASP N N 15 121.512 . . 1 . . . . . 2 ASP N . 51056 1 9 . 1 . 1 4 4 SER H H 1 8.260 . . 1 . . . . . 3 SER H . 51056 1 10 . 1 . 1 4 4 SER C C 13 174.518 . . 1 . . . . . 3 SER C . 51056 1 11 . 1 . 1 4 4 SER CA C 13 58.655 . . 1 . . . . . 3 SER CA . 51056 1 12 . 1 . 1 4 4 SER CB C 13 63.793 . . 1 . . . . . 3 SER CB . 51056 1 13 . 1 . 1 4 4 SER N N 15 115.952 . . 1 . . . . . 3 SER N . 51056 1 14 . 1 . 1 5 5 LEU H H 1 8.282 . . 1 . . . . . 4 LEU H . 51056 1 15 . 1 . 1 5 5 LEU C C 13 177.451 . . 1 . . . . . 4 LEU C . 51056 1 16 . 1 . 1 5 5 LEU CA C 13 55.349 . . 1 . . . . . 4 LEU CA . 51056 1 17 . 1 . 1 5 5 LEU CB C 13 42.381 . . 1 . . . . . 4 LEU CB . 51056 1 18 . 1 . 1 5 5 LEU N N 15 123.679 . . 1 . . . . . 4 LEU N . 51056 1 19 . 1 . 1 6 6 SER H H 1 8.343 . . 1 . . . . . 5 SER H . 51056 1 20 . 1 . 1 6 6 SER C C 13 174.644 . . 1 . . . . . 5 SER C . 51056 1 21 . 1 . 1 6 6 SER CA C 13 58.151 . . 1 . . . . . 5 SER CA . 51056 1 22 . 1 . 1 6 6 SER CB C 13 63.980 . . 1 . . . . . 5 SER CB . 51056 1 23 . 1 . 1 6 6 SER N N 15 116.929 . . 1 . . . . . 5 SER N . 51056 1 24 . 1 . 1 7 7 VAL H H 1 8.107 . . 1 . . . . . 6 VAL H . 51056 1 25 . 1 . 1 7 7 VAL C C 13 175.998 . . 1 . . . . . 6 VAL C . 51056 1 26 . 1 . 1 7 7 VAL CA C 13 62.482 . . 1 . . . . . 6 VAL CA . 51056 1 27 . 1 . 1 7 7 VAL CB C 13 32.596 . . 1 . . . . . 6 VAL CB . 51056 1 28 . 1 . 1 7 7 VAL N N 15 121.417 . . 1 . . . . . 6 VAL N . 51056 1 29 . 1 . 1 8 8 ALA H H 1 8.216 . . 1 . . . . . 7 ALA H . 51056 1 30 . 1 . 1 8 8 ALA C C 13 177.257 . . 1 . . . . . 7 ALA C . 51056 1 31 . 1 . 1 8 8 ALA CA C 13 52.629 . . 1 . . . . . 7 ALA CA . 51056 1 32 . 1 . 1 8 8 ALA CB C 13 19.218 . . 1 . . . . . 7 ALA CB . 51056 1 33 . 1 . 1 8 8 ALA N N 15 126.539 . . 1 . . . . . 7 ALA N . 51056 1 34 . 1 . 1 9 9 ASP H H 1 8.039 . . 1 . . . . . 8 ASP H . 51056 1 35 . 1 . 1 9 9 ASP C C 13 176.001 . . 1 . . . . . 8 ASP C . 51056 1 36 . 1 . 1 9 9 ASP CA C 13 54.236 . . 1 . . . . . 8 ASP CA . 51056 1 37 . 1 . 1 9 9 ASP CB C 13 41.360 . . 1 . . . . . 8 ASP CB . 51056 1 38 . 1 . 1 9 9 ASP N N 15 119.032 . . 1 . . . . . 8 ASP N . 51056 1 39 . 1 . 1 10 10 TYR H H 1 7.973 . . 1 . . . . . 9 TYR H . 51056 1 40 . 1 . 1 10 10 TYR C C 13 177.521 . . 1 . . . . . 9 TYR C . 51056 1 41 . 1 . 1 10 10 TYR CA C 13 57.995 . . 1 . . . . . 9 TYR CA . 51056 1 42 . 1 . 1 10 10 TYR CB C 13 38.551 . . 1 . . . . . 9 TYR CB . 51056 1 43 . 1 . 1 10 10 TYR N N 15 120.105 . . 1 . . . . . 9 TYR N . 51056 1 44 . 1 . 1 11 11 GLY H H 1 8.155 . . 1 . . . . . 10 GLY H . 51056 1 45 . 1 . 1 11 11 GLY C C 13 173.417 . . 1 . . . . . 10 GLY C . 51056 1 46 . 1 . 1 11 11 GLY CA C 13 45.262 . . 1 . . . . . 10 GLY CA . 51056 1 47 . 1 . 1 11 11 GLY N N 15 109.426 . . 1 . . . . . 10 GLY N . 51056 1 48 . 1 . 1 12 12 TRP H H 1 7.973 . . 1 . . . . . 11 TRP H . 51056 1 49 . 1 . 1 12 12 TRP C C 13 174.549 . . 1 . . . . . 11 TRP C . 51056 1 50 . 1 . 1 12 12 TRP CA C 13 55.162 . . 1 . . . . . 11 TRP CA . 51056 1 51 . 1 . 1 12 12 TRP CB C 13 29.039 . . 1 . . . . . 11 TRP CB . 51056 1 52 . 1 . 1 12 12 TRP N N 15 122.101 . . 1 . . . . . 11 TRP N . 51056 1 53 . 1 . 1 13 13 PRO C C 13 176.685 . . 1 . . . . . 12 PRO C . 51056 1 54 . 1 . 1 13 13 PRO CA C 13 63.494 . . 1 . . . . . 12 PRO CA . 51056 1 55 . 1 . 1 13 13 PRO CB C 13 31.966 . . 1 . . . . . 12 PRO CB . 51056 1 56 . 1 . 1 14 14 ASN H H 1 8.420 . . 1 . . . . . 13 ASN H . 51056 1 57 . 1 . 1 14 14 ASN C C 13 175.040 . . 1 . . . . . 13 ASN C . 51056 1 58 . 1 . 1 14 14 ASN CA C 13 53.604 . . 1 . . . . . 13 ASN CA . 51056 1 59 . 1 . 1 14 14 ASN CB C 13 39.072 . . 1 . . . . . 13 ASN CB . 51056 1 60 . 1 . 1 14 14 ASN N N 15 118.474 . . 1 . . . . . 13 ASN N . 51056 1 61 . 1 . 1 15 15 ASP H H 1 8.324 . . 1 . . . . . 14 ASP H . 51056 1 62 . 1 . 1 15 15 ASP C C 13 176.290 . . 1 . . . . . 14 ASP C . 51056 1 63 . 1 . 1 15 15 ASP CA C 13 54.345 . . 1 . . . . . 14 ASP CA . 51056 1 64 . 1 . 1 15 15 ASP CB C 13 41.061 . . 1 . . . . . 14 ASP CB . 51056 1 65 . 1 . 1 15 15 ASP N N 15 119.854 . . 1 . . . . . 14 ASP N . 51056 1 66 . 1 . 1 16 16 VAL H H 1 7.956 . . 1 . . . . . 15 VAL H . 51056 1 67 . 1 . 1 16 16 VAL C C 13 175.958 . . 1 . . . . . 15 VAL C . 51056 1 68 . 1 . 1 16 16 VAL CA C 13 62.542 . . 1 . . . . . 15 VAL CA . 51056 1 69 . 1 . 1 16 16 VAL CB C 13 32.804 . . 1 . . . . . 15 VAL CB . 51056 1 70 . 1 . 1 16 16 VAL N N 15 119.348 . . 1 . . . . . 15 VAL N . 51056 1 71 . 1 . 1 17 17 ASP H H 1 8.394 . . 1 . . . . . 16 ASP H . 51056 1 72 . 1 . 1 17 17 ASP C C 13 176.664 . . 1 . . . . . 16 ASP C . 51056 1 73 . 1 . 1 17 17 ASP CA C 13 54.434 . . 1 . . . . . 16 ASP CA . 51056 1 74 . 1 . 1 17 17 ASP CB C 13 41.194 . . 1 . . . . . 16 ASP CB . 51056 1 75 . 1 . 1 17 17 ASP N N 15 123.576 . . 1 . . . . . 16 ASP N . 51056 1 76 . 1 . 1 18 18 GLN H H 1 8.374 . . 1 . . . . . 17 GLN H . 51056 1 77 . 1 . 1 18 18 GLN C C 13 176.637 . . 1 . . . . . 17 GLN C . 51056 1 78 . 1 . 1 18 18 GLN CA C 13 56.430 . . 1 . . . . . 17 GLN CA . 51056 1 79 . 1 . 1 18 18 GLN CB C 13 28.844 . . 1 . . . . . 17 GLN CB . 51056 1 80 . 1 . 1 18 18 GLN N N 15 121.617 . . 1 . . . . . 17 GLN N . 51056 1 81 . 1 . 1 19 19 SER H H 1 8.400 . . 1 . . . . . 18 SER H . 51056 1 82 . 1 . 1 19 19 SER C C 13 174.819 . . 1 . . . . . 18 SER C . 51056 1 83 . 1 . 1 19 19 SER CA C 13 59.794 . . 1 . . . . . 18 SER CA . 51056 1 84 . 1 . 1 19 19 SER CB C 13 63.580 . . 1 . . . . . 18 SER CB . 51056 1 85 . 1 . 1 19 19 SER N N 15 116.063 . . 1 . . . . . 18 SER N . 51056 1 86 . 1 . 1 20 20 HIS H H 1 8.151 . . 1 . . . . . 19 HIS H . 51056 1 87 . 1 . 1 20 20 HIS C C 13 175.151 . . 1 . . . . . 19 HIS C . 51056 1 88 . 1 . 1 20 20 HIS CA C 13 56.250 . . 1 . . . . . 19 HIS CA . 51056 1 89 . 1 . 1 20 20 HIS CB C 13 29.769 . . 1 . . . . . 19 HIS CB . 51056 1 90 . 1 . 1 20 20 HIS N N 15 120.163 . . 1 . . . . . 19 HIS N . 51056 1 91 . 1 . 1 21 21 LEU H H 1 7.769 . . 1 . . . . . 20 LEU H . 51056 1 92 . 1 . 1 21 21 LEU C C 13 177.111 . . 1 . . . . . 20 LEU C . 51056 1 93 . 1 . 1 21 21 LEU CA C 13 55.402 . . 1 . . . . . 20 LEU CA . 51056 1 94 . 1 . 1 21 21 LEU CB C 13 42.417 . . 1 . . . . . 20 LEU CB . 51056 1 95 . 1 . 1 21 21 LEU N N 15 122.168 . . 1 . . . . . 20 LEU N . 51056 1 96 . 1 . 1 22 22 ASP H H 1 8.526 . . 1 . . . . . 21 ASP H . 51056 1 97 . 1 . 1 22 22 ASP C C 13 176.776 . . 1 . . . . . 21 ASP C . 51056 1 98 . 1 . 1 22 22 ASP CA C 13 54.239 . . 1 . . . . . 21 ASP CA . 51056 1 99 . 1 . 1 22 22 ASP CB C 13 41.680 . . 1 . . . . . 21 ASP CB . 51056 1 100 . 1 . 1 22 22 ASP N N 15 121.052 . . 1 . . . . . 21 ASP N . 51056 1 101 . 1 . 1 23 23 SER H H 1 8.211 . . 1 . . . . . 22 SER H . 51056 1 102 . 1 . 1 23 23 SER C C 13 175.619 . . 1 . . . . . 22 SER C . 51056 1 103 . 1 . 1 23 23 SER CA C 13 59.196 . . 1 . . . . . 22 SER CA . 51056 1 104 . 1 . 1 23 23 SER CB C 13 63.492 . . 1 . . . . . 22 SER CB . 51056 1 105 . 1 . 1 23 23 SER N N 15 116.638 . . 1 . . . . . 22 SER N . 51056 1 106 . 1 . 1 24 24 SER H H 1 8.483 . . 1 . . . . . 23 SER H . 51056 1 107 . 1 . 1 24 24 SER C C 13 173.833 . . 1 . . . . . 23 SER C . 51056 1 108 . 1 . 1 24 24 SER CA C 13 60.255 . . 1 . . . . . 23 SER CA . 51056 1 109 . 1 . 1 24 24 SER CB C 13 63.738 . . 1 . . . . . 23 SER CB . 51056 1 110 . 1 . 1 24 24 SER N N 15 117.593 . . 1 . . . . . 23 SER N . 51056 1 111 . 1 . 1 25 25 ASP H H 1 8.354 . . 1 . . . . . 24 ASP H . 51056 1 112 . 1 . 1 25 25 ASP C C 13 175.605 . . 1 . . . . . 24 ASP C . 51056 1 113 . 1 . 1 25 25 ASP CA C 13 54.552 . . 1 . . . . . 24 ASP CA . 51056 1 114 . 1 . 1 25 25 ASP CB C 13 41.928 . . 1 . . . . . 24 ASP CB . 51056 1 115 . 1 . 1 25 25 ASP N N 15 118.485 . . 1 . . . . . 24 ASP N . 51056 1 116 . 1 . 1 26 26 MET H H 1 7.900 . . 1 . . . . . 25 MET H . 51056 1 117 . 1 . 1 26 26 MET C C 13 174.385 . . 1 . . . . . 25 MET C . 51056 1 118 . 1 . 1 26 26 MET CA C 13 53.748 . . 1 . . . . . 25 MET CA . 51056 1 119 . 1 . 1 26 26 MET CB C 13 36.699 . . 1 . . . . . 25 MET CB . 51056 1 120 . 1 . 1 26 26 MET N N 15 117.401 . . 1 . . . . . 25 MET N . 51056 1 121 . 1 . 1 27 27 PHE H H 1 8.646 . . 1 . . . . . 26 PHE H . 51056 1 122 . 1 . 1 27 27 PHE C C 13 171.715 . . 1 . . . . . 26 PHE C . 51056 1 123 . 1 . 1 27 27 PHE CA C 13 55.263 . . 1 . . . . . 26 PHE CA . 51056 1 124 . 1 . 1 27 27 PHE CB C 13 41.730 . . 1 . . . . . 26 PHE CB . 51056 1 125 . 1 . 1 27 27 PHE N N 15 115.905 . . 1 . . . . . 26 PHE N . 51056 1 126 . 1 . 1 28 28 ASP H H 1 7.977 . . 1 . . . . . 27 ASP H . 51056 1 127 . 1 . 1 28 28 ASP C C 13 176.924 . . 1 . . . . . 27 ASP C . 51056 1 128 . 1 . 1 28 28 ASP CA C 13 52.479 . . 1 . . . . . 27 ASP CA . 51056 1 129 . 1 . 1 28 28 ASP CB C 13 40.544 . . 1 . . . . . 27 ASP CB . 51056 1 130 . 1 . 1 28 28 ASP N N 15 121.503 . . 1 . . . . . 27 ASP N . 51056 1 131 . 1 . 1 29 29 VAL H H 1 8.206 . . 1 . . . . . 28 VAL H . 51056 1 132 . 1 . 1 29 29 VAL C C 13 176.563 . . 1 . . . . . 28 VAL C . 51056 1 133 . 1 . 1 29 29 VAL CA C 13 66.078 . . 1 . . . . . 28 VAL CA . 51056 1 134 . 1 . 1 29 29 VAL CB C 13 32.234 . . 1 . . . . . 28 VAL CB . 51056 1 135 . 1 . 1 29 29 VAL N N 15 129.240 . . 1 . . . . . 28 VAL N . 51056 1 136 . 1 . 1 30 30 ASP H H 1 7.994 . . 1 . . . . . 29 ASP H . 51056 1 137 . 1 . 1 30 30 ASP C C 13 179.364 . . 1 . . . . . 29 ASP C . 51056 1 138 . 1 . 1 30 30 ASP CA C 13 57.454 . . 1 . . . . . 29 ASP CA . 51056 1 139 . 1 . 1 30 30 ASP CB C 13 40.067 . . 1 . . . . . 29 ASP CB . 51056 1 140 . 1 . 1 30 30 ASP N N 15 120.055 . . 1 . . . . . 29 ASP N . 51056 1 141 . 1 . 1 31 31 GLU H H 1 7.942 . . 1 . . . . . 30 GLU H . 51056 1 142 . 1 . 1 31 31 GLU C C 13 177.984 . . 1 . . . . . 30 GLU C . 51056 1 143 . 1 . 1 31 31 GLU CA C 13 59.033 . . 1 . . . . . 30 GLU CA . 51056 1 144 . 1 . 1 31 31 GLU CB C 13 29.790 . . 1 . . . . . 30 GLU CB . 51056 1 145 . 1 . 1 31 31 GLU N N 15 121.419 . . 1 . . . . . 30 GLU N . 51056 1 146 . 1 . 1 32 32 LEU H H 1 7.762 . . 1 . . . . . 31 LEU H . 51056 1 147 . 1 . 1 32 32 LEU C C 13 178.925 . . 1 . . . . . 31 LEU C . 51056 1 148 . 1 . 1 32 32 LEU CA C 13 58.193 . . 1 . . . . . 31 LEU CA . 51056 1 149 . 1 . 1 32 32 LEU CB C 13 41.249 . . 1 . . . . . 31 LEU CB . 51056 1 150 . 1 . 1 32 32 LEU N N 15 120.066 . . 1 . . . . . 31 LEU N . 51056 1 151 . 1 . 1 33 33 LEU H H 1 8.439 . . 1 . . . . . 32 LEU H . 51056 1 152 . 1 . 1 33 33 LEU C C 13 179.363 . . 1 . . . . . 32 LEU C . 51056 1 153 . 1 . 1 33 33 LEU CA C 13 58.476 . . 1 . . . . . 32 LEU CA . 51056 1 154 . 1 . 1 33 33 LEU CB C 13 41.446 . . 1 . . . . . 32 LEU CB . 51056 1 155 . 1 . 1 33 33 LEU N N 15 117.307 . . 1 . . . . . 32 LEU N . 51056 1 156 . 1 . 1 34 34 ARG H H 1 7.846 . . 1 . . . . . 33 ARG H . 51056 1 157 . 1 . 1 34 34 ARG C C 13 179.382 . . 1 . . . . . 33 ARG C . 51056 1 158 . 1 . 1 34 34 ARG CA C 13 59.723 . . 1 . . . . . 33 ARG CA . 51056 1 159 . 1 . 1 34 34 ARG CB C 13 29.989 . . 1 . . . . . 33 ARG CB . 51056 1 160 . 1 . 1 34 34 ARG N N 15 119.055 . . 1 . . . . . 33 ARG N . 51056 1 161 . 1 . 1 35 35 ASP H H 1 7.970 . . 1 . . . . . 34 ASP H . 51056 1 162 . 1 . 1 35 35 ASP C C 13 178.585 . . 1 . . . . . 34 ASP C . 51056 1 163 . 1 . 1 35 35 ASP CA C 13 56.860 . . 1 . . . . . 34 ASP CA . 51056 1 164 . 1 . 1 35 35 ASP CB C 13 40.686 . . 1 . . . . . 34 ASP CB . 51056 1 165 . 1 . 1 35 35 ASP N N 15 121.085 . . 1 . . . . . 34 ASP N . 51056 1 166 . 1 . 1 36 36 LEU H H 1 8.004 . . 1 . . . . . 35 LEU H . 51056 1 167 . 1 . 1 36 36 LEU C C 13 177.733 . . 1 . . . . . 35 LEU C . 51056 1 168 . 1 . 1 36 36 LEU CA C 13 56.117 . . 1 . . . . . 35 LEU CA . 51056 1 169 . 1 . 1 36 36 LEU CB C 13 41.452 . . 1 . . . . . 35 LEU CB . 51056 1 170 . 1 . 1 36 36 LEU N N 15 117.907 . . 1 . . . . . 35 LEU N . 51056 1 171 . 1 . 1 37 37 ASN H H 1 8.095 . . 1 . . . . . 36 ASN H . 51056 1 172 . 1 . 1 37 37 ASN C C 13 176.262 . . 1 . . . . . 36 ASN C . 51056 1 173 . 1 . 1 37 37 ASN CA C 13 53.589 . . 1 . . . . . 36 ASN CA . 51056 1 174 . 1 . 1 37 37 ASN CB C 13 39.067 . . 1 . . . . . 36 ASN CB . 51056 1 175 . 1 . 1 37 37 ASN N N 15 117.605 . . 1 . . . . . 36 ASN N . 51056 1 176 . 1 . 1 38 38 GLY H H 1 8.086 . . 1 . . . . . 37 GLY H . 51056 1 177 . 1 . 1 38 38 GLY C C 13 174.016 . . 1 . . . . . 37 GLY C . 51056 1 178 . 1 . 1 38 38 GLY CA C 13 45.670 . . 1 . . . . . 37 GLY CA . 51056 1 179 . 1 . 1 38 38 GLY N N 15 109.004 . . 1 . . . . . 37 GLY N . 51056 1 180 . 1 . 1 39 39 ASP H H 1 8.293 . . 1 . . . . . 38 ASP H . 51056 1 181 . 1 . 1 39 39 ASP C C 13 176.081 . . 1 . . . . . 38 ASP C . 51056 1 182 . 1 . 1 39 39 ASP CA C 13 54.520 . . 1 . . . . . 38 ASP CA . 51056 1 183 . 1 . 1 39 39 ASP CB C 13 41.431 . . 1 . . . . . 38 ASP CB . 51056 1 184 . 1 . 1 39 39 ASP N N 15 120.299 . . 1 . . . . . 38 ASP N . 51056 1 185 . 1 . 1 40 40 ASP H H 1 8.363 . . 1 . . . . . 39 ASP H . 51056 1 186 . 1 . 1 40 40 ASP C C 13 176.302 . . 1 . . . . . 39 ASP C . 51056 1 187 . 1 . 1 40 40 ASP CA C 13 54.281 . . 1 . . . . . 39 ASP CA . 51056 1 188 . 1 . 1 40 40 ASP CB C 13 41.273 . . 1 . . . . . 39 ASP CB . 51056 1 189 . 1 . 1 40 40 ASP N N 15 120.439 . . 1 . . . . . 39 ASP N . 51056 1 190 . 1 . 1 41 41 VAL H H 1 8.016 . . 1 . . . . . 40 VAL H . 51056 1 191 . 1 . 1 41 41 VAL C C 13 175.946 . . 1 . . . . . 40 VAL C . 51056 1 192 . 1 . 1 41 41 VAL CA C 13 62.474 . . 1 . . . . . 40 VAL CA . 51056 1 193 . 1 . 1 41 41 VAL CB C 13 32.577 . . 1 . . . . . 40 VAL CB . 51056 1 194 . 1 . 1 41 41 VAL N N 15 119.943 . . 1 . . . . . 40 VAL N . 51056 1 195 . 1 . 1 42 42 PHE H H 1 8.381 . . 1 . . . . . 41 PHE H . 51056 1 196 . 1 . 1 42 42 PHE C C 13 175.362 . . 1 . . . . . 41 PHE C . 51056 1 197 . 1 . 1 42 42 PHE CA C 13 57.930 . . 1 . . . . . 41 PHE CA . 51056 1 198 . 1 . 1 42 42 PHE CB C 13 39.437 . . 1 . . . . . 41 PHE CB . 51056 1 199 . 1 . 1 42 42 PHE N N 15 124.135 . . 1 . . . . . 41 PHE N . 51056 1 200 . 1 . 1 43 43 ALA H H 1 8.196 . . 1 . . . . . 42 ALA H . 51056 1 201 . 1 . 1 43 43 ALA C C 13 176.645 . . 1 . . . . . 42 ALA C . 51056 1 202 . 1 . 1 43 43 ALA CA C 13 52.304 . . 1 . . . . . 42 ALA CA . 51056 1 203 . 1 . 1 43 43 ALA CB C 13 19.459 . . 1 . . . . . 42 ALA CB . 51056 1 204 . 1 . 1 43 43 ALA N N 15 127.682 . . 1 . . . . . 42 ALA N . 51056 1 205 . 1 . 1 44 44 GLY H H 1 7.159 . . 1 . . . . . 43 GLY H . 51056 1 206 . 1 . 1 44 44 GLY C C 13 178.891 . . 1 . . . . . 43 GLY C . 51056 1 207 . 1 . 1 44 44 GLY CA C 13 46.179 . . 1 . . . . . 43 GLY CA . 51056 1 208 . 1 . 1 44 44 GLY N N 15 113.816 . . 1 . . . . . 43 GLY N . 51056 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_chemical_shifts_2 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2 _Assigned_chem_shift_list.Entry_ID 51056 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Name '13C15N RCD1-RST + DREB2A' _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 4 '2D 1H-15N HSQC' . . . 51056 2 5 '3D HNCACB' . . . 51056 2 6 '3D HN(CO)CACB' . . . 51056 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 1 $software_1 . . 51056 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 2 . 2 3 3 THR CA C 13 62.011 . . 1 . . . . . 1 THR CA . 51056 2 2 . 2 . 2 3 3 THR CB C 13 69.835 . . 1 . . . . . 1 THR CB . 51056 2 3 . 2 . 2 4 4 THR H H 1 8.273 . . 1 . . . . . 2 THR H . 51056 2 4 . 2 . 2 4 4 THR CA C 13 61.974 . . 1 . . . . . 2 THR CA . 51056 2 5 . 2 . 2 4 4 THR CB C 13 69.866 . . 1 . . . . . 2 THR CB . 51056 2 6 . 2 . 2 4 4 THR N N 15 117.298 . . 1 . . . . . 2 THR N . 51056 2 7 . 2 . 2 5 5 ARG H H 1 8.371 . . 1 . . . . . 3 ARG H . 51056 2 8 . 2 . 2 5 5 ARG CA C 13 54.032 . . 1 . . . . . 3 ARG CA . 51056 2 9 . 2 . 2 5 5 ARG CB C 13 30.334 . . 1 . . . . . 3 ARG CB . 51056 2 10 . 2 . 2 5 5 ARG N N 15 125.204 . . 1 . . . . . 3 ARG N . 51056 2 11 . 2 . 2 6 6 PRO CA C 13 63.014 . . 1 . . . . . 4 PRO CA . 51056 2 12 . 2 . 2 6 6 PRO CB C 13 32.200 . . 1 . . . . . 4 PRO CB . 51056 2 13 . 2 . 2 7 7 LYS H H 1 8.414 . . 1 . . . . . 5 LYS H . 51056 2 14 . 2 . 2 7 7 LYS CA C 13 56.256 . . 1 . . . . . 5 LYS CA . 51056 2 15 . 2 . 2 7 7 LYS CB C 13 33.137 . . 1 . . . . . 5 LYS CB . 51056 2 16 . 2 . 2 7 7 LYS N N 15 121.858 . . 1 . . . . . 5 LYS N . 51056 2 17 . 2 . 2 8 8 SER H H 1 8.669 . . 1 . . . . . 6 SER H . 51056 2 18 . 2 . 2 8 8 SER CA C 13 56.063 . . 1 . . . . . 6 SER CA . 51056 2 19 . 2 . 2 8 8 SER CB C 13 63.661 . . 1 . . . . . 6 SER CB . 51056 2 20 . 2 . 2 8 8 SER N N 15 119.407 . . 1 . . . . . 6 SER N . 51056 2 21 . 2 . 2 9 9 PRO CA C 13 63.263 . . 1 . . . . . 7 PRO CA . 51056 2 22 . 2 . 2 9 9 PRO CB C 13 31.978 . . 1 . . . . . 7 PRO CB . 51056 2 23 . 2 . 2 10 10 TRP H H 1 7.948 . . 1 . . . . . 8 TRP H . 51056 2 24 . 2 . 2 10 10 TRP CA C 13 56.495 . . 1 . . . . . 8 TRP CA . 51056 2 25 . 2 . 2 10 10 TRP CB C 13 30.581 . . 1 . . . . . 8 TRP CB . 51056 2 26 . 2 . 2 10 10 TRP N N 15 120.909 . . 1 . . . . . 8 TRP N . 51056 2 27 . 2 . 2 11 11 MET H H 1 8.449 . . 1 . . . . . 9 MET H . 51056 2 28 . 2 . 2 11 11 MET CA C 13 52.198 . . 1 . . . . . 9 MET CA . 51056 2 29 . 2 . 2 11 11 MET CB C 13 36.467 . . 1 . . . . . 9 MET CB . 51056 2 30 . 2 . 2 11 11 MET N N 15 122.687 . . 1 . . . . . 9 MET N . 51056 2 31 . 2 . 2 12 12 PRO CA C 13 61.940 . . 1 . . . . . 10 PRO CA . 51056 2 32 . 2 . 2 12 12 PRO CB C 13 32.915 . . 1 . . . . . 10 PRO CB . 51056 2 33 . 2 . 2 13 13 PHE H H 1 9.597 . . 1 . . . . . 11 PHE H . 51056 2 34 . 2 . 2 13 13 PHE CA C 13 64.379 . . 1 . . . . . 11 PHE CA . 51056 2 35 . 2 . 2 13 13 PHE CB C 13 36.376 . . 1 . . . . . 11 PHE CB . 51056 2 36 . 2 . 2 13 13 PHE N N 15 126.508 . . 1 . . . . . 11 PHE N . 51056 2 37 . 2 . 2 14 14 PRO CA C 13 66.528 . . 1 . . . . . 12 PRO CA . 51056 2 38 . 2 . 2 14 14 PRO CB C 13 31.237 . . 1 . . . . . 12 PRO CB . 51056 2 39 . 2 . 2 15 15 THR H H 1 7.052 . . 1 . . . . . 13 THR H . 51056 2 40 . 2 . 2 15 15 THR CA C 13 66.552 . . 1 . . . . . 13 THR CA . 51056 2 41 . 2 . 2 15 15 THR CB C 13 68.638 . . 1 . . . . . 13 THR CB . 51056 2 42 . 2 . 2 15 15 THR N N 15 114.819 . . 1 . . . . . 13 THR N . 51056 2 43 . 2 . 2 16 16 LEU H H 1 7.100 . . 1 . . . . . 14 LEU H . 51056 2 44 . 2 . 2 16 16 LEU CA C 13 58.187 . . 1 . . . . . 14 LEU CA . 51056 2 45 . 2 . 2 16 16 LEU CB C 13 41.339 . . 1 . . . . . 14 LEU CB . 51056 2 46 . 2 . 2 16 16 LEU N N 15 123.511 . . 1 . . . . . 14 LEU N . 51056 2 47 . 2 . 2 17 17 PHE H H 1 8.421 . . 1 . . . . . 15 PHE H . 51056 2 48 . 2 . 2 17 17 PHE CA C 13 57.135 . . 1 . . . . . 15 PHE CA . 51056 2 49 . 2 . 2 17 17 PHE CB C 13 36.445 . . 1 . . . . . 15 PHE CB . 51056 2 50 . 2 . 2 17 17 PHE N N 15 117.132 . . 1 . . . . . 15 PHE N . 51056 2 51 . 2 . 2 18 18 ALA H H 1 7.997 . . 1 . . . . . 16 ALA H . 51056 2 52 . 2 . 2 18 18 ALA CA C 13 55.094 . . 1 . . . . . 16 ALA CA . 51056 2 53 . 2 . 2 18 18 ALA CB C 13 17.927 . . 1 . . . . . 16 ALA CB . 51056 2 54 . 2 . 2 18 18 ALA N N 15 120.278 . . 1 . . . . . 16 ALA N . 51056 2 55 . 2 . 2 19 19 ALA H H 1 7.382 . . 1 . . . . . 17 ALA H . 51056 2 56 . 2 . 2 19 19 ALA CA C 13 54.552 . . 1 . . . . . 17 ALA CA . 51056 2 57 . 2 . 2 19 19 ALA CB C 13 19.648 . . 1 . . . . . 17 ALA CB . 51056 2 58 . 2 . 2 19 19 ALA N N 15 119.301 . . 1 . . . . . 17 ALA N . 51056 2 59 . 2 . 2 20 20 ILE H H 1 8.197 . . 1 . . . . . 18 ILE H . 51056 2 60 . 2 . 2 20 20 ILE CA C 13 63.534 . . 1 . . . . . 18 ILE CA . 51056 2 61 . 2 . 2 20 20 ILE CB C 13 38.768 . . 1 . . . . . 18 ILE CB . 51056 2 62 . 2 . 2 20 20 ILE N N 15 112.948 . . 1 . . . . . 18 ILE N . 51056 2 63 . 2 . 2 21 21 SER H H 1 7.982 . . 1 . . . . . 19 SER H . 51056 2 64 . 2 . 2 21 21 SER CA C 13 62.239 . . 1 . . . . . 19 SER CA . 51056 2 65 . 2 . 2 21 21 SER CB C 13 63.059 . . 1 . . . . . 19 SER CB . 51056 2 66 . 2 . 2 21 21 SER N N 15 116.739 . . 1 . . . . . 19 SER N . 51056 2 67 . 2 . 2 22 22 HIS CA C 13 57.237 . . 1 . . . . . 20 HIS CA . 51056 2 68 . 2 . 2 22 22 HIS CB C 13 30.158 . . 1 . . . . . 20 HIS CB . 51056 2 69 . 2 . 2 23 23 LYS H H 1 8.049 . . 1 . . . . . 21 LYS H . 51056 2 70 . 2 . 2 23 23 LYS CA C 13 55.459 . . 1 . . . . . 21 LYS CA . 51056 2 71 . 2 . 2 23 23 LYS CB C 13 35.155 . . 1 . . . . . 21 LYS CB . 51056 2 72 . 2 . 2 23 23 LYS N N 15 117.591 . . 1 . . . . . 21 LYS N . 51056 2 73 . 2 . 2 24 24 VAL H H 1 7.226 . . 1 . . . . . 22 VAL H . 51056 2 74 . 2 . 2 24 24 VAL CA C 13 60.015 . . 1 . . . . . 22 VAL CA . 51056 2 75 . 2 . 2 24 24 VAL CB C 13 34.198 . . 1 . . . . . 22 VAL CB . 51056 2 76 . 2 . 2 24 24 VAL N N 15 115.538 . . 1 . . . . . 22 VAL N . 51056 2 77 . 2 . 2 25 25 ALA H H 1 8.838 . . 1 . . . . . 23 ALA H . 51056 2 78 . 2 . 2 25 25 ALA CA C 13 52.129 . . 1 . . . . . 23 ALA CA . 51056 2 79 . 2 . 2 25 25 ALA CB C 13 19.352 . . 1 . . . . . 23 ALA CB . 51056 2 80 . 2 . 2 25 25 ALA N N 15 126.477 . . 1 . . . . . 23 ALA N . 51056 2 81 . 2 . 2 26 26 GLU H H 1 9.011 . . 1 . . . . . 24 GLU H . 51056 2 82 . 2 . 2 26 26 GLU CA C 13 60.424 . . 1 . . . . . 24 GLU CA . 51056 2 83 . 2 . 2 26 26 GLU CB C 13 29.522 . . 1 . . . . . 24 GLU CB . 51056 2 84 . 2 . 2 26 26 GLU N N 15 123.263 . . 1 . . . . . 24 GLU N . 51056 2 85 . 2 . 2 27 27 ASN H H 1 8.935 . . 1 . . . . . 25 ASN H . 51056 2 86 . 2 . 2 27 27 ASN CA C 13 56.386 . . 1 . . . . . 25 ASN CA . 51056 2 87 . 2 . 2 27 27 ASN CB C 13 37.864 . . 1 . . . . . 25 ASN CB . 51056 2 88 . 2 . 2 27 27 ASN N N 15 114.950 . . 1 . . . . . 25 ASN N . 51056 2 89 . 2 . 2 28 28 ASP H H 1 7.061 . . 1 . . . . . 26 ASP H . 51056 2 90 . 2 . 2 28 28 ASP CA C 13 57.218 . . 1 . . . . . 26 ASP CA . 51056 2 91 . 2 . 2 28 28 ASP CB C 13 40.430 . . 1 . . . . . 26 ASP CB . 51056 2 92 . 2 . 2 28 28 ASP N N 15 119.720 . . 1 . . . . . 26 ASP N . 51056 2 93 . 2 . 2 29 29 MET H H 1 7.747 . . 1 . . . . . 27 MET H . 51056 2 94 . 2 . 2 29 29 MET CA C 13 56.024 . . 1 . . . . . 27 MET CA . 51056 2 95 . 2 . 2 29 29 MET CB C 13 29.826 . . 1 . . . . . 27 MET CB . 51056 2 96 . 2 . 2 29 29 MET N N 15 118.928 . . 1 . . . . . 27 MET N . 51056 2 97 . 2 . 2 30 30 LEU H H 1 7.821 . . 1 . . . . . 28 LEU H . 51056 2 98 . 2 . 2 30 30 LEU CA C 13 58.371 . . 1 . . . . . 28 LEU CA . 51056 2 99 . 2 . 2 30 30 LEU CB C 13 41.431 . . 1 . . . . . 28 LEU CB . 51056 2 100 . 2 . 2 30 30 LEU N N 15 119.312 . . 1 . . . . . 28 LEU N . 51056 2 101 . 2 . 2 31 31 LEU H H 1 7.365 . . 1 . . . . . 29 LEU H . 51056 2 102 . 2 . 2 31 31 LEU CA C 13 58.041 . . 1 . . . . . 29 LEU CA . 51056 2 103 . 2 . 2 31 31 LEU CB C 13 41.847 . . 1 . . . . . 29 LEU CB . 51056 2 104 . 2 . 2 31 31 LEU N N 15 120.907 . . 1 . . . . . 29 LEU N . 51056 2 105 . 2 . 2 32 32 ILE H H 1 7.969 . . 1 . . . . . 30 ILE H . 51056 2 106 . 2 . 2 32 32 ILE CA C 13 65.327 . . 1 . . . . . 30 ILE CA . 51056 2 107 . 2 . 2 32 32 ILE CB C 13 38.228 . . 1 . . . . . 30 ILE CB . 51056 2 108 . 2 . 2 32 32 ILE N N 15 120.815 . . 1 . . . . . 30 ILE N . 51056 2 109 . 2 . 2 33 33 ASN H H 1 8.436 . . 1 . . . . . 31 ASN H . 51056 2 110 . 2 . 2 33 33 ASN CA C 13 56.417 . . 1 . . . . . 31 ASN CA . 51056 2 111 . 2 . 2 33 33 ASN CB C 13 38.428 . . 1 . . . . . 31 ASN CB . 51056 2 112 . 2 . 2 33 33 ASN N N 15 117.133 . . 1 . . . . . 31 ASN N . 51056 2 113 . 2 . 2 34 34 ALA H H 1 7.936 . . 1 . . . . . 32 ALA H . 51056 2 114 . 2 . 2 34 34 ALA CA C 13 55.402 . . 1 . . . . . 32 ALA CA . 51056 2 115 . 2 . 2 34 34 ALA CB C 13 17.953 . . 1 . . . . . 32 ALA CB . 51056 2 116 . 2 . 2 34 34 ALA N N 15 123.581 . . 1 . . . . . 32 ALA N . 51056 2 117 . 2 . 2 35 35 ASP H H 1 8.114 . . 1 . . . . . 33 ASP H . 51056 2 118 . 2 . 2 35 35 ASP CA C 13 57.624 . . 1 . . . . . 33 ASP CA . 51056 2 119 . 2 . 2 35 35 ASP CB C 13 39.404 . . 1 . . . . . 33 ASP CB . 51056 2 120 . 2 . 2 35 35 ASP N N 15 121.323 . . 1 . . . . . 33 ASP N . 51056 2 121 . 2 . 2 36 36 TYR H H 1 9.226 . . 1 . . . . . 34 TYR H . 51056 2 122 . 2 . 2 36 36 TYR CA C 13 60.432 . . 1 . . . . . 34 TYR CA . 51056 2 123 . 2 . 2 36 36 TYR CB C 13 37.856 . . 1 . . . . . 34 TYR CB . 51056 2 124 . 2 . 2 36 36 TYR N N 15 122.400 . . 1 . . . . . 34 TYR N . 51056 2 125 . 2 . 2 37 37 GLN H H 1 8.002 . . 1 . . . . . 35 GLN H . 51056 2 126 . 2 . 2 37 37 GLN CA C 13 58.478 . . 1 . . . . . 35 GLN CA . 51056 2 127 . 2 . 2 37 37 GLN CB C 13 27.755 . . 1 . . . . . 35 GLN CB . 51056 2 128 . 2 . 2 37 37 GLN N N 15 117.843 . . 1 . . . . . 35 GLN N . 51056 2 129 . 2 . 2 38 38 GLN H H 1 7.307 . . 1 . . . . . 36 GLN H . 51056 2 130 . 2 . 2 38 38 GLN CA C 13 59.560 . . 1 . . . . . 36 GLN CA . 51056 2 131 . 2 . 2 38 38 GLN CB C 13 28.897 . . 1 . . . . . 36 GLN CB . 51056 2 132 . 2 . 2 38 38 GLN N N 15 116.687 . . 1 . . . . . 36 GLN N . 51056 2 133 . 2 . 2 39 39 LEU H H 1 8.036 . . 1 . . . . . 37 LEU H . 51056 2 134 . 2 . 2 39 39 LEU CA C 13 58.469 . . 1 . . . . . 37 LEU CA . 51056 2 135 . 2 . 2 39 39 LEU CB C 13 41.067 . . 1 . . . . . 37 LEU CB . 51056 2 136 . 2 . 2 39 39 LEU N N 15 122.914 . . 1 . . . . . 37 LEU N . 51056 2 137 . 2 . 2 40 40 ARG H H 1 8.357 . . 1 . . . . . 38 ARG H . 51056 2 138 . 2 . 2 40 40 ARG CA C 13 59.045 . . 1 . . . . . 38 ARG CA . 51056 2 139 . 2 . 2 40 40 ARG CB C 13 28.949 . . 1 . . . . . 38 ARG CB . 51056 2 140 . 2 . 2 40 40 ARG N N 15 121.501 . . 1 . . . . . 38 ARG N . 51056 2 141 . 2 . 2 41 41 ASP H H 1 7.774 . . 1 . . . . . 39 ASP H . 51056 2 142 . 2 . 2 41 41 ASP CA C 13 54.423 . . 1 . . . . . 39 ASP CA . 51056 2 143 . 2 . 2 41 41 ASP CB C 13 40.945 . . 1 . . . . . 39 ASP CB . 51056 2 144 . 2 . 2 41 41 ASP N N 15 117.697 . . 1 . . . . . 39 ASP N . 51056 2 145 . 2 . 2 42 42 LYS H H 1 8.122 . . 1 . . . . . 40 LYS H . 51056 2 146 . 2 . 2 42 42 LYS CA C 13 57.542 . . 1 . . . . . 40 LYS CA . 51056 2 147 . 2 . 2 42 42 LYS CB C 13 28.381 . . 1 . . . . . 40 LYS CB . 51056 2 148 . 2 . 2 42 42 LYS N N 15 114.001 . . 1 . . . . . 40 LYS N . 51056 2 149 . 2 . 2 43 43 LYS H H 1 8.565 . . 1 . . . . . 41 LYS H . 51056 2 150 . 2 . 2 43 43 LYS CA C 13 55.851 . . 1 . . . . . 41 LYS CA . 51056 2 151 . 2 . 2 43 43 LYS CB C 13 33.392 . . 1 . . . . . 41 LYS CB . 51056 2 152 . 2 . 2 43 43 LYS N N 15 116.642 . . 1 . . . . . 41 LYS N . 51056 2 153 . 2 . 2 44 44 MET H H 1 7.361 . . 1 . . . . . 42 MET H . 51056 2 154 . 2 . 2 44 44 MET CA C 13 54.350 . . 1 . . . . . 42 MET CA . 51056 2 155 . 2 . 2 44 44 MET CB C 13 37.290 . . 1 . . . . . 42 MET CB . 51056 2 156 . 2 . 2 44 44 MET N N 15 117.214 . . 1 . . . . . 42 MET N . 51056 2 157 . 2 . 2 45 45 THR H H 1 8.752 . . 1 . . . . . 43 THR H . 51056 2 158 . 2 . 2 45 45 THR CA C 13 60.942 . . 1 . . . . . 43 THR CA . 51056 2 159 . 2 . 2 45 45 THR CB C 13 71.401 . . 1 . . . . . 43 THR CB . 51056 2 160 . 2 . 2 45 45 THR N N 15 113.476 . . 1 . . . . . 43 THR N . 51056 2 161 . 2 . 2 46 46 ARG H H 1 9.135 . . 1 . . . . . 44 ARG H . 51056 2 162 . 2 . 2 46 46 ARG CA C 13 60.641 . . 1 . . . . . 44 ARG CA . 51056 2 163 . 2 . 2 46 46 ARG CB C 13 29.980 . . 1 . . . . . 44 ARG CB . 51056 2 164 . 2 . 2 46 46 ARG N N 15 122.413 . . 1 . . . . . 44 ARG N . 51056 2 165 . 2 . 2 47 47 ALA H H 1 8.557 . . 1 . . . . . 45 ALA H . 51056 2 166 . 2 . 2 47 47 ALA CA C 13 55.271 . . 1 . . . . . 45 ALA CA . 51056 2 167 . 2 . 2 47 47 ALA CB C 13 18.300 . . 1 . . . . . 45 ALA CB . 51056 2 168 . 2 . 2 47 47 ALA N N 15 119.519 . . 1 . . . . . 45 ALA N . 51056 2 169 . 2 . 2 48 48 GLU H H 1 7.827 . . 1 . . . . . 46 GLU H . 51056 2 170 . 2 . 2 48 48 GLU CA C 13 58.848 . . 1 . . . . . 46 GLU CA . 51056 2 171 . 2 . 2 48 48 GLU CB C 13 29.779 . . 1 . . . . . 46 GLU CB . 51056 2 172 . 2 . 2 48 48 GLU N N 15 119.448 . . 1 . . . . . 46 GLU N . 51056 2 173 . 2 . 2 49 49 PHE H H 1 8.498 . . 1 . . . . . 47 PHE H . 51056 2 174 . 2 . 2 49 49 PHE CA C 13 62.620 . . 1 . . . . . 47 PHE CA . 51056 2 175 . 2 . 2 49 49 PHE CB C 13 39.862 . . 1 . . . . . 47 PHE CB . 51056 2 176 . 2 . 2 49 49 PHE N N 15 120.997 . . 1 . . . . . 47 PHE N . 51056 2 177 . 2 . 2 50 50 VAL H H 1 8.765 . . 1 . . . . . 48 VAL H . 51056 2 178 . 2 . 2 50 50 VAL CA C 13 67.322 . . 1 . . . . . 48 VAL CA . 51056 2 179 . 2 . 2 50 50 VAL CB C 13 31.463 . . 1 . . . . . 48 VAL CB . 51056 2 180 . 2 . 2 50 50 VAL N N 15 118.706 . . 1 . . . . . 48 VAL N . 51056 2 181 . 2 . 2 51 51 ARG H H 1 7.659 . . 1 . . . . . 49 ARG H . 51056 2 182 . 2 . 2 51 51 ARG CA C 13 60.297 . . 1 . . . . . 49 ARG CA . 51056 2 183 . 2 . 2 51 51 ARG CB C 13 29.836 . . 1 . . . . . 49 ARG CB . 51056 2 184 . 2 . 2 51 51 ARG N N 15 119.198 . . 1 . . . . . 49 ARG N . 51056 2 185 . 2 . 2 52 52 LYS H H 1 7.798 . . 1 . . . . . 50 LYS H . 51056 2 186 . 2 . 2 52 52 LYS CA C 13 59.513 . . 1 . . . . . 50 LYS CA . 51056 2 187 . 2 . 2 52 52 LYS CB C 13 31.674 . . 1 . . . . . 50 LYS CB . 51056 2 188 . 2 . 2 52 52 LYS N N 15 119.062 . . 1 . . . . . 50 LYS N . 51056 2 189 . 2 . 2 53 53 LEU H H 1 8.384 . . 1 . . . . . 51 LEU H . 51056 2 190 . 2 . 2 53 53 LEU CA C 13 57.982 . . 1 . . . . . 51 LEU CA . 51056 2 191 . 2 . 2 53 53 LEU CB C 13 42.200 . . 1 . . . . . 51 LEU CB . 51056 2 192 . 2 . 2 53 53 LEU N N 15 121.578 . . 1 . . . . . 51 LEU N . 51056 2 193 . 2 . 2 54 54 ARG H H 1 8.173 . . 1 . . . . . 52 ARG H . 51056 2 194 . 2 . 2 54 54 ARG CA C 13 60.286 . . 1 . . . . . 52 ARG CA . 51056 2 195 . 2 . 2 54 54 ARG CB C 13 31.102 . . 1 . . . . . 52 ARG CB . 51056 2 196 . 2 . 2 54 54 ARG N N 15 117.161 . . 1 . . . . . 52 ARG N . 51056 2 197 . 2 . 2 55 55 VAL H H 1 7.551 . . 1 . . . . . 53 VAL H . 51056 2 198 . 2 . 2 55 55 VAL CA C 13 66.258 . . 1 . . . . . 53 VAL CA . 51056 2 199 . 2 . 2 55 55 VAL CB C 13 31.855 . . 1 . . . . . 53 VAL CB . 51056 2 200 . 2 . 2 55 55 VAL N N 15 119.152 . . 1 . . . . . 53 VAL N . 51056 2 201 . 2 . 2 56 56 ILE H H 1 7.813 . . 1 . . . . . 54 ILE H . 51056 2 202 . 2 . 2 56 56 ILE CA C 13 65.005 . . 1 . . . . . 54 ILE CA . 51056 2 203 . 2 . 2 56 56 ILE CB C 13 39.200 . . 1 . . . . . 54 ILE CB . 51056 2 204 . 2 . 2 56 56 ILE N N 15 118.908 . . 1 . . . . . 54 ILE N . 51056 2 205 . 2 . 2 57 57 VAL H H 1 8.391 . . 1 . . . . . 55 VAL H . 51056 2 206 . 2 . 2 57 57 VAL CA C 13 64.137 . . 1 . . . . . 55 VAL CA . 51056 2 207 . 2 . 2 57 57 VAL CB C 13 32.920 . . 1 . . . . . 55 VAL CB . 51056 2 208 . 2 . 2 57 57 VAL N N 15 114.698 . . 1 . . . . . 55 VAL N . 51056 2 209 . 2 . 2 58 58 GLY H H 1 7.521 . . 1 . . . . . 56 GLY H . 51056 2 210 . 2 . 2 58 58 GLY CA C 13 44.329 . . 1 . . . . . 56 GLY CA . 51056 2 211 . 2 . 2 58 58 GLY N N 15 109.070 . . 1 . . . . . 56 GLY N . 51056 2 212 . 2 . 2 59 59 ASP H H 1 8.277 . . 1 . . . . . 57 ASP H . 51056 2 213 . 2 . 2 59 59 ASP CA C 13 57.878 . . 1 . . . . . 57 ASP CA . 51056 2 214 . 2 . 2 59 59 ASP CB C 13 40.454 . . 1 . . . . . 57 ASP CB . 51056 2 215 . 2 . 2 59 59 ASP N N 15 122.938 . . 1 . . . . . 57 ASP N . 51056 2 216 . 2 . 2 60 60 ASP H H 1 8.430 . . 1 . . . . . 58 ASP H . 51056 2 217 . 2 . 2 60 60 ASP CA C 13 57.803 . . 1 . . . . . 58 ASP CA . 51056 2 218 . 2 . 2 60 60 ASP CB C 13 40.288 . . 1 . . . . . 58 ASP CB . 51056 2 219 . 2 . 2 60 60 ASP N N 15 118.409 . . 1 . . . . . 58 ASP N . 51056 2 220 . 2 . 2 61 61 LEU H H 1 8.453 . . 1 . . . . . 59 LEU H . 51056 2 221 . 2 . 2 61 61 LEU CA C 13 57.224 . . 1 . . . . . 59 LEU CA . 51056 2 222 . 2 . 2 61 61 LEU CB C 13 40.928 . . 1 . . . . . 59 LEU CB . 51056 2 223 . 2 . 2 61 61 LEU N N 15 121.971 . . 1 . . . . . 59 LEU N . 51056 2 224 . 2 . 2 62 62 LEU H H 1 7.980 . . 1 . . . . . 60 LEU H . 51056 2 225 . 2 . 2 62 62 LEU CA C 13 58.723 . . 1 . . . . . 60 LEU CA . 51056 2 226 . 2 . 2 62 62 LEU CB C 13 42.163 . . 1 . . . . . 60 LEU CB . 51056 2 227 . 2 . 2 62 62 LEU N N 15 122.226 . . 1 . . . . . 60 LEU N . 51056 2 228 . 2 . 2 63 63 ARG H H 1 8.777 . . 1 . . . . . 61 ARG H . 51056 2 229 . 2 . 2 63 63 ARG CA C 13 60.637 . . 1 . . . . . 61 ARG CA . 51056 2 230 . 2 . 2 63 63 ARG CB C 13 30.468 . . 1 . . . . . 61 ARG CB . 51056 2 231 . 2 . 2 63 63 ARG N N 15 119.095 . . 1 . . . . . 61 ARG N . 51056 2 232 . 2 . 2 64 64 SER H H 1 8.485 . . 1 . . . . . 62 SER H . 51056 2 233 . 2 . 2 64 64 SER CA C 13 61.497 . . 1 . . . . . 62 SER CA . 51056 2 234 . 2 . 2 64 64 SER CB C 13 62.593 . . 1 . . . . . 62 SER CB . 51056 2 235 . 2 . 2 64 64 SER N N 15 114.920 . . 1 . . . . . 62 SER N . 51056 2 236 . 2 . 2 65 65 THR H H 1 8.164 . . 1 . . . . . 63 THR H . 51056 2 237 . 2 . 2 65 65 THR CA C 13 67.430 . . 1 . . . . . 63 THR CA . 51056 2 238 . 2 . 2 65 65 THR CB C 13 68.391 . . 1 . . . . . 63 THR CB . 51056 2 239 . 2 . 2 65 65 THR N N 15 119.194 . . 1 . . . . . 63 THR N . 51056 2 240 . 2 . 2 66 66 ILE H H 1 8.409 . . 1 . . . . . 64 ILE H . 51056 2 241 . 2 . 2 66 66 ILE CA C 13 66.193 . . 1 . . . . . 64 ILE CA . 51056 2 242 . 2 . 2 66 66 ILE CB C 13 37.586 . . 1 . . . . . 64 ILE CB . 51056 2 243 . 2 . 2 66 66 ILE N N 15 120.914 . . 1 . . . . . 64 ILE N . 51056 2 244 . 2 . 2 67 67 THR H H 1 8.093 . . 1 . . . . . 65 THR H . 51056 2 245 . 2 . 2 67 67 THR CA C 13 66.872 . . 1 . . . . . 65 THR CA . 51056 2 246 . 2 . 2 67 67 THR CB C 13 68.682 . . 1 . . . . . 65 THR CB . 51056 2 247 . 2 . 2 67 67 THR N N 15 113.884 . . 1 . . . . . 65 THR N . 51056 2 248 . 2 . 2 68 68 THR H H 1 7.831 . . 1 . . . . . 66 THR H . 51056 2 249 . 2 . 2 68 68 THR CA C 13 66.576 . . 1 . . . . . 66 THR CA . 51056 2 250 . 2 . 2 68 68 THR CB C 13 68.868 . . 1 . . . . . 66 THR CB . 51056 2 251 . 2 . 2 68 68 THR N N 15 117.753 . . 1 . . . . . 66 THR N . 51056 2 252 . 2 . 2 69 69 LEU H H 1 7.972 . . 1 . . . . . 67 LEU H . 51056 2 253 . 2 . 2 69 69 LEU CA C 13 57.600 . . 1 . . . . . 67 LEU CA . 51056 2 254 . 2 . 2 69 69 LEU CB C 13 42.571 . . 1 . . . . . 67 LEU CB . 51056 2 255 . 2 . 2 69 69 LEU N N 15 121.768 . . 1 . . . . . 67 LEU N . 51056 2 256 . 2 . 2 70 70 GLN H H 1 8.154 . . 1 . . . . . 68 GLN H . 51056 2 257 . 2 . 2 70 70 GLN CA C 13 57.575 . . 1 . . . . . 68 GLN CA . 51056 2 258 . 2 . 2 70 70 GLN CB C 13 29.788 . . 1 . . . . . 68 GLN CB . 51056 2 259 . 2 . 2 70 70 GLN N N 15 116.888 . . 1 . . . . . 68 GLN N . 51056 2 260 . 2 . 2 71 71 ASN H H 1 7.705 . . 1 . . . . . 69 ASN H . 51056 2 261 . 2 . 2 71 71 ASN CA C 13 53.253 . . 1 . . . . . 69 ASN CA . 51056 2 262 . 2 . 2 71 71 ASN CB C 13 39.253 . . 1 . . . . . 69 ASN CB . 51056 2 263 . 2 . 2 71 71 ASN N N 15 116.866 . . 1 . . . . . 69 ASN N . 51056 2 264 . 2 . 2 72 72 GLN H H 1 7.861 . . 1 . . . . . 70 GLN H . 51056 2 265 . 2 . 2 72 72 GLN CA C 13 54.261 . . 1 . . . . . 70 GLN CA . 51056 2 266 . 2 . 2 72 72 GLN CB C 13 28.771 . . 1 . . . . . 70 GLN CB . 51056 2 267 . 2 . 2 72 72 GLN N N 15 121.274 . . 1 . . . . . 70 GLN N . 51056 2 268 . 2 . 2 73 73 PRO CA C 13 63.294 . . 1 . . . . . 71 PRO CA . 51056 2 269 . 2 . 2 73 73 PRO CB C 13 32.150 . . 1 . . . . . 71 PRO CB . 51056 2 270 . 2 . 2 74 74 LYS H H 1 8.489 . . 1 . . . . . 72 LYS H . 51056 2 271 . 2 . 2 74 74 LYS CA C 13 56.255 . . 1 . . . . . 72 LYS CA . 51056 2 272 . 2 . 2 74 74 LYS CB C 13 33.141 . . 1 . . . . . 72 LYS CB . 51056 2 273 . 2 . 2 74 74 LYS N N 15 122.269 . . 1 . . . . . 72 LYS N . 51056 2 274 . 2 . 2 75 75 SER H H 1 7.992 . . 1 . . . . . 73 SER H . 51056 2 275 . 2 . 2 75 75 SER CA C 13 59.966 . . 1 . . . . . 73 SER CA . 51056 2 276 . 2 . 2 75 75 SER CB C 13 64.892 . . 1 . . . . . 73 SER CB . 51056 2 277 . 2 . 2 75 75 SER N N 15 122.817 . . 1 . . . . . 73 SER N . 51056 2 stop_ save_