################################### # 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_yCc_ox_high_salt _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode yCc_ox_high_salt _Assigned_chem_shift_list.Entry_ID 17845 _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 '2D 1H-15N HSQC' . . . 17845 1 2 '3D HNCACB' . . . 17845 1 3 '3D CBCA(CO)NH' . . . 17845 1 4 '3D HNCO' . . . 17845 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 ALA CA C 13 51.81 0.4 . 1 . . . . -5 ALA CA . 17845 1 2 . 1 1 1 1 ALA CB C 13 19.39 0.4 . 1 . . . . -5 ALA CB . 17845 1 3 . 1 1 2 2 GLU H H 1 8.63 0.04 . 1 . . . . -4 GLU H . 17845 1 4 . 1 1 2 2 GLU C C 13 175.47 0.4 . 1 . . . . -4 GLU C . 17845 1 5 . 1 1 2 2 GLU CA C 13 55.98 0.4 . 1 . . . . -4 GLU CA . 17845 1 6 . 1 1 2 2 GLU CB C 13 30.77 0.4 . 1 . . . . -4 GLU CB . 17845 1 7 . 1 1 2 2 GLU N N 15 120.35 0.2 . 1 . . . . -4 GLU N . 17845 1 8 . 1 1 3 3 PHE H H 1 8.65 0.04 . 1 . . . . -3 PHE H . 17845 1 9 . 1 1 3 3 PHE C C 13 174.43 0.4 . 1 . . . . -3 PHE C . 17845 1 10 . 1 1 3 3 PHE CA C 13 58.71 0.4 . 1 . . . . -3 PHE CA . 17845 1 11 . 1 1 3 3 PHE CB C 13 39.64 0.4 . 1 . . . . -3 PHE CB . 17845 1 12 . 1 1 3 3 PHE N N 15 124.46 0.2 . 1 . . . . -3 PHE N . 17845 1 13 . 1 1 4 4 LYS H H 1 6.44 0.04 . 1 . . . . -2 LYS H . 17845 1 14 . 1 1 4 4 LYS C C 13 173.00 0.4 . 1 . . . . -2 LYS C . 17845 1 15 . 1 1 4 4 LYS CA C 13 54.43 0.4 . 1 . . . . -2 LYS CA . 17845 1 16 . 1 1 4 4 LYS CB C 13 34.64 0.4 . 1 . . . . -2 LYS CB . 17845 1 17 . 1 1 4 4 LYS N N 15 127.60 0.2 . 1 . . . . -2 LYS N . 17845 1 18 . 1 1 5 5 ALA H H 1 7.66 0.04 . 1 . . . . -1 ALA H . 17845 1 19 . 1 1 5 5 ALA C C 13 178.30 0.4 . 1 . . . . -1 ALA C . 17845 1 20 . 1 1 5 5 ALA CA C 13 53.29 0.4 . 1 . . . . -1 ALA CA . 17845 1 21 . 1 1 5 5 ALA CB C 13 18.54 0.4 . 1 . . . . -1 ALA CB . 17845 1 22 . 1 1 5 5 ALA N N 15 122.69 0.2 . 1 . . . . -1 ALA N . 17845 1 23 . 1 1 6 6 GLY H H 1 8.10 0.04 . 1 . . . . 1 GLY H . 17845 1 24 . 1 1 6 6 GLY C C 13 173.00 0.4 . 1 . . . . 1 GLY C . 17845 1 25 . 1 1 6 6 GLY CA C 13 43.68 0.4 . 1 . . . . 1 GLY CA . 17845 1 26 . 1 1 6 6 GLY N N 15 110.81 0.2 . 1 . . . . 1 GLY N . 17845 1 27 . 1 1 7 7 SER H H 1 9.40 0.04 . 1 . . . . 2 SER H . 17845 1 28 . 1 1 7 7 SER C C 13 175.34 0.4 . 1 . . . . 2 SER C . 17845 1 29 . 1 1 7 7 SER CA C 13 55.37 0.4 . 1 . . . . 2 SER CA . 17845 1 30 . 1 1 7 7 SER CB C 13 63.05 0.4 . 1 . . . . 2 SER CB . 17845 1 31 . 1 1 7 7 SER N N 15 120.01 0.2 . 1 . . . . 2 SER N . 17845 1 32 . 1 1 8 8 ALA H H 1 9.23 0.04 . 1 . . . . 3 ALA H . 17845 1 33 . 1 1 8 8 ALA C C 13 179.50 0.4 . 1 . . . . 3 ALA C . 17845 1 34 . 1 1 8 8 ALA CA C 13 55.24 0.4 . 1 . . . . 3 ALA CA . 17845 1 35 . 1 1 8 8 ALA CB C 13 18.05 0.4 . 1 . . . . 3 ALA CB . 17845 1 36 . 1 1 8 8 ALA N N 15 131.91 0.2 . 1 . . . . 3 ALA N . 17845 1 37 . 1 1 9 9 LYS H H 1 8.15 0.04 . 1 . . . . 4 LYS H . 17845 1 38 . 1 1 9 9 LYS C C 13 179.21 0.4 . 1 . . . . 4 LYS C . 17845 1 39 . 1 1 9 9 LYS CA C 13 59.62 0.4 . 1 . . . . 4 LYS CA . 17845 1 40 . 1 1 9 9 LYS CB C 13 32.46 0.4 . 1 . . . . 4 LYS CB . 17845 1 41 . 1 1 9 9 LYS N N 15 119.15 0.2 . 1 . . . . 4 LYS N . 17845 1 42 . 1 1 10 10 LYS H H 1 7.69 0.04 . 1 . . . . 5 LYS H . 17845 1 43 . 1 1 10 10 LYS C C 13 180.49 0.4 . 1 . . . . 5 LYS C . 17845 1 44 . 1 1 10 10 LYS CA C 13 58.25 0.4 . 1 . . . . 5 LYS CA . 17845 1 45 . 1 1 10 10 LYS CB C 13 32.13 0.4 . 1 . . . . 5 LYS CB . 17845 1 46 . 1 1 10 10 LYS N N 15 120.08 0.2 . 1 . . . . 5 LYS N . 17845 1 47 . 1 1 11 11 GLY H H 1 8.66 0.04 . 1 . . . . 6 GLY H . 17845 1 48 . 1 1 11 11 GLY C C 13 174.14 0.4 . 1 . . . . 6 GLY C . 17845 1 49 . 1 1 11 11 GLY CA C 13 46.97 0.4 . 1 . . . . 6 GLY CA . 17845 1 50 . 1 1 11 11 GLY N N 15 107.67 0.2 . 1 . . . . 6 GLY N . 17845 1 51 . 1 1 12 12 ALA H H 1 8.00 0.04 . 1 . . . . 7 ALA H . 17845 1 52 . 1 1 12 12 ALA C C 13 180.52 0.4 . 1 . . . . 7 ALA C . 17845 1 53 . 1 1 12 12 ALA CA C 13 54.74 0.4 . 1 . . . . 7 ALA CA . 17845 1 54 . 1 1 12 12 ALA CB C 13 18.57 0.4 . 1 . . . . 7 ALA CB . 17845 1 55 . 1 1 12 12 ALA N N 15 125.21 0.2 . 1 . . . . 7 ALA N . 17845 1 56 . 1 1 13 13 THR H H 1 7.21 0.04 . 1 . . . . 8 THR H . 17845 1 57 . 1 1 13 13 THR C C 13 177.19 0.4 . 1 . . . . 8 THR C . 17845 1 58 . 1 1 13 13 THR CA C 13 66.30 0.4 . 1 . . . . 8 THR CA . 17845 1 59 . 1 1 13 13 THR CB C 13 68.47 0.4 . 1 . . . . 8 THR CB . 17845 1 60 . 1 1 13 13 THR N N 15 115.81 0.2 . 1 . . . . 8 THR N . 17845 1 61 . 1 1 14 14 LEU H H 1 7.83 0.04 . 1 . . . . 9 LEU H . 17845 1 62 . 1 1 14 14 LEU CA C 13 57.93 0.4 . 1 . . . . 9 LEU CA . 17845 1 63 . 1 1 14 14 LEU CB C 13 42.87 0.4 . 1 . . . . 9 LEU CB . 17845 1 64 . 1 1 14 14 LEU N N 15 123.71 0.2 . 1 . . . . 9 LEU N . 17845 1 65 . 1 1 15 15 PHE H H 1 8.61 0.04 . 1 . . . . 10 PHE H . 17845 1 66 . 1 1 15 15 PHE C C 13 178.56 0.4 . 1 . . . . 10 PHE C . 17845 1 67 . 1 1 15 15 PHE CA C 13 62.82 0.4 . 1 . . . . 10 PHE CA . 17845 1 68 . 1 1 15 15 PHE CB C 13 40.01 0.4 . 1 . . . . 10 PHE CB . 17845 1 69 . 1 1 15 15 PHE N N 15 120.42 0.2 . 1 . . . . 10 PHE N . 17845 1 70 . 1 1 16 16 LYS H H 1 8.44 0.04 . 1 . . . . 11 LYS H . 17845 1 71 . 1 1 16 16 LYS C C 13 177.82 0.4 . 1 . . . . 11 LYS C . 17845 1 72 . 1 1 16 16 LYS CA C 13 60.07 0.4 . 1 . . . . 11 LYS CA . 17845 1 73 . 1 1 16 16 LYS CB C 13 32.77 0.4 . 1 . . . . 11 LYS CB . 17845 1 74 . 1 1 16 16 LYS N N 15 120.79 0.2 . 1 . . . . 11 LYS N . 17845 1 75 . 1 1 17 17 THR H H 1 7.88 0.04 . 1 . . . . 12 THR H . 17845 1 76 . 1 1 17 17 THR C C 13 176.73 0.4 . 1 . . . . 12 THR C . 17845 1 77 . 1 1 17 17 THR CA C 13 63.84 0.4 . 1 . . . . 12 THR CA . 17845 1 78 . 1 1 17 17 THR CB C 13 70.44 0.4 . 1 . . . . 12 THR CB . 17845 1 79 . 1 1 17 17 THR N N 15 107.61 0.2 . 1 . . . . 12 THR N . 17845 1 80 . 1 1 18 18 ARG H H 1 8.19 0.04 . 1 . . . . 13 ARG H . 17845 1 81 . 1 1 18 18 ARG C C 13 176.77 0.4 . 1 . . . . 13 ARG C . 17845 1 82 . 1 1 18 18 ARG CA C 13 55.16 0.4 . 1 . . . . 13 ARG CA . 17845 1 83 . 1 1 18 18 ARG CB C 13 31.20 0.4 . 1 . . . . 13 ARG CB . 17845 1 84 . 1 1 18 18 ARG N N 15 116.04 0.2 . 1 . . . . 13 ARG N . 17845 1 85 . 1 1 19 19 CYS H H 1 7.89 0.04 . 1 . . . . 14 CYS H . 17845 1 86 . 1 1 19 19 CYS C C 13 177.72 0.4 . 1 . . . . 14 CYS C . 17845 1 87 . 1 1 19 19 CYS CA C 13 55.17 0.4 . 1 . . . . 14 CYS CA . 17845 1 88 . 1 1 19 19 CYS CB C 13 37.53 0.4 . 1 . . . . 14 CYS CB . 17845 1 89 . 1 1 19 19 CYS N N 15 114.61 0.2 . 1 . . . . 14 CYS N . 17845 1 90 . 1 1 20 20 LEU H H 1 8.02 0.04 . 1 . . . . 15 LEU H . 17845 1 91 . 1 1 20 20 LEU C C 13 177.38 0.4 . 1 . . . . 15 LEU C . 17845 1 92 . 1 1 20 20 LEU CA C 13 57.98 0.4 . 1 . . . . 15 LEU CA . 17845 1 93 . 1 1 20 20 LEU CB C 13 44.00 0.4 . 1 . . . . 15 LEU CB . 17845 1 94 . 1 1 20 20 LEU N N 15 123.46 0.2 . 1 . . . . 15 LEU N . 17845 1 95 . 1 1 21 21 GLN H H 1 9.98 0.04 . 1 . . . . 16 GLN H . 17845 1 96 . 1 1 21 21 GLN HE21 H 1 6.88 0.04 . 2 . . . . 16 GLN HE21 . 17845 1 97 . 1 1 21 21 GLN HE22 H 1 7.59 0.04 . 2 . . . . 16 GLN HE22 . 17845 1 98 . 1 1 21 21 GLN C C 13 177.67 0.4 . 1 . . . . 16 GLN C . 17845 1 99 . 1 1 21 21 GLN CA C 13 59.34 0.4 . 1 . . . . 16 GLN CA . 17845 1 100 . 1 1 21 21 GLN CB C 13 28.85 0.4 . 1 . . . . 16 GLN CB . 17845 1 101 . 1 1 21 21 GLN CG C 13 33.96 0.4 . 1 . . . . 16 GLN CG . 17845 1 102 . 1 1 21 21 GLN CD C 13 180.39 0.4 . 1 . . . . 16 GLN CD . 17845 1 103 . 1 1 21 21 GLN N N 15 117.87 0.2 . 1 . . . . 16 GLN N . 17845 1 104 . 1 1 21 21 GLN NE2 N 15 111.24 0.2 . 1 . . . . 16 GLN NE2 . 17845 1 105 . 1 1 22 22 CYS H H 1 9.73 0.04 . 1 . . . . 17 CYS H . 17845 1 106 . 1 1 22 22 CYS C C 13 176.20 0.4 . 1 . . . . 17 CYS C . 17845 1 107 . 1 1 22 22 CYS CA C 13 58.20 0.4 . 1 . . . . 17 CYS CA . 17845 1 108 . 1 1 22 22 CYS CB C 13 36.84 0.4 . 1 . . . . 17 CYS CB . 17845 1 109 . 1 1 22 22 CYS N N 15 113.77 0.2 . 1 . . . . 17 CYS N . 17845 1 110 . 1 1 23 23 HIS H H 1 11.00 0.04 . 1 . . . . 18 HIS H . 17845 1 111 . 1 1 23 23 HIS C C 13 175.82 0.4 . 1 . . . . 18 HIS C . 17845 1 112 . 1 1 23 23 HIS CA C 13 77.06 0.4 . 1 . . . . 18 HIS CA . 17845 1 113 . 1 1 23 23 HIS CB C 13 26.79 0.4 . 1 . . . . 18 HIS CB . 17845 1 114 . 1 1 23 23 HIS N N 15 119.95 0.2 . 1 . . . . 18 HIS N . 17845 1 115 . 1 1 24 24 THR H H 1 10.11 0.04 . 1 . . . . 19 THR H . 17845 1 116 . 1 1 24 24 THR C C 13 176.66 0.4 . 1 . . . . 19 THR C . 17845 1 117 . 1 1 24 24 THR CA C 13 60.85 0.4 . 1 . . . . 19 THR CA . 17845 1 118 . 1 1 24 24 THR CB C 13 72.91 0.4 . 1 . . . . 19 THR CB . 17845 1 119 . 1 1 24 24 THR N N 15 110.55 0.2 . 1 . . . . 19 THR N . 17845 1 120 . 1 1 25 25 VAL H H 1 8.55 0.04 . 1 . . . . 20 VAL H . 17845 1 121 . 1 1 25 25 VAL C C 13 174.94 0.4 . 1 . . . . 20 VAL C . 17845 1 122 . 1 1 25 25 VAL CA C 13 62.36 0.4 . 1 . . . . 20 VAL CA . 17845 1 123 . 1 1 25 25 VAL CB C 13 34.26 0.4 . 1 . . . . 20 VAL CB . 17845 1 124 . 1 1 25 25 VAL N N 15 110.16 0.2 . 1 . . . . 20 VAL N . 17845 1 125 . 1 1 26 26 GLU H H 1 9.55 0.04 . 1 . . . . 21 GLU H . 17845 1 126 . 1 1 26 26 GLU C C 13 178.17 0.4 . 1 . . . . 21 GLU C . 17845 1 127 . 1 1 26 26 GLU CA C 13 57.63 0.4 . 1 . . . . 21 GLU CA . 17845 1 128 . 1 1 26 26 GLU CB C 13 30.10 0.4 . 1 . . . . 21 GLU CB . 17845 1 129 . 1 1 26 26 GLU N N 15 120.87 0.2 . 1 . . . . 21 GLU N . 17845 1 130 . 1 1 27 27 LYS H H 1 8.97 0.04 . 1 . . . . 22 LYS H . 17845 1 131 . 1 1 27 27 LYS C C 13 177.81 0.4 . 1 . . . . 22 LYS C . 17845 1 132 . 1 1 27 27 LYS CA C 13 58.50 0.4 . 1 . . . . 22 LYS CA . 17845 1 133 . 1 1 27 27 LYS CB C 13 31.70 0.4 . 1 . . . . 22 LYS CB . 17845 1 134 . 1 1 27 27 LYS N N 15 125.87 0.2 . 1 . . . . 22 LYS N . 17845 1 135 . 1 1 28 28 GLY H H 1 9.49 0.04 . 1 . . . . 23 GLY H . 17845 1 136 . 1 1 28 28 GLY C C 13 174.79 0.4 . 1 . . . . 23 GLY C . 17845 1 137 . 1 1 28 28 GLY CA C 13 45.41 0.4 . 1 . . . . 23 GLY CA . 17845 1 138 . 1 1 28 28 GLY N N 15 118.30 0.2 . 1 . . . . 23 GLY N . 17845 1 139 . 1 1 29 29 GLY H H 1 8.23 0.04 . 1 . . . . 24 GLY H . 17845 1 140 . 1 1 29 29 GLY CA C 13 44.46 0.4 . 1 . . . . 24 GLY CA . 17845 1 141 . 1 1 29 29 GLY N N 15 108.59 0.2 . 1 . . . . 24 GLY N . 17845 1 142 . 1 1 30 30 PRO CA C 13 62.55 0.4 . 1 . . . . 25 PRO CA . 17845 1 143 . 1 1 30 30 PRO CB C 13 32.08 0.4 . 1 . . . . 25 PRO CB . 17845 1 144 . 1 1 31 31 HIS H H 1 8.75 0.04 . 1 . . . . 26 HIS H . 17845 1 145 . 1 1 31 31 HIS C C 13 175.72 0.4 . 1 . . . . 26 HIS C . 17845 1 146 . 1 1 31 31 HIS CA C 13 56.16 0.4 . 1 . . . . 26 HIS CA . 17845 1 147 . 1 1 31 31 HIS CB C 13 30.88 0.4 . 1 . . . . 26 HIS CB . 17845 1 148 . 1 1 31 31 HIS N N 15 121.46 0.2 . 1 . . . . 26 HIS N . 17845 1 149 . 1 1 32 32 LYS H H 1 8.31 0.04 . 1 . . . . 27 LYS H . 17845 1 150 . 1 1 32 32 LYS C C 13 176.04 0.4 . 1 . . . . 27 LYS C . 17845 1 151 . 1 1 32 32 LYS CA C 13 55.82 0.4 . 1 . . . . 27 LYS CA . 17845 1 152 . 1 1 32 32 LYS CB C 13 32.70 0.4 . 1 . . . . 27 LYS CB . 17845 1 153 . 1 1 32 32 LYS N N 15 125.77 0.2 . 1 . . . . 27 LYS N . 17845 1 154 . 1 1 33 33 VAL H H 1 7.52 0.04 . 1 . . . . 28 VAL H . 17845 1 155 . 1 1 33 33 VAL C C 13 176.12 0.4 . 1 . . . . 28 VAL C . 17845 1 156 . 1 1 33 33 VAL CA C 13 65.70 0.4 . 1 . . . . 28 VAL CA . 17845 1 157 . 1 1 33 33 VAL CB C 13 32.87 0.4 . 1 . . . . 28 VAL CB . 17845 1 158 . 1 1 33 33 VAL N N 15 121.95 0.2 . 1 . . . . 28 VAL N . 17845 1 159 . 1 1 34 34 GLY H H 1 7.49 0.04 . 1 . . . . 29 GLY H . 17845 1 160 . 1 1 34 34 GLY CA C 13 37.93 0.4 . 1 . . . . 29 GLY CA . 17845 1 161 . 1 1 34 34 GLY N N 15 102.86 0.2 . 1 . . . . 29 GLY N . 17845 1 162 . 1 1 35 35 PRO C C 13 178.05 0.4 . 1 . . . . 30 PRO C . 17845 1 163 . 1 1 35 35 PRO CA C 13 60.37 0.4 . 1 . . . . 30 PRO CA . 17845 1 164 . 1 1 35 35 PRO CB C 13 29.82 0.4 . 1 . . . . 30 PRO CB . 17845 1 165 . 1 1 36 36 ASN H H 1 11.68 0.04 . 1 . . . . 31 ASN H . 17845 1 166 . 1 1 36 36 ASN HD21 H 1 8.13 0.04 . 2 . . . . 31 ASN HD21 . 17845 1 167 . 1 1 36 36 ASN HD22 H 1 8.80 0.04 . 2 . . . . 31 ASN HD22 . 17845 1 168 . 1 1 36 36 ASN C C 13 176.97 0.4 . 1 . . . . 31 ASN C . 17845 1 169 . 1 1 36 36 ASN CA C 13 56.23 0.4 . 1 . . . . 31 ASN CA . 17845 1 170 . 1 1 36 36 ASN CB C 13 41.05 0.4 . 1 . . . . 31 ASN CB . 17845 1 171 . 1 1 36 36 ASN N N 15 127.64 0.2 . 1 . . . . 31 ASN N . 17845 1 172 . 1 1 36 36 ASN ND2 N 15 116.00 0.2 . 1 . . . . 31 ASN ND2 . 17845 1 173 . 1 1 37 37 LEU H H 1 9.48 0.04 . 1 . . . . 32 LEU H . 17845 1 174 . 1 1 37 37 LEU C C 13 175.65 0.4 . 1 . . . . 32 LEU C . 17845 1 175 . 1 1 37 37 LEU CA C 13 54.33 0.4 . 1 . . . . 32 LEU CA . 17845 1 176 . 1 1 37 37 LEU CB C 13 44.21 0.4 . 1 . . . . 32 LEU CB . 17845 1 177 . 1 1 37 37 LEU N N 15 122.24 0.2 . 1 . . . . 32 LEU N . 17845 1 178 . 1 1 38 38 HIS H H 1 8.15 0.04 . 1 . . . . 33 HIS H . 17845 1 179 . 1 1 38 38 HIS C C 13 177.67 0.4 . 1 . . . . 33 HIS C . 17845 1 180 . 1 1 38 38 HIS CA C 13 60.34 0.4 . 1 . . . . 33 HIS CA . 17845 1 181 . 1 1 38 38 HIS CB C 13 28.31 0.4 . 1 . . . . 33 HIS CB . 17845 1 182 . 1 1 38 38 HIS N N 15 119.15 0.2 . 1 . . . . 33 HIS N . 17845 1 183 . 1 1 39 39 GLY H H 1 9.25 0.04 . 1 . . . . 34 GLY H . 17845 1 184 . 1 1 39 39 GLY C C 13 174.87 0.4 . 1 . . . . 34 GLY C . 17845 1 185 . 1 1 39 39 GLY CA C 13 46.20 0.4 . 1 . . . . 34 GLY CA . 17845 1 186 . 1 1 39 39 GLY N N 15 116.29 0.2 . 1 . . . . 34 GLY N . 17845 1 187 . 1 1 40 40 ILE H H 1 7.14 0.04 . 1 . . . . 35 ILE H . 17845 1 188 . 1 1 40 40 ILE C C 13 174.18 0.4 . 1 . . . . 35 ILE C . 17845 1 189 . 1 1 40 40 ILE CA C 13 61.38 0.4 . 1 . . . . 35 ILE CA . 17845 1 190 . 1 1 40 40 ILE CB C 13 37.98 0.4 . 1 . . . . 35 ILE CB . 17845 1 191 . 1 1 40 40 ILE N N 15 116.26 0.2 . 1 . . . . 35 ILE N . 17845 1 192 . 1 1 41 41 PHE H H 1 8.00 0.04 . 1 . . . . 36 PHE H . 17845 1 193 . 1 1 41 41 PHE C C 13 176.92 0.4 . 1 . . . . 36 PHE C . 17845 1 194 . 1 1 41 41 PHE CA C 13 60.83 0.4 . 1 . . . . 36 PHE CA . 17845 1 195 . 1 1 41 41 PHE CB C 13 36.63 0.4 . 1 . . . . 36 PHE CB . 17845 1 196 . 1 1 41 41 PHE N N 15 116.54 0.2 . 1 . . . . 36 PHE N . 17845 1 197 . 1 1 42 42 GLY H H 1 8.81 0.04 . 1 . . . . 37 GLY H . 17845 1 198 . 1 1 42 42 GLY C C 13 173.18 0.4 . 1 . . . . 37 GLY C . 17845 1 199 . 1 1 42 42 GLY CA C 13 44.94 0.4 . 1 . . . . 37 GLY CA . 17845 1 200 . 1 1 42 42 GLY N N 15 110.45 0.2 . 1 . . . . 37 GLY N . 17845 1 201 . 1 1 43 43 ARG H H 1 7.95 0.04 . 1 . . . . 38 ARG H . 17845 1 202 . 1 1 43 43 ARG C C 13 175.05 0.4 . 1 . . . . 38 ARG C . 17845 1 203 . 1 1 43 43 ARG CA C 13 54.70 0.4 . 1 . . . . 38 ARG CA . 17845 1 204 . 1 1 43 43 ARG CB C 13 33.18 0.4 . 1 . . . . 38 ARG CB . 17845 1 205 . 1 1 43 43 ARG N N 15 121.31 0.2 . 1 . . . . 38 ARG N . 17845 1 206 . 1 1 44 44 HIS H H 1 8.18 0.04 . 1 . . . . 39 HIS H . 17845 1 207 . 1 1 44 44 HIS C C 13 176.42 0.4 . 1 . . . . 39 HIS C . 17845 1 208 . 1 1 44 44 HIS CA C 13 56.27 0.4 . 1 . . . . 39 HIS CA . 17845 1 209 . 1 1 44 44 HIS CB C 13 29.79 0.4 . 1 . . . . 39 HIS CB . 17845 1 210 . 1 1 44 44 HIS N N 15 117.87 0.2 . 1 . . . . 39 HIS N . 17845 1 211 . 1 1 45 45 SER H H 1 8.66 0.04 . 1 . . . . 40 SER H . 17845 1 212 . 1 1 45 45 SER C C 13 175.05 0.4 . 1 . . . . 40 SER C . 17845 1 213 . 1 1 45 45 SER CA C 13 58.70 0.4 . 1 . . . . 40 SER CA . 17845 1 214 . 1 1 45 45 SER CB C 13 63.84 0.4 . 1 . . . . 40 SER CB . 17845 1 215 . 1 1 45 45 SER N N 15 116.50 0.2 . 1 . . . . 40 SER N . 17845 1 216 . 1 1 46 46 GLY H H 1 8.92 0.04 . 1 . . . . 41 GLY H . 17845 1 217 . 1 1 46 46 GLY C C 13 174.55 0.4 . 1 . . . . 41 GLY C . 17845 1 218 . 1 1 46 46 GLY CA C 13 45.34 0.4 . 1 . . . . 41 GLY CA . 17845 1 219 . 1 1 46 46 GLY N N 15 109.86 0.2 . 1 . . . . 41 GLY N . 17845 1 220 . 1 1 47 47 GLN H H 1 7.84 0.04 . 1 . . . . 42 GLN H . 17845 1 221 . 1 1 47 47 GLN HE21 H 1 6.76 0.04 . 2 . . . . 42 GLN HE21 . 17845 1 222 . 1 1 47 47 GLN HE22 H 1 7.29 0.04 . 2 . . . . 42 GLN HE22 . 17845 1 223 . 1 1 47 47 GLN C C 13 176.29 0.4 . 1 . . . . 42 GLN C . 17845 1 224 . 1 1 47 47 GLN CA C 13 54.93 0.4 . 1 . . . . 42 GLN CA . 17845 1 225 . 1 1 47 47 GLN CB C 13 30.38 0.4 . 1 . . . . 42 GLN CB . 17845 1 226 . 1 1 47 47 GLN CG C 13 33.84 0.4 . 1 . . . . 42 GLN CG . 17845 1 227 . 1 1 47 47 GLN CD C 13 180.45 0.4 . 1 . . . . 42 GLN CD . 17845 1 228 . 1 1 47 47 GLN N N 15 113.13 0.2 . 1 . . . . 42 GLN N . 17845 1 229 . 1 1 47 47 GLN NE2 N 15 112.34 0.2 . 1 . . . . 42 GLN NE2 . 17845 1 230 . 1 1 48 48 ALA H H 1 8.12 0.04 . 1 . . . . 43 ALA H . 17845 1 231 . 1 1 48 48 ALA C C 13 178.24 0.4 . 1 . . . . 43 ALA C . 17845 1 232 . 1 1 48 48 ALA CA C 13 54.00 0.4 . 1 . . . . 43 ALA CA . 17845 1 233 . 1 1 48 48 ALA CB C 13 18.84 0.4 . 1 . . . . 43 ALA CB . 17845 1 234 . 1 1 48 48 ALA N N 15 124.57 0.2 . 1 . . . . 43 ALA N . 17845 1 235 . 1 1 49 49 GLU H H 1 8.81 0.04 . 1 . . . . 44 GLU H . 17845 1 236 . 1 1 49 49 GLU C C 13 178.69 0.4 . 1 . . . . 44 GLU C . 17845 1 237 . 1 1 49 49 GLU CA C 13 57.79 0.4 . 1 . . . . 44 GLU CA . 17845 1 238 . 1 1 49 49 GLU CB C 13 29.88 0.4 . 1 . . . . 44 GLU CB . 17845 1 239 . 1 1 49 49 GLU N N 15 125.47 0.2 . 1 . . . . 44 GLU N . 17845 1 240 . 1 1 50 50 GLY H H 1 9.05 0.04 . 1 . . . . 45 GLY H . 17845 1 241 . 1 1 50 50 GLY C C 13 172.72 0.4 . 1 . . . . 45 GLY C . 17845 1 242 . 1 1 50 50 GLY CA C 13 45.80 0.4 . 1 . . . . 45 GLY CA . 17845 1 243 . 1 1 50 50 GLY N N 15 113.50 0.2 . 1 . . . . 45 GLY N . 17845 1 244 . 1 1 51 51 TYR H H 1 6.94 0.04 . 1 . . . . 46 TYR H . 17845 1 245 . 1 1 51 51 TYR C C 13 173.27 0.4 . 1 . . . . 46 TYR C . 17845 1 246 . 1 1 51 51 TYR CA C 13 57.07 0.4 . 1 . . . . 46 TYR CA . 17845 1 247 . 1 1 51 51 TYR CB C 13 38.96 0.4 . 1 . . . . 46 TYR CB . 17845 1 248 . 1 1 51 51 TYR N N 15 119.59 0.2 . 1 . . . . 46 TYR N . 17845 1 249 . 1 1 52 52 SER H H 1 6.46 0.04 . 1 . . . . 47 SER H . 17845 1 250 . 1 1 52 52 SER C C 13 171.28 0.4 . 1 . . . . 47 SER C . 17845 1 251 . 1 1 52 52 SER CA C 13 55.86 0.4 . 1 . . . . 47 SER CA . 17845 1 252 . 1 1 52 52 SER CB C 13 61.43 0.4 . 1 . . . . 47 SER CB . 17845 1 253 . 1 1 52 52 SER N N 15 122.32 0.2 . 1 . . . . 47 SER N . 17845 1 254 . 1 1 53 53 TYR H H 1 7.69 0.04 . 1 . . . . 48 TYR H . 17845 1 255 . 1 1 53 53 TYR C C 13 178.93 0.4 . 1 . . . . 48 TYR C . 17845 1 256 . 1 1 53 53 TYR CA C 13 58.27 0.4 . 1 . . . . 48 TYR CA . 17845 1 257 . 1 1 53 53 TYR CB C 13 41.64 0.4 . 1 . . . . 48 TYR CB . 17845 1 258 . 1 1 53 53 TYR N N 15 124.91 0.2 . 1 . . . . 48 TYR N . 17845 1 259 . 1 1 54 54 THR H H 1 9.62 0.04 . 1 . . . . 49 THR H . 17845 1 260 . 1 1 54 54 THR C C 13 176.02 0.4 . 1 . . . . 49 THR C . 17845 1 261 . 1 1 54 54 THR CA C 13 62.41 0.4 . 1 . . . . 49 THR CA . 17845 1 262 . 1 1 54 54 THR CB C 13 71.06 0.4 . 1 . . . . 49 THR CB . 17845 1 263 . 1 1 54 54 THR N N 15 112.32 0.2 . 1 . . . . 49 THR N . 17845 1 264 . 1 1 55 55 ASP H H 1 8.61 0.04 . 1 . . . . 50 ASP H . 17845 1 265 . 1 1 55 55 ASP C C 13 178.73 0.4 . 1 . . . . 50 ASP C . 17845 1 266 . 1 1 55 55 ASP CA C 13 57.19 0.4 . 1 . . . . 50 ASP CA . 17845 1 267 . 1 1 55 55 ASP CB C 13 40.40 0.4 . 1 . . . . 50 ASP CB . 17845 1 268 . 1 1 55 55 ASP N N 15 120.93 0.2 . 1 . . . . 50 ASP N . 17845 1 269 . 1 1 56 56 ALA H H 1 8.01 0.04 . 1 . . . . 51 ALA H . 17845 1 270 . 1 1 56 56 ALA C C 13 179.72 0.4 . 1 . . . . 51 ALA C . 17845 1 271 . 1 1 56 56 ALA CA C 13 55.46 0.4 . 1 . . . . 51 ALA CA . 17845 1 272 . 1 1 56 56 ALA CB C 13 18.85 0.4 . 1 . . . . 51 ALA CB . 17845 1 273 . 1 1 56 56 ALA N N 15 119.63 0.2 . 1 . . . . 51 ALA N . 17845 1 274 . 1 1 57 57 ASN H H 1 8.34 0.04 . 1 . . . . 52 ASN H . 17845 1 275 . 1 1 57 57 ASN HD21 H 1 7.06 0.04 . 2 . . . . 52 ASN HD21 . 17845 1 276 . 1 1 57 57 ASN HD22 H 1 7.38 0.04 . 2 . . . . 52 ASN HD22 . 17845 1 277 . 1 1 57 57 ASN C C 13 178.34 0.4 . 1 . . . . 52 ASN C . 17845 1 278 . 1 1 57 57 ASN CA C 13 56.00 0.4 . 1 . . . . 52 ASN CA . 17845 1 279 . 1 1 57 57 ASN CB C 13 40.44 0.4 . 1 . . . . 52 ASN CB . 17845 1 280 . 1 1 57 57 ASN CG C 13 174.80 0.4 . 1 . . . . 52 ASN CG . 17845 1 281 . 1 1 57 57 ASN N N 15 117.87 0.2 . 1 . . . . 52 ASN N . 17845 1 282 . 1 1 57 57 ASN ND2 N 15 109.24 0.2 . 1 . . . . 52 ASN ND2 . 17845 1 283 . 1 1 58 58 ILE H H 1 7.62 0.04 . 1 . . . . 53 ILE H . 17845 1 284 . 1 1 58 58 ILE C C 13 178.64 0.4 . 1 . . . . 53 ILE C . 17845 1 285 . 1 1 58 58 ILE CA C 13 65.25 0.4 . 1 . . . . 53 ILE CA . 17845 1 286 . 1 1 58 58 ILE CB C 13 39.29 0.4 . 1 . . . . 53 ILE CB . 17845 1 287 . 1 1 58 58 ILE N N 15 121.01 0.2 . 1 . . . . 53 ILE N . 17845 1 288 . 1 1 59 59 LYS H H 1 9.03 0.04 . 1 . . . . 54 LYS H . 17845 1 289 . 1 1 59 59 LYS C C 13 177.89 0.4 . 1 . . . . 54 LYS C . 17845 1 290 . 1 1 59 59 LYS CA C 13 57.99 0.4 . 1 . . . . 54 LYS CA . 17845 1 291 . 1 1 59 59 LYS CB C 13 32.30 0.4 . 1 . . . . 54 LYS CB . 17845 1 292 . 1 1 59 59 LYS N N 15 119.28 0.2 . 1 . . . . 54 LYS N . 17845 1 293 . 1 1 60 60 LYS H H 1 7.39 0.04 . 1 . . . . 55 LYS H . 17845 1 294 . 1 1 60 60 LYS C C 13 176.95 0.4 . 1 . . . . 55 LYS C . 17845 1 295 . 1 1 60 60 LYS CA C 13 57.16 0.4 . 1 . . . . 55 LYS CA . 17845 1 296 . 1 1 60 60 LYS CB C 13 31.57 0.4 . 1 . . . . 55 LYS CB . 17845 1 297 . 1 1 60 60 LYS N N 15 118.58 0.2 . 1 . . . . 55 LYS N . 17845 1 298 . 1 1 61 61 ASN H H 1 7.29 0.04 . 1 . . . . 56 ASN H . 17845 1 299 . 1 1 61 61 ASN HD21 H 1 6.48 0.04 . 2 . . . . 56 ASN HD21 . 17845 1 300 . 1 1 61 61 ASN HD22 H 1 7.51 0.04 . 2 . . . . 56 ASN HD22 . 17845 1 301 . 1 1 61 61 ASN C C 13 174.42 0.4 . 1 . . . . 56 ASN C . 17845 1 302 . 1 1 61 61 ASN CA C 13 53.95 0.4 . 1 . . . . 56 ASN CA . 17845 1 303 . 1 1 61 61 ASN CB C 13 37.48 0.4 . 1 . . . . 56 ASN CB . 17845 1 304 . 1 1 61 61 ASN CG C 13 177.84 0.4 . 1 . . . . 56 ASN CG . 17845 1 305 . 1 1 61 61 ASN N N 15 112.38 0.2 . 1 . . . . 56 ASN N . 17845 1 306 . 1 1 61 61 ASN ND2 N 15 109.52 0.2 . 1 . . . . 56 ASN ND2 . 17845 1 307 . 1 1 62 62 VAL H H 1 7.28 0.04 . 1 . . . . 57 VAL H . 17845 1 308 . 1 1 62 62 VAL C C 13 174.00 0.4 . 1 . . . . 57 VAL C . 17845 1 309 . 1 1 62 62 VAL CA C 13 59.72 0.4 . 1 . . . . 57 VAL CA . 17845 1 310 . 1 1 62 62 VAL CB C 13 33.63 0.4 . 1 . . . . 57 VAL CB . 17845 1 311 . 1 1 62 62 VAL N N 15 114.42 0.2 . 1 . . . . 57 VAL N . 17845 1 312 . 1 1 63 63 LEU H H 1 8.26 0.04 . 1 . . . . 58 LEU H . 17845 1 313 . 1 1 63 63 LEU C C 13 176.67 0.4 . 1 . . . . 58 LEU C . 17845 1 314 . 1 1 63 63 LEU CA C 13 53.53 0.4 . 1 . . . . 58 LEU CA . 17845 1 315 . 1 1 63 63 LEU CB C 13 41.37 0.4 . 1 . . . . 58 LEU CB . 17845 1 316 . 1 1 63 63 LEU N N 15 127.42 0.2 . 1 . . . . 58 LEU N . 17845 1 317 . 1 1 64 64 TRP H H 1 7.91 0.04 . 1 . . . . 59 TRP H . 17845 1 318 . 1 1 64 64 TRP C C 13 176.20 0.4 . 1 . . . . 59 TRP C . 17845 1 319 . 1 1 64 64 TRP CA C 13 57.99 0.4 . 1 . . . . 59 TRP CA . 17845 1 320 . 1 1 64 64 TRP CB C 13 29.80 0.4 . 1 . . . . 59 TRP CB . 17845 1 321 . 1 1 64 64 TRP N N 15 127.86 0.2 . 1 . . . . 59 TRP N . 17845 1 322 . 1 1 65 65 ASP H H 1 9.85 0.04 . 1 . . . . 60 ASP H . 17845 1 323 . 1 1 65 65 ASP C C 13 174.95 0.4 . 1 . . . . 60 ASP C . 17845 1 324 . 1 1 65 65 ASP CA C 13 52.40 0.4 . 1 . . . . 60 ASP CA . 17845 1 325 . 1 1 65 65 ASP CB C 13 42.90 0.4 . 1 . . . . 60 ASP CB . 17845 1 326 . 1 1 65 65 ASP N N 15 125.59 0.2 . 1 . . . . 60 ASP N . 17845 1 327 . 1 1 66 66 GLU H H 1 10.05 0.04 . 1 . . . . 61 GLU H . 17845 1 328 . 1 1 66 66 GLU C C 13 177.40 0.4 . 1 . . . . 61 GLU C . 17845 1 329 . 1 1 66 66 GLU CA C 13 61.60 0.4 . 1 . . . . 61 GLU CA . 17845 1 330 . 1 1 66 66 GLU CB C 13 28.92 0.4 . 1 . . . . 61 GLU CB . 17845 1 331 . 1 1 66 66 GLU N N 15 116.86 0.2 . 1 . . . . 61 GLU N . 17845 1 332 . 1 1 67 67 ASN H H 1 8.16 0.04 . 1 . . . . 62 ASN H . 17845 1 333 . 1 1 67 67 ASN HD21 H 1 7.11 0.04 . 2 . . . . 62 ASN HD21 . 17845 1 334 . 1 1 67 67 ASN HD22 H 1 7.74 0.04 . 2 . . . . 62 ASN HD22 . 17845 1 335 . 1 1 67 67 ASN C C 13 178.41 0.4 . 1 . . . . 62 ASN C . 17845 1 336 . 1 1 67 67 ASN CA C 13 56.22 0.4 . 1 . . . . 62 ASN CA . 17845 1 337 . 1 1 67 67 ASN CB C 13 38.89 0.4 . 1 . . . . 62 ASN CB . 17845 1 338 . 1 1 67 67 ASN CG C 13 176.23 0.4 . 1 . . . . 62 ASN CG . 17845 1 339 . 1 1 67 67 ASN N N 15 115.91 0.2 . 1 . . . . 62 ASN N . 17845 1 340 . 1 1 67 67 ASN ND2 N 15 113.86 0.2 . 1 . . . . 62 ASN ND2 . 17845 1 341 . 1 1 68 68 ASN H H 1 9.43 0.04 . 1 . . . . 63 ASN H . 17845 1 342 . 1 1 68 68 ASN HD21 H 1 7.00 0.04 . 2 . . . . 63 ASN HD21 . 17845 1 343 . 1 1 68 68 ASN HD22 H 1 7.38 0.04 . 2 . . . . 63 ASN HD22 . 17845 1 344 . 1 1 68 68 ASN C C 13 179.42 0.4 . 1 . . . . 63 ASN C . 17845 1 345 . 1 1 68 68 ASN CA C 13 55.96 0.4 . 1 . . . . 63 ASN CA . 17845 1 346 . 1 1 68 68 ASN CB C 13 36.63 0.4 . 1 . . . . 63 ASN CB . 17845 1 347 . 1 1 68 68 ASN CG C 13 175.88 0.4 . 1 . . . . 63 ASN CG . 17845 1 348 . 1 1 68 68 ASN N N 15 122.02 0.2 . 1 . . . . 63 ASN N . 17845 1 349 . 1 1 68 68 ASN ND2 N 15 110.33 0.2 . 1 . . . . 63 ASN ND2 . 17845 1 350 . 1 1 69 69 MET H H 1 8.74 0.04 . 1 . . . . 64 MET H . 17845 1 351 . 1 1 69 69 MET C C 13 177.93 0.4 . 1 . . . . 64 MET C . 17845 1 352 . 1 1 69 69 MET CA C 13 57.44 0.4 . 1 . . . . 64 MET CA . 17845 1 353 . 1 1 69 69 MET CB C 13 30.58 0.4 . 1 . . . . 64 MET CB . 17845 1 354 . 1 1 69 69 MET N N 15 121.46 0.2 . 1 . . . . 64 MET N . 17845 1 355 . 1 1 70 70 SER H H 1 7.48 0.04 . 1 . . . . 65 SER H . 17845 1 356 . 1 1 70 70 SER C C 13 177.42 0.4 . 1 . . . . 65 SER C . 17845 1 357 . 1 1 70 70 SER CA C 13 61.57 0.4 . 1 . . . . 65 SER CA . 17845 1 358 . 1 1 70 70 SER CB C 13 62.81 0.4 . 1 . . . . 65 SER CB . 17845 1 359 . 1 1 70 70 SER N N 15 113.93 0.2 . 1 . . . . 65 SER N . 17845 1 360 . 1 1 71 71 GLU H H 1 7.65 0.04 . 1 . . . . 66 GLU H . 17845 1 361 . 1 1 71 71 GLU C C 13 179.75 0.4 . 1 . . . . 66 GLU C . 17845 1 362 . 1 1 71 71 GLU CA C 13 60.13 0.4 . 1 . . . . 66 GLU CA . 17845 1 363 . 1 1 71 71 GLU CB C 13 29.55 0.4 . 1 . . . . 66 GLU CB . 17845 1 364 . 1 1 71 71 GLU N N 15 121.07 0.2 . 1 . . . . 66 GLU N . 17845 1 365 . 1 1 72 72 TYR H H 1 8.39 0.04 . 1 . . . . 67 TYR H . 17845 1 366 . 1 1 72 72 TYR C C 13 176.99 0.4 . 1 . . . . 67 TYR C . 17845 1 367 . 1 1 72 72 TYR CA C 13 60.85 0.4 . 1 . . . . 67 TYR CA . 17845 1 368 . 1 1 72 72 TYR CB C 13 39.30 0.4 . 1 . . . . 67 TYR CB . 17845 1 369 . 1 1 72 72 TYR N N 15 122.28 0.2 . 1 . . . . 67 TYR N . 17845 1 370 . 1 1 73 73 LEU H H 1 8.10 0.04 . 1 . . . . 68 LEU H . 17845 1 371 . 1 1 73 73 LEU C C 13 177.31 0.4 . 1 . . . . 68 LEU C . 17845 1 372 . 1 1 73 73 LEU CA C 13 55.59 0.4 . 1 . . . . 68 LEU CA . 17845 1 373 . 1 1 73 73 LEU CB C 13 41.07 0.4 . 1 . . . . 68 LEU CB . 17845 1 374 . 1 1 73 73 LEU N N 15 112.88 0.2 . 1 . . . . 68 LEU N . 17845 1 375 . 1 1 74 74 THR H H 1 7.41 0.04 . 1 . . . . 69 THR H . 17845 1 376 . 1 1 74 74 THR C C 13 174.59 0.4 . 1 . . . . 69 THR C . 17845 1 377 . 1 1 74 74 THR CA C 13 66.60 0.4 . 1 . . . . 69 THR CA . 17845 1 378 . 1 1 74 74 THR CB C 13 68.75 0.4 . 1 . . . . 69 THR CB . 17845 1 379 . 1 1 74 74 THR N N 15 116.00 0.2 . 1 . . . . 69 THR N . 17845 1 380 . 1 1 75 75 ASN H H 1 6.82 0.04 . 1 . . . . 70 ASN H . 17845 1 381 . 1 1 75 75 ASN HD21 H 1 7.10 0.04 . 2 . . . . 70 ASN HD21 . 17845 1 382 . 1 1 75 75 ASN HD22 H 1 7.95 0.04 . 2 . . . . 70 ASN HD22 . 17845 1 383 . 1 1 75 75 ASN CA C 13 52.59 0.4 . 1 . . . . 70 ASN CA . 17845 1 384 . 1 1 75 75 ASN CB C 13 37.57 0.4 . 1 . . . . 70 ASN CB . 17845 1 385 . 1 1 75 75 ASN CG C 13 177.67 0.4 . 1 . . . . 70 ASN CG . 17845 1 386 . 1 1 75 75 ASN N N 15 109.05 0.2 . 1 . . . . 70 ASN N . 17845 1 387 . 1 1 75 75 ASN ND2 N 15 111.90 0.2 . 1 . . . . 70 ASN ND2 . 17845 1 388 . 1 1 76 76 PRO C C 13 178.54 0.4 . 1 . . . . 71 PRO C . 17845 1 389 . 1 1 76 76 PRO CA C 13 68.04 0.4 . 1 . . . . 71 PRO CA . 17845 1 390 . 1 1 76 76 PRO CB C 13 34.17 0.4 . 1 . . . . 71 PRO CB . 17845 1 391 . 1 1 77 77 LYS H H 1 9.34 0.04 . 1 . . . . 72 LYS H . 17845 1 392 . 1 1 77 77 LYS C C 13 178.49 0.4 . 1 . . . . 72 LYS C . 17845 1 393 . 1 1 77 77 LYS CA C 13 59.30 0.4 . 1 . . . . 72 LYS CA . 17845 1 394 . 1 1 77 77 LYS CB C 13 32.88 0.4 . 1 . . . . 72 LYS CB . 17845 1 395 . 1 1 77 77 LYS N N 15 115.07 0.2 . 1 . . . . 72 LYS N . 17845 1 396 . 1 1 78 78 LYS H H 1 7.84 0.04 . 1 . . . . 73 LYS H . 17845 1 397 . 1 1 78 78 LYS C C 13 177.57 0.4 . 1 . . . . 73 LYS C . 17845 1 398 . 1 1 78 78 LYS CA C 13 57.93 0.4 . 1 . . . . 73 LYS CA . 17845 1 399 . 1 1 78 78 LYS CB C 13 33.78 0.4 . 1 . . . . 73 LYS CB . 17845 1 400 . 1 1 78 78 LYS N N 15 118.84 0.2 . 1 . . . . 73 LYS N . 17845 1 401 . 1 1 79 79 TYR H H 1 8.27 0.04 . 1 . . . . 74 TYR H . 17845 1 402 . 1 1 79 79 TYR C C 13 176.52 0.4 . 1 . . . . 74 TYR C . 17845 1 403 . 1 1 79 79 TYR CA C 13 62.16 0.4 . 1 . . . . 74 TYR CA . 17845 1 404 . 1 1 79 79 TYR CB C 13 40.91 0.4 . 1 . . . . 74 TYR CB . 17845 1 405 . 1 1 79 79 TYR N N 15 120.65 0.2 . 1 . . . . 74 TYR N . 17845 1 406 . 1 1 80 80 ILE H H 1 9.46 0.04 . 1 . . . . 75 ILE H . 17845 1 407 . 1 1 80 80 ILE CA C 13 59.78 0.4 . 1 . . . . 75 ILE CA . 17845 1 408 . 1 1 80 80 ILE CB C 13 38.50 0.4 . 1 . . . . 75 ILE CB . 17845 1 409 . 1 1 80 80 ILE N N 15 115.04 0.2 . 1 . . . . 75 ILE N . 17845 1 410 . 1 1 81 81 PRO C C 13 179.15 0.4 . 1 . . . . 76 PRO C . 17845 1 411 . 1 1 81 81 PRO CA C 13 64.65 0.4 . 1 . . . . 76 PRO CA . 17845 1 412 . 1 1 81 81 PRO CB C 13 31.53 0.4 . 1 . . . . 76 PRO CB . 17845 1 413 . 1 1 82 82 GLY H H 1 9.31 0.04 . 1 . . . . 77 GLY H . 17845 1 414 . 1 1 82 82 GLY C C 13 176.26 0.4 . 1 . . . . 77 GLY C . 17845 1 415 . 1 1 82 82 GLY CA C 13 44.90 0.4 . 1 . . . . 77 GLY CA . 17845 1 416 . 1 1 82 82 GLY N N 15 111.86 0.2 . 1 . . . . 77 GLY N . 17845 1 417 . 1 1 83 83 THR H H 1 9.07 0.04 . 1 . . . . 78 THR H . 17845 1 418 . 1 1 83 83 THR C C 13 173.29 0.4 . 1 . . . . 78 THR C . 17845 1 419 . 1 1 83 83 THR CA C 13 61.92 0.4 . 1 . . . . 78 THR CA . 17845 1 420 . 1 1 83 83 THR CB C 13 70.26 0.4 . 1 . . . . 78 THR CB . 17845 1 421 . 1 1 83 83 THR N N 15 115.34 0.2 . 1 . . . . 78 THR N . 17845 1 422 . 1 1 84 84 LYS H H 1 8.08 0.04 . 1 . . . . 79 LYS H . 17845 1 423 . 1 1 84 84 LYS C C 13 175.07 0.4 . 1 . . . . 79 LYS C . 17845 1 424 . 1 1 84 84 LYS CA C 13 55.17 0.4 . 1 . . . . 79 LYS CA . 17845 1 425 . 1 1 84 84 LYS CB C 13 31.99 0.4 . 1 . . . . 79 LYS CB . 17845 1 426 . 1 1 84 84 LYS N N 15 122.75 0.2 . 1 . . . . 79 LYS N . 17845 1 427 . 1 1 85 85 MET H H 1 8.81 0.04 . 1 . . . . 80 MET H . 17845 1 428 . 1 1 85 85 MET C C 13 174.27 0.4 . 1 . . . . 80 MET C . 17845 1 429 . 1 1 85 85 MET CA C 13 67.33 0.4 . 1 . . . . 80 MET CA . 17845 1 430 . 1 1 85 85 MET CB C 13 5.78 0.4 . 1 . . . . 80 MET CB . 17845 1 431 . 1 1 85 85 MET N N 15 122.78 0.2 . 1 . . . . 80 MET N . 17845 1 432 . 1 1 86 86 ALA H H 1 8.20 0.04 . 1 . . . . 81 ALA H . 17845 1 433 . 1 1 86 86 ALA C C 13 175.11 0.4 . 1 . . . . 81 ALA C . 17845 1 434 . 1 1 86 86 ALA CA C 13 51.74 0.4 . 1 . . . . 81 ALA CA . 17845 1 435 . 1 1 86 86 ALA CB C 13 17.21 0.4 . 1 . . . . 81 ALA CB . 17845 1 436 . 1 1 86 86 ALA N N 15 138.99 0.2 . 1 . . . . 81 ALA N . 17845 1 437 . 1 1 87 87 PHE H H 1 8.70 0.04 . 1 . . . . 82 PHE H . 17845 1 438 . 1 1 87 87 PHE CA C 13 58.05 0.4 . 1 . . . . 82 PHE CA . 17845 1 439 . 1 1 87 87 PHE CB C 13 42.99 0.4 . 1 . . . . 82 PHE CB . 17845 1 440 . 1 1 87 87 PHE N N 15 122.75 0.2 . 1 . . . . 82 PHE N . 17845 1 441 . 1 1 88 88 GLY C C 13 173.67 0.4 . 1 . . . . 83 GLY C . 17845 1 442 . 1 1 88 88 GLY CA C 13 46.91 0.4 . 1 . . . . 83 GLY CA . 17845 1 443 . 1 1 89 89 GLY H H 1 4.91 0.04 . 1 . . . . 84 GLY H . 17845 1 444 . 1 1 89 89 GLY C C 13 172.23 0.4 . 1 . . . . 84 GLY C . 17845 1 445 . 1 1 89 89 GLY CA C 13 43.71 0.4 . 1 . . . . 84 GLY CA . 17845 1 446 . 1 1 89 89 GLY N N 15 103.57 0.2 . 1 . . . . 84 GLY N . 17845 1 447 . 1 1 90 90 LEU H H 1 8.05 0.04 . 1 . . . . 85 LEU H . 17845 1 448 . 1 1 90 90 LEU C C 13 175.10 0.4 . 1 . . . . 85 LEU C . 17845 1 449 . 1 1 90 90 LEU CA C 13 52.74 0.4 . 1 . . . . 85 LEU CA . 17845 1 450 . 1 1 90 90 LEU CB C 13 42.71 0.4 . 1 . . . . 85 LEU CB . 17845 1 451 . 1 1 90 90 LEU N N 15 122.25 0.2 . 1 . . . . 85 LEU N . 17845 1 452 . 1 1 91 91 LYS H H 1 8.26 0.04 . 1 . . . . 86 LYS H . 17845 1 453 . 1 1 91 91 LYS CA C 13 58.19 0.4 . 1 . . . . 86 LYS CA . 17845 1 454 . 1 1 91 91 LYS CB C 13 32.74 0.4 . 1 . . . . 86 LYS CB . 17845 1 455 . 1 1 91 91 LYS N N 15 122.99 0.2 . 1 . . . . 86 LYS N . 17845 1 456 . 1 1 92 92 LYS H H 1 8.74 0.04 . 1 . . . . 87 LYS H . 17845 1 457 . 1 1 92 92 LYS C C 13 176.89 0.4 . 1 . . . . 87 LYS C . 17845 1 458 . 1 1 92 92 LYS CA C 13 55.87 0.4 . 1 . . . . 87 LYS CA . 17845 1 459 . 1 1 92 92 LYS CB C 13 32.22 0.4 . 1 . . . . 87 LYS CB . 17845 1 460 . 1 1 92 92 LYS N N 15 119.93 0.2 . 1 . . . . 87 LYS N . 17845 1 461 . 1 1 93 93 GLU H H 1 8.87 0.04 . 1 . . . . 88 GLU H . 17845 1 462 . 1 1 93 93 GLU C C 13 177.51 0.4 . 1 . . . . 88 GLU C . 17845 1 463 . 1 1 93 93 GLU CA C 13 60.15 0.4 . 1 . . . . 88 GLU CA . 17845 1 464 . 1 1 93 93 GLU CB C 13 29.68 0.4 . 1 . . . . 88 GLU CB . 17845 1 465 . 1 1 93 93 GLU N N 15 129.23 0.2 . 1 . . . . 88 GLU N . 17845 1 466 . 1 1 94 94 LYS H H 1 8.59 0.04 . 1 . . . . 89 LYS H . 17845 1 467 . 1 1 94 94 LYS C C 13 177.77 0.4 . 1 . . . . 89 LYS C . 17845 1 468 . 1 1 94 94 LYS CA C 13 59.57 0.4 . 1 . . . . 89 LYS CA . 17845 1 469 . 1 1 94 94 LYS CB C 13 32.43 0.4 . 1 . . . . 89 LYS CB . 17845 1 470 . 1 1 94 94 LYS N N 15 116.83 0.2 . 1 . . . . 89 LYS N . 17845 1 471 . 1 1 95 95 ASP H H 1 6.24 0.04 . 1 . . . . 90 ASP H . 17845 1 472 . 1 1 95 95 ASP C C 13 177.86 0.4 . 1 . . . . 90 ASP C . 17845 1 473 . 1 1 95 95 ASP CA C 13 56.72 0.4 . 1 . . . . 90 ASP CA . 17845 1 474 . 1 1 95 95 ASP CB C 13 40.05 0.4 . 1 . . . . 90 ASP CB . 17845 1 475 . 1 1 95 95 ASP N N 15 115.69 0.2 . 1 . . . . 90 ASP N . 17845 1 476 . 1 1 96 96 ARG H H 1 7.25 0.04 . 1 . . . . 91 ARG H . 17845 1 477 . 1 1 96 96 ARG C C 13 177.51 0.4 . 1 . . . . 91 ARG C . 17845 1 478 . 1 1 96 96 ARG CA C 13 61.22 0.4 . 1 . . . . 91 ARG CA . 17845 1 479 . 1 1 96 96 ARG CB C 13 30.19 0.4 . 1 . . . . 91 ARG CB . 17845 1 480 . 1 1 96 96 ARG N N 15 118.05 0.2 . 1 . . . . 91 ARG N . 17845 1 481 . 1 1 97 97 ASN H H 1 8.53 0.04 . 1 . . . . 92 ASN H . 17845 1 482 . 1 1 97 97 ASN HD21 H 1 7.10 0.04 . 2 . . . . 92 ASN HD21 . 17845 1 483 . 1 1 97 97 ASN HD22 H 1 7.13 0.04 . 2 . . . . 92 ASN HD22 . 17845 1 484 . 1 1 97 97 ASN C C 13 179.66 0.4 . 1 . . . . 92 ASN C . 17845 1 485 . 1 1 97 97 ASN CA C 13 55.93 0.4 . 1 . . . . 92 ASN CA . 17845 1 486 . 1 1 97 97 ASN CB C 13 37.02 0.4 . 1 . . . . 92 ASN CB . 17845 1 487 . 1 1 97 97 ASN CG C 13 175.59 0.4 . 1 . . . . 92 ASN CG . 17845 1 488 . 1 1 97 97 ASN N N 15 118.00 0.2 . 1 . . . . 92 ASN N . 17845 1 489 . 1 1 97 97 ASN ND2 N 15 110.46 0.2 . 1 . . . . 92 ASN ND2 . 17845 1 490 . 1 1 98 98 ASP H H 1 8.51 0.04 . 1 . . . . 93 ASP H . 17845 1 491 . 1 1 98 98 ASP C C 13 177.62 0.4 . 1 . . . . 93 ASP C . 17845 1 492 . 1 1 98 98 ASP CA C 13 58.82 0.4 . 1 . . . . 93 ASP CA . 17845 1 493 . 1 1 98 98 ASP CB C 13 39.92 0.4 . 1 . . . . 93 ASP CB . 17845 1 494 . 1 1 98 98 ASP N N 15 125.49 0.2 . 1 . . . . 93 ASP N . 17845 1 495 . 1 1 99 99 LEU H H 1 8.19 0.04 . 1 . . . . 94 LEU H . 17845 1 496 . 1 1 99 99 LEU CA C 13 58.60 0.4 . 1 . . . . 94 LEU CA . 17845 1 497 . 1 1 99 99 LEU CB C 13 41.22 0.4 . 1 . . . . 94 LEU CB . 17845 1 498 . 1 1 99 99 LEU N N 15 120.45 0.2 . 1 . . . . 94 LEU N . 17845 1 499 . 1 1 100 100 ILE H H 1 8.74 0.04 . 1 . . . . 95 ILE H . 17845 1 500 . 1 1 100 100 ILE C C 13 176.14 0.4 . 1 . . . . 95 ILE C . 17845 1 501 . 1 1 100 100 ILE CA C 13 66.12 0.4 . 1 . . . . 95 ILE CA . 17845 1 502 . 1 1 100 100 ILE CB C 13 37.20 0.4 . 1 . . . . 95 ILE CB . 17845 1 503 . 1 1 100 100 ILE N N 15 119.99 0.2 . 1 . . . . 95 ILE N . 17845 1 504 . 1 1 101 101 THR H H 1 7.97 0.04 . 1 . . . . 96 THR H . 17845 1 505 . 1 1 101 101 THR C C 13 176.87 0.4 . 1 . . . . 96 THR C . 17845 1 506 . 1 1 101 101 THR CA C 13 68.06 0.4 . 1 . . . . 96 THR CA . 17845 1 507 . 1 1 101 101 THR N N 15 117.79 0.2 . 1 . . . . 96 THR N . 17845 1 508 . 1 1 102 102 TYR H H 1 7.63 0.04 . 1 . . . . 97 TYR H . 17845 1 509 . 1 1 102 102 TYR C C 13 176.12 0.4 . 1 . . . . 97 TYR C . 17845 1 510 . 1 1 102 102 TYR CA C 13 61.30 0.4 . 1 . . . . 97 TYR CA . 17845 1 511 . 1 1 102 102 TYR CB C 13 37.89 0.4 . 1 . . . . 97 TYR CB . 17845 1 512 . 1 1 102 102 TYR N N 15 119.65 0.2 . 1 . . . . 97 TYR N . 17845 1 513 . 1 1 103 103 LEU H H 1 9.02 0.04 . 1 . . . . 98 LEU H . 17845 1 514 . 1 1 103 103 LEU C C 13 179.21 0.4 . 1 . . . . 98 LEU C . 17845 1 515 . 1 1 103 103 LEU CA C 13 57.40 0.4 . 1 . . . . 98 LEU CA . 17845 1 516 . 1 1 103 103 LEU CB C 13 42.88 0.4 . 1 . . . . 98 LEU CB . 17845 1 517 . 1 1 103 103 LEU N N 15 120.13 0.2 . 1 . . . . 98 LEU N . 17845 1 518 . 1 1 104 104 LYS H H 1 8.56 0.04 . 1 . . . . 99 LYS H . 17845 1 519 . 1 1 104 104 LYS C C 13 176.92 0.4 . 1 . . . . 99 LYS C . 17845 1 520 . 1 1 104 104 LYS CA C 13 59.01 0.4 . 1 . . . . 99 LYS CA . 17845 1 521 . 1 1 104 104 LYS CB C 13 31.36 0.4 . 1 . . . . 99 LYS CB . 17845 1 522 . 1 1 104 104 LYS N N 15 121.21 0.2 . 1 . . . . 99 LYS N . 17845 1 523 . 1 1 105 105 LYS H H 1 6.47 0.04 . 1 . . . . 100 LYS H . 17845 1 524 . 1 1 105 105 LYS C C 13 178.76 0.4 . 1 . . . . 100 LYS C . 17845 1 525 . 1 1 105 105 LYS CA C 13 57.22 0.4 . 1 . . . . 100 LYS CA . 17845 1 526 . 1 1 105 105 LYS CB C 13 32.43 0.4 . 1 . . . . 100 LYS CB . 17845 1 527 . 1 1 105 105 LYS N N 15 115.66 0.2 . 1 . . . . 100 LYS N . 17845 1 528 . 1 1 106 106 ALA H H 1 8.36 0.04 . 1 . . . . 101 ALA H . 17845 1 529 . 1 1 106 106 ALA C C 13 178.74 0.4 . 1 . . . . 101 ALA C . 17845 1 530 . 1 1 106 106 ALA CA C 13 54.03 0.4 . 1 . . . . 101 ALA CA . 17845 1 531 . 1 1 106 106 ALA CB C 13 18.89 0.4 . 1 . . . . 101 ALA CB . 17845 1 532 . 1 1 106 106 ALA N N 15 119.89 0.2 . 1 . . . . 101 ALA N . 17845 1 533 . 1 1 107 107 THR H H 1 7.44 0.04 . 1 . . . . 102 THR H . 17845 1 534 . 1 1 107 107 THR C C 13 173.56 0.4 . 1 . . . . 102 THR C . 17845 1 535 . 1 1 107 107 THR CA C 13 61.52 0.4 . 1 . . . . 102 THR CA . 17845 1 536 . 1 1 107 107 THR CB C 13 70.17 0.4 . 1 . . . . 102 THR CB . 17845 1 537 . 1 1 107 107 THR N N 15 102.50 0.2 . 1 . . . . 102 THR N . 17845 1 538 . 1 1 108 108 GLU H H 1 6.87 0.04 . 1 . . . . 103 GLU H . 17845 1 539 . 1 1 108 108 GLU CA C 13 58.53 0.4 . 1 . . . . 103 GLU CA . 17845 1 540 . 1 1 108 108 GLU CB C 13 30.57 0.4 . 1 . . . . 103 GLU CB . 17845 1 541 . 1 1 108 108 GLU N N 15 127.28 0.2 . 1 . . . . 103 GLU N . 17845 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_yCc_ox_low_salt _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode yCc_ox_low_salt _Assigned_chem_shift_list.Entry_ID 17845 _Assigned_chem_shift_list.ID 2 _Assigned_chem_shift_list.Sample_condition_list_ID 2 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_2 _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 5 '2D 1H-15N HSQC' . . . 17845 2 6 '3D NOESY-HSQC' . . . 17845 2 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.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 GLU H H 1 8.62 0.04 . 1 . . . . -4 GLU H . 17845 2 2 . 1 1 2 2 GLU N N 15 120.36 0.2 . 1 . . . . -4 GLU N . 17845 2 3 . 1 1 3 3 PHE H H 1 8.64 0.04 . 1 . . . . -3 PHE H . 17845 2 4 . 1 1 3 3 PHE N N 15 124.44 0.2 . 1 . . . . -3 PHE N . 17845 2 5 . 1 1 4 4 LYS H H 1 6.47 0.04 . 1 . . . . -2 LYS H . 17845 2 6 . 1 1 4 4 LYS N N 15 127.63 0.2 . 1 . . . . -2 LYS N . 17845 2 7 . 1 1 5 5 ALA H H 1 7.66 0.04 . 1 . . . . -1 ALA H . 17845 2 8 . 1 1 5 5 ALA N N 15 122.75 0.2 . 1 . . . . -1 ALA N . 17845 2 9 . 1 1 6 6 GLY H H 1 8.09 0.04 . 1 . . . . 1 GLY H . 17845 2 10 . 1 1 6 6 GLY N N 15 110.85 0.2 . 1 . . . . 1 GLY N . 17845 2 11 . 1 1 7 7 SER H H 1 9.37 0.04 . 1 . . . . 2 SER H . 17845 2 12 . 1 1 7 7 SER N N 15 120.10 0.2 . 1 . . . . 2 SER N . 17845 2 13 . 1 1 8 8 ALA H H 1 9.18 0.04 . 1 . . . . 3 ALA H . 17845 2 14 . 1 1 8 8 ALA N N 15 132.03 0.2 . 1 . . . . 3 ALA N . 17845 2 15 . 1 1 9 9 LYS H H 1 8.08 0.04 . 1 . . . . 4 LYS H . 17845 2 16 . 1 1 9 9 LYS N N 15 119.41 0.2 . 1 . . . . 4 LYS N . 17845 2 17 . 1 1 10 10 LYS H H 1 7.63 0.04 . 1 . . . . 5 LYS H . 17845 2 18 . 1 1 10 10 LYS N N 15 120.26 0.2 . 1 . . . . 5 LYS N . 17845 2 19 . 1 1 11 11 GLY H H 1 8.63 0.04 . 1 . . . . 6 GLY H . 17845 2 20 . 1 1 11 11 GLY N N 15 107.71 0.2 . 1 . . . . 6 GLY N . 17845 2 21 . 1 1 12 12 ALA H H 1 7.98 0.04 . 1 . . . . 7 ALA H . 17845 2 22 . 1 1 12 12 ALA N N 15 125.23 0.2 . 1 . . . . 7 ALA N . 17845 2 23 . 1 1 13 13 THR H H 1 7.21 0.04 . 1 . . . . 8 THR H . 17845 2 24 . 1 1 13 13 THR N N 15 116.00 0.2 . 1 . . . . 8 THR N . 17845 2 25 . 1 1 14 14 LEU H H 1 7.85 0.04 . 1 . . . . 9 LEU H . 17845 2 26 . 1 1 14 14 LEU N N 15 123.77 0.2 . 1 . . . . 9 LEU N . 17845 2 27 . 1 1 15 15 PHE H H 1 8.60 0.04 . 1 . . . . 10 PHE H . 17845 2 28 . 1 1 15 15 PHE N N 15 120.39 0.2 . 1 . . . . 10 PHE N . 17845 2 29 . 1 1 16 16 LYS H H 1 8.43 0.04 . 1 . . . . 11 LYS H . 17845 2 30 . 1 1 16 16 LYS N N 15 120.86 0.2 . 1 . . . . 11 LYS N . 17845 2 31 . 1 1 17 17 THR H H 1 7.89 0.04 . 1 . . . . 12 THR H . 17845 2 32 . 1 1 17 17 THR N N 15 107.80 0.2 . 1 . . . . 12 THR N . 17845 2 33 . 1 1 18 18 ARG H H 1 8.20 0.04 . 1 . . . . 13 ARG H . 17845 2 34 . 1 1 18 18 ARG N N 15 116.15 0.2 . 1 . . . . 13 ARG N . 17845 2 35 . 1 1 19 19 CYS H H 1 7.89 0.04 . 1 . . . . 14 CYS H . 17845 2 36 . 1 1 19 19 CYS N N 15 114.67 0.2 . 1 . . . . 14 CYS N . 17845 2 37 . 1 1 20 20 LEU H H 1 8.02 0.04 . 1 . . . . 15 LEU H . 17845 2 38 . 1 1 20 20 LEU N N 15 123.49 0.2 . 1 . . . . 15 LEU N . 17845 2 39 . 1 1 21 21 GLN H H 1 9.98 0.04 . 1 . . . . 16 GLN H . 17845 2 40 . 1 1 21 21 GLN HE21 H 1 6.88 0.04 . 2 . . . . 16 GLN HE21 . 17845 2 41 . 1 1 21 21 GLN HE22 H 1 7.58 0.04 . 2 . . . . 16 GLN HE22 . 17845 2 42 . 1 1 21 21 GLN N N 15 117.87 0.2 . 1 . . . . 16 GLN N . 17845 2 43 . 1 1 21 21 GLN NE2 N 15 111.26 0.2 . 1 . . . . 16 GLN NE2 . 17845 2 44 . 1 1 22 22 CYS H H 1 9.73 0.04 . 1 . . . . 17 CYS H . 17845 2 45 . 1 1 22 22 CYS N N 15 113.87 0.2 . 1 . . . . 17 CYS N . 17845 2 46 . 1 1 23 23 HIS H H 1 10.99 0.04 . 1 . . . . 18 HIS H . 17845 2 47 . 1 1 23 23 HIS N N 15 120.02 0.2 . 1 . . . . 18 HIS N . 17845 2 48 . 1 1 24 24 THR H H 1 10.12 0.04 . 1 . . . . 19 THR H . 17845 2 49 . 1 1 24 24 THR N N 15 110.61 0.2 . 1 . . . . 19 THR N . 17845 2 50 . 1 1 25 25 VAL H H 1 8.50 0.04 . 1 . . . . 20 VAL H . 17845 2 51 . 1 1 25 25 VAL N N 15 110.13 0.2 . 1 . . . . 20 VAL N . 17845 2 52 . 1 1 26 26 GLU H H 1 9.56 0.04 . 1 . . . . 21 GLU H . 17845 2 53 . 1 1 26 26 GLU N N 15 120.88 0.2 . 1 . . . . 21 GLU N . 17845 2 54 . 1 1 27 27 LYS H H 1 8.97 0.04 . 1 . . . . 22 LYS H . 17845 2 55 . 1 1 27 27 LYS N N 15 125.94 0.2 . 1 . . . . 22 LYS N . 17845 2 56 . 1 1 28 28 GLY H H 1 9.50 0.04 . 1 . . . . 23 GLY H . 17845 2 57 . 1 1 28 28 GLY N N 15 118.39 0.2 . 1 . . . . 23 GLY N . 17845 2 58 . 1 1 29 29 GLY H H 1 8.23 0.04 . 1 . . . . 24 GLY H . 17845 2 59 . 1 1 29 29 GLY N N 15 108.68 0.2 . 1 . . . . 24 GLY N . 17845 2 60 . 1 1 31 31 HIS H H 1 8.75 0.04 . 1 . . . . 26 HIS H . 17845 2 61 . 1 1 31 31 HIS N N 15 121.51 0.2 . 1 . . . . 26 HIS N . 17845 2 62 . 1 1 32 32 LYS H H 1 8.30 0.04 . 1 . . . . 27 LYS H . 17845 2 63 . 1 1 32 32 LYS N N 15 125.79 0.2 . 1 . . . . 27 LYS N . 17845 2 64 . 1 1 33 33 VAL H H 1 7.51 0.04 . 1 . . . . 28 VAL H . 17845 2 65 . 1 1 33 33 VAL N N 15 121.96 0.2 . 1 . . . . 28 VAL N . 17845 2 66 . 1 1 34 34 GLY H H 1 7.48 0.04 . 1 . . . . 29 GLY H . 17845 2 67 . 1 1 34 34 GLY N N 15 102.91 0.2 . 1 . . . . 29 GLY N . 17845 2 68 . 1 1 36 36 ASN H H 1 11.69 0.04 . 1 . . . . 31 ASN H . 17845 2 69 . 1 1 36 36 ASN HD21 H 1 8.13 0.04 . 2 . . . . 31 ASN HD21 . 17845 2 70 . 1 1 36 36 ASN HD22 H 1 8.78 0.04 . 2 . . . . 31 ASN HD22 . 17845 2 71 . 1 1 36 36 ASN N N 15 127.75 0.2 . 1 . . . . 31 ASN N . 17845 2 72 . 1 1 36 36 ASN ND2 N 15 116.00 0.2 . 1 . . . . 31 ASN ND2 . 17845 2 73 . 1 1 37 37 LEU H H 1 9.47 0.04 . 1 . . . . 32 LEU H . 17845 2 74 . 1 1 37 37 LEU N N 15 122.27 0.2 . 1 . . . . 32 LEU N . 17845 2 75 . 1 1 38 38 HIS H H 1 8.13 0.04 . 1 . . . . 33 HIS H . 17845 2 76 . 1 1 38 38 HIS N N 15 119.31 0.2 . 1 . . . . 33 HIS N . 17845 2 77 . 1 1 39 39 GLY H H 1 9.23 0.04 . 1 . . . . 34 GLY H . 17845 2 78 . 1 1 39 39 GLY N N 15 116.29 0.2 . 1 . . . . 34 GLY N . 17845 2 79 . 1 1 40 40 ILE H H 1 7.14 0.04 . 1 . . . . 35 ILE H . 17845 2 80 . 1 1 40 40 ILE N N 15 116.27 0.2 . 1 . . . . 35 ILE N . 17845 2 81 . 1 1 41 41 PHE H H 1 7.99 0.04 . 1 . . . . 36 PHE H . 17845 2 82 . 1 1 41 41 PHE N N 15 116.61 0.2 . 1 . . . . 36 PHE N . 17845 2 83 . 1 1 42 42 GLY H H 1 8.80 0.04 . 1 . . . . 37 GLY H . 17845 2 84 . 1 1 42 42 GLY N N 15 110.53 0.2 . 1 . . . . 37 GLY N . 17845 2 85 . 1 1 43 43 ARG H H 1 7.94 0.04 . 1 . . . . 38 ARG H . 17845 2 86 . 1 1 43 43 ARG N N 15 121.37 0.2 . 1 . . . . 38 ARG N . 17845 2 87 . 1 1 44 44 HIS H H 1 8.17 0.04 . 1 . . . . 39 HIS H . 17845 2 88 . 1 1 44 44 HIS N N 15 117.92 0.2 . 1 . . . . 39 HIS N . 17845 2 89 . 1 1 45 45 SER H H 1 8.66 0.04 . 1 . . . . 40 SER H . 17845 2 90 . 1 1 45 45 SER N N 15 116.68 0.2 . 1 . . . . 40 SER N . 17845 2 91 . 1 1 46 46 GLY H H 1 8.93 0.04 . 1 . . . . 41 GLY H . 17845 2 92 . 1 1 46 46 GLY N N 15 109.89 0.2 . 1 . . . . 41 GLY N . 17845 2 93 . 1 1 47 47 GLN H H 1 7.84 0.04 . 1 . . . . 42 GLN H . 17845 2 94 . 1 1 47 47 GLN HE21 H 1 6.76 0.04 . 2 . . . . 42 GLN HE21 . 17845 2 95 . 1 1 47 47 GLN HE22 H 1 7.29 0.04 . 2 . . . . 42 GLN HE22 . 17845 2 96 . 1 1 47 47 GLN N N 15 113.19 0.2 . 1 . . . . 42 GLN N . 17845 2 97 . 1 1 47 47 GLN NE2 N 15 112.31 0.2 . 1 . . . . 42 GLN NE2 . 17845 2 98 . 1 1 48 48 ALA H H 1 8.11 0.04 . 1 . . . . 43 ALA H . 17845 2 99 . 1 1 48 48 ALA N N 15 124.61 0.2 . 1 . . . . 43 ALA N . 17845 2 100 . 1 1 49 49 GLU H H 1 8.81 0.04 . 1 . . . . 44 GLU H . 17845 2 101 . 1 1 49 49 GLU N N 15 125.54 0.2 . 1 . . . . 44 GLU N . 17845 2 102 . 1 1 50 50 GLY H H 1 9.06 0.04 . 1 . . . . 45 GLY H . 17845 2 103 . 1 1 50 50 GLY N N 15 113.56 0.2 . 1 . . . . 45 GLY N . 17845 2 104 . 1 1 51 51 TYR H H 1 6.94 0.04 . 1 . . . . 46 TYR H . 17845 2 105 . 1 1 51 51 TYR N N 15 119.64 0.2 . 1 . . . . 46 TYR N . 17845 2 106 . 1 1 52 52 SER H H 1 6.45 0.04 . 1 . . . . 47 SER H . 17845 2 107 . 1 1 52 52 SER N N 15 122.33 0.2 . 1 . . . . 47 SER N . 17845 2 108 . 1 1 53 53 TYR H H 1 7.70 0.04 . 1 . . . . 48 TYR H . 17845 2 109 . 1 1 53 53 TYR N N 15 125.03 0.2 . 1 . . . . 48 TYR N . 17845 2 110 . 1 1 54 54 THR H H 1 9.62 0.04 . 1 . . . . 49 THR H . 17845 2 111 . 1 1 54 54 THR N N 15 112.35 0.2 . 1 . . . . 49 THR N . 17845 2 112 . 1 1 55 55 ASP H H 1 8.61 0.04 . 1 . . . . 50 ASP H . 17845 2 113 . 1 1 55 55 ASP N N 15 120.98 0.2 . 1 . . . . 50 ASP N . 17845 2 114 . 1 1 56 56 ALA H H 1 8.00 0.04 . 1 . . . . 51 ALA H . 17845 2 115 . 1 1 56 56 ALA N N 15 119.63 0.2 . 1 . . . . 51 ALA N . 17845 2 116 . 1 1 57 57 ASN H H 1 8.33 0.04 . 1 . . . . 52 ASN H . 17845 2 117 . 1 1 57 57 ASN HD21 H 1 7.06 0.04 . 2 . . . . 52 ASN HD21 . 17845 2 118 . 1 1 57 57 ASN HD22 H 1 7.38 0.04 . 2 . . . . 52 ASN HD22 . 17845 2 119 . 1 1 57 57 ASN N N 15 117.93 0.2 . 1 . . . . 52 ASN N . 17845 2 120 . 1 1 57 57 ASN ND2 N 15 109.34 0.2 . 1 . . . . 52 ASN ND2 . 17845 2 121 . 1 1 58 58 ILE H H 1 7.62 0.04 . 1 . . . . 53 ILE H . 17845 2 122 . 1 1 58 58 ILE N N 15 121.10 0.2 . 1 . . . . 53 ILE N . 17845 2 123 . 1 1 59 59 LYS H H 1 9.02 0.04 . 1 . . . . 54 LYS H . 17845 2 124 . 1 1 59 59 LYS N N 15 119.25 0.2 . 1 . . . . 54 LYS N . 17845 2 125 . 1 1 60 60 LYS H H 1 7.38 0.04 . 1 . . . . 55 LYS H . 17845 2 126 . 1 1 60 60 LYS N N 15 118.63 0.2 . 1 . . . . 55 LYS N . 17845 2 127 . 1 1 61 61 ASN H H 1 7.28 0.04 . 1 . . . . 56 ASN H . 17845 2 128 . 1 1 61 61 ASN HD21 H 1 6.47 0.04 . 2 . . . . 56 ASN HD21 . 17845 2 129 . 1 1 61 61 ASN HD22 H 1 7.50 0.04 . 2 . . . . 56 ASN HD22 . 17845 2 130 . 1 1 61 61 ASN N N 15 112.32 0.2 . 1 . . . . 56 ASN N . 17845 2 131 . 1 1 61 61 ASN ND2 N 15 109.47 0.2 . 1 . . . . 56 ASN ND2 . 17845 2 132 . 1 1 62 62 VAL H H 1 7.27 0.04 . 1 . . . . 57 VAL H . 17845 2 133 . 1 1 62 62 VAL N N 15 114.38 0.2 . 1 . . . . 57 VAL N . 17845 2 134 . 1 1 63 63 LEU H H 1 8.25 0.04 . 1 . . . . 58 LEU H . 17845 2 135 . 1 1 63 63 LEU N N 15 127.45 0.2 . 1 . . . . 58 LEU N . 17845 2 136 . 1 1 64 64 TRP H H 1 7.91 0.04 . 1 . . . . 59 TRP H . 17845 2 137 . 1 1 64 64 TRP N N 15 127.90 0.2 . 1 . . . . 59 TRP N . 17845 2 138 . 1 1 65 65 ASP H H 1 9.84 0.04 . 1 . . . . 60 ASP H . 17845 2 139 . 1 1 65 65 ASP N N 15 125.61 0.2 . 1 . . . . 60 ASP N . 17845 2 140 . 1 1 66 66 GLU H H 1 10.05 0.04 . 1 . . . . 61 GLU H . 17845 2 141 . 1 1 66 66 GLU N N 15 116.94 0.2 . 1 . . . . 61 GLU N . 17845 2 142 . 1 1 67 67 ASN H H 1 8.16 0.04 . 1 . . . . 62 ASN H . 17845 2 143 . 1 1 67 67 ASN HD21 H 1 7.10 0.04 . 2 . . . . 62 ASN HD21 . 17845 2 144 . 1 1 67 67 ASN HD22 H 1 7.74 0.04 . 2 . . . . 62 ASN HD22 . 17845 2 145 . 1 1 67 67 ASN N N 15 116.00 0.2 . 1 . . . . 62 ASN N . 17845 2 146 . 1 1 67 67 ASN ND2 N 15 113.89 0.2 . 1 . . . . 62 ASN ND2 . 17845 2 147 . 1 1 68 68 ASN H H 1 9.44 0.04 . 1 . . . . 63 ASN H . 17845 2 148 . 1 1 68 68 ASN HD21 H 1 6.99 0.04 . 2 . . . . 63 ASN HD21 . 17845 2 149 . 1 1 68 68 ASN HD22 H 1 7.37 0.04 . 2 . . . . 63 ASN HD22 . 17845 2 150 . 1 1 68 68 ASN N N 15 122.13 0.2 . 1 . . . . 63 ASN N . 17845 2 151 . 1 1 68 68 ASN ND2 N 15 110.36 0.2 . 1 . . . . 63 ASN ND2 . 17845 2 152 . 1 1 69 69 MET H H 1 8.73 0.04 . 1 . . . . 64 MET H . 17845 2 153 . 1 1 69 69 MET N N 15 121.51 0.2 . 1 . . . . 64 MET N . 17845 2 154 . 1 1 70 70 SER H H 1 7.48 0.04 . 1 . . . . 65 SER H . 17845 2 155 . 1 1 70 70 SER N N 15 113.97 0.2 . 1 . . . . 65 SER N . 17845 2 156 . 1 1 71 71 GLU H H 1 7.65 0.04 . 1 . . . . 66 GLU H . 17845 2 157 . 1 1 71 71 GLU N N 15 121.20 0.2 . 1 . . . . 66 GLU N . 17845 2 158 . 1 1 72 72 TYR H H 1 8.39 0.04 . 1 . . . . 67 TYR H . 17845 2 159 . 1 1 72 72 TYR N N 15 122.40 0.2 . 1 . . . . 67 TYR N . 17845 2 160 . 1 1 73 73 LEU H H 1 8.10 0.04 . 1 . . . . 68 LEU H . 17845 2 161 . 1 1 73 73 LEU N N 15 112.95 0.2 . 1 . . . . 68 LEU N . 17845 2 162 . 1 1 74 74 THR H H 1 7.40 0.04 . 1 . . . . 69 THR H . 17845 2 163 . 1 1 74 74 THR N N 15 116.02 0.2 . 1 . . . . 69 THR N . 17845 2 164 . 1 1 75 75 ASN H H 1 6.80 0.04 . 1 . . . . 70 ASN H . 17845 2 165 . 1 1 75 75 ASN HD21 H 1 7.05 0.04 . 2 . . . . 70 ASN HD21 . 17845 2 166 . 1 1 75 75 ASN HD22 H 1 7.90 0.04 . 2 . . . . 70 ASN HD22 . 17845 2 167 . 1 1 75 75 ASN N N 15 109.01 0.2 . 1 . . . . 70 ASN N . 17845 2 168 . 1 1 75 75 ASN ND2 N 15 111.98 0.2 . 1 . . . . 70 ASN ND2 . 17845 2 169 . 1 1 77 77 LYS H H 1 9.35 0.04 . 1 . . . . 72 LYS H . 17845 2 170 . 1 1 77 77 LYS N N 15 115.14 0.2 . 1 . . . . 72 LYS N . 17845 2 171 . 1 1 78 78 LYS H H 1 7.84 0.04 . 1 . . . . 73 LYS H . 17845 2 172 . 1 1 78 78 LYS N N 15 118.91 0.2 . 1 . . . . 73 LYS N . 17845 2 173 . 1 1 79 79 TYR H H 1 8.26 0.04 . 1 . . . . 74 TYR H . 17845 2 174 . 1 1 79 79 TYR N N 15 120.71 0.2 . 1 . . . . 74 TYR N . 17845 2 175 . 1 1 80 80 ILE H H 1 9.46 0.04 . 1 . . . . 75 ILE H . 17845 2 176 . 1 1 80 80 ILE N N 15 115.10 0.2 . 1 . . . . 75 ILE N . 17845 2 177 . 1 1 82 82 GLY H H 1 9.31 0.04 . 1 . . . . 77 GLY H . 17845 2 178 . 1 1 82 82 GLY N N 15 111.85 0.2 . 1 . . . . 77 GLY N . 17845 2 179 . 1 1 83 83 THR H H 1 9.07 0.04 . 1 . . . . 78 THR H . 17845 2 180 . 1 1 83 83 THR N N 15 115.43 0.2 . 1 . . . . 78 THR N . 17845 2 181 . 1 1 84 84 LYS H H 1 8.09 0.04 . 1 . . . . 79 LYS H . 17845 2 182 . 1 1 84 84 LYS N N 15 122.93 0.2 . 1 . . . . 79 LYS N . 17845 2 183 . 1 1 85 85 MET H H 1 8.83 0.04 . 1 . . . . 80 MET H . 17845 2 184 . 1 1 85 85 MET N N 15 122.91 0.2 . 1 . . . . 80 MET N . 17845 2 185 . 1 1 86 86 ALA H H 1 8.20 0.04 . 1 . . . . 81 ALA H . 17845 2 186 . 1 1 86 86 ALA N N 15 139.06 0.2 . 1 . . . . 81 ALA N . 17845 2 187 . 1 1 87 87 PHE H H 1 8.68 0.04 . 1 . . . . 82 PHE H . 17845 2 188 . 1 1 87 87 PHE N N 15 122.86 0.2 . 1 . . . . 82 PHE N . 17845 2 189 . 1 1 90 90 LEU H H 1 8.05 0.04 . 1 . . . . 85 LEU H . 17845 2 190 . 1 1 90 90 LEU N N 15 122.41 0.2 . 1 . . . . 85 LEU N . 17845 2 191 . 1 1 91 91 LYS H H 1 8.38 0.04 . 1 . . . . 86 LYS H . 17845 2 192 . 1 1 91 91 LYS N N 15 122.98 0.2 . 1 . . . . 86 LYS N . 17845 2 193 . 1 1 92 92 LYS H H 1 8.65 0.04 . 1 . . . . 87 LYS H . 17845 2 194 . 1 1 92 92 LYS N N 15 119.96 0.2 . 1 . . . . 87 LYS N . 17845 2 195 . 1 1 93 93 GLU H H 1 8.84 0.04 . 1 . . . . 88 GLU H . 17845 2 196 . 1 1 93 93 GLU N N 15 129.34 0.2 . 1 . . . . 88 GLU N . 17845 2 197 . 1 1 94 94 LYS H H 1 8.65 0.04 . 1 . . . . 89 LYS H . 17845 2 198 . 1 1 94 94 LYS N N 15 116.71 0.2 . 1 . . . . 89 LYS N . 17845 2 199 . 1 1 95 95 ASP H H 1 6.23 0.04 . 1 . . . . 90 ASP H . 17845 2 200 . 1 1 95 95 ASP N N 15 115.75 0.2 . 1 . . . . 90 ASP N . 17845 2 201 . 1 1 96 96 ARG H H 1 7.24 0.04 . 1 . . . . 91 ARG H . 17845 2 202 . 1 1 96 96 ARG N N 15 118.06 0.2 . 1 . . . . 91 ARG N . 17845 2 203 . 1 1 97 97 ASN H H 1 8.51 0.04 . 1 . . . . 92 ASN H . 17845 2 204 . 1 1 97 97 ASN HD21 H 1 7.09 0.04 . 2 . . . . 92 ASN HD21 . 17845 2 205 . 1 1 97 97 ASN HD22 H 1 7.13 0.04 . 2 . . . . 92 ASN HD22 . 17845 2 206 . 1 1 97 97 ASN N N 15 118.04 0.2 . 1 . . . . 92 ASN N . 17845 2 207 . 1 1 97 97 ASN ND2 N 15 110.49 0.2 . 1 . . . . 92 ASN ND2 . 17845 2 208 . 1 1 98 98 ASP H H 1 8.51 0.04 . 1 . . . . 93 ASP H . 17845 2 209 . 1 1 98 98 ASP N N 15 125.50 0.2 . 1 . . . . 93 ASP N . 17845 2 210 . 1 1 99 99 LEU H H 1 8.18 0.04 . 1 . . . . 94 LEU H . 17845 2 211 . 1 1 99 99 LEU N N 15 120.52 0.2 . 1 . . . . 94 LEU N . 17845 2 212 . 1 1 100 100 ILE H H 1 8.72 0.04 . 1 . . . . 95 ILE H . 17845 2 213 . 1 1 100 100 ILE N N 15 120.07 0.2 . 1 . . . . 95 ILE N . 17845 2 214 . 1 1 101 101 THR H H 1 7.96 0.04 . 1 . . . . 96 THR H . 17845 2 215 . 1 1 101 101 THR N N 15 117.81 0.2 . 1 . . . . 96 THR N . 17845 2 216 . 1 1 102 102 TYR H H 1 7.62 0.04 . 1 . . . . 97 TYR H . 17845 2 217 . 1 1 102 102 TYR N N 15 119.69 0.2 . 1 . . . . 97 TYR N . 17845 2 218 . 1 1 103 103 LEU H H 1 9.02 0.04 . 1 . . . . 98 LEU H . 17845 2 219 . 1 1 103 103 LEU N N 15 120.15 0.2 . 1 . . . . 98 LEU N . 17845 2 220 . 1 1 104 104 LYS H H 1 8.56 0.04 . 1 . . . . 99 LYS H . 17845 2 221 . 1 1 104 104 LYS N N 15 121.26 0.2 . 1 . . . . 99 LYS N . 17845 2 222 . 1 1 105 105 LYS H H 1 6.46 0.04 . 1 . . . . 100 LYS H . 17845 2 223 . 1 1 105 105 LYS N N 15 115.64 0.2 . 1 . . . . 100 LYS N . 17845 2 224 . 1 1 106 106 ALA H H 1 8.36 0.04 . 1 . . . . 101 ALA H . 17845 2 225 . 1 1 106 106 ALA N N 15 119.93 0.2 . 1 . . . . 101 ALA N . 17845 2 226 . 1 1 107 107 THR H H 1 7.43 0.04 . 1 . . . . 102 THR H . 17845 2 227 . 1 1 107 107 THR N N 15 102.68 0.2 . 1 . . . . 102 THR N . 17845 2 228 . 1 1 108 108 GLU H H 1 6.87 0.04 . 1 . . . . 103 GLU H . 17845 2 229 . 1 1 108 108 GLU N N 15 127.33 0.2 . 1 . . . . 103 GLU N . 17845 2 stop_ save_