################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 15441 _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' . . . 15441 1 2 '3D CBCA(CO)NH' . . . 15441 1 3 '3D HNCACB' . . . 15441 1 4 '3D 1H-15N NOESY' . . . 15441 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 16 16 SER H H 1 8.46 0.02 . 1 1 . . . 84 SER H . 15441 1 2 . 1 1 16 16 SER CA C 13 58.41 0.05 . 1 1 . . . 84 SER CA . 15441 1 3 . 1 1 16 16 SER CB C 13 63.90 0.05 . 1 1 . . . 84 SER CB . 15441 1 4 . 1 1 16 16 SER N N 15 117.04 0.05 . 1 1 . . . 84 SER N . 15441 1 5 . 1 1 17 17 ASN H H 1 8.51 0.02 . 1 1 . . . 85 ASN H . 15441 1 6 . 1 1 17 17 ASN CA C 13 53.39 0.05 . 1 1 . . . 85 ASN CA . 15441 1 7 . 1 1 17 17 ASN CB C 13 38.80 0.05 . 1 1 . . . 85 ASN CB . 15441 1 8 . 1 1 17 17 ASN N N 15 120.86 0.05 . 1 1 . . . 85 ASN N . 15441 1 9 . 1 1 18 18 THR H H 1 8.16 0.02 . 1 1 . . . 86 THR H . 15441 1 10 . 1 1 18 18 THR CA C 13 62.17 0.05 . 1 1 . . . 86 THR CA . 15441 1 11 . 1 1 18 18 THR CB C 13 69.70 0.05 . 1 1 . . . 86 THR CB . 15441 1 12 . 1 1 18 18 THR N N 15 114.28 0.05 . 1 1 . . . 86 THR N . 15441 1 13 . 1 1 19 19 GLN H H 1 8.50 0.02 . 1 1 . . . 87 GLN H . 15441 1 14 . 1 1 19 19 GLN CA C 13 55.90 0.05 . 1 1 . . . 87 GLN CA . 15441 1 15 . 1 1 19 19 GLN CB C 13 29.24 0.05 . 1 1 . . . 87 GLN CB . 15441 1 16 . 1 1 19 19 GLN N N 15 123.01 0.05 . 1 1 . . . 87 GLN N . 15441 1 17 . 1 1 20 20 THR H H 1 8.32 0.02 . 1 1 . . . 88 THR H . 15441 1 18 . 1 1 20 20 THR CA C 13 60.00 0.05 . 1 1 . . . 88 THR CA . 15441 1 19 . 1 1 20 20 THR CB C 13 69.61 0.05 . 1 1 . . . 88 THR CB . 15441 1 20 . 1 1 20 20 THR N N 15 118.22 0.05 . 1 1 . . . 88 THR N . 15441 1 21 . 1 1 21 21 PRO CA C 13 63.27 0.05 . 1 1 . . . 89 PRO CA . 15441 1 22 . 1 1 21 21 PRO CB C 13 32.06 0.05 . 1 1 . . . 89 PRO CB . 15441 1 23 . 1 1 22 22 ASP H H 1 8.42 0.02 . 1 1 . . . 90 ASP H . 15441 1 24 . 1 1 22 22 ASP CA C 13 54.24 0.05 . 1 1 . . . 90 ASP CA . 15441 1 25 . 1 1 22 22 ASP CB C 13 41.06 0.05 . 1 1 . . . 90 ASP CB . 15441 1 26 . 1 1 22 22 ASP N N 15 120.68 0.05 . 1 1 . . . 90 ASP N . 15441 1 27 . 1 1 23 23 ALA H H 1 8.43 0.02 . 1 1 . . . 91 ALA H . 15441 1 28 . 1 1 23 23 ALA CA C 13 53.23 0.05 . 1 1 . . . 91 ALA CA . 15441 1 29 . 1 1 23 23 ALA CB C 13 19.04 0.05 . 1 1 . . . 91 ALA CB . 15441 1 30 . 1 1 23 23 ALA N N 15 125.89 0.05 . 1 1 . . . 91 ALA N . 15441 1 31 . 1 1 24 24 SER H H 1 8.41 0.02 . 1 1 . . . 92 SER H . 15441 1 32 . 1 1 24 24 SER CA C 13 59.19 0.05 . 1 1 . . . 92 SER CA . 15441 1 33 . 1 1 24 24 SER CB C 13 63.27 0.05 . 1 1 . . . 92 SER CB . 15441 1 34 . 1 1 24 24 SER N N 15 114.73 0.05 . 1 1 . . . 92 SER N . 15441 1 35 . 1 1 25 25 LEU H H 1 8.00 0.02 . 1 1 . . . 93 LEU H . 15441 1 36 . 1 1 25 25 LEU CA C 13 55.43 0.05 . 1 1 . . . 93 LEU CA . 15441 1 37 . 1 1 25 25 LEU CB C 13 42.25 0.05 . 1 1 . . . 93 LEU CB . 15441 1 38 . 1 1 25 25 LEU N N 15 123.36 0.05 . 1 1 . . . 93 LEU N . 15441 1 39 . 1 1 26 26 GLN H H 1 8.17 0.02 . 1 1 . . . 94 GLN H . 15441 1 40 . 1 1 26 26 GLN CA C 13 55.74 0.05 . 1 1 . . . 94 GLN CA . 15441 1 41 . 1 1 26 26 GLN CB C 13 29.24 0.05 . 1 1 . . . 94 GLN CB . 15441 1 42 . 1 1 26 26 GLN N N 15 120.26 0.05 . 1 1 . . . 94 GLN N . 15441 1 43 . 1 1 27 27 ALA H H 1 8.34 0.02 . 1 1 . . . 95 ALA H . 15441 1 44 . 1 1 27 27 ALA CA C 13 52.71 0.05 . 1 1 . . . 95 ALA CA . 15441 1 45 . 1 1 27 27 ALA CB C 13 19.22 0.05 . 1 1 . . . 95 ALA CB . 15441 1 46 . 1 1 27 27 ALA N N 15 125.62 0.05 . 1 1 . . . 95 ALA N . 15441 1 47 . 1 1 28 28 THR H H 1 8.14 0.02 . 1 1 . . . 96 THR H . 15441 1 48 . 1 1 28 28 THR CA C 13 61.72 0.05 . 1 1 . . . 96 THR CA . 15441 1 49 . 1 1 28 28 THR CB C 13 69.77 0.05 . 1 1 . . . 96 THR CB . 15441 1 50 . 1 1 28 28 THR N N 15 112.84 0.05 . 1 1 . . . 96 THR N . 15441 1 51 . 1 1 29 29 VAL H H 1 8.21 0.02 . 1 1 . . . 97 VAL H . 15441 1 52 . 1 1 29 29 VAL CA C 13 62.48 0.05 . 1 1 . . . 97 VAL CA . 15441 1 53 . 1 1 29 29 VAL CB C 13 32.73 0.05 . 1 1 . . . 97 VAL CB . 15441 1 54 . 1 1 29 29 VAL N N 15 122.24 0.05 . 1 1 . . . 97 VAL N . 15441 1 55 . 1 1 30 30 ASN H H 1 8.56 0.02 . 1 1 . . . 98 ASN H . 15441 1 56 . 1 1 30 30 ASN CA C 13 53.61 0.05 . 1 1 . . . 98 ASN CA . 15441 1 57 . 1 1 30 30 ASN CB C 13 38.86 0.05 . 1 1 . . . 98 ASN CB . 15441 1 58 . 1 1 30 30 ASN N N 15 121.99 0.05 . 1 1 . . . 98 ASN N . 15441 1 59 . 1 1 31 31 GLY H H 1 8.39 0.02 . 1 1 . . . 99 GLY H . 15441 1 60 . 1 1 31 31 GLY CA C 13 45.45 0.05 . 1 1 . . . 99 GLY CA . 15441 1 61 . 1 1 31 31 GLY N N 15 109.15 0.05 . 1 1 . . . 99 GLY N . 15441 1 62 . 1 1 32 32 GLN H H 1 8.27 0.02 . 1 1 . . . 100 GLN H . 15441 1 63 . 1 1 32 32 GLN CA C 13 55.83 0.05 . 1 1 . . . 100 GLN CA . 15441 1 64 . 1 1 32 32 GLN CB C 13 29.45 0.05 . 1 1 . . . 100 GLN CB . 15441 1 65 . 1 1 32 32 GLN N N 15 119.71 0.05 . 1 1 . . . 100 GLN N . 15441 1 66 . 1 1 33 33 SER H H 1 8.62 0.02 . 1 1 . . . 101 SER H . 15441 1 67 . 1 1 33 33 SER CA C 13 58.63 0.05 . 1 1 . . . 101 SER CA . 15441 1 68 . 1 1 33 33 SER CB C 13 63.81 0.05 . 1 1 . . . 101 SER CB . 15441 1 69 . 1 1 33 33 SER N N 15 117.77 0.05 . 1 1 . . . 101 SER N . 15441 1 70 . 1 1 34 34 GLY H H 1 8.52 0.02 . 1 1 . . . 102 GLY H . 15441 1 71 . 1 1 34 34 GLY CA C 13 45.61 0.05 . 1 1 . . . 102 GLY CA . 15441 1 72 . 1 1 34 34 GLY N N 15 111.06 0.05 . 1 1 . . . 102 GLY N . 15441 1 73 . 1 1 35 35 GLY H H 1 8.32 0.02 . 1 1 . . . 103 GLY H . 15441 1 74 . 1 1 35 35 GLY CA C 13 45.30 0.05 . 1 1 . . . 103 GLY CA . 15441 1 75 . 1 1 35 35 GLY N N 15 108.69 0.05 . 1 1 . . . 103 GLY N . 15441 1 76 . 1 1 36 36 LYS H H 1 8.22 0.02 . 1 1 . . . 104 LYS H . 15441 1 77 . 1 1 36 36 LYS CA C 13 56.28 0.05 . 1 1 . . . 104 LYS CA . 15441 1 78 . 1 1 36 36 LYS CB C 13 33.22 0.05 . 1 1 . . . 104 LYS CB . 15441 1 79 . 1 1 36 36 LYS N N 15 120.86 0.05 . 1 1 . . . 104 LYS N . 15441 1 80 . 1 1 37 37 LYS H H 1 8.46 0.02 . 1 1 . . . 105 LYS H . 15441 1 81 . 1 1 37 37 LYS CA C 13 55.96 0.05 . 1 1 . . . 105 LYS CA . 15441 1 82 . 1 1 37 37 LYS CB C 13 29.29 0.05 . 1 1 . . . 105 LYS CB . 15441 1 83 . 1 1 37 37 LYS N N 15 123.15 0.05 . 1 1 . . . 105 LYS N . 15441 1 84 . 1 1 38 38 GLN H H 1 8.88 0.02 . 1 1 . . . 106 GLN H . 15441 1 85 . 1 1 38 38 GLN CA C 13 55.81 0.05 . 1 1 . . . 106 GLN CA . 15441 1 86 . 1 1 38 38 GLN CB C 13 29.14 0.05 . 1 1 . . . 106 GLN CB . 15441 1 87 . 1 1 38 38 GLN N N 15 120.71 0.05 . 1 1 . . . 106 GLN N . 15441 1 88 . 1 1 39 39 PRO CA C 13 63.03 0.05 . 1 1 . . . 107 PRO CA . 15441 1 89 . 1 1 39 39 PRO CB C 13 31.99 0.05 . 1 1 . . . 107 PRO CB . 15441 1 90 . 1 1 40 40 LEU H H 1 8.39 0.02 . 1 1 . . . 108 LEU H . 15441 1 91 . 1 1 40 40 LEU CA C 13 55.23 0.05 . 1 1 . . . 108 LEU CA . 15441 1 92 . 1 1 40 40 LEU CB C 13 42.50 0.05 . 1 1 . . . 108 LEU CB . 15441 1 93 . 1 1 40 40 LEU N N 15 122.34 0.05 . 1 1 . . . 108 LEU N . 15441 1 94 . 1 1 41 41 ASN H H 1 8.47 0.02 . 1 1 . . . 109 ASN H . 15441 1 95 . 1 1 41 41 ASN CA C 13 52.92 0.05 . 1 1 . . . 109 ASN CA . 15441 1 96 . 1 1 41 41 ASN CB C 13 38.59 0.05 . 1 1 . . . 109 ASN CB . 15441 1 97 . 1 1 41 41 ASN N N 15 119.41 0.05 . 1 1 . . . 109 ASN N . 15441 1 98 . 1 1 42 42 LEU H H 1 8.27 0.02 . 1 1 . . . 110 LEU H . 15441 1 99 . 1 1 42 42 LEU CA C 13 55.37 0.05 . 1 1 . . . 110 LEU CA . 15441 1 100 . 1 1 42 42 LEU CB C 13 42.10 0.05 . 1 1 . . . 110 LEU CB . 15441 1 101 . 1 1 42 42 LEU N N 15 122.91 0.05 . 1 1 . . . 110 LEU N . 15441 1 102 . 1 1 43 43 SER H H 1 8.34 0.02 . 1 1 . . . 111 SER H . 15441 1 103 . 1 1 43 43 SER CA C 13 58.63 0.05 . 1 1 . . . 111 SER CA . 15441 1 104 . 1 1 43 43 SER CB C 13 63.57 0.05 . 1 1 . . . 111 SER CB . 15441 1 105 . 1 1 43 43 SER N N 15 116.52 0.05 . 1 1 . . . 111 SER N . 15441 1 106 . 1 1 44 44 VAL H H 1 7.92 0.02 . 1 1 . . . 112 VAL H . 15441 1 107 . 1 1 44 44 VAL CA C 13 62.44 0.05 . 1 1 . . . 112 VAL CA . 15441 1 108 . 1 1 44 44 VAL CB C 13 32.62 0.05 . 1 1 . . . 112 VAL CB . 15441 1 109 . 1 1 44 44 VAL N N 15 120.57 0.05 . 1 1 . . . 112 VAL N . 15441 1 110 . 1 1 45 45 TYR H H 1 8.11 0.02 . 1 1 . . . 113 TYR H . 15441 1 111 . 1 1 45 45 TYR CA C 13 58.01 0.05 . 1 1 . . . 113 TYR CA . 15441 1 112 . 1 1 45 45 TYR CB C 13 38.74 0.05 . 1 1 . . . 113 TYR CB . 15441 1 113 . 1 1 45 45 TYR N N 15 122.78 0.05 . 1 1 . . . 113 TYR N . 15441 1 114 . 1 1 46 46 ASN H H 1 8.26 0.02 . 1 1 . . . 114 ASN H . 15441 1 115 . 1 1 46 46 ASN CA C 13 53.07 0.05 . 1 1 . . . 114 ASN CA . 15441 1 116 . 1 1 46 46 ASN CB C 13 39.06 0.05 . 1 1 . . . 114 ASN CB . 15441 1 117 . 1 1 46 46 ASN N N 15 121.03 0.05 . 1 1 . . . 114 ASN N . 15441 1 118 . 1 1 47 47 VAL H H 1 8.05 0.02 . 1 1 . . . 115 VAL H . 15441 1 119 . 1 1 47 47 VAL CA C 13 62.47 0.05 . 1 1 . . . 115 VAL CA . 15441 1 120 . 1 1 47 47 VAL CB C 13 32.79 0.05 . 1 1 . . . 115 VAL CB . 15441 1 121 . 1 1 47 47 VAL N N 15 120.81 0.05 . 1 1 . . . 115 VAL N . 15441 1 122 . 1 1 48 48 GLN H H 1 8.42 0.02 . 1 1 . . . 116 GLN H . 15441 1 123 . 1 1 48 48 GLN CA C 13 55.94 0.05 . 1 1 . . . 116 GLN CA . 15441 1 124 . 1 1 48 48 GLN CB C 13 29.03 0.05 . 1 1 . . . 116 GLN CB . 15441 1 125 . 1 1 48 48 GLN N N 15 123.64 0.05 . 1 1 . . . 116 GLN N . 15441 1 126 . 1 1 49 49 ALA H H 1 8.23 0.02 . 1 1 . . . 117 ALA H . 15441 1 127 . 1 1 49 49 ALA CA C 13 52.76 0.05 . 1 1 . . . 117 ALA CA . 15441 1 128 . 1 1 49 49 ALA CB C 13 19.32 0.05 . 1 1 . . . 117 ALA CB . 15441 1 129 . 1 1 49 49 ALA N N 15 124.52 0.05 . 1 1 . . . 117 ALA N . 15441 1 130 . 1 1 50 50 THR H H 1 8.13 0.02 . 1 1 . . . 118 THR H . 15441 1 131 . 1 1 50 50 THR CA C 13 62.15 0.05 . 1 1 . . . 118 THR CA . 15441 1 132 . 1 1 50 50 THR CB C 13 69.63 0.05 . 1 1 . . . 118 THR CB . 15441 1 133 . 1 1 50 50 THR N N 15 113.59 0.05 . 1 1 . . . 118 THR N . 15441 1 134 . 1 1 51 51 ASN H H 1 8.43 0.02 . 1 1 . . . 119 ASN H . 15441 1 135 . 1 1 51 51 ASN CA C 13 53.23 0.05 . 1 1 . . . 119 ASN CA . 15441 1 136 . 1 1 51 51 ASN CB C 13 38.74 0.05 . 1 1 . . . 119 ASN CB . 15441 1 137 . 1 1 51 51 ASN N N 15 121.01 0.05 . 1 1 . . . 119 ASN N . 15441 1 138 . 1 1 52 52 ILE H H 1 8.11 0.02 . 1 1 . . . 120 ILE H . 15441 1 139 . 1 1 52 52 ILE CA C 13 58.33 0.05 . 1 1 . . . 120 ILE CA . 15441 1 140 . 1 1 52 52 ILE CB C 13 38.59 0.05 . 1 1 . . . 120 ILE CB . 15441 1 141 . 1 1 52 52 ILE N N 15 123.23 0.05 . 1 1 . . . 120 ILE N . 15441 1 142 . 1 1 54 54 PRO CA C 13 62.49 0.05 . 1 1 . . . 122 PRO CA . 15441 1 143 . 1 1 54 54 PRO CB C 13 31.90 0.05 . 1 1 . . . 122 PRO CB . 15441 1 144 . 1 1 55 55 LYS H H 1 8.45 0.02 . 1 1 . . . 123 LYS H . 15441 1 145 . 1 1 55 55 LYS CA C 13 56.53 0.05 . 1 1 . . . 123 LYS CA . 15441 1 146 . 1 1 55 55 LYS CB C 13 32.84 0.05 . 1 1 . . . 123 LYS CB . 15441 1 147 . 1 1 55 55 LYS N N 15 121.85 0.05 . 1 1 . . . 123 LYS N . 15441 1 148 . 1 1 56 56 GLU H H 1 8.49 0.02 . 1 1 . . . 124 GLU H . 15441 1 149 . 1 1 56 56 GLU CA C 13 56.37 0.05 . 1 1 . . . 124 GLU CA . 15441 1 150 . 1 1 56 56 GLU CB C 13 29.86 0.05 . 1 1 . . . 124 GLU CB . 15441 1 151 . 1 1 56 56 GLU N N 15 122.15 0.05 . 1 1 . . . 124 GLU N . 15441 1 152 . 1 1 57 57 THR H H 1 8.26 0.02 . 1 1 . . . 125 THR H . 15441 1 153 . 1 1 57 57 THR CA C 13 62.17 0.05 . 1 1 . . . 125 THR CA . 15441 1 154 . 1 1 57 57 THR CB C 13 69.70 0.05 . 1 1 . . . 125 THR CB . 15441 1 155 . 1 1 57 57 THR N N 15 116.21 0.05 . 1 1 . . . 125 THR N . 15441 1 156 . 1 1 58 58 LEU H H 1 8.25 0.02 . 1 1 . . . 126 LEU H . 15441 1 157 . 1 1 58 58 LEU CA C 13 55.12 0.05 . 1 1 . . . 126 LEU CA . 15441 1 158 . 1 1 58 58 LEU CB C 13 42.10 0.05 . 1 1 . . . 126 LEU CB . 15441 1 159 . 1 1 58 58 LEU N N 15 125.44 0.05 . 1 1 . . . 126 LEU N . 15441 1 160 . 1 1 59 59 VAL H H 1 8.03 0.02 . 1 1 . . . 127 VAL H . 15441 1 161 . 1 1 59 59 VAL CA C 13 62.17 0.05 . 1 1 . . . 127 VAL CA . 15441 1 162 . 1 1 59 59 VAL CB C 13 32.53 0.05 . 1 1 . . . 127 VAL CB . 15441 1 163 . 1 1 59 59 VAL N N 15 121.08 0.05 . 1 1 . . . 127 VAL N . 15441 1 164 . 1 1 60 60 TYR H H 1 8.35 0.02 . 1 1 . . . 128 TYR H . 15441 1 165 . 1 1 60 60 TYR CA C 13 57.94 0.05 . 1 1 . . . 128 TYR CA . 15441 1 166 . 1 1 60 60 TYR CB C 13 38.96 0.05 . 1 1 . . . 128 TYR CB . 15441 1 167 . 1 1 60 60 TYR N N 15 124.52 0.05 . 1 1 . . . 128 TYR N . 15441 1 168 . 1 1 61 61 THR H H 1 8.08 0.02 . 1 1 . . . 129 THR H . 15441 1 169 . 1 1 61 61 THR CA C 13 61.61 0.05 . 1 1 . . . 129 THR CA . 15441 1 170 . 1 1 61 61 THR CB C 13 69.93 0.05 . 1 1 . . . 129 THR CB . 15441 1 171 . 1 1 61 61 THR N N 15 116.83 0.05 . 1 1 . . . 129 THR N . 15441 1 172 . 1 1 62 62 LYS H H 1 8.31 0.02 . 1 1 . . . 130 LYS H . 15441 1 173 . 1 1 62 62 LYS CA C 13 56.75 0.05 . 1 1 . . . 130 LYS CA . 15441 1 174 . 1 1 62 62 LYS CB C 13 33.07 0.05 . 1 1 . . . 130 LYS CB . 15441 1 175 . 1 1 62 62 LYS N N 15 123.90 0.05 . 1 1 . . . 130 LYS N . 15441 1 176 . 1 1 63 63 GLN H H 1 8.56 0.02 . 1 1 . . . 131 GLN H . 15441 1 177 . 1 1 63 63 GLN CA C 13 56.75 0.05 . 1 1 . . . 131 GLN CA . 15441 1 178 . 1 1 63 63 GLN CB C 13 30.23 0.05 . 1 1 . . . 131 GLN CB . 15441 1 179 . 1 1 63 63 GLN N N 15 121.91 0.05 . 1 1 . . . 131 GLN N . 15441 1 180 . 1 1 64 64 THR H H 1 8.26 0.02 . 1 1 . . . 132 THR H . 15441 1 181 . 1 1 64 64 THR CA C 13 61.93 0.05 . 1 1 . . . 132 THR CA . 15441 1 182 . 1 1 64 64 THR CB C 13 69.77 0.05 . 1 1 . . . 132 THR CB . 15441 1 183 . 1 1 64 64 THR N N 15 115.96 0.05 . 1 1 . . . 132 THR N . 15441 1 184 . 1 1 65 65 GLN H H 1 8.43 0.02 . 1 1 . . . 133 GLN H . 15441 1 185 . 1 1 65 65 GLN CA C 13 56.12 0.05 . 1 1 . . . 133 GLN CA . 15441 1 186 . 1 1 65 65 GLN CB C 13 29.61 0.05 . 1 1 . . . 133 GLN CB . 15441 1 187 . 1 1 65 65 GLN N N 15 122.78 0.05 . 1 1 . . . 133 GLN N . 15441 1 188 . 1 1 66 66 THR H H 1 8.37 0.02 . 1 1 . . . 134 THR H . 15441 1 189 . 1 1 66 66 THR CA C 13 61.93 0.05 . 1 1 . . . 134 THR CA . 15441 1 190 . 1 1 66 66 THR CB C 13 69.77 0.05 . 1 1 . . . 134 THR CB . 15441 1 191 . 1 1 66 66 THR N N 15 115.98 0.05 . 1 1 . . . 134 THR N . 15441 1 192 . 1 1 67 67 THR CA C 13 61.54 0.05 . 1 1 . . . 135 THR CA . 15441 1 193 . 1 1 67 67 THR CB C 13 69.78 0.05 . 1 1 . . . 135 THR CB . 15441 1 194 . 1 1 68 68 SER H H 1 8.49 0.02 . 1 1 . . . 136 SER H . 15441 1 195 . 1 1 68 68 SER CA C 13 58.48 0.05 . 1 1 . . . 136 SER CA . 15441 1 196 . 1 1 68 68 SER CB C 13 63.62 0.05 . 1 1 . . . 136 SER CB . 15441 1 197 . 1 1 68 68 SER N N 15 118.29 0.05 . 1 1 . . . 136 SER N . 15441 1 198 . 1 1 69 69 THR H H 1 8.32 0.02 . 1 1 . . . 137 THR H . 15441 1 199 . 1 1 69 69 THR CA C 13 61.86 0.05 . 1 1 . . . 137 THR CA . 15441 1 200 . 1 1 69 69 THR CB C 13 69.86 0.05 . 1 1 . . . 137 THR CB . 15441 1 201 . 1 1 69 69 THR N N 15 115.56 0.05 . 1 1 . . . 137 THR N . 15441 1 202 . 1 1 70 70 GLY H H 1 8.47 0.02 . 1 1 . . . 138 GLY H . 15441 1 203 . 1 1 70 70 GLY CA C 13 45.45 0.05 . 1 1 . . . 138 GLY CA . 15441 1 204 . 1 1 70 70 GLY N N 15 111.26 0.05 . 1 1 . . . 138 GLY N . 15441 1 205 . 1 1 71 71 GLY H H 1 8.39 0.02 . 1 1 . . . 139 GLY H . 15441 1 206 . 1 1 71 71 GLY CA C 13 44.92 0.05 . 1 1 . . . 139 GLY CA . 15441 1 207 . 1 1 71 71 GLY N N 15 109.03 0.05 . 1 1 . . . 139 GLY N . 15441 1 208 . 1 1 72 72 GLY H H 1 8.42 0.02 . 1 1 . . . 140 GLY H . 15441 1 209 . 1 1 72 72 GLY CA C 13 45.08 0.05 . 1 1 . . . 140 GLY CA . 15441 1 210 . 1 1 72 72 GLY N N 15 109.05 0.05 . 1 1 . . . 140 GLY N . 15441 1 211 . 1 1 73 73 ASN H H 1 8.50 0.02 . 1 1 . . . 141 ASN H . 15441 1 212 . 1 1 73 73 ASN CA C 13 53.14 0.05 . 1 1 . . . 141 ASN CA . 15441 1 213 . 1 1 73 73 ASN CB C 13 39.18 0.05 . 1 1 . . . 141 ASN CB . 15441 1 214 . 1 1 73 73 ASN N N 15 118.52 0.05 . 1 1 . . . 141 ASN N . 15441 1 215 . 1 1 74 74 GLY H H 1 8.47 0.02 . 1 1 . . . 142 GLY H . 15441 1 216 . 1 1 74 74 GLY CA C 13 45.14 0.05 . 1 1 . . . 142 GLY CA . 15441 1 217 . 1 1 74 74 GLY N N 15 110.02 0.05 . 1 1 . . . 142 GLY N . 15441 1 218 . 1 1 75 75 ASP H H 1 7.96 0.02 . 1 1 . . . 143 ASP H . 15441 1 219 . 1 1 75 75 ASP CA C 13 55.81 0.05 . 1 1 . . . 143 ASP CA . 15441 1 220 . 1 1 75 75 ASP CB C 13 42.00 0.05 . 1 1 . . . 143 ASP CB . 15441 1 221 . 1 1 75 75 ASP N N 15 125.84 0.05 . 1 1 . . . 143 ASP N . 15441 1 stop_ save_