################################### # 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 16566 _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 13C-13C DARR' . . . 16566 1 2 '2D 15N-13C DCP' . . . 16566 1 3 '3D 15N-13C-13C DCP-DARR' . . . 16566 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 4 4 THR C C 13 173.5 0.2 . 1 . . . . 4 THR C . 16566 1 2 . 1 1 4 4 THR CA C 13 64.1 0.2 . 1 . . . . 4 THR CA . 16566 1 3 . 1 1 4 4 THR CB C 13 69.4 0.2 . 1 . . . . 4 THR CB . 16566 1 4 . 1 1 4 4 THR CG2 C 13 23.9 0.2 . 1 . . . . 4 THR CG2 . 16566 1 5 . 1 1 5 5 PHE CB C 13 39.3 0.2 . 1 . . . . 5 PHE CB . 16566 1 6 . 1 1 5 5 PHE CG C 13 139.5 0.2 . 1 . . . . 5 PHE CG . 16566 1 7 . 1 1 9 9 GLY C C 13 171.5 0.2 . 1 . . . . 9 GLY C . 16566 1 8 . 1 1 9 9 GLY CA C 13 45.5 0.2 . 1 . . . . 9 GLY CA . 16566 1 9 . 1 1 10 10 ASN CA C 13 51.1 0.2 . 1 . . . . 10 ASN CA . 16566 1 10 . 1 1 10 10 ASN N N 15 124.6 0.3 . 1 . . . . 10 ASN N . 16566 1 11 . 1 1 11 11 PHE CA C 13 56.5 0.2 . 1 . . . . 11 PHE CA . 16566 1 12 . 1 1 14 14 ASN C C 13 172.8 0.2 . 1 . . . . 14 ASN C . 16566 1 13 . 1 1 14 14 ASN CA C 13 52.8 0.2 . 1 . . . . 14 ASN CA . 16566 1 14 . 1 1 15 15 GLY C C 13 171.2 0.2 . 1 . . . . 15 GLY C . 16566 1 15 . 1 1 15 15 GLY CA C 13 42.9 0.2 . 1 . . . . 15 GLY CA . 16566 1 16 . 1 1 16 16 SER C C 13 174.3 0.2 . 1 . . . . 16 SER C . 16566 1 17 . 1 1 16 16 SER CA C 13 55.0 0.2 . 1 . . . . 16 SER CA . 16566 1 18 . 1 1 16 16 SER CB C 13 67.0 0.2 . 1 . . . . 16 SER CB . 16566 1 19 . 1 1 16 16 SER N N 15 115.1 0.3 . 1 . . . . 16 SER N . 16566 1 20 . 1 1 17 17 LYS C C 13 179.8 0.2 . 1 . . . . 17 LYS C . 16566 1 21 . 1 1 17 17 LYS CA C 13 62.2 0.2 . 1 . . . . 17 LYS CA . 16566 1 22 . 1 1 17 17 LYS CB C 13 30.9 0.2 . 1 . . . . 17 LYS CB . 16566 1 23 . 1 1 20 20 ILE CA C 13 65.2 0.2 . 1 . . . . 20 ILE CA . 16566 1 24 . 1 1 20 20 ILE CB C 13 36.8 0.2 . 1 . . . . 20 ILE CB . 16566 1 25 . 1 1 23 23 ILE C C 13 178.9 0.2 . 1 . . . . 23 ILE C . 16566 1 26 . 1 1 23 23 ILE CA C 13 65.6 0.2 . 1 . . . . 23 ILE CA . 16566 1 27 . 1 1 23 23 ILE CB C 13 38.9 0.2 . 1 . . . . 23 ILE CB . 16566 1 28 . 1 1 23 23 ILE CG2 C 13 15.9 0.2 . 1 . . . . 23 ILE CG2 . 16566 1 29 . 1 1 23 23 ILE N N 15 120.7 0.3 . 1 . . . . 23 ILE N . 16566 1 30 . 1 1 28 28 ASN CA C 13 55.2 0.2 . 1 . . . . 28 ASN CA . 16566 1 31 . 1 1 28 28 ASN CB C 13 38.5 0.2 . 1 . . . . 28 ASN CB . 16566 1 32 . 1 1 29 29 THR C C 13 174.2 0.2 . 1 . . . . 29 THR C . 16566 1 33 . 1 1 29 29 THR CA C 13 61.0 0.2 . 1 . . . . 29 THR CA . 16566 1 34 . 1 1 29 29 THR CB C 13 70.0 0.2 . 1 . . . . 29 THR CB . 16566 1 35 . 1 1 29 29 THR CG2 C 13 21.6 0.2 . 1 . . . . 29 THR CG2 . 16566 1 36 . 1 1 29 29 THR N N 15 109.4 0.3 . 1 . . . . 29 THR N . 16566 1 37 . 1 1 30 30 ALA C C 13 177.0 0.2 . 1 . . . . 30 ALA C . 16566 1 38 . 1 1 30 30 ALA CA C 13 52.1 0.2 . 1 . . . . 30 ALA CA . 16566 1 39 . 1 1 30 30 ALA CB C 13 20.2 0.2 . 1 . . . . 30 ALA CB . 16566 1 40 . 1 1 31 31 SER CA C 13 57.5 0.2 . 1 . . . . 31 SER CA . 16566 1 41 . 1 1 31 31 SER CB C 13 62.4 0.2 . 1 . . . . 31 SER CB . 16566 1 42 . 1 1 32 32 ILE CB C 13 42.1 0.2 . 1 . . . . 32 ILE CB . 16566 1 43 . 1 1 32 32 ILE CD1 C 13 14.9 0.2 . 1 . . . . 32 ILE CD1 . 16566 1 44 . 1 1 32 32 ILE CG2 C 13 17.6 0.2 . 1 . . . . 32 ILE CG2 . 16566 1 45 . 1 1 33 33 PRO CA C 13 62.3 0.2 . 1 . . . . 33 PRO CA . 16566 1 46 . 1 1 33 33 PRO CB C 13 32.4 0.2 . 1 . . . . 33 PRO CB . 16566 1 47 . 1 1 34 34 GLU C C 13 177.5 0.2 . 1 . . . . 34 GLU C . 16566 1 48 . 1 1 34 34 GLU CB C 13 30.2 0.2 . 1 . . . . 34 GLU CB . 16566 1 49 . 1 1 34 34 GLU CD C 13 183.9 0.2 . 1 . . . . 34 GLU CD . 16566 1 50 . 1 1 37 37 GLU C C 13 172.7 0.2 . 1 . . . . 37 GLU C . 16566 1 51 . 1 1 37 37 GLU CA C 13 55.7 0.2 . 1 . . . . 37 GLU CA . 16566 1 52 . 1 1 38 38 VAL N N 15 124.3 0.3 . 1 . . . . 38 VAL N . 16566 1 53 . 1 1 43 43 PRO CA C 13 62.7 0.2 . 1 . . . . 43 PRO CA . 16566 1 54 . 1 1 43 43 PRO CB C 13 33.5 0.2 . 1 . . . . 43 PRO CB . 16566 1 55 . 1 1 44 44 ALA C C 13 178.7 0.2 . 1 . . . . 44 ALA C . 16566 1 56 . 1 1 44 44 ALA CA C 13 54.8 0.2 . 1 . . . . 44 ALA CA . 16566 1 57 . 1 1 44 44 ALA CB C 13 17.1 0.2 . 1 . . . . 44 ALA CB . 16566 1 58 . 1 1 45 45 THR CA C 13 64.2 0.2 . 1 . . . . 45 THR CA . 16566 1 59 . 1 1 45 45 THR CB C 13 69.5 0.2 . 1 . . . . 45 THR CB . 16566 1 60 . 1 1 45 45 THR CG2 C 13 21.7 0.2 . 1 . . . . 45 THR CG2 . 16566 1 61 . 1 1 45 45 THR N N 15 111.8 0.3 . 1 . . . . 45 THR N . 16566 1 62 . 1 1 47 47 LEU CA C 13 60.0 0.2 . 1 . . . . 47 LEU CA . 16566 1 63 . 1 1 47 47 LEU CB C 13 43.3 0.2 . 1 . . . . 47 LEU CB . 16566 1 64 . 1 1 49 49 TYR CA C 13 60.4 0.2 . 1 . . . . 49 TYR CA . 16566 1 65 . 1 1 49 49 TYR CB C 13 39.9 0.2 . 1 . . . . 49 TYR CB . 16566 1 66 . 1 1 51 51 VAL C C 13 179.5 0.2 . 1 . . . . 51 VAL C . 16566 1 67 . 1 1 51 51 VAL CA C 13 67.3 0.2 . 1 . . . . 51 VAL CA . 16566 1 68 . 1 1 51 51 VAL CB C 13 31.0 0.2 . 1 . . . . 51 VAL CB . 16566 1 69 . 1 1 53 53 LEU C C 13 178.7 0.2 . 1 . . . . 53 LEU C . 16566 1 70 . 1 1 53 53 LEU CA C 13 55.0 0.2 . 1 . . . . 53 LEU CA . 16566 1 71 . 1 1 53 53 LEU CB C 13 45.3 0.2 . 1 . . . . 53 LEU CB . 16566 1 72 . 1 1 54 54 VAL CA C 13 65.6 0.2 . 1 . . . . 54 VAL CA . 16566 1 73 . 1 1 54 54 VAL CB C 13 32.3 0.2 . 1 . . . . 54 VAL CB . 16566 1 74 . 1 1 56 56 LYS CA C 13 52.6 0.2 . 1 . . . . 56 LYS CA . 16566 1 75 . 1 1 56 56 LYS CB C 13 34.3 0.2 . 1 . . . . 56 LYS CB . 16566 1 76 . 1 1 60 60 THR C C 13 172.6 0.2 . 1 . . . . 60 THR C . 16566 1 77 . 1 1 60 60 THR CA C 13 59.7 0.2 . 1 . . . . 60 THR CA . 16566 1 78 . 1 1 60 60 THR CB C 13 73.1 0.2 . 1 . . . . 60 THR CB . 16566 1 79 . 1 1 60 60 THR CG2 C 13 23.3 0.2 . 1 . . . . 60 THR CG2 . 16566 1 80 . 1 1 62 62 GLY CA C 13 45.0 0.2 . 1 . . . . 62 GLY CA . 16566 1 81 . 1 1 62 62 GLY N N 15 114.2 0.3 . 1 . . . . 62 GLY N . 16566 1 82 . 1 1 63 63 ALA C C 13 178.3 0.2 . 1 . . . . 63 ALA C . 16566 1 83 . 1 1 63 63 ALA CA C 13 48.6 0.2 . 1 . . . . 63 ALA CA . 16566 1 84 . 1 1 63 63 ALA CB C 13 23.2 0.2 . 1 . . . . 63 ALA CB . 16566 1 85 . 1 1 63 63 ALA N N 15 117.3 0.3 . 1 . . . . 63 ALA N . 16566 1 86 . 1 1 64 64 GLN C C 13 173.5 0.2 . 1 . . . . 64 GLN C . 16566 1 87 . 1 1 65 65 ASN C C 13 173.5 0.2 . 1 . . . . 65 ASN C . 16566 1 88 . 1 1 65 65 ASN CA C 13 53.2 0.2 . 1 . . . . 65 ASN CA . 16566 1 89 . 1 1 65 65 ASN N N 15 104.7 0.3 . 1 . . . . 65 ASN N . 16566 1 90 . 1 1 66 66 ALA C C 13 174.4 0.2 . 1 . . . . 66 ALA C . 16566 1 91 . 1 1 66 66 ALA CA C 13 52.0 0.2 . 1 . . . . 66 ALA CA . 16566 1 92 . 1 1 66 66 ALA CB C 13 21.8 0.2 . 1 . . . . 66 ALA CB . 16566 1 93 . 1 1 68 68 LEU C C 13 171.0 0.2 . 1 . . . . 68 LEU C . 16566 1 94 . 1 1 68 68 LEU CA C 13 53.8 0.2 . 1 . . . . 68 LEU CA . 16566 1 95 . 1 1 68 68 LEU CB C 13 38.8 0.2 . 1 . . . . 68 LEU CB . 16566 1 96 . 1 1 69 69 LYS CB C 13 36.4 0.2 . 1 . . . . 69 LYS CB . 16566 1 97 . 1 1 69 69 LYS CA C 13 53.3 0.2 . 1 . . . . 69 LYS CA . 16566 1 98 . 1 1 69 69 LYS N N 15 112.3 0.3 . 1 . . . . 69 LYS N . 16566 1 99 . 1 1 70 70 ALA C C 13 178.2 0.2 . 1 . . . . 70 ALA C . 16566 1 100 . 1 1 70 70 ALA CA C 13 53.1 0.2 . 1 . . . . 70 ALA CA . 16566 1 101 . 1 1 70 70 ALA CB C 13 20.3 0.2 . 1 . . . . 70 ALA CB . 16566 1 102 . 1 1 71 71 SER C C 13 172.7 0.2 . 1 . . . . 71 SER C . 16566 1 103 . 1 1 71 71 SER CA C 13 56.2 0.2 . 1 . . . . 71 SER CA . 16566 1 104 . 1 1 71 71 SER CB C 13 65.8 0.2 . 1 . . . . 71 SER CB . 16566 1 105 . 1 1 73 73 ALA C C 13 174.3 0.2 . 1 . . . . 73 ALA C . 16566 1 106 . 1 1 73 73 ALA CA C 13 50.7 0.2 . 1 . . . . 73 ALA CA . 16566 1 107 . 1 1 73 73 ALA CB C 13 15.5 0.2 . 1 . . . . 73 ALA CB . 16566 1 108 . 1 1 74 74 PHE CA C 13 54.1 0.2 . 1 . . . . 74 PHE CA . 16566 1 109 . 1 1 74 74 PHE CB C 13 38.8 0.2 . 1 . . . . 74 PHE CB . 16566 1 110 . 1 1 75 75 THR C C 13 175.8 0.2 . 1 . . . . 75 THR C . 16566 1 111 . 1 1 75 75 THR CA C 13 66.9 0.2 . 1 . . . . 75 THR CA . 16566 1 112 . 1 1 75 75 THR CB C 13 70.1 0.2 . 1 . . . . 75 THR CB . 16566 1 113 . 1 1 75 75 THR CG2 C 13 21.1 0.2 . 1 . . . . 75 THR CG2 . 16566 1 114 . 1 1 76 76 GLY CA C 13 46.2 0.2 . 1 . . . . 76 GLY CA . 16566 1 115 . 1 1 76 76 GLY N N 15 111.4 0.3 . 1 . . . . 76 GLY N . 16566 1 116 . 1 1 77 77 GLU C C 13 175.7 0.2 . 1 . . . . 77 GLU C . 16566 1 117 . 1 1 77 77 GLU CB C 13 32.4 0.2 . 1 . . . . 77 GLU CB . 16566 1 118 . 1 1 78 78 ASN CA C 13 51.1 0.2 . 1 . . . . 78 ASN CA . 16566 1 119 . 1 1 78 78 ASN CB C 13 38.5 0.2 . 1 . . . . 78 ASN CB . 16566 1 120 . 1 1 79 79 SER CA C 13 52.9 0.2 . 1 . . . . 79 SER CA . 16566 1 121 . 1 1 79 79 SER CB C 13 64.6 0.2 . 1 . . . . 79 SER CB . 16566 1 122 . 1 1 83 83 ILE CA C 13 65.4 0.2 . 1 . . . . 83 ILE CA . 16566 1 123 . 1 1 83 83 ILE CB C 13 38.1 0.2 . 1 . . . . 83 ILE CB . 16566 1 124 . 1 1 88 88 ALA CA C 13 51.9 0.2 . 1 . . . . 88 ALA CA . 16566 1 125 . 1 1 88 88 ALA CB C 13 20.0 0.2 . 1 . . . . 88 ALA CB . 16566 1 126 . 1 1 93 93 LEU CA C 13 53.0 0.2 . 1 . . . . 93 LEU CA . 16566 1 127 . 1 1 93 93 LEU CB C 13 46.1 0.2 . 1 . . . . 93 LEU CB . 16566 1 128 . 1 1 94 94 GLY C C 13 173.3 0.2 . 1 . . . . 94 GLY C . 16566 1 129 . 1 1 94 94 GLY CA C 13 45.4 0.2 . 1 . . . . 94 GLY CA . 16566 1 130 . 1 1 95 95 HIS CB C 13 31.6 0.2 . 1 . . . . 95 HIS CB . 16566 1 131 . 1 1 95 95 HIS CD2 C 13 117.4 0.2 . 1 . . . . 95 HIS CD2 . 16566 1 132 . 1 1 95 95 HIS CE1 C 13 137.4 0.2 . 1 . . . . 95 HIS CE1 . 16566 1 133 . 1 1 99 99 ARG CA C 13 59.1 0.2 . 1 . . . . 99 ARG CA . 16566 1 134 . 1 1 99 99 ARG CB C 13 30.2 0.2 . 1 . . . . 99 ARG CB . 16566 1 135 . 1 1 100 100 SER CA C 13 59.0 0.2 . 1 . . . . 100 SER CA . 16566 1 136 . 1 1 100 100 SER CB C 13 63.0 0.2 . 1 . . . . 100 SER CB . 16566 1 137 . 1 1 101 101 TYR CA C 13 60.0 0.2 . 1 . . . . 101 TYR CA . 16566 1 138 . 1 1 101 101 TYR CB C 13 38.3 0.2 . 1 . . . . 101 TYR CB . 16566 1 139 . 1 1 102 102 PHE CA C 13 57.3 0.2 . 1 . . . . 102 PHE CA . 16566 1 140 . 1 1 102 102 PHE CB C 13 38.8 0.2 . 1 . . . . 102 PHE CB . 16566 1 141 . 1 1 103 103 HIS C C 13 174.3 0.2 . 1 . . . . 103 HIS C . 16566 1 142 . 1 1 103 103 HIS CB C 13 26.2 0.2 . 1 . . . . 103 HIS CB . 16566 1 143 . 1 1 103 103 HIS CD2 C 13 118.3 0.2 . 1 . . . . 103 HIS CD2 . 16566 1 144 . 1 1 103 103 HIS CG C 13 132.9 0.2 . 1 . . . . 103 HIS CG . 16566 1 145 . 1 1 104 104 GLU C C 13 175.2 0.2 . 1 . . . . 104 GLU C . 16566 1 146 . 1 1 104 104 GLU CA C 13 58.7 0.2 . 1 . . . . 104 GLU CA . 16566 1 147 . 1 1 104 104 GLU CB C 13 29.0 0.2 . 1 . . . . 104 GLU CB . 16566 1 148 . 1 1 104 104 GLU CD C 13 182.1 0.2 . 1 . . . . 104 GLU CD . 16566 1 149 . 1 1 104 104 GLU CG C 13 38.2 0.2 . 1 . . . . 104 GLU CG . 16566 1 150 . 1 1 105 105 ASP CB C 13 42.9 0.2 . 1 . . . . 105 ASP CB . 16566 1 151 . 1 1 105 105 ASP CA C 13 51.8 0.2 . 1 . . . . 105 ASP CA . 16566 1 152 . 1 1 109 109 ILE C C 13 179.5 0.2 . 1 . . . . 109 ILE C . 16566 1 153 . 1 1 109 109 ILE CA C 13 64.4 0.2 . 1 . . . . 109 ILE CA . 16566 1 154 . 1 1 109 109 ILE CB C 13 37.3 0.2 . 1 . . . . 109 ILE CB . 16566 1 155 . 1 1 110 110 ALA C C 13 178.8 0.2 . 1 . . . . 110 ALA C . 16566 1 156 . 1 1 110 110 ALA CA C 13 56.3 0.2 . 1 . . . . 110 ALA CA . 16566 1 157 . 1 1 110 110 ALA CB C 13 19.6 0.2 . 1 . . . . 110 ALA CB . 16566 1 158 . 1 1 110 110 ALA N N 15 127.8 0.3 . 1 . . . . 110 ALA N . 16566 1 159 . 1 1 111 111 ASP C C 13 181.2 0.2 . 1 . . . . 111 ASP C . 16566 1 160 . 1 1 111 111 ASP CB C 13 40.7 0.2 . 1 . . . . 111 ASP CB . 16566 1 161 . 1 1 117 117 LEU C C 13 183.2 0.2 . 1 . . . . 117 LEU C . 16566 1 162 . 1 1 117 117 LEU CA C 13 56.6 0.2 . 1 . . . . 117 LEU CA . 16566 1 163 . 1 1 117 117 LEU CB C 13 42.1 0.2 . 1 . . . . 117 LEU CB . 16566 1 164 . 1 1 118 118 GLY N N 15 108.5 0.3 . 1 . . . . 118 GLY N . 16566 1 165 . 1 1 119 119 GLN CA C 13 53.7 0.2 . 1 . . . . 119 GLN CA . 16566 1 166 . 1 1 119 119 GLN CB C 13 30.1 0.2 . 1 . . . . 119 GLN CB . 16566 1 167 . 1 1 123 123 VAL CA C 13 59.6 0.2 . 1 . . . . 123 VAL CA . 16566 1 168 . 1 1 123 123 VAL CB C 13 36.7 0.2 . 1 . . . . 123 VAL CB . 16566 1 169 . 1 1 127 127 ILE CA C 13 59.6 0.2 . 1 . . . . 127 ILE CA . 16566 1 170 . 1 1 127 127 ILE CB C 13 42.0 0.2 . 1 . . . . 127 ILE CB . 16566 1 171 . 1 1 128 128 GLY C C 13 172.1 0.2 . 1 . . . . 128 GLY C . 16566 1 172 . 1 1 128 128 GLY CA C 13 46.1 0.2 . 1 . . . . 128 GLY CA . 16566 1 173 . 1 1 129 129 GLU CA C 13 54.9 0.2 . 1 . . . . 129 GLU CA . 16566 1 174 . 1 1 129 129 GLU CB C 13 31.0 0.2 . 1 . . . . 129 GLU CB . 16566 1 175 . 1 1 130 130 THR C C 13 176.2 0.2 . 1 . . . . 130 THR C . 16566 1 176 . 1 1 130 130 THR CA C 13 60.8 0.2 . 1 . . . . 130 THR CA . 16566 1 177 . 1 1 130 130 THR CB C 13 71.5 0.2 . 1 . . . . 130 THR CB . 16566 1 178 . 1 1 130 130 THR CG2 C 13 21.9 0.2 . 1 . . . . 130 THR CG2 . 16566 1 179 . 1 1 134 134 LYS C C 13 181.5 0.2 . 1 . . . . 134 LYS C . 16566 1 180 . 1 1 135 135 LYS N N 15 121.4 0.3 . 1 . . . . 135 LYS N . 16566 1 181 . 1 1 136 136 ALA C C 13 177.4 0.2 . 1 . . . . 136 ALA C . 16566 1 182 . 1 1 136 136 ALA CA C 13 51.9 0.2 . 1 . . . . 136 ALA CA . 16566 1 183 . 1 1 136 136 ALA CB C 13 19.2 0.2 . 1 . . . . 136 ALA CB . 16566 1 184 . 1 1 137 137 GLY C C 13 176.5 0.2 . 1 . . . . 137 GLY C . 16566 1 185 . 1 1 137 137 GLY CA C 13 45.9 0.2 . 1 . . . . 137 GLY CA . 16566 1 186 . 1 1 142 142 VAL CA C 13 67.0 0.2 . 1 . . . . 142 VAL CA . 16566 1 187 . 1 1 142 142 VAL CB C 13 31.7 0.2 . 1 . . . . 142 VAL CB . 16566 1 188 . 1 1 146 146 GLN CD C 13 182.4 0.2 . 1 . . . . 146 GLN CD . 16566 1 189 . 1 1 146 146 GLN CA C 13 59.4 0.2 . 1 . . . . 146 GLN CA . 16566 1 190 . 1 1 146 146 GLN CB C 13 29.3 0.2 . 1 . . . . 146 GLN CB . 16566 1 191 . 1 1 147 147 LEU CA C 13 57.7 0.2 . 1 . . . . 147 LEU CA . 16566 1 192 . 1 1 147 147 LEU CB C 13 42.7 0.2 . 1 . . . . 147 LEU CB . 16566 1 193 . 1 1 148 148 ASN CA C 13 56.1 0.2 . 1 . . . . 148 ASN CA . 16566 1 194 . 1 1 148 148 ASN CB C 13 38.3 0.2 . 1 . . . . 148 ASN CB . 16566 1 195 . 1 1 149 149 ALA C C 13 179.2 0.2 . 1 . . . . 149 ALA C . 16566 1 196 . 1 1 149 149 ALA CB C 13 18.5 0.2 . 1 . . . . 149 ALA CB . 16566 1 197 . 1 1 156 156 ASP CA C 13 52.3 0.2 . 1 . . . . 156 ASP CA . 16566 1 198 . 1 1 156 156 ASP CB C 13 42.1 0.2 . 1 . . . . 156 ASP CB . 16566 1 199 . 1 1 158 158 THR C C 13 175.5 0.2 . 1 . . . . 158 THR C . 16566 1 200 . 1 1 158 158 THR CA C 13 67.7 0.2 . 1 . . . . 158 THR CA . 16566 1 201 . 1 1 158 158 THR CB C 13 69.1 0.2 . 1 . . . . 158 THR CB . 16566 1 202 . 1 1 158 158 THR CG2 C 13 21.1 0.2 . 1 . . . . 158 THR CG2 . 16566 1 203 . 1 1 159 159 ASN CA C 13 52.0 0.2 . 1 . . . . 159 ASN CA . 16566 1 204 . 1 1 159 159 ASN CB C 13 38.3 0.2 . 1 . . . . 159 ASN CB . 16566 1 205 . 1 1 163 163 ALA C C 13 174.0 0.2 . 1 . . . . 163 ALA C . 16566 1 206 . 1 1 163 163 ALA CA C 13 49.9 0.2 . 1 . . . . 163 ALA CA . 16566 1 207 . 1 1 163 163 ALA CB C 13 20.8 0.2 . 1 . . . . 163 ALA CB . 16566 1 208 . 1 1 163 163 ALA N N 15 131.2 0.3 . 1 . . . . 163 ALA N . 16566 1 209 . 1 1 168 168 TRP CA C 13 56.3 0.2 . 1 . . . . 168 TRP CA . 16566 1 210 . 1 1 168 168 TRP CB C 13 28.7 0.2 . 1 . . . . 168 TRP CB . 16566 1 211 . 1 1 168 168 TRP CD1 C 13 126.2 0.3 . 1 . . . . 168 TRP CD1 . 16566 1 212 . 1 1 169 169 ALA CA C 13 51.8 0.2 . 1 . . . . 169 ALA CA . 16566 1 213 . 1 1 169 169 ALA CB C 13 18.2 0.2 . 1 . . . . 169 ALA CB . 16566 1 214 . 1 1 170 170 ILE CA C 13 60.6 0.2 . 1 . . . . 170 ILE CA . 16566 1 215 . 1 1 170 170 ILE CB C 13 37.1 0.2 . 1 . . . . 170 ILE CB . 16566 1 216 . 1 1 172 172 THR C C 13 175.1 0.2 . 1 . . . . 172 THR C . 16566 1 217 . 1 1 172 172 THR CA C 13 61.7 0.2 . 1 . . . . 172 THR CA . 16566 1 218 . 1 1 172 172 THR CB C 13 71.1 0.2 . 1 . . . . 172 THR CB . 16566 1 219 . 1 1 172 172 THR CG2 C 13 22.0 0.2 . 1 . . . . 172 THR CG2 . 16566 1 220 . 1 1 172 172 THR N N 15 108.0 0.3 . 1 . . . . 172 THR N . 16566 1 221 . 1 1 173 173 GLY CA C 13 44.8 0.2 . 1 . . . . 173 GLY CA . 16566 1 222 . 1 1 175 175 ALA C C 13 177.3 0.2 . 1 . . . . 175 ALA C . 16566 1 223 . 1 1 175 175 ALA CA C 13 51.9 0.2 . 1 . . . . 175 ALA CA . 16566 1 224 . 1 1 175 175 ALA CB C 13 21.4 0.2 . 1 . . . . 175 ALA CB . 16566 1 225 . 1 1 176 176 ALA C C 13 179.9 0.2 . 1 . . . . 176 ALA C . 16566 1 226 . 1 1 176 176 ALA CA C 13 51.2 0.2 . 1 . . . . 176 ALA CA . 16566 1 227 . 1 1 176 176 ALA CB C 13 20.3 0.2 . 1 . . . . 176 ALA CB . 16566 1 228 . 1 1 177 177 THR CA C 13 59.3 0.2 . 1 . . . . 177 THR CA . 16566 1 229 . 1 1 177 177 THR CB C 13 68.5 0.2 . 1 . . . . 177 THR CB . 16566 1 230 . 1 1 177 177 THR CG2 C 13 22.9 0.2 . 1 . . . . 177 THR CG2 . 16566 1 231 . 1 1 184 184 ILE CA C 13 62.5 0.2 . 1 . . . . 184 ILE CA . 16566 1 232 . 1 1 184 184 ILE CB C 13 37.4 0.2 . 1 . . . . 184 ILE CB . 16566 1 233 . 1 1 184 184 ILE CG1 C 13 29.4 0.2 . 1 . . . . 184 ILE CG1 . 16566 1 234 . 1 1 185 185 HIS CB C 13 28.8 0.2 . 1 . . . . 185 HIS CB . 16566 1 235 . 1 1 185 185 HIS CD2 C 13 119.3 0.2 . 1 . . . . 185 HIS CD2 . 16566 1 236 . 1 1 185 185 HIS CG C 13 128.9 0.2 . 1 . . . . 185 HIS CG . 16566 1 237 . 1 1 186 186 ALA C C 13 181.6 0.2 . 1 . . . . 186 ALA C . 16566 1 238 . 1 1 186 186 ALA CA C 13 55.5 0.2 . 1 . . . . 186 ALA CA . 16566 1 239 . 1 1 186 186 ALA CB C 13 17.8 0.2 . 1 . . . . 186 ALA CB . 16566 1 240 . 1 1 187 187 SER CA C 13 63.0 0.2 . 1 . . . . 187 SER CA . 16566 1 241 . 1 1 187 187 SER CB C 13 64.3 0.2 . 1 . . . . 187 SER CB . 16566 1 242 . 1 1 193 193 ALA C C 13 180.7 0.2 . 1 . . . . 193 ALA C . 16566 1 243 . 1 1 193 193 ALA CA C 13 54.5 0.2 . 1 . . . . 193 ALA CA . 16566 1 244 . 1 1 193 193 ALA CB C 13 17.3 0.2 . 1 . . . . 193 ALA CB . 16566 1 245 . 1 1 199 199 LYS C C 13 179.5 0.2 . 1 . . . . 199 LYS C . 16566 1 246 . 1 1 199 199 LYS CB C 13 31.5 0.2 . 1 . . . . 199 LYS CB . 16566 1 247 . 1 1 200 200 ALA C C 13 181.8 0.2 . 1 . . . . 200 ALA C . 16566 1 248 . 1 1 200 200 ALA CA C 13 54.8 0.2 . 1 . . . . 200 ALA CA . 16566 1 249 . 1 1 200 200 ALA CB C 13 19.2 0.2 . 1 . . . . 200 ALA CB . 16566 1 250 . 1 1 201 201 ALA C C 13 178.3 0.2 . 1 . . . . 201 ALA C . 16566 1 251 . 1 1 201 201 ALA CB C 13 17.8 0.2 . 1 . . . . 201 ALA CB . 16566 1 252 . 1 1 203 203 GLU C C 13 175.8 0.2 . 1 . . . . 203 GLU C . 16566 1 253 . 1 1 203 203 GLU CA C 13 56.4 0.2 . 1 . . . . 203 GLU CA . 16566 1 254 . 1 1 203 203 GLU CB C 13 30.7 0.2 . 1 . . . . 203 GLU CB . 16566 1 255 . 1 1 203 203 GLU CD C 13 183.7 0.2 . 1 . . . . 203 GLU CD . 16566 1 256 . 1 1 204 204 LEU CA C 13 54.9 0.2 . 1 . . . . 204 LEU CA . 16566 1 257 . 1 1 204 204 LEU CB C 13 43.7 0.2 . 1 . . . . 204 LEU CB . 16566 1 258 . 1 1 209 209 GLY C C 13 170.0 0.2 . 1 . . . . 209 GLY C . 16566 1 259 . 1 1 209 209 GLY CA C 13 44.6 0.2 . 1 . . . . 209 GLY CA . 16566 1 260 . 1 1 210 210 GLY C C 13 176.8 0.2 . 1 . . . . 210 GLY C . 16566 1 261 . 1 1 210 210 GLY CA C 13 48.5 0.2 . 1 . . . . 210 GLY CA . 16566 1 262 . 1 1 210 210 GLY N N 15 122.2 0.3 . 1 . . . . 210 GLY N . 16566 1 263 . 1 1 211 211 SER CA C 13 59.3 0.2 . 1 . . . . 211 SER CA . 16566 1 264 . 1 1 211 211 SER CB C 13 61.7 0.2 . 1 . . . . 211 SER CB . 16566 1 265 . 1 1 212 212 ALA CA C 13 51.2 0.2 . 1 . . . . 212 ALA CA . 16566 1 266 . 1 1 212 212 ALA CB C 13 20.6 0.2 . 1 . . . . 212 ALA CB . 16566 1 267 . 1 1 213 213 ASN CA C 13 52.0 0.2 . 1 . . . . 213 ASN CA . 16566 1 268 . 1 1 213 213 ASN CB C 13 39.6 0.2 . 1 . . . . 213 ASN CB . 16566 1 269 . 1 1 217 217 ALA C C 13 181.6 0.2 . 1 . . . . 217 ALA C . 16566 1 270 . 1 1 217 217 ALA CA C 13 57.1 0.2 . 1 . . . . 217 ALA CA . 16566 1 271 . 1 1 217 217 ALA CB C 13 17.5 0.2 . 1 . . . . 217 ALA CB . 16566 1 272 . 1 1 219 219 THR CA C 13 63.9 0.2 . 1 . . . . 219 THR CA . 16566 1 273 . 1 1 219 219 THR CB C 13 68.6 0.2 . 1 . . . . 219 THR CB . 16566 1 274 . 1 1 219 219 THR CG2 C 13 22.3 0.2 . 1 . . . . 219 THR CG2 . 16566 1 275 . 1 1 223 223 LYS C C 13 176.6 0.2 . 1 . . . . 223 LYS C . 16566 1 276 . 1 1 223 223 LYS CA C 13 53.6 0.2 . 1 . . . . 223 LYS CA . 16566 1 277 . 1 1 223 223 LYS CB C 13 28.4 0.2 . 1 . . . . 223 LYS CB . 16566 1 278 . 1 1 224 224 ALA C C 13 178.0 0.2 . 1 . . . . 224 ALA C . 16566 1 279 . 1 1 224 224 ALA CA C 13 54.9 0.2 . 1 . . . . 224 ALA CA . 16566 1 280 . 1 1 224 224 ALA CB C 13 19.9 0.2 . 1 . . . . 224 ALA CB . 16566 1 281 . 1 1 224 224 ALA N N 15 129.2 0.3 . 1 . . . . 224 ALA N . 16566 1 282 . 1 1 226 226 VAL C C 13 175.3 0.2 . 1 . . . . 226 VAL C . 16566 1 283 . 1 1 226 226 VAL CB C 13 30.9 0.2 . 1 . . . . 226 VAL CB . 16566 1 284 . 1 1 227 227 ASP C C 13 173.4 0.2 . 1 . . . . 227 ASP C . 16566 1 285 . 1 1 228 228 GLY C C 13 171.8 0.2 . 1 . . . . 228 GLY C . 16566 1 286 . 1 1 228 228 GLY CA C 13 44.4 0.2 . 1 . . . . 228 GLY CA . 16566 1 287 . 1 1 228 228 GLY N N 15 102.5 0.3 . 1 . . . . 228 GLY N . 16566 1 288 . 1 1 229 229 PHE CB C 13 45.9 0.2 . 1 . . . . 229 PHE CB . 16566 1 289 . 1 1 229 229 PHE CG C 13 139.0 0.2 . 1 . . . . 229 PHE CG . 16566 1 290 . 1 1 229 229 PHE N N 15 112.9 0.3 . 1 . . . . 229 PHE N . 16566 1 291 . 1 1 232 232 GLY C C 13 175.2 0.2 . 1 . . . . 232 GLY C . 16566 1 292 . 1 1 232 232 GLY CA C 13 44.0 0.2 . 1 . . . . 232 GLY CA . 16566 1 293 . 1 1 234 234 ALA C C 13 178.1 0.2 . 1 . . . . 234 ALA C . 16566 1 294 . 1 1 234 234 ALA CA C 13 54.6 0.2 . 1 . . . . 234 ALA CA . 16566 1 295 . 1 1 234 234 ALA CB C 13 17.3 0.2 . 1 . . . . 234 ALA CB . 16566 1 296 . 1 1 235 235 SER C C 13 173.4 0.2 . 1 . . . . 235 SER C . 16566 1 297 . 1 1 235 235 SER CB C 13 64.3 0.2 . 1 . . . . 235 SER CB . 16566 1 298 . 1 1 238 238 PRO C C 13 178.4 0.2 . 1 . . . . 238 PRO C . 16566 1 299 . 1 1 238 238 PRO CA C 13 65.9 0.2 . 1 . . . . 238 PRO CA . 16566 1 300 . 1 1 238 238 PRO CB C 13 31.4 0.2 . 1 . . . . 238 PRO CB . 16566 1 301 . 1 1 239 239 GLU C C 13 176.2 0.2 . 1 . . . . 239 GLU C . 16566 1 302 . 1 1 239 239 GLU CB C 13 30.0 0.2 . 1 . . . . 239 GLU CB . 16566 1 303 . 1 1 239 239 GLU CD C 13 182.5 0.2 . 1 . . . . 239 GLU CD . 16566 1 304 . 1 1 243 243 ILE C C 13 179.8 0.2 . 1 . . . . 243 ILE C . 16566 1 305 . 1 1 243 243 ILE CA C 13 66.2 0.2 . 1 . . . . 243 ILE CA . 16566 1 306 . 1 1 243 243 ILE CB C 13 37.7 0.2 . 1 . . . . 243 ILE CB . 16566 1 307 . 1 1 244 244 ILE CA C 13 65.7 0.2 . 1 . . . . 244 ILE CA . 16566 1 308 . 1 1 244 244 ILE CB C 13 37.6 0.2 . 1 . . . . 244 ILE CB . 16566 1 309 . 1 1 245 245 ASN CA C 13 54.2 0.2 . 1 . . . . 245 ASN CA . 16566 1 310 . 1 1 245 245 ASN CB C 13 39.8 0.2 . 1 . . . . 245 ASN CB . 16566 1 311 . 1 1 246 246 SER CA C 13 61.9 0.2 . 1 . . . . 246 SER CA . 16566 1 312 . 1 1 246 246 SER CB C 13 64.0 0.2 . 1 . . . . 246 SER CB . 16566 1 313 . 1 1 247 247 ARG CA C 13 55.0 0.2 . 1 . . . . 247 ARG CA . 16566 1 314 . 1 1 247 247 ARG CB C 13 29.1 0.2 . 1 . . . . 247 ARG CB . 16566 1 315 . 1 1 248 248 ASN CA C 13 55.0 0.2 . 1 . . . . 248 ASN CA . 16566 1 316 . 1 1 248 248 ASN CB C 13 38.9 0.2 . 1 . . . . 248 ASN CB . 16566 1 stop_ save_