################################### # 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_EPPH-Assignments _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode EPPH-Assignments _Assigned_chem_shift_list.Entry_ID 19948 _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' . . . 19948 1 2 '3D HNCO' . . . 19948 1 3 '3D HN(CA)CO' . . . 19948 1 4 '3D CBCA(CO)NH' . . . 19948 1 5 '3D HNCACB' . . . 19948 1 6 '3D HACAN' . . . 19948 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.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 3 3 GLY H H 1 8.48 0.02 . 1 . . . . . 3 GLY H . 19948 1 2 . 1 1 3 3 GLY C C 13 174.8 0.3 . 1 . . . . . 3 GLY C . 19948 1 3 . 1 1 3 3 GLY CA C 13 45.2 0.3 . 1 . . . . . 3 GLY CA . 19948 1 4 . 1 1 3 3 GLY N N 15 112.7 0.3 . 1 . . . . . 3 GLY N . 19948 1 5 . 1 1 4 4 ARG H H 1 8.12 0.02 . 1 . . . . . 4 ARG H . 19948 1 6 . 1 1 4 4 ARG C C 13 176.9 0.3 . 1 . . . . . 4 ARG C . 19948 1 7 . 1 1 4 4 ARG CA C 13 56.1 0.3 . 1 . . . . . 4 ARG CA . 19948 1 8 . 1 1 4 4 ARG CB C 13 30.8 0.3 . 1 . . . . . 4 ARG CB . 19948 1 9 . 1 1 4 4 ARG N N 15 120.7 0.3 . 1 . . . . . 4 ARG N . 19948 1 10 . 1 1 5 5 PHE H H 1 8.26 0.02 . 1 . . . . . 5 PHE H . 19948 1 11 . 1 1 5 5 PHE C C 13 176.3 0.3 . 1 . . . . . 5 PHE C . 19948 1 12 . 1 1 5 5 PHE CA C 13 57.6 0.3 . 1 . . . . . 5 PHE CA . 19948 1 13 . 1 1 5 5 PHE CB C 13 39.7 0.3 . 1 . . . . . 5 PHE CB . 19948 1 14 . 1 1 5 5 PHE N N 15 120.8 0.3 . 1 . . . . . 5 PHE N . 19948 1 15 . 1 1 6 6 PHE H H 1 8.26 0.02 . 1 . . . . . 6 PHE H . 19948 1 16 . 1 1 6 6 PHE C C 13 176.4 0.3 . 1 . . . . . 6 PHE C . 19948 1 17 . 1 1 6 6 PHE CA C 13 57.7 0.3 . 1 . . . . . 6 PHE CA . 19948 1 18 . 1 1 6 6 PHE CB C 13 39.8 0.3 . 1 . . . . . 6 PHE CB . 19948 1 19 . 1 1 6 6 PHE N N 15 122.3 0.3 . 1 . . . . . 6 PHE N . 19948 1 20 . 1 1 7 7 SER H H 1 8.30 0.02 . 1 . . . . . 7 SER H . 19948 1 21 . 1 1 7 7 SER C C 13 176.4 0.3 . 1 . . . . . 7 SER C . 19948 1 22 . 1 1 7 7 SER CA C 13 58.2 0.3 . 1 . . . . . 7 SER CA . 19948 1 23 . 1 1 7 7 SER CB C 13 63.9 0.3 . 1 . . . . . 7 SER CB . 19948 1 24 . 1 1 7 7 SER N N 15 118.2 0.3 . 1 . . . . . 7 SER N . 19948 1 25 . 1 1 8 8 GLY H H 1 7.84 0.02 . 1 . . . . . 8 GLY H . 19948 1 26 . 1 1 8 8 GLY C C 13 174.8 0.3 . 1 . . . . . 8 GLY C . 19948 1 27 . 1 1 8 8 GLY CA C 13 45.4 0.3 . 1 . . . . . 8 GLY CA . 19948 1 28 . 1 1 8 8 GLY N N 15 110.2 0.3 . 1 . . . . . 8 GLY N . 19948 1 29 . 1 1 9 9 ASP H H 1 8.24 0.02 . 1 . . . . . 9 ASP H . 19948 1 30 . 1 1 9 9 ASP C C 13 177.7 0.3 . 1 . . . . . 9 ASP C . 19948 1 31 . 1 1 9 9 ASP CA C 13 54.4 0.3 . 1 . . . . . 9 ASP CA . 19948 1 32 . 1 1 9 9 ASP CB C 13 41.3 0.3 . 1 . . . . . 9 ASP CB . 19948 1 33 . 1 1 9 9 ASP N N 15 120.5 0.3 . 1 . . . . . 9 ASP N . 19948 1 34 . 1 1 10 10 ARG H H 1 8.41 0.02 . 1 . . . . . 10 ARG H . 19948 1 35 . 1 1 10 10 ARG C C 13 177.8 0.3 . 1 . . . . . 10 ARG C . 19948 1 36 . 1 1 10 10 ARG CA C 13 56.3 0.3 . 1 . . . . . 10 ARG CA . 19948 1 37 . 1 1 10 10 ARG CB C 13 30.3 0.3 . 1 . . . . . 10 ARG CB . 19948 1 38 . 1 1 10 10 ARG N N 15 121.6 0.3 . 1 . . . . . 10 ARG N . 19948 1 39 . 1 1 11 11 GLY H H 1 8.43 0.02 . 1 . . . . . 11 GLY H . 19948 1 40 . 1 1 11 11 GLY C C 13 174.5 0.3 . 1 . . . . . 11 GLY C . 19948 1 41 . 1 1 11 11 GLY CA C 13 45.2 0.3 . 1 . . . . . 11 GLY CA . 19948 1 42 . 1 1 11 11 GLY N N 15 109.4 0.3 . 1 . . . . . 11 GLY N . 19948 1 43 . 1 1 12 12 ALA H H 1 8.04 0.02 . 1 . . . . . 12 ALA H . 19948 1 44 . 1 1 12 12 ALA C C 13 176.5 0.3 . 1 . . . . . 12 ALA C . 19948 1 45 . 1 1 12 12 ALA CA C 13 50.5 0.3 . 1 . . . . . 12 ALA CA . 19948 1 46 . 1 1 12 12 ALA CB C 13 18.2 0.3 . 1 . . . . . 12 ALA CB . 19948 1 47 . 1 1 12 12 ALA N N 15 124.6 0.3 . 1 . . . . . 12 ALA N . 19948 1 48 . 1 1 13 13 PRO HA H 1 4.43 0.02 . 1 . . . . . 13 PRO HA . 19948 1 49 . 1 1 13 13 PRO CA C 13 63.1 0.3 . 1 . . . . . 13 PRO CA . 19948 1 50 . 1 1 13 13 PRO N N 15 135.7 0.3 . 1 . . . . . 13 PRO N . 19948 1 51 . 1 1 14 14 LYS H H 1 8.48 0.02 . 1 . . . . . 14 LYS H . 19948 1 52 . 1 1 14 14 LYS C C 13 174.2 0.3 . 1 . . . . . 14 LYS C . 19948 1 53 . 1 1 14 14 LYS CA C 13 56.1 0.3 . 1 . . . . . 14 LYS CA . 19948 1 54 . 1 1 14 14 LYS CB C 13 29.8 0.3 . 1 . . . . . 14 LYS CB . 19948 1 55 . 1 1 14 14 LYS N N 15 120.6 0.3 . 1 . . . . . 14 LYS N . 19948 1 56 . 1 1 15 15 ARG H H 1 8.47 0.02 . 1 . . . . . 15 ARG H . 19948 1 57 . 1 1 15 15 ARG C C 13 177.8 0.3 . 1 . . . . . 15 ARG C . 19948 1 58 . 1 1 15 15 ARG CA C 13 56.2 0.3 . 1 . . . . . 15 ARG CA . 19948 1 59 . 1 1 15 15 ARG CB C 13 30.8 0.3 . 1 . . . . . 15 ARG CB . 19948 1 60 . 1 1 15 15 ARG N N 15 122.8 0.3 . 1 . . . . . 15 ARG N . 19948 1 61 . 1 1 16 16 GLY H H 1 8.56 0.02 . 1 . . . . . 16 GLY H . 19948 1 62 . 1 1 16 16 GLY C C 13 175.2 0.3 . 1 . . . . . 16 GLY C . 19948 1 63 . 1 1 16 16 GLY CA C 13 45.3 0.3 . 1 . . . . . 16 GLY CA . 19948 1 64 . 1 1 16 16 GLY N N 15 110.6 0.3 . 1 . . . . . 16 GLY N . 19948 1 65 . 1 1 17 17 SER H H 1 8.36 0.02 . 1 . . . . . 17 SER H . 19948 1 66 . 1 1 17 17 SER C C 13 175.9 0.3 . 1 . . . . . 17 SER C . 19948 1 67 . 1 1 17 17 SER CA C 13 58.5 0.3 . 1 . . . . . 17 SER CA . 19948 1 68 . 1 1 17 17 SER CB C 13 64.0 0.3 . 1 . . . . . 17 SER CB . 19948 1 69 . 1 1 17 17 SER N N 15 115.5 0.3 . 1 . . . . . 17 SER N . 19948 1 70 . 1 1 18 18 GLY H H 1 8.59 0.02 . 1 . . . . . 18 GLY H . 19948 1 71 . 1 1 18 18 GLY C C 13 175.5 0.3 . 1 . . . . . 18 GLY C . 19948 1 72 . 1 1 18 18 GLY CA C 13 45.4 0.3 . 1 . . . . . 18 GLY CA . 19948 1 73 . 1 1 18 18 GLY N N 15 110.9 0.3 . 1 . . . . . 18 GLY N . 19948 1 74 . 1 1 19 19 LYS H H 1 8.27 0.02 . 1 . . . . . 19 LYS H . 19948 1 75 . 1 1 19 19 LYS C C 13 177.5 0.3 . 1 . . . . . 19 LYS C . 19948 1 76 . 1 1 19 19 LYS CA C 13 57.4 0.3 . 1 . . . . . 19 LYS CA . 19948 1 77 . 1 1 19 19 LYS CB C 13 30.6 0.3 . 1 . . . . . 19 LYS CB . 19948 1 78 . 1 1 19 19 LYS N N 15 120.9 0.3 . 1 . . . . . 19 LYS N . 19948 1 79 . 1 1 20 20 ASP H H 1 8.40 0.02 . 1 . . . . . 20 ASP H . 19948 1 80 . 1 1 20 20 ASP C C 13 177.5 0.3 . 1 . . . . . 20 ASP C . 19948 1 81 . 1 1 20 20 ASP CA C 13 54.3 0.3 . 1 . . . . . 20 ASP CA . 19948 1 82 . 1 1 20 20 ASP CB C 13 41.2 0.3 . 1 . . . . . 20 ASP CB . 19948 1 83 . 1 1 20 20 ASP N N 15 120.9 0.3 . 1 . . . . . 20 ASP N . 19948 1 84 . 1 1 21 21 SER H H 1 8.23 0.02 . 1 . . . . . 21 SER H . 19948 1 85 . 1 1 21 21 SER C C 13 175.9 0.3 . 1 . . . . . 21 SER C . 19948 1 86 . 1 1 21 21 SER CA C 13 58.9 0.3 . 1 . . . . . 21 SER CA . 19948 1 87 . 1 1 21 21 SER CB C 13 63.7 0.3 . 1 . . . . . 21 SER CB . 19948 1 88 . 1 1 21 21 SER N N 15 116.0 0.3 . 1 . . . . . 21 SER N . 19948 1 89 . 1 1 23 23 THR H H 1 8.09 0.02 . 1 . . . . . 23 THR H . 19948 1 90 . 1 1 23 23 THR C C 13 175.6 0.3 . 1 . . . . . 23 THR C . 19948 1 91 . 1 1 23 23 THR CA C 13 62.4 0.3 . 1 . . . . . 23 THR CA . 19948 1 92 . 1 1 23 23 THR CB C 13 69.7 0.3 . 1 . . . . . 23 THR CB . 19948 1 93 . 1 1 23 23 THR N N 15 115.1 0.3 . 1 . . . . . 23 THR N . 19948 1 94 . 1 1 24 24 ARG H H 1 8.44 0.02 . 1 . . . . . 24 ARG H . 19948 1 95 . 1 1 24 24 ARG C C 13 177.5 0.3 . 1 . . . . . 24 ARG C . 19948 1 96 . 1 1 24 24 ARG CA C 13 56.3 0.3 . 1 . . . . . 24 ARG CA . 19948 1 97 . 1 1 24 24 ARG CB C 13 30.7 0.3 . 1 . . . . . 24 ARG CB . 19948 1 98 . 1 1 24 24 ARG N N 15 123.7 0.3 . 1 . . . . . 24 ARG N . 19948 1 99 . 1 1 25 25 THR H H 1 8.27 0.02 . 1 . . . . . 25 THR H . 19948 1 100 . 1 1 25 25 THR C C 13 175.7 0.3 . 1 . . . . . 25 THR C . 19948 1 101 . 1 1 25 25 THR CA C 13 61.9 0.3 . 1 . . . . . 25 THR CA . 19948 1 102 . 1 1 25 25 THR CB C 13 69.8 0.3 . 1 . . . . . 25 THR CB . 19948 1 103 . 1 1 25 25 THR N N 15 115.6 0.3 . 1 . . . . . 25 THR N . 19948 1 104 . 1 1 26 26 THR H H 1 8.13 0.02 . 1 . . . . . 26 THR H . 19948 1 105 . 1 1 26 26 THR C C 13 175.1 0.3 . 1 . . . . . 26 THR C . 19948 1 106 . 1 1 26 26 THR CA C 13 61.8 0.3 . 1 . . . . . 26 THR CA . 19948 1 107 . 1 1 26 26 THR CB C 13 69.9 0.3 . 1 . . . . . 26 THR CB . 19948 1 108 . 1 1 26 26 THR N N 15 116.3 0.3 . 1 . . . . . 26 THR N . 19948 1 109 . 1 1 28 28 TYR H H 1 8.20 0.02 . 1 . . . . . 28 TYR H . 19948 1 110 . 1 1 28 28 TYR C C 13 177.4 0.3 . 1 . . . . . 28 TYR C . 19948 1 111 . 1 1 28 28 TYR CA C 13 58.0 0.3 . 1 . . . . . 28 TYR CA . 19948 1 112 . 1 1 28 28 TYR CB C 13 39.3 0.3 . 1 . . . . . 28 TYR CB . 19948 1 113 . 1 1 28 28 TYR N N 15 121.9 0.3 . 1 . . . . . 28 TYR N . 19948 1 114 . 1 1 29 29 GLY H H 1 8.33 0.02 . 1 . . . . . 29 GLY H . 19948 1 115 . 1 1 29 29 GLY C C 13 175.0 0.3 . 1 . . . . . 29 GLY C . 19948 1 116 . 1 1 29 29 GLY CA C 13 45.3 0.3 . 1 . . . . . 29 GLY CA . 19948 1 117 . 1 1 29 29 GLY N N 15 110.4 0.3 . 1 . . . . . 29 GLY N . 19948 1 118 . 1 1 30 30 SER H H 1 8.16 0.02 . 1 . . . . . 30 SER H . 19948 1 119 . 1 1 30 30 SER C C 13 175.2 0.3 . 1 . . . . . 30 SER C . 19948 1 120 . 1 1 30 30 SER CA C 13 58.3 0.3 . 1 . . . . . 30 SER CA . 19948 1 121 . 1 1 30 30 SER CB C 13 63.9 0.3 . 1 . . . . . 30 SER CB . 19948 1 122 . 1 1 30 30 SER N N 15 115.5 0.3 . 1 . . . . . 30 SER N . 19948 1 123 . 1 1 31 31 LEU H H 1 8.30 0.02 . 1 . . . . . 31 LEU H . 19948 1 124 . 1 1 31 31 LEU C C 13 176.4 0.3 . 1 . . . . . 31 LEU C . 19948 1 125 . 1 1 31 31 LEU CA C 13 53.3 0.3 . 1 . . . . . 31 LEU CA . 19948 1 126 . 1 1 31 31 LEU CB C 13 41.7 0.3 . 1 . . . . . 31 LEU CB . 19948 1 127 . 1 1 31 31 LEU N N 15 124.8 0.3 . 1 . . . . . 31 LEU N . 19948 1 128 . 1 1 34 34 LYS H H 1 8.44 0.02 . 1 . . . . . 34 LYS H . 19948 1 129 . 1 1 34 34 LYS C C 13 177.9 0.3 . 1 . . . . . 34 LYS C . 19948 1 130 . 1 1 34 34 LYS CA C 13 56.2 0.3 . 1 . . . . . 34 LYS CA . 19948 1 131 . 1 1 34 34 LYS CB C 13 32.9 0.3 . 1 . . . . . 34 LYS CB . 19948 1 132 . 1 1 34 34 LYS N N 15 121.7 0.3 . 1 . . . . . 34 LYS N . 19948 1 133 . 1 1 35 35 SER H H 1 8.32 0.02 . 1 . . . . . 35 SER H . 19948 1 134 . 1 1 35 35 SER C C 13 175.7 0.3 . 1 . . . . . 35 SER C . 19948 1 135 . 1 1 35 35 SER CA C 13 58.3 0.3 . 1 . . . . . 35 SER CA . 19948 1 136 . 1 1 35 35 SER CB C 13 63.9 0.3 . 1 . . . . . 35 SER CB . 19948 1 137 . 1 1 35 35 SER N N 15 116.7 0.3 . 1 . . . . . 35 SER N . 19948 1 138 . 1 1 38 38 GLY H H 1 8.43 0.02 . 1 . . . . . 38 GLY H . 19948 1 139 . 1 1 38 38 GLY C C 13 175.2 0.3 . 1 . . . . . 38 GLY C . 19948 1 140 . 1 1 38 38 GLY CA C 13 45.2 0.3 . 1 . . . . . 38 GLY CA . 19948 1 141 . 1 1 38 38 GLY N N 15 110.1 0.3 . 1 . . . . . 38 GLY N . 19948 1 142 . 1 1 39 39 ARG H H 1 8.33 0.02 . 1 . . . . . 39 ARG H . 19948 1 143 . 1 1 39 39 ARG C C 13 177.9 0.3 . 1 . . . . . 39 ARG C . 19948 1 144 . 1 1 39 39 ARG CA C 13 56.2 0.3 . 1 . . . . . 39 ARG CA . 19948 1 145 . 1 1 39 39 ARG CB C 13 30.8 0.3 . 1 . . . . . 39 ARG CB . 19948 1 146 . 1 1 39 39 ARG N N 15 120.8 0.3 . 1 . . . . . 39 ARG N . 19948 1 147 . 1 1 40 40 THR H H 1 8.34 0.02 . 1 . . . . . 40 THR H . 19948 1 148 . 1 1 40 40 THR C C 13 175.8 0.3 . 1 . . . . . 40 THR C . 19948 1 149 . 1 1 40 40 THR CA C 13 62.1 0.3 . 1 . . . . . 40 THR CA . 19948 1 150 . 1 1 40 40 THR CB C 13 69.8 0.3 . 1 . . . . . 40 THR CB . 19948 1 151 . 1 1 40 40 THR N N 15 115.6 0.3 . 1 . . . . . 40 THR N . 19948 1 152 . 1 1 41 41 GLN H H 1 8.51 0.02 . 1 . . . . . 41 GLN H . 19948 1 153 . 1 1 41 41 GLN C C 13 176.7 0.3 . 1 . . . . . 41 GLN C . 19948 1 154 . 1 1 41 41 GLN CA C 13 56.1 0.3 . 1 . . . . . 41 GLN CA . 19948 1 155 . 1 1 41 41 GLN CB C 13 29.4 0.3 . 1 . . . . . 41 GLN CB . 19948 1 156 . 1 1 41 41 GLN N N 15 122.0 0.3 . 1 . . . . . 41 GLN N . 19948 1 157 . 1 1 42 42 ASP H H 1 8.32 0.02 . 1 . . . . . 42 ASP H . 19948 1 158 . 1 1 42 42 ASP C C 13 177.1 0.3 . 1 . . . . . 42 ASP C . 19948 1 159 . 1 1 42 42 ASP CA C 13 54.5 0.3 . 1 . . . . . 42 ASP CA . 19948 1 160 . 1 1 42 42 ASP CB C 13 41.2 0.3 . 1 . . . . . 42 ASP CB . 19948 1 161 . 1 1 42 42 ASP N N 15 121.3 0.3 . 1 . . . . . 42 ASP N . 19948 1 162 . 1 1 43 43 GLU H H 1 8.30 0.02 . 1 . . . . . 43 GLU H . 19948 1 163 . 1 1 43 43 GLU C C 13 177.1 0.3 . 1 . . . . . 43 GLU C . 19948 1 164 . 1 1 43 43 GLU CA C 13 56.4 0.3 . 1 . . . . . 43 GLU CA . 19948 1 165 . 1 1 43 43 GLU CB C 13 30.6 0.3 . 1 . . . . . 43 GLU CB . 19948 1 166 . 1 1 43 43 GLU N N 15 120.8 0.3 . 1 . . . . . 43 GLU N . 19948 1 167 . 1 1 44 44 ASN H H 1 8.48 0.02 . 1 . . . . . 44 ASN H . 19948 1 168 . 1 1 44 44 ASN HA H 1 4.98 0.02 . 1 . . . . . 44 ASN HA . 19948 1 169 . 1 1 44 44 ASN C C 13 177.3 0.3 . 1 . . . . . 44 ASN C . 19948 1 170 . 1 1 44 44 ASN CA C 13 51.5 0.3 . 1 . . . . . 44 ASN CA . 19948 1 171 . 1 1 44 44 ASN CB C 13 38.9 0.3 . 1 . . . . . 44 ASN CB . 19948 1 172 . 1 1 44 44 ASN N N 15 120.6 0.3 . 1 . . . . . 44 ASN N . 19948 1 173 . 1 1 45 45 PRO HA H 1 4.46 0.02 . 1 . . . . . 45 PRO HA . 19948 1 174 . 1 1 45 45 PRO CA C 13 63.4 0.3 . 1 . . . . . 45 PRO CA . 19948 1 175 . 1 1 45 45 PRO N N 15 136.3 0.3 . 1 . . . . . 45 PRO N . 19948 1 176 . 1 1 46 46 VAL H H 1 8.15 0.02 . 1 . . . . . 46 VAL H . 19948 1 177 . 1 1 46 46 VAL C C 13 177.2 0.3 . 1 . . . . . 46 VAL C . 19948 1 178 . 1 1 46 46 VAL CA C 13 63.0 0.3 . 1 . . . . . 46 VAL CA . 19948 1 179 . 1 1 46 46 VAL CB C 13 32.3 0.3 . 1 . . . . . 46 VAL CB . 19948 1 180 . 1 1 46 46 VAL N N 15 120.1 0.3 . 1 . . . . . 46 VAL N . 19948 1 181 . 1 1 47 47 VAL H H 1 7.98 0.02 . 1 . . . . . 47 VAL H . 19948 1 182 . 1 1 47 47 VAL C C 13 176.8 0.3 . 1 . . . . . 47 VAL C . 19948 1 183 . 1 1 47 47 VAL CA C 13 62.4 0.3 . 1 . . . . . 47 VAL CA . 19948 1 184 . 1 1 47 47 VAL CB C 13 32.6 0.3 . 1 . . . . . 47 VAL CB . 19948 1 185 . 1 1 47 47 VAL N N 15 123.1 0.3 . 1 . . . . . 47 VAL N . 19948 1 186 . 1 1 48 48 HIS H H 1 8.26 0.02 . 1 . . . . . 48 HIS H . 19948 1 187 . 1 1 48 48 HIS C C 13 175.6 0.3 . 1 . . . . . 48 HIS C . 19948 1 188 . 1 1 48 48 HIS CA C 13 55.8 0.3 . 1 . . . . . 48 HIS CA . 19948 1 189 . 1 1 48 48 HIS CB C 13 30.3 0.3 . 1 . . . . . 48 HIS CB . 19948 1 190 . 1 1 48 48 HIS N N 15 122.4 0.3 . 1 . . . . . 48 HIS N . 19948 1 191 . 1 1 49 49 PHE H H 1 8.12 0.02 . 1 . . . . . 49 PHE H . 19948 1 192 . 1 1 49 49 PHE C C 13 176.2 0.3 . 1 . . . . . 49 PHE C . 19948 1 193 . 1 1 49 49 PHE CA C 13 57.8 0.3 . 1 . . . . . 49 PHE CA . 19948 1 194 . 1 1 49 49 PHE CB C 13 39.7 0.3 . 1 . . . . . 49 PHE CB . 19948 1 195 . 1 1 49 49 PHE N N 15 121.4 0.3 . 1 . . . . . 49 PHE N . 19948 1 196 . 1 1 50 50 PHE H H 1 8.20 0.02 . 1 . . . . . 50 PHE H . 19948 1 197 . 1 1 50 50 PHE C C 13 176.4 0.3 . 1 . . . . . 50 PHE C . 19948 1 198 . 1 1 50 50 PHE CA C 13 57.9 0.3 . 1 . . . . . 50 PHE CA . 19948 1 199 . 1 1 50 50 PHE CB C 13 39.6 0.3 . 1 . . . . . 50 PHE CB . 19948 1 200 . 1 1 50 50 PHE N N 15 121.5 0.3 . 1 . . . . . 50 PHE N . 19948 1 201 . 1 1 51 51 LYS H H 1 8.11 0.02 . 1 . . . . . 51 LYS H . 19948 1 202 . 1 1 51 51 LYS C C 13 176.7 0.3 . 1 . . . . . 51 LYS C . 19948 1 203 . 1 1 51 51 LYS CA C 13 56.3 0.3 . 1 . . . . . 51 LYS CA . 19948 1 204 . 1 1 51 51 LYS CB C 13 33.1 0.3 . 1 . . . . . 51 LYS CB . 19948 1 205 . 1 1 51 51 LYS N N 15 122.4 0.3 . 1 . . . . . 51 LYS N . 19948 1 206 . 1 1 52 52 ASN H H 1 8.33 0.02 . 1 . . . . . 52 ASN H . 19948 1 207 . 1 1 52 52 ASN C C 13 175.8 0.3 . 1 . . . . . 52 ASN C . 19948 1 208 . 1 1 52 52 ASN CA C 13 53.4 0.3 . 1 . . . . . 52 ASN CA . 19948 1 209 . 1 1 52 52 ASN CB C 13 38.9 0.3 . 1 . . . . . 52 ASN CB . 19948 1 210 . 1 1 52 52 ASN N N 15 119.5 0.3 . 1 . . . . . 52 ASN N . 19948 1 211 . 1 1 53 53 ILE H H 1 8.03 0.02 . 1 . . . . . 53 ILE H . 19948 1 212 . 1 1 53 53 ILE C C 13 177.1 0.3 . 1 . . . . . 53 ILE C . 19948 1 213 . 1 1 53 53 ILE CA C 13 61.1 0.3 . 1 . . . . . 53 ILE CA . 19948 1 214 . 1 1 53 53 ILE CB C 13 38.7 0.3 . 1 . . . . . 53 ILE CB . 19948 1 215 . 1 1 53 53 ILE N N 15 121.2 0.3 . 1 . . . . . 53 ILE N . 19948 1 216 . 1 1 54 54 VAL H H 1 8.23 0.02 . 1 . . . . . 54 VAL H . 19948 1 217 . 1 1 54 54 VAL C C 13 177.0 0.3 . 1 . . . . . 54 VAL C . 19948 1 218 . 1 1 54 54 VAL CA C 13 62.1 0.3 . 1 . . . . . 54 VAL CA . 19948 1 219 . 1 1 54 54 VAL CB C 13 32.7 0.3 . 1 . . . . . 54 VAL CB . 19948 1 220 . 1 1 54 54 VAL N N 15 124.8 0.3 . 1 . . . . . 54 VAL N . 19948 1 221 . 1 1 55 55 THR H H 1 8.27 0.02 . 1 . . . . . 55 THR H . 19948 1 222 . 1 1 55 55 THR C C 13 173.7 0.3 . 1 . . . . . 55 THR C . 19948 1 223 . 1 1 55 55 THR CA C 13 59.8 0.3 . 1 . . . . . 55 THR CA . 19948 1 224 . 1 1 55 55 THR CB C 13 69.6 0.3 . 1 . . . . . 55 THR CB . 19948 1 225 . 1 1 55 55 THR N N 15 121.0 0.3 . 1 . . . . . 55 THR N . 19948 1 226 . 1 1 56 56 PRO HA H 1 4.43 0.02 . 1 . . . . . 56 PRO HA . 19948 1 227 . 1 1 56 56 PRO CA C 13 63.1 0.3 . 1 . . . . . 56 PRO CA . 19948 1 228 . 1 1 56 56 PRO N N 15 135.7 0.3 . 1 . . . . . 56 PRO N . 19948 1 229 . 1 1 57 57 ARG H H 1 8.47 0.02 . 1 . . . . . 57 ARG H . 19948 1 230 . 1 1 57 57 ARG C C 13 177.6 0.3 . 1 . . . . . 57 ARG C . 19948 1 231 . 1 1 57 57 ARG CA C 13 56.1 0.3 . 1 . . . . . 57 ARG CA . 19948 1 232 . 1 1 57 57 ARG CB C 13 29.6 0.3 . 1 . . . . . 57 ARG CB . 19948 1 233 . 1 1 57 57 ARG N N 15 121.5 0.3 . 1 . . . . . 57 ARG N . 19948 1 234 . 1 1 58 58 THR H H 1 8.20 0.02 . 1 . . . . . 58 THR H . 19948 1 235 . 1 1 58 58 THR C C 13 173.3 0.3 . 1 . . . . . 58 THR C . 19948 1 236 . 1 1 58 58 THR CA C 13 59.8 0.3 . 1 . . . . . 58 THR CA . 19948 1 237 . 1 1 58 58 THR CB C 13 69.6 0.3 . 1 . . . . . 58 THR CB . 19948 1 238 . 1 1 58 58 THR N N 15 117.7 0.3 . 1 . . . . . 58 THR N . 19948 1 239 . 1 1 59 59 PRO HA H 1 4.68 0.02 . 1 . . . . . 59 PRO HA . 19948 1 240 . 1 1 59 59 PRO CA C 13 61.6 0.3 . 1 . . . . . 59 PRO CA . 19948 1 241 . 1 1 59 59 PRO N N 15 139.8 0.3 . 1 . . . . . 59 PRO N . 19948 1 242 . 1 1 60 60 PRO HA H 1 4.45 0.02 . 1 . . . . . 60 PRO HA . 19948 1 243 . 1 1 60 60 PRO CA C 13 63.2 0.3 . 1 . . . . . 60 PRO CA . 19948 1 244 . 1 1 60 60 PRO N N 15 136.4 0.3 . 1 . . . . . 60 PRO N . 19948 1 245 . 1 1 61 61 PRO HA H 1 4.45 0.02 . 1 . . . . . 61 PRO HA . 19948 1 246 . 1 1 61 61 PRO CA C 13 63.0 0.3 . 1 . . . . . 61 PRO CA . 19948 1 247 . 1 1 61 61 PRO N N 15 138.5 0.3 . 1 . . . . . 61 PRO N . 19948 1 248 . 1 1 62 62 SER H H 1 8.33 0.02 . 1 . . . . . 62 SER H . 19948 1 249 . 1 1 62 62 SER C C 13 175.8 0.3 . 1 . . . . . 62 SER C . 19948 1 250 . 1 1 62 62 SER CA C 13 58.3 0.3 . 1 . . . . . 62 SER CA . 19948 1 251 . 1 1 62 62 SER CB C 13 63.9 0.3 . 1 . . . . . 62 SER CB . 19948 1 252 . 1 1 62 62 SER N N 15 115.4 0.3 . 1 . . . . . 62 SER N . 19948 1 253 . 1 1 63 63 GLN H H 1 8.46 0.02 . 1 . . . . . 63 GLN H . 19948 1 254 . 1 1 63 63 GLN C C 13 177.8 0.3 . 1 . . . . . 63 GLN C . 19948 1 255 . 1 1 63 63 GLN CA C 13 56.1 0.3 . 1 . . . . . 63 GLN CA . 19948 1 256 . 1 1 63 63 GLN CB C 13 29.4 0.3 . 1 . . . . . 63 GLN CB . 19948 1 257 . 1 1 63 63 GLN N N 15 122.2 0.3 . 1 . . . . . 63 GLN N . 19948 1 258 . 1 1 64 64 GLY H H 1 8.45 0.02 . 1 . . . . . 64 GLY H . 19948 1 259 . 1 1 64 64 GLY C C 13 175.2 0.3 . 1 . . . . . 64 GLY C . 19948 1 260 . 1 1 64 64 GLY CA C 13 45.3 0.3 . 1 . . . . . 64 GLY CA . 19948 1 261 . 1 1 64 64 GLY N N 15 109.8 0.3 . 1 . . . . . 64 GLY N . 19948 1 262 . 1 1 65 65 LYS H H 1 8.30 0.02 . 1 . . . . . 65 LYS H . 19948 1 263 . 1 1 65 65 LYS C C 13 178.1 0.3 . 1 . . . . . 65 LYS C . 19948 1 264 . 1 1 65 65 LYS CA C 13 56.4 0.3 . 1 . . . . . 65 LYS CA . 19948 1 265 . 1 1 65 65 LYS CB C 13 30.5 0.3 . 1 . . . . . 65 LYS CB . 19948 1 266 . 1 1 65 65 LYS N N 15 120.7 0.3 . 1 . . . . . 65 LYS N . 19948 1 267 . 1 1 66 66 GLY H H 1 8.53 0.02 . 1 . . . . . 66 GLY H . 19948 1 268 . 1 1 66 66 GLY C C 13 175.2 0.3 . 1 . . . . . 66 GLY C . 19948 1 269 . 1 1 66 66 GLY CA C 13 45.3 0.3 . 1 . . . . . 66 GLY CA . 19948 1 270 . 1 1 66 66 GLY N N 15 110.2 0.3 . 1 . . . . . 66 GLY N . 19948 1 271 . 1 1 67 67 ARG H H 1 8.31 0.02 . 1 . . . . . 67 ARG H . 19948 1 272 . 1 1 67 67 ARG C C 13 177.1 0.3 . 1 . . . . . 67 ARG C . 19948 1 273 . 1 1 67 67 ARG CA C 13 56.4 0.3 . 1 . . . . . 67 ARG CA . 19948 1 274 . 1 1 67 67 ARG CB C 13 30.5 0.3 . 1 . . . . . 67 ARG CB . 19948 1 275 . 1 1 67 67 ARG N N 15 120.6 0.3 . 1 . . . . . 67 ARG N . 19948 1 276 . 1 1 68 68 GLY H H 1 8.51 0.02 . 1 . . . . . 68 GLY H . 19948 1 277 . 1 1 68 68 GLY C C 13 175.2 0.3 . 1 . . . . . 68 GLY C . 19948 1 278 . 1 1 68 68 GLY CA C 13 45.3 0.3 . 1 . . . . . 68 GLY CA . 19948 1 279 . 1 1 68 68 GLY N N 15 109.9 0.3 . 1 . . . . . 68 GLY N . 19948 1 280 . 1 1 69 69 LEU H H 1 8.17 0.02 . 1 . . . . . 69 LEU H . 19948 1 281 . 1 1 69 69 LEU C C 13 177.8 0.3 . 1 . . . . . 69 LEU C . 19948 1 282 . 1 1 69 69 LEU CA C 13 55.3 0.3 . 1 . . . . . 69 LEU CA . 19948 1 283 . 1 1 69 69 LEU CB C 13 42.5 0.3 . 1 . . . . . 69 LEU CB . 19948 1 284 . 1 1 69 69 LEU N N 15 122.0 0.3 . 1 . . . . . 69 LEU N . 19948 1 285 . 1 1 70 70 SER H H 1 7.94 0.02 . 1 . . . . . 70 SER H . 19948 1 286 . 1 1 70 70 SER C C 13 179.7 0.3 . 1 . . . . . 70 SER C . 19948 1 287 . 1 1 70 70 SER CA C 13 60.0 0.3 . 1 . . . . . 70 SER CA . 19948 1 288 . 1 1 70 70 SER CB C 13 64.9 0.3 . 1 . . . . . 70 SER CB . 19948 1 289 . 1 1 70 70 SER N N 15 121.6 0.3 . 1 . . . . . 70 SER N . 19948 1 stop_ save_