################################### # 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 15529 _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' . . . 15529 1 2 '3D CBCA(CO)NH' . . . 15529 1 3 '3D HNCACB' . . . 15529 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 LEU H H 1 8.74 0.03 . 1 . . . . 4 L HN . 15529 1 2 . 1 1 4 4 LEU CA C 13 57.96 0.4 . 1 . . . . 4 L CA . 15529 1 3 . 1 1 4 4 LEU CB C 13 41.91 0.4 . 1 . . . . 4 L CB . 15529 1 4 . 1 1 4 4 LEU N N 15 122.38 0.4 . 1 . . . . 4 L N . 15529 1 5 . 1 1 5 5 MET H H 1 8.50 0.03 . 1 . . . . 5 M HN . 15529 1 6 . 1 1 5 5 MET CA C 13 58.76 0.4 . 1 . . . . 5 M CA . 15529 1 7 . 1 1 5 5 MET CB C 13 32.67 0.4 . 1 . . . . 5 M CB . 15529 1 8 . 1 1 5 5 MET N N 15 118.11 0.4 . 1 . . . . 5 M N . 15529 1 9 . 1 1 6 6 GLY H H 1 7.41 0.03 . 1 . . . . 6 G HN . 15529 1 10 . 1 1 6 6 GLY CA C 13 47.10 0.4 . 1 . . . . 6 G CA . 15529 1 11 . 1 1 6 6 GLY N N 15 105.36 0.4 . 1 . . . . 6 G N . 15529 1 12 . 1 1 7 7 ILE H H 1 7.61 0.03 . 1 . . . . 7 I HN . 15529 1 13 . 1 1 7 7 ILE CA C 13 66.17 0.4 . 1 . . . . 7 I CA . 15529 1 14 . 1 1 7 7 ILE CB C 13 39.46 0.4 . 1 . . . . 7 I CB . 15529 1 15 . 1 1 7 7 ILE N N 15 123.46 0.4 . 1 . . . . 7 I N . 15529 1 16 . 1 1 8 8 ILE H H 1 8.36 0.03 . 1 . . . . 8 I HN . 15529 1 17 . 1 1 8 8 ILE CA C 13 66.10 0.4 . 1 . . . . 8 I CA . 15529 1 18 . 1 1 8 8 ILE CB C 13 39.12 0.4 . 1 . . . . 8 I CB . 15529 1 19 . 1 1 8 8 ILE N N 15 118.84 0.4 . 1 . . . . 8 I N . 15529 1 20 . 1 1 9 9 THR H H 1 8.39 0.03 . 1 . . . . 9 T HN . 15529 1 21 . 1 1 9 9 THR CA C 13 66.32 0.4 . 1 . . . . 9 T CA . 15529 1 22 . 1 1 9 9 THR CB C 13 68.76 0.4 . 1 . . . . 9 T CB . 15529 1 23 . 1 1 9 9 THR N N 15 111.67 0.4 . 1 . . . . 9 T N . 15529 1 24 . 1 1 10 10 ARG H H 1 7.63 0.03 . 1 . . . . 10 R HN . 15529 1 25 . 1 1 10 10 ARG CA C 13 59.68 0.4 . 1 . . . . 10 R CA . 15529 1 26 . 1 1 10 10 ARG CB C 13 30.53 0.4 . 1 . . . . 10 R CB . 15529 1 27 . 1 1 10 10 ARG N N 15 122.46 0.4 . 1 . . . . 10 R N . 15529 1 28 . 1 1 11 11 LEU H H 1 8.29 0.03 . 1 . . . . 11 L HN . 15529 1 29 . 1 1 11 11 LEU CA C 13 58.11 0.4 . 1 . . . . 11 L CA . 15529 1 30 . 1 1 11 11 LEU CB C 13 41.12 0.4 . 1 . . . . 11 L CB . 15529 1 31 . 1 1 11 11 LEU N N 15 121.82 0.4 . 1 . . . . 11 L N . 15529 1 32 . 1 1 12 12 GLN H H 1 9.03 0.03 . 1 . . . . 12 Q HN . 15529 1 33 . 1 1 12 12 GLN CA C 13 59.26 0.4 . 1 . . . . 12 Q CA . 15529 1 34 . 1 1 12 12 GLN CB C 13 28.23 0.4 . 1 . . . . 12 Q CB . 15529 1 35 . 1 1 12 12 GLN N N 15 121.43 0.4 . 1 . . . . 12 Q N . 15529 1 36 . 1 1 13 13 SER H H 1 7.93 0.03 . 1 . . . . 13 S HN . 15529 1 37 . 1 1 13 13 SER CA C 13 61.29 0.4 . 1 . . . . 13 S CA . 15529 1 38 . 1 1 13 13 SER CB C 13 62.65 0.4 . 1 . . . . 13 S CB . 15529 1 39 . 1 1 13 13 SER N N 15 114.13 0.4 . 1 . . . . 13 S N . 15529 1 40 . 1 1 14 14 LEU H H 1 7.61 0.03 . 1 . . . . 14 L HN . 15529 1 41 . 1 1 14 14 LEU CA C 13 58.00 0.4 . 1 . . . . 14 L CA . 15529 1 42 . 1 1 14 14 LEU CB C 13 42.39 0.4 . 1 . . . . 14 L CB . 15529 1 43 . 1 1 14 14 LEU N N 15 123.46 0.4 . 1 . . . . 14 L N . 15529 1 44 . 1 1 15 15 GLN H H 1 7.74 0.03 . 1 . . . . 15 Q HN . 15529 1 45 . 1 1 15 15 GLN CA C 13 58.38 0.4 . 1 . . . . 15 Q CA . 15529 1 46 . 1 1 15 15 GLN CB C 13 28.77 0.4 . 1 . . . . 15 Q CB . 15529 1 47 . 1 1 15 15 GLN N N 15 117.07 0.4 . 1 . . . . 15 Q N . 15529 1 48 . 1 1 16 16 GLU H H 1 7.95 0.03 . 1 . . . . 16 E HN . 15529 1 49 . 1 1 16 16 GLU CA C 13 58.68 0.4 . 1 . . . . 16 E CA . 15529 1 50 . 1 1 16 16 GLU CB C 13 29.95 0.4 . 1 . . . . 16 E CB . 15529 1 51 . 1 1 16 16 GLU N N 15 117.77 0.4 . 1 . . . . 16 E N . 15529 1 52 . 1 1 17 17 THR H H 1 8.23 0.03 . 1 . . . . 17 T HN . 15529 1 53 . 1 1 17 17 THR CA C 13 65.02 0.4 . 1 . . . . 17 T CA . 15529 1 54 . 1 1 17 17 THR CB C 13 69.26 0.4 . 1 . . . . 17 T CB . 15529 1 55 . 1 1 17 17 THR N N 15 114.76 0.4 . 1 . . . . 17 T N . 15529 1 56 . 1 1 18 18 ALA H H 1 8.32 0.03 . 1 . . . . 18 A HN . 15529 1 57 . 1 1 18 18 ALA CA C 13 55.01 0.4 . 1 . . . . 18 A CA . 15529 1 58 . 1 1 18 18 ALA CB C 13 20.02 0.4 . 1 . . . . 18 A CB . 15529 1 59 . 1 1 18 18 ALA N N 15 126.72 0.4 . 1 . . . . 18 A N . 15529 1 60 . 1 1 19 19 GLU H H 1 8.44 0.03 . 1 . . . . 19 E HN . 15529 1 61 . 1 1 19 19 GLU CA C 13 58.64 0.4 . 1 . . . . 19 E CA . 15529 1 62 . 1 1 19 19 GLU CB C 13 29.60 0.4 . 1 . . . . 19 E CB . 15529 1 63 . 1 1 19 19 GLU N N 15 117.73 0.4 . 1 . . . . 19 E N . 15529 1 64 . 1 1 20 20 ALA H H 1 7.92 0.03 . 1 . . . . 20 A HN . 15529 1 65 . 1 1 20 20 ALA CA C 13 53.81 0.4 . 1 . . . . 20 A CA . 15529 1 66 . 1 1 20 20 ALA CB C 13 18.81 0.4 . 1 . . . . 20 A CB . 15529 1 67 . 1 1 20 20 ALA N N 15 121.42 0.4 . 1 . . . . 20 A N . 15529 1 68 . 1 1 21 21 ALA H H 1 7.95 0.03 . 1 . . . . 21 A HN . 15529 1 69 . 1 1 21 21 ALA CA C 13 52.65 0.4 . 1 . . . . 21 A CA . 15529 1 70 . 1 1 21 21 ALA CB C 13 19.85 0.4 . 1 . . . . 21 A CB . 15529 1 71 . 1 1 21 21 ALA N N 15 119.40 0.4 . 1 . . . . 21 A N . 15529 1 72 . 1 1 22 22 ASN H H 1 8.25 0.03 . 1 . . . . 22 N HN . 15529 1 73 . 1 1 22 22 ASN CA C 13 54.30 0.4 . 1 . . . . 22 N CA . 15529 1 74 . 1 1 22 22 ASN CB C 13 38.21 0.4 . 1 . . . . 22 N CB . 15529 1 75 . 1 1 22 22 ASN N N 15 115.18 0.4 . 1 . . . . 22 N N . 15529 1 76 . 1 1 23 23 GLU H H 1 7.78 0.03 . 1 . . . . 23 E HN . 15529 1 77 . 1 1 23 23 GLU CA C 13 54.35 0.4 . 1 . . . . 23 E CA . 15529 1 78 . 1 1 23 23 GLU CB C 13 31.67 0.4 . 1 . . . . 23 E CB . 15529 1 79 . 1 1 23 23 GLU N N 15 116.93 0.4 . 1 . . . . 23 E N . 15529 1 80 . 1 1 26 26 GLN H H 1 7.84 0.03 . 1 . . . . 26 Q HN . 15529 1 81 . 1 1 26 26 GLN CA C 13 54.21 0.4 . 1 . . . . 26 Q CA . 15529 1 82 . 1 1 26 26 GLN CB C 13 36.34 0.4 . 1 . . . . 26 Q CB . 15529 1 83 . 1 1 26 26 GLN N N 15 119.41 0.4 . 1 . . . . 26 Q N . 15529 1 84 . 1 1 27 27 ARG H H 1 8.50 0.03 . 1 . . . . 27 R HN . 15529 1 85 . 1 1 27 27 ARG CA C 13 54.15 0.4 . 1 . . . . 27 R CA . 15529 1 86 . 1 1 27 27 ARG CB C 13 33.23 0.4 . 1 . . . . 27 R CB . 15529 1 87 . 1 1 27 27 ARG N N 15 119.44 0.4 . 1 . . . . 27 R N . 15529 1 88 . 1 1 28 28 TYR H H 1 8.74 0.03 . 1 . . . . 28 Y HN . 15529 1 89 . 1 1 28 28 TYR CA C 13 57.55 0.4 . 1 . . . . 28 Y CA . 15529 1 90 . 1 1 28 28 TYR CB C 13 41.17 0.4 . 1 . . . . 28 Y CB . 15529 1 91 . 1 1 28 28 TYR N N 15 119.77 0.4 . 1 . . . . 28 Y N . 15529 1 92 . 1 1 29 29 PHE H H 1 8.75 0.03 . 1 . . . . 29 F HN . 15529 1 93 . 1 1 29 29 PHE CA C 13 58.08 0.4 . 1 . . . . 29 F CA . 15529 1 94 . 1 1 29 29 PHE CB C 13 40.98 0.4 . 1 . . . . 29 F CB . 15529 1 95 . 1 1 29 29 PHE N N 15 118.67 0.4 . 1 . . . . 29 F N . 15529 1 96 . 1 1 30 30 GLU H H 1 8.89 0.03 . 1 . . . . 30 E HN . 15529 1 97 . 1 1 30 30 GLU CA C 13 54.52 0.4 . 1 . . . . 30 E CA . 15529 1 98 . 1 1 30 30 GLU CB C 13 34.52 0.4 . 1 . . . . 30 E CB . 15529 1 99 . 1 1 30 30 GLU N N 15 122.60 0.4 . 1 . . . . 30 E N . 15529 1 100 . 1 1 31 31 VAL H H 1 8.53 0.03 . 1 . . . . 31 V HN . 15529 1 101 . 1 1 31 31 VAL CA C 13 62.04 0.4 . 1 . . . . 31 V CA . 15529 1 102 . 1 1 31 31 VAL CB C 13 34.94 0.4 . 1 . . . . 31 V CB . 15529 1 103 . 1 1 31 31 VAL N N 15 119.51 0.4 . 1 . . . . 31 V N . 15529 1 104 . 1 1 32 32 ASN H H 1 9.62 0.03 . 1 . . . . 32 N HN . 15529 1 105 . 1 1 32 32 ASN CA C 13 54.33 0.4 . 1 . . . . 32 N CA . 15529 1 106 . 1 1 32 32 ASN CB C 13 37.54 0.4 . 1 . . . . 32 N CB . 15529 1 107 . 1 1 32 32 ASN N N 15 127.56 0.4 . 1 . . . . 32 N N . 15529 1 108 . 1 1 33 33 GLY H H 1 8.74 0.03 . 1 . . . . 33 G HN . 15529 1 109 . 1 1 33 33 GLY CA C 13 45.48 0.4 . 1 . . . . 33 G CA . 15529 1 110 . 1 1 33 33 GLY N N 15 103.56 0.4 . 1 . . . . 33 G N . 15529 1 111 . 1 1 34 34 GLU H H 1 7.83 0.03 . 1 . . . . 34 E HN . 15529 1 112 . 1 1 34 34 GLU CA C 13 54.33 0.4 . 1 . . . . 34 E CA . 15529 1 113 . 1 1 34 34 GLU CB C 13 31.70 0.4 . 1 . . . . 34 E CB . 15529 1 114 . 1 1 34 34 GLU N N 15 120.64 0.4 . 1 . . . . 34 E N . 15529 1 115 . 1 1 35 35 LYS H H 1 8.72 0.03 . 1 . . . . 35 K HN . 15529 1 116 . 1 1 35 35 LYS CA C 13 57.32 0.4 . 1 . . . . 35 K CA . 15529 1 117 . 1 1 35 35 LYS CB C 13 32.05 0.4 . 1 . . . . 35 K CB . 15529 1 118 . 1 1 35 35 LYS N N 15 124.27 0.4 . 1 . . . . 35 K N . 15529 1 119 . 1 1 36 36 ILE H H 1 8.90 0.03 . 1 . . . . 36 I HN . 15529 1 120 . 1 1 36 36 ILE CA C 13 60.68 0.4 . 1 . . . . 36 I CA . 15529 1 121 . 1 1 36 36 ILE CB C 13 39.13 0.4 . 1 . . . . 36 I CB . 15529 1 122 . 1 1 36 36 ILE N N 15 123.79 0.4 . 1 . . . . 36 I N . 15529 1 123 . 1 1 37 37 CYS H H 1 8.16 0.03 . 1 . . . . 37 C HN . 15529 1 124 . 1 1 37 37 CYS CA C 13 56.13 0.4 . 1 . . . . 37 C CA . 15529 1 125 . 1 1 37 37 CYS CB C 13 31.22 0.4 . 1 . . . . 37 C CB . 15529 1 126 . 1 1 37 37 CYS N N 15 111.63 0.4 . 1 . . . . 37 C N . 15529 1 127 . 1 1 38 38 SER H H 1 9.36 0.03 . 1 . . . . 38 S HN . 15529 1 128 . 1 1 38 38 SER CA C 13 56.58 0.4 . 1 . . . . 38 S CA . 15529 1 129 . 1 1 38 38 SER CB C 13 66.07 0.4 . 1 . . . . 38 S CB . 15529 1 130 . 1 1 38 38 SER N N 15 114.85 0.4 . 1 . . . . 38 S N . 15529 1 131 . 1 1 39 39 VAL H H 1 9.19 0.03 . 1 . . . . 39 V HN . 15529 1 132 . 1 1 39 39 VAL CA C 13 59.75 0.4 . 1 . . . . 39 V CA . 15529 1 133 . 1 1 39 39 VAL CB C 13 35.71 0.4 . 1 . . . . 39 V CB . 15529 1 134 . 1 1 39 39 VAL N N 15 123.07 0.4 . 1 . . . . 39 V N . 15529 1 135 . 1 1 40 40 LYS H H 1 8.65 0.03 . 1 . . . . 40 K HN . 15529 1 136 . 1 1 40 40 LYS CA C 13 54.36 0.4 . 1 . . . . 40 K CA . 15529 1 137 . 1 1 40 40 LYS CB C 13 37.12 0.4 . 1 . . . . 40 K CB . 15529 1 138 . 1 1 40 40 LYS N N 15 126.70 0.4 . 1 . . . . 40 K N . 15529 1 139 . 1 1 41 41 TYR H H 1 8.77 0.03 . 1 . . . . 41 Y HN . 15529 1 140 . 1 1 41 41 TYR CA C 13 56.29 0.4 . 1 . . . . 41 Y CA . 15529 1 141 . 1 1 41 41 TYR CB C 13 41.47 0.4 . 1 . . . . 41 Y CB . 15529 1 142 . 1 1 41 41 TYR N N 15 124.88 0.4 . 1 . . . . 41 Y N . 15529 1 143 . 1 1 42 42 PHE H H 1 8.09 0.03 . 1 . . . . 42 F HN . 15529 1 144 . 1 1 42 42 PHE CA C 13 56.35 0.4 . 1 . . . . 42 F CA . 15529 1 145 . 1 1 42 42 PHE CB C 13 39.05 0.4 . 1 . . . . 42 F CB . 15529 1 146 . 1 1 42 42 PHE N N 15 126.19 0.4 . 1 . . . . 42 F N . 15529 1 147 . 1 1 43 43 GLU H H 1 8.50 0.03 . 1 . . . . 43 E HN . 15529 1 148 . 1 1 43 43 GLU CA C 13 58.10 0.4 . 1 . . . . 43 E CA . 15529 1 149 . 1 1 43 43 GLU CB C 13 28.88 0.4 . 1 . . . . 43 E CB . 15529 1 150 . 1 1 43 43 GLU N N 15 125.09 0.4 . 1 . . . . 43 E N . 15529 1 151 . 1 1 44 44 LYS H H 1 8.47 0.03 . 1 . . . . 44 K HN . 15529 1 152 . 1 1 44 44 LYS CA C 13 58.98 0.4 . 1 . . . . 44 K CA . 15529 1 153 . 1 1 44 44 LYS CB C 13 31.91 0.4 . 1 . . . . 44 K CB . 15529 1 154 . 1 1 44 44 LYS N N 15 119.33 0.4 . 1 . . . . 44 K N . 15529 1 155 . 1 1 45 45 ASN H H 1 7.04 0.03 . 1 . . . . 45 N HN . 15529 1 156 . 1 1 45 45 ASN CA C 13 51.89 0.4 . 1 . . . . 45 N CA . 15529 1 157 . 1 1 45 45 ASN CB C 13 38.55 0.4 . 1 . . . . 45 N CB . 15529 1 158 . 1 1 45 45 ASN N N 15 112.59 0.4 . 1 . . . . 45 N N . 15529 1 159 . 1 1 46 46 GLN H H 1 7.72 0.03 . 1 . . . . 46 Q HN . 15529 1 160 . 1 1 46 46 GLN CA C 13 57.13 0.4 . 1 . . . . 46 Q CA . 15529 1 161 . 1 1 46 46 GLN CB C 13 26.27 0.4 . 1 . . . . 46 Q CB . 15529 1 162 . 1 1 46 46 GLN N N 15 116.30 0.4 . 1 . . . . 46 Q N . 15529 1 163 . 1 1 47 47 THR H H 1 7.27 0.03 . 1 . . . . 47 T HN . 15529 1 164 . 1 1 47 47 THR CA C 13 60.86 0.4 . 1 . . . . 47 T CA . 15529 1 165 . 1 1 47 47 THR CB C 13 72.43 0.4 . 1 . . . . 47 T CB . 15529 1 166 . 1 1 47 47 THR N N 15 108.69 0.4 . 1 . . . . 47 T N . 15529 1 167 . 1 1 48 48 PHE H H 1 9.16 0.03 . 1 . . . . 48 F HN . 15529 1 168 . 1 1 48 48 PHE CA C 13 56.64 0.4 . 1 . . . . 48 F CA . 15529 1 169 . 1 1 48 48 PHE CB C 13 42.56 0.4 . 1 . . . . 48 F CB . 15529 1 170 . 1 1 48 48 PHE N N 15 118.14 0.4 . 1 . . . . 48 F N . 15529 1 171 . 1 1 49 49 GLU H H 1 9.67 0.03 . 1 . . . . 49 E HN . 15529 1 172 . 1 1 49 49 GLU CA C 13 56.13 0.4 . 1 . . . . 49 E CA . 15529 1 173 . 1 1 49 49 GLU CB C 13 33.03 0.4 . 1 . . . . 49 E CB . 15529 1 174 . 1 1 49 49 GLU N N 15 122.18 0.4 . 1 . . . . 49 E N . 15529 1 175 . 1 1 50 50 LEU H H 1 9.64 0.03 . 1 . . . . 50 L HN . 15529 1 176 . 1 1 50 50 LEU CA C 13 53.91 0.4 . 1 . . . . 50 L CA . 15529 1 177 . 1 1 50 50 LEU CB C 13 45.82 0.4 . 1 . . . . 50 L CB . 15529 1 178 . 1 1 50 50 LEU N N 15 133.20 0.4 . 1 . . . . 50 L N . 15529 1 179 . 1 1 51 51 THR H H 1 9.71 0.03 . 1 . . . . 51 T HN . 15529 1 180 . 1 1 51 51 THR CA C 13 62.33 0.4 . 1 . . . . 51 T CA . 15529 1 181 . 1 1 51 51 THR CB C 13 69.68 0.4 . 1 . . . . 51 T CB . 15529 1 182 . 1 1 51 51 THR N N 15 125.83 0.4 . 1 . . . . 51 T N . 15529 1 183 . 1 1 52 52 VAL H H 1 9.05 0.03 . 1 . . . . 52 V HN . 15529 1 184 . 1 1 52 52 VAL CA C 13 62.35 0.4 . 1 . . . . 52 V CA . 15529 1 185 . 1 1 52 52 VAL CB C 13 34.21 0.4 . 1 . . . . 52 V CB . 15529 1 186 . 1 1 52 52 VAL N N 15 126.68 0.4 . 1 . . . . 52 V N . 15529 1 187 . 1 1 53 53 PHE H H 1 7.58 0.03 . 1 . . . . 53 F HN . 15529 1 188 . 1 1 53 53 PHE CA C 13 57.49 0.4 . 1 . . . . 53 F CA . 15529 1 189 . 1 1 53 53 PHE CB C 13 39.42 0.4 . 1 . . . . 53 F CB . 15529 1 190 . 1 1 53 53 PHE N N 15 126.67 0.4 . 1 . . . . 53 F N . 15529 1 191 . 1 1 54 54 GLN H H 1 8.85 0.03 . 1 . . . . 54 Q HN . 15529 1 192 . 1 1 54 54 GLN CA C 13 54.95 0.4 . 1 . . . . 54 Q CA . 15529 1 193 . 1 1 54 54 GLN CB C 13 31.26 0.4 . 1 . . . . 54 Q CB . 15529 1 194 . 1 1 54 54 GLN N N 15 122.21 0.4 . 1 . . . . 54 Q N . 15529 1 195 . 1 1 55 55 LYS H H 1 8.73 0.03 . 1 . . . . 55 K HN . 15529 1 196 . 1 1 55 55 LYS CA C 13 58.20 0.4 . 1 . . . . 55 K CA . 15529 1 197 . 1 1 55 55 LYS CB C 13 31.91 0.4 . 1 . . . . 55 K CB . 15529 1 198 . 1 1 55 55 LYS N N 15 124.96 0.4 . 1 . . . . 55 K N . 15529 1 199 . 1 1 56 56 GLY H H 1 8.85 0.03 . 1 . . . . 56 G HN . 15529 1 200 . 1 1 56 56 GLY CA C 13 45.61 0.4 . 1 . . . . 56 G CA . 15529 1 201 . 1 1 56 56 GLY N N 15 112.88 0.4 . 1 . . . . 56 G N . 15529 1 202 . 1 1 57 57 GLU H H 1 7.93 0.03 . 1 . . . . 57 E HN . 15529 1 203 . 1 1 57 57 GLU CA C 13 54.36 0.4 . 1 . . . . 57 E CA . 15529 1 204 . 1 1 57 57 GLU CB C 13 32.93 0.4 . 1 . . . . 57 E CB . 15529 1 205 . 1 1 57 57 GLU N N 15 118.55 0.4 . 1 . . . . 57 E N . 15529 1 206 . 1 1 58 58 LYS H H 1 8.67 0.03 . 1 . . . . 58 K HN . 15529 1 207 . 1 1 58 58 LYS CA C 13 54.81 0.4 . 1 . . . . 58 K CA . 15529 1 208 . 1 1 58 58 LYS CB C 13 31.87 0.4 . 1 . . . . 58 K CB . 15529 1 209 . 1 1 58 58 LYS N N 15 122.98 0.4 . 1 . . . . 58 K N . 15529 1 210 . 1 1 60 60 ASN H H 1 7.89 0.03 . 1 . . . . 60 N HN . 15529 1 211 . 1 1 60 60 ASN CA C 13 52.37 0.4 . 1 . . . . 60 N CA . 15529 1 212 . 1 1 60 60 ASN CB C 13 42.39 0.4 . 1 . . . . 60 N CB . 15529 1 213 . 1 1 60 60 ASN N N 15 119.22 0.4 . 1 . . . . 60 N N . 15529 1 214 . 1 1 61 61 THR H H 1 8.22 0.03 . 1 . . . . 61 T HN . 15529 1 215 . 1 1 61 61 THR CA C 13 61.26 0.4 . 1 . . . . 61 T CA . 15529 1 216 . 1 1 61 61 THR CB C 13 71.12 0.4 . 1 . . . . 61 T CB . 15529 1 217 . 1 1 61 61 THR N N 15 117.44 0.4 . 1 . . . . 61 T N . 15529 1 218 . 1 1 62 62 TYR H H 1 9.32 0.03 . 1 . . . . 62 Y HN . 15529 1 219 . 1 1 62 62 TYR CA C 13 54.39 0.4 . 1 . . . . 62 Y CA . 15529 1 220 . 1 1 62 62 TYR CB C 13 41.42 0.4 . 1 . . . . 62 Y CB . 15529 1 221 . 1 1 62 62 TYR N N 15 124.74 0.4 . 1 . . . . 62 Y N . 15529 1 222 . 1 1 64 64 PHE H H 1 9.15 0.03 . 1 . . . . 64 F HN . 15529 1 223 . 1 1 64 64 PHE CA C 13 57.89 0.4 . 1 . . . . 64 F CA . 15529 1 224 . 1 1 64 64 PHE CB C 13 44.94 0.4 . 1 . . . . 64 F CB . 15529 1 225 . 1 1 64 64 PHE N N 15 117.67 0.4 . 1 . . . . 64 F N . 15529 1 226 . 1 1 65 65 ASP H H 1 8.97 0.03 . 1 . . . . 65 D HN . 15529 1 227 . 1 1 65 65 ASP CA C 13 53.32 0.4 . 1 . . . . 65 D CA . 15529 1 228 . 1 1 65 65 ASP CB C 13 41.48 0.4 . 1 . . . . 65 D CB . 15529 1 229 . 1 1 65 65 ASP N N 15 120.18 0.4 . 1 . . . . 65 D N . 15529 1 230 . 1 1 66 66 ASN H H 1 7.40 0.03 . 1 . . . . 66 N HN . 15529 1 231 . 1 1 66 66 ASN CA C 13 53.08 0.4 . 1 . . . . 66 N CA . 15529 1 232 . 1 1 66 66 ASN CB C 13 42.38 0.4 . 1 . . . . 66 N CB . 15529 1 233 . 1 1 66 66 ASN N N 15 115.42 0.4 . 1 . . . . 66 N N . 15529 1 234 . 1 1 67 67 ILE H H 1 9.26 0.03 . 1 . . . . 67 I HN . 15529 1 235 . 1 1 67 67 ILE CA C 13 63.72 0.4 . 1 . . . . 67 I CA . 15529 1 236 . 1 1 67 67 ILE CB C 13 38.37 0.4 . 1 . . . . 67 I CB . 15529 1 237 . 1 1 67 67 ILE N N 15 125.88 0.4 . 1 . . . . 67 I N . 15529 1 238 . 1 1 68 68 ASP H H 1 7.98 0.03 . 1 . . . . 68 D HN . 15529 1 239 . 1 1 68 68 ASP CA C 13 57.90 0.4 . 1 . . . . 68 D CA . 15529 1 240 . 1 1 68 68 ASP CB C 13 41.71 0.4 . 1 . . . . 68 D CB . 15529 1 241 . 1 1 68 68 ASP N N 15 126.09 0.4 . 1 . . . . 68 D N . 15529 1 242 . 1 1 69 69 MET H H 1 7.76 0.03 . 1 . . . . 69 M HN . 15529 1 243 . 1 1 69 69 MET CA C 13 57.74 0.4 . 1 . . . . 69 M CA . 15529 1 244 . 1 1 69 69 MET CB C 13 31.93 0.4 . 1 . . . . 69 M CB . 15529 1 245 . 1 1 69 69 MET N N 15 116.26 0.4 . 1 . . . . 69 M N . 15529 1 246 . 1 1 70 70 VAL H H 1 7.13 0.03 . 1 . . . . 70 V HN . 15529 1 247 . 1 1 70 70 VAL CA C 13 63.76 0.4 . 1 . . . . 70 V CA . 15529 1 248 . 1 1 70 70 VAL CB C 13 30.49 0.4 . 1 . . . . 70 V CB . 15529 1 249 . 1 1 70 70 VAL N N 15 116.96 0.4 . 1 . . . . 70 V N . 15529 1 250 . 1 1 71 71 SER H H 1 7.26 0.03 . 1 . . . . 71 S HN . 15529 1 251 . 1 1 71 71 SER CA C 13 63.75 0.4 . 1 . . . . 71 S CA . 15529 1 252 . 1 1 71 71 SER CB C 13 61.99 0.4 . 1 . . . . 71 S CB . 15529 1 253 . 1 1 71 71 SER N N 15 119.63 0.4 . 1 . . . . 71 S N . 15529 1 254 . 1 1 72 72 ILE H H 1 7.37 0.03 . 1 . . . . 72 I HN . 15529 1 255 . 1 1 72 72 ILE CA C 13 66.18 0.4 . 1 . . . . 72 I CA . 15529 1 256 . 1 1 72 72 ILE CB C 13 38.54 0.4 . 1 . . . . 72 I CB . 15529 1 257 . 1 1 72 72 ILE N N 15 121.14 0.4 . 1 . . . . 72 I N . 15529 1 258 . 1 1 73 73 GLU H H 1 7.02 0.03 . 1 . . . . 73 E HN . 15529 1 259 . 1 1 73 73 GLU CA C 13 59.35 0.4 . 1 . . . . 73 E CA . 15529 1 260 . 1 1 73 73 GLU CB C 13 28.76 0.4 . 1 . . . . 73 E CB . 15529 1 261 . 1 1 73 73 GLU N N 15 118.86 0.4 . 1 . . . . 73 E N . 15529 1 262 . 1 1 74 74 ILE H H 1 7.91 0.03 . 1 . . . . 74 I HN . 15529 1 263 . 1 1 74 74 ILE CA C 13 57.67 0.4 . 1 . . . . 74 I CA . 15529 1 264 . 1 1 74 74 ILE CB C 13 42.21 0.4 . 1 . . . . 74 I CB . 15529 1 265 . 1 1 74 74 ILE N N 15 120.70 0.4 . 1 . . . . 74 I N . 15529 1 266 . 1 1 75 75 PHE H H 1 8.04 0.03 . 1 . . . . 75 F HN . 15529 1 267 . 1 1 75 75 PHE CA C 13 56.80 0.4 . 1 . . . . 75 F CA . 15529 1 268 . 1 1 75 75 PHE CB C 13 41.06 0.4 . 1 . . . . 75 F CB . 15529 1 269 . 1 1 75 75 PHE N N 15 117.46 0.4 . 1 . . . . 75 F N . 15529 1 270 . 1 1 76 76 GLU H H 1 7.62 0.03 . 1 . . . . 76 E HN . 15529 1 271 . 1 1 76 76 GLU CA C 13 56.29 0.4 . 1 . . . . 76 E CA . 15529 1 272 . 1 1 76 76 GLU CB C 13 28.27 0.4 . 1 . . . . 76 E CB . 15529 1 273 . 1 1 76 76 GLU N N 15 116.94 0.4 . 1 . . . . 76 E N . 15529 1 274 . 1 1 77 77 LEU H H 1 7.70 0.03 . 1 . . . . 77 L HN . 15529 1 275 . 1 1 77 77 LEU CA C 13 56.69 0.4 . 1 . . . . 77 L CA . 15529 1 276 . 1 1 77 77 LEU CB C 13 41.82 0.4 . 1 . . . . 77 L CB . 15529 1 277 . 1 1 77 77 LEU N N 15 119.98 0.4 . 1 . . . . 77 L N . 15529 1 stop_ save_