################################### # 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 11512 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _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' . . . 11512 1 2 '2D 13C-13C DQSQ' . . . 11512 1 3 '2D (CA)i-(COCA)i-1' . . . 11512 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 1 1 MET C C 13 174.92 1.21 . 1 . . . . . 1 M C . 11512 1 2 . 1 1 1 1 MET CA C 13 55.63 1.43 . 1 . . . . . 1 M CA . 11512 1 3 . 1 1 1 1 MET CB C 13 33.66 1.44 . 1 . . . . . 1 M CB . 11512 1 4 . 1 1 2 2 GLN C C 13 175.77 1.07 . 1 . . . . . 2 Q C . 11512 1 5 . 1 1 2 2 GLN CA C 13 54.41 1.64 . 1 . . . . . 2 Q CA . 11512 1 6 . 1 1 2 2 GLN CB C 13 30.44 1.72 . 1 . . . . . 2 Q CB . 11512 1 7 . 1 1 3 3 ILE C C 13 174.84 1.06 . 1 . . . . . 3 I C . 11512 1 8 . 1 1 3 3 ILE CA C 13 58.53 0.95 . 1 . . . . . 3 I CA . 11512 1 9 . 1 1 3 3 ILE CB C 13 41.28 0.93 . 1 . . . . . 3 I CB . 11512 1 10 . 1 1 4 4 PHE C C 13 175.24 0.82 . 1 . . . . . 4 F C . 11512 1 11 . 1 1 4 4 PHE CA C 13 56.00 1.20 . 1 . . . . . 4 F CA . 11512 1 12 . 1 1 4 4 PHE CB C 13 41.66 1.00 . 1 . . . . . 4 F CB . 11512 1 13 . 1 1 5 5 VAL C C 13 174.94 1.24 . 1 . . . . . 5 V C . 11512 1 14 . 1 1 5 5 VAL CA C 13 60.19 1.46 . 1 . . . . . 5 V CA . 11512 1 15 . 1 1 5 5 VAL CB C 13 34.80 0.68 . 1 . . . . . 5 V CB . 11512 1 16 . 1 1 6 6 LYS C C 13 176.17 1.20 . 1 . . . . . 6 K C . 11512 1 17 . 1 1 6 6 LYS CA C 13 56.03 2.09 . 1 . . . . . 6 K CA . 11512 1 18 . 1 1 6 6 LYS CB C 13 34.88 1.29 . 1 . . . . . 6 K CB . 11512 1 19 . 1 1 7 7 THR C C 13 174.97 1.34 . 1 . . . . . 7 T C . 11512 1 20 . 1 1 7 7 THR CA C 13 60.71 1.09 . 1 . . . . . 7 T CA . 11512 1 21 . 1 1 7 7 THR CB C 13 70.82 0.99 . 1 . . . . . 7 T CB . 11512 1 22 . 1 1 8 8 LEU C C 13 177.78 1.39 . 1 . . . . . 8 L C . 11512 1 23 . 1 1 8 8 LEU CA C 13 56.68 2.10 . 1 . . . . . 8 L CA . 11512 1 24 . 1 1 8 8 LEU CB C 13 42.40 1.86 . 1 . . . . . 8 L CB . 11512 1 25 . 1 1 9 9 THR C C 13 175.07 1.12 . 1 . . . . . 9 T C . 11512 1 26 . 1 1 9 9 THR CA C 13 61.60 0.75 . 1 . . . . . 9 T CA . 11512 1 27 . 1 1 9 9 THR CB C 13 69.44 0.90 . 1 . . . . . 9 T CB . 11512 1 28 . 1 1 10 10 GLY C C 13 174.11 0.99 . 1 . . . . . 10 G C . 11512 1 29 . 1 1 10 10 GLY CA C 13 45.17 0.70 . 1 . . . . . 10 G CA . 11512 1 30 . 1 1 11 11 LYS C C 13 176.47 1.30 . 1 . . . . . 11 K C . 11512 1 31 . 1 1 11 11 LYS CA C 13 56.50 1.95 . 1 . . . . . 11 K CA . 11512 1 32 . 1 1 11 11 LYS CB C 13 34.38 1.38 . 1 . . . . . 11 K CB . 11512 1 33 . 1 1 12 12 THR C C 13 174.29 1.03 . 1 . . . . . 12 T C . 11512 1 34 . 1 1 12 12 THR CA C 13 61.54 1.29 . 1 . . . . . 12 T CA . 11512 1 35 . 1 1 12 12 THR CB C 13 70.66 1.24 . 1 . . . . . 12 T CB . 11512 1 36 . 1 1 13 13 ILE C C 13 175.63 1.38 . 1 . . . . . 13 I C . 11512 1 37 . 1 1 13 13 ILE CA C 13 60.42 1.70 . 1 . . . . . 13 I CA . 11512 1 38 . 1 1 13 13 ILE CB C 13 40.67 2.07 . 1 . . . . . 13 I CB . 11512 1 39 . 1 1 14 14 THR C C 13 173.78 0.96 . 1 . . . . . 14 T C . 11512 1 40 . 1 1 14 14 THR CA C 13 61.65 1.04 . 1 . . . . . 14 T CA . 11512 1 41 . 1 1 14 14 THR CB C 13 70.72 1.17 . 1 . . . . . 14 T CB . 11512 1 42 . 1 1 15 15 LEU C C 13 175.71 1.44 . 1 . . . . . 15 L C . 11512 1 43 . 1 1 15 15 LEU CA C 13 54.15 2.31 . 1 . . . . . 15 L CA . 11512 1 44 . 1 1 15 15 LEU CB C 13 44.96 1.83 . 1 . . . . . 15 L CB . 11512 1 45 . 1 1 16 16 GLU C C 13 175.85 1.12 . 1 . . . . . 16 E C . 11512 1 46 . 1 1 16 16 GLU CA C 13 55.06 1.38 . 1 . . . . . 16 E CA . 11512 1 47 . 1 1 16 16 GLU CB C 13 31.42 1.50 . 1 . . . . . 16 E CB . 11512 1 48 . 1 1 17 17 VAL C C 13 174.87 1.26 . 1 . . . . . 17 V C . 11512 1 49 . 1 1 17 17 VAL CA C 13 60.10 1.91 . 1 . . . . . 17 V CA . 11512 1 50 . 1 1 17 17 VAL CB C 13 34.58 0.95 . 1 . . . . . 17 V CB . 11512 1 51 . 1 1 18 18 GLU C C 13 175.05 1.54 . 1 . . . . . 18 E C . 11512 1 52 . 1 1 18 18 GLU CA C 13 54.49 1.81 . 1 . . . . . 18 E CA . 11512 1 53 . 1 1 18 18 GLU CB C 13 31.73 1.97 . 1 . . . . . 18 E CB . 11512 1 54 . 1 1 19 19 PRO C C 13 176.60 1.61 . 1 . . . . . 19 P C . 11512 1 55 . 1 1 19 19 PRO CA C 13 63.12 2.68 . 1 . . . . . 19 P CA . 11512 1 56 . 1 1 19 19 PRO CB C 13 33.32 1.04 . 1 . . . . . 19 P CB . 11512 1 57 . 1 1 20 20 SER C C 13 174.65 1.21 . 1 . . . . . 20 S C . 11512 1 58 . 1 1 20 20 SER CA C 13 58.96 2.48 . 1 . . . . . 20 S CA . 11512 1 59 . 1 1 20 20 SER CB C 13 64.48 1.03 . 1 . . . . . 20 S CB . 11512 1 60 . 1 1 21 21 ASP C C 13 177.51 1.50 . 1 . . . . . 21 D C . 11512 1 61 . 1 1 21 21 ASP CA C 13 55.63 1.63 . 1 . . . . . 21 D CA . 11512 1 62 . 1 1 21 21 ASP CB C 13 41.38 1.07 . 1 . . . . . 21 D CB . 11512 1 63 . 1 1 22 22 THR C C 13 174.76 1.59 . 1 . . . . . 22 T C . 11512 1 64 . 1 1 22 22 THR CA C 13 61.90 1.59 . 1 . . . . . 22 T CA . 11512 1 65 . 1 1 22 22 THR CB C 13 70.31 1.34 . 1 . . . . . 22 T CB . 11512 1 66 . 1 1 23 23 ILE C C 13 176.97 1.73 . 1 . . . . . 23 I C . 11512 1 67 . 1 1 23 23 ILE CA C 13 63.10 3.12 . 1 . . . . . 23 I CA . 11512 1 68 . 1 1 23 23 ILE CB C 13 38.49 1.86 . 1 . . . . . 23 I CB . 11512 1 69 . 1 1 24 24 GLU C C 13 177.67 2.17 . 1 . . . . . 24 E C . 11512 1 70 . 1 1 24 24 GLU CA C 13 58.21 1.90 . 1 . . . . . 24 E CA . 11512 1 71 . 1 1 24 24 GLU CB C 13 29.82 1.97 . 1 . . . . . 24 E CB . 11512 1 72 . 1 1 25 25 ASN C C 13 177.34 1.35 . 1 . . . . . 25 N C . 11512 1 73 . 1 1 25 25 ASN CA C 13 55.63 1.29 . 1 . . . . . 25 N CA . 11512 1 74 . 1 1 25 25 ASN CB C 13 39.53 1.00 . 1 . . . . . 25 N CB . 11512 1 75 . 1 1 26 26 VAL C C 13 177.44 1.43 . 1 . . . . . 26 V C . 11512 1 76 . 1 1 26 26 VAL CA C 13 65.30 3.14 . 1 . . . . . 26 V CA . 11512 1 77 . 1 1 26 26 VAL CB C 13 32.39 1.18 . 1 . . . . . 26 V CB . 11512 1 78 . 1 1 27 27 LYS C C 13 178.32 1.66 . 1 . . . . . 27 K C . 11512 1 79 . 1 1 27 27 LYS CA C 13 59.43 1.96 . 1 . . . . . 27 K CA . 11512 1 80 . 1 1 27 27 LYS CB C 13 33.57 0.62 . 1 . . . . . 27 K CB . 11512 1 81 . 1 1 28 28 ALA C C 13 179.99 0.66 . 1 . . . . . 28 A C . 11512 1 82 . 1 1 28 28 ALA CA C 13 55.02 0.22 . 1 . . . . . 28 A CA . 11512 1 83 . 1 1 28 28 ALA CB C 13 18.71 0.12 . 1 . . . . . 28 A CB . 11512 1 84 . 1 1 29 29 LYS C C 13 178.14 1.03 . 1 . . . . . 29 K C . 11512 1 85 . 1 1 29 29 LYS CA C 13 59.37 1.65 . 1 . . . . . 29 K CA . 11512 1 86 . 1 1 29 29 LYS CB C 13 33.66 0.56 . 1 . . . . . 29 K CB . 11512 1 87 . 1 1 30 30 ILE C C 13 177.25 1.66 . 1 . . . . . 30 I C . 11512 1 88 . 1 1 30 30 ILE CA C 13 63.36 3.19 . 1 . . . . . 30 I CA . 11512 1 89 . 1 1 30 30 ILE CB C 13 38.14 1.90 . 1 . . . . . 30 I CB . 11512 1 90 . 1 1 31 31 GLN C C 13 177.28 2.02 . 1 . . . . . 31 Q C . 11512 1 91 . 1 1 31 31 GLN CA C 13 57.85 2.46 . 1 . . . . . 31 Q CA . 11512 1 92 . 1 1 31 31 GLN CB C 13 28.72 1.64 . 1 . . . . . 31 Q CB . 11512 1 93 . 1 1 32 32 ASP C C 13 177.46 1.59 . 1 . . . . . 32 D C . 11512 1 94 . 1 1 32 32 ASP CA C 13 56.34 1.46 . 1 . . . . . 32 D CA . 11512 1 95 . 1 1 32 32 ASP CB C 13 41.56 1.08 . 1 . . . . . 32 D CB . 11512 1 96 . 1 1 33 33 LYS C C 13 176.86 1.37 . 1 . . . . . 33 K C . 11512 1 97 . 1 1 33 33 LYS CA C 13 57.30 1.85 . 1 . . . . . 33 K CA . 11512 1 98 . 1 1 33 33 LYS CB C 13 34.06 1.57 . 1 . . . . . 33 K CB . 11512 1 99 . 1 1 34 34 GLU C C 13 175.95 0.92 . 1 . . . . . 34 E C . 11512 1 100 . 1 1 34 34 GLU CA C 13 56.47 1.45 . 1 . . . . . 34 E CA . 11512 1 101 . 1 1 34 34 GLU CB C 13 29.98 1.78 . 1 . . . . . 34 E CB . 11512 1 102 . 1 1 35 35 GLY C C 13 174.46 0.92 . 1 . . . . . 35 G C . 11512 1 103 . 1 1 35 35 GLY CA C 13 45.48 0.69 . 1 . . . . . 35 G CA . 11512 1 104 . 1 1 36 36 ILE C C 13 174.78 1.32 . 1 . . . . . 36 I C . 11512 1 105 . 1 1 36 36 ILE CA C 13 60.07 2.09 . 1 . . . . . 36 I CA . 11512 1 106 . 1 1 36 36 ILE CB C 13 38.77 2.68 . 1 . . . . . 36 I CB . 11512 1 107 . 1 1 37 37 PRO C C 13 174.68 1.82 . 1 . . . . . 37 P C . 11512 1 108 . 1 1 37 37 PRO CA C 13 61.72 1.18 . 1 . . . . . 37 P CA . 11512 1 109 . 1 1 37 37 PRO CB C 13 33.72 0.88 . 1 . . . . . 37 P CB . 11512 1 110 . 1 1 38 38 PRO C C 13 175.56 2.14 . 1 . . . . . 38 P C . 11512 1 111 . 1 1 38 38 PRO CA C 13 63.55 2.67 . 1 . . . . . 38 P CA . 11512 1 112 . 1 1 38 38 PRO CB C 13 33.32 1.07 . 1 . . . . . 38 P CB . 11512 1 113 . 1 1 39 39 ASP C C 13 176.07 1.26 . 1 . . . . . 39 D C . 11512 1 114 . 1 1 39 39 ASP CA C 13 54.89 1.47 . 1 . . . . . 39 D CA . 11512 1 115 . 1 1 39 39 ASP CB C 13 41.42 1.47 . 1 . . . . . 39 D CB . 11512 1 116 . 1 1 40 40 GLN C C 13 175.09 1.36 . 1 . . . . . 40 Q C . 11512 1 117 . 1 1 40 40 GLN CA C 13 55.30 1.42 . 1 . . . . . 40 Q CA . 11512 1 118 . 1 1 40 40 GLN CB C 13 30.19 1.74 . 1 . . . . . 40 Q CB . 11512 1 119 . 1 1 41 41 GLN C C 13 175.15 1.26 . 1 . . . . . 41 Q C . 11512 1 120 . 1 1 41 41 GLN CA C 13 54.49 1.56 . 1 . . . . . 41 Q CA . 11512 1 121 . 1 1 41 41 GLN CB C 13 30.29 1.46 . 1 . . . . . 41 Q CB . 11512 1 122 . 1 1 42 42 ARG C C 13 174.92 1.29 . 1 . . . . . 42 R C . 11512 1 123 . 1 1 42 42 ARG CA C 13 55.60 1.58 . 1 . . . . . 42 R CA . 11512 1 124 . 1 1 42 42 ARG CB C 13 32.67 1.77 . 1 . . . . . 42 R CB . 11512 1 125 . 1 1 43 43 LEU C C 13 176.81 1.47 . 1 . . . . . 43 L C . 11512 1 126 . 1 1 43 43 LEU CA C 13 54.72 1.96 . 1 . . . . . 43 L CA . 11512 1 127 . 1 1 43 43 LEU CB C 13 43.90 2.05 . 1 . . . . . 43 L CB . 11512 1 128 . 1 1 44 44 ILE C C 13 175.72 1.37 . 1 . . . . . 44 I C . 11512 1 129 . 1 1 44 44 ILE CA C 13 59.54 2.47 . 1 . . . . . 44 I CA . 11512 1 130 . 1 1 44 44 ILE CB C 13 40.31 1.93 . 1 . . . . . 44 I CB . 11512 1 131 . 1 1 45 45 PHE C C 13 174.96 1.13 . 1 . . . . . 45 F C . 11512 1 132 . 1 1 45 45 PHE CA C 13 56.79 1.63 . 1 . . . . . 45 F CA . 11512 1 133 . 1 1 45 45 PHE CB C 13 40.97 1.33 . 1 . . . . . 45 F CB . 11512 1 134 . 1 1 46 46 ALA C C 13 177.60 1.00 . 1 . . . . . 46 A C . 11512 1 135 . 1 1 46 46 ALA CA C 13 54.14 1.23 . 1 . . . . . 46 A CA . 11512 1 136 . 1 1 46 46 ALA CB C 13 18.50 0.40 . 1 . . . . . 46 A CB . 11512 1 137 . 1 1 47 47 GLY C C 13 173.70 0.90 . 1 . . . . . 47 G C . 11512 1 138 . 1 1 47 47 GLY CA C 13 45.65 0.59 . 1 . . . . . 47 G CA . 11512 1 139 . 1 1 48 48 LYS C C 13 175.64 1.46 . 1 . . . . . 48 K C . 11512 1 140 . 1 1 48 48 LYS CA C 13 55.68 2.20 . 1 . . . . . 48 K CA . 11512 1 141 . 1 1 48 48 LYS CB C 13 34.74 1.78 . 1 . . . . . 48 K CB . 11512 1 142 . 1 1 49 49 GLN C C 13 175.48 1.39 . 1 . . . . . 49 Q C . 11512 1 143 . 1 1 49 49 GLN CA C 13 54.99 1.66 . 1 . . . . . 49 Q CA . 11512 1 144 . 1 1 49 49 GLN CB C 13 30.13 1.73 . 1 . . . . . 49 Q CB . 11512 1 145 . 1 1 50 50 LEU C C 13 177.69 1.98 . 1 . . . . . 50 L C . 11512 1 146 . 1 1 50 50 LEU CA C 13 56.24 2.11 . 1 . . . . . 50 L CA . 11512 1 147 . 1 1 50 50 LEU CB C 13 42.56 1.65 . 1 . . . . . 50 L CB . 11512 1 148 . 1 1 51 51 GLU C C 13 176.67 1.81 . 1 . . . . . 51 E C . 11512 1 149 . 1 1 51 51 GLU CA C 13 56.57 1.83 . 1 . . . . . 51 E CA . 11512 1 150 . 1 1 51 51 GLU CB C 13 30.58 1.81 . 1 . . . . . 51 E CB . 11512 1 151 . 1 1 52 52 ASP C C 13 176.17 1.05 . 1 . . . . . 52 D C . 11512 1 152 . 1 1 52 52 ASP CA C 13 55.91 1.24 . 1 . . . . . 52 D CA . 11512 1 153 . 1 1 52 52 ASP CB C 13 41.16 1.09 . 1 . . . . . 52 D CB . 11512 1 154 . 1 1 53 53 GLY C C 13 173.83 1.03 . 1 . . . . . 53 G C . 11512 1 155 . 1 1 53 53 GLY CA C 13 45.30 0.71 . 1 . . . . . 53 G CA . 11512 1 156 . 1 1 54 54 ARG C C 13 176.25 1.37 . 1 . . . . . 54 R C . 11512 1 157 . 1 1 54 54 ARG CA C 13 55.37 1.63 . 1 . . . . . 54 R CA . 11512 1 158 . 1 1 54 54 ARG CB C 13 32.29 1.55 . 1 . . . . . 54 R CB . 11512 1 159 . 1 1 55 55 THR C C 13 175.24 1.48 . 1 . . . . . 55 T C . 11512 1 160 . 1 1 55 55 THR CA C 13 60.94 1.36 . 1 . . . . . 55 T CA . 11512 1 161 . 1 1 55 55 THR CB C 13 70.65 1.23 . 1 . . . . . 55 T CB . 11512 1 162 . 1 1 56 56 LEU C C 13 178.25 1.91 . 1 . . . . . 56 L C . 11512 1 163 . 1 1 56 56 LEU CA C 13 56.93 2.51 . 1 . . . . . 56 L CA . 11512 1 164 . 1 1 56 56 LEU CB C 13 42.64 1.69 . 1 . . . . . 56 L CB . 11512 1 165 . 1 1 57 57 SER C C 13 175.02 1.34 . 1 . . . . . 57 S C . 11512 1 166 . 1 1 57 57 SER CA C 13 59.90 2.44 . 1 . . . . . 57 S CA . 11512 1 167 . 1 1 57 57 SER CB C 13 64.17 0.96 . 1 . . . . . 57 S CB . 11512 1 168 . 1 1 58 58 ASP C C 13 176.69 1.31 . 1 . . . . . 58 D C . 11512 1 169 . 1 1 58 58 ASP CA C 13 55.60 1.54 . 1 . . . . . 58 D CA . 11512 1 170 . 1 1 58 58 ASP CB C 13 41.91 1.52 . 1 . . . . . 58 D CB . 11512 1 171 . 1 1 59 59 TYR C C 13 175.31 1.80 . 1 . . . . . 59 Y C . 11512 1 172 . 1 1 59 59 TYR CA C 13 57.17 1.24 . 1 . . . . . 59 Y CA . 11512 1 173 . 1 1 59 59 TYR CB C 13 39.61 1.89 . 1 . . . . . 59 Y CB . 11512 1 174 . 1 1 60 60 ASN C C 13 175.61 1.09 . 1 . . . . . 60 N C . 11512 1 175 . 1 1 60 60 ASN CA C 13 54.53 0.86 . 1 . . . . . 60 N CA . 11512 1 176 . 1 1 60 60 ASN CB C 13 39.42 1.44 . 1 . . . . . 60 N CB . 11512 1 177 . 1 1 61 61 ILE C C 13 174.85 1.17 . 1 . . . . . 61 I C . 11512 1 178 . 1 1 61 61 ILE CA C 13 58.91 1.51 . 1 . . . . . 61 I CA . 11512 1 179 . 1 1 61 61 ILE CB C 13 40.82 1.72 . 1 . . . . . 61 I CB . 11512 1 180 . 1 1 62 62 GLN C C 13 175.18 1.22 . 1 . . . . . 62 Q C . 11512 1 181 . 1 1 62 62 GLN CA C 13 55.06 1.90 . 1 . . . . . 62 Q CA . 11512 1 182 . 1 1 62 62 GLN CB C 13 30.28 2.06 . 1 . . . . . 62 Q CB . 11512 1 183 . 1 1 63 63 LYS C C 13 176.48 1.57 . 1 . . . . . 63 K C . 11512 1 184 . 1 1 63 63 LYS CA C 13 56.34 1.82 . 1 . . . . . 63 K CA . 11512 1 185 . 1 1 63 63 LYS CB C 13 34.28 1.42 . 1 . . . . . 63 K CB . 11512 1 186 . 1 1 64 64 GLU C C 13 176.13 1.30 . 1 . . . . . 64 E C . 11512 1 187 . 1 1 64 64 GLU CA C 13 55.56 1.42 . 1 . . . . . 64 E CA . 11512 1 188 . 1 1 64 64 GLU CB C 13 31.30 1.89 . 1 . . . . . 64 E CB . 11512 1 189 . 1 1 65 65 SER C C 13 175.23 1.53 . 1 . . . . . 65 S C . 11512 1 190 . 1 1 65 65 SER CA C 13 59.19 2.47 . 1 . . . . . 65 S CA . 11512 1 191 . 1 1 65 65 SER CB C 13 64.52 1.04 . 1 . . . . . 65 S CB . 11512 1 192 . 1 1 66 66 THR C C 13 173.90 1.27 . 1 . . . . . 66 T C . 11512 1 193 . 1 1 66 66 THR CA C 13 61.90 1.41 . 1 . . . . . 66 T CA . 11512 1 194 . 1 1 66 66 THR CB C 13 70.54 1.31 . 1 . . . . . 66 T CB . 11512 1 195 . 1 1 67 67 LEU C C 13 177.08 2.37 . 1 . . . . . 67 L C . 11512 1 196 . 1 1 67 67 LEU CA C 13 55.94 2.65 . 1 . . . . . 67 L CA . 11512 1 197 . 1 1 67 67 LEU CB C 13 43.36 2.06 . 1 . . . . . 67 L CB . 11512 1 198 . 1 1 68 68 HIS C C 13 175.05 1.54 . 1 . . . . . 68 H C . 11512 1 199 . 1 1 68 68 HIS CA C 13 55.79 2.16 . 1 . . . . . 68 H CA . 11512 1 200 . 1 1 68 68 HIS CB C 13 30.54 2.42 . 1 . . . . . 68 H CB . 11512 1 201 . 1 1 69 69 LEU C C 13 176.82 1.68 . 1 . . . . . 69 L C . 11512 1 202 . 1 1 69 69 LEU CA C 13 55.17 2.16 . 1 . . . . . 69 L CA . 11512 1 203 . 1 1 69 69 LEU CB C 13 43.91 2.37 . 1 . . . . . 69 L CB . 11512 1 204 . 1 1 70 70 VAL C C 13 175.37 1.71 . 1 . . . . . 70 V C . 11512 1 205 . 1 1 70 70 VAL CA C 13 61.37 2.87 . 1 . . . . . 70 V CA . 11512 1 206 . 1 1 70 70 VAL CB C 13 34.29 1.24 . 1 . . . . . 70 V CB . 11512 1 207 . 1 1 71 71 LEU C C 13 176.62 1.91 . 1 . . . . . 71 L C . 11512 1 208 . 1 1 71 71 LEU CA C 13 55.10 2.44 . 1 . . . . . 71 L CA . 11512 1 209 . 1 1 71 71 LEU CB C 13 43.76 2.00 . 1 . . . . . 71 L CB . 11512 1 210 . 1 1 72 72 ARG C C 13 175.91 1.73 . 1 . . . . . 72 R C . 11512 1 211 . 1 1 72 72 ARG CA C 13 55.90 2.06 . 1 . . . . . 72 R CA . 11512 1 212 . 1 1 72 72 ARG CB C 13 31.85 2.21 . 1 . . . . . 72 R CB . 11512 1 213 . 1 1 73 73 LEU C C 13 177.66 1.99 . 1 . . . . . 73 L C . 11512 1 214 . 1 1 73 73 LEU CA C 13 55.84 1.95 . 1 . . . . . 73 L CA . 11512 1 215 . 1 1 73 73 LEU CB C 13 42.79 1.73 . 1 . . . . . 73 L CB . 11512 1 216 . 1 1 74 74 ARG C C 13 175.68 0.82 . 1 . . . . . 74 R C . 11512 1 217 . 1 1 74 74 ARG CA C 13 56.33 1.09 . 1 . . . . . 74 R CA . 11512 1 218 . 1 1 74 74 ARG CB C 13 32.13 1.42 . 1 . . . . . 74 R CB . 11512 1 219 . 1 1 75 75 GLY C C 13 174.69 0.82 . 1 . . . . . 75 G C . 11512 1 220 . 1 1 75 75 GLY CA C 13 44.53 0.54 . 1 . . . . . 75 G CA . 11512 1 221 . 1 1 76 76 GLY C C 13 174.69 0.83 . 1 . . . . . 76 G C . 11512 1 222 . 1 1 76 76 GLY CA C 13 45.64 0.71 . 1 . . . . . 76 G CA . 11512 1 stop_ save_