################################### # 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 53717 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name Assigned_chem_shift_list_HsR7 _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 $chem_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' . . . 53717 1 2 '3D HNCACB' . . . 53717 1 3 '3D CBCA(CO)NH' . . . 53717 1 stop_ loop_ _Chem_shift_software.Software_ID _Chem_shift_software.Software_label _Chem_shift_software.Method_ID _Chem_shift_software.Method_label _Chem_shift_software.Entry_ID _Chem_shift_software.Assigned_chem_shift_list_ID 1 $software_1 . . 53717 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_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 LYS CA C 13 58.05 0.30 . 1 . . . . . 3 LYS CA . 53717 1 2 . 1 . 1 3 3 LYS CB C 13 32.39 0.30 . 1 . . . . . 3 LYS CB . 53717 1 3 . 1 . 1 4 4 GLY H H 1 8.73 0.02 . 1 . . . . . 4 GLY H . 53717 1 4 . 1 . 1 4 4 GLY CA C 13 45.36 0.30 . 1 . . . . . 4 GLY CA . 53717 1 5 . 1 . 1 4 4 GLY N N 15 110.44 0.30 . 1 . . . . . 4 GLY N . 53717 1 6 . 1 . 1 5 5 MET H H 1 7.37 0.02 . 1 . . . . . 5 MET H . 53717 1 7 . 1 . 1 5 5 MET CA C 13 55.10 0.30 . 1 . . . . . 5 MET CA . 53717 1 8 . 1 . 1 5 5 MET CB C 13 35.30 0.30 . 1 . . . . . 5 MET CB . 53717 1 9 . 1 . 1 5 5 MET N N 15 118.98 0.30 . 1 . . . . . 5 MET N . 53717 1 10 . 1 . 1 6 6 THR H H 1 8.71 0.02 . 1 . . . . . 6 THR H . 53717 1 11 . 1 . 1 6 6 THR CA C 13 61.12 0.30 . 1 . . . . . 6 THR CA . 53717 1 12 . 1 . 1 6 6 THR CB C 13 69.53 0.30 . 1 . . . . . 6 THR CB . 53717 1 13 . 1 . 1 6 6 THR N N 15 114.95 0.30 . 1 . . . . . 6 THR N . 53717 1 14 . 1 . 1 7 7 SER H H 1 8.96 0.02 . 1 . . . . . 7 SER H . 53717 1 15 . 1 . 1 7 7 SER CA C 13 63.20 0.30 . 1 . . . . . 7 SER CA . 53717 1 16 . 1 . 1 7 7 SER CB C 13 62.42 0.30 . 1 . . . . . 7 SER CB . 53717 1 17 . 1 . 1 7 7 SER N N 15 117.89 0.30 . 1 . . . . . 7 SER N . 53717 1 18 . 1 . 1 8 8 SER H H 1 10.03 0.02 . 1 . . . . . 8 SER H . 53717 1 19 . 1 . 1 8 8 SER CA C 13 60.84 0.30 . 1 . . . . . 8 SER CA . 53717 1 20 . 1 . 1 8 8 SER CB C 13 63.30 0.30 . 1 . . . . . 8 SER CB . 53717 1 21 . 1 . 1 8 8 SER N N 15 119.47 0.30 . 1 . . . . . 8 SER N . 53717 1 22 . 1 . 1 9 9 GLN H H 1 8.27 0.02 . 1 . . . . . 9 GLN H . 53717 1 23 . 1 . 1 9 9 GLN CA C 13 59.37 0.30 . 1 . . . . . 9 GLN CA . 53717 1 24 . 1 . 1 9 9 GLN CB C 13 28.43 0.30 . 1 . . . . . 9 GLN CB . 53717 1 25 . 1 . 1 9 9 GLN N N 15 122.65 0.30 . 1 . . . . . 9 GLN N . 53717 1 26 . 1 . 1 10 10 TRP H H 1 8.41 0.02 . 1 . . . . . 10 TRP H . 53717 1 27 . 1 . 1 10 10 TRP HE1 H 1 10.07 0.02 . 1 . . . . . 10 TRP HE1 . 53717 1 28 . 1 . 1 10 10 TRP CA C 13 58.23 0.30 . 1 . . . . . 10 TRP CA . 53717 1 29 . 1 . 1 10 10 TRP CB C 13 31.68 0.30 . 1 . . . . . 10 TRP CB . 53717 1 30 . 1 . 1 10 10 TRP N N 15 120.59 0.30 . 1 . . . . . 10 TRP N . 53717 1 31 . 1 . 1 10 10 TRP NE1 N 15 129.76 0.30 . 1 . . . . . 10 TRP NE1 . 53717 1 32 . 1 . 1 11 11 PHE H H 1 8.42 0.02 . 1 . . . . . 11 PHE H . 53717 1 33 . 1 . 1 11 11 PHE CA C 13 62.31 0.30 . 1 . . . . . 11 PHE CA . 53717 1 34 . 1 . 1 11 11 PHE CB C 13 39.12 0.30 . 1 . . . . . 11 PHE CB . 53717 1 35 . 1 . 1 11 11 PHE N N 15 120.81 0.30 . 1 . . . . . 11 PHE N . 53717 1 36 . 1 . 1 12 12 LYS H H 1 8.11 0.02 . 1 . . . . . 12 LYS H . 53717 1 37 . 1 . 1 12 12 LYS CA C 13 60.69 0.30 . 1 . . . . . 12 LYS CA . 53717 1 38 . 1 . 1 12 12 LYS CB C 13 32.44 0.30 . 1 . . . . . 12 LYS CB . 53717 1 39 . 1 . 1 12 12 LYS N N 15 118.82 0.30 . 1 . . . . . 12 LYS N . 53717 1 40 . 1 . 1 13 13 ILE H H 1 7.90 0.02 . 1 . . . . . 13 ILE H . 53717 1 41 . 1 . 1 13 13 ILE CA C 13 64.35 0.30 . 1 . . . . . 13 ILE CA . 53717 1 42 . 1 . 1 13 13 ILE CB C 13 38.30 0.30 . 1 . . . . . 13 ILE CB . 53717 1 43 . 1 . 1 13 13 ILE N N 15 119.06 0.30 . 1 . . . . . 13 ILE N . 53717 1 44 . 1 . 1 14 14 GLN H H 1 7.50 0.02 . 1 . . . . . 14 GLN H . 53717 1 45 . 1 . 1 14 14 GLN CA C 13 58.29 0.30 . 1 . . . . . 14 GLN CA . 53717 1 46 . 1 . 1 14 14 GLN CB C 13 30.39 0.30 . 1 . . . . . 14 GLN CB . 53717 1 47 . 1 . 1 14 14 GLN N N 15 114.15 0.30 . 1 . . . . . 14 GLN N . 53717 1 48 . 1 . 1 15 15 HIS H H 1 7.48 0.02 . 1 . . . . . 15 HIS H . 53717 1 49 . 1 . 1 15 15 HIS CA C 13 55.24 0.30 . 1 . . . . . 15 HIS CA . 53717 1 50 . 1 . 1 15 15 HIS CB C 13 30.86 0.30 . 1 . . . . . 15 HIS CB . 53717 1 51 . 1 . 1 15 15 HIS N N 15 105.73 0.30 . 1 . . . . . 15 HIS N . 53717 1 52 . 1 . 1 16 16 MET H H 1 8.17 0.02 . 1 . . . . . 16 MET H . 53717 1 53 . 1 . 1 16 16 MET CA C 13 53.56 0.30 . 1 . . . . . 16 MET CA . 53717 1 54 . 1 . 1 16 16 MET CB C 13 29.34 0.30 . 1 . . . . . 16 MET CB . 53717 1 55 . 1 . 1 16 16 MET N N 15 116.92 0.30 . 1 . . . . . 16 MET N . 53717 1 56 . 1 . 1 17 17 GLN H H 1 8.56 0.02 . 1 . . . . . 17 GLN H . 53717 1 57 . 1 . 1 17 17 GLN CA C 13 53.46 0.30 . 1 . . . . . 17 GLN CA . 53717 1 58 . 1 . 1 17 17 GLN CB C 13 33.24 0.30 . 1 . . . . . 17 GLN CB . 53717 1 59 . 1 . 1 17 17 GLN N N 15 124.56 0.30 . 1 . . . . . 17 GLN N . 53717 1 60 . 1 . 1 18 18 PRO CA C 13 66.41 0.30 . 1 . . . . . 18 PRO CA . 53717 1 61 . 1 . 1 18 18 PRO CB C 13 31.88 0.30 . 1 . . . . . 18 PRO CB . 53717 1 62 . 1 . 1 19 19 SER H H 1 7.51 0.02 . 1 . . . . . 19 SER H . 53717 1 63 . 1 . 1 19 19 SER CA C 13 54.07 0.30 . 1 . . . . . 19 SER CA . 53717 1 64 . 1 . 1 19 19 SER CB C 13 63.56 0.30 . 1 . . . . . 19 SER CB . 53717 1 65 . 1 . 1 19 19 SER N N 15 110.47 0.30 . 1 . . . . . 19 SER N . 53717 1 66 . 1 . 1 20 20 PRO CA C 13 64.01 0.30 . 1 . . . . . 20 PRO CA . 53717 1 67 . 1 . 1 20 20 PRO CB C 13 32.09 0.30 . 1 . . . . . 20 PRO CB . 53717 1 68 . 1 . 1 21 21 GLN H H 1 7.37 0.02 . 1 . . . . . 21 GLN H . 53717 1 69 . 1 . 1 21 21 GLN CA C 13 53.05 0.30 . 1 . . . . . 21 GLN CA . 53717 1 70 . 1 . 1 21 21 GLN CB C 13 32.88 0.30 . 1 . . . . . 21 GLN CB . 53717 1 71 . 1 . 1 21 21 GLN N N 15 122.30 0.30 . 1 . . . . . 21 GLN N . 53717 1 72 . 1 . 1 22 22 ALA H H 1 8.49 0.02 . 1 . . . . . 22 ALA H . 53717 1 73 . 1 . 1 22 22 ALA CA C 13 52.12 0.30 . 1 . . . . . 22 ALA CA . 53717 1 74 . 1 . 1 22 22 ALA CB C 13 18.81 0.30 . 1 . . . . . 22 ALA CB . 53717 1 75 . 1 . 1 22 22 ALA N N 15 125.42 0.30 . 1 . . . . . 22 ALA N . 53717 1 76 . 1 . 1 23 23 CYS H H 1 9.43 0.02 . 1 . . . . . 23 CYS H . 53717 1 77 . 1 . 1 23 23 CYS CA C 13 60.86 0.30 . 1 . . . . . 23 CYS CA . 53717 1 78 . 1 . 1 23 23 CYS CB C 13 41.26 0.30 . 1 . . . . . 23 CYS CB . 53717 1 79 . 1 . 1 23 23 CYS N N 15 121.20 0.30 . 1 . . . . . 23 CYS N . 53717 1 80 . 1 . 1 24 24 ASN H H 1 9.19 0.02 . 1 . . . . . 24 ASN H . 53717 1 81 . 1 . 1 24 24 ASN CA C 13 56.65 0.30 . 1 . . . . . 24 ASN CA . 53717 1 82 . 1 . 1 24 24 ASN CB C 13 37.24 0.30 . 1 . . . . . 24 ASN CB . 53717 1 83 . 1 . 1 24 24 ASN N N 15 115.87 0.30 . 1 . . . . . 24 ASN N . 53717 1 84 . 1 . 1 25 25 SER H H 1 7.09 0.02 . 1 . . . . . 25 SER H . 53717 1 85 . 1 . 1 25 25 SER CA C 13 60.07 0.30 . 1 . . . . . 25 SER CA . 53717 1 86 . 1 . 1 25 25 SER CB C 13 62.93 0.30 . 1 . . . . . 25 SER CB . 53717 1 87 . 1 . 1 25 25 SER N N 15 111.86 0.30 . 1 . . . . . 25 SER N . 53717 1 88 . 1 . 1 26 26 ALA H H 1 8.43 0.02 . 1 . . . . . 26 ALA H . 53717 1 89 . 1 . 1 26 26 ALA CA C 13 54.80 0.30 . 1 . . . . . 26 ALA CA . 53717 1 90 . 1 . 1 26 26 ALA CB C 13 19.95 0.30 . 1 . . . . . 26 ALA CB . 53717 1 91 . 1 . 1 26 26 ALA N N 15 125.15 0.30 . 1 . . . . . 26 ALA N . 53717 1 92 . 1 . 1 27 27 MET H H 1 8.71 0.02 . 1 . . . . . 27 MET H . 53717 1 93 . 1 . 1 27 27 MET CA C 13 54.83 0.30 . 1 . . . . . 27 MET CA . 53717 1 94 . 1 . 1 27 27 MET CB C 13 29.07 0.30 . 1 . . . . . 27 MET CB . 53717 1 95 . 1 . 1 27 27 MET N N 15 112.25 0.30 . 1 . . . . . 27 MET N . 53717 1 96 . 1 . 1 28 28 LYS H H 1 7.34 0.02 . 1 . . . . . 28 LYS H . 53717 1 97 . 1 . 1 28 28 LYS CA C 13 60.19 0.30 . 1 . . . . . 28 LYS CA . 53717 1 98 . 1 . 1 28 28 LYS CB C 13 32.26 0.30 . 1 . . . . . 28 LYS CB . 53717 1 99 . 1 . 1 28 28 LYS N N 15 120.17 0.30 . 1 . . . . . 28 LYS N . 53717 1 100 . 1 . 1 29 29 ASN H H 1 7.40 0.02 . 1 . . . . . 29 ASN H . 53717 1 101 . 1 . 1 29 29 ASN CA C 13 55.42 0.30 . 1 . . . . . 29 ASN CA . 53717 1 102 . 1 . 1 29 29 ASN CB C 13 38.57 0.30 . 1 . . . . . 29 ASN CB . 53717 1 103 . 1 . 1 29 29 ASN N N 15 114.03 0.30 . 1 . . . . . 29 ASN N . 53717 1 104 . 1 . 1 30 30 ILE H H 1 7.07 0.02 . 1 . . . . . 30 ILE H . 53717 1 105 . 1 . 1 30 30 ILE CA C 13 64.02 0.30 . 1 . . . . . 30 ILE CA . 53717 1 106 . 1 . 1 30 30 ILE CB C 13 38.62 0.30 . 1 . . . . . 30 ILE CB . 53717 1 107 . 1 . 1 30 30 ILE N N 15 117.59 0.30 . 1 . . . . . 30 ILE N . 53717 1 108 . 1 . 1 31 31 ASN H H 1 8.48 0.02 . 1 . . . . . 31 ASN H . 53717 1 109 . 1 . 1 31 31 ASN CA C 13 54.77 0.30 . 1 . . . . . 31 ASN CA . 53717 1 110 . 1 . 1 31 31 ASN CB C 13 38.40 0.30 . 1 . . . . . 31 ASN CB . 53717 1 111 . 1 . 1 31 31 ASN N N 15 116.35 0.30 . 1 . . . . . 31 ASN N . 53717 1 112 . 1 . 1 32 32 LYS H H 1 7.53 0.02 . 1 . . . . . 32 LYS H . 53717 1 113 . 1 . 1 32 32 LYS CA C 13 58.70 0.30 . 1 . . . . . 32 LYS CA . 53717 1 114 . 1 . 1 32 32 LYS CB C 13 31.90 0.30 . 1 . . . . . 32 LYS CB . 53717 1 115 . 1 . 1 32 32 LYS N N 15 119.37 0.30 . 1 . . . . . 32 LYS N . 53717 1 116 . 1 . 1 33 33 HIS H H 1 7.74 0.02 . 1 . . . . . 33 HIS H . 53717 1 117 . 1 . 1 33 33 HIS CA C 13 55.36 0.30 . 1 . . . . . 33 HIS CA . 53717 1 118 . 1 . 1 33 33 HIS CB C 13 31.28 0.30 . 1 . . . . . 33 HIS CB . 53717 1 119 . 1 . 1 33 33 HIS N N 15 115.74 0.30 . 1 . . . . . 33 HIS N . 53717 1 120 . 1 . 1 38 38 LYS CA C 13 57.46 0.30 . 1 . . . . . 38 LYS CA . 53717 1 121 . 1 . 1 38 38 LYS CB C 13 32.59 0.30 . 1 . . . . . 38 LYS CB . 53717 1 122 . 1 . 1 39 39 ASP H H 1 8.99 0.02 . 1 . . . . . 39 ASP H . 53717 1 123 . 1 . 1 39 39 ASP CA C 13 57.49 0.30 . 1 . . . . . 39 ASP CA . 53717 1 124 . 1 . 1 39 39 ASP CB C 13 41.67 0.30 . 1 . . . . . 39 ASP CB . 53717 1 125 . 1 . 1 39 39 ASP N N 15 128.38 0.30 . 1 . . . . . 39 ASP N . 53717 1 126 . 1 . 1 40 40 LEU H H 1 7.74 0.02 . 1 . . . . . 40 LEU H . 53717 1 127 . 1 . 1 40 40 LEU CA C 13 54.01 0.30 . 1 . . . . . 40 LEU CA . 53717 1 128 . 1 . 1 40 40 LEU CB C 13 45.42 0.30 . 1 . . . . . 40 LEU CB . 53717 1 129 . 1 . 1 40 40 LEU N N 15 119.14 0.30 . 1 . . . . . 40 LEU N . 53717 1 130 . 1 . 1 41 41 ASN H H 1 8.59 0.02 . 1 . . . . . 41 ASN H . 53717 1 131 . 1 . 1 41 41 ASN CA C 13 53.69 0.30 . 1 . . . . . 41 ASN CA . 53717 1 132 . 1 . 1 41 41 ASN CB C 13 44.74 0.30 . 1 . . . . . 41 ASN CB . 53717 1 133 . 1 . 1 41 41 ASN N N 15 120.63 0.30 . 1 . . . . . 41 ASN N . 53717 1 134 . 1 . 1 42 42 THR H H 1 7.56 0.02 . 1 . . . . . 42 THR H . 53717 1 135 . 1 . 1 42 42 THR CA C 13 62.26 0.30 . 1 . . . . . 42 THR CA . 53717 1 136 . 1 . 1 42 42 THR CB C 13 69.94 0.30 . 1 . . . . . 42 THR CB . 53717 1 137 . 1 . 1 42 42 THR N N 15 122.47 0.30 . 1 . . . . . 42 THR N . 53717 1 138 . 1 . 1 43 43 PHE H H 1 9.34 0.02 . 1 . . . . . 43 PHE H . 53717 1 139 . 1 . 1 43 43 PHE CA C 13 56.22 0.30 . 1 . . . . . 43 PHE CA . 53717 1 140 . 1 . 1 43 43 PHE CB C 13 42.32 0.30 . 1 . . . . . 43 PHE CB . 53717 1 141 . 1 . 1 43 43 PHE N N 15 124.75 0.30 . 1 . . . . . 43 PHE N . 53717 1 142 . 1 . 1 44 44 LEU H H 1 9.27 0.02 . 1 . . . . . 44 LEU H . 53717 1 143 . 1 . 1 44 44 LEU CA C 13 54.06 0.30 . 1 . . . . . 44 LEU CA . 53717 1 144 . 1 . 1 44 44 LEU CB C 13 42.99 0.30 . 1 . . . . . 44 LEU CB . 53717 1 145 . 1 . 1 44 44 LEU N N 15 120.53 0.30 . 1 . . . . . 44 LEU N . 53717 1 146 . 1 . 1 45 45 HIS H H 1 8.64 0.02 . 1 . . . . . 45 HIS H . 53717 1 147 . 1 . 1 45 45 HIS CA C 13 52.61 0.30 . 1 . . . . . 45 HIS CA . 53717 1 148 . 1 . 1 45 45 HIS CB C 13 26.04 0.30 . 1 . . . . . 45 HIS CB . 53717 1 149 . 1 . 1 45 45 HIS N N 15 124.34 0.30 . 1 . . . . . 45 HIS N . 53717 1 150 . 1 . 1 46 46 GLU H H 1 6.92 0.02 . 1 . . . . . 46 GLU H . 53717 1 151 . 1 . 1 46 46 GLU CA C 13 52.76 0.30 . 1 . . . . . 46 GLU CA . 53717 1 152 . 1 . 1 46 46 GLU CB C 13 34.74 0.30 . 1 . . . . . 46 GLU CB . 53717 1 153 . 1 . 1 46 46 GLU N N 15 120.66 0.30 . 1 . . . . . 46 GLU N . 53717 1 154 . 1 . 1 47 47 PRO CA C 13 62.19 0.30 . 1 . . . . . 47 PRO CA . 53717 1 155 . 1 . 1 47 47 PRO CB C 13 32.01 0.30 . 1 . . . . . 47 PRO CB . 53717 1 156 . 1 . 1 48 48 PHE H H 1 9.38 0.02 . 1 . . . . . 48 PHE H . 53717 1 157 . 1 . 1 48 48 PHE CA C 13 62.47 0.30 . 1 . . . . . 48 PHE CA . 53717 1 158 . 1 . 1 48 48 PHE CB C 13 38.69 0.30 . 1 . . . . . 48 PHE CB . 53717 1 159 . 1 . 1 48 48 PHE N N 15 124.65 0.30 . 1 . . . . . 48 PHE N . 53717 1 160 . 1 . 1 49 49 SER H H 1 8.93 0.02 . 1 . . . . . 49 SER H . 53717 1 161 . 1 . 1 49 49 SER CA C 13 61.30 0.30 . 1 . . . . . 49 SER CA . 53717 1 162 . 1 . 1 49 49 SER N N 15 111.34 0.30 . 1 . . . . . 49 SER N . 53717 1 163 . 1 . 1 50 50 SER H H 1 7.20 0.02 . 1 . . . . . 50 SER H . 53717 1 164 . 1 . 1 50 50 SER CA C 13 60.64 0.30 . 1 . . . . . 50 SER CA . 53717 1 165 . 1 . 1 50 50 SER CB C 13 62.96 0.30 . 1 . . . . . 50 SER CB . 53717 1 166 . 1 . 1 50 50 SER N N 15 118.19 0.30 . 1 . . . . . 50 SER N . 53717 1 167 . 1 . 1 51 51 VAL H H 1 7.25 0.02 . 1 . . . . . 51 VAL H . 53717 1 168 . 1 . 1 51 51 VAL CA C 13 64.67 0.30 . 1 . . . . . 51 VAL CA . 53717 1 169 . 1 . 1 51 51 VAL CB C 13 31.20 0.30 . 1 . . . . . 51 VAL CB . 53717 1 170 . 1 . 1 51 51 VAL N N 15 123.46 0.30 . 1 . . . . . 51 VAL N . 53717 1 171 . 1 . 1 52 52 ALA H H 1 8.24 0.02 . 1 . . . . . 52 ALA H . 53717 1 172 . 1 . 1 52 52 ALA CA C 13 54.86 0.30 . 1 . . . . . 52 ALA CA . 53717 1 173 . 1 . 1 52 52 ALA CB C 13 15.78 0.30 . 1 . . . . . 52 ALA CB . 53717 1 174 . 1 . 1 52 52 ALA N N 15 119.69 0.30 . 1 . . . . . 52 ALA N . 53717 1 175 . 1 . 1 53 53 ALA H H 1 7.26 0.02 . 1 . . . . . 53 ALA H . 53717 1 176 . 1 . 1 53 53 ALA CA C 13 54.72 0.30 . 1 . . . . . 53 ALA CA . 53717 1 177 . 1 . 1 53 53 ALA CB C 13 17.21 0.30 . 1 . . . . . 53 ALA CB . 53717 1 178 . 1 . 1 53 53 ALA N N 15 120.31 0.30 . 1 . . . . . 53 ALA N . 53717 1 179 . 1 . 1 54 54 THR H H 1 7.73 0.02 . 1 . . . . . 54 THR H . 53717 1 180 . 1 . 1 54 54 THR CA C 13 65.61 0.30 . 1 . . . . . 54 THR CA . 53717 1 181 . 1 . 1 54 54 THR CB C 13 67.18 0.30 . 1 . . . . . 54 THR CB . 53717 1 182 . 1 . 1 54 54 THR N N 15 119.69 0.30 . 1 . . . . . 54 THR N . 53717 1 183 . 1 . 1 55 55 CYS H H 1 7.35 0.02 . 1 . . . . . 55 CYS H . 53717 1 184 . 1 . 1 55 55 CYS CA C 13 55.02 0.30 . 1 . . . . . 55 CYS CA . 53717 1 185 . 1 . 1 55 55 CYS CB C 13 39.64 0.30 . 1 . . . . . 55 CYS CB . 53717 1 186 . 1 . 1 55 55 CYS N N 15 115.37 0.30 . 1 . . . . . 55 CYS N . 53717 1 187 . 1 . 1 56 56 GLN H H 1 7.38 0.02 . 1 . . . . . 56 GLN H . 53717 1 188 . 1 . 1 56 56 GLN CA C 13 55.49 0.30 . 1 . . . . . 56 GLN CA . 53717 1 189 . 1 . 1 56 56 GLN CB C 13 28.79 0.30 . 1 . . . . . 56 GLN CB . 53717 1 190 . 1 . 1 56 56 GLN N N 15 113.96 0.30 . 1 . . . . . 56 GLN N . 53717 1 191 . 1 . 1 57 57 THR H H 1 7.59 0.02 . 1 . . . . . 57 THR H . 53717 1 192 . 1 . 1 57 57 THR CA C 13 61.67 0.30 . 1 . . . . . 57 THR CA . 53717 1 193 . 1 . 1 57 57 THR CB C 13 67.62 0.30 . 1 . . . . . 57 THR CB . 53717 1 194 . 1 . 1 57 57 THR N N 15 112.39 0.30 . 1 . . . . . 57 THR N . 53717 1 195 . 1 . 1 58 58 PRO CA C 13 62.87 0.30 . 1 . . . . . 58 PRO CA . 53717 1 196 . 1 . 1 58 58 PRO CB C 13 32.24 0.30 . 1 . . . . . 58 PRO CB . 53717 1 197 . 1 . 1 59 59 LYS H H 1 8.46 0.02 . 1 . . . . . 59 LYS H . 53717 1 198 . 1 . 1 59 59 LYS CA C 13 56.95 0.30 . 1 . . . . . 59 LYS CA . 53717 1 199 . 1 . 1 59 59 LYS CB C 13 32.82 0.30 . 1 . . . . . 59 LYS CB . 53717 1 200 . 1 . 1 59 59 LYS N N 15 122.57 0.30 . 1 . . . . . 59 LYS N . 53717 1 201 . 1 . 1 60 60 ILE H H 1 8.50 0.02 . 1 . . . . . 60 ILE H . 53717 1 202 . 1 . 1 60 60 ILE CA C 13 59.04 0.30 . 1 . . . . . 60 ILE CA . 53717 1 203 . 1 . 1 60 60 ILE CB C 13 43.01 0.30 . 1 . . . . . 60 ILE CB . 53717 1 204 . 1 . 1 60 60 ILE N N 15 118.90 0.30 . 1 . . . . . 60 ILE N . 53717 1 205 . 1 . 1 61 61 ALA H H 1 8.19 0.02 . 1 . . . . . 61 ALA H . 53717 1 206 . 1 . 1 61 61 ALA CA C 13 52.61 0.30 . 1 . . . . . 61 ALA CA . 53717 1 207 . 1 . 1 61 61 ALA CB C 13 18.75 0.30 . 1 . . . . . 61 ALA CB . 53717 1 208 . 1 . 1 61 61 ALA N N 15 120.87 0.30 . 1 . . . . . 61 ALA N . 53717 1 209 . 1 . 1 62 62 CYS H H 1 9.07 0.02 . 1 . . . . . 62 CYS H . 53717 1 210 . 1 . 1 62 62 CYS CA C 13 52.19 0.30 . 1 . . . . . 62 CYS CA . 53717 1 211 . 1 . 1 62 62 CYS CB C 13 40.55 0.30 . 1 . . . . . 62 CYS CB . 53717 1 212 . 1 . 1 62 62 CYS N N 15 120.63 0.30 . 1 . . . . . 62 CYS N . 53717 1 213 . 1 . 1 63 63 LYS H H 1 11.14 0.02 . 1 . . . . . 63 LYS H . 53717 1 214 . 1 . 1 63 63 LYS CA C 13 60.25 0.30 . 1 . . . . . 63 LYS CA . 53717 1 215 . 1 . 1 63 63 LYS CB C 13 31.82 0.30 . 1 . . . . . 63 LYS CB . 53717 1 216 . 1 . 1 63 63 LYS N N 15 128.71 0.30 . 1 . . . . . 63 LYS N . 53717 1 217 . 1 . 1 64 64 ASN H H 1 8.11 0.02 . 1 . . . . . 64 ASN H . 53717 1 218 . 1 . 1 64 64 ASN CA C 13 52.68 0.30 . 1 . . . . . 64 ASN CA . 53717 1 219 . 1 . 1 64 64 ASN CB C 13 37.42 0.30 . 1 . . . . . 64 ASN CB . 53717 1 220 . 1 . 1 64 64 ASN N N 15 114.19 0.30 . 1 . . . . . 64 ASN N . 53717 1 221 . 1 . 1 65 65 GLY H H 1 7.98 0.02 . 1 . . . . . 65 GLY H . 53717 1 222 . 1 . 1 65 65 GLY CA C 13 44.90 0.30 . 1 . . . . . 65 GLY CA . 53717 1 223 . 1 . 1 65 65 GLY N N 15 108.53 0.30 . 1 . . . . . 65 GLY N . 53717 1 224 . 1 . 1 66 66 ASP H H 1 8.05 0.02 . 1 . . . . . 66 ASP H . 53717 1 225 . 1 . 1 66 66 ASP CA C 13 54.68 0.30 . 1 . . . . . 66 ASP CA . 53717 1 226 . 1 . 1 66 66 ASP CB C 13 40.83 0.30 . 1 . . . . . 66 ASP CB . 53717 1 227 . 1 . 1 66 66 ASP N N 15 121.43 0.30 . 1 . . . . . 66 ASP N . 53717 1 228 . 1 . 1 67 67 LYS H H 1 8.78 0.02 . 1 . . . . . 67 LYS H . 53717 1 229 . 1 . 1 67 67 LYS CA C 13 55.05 0.30 . 1 . . . . . 67 LYS CA . 53717 1 230 . 1 . 1 67 67 LYS CB C 13 31.03 0.30 . 1 . . . . . 67 LYS CB . 53717 1 231 . 1 . 1 67 67 LYS N N 15 122.25 0.30 . 1 . . . . . 67 LYS N . 53717 1 232 . 1 . 1 68 68 ASN H H 1 7.75 0.02 . 1 . . . . . 68 ASN H . 53717 1 233 . 1 . 1 68 68 ASN CA C 13 52.16 0.30 . 1 . . . . . 68 ASN CA . 53717 1 234 . 1 . 1 68 68 ASN CB C 13 38.40 0.30 . 1 . . . . . 68 ASN CB . 53717 1 235 . 1 . 1 68 68 ASN N N 15 115.98 0.30 . 1 . . . . . 68 ASN N . 53717 1 236 . 1 . 1 69 69 CYS H H 1 7.73 0.02 . 1 . . . . . 69 CYS H . 53717 1 237 . 1 . 1 69 69 CYS CA C 13 61.01 0.30 . 1 . . . . . 69 CYS CA . 53717 1 238 . 1 . 1 69 69 CYS CB C 13 44.02 0.30 . 1 . . . . . 69 CYS CB . 53717 1 239 . 1 . 1 69 69 CYS N N 15 117.26 0.30 . 1 . . . . . 69 CYS N . 53717 1 240 . 1 . 1 70 70 HIS H H 1 8.31 0.02 . 1 . . . . . 70 HIS H . 53717 1 241 . 1 . 1 70 70 HIS CA C 13 55.58 0.30 . 1 . . . . . 70 HIS CA . 53717 1 242 . 1 . 1 70 70 HIS CB C 13 32.90 0.30 . 1 . . . . . 70 HIS CB . 53717 1 243 . 1 . 1 70 70 HIS N N 15 116.09 0.30 . 1 . . . . . 70 HIS N . 53717 1 244 . 1 . 1 71 71 GLN H H 1 9.24 0.02 . 1 . . . . . 71 GLN H . 53717 1 245 . 1 . 1 71 71 GLN CA C 13 54.49 0.30 . 1 . . . . . 71 GLN CA . 53717 1 246 . 1 . 1 71 71 GLN CB C 13 29.78 0.30 . 1 . . . . . 71 GLN CB . 53717 1 247 . 1 . 1 71 71 GLN N N 15 126.69 0.30 . 1 . . . . . 71 GLN N . 53717 1 248 . 1 . 1 72 72 SER H H 1 8.63 0.02 . 1 . . . . . 72 SER H . 53717 1 249 . 1 . 1 72 72 SER CA C 13 59.02 0.30 . 1 . . . . . 72 SER CA . 53717 1 250 . 1 . 1 72 72 SER CB C 13 63.67 0.30 . 1 . . . . . 72 SER CB . 53717 1 251 . 1 . 1 72 72 SER N N 15 121.51 0.30 . 1 . . . . . 72 SER N . 53717 1 252 . 1 . 1 73 73 HIS H H 1 9.23 0.02 . 1 . . . . . 73 HIS H . 53717 1 253 . 1 . 1 73 73 HIS CA C 13 57.87 0.30 . 1 . . . . . 73 HIS CA . 53717 1 254 . 1 . 1 73 73 HIS CB C 13 28.30 0.30 . 1 . . . . . 73 HIS CB . 53717 1 255 . 1 . 1 73 73 HIS N N 15 121.55 0.30 . 1 . . . . . 73 HIS N . 53717 1 256 . 1 . 1 74 74 GLY H H 1 7.60 0.02 . 1 . . . . . 74 GLY H . 53717 1 257 . 1 . 1 74 74 GLY CA C 13 43.88 0.30 . 1 . . . . . 74 GLY CA . 53717 1 258 . 1 . 1 74 74 GLY N N 15 105.26 0.30 . 1 . . . . . 74 GLY N . 53717 1 259 . 1 . 1 75 75 ALA H H 1 8.35 0.02 . 1 . . . . . 75 ALA H . 53717 1 260 . 1 . 1 75 75 ALA CA C 13 51.69 0.30 . 1 . . . . . 75 ALA CA . 53717 1 261 . 1 . 1 75 75 ALA CB C 13 19.01 0.30 . 1 . . . . . 75 ALA CB . 53717 1 262 . 1 . 1 75 75 ALA N N 15 123.11 0.30 . 1 . . . . . 75 ALA N . 53717 1 263 . 1 . 1 76 76 VAL H H 1 8.46 0.02 . 1 . . . . . 76 VAL H . 53717 1 264 . 1 . 1 76 76 VAL CA C 13 58.72 0.30 . 1 . . . . . 76 VAL CA . 53717 1 265 . 1 . 1 76 76 VAL CB C 13 35.09 0.30 . 1 . . . . . 76 VAL CB . 53717 1 266 . 1 . 1 76 76 VAL N N 15 115.73 0.30 . 1 . . . . . 76 VAL N . 53717 1 267 . 1 . 1 77 77 SER H H 1 8.52 0.02 . 1 . . . . . 77 SER H . 53717 1 268 . 1 . 1 77 77 SER CA C 13 58.40 0.30 . 1 . . . . . 77 SER CA . 53717 1 269 . 1 . 1 77 77 SER CB C 13 63.60 0.30 . 1 . . . . . 77 SER CB . 53717 1 270 . 1 . 1 77 77 SER N N 15 114.72 0.30 . 1 . . . . . 77 SER N . 53717 1 271 . 1 . 1 78 78 LEU H H 1 9.16 0.02 . 1 . . . . . 78 LEU H . 53717 1 272 . 1 . 1 78 78 LEU CA C 13 54.36 0.30 . 1 . . . . . 78 LEU CA . 53717 1 273 . 1 . 1 78 78 LEU CB C 13 45.53 0.30 . 1 . . . . . 78 LEU CB . 53717 1 274 . 1 . 1 78 78 LEU N N 15 124.40 0.30 . 1 . . . . . 78 LEU N . 53717 1 275 . 1 . 1 79 79 THR H H 1 8.94 0.02 . 1 . . . . . 79 THR H . 53717 1 276 . 1 . 1 79 79 THR CA C 13 62.80 0.30 . 1 . . . . . 79 THR CA . 53717 1 277 . 1 . 1 79 79 THR CB C 13 72.08 0.30 . 1 . . . . . 79 THR CB . 53717 1 278 . 1 . 1 79 79 THR N N 15 118.22 0.30 . 1 . . . . . 79 THR N . 53717 1 279 . 1 . 1 80 80 MET H H 1 9.11 0.02 . 1 . . . . . 80 MET H . 53717 1 280 . 1 . 1 80 80 MET CA C 13 54.45 0.30 . 1 . . . . . 80 MET CA . 53717 1 281 . 1 . 1 80 80 MET CB C 13 34.23 0.30 . 1 . . . . . 80 MET CB . 53717 1 282 . 1 . 1 80 80 MET N N 15 125.36 0.30 . 1 . . . . . 80 MET N . 53717 1 283 . 1 . 1 81 81 CYS H H 1 9.01 0.02 . 1 . . . . . 81 CYS H . 53717 1 284 . 1 . 1 81 81 CYS CA C 13 52.57 0.30 . 1 . . . . . 81 CYS CA . 53717 1 285 . 1 . 1 81 81 CYS CB C 13 39.53 0.30 . 1 . . . . . 81 CYS CB . 53717 1 286 . 1 . 1 81 81 CYS N N 15 122.93 0.30 . 1 . . . . . 81 CYS N . 53717 1 287 . 1 . 1 82 82 LYS H H 1 9.01 0.02 . 1 . . . . . 82 LYS H . 53717 1 288 . 1 . 1 82 82 LYS CA C 13 54.40 0.30 . 1 . . . . . 82 LYS CA . 53717 1 289 . 1 . 1 82 82 LYS CB C 13 35.64 0.30 . 1 . . . . . 82 LYS CB . 53717 1 290 . 1 . 1 82 82 LYS N N 15 125.84 0.30 . 1 . . . . . 82 LYS N . 53717 1 291 . 1 . 1 83 83 LEU H H 1 9.28 0.02 . 1 . . . . . 83 LEU H . 53717 1 292 . 1 . 1 83 83 LEU CA C 13 56.55 0.30 . 1 . . . . . 83 LEU CA . 53717 1 293 . 1 . 1 83 83 LEU CB C 13 43.34 0.30 . 1 . . . . . 83 LEU CB . 53717 1 294 . 1 . 1 83 83 LEU N N 15 132.20 0.30 . 1 . . . . . 83 LEU N . 53717 1 295 . 1 . 1 84 84 THR H H 1 9.43 0.02 . 1 . . . . . 84 THR H . 53717 1 296 . 1 . 1 84 84 THR CA C 13 61.95 0.30 . 1 . . . . . 84 THR CA . 53717 1 297 . 1 . 1 84 84 THR CB C 13 69.73 0.30 . 1 . . . . . 84 THR CB . 53717 1 298 . 1 . 1 84 84 THR N N 15 119.93 0.30 . 1 . . . . . 84 THR N . 53717 1 299 . 1 . 1 85 85 SER H H 1 7.59 0.02 . 1 . . . . . 85 SER H . 53717 1 300 . 1 . 1 85 85 SER CA C 13 58.56 0.30 . 1 . . . . . 85 SER CA . 53717 1 301 . 1 . 1 85 85 SER CB C 13 64.13 0.30 . 1 . . . . . 85 SER CB . 53717 1 302 . 1 . 1 85 85 SER N N 15 114.44 0.30 . 1 . . . . . 85 SER N . 53717 1 303 . 1 . 1 86 86 GLY H H 1 8.28 0.02 . 1 . . . . . 86 GLY H . 53717 1 304 . 1 . 1 86 86 GLY CA C 13 44.84 0.30 . 1 . . . . . 86 GLY CA . 53717 1 305 . 1 . 1 86 86 GLY N N 15 106.50 0.30 . 1 . . . . . 86 GLY N . 53717 1 306 . 1 . 1 89 89 PRO CA C 13 64.88 0.30 . 1 . . . . . 89 PRO CA . 53717 1 307 . 1 . 1 89 89 PRO CB C 13 32.11 0.30 . 1 . . . . . 89 PRO CB . 53717 1 308 . 1 . 1 90 90 ASN H H 1 8.33 0.02 . 1 . . . . . 90 ASN H . 53717 1 309 . 1 . 1 90 90 ASN CA C 13 57.07 0.30 . 1 . . . . . 90 ASN CA . 53717 1 310 . 1 . 1 90 90 ASN CB C 13 32.06 0.30 . 1 . . . . . 90 ASN CB . 53717 1 311 . 1 . 1 90 90 ASN N N 15 121.84 0.30 . 1 . . . . . 90 ASN N . 53717 1 312 . 1 . 1 91 91 CYS H H 1 7.38 0.02 . 1 . . . . . 91 CYS H . 53717 1 313 . 1 . 1 91 91 CYS CA C 13 54.23 0.30 . 1 . . . . . 91 CYS CA . 53717 1 314 . 1 . 1 91 91 CYS CB C 13 33.12 0.30 . 1 . . . . . 91 CYS CB . 53717 1 315 . 1 . 1 91 91 CYS N N 15 116.45 0.30 . 1 . . . . . 91 CYS N . 53717 1 316 . 1 . 1 92 92 ARG H H 1 8.52 0.02 . 1 . . . . . 92 ARG H . 53717 1 317 . 1 . 1 92 92 ARG CA C 13 55.15 0.30 . 1 . . . . . 92 ARG CA . 53717 1 318 . 1 . 1 92 92 ARG CB C 13 31.23 0.30 . 1 . . . . . 92 ARG CB . 53717 1 319 . 1 . 1 92 92 ARG N N 15 125.15 0.30 . 1 . . . . . 92 ARG N . 53717 1 320 . 1 . 1 93 93 TYR H H 1 9.55 0.02 . 1 . . . . . 93 TYR H . 53717 1 321 . 1 . 1 93 93 TYR CA C 13 58.50 0.30 . 1 . . . . . 93 TYR CA . 53717 1 322 . 1 . 1 93 93 TYR CB C 13 43.21 0.30 . 1 . . . . . 93 TYR CB . 53717 1 323 . 1 . 1 93 93 TYR N N 15 120.59 0.30 . 1 . . . . . 93 TYR N . 53717 1 324 . 1 . 1 94 94 LYS H H 1 9.43 0.02 . 1 . . . . . 94 LYS H . 53717 1 325 . 1 . 1 94 94 LYS CA C 13 55.01 0.30 . 1 . . . . . 94 LYS CA . 53717 1 326 . 1 . 1 94 94 LYS CB C 13 34.83 0.30 . 1 . . . . . 94 LYS CB . 53717 1 327 . 1 . 1 94 94 LYS N N 15 122.26 0.30 . 1 . . . . . 94 LYS N . 53717 1 328 . 1 . 1 95 95 GLU H H 1 8.70 0.02 . 1 . . . . . 95 GLU H . 53717 1 329 . 1 . 1 95 95 GLU CA C 13 55.59 0.30 . 1 . . . . . 95 GLU CA . 53717 1 330 . 1 . 1 95 95 GLU CB C 13 34.00 0.30 . 1 . . . . . 95 GLU CB . 53717 1 331 . 1 . 1 95 95 GLU N N 15 125.05 0.30 . 1 . . . . . 95 GLU N . 53717 1 332 . 1 . 1 96 96 LYS H H 1 8.66 0.02 . 1 . . . . . 96 LYS H . 53717 1 333 . 1 . 1 96 96 LYS CA C 13 55.77 0.30 . 1 . . . . . 96 LYS CA . 53717 1 334 . 1 . 1 96 96 LYS CB C 13 35.39 0.30 . 1 . . . . . 96 LYS CB . 53717 1 335 . 1 . 1 96 96 LYS N N 15 124.21 0.30 . 1 . . . . . 96 LYS N . 53717 1 336 . 1 . 1 97 97 ARG H H 1 9.10 0.02 . 1 . . . . . 97 ARG H . 53717 1 337 . 1 . 1 97 97 ARG CA C 13 55.63 0.30 . 1 . . . . . 97 ARG CA . 53717 1 338 . 1 . 1 97 97 ARG CB C 13 30.51 0.30 . 1 . . . . . 97 ARG CB . 53717 1 339 . 1 . 1 97 97 ARG N N 15 129.66 0.30 . 1 . . . . . 97 ARG N . 53717 1 340 . 1 . 1 98 98 GLN H H 1 9.09 0.02 . 1 . . . . . 98 GLN H . 53717 1 341 . 1 . 1 98 98 GLN CA C 13 54.60 0.30 . 1 . . . . . 98 GLN CA . 53717 1 342 . 1 . 1 98 98 GLN CB C 13 34.15 0.30 . 1 . . . . . 98 GLN CB . 53717 1 343 . 1 . 1 98 98 GLN N N 15 122.59 0.30 . 1 . . . . . 98 GLN N . 53717 1 344 . 1 . 1 99 99 ASN H H 1 8.60 0.02 . 1 . . . . . 99 ASN H . 53717 1 345 . 1 . 1 99 99 ASN CA C 13 52.58 0.30 . 1 . . . . . 99 ASN CA . 53717 1 346 . 1 . 1 99 99 ASN CB C 13 39.27 0.30 . 1 . . . . . 99 ASN CB . 53717 1 347 . 1 . 1 99 99 ASN N N 15 120.59 0.30 . 1 . . . . . 99 ASN N . 53717 1 348 . 1 . 1 100 100 LYS H H 1 8.80 0.02 . 1 . . . . . 100 LYS H . 53717 1 349 . 1 . 1 100 100 LYS CA C 13 54.46 0.30 . 1 . . . . . 100 LYS CA . 53717 1 350 . 1 . 1 100 100 LYS CB C 13 39.31 0.30 . 1 . . . . . 100 LYS CB . 53717 1 351 . 1 . 1 100 100 LYS N N 15 122.76 0.30 . 1 . . . . . 100 LYS N . 53717 1 352 . 1 . 1 101 101 SER H H 1 8.75 0.02 . 1 . . . . . 101 SER H . 53717 1 353 . 1 . 1 101 101 SER CA C 13 59.48 0.30 . 1 . . . . . 101 SER CA . 53717 1 354 . 1 . 1 101 101 SER CB C 13 63.56 0.30 . 1 . . . . . 101 SER CB . 53717 1 355 . 1 . 1 101 101 SER N N 15 117.30 0.30 . 1 . . . . . 101 SER N . 53717 1 356 . 1 . 1 102 102 TYR H H 1 7.84 0.02 . 1 . . . . . 102 TYR H . 53717 1 357 . 1 . 1 102 102 TYR CA C 13 55.43 0.30 . 1 . . . . . 102 TYR CA . 53717 1 358 . 1 . 1 102 102 TYR CB C 13 41.69 0.30 . 1 . . . . . 102 TYR CB . 53717 1 359 . 1 . 1 102 102 TYR N N 15 114.60 0.30 . 1 . . . . . 102 TYR N . 53717 1 360 . 1 . 1 103 103 VAL H H 1 8.58 0.02 . 1 . . . . . 103 VAL H . 53717 1 361 . 1 . 1 103 103 VAL CA C 13 60.29 0.30 . 1 . . . . . 103 VAL CA . 53717 1 362 . 1 . 1 103 103 VAL CB C 13 34.78 0.30 . 1 . . . . . 103 VAL CB . 53717 1 363 . 1 . 1 103 103 VAL N N 15 118.67 0.30 . 1 . . . . . 103 VAL N . 53717 1 364 . 1 . 1 104 104 VAL H H 1 8.77 0.02 . 1 . . . . . 104 VAL H . 53717 1 365 . 1 . 1 104 104 VAL CA C 13 57.90 0.30 . 1 . . . . . 104 VAL CA . 53717 1 366 . 1 . 1 104 104 VAL CB C 13 34.79 0.30 . 1 . . . . . 104 VAL CB . 53717 1 367 . 1 . 1 104 104 VAL N N 15 117.52 0.30 . 1 . . . . . 104 VAL N . 53717 1 368 . 1 . 1 105 105 ALA H H 1 8.76 0.02 . 1 . . . . . 105 ALA H . 53717 1 369 . 1 . 1 105 105 ALA CA C 13 51.35 0.30 . 1 . . . . . 105 ALA CA . 53717 1 370 . 1 . 1 105 105 ALA CB C 13 20.74 0.30 . 1 . . . . . 105 ALA CB . 53717 1 371 . 1 . 1 105 105 ALA N N 15 124.41 0.30 . 1 . . . . . 105 ALA N . 53717 1 372 . 1 . 1 106 106 CYS H H 1 8.62 0.02 . 1 . . . . . 106 CYS H . 53717 1 373 . 1 . 1 106 106 CYS CA C 13 55.33 0.30 . 1 . . . . . 106 CYS CA . 53717 1 374 . 1 . 1 106 106 CYS CB C 13 50.41 0.30 . 1 . . . . . 106 CYS CB . 53717 1 375 . 1 . 1 106 106 CYS N N 15 117.56 0.30 . 1 . . . . . 106 CYS N . 53717 1 376 . 1 . 1 107 107 LYS H H 1 8.91 0.02 . 1 . . . . . 107 LYS H . 53717 1 377 . 1 . 1 107 107 LYS CA C 13 54.28 0.30 . 1 . . . . . 107 LYS CA . 53717 1 378 . 1 . 1 107 107 LYS CB C 13 36.00 0.30 . 1 . . . . . 107 LYS CB . 53717 1 379 . 1 . 1 107 107 LYS N N 15 122.77 0.30 . 1 . . . . . 107 LYS N . 53717 1 380 . 1 . 1 109 109 PRO CA C 13 62.83 0.30 . 1 . . . . . 109 PRO CA . 53717 1 381 . 1 . 1 109 109 PRO CB C 13 32.65 0.30 . 1 . . . . . 109 PRO CB . 53717 1 382 . 1 . 1 110 110 GLN H H 1 9.54 0.02 . 1 . . . . . 110 GLN H . 53717 1 383 . 1 . 1 110 110 GLN CA C 13 55.18 0.30 . 1 . . . . . 110 GLN CA . 53717 1 384 . 1 . 1 110 110 GLN CB C 13 30.51 0.30 . 1 . . . . . 110 GLN CB . 53717 1 385 . 1 . 1 110 110 GLN N N 15 120.90 0.30 . 1 . . . . . 110 GLN N . 53717 1 386 . 1 . 1 111 111 LYS H H 1 8.68 0.02 . 1 . . . . . 111 LYS H . 53717 1 387 . 1 . 1 111 111 LYS CA C 13 59.87 0.30 . 1 . . . . . 111 LYS CA . 53717 1 388 . 1 . 1 111 111 LYS CB C 13 32.33 0.30 . 1 . . . . . 111 LYS CB . 53717 1 389 . 1 . 1 111 111 LYS N N 15 121.99 0.30 . 1 . . . . . 111 LYS N . 53717 1 390 . 1 . 1 112 112 LYS H H 1 7.90 0.02 . 1 . . . . . 112 LYS H . 53717 1 391 . 1 . 1 112 112 LYS CA C 13 56.83 0.30 . 1 . . . . . 112 LYS CA . 53717 1 392 . 1 . 1 112 112 LYS CB C 13 32.04 0.30 . 1 . . . . . 112 LYS CB . 53717 1 393 . 1 . 1 112 112 LYS N N 15 112.96 0.30 . 1 . . . . . 112 LYS N . 53717 1 394 . 1 . 1 113 113 ASP H H 1 7.54 0.02 . 1 . . . . . 113 ASP H . 53717 1 395 . 1 . 1 113 113 ASP CA C 13 54.82 0.30 . 1 . . . . . 113 ASP CA . 53717 1 396 . 1 . 1 113 113 ASP CB C 13 43.05 0.30 . 1 . . . . . 113 ASP CB . 53717 1 397 . 1 . 1 113 113 ASP N N 15 118.66 0.30 . 1 . . . . . 113 ASP N . 53717 1 398 . 1 . 1 114 114 SER H H 1 8.39 0.02 . 1 . . . . . 114 SER H . 53717 1 399 . 1 . 1 114 114 SER CA C 13 59.20 0.30 . 1 . . . . . 114 SER CA . 53717 1 400 . 1 . 1 114 114 SER CB C 13 63.46 0.30 . 1 . . . . . 114 SER CB . 53717 1 401 . 1 . 1 114 114 SER N N 15 113.82 0.30 . 1 . . . . . 114 SER N . 53717 1 402 . 1 . 1 115 115 GLN H H 1 8.68 0.02 . 1 . . . . . 115 GLN H . 53717 1 403 . 1 . 1 115 115 GLN CA C 13 54.41 0.30 . 1 . . . . . 115 GLN CA . 53717 1 404 . 1 . 1 115 115 GLN CB C 13 28.32 0.30 . 1 . . . . . 115 GLN CB . 53717 1 405 . 1 . 1 115 115 GLN N N 15 122.39 0.30 . 1 . . . . . 115 GLN N . 53717 1 406 . 1 . 1 116 116 GLN H H 1 8.00 0.02 . 1 . . . . . 116 GLN H . 53717 1 407 . 1 . 1 116 116 GLN CA C 13 58.30 0.30 . 1 . . . . . 116 GLN CA . 53717 1 408 . 1 . 1 116 116 GLN CB C 13 28.55 0.30 . 1 . . . . . 116 GLN CB . 53717 1 409 . 1 . 1 116 116 GLN N N 15 119.71 0.30 . 1 . . . . . 116 GLN N . 53717 1 410 . 1 . 1 117 117 PHE H H 1 7.80 0.02 . 1 . . . . . 117 PHE H . 53717 1 411 . 1 . 1 117 117 PHE CA C 13 55.68 0.30 . 1 . . . . . 117 PHE CA . 53717 1 412 . 1 . 1 117 117 PHE CB C 13 40.84 0.30 . 1 . . . . . 117 PHE CB . 53717 1 413 . 1 . 1 117 117 PHE N N 15 115.40 0.30 . 1 . . . . . 117 PHE N . 53717 1 414 . 1 . 1 118 118 HIS H H 1 9.03 0.02 . 1 . . . . . 118 HIS H . 53717 1 415 . 1 . 1 118 118 HIS CA C 13 57.14 0.30 . 1 . . . . . 118 HIS CA . 53717 1 416 . 1 . 1 118 118 HIS CB C 13 28.80 0.30 . 1 . . . . . 118 HIS CB . 53717 1 417 . 1 . 1 118 118 HIS N N 15 120.13 0.30 . 1 . . . . . 118 HIS N . 53717 1 418 . 1 . 1 119 119 LEU H H 1 7.17 0.02 . 1 . . . . . 119 LEU H . 53717 1 419 . 1 . 1 119 119 LEU CA C 13 53.92 0.30 . 1 . . . . . 119 LEU CA . 53717 1 420 . 1 . 1 119 119 LEU CB C 13 48.11 0.30 . 1 . . . . . 119 LEU CB . 53717 1 421 . 1 . 1 119 119 LEU N N 15 115.47 0.30 . 1 . . . . . 119 LEU N . 53717 1 422 . 1 . 1 120 120 VAL H H 1 9.08 0.02 . 1 . . . . . 120 VAL H . 53717 1 423 . 1 . 1 120 120 VAL CA C 13 56.86 0.30 . 1 . . . . . 120 VAL CA . 53717 1 424 . 1 . 1 120 120 VAL CB C 13 33.78 0.30 . 1 . . . . . 120 VAL CB . 53717 1 425 . 1 . 1 120 120 VAL N N 15 111.96 0.30 . 1 . . . . . 120 VAL N . 53717 1 426 . 1 . 1 121 121 PRO CA C 13 61.63 0.30 . 1 . . . . . 121 PRO CA . 53717 1 427 . 1 . 1 121 121 PRO CB C 13 30.48 0.30 . 1 . . . . . 121 PRO CB . 53717 1 428 . 1 . 1 122 122 VAL H H 1 8.81 0.02 . 1 . . . . . 122 VAL H . 53717 1 429 . 1 . 1 122 122 VAL CA C 13 61.02 0.30 . 1 . . . . . 122 VAL CA . 53717 1 430 . 1 . 1 122 122 VAL CB C 13 34.26 0.30 . 1 . . . . . 122 VAL CB . 53717 1 431 . 1 . 1 122 122 VAL N N 15 109.86 0.30 . 1 . . . . . 122 VAL N . 53717 1 432 . 1 . 1 123 123 HIS H H 1 7.34 0.02 . 1 . . . . . 123 HIS H . 53717 1 433 . 1 . 1 123 123 HIS CA C 13 56.48 0.30 . 1 . . . . . 123 HIS CA . 53717 1 434 . 1 . 1 123 123 HIS CB C 13 33.63 0.30 . 1 . . . . . 123 HIS CB . 53717 1 435 . 1 . 1 123 123 HIS N N 15 118.57 0.30 . 1 . . . . . 123 HIS N . 53717 1 436 . 1 . 1 124 124 LEU H H 1 9.14 0.02 . 1 . . . . . 124 LEU H . 53717 1 437 . 1 . 1 124 124 LEU CA C 13 54.37 0.30 . 1 . . . . . 124 LEU CA . 53717 1 438 . 1 . 1 124 124 LEU CB C 13 40.64 0.30 . 1 . . . . . 124 LEU CB . 53717 1 439 . 1 . 1 124 124 LEU N N 15 130.67 0.30 . 1 . . . . . 124 LEU N . 53717 1 440 . 1 . 1 125 125 ASP H H 1 8.79 0.02 . 1 . . . . . 125 ASP H . 53717 1 441 . 1 . 1 125 125 ASP CA C 13 57.52 0.30 . 1 . . . . . 125 ASP CA . 53717 1 442 . 1 . 1 125 125 ASP CB C 13 46.32 0.30 . 1 . . . . . 125 ASP CB . 53717 1 443 . 1 . 1 125 125 ASP N N 15 130.02 0.30 . 1 . . . . . 125 ASP N . 53717 1 444 . 1 . 1 126 126 ARG H H 1 7.44 0.02 . 1 . . . . . 126 ARG H . 53717 1 445 . 1 . 1 126 126 ARG CA C 13 55.37 0.30 . 1 . . . . . 126 ARG CA . 53717 1 446 . 1 . 1 126 126 ARG CB C 13 32.62 0.30 . 1 . . . . . 126 ARG CB . 53717 1 447 . 1 . 1 126 126 ARG N N 15 108.71 0.30 . 1 . . . . . 126 ARG N . 53717 1 448 . 1 . 1 127 127 VAL H H 1 8.19 0.02 . 1 . . . . . 127 VAL H . 53717 1 449 . 1 . 1 127 127 VAL CA C 13 61.48 0.30 . 1 . . . . . 127 VAL CA . 53717 1 450 . 1 . 1 127 127 VAL CB C 13 33.84 0.30 . 1 . . . . . 127 VAL CB . 53717 1 451 . 1 . 1 127 127 VAL N N 15 118.55 0.30 . 1 . . . . . 127 VAL N . 53717 1 452 . 1 . 1 128 128 LEU H H 1 8.21 0.02 . 1 . . . . . 128 LEU H . 53717 1 453 . 1 . 1 128 128 LEU CA C 13 57.56 0.30 . 1 . . . . . 128 LEU CA . 53717 1 454 . 1 . 1 128 128 LEU CB C 13 42.84 0.30 . 1 . . . . . 128 LEU CB . 53717 1 455 . 1 . 1 128 128 LEU N N 15 131.24 0.30 . 1 . . . . . 128 LEU N . 53717 1 stop_ save_