################################### # 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_assignment_for_bLG_A34C_at_pH_6.5 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assignment_for_bLG_A34C_at_pH_6.5 _Assigned_chem_shift_list.Entry_ID 10010 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $conditions_for_BLG_A34C_at_pH_6.5 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $default_reference _Assigned_chem_shift_list.Chem_shift_1H_err 0.02 _Assigned_chem_shift_list.Chem_shift_13C_err 0.2 _Assigned_chem_shift_list.Chem_shift_15N_err 0.1 _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 '1H15N HSQC' 1 $sample_1 isotropic 10010 1 2 CBCA(CO)NH 1 $sample_1 isotropic 10010 1 3 HNCACB 1 $sample_1 isotropic 10010 1 4 HNCO 1 $sample_1 isotropic 10010 1 5 HNCACO 1 $sample_1 isotropic 10010 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 $pipp.com . . 10010 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 2 2 ALA CA C 13 52.68 0.2 . 1 . . . . -2 ALA CA . 10010 1 2 . 1 1 2 2 ALA CB C 13 19.32 0.2 . 1 . . . . -2 ALA CB . 10010 1 3 . 1 1 3 3 GLU H H 1 8.51 0.02 . 1 . . . . -1 GLU H . 10010 1 4 . 1 1 3 3 GLU C C 13 176.02 0.2 . 1 . . . . -1 GLU C . 10010 1 5 . 1 1 3 3 GLU CA C 13 56.71 0.2 . 1 . . . . -1 GLU CA . 10010 1 6 . 1 1 3 3 GLU CB C 13 30.26 0.2 . 1 . . . . -1 GLU CB . 10010 1 7 . 1 1 3 3 GLU N N 15 120.73 0.1 . 1 . . . . -1 GLU N . 10010 1 8 . 1 1 4 4 ALA H H 1 8.22 0.02 . 1 . . . . 1 ALA H . 10010 1 9 . 1 1 4 4 ALA C C 13 177.22 0.2 . 1 . . . . 1 ALA C . 10010 1 10 . 1 1 4 4 ALA CA C 13 52.56 0.2 . 1 . . . . 1 ALA CA . 10010 1 11 . 1 1 4 4 ALA CB C 13 19.49 0.2 . 1 . . . . 1 ALA CB . 10010 1 12 . 1 1 4 4 ALA N N 15 124.3 0.1 . 1 . . . . 1 ALA N . 10010 1 13 . 1 1 5 5 TYR H H 1 8.58 0.02 . 1 . . . . 2 TYR H . 10010 1 14 . 1 1 5 5 TYR C C 13 176.14 0.2 . 1 . . . . 2 TYR C . 10010 1 15 . 1 1 5 5 TYR CA C 13 58.91 0.2 . 1 . . . . 2 TYR CA . 10010 1 16 . 1 1 5 5 TYR CB C 13 38.88 0.2 . 1 . . . . 2 TYR CB . 10010 1 17 . 1 1 5 5 TYR N N 15 118.51 0.1 . 1 . . . . 2 TYR N . 10010 1 18 . 1 1 6 6 VAL H H 1 8.2 0.02 . 1 . . . . 3 VAL H . 10010 1 19 . 1 1 6 6 VAL C C 13 175.86 0.2 . 1 . . . . 3 VAL C . 10010 1 20 . 1 1 6 6 VAL CA C 13 63.2 0.2 . 1 . . . . 3 VAL CA . 10010 1 21 . 1 1 6 6 VAL CB C 13 32.01 0.2 . 1 . . . . 3 VAL CB . 10010 1 22 . 1 1 6 6 VAL N N 15 120.44 0.1 . 1 . . . . 3 VAL N . 10010 1 23 . 1 1 7 7 THR H H 1 7.91 0.02 . 1 . . . . 4 THR H . 10010 1 24 . 1 1 7 7 THR C C 13 174.91 0.2 . 1 . . . . 4 THR C . 10010 1 25 . 1 1 7 7 THR CA C 13 62.03 0.2 . 1 . . . . 4 THR CA . 10010 1 26 . 1 1 7 7 THR CB C 13 69.59 0.2 . 1 . . . . 4 THR CB . 10010 1 27 . 1 1 7 7 THR N N 15 115.29 0.1 . 1 . . . . 4 THR N . 10010 1 28 . 1 1 8 8 GLN H H 1 8.11 0.02 . 1 . . . . 5 GLN H . 10010 1 29 . 1 1 8 8 GLN C C 13 175.03 0.2 . 1 . . . . 5 GLN C . 10010 1 30 . 1 1 8 8 GLN CA C 13 55.67 0.2 . 1 . . . . 5 GLN CA . 10010 1 31 . 1 1 8 8 GLN CB C 13 29.14 0.2 . 1 . . . . 5 GLN CB . 10010 1 32 . 1 1 8 8 GLN N N 15 123.1 0.1 . 1 . . . . 5 GLN N . 10010 1 33 . 1 1 9 9 THR H H 1 7.65 0.02 . 1 . . . . 6 THR H . 10010 1 34 . 1 1 9 9 THR C C 13 174.89 0.2 . 1 . . . . 6 THR C . 10010 1 35 . 1 1 9 9 THR CA C 13 60.59 0.2 . 1 . . . . 6 THR CA . 10010 1 36 . 1 1 9 9 THR CB C 13 70.7 0.2 . 1 . . . . 6 THR CB . 10010 1 37 . 1 1 9 9 THR N N 15 110.49 0.1 . 1 . . . . 6 THR N . 10010 1 38 . 1 1 10 10 MET H H 1 7.87 0.02 . 1 . . . . 7 MET H . 10010 1 39 . 1 1 10 10 MET C C 13 175.8 0.2 . 1 . . . . 7 MET C . 10010 1 40 . 1 1 10 10 MET CA C 13 56.87 0.2 . 1 . . . . 7 MET CA . 10010 1 41 . 1 1 10 10 MET CB C 13 33.18 0.2 . 1 . . . . 7 MET CB . 10010 1 42 . 1 1 10 10 MET N N 15 120.44 0.1 . 1 . . . . 7 MET N . 10010 1 43 . 1 1 11 11 LYS H H 1 8.61 0.02 . 1 . . . . 8 LYS H . 10010 1 44 . 1 1 11 11 LYS C C 13 177.45 0.2 . 1 . . . . 8 LYS C . 10010 1 45 . 1 1 11 11 LYS CA C 13 56.94 0.2 . 1 . . . . 8 LYS CA . 10010 1 46 . 1 1 11 11 LYS CB C 13 32.71 0.2 . 1 . . . . 8 LYS CB . 10010 1 47 . 1 1 11 11 LYS N N 15 127.15 0.1 . 1 . . . . 8 LYS N . 10010 1 48 . 1 1 12 12 GLY H H 1 8.53 0.02 . 1 . . . . 9 GLY H . 10010 1 49 . 1 1 12 12 GLY C C 13 174.26 0.2 . 1 . . . . 9 GLY C . 10010 1 50 . 1 1 12 12 GLY CA C 13 45.84 0.2 . 1 . . . . 9 GLY CA . 10010 1 51 . 1 1 12 12 GLY N N 15 109.16 0.1 . 1 . . . . 9 GLY N . 10010 1 52 . 1 1 13 13 LEU H H 1 7.51 0.02 . 1 . . . . 10 LEU H . 10010 1 53 . 1 1 13 13 LEU C C 13 175.42 0.2 . 1 . . . . 10 LEU C . 10010 1 54 . 1 1 13 13 LEU CA C 13 56.29 0.2 . 1 . . . . 10 LEU CA . 10010 1 55 . 1 1 13 13 LEU CB C 13 43.02 0.2 . 1 . . . . 10 LEU CB . 10010 1 56 . 1 1 13 13 LEU N N 15 120.55 0.1 . 1 . . . . 10 LEU N . 10010 1 57 . 1 1 14 14 ASP H H 1 8.59 0.02 . 1 . . . . 11 ASP H . 10010 1 58 . 1 1 14 14 ASP C C 13 177.07 0.2 . 1 . . . . 11 ASP C . 10010 1 59 . 1 1 14 14 ASP CA C 13 52.06 0.2 . 1 . . . . 11 ASP CA . 10010 1 60 . 1 1 14 14 ASP CB C 13 40.53 0.2 . 1 . . . . 11 ASP CB . 10010 1 61 . 1 1 14 14 ASP N N 15 127.98 0.1 . 1 . . . . 11 ASP N . 10010 1 62 . 1 1 15 15 ILE H H 1 8.74 0.02 . 1 . . . . 12 ILE H . 10010 1 63 . 1 1 15 15 ILE C C 13 176.57 0.2 . 1 . . . . 12 ILE C . 10010 1 64 . 1 1 15 15 ILE CA C 13 61.77 0.2 . 1 . . . . 12 ILE CA . 10010 1 65 . 1 1 15 15 ILE CB C 13 39.14 0.2 . 1 . . . . 12 ILE CB . 10010 1 66 . 1 1 15 15 ILE N N 15 122.66 0.1 . 1 . . . . 12 ILE N . 10010 1 67 . 1 1 16 16 GLN H H 1 8.11 0.02 . 1 . . . . 13 GLN H . 10010 1 68 . 1 1 16 16 GLN C C 13 179.55 0.2 . 1 . . . . 13 GLN C . 10010 1 69 . 1 1 16 16 GLN CA C 13 57.9 0.2 . 1 . . . . 13 GLN CA . 10010 1 70 . 1 1 16 16 GLN CB C 13 27.35 0.2 . 1 . . . . 13 GLN CB . 10010 1 71 . 1 1 16 16 GLN N N 15 116.85 0.1 . 1 . . . . 13 GLN N . 10010 1 72 . 1 1 17 17 LYS H H 1 7.34 0.02 . 1 . . . . 14 LYS H . 10010 1 73 . 1 1 17 17 LYS C C 13 177.76 0.2 . 1 . . . . 14 LYS C . 10010 1 74 . 1 1 17 17 LYS CA C 13 57.56 0.2 . 1 . . . . 14 LYS CA . 10010 1 75 . 1 1 17 17 LYS CB C 13 33.39 0.2 . 1 . . . . 14 LYS CB . 10010 1 76 . 1 1 17 17 LYS N N 15 114.22 0.1 . 1 . . . . 14 LYS N . 10010 1 77 . 1 1 18 18 VAL H H 1 7.39 0.02 . 1 . . . . 15 VAL H . 10010 1 78 . 1 1 18 18 VAL C C 13 173.95 0.2 . 1 . . . . 15 VAL C . 10010 1 79 . 1 1 18 18 VAL CA C 13 60.99 0.2 . 1 . . . . 15 VAL CA . 10010 1 80 . 1 1 18 18 VAL CB C 13 31.25 0.2 . 1 . . . . 15 VAL CB . 10010 1 81 . 1 1 18 18 VAL N N 15 110.18 0.1 . 1 . . . . 15 VAL N . 10010 1 82 . 1 1 19 19 ALA H H 1 6.81 0.02 . 1 . . . . 16 ALA H . 10010 1 83 . 1 1 19 19 ALA C C 13 178.56 0.2 . 1 . . . . 16 ALA C . 10010 1 84 . 1 1 19 19 ALA CA C 13 52.77 0.2 . 1 . . . . 16 ALA CA . 10010 1 85 . 1 1 19 19 ALA CB C 13 20.28 0.2 . 1 . . . . 16 ALA CB . 10010 1 86 . 1 1 19 19 ALA N N 15 120.67 0.1 . 1 . . . . 16 ALA N . 10010 1 87 . 1 1 20 20 GLY H H 1 9.18 0.02 . 1 . . . . 17 GLY H . 10010 1 88 . 1 1 20 20 GLY C C 13 172.72 0.2 . 1 . . . . 17 GLY C . 10010 1 89 . 1 1 20 20 GLY CA C 13 44.42 0.2 . 1 . . . . 17 GLY CA . 10010 1 90 . 1 1 20 20 GLY N N 15 110.78 0.1 . 1 . . . . 17 GLY N . 10010 1 91 . 1 1 21 21 THR H H 1 8.28 0.02 . 1 . . . . 18 THR H . 10010 1 92 . 1 1 21 21 THR C C 13 173.9 0.2 . 1 . . . . 18 THR C . 10010 1 93 . 1 1 21 21 THR CA C 13 64 0.2 . 1 . . . . 18 THR CA . 10010 1 94 . 1 1 21 21 THR CB C 13 70.07 0.2 . 1 . . . . 18 THR CB . 10010 1 95 . 1 1 21 21 THR N N 15 117.41 0.1 . 1 . . . . 18 THR N . 10010 1 96 . 1 1 22 22 TRP H H 1 7.49 0.02 . 1 . . . . 19 TRP H . 10010 1 97 . 1 1 22 22 TRP C C 13 172.12 0.2 . 1 . . . . 19 TRP C . 10010 1 98 . 1 1 22 22 TRP CA C 13 55.73 0.2 . 1 . . . . 19 TRP CA . 10010 1 99 . 1 1 22 22 TRP CB C 13 36.97 0.2 . 1 . . . . 19 TRP CB . 10010 1 100 . 1 1 22 22 TRP N N 15 123.57 0.1 . 1 . . . . 19 TRP N . 10010 1 101 . 1 1 23 23 TYR H H 1 9.22 0.02 . 1 . . . . 20 TYR H . 10010 1 102 . 1 1 23 23 TYR C C 13 177.52 0.2 . 1 . . . . 20 TYR C . 10010 1 103 . 1 1 23 23 TYR CA C 13 56.86 0.2 . 1 . . . . 20 TYR CA . 10010 1 104 . 1 1 23 23 TYR CB C 13 42.01 0.2 . 1 . . . . 20 TYR CB . 10010 1 105 . 1 1 23 23 TYR N N 15 112.6 0.1 . 1 . . . . 20 TYR N . 10010 1 106 . 1 1 24 24 SER H H 1 9.93 0.02 . 1 . . . . 21 SER H . 10010 1 107 . 1 1 24 24 SER C C 13 172.82 0.2 . 1 . . . . 21 SER C . 10010 1 108 . 1 1 24 24 SER CA C 13 60.06 0.2 . 1 . . . . 21 SER CA . 10010 1 109 . 1 1 24 24 SER CB C 13 62.97 0.2 . 1 . . . . 21 SER CB . 10010 1 110 . 1 1 24 24 SER N N 15 119.91 0.1 . 1 . . . . 21 SER N . 10010 1 111 . 1 1 25 25 LEU C C 13 174.61 0.2 . 1 . . . . 22 LEU C . 10010 1 112 . 1 1 25 25 LEU CA C 13 56.71 0.2 . 1 . . . . 22 LEU CA . 10010 1 113 . 1 1 25 25 LEU CB C 13 44.02 0.2 . 1 . . . . 22 LEU CB . 10010 1 114 . 1 1 26 26 ALA H H 1 7.81 0.02 . 1 . . . . 23 ALA H . 10010 1 115 . 1 1 26 26 ALA C C 13 175.58 0.2 . 1 . . . . 23 ALA C . 10010 1 116 . 1 1 26 26 ALA CA C 13 50.86 0.2 . 1 . . . . 23 ALA CA . 10010 1 117 . 1 1 26 26 ALA CB C 13 23.34 0.2 . 1 . . . . 23 ALA CB . 10010 1 118 . 1 1 26 26 ALA N N 15 115.14 0.1 . 1 . . . . 23 ALA N . 10010 1 119 . 1 1 27 27 MET H H 1 9.24 0.02 . 1 . . . . 24 MET H . 10010 1 120 . 1 1 27 27 MET C C 13 173 0.2 . 1 . . . . 24 MET C . 10010 1 121 . 1 1 27 27 MET CA C 13 54.32 0.2 . 1 . . . . 24 MET CA . 10010 1 122 . 1 1 27 27 MET CB C 13 37 0.2 . 1 . . . . 24 MET CB . 10010 1 123 . 1 1 27 27 MET N N 15 114.58 0.1 . 1 . . . . 24 MET N . 10010 1 124 . 1 1 28 28 ALA H H 1 9.39 0.02 . 1 . . . . 25 ALA H . 10010 1 125 . 1 1 28 28 ALA C C 13 174.49 0.2 . 1 . . . . 25 ALA C . 10010 1 126 . 1 1 28 28 ALA CA C 13 51.26 0.2 . 1 . . . . 25 ALA CA . 10010 1 127 . 1 1 28 28 ALA CB C 13 24.85 0.2 . 1 . . . . 25 ALA CB . 10010 1 128 . 1 1 28 28 ALA N N 15 123.72 0.1 . 1 . . . . 25 ALA N . 10010 1 129 . 1 1 29 29 ALA H H 1 8.64 0.02 . 1 . . . . 26 ALA H . 10010 1 130 . 1 1 29 29 ALA C C 13 178.13 0.2 . 1 . . . . 26 ALA C . 10010 1 131 . 1 1 29 29 ALA CA C 13 51.07 0.2 . 1 . . . . 26 ALA CA . 10010 1 132 . 1 1 29 29 ALA CB C 13 25.27 0.2 . 1 . . . . 26 ALA CB . 10010 1 133 . 1 1 29 29 ALA N N 15 119.86 0.1 . 1 . . . . 26 ALA N . 10010 1 134 . 1 1 30 30 SER H H 1 8.96 0.02 . 1 . . . . 27 SER H . 10010 1 135 . 1 1 30 30 SER C C 13 173.65 0.2 . 1 . . . . 27 SER C . 10010 1 136 . 1 1 30 30 SER CA C 13 60.24 0.2 . 1 . . . . 27 SER CA . 10010 1 137 . 1 1 30 30 SER CB C 13 63.8 0.2 . 1 . . . . 27 SER CB . 10010 1 138 . 1 1 30 30 SER N N 15 116.44 0.1 . 1 . . . . 27 SER N . 10010 1 139 . 1 1 31 31 ASP H H 1 7.2 0.02 . 1 . . . . 28 ASP H . 10010 1 140 . 1 1 31 31 ASP C C 13 176.66 0.2 . 1 . . . . 28 ASP C . 10010 1 141 . 1 1 31 31 ASP CA C 13 52.68 0.2 . 1 . . . . 28 ASP CA . 10010 1 142 . 1 1 31 31 ASP CB C 13 44.4 0.2 . 1 . . . . 28 ASP CB . 10010 1 143 . 1 1 31 31 ASP N N 15 121.59 0.1 . 1 . . . . 28 ASP N . 10010 1 144 . 1 1 32 32 ILE H H 1 9.14 0.02 . 1 . . . . 29 ILE H . 10010 1 145 . 1 1 32 32 ILE C C 13 177.46 0.2 . 1 . . . . 29 ILE C . 10010 1 146 . 1 1 32 32 ILE CA C 13 65.78 0.2 . 1 . . . . 29 ILE CA . 10010 1 147 . 1 1 32 32 ILE CB C 13 39.42 0.2 . 1 . . . . 29 ILE CB . 10010 1 148 . 1 1 32 32 ILE N N 15 126.43 0.1 . 1 . . . . 29 ILE N . 10010 1 149 . 1 1 33 33 SER H H 1 8.55 0.02 . 1 . . . . 30 SER H . 10010 1 150 . 1 1 33 33 SER C C 13 175.79 0.2 . 1 . . . . 30 SER C . 10010 1 151 . 1 1 33 33 SER CA C 13 61.02 0.2 . 1 . . . . 30 SER CA . 10010 1 152 . 1 1 33 33 SER CB C 13 63.42 0.2 . 1 . . . . 30 SER CB . 10010 1 153 . 1 1 33 33 SER N N 15 113.18 0.1 . 1 . . . . 30 SER N . 10010 1 154 . 1 1 34 34 LEU H H 1 7.72 0.02 . 1 . . . . 31 LEU H . 10010 1 155 . 1 1 34 34 LEU C C 13 176.88 0.2 . 1 . . . . 31 LEU C . 10010 1 156 . 1 1 34 34 LEU CA C 13 57.56 0.2 . 1 . . . . 31 LEU CA . 10010 1 157 . 1 1 34 34 LEU CB C 13 41.76 0.2 . 1 . . . . 31 LEU CB . 10010 1 158 . 1 1 34 34 LEU N N 15 119.57 0.1 . 1 . . . . 31 LEU N . 10010 1 159 . 1 1 35 35 LEU H H 1 6.91 0.02 . 1 . . . . 32 LEU H . 10010 1 160 . 1 1 35 35 LEU C C 13 173.87 0.2 . 1 . . . . 32 LEU C . 10010 1 161 . 1 1 35 35 LEU CA C 13 53.98 0.2 . 1 . . . . 32 LEU CA . 10010 1 162 . 1 1 35 35 LEU CB C 13 46.89 0.2 . 1 . . . . 32 LEU CB . 10010 1 163 . 1 1 35 35 LEU N N 15 110.64 0.1 . 1 . . . . 32 LEU N . 10010 1 164 . 1 1 36 36 ASP H H 1 7.55 0.02 . 1 . . . . 33 ASP H . 10010 1 165 . 1 1 36 36 ASP C C 13 175.81 0.2 . 1 . . . . 33 ASP C . 10010 1 166 . 1 1 36 36 ASP CA C 13 56.24 0.2 . 1 . . . . 33 ASP CA . 10010 1 167 . 1 1 36 36 ASP CB C 13 42.14 0.2 . 1 . . . . 33 ASP CB . 10010 1 168 . 1 1 36 36 ASP N N 15 119.58 0.1 . 1 . . . . 33 ASP N . 10010 1 169 . 1 1 37 37 CYS H H 1 8.56 0.02 . 1 . . . . 34 CYS H . 10010 1 170 . 1 1 37 37 CYS C C 13 175.07 0.2 . 1 . . . . 34 CYS C . 10010 1 171 . 1 1 37 37 CYS CA C 13 58.16 0.2 . 1 . . . . 34 CYS CA . 10010 1 172 . 1 1 37 37 CYS CB C 13 45.24 0.2 . 1 . . . . 34 CYS CB . 10010 1 173 . 1 1 37 37 CYS N N 15 121.41 0.1 . 1 . . . . 34 CYS N . 10010 1 174 . 1 1 38 38 GLN H H 1 8.29 0.02 . 1 . . . . 35 GLN H . 10010 1 175 . 1 1 38 38 GLN C C 13 175.82 0.2 . 1 . . . . 35 GLN C . 10010 1 176 . 1 1 38 38 GLN CA C 13 59.25 0.2 . 1 . . . . 35 GLN CA . 10010 1 177 . 1 1 38 38 GLN CB C 13 28.86 0.2 . 1 . . . . 35 GLN CB . 10010 1 178 . 1 1 38 38 GLN N N 15 121.17 0.1 . 1 . . . . 35 GLN N . 10010 1 179 . 1 1 39 39 SER H H 1 7.34 0.02 . 1 . . . . 36 SER H . 10010 1 180 . 1 1 39 39 SER C C 13 174.24 0.2 . 1 . . . . 36 SER C . 10010 1 181 . 1 1 39 39 SER CA C 13 57.25 0.2 . 1 . . . . 36 SER CA . 10010 1 182 . 1 1 39 39 SER CB C 13 63.64 0.2 . 1 . . . . 36 SER CB . 10010 1 183 . 1 1 39 39 SER N N 15 106.73 0.1 . 1 . . . . 36 SER N . 10010 1 184 . 1 1 40 40 ALA H H 1 7.74 0.02 . 1 . . . . 37 ALA H . 10010 1 185 . 1 1 40 40 ALA C C 13 178.03 0.2 . 1 . . . . 37 ALA C . 10010 1 186 . 1 1 40 40 ALA CA C 13 51.69 0.2 . 1 . . . . 37 ALA CA . 10010 1 187 . 1 1 40 40 ALA CB C 13 17.98 0.2 . 1 . . . . 37 ALA CB . 10010 1 188 . 1 1 40 40 ALA N N 15 127.73 0.1 . 1 . . . . 37 ALA N . 10010 1 189 . 1 1 41 41 PRO C C 13 176.69 0.2 . 1 . . . . 38 PRO C . 10010 1 190 . 1 1 41 41 PRO CA C 13 65.15 0.2 . 1 . . . . 38 PRO CA . 10010 1 191 . 1 1 41 41 PRO CB C 13 32.01 0.2 . 1 . . . . 38 PRO CB . 10010 1 192 . 1 1 42 42 LEU H H 1 7.56 0.02 . 1 . . . . 39 LEU H . 10010 1 193 . 1 1 42 42 LEU C C 13 175.72 0.2 . 1 . . . . 39 LEU C . 10010 1 194 . 1 1 42 42 LEU CA C 13 52.08 0.2 . 1 . . . . 39 LEU CA . 10010 1 195 . 1 1 42 42 LEU CB C 13 41.02 0.2 . 1 . . . . 39 LEU CB . 10010 1 196 . 1 1 42 42 LEU N N 15 114.38 0.1 . 1 . . . . 39 LEU N . 10010 1 197 . 1 1 43 43 ARG H H 1 7.08 0.02 . 1 . . . . 40 ARG H . 10010 1 198 . 1 1 43 43 ARG C C 13 172.43 0.2 . 1 . . . . 40 ARG C . 10010 1 199 . 1 1 43 43 ARG CA C 13 55.29 0.2 . 1 . . . . 40 ARG CA . 10010 1 200 . 1 1 43 43 ARG CB C 13 29.62 0.2 . 1 . . . . 40 ARG CB . 10010 1 201 . 1 1 43 43 ARG N N 15 122.41 0.1 . 1 . . . . 40 ARG N . 10010 1 202 . 1 1 44 44 VAL H H 1 7.03 0.02 . 1 . . . . 41 VAL H . 10010 1 203 . 1 1 44 44 VAL C C 13 172.89 0.2 . 1 . . . . 41 VAL C . 10010 1 204 . 1 1 44 44 VAL CA C 13 57.36 0.2 . 1 . . . . 41 VAL CA . 10010 1 205 . 1 1 44 44 VAL CB C 13 34.62 0.2 . 1 . . . . 41 VAL CB . 10010 1 206 . 1 1 44 44 VAL N N 15 115.77 0.1 . 1 . . . . 41 VAL N . 10010 1 207 . 1 1 45 45 TYR H H 1 8.66 0.02 . 1 . . . . 42 TYR H . 10010 1 208 . 1 1 45 45 TYR C C 13 176.17 0.2 . 1 . . . . 42 TYR C . 10010 1 209 . 1 1 45 45 TYR CA C 13 55.33 0.2 . 1 . . . . 42 TYR CA . 10010 1 210 . 1 1 45 45 TYR CB C 13 38.85 0.2 . 1 . . . . 42 TYR CB . 10010 1 211 . 1 1 45 45 TYR N N 15 120.63 0.1 . 1 . . . . 42 TYR N . 10010 1 212 . 1 1 46 46 VAL H H 1 8.65 0.02 . 1 . . . . 43 VAL H . 10010 1 213 . 1 1 46 46 VAL C C 13 174.11 0.2 . 1 . . . . 43 VAL C . 10010 1 214 . 1 1 46 46 VAL CA C 13 64.51 0.2 . 1 . . . . 43 VAL CA . 10010 1 215 . 1 1 46 46 VAL CB C 13 31.92 0.2 . 1 . . . . 43 VAL CB . 10010 1 216 . 1 1 46 46 VAL N N 15 125.34 0.1 . 1 . . . . 43 VAL N . 10010 1 217 . 1 1 47 47 GLU H H 1 8.97 0.02 . 1 . . . . 44 GLU H . 10010 1 218 . 1 1 47 47 GLU C C 13 176.58 0.2 . 1 . . . . 44 GLU C . 10010 1 219 . 1 1 47 47 GLU CA C 13 55.83 0.2 . 1 . . . . 44 GLU CA . 10010 1 220 . 1 1 47 47 GLU CB C 13 32.86 0.2 . 1 . . . . 44 GLU CB . 10010 1 221 . 1 1 47 47 GLU N N 15 122.9 0.1 . 1 . . . . 44 GLU N . 10010 1 222 . 1 1 48 48 GLU H H 1 7.66 0.02 . 1 . . . . 45 GLU H . 10010 1 223 . 1 1 48 48 GLU C C 13 174.01 0.2 . 1 . . . . 45 GLU C . 10010 1 224 . 1 1 48 48 GLU CA C 13 55.48 0.2 . 1 . . . . 45 GLU CA . 10010 1 225 . 1 1 48 48 GLU CB C 13 34.68 0.2 . 1 . . . . 45 GLU CB . 10010 1 226 . 1 1 48 48 GLU N N 15 117.2 0.1 . 1 . . . . 45 GLU N . 10010 1 227 . 1 1 49 49 LEU H H 1 8.66 0.02 . 1 . . . . 46 LEU H . 10010 1 228 . 1 1 49 49 LEU C C 13 176.5 0.2 . 1 . . . . 46 LEU C . 10010 1 229 . 1 1 49 49 LEU CA C 13 53.71 0.2 . 1 . . . . 46 LEU CA . 10010 1 230 . 1 1 49 49 LEU CB C 13 43.8 0.2 . 1 . . . . 46 LEU CB . 10010 1 231 . 1 1 49 49 LEU N N 15 121.98 0.1 . 1 . . . . 46 LEU N . 10010 1 232 . 1 1 50 50 LYS H H 1 9.26 0.02 . 1 . . . . 47 LYS H . 10010 1 233 . 1 1 50 50 LYS C C 13 173.27 0.2 . 1 . . . . 47 LYS C . 10010 1 234 . 1 1 50 50 LYS CA C 13 53.01 0.2 . 1 . . . . 47 LYS CA . 10010 1 235 . 1 1 50 50 LYS CB C 13 34.64 0.2 . 1 . . . . 47 LYS CB . 10010 1 236 . 1 1 50 50 LYS N N 15 123.12 0.1 . 1 . . . . 47 LYS N . 10010 1 237 . 1 1 51 51 PRO C C 13 176.86 0.2 . 1 . . . . 48 PRO C . 10010 1 238 . 1 1 51 51 PRO CA C 13 62.25 0.2 . 1 . . . . 48 PRO CA . 10010 1 239 . 1 1 51 51 PRO CB C 13 32.44 0.2 . 1 . . . . 48 PRO CB . 10010 1 240 . 1 1 52 52 THR H H 1 8.8 0.02 . 1 . . . . 49 THR H . 10010 1 241 . 1 1 52 52 THR C C 13 175.83 0.2 . 1 . . . . 49 THR C . 10010 1 242 . 1 1 52 52 THR CA C 13 59.25 0.2 . 1 . . . . 49 THR CA . 10010 1 243 . 1 1 52 52 THR CB C 13 68.64 0.2 . 1 . . . . 49 THR CB . 10010 1 244 . 1 1 52 52 THR N N 15 115.66 0.1 . 1 . . . . 49 THR N . 10010 1 245 . 1 1 53 53 PRO C C 13 177.79 0.2 . 1 . . . . 50 PRO C . 10010 1 246 . 1 1 53 53 PRO CA C 13 65.36 0.2 . 1 . . . . 50 PRO CA . 10010 1 247 . 1 1 53 53 PRO CB C 13 31.74 0.2 . 1 . . . . 50 PRO CB . 10010 1 248 . 1 1 54 54 GLU H H 1 7.71 0.02 . 1 . . . . 51 GLU H . 10010 1 249 . 1 1 54 54 GLU C C 13 176.86 0.2 . 1 . . . . 51 GLU C . 10010 1 250 . 1 1 54 54 GLU CA C 13 56.83 0.2 . 1 . . . . 51 GLU CA . 10010 1 251 . 1 1 54 54 GLU CB C 13 29.44 0.2 . 1 . . . . 51 GLU CB . 10010 1 252 . 1 1 54 54 GLU N N 15 112.72 0.1 . 1 . . . . 51 GLU N . 10010 1 253 . 1 1 55 55 GLY H H 1 8.3 0.02 . 1 . . . . 52 GLY H . 10010 1 254 . 1 1 55 55 GLY C C 13 174.31 0.2 . 1 . . . . 52 GLY C . 10010 1 255 . 1 1 55 55 GLY CA C 13 45.76 0.2 . 1 . . . . 52 GLY CA . 10010 1 256 . 1 1 55 55 GLY N N 15 108.08 0.1 . 1 . . . . 52 GLY N . 10010 1 257 . 1 1 56 56 ASP H H 1 7.22 0.02 . 1 . . . . 53 ASP H . 10010 1 258 . 1 1 56 56 ASP C C 13 174.17 0.2 . 1 . . . . 53 ASP C . 10010 1 259 . 1 1 56 56 ASP CA C 13 54.09 0.2 . 1 . . . . 53 ASP CA . 10010 1 260 . 1 1 56 56 ASP CB C 13 41.63 0.2 . 1 . . . . 53 ASP CB . 10010 1 261 . 1 1 56 56 ASP N N 15 117.23 0.1 . 1 . . . . 53 ASP N . 10010 1 262 . 1 1 57 57 LEU H H 1 8.94 0.02 . 1 . . . . 54 LEU H . 10010 1 263 . 1 1 57 57 LEU C C 13 174.09 0.2 . 1 . . . . 54 LEU C . 10010 1 264 . 1 1 57 57 LEU CA C 13 54.19 0.2 . 1 . . . . 54 LEU CA . 10010 1 265 . 1 1 57 57 LEU CB C 13 46.38 0.2 . 1 . . . . 54 LEU CB . 10010 1 266 . 1 1 57 57 LEU N N 15 119.44 0.1 . 1 . . . . 54 LEU N . 10010 1 267 . 1 1 58 58 GLU H H 1 8.38 0.02 . 1 . . . . 55 GLU H . 10010 1 268 . 1 1 58 58 GLU C C 13 175.39 0.2 . 1 . . . . 55 GLU C . 10010 1 269 . 1 1 58 58 GLU CA C 13 55.42 0.2 . 1 . . . . 55 GLU CA . 10010 1 270 . 1 1 58 58 GLU CB C 13 30.8 0.2 . 1 . . . . 55 GLU CB . 10010 1 271 . 1 1 58 58 GLU N N 15 126 0.1 . 1 . . . . 55 GLU N . 10010 1 272 . 1 1 59 59 ILE H H 1 9.19 0.02 . 1 . . . . 56 ILE H . 10010 1 273 . 1 1 59 59 ILE C C 13 173.99 0.2 . 1 . . . . 56 ILE C . 10010 1 274 . 1 1 59 59 ILE CA C 13 60.96 0.2 . 1 . . . . 56 ILE CA . 10010 1 275 . 1 1 59 59 ILE CB C 13 39.95 0.2 . 1 . . . . 56 ILE CB . 10010 1 276 . 1 1 59 59 ILE N N 15 125.31 0.1 . 1 . . . . 56 ILE N . 10010 1 277 . 1 1 60 60 LEU H H 1 8.58 0.02 . 1 . . . . 57 LEU H . 10010 1 278 . 1 1 60 60 LEU C C 13 175.71 0.2 . 1 . . . . 57 LEU C . 10010 1 279 . 1 1 60 60 LEU CA C 13 54.78 0.2 . 1 . . . . 57 LEU CA . 10010 1 280 . 1 1 60 60 LEU CB C 13 42.46 0.2 . 1 . . . . 57 LEU CB . 10010 1 281 . 1 1 60 60 LEU N N 15 128.99 0.1 . 1 . . . . 57 LEU N . 10010 1 282 . 1 1 61 61 LEU H H 1 9.09 0.02 . 1 . . . . 58 LEU H . 10010 1 283 . 1 1 61 61 LEU C C 13 175.11 0.2 . 1 . . . . 58 LEU C . 10010 1 284 . 1 1 61 61 LEU CA C 13 53.2 0.2 . 1 . . . . 58 LEU CA . 10010 1 285 . 1 1 61 61 LEU CB C 13 46.25 0.2 . 1 . . . . 58 LEU CB . 10010 1 286 . 1 1 61 61 LEU N N 15 122.94 0.1 . 1 . . . . 58 LEU N . 10010 1 287 . 1 1 62 62 GLN H H 1 9.31 0.02 . 1 . . . . 59 GLN H . 10010 1 288 . 1 1 62 62 GLN C C 13 175.4 0.2 . 1 . . . . 59 GLN C . 10010 1 289 . 1 1 62 62 GLN CA C 13 53.84 0.2 . 1 . . . . 59 GLN CA . 10010 1 290 . 1 1 62 62 GLN CB C 13 31.93 0.2 . 1 . . . . 59 GLN CB . 10010 1 291 . 1 1 62 62 GLN N N 15 118.48 0.1 . 1 . . . . 59 GLN N . 10010 1 292 . 1 1 63 63 LYS H H 1 8.95 0.02 . 1 . . . . 60 LYS H . 10010 1 293 . 1 1 63 63 LYS C C 13 173.72 0.2 . 1 . . . . 60 LYS C . 10010 1 294 . 1 1 63 63 LYS CA C 13 55.34 0.2 . 1 . . . . 60 LYS CA . 10010 1 295 . 1 1 63 63 LYS CB C 13 37.54 0.2 . 1 . . . . 60 LYS CB . 10010 1 296 . 1 1 63 63 LYS N N 15 121.55 0.1 . 1 . . . . 60 LYS N . 10010 1 297 . 1 1 64 64 TRP H H 1 9.67 0.02 . 1 . . . . 61 TRP H . 10010 1 298 . 1 1 64 64 TRP C C 13 175.85 0.2 . 1 . . . . 61 TRP C . 10010 1 299 . 1 1 64 64 TRP CA C 13 57.97 0.2 . 1 . . . . 61 TRP CA . 10010 1 300 . 1 1 64 64 TRP CB C 13 29.84 0.2 . 1 . . . . 61 TRP CB . 10010 1 301 . 1 1 64 64 TRP N N 15 129.37 0.1 . 1 . . . . 61 TRP N . 10010 1 302 . 1 1 65 65 GLU H H 1 8.78 0.02 . 1 . . . . 62 GLU H . 10010 1 303 . 1 1 65 65 GLU C C 13 175.23 0.2 . 1 . . . . 62 GLU C . 10010 1 304 . 1 1 65 65 GLU CA C 13 55.71 0.2 . 1 . . . . 62 GLU CA . 10010 1 305 . 1 1 65 65 GLU CB C 13 32.66 0.2 . 1 . . . . 62 GLU CB . 10010 1 306 . 1 1 65 65 GLU N N 15 128.12 0.1 . 1 . . . . 62 GLU N . 10010 1 307 . 1 1 66 66 ASN H H 1 8.95 0.02 . 1 . . . . 63 ASN H . 10010 1 308 . 1 1 66 66 ASN C C 13 173.89 0.2 . 1 . . . . 63 ASN C . 10010 1 309 . 1 1 66 66 ASN CA C 13 54.92 0.2 . 1 . . . . 63 ASN CA . 10010 1 310 . 1 1 66 66 ASN CB C 13 37.23 0.2 . 1 . . . . 63 ASN CB . 10010 1 311 . 1 1 66 66 ASN N N 15 122.08 0.1 . 1 . . . . 63 ASN N . 10010 1 312 . 1 1 67 67 ASP H H 1 7.9 0.02 . 1 . . . . 64 ASP H . 10010 1 313 . 1 1 67 67 ASP C C 13 173.38 0.2 . 1 . . . . 64 ASP C . 10010 1 314 . 1 1 67 67 ASP CA C 13 55.38 0.2 . 1 . . . . 64 ASP CA . 10010 1 315 . 1 1 67 67 ASP CB C 13 39.8 0.2 . 1 . . . . 64 ASP CB . 10010 1 316 . 1 1 67 67 ASP N N 15 110.86 0.1 . 1 . . . . 64 ASP N . 10010 1 317 . 1 1 68 68 GLU H H 1 6.84 0.02 . 1 . . . . 65 GLU H . 10010 1 318 . 1 1 68 68 GLU C C 13 172.5 0.2 . 1 . . . . 65 GLU C . 10010 1 319 . 1 1 68 68 GLU CA C 13 54.27 0.2 . 1 . . . . 65 GLU CA . 10010 1 320 . 1 1 68 68 GLU CB C 13 32.8 0.2 . 1 . . . . 65 GLU CB . 10010 1 321 . 1 1 68 68 GLU N N 15 115.52 0.1 . 1 . . . . 65 GLU N . 10010 1 322 . 1 1 69 69 CYS H H 1 8.53 0.02 . 1 . . . . 66 CYS H . 10010 1 323 . 1 1 69 69 CYS C C 13 173.54 0.2 . 1 . . . . 66 CYS C . 10010 1 324 . 1 1 69 69 CYS CA C 13 55.23 0.2 . 1 . . . . 66 CYS CA . 10010 1 325 . 1 1 69 69 CYS CB C 13 39.75 0.2 . 1 . . . . 66 CYS CB . 10010 1 326 . 1 1 69 69 CYS N N 15 119.67 0.1 . 1 . . . . 66 CYS N . 10010 1 327 . 1 1 70 70 ALA H H 1 9.05 0.02 . 1 . . . . 67 ALA H . 10010 1 328 . 1 1 70 70 ALA C C 13 176.14 0.2 . 1 . . . . 67 ALA C . 10010 1 329 . 1 1 70 70 ALA CA C 13 51.33 0.2 . 1 . . . . 67 ALA CA . 10010 1 330 . 1 1 70 70 ALA CB C 13 21.5 0.2 . 1 . . . . 67 ALA CB . 10010 1 331 . 1 1 70 70 ALA N N 15 132.85 0.1 . 1 . . . . 67 ALA N . 10010 1 332 . 1 1 71 71 GLN H H 1 8.38 0.02 . 1 . . . . 68 GLN H . 10010 1 333 . 1 1 71 71 GLN C C 13 176.38 0.2 . 1 . . . . 68 GLN C . 10010 1 334 . 1 1 71 71 GLN CA C 13 55.05 0.2 . 1 . . . . 68 GLN CA . 10010 1 335 . 1 1 71 71 GLN CB C 13 31.14 0.2 . 1 . . . . 68 GLN CB . 10010 1 336 . 1 1 71 71 GLN N N 15 119.55 0.1 . 1 . . . . 68 GLN N . 10010 1 337 . 1 1 72 72 LYS H H 1 9.2 0.02 . 1 . . . . 69 LYS H . 10010 1 338 . 1 1 72 72 LYS C C 13 173.91 0.2 . 1 . . . . 69 LYS C . 10010 1 339 . 1 1 72 72 LYS CA C 13 54.08 0.2 . 1 . . . . 69 LYS CA . 10010 1 340 . 1 1 72 72 LYS CB C 13 35.61 0.2 . 1 . . . . 69 LYS CB . 10010 1 341 . 1 1 72 72 LYS N N 15 124.04 0.1 . 1 . . . . 69 LYS N . 10010 1 342 . 1 1 73 73 LYS H H 1 8.41 0.02 . 1 . . . . 70 LYS H . 10010 1 343 . 1 1 73 73 LYS C C 13 175.82 0.2 . 1 . . . . 70 LYS C . 10010 1 344 . 1 1 73 73 LYS CA C 13 55.19 0.2 . 1 . . . . 70 LYS CA . 10010 1 345 . 1 1 73 73 LYS CB C 13 34.67 0.2 . 1 . . . . 70 LYS CB . 10010 1 346 . 1 1 73 73 LYS N N 15 122.76 0.1 . 1 . . . . 70 LYS N . 10010 1 347 . 1 1 74 74 ILE H H 1 9.07 0.02 . 1 . . . . 71 ILE H . 10010 1 348 . 1 1 74 74 ILE C C 13 174.13 0.2 . 1 . . . . 71 ILE C . 10010 1 349 . 1 1 74 74 ILE CA C 13 59.6 0.2 . 1 . . . . 71 ILE CA . 10010 1 350 . 1 1 74 74 ILE CB C 13 41.51 0.2 . 1 . . . . 71 ILE CB . 10010 1 351 . 1 1 74 74 ILE N N 15 125 0.1 . 1 . . . . 71 ILE N . 10010 1 352 . 1 1 75 75 ILE H H 1 8.42 0.02 . 1 . . . . 72 ILE H . 10010 1 353 . 1 1 75 75 ILE C C 13 173.74 0.2 . 1 . . . . 72 ILE C . 10010 1 354 . 1 1 75 75 ILE CA C 13 60.24 0.2 . 1 . . . . 72 ILE CA . 10010 1 355 . 1 1 75 75 ILE CB C 13 37.96 0.2 . 1 . . . . 72 ILE CB . 10010 1 356 . 1 1 75 75 ILE N N 15 125.28 0.1 . 1 . . . . 72 ILE N . 10010 1 357 . 1 1 76 76 ALA H H 1 9.36 0.02 . 1 . . . . 73 ALA H . 10010 1 358 . 1 1 76 76 ALA C C 13 175.52 0.2 . 1 . . . . 73 ALA C . 10010 1 359 . 1 1 76 76 ALA CA C 13 49.65 0.2 . 1 . . . . 73 ALA CA . 10010 1 360 . 1 1 76 76 ALA CB C 13 19.61 0.2 . 1 . . . . 73 ALA CB . 10010 1 361 . 1 1 76 76 ALA N N 15 134 0.1 . 1 . . . . 73 ALA N . 10010 1 362 . 1 1 77 77 GLU H H 1 9.37 0.02 . 1 . . . . 74 GLU H . 10010 1 363 . 1 1 77 77 GLU C C 13 176.82 0.2 . 1 . . . . 74 GLU C . 10010 1 364 . 1 1 77 77 GLU CA C 13 55.36 0.2 . 1 . . . . 74 GLU CA . 10010 1 365 . 1 1 77 77 GLU CB C 13 32.45 0.2 . 1 . . . . 74 GLU CB . 10010 1 366 . 1 1 77 77 GLU N N 15 125.29 0.1 . 1 . . . . 74 GLU N . 10010 1 367 . 1 1 78 78 LYS H H 1 9.23 0.02 . 1 . . . . 75 LYS H . 10010 1 368 . 1 1 78 78 LYS C C 13 175.91 0.2 . 1 . . . . 75 LYS C . 10010 1 369 . 1 1 78 78 LYS CA C 13 57.32 0.2 . 1 . . . . 75 LYS CA . 10010 1 370 . 1 1 78 78 LYS CB C 13 32.17 0.2 . 1 . . . . 75 LYS CB . 10010 1 371 . 1 1 78 78 LYS N N 15 124.05 0.1 . 1 . . . . 75 LYS N . 10010 1 372 . 1 1 79 79 THR H H 1 8.36 0.02 . 1 . . . . 76 THR H . 10010 1 373 . 1 1 79 79 THR C C 13 174.56 0.2 . 1 . . . . 76 THR C . 10010 1 374 . 1 1 79 79 THR CA C 13 60.15 0.2 . 1 . . . . 76 THR CA . 10010 1 375 . 1 1 79 79 THR CB C 13 72.2 0.2 . 1 . . . . 76 THR CB . 10010 1 376 . 1 1 79 79 THR N N 15 112.06 0.1 . 1 . . . . 76 THR N . 10010 1 377 . 1 1 80 80 LYS H H 1 8.24 0.02 . 1 . . . . 77 LYS H . 10010 1 378 . 1 1 80 80 LYS C C 13 176.17 0.2 . 1 . . . . 77 LYS C . 10010 1 379 . 1 1 80 80 LYS CA C 13 57.54 0.2 . 1 . . . . 77 LYS CA . 10010 1 380 . 1 1 80 80 LYS CB C 13 32.18 0.2 . 1 . . . . 77 LYS CB . 10010 1 381 . 1 1 80 80 LYS N N 15 116.17 0.1 . 1 . . . . 77 LYS N . 10010 1 382 . 1 1 81 81 ILE H H 1 8.05 0.02 . 1 . . . . 78 ILE H . 10010 1 383 . 1 1 81 81 ILE C C 13 174.81 0.2 . 1 . . . . 78 ILE C . 10010 1 384 . 1 1 81 81 ILE CB C 13 39.1 0.2 . 1 . . . . 78 ILE CB . 10010 1 385 . 1 1 81 81 ILE N N 15 122.55 0.1 . 1 . . . . 78 ILE N . 10010 1 386 . 1 1 82 82 PRO C C 13 175.86 0.2 . 1 . . . . 79 PRO C . 10010 1 387 . 1 1 82 82 PRO CA C 13 64.74 0.2 . 1 . . . . 79 PRO CA . 10010 1 388 . 1 1 83 83 ALA H H 1 7.9 0.02 . 1 . . . . 80 ALA H . 10010 1 389 . 1 1 83 83 ALA C C 13 174.31 0.2 . 1 . . . . 80 ALA C . 10010 1 390 . 1 1 83 83 ALA CA C 13 52.82 0.2 . 1 . . . . 80 ALA CA . 10010 1 391 . 1 1 83 83 ALA CB C 13 19.82 0.2 . 1 . . . . 80 ALA CB . 10010 1 392 . 1 1 83 83 ALA N N 15 115.43 0.1 . 1 . . . . 80 ALA N . 10010 1 393 . 1 1 84 84 VAL H H 1 7.29 0.02 . 1 . . . . 81 VAL H . 10010 1 394 . 1 1 84 84 VAL C C 13 175.08 0.2 . 1 . . . . 81 VAL C . 10010 1 395 . 1 1 84 84 VAL CA C 13 61.99 0.2 . 1 . . . . 81 VAL CA . 10010 1 396 . 1 1 84 84 VAL CB C 13 33.58 0.2 . 1 . . . . 81 VAL CB . 10010 1 397 . 1 1 84 84 VAL N N 15 117.26 0.1 . 1 . . . . 81 VAL N . 10010 1 398 . 1 1 85 85 PHE H H 1 9.61 0.02 . 1 . . . . 82 PHE H . 10010 1 399 . 1 1 85 85 PHE C C 13 174.77 0.2 . 1 . . . . 82 PHE C . 10010 1 400 . 1 1 85 85 PHE CA C 13 55.94 0.2 . 1 . . . . 82 PHE CA . 10010 1 401 . 1 1 85 85 PHE CB C 13 43.66 0.2 . 1 . . . . 82 PHE CB . 10010 1 402 . 1 1 85 85 PHE N N 15 126.89 0.1 . 1 . . . . 82 PHE N . 10010 1 403 . 1 1 86 86 LYS H H 1 9.64 0.02 . 1 . . . . 83 LYS H . 10010 1 404 . 1 1 86 86 LYS C C 13 176.36 0.2 . 1 . . . . 83 LYS C . 10010 1 405 . 1 1 86 86 LYS CA C 13 55.67 0.2 . 1 . . . . 83 LYS CA . 10010 1 406 . 1 1 86 86 LYS CB C 13 34.81 0.2 . 1 . . . . 83 LYS CB . 10010 1 407 . 1 1 86 86 LYS N N 15 124.08 0.1 . 1 . . . . 83 LYS N . 10010 1 408 . 1 1 87 87 ILE H H 1 7.72 0.02 . 1 . . . . 84 ILE H . 10010 1 409 . 1 1 87 87 ILE C C 13 174.6 0.2 . 1 . . . . 84 ILE C . 10010 1 410 . 1 1 87 87 ILE CA C 13 59.43 0.2 . 1 . . . . 84 ILE CA . 10010 1 411 . 1 1 87 87 ILE CB C 13 43.88 0.2 . 1 . . . . 84 ILE CB . 10010 1 412 . 1 1 87 87 ILE N N 15 116.93 0.1 . 1 . . . . 84 ILE N . 10010 1 413 . 1 1 88 88 ASP H H 1 8.75 0.02 . 1 . . . . 85 ASP H . 10010 1 414 . 1 1 88 88 ASP C C 13 174.04 0.2 . 1 . . . . 85 ASP C . 10010 1 415 . 1 1 88 88 ASP CA C 13 53.6 0.2 . 1 . . . . 85 ASP CA . 10010 1 416 . 1 1 88 88 ASP CB C 13 40.87 0.2 . 1 . . . . 85 ASP CB . 10010 1 417 . 1 1 88 88 ASP N N 15 120.56 0.1 . 1 . . . . 85 ASP N . 10010 1 418 . 1 1 89 89 ALA H H 1 7.2 0.02 . 1 . . . . 86 ALA H . 10010 1 419 . 1 1 89 89 ALA C C 13 175.91 0.2 . 1 . . . . 86 ALA C . 10010 1 420 . 1 1 89 89 ALA CA C 13 51.88 0.2 . 1 . . . . 86 ALA CA . 10010 1 421 . 1 1 89 89 ALA CB C 13 22.72 0.2 . 1 . . . . 86 ALA CB . 10010 1 422 . 1 1 89 89 ALA N N 15 121.96 0.1 . 1 . . . . 86 ALA N . 10010 1 423 . 1 1 90 90 LEU H H 1 8.99 0.02 . 1 . . . . 87 LEU H . 10010 1 424 . 1 1 90 90 LEU C C 13 175.89 0.2 . 1 . . . . 87 LEU C . 10010 1 425 . 1 1 90 90 LEU CA C 13 55.66 0.2 . 1 . . . . 87 LEU CA . 10010 1 426 . 1 1 90 90 LEU CB C 13 38.52 0.2 . 1 . . . . 87 LEU CB . 10010 1 427 . 1 1 90 90 LEU N N 15 114.61 0.1 . 1 . . . . 87 LEU N . 10010 1 428 . 1 1 91 91 ASN H H 1 8.71 0.02 . 1 . . . . 88 ASN H . 10010 1 429 . 1 1 91 91 ASN C C 13 174.45 0.2 . 1 . . . . 88 ASN C . 10010 1 430 . 1 1 91 91 ASN CA C 13 55.2 0.2 . 1 . . . . 88 ASN CA . 10010 1 431 . 1 1 91 91 ASN CB C 13 38.23 0.2 . 1 . . . . 88 ASN CB . 10010 1 432 . 1 1 91 91 ASN N N 15 111.07 0.1 . 1 . . . . 88 ASN N . 10010 1 433 . 1 1 92 92 GLU H H 1 8.28 0.02 . 1 . . . . 89 GLU H . 10010 1 434 . 1 1 92 92 GLU C C 13 176.3 0.2 . 1 . . . . 89 GLU C . 10010 1 435 . 1 1 92 92 GLU CA C 13 53.97 0.2 . 1 . . . . 89 GLU CA . 10010 1 436 . 1 1 92 92 GLU CB C 13 32.43 0.2 . 1 . . . . 89 GLU CB . 10010 1 437 . 1 1 92 92 GLU N N 15 117.17 0.1 . 1 . . . . 89 GLU N . 10010 1 438 . 1 1 93 93 ASN H H 1 9.16 0.02 . 1 . . . . 90 ASN H . 10010 1 439 . 1 1 93 93 ASN C C 13 176.71 0.2 . 1 . . . . 90 ASN C . 10010 1 440 . 1 1 93 93 ASN CA C 13 52.99 0.2 . 1 . . . . 90 ASN CA . 10010 1 441 . 1 1 93 93 ASN CB C 13 40.25 0.2 . 1 . . . . 90 ASN CB . 10010 1 442 . 1 1 93 93 ASN N N 15 115.34 0.1 . 1 . . . . 90 ASN N . 10010 1 443 . 1 1 94 94 LYS H H 1 8.51 0.02 . 1 . . . . 91 LYS H . 10010 1 444 . 1 1 94 94 LYS C C 13 175.32 0.2 . 1 . . . . 91 LYS C . 10010 1 445 . 1 1 94 94 LYS CA C 13 55.52 0.2 . 1 . . . . 91 LYS CA . 10010 1 446 . 1 1 94 94 LYS CB C 13 37.95 0.2 . 1 . . . . 91 LYS CB . 10010 1 447 . 1 1 94 94 LYS N N 15 121.56 0.1 . 1 . . . . 91 LYS N . 10010 1 448 . 1 1 95 95 VAL H H 1 9.02 0.02 . 1 . . . . 92 VAL H . 10010 1 449 . 1 1 95 95 VAL C C 13 173.95 0.2 . 1 . . . . 92 VAL C . 10010 1 450 . 1 1 95 95 VAL CA C 13 61.31 0.2 . 1 . . . . 92 VAL CA . 10010 1 451 . 1 1 95 95 VAL CB C 13 35.09 0.2 . 1 . . . . 92 VAL CB . 10010 1 452 . 1 1 95 95 VAL N N 15 121.25 0.1 . 1 . . . . 92 VAL N . 10010 1 453 . 1 1 96 96 LEU H H 1 9.51 0.02 . 1 . . . . 93 LEU H . 10010 1 454 . 1 1 96 96 LEU C C 13 176.22 0.2 . 1 . . . . 93 LEU C . 10010 1 455 . 1 1 96 96 LEU CA C 13 53.88 0.2 . 1 . . . . 93 LEU CA . 10010 1 456 . 1 1 96 96 LEU CB C 13 44.51 0.2 . 1 . . . . 93 LEU CB . 10010 1 457 . 1 1 96 96 LEU N N 15 126.01 0.1 . 1 . . . . 93 LEU N . 10010 1 458 . 1 1 97 97 VAL H H 1 9.3 0.02 . 1 . . . . 94 VAL H . 10010 1 459 . 1 1 97 97 VAL C C 13 175.04 0.2 . 1 . . . . 94 VAL C . 10010 1 460 . 1 1 97 97 VAL CA C 13 63.57 0.2 . 1 . . . . 94 VAL CA . 10010 1 461 . 1 1 97 97 VAL CB C 13 31.66 0.2 . 1 . . . . 94 VAL CB . 10010 1 462 . 1 1 97 97 VAL N N 15 123.74 0.1 . 1 . . . . 94 VAL N . 10010 1 463 . 1 1 98 98 LEU H H 1 8.55 0.02 . 1 . . . . 95 LEU H . 10010 1 464 . 1 1 98 98 LEU C C 13 176.75 0.2 . 1 . . . . 95 LEU C . 10010 1 465 . 1 1 98 98 LEU CA C 13 57.82 0.2 . 1 . . . . 95 LEU CA . 10010 1 466 . 1 1 98 98 LEU CB C 13 42.73 0.2 . 1 . . . . 95 LEU CB . 10010 1 467 . 1 1 98 98 LEU N N 15 128.08 0.1 . 1 . . . . 95 LEU N . 10010 1 468 . 1 1 99 99 ASP H H 1 7.25 0.02 . 1 . . . . 96 ASP H . 10010 1 469 . 1 1 99 99 ASP C C 13 174.18 0.2 . 1 . . . . 96 ASP C . 10010 1 470 . 1 1 99 99 ASP CA C 13 54.85 0.2 . 1 . . . . 96 ASP CA . 10010 1 471 . 1 1 99 99 ASP CB C 13 44.33 0.2 . 1 . . . . 96 ASP CB . 10010 1 472 . 1 1 99 99 ASP N N 15 110.55 0.1 . 1 . . . . 96 ASP N . 10010 1 473 . 1 1 100 100 THR H H 1 7.76 0.02 . 1 . . . . 97 THR H . 10010 1 474 . 1 1 100 100 THR C C 13 169.55 0.2 . 1 . . . . 97 THR C . 10010 1 475 . 1 1 100 100 THR CA C 13 60.38 0.2 . 1 . . . . 97 THR CA . 10010 1 476 . 1 1 100 100 THR CB C 13 69.22 0.2 . 1 . . . . 97 THR CB . 10010 1 477 . 1 1 100 100 THR N N 15 119.07 0.1 . 1 . . . . 97 THR N . 10010 1 478 . 1 1 101 101 ASP H H 1 6.87 0.02 . 1 . . . . 98 ASP H . 10010 1 479 . 1 1 101 101 ASP C C 13 179.46 0.2 . 1 . . . . 98 ASP C . 10010 1 480 . 1 1 101 101 ASP CA C 13 52.66 0.2 . 1 . . . . 98 ASP CA . 10010 1 481 . 1 1 101 101 ASP CB C 13 42.29 0.2 . 1 . . . . 98 ASP CB . 10010 1 482 . 1 1 101 101 ASP N N 15 123.8 0.1 . 1 . . . . 98 ASP N . 10010 1 483 . 1 1 102 102 TYR H H 1 9.03 0.02 . 1 . . . . 99 TYR H . 10010 1 484 . 1 1 102 102 TYR C C 13 176.59 0.2 . 1 . . . . 99 TYR C . 10010 1 485 . 1 1 102 102 TYR CA C 13 65.05 0.2 . 1 . . . . 99 TYR CA . 10010 1 486 . 1 1 102 102 TYR CB C 13 36.77 0.2 . 1 . . . . 99 TYR CB . 10010 1 487 . 1 1 102 102 TYR N N 15 117.51 0.1 . 1 . . . . 99 TYR N . 10010 1 488 . 1 1 103 103 LYS H H 1 9.05 0.02 . 1 . . . . 100 LYS H . 10010 1 489 . 1 1 103 103 LYS C C 13 176.25 0.2 . 1 . . . . 100 LYS C . 10010 1 490 . 1 1 103 103 LYS CA C 13 56.84 0.2 . 1 . . . . 100 LYS CA . 10010 1 491 . 1 1 103 103 LYS CB C 13 34.53 0.2 . 1 . . . . 100 LYS CB . 10010 1 492 . 1 1 103 103 LYS N N 15 119.95 0.1 . 1 . . . . 100 LYS N . 10010 1 493 . 1 1 104 104 LYS H H 1 9.75 0.02 . 1 . . . . 101 LYS H . 10010 1 494 . 1 1 104 104 LYS C C 13 175.88 0.2 . 1 . . . . 101 LYS C . 10010 1 495 . 1 1 104 104 LYS CA C 13 59.47 0.2 . 1 . . . . 101 LYS CA . 10010 1 496 . 1 1 104 104 LYS CB C 13 35.59 0.2 . 1 . . . . 101 LYS CB . 10010 1 497 . 1 1 104 104 LYS N N 15 121.68 0.1 . 1 . . . . 101 LYS N . 10010 1 498 . 1 1 105 105 TYR H H 1 9.19 0.02 . 1 . . . . 102 TYR H . 10010 1 499 . 1 1 105 105 TYR C C 13 174.38 0.2 . 1 . . . . 102 TYR C . 10010 1 500 . 1 1 105 105 TYR CA C 13 56.72 0.2 . 1 . . . . 102 TYR CA . 10010 1 501 . 1 1 105 105 TYR CB C 13 44.16 0.2 . 1 . . . . 102 TYR CB . 10010 1 502 . 1 1 105 105 TYR N N 15 116.6 0.1 . 1 . . . . 102 TYR N . 10010 1 503 . 1 1 106 106 LEU H H 1 9.21 0.02 . 1 . . . . 103 LEU H . 10010 1 504 . 1 1 106 106 LEU C C 13 173.66 0.2 . 1 . . . . 103 LEU C . 10010 1 505 . 1 1 106 106 LEU CA C 13 56.82 0.2 . 1 . . . . 103 LEU CA . 10010 1 506 . 1 1 106 106 LEU CB C 13 44.31 0.2 . 1 . . . . 103 LEU CB . 10010 1 507 . 1 1 106 106 LEU N N 15 124.97 0.1 . 1 . . . . 103 LEU N . 10010 1 508 . 1 1 107 107 LEU H H 1 9.41 0.02 . 1 . . . . 104 LEU H . 10010 1 509 . 1 1 107 107 LEU C C 13 176.35 0.2 . 1 . . . . 104 LEU C . 10010 1 510 . 1 1 107 107 LEU CA C 13 52.65 0.2 . 1 . . . . 104 LEU CA . 10010 1 511 . 1 1 107 107 LEU CB C 13 44.04 0.2 . 1 . . . . 104 LEU CB . 10010 1 512 . 1 1 107 107 LEU N N 15 124.82 0.1 . 1 . . . . 104 LEU N . 10010 1 513 . 1 1 108 108 PHE H H 1 8.92 0.02 . 1 . . . . 105 PHE H . 10010 1 514 . 1 1 108 108 PHE C C 13 172.27 0.2 . 1 . . . . 105 PHE C . 10010 1 515 . 1 1 108 108 PHE CA C 13 55.95 0.2 . 1 . . . . 105 PHE CA . 10010 1 516 . 1 1 108 108 PHE CB C 13 42.33 0.2 . 1 . . . . 105 PHE CB . 10010 1 517 . 1 1 108 108 PHE N N 15 121.51 0.1 . 1 . . . . 105 PHE N . 10010 1 518 . 1 1 109 109 CYS H H 1 9.63 0.02 . 1 . . . . 106 CYS H . 10010 1 519 . 1 1 109 109 CYS C C 13 172.8 0.2 . 1 . . . . 106 CYS C . 10010 1 520 . 1 1 109 109 CYS CA C 13 55.74 0.2 . 1 . . . . 106 CYS CA . 10010 1 521 . 1 1 109 109 CYS CB C 13 49.56 0.2 . 1 . . . . 106 CYS CB . 10010 1 522 . 1 1 109 109 CYS N N 15 117.1 0.1 . 1 . . . . 106 CYS N . 10010 1 523 . 1 1 110 110 MET H H 1 9.97 0.02 . 1 . . . . 107 MET H . 10010 1 524 . 1 1 110 110 MET C C 13 173.22 0.2 . 1 . . . . 107 MET C . 10010 1 525 . 1 1 110 110 MET CA C 13 54.58 0.2 . 1 . . . . 107 MET CA . 10010 1 526 . 1 1 110 110 MET CB C 13 37.54 0.2 . 1 . . . . 107 MET CB . 10010 1 527 . 1 1 110 110 MET N N 15 120.86 0.1 . 1 . . . . 107 MET N . 10010 1 528 . 1 1 111 111 GLU H H 1 8.29 0.02 . 1 . . . . 108 GLU H . 10010 1 529 . 1 1 111 111 GLU C C 13 174.61 0.2 . 1 . . . . 108 GLU C . 10010 1 530 . 1 1 111 111 GLU CA C 13 55.21 0.2 . 1 . . . . 108 GLU CA . 10010 1 531 . 1 1 111 111 GLU CB C 13 33.62 0.2 . 1 . . . . 108 GLU CB . 10010 1 532 . 1 1 111 111 GLU N N 15 113.83 0.1 . 1 . . . . 108 GLU N . 10010 1 533 . 1 1 112 112 ASN H H 1 9.13 0.02 . 1 . . . . 109 ASN H . 10010 1 534 . 1 1 112 112 ASN C C 13 177.29 0.2 . 1 . . . . 109 ASN C . 10010 1 535 . 1 1 112 112 ASN CA C 13 52.08 0.2 . 1 . . . . 109 ASN CA . 10010 1 536 . 1 1 112 112 ASN CB C 13 38.89 0.2 . 1 . . . . 109 ASN CB . 10010 1 537 . 1 1 112 112 ASN N N 15 119.8 0.1 . 1 . . . . 109 ASN N . 10010 1 538 . 1 1 113 113 SER H H 1 9.67 0.02 . 1 . . . . 110 SER H . 10010 1 539 . 1 1 113 113 SER C C 13 174.66 0.2 . 1 . . . . 110 SER C . 10010 1 540 . 1 1 113 113 SER CA C 13 61 0.2 . 1 . . . . 110 SER CA . 10010 1 541 . 1 1 113 113 SER CB C 13 63.18 0.2 . 1 . . . . 110 SER CB . 10010 1 542 . 1 1 113 113 SER N N 15 121.2 0.1 . 1 . . . . 110 SER N . 10010 1 543 . 1 1 114 114 ALA H H 1 8.24 0.02 . 1 . . . . 111 ALA H . 10010 1 544 . 1 1 114 114 ALA C C 13 178.43 0.2 . 1 . . . . 111 ALA C . 10010 1 545 . 1 1 114 114 ALA CA C 13 53.82 0.2 . 1 . . . . 111 ALA CA . 10010 1 546 . 1 1 114 114 ALA CB C 13 19.44 0.2 . 1 . . . . 111 ALA CB . 10010 1 547 . 1 1 114 114 ALA N N 15 122.92 0.1 . 1 . . . . 111 ALA N . 10010 1 548 . 1 1 115 115 GLU H H 1 7.66 0.02 . 1 . . . . 112 GLU H . 10010 1 549 . 1 1 115 115 GLU C C 13 175.11 0.2 . 1 . . . . 112 GLU C . 10010 1 550 . 1 1 115 115 GLU CB C 13 29.89 0.2 . 1 . . . . 112 GLU CB . 10010 1 551 . 1 1 115 115 GLU N N 15 114.44 0.1 . 1 . . . . 112 GLU N . 10010 1 552 . 1 1 116 116 PRO C C 13 178.43 0.2 . 1 . . . . 113 PRO C . 10010 1 553 . 1 1 116 116 PRO CA C 13 66.36 0.2 . 1 . . . . 113 PRO CA . 10010 1 554 . 1 1 116 116 PRO CB C 13 31.9 0.2 . 1 . . . . 113 PRO CB . 10010 1 555 . 1 1 117 117 GLU H H 1 8.69 0.02 . 1 . . . . 114 GLU H . 10010 1 556 . 1 1 117 117 GLU C C 13 178.68 0.2 . 1 . . . . 114 GLU C . 10010 1 557 . 1 1 117 117 GLU CA C 13 59.62 0.2 . 1 . . . . 114 GLU CA . 10010 1 558 . 1 1 117 117 GLU CB C 13 29 0.2 . 1 . . . . 114 GLU CB . 10010 1 559 . 1 1 117 117 GLU N N 15 114.5 0.1 . 1 . . . . 114 GLU N . 10010 1 560 . 1 1 118 118 GLN H H 1 7.63 0.02 . 1 . . . . 115 GLN H . 10010 1 561 . 1 1 118 118 GLN C C 13 175.84 0.2 . 1 . . . . 115 GLN C . 10010 1 562 . 1 1 118 118 GLN CA C 13 56.42 0.2 . 1 . . . . 115 GLN CA . 10010 1 563 . 1 1 118 118 GLN CB C 13 29.42 0.2 . 1 . . . . 115 GLN CB . 10010 1 564 . 1 1 118 118 GLN N N 15 116.61 0.1 . 1 . . . . 115 GLN N . 10010 1 565 . 1 1 119 119 SER H H 1 7.68 0.02 . 1 . . . . 116 SER H . 10010 1 566 . 1 1 119 119 SER C C 13 173.2 0.2 . 1 . . . . 116 SER C . 10010 1 567 . 1 1 119 119 SER CA C 13 58.69 0.2 . 1 . . . . 116 SER CA . 10010 1 568 . 1 1 119 119 SER CB C 13 65.73 0.2 . 1 . . . . 116 SER CB . 10010 1 569 . 1 1 119 119 SER N N 15 110.49 0.1 . 1 . . . . 116 SER N . 10010 1 570 . 1 1 120 120 LEU H H 1 7.36 0.02 . 1 . . . . 117 LEU H . 10010 1 571 . 1 1 120 120 LEU C C 13 175.75 0.2 . 1 . . . . 117 LEU C . 10010 1 572 . 1 1 120 120 LEU CA C 13 56.66 0.2 . 1 . . . . 117 LEU CA . 10010 1 573 . 1 1 120 120 LEU CB C 13 42.99 0.2 . 1 . . . . 117 LEU CB . 10010 1 574 . 1 1 120 120 LEU N N 15 127.26 0.1 . 1 . . . . 117 LEU N . 10010 1 575 . 1 1 121 121 VAL H H 1 8.8 0.02 . 1 . . . . 118 VAL H . 10010 1 576 . 1 1 121 121 VAL C C 13 174.68 0.2 . 1 . . . . 118 VAL C . 10010 1 577 . 1 1 121 121 VAL CA C 13 60.05 0.2 . 1 . . . . 118 VAL CA . 10010 1 578 . 1 1 121 121 VAL CB C 13 35.74 0.2 . 1 . . . . 118 VAL CB . 10010 1 579 . 1 1 121 121 VAL N N 15 125.66 0.1 . 1 . . . . 118 VAL N . 10010 1 580 . 1 1 122 122 CYS H H 1 9.53 0.02 . 1 . . . . 119 CYS H . 10010 1 581 . 1 1 122 122 CYS C C 13 173.26 0.2 . 1 . . . . 119 CYS C . 10010 1 582 . 1 1 122 122 CYS CA C 13 55.35 0.2 . 1 . . . . 119 CYS CA . 10010 1 583 . 1 1 122 122 CYS CB C 13 50.23 0.2 . 1 . . . . 119 CYS CB . 10010 1 584 . 1 1 122 122 CYS N N 15 122 0.1 . 1 . . . . 119 CYS N . 10010 1 585 . 1 1 123 123 GLN H H 1 9.31 0.02 . 1 . . . . 120 GLN H . 10010 1 586 . 1 1 123 123 GLN C C 13 173.63 0.2 . 1 . . . . 120 GLN C . 10010 1 587 . 1 1 123 123 GLN CA C 13 55.57 0.2 . 1 . . . . 120 GLN CA . 10010 1 588 . 1 1 123 123 GLN CB C 13 32.77 0.2 . 1 . . . . 120 GLN CB . 10010 1 589 . 1 1 123 123 GLN N N 15 118.48 0.1 . 1 . . . . 120 GLN N . 10010 1 590 . 1 1 124 124 CYS H H 1 7.84 0.02 . 1 . . . . 121 CYS H . 10010 1 591 . 1 1 124 124 CYS C C 13 173 0.2 . 1 . . . . 121 CYS C . 10010 1 592 . 1 1 124 124 CYS CA C 13 56.76 0.2 . 1 . . . . 121 CYS CA . 10010 1 593 . 1 1 124 124 CYS CB C 13 27.62 0.2 . 1 . . . . 121 CYS CB . 10010 1 594 . 1 1 124 124 CYS N N 15 120.03 0.1 . 1 . . . . 121 CYS N . 10010 1 595 . 1 1 125 125 LEU H H 1 9.78 0.02 . 1 . . . . 122 LEU H . 10010 1 596 . 1 1 125 125 LEU C C 13 177.26 0.2 . 1 . . . . 122 LEU C . 10010 1 597 . 1 1 125 125 LEU CA C 13 52.64 0.2 . 1 . . . . 122 LEU CA . 10010 1 598 . 1 1 125 125 LEU CB C 13 44.96 0.2 . 1 . . . . 122 LEU CB . 10010 1 599 . 1 1 125 125 LEU N N 15 128.55 0.1 . 1 . . . . 122 LEU N . 10010 1 600 . 1 1 126 126 VAL H H 1 9.47 0.02 . 1 . . . . 123 VAL H . 10010 1 601 . 1 1 126 126 VAL C C 13 178.2 0.2 . 1 . . . . 123 VAL C . 10010 1 602 . 1 1 126 126 VAL CA C 13 59.26 0.2 . 1 . . . . 123 VAL CA . 10010 1 603 . 1 1 126 126 VAL CB C 13 37.29 0.2 . 1 . . . . 123 VAL CB . 10010 1 604 . 1 1 126 126 VAL N N 15 111.65 0.1 . 1 . . . . 123 VAL N . 10010 1 605 . 1 1 127 127 ARG H H 1 8.05 0.02 . 1 . . . . 124 ARG H . 10010 1 606 . 1 1 127 127 ARG C C 13 176.06 0.2 . 1 . . . . 124 ARG C . 10010 1 607 . 1 1 127 127 ARG CA C 13 57.03 0.2 . 1 . . . . 124 ARG CA . 10010 1 608 . 1 1 127 127 ARG CB C 13 33.72 0.2 . 1 . . . . 124 ARG CB . 10010 1 609 . 1 1 127 127 ARG N N 15 119.59 0.1 . 1 . . . . 124 ARG N . 10010 1 610 . 1 1 128 128 THR H H 1 7.59 0.02 . 1 . . . . 125 THR H . 10010 1 611 . 1 1 128 128 THR C C 13 172.88 0.2 . 1 . . . . 125 THR C . 10010 1 612 . 1 1 128 128 THR CA C 13 57.56 0.2 . 1 . . . . 125 THR CA . 10010 1 613 . 1 1 128 128 THR CB C 13 69.8 0.2 . 1 . . . . 125 THR CB . 10010 1 614 . 1 1 128 128 THR N N 15 108.1 0.1 . 1 . . . . 125 THR N . 10010 1 615 . 1 1 129 129 PRO C C 13 173.45 0.2 . 1 . . . . 126 PRO C . 10010 1 616 . 1 1 129 129 PRO CA C 13 62.21 0.2 . 1 . . . . 126 PRO CA . 10010 1 617 . 1 1 129 129 PRO CB C 13 26.72 0.2 . 1 . . . . 126 PRO CB . 10010 1 618 . 1 1 130 130 GLU H H 1 8.45 0.02 . 1 . . . . 127 GLU H . 10010 1 619 . 1 1 130 130 GLU C C 13 175.23 0.2 . 1 . . . . 127 GLU C . 10010 1 620 . 1 1 130 130 GLU CA C 13 54.34 0.2 . 1 . . . . 127 GLU CA . 10010 1 621 . 1 1 130 130 GLU CB C 13 33.49 0.2 . 1 . . . . 127 GLU CB . 10010 1 622 . 1 1 130 130 GLU N N 15 121.73 0.1 . 1 . . . . 127 GLU N . 10010 1 623 . 1 1 131 131 VAL H H 1 8.64 0.02 . 1 . . . . 128 VAL H . 10010 1 624 . 1 1 131 131 VAL C C 13 174.95 0.2 . 1 . . . . 128 VAL C . 10010 1 625 . 1 1 131 131 VAL CA C 13 64.01 0.2 . 1 . . . . 128 VAL CA . 10010 1 626 . 1 1 131 131 VAL CB C 13 31.44 0.2 . 1 . . . . 128 VAL CB . 10010 1 627 . 1 1 131 131 VAL N N 15 121.26 0.1 . 1 . . . . 128 VAL N . 10010 1 628 . 1 1 132 132 ASP H H 1 6.14 0.02 . 1 . . . . 129 ASP H . 10010 1 629 . 1 1 132 132 ASP C C 13 175.31 0.2 . 1 . . . . 129 ASP C . 10010 1 630 . 1 1 132 132 ASP CA C 13 52.93 0.2 . 1 . . . . 129 ASP CA . 10010 1 631 . 1 1 132 132 ASP CB C 13 43.11 0.2 . 1 . . . . 129 ASP CB . 10010 1 632 . 1 1 132 132 ASP N N 15 126.93 0.1 . 1 . . . . 129 ASP N . 10010 1 633 . 1 1 133 133 ASP H H 1 8.8 0.02 . 1 . . . . 130 ASP H . 10010 1 634 . 1 1 133 133 ASP C C 13 178.65 0.2 . 1 . . . . 130 ASP C . 10010 1 635 . 1 1 133 133 ASP CA C 13 57.77 0.2 . 1 . . . . 130 ASP CA . 10010 1 636 . 1 1 133 133 ASP CB C 13 40.88 0.2 . 1 . . . . 130 ASP CB . 10010 1 637 . 1 1 133 133 ASP N N 15 125.66 0.1 . 1 . . . . 130 ASP N . 10010 1 638 . 1 1 134 134 GLU H H 1 8.19 0.02 . 1 . . . . 131 GLU H . 10010 1 639 . 1 1 134 134 GLU C C 13 178.72 0.2 . 1 . . . . 131 GLU C . 10010 1 640 . 1 1 134 134 GLU CA C 13 59.45 0.2 . 1 . . . . 131 GLU CA . 10010 1 641 . 1 1 134 134 GLU CB C 13 29.12 0.2 . 1 . . . . 131 GLU CB . 10010 1 642 . 1 1 134 134 GLU N N 15 121.84 0.1 . 1 . . . . 131 GLU N . 10010 1 643 . 1 1 135 135 ALA H H 1 8.27 0.02 . 1 . . . . 132 ALA H . 10010 1 644 . 1 1 135 135 ALA C C 13 179.3 0.2 . 1 . . . . 132 ALA C . 10010 1 645 . 1 1 135 135 ALA CA C 13 55.2 0.2 . 1 . . . . 132 ALA CA . 10010 1 646 . 1 1 135 135 ALA CB C 13 18.67 0.2 . 1 . . . . 132 ALA CB . 10010 1 647 . 1 1 135 135 ALA N N 15 123.3 0.1 . 1 . . . . 132 ALA N . 10010 1 648 . 1 1 136 136 LEU H H 1 7.71 0.02 . 1 . . . . 133 LEU H . 10010 1 649 . 1 1 136 136 LEU C C 13 179.27 0.2 . 1 . . . . 133 LEU C . 10010 1 650 . 1 1 136 136 LEU CA C 13 57.93 0.2 . 1 . . . . 133 LEU CA . 10010 1 651 . 1 1 136 136 LEU CB C 13 41.51 0.2 . 1 . . . . 133 LEU CB . 10010 1 652 . 1 1 136 136 LEU N N 15 115.54 0.1 . 1 . . . . 133 LEU N . 10010 1 653 . 1 1 137 137 GLU H H 1 8.03 0.02 . 1 . . . . 134 GLU H . 10010 1 654 . 1 1 137 137 GLU C C 13 179.48 0.2 . 1 . . . . 134 GLU C . 10010 1 655 . 1 1 137 137 GLU CA C 13 59.56 0.2 . 1 . . . . 134 GLU CA . 10010 1 656 . 1 1 137 137 GLU CB C 13 29.14 0.2 . 1 . . . . 134 GLU CB . 10010 1 657 . 1 1 137 137 GLU N N 15 121.78 0.1 . 1 . . . . 134 GLU N . 10010 1 658 . 1 1 138 138 LYS H H 1 8.07 0.02 . 1 . . . . 135 LYS H . 10010 1 659 . 1 1 138 138 LYS C C 13 179.72 0.2 . 1 . . . . 135 LYS C . 10010 1 660 . 1 1 138 138 LYS CA C 13 59.6 0.2 . 1 . . . . 135 LYS CA . 10010 1 661 . 1 1 138 138 LYS CB C 13 32.27 0.2 . 1 . . . . 135 LYS CB . 10010 1 662 . 1 1 138 138 LYS N N 15 119.51 0.1 . 1 . . . . 135 LYS N . 10010 1 663 . 1 1 139 139 PHE H H 1 8.49 0.02 . 1 . . . . 136 PHE H . 10010 1 664 . 1 1 139 139 PHE C C 13 175.56 0.2 . 1 . . . . 136 PHE C . 10010 1 665 . 1 1 139 139 PHE CA C 13 60.47 0.2 . 1 . . . . 136 PHE CA . 10010 1 666 . 1 1 139 139 PHE CB C 13 39.11 0.2 . 1 . . . . 136 PHE CB . 10010 1 667 . 1 1 139 139 PHE N N 15 121.48 0.1 . 1 . . . . 136 PHE N . 10010 1 668 . 1 1 140 140 ASP H H 1 8.44 0.02 . 1 . . . . 137 ASP H . 10010 1 669 . 1 1 140 140 ASP C C 13 179.61 0.2 . 1 . . . . 137 ASP C . 10010 1 670 . 1 1 140 140 ASP CA C 13 57.8 0.2 . 1 . . . . 137 ASP CA . 10010 1 671 . 1 1 140 140 ASP CB C 13 40.91 0.2 . 1 . . . . 137 ASP CB . 10010 1 672 . 1 1 140 140 ASP N N 15 118.42 0.1 . 1 . . . . 137 ASP N . 10010 1 673 . 1 1 141 141 LYS H H 1 8.11 0.02 . 1 . . . . 138 LYS H . 10010 1 674 . 1 1 141 141 LYS C C 13 179.3 0.2 . 1 . . . . 138 LYS C . 10010 1 675 . 1 1 141 141 LYS CA C 13 59.59 0.2 . 1 . . . . 138 LYS CA . 10010 1 676 . 1 1 141 141 LYS CB C 13 32.42 0.2 . 1 . . . . 138 LYS CB . 10010 1 677 . 1 1 141 141 LYS N N 15 118.5 0.1 . 1 . . . . 138 LYS N . 10010 1 678 . 1 1 142 142 ALA H H 1 7.88 0.02 . 1 . . . . 139 ALA H . 10010 1 679 . 1 1 142 142 ALA C C 13 179.25 0.2 . 1 . . . . 139 ALA C . 10010 1 680 . 1 1 142 142 ALA CA C 13 54.26 0.2 . 1 . . . . 139 ALA CA . 10010 1 681 . 1 1 142 142 ALA CB C 13 17.79 0.2 . 1 . . . . 139 ALA CB . 10010 1 682 . 1 1 142 142 ALA N N 15 121.74 0.1 . 1 . . . . 139 ALA N . 10010 1 683 . 1 1 143 143 LEU H H 1 7.46 0.02 . 1 . . . . 140 LEU H . 10010 1 684 . 1 1 143 143 LEU C C 13 178.73 0.2 . 1 . . . . 140 LEU C . 10010 1 685 . 1 1 143 143 LEU CA C 13 55.34 0.2 . 1 . . . . 140 LEU CA . 10010 1 686 . 1 1 143 143 LEU CB C 13 41.44 0.2 . 1 . . . . 140 LEU CB . 10010 1 687 . 1 1 143 143 LEU N N 15 114.71 0.1 . 1 . . . . 140 LEU N . 10010 1 688 . 1 1 144 144 LYS H H 1 7.17 0.02 . 1 . . . . 141 LYS H . 10010 1 689 . 1 1 144 144 LYS C C 13 177 0.2 . 1 . . . . 141 LYS C . 10010 1 690 . 1 1 144 144 LYS CA C 13 59.23 0.2 . 1 . . . . 141 LYS CA . 10010 1 691 . 1 1 144 144 LYS CB C 13 32.46 0.2 . 1 . . . . 141 LYS CB . 10010 1 692 . 1 1 144 144 LYS N N 15 120.19 0.1 . 1 . . . . 141 LYS N . 10010 1 693 . 1 1 145 145 ALA H H 1 7.82 0.02 . 1 . . . . 142 ALA H . 10010 1 694 . 1 1 145 145 ALA C C 13 176.7 0.2 . 1 . . . . 142 ALA C . 10010 1 695 . 1 1 145 145 ALA CA C 13 51.72 0.2 . 1 . . . . 142 ALA CA . 10010 1 696 . 1 1 145 145 ALA CB C 13 19.32 0.2 . 1 . . . . 142 ALA CB . 10010 1 697 . 1 1 145 145 ALA N N 15 117.97 0.1 . 1 . . . . 142 ALA N . 10010 1 698 . 1 1 146 146 LEU H H 1 7.78 0.02 . 1 . . . . 143 LEU H . 10010 1 699 . 1 1 146 146 LEU C C 13 175.92 0.2 . 1 . . . . 143 LEU C . 10010 1 700 . 1 1 146 146 LEU CB C 13 42.71 0.2 . 1 . . . . 143 LEU CB . 10010 1 701 . 1 1 146 146 LEU N N 15 120.02 0.1 . 1 . . . . 143 LEU N . 10010 1 702 . 1 1 147 147 PRO C C 13 174.89 0.2 . 1 . . . . 144 PRO C . 10010 1 703 . 1 1 147 147 PRO CA C 13 62.3 0.2 . 1 . . . . 144 PRO CA . 10010 1 704 . 1 1 147 147 PRO CB C 13 28.25 0.2 . 1 . . . . 144 PRO CB . 10010 1 705 . 1 1 148 148 MET H H 1 7.66 0.02 . 1 . . . . 145 MET H . 10010 1 706 . 1 1 148 148 MET C C 13 177.41 0.2 . 1 . . . . 145 MET C . 10010 1 707 . 1 1 148 148 MET CA C 13 54.3 0.2 . 1 . . . . 145 MET CA . 10010 1 708 . 1 1 148 148 MET CB C 13 32.77 0.2 . 1 . . . . 145 MET CB . 10010 1 709 . 1 1 148 148 MET N N 15 117.94 0.1 . 1 . . . . 145 MET N . 10010 1 710 . 1 1 149 149 HIS H H 1 8.87 0.02 . 1 . . . . 146 HIS H . 10010 1 711 . 1 1 149 149 HIS C C 13 171.66 0.2 . 1 . . . . 146 HIS C . 10010 1 712 . 1 1 149 149 HIS CA C 13 57.19 0.2 . 1 . . . . 146 HIS CA . 10010 1 713 . 1 1 149 149 HIS CB C 13 31.38 0.2 . 1 . . . . 146 HIS CB . 10010 1 714 . 1 1 149 149 HIS N N 15 118.8 0.1 . 1 . . . . 146 HIS N . 10010 1 715 . 1 1 150 150 ILE H H 1 7.68 0.02 . 1 . . . . 147 ILE H . 10010 1 716 . 1 1 150 150 ILE C C 13 172.73 0.2 . 1 . . . . 147 ILE C . 10010 1 717 . 1 1 150 150 ILE CA C 13 59.44 0.2 . 1 . . . . 147 ILE CA . 10010 1 718 . 1 1 150 150 ILE CB C 13 40.58 0.2 . 1 . . . . 147 ILE CB . 10010 1 719 . 1 1 150 150 ILE N N 15 116.3 0.1 . 1 . . . . 147 ILE N . 10010 1 720 . 1 1 151 151 ARG H H 1 8.55 0.02 . 1 . . . . 148 ARG H . 10010 1 721 . 1 1 151 151 ARG C C 13 174.09 0.2 . 1 . . . . 148 ARG C . 10010 1 722 . 1 1 151 151 ARG CA C 13 55.14 0.2 . 1 . . . . 148 ARG CA . 10010 1 723 . 1 1 151 151 ARG CB C 13 34.33 0.2 . 1 . . . . 148 ARG CB . 10010 1 724 . 1 1 151 151 ARG N N 15 125.75 0.1 . 1 . . . . 148 ARG N . 10010 1 725 . 1 1 152 152 LEU H H 1 9.21 0.02 . 1 . . . . 149 LEU H . 10010 1 726 . 1 1 152 152 LEU C C 13 175.67 0.2 . 1 . . . . 149 LEU C . 10010 1 727 . 1 1 152 152 LEU CA C 13 54.42 0.2 . 1 . . . . 149 LEU CA . 10010 1 728 . 1 1 152 152 LEU CB C 13 46.72 0.2 . 1 . . . . 149 LEU CB . 10010 1 729 . 1 1 152 152 LEU N N 15 124.39 0.1 . 1 . . . . 149 LEU N . 10010 1 730 . 1 1 153 153 SER H H 1 8.84 0.02 . 1 . . . . 150 SER H . 10010 1 731 . 1 1 153 153 SER C C 13 173.35 0.2 . 1 . . . . 150 SER C . 10010 1 732 . 1 1 153 153 SER CA C 13 57.21 0.2 . 1 . . . . 150 SER CA . 10010 1 733 . 1 1 153 153 SER CB C 13 65.65 0.2 . 1 . . . . 150 SER CB . 10010 1 734 . 1 1 153 153 SER N N 15 116.5 0.1 . 1 . . . . 150 SER N . 10010 1 735 . 1 1 154 154 PHE H H 1 8.46 0.02 . 1 . . . . 151 PHE H . 10010 1 736 . 1 1 154 154 PHE C C 13 174.13 0.2 . 1 . . . . 151 PHE C . 10010 1 737 . 1 1 154 154 PHE CA C 13 58.41 0.2 . 1 . . . . 151 PHE CA . 10010 1 738 . 1 1 154 154 PHE CB C 13 41.49 0.2 . 1 . . . . 151 PHE CB . 10010 1 739 . 1 1 154 154 PHE N N 15 121.29 0.1 . 1 . . . . 151 PHE N . 10010 1 740 . 1 1 155 155 ASN H H 1 8.66 0.02 . 1 . . . . 152 ASN H . 10010 1 741 . 1 1 155 155 ASN C C 13 174.34 0.2 . 1 . . . . 152 ASN C . 10010 1 742 . 1 1 155 155 ASN CA C 13 50.9 0.2 . 1 . . . . 152 ASN CA . 10010 1 743 . 1 1 155 155 ASN CB C 13 38.11 0.2 . 1 . . . . 152 ASN CB . 10010 1 744 . 1 1 155 155 ASN N N 15 118.63 0.1 . 1 . . . . 152 ASN N . 10010 1 745 . 1 1 156 156 PRO C C 13 177.96 0.2 . 1 . . . . 153 PRO C . 10010 1 746 . 1 1 156 156 PRO CA C 13 66.45 0.2 . 1 . . . . 153 PRO CA . 10010 1 747 . 1 1 156 156 PRO CB C 13 32.18 0.2 . 1 . . . . 153 PRO CB . 10010 1 748 . 1 1 157 157 THR H H 1 7.7 0.02 . 1 . . . . 154 THR H . 10010 1 749 . 1 1 157 157 THR C C 13 176.71 0.2 . 1 . . . . 154 THR C . 10010 1 750 . 1 1 157 157 THR CA C 13 65.43 0.2 . 1 . . . . 154 THR CA . 10010 1 751 . 1 1 157 157 THR CB C 13 68.72 0.2 . 1 . . . . 154 THR CB . 10010 1 752 . 1 1 157 157 THR N N 15 110.84 0.1 . 1 . . . . 154 THR N . 10010 1 753 . 1 1 158 158 GLN H H 1 7.85 0.02 . 1 . . . . 155 GLN H . 10010 1 754 . 1 1 158 158 GLN C C 13 177.74 0.2 . 1 . . . . 155 GLN C . 10010 1 755 . 1 1 158 158 GLN CA C 13 57.87 0.2 . 1 . . . . 155 GLN CA . 10010 1 756 . 1 1 158 158 GLN CB C 13 28.67 0.2 . 1 . . . . 155 GLN CB . 10010 1 757 . 1 1 158 158 GLN N N 15 119.91 0.1 . 1 . . . . 155 GLN N . 10010 1 stop_ save_