################################### # 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 50131 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name assigned_chem_shift_list_1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.01 _Assigned_chem_shift_list.Chem_shift_13C_err . _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 '2D 1H-15N HSQC' . . . 50131 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 . . 50131 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 ASP H H 1 8.809 0.01 . 1 . . . . . 3 ASP H . 50131 1 2 . 1 . 1 3 3 ASP N N 15 121.327 0.1 . 1 . . . . . 3 ASP N . 50131 1 3 . 1 . 1 4 4 GLN H H 1 8.429 0.01 . 1 . . . . . 4 GLN H . 50131 1 4 . 1 . 1 4 4 GLN N N 15 120.628 0.1 . 1 . . . . . 4 GLN N . 50131 1 5 . 1 . 1 5 5 GLN H H 1 8.402 0.01 . 1 . . . . . 5 GLN H . 50131 1 6 . 1 . 1 5 5 GLN N N 15 120.927 0.1 . 1 . . . . . 5 GLN N . 50131 1 7 . 1 . 1 6 6 ASN H H 1 8.413 0.01 . 1 . . . . . 6 ASN H . 50131 1 8 . 1 . 1 6 6 ASN N N 15 119.484 0.1 . 1 . . . . . 6 ASN N . 50131 1 9 . 1 . 1 7 7 GLN H H 1 8.388 0.01 . 1 . . . . . 7 GLN H . 50131 1 10 . 1 . 1 7 7 GLN N N 15 120.543 0.1 . 1 . . . . . 7 GLN N . 50131 1 11 . 1 . 1 8 8 ASP H H 1 8.413 0.01 . 1 . . . . . 8 ASP H . 50131 1 12 . 1 . 1 8 8 ASP N N 15 120.448 0.1 . 1 . . . . . 8 ASP N . 50131 1 13 . 1 . 1 9 9 GLN H H 1 8.276 0.01 . 1 . . . . . 9 GLN H . 50131 1 14 . 1 . 1 9 9 GLN N N 15 120.383 0.1 . 1 . . . . . 9 GLN N . 50131 1 15 . 1 . 1 10 10 GLY H H 1 8.403 0.01 . 1 . . . . . 10 GLY H . 50131 1 16 . 1 . 1 10 10 GLY N N 15 109.418 0.1 . 1 . . . . . 10 GLY N . 50131 1 17 . 1 . 1 11 11 GLN H H 1 8.231 0.01 . 1 . . . . . 11 GLN H . 50131 1 18 . 1 . 1 11 11 GLN N N 15 119.635 0.1 . 1 . . . . . 11 GLN N . 50131 1 19 . 1 . 1 12 12 GLY H H 1 8.446 0.01 . 1 . . . . . 12 GLY H . 50131 1 20 . 1 . 1 12 12 GLY N N 15 109.728 0.1 . 1 . . . . . 12 GLY N . 50131 1 21 . 1 . 1 13 13 GLN H H 1 8.247 0.01 . 1 . . . . . 13 GLN H . 50131 1 22 . 1 . 1 13 13 GLN N N 15 119.616 0.1 . 1 . . . . . 13 GLN N . 50131 1 23 . 1 . 1 14 14 GLY H H 1 8.391 0.01 . 1 . . . . . 14 GLY H . 50131 1 24 . 1 . 1 14 14 GLY N N 15 109.505 0.1 . 1 . . . . . 14 GLY N . 50131 1 25 . 1 . 1 15 15 TYR H H 1 7.990 0.01 . 1 . . . . . 15 TYR H . 50131 1 26 . 1 . 1 15 15 TYR N N 15 120.028 0.1 . 1 . . . . . 15 TYR N . 50131 1 27 . 1 . 1 16 16 ASN H H 1 8.157 0.01 . 1 . . . . . 16 ASN H . 50131 1 28 . 1 . 1 16 16 ASN N N 15 120.102 0.1 . 1 . . . . . 16 ASN N . 50131 1 29 . 1 . 1 17 17 GLN H H 1 8.231 0.01 . 1 . . . . . 17 GLN H . 50131 1 30 . 1 . 1 17 17 GLN N N 15 120.167 0.1 . 1 . . . . . 17 GLN N . 50131 1 31 . 1 . 1 18 18 TYR H H 1 8.067 0.01 . 1 . . . . . 18 TYR H . 50131 1 32 . 1 . 1 18 18 TYR N N 15 119.871 0.1 . 1 . . . . . 18 TYR N . 50131 1 33 . 1 . 1 19 19 ASN H H 1 8.132 0.01 . 1 . . . . . 19 ASN H . 50131 1 34 . 1 . 1 19 19 ASN N N 15 119.687 0.1 . 1 . . . . . 19 ASN N . 50131 1 35 . 1 . 1 20 20 GLN H H 1 8.223 0.01 . 1 . . . . . 20 GLN H . 50131 1 36 . 1 . 1 20 20 GLN N N 15 120.117 0.1 . 1 . . . . . 20 GLN N . 50131 1 37 . 1 . 1 21 21 TYR H H 1 8.087 0.01 . 1 . . . . . 21 TYR H . 50131 1 38 . 1 . 1 21 21 TYR N N 15 119.801 0.1 . 1 . . . . . 21 TYR N . 50131 1 39 . 1 . 1 22 22 GLY H H 1 8.099 0.01 . 1 . . . . . 22 GLY H . 50131 1 40 . 1 . 1 22 22 GLY N N 15 109.557 0.1 . 1 . . . . . 22 GLY N . 50131 1 41 . 1 . 1 23 23 GLN H H 1 8.079 0.01 . 1 . . . . . 23 GLN H . 50131 1 42 . 1 . 1 23 23 GLN N N 15 119.525 0.1 . 1 . . . . . 23 GLN N . 50131 1 43 . 1 . 1 24 24 TYR H H 1 8.176 0.01 . 1 . . . . . 24 TYR H . 50131 1 44 . 1 . 1 24 24 TYR N N 15 120.528 0.1 . 1 . . . . . 24 TYR N . 50131 1 45 . 1 . 1 25 25 ASN H H 1 8.299 0.01 . 1 . . . . . 25 ASN H . 50131 1 46 . 1 . 1 25 25 ASN N N 15 120.559 0.1 . 1 . . . . . 25 ASN N . 50131 1 47 . 1 . 1 26 26 GLN H H 1 8.185 0.01 . 1 . . . . . 26 GLN H . 50131 1 48 . 1 . 1 26 26 GLN N N 15 120.152 0.1 . 1 . . . . . 26 GLN N . 50131 1 49 . 1 . 1 27 27 TYR H H 1 8.017 0.01 . 1 . . . . . 27 TYR H . 50131 1 50 . 1 . 1 27 27 TYR N N 15 119.794 0.1 . 1 . . . . . 27 TYR N . 50131 1 51 . 1 . 1 28 28 TYR H H 1 7.822 0.01 . 1 . . . . . 28 TYR H . 50131 1 52 . 1 . 1 28 28 TYR N N 15 120.415 0.1 . 1 . . . . . 28 TYR N . 50131 1 53 . 1 . 1 29 29 ASN H H 1 8.115 0.01 . 1 . . . . . 29 ASN H . 50131 1 54 . 1 . 1 29 29 ASN N N 15 119.933 0.1 . 1 . . . . . 29 ASN N . 50131 1 55 . 1 . 1 30 30 GLN H H 1 8.137 0.01 . 1 . . . . . 30 GLN H . 50131 1 56 . 1 . 1 30 30 GLN N N 15 120.201 0.1 . 1 . . . . . 30 GLN N . 50131 1 57 . 1 . 1 31 31 GLN H H 1 8.295 0.01 . 1 . . . . . 31 GLN H . 50131 1 58 . 1 . 1 31 31 GLN N N 15 120.215 0.1 . 1 . . . . . 31 GLN N . 50131 1 59 . 1 . 1 32 32 GLY H H 1 8.232 0.01 . 1 . . . . . 32 GLY H . 50131 1 60 . 1 . 1 32 32 GLY N N 15 109.262 0.1 . 1 . . . . . 32 GLY N . 50131 1 61 . 1 . 1 33 33 TYR H H 1 7.984 0.01 . 1 . . . . . 33 TYR H . 50131 1 62 . 1 . 1 33 33 TYR N N 15 120.184 0.1 . 1 . . . . . 33 TYR N . 50131 1 63 . 1 . 1 34 34 GLN H H 1 8.289 0.01 . 1 . . . . . 34 GLN H . 50131 1 64 . 1 . 1 34 34 GLN N N 15 122.621 0.1 . 1 . . . . . 34 GLN N . 50131 1 65 . 1 . 1 35 35 GLY H H 1 7.727 0.01 . 1 . . . . . 35 GLY H . 50131 1 66 . 1 . 1 35 35 GLY N N 15 108.820 0.1 . 1 . . . . . 35 GLY N . 50131 1 67 . 1 . 1 36 36 TYR H H 1 8.002 0.01 . 1 . . . . . 36 TYR H . 50131 1 68 . 1 . 1 36 36 TYR N N 15 120.028 0.1 . 1 . . . . . 36 TYR N . 50131 1 69 . 1 . 1 37 37 ASN H H 1 8.353 0.01 . 1 . . . . . 37 ASN H . 50131 1 70 . 1 . 1 37 37 ASN N N 15 121.566 0.1 . 1 . . . . . 37 ASN N . 50131 1 71 . 1 . 1 38 38 GLY H H 1 7.735 0.01 . 1 . . . . . 38 GLY H . 50131 1 72 . 1 . 1 38 38 GLY N N 15 108.421 0.1 . 1 . . . . . 38 GLY N . 50131 1 73 . 1 . 1 39 39 GLN H H 1 8.129 0.01 . 1 . . . . . 39 GLN H . 50131 1 74 . 1 . 1 39 39 GLN N N 15 119.553 0.1 . 1 . . . . . 39 GLN N . 50131 1 75 . 1 . 1 40 40 GLN H H 1 8.392 0.01 . 1 . . . . . 40 GLN H . 50131 1 76 . 1 . 1 40 40 GLN N N 15 121.187 0.1 . 1 . . . . . 40 GLN N . 50131 1 77 . 1 . 1 41 41 GLY H H 1 8.316 0.01 . 1 . . . . . 41 GLY H . 50131 1 78 . 1 . 1 41 41 GLY N N 15 109.988 0.1 . 1 . . . . . 41 GLY N . 50131 1 79 . 1 . 1 42 42 ALA H H 1 8.013 0.01 . 1 . . . . . 42 ALA H . 50131 1 80 . 1 . 1 42 42 ALA N N 15 124.473 0.1 . 1 . . . . . 42 ALA N . 50131 1 81 . 1 . 1 44 44 GLN H H 1 8.402 0.01 . 1 . . . . . 44 GLN H . 50131 1 82 . 1 . 1 44 44 GLN N N 15 120.004 0.1 . 1 . . . . . 44 GLN N . 50131 1 83 . 1 . 1 45 45 GLY H H 1 8.333 0.01 . 1 . . . . . 45 GLY H . 50131 1 84 . 1 . 1 45 45 GLY N N 15 109.732 0.1 . 1 . . . . . 45 GLY N . 50131 1 85 . 1 . 1 46 46 TYR H H 1 8.005 0.01 . 1 . . . . . 46 TYR H . 50131 1 86 . 1 . 1 46 46 TYR N N 15 120.223 0.1 . 1 . . . . . 46 TYR N . 50131 1 87 . 1 . 1 47 47 GLN H H 1 8.147 0.01 . 1 . . . . . 47 GLN H . 50131 1 88 . 1 . 1 47 47 GLN N N 15 122.192 0.1 . 1 . . . . . 47 GLN N . 50131 1 89 . 1 . 1 48 48 ALA H H 1 8.045 0.01 . 1 . . . . . 48 ALA H . 50131 1 90 . 1 . 1 48 48 ALA N N 15 124.409 0.1 . 1 . . . . . 48 ALA N . 50131 1 91 . 1 . 1 49 49 TYR H H 1 7.924 0.01 . 1 . . . . . 49 TYR H . 50131 1 92 . 1 . 1 49 49 TYR N N 15 118.481 0.1 . 1 . . . . . 49 TYR N . 50131 1 93 . 1 . 1 50 50 GLN H H 1 8.002 0.01 . 1 . . . . . 50 GLN H . 50131 1 94 . 1 . 1 50 50 GLN N N 15 121.755 0.1 . 1 . . . . . 50 GLN N . 50131 1 95 . 1 . 1 51 51 ALA H H 1 8.022 0.01 . 1 . . . . . 51 ALA H . 50131 1 96 . 1 . 1 51 51 ALA N N 15 124.505 0.1 . 1 . . . . . 51 ALA N . 50131 1 97 . 1 . 1 52 52 TYR H H 1 7.997 0.01 . 1 . . . . . 52 TYR H . 50131 1 98 . 1 . 1 52 52 TYR N N 15 118.825 0.1 . 1 . . . . . 52 TYR N . 50131 1 99 . 1 . 1 53 53 GLY H H 1 8.189 0.01 . 1 . . . . . 53 GLY H . 50131 1 100 . 1 . 1 53 53 GLY N N 15 110.176 0.1 . 1 . . . . . 53 GLY N . 50131 1 101 . 1 . 1 54 54 GLN H H 1 8.062 0.01 . 1 . . . . . 54 GLN H . 50131 1 102 . 1 . 1 54 54 GLN N N 15 119.376 0.1 . 1 . . . . . 54 GLN N . 50131 1 103 . 1 . 1 55 55 GLN H H 1 8.360 0.01 . 1 . . . . . 55 GLN H . 50131 1 104 . 1 . 1 55 55 GLN N N 15 122.302 0.1 . 1 . . . . . 55 GLN N . 50131 1 105 . 1 . 1 57 57 GLN H H 1 8.453 0.01 . 1 . . . . . 57 GLN H . 50131 1 106 . 1 . 1 57 57 GLN N N 15 120.379 0.1 . 1 . . . . . 57 GLN N . 50131 1 107 . 1 . 1 58 58 GLY H H 1 8.323 0.01 . 1 . . . . . 58 GLY H . 50131 1 108 . 1 . 1 58 58 GLY N N 15 109.866 0.1 . 1 . . . . . 58 GLY N . 50131 1 109 . 1 . 1 59 59 ALA H H 1 8.035 0.01 . 1 . . . . . 59 ALA H . 50131 1 110 . 1 . 1 59 59 ALA N N 15 123.436 0.1 . 1 . . . . . 59 ALA N . 50131 1 111 . 1 . 1 60 60 TYR H H 1 8.069 0.01 . 1 . . . . . 60 TYR H . 50131 1 112 . 1 . 1 60 60 TYR N N 15 119.269 0.1 . 1 . . . . . 60 TYR N . 50131 1 113 . 1 . 1 61 61 GLN H H 1 8.230 0.01 . 1 . . . . . 61 GLN H . 50131 1 114 . 1 . 1 61 61 GLN N N 15 122.568 0.1 . 1 . . . . . 61 GLN N . 50131 1 115 . 1 . 1 62 62 GLY H H 1 7.784 0.01 . 1 . . . . . 62 GLY H . 50131 1 116 . 1 . 1 62 62 GLY N N 15 109.093 0.1 . 1 . . . . . 62 GLY N . 50131 1 117 . 1 . 1 63 63 TYR H H 1 7.956 0.01 . 1 . . . . . 63 TYR H . 50131 1 118 . 1 . 1 63 63 TYR N N 15 120.178 0.1 . 1 . . . . . 63 TYR N . 50131 1 119 . 1 . 1 64 64 ASN H H 1 8.217 0.01 . 1 . . . . . 64 ASN H . 50131 1 120 . 1 . 1 64 64 ASN N N 15 123.040 0.1 . 1 . . . . . 64 ASN N . 50131 1 121 . 1 . 1 66 66 GLN H H 1 8.133 0.01 . 1 . . . . . 66 GLN H . 50131 1 122 . 1 . 1 66 66 GLN N N 15 118.210 0.1 . 1 . . . . . 66 GLN N . 50131 1 123 . 1 . 1 67 67 GLN H H 1 7.959 0.01 . 1 . . . . . 67 GLN H . 50131 1 124 . 1 . 1 67 67 GLN N N 15 120.032 0.1 . 1 . . . . . 67 GLN N . 50131 1 125 . 1 . 1 68 68 ALA H H 1 8.129 0.01 . 1 . . . . . 68 ALA H . 50131 1 126 . 1 . 1 68 68 ALA N N 15 124.553 0.1 . 1 . . . . . 68 ALA N . 50131 1 127 . 1 . 1 69 69 GLN H H 1 8.234 0.01 . 1 . . . . . 69 GLN H . 50131 1 128 . 1 . 1 69 69 GLN N N 15 118.972 0.1 . 1 . . . . . 69 GLN N . 50131 1 129 . 1 . 1 70 70 GLY H H 1 8.281 0.01 . 1 . . . . . 70 GLY H . 50131 1 130 . 1 . 1 70 70 GLY N N 15 109.456 0.1 . 1 . . . . . 70 GLY N . 50131 1 131 . 1 . 1 71 71 TYR H H 1 7.968 0.01 . 1 . . . . . 71 TYR H . 50131 1 132 . 1 . 1 71 71 TYR N N 15 120.260 0.1 . 1 . . . . . 71 TYR N . 50131 1 133 . 1 . 1 72 72 GLN H H 1 8.038 0.01 . 1 . . . . . 72 GLN H . 50131 1 134 . 1 . 1 72 72 GLN N N 15 124.057 0.1 . 1 . . . . . 72 GLN N . 50131 1 135 . 1 . 1 74 74 TYR H H 1 7.945 0.01 . 1 . . . . . 74 TYR H . 50131 1 136 . 1 . 1 74 74 TYR N N 15 119.011 0.1 . 1 . . . . . 74 TYR N . 50131 1 137 . 1 . 1 75 75 GLN H H 1 8.187 0.01 . 1 . . . . . 75 GLN H . 50131 1 138 . 1 . 1 75 75 GLN N N 15 122.308 0.1 . 1 . . . . . 75 GLN N . 50131 1 139 . 1 . 1 76 76 GLY H H 1 7.812 0.01 . 1 . . . . . 76 GLY H . 50131 1 140 . 1 . 1 76 76 GLY N N 15 109.099 0.1 . 1 . . . . . 76 GLY N . 50131 1 141 . 1 . 1 77 77 TYR H H 1 7.946 0.01 . 1 . . . . . 77 TYR H . 50131 1 142 . 1 . 1 77 77 TYR N N 15 120.171 0.1 . 1 . . . . . 77 TYR N . 50131 1 143 . 1 . 1 78 78 ASN H H 1 8.248 0.01 . 1 . . . . . 78 ASN H . 50131 1 144 . 1 . 1 78 78 ASN N N 15 121.260 0.1 . 1 . . . . . 78 ASN N . 50131 1 145 . 1 . 1 79 79 ALA H H 1 8.115 0.01 . 1 . . . . . 79 ALA H . 50131 1 146 . 1 . 1 79 79 ALA N N 15 124.370 0.1 . 1 . . . . . 79 ALA N . 50131 1 147 . 1 . 1 80 80 GLN H H 1 8.180 0.01 . 1 . . . . . 80 GLN H . 50131 1 148 . 1 . 1 80 80 GLN N N 15 118.019 0.1 . 1 . . . . . 80 GLN N . 50131 1 149 . 1 . 1 81 81 GLN H H 1 8.123 0.01 . 1 . . . . . 81 GLN H . 50131 1 150 . 1 . 1 81 81 GLN N N 15 120.314 0.1 . 1 . . . . . 81 GLN N . 50131 1 151 . 1 . 1 82 82 GLN H H 1 8.297 0.01 . 1 . . . . . 82 GLN H . 50131 1 152 . 1 . 1 82 82 GLN N N 15 120.642 0.1 . 1 . . . . . 82 GLN N . 50131 1 153 . 1 . 1 83 83 GLY H H 1 8.306 0.01 . 1 . . . . . 83 GLY H . 50131 1 154 . 1 . 1 83 83 GLY N N 15 109.449 0.1 . 1 . . . . . 83 GLY N . 50131 1 155 . 1 . 1 84 84 TYR H H 1 8.019 0.01 . 1 . . . . . 84 TYR H . 50131 1 156 . 1 . 1 84 84 TYR N N 15 120.345 0.1 . 1 . . . . . 84 TYR N . 50131 1 157 . 1 . 1 85 85 ASN H H 1 8.252 0.01 . 1 . . . . . 85 ASN H . 50131 1 158 . 1 . 1 85 85 ASN N N 15 121.052 0.1 . 1 . . . . . 85 ASN N . 50131 1 159 . 1 . 1 86 86 ALA H H 1 8.106 0.01 . 1 . . . . . 86 ALA H . 50131 1 160 . 1 . 1 86 86 ALA N N 15 124.362 0.1 . 1 . . . . . 86 ALA N . 50131 1 161 . 1 . 1 87 87 GLN H H 1 8.203 0.01 . 1 . . . . . 87 GLN H . 50131 1 162 . 1 . 1 87 87 GLN N N 15 118.317 0.1 . 1 . . . . . 87 GLN N . 50131 1 163 . 1 . 1 88 88 GLN H H 1 8.203 0.01 . 1 . . . . . 88 GLN H . 50131 1 164 . 1 . 1 88 88 GLN N N 15 120.570 0.1 . 1 . . . . . 88 GLN N . 50131 1 165 . 1 . 1 89 89 GLY H H 1 8.334 0.01 . 1 . . . . . 89 GLY H . 50131 1 166 . 1 . 1 89 89 GLY N N 15 109.579 0.1 . 1 . . . . . 89 GLY N . 50131 1 167 . 1 . 1 90 90 GLY H H 1 8.193 0.01 . 1 . . . . . 90 GLY H . 50131 1 168 . 1 . 1 90 90 GLY N N 15 108.155 0.1 . 1 . . . . . 90 GLY N . 50131 1 169 . 1 . 1 91 91 HIS H H 1 8.358 0.01 . 1 . . . . . 91 HIS H . 50131 1 170 . 1 . 1 91 91 HIS N N 15 117.797 0.1 . 1 . . . . . 91 HIS N . 50131 1 171 . 1 . 1 92 92 ASN H H 1 8.462 0.01 . 1 . . . . . 92 ASN H . 50131 1 172 . 1 . 1 92 92 ASN N N 15 119.618 0.1 . 1 . . . . . 92 ASN N . 50131 1 173 . 1 . 1 93 93 ASN H H 1 8.430 0.01 . 1 . . . . . 93 ASN H . 50131 1 174 . 1 . 1 93 93 ASN N N 15 119.353 0.1 . 1 . . . . . 93 ASN N . 50131 1 175 . 1 . 1 94 94 ASN H H 1 8.334 0.01 . 1 . . . . . 94 ASN H . 50131 1 176 . 1 . 1 94 94 ASN N N 15 118.712 0.1 . 1 . . . . . 94 ASN N . 50131 1 177 . 1 . 1 95 95 TYR H H 1 8.044 0.01 . 1 . . . . . 95 TYR H . 50131 1 178 . 1 . 1 95 95 TYR N N 15 120.362 0.1 . 1 . . . . . 95 TYR N . 50131 1 179 . 1 . 1 96 96 ASN H H 1 8.197 0.01 . 1 . . . . . 96 ASN H . 50131 1 180 . 1 . 1 96 96 ASN N N 15 120.183 0.1 . 1 . . . . . 96 ASN N . 50131 1 181 . 1 . 1 97 97 LYS H H 1 8.107 0.01 . 1 . . . . . 97 LYS H . 50131 1 182 . 1 . 1 97 97 LYS N N 15 121.489 0.1 . 1 . . . . . 97 LYS N . 50131 1 183 . 1 . 1 98 98 ASN H H 1 8.249 0.01 . 1 . . . . . 98 ASN H . 50131 1 184 . 1 . 1 98 98 ASN N N 15 118.519 0.1 . 1 . . . . . 98 ASN N . 50131 1 185 . 1 . 1 99 99 TYR H H 1 7.994 0.01 . 1 . . . . . 99 TYR H . 50131 1 186 . 1 . 1 99 99 TYR N N 15 120.666 0.1 . 1 . . . . . 99 TYR N . 50131 1 187 . 1 . 1 100 100 ASN H H 1 8.247 0.01 . 1 . . . . . 100 ASN H . 50131 1 188 . 1 . 1 100 100 ASN N N 15 120.099 0.1 . 1 . . . . . 100 ASN N . 50131 1 189 . 1 . 1 101 101 ASN H H 1 8.202 0.01 . 1 . . . . . 101 ASN H . 50131 1 190 . 1 . 1 101 101 ASN N N 15 119.261 0.1 . 1 . . . . . 101 ASN N . 50131 1 191 . 1 . 1 102 102 LYS H H 1 8.233 0.01 . 1 . . . . . 102 LYS H . 50131 1 192 . 1 . 1 102 102 LYS N N 15 121.243 0.1 . 1 . . . . . 102 LYS N . 50131 1 193 . 1 . 1 103 103 ASN H H 1 8.312 0.01 . 1 . . . . . 103 ASN H . 50131 1 194 . 1 . 1 103 103 ASN N N 15 118.848 0.1 . 1 . . . . . 103 ASN N . 50131 1 195 . 1 . 1 104 104 SER H H 1 8.079 0.01 . 1 . . . . . 104 SER H . 50131 1 196 . 1 . 1 104 104 SER N N 15 115.705 0.1 . 1 . . . . . 104 SER N . 50131 1 197 . 1 . 1 105 105 TYR H H 1 8.100 0.01 . 1 . . . . . 105 TYR H . 50131 1 198 . 1 . 1 105 105 TYR N N 15 121.669 0.1 . 1 . . . . . 105 TYR N . 50131 1 199 . 1 . 1 106 106 ASN H H 1 8.190 0.01 . 1 . . . . . 106 ASN H . 50131 1 200 . 1 . 1 106 106 ASN N N 15 119.834 0.1 . 1 . . . . . 106 ASN N . 50131 1 201 . 1 . 1 107 107 ASN H H 1 8.156 0.01 . 1 . . . . . 107 ASN H . 50131 1 202 . 1 . 1 107 107 ASN N N 15 118.776 0.1 . 1 . . . . . 107 ASN N . 50131 1 203 . 1 . 1 108 108 TYR H H 1 8.035 0.01 . 1 . . . . . 108 TYR H . 50131 1 204 . 1 . 1 108 108 TYR N N 15 120.125 0.1 . 1 . . . . . 108 TYR N . 50131 1 205 . 1 . 1 109 109 ASN H H 1 8.197 0.01 . 1 . . . . . 109 ASN H . 50131 1 206 . 1 . 1 109 109 ASN N N 15 119.885 0.1 . 1 . . . . . 109 ASN N . 50131 1 207 . 1 . 1 110 110 LYS H H 1 8.097 0.01 . 1 . . . . . 110 LYS H . 50131 1 208 . 1 . 1 110 110 LYS N N 15 121.426 0.1 . 1 . . . . . 110 LYS N . 50131 1 209 . 1 . 1 111 111 GLN H H 1 8.284 0.01 . 1 . . . . . 111 GLN H . 50131 1 210 . 1 . 1 111 111 GLN N N 15 120.432 0.1 . 1 . . . . . 111 GLN N . 50131 1 211 . 1 . 1 112 112 GLY H H 1 8.287 0.01 . 1 . . . . . 112 GLY H . 50131 1 212 . 1 . 1 112 112 GLY N N 15 109.651 0.1 . 1 . . . . . 112 GLY N . 50131 1 213 . 1 . 1 113 113 TYR H H 1 8.031 0.01 . 1 . . . . . 113 TYR H . 50131 1 214 . 1 . 1 113 113 TYR N N 15 120.321 0.1 . 1 . . . . . 113 TYR N . 50131 1 215 . 1 . 1 114 114 GLN H H 1 8.324 0.01 . 1 . . . . . 114 GLN H . 50131 1 216 . 1 . 1 114 114 GLN N N 15 123.010 0.1 . 1 . . . . . 114 GLN N . 50131 1 217 . 1 . 1 115 115 GLY H H 1 7.735 0.01 . 1 . . . . . 115 GLY H . 50131 1 218 . 1 . 1 115 115 GLY N N 15 109.152 0.1 . 1 . . . . . 115 GLY N . 50131 1 219 . 1 . 1 116 116 ALA H H 1 8.132 0.01 . 1 . . . . . 116 ALA H . 50131 1 220 . 1 . 1 116 116 ALA N N 15 123.570 0.1 . 1 . . . . . 116 ALA N . 50131 1 221 . 1 . 1 117 117 GLN H H 1 8.344 0.01 . 1 . . . . . 117 GLN H . 50131 1 222 . 1 . 1 117 117 GLN N N 15 119.130 0.1 . 1 . . . . . 117 GLN N . 50131 1 223 . 1 . 1 118 118 GLY H H 1 8.269 0.01 . 1 . . . . . 118 GLY H . 50131 1 224 . 1 . 1 118 118 GLY N N 15 109.456 0.1 . 1 . . . . . 118 GLY N . 50131 1 225 . 1 . 1 119 119 TYR H H 1 8.018 0.01 . 1 . . . . . 119 TYR H . 50131 1 226 . 1 . 1 119 119 TYR N N 15 120.273 0.1 . 1 . . . . . 119 TYR N . 50131 1 227 . 1 . 1 120 120 ASN H H 1 8.262 0.01 . 1 . . . . . 120 ASN H . 50131 1 228 . 1 . 1 120 120 ASN N N 15 121.351 0.1 . 1 . . . . . 120 ASN N . 50131 1 229 . 1 . 1 121 121 ALA H H 1 8.079 0.01 . 1 . . . . . 121 ALA H . 50131 1 230 . 1 . 1 121 121 ALA N N 15 124.381 0.1 . 1 . . . . . 121 ALA N . 50131 1 231 . 1 . 1 122 122 GLN H H 1 8.181 0.01 . 1 . . . . . 122 GLN H . 50131 1 232 . 1 . 1 122 122 GLN N N 15 118.528 0.1 . 1 . . . . . 122 GLN N . 50131 1 233 . 1 . 1 123 123 GLN H H 1 8.203 0.01 . 1 . . . . . 123 GLN H . 50131 1 234 . 1 . 1 123 123 GLN N N 15 122.125 0.1 . 1 . . . . . 123 GLN N . 50131 1 235 . 1 . 1 125 125 THR H H 1 8.173 0.01 . 1 . . . . . 125 THR H . 50131 1 236 . 1 . 1 125 125 THR N N 15 113.874 0.1 . 1 . . . . . 125 THR N . 50131 1 237 . 1 . 1 126 126 GLY H H 1 8.317 0.01 . 1 . . . . . 126 GLY H . 50131 1 238 . 1 . 1 126 126 GLY N N 15 110.875 0.1 . 1 . . . . . 126 GLY N . 50131 1 239 . 1 . 1 127 127 TYR H H 1 7.978 0.01 . 1 . . . . . 127 TYR H . 50131 1 240 . 1 . 1 127 127 TYR N N 15 120.262 0.1 . 1 . . . . . 127 TYR N . 50131 1 241 . 1 . 1 128 128 ALA H H 1 8.026 0.01 . 1 . . . . . 128 ALA H . 50131 1 242 . 1 . 1 128 128 ALA N N 15 126.593 0.1 . 1 . . . . . 128 ALA N . 50131 1 243 . 1 . 1 129 129 ALA H H 1 8.093 0.01 . 1 . . . . . 129 ALA H . 50131 1 244 . 1 . 1 129 129 ALA N N 15 125.084 0.1 . 1 . . . . . 129 ALA N . 50131 1 245 . 1 . 1 131 131 ALA H H 1 8.339 0.01 . 1 . . . . . 131 ALA H . 50131 1 246 . 1 . 1 131 131 ALA N N 15 124.106 0.1 . 1 . . . . . 131 ALA N . 50131 1 247 . 1 . 1 132 132 GLN H H 1 8.344 0.01 . 1 . . . . . 132 GLN H . 50131 1 248 . 1 . 1 132 132 GLN N N 15 119.371 0.1 . 1 . . . . . 132 GLN N . 50131 1 249 . 1 . 1 133 133 SER H H 1 8.338 0.01 . 1 . . . . . 133 SER H . 50131 1 250 . 1 . 1 133 133 SER N N 15 116.800 0.1 . 1 . . . . . 133 SER N . 50131 1 251 . 1 . 1 134 134 SER H H 1 8.374 0.01 . 1 . . . . . 134 SER H . 50131 1 252 . 1 . 1 134 134 SER N N 15 117.655 0.1 . 1 . . . . . 134 SER N . 50131 1 253 . 1 . 1 135 135 SER H H 1 8.343 0.01 . 1 . . . . . 135 SER H . 50131 1 254 . 1 . 1 135 135 SER N N 15 117.588 0.1 . 1 . . . . . 135 SER N . 50131 1 255 . 1 . 1 136 136 GLN H H 1 8.322 0.01 . 1 . . . . . 136 GLN H . 50131 1 256 . 1 . 1 136 136 GLN N N 15 121.849 0.1 . 1 . . . . . 136 GLN N . 50131 1 257 . 1 . 1 137 137 GLY H H 1 8.368 0.01 . 1 . . . . . 137 GLY H . 50131 1 258 . 1 . 1 137 137 GLY N N 15 109.521 0.1 . 1 . . . . . 137 GLY N . 50131 1 259 . 1 . 1 138 138 MET H H 1 8.158 0.01 . 1 . . . . . 138 MET H . 50131 1 260 . 1 . 1 138 138 MET N N 15 119.903 0.1 . 1 . . . . . 138 MET N . 50131 1 261 . 1 . 1 139 139 THR H H 1 8.266 0.01 . 1 . . . . . 139 THR H . 50131 1 262 . 1 . 1 139 139 THR N N 15 115.599 0.1 . 1 . . . . . 139 THR N . 50131 1 263 . 1 . 1 140 140 LEU H H 1 8.247 0.01 . 1 . . . . . 140 LEU H . 50131 1 264 . 1 . 1 140 140 LEU N N 15 124.363 0.1 . 1 . . . . . 140 LEU N . 50131 1 265 . 1 . 1 141 141 LYS H H 1 8.173 0.01 . 1 . . . . . 141 LYS H . 50131 1 266 . 1 . 1 141 141 LYS N N 15 121.137 0.1 . 1 . . . . . 141 LYS N . 50131 1 267 . 1 . 1 142 142 ASP H H 1 8.131 0.01 . 1 . . . . . 142 ASP H . 50131 1 268 . 1 . 1 142 142 ASP N N 15 119.881 0.1 . 1 . . . . . 142 ASP N . 50131 1 269 . 1 . 1 143 143 PHE H H 1 8.093 0.01 . 1 . . . . . 143 PHE H . 50131 1 270 . 1 . 1 143 143 PHE N N 15 120.271 0.1 . 1 . . . . . 143 PHE N . 50131 1 271 . 1 . 1 144 144 GLN H H 1 8.245 0.01 . 1 . . . . . 144 GLN H . 50131 1 272 . 1 . 1 144 144 GLN N N 15 120.594 0.1 . 1 . . . . . 144 GLN N . 50131 1 273 . 1 . 1 145 145 ASN H H 1 8.257 0.01 . 1 . . . . . 145 ASN H . 50131 1 274 . 1 . 1 145 145 ASN N N 15 118.952 0.1 . 1 . . . . . 145 ASN N . 50131 1 275 . 1 . 1 146 146 GLN H H 1 8.326 0.01 . 1 . . . . . 146 GLN H . 50131 1 276 . 1 . 1 146 146 GLN N N 15 120.616 0.1 . 1 . . . . . 146 GLN N . 50131 1 277 . 1 . 1 147 147 GLN H H 1 8.373 0.01 . 1 . . . . . 147 GLN H . 50131 1 278 . 1 . 1 147 147 GLN N N 15 120.874 0.1 . 1 . . . . . 147 GLN N . 50131 1 279 . 1 . 1 148 148 GLY H H 1 8.368 0.01 . 1 . . . . . 148 GLY H . 50131 1 280 . 1 . 1 148 148 GLY N N 15 109.740 0.1 . 1 . . . . . 148 GLY N . 50131 1 281 . 1 . 1 149 149 SER H H 1 8.204 0.01 . 1 . . . . . 149 SER H . 50131 1 282 . 1 . 1 149 149 SER N N 15 115.491 0.1 . 1 . . . . . 149 SER N . 50131 1 283 . 1 . 1 150 150 THR H H 1 8.217 0.01 . 1 . . . . . 150 THR H . 50131 1 284 . 1 . 1 150 150 THR N N 15 115.580 0.1 . 1 . . . . . 150 THR N . 50131 1 285 . 1 . 1 151 151 ASN H H 1 8.386 0.01 . 1 . . . . . 151 ASN H . 50131 1 286 . 1 . 1 151 151 ASN N N 15 120.910 0.1 . 1 . . . . . 151 ASN N . 50131 1 287 . 1 . 1 152 152 ALA H H 1 8.128 0.01 . 1 . . . . . 152 ALA H . 50131 1 288 . 1 . 1 152 152 ALA N N 15 124.391 0.1 . 1 . . . . . 152 ALA N . 50131 1 289 . 1 . 1 153 153 ALA H H 1 8.122 0.01 . 1 . . . . . 153 ALA H . 50131 1 290 . 1 . 1 153 153 ALA N N 15 122.965 0.1 . 1 . . . . . 153 ALA N . 50131 1 291 . 1 . 1 154 154 LYS H H 1 8.122 0.01 . 1 . . . . . 154 LYS H . 50131 1 292 . 1 . 1 154 154 LYS N N 15 121.897 0.1 . 1 . . . . . 154 LYS N . 50131 1 293 . 1 . 1 156 156 LYS H H 1 8.396 0.01 . 1 . . . . . 156 LYS H . 50131 1 294 . 1 . 1 156 156 LYS N N 15 123.173 0.1 . 1 . . . . . 156 LYS N . 50131 1 295 . 1 . 1 158 158 LYS H H 1 8.373 0.01 . 1 . . . . . 158 LYS H . 50131 1 296 . 1 . 1 158 158 LYS N N 15 121.984 0.1 . 1 . . . . . 158 LYS N . 50131 1 297 . 1 . 1 159 159 LEU H H 1 8.154 0.01 . 1 . . . . . 159 LEU H . 50131 1 298 . 1 . 1 159 159 LEU N N 15 123.955 0.1 . 1 . . . . . 159 LEU N . 50131 1 299 . 1 . 1 160 160 LYS H H 1 8.338 0.01 . 1 . . . . . 160 LYS H . 50131 1 300 . 1 . 1 160 160 LYS N N 15 123.305 0.1 . 1 . . . . . 160 LYS N . 50131 1 301 . 1 . 1 161 161 LEU H H 1 8.214 0.01 . 1 . . . . . 161 LEU H . 50131 1 302 . 1 . 1 161 161 LEU N N 15 124.506 0.1 . 1 . . . . . 161 LEU N . 50131 1 303 . 1 . 1 162 162 ALA H H 1 8.356 0.01 . 1 . . . . . 162 ALA H . 50131 1 304 . 1 . 1 162 162 ALA N N 15 125.447 0.1 . 1 . . . . . 162 ALA N . 50131 1 305 . 1 . 1 163 163 SER H H 1 8.268 0.01 . 1 . . . . . 163 SER H . 50131 1 306 . 1 . 1 163 163 SER N N 15 115.047 0.1 . 1 . . . . . 163 SER N . 50131 1 307 . 1 . 1 164 164 SER H H 1 8.368 0.01 . 1 . . . . . 164 SER H . 50131 1 308 . 1 . 1 164 164 SER N N 15 117.774 0.1 . 1 . . . . . 164 SER N . 50131 1 309 . 1 . 1 165 165 SER H H 1 8.338 0.01 . 1 . . . . . 165 SER H . 50131 1 310 . 1 . 1 165 165 SER N N 15 117.638 0.1 . 1 . . . . . 165 SER N . 50131 1 311 . 1 . 1 166 166 GLY H H 1 8.369 0.01 . 1 . . . . . 166 GLY H . 50131 1 312 . 1 . 1 166 166 GLY N N 15 110.683 0.1 . 1 . . . . . 166 GLY N . 50131 1 313 . 1 . 1 167 167 ILE H H 1 7.901 0.01 . 1 . . . . . 167 ILE H . 50131 1 314 . 1 . 1 167 167 ILE N N 15 120.198 0.1 . 1 . . . . . 167 ILE N . 50131 1 315 . 1 . 1 168 168 LYS H H 1 8.345 0.01 . 1 . . . . . 168 LYS H . 50131 1 316 . 1 . 1 168 168 LYS N N 15 125.817 0.1 . 1 . . . . . 168 LYS N . 50131 1 317 . 1 . 1 169 169 LEU H H 1 8.246 0.01 . 1 . . . . . 169 LEU H . 50131 1 318 . 1 . 1 169 169 LEU N N 15 124.620 0.1 . 1 . . . . . 169 LEU N . 50131 1 319 . 1 . 1 170 170 VAL H H 1 8.121 0.01 . 1 . . . . . 170 VAL H . 50131 1 320 . 1 . 1 170 170 VAL N N 15 121.550 0.1 . 1 . . . . . 170 VAL N . 50131 1 321 . 1 . 1 171 171 GLY H H 1 8.421 0.01 . 1 . . . . . 171 GLY H . 50131 1 322 . 1 . 1 171 171 GLY N N 15 112.580 0.1 . 1 . . . . . 171 GLY N . 50131 1 323 . 1 . 1 172 172 ALA H H 1 8.096 0.01 . 1 . . . . . 172 ALA H . 50131 1 324 . 1 . 1 172 172 ALA N N 15 123.821 0.1 . 1 . . . . . 172 ALA N . 50131 1 325 . 1 . 1 173 173 LYS H H 1 8.266 0.01 . 1 . . . . . 173 LYS H . 50131 1 326 . 1 . 1 173 173 LYS N N 15 120.940 0.1 . 1 . . . . . 173 LYS N . 50131 1 327 . 1 . 1 174 174 LYS H H 1 8.284 0.01 . 1 . . . . . 174 LYS H . 50131 1 328 . 1 . 1 174 174 LYS N N 15 124.374 0.1 . 1 . . . . . 174 LYS N . 50131 1 329 . 1 . 1 176 176 VAL H H 1 8.169 0.01 . 1 . . . . . 176 VAL H . 50131 1 330 . 1 . 1 176 176 VAL N N 15 120.734 0.1 . 1 . . . . . 176 VAL N . 50131 1 331 . 1 . 1 177 177 ALA H H 1 8.334 0.01 . 1 . . . . . 177 ALA H . 50131 1 332 . 1 . 1 177 177 ALA N N 15 129.420 0.1 . 1 . . . . . 177 ALA N . 50131 1 333 . 1 . 1 179 179 LYS H H 1 8.398 0.01 . 1 . . . . . 179 LYS H . 50131 1 334 . 1 . 1 179 179 LYS N N 15 121.514 0.1 . 1 . . . . . 179 LYS N . 50131 1 335 . 1 . 1 180 180 THR H H 1 8.134 0.01 . 1 . . . . . 180 THR H . 50131 1 336 . 1 . 1 180 180 THR N N 15 115.361 0.1 . 1 . . . . . 180 THR N . 50131 1 337 . 1 . 1 181 181 GLU H H 1 8.393 0.01 . 1 . . . . . 181 GLU H . 50131 1 338 . 1 . 1 181 181 GLU N N 15 123.284 0.1 . 1 . . . . . 181 GLU N . 50131 1 339 . 1 . 1 182 182 LYS H H 1 8.415 0.01 . 1 . . . . . 182 LYS H . 50131 1 340 . 1 . 1 182 182 LYS N N 15 122.743 0.1 . 1 . . . . . 182 LYS N . 50131 1 341 . 1 . 1 183 183 THR H H 1 8.192 0.01 . 1 . . . . . 183 THR H . 50131 1 342 . 1 . 1 183 183 THR N N 15 115.540 0.1 . 1 . . . . . 183 THR N . 50131 1 343 . 1 . 1 184 184 ASP H H 1 8.416 0.01 . 1 . . . . . 184 ASP H . 50131 1 344 . 1 . 1 184 184 ASP N N 15 122.298 0.1 . 1 . . . . . 184 ASP N . 50131 1 345 . 1 . 1 185 185 GLU H H 1 8.408 0.01 . 1 . . . . . 185 GLU H . 50131 1 346 . 1 . 1 185 185 GLU N N 15 121.812 0.1 . 1 . . . . . 185 GLU N . 50131 1 347 . 1 . 1 186 186 SER H H 1 8.361 0.01 . 1 . . . . . 186 SER H . 50131 1 348 . 1 . 1 186 186 SER N N 15 116.651 0.1 . 1 . . . . . 186 SER N . 50131 1 349 . 1 . 1 187 187 LYS H H 1 8.203 0.01 . 1 . . . . . 187 LYS H . 50131 1 350 . 1 . 1 187 187 LYS N N 15 122.722 0.1 . 1 . . . . . 187 LYS N . 50131 1 351 . 1 . 1 188 188 GLU H H 1 8.193 0.01 . 1 . . . . . 188 GLU H . 50131 1 352 . 1 . 1 188 188 GLU N N 15 120.710 0.1 . 1 . . . . . 188 GLU N . 50131 1 353 . 1 . 1 189 189 ALA H H 1 8.258 0.01 . 1 . . . . . 189 ALA H . 50131 1 354 . 1 . 1 189 189 ALA N N 15 124.935 0.1 . 1 . . . . . 189 ALA N . 50131 1 355 . 1 . 1 190 190 THR H H 1 8.047 0.01 . 1 . . . . . 190 THR H . 50131 1 356 . 1 . 1 190 190 THR N N 15 113.444 0.1 . 1 . . . . . 190 THR N . 50131 1 357 . 1 . 1 191 191 LYS H H 1 8.301 0.01 . 1 . . . . . 191 LYS H . 50131 1 358 . 1 . 1 191 191 LYS N N 15 123.906 0.1 . 1 . . . . . 191 LYS N . 50131 1 359 . 1 . 1 192 192 THR H H 1 8.275 0.01 . 1 . . . . . 192 THR H . 50131 1 360 . 1 . 1 192 192 THR N N 15 115.636 0.1 . 1 . . . . . 192 THR N . 50131 1 361 . 1 . 1 193 193 THR H H 1 8.133 0.01 . 1 . . . . . 193 THR H . 50131 1 362 . 1 . 1 193 193 THR N N 15 115.480 0.1 . 1 . . . . . 193 THR N . 50131 1 363 . 1 . 1 194 194 ASP H H 1 8.374 0.01 . 1 . . . . . 194 ASP H . 50131 1 364 . 1 . 1 194 194 ASP N N 15 121.899 0.1 . 1 . . . . . 194 ASP N . 50131 1 365 . 1 . 1 195 195 ASP H H 1 8.355 0.01 . 1 . . . . . 195 ASP H . 50131 1 366 . 1 . 1 195 195 ASP N N 15 120.299 0.1 . 1 . . . . . 195 ASP N . 50131 1 367 . 1 . 1 196 196 ASN H H 1 8.388 0.01 . 1 . . . . . 196 ASN H . 50131 1 368 . 1 . 1 196 196 ASN N N 15 119.020 0.1 . 1 . . . . . 196 ASN N . 50131 1 369 . 1 . 1 197 197 GLU H H 1 8.290 0.01 . 1 . . . . . 197 GLU H . 50131 1 370 . 1 . 1 197 197 GLU N N 15 120.311 0.1 . 1 . . . . . 197 GLU N . 50131 1 371 . 1 . 1 198 198 GLU H H 1 8.287 0.01 . 1 . . . . . 198 GLU H . 50131 1 372 . 1 . 1 198 198 GLU N N 15 120.633 0.1 . 1 . . . . . 198 GLU N . 50131 1 373 . 1 . 1 199 199 ALA H H 1 8.195 0.01 . 1 . . . . . 199 ALA H . 50131 1 374 . 1 . 1 199 199 ALA N N 15 124.398 0.1 . 1 . . . . . 199 ALA N . 50131 1 375 . 1 . 1 200 200 GLN H H 1 8.260 0.01 . 1 . . . . . 200 GLN H . 50131 1 376 . 1 . 1 200 200 GLN N N 15 118.864 0.1 . 1 . . . . . 200 GLN N . 50131 1 377 . 1 . 1 201 201 SER H H 1 8.203 0.01 . 1 . . . . . 201 SER H . 50131 1 378 . 1 . 1 201 201 SER N N 15 116.163 0.1 . 1 . . . . . 201 SER N . 50131 1 379 . 1 . 1 202 202 GLU H H 1 8.241 0.01 . 1 . . . . . 202 GLU H . 50131 1 380 . 1 . 1 202 202 GLU N N 15 121.767 0.1 . 1 . . . . . 202 GLU N . 50131 1 381 . 1 . 1 203 203 LEU H H 1 8.090 0.01 . 1 . . . . . 203 LEU H . 50131 1 382 . 1 . 1 203 203 LEU N N 15 124.204 0.1 . 1 . . . . . 203 LEU N . 50131 1 383 . 1 . 1 205 205 LYS H H 1 8.340 0.01 . 1 . . . . . 205 LYS H . 50131 1 384 . 1 . 1 205 205 LYS N N 15 121.804 0.1 . 1 . . . . . 205 LYS N . 50131 1 385 . 1 . 1 206 206 ILE H H 1 8.136 0.01 . 1 . . . . . 206 ILE H . 50131 1 386 . 1 . 1 206 206 ILE N N 15 121.852 0.1 . 1 . . . . . 206 ILE N . 50131 1 387 . 1 . 1 207 207 ASP H H 1 8.403 0.01 . 1 . . . . . 207 ASP H . 50131 1 388 . 1 . 1 207 207 ASP N N 15 123.282 0.1 . 1 . . . . . 207 ASP N . 50131 1 389 . 1 . 1 208 208 ASP H H 1 8.242 0.01 . 1 . . . . . 208 ASP H . 50131 1 390 . 1 . 1 208 208 ASP N N 15 120.526 0.1 . 1 . . . . . 208 ASP N . 50131 1 391 . 1 . 1 209 209 LEU H H 1 8.120 0.01 . 1 . . . . . 209 LEU H . 50131 1 392 . 1 . 1 209 209 LEU N N 15 122.241 0.1 . 1 . . . . . 209 LEU N . 50131 1 393 . 1 . 1 210 210 LYS H H 1 8.167 0.01 . 1 . . . . . 210 LYS H . 50131 1 394 . 1 . 1 210 210 LYS N N 15 121.208 0.1 . 1 . . . . . 210 LYS N . 50131 1 395 . 1 . 1 211 211 ILE H H 1 7.950 0.01 . 1 . . . . . 211 ILE H . 50131 1 396 . 1 . 1 211 211 ILE N N 15 121.028 0.1 . 1 . . . . . 211 ILE N . 50131 1 397 . 1 . 1 212 212 SER H H 1 8.273 0.01 . 1 . . . . . 212 SER H . 50131 1 398 . 1 . 1 212 212 SER N N 15 118.944 0.1 . 1 . . . . . 212 SER N . 50131 1 399 . 1 . 1 213 213 GLU H H 1 8.331 0.01 . 1 . . . . . 213 GLU H . 50131 1 400 . 1 . 1 213 213 GLU N N 15 122.444 0.1 . 1 . . . . . 213 GLU N . 50131 1 401 . 1 . 1 214 214 ALA H H 1 8.119 0.01 . 1 . . . . . 214 ALA H . 50131 1 402 . 1 . 1 214 214 ALA N N 15 123.768 0.1 . 1 . . . . . 214 ALA N . 50131 1 403 . 1 . 1 215 215 GLU H H 1 8.102 0.01 . 1 . . . . . 215 GLU H . 50131 1 404 . 1 . 1 215 215 GLU N N 15 118.882 0.1 . 1 . . . . . 215 GLU N . 50131 1 405 . 1 . 1 216 216 LYS H H 1 8.146 0.01 . 1 . . . . . 216 LYS H . 50131 1 406 . 1 . 1 216 216 LYS N N 15 123.613 0.1 . 1 . . . . . 216 LYS N . 50131 1 407 . 1 . 1 218 218 LYS H H 1 8.483 0.01 . 1 . . . . . 218 LYS H . 50131 1 408 . 1 . 1 218 218 LYS N N 15 122.012 0.1 . 1 . . . . . 218 LYS N . 50131 1 409 . 1 . 1 219 219 THR H H 1 8.095 0.01 . 1 . . . . . 219 THR H . 50131 1 410 . 1 . 1 219 219 THR N N 15 115.237 0.1 . 1 . . . . . 219 THR N . 50131 1 411 . 1 . 1 220 220 LYS H H 1 8.364 0.01 . 1 . . . . . 220 LYS H . 50131 1 412 . 1 . 1 220 220 LYS N N 15 123.510 0.1 . 1 . . . . . 220 LYS N . 50131 1 413 . 1 . 1 221 221 GLU H H 1 8.403 0.01 . 1 . . . . . 221 GLU H . 50131 1 414 . 1 . 1 221 221 GLU N N 15 121.733 0.1 . 1 . . . . . 221 GLU N . 50131 1 415 . 1 . 1 222 222 ASN H H 1 8.523 0.01 . 1 . . . . . 222 ASN H . 50131 1 416 . 1 . 1 222 222 ASN N N 15 120.107 0.1 . 1 . . . . . 222 ASN N . 50131 1 417 . 1 . 1 223 223 THR H H 1 8.072 0.01 . 1 . . . . . 223 THR H . 50131 1 418 . 1 . 1 223 223 THR N N 15 116.679 0.1 . 1 . . . . . 223 THR N . 50131 1 419 . 1 . 1 225 225 SER H H 1 8.384 0.01 . 1 . . . . . 225 SER H . 50131 1 420 . 1 . 1 225 225 SER N N 15 116.284 0.1 . 1 . . . . . 225 SER N . 50131 1 421 . 1 . 1 226 226 ALA H H 1 8.360 0.01 . 1 . . . . . 226 ALA H . 50131 1 422 . 1 . 1 226 226 ALA N N 15 125.980 0.1 . 1 . . . . . 226 ALA N . 50131 1 423 . 1 . 1 227 227 ASP H H 1 8.268 0.01 . 1 . . . . . 227 ASP H . 50131 1 424 . 1 . 1 227 227 ASP N N 15 118.378 0.1 . 1 . . . . . 227 ASP N . 50131 1 425 . 1 . 1 228 228 ASP H H 1 8.283 0.01 . 1 . . . . . 228 ASP H . 50131 1 426 . 1 . 1 228 228 ASP N N 15 120.579 0.1 . 1 . . . . . 228 ASP N . 50131 1 427 . 1 . 1 229 229 THR H H 1 8.197 0.01 . 1 . . . . . 229 THR H . 50131 1 428 . 1 . 1 229 229 THR N N 15 114.181 0.1 . 1 . . . . . 229 THR N . 50131 1 429 . 1 . 1 230 230 SER H H 1 8.333 0.01 . 1 . . . . . 230 SER H . 50131 1 430 . 1 . 1 230 230 SER N N 15 117.891 0.1 . 1 . . . . . 230 SER N . 50131 1 431 . 1 . 1 231 231 SER H H 1 8.269 0.01 . 1 . . . . . 231 SER H . 50131 1 432 . 1 . 1 231 231 SER N N 15 117.509 0.1 . 1 . . . . . 231 SER N . 50131 1 433 . 1 . 1 232 232 GLU H H 1 8.247 0.01 . 1 . . . . . 232 GLU H . 50131 1 434 . 1 . 1 232 232 GLU N N 15 121.891 0.1 . 1 . . . . . 232 GLU N . 50131 1 435 . 1 . 1 233 233 LYS H H 1 8.254 0.01 . 1 . . . . . 233 LYS H . 50131 1 436 . 1 . 1 233 233 LYS N N 15 121.829 0.1 . 1 . . . . . 233 LYS N . 50131 1 437 . 1 . 1 234 234 THR H H 1 8.136 0.01 . 1 . . . . . 234 THR H . 50131 1 438 . 1 . 1 234 234 THR N N 15 114.908 0.1 . 1 . . . . . 234 THR N . 50131 1 439 . 1 . 1 235 235 THR H H 1 8.180 0.01 . 1 . . . . . 235 THR H . 50131 1 440 . 1 . 1 235 235 THR N N 15 116.046 0.1 . 1 . . . . . 235 THR N . 50131 1 441 . 1 . 1 236 236 SER H H 1 8.280 0.01 . 1 . . . . . 236 SER H . 50131 1 442 . 1 . 1 236 236 SER N N 15 118.109 0.1 . 1 . . . . . 236 SER N . 50131 1 443 . 1 . 1 237 237 ALA H H 1 8.280 0.01 . 1 . . . . . 237 ALA H . 50131 1 444 . 1 . 1 237 237 ALA N N 15 126.141 0.1 . 1 . . . . . 237 ALA N . 50131 1 445 . 1 . 1 238 238 LYS H H 1 8.188 0.01 . 1 . . . . . 238 LYS H . 50131 1 446 . 1 . 1 238 238 LYS N N 15 120.561 0.1 . 1 . . . . . 238 LYS N . 50131 1 447 . 1 . 1 239 239 ALA H H 1 8.260 0.01 . 1 . . . . . 239 ALA H . 50131 1 448 . 1 . 1 239 239 ALA N N 15 125.248 0.1 . 1 . . . . . 239 ALA N . 50131 1 449 . 1 . 1 240 240 ASP H H 1 8.376 0.01 . 1 . . . . . 240 ASP H . 50131 1 450 . 1 . 1 240 240 ASP N N 15 119.509 0.1 . 1 . . . . . 240 ASP N . 50131 1 451 . 1 . 1 241 241 THR H H 1 8.111 0.01 . 1 . . . . . 241 THR H . 50131 1 452 . 1 . 1 241 241 THR N N 15 113.992 0.1 . 1 . . . . . 241 THR N . 50131 1 453 . 1 . 1 242 242 SER H H 1 8.415 0.01 . 1 . . . . . 242 SER H . 50131 1 454 . 1 . 1 242 242 SER N N 15 118.218 0.1 . 1 . . . . . 242 SER N . 50131 1 455 . 1 . 1 243 243 THR H H 1 8.169 0.01 . 1 . . . . . 243 THR H . 50131 1 456 . 1 . 1 243 243 THR N N 15 115.034 0.1 . 1 . . . . . 243 THR N . 50131 1 457 . 1 . 1 244 244 GLY H H 1 8.366 0.01 . 1 . . . . . 244 GLY H . 50131 1 458 . 1 . 1 244 244 GLY N N 15 111.008 0.1 . 1 . . . . . 244 GLY N . 50131 1 459 . 1 . 1 245 245 GLY H H 1 8.255 0.01 . 1 . . . . . 245 GLY H . 50131 1 460 . 1 . 1 245 245 GLY N N 15 108.824 0.1 . 1 . . . . . 245 GLY N . 50131 1 461 . 1 . 1 246 246 ALA H H 1 8.254 0.01 . 1 . . . . . 246 ALA H . 50131 1 462 . 1 . 1 246 246 ALA N N 15 123.868 0.1 . 1 . . . . . 246 ALA N . 50131 1 463 . 1 . 1 247 247 ASN H H 1 8.414 0.01 . 1 . . . . . 247 ASN H . 50131 1 464 . 1 . 1 247 247 ASN N N 15 117.413 0.1 . 1 . . . . . 247 ASN N . 50131 1 465 . 1 . 1 248 248 SER H H 1 8.155 0.01 . 1 . . . . . 248 SER H . 50131 1 466 . 1 . 1 248 248 SER N N 15 116.038 0.1 . 1 . . . . . 248 SER N . 50131 1 467 . 1 . 1 249 249 VAL H H 1 8.143 0.01 . 1 . . . . . 249 VAL H . 50131 1 468 . 1 . 1 249 249 VAL N N 15 121.382 0.1 . 1 . . . . . 249 VAL N . 50131 1 469 . 1 . 1 250 250 ASP H H 1 8.281 0.01 . 1 . . . . . 250 ASP H . 50131 1 470 . 1 . 1 250 250 ASP N N 15 122.012 0.1 . 1 . . . . . 250 ASP N . 50131 1 471 . 1 . 1 251 251 ALA H H 1 8.078 0.01 . 1 . . . . . 251 ALA H . 50131 1 472 . 1 . 1 251 251 ALA N N 15 123.672 0.1 . 1 . . . . . 251 ALA N . 50131 1 473 . 1 . 1 252 252 LEU H H 1 7.998 0.01 . 1 . . . . . 252 LEU H . 50131 1 474 . 1 . 1 252 252 LEU N N 15 119.865 0.1 . 1 . . . . . 252 LEU N . 50131 1 475 . 1 . 1 253 253 ILE H H 1 7.865 0.01 . 1 . . . . . 253 ILE H . 50131 1 476 . 1 . 1 253 253 ILE N N 15 120.638 0.1 . 1 . . . . . 253 ILE N . 50131 1 477 . 1 . 1 254 254 LYS H H 1 8.114 0.01 . 1 . . . . . 254 LYS H . 50131 1 478 . 1 . 1 254 254 LYS N N 15 123.541 0.1 . 1 . . . . . 254 LYS N . 50131 1 479 . 1 . 1 255 255 GLU H H 1 8.190 0.01 . 1 . . . . . 255 GLU H . 50131 1 480 . 1 . 1 255 255 GLU N N 15 120.396 0.1 . 1 . . . . . 255 GLU N . 50131 1 481 . 1 . 1 256 256 GLN H H 1 8.236 0.01 . 1 . . . . . 256 GLN H . 50131 1 482 . 1 . 1 256 256 GLN N N 15 120.225 0.1 . 1 . . . . . 256 GLN N . 50131 1 483 . 1 . 1 257 257 GLU H H 1 8.312 0.01 . 1 . . . . . 257 GLU H . 50131 1 484 . 1 . 1 257 257 GLU N N 15 120.679 0.1 . 1 . . . . . 257 GLU N . 50131 1 485 . 1 . 1 258 258 ASP H H 1 8.345 0.01 . 1 . . . . . 258 ASP H . 50131 1 486 . 1 . 1 258 258 ASP N N 15 119.808 0.1 . 1 . . . . . 258 ASP N . 50131 1 487 . 1 . 1 259 259 GLU H H 1 8.163 0.01 . 1 . . . . . 259 GLU H . 50131 1 488 . 1 . 1 259 259 GLU N N 15 120.349 0.1 . 1 . . . . . 259 GLU N . 50131 1 489 . 1 . 1 260 260 VAL H H 1 8.008 0.01 . 1 . . . . . 260 VAL H . 50131 1 490 . 1 . 1 260 260 VAL N N 15 119.861 0.1 . 1 . . . . . 260 VAL N . 50131 1 491 . 1 . 1 261 261 ASP H H 1 8.284 0.01 . 1 . . . . . 261 ASP H . 50131 1 492 . 1 . 1 261 261 ASP N N 15 121.932 0.1 . 1 . . . . . 261 ASP N . 50131 1 493 . 1 . 1 262 262 GLU H H 1 8.271 0.01 . 1 . . . . . 262 GLU H . 50131 1 494 . 1 . 1 262 262 GLU N N 15 120.566 0.1 . 1 . . . . . 262 GLU N . 50131 1 495 . 1 . 1 263 263 GLU H H 1 8.251 0.01 . 1 . . . . . 263 GLU H . 50131 1 496 . 1 . 1 263 263 GLU N N 15 119.727 0.1 . 1 . . . . . 263 GLU N . 50131 1 497 . 1 . 1 264 264 VAL H H 1 7.897 0.01 . 1 . . . . . 264 VAL H . 50131 1 498 . 1 . 1 264 264 VAL N N 15 119.358 0.1 . 1 . . . . . 264 VAL N . 50131 1 499 . 1 . 1 265 265 VAL H H 1 7.854 0.01 . 1 . . . . . 265 VAL H . 50131 1 500 . 1 . 1 265 265 VAL N N 15 121.317 0.1 . 1 . . . . . 265 VAL N . 50131 1 501 . 1 . 1 266 266 LYS H H 1 8.139 0.01 . 1 . . . . . 266 LYS H . 50131 1 502 . 1 . 1 266 266 LYS N N 15 122.781 0.1 . 1 . . . . . 266 LYS N . 50131 1 503 . 1 . 1 267 267 ASP H H 1 8.022 0.01 . 1 . . . . . 267 ASP H . 50131 1 504 . 1 . 1 267 267 ASP N N 15 119.116 0.1 . 1 . . . . . 267 ASP N . 50131 1 505 . 1 . 1 268 268 HIS H H 1 8.455 0.01 . 1 . . . . . 268 HIS H . 50131 1 506 . 1 . 1 268 268 HIS N N 15 118.396 0.1 . 1 . . . . . 268 HIS N . 50131 1 507 . 1 . 1 269 269 HIS H H 1 8.483 0.01 . 1 . . . . . 269 HIS H . 50131 1 508 . 1 . 1 269 269 HIS N N 15 117.212 0.1 . 1 . . . . . 269 HIS N . 50131 1 509 . 1 . 1 270 270 HIS H H 1 8.432 0.01 . 1 . . . . . 270 HIS H . 50131 1 510 . 1 . 1 270 270 HIS N N 15 118.363 0.1 . 1 . . . . . 270 HIS N . 50131 1 511 . 1 . 1 271 271 HIS H H 1 8.642 0.01 . 1 . . . . . 271 HIS H . 50131 1 512 . 1 . 1 271 271 HIS N N 15 119.743 0.1 . 1 . . . . . 271 HIS N . 50131 1 513 . 1 . 1 272 272 HIS H H 1 8.733 0.01 . 1 . . . . . 272 HIS H . 50131 1 514 . 1 . 1 272 272 HIS N N 15 120.392 0.1 . 1 . . . . . 272 HIS N . 50131 1 515 . 1 . 1 273 273 HIS H H 1 8.581 0.01 . 1 . . . . . 273 HIS H . 50131 1 516 . 1 . 1 273 273 HIS N N 15 120.603 0.1 . 1 . . . . . 273 HIS N . 50131 1 517 . 1 . 1 274 274 HIS H H 1 8.384 0.01 . 1 . . . . . 274 HIS H . 50131 1 518 . 1 . 1 274 274 HIS N N 15 125.574 0.1 . 1 . . . . . 274 HIS N . 50131 1 stop_ save_