################################### # 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_R119K_Ap5A _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_R119K_Ap5A _Assigned_chem_shift_list.Entry_ID 27010 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err . _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err . _Assigned_chem_shift_list.Chem_shift_31P_err . _Assigned_chem_shift_list.Chem_shift_2H_err . _Assigned_chem_shift_list.Chem_shift_19F_err . _Assigned_chem_shift_list.Error_derivation_method . _Assigned_chem_shift_list.Details . _Assigned_chem_shift_list.Text_data_format . _Assigned_chem_shift_list.Text_data . loop_ _Chem_shift_experiment.Experiment_ID _Chem_shift_experiment.Experiment_name _Chem_shift_experiment.Sample_ID _Chem_shift_experiment.Sample_label _Chem_shift_experiment.Sample_state _Chem_shift_experiment.Entry_ID _Chem_shift_experiment.Assigned_chem_shift_list_ID 1 '2D 1H-15N HSQC' . . . 27010 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 2 $NMRPipe . . 27010 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 1 2 2 ARG H H 1 9.63 0.01 . 1 . . . . . 2 ARG H . 27010 1 2 . 1 1 2 2 ARG N N 15 126.457 0.02 . 1 . . . . . 2 ARG N . 27010 1 3 . 1 1 4 4 ILE H H 1 8.658 0.01 . 1 . . . . . 4 ILE H . 27010 1 4 . 1 1 4 4 ILE N N 15 126.297 0.02 . 1 . . . . . 4 ILE N . 27010 1 5 . 1 1 5 5 LEU H H 1 8.451 0.01 . 1 . . . . . 5 LEU H . 27010 1 6 . 1 1 5 5 LEU N N 15 128.146 0.02 . 1 . . . . . 5 LEU N . 27010 1 7 . 1 1 6 6 LEU H H 1 9.259 0.01 . 1 . . . . . 6 LEU H . 27010 1 8 . 1 1 6 6 LEU N N 15 127.686 0.02 . 1 . . . . . 6 LEU N . 27010 1 9 . 1 1 7 7 GLY H H 1 8.304 0.01 . 1 . . . . . 7 GLY H . 27010 1 10 . 1 1 7 7 GLY N N 15 108.409 0.02 . 1 . . . . . 7 GLY N . 27010 1 11 . 1 1 8 8 ALA H H 1 8.993 0.01 . 1 . . . . . 8 ALA H . 27010 1 12 . 1 1 8 8 ALA N N 15 125.883 0.02 . 1 . . . . . 8 ALA N . 27010 1 13 . 1 1 10 10 GLY H H 1 8.605 0.01 . 1 . . . . . 10 GLY H . 27010 1 14 . 1 1 10 10 GLY N N 15 111.03 0.02 . 1 . . . . . 10 GLY N . 27010 1 15 . 1 1 16 16 GLN H H 1 7.099 0.01 . 1 . . . . . 16 GLN H . 27010 1 16 . 1 1 16 16 GLN N N 15 117.854 0.02 . 1 . . . . . 16 GLN N . 27010 1 17 . 1 1 18 18 GLN H H 1 7.68 0.01 . 1 . . . . . 18 GLN H . 27010 1 18 . 1 1 18 18 GLN N N 15 114.987 0.02 . 1 . . . . . 18 GLN N . 27010 1 19 . 1 1 19 19 PHE H H 1 7.106 0.01 . 1 . . . . . 19 PHE H . 27010 1 20 . 1 1 19 19 PHE N N 15 118.972 0.02 . 1 . . . . . 19 PHE N . 27010 1 21 . 1 1 22 22 GLU H H 1 7.778 0.01 . 1 . . . . . 22 GLU H . 27010 1 22 . 1 1 22 22 GLU N N 15 118.151 0.02 . 1 . . . . . 22 GLU N . 27010 1 23 . 1 1 24 24 TYR H H 1 7.687 0.01 . 1 . . . . . 24 TYR H . 27010 1 24 . 1 1 24 24 TYR N N 15 112.518 0.02 . 1 . . . . . 24 TYR N . 27010 1 25 . 1 1 25 25 GLY H H 1 7.667 0.01 . 1 . . . . . 25 GLY H . 27010 1 26 . 1 1 25 25 GLY N N 15 110.895 0.02 . 1 . . . . . 25 GLY N . 27010 1 27 . 1 1 29 29 ILE H H 1 9.579 0.01 . 1 . . . . . 29 ILE H . 27010 1 28 . 1 1 29 29 ILE N N 15 130.577 0.02 . 1 . . . . . 29 ILE N . 27010 1 29 . 1 1 31 31 THR H H 1 9.231 0.01 . 1 . . . . . 31 THR H . 27010 1 30 . 1 1 31 31 THR N N 15 117.587 0.02 . 1 . . . . . 31 THR N . 27010 1 31 . 1 1 32 32 GLY H H 1 9.107 0.01 . 1 . . . . . 32 GLY H . 27010 1 32 . 1 1 32 32 GLY N N 15 110.785 0.02 . 1 . . . . . 32 GLY N . 27010 1 33 . 1 1 33 33 ASP H H 1 7.808 0.01 . 1 . . . . . 33 ASP H . 27010 1 34 . 1 1 33 33 ASP N N 15 121.865 0.02 . 1 . . . . . 33 ASP N . 27010 1 35 . 1 1 35 35 LEU H H 1 8.555 0.01 . 1 . . . . . 35 LEU H . 27010 1 36 . 1 1 35 35 LEU N N 15 122.041 0.02 . 1 . . . . . 35 LEU N . 27010 1 37 . 1 1 37 37 ALA H H 1 8.045 0.01 . 1 . . . . . 37 ALA H . 27010 1 38 . 1 1 37 37 ALA N N 15 121.528 0.02 . 1 . . . . . 37 ALA N . 27010 1 39 . 1 1 40 40 LYS H H 1 7.81 0.01 . 1 . . . . . 40 LYS H . 27010 1 40 . 1 1 40 40 LYS N N 15 120.036 0.02 . 1 . . . . . 40 LYS N . 27010 1 41 . 1 1 41 41 SER H H 1 7.894 0.01 . 1 . . . . . 41 SER H . 27010 1 42 . 1 1 41 41 SER N N 15 112.987 0.02 . 1 . . . . . 41 SER N . 27010 1 43 . 1 1 42 42 GLY H H 1 7.714 0.01 . 1 . . . . . 42 GLY H . 27010 1 44 . 1 1 42 42 GLY N N 15 109.744 0.02 . 1 . . . . . 42 GLY N . 27010 1 45 . 1 1 43 43 SER H H 1 7.658 0.01 . 1 . . . . . 43 SER H . 27010 1 46 . 1 1 43 43 SER N N 15 114.74 0.02 . 1 . . . . . 43 SER N . 27010 1 47 . 1 1 44 44 GLU H H 1 8.894 0.01 . 1 . . . . . 44 GLU H . 27010 1 48 . 1 1 44 44 GLU N N 15 121.992 0.02 . 1 . . . . . 44 GLU N . 27010 1 49 . 1 1 46 46 GLY H H 1 7.9 0.01 . 1 . . . . . 46 GLY H . 27010 1 50 . 1 1 46 46 GLY N N 15 107.412 0.02 . 1 . . . . . 46 GLY N . 27010 1 51 . 1 1 47 47 LYS H H 1 8.256 0.01 . 1 . . . . . 47 LYS H . 27010 1 52 . 1 1 47 47 LYS N N 15 121.425 0.02 . 1 . . . . . 47 LYS N . 27010 1 53 . 1 1 48 48 GLN H H 1 7.565 0.01 . 1 . . . . . 48 GLN H . 27010 1 54 . 1 1 48 48 GLN N N 15 117.713 0.02 . 1 . . . . . 48 GLN N . 27010 1 55 . 1 1 51 51 ASP H H 1 7.918 0.01 . 1 . . . . . 51 ASP H . 27010 1 56 . 1 1 51 51 ASP N N 15 116.686 0.02 . 1 . . . . . 51 ASP N . 27010 1 57 . 1 1 52 52 ILE H H 1 7.294 0.01 . 1 . . . . . 52 ILE H . 27010 1 58 . 1 1 52 52 ILE N N 15 120.84 0.02 . 1 . . . . . 52 ILE N . 27010 1 59 . 1 1 54 54 ASP H H 1 9.337 0.01 . 1 . . . . . 54 ASP H . 27010 1 60 . 1 1 54 54 ASP N N 15 122.807 0.02 . 1 . . . . . 54 ASP N . 27010 1 61 . 1 1 55 55 ALA H H 1 7.204 0.01 . 1 . . . . . 55 ALA H . 27010 1 62 . 1 1 55 55 ALA N N 15 120.002 0.02 . 1 . . . . . 55 ALA N . 27010 1 63 . 1 1 56 56 GLY H H 1 7.985 0.01 . 1 . . . . . 56 GLY H . 27010 1 64 . 1 1 56 56 GLY N N 15 107.447 0.02 . 1 . . . . . 56 GLY N . 27010 1 65 . 1 1 57 57 LYS H H 1 7.215 0.01 . 1 . . . . . 57 LYS H . 27010 1 66 . 1 1 57 57 LYS N N 15 118.731 0.02 . 1 . . . . . 57 LYS N . 27010 1 67 . 1 1 60 60 THR H H 1 6.899 0.01 . 1 . . . . . 60 THR H . 27010 1 68 . 1 1 60 60 THR N N 15 117.619 0.02 . 1 . . . . . 60 THR N . 27010 1 69 . 1 1 61 61 ASP H H 1 8.882 0.01 . 1 . . . . . 61 ASP H . 27010 1 70 . 1 1 61 61 ASP N N 15 125.271 0.02 . 1 . . . . . 61 ASP N . 27010 1 71 . 1 1 62 62 GLU H H 1 9.113 0.01 . 1 . . . . . 62 GLU H . 27010 1 72 . 1 1 62 62 GLU N N 15 116.453 0.02 . 1 . . . . . 62 GLU N . 27010 1 73 . 1 1 66 66 ALA H H 1 7.21 0.01 . 1 . . . . . 66 ALA H . 27010 1 74 . 1 1 66 66 ALA N N 15 120.451 0.02 . 1 . . . . . 66 ALA N . 27010 1 75 . 1 1 68 68 VAL H H 1 7.938 0.01 . 1 . . . . . 68 VAL H . 27010 1 76 . 1 1 68 68 VAL N N 15 120.309 0.02 . 1 . . . . . 68 VAL N . 27010 1 77 . 1 1 69 69 LYS H H 1 8.328 0.01 . 1 . . . . . 69 LYS H . 27010 1 78 . 1 1 69 69 LYS N N 15 117.92 0.02 . 1 . . . . . 69 LYS N . 27010 1 79 . 1 1 70 70 GLU H H 1 7.317 0.01 . 1 . . . . . 70 GLU H . 27010 1 80 . 1 1 70 70 GLU N N 15 116.664 0.02 . 1 . . . . . 70 GLU N . 27010 1 81 . 1 1 72 72 ILE H H 1 8.104 0.01 . 1 . . . . . 72 ILE H . 27010 1 82 . 1 1 72 72 ILE N N 15 111.547 0.02 . 1 . . . . . 72 ILE N . 27010 1 83 . 1 1 73 73 ALA H H 1 6.839 0.01 . 1 . . . . . 73 ALA H . 27010 1 84 . 1 1 73 73 ALA N N 15 121.477 0.02 . 1 . . . . . 73 ALA N . 27010 1 85 . 1 1 74 74 GLN H H 1 7.160764 0.01 . 1 . . . . . 74 GLN H . 27010 1 86 . 1 1 74 74 GLN N N 15 116.5232 0.02 . 1 . . . . . 74 GLN N . 27010 1 87 . 1 1 76 76 ASP H H 1 8.409 0.01 . 1 . . . . . 76 ASP H . 27010 1 88 . 1 1 76 76 ASP N N 15 117.354 0.02 . 1 . . . . . 76 ASP N . 27010 1 89 . 1 1 77 77 CYS H H 1 7.615 0.01 . 1 . . . . . 77 CYS H . 27010 1 90 . 1 1 77 77 CYS N N 15 117.913 0.02 . 1 . . . . . 77 CYS N . 27010 1 91 . 1 1 78 78 ARG H H 1 7.647 0.01 . 1 . . . . . 78 ARG H . 27010 1 92 . 1 1 78 78 ARG N N 15 122.142 0.02 . 1 . . . . . 78 ARG N . 27010 1 93 . 1 1 79 79 ASN H H 1 8.66 0.01 . 1 . . . . . 79 ASN H . 27010 1 94 . 1 1 79 79 ASN N N 15 114.739 0.02 . 1 . . . . . 79 ASN N . 27010 1 95 . 1 1 80 80 GLY H H 1 7.419 0.01 . 1 . . . . . 80 GLY H . 27010 1 96 . 1 1 80 80 GLY N N 15 107.761 0.02 . 1 . . . . . 80 GLY N . 27010 1 97 . 1 1 81 81 PHE H H 1 7.425 0.01 . 1 . . . . . 81 PHE H . 27010 1 98 . 1 1 81 81 PHE N N 15 109.067 0.02 . 1 . . . . . 81 PHE N . 27010 1 99 . 1 1 82 82 LEU H H 1 8.755 0.01 . 1 . . . . . 82 LEU H . 27010 1 100 . 1 1 82 82 LEU N N 15 122.392 0.02 . 1 . . . . . 82 LEU N . 27010 1 101 . 1 1 83 83 LEU H H 1 9.651 0.01 . 1 . . . . . 83 LEU H . 27010 1 102 . 1 1 83 83 LEU N N 15 128.802 0.02 . 1 . . . . . 83 LEU N . 27010 1 103 . 1 1 85 85 GLY H H 1 8.697 0.01 . 1 . . . . . 85 GLY H . 27010 1 104 . 1 1 85 85 GLY N N 15 111.667 0.02 . 1 . . . . . 85 GLY N . 27010 1 105 . 1 1 86 86 PHE H H 1 7.338 0.01 . 1 . . . . . 86 PHE H . 27010 1 106 . 1 1 86 86 PHE N N 15 119.316 0.02 . 1 . . . . . 86 PHE N . 27010 1 107 . 1 1 88 88 ARG H H 1 8.223 0.01 . 1 . . . . . 88 ARG H . 27010 1 108 . 1 1 88 88 ARG N N 15 114.38 0.02 . 1 . . . . . 88 ARG N . 27010 1 109 . 1 1 89 89 THR H H 1 6.87 0.01 . 1 . . . . . 89 THR H . 27010 1 110 . 1 1 89 89 THR N N 15 106.098 0.02 . 1 . . . . . 89 THR N . 27010 1 111 . 1 1 92 92 GLN H H 1 7.104 0.01 . 1 . . . . . 92 GLN H . 27010 1 112 . 1 1 92 92 GLN N N 15 115.719 0.02 . 1 . . . . . 92 GLN N . 27010 1 113 . 1 1 93 93 ALA H H 1 7.448 0.01 . 1 . . . . . 93 ALA H . 27010 1 114 . 1 1 93 93 ALA N N 15 123.829 0.02 . 1 . . . . . 93 ALA N . 27010 1 115 . 1 1 94 94 ASP H H 1 9.026 0.01 . 1 . . . . . 94 ASP H . 27010 1 116 . 1 1 94 94 ASP N N 15 120.305 0.02 . 1 . . . . . 94 ASP N . 27010 1 117 . 1 1 95 95 ALA H H 1 7.886 0.01 . 1 . . . . . 95 ALA H . 27010 1 118 . 1 1 95 95 ALA N N 15 122.097 0.02 . 1 . . . . . 95 ALA N . 27010 1 119 . 1 1 97 97 LYS H H 1 7.496 0.01 . 1 . . . . . 97 LYS H . 27010 1 120 . 1 1 97 97 LYS N N 15 120.968 0.02 . 1 . . . . . 97 LYS N . 27010 1 121 . 1 1 98 98 GLU H H 1 8.582 0.01 . 1 . . . . . 98 GLU H . 27010 1 122 . 1 1 98 98 GLU N N 15 120.951 0.02 . 1 . . . . . 98 GLU N . 27010 1 123 . 1 1 99 99 ALA H H 1 7.438 0.01 . 1 . . . . . 99 ALA H . 27010 1 124 . 1 1 99 99 ALA N N 15 112.919 0.02 . 1 . . . . . 99 ALA N . 27010 1 125 . 1 1 100 100 GLY H H 1 7.825 0.01 . 1 . . . . . 100 GLY H . 27010 1 126 . 1 1 100 100 GLY N N 15 107.54 0.02 . 1 . . . . . 100 GLY N . 27010 1 127 . 1 1 101 101 ILE H H 1 8.057113 0.01 . 1 . . . . . 101 ILE H . 27010 1 128 . 1 1 101 101 ILE N N 15 121.7124 0.02 . 1 . . . . . 101 ILE N . 27010 1 129 . 1 1 102 102 ASN H H 1 7.926 0.01 . 1 . . . . . 102 ASN H . 27010 1 130 . 1 1 102 102 ASN N N 15 124.542 0.02 . 1 . . . . . 102 ASN N . 27010 1 131 . 1 1 103 103 VAL H H 1 8.617 0.01 . 1 . . . . . 103 VAL H . 27010 1 132 . 1 1 103 103 VAL N N 15 114.297 0.02 . 1 . . . . . 103 VAL N . 27010 1 133 . 1 1 106 106 VAL H H 1 8.864 0.01 . 1 . . . . . 106 VAL H . 27010 1 134 . 1 1 106 106 VAL N N 15 123.382 0.02 . 1 . . . . . 106 VAL N . 27010 1 135 . 1 1 107 107 LEU H H 1 8.847 0.01 . 1 . . . . . 107 LEU H . 27010 1 136 . 1 1 107 107 LEU N N 15 124.969 0.02 . 1 . . . . . 107 LEU N . 27010 1 137 . 1 1 108 108 GLU H H 1 8.672 0.01 . 1 . . . . . 108 GLU H . 27010 1 138 . 1 1 108 108 GLU N N 15 124.869 0.02 . 1 . . . . . 108 GLU N . 27010 1 139 . 1 1 109 109 PHE H H 1 9.296 0.01 . 1 . . . . . 109 PHE H . 27010 1 140 . 1 1 109 109 PHE N N 15 130.72 0.02 . 1 . . . . . 109 PHE N . 27010 1 141 . 1 1 110 110 ASP H H 1 8.66 0.01 . 1 . . . . . 110 ASP H . 27010 1 142 . 1 1 110 110 ASP N N 15 127.667 0.02 . 1 . . . . . 110 ASP N . 27010 1 143 . 1 1 111 111 VAL H H 1 7.379 0.01 . 1 . . . . . 111 VAL H . 27010 1 144 . 1 1 111 111 VAL N N 15 126.31 0.02 . 1 . . . . . 111 VAL N . 27010 1 145 . 1 1 113 113 ASP H H 1 8.703 0.01 . 1 . . . . . 113 ASP H . 27010 1 146 . 1 1 113 113 ASP N N 15 123.343 0.02 . 1 . . . . . 113 ASP N . 27010 1 147 . 1 1 114 114 GLU H H 1 8.979 0.01 . 1 . . . . . 114 GLU H . 27010 1 148 . 1 1 114 114 GLU N N 15 114.604 0.02 . 1 . . . . . 114 GLU N . 27010 1 149 . 1 1 115 115 LEU H H 1 7.055 0.01 . 1 . . . . . 115 LEU H . 27010 1 150 . 1 1 115 115 LEU N N 15 118.674 0.02 . 1 . . . . . 115 LEU N . 27010 1 151 . 1 1 116 116 ILE H H 1 7.365 0.01 . 1 . . . . . 116 ILE H . 27010 1 152 . 1 1 116 116 ILE N N 15 121.967 0.02 . 1 . . . . . 116 ILE N . 27010 1 153 . 1 1 117 117 VAL H H 1 8.136 0.01 . 1 . . . . . 117 VAL H . 27010 1 154 . 1 1 117 117 VAL N N 15 117.554 0.02 . 1 . . . . . 117 VAL N . 27010 1 155 . 1 1 121 121 VAL H H 1 8.485 0.01 . 1 . . . . . 121 VAL H . 27010 1 156 . 1 1 121 121 VAL N N 15 115.222 0.02 . 1 . . . . . 121 VAL N . 27010 1 157 . 1 1 122 122 GLY H H 1 7.307 0.01 . 1 . . . . . 122 GLY H . 27010 1 158 . 1 1 122 122 GLY N N 15 105.784 0.02 . 1 . . . . . 122 GLY N . 27010 1 159 . 1 1 123 123 ARG H H 1 7.616 0.01 . 1 . . . . . 123 ARG H . 27010 1 160 . 1 1 123 123 ARG N N 15 121 0.02 . 1 . . . . . 123 ARG N . 27010 1 161 . 1 1 124 124 ARG H H 1 8.723 0.01 . 1 . . . . . 124 ARG H . 27010 1 162 . 1 1 124 124 ARG N N 15 125.857 0.02 . 1 . . . . . 124 ARG N . 27010 1 163 . 1 1 126 126 HIS H H 1 9.088 0.01 . 1 . . . . . 126 HIS H . 27010 1 164 . 1 1 126 126 HIS N N 15 126.469 0.02 . 1 . . . . . 126 HIS N . 27010 1 165 . 1 1 127 127 ALA H H 1 8.988 0.01 . 1 . . . . . 127 ALA H . 27010 1 166 . 1 1 127 127 ALA N N 15 129.482 0.02 . 1 . . . . . 127 ALA N . 27010 1 167 . 1 1 129 129 SER H H 1 6.726 0.01 . 1 . . . . . 129 SER H . 27010 1 168 . 1 1 129 129 SER N N 15 107.509 0.02 . 1 . . . . . 129 SER N . 27010 1 169 . 1 1 130 130 GLY H H 1 8.512 0.01 . 1 . . . . . 130 GLY H . 27010 1 170 . 1 1 130 130 GLY N N 15 113.147 0.02 . 1 . . . . . 130 GLY N . 27010 1 171 . 1 1 131 131 ARG H H 1 8.37 0.01 . 1 . . . . . 131 ARG H . 27010 1 172 . 1 1 131 131 ARG N N 15 122.053 0.02 . 1 . . . . . 131 ARG N . 27010 1 173 . 1 1 132 132 VAL H H 1 7.81 0.01 . 1 . . . . . 132 VAL H . 27010 1 174 . 1 1 132 132 VAL N N 15 119.367 0.02 . 1 . . . . . 132 VAL N . 27010 1 175 . 1 1 133 133 TYR H H 1 9.133 0.01 . 1 . . . . . 133 TYR H . 27010 1 176 . 1 1 133 133 TYR N N 15 123.648 0.02 . 1 . . . . . 133 TYR N . 27010 1 177 . 1 1 134 134 HIS H H 1 8.352 0.01 . 1 . . . . . 134 HIS H . 27010 1 178 . 1 1 134 134 HIS N N 15 120.967 0.02 . 1 . . . . . 134 HIS N . 27010 1 179 . 1 1 136 136 LYS H H 1 9.438 0.01 . 1 . . . . . 136 LYS H . 27010 1 180 . 1 1 136 136 LYS N N 15 120.054 0.02 . 1 . . . . . 136 LYS N . 27010 1 181 . 1 1 137 137 PHE H H 1 8.292 0.01 . 1 . . . . . 137 PHE H . 27010 1 182 . 1 1 137 137 PHE N N 15 117.129 0.02 . 1 . . . . . 137 PHE N . 27010 1 183 . 1 1 138 138 ASN H H 1 8.459 0.01 . 1 . . . . . 138 ASN H . 27010 1 184 . 1 1 138 138 ASN N N 15 114.08 0.02 . 1 . . . . . 138 ASN N . 27010 1 185 . 1 1 141 141 LYS H H 1 10.038 0.01 . 1 . . . . . 141 LYS H . 27010 1 186 . 1 1 141 141 LYS N N 15 124.144 0.02 . 1 . . . . . 141 LYS N . 27010 1 187 . 1 1 143 143 GLU H H 1 8.073 0.01 . 1 . . . . . 143 GLU H . 27010 1 188 . 1 1 143 143 GLU N N 15 125.572 0.02 . 1 . . . . . 143 GLU N . 27010 1 189 . 1 1 144 144 GLY H H 1 8.81 0.01 . 1 . . . . . 144 GLY H . 27010 1 190 . 1 1 144 144 GLY N N 15 111.77 0.02 . 1 . . . . . 144 GLY N . 27010 1 191 . 1 1 145 145 LYS H H 1 7.918 0.01 . 1 . . . . . 145 LYS H . 27010 1 192 . 1 1 145 145 LYS N N 15 119.415 0.02 . 1 . . . . . 145 LYS N . 27010 1 193 . 1 1 146 146 ASP H H 1 8.974 0.01 . 1 . . . . . 146 ASP H . 27010 1 194 . 1 1 146 146 ASP N N 15 119.909 0.02 . 1 . . . . . 146 ASP N . 27010 1 195 . 1 1 147 147 ASP H H 1 7.84 0.01 . 1 . . . . . 147 ASP H . 27010 1 196 . 1 1 147 147 ASP N N 15 127.131 0.02 . 1 . . . . . 147 ASP N . 27010 1 197 . 1 1 148 148 VAL H H 1 6.272 0.01 . 1 . . . . . 148 VAL H . 27010 1 198 . 1 1 148 148 VAL N N 15 115.052 0.02 . 1 . . . . . 148 VAL N . 27010 1 199 . 1 1 149 149 THR H H 1 7.421 0.01 . 1 . . . . . 149 THR H . 27010 1 200 . 1 1 149 149 THR N N 15 105.552 0.02 . 1 . . . . . 149 THR N . 27010 1 201 . 1 1 150 150 GLY H H 1 7.783 0.01 . 1 . . . . . 150 GLY H . 27010 1 202 . 1 1 150 150 GLY N N 15 111.124 0.02 . 1 . . . . . 150 GLY N . 27010 1 203 . 1 1 151 151 GLU H H 1 7.292 0.01 . 1 . . . . . 151 GLU H . 27010 1 204 . 1 1 151 151 GLU N N 15 118.354 0.02 . 1 . . . . . 151 GLU N . 27010 1 205 . 1 1 152 152 GLU H H 1 8.624 0.01 . 1 . . . . . 152 GLU H . 27010 1 206 . 1 1 152 152 GLU N N 15 119.67 0.02 . 1 . . . . . 152 GLU N . 27010 1 207 . 1 1 153 153 LEU H H 1 7.863 0.01 . 1 . . . . . 153 LEU H . 27010 1 208 . 1 1 153 153 LEU N N 15 121.018 0.02 . 1 . . . . . 153 LEU N . 27010 1 209 . 1 1 154 154 THR H H 1 9.238 0.01 . 1 . . . . . 154 THR H . 27010 1 210 . 1 1 154 154 THR N N 15 114.214 0.02 . 1 . . . . . 154 THR N . 27010 1 211 . 1 1 155 155 THR H H 1 8.287 0.01 . 1 . . . . . 155 THR H . 27010 1 212 . 1 1 155 155 THR N N 15 115.276 0.02 . 1 . . . . . 155 THR N . 27010 1 213 . 1 1 156 156 ARG H H 1 9.771 0.01 . 1 . . . . . 156 ARG H . 27010 1 214 . 1 1 156 156 ARG N N 15 127.318 0.02 . 1 . . . . . 156 ARG N . 27010 1 215 . 1 1 158 158 ASP H H 1 8.377 0.01 . 1 . . . . . 158 ASP H . 27010 1 216 . 1 1 158 158 ASP N N 15 114.381 0.02 . 1 . . . . . 158 ASP N . 27010 1 217 . 1 1 159 159 ASP H H 1 7.318 0.01 . 1 . . . . . 159 ASP H . 27010 1 218 . 1 1 159 159 ASP N N 15 117.262 0.02 . 1 . . . . . 159 ASP N . 27010 1 219 . 1 1 160 160 GLN H H 1 6.983 0.01 . 1 . . . . . 160 GLN H . 27010 1 220 . 1 1 160 160 GLN N N 15 117.242 0.02 . 1 . . . . . 160 GLN N . 27010 1 221 . 1 1 161 161 GLU H H 1 9.126 0.01 . 1 . . . . . 161 GLU H . 27010 1 222 . 1 1 161 161 GLU N N 15 124.562 0.02 . 1 . . . . . 161 GLU N . 27010 1 223 . 1 1 162 162 GLU H H 1 9.156 0.01 . 1 . . . . . 162 GLU H . 27010 1 224 . 1 1 162 162 GLU N N 15 116.256 0.02 . 1 . . . . . 162 GLU N . 27010 1 225 . 1 1 163 163 THR H H 1 7.154629 0.01 . 1 . . . . . 163 THR H . 27010 1 226 . 1 1 163 163 THR N N 15 116.2902 0.02 . 1 . . . . . 163 THR N . 27010 1 227 . 1 1 164 164 VAL H H 1 8.183 0.01 . 1 . . . . . 164 VAL H . 27010 1 228 . 1 1 164 164 VAL N N 15 123.262 0.02 . 1 . . . . . 164 VAL N . 27010 1 229 . 1 1 165 165 ARG H H 1 8.571 0.01 . 1 . . . . . 165 ARG H . 27010 1 230 . 1 1 165 165 ARG N N 15 116.863 0.02 . 1 . . . . . 165 ARG N . 27010 1 231 . 1 1 166 166 LYS H H 1 7.6 0.01 . 1 . . . . . 166 LYS H . 27010 1 232 . 1 1 166 166 LYS N N 15 120.021 0.02 . 1 . . . . . 166 LYS N . 27010 1 233 . 1 1 175 175 THR H H 1 8.001 0.01 . 1 . . . . . 175 THR H . 27010 1 234 . 1 1 175 175 THR N N 15 114.381 0.02 . 1 . . . . . 175 THR N . 27010 1 235 . 1 1 176 176 ALA H H 1 8.025 0.01 . 1 . . . . . 176 ALA H . 27010 1 236 . 1 1 176 176 ALA N N 15 125.913 0.02 . 1 . . . . . 176 ALA N . 27010 1 237 . 1 1 179 179 ILE H H 1 8.246 0.01 . 1 . . . . . 179 ILE H . 27010 1 238 . 1 1 179 179 ILE N N 15 121.815 0.02 . 1 . . . . . 179 ILE N . 27010 1 239 . 1 1 180 180 GLY H H 1 7.785 0.01 . 1 . . . . . 180 GLY H . 27010 1 240 . 1 1 180 180 GLY N N 15 108.324 0.02 . 1 . . . . . 180 GLY N . 27010 1 241 . 1 1 181 181 TYR H H 1 7.76 0.01 . 1 . . . . . 181 TYR H . 27010 1 242 . 1 1 181 181 TYR N N 15 123.706 0.02 . 1 . . . . . 181 TYR N . 27010 1 243 . 1 1 182 182 TYR H H 1 8.794 0.01 . 1 . . . . . 182 TYR H . 27010 1 244 . 1 1 182 182 TYR N N 15 117.78 0.02 . 1 . . . . . 182 TYR N . 27010 1 245 . 1 1 184 184 LYS H H 1 7.547 0.01 . 1 . . . . . 184 LYS H . 27010 1 246 . 1 1 184 184 LYS N N 15 123.379 0.02 . 1 . . . . . 184 LYS N . 27010 1 247 . 1 1 185 185 GLU H H 1 7.66 0.01 . 1 . . . . . 185 GLU H . 27010 1 248 . 1 1 185 185 GLU N N 15 120.104 0.02 . 1 . . . . . 185 GLU N . 27010 1 249 . 1 1 186 186 ALA H H 1 8.324 0.01 . 1 . . . . . 186 ALA H . 27010 1 250 . 1 1 186 186 ALA N N 15 122.882 0.02 . 1 . . . . . 186 ALA N . 27010 1 251 . 1 1 187 187 GLU H H 1 8.019 0.01 . 1 . . . . . 187 GLU H . 27010 1 252 . 1 1 187 187 GLU N N 15 122.306 0.02 . 1 . . . . . 187 GLU N . 27010 1 253 . 1 1 188 188 ALA H H 1 7.413 0.01 . 1 . . . . . 188 ALA H . 27010 1 254 . 1 1 188 188 ALA N N 15 118.666 0.02 . 1 . . . . . 188 ALA N . 27010 1 255 . 1 1 189 189 GLY H H 1 7.78 0.01 . 1 . . . . . 189 GLY H . 27010 1 256 . 1 1 189 189 GLY N N 15 105.261 0.02 . 1 . . . . . 189 GLY N . 27010 1 257 . 1 1 190 190 ASN H H 1 8.124 0.01 . 1 . . . . . 190 ASN H . 27010 1 258 . 1 1 190 190 ASN N N 15 116.978 0.02 . 1 . . . . . 190 ASN N . 27010 1 259 . 1 1 191 191 THR H H 1 7.472 0.01 . 1 . . . . . 191 THR H . 27010 1 260 . 1 1 191 191 THR N N 15 114.011 0.02 . 1 . . . . . 191 THR N . 27010 1 261 . 1 1 192 192 LYS H H 1 7.773 0.01 . 1 . . . . . 192 LYS H . 27010 1 262 . 1 1 192 192 LYS N N 15 122.748 0.02 . 1 . . . . . 192 LYS N . 27010 1 263 . 1 1 193 193 TYR H H 1 8.388 0.01 . 1 . . . . . 193 TYR H . 27010 1 264 . 1 1 193 193 TYR N N 15 124.653 0.02 . 1 . . . . . 193 TYR N . 27010 1 265 . 1 1 194 194 ALA H H 1 8.4 0.01 . 1 . . . . . 194 ALA H . 27010 1 266 . 1 1 194 194 ALA N N 15 130.845 0.02 . 1 . . . . . 194 ALA N . 27010 1 267 . 1 1 195 195 LYS H H 1 8.261 0.01 . 1 . . . . . 195 LYS H . 27010 1 268 . 1 1 195 195 LYS N N 15 122.375 0.02 . 1 . . . . . 195 LYS N . 27010 1 269 . 1 1 196 196 VAL H H 1 9.106 0.01 . 1 . . . . . 196 VAL H . 27010 1 270 . 1 1 196 196 VAL N N 15 125.471 0.02 . 1 . . . . . 196 VAL N . 27010 1 271 . 1 1 197 197 ASP H H 1 8.658 0.01 . 1 . . . . . 197 ASP H . 27010 1 272 . 1 1 197 197 ASP N N 15 124.464 0.02 . 1 . . . . . 197 ASP N . 27010 1 273 . 1 1 198 198 GLY H H 1 8.288 0.01 . 1 . . . . . 198 GLY H . 27010 1 274 . 1 1 198 198 GLY N N 15 112.028 0.02 . 1 . . . . . 198 GLY N . 27010 1 275 . 1 1 199 199 THR H H 1 8.545 0.01 . 1 . . . . . 199 THR H . 27010 1 276 . 1 1 199 199 THR N N 15 111.256 0.02 . 1 . . . . . 199 THR N . 27010 1 277 . 1 1 200 200 LYS H H 1 6.499 0.01 . 1 . . . . . 200 LYS H . 27010 1 278 . 1 1 200 200 LYS N N 15 121.811 0.02 . 1 . . . . . 200 LYS N . 27010 1 279 . 1 1 203 203 ALA H H 1 8.761 0.01 . 1 . . . . . 203 ALA H . 27010 1 280 . 1 1 203 203 ALA N N 15 119.447 0.02 . 1 . . . . . 203 ALA N . 27010 1 281 . 1 1 204 204 GLU H H 1 7.346 0.01 . 1 . . . . . 204 GLU H . 27010 1 282 . 1 1 204 204 GLU N N 15 117.794 0.02 . 1 . . . . . 204 GLU N . 27010 1 283 . 1 1 205 205 VAL H H 1 7.814 0.01 . 1 . . . . . 205 VAL H . 27010 1 284 . 1 1 205 205 VAL N N 15 121.45 0.02 . 1 . . . . . 205 VAL N . 27010 1 285 . 1 1 207 207 ALA H H 1 7.151 0.01 . 1 . . . . . 207 ALA H . 27010 1 286 . 1 1 207 207 ALA N N 15 120.363 0.02 . 1 . . . . . 207 ALA N . 27010 1 287 . 1 1 208 208 ASP H H 1 8.146 0.01 . 1 . . . . . 208 ASP H . 27010 1 288 . 1 1 208 208 ASP N N 15 121.345 0.02 . 1 . . . . . 208 ASP N . 27010 1 289 . 1 1 209 209 LEU H H 1 8.469 0.01 . 1 . . . . . 209 LEU H . 27010 1 290 . 1 1 209 209 LEU N N 15 120.665 0.02 . 1 . . . . . 209 LEU N . 27010 1 291 . 1 1 210 210 GLU H H 1 8.359 0.01 . 1 . . . . . 210 GLU H . 27010 1 292 . 1 1 210 210 GLU N N 15 118.979 0.02 . 1 . . . . . 210 GLU N . 27010 1 293 . 1 1 212 212 ILE H H 1 7.471 0.01 . 1 . . . . . 212 ILE H . 27010 1 294 . 1 1 212 212 ILE N N 15 119.302 0.02 . 1 . . . . . 212 ILE N . 27010 1 295 . 1 1 214 214 GLY H H 1 7.593 0.01 . 1 . . . . . 214 GLY H . 27010 1 296 . 1 1 214 214 GLY N N 15 112.618 0.02 . 1 . . . . . 214 GLY N . 27010 1 stop_ save_