################################### # 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_AdK_ATP _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode AdK_ATP _Assigned_chem_shift_list.Entry_ID 27005 _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' . . . 27005 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 . . 27005 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 9.613 0.01 . 1 . . . . . 2 ARG H . 27005 1 2 . 1 1 2 2 ARG N N 15 126.718 0.02 . 1 . . . . . 2 ARG N . 27005 1 3 . 1 1 4 4 ILE H H 1 8.5 0.01 . 1 . . . . . 4 ILE H . 27005 1 4 . 1 1 4 4 ILE N N 15 125.342 0.02 . 1 . . . . . 4 ILE N . 27005 1 5 . 1 1 5 5 LEU H H 1 8.401 0.01 . 1 . . . . . 5 LEU H . 27005 1 6 . 1 1 5 5 LEU N N 15 125.737 0.02 . 1 . . . . . 5 LEU N . 27005 1 7 . 1 1 6 6 LEU H H 1 9.319 0.01 . 1 . . . . . 6 LEU H . 27005 1 8 . 1 1 6 6 LEU N N 15 125.195 0.02 . 1 . . . . . 6 LEU N . 27005 1 9 . 1 1 7 7 GLY H H 1 8.32 0.01 . 1 . . . . . 7 GLY H . 27005 1 10 . 1 1 7 7 GLY N N 15 108.523 0.02 . 1 . . . . . 7 GLY N . 27005 1 11 . 1 1 8 8 ALA H H 1 8.833 0.01 . 1 . . . . . 8 ALA H . 27005 1 12 . 1 1 8 8 ALA N N 15 126.764 0.02 . 1 . . . . . 8 ALA N . 27005 1 13 . 1 1 18 18 GLN H H 1 7.335 0.01 . 1 . . . . . 18 GLN H . 27005 1 14 . 1 1 18 18 GLN N N 15 114.138 0.02 . 1 . . . . . 18 GLN N . 27005 1 15 . 1 1 19 19 PHE H H 1 6.783 0.01 . 1 . . . . . 19 PHE H . 27005 1 16 . 1 1 19 19 PHE N N 15 118.228 0.02 . 1 . . . . . 19 PHE N . 27005 1 17 . 1 1 21 21 MET H H 1 8.477 0.01 . 1 . . . . . 21 MET H . 27005 1 18 . 1 1 21 21 MET N N 15 118.842 0.02 . 1 . . . . . 21 MET N . 27005 1 19 . 1 1 22 22 GLU H H 1 7.483 0.01 . 1 . . . . . 22 GLU H . 27005 1 20 . 1 1 22 22 GLU N N 15 117.636 0.02 . 1 . . . . . 22 GLU N . 27005 1 21 . 1 1 24 24 TYR H H 1 7.854 0.01 . 1 . . . . . 24 TYR H . 27005 1 22 . 1 1 24 24 TYR N N 15 112.709 0.02 . 1 . . . . . 24 TYR N . 27005 1 23 . 1 1 25 25 GLY H H 1 7.691 0.01 . 1 . . . . . 25 GLY H . 27005 1 24 . 1 1 25 25 GLY N N 15 110.664 0.02 . 1 . . . . . 25 GLY N . 27005 1 25 . 1 1 28 28 GLN H H 1 8.183 0.01 . 1 . . . . . 28 GLN H . 27005 1 26 . 1 1 28 28 GLN N N 15 119.544 0.02 . 1 . . . . . 28 GLN N . 27005 1 27 . 1 1 29 29 ILE H H 1 9.288 0.01 . 1 . . . . . 29 ILE H . 27005 1 28 . 1 1 29 29 ILE N N 15 128.214 0.02 . 1 . . . . . 29 ILE N . 27005 1 29 . 1 1 31 31 THR H H 1 9.243 0.01 . 1 . . . . . 31 THR H . 27005 1 30 . 1 1 31 31 THR N N 15 117.062 0.02 . 1 . . . . . 31 THR N . 27005 1 31 . 1 1 32 32 GLY H H 1 8.986 0.01 . 1 . . . . . 32 GLY H . 27005 1 32 . 1 1 32 32 GLY N N 15 110.436 0.02 . 1 . . . . . 32 GLY N . 27005 1 33 . 1 1 33 33 ASP H H 1 7.543 0.01 . 1 . . . . . 33 ASP H . 27005 1 34 . 1 1 33 33 ASP N N 15 121.713 0.02 . 1 . . . . . 33 ASP N . 27005 1 35 . 1 1 36 36 ARG H H 1 7.86 0.01 . 1 . . . . . 36 ARG H . 27005 1 36 . 1 1 36 36 ARG N N 15 118.113 0.02 . 1 . . . . . 36 ARG N . 27005 1 37 . 1 1 37 37 ALA H H 1 8.034 0.01 . 1 . . . . . 37 ALA H . 27005 1 38 . 1 1 37 37 ALA N N 15 120.685 0.02 . 1 . . . . . 37 ALA N . 27005 1 39 . 1 1 40 40 LYS H H 1 7.69 0.01 . 1 . . . . . 40 LYS H . 27005 1 40 . 1 1 40 40 LYS N N 15 119.432 0.02 . 1 . . . . . 40 LYS N . 27005 1 41 . 1 1 41 41 SER H H 1 7.86 0.01 . 1 . . . . . 41 SER H . 27005 1 42 . 1 1 41 41 SER N N 15 113.393 0.02 . 1 . . . . . 41 SER N . 27005 1 43 . 1 1 42 42 GLY H H 1 7.775 0.01 . 1 . . . . . 42 GLY H . 27005 1 44 . 1 1 42 42 GLY N N 15 109.794 0.02 . 1 . . . . . 42 GLY N . 27005 1 45 . 1 1 43 43 SER H H 1 7.746 0.01 . 1 . . . . . 43 SER H . 27005 1 46 . 1 1 43 43 SER N N 15 115.185 0.02 . 1 . . . . . 43 SER N . 27005 1 47 . 1 1 44 44 GLU H H 1 8.886 0.01 . 1 . . . . . 44 GLU H . 27005 1 48 . 1 1 44 44 GLU N N 15 122.3 0.02 . 1 . . . . . 44 GLU N . 27005 1 49 . 1 1 46 46 GLY H H 1 8.011 0.01 . 1 . . . . . 46 GLY H . 27005 1 50 . 1 1 46 46 GLY N N 15 107.855 0.02 . 1 . . . . . 46 GLY N . 27005 1 51 . 1 1 47 47 LYS H H 1 8.318 0.01 . 1 . . . . . 47 LYS H . 27005 1 52 . 1 1 47 47 LYS N N 15 122.116 0.02 . 1 . . . . . 47 LYS N . 27005 1 53 . 1 1 49 49 ALA H H 1 8.246 0.01 . 1 . . . . . 49 ALA H . 27005 1 54 . 1 1 49 49 ALA N N 15 120.6 0.02 . 1 . . . . . 49 ALA N . 27005 1 55 . 1 1 52 52 ILE H H 1 7.408 0.01 . 1 . . . . . 52 ILE H . 27005 1 56 . 1 1 52 52 ILE N N 15 120.85 0.02 . 1 . . . . . 52 ILE N . 27005 1 57 . 1 1 53 53 MET H H 1 8.32 0.01 . 1 . . . . . 53 MET H . 27005 1 58 . 1 1 53 53 MET N N 15 119.433 0.02 . 1 . . . . . 53 MET N . 27005 1 59 . 1 1 54 54 ASP H H 1 9.084 0.01 . 1 . . . . . 54 ASP H . 27005 1 60 . 1 1 54 54 ASP N N 15 121.789 0.02 . 1 . . . . . 54 ASP N . 27005 1 61 . 1 1 55 55 ALA H H 1 7.226 0.01 . 1 . . . . . 55 ALA H . 27005 1 62 . 1 1 55 55 ALA N N 15 119.983 0.02 . 1 . . . . . 55 ALA N . 27005 1 63 . 1 1 56 56 GLY H H 1 7.989 0.01 . 1 . . . . . 56 GLY H . 27005 1 64 . 1 1 56 56 GLY N N 15 107.716 0.02 . 1 . . . . . 56 GLY N . 27005 1 65 . 1 1 57 57 LYS H H 1 7.372 0.01 . 1 . . . . . 57 LYS H . 27005 1 66 . 1 1 57 57 LYS N N 15 119.163 0.02 . 1 . . . . . 57 LYS N . 27005 1 67 . 1 1 60 60 THR H H 1 6.871 0.01 . 1 . . . . . 60 THR H . 27005 1 68 . 1 1 60 60 THR N N 15 116.496 0.02 . 1 . . . . . 60 THR N . 27005 1 69 . 1 1 61 61 ASP H H 1 8.849 0.01 . 1 . . . . . 61 ASP H . 27005 1 70 . 1 1 61 61 ASP N N 15 123.01 0.02 . 1 . . . . . 61 ASP N . 27005 1 71 . 1 1 62 62 GLU H H 1 8.798 0.01 . 1 . . . . . 62 GLU H . 27005 1 72 . 1 1 62 62 GLU N N 15 116.87 0.02 . 1 . . . . . 62 GLU N . 27005 1 73 . 1 1 63 63 LEU H H 1 7.292 0.01 . 1 . . . . . 63 LEU H . 27005 1 74 . 1 1 63 63 LEU N N 15 121.457 0.02 . 1 . . . . . 63 LEU N . 27005 1 75 . 1 1 66 66 ALA H H 1 7.405 0.01 . 1 . . . . . 66 ALA H . 27005 1 76 . 1 1 66 66 ALA N N 15 122.048 0.02 . 1 . . . . . 66 ALA N . 27005 1 77 . 1 1 70 70 GLU H H 1 7.347 0.01 . 1 . . . . . 70 GLU H . 27005 1 78 . 1 1 70 70 GLU N N 15 117.005 0.02 . 1 . . . . . 70 GLU N . 27005 1 79 . 1 1 72 72 ILE H H 1 8.147 0.01 . 1 . . . . . 72 ILE H . 27005 1 80 . 1 1 72 72 ILE N N 15 110.961 0.02 . 1 . . . . . 72 ILE N . 27005 1 81 . 1 1 73 73 ALA H H 1 6.937 0.01 . 1 . . . . . 73 ALA H . 27005 1 82 . 1 1 73 73 ALA N N 15 122.07 0.02 . 1 . . . . . 73 ALA N . 27005 1 83 . 1 1 74 74 GLN H H 1 7.2 0.01 . 1 . . . . . 74 GLN H . 27005 1 84 . 1 1 74 74 GLN N N 15 116.756 0.02 . 1 . . . . . 74 GLN N . 27005 1 85 . 1 1 75 75 GLU H H 1 8.926 0.01 . 1 . . . . . 75 GLU H . 27005 1 86 . 1 1 75 75 GLU N N 15 122.196 0.02 . 1 . . . . . 75 GLU N . 27005 1 87 . 1 1 77 77 CYS H H 1 7.642 0.01 . 1 . . . . . 77 CYS H . 27005 1 88 . 1 1 77 77 CYS N N 15 117.94 0.02 . 1 . . . . . 77 CYS N . 27005 1 89 . 1 1 78 78 ARG H H 1 7.651 0.01 . 1 . . . . . 78 ARG H . 27005 1 90 . 1 1 78 78 ARG N N 15 122.45 0.02 . 1 . . . . . 78 ARG N . 27005 1 91 . 1 1 79 79 ASN H H 1 8.693 0.01 . 1 . . . . . 79 ASN H . 27005 1 92 . 1 1 79 79 ASN N N 15 115.103 0.02 . 1 . . . . . 79 ASN N . 27005 1 93 . 1 1 80 80 GLY H H 1 7.543 0.01 . 1 . . . . . 80 GLY H . 27005 1 94 . 1 1 80 80 GLY N N 15 108.349 0.02 . 1 . . . . . 80 GLY N . 27005 1 95 . 1 1 81 81 PHE H H 1 7.426 0.01 . 1 . . . . . 81 PHE H . 27005 1 96 . 1 1 81 81 PHE N N 15 108.843 0.02 . 1 . . . . . 81 PHE N . 27005 1 97 . 1 1 82 82 LEU H H 1 8.756 0.01 . 1 . . . . . 82 LEU H . 27005 1 98 . 1 1 82 82 LEU N N 15 121.371 0.02 . 1 . . . . . 82 LEU N . 27005 1 99 . 1 1 83 83 LEU H H 1 9.227 0.01 . 1 . . . . . 83 LEU H . 27005 1 100 . 1 1 83 83 LEU N N 15 127.167 0.02 . 1 . . . . . 83 LEU N . 27005 1 101 . 1 1 85 85 GLY H H 1 8.689 0.01 . 1 . . . . . 85 GLY H . 27005 1 102 . 1 1 85 85 GLY N N 15 112.767 0.02 . 1 . . . . . 85 GLY N . 27005 1 103 . 1 1 86 86 PHE H H 1 7.349 0.01 . 1 . . . . . 86 PHE H . 27005 1 104 . 1 1 86 86 PHE N N 15 119.842 0.02 . 1 . . . . . 86 PHE N . 27005 1 105 . 1 1 88 88 ARG H H 1 8.639 0.01 . 1 . . . . . 88 ARG H . 27005 1 106 . 1 1 88 88 ARG N N 15 114.955 0.02 . 1 . . . . . 88 ARG N . 27005 1 107 . 1 1 89 89 THR H H 1 6.968 0.01 . 1 . . . . . 89 THR H . 27005 1 108 . 1 1 89 89 THR N N 15 106.816 0.02 . 1 . . . . . 89 THR N . 27005 1 109 . 1 1 90 90 ILE H H 1 9.225 0.01 . 1 . . . . . 90 ILE H . 27005 1 110 . 1 1 90 90 ILE N N 15 122.078 0.02 . 1 . . . . . 90 ILE N . 27005 1 111 . 1 1 92 92 GLN H H 1 7.229 0.01 . 1 . . . . . 92 GLN H . 27005 1 112 . 1 1 92 92 GLN N N 15 116.39 0.02 . 1 . . . . . 92 GLN N . 27005 1 113 . 1 1 93 93 ALA H H 1 7.607 0.01 . 1 . . . . . 93 ALA H . 27005 1 114 . 1 1 93 93 ALA N N 15 124.749 0.02 . 1 . . . . . 93 ALA N . 27005 1 115 . 1 1 94 94 ASP H H 1 8.792 0.01 . 1 . . . . . 94 ASP H . 27005 1 116 . 1 1 94 94 ASP N N 15 119.879 0.02 . 1 . . . . . 94 ASP N . 27005 1 117 . 1 1 95 95 ALA H H 1 7.993 0.01 . 1 . . . . . 95 ALA H . 27005 1 118 . 1 1 95 95 ALA N N 15 122.879 0.02 . 1 . . . . . 95 ALA N . 27005 1 119 . 1 1 97 97 LYS H H 1 7.612 0.01 . 1 . . . . . 97 LYS H . 27005 1 120 . 1 1 97 97 LYS N N 15 120.82 0.02 . 1 . . . . . 97 LYS N . 27005 1 121 . 1 1 99 99 ALA H H 1 7.461 0.01 . 1 . . . . . 99 ALA H . 27005 1 122 . 1 1 99 99 ALA N N 15 112.943 0.02 . 1 . . . . . 99 ALA N . 27005 1 123 . 1 1 100 100 GLY H H 1 7.817 0.01 . 1 . . . . . 100 GLY H . 27005 1 124 . 1 1 100 100 GLY N N 15 106.939 0.02 . 1 . . . . . 100 GLY N . 27005 1 125 . 1 1 102 102 ASN H H 1 7.875 0.01 . 1 . . . . . 102 ASN H . 27005 1 126 . 1 1 102 102 ASN N N 15 124.178 0.02 . 1 . . . . . 102 ASN N . 27005 1 127 . 1 1 103 103 VAL H H 1 8.531 0.01 . 1 . . . . . 103 VAL H . 27005 1 128 . 1 1 103 103 VAL N N 15 112.502 0.02 . 1 . . . . . 103 VAL N . 27005 1 129 . 1 1 105 105 TYR H H 1 7.632 0.01 . 1 . . . . . 105 TYR H . 27005 1 130 . 1 1 105 105 TYR N N 15 115.288 0.02 . 1 . . . . . 105 TYR N . 27005 1 131 . 1 1 109 109 PHE H H 1 9.097 0.01 . 1 . . . . . 109 PHE H . 27005 1 132 . 1 1 109 109 PHE N N 15 128.866 0.02 . 1 . . . . . 109 PHE N . 27005 1 133 . 1 1 110 110 ASP H H 1 8.801 0.01 . 1 . . . . . 110 ASP H . 27005 1 134 . 1 1 110 110 ASP N N 15 126.645 0.02 . 1 . . . . . 110 ASP N . 27005 1 135 . 1 1 111 111 VAL H H 1 7.444 0.01 . 1 . . . . . 111 VAL H . 27005 1 136 . 1 1 111 111 VAL N N 15 125.53 0.02 . 1 . . . . . 111 VAL N . 27005 1 137 . 1 1 114 114 GLU H H 1 8.99 0.01 . 1 . . . . . 114 GLU H . 27005 1 138 . 1 1 114 114 GLU N N 15 114.904 0.02 . 1 . . . . . 114 GLU N . 27005 1 139 . 1 1 115 115 LEU H H 1 7.133 0.01 . 1 . . . . . 115 LEU H . 27005 1 140 . 1 1 115 115 LEU N N 15 118.708 0.02 . 1 . . . . . 115 LEU N . 27005 1 141 . 1 1 116 116 ILE H H 1 7.355 0.01 . 1 . . . . . 116 ILE H . 27005 1 142 . 1 1 116 116 ILE N N 15 120.38 0.02 . 1 . . . . . 116 ILE N . 27005 1 143 . 1 1 117 117 VAL H H 1 8.084 0.01 . 1 . . . . . 117 VAL H . 27005 1 144 . 1 1 117 117 VAL N N 15 117.888 0.02 . 1 . . . . . 117 VAL N . 27005 1 145 . 1 1 118 118 ASP H H 1 7.743 0.01 . 1 . . . . . 118 ASP H . 27005 1 146 . 1 1 118 118 ASP N N 15 116.923 0.02 . 1 . . . . . 118 ASP N . 27005 1 147 . 1 1 120 120 ILE H H 1 7.757 0.01 . 1 . . . . . 120 ILE H . 27005 1 148 . 1 1 120 120 ILE N N 15 119.202 0.02 . 1 . . . . . 120 ILE N . 27005 1 149 . 1 1 121 121 VAL H H 1 8.604 0.01 . 1 . . . . . 121 VAL H . 27005 1 150 . 1 1 121 121 VAL N N 15 115.611 0.02 . 1 . . . . . 121 VAL N . 27005 1 151 . 1 1 123 123 ARG H H 1 7.501 0.01 . 1 . . . . . 123 ARG H . 27005 1 152 . 1 1 123 123 ARG N N 15 121.582 0.02 . 1 . . . . . 123 ARG N . 27005 1 153 . 1 1 124 124 ARG H H 1 8.562 0.01 . 1 . . . . . 124 ARG H . 27005 1 154 . 1 1 124 124 ARG N N 15 127.706 0.02 . 1 . . . . . 124 ARG N . 27005 1 155 . 1 1 126 126 HIS H H 1 9.079 0.01 . 1 . . . . . 126 HIS H . 27005 1 156 . 1 1 126 126 HIS N N 15 126.042 0.02 . 1 . . . . . 126 HIS N . 27005 1 157 . 1 1 127 127 ALA H H 1 8.988 0.01 . 1 . . . . . 127 ALA H . 27005 1 158 . 1 1 127 127 ALA N N 15 129.378 0.02 . 1 . . . . . 127 ALA N . 27005 1 159 . 1 1 129 129 SER H H 1 6.724 0.01 . 1 . . . . . 129 SER H . 27005 1 160 . 1 1 129 129 SER N N 15 107.52 0.02 . 1 . . . . . 129 SER N . 27005 1 161 . 1 1 130 130 GLY H H 1 8.488 0.01 . 1 . . . . . 130 GLY H . 27005 1 162 . 1 1 130 130 GLY N N 15 113.019 0.02 . 1 . . . . . 130 GLY N . 27005 1 163 . 1 1 132 132 VAL H H 1 7.879 0.01 . 1 . . . . . 132 VAL H . 27005 1 164 . 1 1 132 132 VAL N N 15 119.451 0.02 . 1 . . . . . 132 VAL N . 27005 1 165 . 1 1 136 136 LYS H H 1 9.424 0.01 . 1 . . . . . 136 LYS H . 27005 1 166 . 1 1 136 136 LYS N N 15 119.955 0.02 . 1 . . . . . 136 LYS N . 27005 1 167 . 1 1 138 138 ASN H H 1 8.15 0.01 . 1 . . . . . 138 ASN H . 27005 1 168 . 1 1 138 138 ASN N N 15 113.442 0.02 . 1 . . . . . 138 ASN N . 27005 1 169 . 1 1 141 141 LYS H H 1 10.053 0.01 . 1 . . . . . 141 LYS H . 27005 1 170 . 1 1 141 141 LYS N N 15 123.992 0.02 . 1 . . . . . 141 LYS N . 27005 1 171 . 1 1 143 143 GLU H H 1 8.075 0.01 . 1 . . . . . 143 GLU H . 27005 1 172 . 1 1 143 143 GLU N N 15 125.562 0.02 . 1 . . . . . 143 GLU N . 27005 1 173 . 1 1 144 144 GLY H H 1 8.755 0.01 . 1 . . . . . 144 GLY H . 27005 1 174 . 1 1 144 144 GLY N N 15 111.694 0.02 . 1 . . . . . 144 GLY N . 27005 1 175 . 1 1 145 145 LYS H H 1 7.913 0.01 . 1 . . . . . 145 LYS H . 27005 1 176 . 1 1 145 145 LYS N N 15 119.387 0.02 . 1 . . . . . 145 LYS N . 27005 1 177 . 1 1 146 146 ASP H H 1 8.981 0.01 . 1 . . . . . 146 ASP H . 27005 1 178 . 1 1 146 146 ASP N N 15 119.887 0.02 . 1 . . . . . 146 ASP N . 27005 1 179 . 1 1 147 147 ASP H H 1 7.847 0.01 . 1 . . . . . 147 ASP H . 27005 1 180 . 1 1 147 147 ASP N N 15 127.03 0.02 . 1 . . . . . 147 ASP N . 27005 1 181 . 1 1 148 148 VAL H H 1 6.269 0.01 . 1 . . . . . 148 VAL H . 27005 1 182 . 1 1 148 148 VAL N N 15 115.161 0.02 . 1 . . . . . 148 VAL N . 27005 1 183 . 1 1 149 149 THR H H 1 7.439 0.01 . 1 . . . . . 149 THR H . 27005 1 184 . 1 1 149 149 THR N N 15 105.58 0.02 . 1 . . . . . 149 THR N . 27005 1 185 . 1 1 150 150 GLY H H 1 7.772 0.01 . 1 . . . . . 150 GLY H . 27005 1 186 . 1 1 150 150 GLY N N 15 111.097 0.02 . 1 . . . . . 150 GLY N . 27005 1 187 . 1 1 151 151 GLU H H 1 7.582 0.01 . 1 . . . . . 151 GLU H . 27005 1 188 . 1 1 151 151 GLU N N 15 118.725 0.02 . 1 . . . . . 151 GLU N . 27005 1 189 . 1 1 152 152 GLU H H 1 8.627 0.01 . 1 . . . . . 152 GLU H . 27005 1 190 . 1 1 152 152 GLU N N 15 119.787 0.02 . 1 . . . . . 152 GLU N . 27005 1 191 . 1 1 153 153 LEU H H 1 7.869 0.01 . 1 . . . . . 153 LEU H . 27005 1 192 . 1 1 153 153 LEU N N 15 121.076 0.02 . 1 . . . . . 153 LEU N . 27005 1 193 . 1 1 154 154 THR H H 1 9.268 0.01 . 1 . . . . . 154 THR H . 27005 1 194 . 1 1 154 154 THR N N 15 113.957 0.02 . 1 . . . . . 154 THR N . 27005 1 195 . 1 1 155 155 THR H H 1 8.264 0.01 . 1 . . . . . 155 THR H . 27005 1 196 . 1 1 155 155 THR N N 15 114.684 0.02 . 1 . . . . . 155 THR N . 27005 1 197 . 1 1 156 156 ARG H H 1 9.785 0.01 . 1 . . . . . 156 ARG H . 27005 1 198 . 1 1 156 156 ARG N N 15 127.048 0.02 . 1 . . . . . 156 ARG N . 27005 1 199 . 1 1 158 158 ASP H H 1 8.384 0.01 . 1 . . . . . 158 ASP H . 27005 1 200 . 1 1 158 158 ASP N N 15 114.242 0.02 . 1 . . . . . 158 ASP N . 27005 1 201 . 1 1 160 160 GLN H H 1 7.174 0.01 . 1 . . . . . 160 GLN H . 27005 1 202 . 1 1 160 160 GLN N N 15 117.591 0.02 . 1 . . . . . 160 GLN N . 27005 1 203 . 1 1 162 162 GLU H H 1 9.141 0.01 . 1 . . . . . 162 GLU H . 27005 1 204 . 1 1 162 162 GLU N N 15 116.582 0.02 . 1 . . . . . 162 GLU N . 27005 1 205 . 1 1 163 163 THR H H 1 7.189 0.01 . 1 . . . . . 163 THR H . 27005 1 206 . 1 1 163 163 THR N N 15 115.538 0.02 . 1 . . . . . 163 THR N . 27005 1 207 . 1 1 164 164 VAL H H 1 8.26 0.01 . 1 . . . . . 164 VAL H . 27005 1 208 . 1 1 164 164 VAL N N 15 123.235 0.02 . 1 . . . . . 164 VAL N . 27005 1 209 . 1 1 165 165 ARG H H 1 8.386 0.01 . 1 . . . . . 165 ARG H . 27005 1 210 . 1 1 165 165 ARG N N 15 117.679 0.02 . 1 . . . . . 165 ARG N . 27005 1 211 . 1 1 166 166 LYS H H 1 7.475 0.01 . 1 . . . . . 166 LYS H . 27005 1 212 . 1 1 166 166 LYS N N 15 119.781 0.02 . 1 . . . . . 166 LYS N . 27005 1 213 . 1 1 167 167 ARG H H 1 8.155 0.01 . 1 . . . . . 167 ARG H . 27005 1 214 . 1 1 167 167 ARG N N 15 119.43 0.02 . 1 . . . . . 167 ARG N . 27005 1 215 . 1 1 174 174 MET H H 1 8.178 0.01 . 1 . . . . . 174 MET H . 27005 1 216 . 1 1 174 174 MET N N 15 114.63 0.02 . 1 . . . . . 174 MET N . 27005 1 217 . 1 1 175 175 THR H H 1 7.869 0.01 . 1 . . . . . 175 THR H . 27005 1 218 . 1 1 175 175 THR N N 15 115.169 0.02 . 1 . . . . . 175 THR N . 27005 1 219 . 1 1 176 176 ALA H H 1 7.952 0.01 . 1 . . . . . 176 ALA H . 27005 1 220 . 1 1 176 176 ALA N N 15 126.181 0.02 . 1 . . . . . 176 ALA N . 27005 1 221 . 1 1 180 180 GLY H H 1 7.701 0.01 . 1 . . . . . 180 GLY H . 27005 1 222 . 1 1 180 180 GLY N N 15 108.141 0.02 . 1 . . . . . 180 GLY N . 27005 1 223 . 1 1 182 182 TYR H H 1 8.929 0.01 . 1 . . . . . 182 TYR H . 27005 1 224 . 1 1 182 182 TYR N N 15 118.023 0.02 . 1 . . . . . 182 TYR N . 27005 1 225 . 1 1 184 184 LYS H H 1 7.441 0.01 . 1 . . . . . 184 LYS H . 27005 1 226 . 1 1 184 184 LYS N N 15 123.324 0.02 . 1 . . . . . 184 LYS N . 27005 1 227 . 1 1 185 185 GLU H H 1 7.734 0.01 . 1 . . . . . 185 GLU H . 27005 1 228 . 1 1 185 185 GLU N N 15 120.392 0.02 . 1 . . . . . 185 GLU N . 27005 1 229 . 1 1 187 187 GLU H H 1 7.921 0.01 . 1 . . . . . 187 GLU H . 27005 1 230 . 1 1 187 187 GLU N N 15 122.268 0.02 . 1 . . . . . 187 GLU N . 27005 1 231 . 1 1 188 188 ALA H H 1 7.402 0.01 . 1 . . . . . 188 ALA H . 27005 1 232 . 1 1 188 188 ALA N N 15 118.654 0.02 . 1 . . . . . 188 ALA N . 27005 1 233 . 1 1 189 189 GLY H H 1 7.775 0.01 . 1 . . . . . 189 GLY H . 27005 1 234 . 1 1 189 189 GLY N N 15 105.231 0.02 . 1 . . . . . 189 GLY N . 27005 1 235 . 1 1 190 190 ASN H H 1 8.096 0.01 . 1 . . . . . 190 ASN H . 27005 1 236 . 1 1 190 190 ASN N N 15 117.024 0.02 . 1 . . . . . 190 ASN N . 27005 1 237 . 1 1 192 192 LYS H H 1 7.78 0.01 . 1 . . . . . 192 LYS H . 27005 1 238 . 1 1 192 192 LYS N N 15 122.88 0.02 . 1 . . . . . 192 LYS N . 27005 1 239 . 1 1 193 193 TYR H H 1 8.372 0.01 . 1 . . . . . 193 TYR H . 27005 1 240 . 1 1 193 193 TYR N N 15 124.638 0.02 . 1 . . . . . 193 TYR N . 27005 1 241 . 1 1 194 194 ALA H H 1 8.31 0.01 . 1 . . . . . 194 ALA H . 27005 1 242 . 1 1 194 194 ALA N N 15 130.753 0.02 . 1 . . . . . 194 ALA N . 27005 1 243 . 1 1 196 196 VAL H H 1 9.154 0.01 . 1 . . . . . 196 VAL H . 27005 1 244 . 1 1 196 196 VAL N N 15 126.351 0.02 . 1 . . . . . 196 VAL N . 27005 1 245 . 1 1 197 197 ASP H H 1 8.711 0.01 . 1 . . . . . 197 ASP H . 27005 1 246 . 1 1 197 197 ASP N N 15 124.467 0.02 . 1 . . . . . 197 ASP N . 27005 1 247 . 1 1 198 198 GLY H H 1 8.36 0.01 . 1 . . . . . 198 GLY H . 27005 1 248 . 1 1 198 198 GLY N N 15 112.269 0.02 . 1 . . . . . 198 GLY N . 27005 1 249 . 1 1 199 199 THR H H 1 8.65 0.01 . 1 . . . . . 199 THR H . 27005 1 250 . 1 1 199 199 THR N N 15 111.544 0.02 . 1 . . . . . 199 THR N . 27005 1 251 . 1 1 200 200 LYS H H 1 6.423 0.01 . 1 . . . . . 200 LYS H . 27005 1 252 . 1 1 200 200 LYS N N 15 122.44 0.02 . 1 . . . . . 200 LYS N . 27005 1 253 . 1 1 202 202 VAL H H 1 8.238 0.01 . 1 . . . . . 202 VAL H . 27005 1 254 . 1 1 202 202 VAL N N 15 122.979 0.02 . 1 . . . . . 202 VAL N . 27005 1 255 . 1 1 203 203 ALA H H 1 8.78 0.01 . 1 . . . . . 203 ALA H . 27005 1 256 . 1 1 203 203 ALA N N 15 118.57 0.02 . 1 . . . . . 203 ALA N . 27005 1 257 . 1 1 204 204 GLU H H 1 7.342 0.01 . 1 . . . . . 204 GLU H . 27005 1 258 . 1 1 204 204 GLU N N 15 118.208 0.02 . 1 . . . . . 204 GLU N . 27005 1 259 . 1 1 205 205 VAL H H 1 7.891 0.01 . 1 . . . . . 205 VAL H . 27005 1 260 . 1 1 205 205 VAL N N 15 121.671 0.02 . 1 . . . . . 205 VAL N . 27005 1 261 . 1 1 207 207 ALA H H 1 7.191 0.01 . 1 . . . . . 207 ALA H . 27005 1 262 . 1 1 207 207 ALA N N 15 120.434 0.02 . 1 . . . . . 207 ALA N . 27005 1 263 . 1 1 209 209 LEU H H 1 8.378 0.01 . 1 . . . . . 209 LEU H . 27005 1 264 . 1 1 209 209 LEU N N 15 120.945 0.02 . 1 . . . . . 209 LEU N . 27005 1 265 . 1 1 212 212 ILE H H 1 7.393 0.01 . 1 . . . . . 212 ILE H . 27005 1 266 . 1 1 212 212 ILE N N 15 119.324 0.02 . 1 . . . . . 212 ILE N . 27005 1 stop_ save_