################################### # 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_chemical_shift_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode chemical_shift_1 _Assigned_chem_shift_list.Entry_ID 11375 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $condition_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $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 '3D 1H-15N NOESY' 1 $sample_1 isotropic 11375 1 2 '3D 1H-13C NOESY' 1 $sample_1 isotropic 11375 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 $OPAL . . 11375 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 8 8 GLN H H 1 8.161 0.030 . 1 . . . . 8 GLN H . 11375 1 2 . 1 1 8 8 GLN N N 15 119.870 0.300 . 1 . . . . 8 GLN N . 11375 1 3 . 1 1 9 9 LYS H H 1 8.390 0.030 . 1 . . . . 9 LYS H . 11375 1 4 . 1 1 9 9 LYS N N 15 123.239 0.300 . 1 . . . . 9 LYS N . 11375 1 5 . 1 1 10 10 LYS H H 1 8.403 0.030 . 1 . . . . 10 LYS H . 11375 1 6 . 1 1 10 10 LYS N N 15 123.239 0.300 . 1 . . . . 10 LYS N . 11375 1 7 . 1 1 11 11 ASP H H 1 8.421 0.030 . 1 . . . . 11 ASP H . 11375 1 8 . 1 1 11 11 ASP N N 15 122.133 0.300 . 1 . . . . 11 ASP N . 11375 1 9 . 1 1 12 12 THR H H 1 8.216 0.030 . 1 . . . . 12 THR H . 11375 1 10 . 1 1 12 12 THR N N 15 114.790 0.300 . 1 . . . . 12 THR N . 11375 1 11 . 1 1 13 13 SER H H 1 8.311 0.030 . 1 . . . . 13 SER H . 11375 1 12 . 1 1 13 13 SER N N 15 119.039 0.300 . 1 . . . . 13 SER N . 11375 1 13 . 1 1 14 14 ASN H H 1 8.246 0.030 . 1 . . . . 14 ASN H . 11375 1 14 . 1 1 14 14 ASN N N 15 119.162 0.300 . 1 . . . . 14 ASN N . 11375 1 15 . 1 1 15 15 HIS H H 1 7.370 0.030 . 1 . . . . 15 HIS H . 11375 1 16 . 1 1 15 15 HIS N N 15 119.122 0.300 . 1 . . . . 15 HIS N . 11375 1 17 . 1 1 16 16 PHE H H 1 8.488 0.030 . 1 . . . . 16 PHE H . 11375 1 18 . 1 1 16 16 PHE N N 15 117.443 0.300 . 1 . . . . 16 PHE N . 11375 1 19 . 1 1 17 17 HIS H H 1 9.094 0.030 . 1 . . . . 17 HIS H . 11375 1 20 . 1 1 17 17 HIS N N 15 124.835 0.300 . 1 . . . . 17 HIS N . 11375 1 21 . 1 1 18 18 VAL H H 1 9.765 0.030 . 1 . . . . 18 VAL H . 11375 1 22 . 1 1 18 18 VAL N N 15 126.130 0.300 . 1 . . . . 18 VAL N . 11375 1 23 . 1 1 19 19 PHE H H 1 9.040 0.030 . 1 . . . . 19 PHE H . 11375 1 24 . 1 1 19 19 PHE N N 15 127.714 0.300 . 1 . . . . 19 PHE N . 11375 1 25 . 1 1 20 20 VAL H H 1 7.699 0.030 . 1 . . . . 20 VAL H . 11375 1 26 . 1 1 20 20 VAL N N 15 126.758 0.300 . 1 . . . . 20 VAL N . 11375 1 27 . 1 1 21 21 GLY H H 1 8.617 0.030 . 1 . . . . 21 GLY H . 11375 1 28 . 1 1 21 21 GLY N N 15 111.005 0.300 . 1 . . . . 21 GLY N . 11375 1 29 . 1 1 22 22 ASP H H 1 8.395 0.030 . 1 . . . . 22 ASP H . 11375 1 30 . 1 1 22 22 ASP N N 15 115.375 0.300 . 1 . . . . 22 ASP N . 11375 1 31 . 1 1 23 23 LEU H H 1 7.639 0.030 . 1 . . . . 23 LEU H . 11375 1 32 . 1 1 23 23 LEU N N 15 112.424 0.300 . 1 . . . . 23 LEU N . 11375 1 33 . 1 1 24 24 SER H H 1 8.950 0.030 . 1 . . . . 24 SER H . 11375 1 34 . 1 1 24 24 SER N N 15 121.344 0.300 . 1 . . . . 24 SER N . 11375 1 35 . 1 1 26 26 GLU H H 1 9.066 0.030 . 1 . . . . 26 GLU H . 11375 1 36 . 1 1 26 26 GLU N N 15 116.054 0.300 . 1 . . . . 26 GLU N . 11375 1 37 . 1 1 27 27 ILE H H 1 7.369 0.030 . 1 . . . . 27 ILE H . 11375 1 38 . 1 1 27 27 ILE N N 15 121.809 0.300 . 1 . . . . 27 ILE N . 11375 1 39 . 1 1 28 28 THR H H 1 9.395 0.030 . 1 . . . . 28 THR H . 11375 1 40 . 1 1 28 28 THR N N 15 121.128 0.300 . 1 . . . . 28 THR N . 11375 1 41 . 1 1 29 29 THR H H 1 9.010 0.030 . 1 . . . . 29 THR H . 11375 1 42 . 1 1 29 29 THR N N 15 118.080 0.300 . 1 . . . . 29 THR N . 11375 1 43 . 1 1 30 30 GLU H H 1 8.380 0.030 . 1 . . . . 30 GLU H . 11375 1 44 . 1 1 30 30 GLU N N 15 119.903 0.300 . 1 . . . . 30 GLU N . 11375 1 45 . 1 1 31 31 ASP H H 1 7.677 0.030 . 1 . . . . 31 ASP H . 11375 1 46 . 1 1 31 31 ASP N N 15 119.990 0.300 . 1 . . . . 31 ASP N . 11375 1 47 . 1 1 32 32 ILE H H 1 7.872 0.030 . 1 . . . . 32 ILE H . 11375 1 48 . 1 1 32 32 ILE N N 15 118.196 0.300 . 1 . . . . 32 ILE N . 11375 1 49 . 1 1 33 33 LYS H H 1 8.230 0.030 . 1 . . . . 33 LYS H . 11375 1 50 . 1 1 33 33 LYS N N 15 121.254 0.300 . 1 . . . . 33 LYS N . 11375 1 51 . 1 1 34 34 ALA H H 1 7.745 0.030 . 1 . . . . 34 ALA H . 11375 1 52 . 1 1 34 34 ALA N N 15 118.266 0.300 . 1 . . . . 34 ALA N . 11375 1 53 . 1 1 35 35 ALA H H 1 7.832 0.030 . 1 . . . . 35 ALA H . 11375 1 54 . 1 1 35 35 ALA N N 15 118.087 0.300 . 1 . . . . 35 ALA N . 11375 1 55 . 1 1 36 36 PHE H H 1 7.975 0.030 . 1 . . . . 36 PHE H . 11375 1 56 . 1 1 36 36 PHE N N 15 112.069 0.300 . 1 . . . . 36 PHE N . 11375 1 57 . 1 1 37 37 ALA H H 1 7.989 0.030 . 1 . . . . 37 ALA H . 11375 1 58 . 1 1 37 37 ALA N N 15 125.144 0.300 . 1 . . . . 37 ALA N . 11375 1 59 . 1 1 39 39 PHE H H 1 7.719 0.030 . 1 . . . . 39 PHE H . 11375 1 60 . 1 1 39 39 PHE N N 15 112.740 0.300 . 1 . . . . 39 PHE N . 11375 1 61 . 1 1 40 40 GLY H H 1 7.604 0.030 . 1 . . . . 40 GLY H . 11375 1 62 . 1 1 40 40 GLY N N 15 104.806 0.300 . 1 . . . . 40 GLY N . 11375 1 63 . 1 1 41 41 ARG H H 1 8.241 0.030 . 1 . . . . 41 ARG H . 11375 1 64 . 1 1 41 41 ARG N N 15 117.050 0.300 . 1 . . . . 41 ARG N . 11375 1 65 . 1 1 42 42 ILE H H 1 8.472 0.030 . 1 . . . . 42 ILE H . 11375 1 66 . 1 1 42 42 ILE N N 15 127.737 0.300 . 1 . . . . 42 ILE N . 11375 1 67 . 1 1 43 43 SER H H 1 8.813 0.030 . 1 . . . . 43 SER H . 11375 1 68 . 1 1 43 43 SER N N 15 123.021 0.300 . 1 . . . . 43 SER N . 11375 1 69 . 1 1 44 44 ASP H H 1 7.295 0.030 . 1 . . . . 44 ASP H . 11375 1 70 . 1 1 44 44 ASP N N 15 119.575 0.300 . 1 . . . . 44 ASP N . 11375 1 71 . 1 1 45 45 ALA H H 1 8.031 0.030 . 1 . . . . 45 ALA H . 11375 1 72 . 1 1 45 45 ALA N N 15 120.547 0.300 . 1 . . . . 45 ALA N . 11375 1 73 . 1 1 46 46 ARG H H 1 8.838 0.030 . 1 . . . . 46 ARG H . 11375 1 74 . 1 1 46 46 ARG N N 15 116.035 0.300 . 1 . . . . 46 ARG N . 11375 1 75 . 1 1 47 47 VAL H H 1 7.642 0.030 . 1 . . . . 47 VAL H . 11375 1 76 . 1 1 47 47 VAL N N 15 124.088 0.300 . 1 . . . . 47 VAL N . 11375 1 77 . 1 1 48 48 VAL H H 1 8.361 0.030 . 1 . . . . 48 VAL H . 11375 1 78 . 1 1 48 48 VAL N N 15 130.567 0.300 . 1 . . . . 48 VAL N . 11375 1 79 . 1 1 49 49 LYS H H 1 8.101 0.030 . 1 . . . . 49 LYS H . 11375 1 80 . 1 1 49 49 LYS N N 15 125.357 0.300 . 1 . . . . 49 LYS N . 11375 1 81 . 1 1 50 50 ASP H H 1 8.655 0.030 . 1 . . . . 50 ASP H . 11375 1 82 . 1 1 50 50 ASP N N 15 121.840 0.300 . 1 . . . . 50 ASP N . 11375 1 83 . 1 1 51 51 MET H H 1 9.040 0.030 . 1 . . . . 51 MET H . 11375 1 84 . 1 1 51 51 MET N N 15 127.153 0.300 . 1 . . . . 51 MET N . 11375 1 85 . 1 1 52 52 ALA H H 1 8.598 0.030 . 1 . . . . 52 ALA H . 11375 1 86 . 1 1 52 52 ALA N N 15 120.829 0.300 . 1 . . . . 52 ALA N . 11375 1 87 . 1 1 53 53 THR H H 1 7.706 0.030 . 1 . . . . 53 THR H . 11375 1 88 . 1 1 53 53 THR N N 15 104.999 0.300 . 1 . . . . 53 THR N . 11375 1 89 . 1 1 54 54 GLY H H 1 8.491 0.030 . 1 . . . . 54 GLY H . 11375 1 90 . 1 1 54 54 GLY N N 15 111.488 0.300 . 1 . . . . 54 GLY N . 11375 1 91 . 1 1 55 55 LYS H H 1 7.710 0.030 . 1 . . . . 55 LYS H . 11375 1 92 . 1 1 55 55 LYS N N 15 119.224 0.300 . 1 . . . . 55 LYS N . 11375 1 93 . 1 1 56 56 SER H H 1 8.707 0.030 . 1 . . . . 56 SER H . 11375 1 94 . 1 1 56 56 SER N N 15 115.239 0.300 . 1 . . . . 56 SER N . 11375 1 95 . 1 1 57 57 LYS H H 1 9.222 0.030 . 1 . . . . 57 LYS H . 11375 1 96 . 1 1 57 57 LYS N N 15 125.377 0.300 . 1 . . . . 57 LYS N . 11375 1 97 . 1 1 58 58 GLY H H 1 8.931 0.030 . 1 . . . . 58 GLY H . 11375 1 98 . 1 1 58 58 GLY N N 15 105.420 0.300 . 1 . . . . 58 GLY N . 11375 1 99 . 1 1 59 59 TYR H H 1 6.979 0.030 . 1 . . . . 59 TYR H . 11375 1 100 . 1 1 59 59 TYR N N 15 112.750 0.300 . 1 . . . . 59 TYR N . 11375 1 101 . 1 1 60 60 GLY H H 1 8.724 0.030 . 1 . . . . 60 GLY H . 11375 1 102 . 1 1 60 60 GLY N N 15 106.517 0.300 . 1 . . . . 60 GLY N . 11375 1 103 . 1 1 61 61 PHE H H 1 8.494 0.030 . 1 . . . . 61 PHE H . 11375 1 104 . 1 1 61 61 PHE N N 15 113.297 0.300 . 1 . . . . 61 PHE N . 11375 1 105 . 1 1 62 62 VAL H H 1 8.930 0.030 . 1 . . . . 62 VAL H . 11375 1 106 . 1 1 62 62 VAL N N 15 119.804 0.300 . 1 . . . . 62 VAL N . 11375 1 107 . 1 1 63 63 SER H H 1 8.654 0.030 . 1 . . . . 63 SER H . 11375 1 108 . 1 1 63 63 SER N N 15 121.903 0.300 . 1 . . . . 63 SER N . 11375 1 109 . 1 1 64 64 PHE H H 1 9.271 0.030 . 1 . . . . 64 PHE H . 11375 1 110 . 1 1 64 64 PHE N N 15 121.708 0.300 . 1 . . . . 64 PHE N . 11375 1 111 . 1 1 65 65 PHE H H 1 7.710 0.030 . 1 . . . . 65 PHE H . 11375 1 112 . 1 1 65 65 PHE N N 15 117.884 0.300 . 1 . . . . 65 PHE N . 11375 1 113 . 1 1 66 66 ASN H H 1 8.564 0.030 . 1 . . . . 66 ASN H . 11375 1 114 . 1 1 66 66 ASN N N 15 113.918 0.300 . 1 . . . . 66 ASN N . 11375 1 115 . 1 1 67 67 LYS H H 1 8.188 0.030 . 1 . . . . 67 LYS H . 11375 1 116 . 1 1 67 67 LYS N N 15 126.583 0.300 . 1 . . . . 67 LYS N . 11375 1 117 . 1 1 68 68 TRP H H 1 7.578 0.030 . 1 . . . . 68 TRP H . 11375 1 118 . 1 1 68 68 TRP N N 15 116.605 0.300 . 1 . . . . 68 TRP N . 11375 1 119 . 1 1 69 69 ASP H H 1 6.892 0.030 . 1 . . . . 69 ASP H . 11375 1 120 . 1 1 69 69 ASP N N 15 121.216 0.300 . 1 . . . . 69 ASP N . 11375 1 121 . 1 1 70 70 ALA H H 1 6.623 0.030 . 1 . . . . 70 ALA H . 11375 1 122 . 1 1 70 70 ALA N N 15 119.748 0.300 . 1 . . . . 70 ALA N . 11375 1 123 . 1 1 71 71 GLU H H 1 8.373 0.030 . 1 . . . . 71 GLU H . 11375 1 124 . 1 1 71 71 GLU N N 15 117.093 0.300 . 1 . . . . 71 GLU N . 11375 1 125 . 1 1 72 72 ASN H H 1 7.956 0.030 . 1 . . . . 72 ASN H . 11375 1 126 . 1 1 72 72 ASN N N 15 118.013 0.300 . 1 . . . . 72 ASN N . 11375 1 127 . 1 1 73 73 ALA H H 1 7.925 0.030 . 1 . . . . 73 ALA H . 11375 1 128 . 1 1 73 73 ALA N N 15 121.706 0.300 . 1 . . . . 73 ALA N . 11375 1 129 . 1 1 74 74 ILE H H 1 8.058 0.030 . 1 . . . . 74 ILE H . 11375 1 130 . 1 1 74 74 ILE N N 15 116.362 0.300 . 1 . . . . 74 ILE N . 11375 1 131 . 1 1 75 75 GLN H H 1 7.603 0.030 . 1 . . . . 75 GLN H . 11375 1 132 . 1 1 75 75 GLN N N 15 117.023 0.300 . 1 . . . . 75 GLN N . 11375 1 133 . 1 1 76 76 GLN H H 1 8.472 0.030 . 1 . . . . 76 GLN H . 11375 1 134 . 1 1 76 76 GLN N N 15 114.616 0.300 . 1 . . . . 76 GLN N . 11375 1 135 . 1 1 77 77 MET H H 1 7.637 0.030 . 1 . . . . 77 MET H . 11375 1 136 . 1 1 77 77 MET N N 15 112.977 0.300 . 1 . . . . 77 MET N . 11375 1 137 . 1 1 78 78 GLY H H 1 6.984 0.030 . 1 . . . . 78 GLY H . 11375 1 138 . 1 1 78 78 GLY N N 15 106.914 0.300 . 1 . . . . 78 GLY N . 11375 1 139 . 1 1 79 79 GLY H H 1 8.414 0.030 . 1 . . . . 79 GLY H . 11375 1 140 . 1 1 79 79 GLY N N 15 115.380 0.300 . 1 . . . . 79 GLY N . 11375 1 141 . 1 1 80 80 GLN H H 1 7.579 0.030 . 1 . . . . 80 GLN H . 11375 1 142 . 1 1 80 80 GLN N N 15 118.970 0.300 . 1 . . . . 80 GLN N . 11375 1 143 . 1 1 81 81 TRP H H 1 8.626 0.030 . 1 . . . . 81 TRP H . 11375 1 144 . 1 1 81 81 TRP N N 15 120.834 0.300 . 1 . . . . 81 TRP N . 11375 1 145 . 1 1 82 82 LEU H H 1 8.580 0.030 . 1 . . . . 82 LEU H . 11375 1 146 . 1 1 82 82 LEU N N 15 125.912 0.300 . 1 . . . . 82 LEU N . 11375 1 147 . 1 1 83 83 GLY H H 1 9.309 0.030 . 1 . . . . 83 GLY H . 11375 1 148 . 1 1 83 83 GLY N N 15 115.490 0.300 . 1 . . . . 83 GLY N . 11375 1 149 . 1 1 84 84 GLY H H 1 8.713 0.030 . 1 . . . . 84 GLY H . 11375 1 150 . 1 1 84 84 GLY N N 15 108.070 0.300 . 1 . . . . 84 GLY N . 11375 1 151 . 1 1 85 85 ARG H H 1 7.622 0.030 . 1 . . . . 85 ARG H . 11375 1 152 . 1 1 85 85 ARG N N 15 118.385 0.300 . 1 . . . . 85 ARG N . 11375 1 153 . 1 1 86 86 GLN H H 1 7.781 0.030 . 1 . . . . 86 GLN H . 11375 1 154 . 1 1 86 86 GLN N N 15 121.687 0.300 . 1 . . . . 86 GLN N . 11375 1 155 . 1 1 87 87 ILE H H 1 8.144 0.030 . 1 . . . . 87 ILE H . 11375 1 156 . 1 1 87 87 ILE N N 15 117.795 0.300 . 1 . . . . 87 ILE N . 11375 1 157 . 1 1 88 88 ARG H H 1 7.929 0.030 . 1 . . . . 88 ARG H . 11375 1 158 . 1 1 88 88 ARG N N 15 119.474 0.300 . 1 . . . . 88 ARG N . 11375 1 159 . 1 1 89 89 THR H H 1 8.416 0.030 . 1 . . . . 89 THR H . 11375 1 160 . 1 1 89 89 THR N N 15 109.928 0.300 . 1 . . . . 89 THR N . 11375 1 161 . 1 1 90 90 ASN H H 1 8.781 0.030 . 1 . . . . 90 ASN H . 11375 1 162 . 1 1 90 90 ASN N N 15 115.722 0.300 . 1 . . . . 90 ASN N . 11375 1 163 . 1 1 91 91 TRP H H 1 8.505 0.030 . 1 . . . . 91 TRP H . 11375 1 164 . 1 1 91 91 TRP N N 15 121.444 0.300 . 1 . . . . 91 TRP N . 11375 1 165 . 1 1 92 92 ALA H H 1 8.871 0.030 . 1 . . . . 92 ALA H . 11375 1 166 . 1 1 92 92 ALA N N 15 126.392 0.300 . 1 . . . . 92 ALA N . 11375 1 167 . 1 1 94 94 ARG H H 1 8.157 0.030 . 1 . . . . 94 ARG H . 11375 1 168 . 1 1 94 94 ARG N N 15 122.387 0.300 . 1 . . . . 94 ARG N . 11375 1 169 . 1 1 95 95 LYS H H 1 8.230 0.030 . 1 . . . . 95 LYS H . 11375 1 170 . 1 1 95 95 LYS N N 15 123.691 0.300 . 1 . . . . 95 LYS N . 11375 1 171 . 1 1 98 98 ALA H H 1 8.316 0.030 . 1 . . . . 98 ALA H . 11375 1 172 . 1 1 98 98 ALA N N 15 125.602 0.300 . 1 . . . . 98 ALA N . 11375 1 173 . 1 1 100 100 LYS H H 1 8.417 0.030 . 1 . . . . 100 LYS H . 11375 1 174 . 1 1 100 100 LYS N N 15 121.864 0.300 . 1 . . . . 100 LYS N . 11375 1 175 . 1 1 101 101 SER H H 1 8.379 0.030 . 1 . . . . 101 SER H . 11375 1 176 . 1 1 101 101 SER N N 15 116.941 0.300 . 1 . . . . 101 SER N . 11375 1 177 . 1 1 102 102 THR H H 1 8.132 0.030 . 1 . . . . 102 THR H . 11375 1 178 . 1 1 102 102 THR N N 15 115.628 0.300 . 1 . . . . 102 THR N . 11375 1 179 . 1 1 103 103 TYR H H 1 8.126 0.030 . 1 . . . . 103 TYR H . 11375 1 180 . 1 1 103 103 TYR N N 15 121.905 0.300 . 1 . . . . 103 TYR N . 11375 1 181 . 1 1 104 104 GLU H H 1 8.226 0.030 . 1 . . . . 104 GLU H . 11375 1 182 . 1 1 104 104 GLU N N 15 122.689 0.300 . 1 . . . . 104 GLU N . 11375 1 183 . 1 1 105 105 SER H H 1 8.279 0.030 . 1 . . . . 105 SER H . 11375 1 184 . 1 1 105 105 SER N N 15 116.823 0.300 . 1 . . . . 105 SER N . 11375 1 185 . 1 1 107 107 THR H H 1 8.080 0.030 . 1 . . . . 107 THR H . 11375 1 186 . 1 1 107 107 THR N N 15 114.229 0.300 . 1 . . . . 107 THR N . 11375 1 187 . 1 1 108 108 LYS H H 1 8.274 0.030 . 1 . . . . 108 LYS H . 11375 1 188 . 1 1 108 108 LYS N N 15 123.629 0.300 . 1 . . . . 108 LYS N . 11375 1 189 . 1 1 109 109 GLN H H 1 8.388 0.030 . 1 . . . . 109 GLN H . 11375 1 190 . 1 1 109 109 GLN N N 15 121.432 0.300 . 1 . . . . 109 GLN N . 11375 1 191 . 1 1 110 110 SER H H 1 8.443 0.030 . 1 . . . . 110 SER H . 11375 1 192 . 1 1 110 110 SER N N 15 117.406 0.300 . 1 . . . . 110 SER N . 11375 1 193 . 1 1 111 111 GLY H H 1 8.242 0.030 . 1 . . . . 111 GLY H . 11375 1 194 . 1 1 111 111 GLY N N 15 110.755 0.300 . 1 . . . . 111 GLY N . 11375 1 195 . 1 1 113 113 SER H H 1 8.527 0.030 . 1 . . . . 113 SER H . 11375 1 196 . 1 1 113 113 SER N N 15 116.727 0.300 . 1 . . . . 113 SER N . 11375 1 197 . 1 1 114 114 SER H H 1 8.306 0.030 . 1 . . . . 114 SER H . 11375 1 198 . 1 1 114 114 SER N N 15 117.833 0.300 . 1 . . . . 114 SER N . 11375 1 199 . 1 1 115 115 GLY H H 1 8.031 0.030 . 1 . . . . 115 GLY H . 11375 1 200 . 1 1 115 115 GLY N N 15 116.861 0.300 . 1 . . . . 115 GLY N . 11375 1 stop_ save_