################################### # 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_chem_shift_list_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1 _Assigned_chem_shift_list.Entry_ID 26701 _Assigned_chem_shift_list.ID 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 $chemical_shift_reference_1 _Assigned_chem_shift_list.Chem_shift_1H_err 0.05 _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err 0.2 _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' . . . 26701 1 2 '3D HNCA' . . . 26701 1 3 '3D HNCACB' . . . 26701 1 4 '3D CBCA(CO)NH' . . . 26701 1 5 '3D 1H-15N NOESY' . . . 26701 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 $SPARKY . . 26701 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 6 6 ASN H H 1 8.161 0.05 . 1 . . . . 53 ASN HN . 26701 1 2 . 1 1 6 6 ASN N N 15 119.676 0.2 . 1 . . . . 53 ASN N . 26701 1 3 . 1 1 7 7 MET H H 1 8.476 0.05 . 1 . . . . 54 MET HN . 26701 1 4 . 1 1 7 7 MET N N 15 120.341 0.2 . 1 . . . . 54 MET N . 26701 1 5 . 1 1 8 8 LYS H H 1 8.352 0.05 . 1 . . . . 55 LYS HN . 26701 1 6 . 1 1 8 8 LYS N N 15 121.240 0.2 . 1 . . . . 55 LYS N . 26701 1 7 . 1 1 9 9 LEU H H 1 8.472 0.05 . 1 . . . . 56 LEU HN . 26701 1 8 . 1 1 9 9 LEU N N 15 124.542 0.2 . 1 . . . . 56 LEU N . 26701 1 9 . 1 1 10 10 GLY H H 1 8.285 0.05 . 1 . . . . 57 GLY HN . 26701 1 10 . 1 1 10 10 GLY N N 15 109.107 0.2 . 1 . . . . 57 GLY N . 26701 1 11 . 1 1 11 11 GLN H H 1 8.859 0.05 . 1 . . . . 58 GLN HN . 26701 1 12 . 1 1 11 11 GLN N N 15 122.279 0.2 . 1 . . . . 58 GLN N . 26701 1 13 . 1 1 12 12 LYS H H 1 8.609 0.05 . 1 . . . . 59 LYS HN . 26701 1 14 . 1 1 12 12 LYS N N 15 126.919 0.2 . 1 . . . . 59 LYS N . 26701 1 15 . 1 1 13 13 VAL H H 1 9.515 0.05 . 1 . . . . 60 VAL HN . 26701 1 16 . 1 1 13 13 VAL N N 15 125.367 0.2 . 1 . . . . 60 VAL N . 26701 1 17 . 1 1 14 14 LEU H H 1 8.498 0.05 . 1 . . . . 61 LEU HN . 26701 1 18 . 1 1 14 14 LEU N N 15 127.701 0.2 . 1 . . . . 61 LEU N . 26701 1 19 . 1 1 15 15 ILE H H 1 7.597 0.05 . 1 . . . . 62 ILE HN . 26701 1 20 . 1 1 15 15 ILE N N 15 123.481 0.2 . 1 . . . . 62 ILE N . 26701 1 21 . 1 1 17 17 VAL H H 1 8.730 0.05 . 1 . . . . 64 VAL HN . 26701 1 22 . 1 1 17 17 VAL N N 15 121.954 0.2 . 1 . . . . 64 VAL N . 26701 1 23 . 1 1 18 18 LYS H H 1 8.306 0.05 . 1 . . . . 65 LYS HN . 26701 1 24 . 1 1 18 18 LYS N N 15 117.204 0.2 . 1 . . . . 65 LYS N . 26701 1 25 . 1 1 19 19 GLN H H 1 7.396 0.05 . 1 . . . . 66 GLN HN . 26701 1 26 . 1 1 19 19 GLN N N 15 117.423 0.2 . 1 . . . . 66 GLN N . 26701 1 27 . 1 1 20 20 PHE H H 1 7.308 0.05 . 1 . . . . 67 PHE HN . 26701 1 28 . 1 1 20 20 PHE N N 15 115.496 0.2 . 1 . . . . 67 PHE N . 26701 1 29 . 1 1 22 22 LYS H H 1 8.699 0.05 . 1 . . . . 69 LYS HN . 26701 1 30 . 1 1 22 22 LYS N N 15 116.568 0.2 . 1 . . . . 69 LYS N . 26701 1 31 . 1 1 23 23 PHE H H 1 7.554 0.05 . 1 . . . . 70 PHE HN . 26701 1 32 . 1 1 23 23 PHE N N 15 121.075 0.2 . 1 . . . . 70 PHE N . 26701 1 33 . 1 1 25 25 PHE H H 1 8.134 0.05 . 1 . . . . 72 PHE HN . 26701 1 34 . 1 1 25 25 PHE N N 15 124.405 0.2 . 1 . . . . 72 PHE N . 26701 1 35 . 1 1 26 26 VAL H H 1 8.322 0.05 . 1 . . . . 73 VAL HN . 26701 1 36 . 1 1 26 26 VAL N N 15 118.712 0.2 . 1 . . . . 73 VAL N . 26701 1 37 . 1 1 27 27 GLY H H 1 7.561 0.05 . 1 . . . . 74 GLY HN . 26701 1 38 . 1 1 27 27 GLY N N 15 104.215 0.2 . 1 . . . . 74 GLY N . 26701 1 39 . 1 1 28 28 LYS H H 1 7.190 0.05 . 1 . . . . 75 LYS HN . 26701 1 40 . 1 1 28 28 LYS N N 15 122.210 0.2 . 1 . . . . 75 LYS N . 26701 1 41 . 1 1 29 29 LEU H H 1 8.112 0.05 . 1 . . . . 76 LEU HN . 26701 1 42 . 1 1 29 29 LEU N N 15 118.541 0.2 . 1 . . . . 76 LEU N . 26701 1 43 . 1 1 30 30 LEU H H 1 7.980 0.05 . 1 . . . . 77 LEU HN . 26701 1 44 . 1 1 30 30 LEU N N 15 113.462 0.2 . 1 . . . . 77 LEU N . 26701 1 45 . 1 1 31 31 GLY H H 1 7.656 0.05 . 1 . . . . 78 GLY HN . 26701 1 46 . 1 1 31 31 GLY N N 15 105.358 0.2 . 1 . . . . 78 GLY N . 26701 1 47 . 1 1 33 33 ARG H H 1 8.306 0.05 . 1 . . . . 80 ARG HN . 26701 1 48 . 1 1 33 33 ARG N N 15 120.326 0.2 . 1 . . . . 80 ARG N . 26701 1 49 . 1 1 34 34 GLY H H 1 7.734 0.05 . 1 . . . . 81 GLY HN . 26701 1 50 . 1 1 34 34 GLY N N 15 106.597 0.2 . 1 . . . . 81 GLY N . 26701 1 51 . 1 1 35 35 ASN H H 1 8.223 0.05 . 1 . . . . 82 ASN HN . 26701 1 52 . 1 1 35 35 ASN N N 15 117.577 0.2 . 1 . . . . 82 ASN N . 26701 1 53 . 1 1 36 36 SER H H 1 8.744 0.05 . 1 . . . . 83 SER HN . 26701 1 54 . 1 1 36 36 SER N N 15 118.129 0.2 . 1 . . . . 83 SER N . 26701 1 55 . 1 1 37 37 LEU H H 1 7.453 0.05 . 1 . . . . 84 LEU HN . 26701 1 56 . 1 1 37 37 LEU N N 15 124.445 0.2 . 1 . . . . 84 LEU N . 26701 1 57 . 1 1 38 38 LYS H H 1 7.796 0.05 . 1 . . . . 85 LYS HN . 26701 1 58 . 1 1 38 38 LYS N N 15 120.999 0.2 . 1 . . . . 85 LYS N . 26701 1 59 . 1 1 39 39 ARG H H 1 7.869 0.05 . 1 . . . . 86 ARG HN . 26701 1 60 . 1 1 39 39 ARG N N 15 119.074 0.2 . 1 . . . . 86 ARG N . 26701 1 61 . 1 1 40 40 LEU H H 1 7.974 0.05 . 1 . . . . 87 LEU HN . 26701 1 62 . 1 1 40 40 LEU N N 15 119.949 0.2 . 1 . . . . 87 LEU N . 26701 1 63 . 1 1 41 41 GLN H H 1 8.031 0.05 . 1 . . . . 88 GLN HN . 26701 1 64 . 1 1 41 41 GLN N N 15 120.547 0.2 . 1 . . . . 88 GLN N . 26701 1 65 . 1 1 42 42 GLU H H 1 7.906 0.05 . 1 . . . . 89 GLU HN . 26701 1 66 . 1 1 42 42 GLU N N 15 120.045 0.2 . 1 . . . . 89 GLU N . 26701 1 67 . 1 1 43 43 GLU H H 1 8.590 0.05 . 1 . . . . 90 GLU HN . 26701 1 68 . 1 1 43 43 GLU N N 15 116.829 0.2 . 1 . . . . 90 GLU N . 26701 1 69 . 1 1 44 44 THR H H 1 7.527 0.05 . 1 . . . . 91 THR HN . 26701 1 70 . 1 1 44 44 THR N N 15 104.234 0.2 . 1 . . . . 91 THR N . 26701 1 71 . 1 1 45 45 LEU H H 1 7.894 0.05 . 1 . . . . 92 LEU HN . 26701 1 72 . 1 1 45 45 LEU N N 15 119.190 0.2 . 1 . . . . 92 LEU N . 26701 1 73 . 1 1 46 46 THR H H 1 7.783 0.05 . 1 . . . . 93 THR HN . 26701 1 74 . 1 1 46 46 THR N N 15 106.827 0.2 . 1 . . . . 93 THR N . 26701 1 75 . 1 1 47 47 LYS H H 1 8.642 0.05 . 1 . . . . 94 LYS HN . 26701 1 76 . 1 1 47 47 LYS N N 15 119.091 0.2 . 1 . . . . 94 LYS N . 26701 1 77 . 1 1 48 48 MET H H 1 8.398 0.05 . 1 . . . . 95 MET HN . 26701 1 78 . 1 1 48 48 MET N N 15 122.641 0.2 . 1 . . . . 95 MET N . 26701 1 79 . 1 1 49 49 SER H H 1 8.179 0.05 . 1 . . . . 96 SER HN . 26701 1 80 . 1 1 49 49 SER N N 15 114.412 0.2 . 1 . . . . 96 SER N . 26701 1 81 . 1 1 50 50 ILE H H 1 8.594 0.05 . 1 . . . . 97 ILE HN . 26701 1 82 . 1 1 50 50 ILE N N 15 124.909 0.2 . 1 . . . . 97 ILE N . 26701 1 83 . 1 1 51 51 LEU H H 1 8.447 0.05 . 1 . . . . 98 LEU HN . 26701 1 84 . 1 1 51 51 LEU N N 15 129.526 0.2 . 1 . . . . 98 LEU N . 26701 1 85 . 1 1 52 52 GLY H H 1 10.006 0.05 . 1 . . . . 99 GLY HN . 26701 1 86 . 1 1 52 52 GLY N N 15 106.940 0.2 . 1 . . . . 99 GLY N . 26701 1 87 . 1 1 53 53 LYS H H 1 8.778 0.05 . 1 . . . . 100 LYS HN . 26701 1 88 . 1 1 53 53 LYS N N 15 121.461 0.2 . 1 . . . . 100 LYS N . 26701 1 89 . 1 1 54 54 GLY H H 1 11.040 0.05 . 1 . . . . 101 GLY HN . 26701 1 90 . 1 1 54 54 GLY N N 15 117.119 0.2 . 1 . . . . 101 GLY N . 26701 1 91 . 1 1 55 55 SER H H 1 8.335 0.05 . 1 . . . . 102 SER HN . 26701 1 92 . 1 1 55 55 SER N N 15 115.364 0.2 . 1 . . . . 102 SER N . 26701 1 93 . 1 1 56 56 MET H H 1 8.300 0.05 . 1 . . . . 103 MET HN . 26701 1 94 . 1 1 56 56 MET N N 15 119.334 0.2 . 1 . . . . 103 MET N . 26701 1 95 . 1 1 57 57 ARG H H 1 7.944 0.05 . 1 . . . . 104 ARG HN . 26701 1 96 . 1 1 57 57 ARG N N 15 117.595 0.2 . 1 . . . . 104 ARG N . 26701 1 97 . 1 1 58 58 ASP H H 1 7.770 0.05 . 1 . . . . 105 ASP HN . 26701 1 98 . 1 1 58 58 ASP N N 15 117.141 0.2 . 1 . . . . 105 ASP N . 26701 1 99 . 1 1 59 59 LYS H H 1 8.508 0.05 . 1 . . . . 106 LYS HN . 26701 1 100 . 1 1 59 59 LYS N N 15 126.244 0.2 . 1 . . . . 106 LYS N . 26701 1 101 . 1 1 60 60 ALA H H 1 8.136 0.05 . 1 . . . . 107 ALA HN . 26701 1 102 . 1 1 60 60 ALA N N 15 122.075 0.2 . 1 . . . . 107 ALA N . 26701 1 103 . 1 1 61 61 LYS H H 1 7.727 0.05 . 1 . . . . 108 LYS HN . 26701 1 104 . 1 1 61 61 LYS N N 15 120.914 0.2 . 1 . . . . 108 LYS N . 26701 1 105 . 1 1 62 62 GLU H H 1 8.168 0.05 . 1 . . . . 109 GLU HN . 26701 1 106 . 1 1 62 62 GLU N N 15 118.441 0.2 . 1 . . . . 109 GLU N . 26701 1 107 . 1 1 63 63 GLU H H 1 7.729 0.05 . 1 . . . . 110 GLU HN . 26701 1 108 . 1 1 63 63 GLU N N 15 117.279 0.2 . 1 . . . . 110 GLU N . 26701 1 109 . 1 1 64 64 GLU H H 1 7.524 0.05 . 1 . . . . 111 GLU HN . 26701 1 110 . 1 1 64 64 GLU N N 15 119.006 0.2 . 1 . . . . 111 GLU N . 26701 1 111 . 1 1 65 65 LEU H H 1 8.163 0.05 . 1 . . . . 112 LEU HN . 26701 1 112 . 1 1 65 65 LEU N N 15 119.412 0.2 . 1 . . . . 112 LEU N . 26701 1 113 . 1 1 66 66 ARG H H 1 8.621 0.05 . 1 . . . . 113 ARG HN . 26701 1 114 . 1 1 66 66 ARG N N 15 122.515 0.2 . 1 . . . . 113 ARG N . 26701 1 115 . 1 1 67 67 LYS H H 1 7.883 0.05 . 1 . . . . 114 LYS HN . 26701 1 116 . 1 1 67 67 LYS N N 15 117.232 0.2 . 1 . . . . 114 LYS N . 26701 1 117 . 1 1 68 68 SER H H 1 7.608 0.05 . 1 . . . . 115 SER HN . 26701 1 118 . 1 1 68 68 SER N N 15 114.676 0.2 . 1 . . . . 115 SER N . 26701 1 119 . 1 1 69 69 GLY H H 1 7.650 0.05 . 1 . . . . 116 GLY HN . 26701 1 120 . 1 1 69 69 GLY N N 15 109.029 0.2 . 1 . . . . 116 GLY N . 26701 1 121 . 1 1 70 70 GLU H H 1 7.861 0.05 . 1 . . . . 117 GLU HN . 26701 1 122 . 1 1 70 70 GLU N N 15 120.058 0.2 . 1 . . . . 117 GLU N . 26701 1 123 . 1 1 71 71 ALA H H 1 8.623 0.05 . 1 . . . . 118 ALA HN . 26701 1 124 . 1 1 71 71 ALA N N 15 130.195 0.2 . 1 . . . . 118 ALA N . 26701 1 125 . 1 1 72 72 LYS H H 1 8.235 0.05 . 1 . . . . 119 LYS HN . 26701 1 126 . 1 1 72 72 LYS N N 15 116.297 0.2 . 1 . . . . 119 LYS N . 26701 1 127 . 1 1 73 73 TYR H H 1 7.348 0.05 . 1 . . . . 120 TYR HN . 26701 1 128 . 1 1 73 73 TYR N N 15 115.320 0.2 . 1 . . . . 120 TYR N . 26701 1 129 . 1 1 74 74 PHE H H 1 7.765 0.05 . 1 . . . . 121 PHE HN . 26701 1 130 . 1 1 74 74 PHE N N 15 122.014 0.2 . 1 . . . . 121 PHE N . 26701 1 131 . 1 1 75 75 HIS H H 1 8.306 0.05 . 1 . . . . 122 HIS HN . 26701 1 132 . 1 1 75 75 HIS N N 15 117.568 0.2 . 1 . . . . 122 HIS N . 26701 1 133 . 1 1 76 76 LEU H H 1 7.210 0.05 . 1 . . . . 123 LEU HN . 26701 1 134 . 1 1 76 76 LEU N N 15 119.125 0.2 . 1 . . . . 123 LEU N . 26701 1 135 . 1 1 77 77 ASN H H 1 7.724 0.05 . 1 . . . . 124 ASN HN . 26701 1 136 . 1 1 77 77 ASN N N 15 114.587 0.2 . 1 . . . . 124 ASN N . 26701 1 137 . 1 1 78 78 ASP H H 1 8.137 0.05 . 1 . . . . 125 ASP HN . 26701 1 138 . 1 1 78 78 ASP N N 15 122.232 0.2 . 1 . . . . 125 ASP N . 26701 1 139 . 1 1 79 79 ASP H H 1 8.610 0.05 . 1 . . . . 126 ASP HN . 26701 1 140 . 1 1 79 79 ASP N N 15 119.283 0.2 . 1 . . . . 126 ASP N . 26701 1 141 . 1 1 80 80 LEU H H 1 8.391 0.05 . 1 . . . . 127 LEU HN . 26701 1 142 . 1 1 80 80 LEU N N 15 124.482 0.2 . 1 . . . . 127 LEU N . 26701 1 143 . 1 1 81 81 HIS H H 1 9.176 0.05 . 1 . . . . 128 HIS HN . 26701 1 144 . 1 1 81 81 HIS N N 15 122.918 0.2 . 1 . . . . 128 HIS N . 26701 1 145 . 1 1 82 82 VAL H H 1 8.794 0.05 . 1 . . . . 129 VAL HN . 26701 1 146 . 1 1 82 82 VAL N N 15 117.287 0.2 . 1 . . . . 129 VAL N . 26701 1 147 . 1 1 83 83 LEU H H 1 9.068 0.05 . 1 . . . . 130 LEU HN . 26701 1 148 . 1 1 83 83 LEU N N 15 129.209 0.2 . 1 . . . . 130 LEU N . 26701 1 149 . 1 1 84 84 ILE H H 1 8.799 0.05 . 1 . . . . 131 ILE HN . 26701 1 150 . 1 1 84 84 ILE N N 15 129.659 0.2 . 1 . . . . 131 ILE N . 26701 1 151 . 1 1 85 85 GLU H H 1 9.409 0.05 . 1 . . . . 132 GLU HN . 26701 1 152 . 1 1 85 85 GLU N N 15 124.980 0.2 . 1 . . . . 132 GLU N . 26701 1 153 . 1 1 86 86 VAL H H 1 8.694 0.05 . 1 . . . . 133 VAL HN . 26701 1 154 . 1 1 86 86 VAL N N 15 119.851 0.2 . 1 . . . . 133 VAL N . 26701 1 155 . 1 1 87 87 PHE H H 1 8.239 0.05 . 1 . . . . 134 PHE HN . 26701 1 156 . 1 1 87 87 PHE N N 15 127.184 0.2 . 1 . . . . 134 PHE N . 26701 1 157 . 1 1 88 88 ALA H H 1 8.545 0.05 . 1 . . . . 135 ALA HN . 26701 1 158 . 1 1 88 88 ALA N N 15 127.318 0.2 . 1 . . . . 135 ALA N . 26701 1 159 . 1 1 91 91 ALA H H 1 8.111 0.05 . 1 . . . . 138 ALA HN . 26701 1 160 . 1 1 91 91 ALA N N 15 122.505 0.2 . 1 . . . . 138 ALA N . 26701 1 161 . 1 1 92 92 GLU H H 1 8.021 0.05 . 1 . . . . 139 GLU HN . 26701 1 162 . 1 1 92 92 GLU N N 15 119.755 0.2 . 1 . . . . 139 GLU N . 26701 1 163 . 1 1 93 93 ALA H H 1 8.386 0.05 . 1 . . . . 140 ALA HN . 26701 1 164 . 1 1 93 93 ALA N N 15 116.246 0.2 . 1 . . . . 140 ALA N . 26701 1 165 . 1 1 94 94 TYR H H 1 9.047 0.05 . 1 . . . . 141 TYR HN . 26701 1 166 . 1 1 94 94 TYR N N 15 118.310 0.2 . 1 . . . . 141 TYR N . 26701 1 167 . 1 1 95 95 ALA H H 1 7.753 0.05 . 1 . . . . 142 ALA HN . 26701 1 168 . 1 1 95 95 ALA N N 15 120.359 0.2 . 1 . . . . 142 ALA N . 26701 1 169 . 1 1 96 96 ARG H H 1 8.954 0.05 . 1 . . . . 143 ARG HN . 26701 1 170 . 1 1 96 96 ARG N N 15 119.188 0.2 . 1 . . . . 143 ARG N . 26701 1 171 . 1 1 97 97 MET H H 1 7.977 0.05 . 1 . . . . 144 MET HN . 26701 1 172 . 1 1 97 97 MET N N 15 118.493 0.2 . 1 . . . . 144 MET N . 26701 1 173 . 1 1 98 98 GLY H H 1 8.418 0.05 . 1 . . . . 145 GLY HN . 26701 1 174 . 1 1 98 98 GLY N N 15 105.661 0.2 . 1 . . . . 145 GLY N . 26701 1 175 . 1 1 99 99 HIS H H 1 7.872 0.05 . 1 . . . . 146 HIS HN . 26701 1 176 . 1 1 99 99 HIS N N 15 119.327 0.2 . 1 . . . . 146 HIS N . 26701 1 177 . 1 1 100 100 ALA H H 1 8.548 0.05 . 1 . . . . 147 ALA HN . 26701 1 178 . 1 1 100 100 ALA N N 15 121.751 0.2 . 1 . . . . 147 ALA N . 26701 1 179 . 1 1 101 101 LEU H H 1 8.385 0.05 . 1 . . . . 148 LEU HN . 26701 1 180 . 1 1 101 101 LEU N N 15 116.326 0.2 . 1 . . . . 148 LEU N . 26701 1 181 . 1 1 102 102 GLU H H 1 7.765 0.05 . 1 . . . . 149 GLU HN . 26701 1 182 . 1 1 102 102 GLU N N 15 117.200 0.2 . 1 . . . . 149 GLU N . 26701 1 183 . 1 1 103 103 GLU H H 1 8.055 0.05 . 1 . . . . 150 GLU HN . 26701 1 184 . 1 1 103 103 GLU N N 15 117.810 0.2 . 1 . . . . 150 GLU N . 26701 1 185 . 1 1 104 104 ILE H H 1 8.499 0.05 . 1 . . . . 151 ILE HN . 26701 1 186 . 1 1 104 104 ILE N N 15 118.038 0.2 . 1 . . . . 151 ILE N . 26701 1 187 . 1 1 105 105 LYS H H 1 7.399 0.05 . 1 . . . . 152 LYS HN . 26701 1 188 . 1 1 105 105 LYS N N 15 120.175 0.2 . 1 . . . . 152 LYS N . 26701 1 189 . 1 1 106 106 LYS H H 1 7.421 0.05 . 1 . . . . 153 LYS HN . 26701 1 190 . 1 1 106 106 LYS N N 15 115.189 0.2 . 1 . . . . 153 LYS N . 26701 1 191 . 1 1 107 107 PHE H H 1 7.843 0.05 . 1 . . . . 154 PHE HN . 26701 1 192 . 1 1 107 107 PHE N N 15 116.936 0.2 . 1 . . . . 154 PHE N . 26701 1 193 . 1 1 108 108 LEU H H 1 7.274 0.05 . 1 . . . . 155 LEU HN . 26701 1 194 . 1 1 108 108 LEU N N 15 115.803 0.2 . 1 . . . . 155 LEU N . 26701 1 195 . 1 1 109 109 ILE H H 1 6.929 0.05 . 1 . . . . 156 ILE HN . 26701 1 196 . 1 1 109 109 ILE N N 15 118.120 0.2 . 1 . . . . 156 ILE N . 26701 1 197 . 1 1 111 111 ASP H H 1 6.324 0.05 . 1 . . . . 158 ASP HN . 26701 1 198 . 1 1 111 111 ASP N N 15 119.166 0.2 . 1 . . . . 158 ASP N . 26701 1 199 . 1 1 112 112 TYR H H 1 7.850 0.05 . 1 . . . . 159 TYR HN . 26701 1 200 . 1 1 112 112 TYR N N 15 119.344 0.2 . 1 . . . . 159 TYR N . 26701 1 201 . 1 1 113 113 ASN H H 1 7.910 0.05 . 1 . . . . 160 ASN HN . 26701 1 202 . 1 1 113 113 ASN N N 15 124.908 0.2 . 1 . . . . 160 ASN N . 26701 1 stop_ save_