################################### # 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 18326 _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 . _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' . . . 18326 1 2 '2D 1H-13C HSQC' . . . 18326 1 3 '3D CBCA(CO)NH' . . . 18326 1 4 '3D HNCO' . . . 18326 1 5 '3D HNCA' . . . 18326 1 6 '3D HNCACB' . . . 18326 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 12 12 ALA H H 1 8.1058 . . 1 . . . . 13 ALA HN . 18326 1 2 . 1 1 12 12 ALA CA C 13 50.6531 . . 1 . . . . 13 ALA CA . 18326 1 3 . 1 1 12 12 ALA N N 15 126.6263 . . 1 . . . . 13 ALA N . 18326 1 4 . 1 1 14 14 LEU H H 1 8.0218 . . 1 . . . . 15 LEU HN . 18326 1 5 . 1 1 14 14 LEU CA C 13 55.4258 . . 1 . . . . 15 LEU CA . 18326 1 6 . 1 1 14 14 LEU N N 15 121.8485 . . 1 . . . . 15 LEU N . 18326 1 7 . 1 1 15 15 ASP H H 1 7.8034 . . 1 . . . . 16 ASP HN . 18326 1 8 . 1 1 15 15 ASP CA C 13 52.5720 . . 1 . . . . 16 ASP CA . 18326 1 9 . 1 1 15 15 ASP N N 15 121.4814 . . 1 . . . . 16 ASP N . 18326 1 10 . 1 1 16 16 SER H H 1 8.6726 . . 1 . . . . 17 SER HN . 18326 1 11 . 1 1 16 16 SER CA C 13 62.7078 . . 1 . . . . 17 SER CA . 18326 1 12 . 1 1 16 16 SER N N 15 114.3404 . . 1 . . . . 17 SER N . 18326 1 13 . 1 1 17 17 GLN H H 1 8.1400 . . 1 . . . . 18 GLN HN . 18326 1 14 . 1 1 17 17 GLN CA C 13 59.0176 . . 1 . . . . 18 GLN CA . 18326 1 15 . 1 1 17 17 GLN N N 15 122.4026 . . 1 . . . . 18 GLN N . 18326 1 16 . 1 1 18 18 ALA H H 1 8.4844 . . 1 . . . . 19 ALA HN . 18326 1 17 . 1 1 18 18 ALA CA C 13 55.0813 . . 1 . . . . 19 ALA CA . 18326 1 18 . 1 1 18 18 ALA N N 15 124.7691 . . 1 . . . . 19 ALA N . 18326 1 19 . 1 1 19 19 ALA H H 1 8.9711 . . 1 . . . . 20 ALA HN . 18326 1 20 . 1 1 19 19 ALA CA C 13 55.2289 . . 1 . . . . 20 ALA CA . 18326 1 21 . 1 1 19 19 ALA N N 15 119.0343 . . 1 . . . . 20 ALA N . 18326 1 22 . 1 1 20 20 ALA H H 1 7.7142 . . 1 . . . . 21 ALA HN . 18326 1 23 . 1 1 20 20 ALA CA C 13 55.4750 . . 1 . . . . 21 ALA CA . 18326 1 24 . 1 1 20 20 ALA N N 15 119.1734 . . 1 . . . . 21 ALA N . 18326 1 25 . 1 1 21 21 GLN H H 1 7.6127 . . 1 . . . . 22 GLN HN . 18326 1 26 . 1 1 21 21 GLN CA C 13 58.9191 . . 1 . . . . 22 GLN CA . 18326 1 27 . 1 1 21 21 GLN N N 15 119.0038 . . 1 . . . . 22 GLN N . 18326 1 28 . 1 1 22 22 VAL H H 1 8.4053 . . 1 . . . . 23 VAL HN . 18326 1 29 . 1 1 22 22 VAL CA C 13 66.5456 . . 1 . . . . 23 VAL CA . 18326 1 30 . 1 1 22 22 VAL N N 15 121.5352 . . 1 . . . . 23 VAL N . 18326 1 31 . 1 1 23 23 ALA H H 1 8.5420 . . 1 . . . . 24 ALA HN . 18326 1 32 . 1 1 23 23 ALA CA C 13 56.1638 . . 1 . . . . 24 ALA CA . 18326 1 33 . 1 1 23 23 ALA N N 15 121.5297 . . 1 . . . . 24 ALA N . 18326 1 34 . 1 1 24 24 SER H H 1 7.7587 . . 1 . . . . 25 SER HN . 18326 1 35 . 1 1 24 24 SER CA C 13 62.0189 . . 1 . . . . 25 SER CA . 18326 1 36 . 1 1 24 24 SER N N 15 111.9819 . . 1 . . . . 25 SER N . 18326 1 37 . 1 1 25 25 THR H H 1 7.6387 . . 1 . . . . 26 THR HN . 18326 1 38 . 1 1 25 25 THR CA C 13 67.0376 . . 1 . . . . 26 THR CA . 18326 1 39 . 1 1 25 25 THR N N 15 119.7518 . . 1 . . . . 26 THR N . 18326 1 40 . 1 1 26 26 LEU H H 1 8.0056 . . 1 . . . . 27 LEU HN . 18326 1 41 . 1 1 26 26 LEU CA C 13 58.0827 . . 1 . . . . 27 LEU CA . 18326 1 42 . 1 1 26 26 LEU N N 15 119.2698 . . 1 . . . . 27 LEU N . 18326 1 43 . 1 1 27 27 GLN H H 1 8.4457 . . 1 . . . . 28 GLN HN . 18326 1 44 . 1 1 27 27 GLN CA C 13 58.8699 . . 1 . . . . 28 GLN CA . 18326 1 45 . 1 1 27 27 GLN N N 15 116.0178 . . 1 . . . . 28 GLN N . 18326 1 46 . 1 1 28 28 ALA H H 1 7.4088 . . 1 . . . . 29 ALA HN . 18326 1 47 . 1 1 28 28 ALA CA C 13 54.1456 . . 1 . . . . 29 ALA CA . 18326 1 48 . 1 1 28 28 ALA N N 15 118.9847 . . 1 . . . . 29 ALA N . 18326 1 49 . 1 1 29 29 LEU H H 1 7.3540 . . 1 . . . . 30 LEU HN . 18326 1 50 . 1 1 29 29 LEU CA C 13 55.8686 . . 1 . . . . 30 LEU CA . 18326 1 51 . 1 1 29 29 LEU N N 15 113.0808 . . 1 . . . . 30 LEU N . 18326 1 52 . 1 1 30 30 ALA H H 1 7.1048 . . 1 . . . . 31 ALA HN . 18326 1 53 . 1 1 30 30 ALA CA C 13 52.3260 . . 1 . . . . 31 ALA CA . 18326 1 54 . 1 1 30 30 ALA N N 15 119.5464 . . 1 . . . . 31 ALA N . 18326 1 55 . 1 1 31 31 THR H H 1 8.4821 . . 1 . . . . 32 THR HN . 18326 1 56 . 1 1 31 31 THR CA C 13 58.5255 . . 1 . . . . 32 THR CA . 18326 1 57 . 1 1 31 31 THR N N 15 114.9399 . . 1 . . . . 32 THR N . 18326 1 58 . 1 1 34 34 ARG H H 1 7.3411 . . 1 . . . . 35 ARG HN . 18326 1 59 . 1 1 34 34 ARG CA C 13 60.6904 . . 1 . . . . 35 ARG CA . 18326 1 60 . 1 1 34 34 ARG N N 15 120.0127 . . 1 . . . . 35 ARG N . 18326 1 61 . 1 1 35 35 LEU H H 1 8.2036 . . 1 . . . . 36 LEU HN . 18326 1 62 . 1 1 35 35 LEU CA C 13 58.1319 . . 1 . . . . 36 LEU CA . 18326 1 63 . 1 1 35 35 LEU N N 15 118.6129 . . 1 . . . . 36 LEU N . 18326 1 64 . 1 1 36 36 MET H H 1 8.3550 . . 1 . . . . 37 MET HN . 18326 1 65 . 1 1 36 36 MET CA C 13 60.5428 . . 1 . . . . 37 MET CA . 18326 1 66 . 1 1 36 36 MET N N 15 121.0726 . . 1 . . . . 37 MET N . 18326 1 67 . 1 1 37 37 ILE H H 1 7.6639 . . 1 . . . . 38 ILE HN . 18326 1 68 . 1 1 37 37 ILE CA C 13 66.0043 . . 1 . . . . 38 ILE CA . 18326 1 69 . 1 1 37 37 ILE N N 15 117.9963 . . 1 . . . . 38 ILE N . 18326 1 70 . 1 1 38 38 LEU H H 1 8.6173 . . 1 . . . . 39 LEU HN . 18326 1 71 . 1 1 38 38 LEU CA C 13 58.2795 . . 1 . . . . 39 LEU CA . 18326 1 72 . 1 1 38 38 LEU N N 15 116.2105 . . 1 . . . . 39 LEU N . 18326 1 73 . 1 1 39 39 THR H H 1 8.1631 . . 1 . . . . 40 THR HN . 18326 1 74 . 1 1 39 39 THR CA C 13 65.4631 . . 1 . . . . 40 THR CA . 18326 1 75 . 1 1 39 39 THR N N 15 106.1878 . . 1 . . . . 40 THR N . 18326 1 76 . 1 1 40 40 GLN H H 1 7.4862 . . 1 . . . . 41 GLN HN . 18326 1 77 . 1 1 40 40 GLN CA C 13 58.2795 . . 1 . . . . 41 GLN CA . 18326 1 78 . 1 1 40 40 GLN N N 15 122.1164 . . 1 . . . . 41 GLN N . 18326 1 79 . 1 1 41 41 LEU H H 1 7.5268 . . 1 . . . . 42 LEU HN . 18326 1 80 . 1 1 41 41 LEU CA C 13 55.6226 . . 1 . . . . 42 LEU CA . 18326 1 81 . 1 1 41 41 LEU N N 15 116.7186 . . 1 . . . . 42 LEU N . 18326 1 82 . 1 1 42 42 ARG H H 1 7.5630 . . 1 . . . . 43 ARG HN . 18326 1 83 . 1 1 42 42 ARG N N 15 119.9434 . . 1 . . . . 43 ARG N . 18326 1 84 . 1 1 43 43 ASN H H 1 7.6703 . . 1 . . . . 44 ASN HN . 18326 1 85 . 1 1 43 43 ASN CA C 13 54.0973 . . 1 . . . . 44 ASN CA . 18326 1 86 . 1 1 43 43 ASN N N 15 114.9870 . . 1 . . . . 44 ASN N . 18326 1 87 . 1 1 44 44 GLY H H 1 7.3616 . . 1 . . . . 45 GLY HN . 18326 1 88 . 1 1 44 44 GLY CA C 13 44.5028 . . 1 . . . . 45 GLY CA . 18326 1 89 . 1 1 44 44 GLY N N 15 109.0510 . . 1 . . . . 45 GLY N . 18326 1 90 . 1 1 46 46 LEU H H 1 8.1739 . . 1 . . . . 47 LEU HN . 18326 1 91 . 1 1 46 46 LEU CA C 13 52.6704 . . 1 . . . . 47 LEU CA . 18326 1 92 . 1 1 46 46 LEU N N 15 120.4405 . . 1 . . . . 47 LEU N . 18326 1 93 . 1 1 48 48 VAL H H 1 9.0045 . . 1 . . . . 49 VAL HN . 18326 1 94 . 1 1 48 48 VAL CA C 13 67.0376 . . 1 . . . . 49 VAL CA . 18326 1 95 . 1 1 48 48 VAL N N 15 119.3200 . . 1 . . . . 49 VAL N . 18326 1 96 . 1 1 49 49 THR H H 1 7.8526 . . 1 . . . . 50 THR HN . 18326 1 97 . 1 1 49 49 THR CA C 13 65.3647 . . 1 . . . . 50 THR CA . 18326 1 98 . 1 1 49 49 THR N N 15 111.0490 . . 1 . . . . 50 THR N . 18326 1 99 . 1 1 50 50 ASP H H 1 7.1092 . . 1 . . . . 51 ASP HN . 18326 1 100 . 1 1 50 50 ASP CA C 13 57.0002 . . 1 . . . . 51 ASP CA . 18326 1 101 . 1 1 50 50 ASP N N 15 120.2607 . . 1 . . . . 51 ASP N . 18326 1 102 . 1 1 51 51 LEU H H 1 7.9016 . . 1 . . . . 52 LEU HN . 18326 1 103 . 1 1 51 51 LEU CA C 13 58.6239 . . 1 . . . . 52 LEU CA . 18326 1 104 . 1 1 51 51 LEU N N 15 121.1463 . . 1 . . . . 52 LEU N . 18326 1 105 . 1 1 52 52 ALA H H 1 8.5000 . . 1 . . . . 53 ALA HN . 18326 1 106 . 1 1 52 52 ALA CA C 13 56.1638 . . 1 . . . . 53 ALA CA . 18326 1 107 . 1 1 52 52 ALA N N 15 119.3525 . . 1 . . . . 53 ALA N . 18326 1 108 . 1 1 53 53 GLU H H 1 7.7084 . . 1 . . . . 54 GLU HN . 18326 1 109 . 1 1 53 53 GLU CA C 13 58.8207 . . 1 . . . . 54 GLU CA . 18326 1 110 . 1 1 53 53 GLU N N 15 115.7078 . . 1 . . . . 54 GLU N . 18326 1 111 . 1 1 54 54 ALA H H 1 7.8948 . . 1 . . . . 55 ALA HN . 18326 1 112 . 1 1 54 54 ALA CA C 13 54.9337 . . 1 . . . . 55 ALA CA . 18326 1 113 . 1 1 54 54 ALA N N 15 120.2562 . . 1 . . . . 55 ALA N . 18326 1 114 . 1 1 55 55 ILE H H 1 7.4969 . . 1 . . . . 56 ILE HN . 18326 1 115 . 1 1 55 55 ILE CA C 13 60.8381 . . 1 . . . . 56 ILE CA . 18326 1 116 . 1 1 55 55 ILE N N 15 107.2583 . . 1 . . . . 56 ILE N . 18326 1 117 . 1 1 56 56 GLY H H 1 7.7687 . . 1 . . . . 57 GLY HN . 18326 1 118 . 1 1 56 56 GLY CA C 13 47.3073 . . 1 . . . . 57 GLY CA . 18326 1 119 . 1 1 56 56 GLY N N 15 111.2161 . . 1 . . . . 57 GLY N . 18326 1 120 . 1 1 57 57 MET H H 1 7.6472 . . 1 . . . . 58 MET HN . 18326 1 121 . 1 1 57 57 MET CA C 13 54.3433 . . 1 . . . . 58 MET CA . 18326 1 122 . 1 1 57 57 MET N N 15 118.1500 . . 1 . . . . 58 MET N . 18326 1 123 . 1 1 58 58 GLU H H 1 8.5291 . . 1 . . . . 59 GLU HN . 18326 1 124 . 1 1 58 58 GLU CA C 13 56.7542 . . 1 . . . . 59 GLU CA . 18326 1 125 . 1 1 58 58 GLU N N 15 121.7413 . . 1 . . . . 59 GLU N . 18326 1 126 . 1 1 61 61 ALA H H 1 7.0797 . . 1 . . . . 62 ALA HN . 18326 1 127 . 1 1 61 61 ALA CA C 13 54.7861 . . 1 . . . . 62 ALA CA . 18326 1 128 . 1 1 61 61 ALA N N 15 126.0576 . . 1 . . . . 62 ALA N . 18326 1 129 . 1 1 62 62 VAL H H 1 7.9368 . . 1 . . . . 63 VAL HN . 18326 1 130 . 1 1 62 62 VAL CA C 13 66.8900 . . 1 . . . . 63 VAL CA . 18326 1 131 . 1 1 62 62 VAL N N 15 119.2554 . . 1 . . . . 63 VAL N . 18326 1 132 . 1 1 63 63 SER H H 1 8.7316 . . 1 . . . . 64 SER HN . 18326 1 133 . 1 1 63 63 SER CA C 13 62.7078 . . 1 . . . . 64 SER CA . 18326 1 134 . 1 1 63 63 SER N N 15 115.3449 . . 1 . . . . 64 SER N . 18326 1 135 . 1 1 64 64 HIS H H 1 7.7670 . . 1 . . . . 65 HIS HN . 18326 1 136 . 1 1 64 64 HIS CA C 13 60.1492 . . 1 . . . . 65 HIS CA . 18326 1 137 . 1 1 64 64 HIS N N 15 120.1999 . . 1 . . . . 65 HIS N . 18326 1 138 . 1 1 65 65 GLN H H 1 7.7351 . . 1 . . . . 66 GLN HN . 18326 1 139 . 1 1 65 65 GLN CA C 13 58.2303 . . 1 . . . . 66 GLN CA . 18326 1 140 . 1 1 65 65 GLN N N 15 115.5262 . . 1 . . . . 66 GLN N . 18326 1 141 . 1 1 66 66 LEU H H 1 8.5680 . . 1 . . . . 67 LEU HN . 18326 1 142 . 1 1 66 66 LEU CA C 13 58.1811 . . 1 . . . . 67 LEU CA . 18326 1 143 . 1 1 66 66 LEU N N 15 118.6807 . . 1 . . . . 67 LEU N . 18326 1 144 . 1 1 67 67 ARG H H 1 7.6025 . . 1 . . . . 68 ARG HN . 18326 1 145 . 1 1 67 67 ARG CA C 13 60.0016 . . 1 . . . . 68 ARG CA . 18326 1 146 . 1 1 67 67 ARG N N 15 119.6432 . . 1 . . . . 68 ARG N . 18326 1 147 . 1 1 68 68 VAL H H 1 7.2930 . . 1 . . . . 69 VAL HN . 18326 1 148 . 1 1 68 68 VAL CA C 13 66.4472 . . 1 . . . . 69 VAL CA . 18326 1 149 . 1 1 68 68 VAL N N 15 119.9421 . . 1 . . . . 69 VAL N . 18326 1 150 . 1 1 69 69 LEU H H 1 8.4448 . . 1 . . . . 70 LEU HN . 18326 1 151 . 1 1 69 69 LEU CA C 13 58.2795 . . 1 . . . . 70 LEU CA . 18326 1 152 . 1 1 69 69 LEU N N 15 117.8139 . . 1 . . . . 70 LEU N . 18326 1 153 . 1 1 70 70 ARG H H 1 8.7592 . . 1 . . . . 71 ARG HN . 18326 1 154 . 1 1 70 70 ARG CA C 13 58.9191 . . 1 . . . . 71 ARG CA . 18326 1 155 . 1 1 70 70 ARG N N 15 122.6517 . . 1 . . . . 71 ARG N . 18326 1 156 . 1 1 71 71 ASN H H 1 8.1034 . . 1 . . . . 72 ASN HN . 18326 1 157 . 1 1 71 71 ASN CA C 13 56.1146 . . 1 . . . . 72 ASN CA . 18326 1 158 . 1 1 71 71 ASN N N 15 121.8074 . . 1 . . . . 72 ASN N . 18326 1 159 . 1 1 72 72 LEU H H 1 7.8392 . . 1 . . . . 73 LEU HN . 18326 1 160 . 1 1 72 72 LEU CA C 13 54.9829 . . 1 . . . . 73 LEU CA . 18326 1 161 . 1 1 72 72 LEU N N 15 116.8588 . . 1 . . . . 73 LEU N . 18326 1 162 . 1 1 73 73 GLY H H 1 7.7939 . . 1 . . . . 74 GLY HN . 18326 1 163 . 1 1 73 73 GLY N N 15 108.2480 . . 1 . . . . 74 GLY N . 18326 1 164 . 1 1 74 74 LEU H H 1 7.8323 . . 1 . . . . 75 LEU HN . 18326 1 165 . 1 1 74 74 LEU N N 15 113.9104 . . 1 . . . . 75 LEU N . 18326 1 166 . 1 1 75 75 VAL H H 1 7.1175 . . 1 . . . . 76 VAL HN . 18326 1 167 . 1 1 75 75 VAL CA C 13 58.1811 . . 1 . . . . 76 VAL CA . 18326 1 168 . 1 1 75 75 VAL N N 15 110.7360 . . 1 . . . . 76 VAL N . 18326 1 169 . 1 1 76 76 VAL H H 1 9.0344 . . 1 . . . . 77 VAL HN . 18326 1 170 . 1 1 76 76 VAL CA C 13 60.3460 . . 1 . . . . 77 VAL CA . 18326 1 171 . 1 1 76 76 VAL N N 15 117.8174 . . 1 . . . . 77 VAL N . 18326 1 172 . 1 1 77 77 GLY H H 1 8.2073 . . 1 . . . . 78 GLY HN . 18326 1 173 . 1 1 77 77 GLY CA C 13 44.6504 . . 1 . . . . 78 GLY CA . 18326 1 174 . 1 1 77 77 GLY N N 15 109.2635 . . 1 . . . . 78 GLY N . 18326 1 175 . 1 1 78 78 ASP H H 1 8.4392 . . 1 . . . . 79 ASP HN . 18326 1 176 . 1 1 78 78 ASP CA C 13 53.2116 . . 1 . . . . 79 ASP CA . 18326 1 177 . 1 1 78 78 ASP N N 15 122.6370 . . 1 . . . . 79 ASP N . 18326 1 178 . 1 1 79 79 ARG H H 1 8.5622 . . 1 . . . . 80 ARG HN . 18326 1 179 . 1 1 79 79 ARG N N 15 122.6230 . . 1 . . . . 80 ARG N . 18326 1 180 . 1 1 80 80 ALA H H 1 8.3770 . . 1 . . . . 81 ALA HN . 18326 1 181 . 1 1 80 80 ALA CA C 13 51.8340 . . 1 . . . . 81 ALA CA . 18326 1 182 . 1 1 80 80 ALA N N 15 129.0459 . . 1 . . . . 81 ALA N . 18326 1 183 . 1 1 83 83 SER H H 1 7.8158 . . 1 . . . . 84 SER HN . 18326 1 184 . 1 1 83 83 SER CA C 13 57.3447 . . 1 . . . . 84 SER CA . 18326 1 185 . 1 1 83 83 SER N N 15 114.7307 . . 1 . . . . 84 SER N . 18326 1 186 . 1 1 84 84 ILE H H 1 8.2512 . . 1 . . . . 85 ILE HN . 18326 1 187 . 1 1 84 84 ILE CA C 13 60.6412 . . 1 . . . . 85 ILE CA . 18326 1 188 . 1 1 84 84 ILE N N 15 123.0506 . . 1 . . . . 85 ILE N . 18326 1 189 . 1 1 85 85 VAL H H 1 8.4591 . . 1 . . . . 86 VAL HN . 18326 1 190 . 1 1 85 85 VAL CA C 13 60.1000 . . 1 . . . . 86 VAL CA . 18326 1 191 . 1 1 85 85 VAL N N 15 121.9428 . . 1 . . . . 86 VAL N . 18326 1 192 . 1 1 86 86 TYR H H 1 8.4333 . . 1 . . . . 87 TYR HN . 18326 1 193 . 1 1 86 86 TYR CA C 13 57.6399 . . 1 . . . . 87 TYR CA . 18326 1 194 . 1 1 86 86 TYR N N 15 124.7898 . . 1 . . . . 87 TYR N . 18326 1 195 . 1 1 87 87 SER H H 1 8.6588 . . 1 . . . . 88 SER HN . 18326 1 196 . 1 1 87 87 SER CA C 13 56.2622 . . 1 . . . . 88 SER CA . 18326 1 197 . 1 1 87 87 SER N N 15 110.8055 . . 1 . . . . 88 SER N . 18326 1 198 . 1 1 88 88 LEU H H 1 9.0178 . . 1 . . . . 89 LEU HN . 18326 1 199 . 1 1 88 88 LEU CA C 13 55.4258 . . 1 . . . . 89 LEU CA . 18326 1 200 . 1 1 88 88 LEU N N 15 120.1285 . . 1 . . . . 89 LEU N . 18326 1 201 . 1 1 89 89 TYR H H 1 8.0455 . . 1 . . . . 90 TYR HN . 18326 1 202 . 1 1 89 89 TYR CA C 13 61.7729 . . 1 . . . . 90 TYR CA . 18326 1 203 . 1 1 89 89 TYR N N 15 120.3488 . . 1 . . . . 90 TYR N . 18326 1 204 . 1 1 94 94 ALA H H 1 6.5450 . . 1 . . . . 95 ALA HN . 18326 1 205 . 1 1 94 94 ALA N N 15 117.8125 . . 1 . . . . 95 ALA N . 18326 1 206 . 1 1 97 97 LEU H H 1 7.3742 . . 1 . . . . 98 LEU HN . 18326 1 207 . 1 1 97 97 LEU N N 15 118.3844 . . 1 . . . . 98 LEU N . 18326 1 208 . 1 1 98 98 ASP H H 1 7.8684 . . 1 . . . . 99 ASP HN . 18326 1 209 . 1 1 98 98 ASP N N 15 118.7071 . . 1 . . . . 99 ASP N . 18326 1 210 . 1 1 99 99 GLU H H 1 8.4736 . . 1 . . . . 100 GLU HN . 18326 1 211 . 1 1 99 99 GLU N N 15 117.7837 . . 1 . . . . 100 GLU N . 18326 1 212 . 1 1 110 110 GLY H H 1 7.8928 . . 1 . . . . 111 GLY HN . 18326 1 213 . 1 1 110 110 GLY N N 15 110.1782 . . 1 . . . . 111 GLY N . 18326 1 214 . 1 1 111 111 LEU H H 1 7.9680 . . 1 . . . . 112 LEU HN . 18326 1 215 . 1 1 111 111 LEU N N 15 121.1310 . . 1 . . . . 112 LEU N . 18326 1 216 . 1 1 112 112 SER H H 1 8.1058 . . 1 . . . . 113 SER HN . 18326 1 217 . 1 1 112 112 SER N N 15 115.8524 . . 1 . . . . 113 SER N . 18326 1 218 . 1 1 113 113 ASP H H 1 8.1952 . . 1 . . . . 114 ASP HN . 18326 1 219 . 1 1 113 113 ASP CA C 13 54.1465 . . 1 . . . . 114 ASP CA . 18326 1 220 . 1 1 113 113 ASP N N 15 121.8208 . . 1 . . . . 114 ASP N . 18326 1 221 . 1 1 114 114 ARG H H 1 8.0109 . . 1 . . . . 115 ARG HN . 18326 1 222 . 1 1 114 114 ARG CA C 13 55.4750 . . 1 . . . . 115 ARG CA . 18326 1 223 . 1 1 114 114 ARG N N 15 120.1921 . . 1 . . . . 115 ARG N . 18326 1 224 . 1 1 117 117 SER H H 1 8.5812 . . 1 . . . . 118 SER HN . 18326 1 225 . 1 1 117 117 SER N N 15 116.5143 . . 1 . . . . 118 SER N . 18326 1 226 . 1 1 118 118 ALA H H 1 8.2909 . . 1 . . . . 119 ALA HN . 18326 1 227 . 1 1 118 118 ALA CA C 13 52.6212 . . 1 . . . . 119 ALA CA . 18326 1 228 . 1 1 118 118 ALA N N 15 126.3175 . . 1 . . . . 119 ALA N . 18326 1 229 . 1 1 119 119 GLY H H 1 7.8877 . . 1 . . . . 120 GLY HN . 18326 1 230 . 1 1 119 119 GLY CA C 13 46.5693 . . 1 . . . . 120 GLY CA . 18326 1 231 . 1 1 119 119 GLY N N 15 114.2952 . . 1 . . . . 120 GLY N . 18326 1 stop_ save_