################################### # 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 26786 _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 0.003 _Assigned_chem_shift_list.Chem_shift_13C_err . _Assigned_chem_shift_list.Chem_shift_15N_err 0.03 _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 '13C chemical shift error: CACB:0.2; C:0.03' _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' . . . 26786 1 2 '3D HNCO' . . . 26786 1 3 '3D HNCACB' . . . 26786 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 $CcpNMR_Analysis . . 26786 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 2 2 THR C C 13 174.645 0.03 . 1 . . . . 309 THR C . 26786 1 2 . 1 1 2 2 THR CA C 13 61.985 0.2 . 1 . . . . 309 THR CA . 26786 1 3 . 1 1 2 2 THR CB C 13 69.895 0.2 . 1 . . . . 309 THR CB . 26786 1 4 . 1 1 3 3 GLN H H 1 8.735 0.003 . 1 . . . . 310 GLN H . 26786 1 5 . 1 1 3 3 GLN CA C 13 53.785 0.2 . 1 . . . . 310 GLN CA . 26786 1 6 . 1 1 3 3 GLN CB C 13 28.805 0.2 . 1 . . . . 310 GLN CB . 26786 1 7 . 1 1 3 3 GLN N N 15 124.565 0.03 . 1 . . . . 310 GLN N . 26786 1 8 . 1 1 4 4 PRO C C 13 176.845 0.03 . 1 . . . . 311 PRO C . 26786 1 9 . 1 1 4 4 PRO CA C 13 62.995 0.2 . 1 . . . . 311 PRO CA . 26786 1 10 . 1 1 4 4 PRO CB C 13 32.205 0.2 . 1 . . . . 311 PRO CB . 26786 1 11 . 1 1 5 5 GLN H H 1 8.715 0.003 . 1 . . . . 312 GLN H . 26786 1 12 . 1 1 5 5 GLN C C 13 176.155 0.03 . 1 . . . . 312 GLN C . 26786 1 13 . 1 1 5 5 GLN CA C 13 55.705 0.2 . 1 . . . . 312 GLN CA . 26786 1 14 . 1 1 5 5 GLN CB C 13 29.615 0.2 . 1 . . . . 312 GLN CB . 26786 1 15 . 1 1 5 5 GLN N N 15 121.485 0.03 . 1 . . . . 312 GLN N . 26786 1 16 . 1 1 6 6 LYS H H 1 8.615 0.003 . 1 . . . . 313 LYS H . 26786 1 17 . 1 1 6 6 LYS C C 13 177.135 0.03 . 1 . . . . 313 LYS C . 26786 1 18 . 1 1 6 6 LYS CA C 13 56.535 0.2 . 1 . . . . 313 LYS CA . 26786 1 19 . 1 1 6 6 LYS CB C 13 33.055 0.2 . 1 . . . . 313 LYS CB . 26786 1 20 . 1 1 6 6 LYS N N 15 123.605 0.03 . 1 . . . . 313 LYS N . 26786 1 21 . 1 1 7 7 GLY H H 1 8.645 0.003 . 1 . . . . 314 GLY H . 26786 1 22 . 1 1 7 7 GLY C C 13 173.835 0.03 . 1 . . . . 314 GLY C . 26786 1 23 . 1 1 7 7 GLY CA C 13 45.135 0.2 . 1 . . . . 314 GLY CA . 26786 1 24 . 1 1 7 7 GLY N N 15 110.795 0.03 . 1 . . . . 314 GLY N . 26786 1 25 . 1 1 8 8 ARG H H 1 8.315 0.003 . 1 . . . . 315 ARG H . 26786 1 26 . 1 1 8 8 ARG C C 13 176.285 0.03 . 1 . . . . 315 ARG C . 26786 1 27 . 1 1 8 8 ARG CA C 13 55.825 0.2 . 1 . . . . 315 ARG CA . 26786 1 28 . 1 1 8 8 ARG CB C 13 31.045 0.2 . 1 . . . . 315 ARG CB . 26786 1 29 . 1 1 8 8 ARG N N 15 120.805 0.03 . 1 . . . . 315 ARG N . 26786 1 30 . 1 1 9 9 LYS H H 1 8.685 0.003 . 1 . . . . 316 LYS H . 26786 1 31 . 1 1 9 9 LYS CA C 13 54.365 0.2 . 1 . . . . 316 LYS CA . 26786 1 32 . 1 1 9 9 LYS CB C 13 32.465 0.2 . 1 . . . . 316 LYS CB . 26786 1 33 . 1 1 9 9 LYS N N 15 125.195 0.03 . 1 . . . . 316 LYS N . 26786 1 34 . 1 1 10 10 PRO C C 13 177.025 0.03 . 1 . . . . 317 PRO C . 26786 1 35 . 1 1 10 10 PRO CA C 13 63.415 0.2 . 1 . . . . 317 PRO CA . 26786 1 36 . 1 1 10 10 PRO CB C 13 32.315 0.2 . 1 . . . . 317 PRO CB . 26786 1 37 . 1 1 11 11 ARG H H 1 8.575 0.003 . 1 . . . . 318 ARG H . 26786 1 38 . 1 1 11 11 ARG C C 13 176.295 0.03 . 1 . . . . 318 ARG C . 26786 1 39 . 1 1 11 11 ARG CA C 13 56.365 0.2 . 1 . . . . 318 ARG CA . 26786 1 40 . 1 1 11 11 ARG CB C 13 30.675 0.2 . 1 . . . . 318 ARG CB . 26786 1 41 . 1 1 11 11 ARG N N 15 121.045 0.03 . 1 . . . . 318 ARG N . 26786 1 42 . 1 1 12 12 ASP H H 1 8.435 0.003 . 1 . . . . 319 ASP H . 26786 1 43 . 1 1 12 12 ASP C C 13 176.335 0.03 . 1 . . . . 319 ASP C . 26786 1 44 . 1 1 12 12 ASP CA C 13 54.665 0.2 . 1 . . . . 319 ASP CA . 26786 1 45 . 1 1 12 12 ASP CB C 13 41.025 0.2 . 1 . . . . 319 ASP CB . 26786 1 46 . 1 1 12 12 ASP N N 15 121.575 0.03 . 1 . . . . 319 ASP N . 26786 1 47 . 1 1 13 13 LEU H H 1 8.295 0.003 . 1 . . . . 320 LEU H . 26786 1 48 . 1 1 13 13 LEU C C 13 177.315 0.03 . 1 . . . . 320 LEU C . 26786 1 49 . 1 1 13 13 LEU CA C 13 55.275 0.2 . 1 . . . . 320 LEU CA . 26786 1 50 . 1 1 13 13 LEU CB C 13 42.265 0.2 . 1 . . . . 320 LEU CB . 26786 1 51 . 1 1 13 13 LEU N N 15 122.135 0.03 . 1 . . . . 320 LEU N . 26786 1 52 . 1 1 14 14 GLU H H 1 8.395 0.003 . 1 . . . . 321 GLU H . 26786 1 53 . 1 1 14 14 GLU C C 13 176.165 0.03 . 1 . . . . 321 GLU C . 26786 1 54 . 1 1 14 14 GLU CA C 13 56.115 0.2 . 1 . . . . 321 GLU CA . 26786 1 55 . 1 1 14 14 GLU CB C 13 30.175 0.2 . 1 . . . . 321 GLU CB . 26786 1 56 . 1 1 14 14 GLU N N 15 121.505 0.03 . 1 . . . . 321 GLU N . 26786 1 57 . 1 1 15 15 LEU H H 1 8.325 0.003 . 1 . . . . 322 LEU H . 26786 1 58 . 1 1 15 15 LEU CA C 13 52.955 0.2 . 1 . . . . 322 LEU CA . 26786 1 59 . 1 1 15 15 LEU CB C 13 41.645 0.2 . 1 . . . . 322 LEU CB . 26786 1 60 . 1 1 15 15 LEU N N 15 124.915 0.03 . 1 . . . . 322 LEU N . 26786 1 61 . 1 1 16 16 PRO C C 13 176.785 0.03 . 1 . . . . 323 PRO C . 26786 1 62 . 1 1 16 16 PRO CA C 13 62.735 0.2 . 1 . . . . 323 PRO CA . 26786 1 63 . 1 1 16 16 PRO CB C 13 32.335 0.2 . 1 . . . . 323 PRO CB . 26786 1 64 . 1 1 17 17 LEU H H 1 8.505 0.003 . 1 . . . . 324 LEU H . 26786 1 65 . 1 1 17 17 LEU C C 13 177.435 0.03 . 1 . . . . 324 LEU C . 26786 1 66 . 1 1 17 17 LEU CA C 13 55.335 0.2 . 1 . . . . 324 LEU CA . 26786 1 67 . 1 1 17 17 LEU CB C 13 42.535 0.2 . 1 . . . . 324 LEU CB . 26786 1 68 . 1 1 17 17 LEU N N 15 122.685 0.03 . 1 . . . . 324 LEU N . 26786 1 69 . 1 1 18 18 SER H H 1 8.435 0.003 . 1 . . . . 325 SER H . 26786 1 70 . 1 1 18 18 SER CA C 13 56.085 0.2 . 1 . . . . 325 SER CA . 26786 1 71 . 1 1 18 18 SER CB C 13 63.485 0.2 . 1 . . . . 325 SER CB . 26786 1 72 . 1 1 18 18 SER N N 15 118.335 0.03 . 1 . . . . 325 SER N . 26786 1 73 . 1 1 19 19 PRO C C 13 177.215 0.03 . 1 . . . . 326 PRO C . 26786 1 74 . 1 1 19 19 PRO CB C 13 32.155 0.2 . 1 . . . . 326 PRO CB . 26786 1 75 . 1 1 20 20 SER H H 1 8.455 0.003 . 1 . . . . 327 SER H . 26786 1 76 . 1 1 20 20 SER C C 13 174.985 0.03 . 1 . . . . 327 SER C . 26786 1 77 . 1 1 20 20 SER CA C 13 58.555 0.2 . 1 . . . . 327 SER CA . 26786 1 78 . 1 1 20 20 SER CB C 13 63.605 0.2 . 1 . . . . 327 SER CB . 26786 1 79 . 1 1 20 20 SER N N 15 115.665 0.03 . 1 . . . . 327 SER N . 26786 1 80 . 1 1 21 21 LEU H H 1 8.395 0.003 . 1 . . . . 328 LEU H . 26786 1 81 . 1 1 21 21 LEU C C 13 177.675 0.03 . 1 . . . . 328 LEU C . 26786 1 82 . 1 1 21 21 LEU CA C 13 55.305 0.2 . 1 . . . . 328 LEU CA . 26786 1 83 . 1 1 21 21 LEU CB C 13 42.105 0.2 . 1 . . . . 328 LEU CB . 26786 1 84 . 1 1 21 21 LEU N N 15 124.565 0.03 . 1 . . . . 328 LEU N . 26786 1 85 . 1 1 22 22 LEU H H 1 8.265 0.003 . 1 . . . . 329 LEU H . 26786 1 86 . 1 1 22 22 LEU C C 13 178.075 0.03 . 1 . . . . 329 LEU C . 26786 1 87 . 1 1 22 22 LEU CA C 13 55.295 0.2 . 1 . . . . 329 LEU CA . 26786 1 88 . 1 1 22 22 LEU CB C 13 42.055 0.2 . 1 . . . . 329 LEU CB . 26786 1 89 . 1 1 22 22 LEU N N 15 122.215 0.03 . 1 . . . . 329 LEU N . 26786 1 90 . 1 1 23 23 GLY H H 1 8.485 0.003 . 1 . . . . 330 GLY H . 26786 1 91 . 1 1 23 23 GLY C C 13 174.915 0.03 . 1 . . . . 330 GLY C . 26786 1 92 . 1 1 23 23 GLY CA C 13 45.455 0.2 . 1 . . . . 330 GLY CA . 26786 1 93 . 1 1 23 23 GLY N N 15 109.625 0.03 . 1 . . . . 330 GLY N . 26786 1 94 . 1 1 24 24 GLY H H 1 8.395 0.003 . 1 . . . . 331 GLY H . 26786 1 95 . 1 1 24 24 GLY C C 13 174.255 0.03 . 1 . . . . 331 GLY C . 26786 1 96 . 1 1 24 24 GLY CA C 13 45.325 0.2 . 1 . . . . 331 GLY CA . 26786 1 97 . 1 1 24 24 GLY N N 15 108.805 0.03 . 1 . . . . 331 GLY N . 26786 1 98 . 1 1 25 25 GLN H H 1 8.445 0.003 . 1 . . . . 332 GLN H . 26786 1 99 . 1 1 25 25 GLN C C 13 176.275 0.03 . 1 . . . . 332 GLN C . 26786 1 100 . 1 1 25 25 GLN CA C 13 55.635 0.2 . 1 . . . . 332 GLN CA . 26786 1 101 . 1 1 25 25 GLN CB C 13 29.805 0.2 . 1 . . . . 332 GLN CB . 26786 1 102 . 1 1 25 25 GLN N N 15 119.615 0.03 . 1 . . . . 332 GLN N . 26786 1 103 . 1 1 26 26 GLY H H 1 8.515 0.003 . 1 . . . . 333 GLY H . 26786 1 104 . 1 1 26 26 GLY CA C 13 44.615 0.2 . 1 . . . . 333 GLY CA . 26786 1 105 . 1 1 26 26 GLY N N 15 110.625 0.03 . 1 . . . . 333 GLY N . 26786 1 106 . 1 1 27 27 PRO C C 13 177.155 0.03 . 1 . . . . 334 PRO C . 26786 1 107 . 1 1 27 27 PRO CA C 13 63.215 0.2 . 1 . . . . 334 PRO CA . 26786 1 108 . 1 1 27 27 PRO CB C 13 32.185 0.2 . 1 . . . . 334 PRO CB . 26786 1 109 . 1 1 28 28 GLU H H 1 8.725 0.003 . 1 . . . . 335 GLU H . 26786 1 110 . 1 1 28 28 GLU C C 13 176.835 0.03 . 1 . . . . 335 GLU C . 26786 1 111 . 1 1 28 28 GLU CA C 13 56.755 0.2 . 1 . . . . 335 GLU CA . 26786 1 112 . 1 1 28 28 GLU CB C 13 30.055 0.2 . 1 . . . . 335 GLU CB . 26786 1 113 . 1 1 28 28 GLU N N 15 121.235 0.03 . 1 . . . . 335 GLU N . 26786 1 114 . 1 1 29 29 ARG H H 1 8.505 0.003 . 1 . . . . 336 ARG H . 26786 1 115 . 1 1 29 29 ARG C C 13 176.045 0.03 . 1 . . . . 336 ARG C . 26786 1 116 . 1 1 29 29 ARG CA C 13 55.515 0.2 . 1 . . . . 336 ARG CA . 26786 1 117 . 1 1 29 29 ARG CB C 13 31.245 0.2 . 1 . . . . 336 ARG CB . 26786 1 118 . 1 1 29 29 ARG N N 15 122.675 0.03 . 1 . . . . 336 ARG N . 26786 1 119 . 1 1 30 30 SEP H H 1 9.275 0.003 . 1 . . . . 337 SER H . 26786 1 120 . 1 1 30 30 SEP CA C 13 60.875 0.2 . 1 . . . . 337 SER CA . 26786 1 121 . 1 1 30 30 SEP CB C 13 72.065 0.2 . 1 . . . . 337 SER CB . 26786 1 122 . 1 1 30 30 SEP N N 15 120.915 0.03 . 1 . . . . 337 SER N . 26786 1 123 . 1 1 31 31 PRO C C 13 177.825 0.03 . 1 . . . . 338 PRO C . 26786 1 124 . 1 1 31 31 PRO CA C 13 64.415 0.2 . 1 . . . . 338 PRO CA . 26786 1 125 . 1 1 31 31 PRO CB C 13 32.265 0.2 . 1 . . . . 338 PRO CB . 26786 1 126 . 1 1 32 32 GLY H H 1 9.125 0.003 . 1 . . . . 339 GLY H . 26786 1 127 . 1 1 32 32 GLY C C 13 174.845 0.03 . 1 . . . . 339 GLY C . 26786 1 128 . 1 1 32 32 GLY CA C 13 45.505 0.2 . 1 . . . . 339 GLY CA . 26786 1 129 . 1 1 32 32 GLY N N 15 110.525 0.03 . 1 . . . . 339 GLY N . 26786 1 130 . 1 1 33 33 SER H H 1 8.385 0.003 . 1 . . . . 340 SER H . 26786 1 131 . 1 1 33 33 SER C C 13 175.465 0.03 . 1 . . . . 340 SER C . 26786 1 132 . 1 1 33 33 SER CA C 13 58.875 0.2 . 1 . . . . 340 SER CA . 26786 1 133 . 1 1 33 33 SER CB C 13 63.935 0.2 . 1 . . . . 340 SER CB . 26786 1 134 . 1 1 33 33 SER N N 15 115.895 0.03 . 1 . . . . 340 SER N . 26786 1 135 . 1 1 34 34 GLY H H 1 8.705 0.003 . 1 . . . . 341 GLY H . 26786 1 136 . 1 1 34 34 GLY C C 13 174.585 0.03 . 1 . . . . 341 GLY C . 26786 1 137 . 1 1 34 34 GLY CA C 13 45.385 0.2 . 1 . . . . 341 GLY CA . 26786 1 138 . 1 1 34 34 GLY N N 15 111.295 0.03 . 1 . . . . 341 GLY N . 26786 1 139 . 1 1 35 35 THR H H 1 8.245 0.003 . 1 . . . . 342 THR H . 26786 1 140 . 1 1 35 35 THR C C 13 175.015 0.03 . 1 . . . . 342 THR C . 26786 1 141 . 1 1 35 35 THR CA C 13 61.785 0.2 . 1 . . . . 342 THR CA . 26786 1 142 . 1 1 35 35 THR CB C 13 69.975 0.2 . 1 . . . . 342 THR CB . 26786 1 143 . 1 1 35 35 THR N N 15 113.695 0.03 . 1 . . . . 342 THR N . 26786 1 144 . 1 1 36 36 SER H H 1 8.585 0.003 . 1 . . . . 343 SER H . 26786 1 145 . 1 1 36 36 SER C C 13 174.845 0.03 . 1 . . . . 343 SER C . 26786 1 146 . 1 1 36 36 SER CA C 13 58.495 0.2 . 1 . . . . 343 SER CA . 26786 1 147 . 1 1 36 36 SER CB C 13 63.805 0.2 . 1 . . . . 343 SER CB . 26786 1 148 . 1 1 36 36 SER N N 15 118.475 0.03 . 1 . . . . 343 SER N . 26786 1 149 . 1 1 37 37 SER H H 1 8.545 0.003 . 1 . . . . 344 SER H . 26786 1 150 . 1 1 37 37 SER C C 13 175.115 0.03 . 1 . . . . 344 SER C . 26786 1 151 . 1 1 37 37 SER CA C 13 58.745 0.2 . 1 . . . . 344 SER CA . 26786 1 152 . 1 1 37 37 SER CB C 13 63.875 0.2 . 1 . . . . 344 SER CB . 26786 1 153 . 1 1 37 37 SER N N 15 118.175 0.03 . 1 . . . . 344 SER N . 26786 1 154 . 1 1 38 38 GLY H H 1 8.495 0.003 . 1 . . . . 345 GLY H . 26786 1 155 . 1 1 38 38 GLY C C 13 174.065 0.03 . 1 . . . . 345 GLY C . 26786 1 156 . 1 1 38 38 GLY CA C 13 45.265 0.2 . 1 . . . . 345 GLY CA . 26786 1 157 . 1 1 38 38 GLY N N 15 110.855 0.03 . 1 . . . . 345 GLY N . 26786 1 158 . 1 1 39 39 LEU H H 1 8.185 0.003 . 1 . . . . 346 LEU H . 26786 1 159 . 1 1 39 39 LEU C C 13 177.445 0.03 . 1 . . . . 346 LEU C . 26786 1 160 . 1 1 39 39 LEU CA C 13 55.045 0.2 . 1 . . . . 346 LEU CA . 26786 1 161 . 1 1 39 39 LEU CB C 13 42.445 0.2 . 1 . . . . 346 LEU CB . 26786 1 162 . 1 1 39 39 LEU N N 15 121.695 0.03 . 1 . . . . 346 LEU N . 26786 1 163 . 1 1 40 40 GLN H H 1 8.525 0.003 . 1 . . . . 347 GLN H . 26786 1 164 . 1 1 40 40 GLN C C 13 175.315 0.03 . 1 . . . . 347 GLN C . 26786 1 165 . 1 1 40 40 GLN CA C 13 55.105 0.2 . 1 . . . . 347 GLN CA . 26786 1 166 . 1 1 40 40 GLN CB C 13 29.575 0.2 . 1 . . . . 347 GLN CB . 26786 1 167 . 1 1 40 40 GLN N N 15 121.935 0.03 . 1 . . . . 347 GLN N . 26786 1 168 . 1 1 41 41 ALA H H 1 8.535 0.003 . 1 . . . . 348 ALA H . 26786 1 169 . 1 1 41 41 ALA CA C 13 50.575 0.2 . 1 . . . . 348 ALA CA . 26786 1 170 . 1 1 41 41 ALA CB C 13 18.005 0.2 . 1 . . . . 348 ALA CB . 26786 1 171 . 1 1 41 41 ALA N N 15 127.675 0.03 . 1 . . . . 348 ALA N . 26786 1 172 . 1 1 42 42 PRO C C 13 177.255 0.03 . 1 . . . . 349 PRO C . 26786 1 173 . 1 1 42 42 PRO CA C 13 63.215 0.2 . 1 . . . . 349 PRO CA . 26786 1 174 . 1 1 42 42 PRO CB C 13 32.365 0.2 . 1 . . . . 349 PRO CB . 26786 1 175 . 1 1 43 43 GLY H H 1 8.425 0.003 . 1 . . . . 350 GLY H . 26786 1 176 . 1 1 43 43 GLY CA C 13 44.385 0.2 . 1 . . . . 350 GLY CA . 26786 1 177 . 1 1 43 43 GLY N N 15 109.485 0.03 . 1 . . . . 350 GLY N . 26786 1 178 . 1 1 44 44 PRO C C 13 176.535 0.03 . 1 . . . . 351 PRO C . 26786 1 179 . 1 1 44 44 PRO CA C 13 62.885 0.2 . 1 . . . . 351 PRO CA . 26786 1 180 . 1 1 44 44 PRO CB C 13 32.285 0.2 . 1 . . . . 351 PRO CB . 26786 1 181 . 1 1 45 45 ALA H H 1 8.555 0.003 . 1 . . . . 352 ALA H . 26786 1 182 . 1 1 45 45 ALA C C 13 177.605 0.03 . 1 . . . . 352 ALA C . 26786 1 183 . 1 1 45 45 ALA CA C 13 52.135 0.2 . 1 . . . . 352 ALA CA . 26786 1 184 . 1 1 45 45 ALA CB C 13 19.085 0.2 . 1 . . . . 352 ALA CB . 26786 1 185 . 1 1 45 45 ALA N N 15 124.735 0.03 . 1 . . . . 352 ALA N . 26786 1 186 . 1 1 46 46 LEU H H 1 8.425 0.003 . 1 . . . . 353 LEU H . 26786 1 187 . 1 1 46 46 LEU C C 13 177.285 0.03 . 1 . . . . 353 LEU C . 26786 1 188 . 1 1 46 46 LEU CA C 13 54.655 0.2 . 1 . . . . 353 LEU CA . 26786 1 189 . 1 1 46 46 LEU CB C 13 42.695 0.2 . 1 . . . . 353 LEU CB . 26786 1 190 . 1 1 46 46 LEU N N 15 122.845 0.03 . 1 . . . . 353 LEU N . 26786 1 191 . 1 1 47 47 TPO H H 1 8.965 0.003 . 1 . . . . 354 THR H . 26786 1 192 . 1 1 47 47 TPO CA C 13 60.285 0.2 . 1 . . . . 354 THR CA . 26786 1 193 . 1 1 47 47 TPO CB C 13 72.295 0.2 . 1 . . . . 354 THR CB . 26786 1 194 . 1 1 47 47 TPO N N 15 121.405 0.03 . 1 . . . . 354 THR N . 26786 1 195 . 1 1 48 48 PRO C C 13 177.235 0.03 . 1 . . . . 355 PRO C . 26786 1 196 . 1 1 48 48 PRO CA C 13 62.635 0.2 . 1 . . . . 355 PRO CA . 26786 1 197 . 1 1 48 48 PRO CB C 13 32.335 0.2 . 1 . . . . 355 PRO CB . 26786 1 198 . 1 1 49 49 SER H H 1 8.375 0.003 . 1 . . . . 356 SER H . 26786 1 199 . 1 1 49 49 SER C C 13 174.735 0.03 . 1 . . . . 356 SER C . 26786 1 200 . 1 1 49 49 SER CA C 13 59.135 0.2 . 1 . . . . 356 SER CA . 26786 1 201 . 1 1 49 49 SER CB C 13 63.435 0.2 . 1 . . . . 356 SER CB . 26786 1 202 . 1 1 49 49 SER N N 15 115.445 0.03 . 1 . . . . 356 SER N . 26786 1 203 . 1 1 50 50 LEU H H 1 8.385 0.003 . 1 . . . . 357 LEU H . 26786 1 204 . 1 1 50 50 LEU C C 13 177.135 0.03 . 1 . . . . 357 LEU C . 26786 1 205 . 1 1 50 50 LEU CA C 13 54.785 0.2 . 1 . . . . 357 LEU CA . 26786 1 206 . 1 1 50 50 LEU CB C 13 42.385 0.2 . 1 . . . . 357 LEU CB . 26786 1 207 . 1 1 50 50 LEU N N 15 124.135 0.03 . 1 . . . . 357 LEU N . 26786 1 208 . 1 1 51 51 LEU H H 1 8.245 0.003 . 1 . . . . 358 LEU H . 26786 1 209 . 1 1 51 51 LEU CA C 13 53.035 0.2 . 1 . . . . 358 LEU CA . 26786 1 210 . 1 1 51 51 LEU CB C 13 41.635 0.2 . 1 . . . . 358 LEU CB . 26786 1 211 . 1 1 51 51 LEU N N 15 124.385 0.03 . 1 . . . . 358 LEU N . 26786 1 212 . 1 1 52 52 PRO C C 13 177.135 0.03 . 1 . . . . 359 PRO C . 26786 1 213 . 1 1 52 52 PRO CA C 13 63.075 0.2 . 1 . . . . 359 PRO CA . 26786 1 214 . 1 1 52 52 PRO CB C 13 32.225 0.2 . 1 . . . . 359 PRO CB . 26786 1 215 . 1 1 53 53 THR H H 1 8.410 0.003 . 1 . . . . 360 THR H . 26786 1 216 . 1 1 53 53 THR CA C 13 61.935 0.2 . 1 . . . . 360 THR CA . 26786 1 217 . 1 1 53 53 THR CB C 13 70.025 0.2 . 1 . . . . 360 THR CB . 26786 1 218 . 1 1 53 53 THR N N 15 114.965 0.03 . 1 . . . . 360 THR N . 26786 1 219 . 1 1 55 55 THR C C 13 173.785 0.03 . 1 . . . . 362 THR C . 26786 1 220 . 1 1 55 55 THR CA C 13 61.925 0.2 . 1 . . . . 362 THR CA . 26786 1 221 . 1 1 55 55 THR CB C 13 69.715 0.2 . 1 . . . . 362 THR CB . 26786 1 222 . 1 1 56 56 LEU H H 1 8.445 0.003 . 1 . . . . 363 LEU H . 26786 1 223 . 1 1 56 56 LEU C C 13 177.105 0.03 . 1 . . . . 363 LEU C . 26786 1 224 . 1 1 56 56 LEU CA C 13 55.335 0.2 . 1 . . . . 363 LEU CA . 26786 1 225 . 1 1 56 56 LEU CB C 13 42.455 0.2 . 1 . . . . 363 LEU CB . 26786 1 226 . 1 1 56 56 LEU N N 15 125.675 0.03 . 1 . . . . 363 LEU N . 26786 1 227 . 1 1 57 57 TPO H H 1 9.595 0.003 . 1 . . . . 364 THR H . 26786 1 228 . 1 1 57 57 TPO CA C 13 61.395 0.2 . 1 . . . . 364 THR CA . 26786 1 229 . 1 1 57 57 TPO CB C 13 72.715 0.2 . 1 . . . . 364 THR CB . 26786 1 230 . 1 1 57 57 TPO N N 15 125.605 0.03 . 1 . . . . 364 THR N . 26786 1 231 . 1 1 58 58 PRO C C 13 176.535 0.03 . 1 . . . . 365 PRO C . 26786 1 232 . 1 1 58 58 PRO CA C 13 63.185 0.2 . 1 . . . . 365 PRO CA . 26786 1 233 . 1 1 58 58 PRO CB C 13 32.335 0.2 . 1 . . . . 365 PRO CB . 26786 1 234 . 1 1 59 59 VAL H H 1 8.415 0.003 . 1 . . . . 366 VAL H . 26786 1 235 . 1 1 59 59 VAL C C 13 176.035 0.03 . 1 . . . . 366 VAL C . 26786 1 236 . 1 1 59 59 VAL CA C 13 62.235 0.2 . 1 . . . . 366 VAL CA . 26786 1 237 . 1 1 59 59 VAL CB C 13 32.885 0.2 . 1 . . . . 366 VAL CB . 26786 1 238 . 1 1 59 59 VAL N N 15 122.485 0.03 . 1 . . . . 366 VAL N . 26786 1 239 . 1 1 60 60 LEU H H 1 8.555 0.003 . 1 . . . . 367 LEU H . 26786 1 240 . 1 1 60 60 LEU C C 13 176.735 0.03 . 1 . . . . 367 LEU C . 26786 1 241 . 1 1 60 60 LEU CA C 13 54.735 0.2 . 1 . . . . 367 LEU CA . 26786 1 242 . 1 1 60 60 LEU CB C 13 42.335 0.2 . 1 . . . . 367 LEU CB . 26786 1 243 . 1 1 60 60 LEU N N 15 127.935 0.03 . 1 . . . . 367 LEU N . 26786 1 244 . 1 1 61 61 LEU H H 1 8.385 0.003 . 1 . . . . 368 LEU H . 26786 1 245 . 1 1 61 61 LEU C C 13 176.925 0.03 . 1 . . . . 368 LEU C . 26786 1 246 . 1 1 61 61 LEU CA C 13 54.415 0.2 . 1 . . . . 368 LEU CA . 26786 1 247 . 1 1 61 61 LEU CB C 13 42.675 0.2 . 1 . . . . 368 LEU CB . 26786 1 248 . 1 1 61 61 LEU N N 15 124.935 0.03 . 1 . . . . 368 LEU N . 26786 1 249 . 1 1 62 62 TPO H H 1 8.725 0.003 . 1 . . . . 369 THR H . 26786 1 250 . 1 1 62 62 TPO CA C 13 60.025 0.2 . 1 . . . . 369 THR CA . 26786 1 251 . 1 1 62 62 TPO CB C 13 71.305 0.2 . 1 . . . . 369 THR CB . 26786 1 252 . 1 1 62 62 TPO N N 15 118.785 0.03 . 1 . . . . 369 THR N . 26786 1 253 . 1 1 63 63 PRO C C 13 177.955 0.03 . 1 . . . . 370 PRO C . 26786 1 254 . 1 1 63 63 PRO CA C 13 64.695 0.2 . 1 . . . . 370 PRO CA . 26786 1 255 . 1 1 63 63 PRO CB C 13 32.485 0.2 . 1 . . . . 370 PRO CB . 26786 1 256 . 1 1 64 64 SER H H 1 9.275 0.003 . 1 . . . . 371 SER H . 26786 1 257 . 1 1 64 64 SER C C 13 175.235 0.03 . 1 . . . . 371 SER C . 26786 1 258 . 1 1 64 64 SER CA C 13 59.805 0.2 . 1 . . . . 371 SER CA . 26786 1 259 . 1 1 64 64 SER CB C 13 63.215 0.2 . 1 . . . . 371 SER CB . 26786 1 260 . 1 1 64 64 SER N N 15 116.735 0.03 . 1 . . . . 371 SER N . 26786 1 261 . 1 1 65 65 SER H H 1 8.285 0.003 . 1 . . . . 372 SER H . 26786 1 262 . 1 1 65 65 SER C C 13 173.905 0.03 . 1 . . . . 372 SER C . 26786 1 263 . 1 1 65 65 SER CA C 13 58.685 0.2 . 1 . . . . 372 SER CA . 26786 1 264 . 1 1 65 65 SER CB C 13 64.235 0.2 . 1 . . . . 372 SER CB . 26786 1 265 . 1 1 65 65 SER N N 15 117.985 0.03 . 1 . . . . 372 SER N . 26786 1 266 . 1 1 66 66 LEU H H 1 7.975 0.003 . 1 . . . . 373 LEU H . 26786 1 267 . 1 1 66 66 LEU CA C 13 53.135 0.2 . 1 . . . . 373 LEU CA . 26786 1 268 . 1 1 66 66 LEU CB C 13 41.635 0.2 . 1 . . . . 373 LEU CB . 26786 1 269 . 1 1 66 66 LEU N N 15 124.725 0.03 . 1 . . . . 373 LEU N . 26786 1 270 . 1 1 68 68 PRO C C 13 176.925 0.03 . 1 . . . . 375 PRO C . 26786 1 271 . 1 1 68 68 PRO CA C 13 62.875 0.2 . 1 . . . . 375 PRO CA . 26786 1 272 . 1 1 68 68 PRO CB C 13 32.145 0.2 . 1 . . . . 375 PRO CB . 26786 1 273 . 1 1 69 69 SER H H 1 8.485 0.003 . 1 . . . . 376 SER H . 26786 1 274 . 1 1 69 69 SER C C 13 174.625 0.03 . 1 . . . . 376 SER C . 26786 1 275 . 1 1 69 69 SER CA C 13 58.125 0.2 . 1 . . . . 376 SER CA . 26786 1 276 . 1 1 69 69 SER CB C 13 63.855 0.2 . 1 . . . . 376 SER CB . 26786 1 277 . 1 1 69 69 SER N N 15 116.265 0.03 . 1 . . . . 376 SER N . 26786 1 278 . 1 1 70 70 ILE H H 1 8.195 0.003 . 1 . . . . 377 ILE H . 26786 1 279 . 1 1 70 70 ILE C C 13 175.785 0.03 . 1 . . . . 377 ILE C . 26786 1 280 . 1 1 70 70 ILE CA C 13 61.155 0.2 . 1 . . . . 377 ILE CA . 26786 1 281 . 1 1 70 70 ILE CB C 13 38.675 0.2 . 1 . . . . 377 ILE CB . 26786 1 282 . 1 1 70 70 ILE N N 15 122.375 0.03 . 1 . . . . 377 ILE N . 26786 1 283 . 1 1 71 71 HIS H H 1 8.370 0.003 . 1 . . . . 378 HIS H . 26786 1 284 . 1 1 71 71 HIS CA C 13 55.385 0.2 . 1 . . . . 378 HIS CA . 26786 1 285 . 1 1 71 71 HIS CB C 13 30.185 0.2 . 1 . . . . 378 HIS CB . 26786 1 286 . 1 1 71 71 HIS N N 15 123.055 0.03 . 1 . . . . 378 HIS N . 26786 1 287 . 1 1 72 72 PHE C C 13 175.195 0.03 . 1 . . . . 379 PHE C . 26786 1 288 . 1 1 72 72 PHE CA C 13 58.035 0.2 . 1 . . . . 379 PHE CA . 26786 1 289 . 1 1 72 72 PHE CB C 13 39.625 0.2 . 1 . . . . 379 PHE CB . 26786 1 290 . 1 1 73 73 TRP H H 1 8.065 0.003 . 1 . . . . 380 TRP H . 26786 1 291 . 1 1 73 73 TRP C C 13 175.875 0.03 . 1 . . . . 380 TRP C . 26786 1 292 . 1 1 73 73 TRP CA C 13 57.155 0.2 . 1 . . . . 380 TRP CA . 26786 1 293 . 1 1 73 73 TRP CB C 13 29.715 0.2 . 1 . . . . 380 TRP CB . 26786 1 294 . 1 1 73 73 TRP N N 15 122.445 0.03 . 1 . . . . 380 TRP N . 26786 1 295 . 1 1 74 74 SER H H 1 8.135 0.003 . 1 . . . . 381 SER H . 26786 1 296 . 1 1 74 74 SER C C 13 174.435 0.03 . 1 . . . . 381 SER C . 26786 1 297 . 1 1 74 74 SER CA C 13 58.095 0.2 . 1 . . . . 381 SER CA . 26786 1 298 . 1 1 74 74 SER CB C 13 64.025 0.2 . 1 . . . . 381 SER CB . 26786 1 299 . 1 1 74 74 SER N N 15 117.435 0.03 . 1 . . . . 381 SER N . 26786 1 300 . 1 1 75 75 THR H H 1 8.225 0.003 . 1 . . . . 382 THR H . 26786 1 301 . 1 1 75 75 THR C C 13 174.345 0.03 . 1 . . . . 382 THR C . 26786 1 302 . 1 1 75 75 THR CA C 13 61.845 0.2 . 1 . . . . 382 THR CA . 26786 1 303 . 1 1 75 75 THR CB C 13 69.685 0.2 . 1 . . . . 382 THR CB . 26786 1 304 . 1 1 75 75 THR N N 15 115.945 0.03 . 1 . . . . 382 THR N . 26786 1 305 . 1 1 76 76 LEU H H 1 8.275 0.003 . 1 . . . . 383 LEU H . 26786 1 306 . 1 1 76 76 LEU C C 13 177.325 0.03 . 1 . . . . 383 LEU C . 26786 1 307 . 1 1 76 76 LEU CA C 13 54.755 0.2 . 1 . . . . 383 LEU CA . 26786 1 308 . 1 1 76 76 LEU CB C 13 42.425 0.2 . 1 . . . . 383 LEU CB . 26786 1 309 . 1 1 76 76 LEU N N 15 124.155 0.03 . 1 . . . . 383 LEU N . 26786 1 310 . 1 1 77 77 SEP H H 1 8.735 0.003 . 1 . . . . 384 SER H . 26786 1 311 . 1 1 77 77 SEP CA C 13 56.325 0.2 . 1 . . . . 384 SER CA . 26786 1 312 . 1 1 77 77 SEP CB C 13 64.565 0.2 . 1 . . . . 384 SER CB . 26786 1 313 . 1 1 77 77 SEP N N 15 120.455 0.03 . 1 . . . . 384 SER N . 26786 1 314 . 1 1 78 78 PRO C C 13 176.735 0.03 . 1 . . . . 385 PRO C . 26786 1 315 . 1 1 78 78 PRO CA C 13 63.205 0.2 . 1 . . . . 385 PRO CA . 26786 1 316 . 1 1 78 78 PRO CB C 13 32.265 0.2 . 1 . . . . 385 PRO CB . 26786 1 317 . 1 1 79 79 ILE H H 1 8.385 0.003 . 1 . . . . 386 ILE H . 26786 1 318 . 1 1 79 79 ILE C C 13 175.935 0.03 . 1 . . . . 386 ILE C . 26786 1 319 . 1 1 79 79 ILE CA C 13 60.825 0.2 . 1 . . . . 386 ILE CA . 26786 1 320 . 1 1 79 79 ILE CB C 13 38.665 0.2 . 1 . . . . 386 ILE CB . 26786 1 321 . 1 1 79 79 ILE N N 15 121.935 0.03 . 1 . . . . 386 ILE N . 26786 1 322 . 1 1 80 80 ALA H H 1 8.535 0.003 . 1 . . . . 387 ALA H . 26786 1 323 . 1 1 80 80 ALA CA C 13 50.435 0.2 . 1 . . . . 387 ALA CA . 26786 1 324 . 1 1 80 80 ALA CB C 13 18.065 0.2 . 1 . . . . 387 ALA CB . 26786 1 325 . 1 1 80 80 ALA N N 15 130.605 0.03 . 1 . . . . 387 ALA N . 26786 1 326 . 1 1 81 81 PRO C C 13 176.835 0.03 . 1 . . . . 388 PRO C . 26786 1 327 . 1 1 81 81 PRO CA C 13 62.685 0.2 . 1 . . . . 388 PRO CA . 26786 1 328 . 1 1 81 81 PRO CB C 13 32.425 0.2 . 1 . . . . 388 PRO CB . 26786 1 329 . 1 1 82 82 ARG H H 1 8.545 0.003 . 1 . . . . 389 ARG H . 26786 1 330 . 1 1 82 82 ARG C C 13 176.265 0.03 . 1 . . . . 389 ARG C . 26786 1 331 . 1 1 82 82 ARG CA C 13 55.635 0.2 . 1 . . . . 389 ARG CA . 26786 1 332 . 1 1 82 82 ARG CB C 13 31.235 0.2 . 1 . . . . 389 ARG CB . 26786 1 333 . 1 1 82 82 ARG N N 15 122.125 0.03 . 1 . . . . 389 ARG N . 26786 1 334 . 1 1 83 83 SEP H H 1 9.005 0.003 . 1 . . . . 390 SER H . 26786 1 335 . 1 1 83 83 SEP CA C 13 55.835 0.2 . 1 . . . . 390 SER CA . 26786 1 336 . 1 1 83 83 SEP CB C 13 64.725 0.2 . 1 . . . . 390 SER CB . 26786 1 337 . 1 1 83 83 SEP N N 15 119.805 0.03 . 1 . . . . 390 SER N . 26786 1 338 . 1 1 84 84 PRO C C 13 176.705 0.03 . 1 . . . . 391 PRO C . 26786 1 339 . 1 1 84 84 PRO CA C 13 63.175 0.2 . 1 . . . . 391 PRO CA . 26786 1 340 . 1 1 84 84 PRO CB C 13 31.995 0.2 . 1 . . . . 391 PRO CB . 26786 1 341 . 1 1 85 85 ALA H H 1 8.565 0.003 . 1 . . . . 392 ALA H . 26786 1 342 . 1 1 85 85 ALA C C 13 178.105 0.03 . 1 . . . . 392 ALA C . 26786 1 343 . 1 1 85 85 ALA CA C 13 52.695 0.2 . 1 . . . . 392 ALA CA . 26786 1 344 . 1 1 85 85 ALA CB C 13 18.935 0.2 . 1 . . . . 392 ALA CB . 26786 1 345 . 1 1 85 85 ALA N N 15 124.565 0.03 . 1 . . . . 392 ALA N . 26786 1 346 . 1 1 86 86 LYS H H 1 8.505 0.003 . 1 . . . . 393 LYS H . 26786 1 347 . 1 1 86 86 LYS C C 13 176.785 0.03 . 1 . . . . 393 LYS C . 26786 1 348 . 1 1 86 86 LYS CA C 13 55.995 0.2 . 1 . . . . 393 LYS CA . 26786 1 349 . 1 1 86 86 LYS CB C 13 33.005 0.2 . 1 . . . . 393 LYS CB . 26786 1 350 . 1 1 86 86 LYS N N 15 121.445 0.03 . 1 . . . . 393 LYS N . 26786 1 351 . 1 1 87 87 LEU H H 1 8.385 0.003 . 1 . . . . 394 LEU H . 26786 1 352 . 1 1 87 87 LEU C C 13 177.355 0.03 . 1 . . . . 394 LEU C . 26786 1 353 . 1 1 87 87 LEU CA C 13 55.075 0.2 . 1 . . . . 394 LEU CA . 26786 1 354 . 1 1 87 87 LEU CB C 13 42.335 0.2 . 1 . . . . 394 LEU CB . 26786 1 355 . 1 1 87 87 LEU N N 15 123.475 0.03 . 1 . . . . 394 LEU N . 26786 1 356 . 1 1 88 88 SER H H 1 8.335 0.003 . 1 . . . . 395 SER H . 26786 1 357 . 1 1 88 88 SER C C 13 174.085 0.03 . 1 . . . . 395 SER C . 26786 1 358 . 1 1 88 88 SER CA C 13 58.075 0.2 . 1 . . . . 395 SER CA . 26786 1 359 . 1 1 88 88 SER CB C 13 63.895 0.2 . 1 . . . . 395 SER CB . 26786 1 360 . 1 1 88 88 SER N N 15 116.565 0.03 . 1 . . . . 395 SER N . 26786 1 361 . 1 1 89 89 PHE H H 1 8.305 0.003 . 1 . . . . 396 PHE H . 26786 1 362 . 1 1 89 89 PHE C C 13 175.185 0.03 . 1 . . . . 396 PHE C . 26786 1 363 . 1 1 89 89 PHE CA C 13 57.935 0.2 . 1 . . . . 396 PHE CA . 26786 1 364 . 1 1 89 89 PHE CB C 13 39.685 0.2 . 1 . . . . 396 PHE CB . 26786 1 365 . 1 1 89 89 PHE N N 15 122.335 0.03 . 1 . . . . 396 PHE N . 26786 1 366 . 1 1 90 90 GLN H H 1 8.125 0.003 . 1 . . . . 397 GLN H . 26786 1 367 . 1 1 90 90 GLN C C 13 174.835 0.03 . 1 . . . . 397 GLN C . 26786 1 368 . 1 1 90 90 GLN CA C 13 55.235 0.2 . 1 . . . . 397 GLN CA . 26786 1 369 . 1 1 90 90 GLN CB C 13 29.785 0.2 . 1 . . . . 397 GLN CB . 26786 1 370 . 1 1 90 90 GLN N N 15 122.285 0.03 . 1 . . . . 397 GLN N . 26786 1 371 . 1 1 91 91 PHE H H 1 8.335 0.003 . 1 . . . . 398 PHE H . 26786 1 372 . 1 1 91 91 PHE CA C 13 55.935 0.2 . 1 . . . . 398 PHE CA . 26786 1 373 . 1 1 91 91 PHE CB C 13 38.885 0.2 . 1 . . . . 398 PHE CB . 26786 1 374 . 1 1 91 91 PHE N N 15 122.435 0.03 . 1 . . . . 398 PHE N . 26786 1 375 . 1 1 92 92 PRO C C 13 177.055 0.03 . 1 . . . . 399 PRO C . 26786 1 376 . 1 1 92 92 PRO CA C 13 62.965 0.2 . 1 . . . . 399 PRO CA . 26786 1 377 . 1 1 92 92 PRO CB C 13 32.055 0.2 . 1 . . . . 399 PRO CB . 26786 1 378 . 1 1 93 93 SER H H 1 8.645 0.003 . 1 . . . . 400 SER H . 26786 1 379 . 1 1 93 93 SER C C 13 174.975 0.03 . 1 . . . . 400 SER C . 26786 1 380 . 1 1 93 93 SER CA C 13 58.505 0.2 . 1 . . . . 400 SER CA . 26786 1 381 . 1 1 93 93 SER CB C 13 63.895 0.2 . 1 . . . . 400 SER CB . 26786 1 382 . 1 1 93 93 SER N N 15 116.815 0.03 . 1 . . . . 400 SER N . 26786 1 383 . 1 1 94 94 SER H H 1 8.565 0.003 . 1 . . . . 401 SER H . 26786 1 384 . 1 1 94 94 SER C C 13 175.205 0.03 . 1 . . . . 401 SER C . 26786 1 385 . 1 1 94 94 SER CA C 13 58.775 0.2 . 1 . . . . 401 SER CA . 26786 1 386 . 1 1 94 94 SER CB C 13 63.885 0.2 . 1 . . . . 401 SER CB . 26786 1 387 . 1 1 94 94 SER N N 15 117.965 0.03 . 1 . . . . 401 SER N . 26786 1 388 . 1 1 95 95 GLY H H 1 8.575 0.003 . 1 . . . . 402 GLY H . 26786 1 389 . 1 1 95 95 GLY C C 13 174.305 0.03 . 1 . . . . 402 GLY C . 26786 1 390 . 1 1 95 95 GLY CA C 13 45.395 0.2 . 1 . . . . 402 GLY CA . 26786 1 391 . 1 1 95 95 GLY N N 15 111.095 0.03 . 1 . . . . 402 GLY N . 26786 1 392 . 1 1 96 96 SER H H 1 8.315 0.003 . 1 . . . . 403 SER H . 26786 1 393 . 1 1 96 96 SER C C 13 174.385 0.03 . 1 . . . . 403 SER C . 26786 1 394 . 1 1 96 96 SER CA C 13 58.345 0.2 . 1 . . . . 403 SER CA . 26786 1 395 . 1 1 96 96 SER CB C 13 63.985 0.2 . 1 . . . . 403 SER CB . 26786 1 396 . 1 1 96 96 SER N N 15 115.925 0.03 . 1 . . . . 403 SER N . 26786 1 397 . 1 1 97 97 ALA H H 1 8.475 0.003 . 1 . . . . 404 ALA H . 26786 1 398 . 1 1 97 97 ALA C C 13 177.645 0.03 . 1 . . . . 404 ALA C . 26786 1 399 . 1 1 97 97 ALA CA C 13 52.585 0.2 . 1 . . . . 404 ALA CA . 26786 1 400 . 1 1 97 97 ALA CB C 13 19.135 0.2 . 1 . . . . 404 ALA CB . 26786 1 401 . 1 1 97 97 ALA N N 15 125.995 0.03 . 1 . . . . 404 ALA N . 26786 1 402 . 1 1 98 98 GLN H H 1 8.415 0.003 . 1 . . . . 405 GLN H . 26786 1 403 . 1 1 98 98 GLN C C 13 175.835 0.03 . 1 . . . . 405 GLN C . 26786 1 404 . 1 1 98 98 GLN CA C 13 55.685 0.2 . 1 . . . . 405 GLN CA . 26786 1 405 . 1 1 98 98 GLN CB C 13 29.625 0.2 . 1 . . . . 405 GLN CB . 26786 1 406 . 1 1 98 98 GLN N N 15 120.035 0.03 . 1 . . . . 405 GLN N . 26786 1 407 . 1 1 99 99 VAL H H 1 8.275 0.003 . 1 . . . . 406 VAL H . 26786 1 408 . 1 1 99 99 VAL C C 13 175.685 0.03 . 1 . . . . 406 VAL C . 26786 1 409 . 1 1 99 99 VAL CA C 13 62.215 0.2 . 1 . . . . 406 VAL CA . 26786 1 410 . 1 1 99 99 VAL CB C 13 32.975 0.2 . 1 . . . . 406 VAL CB . 26786 1 411 . 1 1 99 99 VAL N N 15 122.305 0.03 . 1 . . . . 406 VAL N . 26786 1 412 . 1 1 100 100 HIS H H 1 8.685 0.003 . 1 . . . . 407 HIS H . 26786 1 413 . 1 1 100 100 HIS C C 13 174.475 0.03 . 1 . . . . 407 HIS C . 26786 1 414 . 1 1 100 100 HIS CA C 13 55.675 0.2 . 1 . . . . 407 HIS CA . 26786 1 415 . 1 1 100 100 HIS CB C 13 30.375 0.2 . 1 . . . . 407 HIS CB . 26786 1 416 . 1 1 100 100 HIS N N 15 124.575 0.03 . 1 . . . . 407 HIS N . 26786 1 417 . 1 1 101 101 ILE H H 1 8.415 0.003 . 1 . . . . 408 ILE H . 26786 1 418 . 1 1 101 101 ILE CA C 13 58.365 0.2 . 1 . . . . 408 ILE CA . 26786 1 419 . 1 1 101 101 ILE CB C 13 38.555 0.2 . 1 . . . . 408 ILE CB . 26786 1 420 . 1 1 101 101 ILE N N 15 126.755 0.03 . 1 . . . . 408 ILE N . 26786 1 421 . 1 1 102 102 PRO C C 13 176.785 0.03 . 1 . . . . 409 PRO C . 26786 1 422 . 1 1 102 102 PRO CA C 13 62.905 0.2 . 1 . . . . 409 PRO CA . 26786 1 423 . 1 1 102 102 PRO CB C 13 32.315 0.2 . 1 . . . . 409 PRO CB . 26786 1 424 . 1 1 103 103 SER H H 1 8.635 0.003 . 1 . . . . 410 SER H . 26786 1 425 . 1 1 103 103 SER C C 13 174.565 0.03 . 1 . . . . 410 SER C . 26786 1 426 . 1 1 103 103 SER CA C 13 58.255 0.2 . 1 . . . . 410 SER CA . 26786 1 427 . 1 1 103 103 SER CB C 13 63.775 0.2 . 1 . . . . 410 SER CB . 26786 1 428 . 1 1 103 103 SER N N 15 117.175 0.03 . 1 . . . . 410 SER N . 26786 1 429 . 1 1 104 104 ILE H H 1 8.345 0.003 . 1 . . . . 411 ILE H . 26786 1 430 . 1 1 104 104 ILE C C 13 176.225 0.03 . 1 . . . . 411 ILE C . 26786 1 431 . 1 1 104 104 ILE CA C 13 61.145 0.2 . 1 . . . . 411 ILE CA . 26786 1 432 . 1 1 104 104 ILE CB C 13 39.095 0.2 . 1 . . . . 411 ILE CB . 26786 1 433 . 1 1 104 104 ILE N N 15 122.755 0.03 . 1 . . . . 411 ILE N . 26786 1 434 . 1 1 105 105 SER H H 1 8.545 0.003 . 1 . . . . 412 SER H . 26786 1 435 . 1 1 105 105 SER C C 13 174.865 0.03 . 1 . . . . 412 SER C . 26786 1 436 . 1 1 105 105 SER CA C 13 58.025 0.2 . 1 . . . . 412 SER CA . 26786 1 437 . 1 1 105 105 SER CB C 13 63.905 0.2 . 1 . . . . 412 SER CB . 26786 1 438 . 1 1 105 105 SER N N 15 120.575 0.03 . 1 . . . . 412 SER N . 26786 1 439 . 1 1 106 106 VAL H H 1 8.495 0.003 . 1 . . . . 413 VAL H . 26786 1 440 . 1 1 106 106 VAL C C 13 176.125 0.03 . 1 . . . . 413 VAL C . 26786 1 441 . 1 1 106 106 VAL CA C 13 62.445 0.2 . 1 . . . . 413 VAL CA . 26786 1 442 . 1 1 106 106 VAL CB C 13 32.695 0.2 . 1 . . . . 413 VAL CB . 26786 1 443 . 1 1 106 106 VAL N N 15 122.435 0.03 . 1 . . . . 413 VAL N . 26786 1 444 . 1 1 107 107 ASP H H 1 8.435 0.003 . 1 . . . . 414 ASP H . 26786 1 445 . 1 1 107 107 ASP C C 13 176.735 0.03 . 1 . . . . 414 ASP C . 26786 1 446 . 1 1 107 107 ASP CA C 13 54.515 0.2 . 1 . . . . 414 ASP CA . 26786 1 447 . 1 1 107 107 ASP CB C 13 41.215 0.2 . 1 . . . . 414 ASP CB . 26786 1 448 . 1 1 107 107 ASP N N 15 123.085 0.03 . 1 . . . . 414 ASP N . 26786 1 449 . 1 1 108 108 GLY H H 1 8.385 0.003 . 1 . . . . 415 GLY H . 26786 1 450 . 1 1 108 108 GLY C C 13 174.125 0.03 . 1 . . . . 415 GLY C . 26786 1 451 . 1 1 108 108 GLY CA C 13 45.425 0.2 . 1 . . . . 415 GLY CA . 26786 1 452 . 1 1 108 108 GLY N N 15 109.405 0.03 . 1 . . . . 415 GLY N . 26786 1 453 . 1 1 109 109 LEU H H 1 8.185 0.003 . 1 . . . . 416 LEU H . 26786 1 454 . 1 1 109 109 LEU C C 13 177.455 0.03 . 1 . . . . 416 LEU C . 26786 1 455 . 1 1 109 109 LEU CA C 13 54.935 0.2 . 1 . . . . 416 LEU CA . 26786 1 456 . 1 1 109 109 LEU CB C 13 42.525 0.2 . 1 . . . . 416 LEU CB . 26786 1 457 . 1 1 109 109 LEU N N 15 121.525 0.03 . 1 . . . . 416 LEU N . 26786 1 458 . 1 1 110 110 SER H H 1 8.365 0.003 . 1 . . . . 417 SER H . 26786 1 459 . 1 1 110 110 SER C C 13 174.015 0.03 . 1 . . . . 417 SER C . 26786 1 460 . 1 1 110 110 SER CA C 13 58.435 0.2 . 1 . . . . 417 SER CA . 26786 1 461 . 1 1 110 110 SER CB C 13 64.075 0.2 . 1 . . . . 417 SER CB . 26786 1 462 . 1 1 110 110 SER N N 15 117.355 0.03 . 1 . . . . 417 SER N . 26786 1 463 . 1 1 111 111 TPO H H 1 9.325 0.003 . 1 . . . . 418 THR H . 26786 1 464 . 1 1 111 111 TPO CA C 13 60.965 0.2 . 1 . . . . 418 THR CA . 26786 1 465 . 1 1 111 111 TPO CB C 13 72.905 0.2 . 1 . . . . 418 THR CB . 26786 1 466 . 1 1 111 111 TPO N N 15 123.045 0.03 . 1 . . . . 418 THR N . 26786 1 467 . 1 1 112 112 PRO C C 13 176.585 0.03 . 1 . . . . 419 PRO C . 26786 1 468 . 1 1 112 112 PRO CA C 13 63.235 0.2 . 1 . . . . 419 PRO CA . 26786 1 469 . 1 1 112 112 PRO CB C 13 32.285 0.2 . 1 . . . . 419 PRO CB . 26786 1 470 . 1 1 113 113 VAL H H 1 8.470 0.003 . 1 . . . . 420 VAL H . 26786 1 471 . 1 1 113 113 VAL C C 13 176.115 0.03 . 1 . . . . 420 VAL C . 26786 1 472 . 1 1 113 113 VAL CA C 13 62.585 0.2 . 1 . . . . 420 VAL CA . 26786 1 473 . 1 1 113 113 VAL CB C 13 32.835 0.2 . 1 . . . . 420 VAL CB . 26786 1 474 . 1 1 113 113 VAL N N 15 122.635 0.03 . 1 . . . . 420 VAL N . 26786 1 475 . 1 1 114 114 VAL H H 1 8.555 0.003 . 1 . . . . 421 VAL H . 26786 1 476 . 1 1 114 114 VAL C C 13 175.875 0.03 . 1 . . . . 421 VAL C . 26786 1 477 . 1 1 114 114 VAL CA C 13 62.115 0.2 . 1 . . . . 421 VAL CA . 26786 1 478 . 1 1 114 114 VAL CB C 13 32.835 0.2 . 1 . . . . 421 VAL CB . 26786 1 479 . 1 1 114 114 VAL N N 15 127.165 0.03 . 1 . . . . 421 VAL N . 26786 1 480 . 1 1 115 115 LEU H H 1 8.585 0.003 . 1 . . . . 422 LEU H . 26786 1 481 . 1 1 115 115 LEU C C 13 177.025 0.03 . 1 . . . . 422 LEU C . 26786 1 482 . 1 1 115 115 LEU CA C 13 54.485 0.2 . 1 . . . . 422 LEU CA . 26786 1 483 . 1 1 115 115 LEU CB C 13 42.585 0.2 . 1 . . . . 422 LEU CB . 26786 1 484 . 1 1 115 115 LEU N N 15 128.265 0.03 . 1 . . . . 422 LEU N . 26786 1 485 . 1 1 116 116 SEP H H 1 8.815 0.003 . 1 . . . . 423 SER H . 26786 1 486 . 1 1 116 116 SEP CA C 13 55.755 0.2 . 1 . . . . 423 SER CA . 26786 1 487 . 1 1 116 116 SEP CB C 13 65.065 0.2 . 1 . . . . 423 SER CB . 26786 1 488 . 1 1 116 116 SEP N N 15 119.675 0.03 . 1 . . . . 423 SER N . 26786 1 489 . 1 1 117 117 PRO C C 13 177.395 0.03 . 1 . . . . 424 PRO C . 26786 1 490 . 1 1 117 117 PRO CA C 13 63.635 0.2 . 1 . . . . 424 PRO CA . 26786 1 491 . 1 1 117 117 PRO CB C 13 32.365 0.2 . 1 . . . . 424 PRO CB . 26786 1 492 . 1 1 118 118 GLY H H 1 8.345 0.003 . 1 . . . . 425 GLY H . 26786 1 493 . 1 1 118 118 GLY CA C 13 44.565 0.2 . 1 . . . . 425 GLY CA . 26786 1 494 . 1 1 118 118 GLY N N 15 109.095 0.03 . 1 . . . . 425 GLY N . 26786 1 495 . 1 1 119 119 PRO C C 13 177.215 0.03 . 1 . . . . 426 PRO C . 26786 1 496 . 1 1 119 119 PRO CA C 13 63.015 0.2 . 1 . . . . 426 PRO CA . 26786 1 497 . 1 1 119 119 PRO CB C 13 32.265 0.2 . 1 . . . . 426 PRO CB . 26786 1 498 . 1 1 120 120 GLN H H 1 8.685 0.003 . 1 . . . . 427 GLN H . 26786 1 499 . 1 1 120 120 GLN C C 13 175.875 0.03 . 1 . . . . 427 GLN C . 26786 1 500 . 1 1 120 120 GLN CA C 13 55.715 0.2 . 1 . . . . 427 GLN CA . 26786 1 501 . 1 1 120 120 GLN CB C 13 29.565 0.2 . 1 . . . . 427 GLN CB . 26786 1 502 . 1 1 120 120 GLN N N 15 121.415 0.03 . 1 . . . . 427 GLN N . 26786 1 503 . 1 1 121 121 LYS H H 1 8.575 0.003 . 1 . . . . 428 LYS H . 26786 1 504 . 1 1 121 121 LYS CA C 13 54.205 0.2 . 1 . . . . 428 LYS CA . 26786 1 505 . 1 1 121 121 LYS CB C 13 32.415 0.2 . 1 . . . . 428 LYS CB . 26786 1 506 . 1 1 121 121 LYS N N 15 125.525 0.03 . 1 . . . . 428 LYS N . 26786 1 stop_ save_