################################### # 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_chemical_shifts_1 _Assigned_chem_shift_list.Sf_category assigned_chemical_shifts _Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1 _Assigned_chem_shift_list.Entry_ID 50643 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name . _Assigned_chem_shift_list.Sample_condition_list_ID 1 _Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1 _Assigned_chem_shift_list.Chem_shift_reference_ID 1 _Assigned_chem_shift_list.Chem_shift_reference_label $chem_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' . . . 50643 1 2 '3D HNCA' . . . 50643 1 3 '3D HN(CO)CA' . . . 50643 1 stop_ loop_ _Systematic_chem_shift_offset.Type _Systematic_chem_shift_offset.Atom_type _Systematic_chem_shift_offset.Atom_isotope_number _Systematic_chem_shift_offset.Val _Systematic_chem_shift_offset.Val_err _Systematic_chem_shift_offset.Entry_ID _Systematic_chem_shift_offset.Assigned_chem_shift_list_ID 'spectrometer error' 'all 13C' 13 -2.40 . 50643 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 $software_1 . . 50643 1 2 $software_2 . . 50643 1 3 $software_3 . . 50643 1 4 $software_4 . . 50643 1 stop_ loop_ _Atom_chem_shift.ID _Atom_chem_shift.Assembly_atom_ID _Atom_chem_shift.Entity_assembly_ID _Atom_chem_shift.Entity_assembly_asym_ID _Atom_chem_shift.Entity_ID _Atom_chem_shift.Comp_index_ID _Atom_chem_shift.Seq_ID _Atom_chem_shift.Comp_ID _Atom_chem_shift.Atom_ID _Atom_chem_shift.Atom_type _Atom_chem_shift.Atom_isotope_number _Atom_chem_shift.Val _Atom_chem_shift.Val_err _Atom_chem_shift.Assign_fig_of_merit _Atom_chem_shift.Ambiguity_code _Atom_chem_shift.Ambiguity_set_ID _Atom_chem_shift.Occupancy _Atom_chem_shift.Resonance_ID _Atom_chem_shift.Auth_entity_assembly_ID _Atom_chem_shift.Auth_asym_ID _Atom_chem_shift.Auth_seq_ID _Atom_chem_shift.Auth_comp_ID _Atom_chem_shift.Auth_atom_ID _Atom_chem_shift.Details _Atom_chem_shift.Entry_ID _Atom_chem_shift.Assigned_chem_shift_list_ID 1 . 1 . 1 2 2 GLY H H 1 8.300 0.002 . 1 . . 612 . . 2 GLY H . 50643 1 2 . 1 . 1 2 2 GLY CA C 13 45.643 0.016 . 1 . . 283 . . 2 GLY CA . 50643 1 3 . 1 . 1 2 2 GLY N N 15 113.308 0.007 . 1 . . 282 . . 2 GLY N . 50643 1 4 . 1 . 1 3 3 ALA H H 1 8.483 0.005 . 1 . . 284 . . 3 ALA H . 50643 1 5 . 1 . 1 3 3 ALA CA C 13 53.127 0.016 . 1 . . 286 . . 3 ALA CA . 50643 1 6 . 1 . 1 3 3 ALA N N 15 124.910 0.017 . 1 . . 285 . . 3 ALA N . 50643 1 7 . 1 . 1 4 4 ARG H H 1 8.071 0.001 . 1 . . 287 . . 4 ARG H . 50643 1 8 . 1 . 1 4 4 ARG CA C 13 56.302 . . 1 . . 289 . . 4 ARG CA . 50643 1 9 . 1 . 1 4 4 ARG N N 15 117.734 0.011 . 1 . . 288 . . 4 ARG N . 50643 1 10 . 1 . 1 5 5 ALA H H 1 7.935 0.001 . 1 . . 290 . . 5 ALA H . 50643 1 11 . 1 . 1 5 5 ALA CA C 13 53.255 0.022 . 1 . . 292 . . 5 ALA CA . 50643 1 12 . 1 . 1 5 5 ALA N N 15 121.582 0.044 . 1 . . 291 . . 5 ALA N . 50643 1 13 . 1 . 1 6 6 SER H H 1 7.903 0.0 . 1 . . 293 . . 6 SER H . 50643 1 14 . 1 . 1 6 6 SER CA C 13 58.883 . . 1 . . 295 . . 6 SER CA . 50643 1 15 . 1 . 1 6 6 SER N N 15 111.943 0.03 . 1 . . 294 . . 6 SER N . 50643 1 16 . 1 . 1 7 7 VAL H H 1 7.605 . . 1 . . 296 . . 7 VAL H . 50643 1 17 . 1 . 1 7 7 VAL N N 15 118.511 . . 1 . . 297 . . 7 VAL N . 50643 1 18 . 1 . 1 9 9 SER CA C 13 57.683 . . 1 . . 301 . . 9 SER CA . 50643 1 19 . 1 . 1 10 10 GLY H H 1 8.771 0.005 . 1 . . 298 . . 10 GLY H . 50643 1 20 . 1 . 1 10 10 GLY CA C 13 46.632 0.045 . 1 . . 300 . . 10 GLY CA . 50643 1 21 . 1 . 1 10 10 GLY N N 15 110.288 0.017 . 1 . . 299 . . 10 GLY N . 50643 1 22 . 1 . 1 11 11 GLY H H 1 8.556 0.001 . 1 . . 302 . . 11 GLY H . 50643 1 23 . 1 . 1 11 11 GLY CA C 13 46.294 . . 1 . . 304 . . 11 GLY CA . 50643 1 24 . 1 . 1 11 11 GLY N N 15 109.439 0.01 . 1 . . 303 . . 11 GLY N . 50643 1 25 . 1 . 1 13 13 LEU H H 1 8.135 0.0 . 1 . . 309 . . 13 LEU H . 50643 1 26 . 1 . 1 13 13 LEU CA C 13 57.392 0.018 . 1 . . 308 . . 13 LEU CA . 50643 1 27 . 1 . 1 13 13 LEU N N 15 120.684 0.001 . 1 . . 310 . . 13 LEU N . 50643 1 28 . 1 . 1 14 14 ASP H H 1 7.714 0.001 . 1 . . 305 . . 14 ASP H . 50643 1 29 . 1 . 1 14 14 ASP CA C 13 56.788 0.026 . 1 . . 307 . . 14 ASP CA . 50643 1 30 . 1 . 1 14 14 ASP N N 15 116.948 0.03 . 1 . . 306 . . 14 ASP N . 50643 1 31 . 1 . 1 15 15 LYS H H 1 7.249 0.002 . 1 . . 311 . . 15 LYS H . 50643 1 32 . 1 . 1 15 15 LYS CA C 13 58.345 . . 1 . . 313 . . 15 LYS CA . 50643 1 33 . 1 . 1 15 15 LYS N N 15 116.268 0.029 . 1 . . 312 . . 15 LYS N . 50643 1 34 . 1 . 1 17 17 GLU H H 1 7.575 0.002 . 1 . . 318 . . 17 GLU H . 50643 1 35 . 1 . 1 17 17 GLU CA C 13 56.547 0.002 . 1 . . 320 . . 17 GLU CA . 50643 1 36 . 1 . 1 17 17 GLU N N 15 108.213 0.014 . 1 . . 319 . . 17 GLU N . 50643 1 37 . 1 . 1 18 18 LYS H H 1 7.341 0.003 . 1 . . 321 . . 18 LYS H . 50643 1 38 . 1 . 1 18 18 LYS CA C 13 55.434 . . 1 . . 323 . . 18 LYS CA . 50643 1 39 . 1 . 1 18 18 LYS N N 15 115.686 0.035 . 1 . . 322 . . 18 LYS N . 50643 1 40 . 1 . 1 19 19 ILE H H 1 7.597 0.002 . 1 . . 324 . . 19 ILE H . 50643 1 41 . 1 . 1 19 19 ILE CA C 13 62.873 . . 1 . . 326 . . 19 ILE CA . 50643 1 42 . 1 . 1 19 19 ILE N N 15 124.255 0.014 . 1 . . 325 . . 19 ILE N . 50643 1 43 . 1 . 1 20 20 ARG H H 1 8.017 0.001 . 1 . . 327 . . 20 ARG H . 50643 1 44 . 1 . 1 20 20 ARG CA C 13 56.100 0.0 . 1 . . 329 . . 20 ARG CA . 50643 1 45 . 1 . 1 20 20 ARG N N 15 125.997 0.002 . 1 . . 328 . . 20 ARG N . 50643 1 46 . 1 . 1 21 21 LEU H H 1 7.783 0.002 . 1 . . 330 . . 21 LEU H . 50643 1 47 . 1 . 1 21 21 LEU CA C 13 57.961 . . 1 . . 334 . . 21 LEU CA . 50643 1 48 . 1 . 1 21 21 LEU N N 15 120.674 0.002 . 1 . . 331 . . 21 LEU N . 50643 1 49 . 1 . 1 22 22 ARG H H 1 8.996 0.005 . 1 . . 332 . . 22 ARG H . 50643 1 50 . 1 . 1 22 22 ARG CA C 13 52.535 . . 1 . . 335 . . 22 ARG CA . 50643 1 51 . 1 . 1 22 22 ARG N N 15 119.839 0.035 . 1 . . 333 . . 22 ARG N . 50643 1 52 . 1 . 1 23 23 PRO CA C 13 63.208 . . 1 . . 338 . . 23 PRO CA . 50643 1 53 . 1 . 1 24 24 GLY H H 1 9.116 0.001 . 1 . . 336 . . 24 GLY H . 50643 1 54 . 1 . 1 24 24 GLY CA C 13 45.473 0.005 . 1 . . 339 . . 24 GLY CA . 50643 1 55 . 1 . 1 24 24 GLY N N 15 112.987 0.019 . 1 . . 337 . . 24 GLY N . 50643 1 56 . 1 . 1 25 25 GLY H H 1 8.102 0.003 . 1 . . 340 . . 25 GLY H . 50643 1 57 . 1 . 1 25 25 GLY CA C 13 44.269 . . 1 . . 342 . . 25 GLY CA . 50643 1 58 . 1 . 1 25 25 GLY N N 15 108.217 0.029 . 1 . . 341 . . 25 GLY N . 50643 1 59 . 1 . 1 34 34 ILE H H 1 7.859 0.001 . 1 . . 596 . . 34 ILE H . 50643 1 60 . 1 . 1 34 34 ILE CA C 13 64.110 0.029 . 1 . . 597 . . 34 ILE CA . 50643 1 61 . 1 . 1 34 34 ILE N N 15 119.584 0.002 . 1 . . 595 . . 34 ILE N . 50643 1 62 . 1 . 1 35 35 VAL H H 1 7.694 0.001 . 1 . . 349 . . 35 VAL H . 50643 1 63 . 1 . 1 35 35 VAL N N 15 121.225 0.037 . 1 . . 350 . . 35 VAL N . 50643 1 64 . 1 . 1 36 36 TRP H H 1 8.546 0.001 . 1 . . 347 . . 36 TRP H . 50643 1 65 . 1 . 1 36 36 TRP CA C 13 61.601 0.033 . 1 . . 346 . . 36 TRP CA . 50643 1 66 . 1 . 1 36 36 TRP N N 15 120.470 0.004 . 1 . . 348 . . 36 TRP N . 50643 1 67 . 1 . 1 37 37 ALA H H 1 8.275 0.004 . 1 . . 343 . . 37 ALA H . 50643 1 68 . 1 . 1 37 37 ALA CA C 13 54.847 0.019 . 1 . . 345 . . 37 ALA CA . 50643 1 69 . 1 . 1 37 37 ALA N N 15 120.566 0.076 . 1 . . 344 . . 37 ALA N . 50643 1 70 . 1 . 1 38 38 SER H H 1 8.189 0.001 . 1 . . 352 . . 38 SER H . 50643 1 71 . 1 . 1 38 38 SER CA C 13 62.096 0.026 . 1 . . 354 . . 38 SER CA . 50643 1 72 . 1 . 1 38 38 SER N N 15 111.525 0.071 . 1 . . 353 . . 38 SER N . 50643 1 73 . 1 . 1 39 39 ARG H H 1 7.529 0.002 . 1 . . 355 . . 39 ARG H . 50643 1 74 . 1 . 1 39 39 ARG CA C 13 58.335 0.054 . 1 . . 357 . . 39 ARG CA . 50643 1 75 . 1 . 1 39 39 ARG N N 15 120.693 0.028 . 1 . . 356 . . 39 ARG N . 50643 1 76 . 1 . 1 40 40 GLU H H 1 8.211 0.001 . 1 . . 362 . . 40 GLU H . 50643 1 77 . 1 . 1 40 40 GLU CA C 13 58.025 0.059 . 1 . . 361 . . 40 GLU CA . 50643 1 78 . 1 . 1 40 40 GLU N N 15 121.087 0.019 . 1 . . 363 . . 40 GLU N . 50643 1 79 . 1 . 1 41 41 LEU H H 1 7.969 0.001 . 1 . . 358 . . 41 LEU H . 50643 1 80 . 1 . 1 41 41 LEU CA C 13 57.906 0.007 . 1 . . 360 . . 41 LEU CA . 50643 1 81 . 1 . 1 41 41 LEU N N 15 117.050 0.033 . 1 . . 359 . . 41 LEU N . 50643 1 82 . 1 . 1 42 42 GLU H H 1 7.537 0.001 . 1 . . 364 . . 42 GLU H . 50643 1 83 . 1 . 1 42 42 GLU CA C 13 59.456 0.02 . 1 . . 366 . . 42 GLU CA . 50643 1 84 . 1 . 1 42 42 GLU N N 15 117.651 0.013 . 1 . . 365 . . 42 GLU N . 50643 1 85 . 1 . 1 43 43 ARG H H 1 7.637 0.001 . 1 . . 367 . . 43 ARG H . 50643 1 86 . 1 . 1 43 43 ARG CA C 13 58.415 0.026 . 1 . . 369 . . 43 ARG CA . 50643 1 87 . 1 . 1 43 43 ARG N N 15 119.839 0.022 . 1 . . 368 . . 43 ARG N . 50643 1 88 . 1 . 1 44 44 PHE H H 1 7.509 0.0 . 1 . . 370 . . 44 PHE H . 50643 1 89 . 1 . 1 44 44 PHE CA C 13 57.043 0.034 . 1 . . 372 . . 44 PHE CA . 50643 1 90 . 1 . 1 44 44 PHE N N 15 117.850 0.034 . 1 . . 371 . . 44 PHE N . 50643 1 91 . 1 . 1 45 45 ALA H H 1 7.929 0.003 . 1 . . 373 . . 45 ALA H . 50643 1 92 . 1 . 1 45 45 ALA CA C 13 52.990 0.015 . 1 . . 375 . . 45 ALA CA . 50643 1 93 . 1 . 1 45 45 ALA N N 15 119.156 0.062 . 1 . . 374 . . 45 ALA N . 50643 1 94 . 1 . 1 46 46 VAL H H 1 7.747 0.001 . 1 . . 376 . . 46 VAL H . 50643 1 95 . 1 . 1 46 46 VAL CA C 13 60.597 0.017 . 1 . . 378 . . 46 VAL CA . 50643 1 96 . 1 . 1 46 46 VAL N N 15 119.566 0.026 . 1 . . 377 . . 46 VAL N . 50643 1 97 . 1 . 1 47 47 ASN H H 1 8.380 0.002 . 1 . . 379 . . 47 ASN H . 50643 1 98 . 1 . 1 47 47 ASN CA C 13 50.777 . . 1 . . 598 . . 47 ASN CA . 50643 1 99 . 1 . 1 47 47 ASN N N 15 125.848 0.02 . 1 . . 380 . . 47 ASN N . 50643 1 100 . 1 . 1 48 48 PRO CA C 13 64.049 . . 1 . . 384 . . 48 PRO CA . 50643 1 101 . 1 . 1 49 49 GLY H H 1 8.506 0.005 . 1 . . 381 . . 49 GLY H . 50643 1 102 . 1 . 1 49 49 GLY CA C 13 46.211 0.001 . 1 . . 383 . . 49 GLY CA . 50643 1 103 . 1 . 1 49 49 GLY N N 15 106.968 0.065 . 1 . . 382 . . 49 GLY N . 50643 1 104 . 1 . 1 50 50 LEU H H 1 7.780 0.001 . 1 . . 385 . . 50 LEU H . 50643 1 105 . 1 . 1 50 50 LEU CA C 13 56.981 0.004 . 1 . . 387 . . 50 LEU CA . 50643 1 106 . 1 . 1 50 50 LEU N N 15 122.209 0.008 . 1 . . 386 . . 50 LEU N . 50643 1 107 . 1 . 1 51 51 LEU H H 1 7.452 0.011 . 1 . . 599 . . 51 LEU H . 50643 1 108 . 1 . 1 51 51 LEU CA C 13 55.961 . . 1 . . 391 . . 51 LEU CA . 50643 1 109 . 1 . 1 51 51 LEU N N 15 112.415 0.091 . 1 . . 600 . . 51 LEU N . 50643 1 110 . 1 . 1 52 52 GLU H H 1 7.435 0.002 . 1 . . 388 . . 52 GLU H . 50643 1 111 . 1 . 1 52 52 GLU CA C 13 58.238 0.024 . 1 . . 390 . . 52 GLU CA . 50643 1 112 . 1 . 1 52 52 GLU N N 15 114.275 0.031 . 1 . . 389 . . 52 GLU N . 50643 1 113 . 1 . 1 53 53 THR H H 1 7.199 0.001 . 1 . . 392 . . 53 THR H . 50643 1 114 . 1 . 1 53 53 THR CA C 13 57.968 0.002 . 1 . . 601 . . 53 THR CA . 50643 1 115 . 1 . 1 53 53 THR N N 15 103.380 0.025 . 1 . . 393 . . 53 THR N . 50643 1 116 . 1 . 1 54 54 SER H H 1 9.243 0.001 . 1 . . 398 . . 54 SER H . 50643 1 117 . 1 . 1 54 54 SER CA C 13 62.213 0.014 . 1 . . 397 . . 54 SER CA . 50643 1 118 . 1 . 1 54 54 SER N N 15 119.191 0.009 . 1 . . 399 . . 54 SER N . 50643 1 119 . 1 . 1 55 55 GLU H H 1 8.858 0.001 . 1 . . 394 . . 55 GLU H . 50643 1 120 . 1 . 1 55 55 GLU CA C 13 59.379 0.008 . 1 . . 396 . . 55 GLU CA . 50643 1 121 . 1 . 1 55 55 GLU N N 15 121.655 0.025 . 1 . . 395 . . 55 GLU N . 50643 1 122 . 1 . 1 56 56 GLY H H 1 8.481 0.003 . 1 . . 400 . . 56 GLY H . 50643 1 123 . 1 . 1 56 56 GLY CA C 13 47.646 0.042 . 1 . . 402 . . 56 GLY CA . 50643 1 124 . 1 . 1 56 56 GLY N N 15 110.947 0.042 . 1 . . 401 . . 56 GLY N . 50643 1 125 . 1 . 1 57 57 CYS H H 1 8.138 0.002 . 1 . . 403 . . 57 CYS H . 50643 1 126 . 1 . 1 57 57 CYS CA C 13 64.756 0.003 . 1 . . 405 . . 57 CYS CA . 50643 1 127 . 1 . 1 57 57 CYS N N 15 118.745 0.032 . 1 . . 404 . . 57 CYS N . 50643 1 128 . 1 . 1 58 58 ARG H H 1 8.488 0.003 . 1 . . 406 . . 58 ARG H . 50643 1 129 . 1 . 1 58 58 ARG CA C 13 59.607 0.015 . 1 . . 408 . . 58 ARG CA . 50643 1 130 . 1 . 1 58 58 ARG N N 15 119.862 0.017 . 1 . . 407 . . 58 ARG N . 50643 1 131 . 1 . 1 59 59 GLN H H 1 8.004 0.001 . 1 . . 613 . . 59 GLN H . 50643 1 132 . 1 . 1 59 59 GLN CA C 13 58.891 0.042 . 1 . . 615 . . 59 GLN CA . 50643 1 133 . 1 . 1 59 59 GLN N N 15 120.070 0.057 . 1 . . 614 . . 59 GLN N . 50643 1 134 . 1 . 1 60 60 ILE H H 1 8.145 0.0 . 1 . . 412 . . 60 ILE H . 50643 1 135 . 1 . 1 60 60 ILE CA C 13 65.559 0.009 . 1 . . 411 . . 60 ILE CA . 50643 1 136 . 1 . 1 60 60 ILE N N 15 120.529 0.026 . 1 . . 413 . . 60 ILE N . 50643 1 137 . 1 . 1 61 61 LEU H H 1 8.359 0.001 . 1 . . 409 . . 61 LEU H . 50643 1 138 . 1 . 1 61 61 LEU CA C 13 58.435 0.035 . 1 . . 414 . . 61 LEU CA . 50643 1 139 . 1 . 1 61 61 LEU N N 15 118.972 0.03 . 1 . . 410 . . 61 LEU N . 50643 1 140 . 1 . 1 62 62 GLY H H 1 7.869 0.003 . 1 . . 415 . . 62 GLY H . 50643 1 141 . 1 . 1 62 62 GLY CA C 13 46.728 0.015 . 1 . . 417 . . 62 GLY CA . 50643 1 142 . 1 . 1 62 62 GLY N N 15 103.666 0.051 . 1 . . 416 . . 62 GLY N . 50643 1 143 . 1 . 1 63 63 GLN H H 1 7.781 0.003 . 1 . . 418 . . 63 GLN H . 50643 1 144 . 1 . 1 63 63 GLN CA C 13 57.838 0.032 . 1 . . 420 . . 63 GLN CA . 50643 1 145 . 1 . 1 63 63 GLN N N 15 119.837 0.059 . 1 . . 419 . . 63 GLN N . 50643 1 146 . 1 . 1 64 64 LEU H H 1 8.210 0.002 . 1 . . 421 . . 64 LEU H . 50643 1 147 . 1 . 1 64 64 LEU CA C 13 55.961 0.009 . 1 . . 423 . . 64 LEU CA . 50643 1 148 . 1 . 1 64 64 LEU N N 15 117.271 0.009 . 1 . . 422 . . 64 LEU N . 50643 1 149 . 1 . 1 65 65 GLN H H 1 8.095 0.003 . 1 . . 424 . . 65 GLN H . 50643 1 150 . 1 . 1 65 65 GLN CA C 13 61.196 . . 1 . . 426 . . 65 GLN CA . 50643 1 151 . 1 . 1 65 65 GLN N N 15 118.849 0.043 . 1 . . 425 . . 65 GLN N . 50643 1 152 . 1 . 1 66 66 PRO CA C 13 65.539 . . 1 . . 430 . . 66 PRO CA . 50643 1 153 . 1 . 1 67 67 SER H H 1 7.752 0.0 . 1 . . 427 . . 67 SER H . 50643 1 154 . 1 . 1 67 67 SER CA C 13 59.671 0.014 . 1 . . 429 . . 67 SER CA . 50643 1 155 . 1 . 1 67 67 SER N N 15 111.714 0.009 . 1 . . 428 . . 67 SER N . 50643 1 156 . 1 . 1 68 68 LEU H H 1 7.585 0.001 . 1 . . 431 . . 68 LEU H . 50643 1 157 . 1 . 1 68 68 LEU CA C 13 57.528 0.021 . 1 . . 433 . . 68 LEU CA . 50643 1 158 . 1 . 1 68 68 LEU N N 15 121.124 0.009 . 1 . . 432 . . 68 LEU N . 50643 1 159 . 1 . 1 69 69 GLN H H 1 8.034 0.002 . 1 . . 434 . . 69 GLN H . 50643 1 160 . 1 . 1 69 69 GLN CA C 13 58.275 0.014 . 1 . . 436 . . 69 GLN CA . 50643 1 161 . 1 . 1 69 69 GLN N N 15 117.383 0.012 . 1 . . 435 . . 69 GLN N . 50643 1 162 . 1 . 1 70 70 ARG H H 1 7.745 0.001 . 1 . . 616 . . 70 ARG H . 50643 1 163 . 1 . 1 70 70 ARG CA C 13 55.497 0.013 . 1 . . 317 . . 70 ARG CA . 50643 1 164 . 1 . 1 70 70 ARG N N 15 116.523 0.002 . 1 . . 617 . . 70 ARG N . 50643 1 165 . 1 . 1 71 71 GLY H H 1 7.632 0.0 . 1 . . 314 . . 71 GLY H . 50643 1 166 . 1 . 1 71 71 GLY CA C 13 45.271 0.002 . 1 . . 316 . . 71 GLY CA . 50643 1 167 . 1 . 1 71 71 GLY N N 15 107.774 0.008 . 1 . . 315 . . 71 GLY N . 50643 1 168 . 1 . 1 72 72 SER H H 1 8.171 0.001 . 1 . . 437 . . 72 SER H . 50643 1 169 . 1 . 1 72 72 SER CA C 13 57.007 0.013 . 1 . . 439 . . 72 SER CA . 50643 1 170 . 1 . 1 72 72 SER N N 15 115.495 0.011 . 1 . . 438 . . 72 SER N . 50643 1 171 . 1 . 1 73 73 GLU H H 1 8.999 0.001 . 1 . . 440 . . 73 GLU H . 50643 1 172 . 1 . 1 73 73 GLU CA C 13 58.895 0.009 . 1 . . 442 . . 73 GLU CA . 50643 1 173 . 1 . 1 73 73 GLU N N 15 123.858 0.014 . 1 . . 441 . . 73 GLU N . 50643 1 174 . 1 . 1 74 74 GLU H H 1 8.781 0.001 . 1 . . 447 . . 74 GLU H . 50643 1 175 . 1 . 1 74 74 GLU CA C 13 59.982 0.01 . 1 . . 446 . . 74 GLU CA . 50643 1 176 . 1 . 1 74 74 GLU N N 15 120.257 0.029 . 1 . . 448 . . 74 GLU N . 50643 1 177 . 1 . 1 75 75 LEU H H 1 7.772 0.001 . 1 . . 443 . . 75 LEU H . 50643 1 178 . 1 . 1 75 75 LEU CA C 13 57.231 0.005 . 1 . . 445 . . 75 LEU CA . 50643 1 179 . 1 . 1 75 75 LEU N N 15 121.669 0.039 . 1 . . 444 . . 75 LEU N . 50643 1 180 . 1 . 1 76 76 ARG H H 1 7.866 0.0 . 1 . . 449 . . 76 ARG H . 50643 1 181 . 1 . 1 76 76 ARG CA C 13 59.559 0.005 . 1 . . 451 . . 76 ARG CA . 50643 1 182 . 1 . 1 76 76 ARG N N 15 119.833 0.007 . 1 . . 450 . . 76 ARG N . 50643 1 183 . 1 . 1 77 77 SER H H 1 8.580 0.001 . 1 . . 452 . . 77 SER H . 50643 1 184 . 1 . 1 77 77 SER CA C 13 62.220 0.023 . 1 . . 454 . . 77 SER CA . 50643 1 185 . 1 . 1 77 77 SER N N 15 114.282 0.021 . 1 . . 453 . . 77 SER N . 50643 1 186 . 1 . 1 78 78 LEU H H 1 8.403 0.002 . 1 . . 455 . . 78 LEU H . 50643 1 187 . 1 . 1 78 78 LEU CA C 13 58.790 0.0 . 1 . . 457 . . 78 LEU CA . 50643 1 188 . 1 . 1 78 78 LEU N N 15 126.166 0.035 . 1 . . 456 . . 78 LEU N . 50643 1 189 . 1 . 1 79 79 TYR H H 1 8.658 0.001 . 1 . . 458 . . 79 TYR H . 50643 1 190 . 1 . 1 79 79 TYR CA C 13 62.484 0.004 . 1 . . 460 . . 79 TYR CA . 50643 1 191 . 1 . 1 79 79 TYR N N 15 120.205 0.009 . 1 . . 459 . . 79 TYR N . 50643 1 192 . 1 . 1 80 80 ASN H H 1 8.877 0.002 . 1 . . 461 . . 80 ASN H . 50643 1 193 . 1 . 1 80 80 ASN CA C 13 55.453 0.003 . 1 . . 463 . . 80 ASN CA . 50643 1 194 . 1 . 1 80 80 ASN N N 15 117.113 0.017 . 1 . . 462 . . 80 ASN N . 50643 1 195 . 1 . 1 81 81 THR H H 1 8.088 0.003 . 1 . . 464 . . 81 THR H . 50643 1 196 . 1 . 1 81 81 THR CA C 13 67.611 0.041 . 1 . . 466 . . 81 THR CA . 50643 1 197 . 1 . 1 81 81 THR N N 15 115.906 0.092 . 1 . . 465 . . 81 THR N . 50643 1 198 . 1 . 1 82 82 ILE H H 1 8.030 0.001 . 1 . . 467 . . 82 ILE H . 50643 1 199 . 1 . 1 82 82 ILE CA C 13 63.889 0.036 . 1 . . 469 . . 82 ILE CA . 50643 1 200 . 1 . 1 82 82 ILE N N 15 121.353 0.021 . 1 . . 468 . . 82 ILE N . 50643 1 201 . 1 . 1 83 83 ALA H H 1 8.744 0.001 . 1 . . 470 . . 83 ALA H . 50643 1 202 . 1 . 1 83 83 ALA CA C 13 55.462 0.008 . 1 . . 472 . . 83 ALA CA . 50643 1 203 . 1 . 1 83 83 ALA N N 15 125.285 0.038 . 1 . . 471 . . 83 ALA N . 50643 1 204 . 1 . 1 84 84 VAL H H 1 7.795 0.001 . 1 . . 473 . . 84 VAL H . 50643 1 205 . 1 . 1 84 84 VAL CA C 13 67.178 0.016 . 1 . . 475 . . 84 VAL CA . 50643 1 206 . 1 . 1 84 84 VAL N N 15 117.754 0.012 . 1 . . 474 . . 84 VAL N . 50643 1 207 . 1 . 1 85 85 LEU H H 1 8.126 0.001 . 1 . . 476 . . 85 LEU H . 50643 1 208 . 1 . 1 85 85 LEU CA C 13 58.022 0.003 . 1 . . 478 . . 85 LEU CA . 50643 1 209 . 1 . 1 85 85 LEU N N 15 122.123 0.055 . 1 . . 477 . . 85 LEU N . 50643 1 210 . 1 . 1 86 86 TYR H H 1 9.042 0.0 . 1 . . 479 . . 86 TYR H . 50643 1 211 . 1 . 1 86 86 TYR CA C 13 62.403 0.015 . 1 . . 481 . . 86 TYR CA . 50643 1 212 . 1 . 1 86 86 TYR N N 15 119.108 0.021 . 1 . . 480 . . 86 TYR N . 50643 1 213 . 1 . 1 87 87 CYS H H 1 7.491 0.0 . 1 . . 482 . . 87 CYS H . 50643 1 214 . 1 . 1 87 87 CYS CA C 13 65.205 0.027 . 1 . . 484 . . 87 CYS CA . 50643 1 215 . 1 . 1 87 87 CYS N N 15 116.143 0.015 . 1 . . 483 . . 87 CYS N . 50643 1 216 . 1 . 1 88 88 VAL H H 1 8.328 0.007 . 1 . . 485 . . 88 VAL H . 50643 1 217 . 1 . 1 88 88 VAL CA C 13 66.235 0.014 . 1 . . 487 . . 88 VAL CA . 50643 1 218 . 1 . 1 88 88 VAL N N 15 120.868 0.01 . 1 . . 486 . . 88 VAL N . 50643 1 219 . 1 . 1 89 89 HIS H H 1 8.784 0.001 . 1 . . 488 . . 89 HIS H . 50643 1 220 . 1 . 1 89 89 HIS CA C 13 57.422 0.032 . 1 . . 490 . . 89 HIS CA . 50643 1 221 . 1 . 1 89 89 HIS N N 15 119.865 0.018 . 1 . . 489 . . 89 HIS N . 50643 1 222 . 1 . 1 90 90 GLN H H 1 7.875 0.002 . 1 . . 491 . . 90 GLN H . 50643 1 223 . 1 . 1 90 90 GLN CA C 13 54.966 0.016 . 1 . . 493 . . 90 GLN CA . 50643 1 224 . 1 . 1 90 90 GLN N N 15 116.360 0.022 . 1 . . 492 . . 90 GLN N . 50643 1 225 . 1 . 1 91 91 ARG H H 1 7.910 0.005 . 1 . . 494 . . 91 ARG H . 50643 1 226 . 1 . 1 91 91 ARG CA C 13 56.782 0.023 . 1 . . 496 . . 91 ARG CA . 50643 1 227 . 1 . 1 91 91 ARG N N 15 115.668 0.022 . 1 . . 495 . . 91 ARG N . 50643 1 228 . 1 . 1 92 92 ILE H H 1 8.332 0.001 . 1 . . 497 . . 92 ILE H . 50643 1 229 . 1 . 1 92 92 ILE CA C 13 60.490 0.011 . 1 . . 499 . . 92 ILE CA . 50643 1 230 . 1 . 1 92 92 ILE N N 15 120.812 0.025 . 1 . . 498 . . 92 ILE N . 50643 1 231 . 1 . 1 93 93 ASP H H 1 8.596 0.001 . 1 . . 500 . . 93 ASP H . 50643 1 232 . 1 . 1 93 93 ASP CA C 13 54.631 0.0 . 1 . . 502 . . 93 ASP CA . 50643 1 233 . 1 . 1 93 93 ASP N N 15 129.371 0.036 . 1 . . 501 . . 93 ASP N . 50643 1 234 . 1 . 1 94 94 VAL H H 1 7.741 0.001 . 1 . . 503 . . 94 VAL H . 50643 1 235 . 1 . 1 94 94 VAL CA C 13 58.924 0.016 . 1 . . 507 . . 94 VAL CA . 50643 1 236 . 1 . 1 94 94 VAL N N 15 116.158 0.025 . 1 . . 504 . . 94 VAL N . 50643 1 237 . 1 . 1 95 95 LYS H H 1 9.230 0.002 . 1 . . 505 . . 95 LYS H . 50643 1 238 . 1 . 1 95 95 LYS CA C 13 56.369 0.018 . 1 . . 508 . . 95 LYS CA . 50643 1 239 . 1 . 1 95 95 LYS N N 15 119.195 0.024 . 1 . . 506 . . 95 LYS N . 50643 1 240 . 1 . 1 96 96 ASP H H 1 7.402 0.005 . 1 . . 509 . . 96 ASP H . 50643 1 241 . 1 . 1 96 96 ASP CA C 13 52.580 0.001 . 1 . . 514 . . 96 ASP CA . 50643 1 242 . 1 . 1 96 96 ASP N N 15 112.299 0.009 . 1 . . 510 . . 96 ASP N . 50643 1 243 . 1 . 1 97 97 THR H H 1 7.217 0.003 . 1 . . 511 . . 97 THR H . 50643 1 244 . 1 . 1 97 97 THR CA C 13 65.655 0.006 . 1 . . 513 . . 97 THR CA . 50643 1 245 . 1 . 1 97 97 THR N N 15 109.560 0.021 . 1 . . 512 . . 97 THR N . 50643 1 246 . 1 . 1 98 98 LYS H H 1 7.855 0.001 . 1 . . 515 . . 98 LYS H . 50643 1 247 . 1 . 1 98 98 LYS CA C 13 59.389 0.014 . 1 . . 517 . . 98 LYS CA . 50643 1 248 . 1 . 1 98 98 LYS N N 15 121.336 0.019 . 1 . . 516 . . 98 LYS N . 50643 1 249 . 1 . 1 99 99 GLU H H 1 8.362 0.0 . 1 . . 522 . . 99 GLU H . 50643 1 250 . 1 . 1 99 99 GLU CA C 13 59.647 0.033 . 1 . . 520 . . 99 GLU CA . 50643 1 251 . 1 . 1 99 99 GLU N N 15 119.495 0.038 . 1 . . 523 . . 99 GLU N . 50643 1 252 . 1 . 1 100 100 ALA H H 1 7.367 0.001 . 1 . . 518 . . 100 ALA H . 50643 1 253 . 1 . 1 100 100 ALA CA C 13 55.038 0.019 . 1 . . 521 . . 100 ALA CA . 50643 1 254 . 1 . 1 100 100 ALA N N 15 119.224 0.023 . 1 . . 519 . . 100 ALA N . 50643 1 255 . 1 . 1 101 101 LEU H H 1 8.118 0.003 . 1 . . 524 . . 101 LEU H . 50643 1 256 . 1 . 1 101 101 LEU CA C 13 57.733 0.03 . 1 . . 526 . . 101 LEU CA . 50643 1 257 . 1 . 1 101 101 LEU N N 15 118.206 0.036 . 1 . . 525 . . 101 LEU N . 50643 1 258 . 1 . 1 102 102 ASP H H 1 8.682 0.002 . 1 . . 527 . . 102 ASP H . 50643 1 259 . 1 . 1 102 102 ASP CA C 13 57.106 0.023 . 1 . . 529 . . 102 ASP CA . 50643 1 260 . 1 . 1 102 102 ASP N N 15 120.774 0.045 . 1 . . 528 . . 102 ASP N . 50643 1 261 . 1 . 1 103 103 LYS H H 1 8.180 0.002 . 1 . . 530 . . 103 LYS H . 50643 1 262 . 1 . 1 103 103 LYS CA C 13 57.864 0.037 . 1 . . 620 . . 103 LYS CA . 50643 1 263 . 1 . 1 103 103 LYS N N 15 120.769 0.057 . 1 . . 531 . . 103 LYS N . 50643 1 264 . 1 . 1 104 104 ILE H H 1 8.147 0.003 . 1 . . 618 . . 104 ILE H . 50643 1 265 . 1 . 1 104 104 ILE CA C 13 64.427 0.017 . 1 . . 611 . . 104 ILE CA . 50643 1 266 . 1 . 1 104 104 ILE N N 15 120.248 0.057 . 1 . . 619 . . 104 ILE N . 50643 1 267 . 1 . 1 105 105 GLU H H 1 7.988 0.001 . 1 . . 602 . . 105 GLU H . 50643 1 268 . 1 . 1 105 105 GLU CA C 13 59.232 0.029 . 1 . . 604 . . 105 GLU CA . 50643 1 269 . 1 . 1 105 105 GLU N N 15 121.696 0.022 . 1 . . 603 . . 105 GLU N . 50643 1 270 . 1 . 1 106 106 GLU H H 1 8.011 0.002 . 1 . . 605 . . 106 GLU H . 50643 1 271 . 1 . 1 106 106 GLU CA C 13 59.024 0.021 . 1 . . 607 . . 106 GLU CA . 50643 1 272 . 1 . 1 106 106 GLU N N 15 119.488 0.016 . 1 . . 606 . . 106 GLU N . 50643 1 273 . 1 . 1 107 107 GLU H H 1 7.986 0.0 . 1 . . 608 . . 107 GLU H . 50643 1 274 . 1 . 1 107 107 GLU CA C 13 59.052 0.066 . 1 . . 610 . . 107 GLU CA . 50643 1 275 . 1 . 1 107 107 GLU N N 15 119.291 0.001 . 1 . . 609 . . 107 GLU N . 50643 1 276 . 1 . 1 108 108 GLN H H 1 8.226 0.001 . 1 . . 621 . . 108 GLN H . 50643 1 277 . 1 . 1 108 108 GLN CA C 13 57.820 0.005 . 1 . . 623 . . 108 GLN CA . 50643 1 278 . 1 . 1 108 108 GLN N N 15 118.611 0.029 . 1 . . 622 . . 108 GLN N . 50643 1 279 . 1 . 1 109 109 ASN H H 1 8.232 0.005 . 1 . . 624 . . 109 ASN H . 50643 1 280 . 1 . 1 109 109 ASN CA C 13 54.655 0.009 . 1 . . 534 . . 109 ASN CA . 50643 1 281 . 1 . 1 109 109 ASN N N 15 118.246 0.027 . 1 . . 625 . . 109 ASN N . 50643 1 282 . 1 . 1 110 110 LYS H H 1 8.014 0.001 . 1 . . 532 . . 110 LYS H . 50643 1 283 . 1 . 1 110 110 LYS CA C 13 58.249 0.02 . 1 . . 535 . . 110 LYS CA . 50643 1 284 . 1 . 1 110 110 LYS N N 15 120.524 0.01 . 1 . . 533 . . 110 LYS N . 50643 1 285 . 1 . 1 111 111 SER H H 1 7.997 0.001 . 1 . . 536 . . 111 SER H . 50643 1 286 . 1 . 1 111 111 SER CA C 13 59.541 0.004 . 1 . . 538 . . 111 SER CA . 50643 1 287 . 1 . 1 111 111 SER N N 15 114.702 0.02 . 1 . . 537 . . 111 SER N . 50643 1 288 . 1 . 1 112 112 LYS H H 1 7.926 0.001 . 1 . . 539 . . 112 LYS H . 50643 1 289 . 1 . 1 112 112 LYS CA C 13 57.119 0.007 . 1 . . 541 . . 112 LYS CA . 50643 1 290 . 1 . 1 112 112 LYS N N 15 122.423 0.016 . 1 . . 540 . . 112 LYS N . 50643 1 291 . 1 . 1 113 113 LYS H H 1 7.994 0.002 . 1 . . 542 . . 113 LYS H . 50643 1 292 . 1 . 1 113 113 LYS CA C 13 56.852 0.002 . 1 . . 544 . . 113 LYS CA . 50643 1 293 . 1 . 1 113 113 LYS N N 15 121.047 0.023 . 1 . . 543 . . 113 LYS N . 50643 1 294 . 1 . 1 114 114 LYS H H 1 8.106 0.001 . 1 . . 545 . . 114 LYS H . 50643 1 295 . 1 . 1 114 114 LYS CA C 13 56.732 0.007 . 1 . . 547 . . 114 LYS CA . 50643 1 296 . 1 . 1 114 114 LYS N N 15 121.760 0.024 . 1 . . 546 . . 114 LYS N . 50643 1 297 . 1 . 1 115 115 ALA H H 1 8.157 0.0 . 1 . . 548 . . 115 ALA H . 50643 1 298 . 1 . 1 115 115 ALA CA C 13 52.727 0.004 . 1 . . 550 . . 115 ALA CA . 50643 1 299 . 1 . 1 115 115 ALA N N 15 124.389 0.021 . 1 . . 549 . . 115 ALA N . 50643 1 300 . 1 . 1 116 116 GLN H H 1 8.207 0.001 . 1 . . 551 . . 116 GLN H . 50643 1 301 . 1 . 1 116 116 GLN CA C 13 56.076 0.01 . 1 . . 553 . . 116 GLN CA . 50643 1 302 . 1 . 1 116 116 GLN N N 15 119.247 0.014 . 1 . . 552 . . 116 GLN N . 50643 1 303 . 1 . 1 117 117 GLN H H 1 8.249 0.002 . 1 . . 626 . . 117 GLN H . 50643 1 304 . 1 . 1 117 117 GLN CA C 13 55.923 0.018 . 1 . . 557 . . 117 GLN CA . 50643 1 305 . 1 . 1 117 117 GLN N N 15 121.291 0.017 . 1 . . 627 . . 117 GLN N . 50643 1 306 . 1 . 1 118 118 ALA H H 1 8.255 0.001 . 1 . . 554 . . 118 ALA H . 50643 1 307 . 1 . 1 118 118 ALA CA C 13 52.414 0.02 . 1 . . 556 . . 118 ALA CA . 50643 1 308 . 1 . 1 118 118 ALA N N 15 125.098 0.001 . 1 . . 555 . . 118 ALA N . 50643 1 309 . 1 . 1 119 119 ALA H H 1 8.143 0.002 . 1 . . 558 . . 119 ALA H . 50643 1 310 . 1 . 1 119 119 ALA CA C 13 52.297 0.033 . 1 . . 562 . . 119 ALA CA . 50643 1 311 . 1 . 1 119 119 ALA N N 15 123.021 0.012 . 1 . . 559 . . 119 ALA N . 50643 1 312 . 1 . 1 120 120 ALA H H 1 8.142 0.001 . 1 . . 560 . . 120 ALA H . 50643 1 313 . 1 . 1 120 120 ALA CA C 13 52.288 0.024 . 1 . . 563 . . 120 ALA CA . 50643 1 314 . 1 . 1 120 120 ALA N N 15 122.860 0.004 . 1 . . 561 . . 120 ALA N . 50643 1 315 . 1 . 1 121 121 ASP H H 1 8.235 0.002 . 1 . . 564 . . 121 ASP H . 50643 1 316 . 1 . 1 121 121 ASP CA C 13 54.061 0.005 . 1 . . 566 . . 121 ASP CA . 50643 1 317 . 1 . 1 121 121 ASP N N 15 119.507 0.016 . 1 . . 565 . . 121 ASP N . 50643 1 318 . 1 . 1 122 122 THR H H 1 8.059 0.002 . 1 . . 567 . . 122 THR H . 50643 1 319 . 1 . 1 122 122 THR CA C 13 61.852 0.002 . 1 . . 569 . . 122 THR CA . 50643 1 320 . 1 . 1 122 122 THR N N 15 113.701 0.007 . 1 . . 568 . . 122 THR N . 50643 1 321 . 1 . 1 123 123 GLY H H 1 8.408 0.001 . 1 . . 570 . . 123 GLY H . 50643 1 322 . 1 . 1 123 123 GLY CA C 13 45.309 0.002 . 1 . . 572 . . 123 GLY CA . 50643 1 323 . 1 . 1 123 123 GLY N N 15 110.725 0.016 . 1 . . 571 . . 123 GLY N . 50643 1 324 . 1 . 1 124 124 ASN H H 1 8.247 0.001 . 1 . . 573 . . 124 ASN H . 50643 1 325 . 1 . 1 124 124 ASN CA C 13 53.032 0.003 . 1 . . 575 . . 124 ASN CA . 50643 1 326 . 1 . 1 124 124 ASN N N 15 118.607 0.053 . 1 . . 574 . . 124 ASN N . 50643 1 327 . 1 . 1 125 125 ASN H H 1 8.429 0.002 . 1 . . 576 . . 125 ASN H . 50643 1 328 . 1 . 1 125 125 ASN CA C 13 53.221 0.023 . 1 . . 578 . . 125 ASN CA . 50643 1 329 . 1 . 1 125 125 ASN N N 15 119.337 0.03 . 1 . . 577 . . 125 ASN N . 50643 1 330 . 1 . 1 126 126 SER H H 1 8.248 0.002 . 1 . . 579 . . 126 SER H . 50643 1 331 . 1 . 1 126 126 SER CA C 13 58.650 0.034 . 1 . . 581 . . 126 SER CA . 50643 1 332 . 1 . 1 126 126 SER N N 15 115.957 0.014 . 1 . . 580 . . 126 SER N . 50643 1 333 . 1 . 1 127 127 GLN H H 1 8.338 0.001 . 1 . . 582 . . 127 GLN H . 50643 1 334 . 1 . 1 127 127 GLN CA C 13 55.910 0.004 . 1 . . 584 . . 127 GLN CA . 50643 1 335 . 1 . 1 127 127 GLN N N 15 121.826 0.019 . 1 . . 583 . . 127 GLN N . 50643 1 336 . 1 . 1 128 128 VAL H H 1 7.978 0.001 . 1 . . 585 . . 128 VAL H . 50643 1 337 . 1 . 1 128 128 VAL CA C 13 62.381 0.001 . 1 . . 587 . . 128 VAL CA . 50643 1 338 . 1 . 1 128 128 VAL N N 15 119.991 0.002 . 1 . . 586 . . 128 VAL N . 50643 1 339 . 1 . 1 129 129 SER H H 1 8.228 0.0 . 1 . . 588 . . 129 SER H . 50643 1 340 . 1 . 1 129 129 SER CA C 13 58.288 . . 1 . . 590 . . 129 SER CA . 50643 1 341 . 1 . 1 129 129 SER N N 15 118.569 0.005 . 1 . . 589 . . 129 SER N . 50643 1 342 . 1 . 1 131 131 ASN CA C 13 52.926 . . 1 . . 594 . . 131 ASN CA . 50643 1 343 . 1 . 1 132 132 TYR H H 1 7.940 0.001 . 1 . . 591 . . 132 TYR H . 50643 1 344 . 1 . 1 132 132 TYR CA C 13 57.893 . . 1 . . 593 . . 132 TYR CA . 50643 1 345 . 1 . 1 132 132 TYR N N 15 120.512 0.004 . 1 . . 592 . . 132 TYR N . 50643 1 stop_ save_