################################### # 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 50770 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 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 $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' . . . 50770 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 . . 50770 1 2 $software_2 . . 50770 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 3 3 MET H H 1 8.502 0.000 . 1 . . . . . 401 MET H . 50770 1 2 . 1 . 1 3 3 MET N N 15 119.875 0.000 . 1 . . . . . 401 MET N . 50770 1 3 . 1 . 1 4 4 ALA H H 1 8.458 0.000 . 1 . . . . . 402 ALA H . 50770 1 4 . 1 . 1 4 4 ALA N N 15 125.628 0.000 . 1 . . . . . 402 ALA N . 50770 1 5 . 1 . 1 5 5 SER H H 1 8.407 0.000 . 1 . . . . . 403 SER H . 50770 1 6 . 1 . 1 5 5 SER N N 15 115.240 0.000 . 1 . . . . . 403 SER N . 50770 1 7 . 1 . 1 6 6 THR H H 1 8.092 0.000 . 1 . . . . . 404 THR H . 50770 1 8 . 1 . 1 6 6 THR N N 15 113.825 0.000 . 1 . . . . . 404 THR N . 50770 1 9 . 1 . 1 7 7 ASP H H 1 8.347 0.000 . 1 . . . . . 405 ASP H . 50770 1 10 . 1 . 1 7 7 ASP N N 15 122.743 0.000 . 1 . . . . . 405 ASP N . 50770 1 11 . 1 . 1 8 8 VAL H H 1 7.855 0.000 . 1 . . . . . 406 VAL H . 50770 1 12 . 1 . 1 8 8 VAL N N 15 121.077 0.000 . 1 . . . . . 406 VAL N . 50770 1 13 . 1 . 1 9 9 GLU H H 1 8.087 0.000 . 1 . . . . . 407 GLU H . 50770 1 14 . 1 . 1 9 9 GLU N N 15 130.340 0.000 . 1 . . . . . 407 GLU N . 50770 1 15 . 1 . 1 10 10 GLN H H 1 8.975 0.000 . 1 . . . . . 408 GLN H . 50770 1 16 . 1 . 1 10 10 GLN N N 15 128.493 0.000 . 1 . . . . . 408 GLN N . 50770 1 17 . 1 . 1 12 12 PHE H H 1 9.397 0.000 . 1 . . . . . 410 PHE H . 50770 1 18 . 1 . 1 12 12 PHE N N 15 126.552 0.000 . 1 . . . . . 410 PHE N . 50770 1 19 . 1 . 1 13 13 ILE H H 1 8.949 0.000 . 1 . . . . . 411 ILE H . 50770 1 20 . 1 . 1 13 13 ILE N N 15 121.418 0.000 . 1 . . . . . 411 ILE N . 50770 1 21 . 1 . 1 14 14 GLU H H 1 8.577 0.000 . 1 . . . . . 412 GLU H . 50770 1 22 . 1 . 1 14 14 GLU N N 15 129.476 0.000 . 1 . . . . . 412 GLU N . 50770 1 23 . 1 . 1 15 15 VAL H H 1 8.362 0.000 . 1 . . . . . 413 VAL H . 50770 1 24 . 1 . 1 15 15 VAL N N 15 124.133 0.000 . 1 . . . . . 413 VAL N . 50770 1 25 . 1 . 1 16 16 THR H H 1 7.663 0.000 . 1 . . . . . 414 THR H . 50770 1 26 . 1 . 1 16 16 THR N N 15 110.671 0.000 . 1 . . . . . 414 THR N . 50770 1 27 . 1 . 1 17 17 LYS H H 1 8.405 0.000 . 1 . . . . . 415 LYS H . 50770 1 28 . 1 . 1 17 17 LYS N N 15 119.585 0.000 . 1 . . . . . 415 LYS N . 50770 1 29 . 1 . 1 18 18 TYR H H 1 7.802 0.000 . 1 . . . . . 416 TYR H . 50770 1 30 . 1 . 1 18 18 TYR N N 15 116.486 0.000 . 1 . . . . . 416 TYR N . 50770 1 31 . 1 . 1 19 19 GLU H H 1 7.595 0.000 . 1 . . . . . 417 GLU H . 50770 1 32 . 1 . 1 19 19 GLU N N 15 118.662 0.000 . 1 . . . . . 417 GLU N . 50770 1 33 . 1 . 1 24 24 LEU H H 1 8.665 0.000 . 1 . . . . . 422 LEU H . 50770 1 34 . 1 . 1 24 24 LEU N N 15 122.891 0.000 . 1 . . . . . 422 LEU N . 50770 1 35 . 1 . 1 25 25 LYS H H 1 8.024 0.000 . 1 . . . . . 423 LYS H . 50770 1 36 . 1 . 1 25 25 LYS N N 15 119.738 0.000 . 1 . . . . . 423 LYS N . 50770 1 37 . 1 . 1 26 26 GLN H H 1 7.844 0.000 . 1 . . . . . 424 GLN H . 50770 1 38 . 1 . 1 26 26 GLN N N 15 116.736 0.000 . 1 . . . . . 424 GLN N . 50770 1 39 . 1 . 1 27 27 LEU H H 1 7.665 0.000 . 1 . . . . . 425 LEU H . 50770 1 40 . 1 . 1 27 27 LEU N N 15 119.815 0.000 . 1 . . . . . 425 LEU N . 50770 1 41 . 1 . 1 28 28 ILE H H 1 8.448 0.000 . 1 . . . . . 426 ILE H . 50770 1 42 . 1 . 1 28 28 ILE N N 15 120.250 0.000 . 1 . . . . . 426 ILE N . 50770 1 43 . 1 . 1 29 29 GLU H H 1 8.199 0.000 . 1 . . . . . 427 GLU H . 50770 1 44 . 1 . 1 29 29 GLU N N 15 120.359 0.000 . 1 . . . . . 427 GLU N . 50770 1 45 . 1 . 1 30 30 GLU H H 1 7.803 0.000 . 1 . . . . . 428 GLU H . 50770 1 46 . 1 . 1 30 30 GLU N N 15 116.165 0.000 . 1 . . . . . 428 GLU N . 50770 1 47 . 1 . 1 31 31 ASN H H 1 7.601 0.000 . 1 . . . . . 429 ASN H . 50770 1 48 . 1 . 1 31 31 ASN N N 15 119.794 0.000 . 1 . . . . . 429 ASN N . 50770 1 49 . 1 . 1 32 32 ASP H H 1 7.778 0.000 . 1 . . . . . 430 ASP H . 50770 1 50 . 1 . 1 32 32 ASP N N 15 120.116 0.000 . 1 . . . . . 430 ASP N . 50770 1 51 . 1 . 1 33 33 GLY H H 1 8.711 0.000 . 1 . . . . . 431 GLY H . 50770 1 52 . 1 . 1 33 33 GLY N N 15 114.207 0.000 . 1 . . . . . 431 GLY N . 50770 1 53 . 1 . 1 34 34 LYS H H 1 7.536 0.000 . 1 . . . . . 432 LYS H . 50770 1 54 . 1 . 1 34 34 LYS N N 15 119.037 0.000 . 1 . . . . . 432 LYS N . 50770 1 55 . 1 . 1 35 35 ARG H H 1 9.841 0.000 . 1 . . . . . 433 ARG H . 50770 1 56 . 1 . 1 35 35 ARG N N 15 121.409 0.000 . 1 . . . . . 433 ARG N . 50770 1 57 . 1 . 1 36 36 ILE H H 1 9.059 0.000 . 1 . . . . . 434 ILE H . 50770 1 58 . 1 . 1 36 36 ILE N N 15 126.824 0.000 . 1 . . . . . 434 ILE N . 50770 1 59 . 1 . 1 37 37 LEU H H 1 8.417 0.000 . 1 . . . . . 435 LEU H . 50770 1 60 . 1 . 1 37 37 LEU N N 15 128.995 0.000 . 1 . . . . . 435 LEU N . 50770 1 61 . 1 . 1 38 38 VAL H H 1 9.207 0.000 . 1 . . . . . 436 VAL H . 50770 1 62 . 1 . 1 38 38 VAL N N 15 126.152 0.000 . 1 . . . . . 436 VAL N . 50770 1 63 . 1 . 1 39 39 PHE H H 1 9.178 0.000 . 1 . . . . . 437 PHE H . 50770 1 64 . 1 . 1 39 39 PHE N N 15 123.812 0.000 . 1 . . . . . 437 PHE N . 50770 1 65 . 1 . 1 43 43 LYS H H 1 8.914 0.000 . 1 . . . . . 441 LYS H . 50770 1 66 . 1 . 1 43 43 LYS N N 15 123.854 0.000 . 1 . . . . . 441 LYS N . 50770 1 67 . 1 . 1 44 44 ARG H H 1 8.255 0.000 . 1 . . . . . 442 ARG H . 50770 1 68 . 1 . 1 44 44 ARG N N 15 117.555 0.000 . 1 . . . . . 442 ARG N . 50770 1 69 . 1 . 1 45 45 ASN H H 1 7.705 0.000 . 1 . . . . . 443 ASN H . 50770 1 70 . 1 . 1 45 45 ASN N N 15 117.723 0.000 . 1 . . . . . 443 ASN N . 50770 1 71 . 1 . 1 46 46 ALA H H 1 8.101 0.000 . 1 . . . . . 444 ALA H . 50770 1 72 . 1 . 1 46 46 ALA N N 15 124.814 0.000 . 1 . . . . . 444 ALA N . 50770 1 73 . 1 . 1 75 75 ALA H H 1 7.917 0.000 . 1 . . . . . 473 ALA H . 50770 1 74 . 1 . 1 75 75 ALA N N 15 121.768 0.000 . 1 . . . . . 473 ALA N . 50770 1 75 . 1 . 1 76 76 LEU H H 1 8.178 0.000 . 1 . . . . . 474 LEU H . 50770 1 76 . 1 . 1 76 76 LEU N N 15 117.694 0.000 . 1 . . . . . 474 LEU N . 50770 1 77 . 1 . 1 77 77 GLN H H 1 8.438 0.000 . 1 . . . . . 475 GLN H . 50770 1 78 . 1 . 1 77 77 GLN N N 15 120.249 0.000 . 1 . . . . . 475 GLN N . 50770 1 79 . 1 . 1 78 78 ASN H H 1 8.624 0.000 . 1 . . . . . 476 ASN H . 50770 1 80 . 1 . 1 78 78 ASN N N 15 119.126 0.000 . 1 . . . . . 476 ASN N . 50770 1 81 . 1 . 1 79 79 PHE H H 1 8.215 0.000 . 1 . . . . . 477 PHE H . 50770 1 82 . 1 . 1 79 79 PHE N N 15 118.464 0.000 . 1 . . . . . 477 PHE N . 50770 1 83 . 1 . 1 80 80 LYS H H 1 9.007 0.000 . 1 . . . . . 478 LYS H . 50770 1 84 . 1 . 1 80 80 LYS N N 15 121.260 0.000 . 1 . . . . . 478 LYS N . 50770 1 85 . 1 . 1 81 81 SER H H 1 8.301 0.000 . 1 . . . . . 479 SER H . 50770 1 86 . 1 . 1 81 81 SER N N 15 111.225 0.000 . 1 . . . . . 479 SER N . 50770 1 87 . 1 . 1 82 82 GLY H H 1 7.444 0.000 . 1 . . . . . 480 GLY H . 50770 1 88 . 1 . 1 82 82 GLY N N 15 109.783 0.000 . 1 . . . . . 480 GLY N . 50770 1 89 . 1 . 1 83 83 LYS H H 1 7.978 0.000 . 1 . . . . . 481 LYS H . 50770 1 90 . 1 . 1 83 83 LYS N N 15 122.239 0.000 . 1 . . . . . 481 LYS N . 50770 1 91 . 1 . 1 84 84 HIS H H 1 7.665 0.000 . 1 . . . . . 482 HIS H . 50770 1 92 . 1 . 1 84 84 HIS N N 15 115.400 0.000 . 1 . . . . . 482 HIS N . 50770 1 93 . 1 . 1 85 85 CYS H H 1 9.049 0.000 . 1 . . . . . 483 CYS H . 50770 1 94 . 1 . 1 85 85 CYS N N 15 117.024 0.000 . 1 . . . . . 483 CYS N . 50770 1 95 . 1 . 1 98 98 ASP H H 1 8.305 0.000 . 1 . . . . . 496 ASP H . 50770 1 96 . 1 . 1 98 98 ASP N N 15 129.076 0.000 . 1 . . . . . 496 ASP N . 50770 1 97 . 1 . 1 99 99 ILE H H 1 8.653 0.000 . 1 . . . . . 497 ILE H . 50770 1 98 . 1 . 1 99 99 ILE N N 15 126.792 0.000 . 1 . . . . . 497 ILE N . 50770 1 99 . 1 . 1 100 100 LYS H H 1 8.550 0.000 . 1 . . . . . 498 LYS H . 50770 1 100 . 1 . 1 100 100 LYS N N 15 124.300 0.000 . 1 . . . . . 498 LYS N . 50770 1 101 . 1 . 1 101 101 ASN H H 1 8.748 0.117 . 1 . . . . . 499 ASN H . 50770 1 102 . 1 . 1 101 101 ASN N N 15 119.559 5.458 . 1 . . . . . 499 ASN N . 50770 1 103 . 1 . 1 102 102 VAL H H 1 8.572 0.000 . 1 . . . . . 500 VAL H . 50770 1 104 . 1 . 1 102 102 VAL N N 15 114.731 0.000 . 1 . . . . . 500 VAL N . 50770 1 105 . 1 . 1 103 103 ASP H H 1 8.133 0.000 . 1 . . . . . 501 ASP H . 50770 1 106 . 1 . 1 103 103 ASP N N 15 123.040 0.000 . 1 . . . . . 501 ASP N . 50770 1 107 . 1 . 1 104 104 ILE H H 1 7.759 0.000 . 1 . . . . . 502 ILE H . 50770 1 108 . 1 . 1 104 104 ILE N N 15 116.107 0.000 . 1 . . . . . 502 ILE N . 50770 1 109 . 1 . 1 105 105 VAL H H 1 8.623 0.000 . 1 . . . . . 503 VAL H . 50770 1 110 . 1 . 1 105 105 VAL N N 15 125.886 0.000 . 1 . . . . . 503 VAL N . 50770 1 111 . 1 . 1 106 106 VAL H H 1 9.500 0.000 . 1 . . . . . 504 VAL H . 50770 1 112 . 1 . 1 106 106 VAL N N 15 126.280 0.000 . 1 . . . . . 504 VAL N . 50770 1 113 . 1 . 1 107 107 ASN H H 1 9.186 0.000 . 1 . . . . . 505 ASN H . 50770 1 114 . 1 . 1 107 107 ASN N N 15 125.406 0.000 . 1 . . . . . 505 ASN N . 50770 1 115 . 1 . 1 108 108 TYR H H 1 8.216 0.000 . 1 . . . . . 506 TYR H . 50770 1 116 . 1 . 1 108 108 TYR N N 15 128.775 0.000 . 1 . . . . . 506 TYR N . 50770 1 117 . 1 . 1 109 109 ASP H H 1 7.327 0.000 . 1 . . . . . 507 ASP H . 50770 1 118 . 1 . 1 109 109 ASP N N 15 109.909 0.000 . 1 . . . . . 507 ASP N . 50770 1 119 . 1 . 1 110 110 LEU H H 1 9.344 0.000 . 1 . . . . . 508 LEU H . 50770 1 120 . 1 . 1 110 110 LEU N N 15 126.732 0.000 . 1 . . . . . 508 LEU N . 50770 1 121 . 1 . 1 112 112 LYS H H 1 8.845 0.000 . 1 . . . . . 510 LYS H . 50770 1 122 . 1 . 1 112 112 LYS N N 15 114.369 0.000 . 1 . . . . . 510 LYS N . 50770 1 123 . 1 . 1 113 113 SER H H 1 7.438 0.000 . 1 . . . . . 511 SER H . 50770 1 124 . 1 . 1 113 113 SER N N 15 110.918 0.000 . 1 . . . . . 511 SER N . 50770 1 125 . 1 . 1 114 114 ILE H H 1 9.351 0.000 . 1 . . . . . 512 ILE H . 50770 1 126 . 1 . 1 114 114 ILE N N 15 125.103 0.000 . 1 . . . . . 512 ILE N . 50770 1 127 . 1 . 1 115 115 ASP H H 1 8.409 0.000 . 1 . . . . . 513 ASP H . 50770 1 128 . 1 . 1 115 115 ASP N N 15 122.570 0.000 . 1 . . . . . 513 ASP N . 50770 1 129 . 1 . 1 116 116 GLU H H 1 7.428 0.000 . 1 . . . . . 514 GLU H . 50770 1 130 . 1 . 1 116 116 GLU N N 15 118.162 0.000 . 1 . . . . . 514 GLU N . 50770 1 131 . 1 . 1 117 117 TYR H H 1 7.395 0.000 . 1 . . . . . 515 TYR H . 50770 1 132 . 1 . 1 117 117 TYR N N 15 120.168 0.000 . 1 . . . . . 515 TYR N . 50770 1 133 . 1 . 1 118 118 VAL H H 1 8.334 0.000 . 1 . . . . . 516 VAL H . 50770 1 134 . 1 . 1 118 118 VAL N N 15 118.067 0.000 . 1 . . . . . 516 VAL N . 50770 1 135 . 1 . 1 119 119 HIS H H 1 7.876 0.000 . 1 . . . . . 517 HIS H . 50770 1 136 . 1 . 1 119 119 HIS N N 15 119.355 0.000 . 1 . . . . . 517 HIS N . 50770 1 137 . 1 . 1 120 120 ARG H H 1 8.087 0.000 . 1 . . . . . 518 ARG H . 50770 1 138 . 1 . 1 120 120 ARG N N 15 118.415 0.000 . 1 . . . . . 518 ARG N . 50770 1 139 . 1 . 1 121 121 ILE H H 1 7.761 0.000 . 1 . . . . . 519 ILE H . 50770 1 140 . 1 . 1 121 121 ILE N N 15 111.023 0.000 . 1 . . . . . 519 ILE N . 50770 1 141 . 1 . 1 122 122 GLY H H 1 7.346 0.000 . 1 . . . . . 520 GLY H . 50770 1 142 . 1 . 1 122 122 GLY N N 15 104.844 0.000 . 1 . . . . . 520 GLY N . 50770 1 143 . 1 . 1 123 123 ARG H H 1 7.525 0.000 . 1 . . . . . 521 ARG H . 50770 1 144 . 1 . 1 123 123 ARG N N 15 117.229 0.000 . 1 . . . . . 521 ARG N . 50770 1 145 . 1 . 1 124 124 THR H H 1 7.236 0.000 . 1 . . . . . 522 THR H . 50770 1 146 . 1 . 1 124 124 THR N N 15 111.345 0.000 . 1 . . . . . 522 THR N . 50770 1 147 . 1 . 1 125 125 GLY H H 1 7.855 0.000 . 1 . . . . . 523 GLY H . 50770 1 148 . 1 . 1 125 125 GLY N N 15 113.629 0.000 . 1 . . . . . 523 GLY N . 50770 1 149 . 1 . 1 126 126 ARG H H 1 8.397 0.000 . 1 . . . . . 524 ARG H . 50770 1 150 . 1 . 1 126 126 ARG N N 15 118.136 0.000 . 1 . . . . . 524 ARG N . 50770 1 151 . 1 . 1 127 127 VAL H H 1 8.178 0.000 . 1 . . . . . 525 VAL H . 50770 1 152 . 1 . 1 127 127 VAL N N 15 115.549 0.000 . 1 . . . . . 525 VAL N . 50770 1 153 . 1 . 1 128 128 GLY H H 1 8.922 0.000 . 1 . . . . . 526 GLY H . 50770 1 154 . 1 . 1 128 128 GLY N N 15 115.597 0.000 . 1 . . . . . 526 GLY N . 50770 1 155 . 1 . 1 129 129 ASN H H 1 8.186 0.000 . 1 . . . . . 527 ASN H . 50770 1 156 . 1 . 1 129 129 ASN N N 15 119.590 0.000 . 1 . . . . . 527 ASN N . 50770 1 157 . 1 . 1 130 130 ARG H H 1 8.648 0.000 . 1 . . . . . 528 ARG H . 50770 1 158 . 1 . 1 130 130 ARG N N 15 125.580 0.000 . 1 . . . . . 528 ARG N . 50770 1 159 . 1 . 1 131 131 GLY H H 1 8.755 0.000 . 1 . . . . . 529 GLY H . 50770 1 160 . 1 . 1 131 131 GLY N N 15 110.923 0.000 . 1 . . . . . 529 GLY N . 50770 1 161 . 1 . 1 132 132 LYS H H 1 8.023 0.000 . 1 . . . . . 530 LYS H . 50770 1 162 . 1 . 1 132 132 LYS N N 15 123.289 0.000 . 1 . . . . . 530 LYS N . 50770 1 163 . 1 . 1 133 133 ALA H H 1 9.199 0.000 . 1 . . . . . 531 ALA H . 50770 1 164 . 1 . 1 133 133 ALA N N 15 129.305 0.000 . 1 . . . . . 531 ALA N . 50770 1 165 . 1 . 1 135 135 SER H H 1 8.849 0.000 . 1 . . . . . 533 SER H . 50770 1 166 . 1 . 1 135 135 SER N N 15 121.061 0.000 . 1 . . . . . 533 SER N . 50770 1 167 . 1 . 1 136 136 PHE H H 1 8.222 0.000 . 1 . . . . . 534 PHE H . 50770 1 168 . 1 . 1 136 136 PHE N N 15 126.182 0.000 . 1 . . . . . 534 PHE N . 50770 1 169 . 1 . 1 137 137 TYR H H 1 9.413 0.000 . 1 . . . . . 535 TYR H . 50770 1 170 . 1 . 1 137 137 TYR N N 15 125.895 0.000 . 1 . . . . . 535 TYR N . 50770 1 171 . 1 . 1 138 138 ASP H H 1 9.056 0.000 . 1 . . . . . 536 ASP H . 50770 1 172 . 1 . 1 138 138 ASP N N 15 129.541 0.000 . 1 . . . . . 536 ASP N . 50770 1 173 . 1 . 1 139 139 SER H H 1 9.076 0.000 . 1 . . . . . 537 SER H . 50770 1 174 . 1 . 1 139 139 SER N N 15 123.354 0.000 . 1 . . . . . 537 SER N . 50770 1 175 . 1 . 1 140 140 ASP H H 1 8.061 0.000 . 1 . . . . . 538 ASP H . 50770 1 176 . 1 . 1 140 140 ASP N N 15 119.719 0.000 . 1 . . . . . 538 ASP N . 50770 1 177 . 1 . 1 141 141 GLN H H 1 7.540 0.000 . 1 . . . . . 539 GLN H . 50770 1 178 . 1 . 1 141 141 GLN N N 15 115.514 0.000 . 1 . . . . . 539 GLN N . 50770 1 179 . 1 . 1 142 142 ASP H H 1 8.431 0.000 . 1 . . . . . 540 ASP H . 50770 1 180 . 1 . 1 142 142 ASP N N 15 116.703 0.000 . 1 . . . . . 540 ASP N . 50770 1 181 . 1 . 1 143 143 LEU H H 1 7.322 0.000 . 1 . . . . . 541 LEU H . 50770 1 182 . 1 . 1 143 143 LEU N N 15 121.481 0.000 . 1 . . . . . 541 LEU N . 50770 1 183 . 1 . 1 144 144 ALA H H 1 8.758 0.000 . 1 . . . . . 542 ALA H . 50770 1 184 . 1 . 1 144 144 ALA N N 15 118.363 0.000 . 1 . . . . . 542 ALA N . 50770 1 185 . 1 . 1 145 145 LEU H H 1 8.032 0.000 . 1 . . . . . 543 LEU H . 50770 1 186 . 1 . 1 145 145 LEU N N 15 118.391 0.000 . 1 . . . . . 543 LEU N . 50770 1 187 . 1 . 1 146 146 VAL H H 1 7.606 0.000 . 1 . . . . . 544 VAL H . 50770 1 188 . 1 . 1 146 146 VAL N N 15 117.325 0.000 . 1 . . . . . 544 VAL N . 50770 1 189 . 1 . 1 147 147 ALA H H 1 8.441 0.000 . 1 . . . . . 545 ALA H . 50770 1 190 . 1 . 1 147 147 ALA N N 15 122.647 0.000 . 1 . . . . . 545 ALA N . 50770 1 191 . 1 . 1 148 148 ASP H H 1 8.215 0.000 . 1 . . . . . 546 ASP H . 50770 1 192 . 1 . 1 148 148 ASP N N 15 118.550 0.000 . 1 . . . . . 546 ASP N . 50770 1 193 . 1 . 1 149 149 LEU H H 1 8.490 0.000 . 1 . . . . . 547 LEU H . 50770 1 194 . 1 . 1 149 149 LEU N N 15 120.982 0.000 . 1 . . . . . 547 LEU N . 50770 1 195 . 1 . 1 150 150 SER H H 1 8.418 0.000 . 1 . . . . . 548 SER H . 50770 1 196 . 1 . 1 150 150 SER N N 15 113.040 0.000 . 1 . . . . . 548 SER N . 50770 1 197 . 1 . 1 151 151 LYS H H 1 7.358 0.000 . 1 . . . . . 549 LYS H . 50770 1 198 . 1 . 1 151 151 LYS N N 15 120.561 0.000 . 1 . . . . . 549 LYS N . 50770 1 199 . 1 . 1 152 152 ILE H H 1 7.719 0.000 . 1 . . . . . 550 ILE H . 50770 1 200 . 1 . 1 152 152 ILE N N 15 119.403 0.000 . 1 . . . . . 550 ILE N . 50770 1 201 . 1 . 1 153 153 LEU H H 1 8.070 0.000 . 1 . . . . . 551 LEU H . 50770 1 202 . 1 . 1 153 153 LEU N N 15 122.020 0.000 . 1 . . . . . 551 LEU N . 50770 1 203 . 1 . 1 154 154 ARG H H 1 8.177 0.000 . 1 . . . . . 552 ARG H . 50770 1 204 . 1 . 1 154 154 ARG N N 15 118.158 0.000 . 1 . . . . . 552 ARG N . 50770 1 205 . 1 . 1 155 155 GLN H H 1 8.311 0.000 . 1 . . . . . 553 GLN H . 50770 1 206 . 1 . 1 155 155 GLN N N 15 119.984 0.000 . 1 . . . . . 553 GLN N . 50770 1 207 . 1 . 1 156 156 ALA H H 1 7.552 0.000 . 1 . . . . . 554 ALA H . 50770 1 208 . 1 . 1 156 156 ALA N N 15 120.726 0.000 . 1 . . . . . 554 ALA N . 50770 1 209 . 1 . 1 157 157 ASP H H 1 8.087 0.000 . 1 . . . . . 555 ASP H . 50770 1 210 . 1 . 1 157 157 ASP N N 15 117.714 0.000 . 1 . . . . . 555 ASP N . 50770 1 211 . 1 . 1 158 158 GLN H H 1 8.139 0.000 . 1 . . . . . 556 GLN H . 50770 1 212 . 1 . 1 158 158 GLN N N 15 116.432 0.000 . 1 . . . . . 556 GLN N . 50770 1 213 . 1 . 1 159 159 SER H H 1 8.512 0.000 . 1 . . . . . 557 SER H . 50770 1 214 . 1 . 1 159 159 SER N N 15 116.207 0.000 . 1 . . . . . 557 SER N . 50770 1 215 . 1 . 1 160 160 VAL H H 1 8.341 0.000 . 1 . . . . . 558 VAL H . 50770 1 216 . 1 . 1 160 160 VAL N N 15 124.978 0.000 . 1 . . . . . 558 VAL N . 50770 1 217 . 1 . 1 162 162 ASP H H 1 8.699 0.000 . 1 . . . . . 560 ASP H . 50770 1 218 . 1 . 1 162 162 ASP N N 15 121.108 0.000 . 1 . . . . . 560 ASP N . 50770 1 219 . 1 . 1 163 163 PHE H H 1 6.794 0.000 . 1 . . . . . 561 PHE H . 50770 1 220 . 1 . 1 163 163 PHE N N 15 111.223 0.000 . 1 . . . . . 561 PHE N . 50770 1 221 . 1 . 1 164 164 LEU H H 1 7.123 0.000 . 1 . . . . . 562 LEU H . 50770 1 222 . 1 . 1 164 164 LEU N N 15 121.549 0.000 . 1 . . . . . 562 LEU N . 50770 1 223 . 1 . 1 165 165 LYS H H 1 7.132 0.000 . 1 . . . . . 563 LYS H . 50770 1 224 . 1 . 1 165 165 LYS N N 15 118.757 0.000 . 1 . . . . . 563 LYS N . 50770 1 225 . 1 . 1 166 166 GLY H H 1 7.819 0.000 . 1 . . . . . 564 GLY H . 50770 1 226 . 1 . 1 166 166 GLY N N 15 115.349 0.000 . 1 . . . . . 564 GLY N . 50770 1 stop_ save_