################################### # 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 52368 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name 'The backbone assignment of FtsZ C-terminal disordered tail' _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' . . . 52368 1 2 '3D CBCANH' . . . 52368 1 3 '3D CBCA(CO)NH' . . . 52368 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 . . 52368 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 1 1 THR CA C 13 62.0192 0.0000 . 1 . . . . . 1 THR CA . 52368 1 2 . 1 . 1 1 1 THR CB C 13 69.8623 0.0000 . 1 . . . . . 1 THR CB . 52368 1 3 . 1 . 1 2 2 GLY H H 1 8.5472 0.0000 . 1 . . . . . 2 GLY H . 52368 1 4 . 1 . 1 2 2 GLY CA C 13 45.1337 0.0000 . 1 . . . . . 2 GLY CA . 52368 1 5 . 1 . 1 2 2 GLY N N 15 111.8388 0.0000 . 1 . . . . . 2 GLY N . 52368 1 6 . 1 . 1 3 3 ILE H H 1 8.1880 0.0000 . 1 . . . . . 3 ILE H . 52368 1 7 . 1 . 1 3 3 ILE CA C 13 61.2805 0.0000 . 1 . . . . . 3 ILE CA . 52368 1 8 . 1 . 1 3 3 ILE CB C 13 38.6865 0.0000 . 1 . . . . . 3 ILE CB . 52368 1 9 . 1 . 1 3 3 ILE N N 15 120.2768 0.0000 . 1 . . . . . 3 ILE N . 52368 1 10 . 1 . 1 4 4 GLY H H 1 8.6824 0.0000 . 1 . . . . . 4 GLY H . 52368 1 11 . 1 . 1 4 4 GLY CA C 13 45.3592 0.0000 . 1 . . . . . 4 GLY CA . 52368 1 12 . 1 . 1 4 4 GLY N N 15 113.4540 0.0000 . 1 . . . . . 4 GLY N . 52368 1 13 . 1 . 1 5 5 MET H H 1 8.3017 0.0000 . 1 . . . . . 5 MET H . 52368 1 14 . 1 . 1 5 5 MET CA C 13 55.5136 0.0000 . 1 . . . . . 5 MET CA . 52368 1 15 . 1 . 1 5 5 MET CB C 13 32.6986 0.0000 . 1 . . . . . 5 MET CB . 52368 1 16 . 1 . 1 5 5 MET N N 15 119.9909 0.0000 . 1 . . . . . 5 MET N . 52368 1 17 . 1 . 1 6 6 ASP H H 1 8.4804 0.0000 . 1 . . . . . 6 ASP H . 52368 1 18 . 1 . 1 6 6 ASP CA C 13 47.5799 0.0000 . 1 . . . . . 6 ASP CA . 52368 1 19 . 1 . 1 6 6 ASP CB C 13 47.3787 0.0000 . 1 . . . . . 6 ASP CB . 52368 1 20 . 1 . 1 6 6 ASP N N 15 121.4931 0.0000 . 1 . . . . . 6 ASP N . 52368 1 21 . 1 . 1 7 7 LYS H H 1 8.2081 0.0000 . 1 . . . . . 7 LYS H . 52368 1 22 . 1 . 1 7 7 LYS CA C 13 55.8263 0.0000 . 1 . . . . . 7 LYS CA . 52368 1 23 . 1 . 1 7 7 LYS CB C 13 32.6519 0.0000 . 1 . . . . . 7 LYS CB . 52368 1 24 . 1 . 1 7 7 LYS N N 15 121.4265 0.0000 . 1 . . . . . 7 LYS N . 52368 1 25 . 1 . 1 8 8 ARG H H 1 8.4319 0.0000 . 1 . . . . . 8 ARG H . 52368 1 26 . 1 . 1 8 8 ARG CA C 13 54.0139 0.0000 . 1 . . . . . 8 ARG CA . 52368 1 27 . 1 . 1 8 8 ARG CB C 13 29.8017 0.0000 . 1 . . . . . 8 ARG CB . 52368 1 28 . 1 . 1 8 8 ARG N N 15 124.2377 0.0000 . 1 . . . . . 8 ARG N . 52368 1 29 . 1 . 1 10 10 GLU H H 1 8.6568 0.0000 . 1 . . . . . 10 GLU H . 52368 1 30 . 1 . 1 10 10 GLU CA C 13 56.3880 0.0000 . 1 . . . . . 10 GLU CA . 52368 1 31 . 1 . 1 10 10 GLU CB C 13 29.8859 0.0000 . 1 . . . . . 10 GLU CB . 52368 1 32 . 1 . 1 10 10 GLU N N 15 121.4594 0.0000 . 1 . . . . . 10 GLU N . 52368 1 33 . 1 . 1 11 11 ILE H H 1 8.3062 0.0000 . 1 . . . . . 11 ILE H . 52368 1 34 . 1 . 1 11 11 ILE CA C 13 60.9522 0.0000 . 1 . . . . . 11 ILE CA . 52368 1 35 . 1 . 1 11 11 ILE CB C 13 38.5544 0.0000 . 1 . . . . . 11 ILE CB . 52368 1 36 . 1 . 1 11 11 ILE N N 15 122.7599 0.0000 . 1 . . . . . 11 ILE N . 52368 1 37 . 1 . 1 12 12 THR H H 1 8.3351 0.0000 . 1 . . . . . 12 THR H . 52368 1 38 . 1 . 1 12 12 THR CA C 13 62.0488 0.0000 . 1 . . . . . 12 THR CA . 52368 1 39 . 1 . 1 12 12 THR CB C 13 69.6715 0.0000 . 1 . . . . . 12 THR CB . 52368 1 40 . 1 . 1 12 12 THR N N 15 120.1174 0.0000 . 1 . . . . . 12 THR N . 52368 1 41 . 1 . 1 13 13 LEU H H 1 8.3801 0.0000 . 1 . . . . . 13 LEU H . 52368 1 42 . 1 . 1 13 13 LEU CA C 13 55.1227 0.0000 . 1 . . . . . 13 LEU CA . 52368 1 43 . 1 . 1 13 13 LEU CB C 13 42.3368 0.0000 . 1 . . . . . 13 LEU CB . 52368 1 44 . 1 . 1 13 13 LEU N N 15 126.0118 0.0000 . 1 . . . . . 13 LEU N . 52368 1 45 . 1 . 1 14 14 VAL H H 1 8.2972 0.0000 . 1 . . . . . 14 VAL H . 52368 1 46 . 1 . 1 14 14 VAL CA C 13 62.3946 0.0000 . 1 . . . . . 14 VAL CA . 52368 1 47 . 1 . 1 14 14 VAL CB C 13 32.7694 0.0000 . 1 . . . . . 14 VAL CB . 52368 1 48 . 1 . 1 14 14 VAL N N 15 122.6429 0.0000 . 1 . . . . . 14 VAL N . 52368 1 49 . 1 . 1 15 15 THR H H 1 8.3049 0.0000 . 1 . . . . . 15 THR H . 52368 1 50 . 1 . 1 15 15 THR CA C 13 61.6420 0.0000 . 1 . . . . . 15 THR CA . 52368 1 51 . 1 . 1 15 15 THR CB C 13 69.8425 0.0000 . 1 . . . . . 15 THR CB . 52368 1 52 . 1 . 1 15 15 THR N N 15 118.4127 0.0000 . 1 . . . . . 15 THR N . 52368 1 53 . 1 . 1 16 16 ASN H H 1 8.4756 0.0000 . 1 . . . . . 16 ASN H . 52368 1 54 . 1 . 1 16 16 ASN CA C 13 45.7824 0.0000 . 1 . . . . . 16 ASN CA . 52368 1 55 . 1 . 1 16 16 ASN CB C 13 45.4915 0.0000 . 1 . . . . . 16 ASN CB . 52368 1 56 . 1 . 1 16 16 ASN N N 15 121.5584 0.0000 . 1 . . . . . 16 ASN N . 52368 1 57 . 1 . 1 17 17 LYS H H 1 8.3687 0.0000 . 1 . . . . . 17 LYS H . 52368 1 58 . 1 . 1 17 17 LYS CA C 13 55.6972 0.0000 . 1 . . . . . 17 LYS CA . 52368 1 59 . 1 . 1 17 17 LYS CB C 13 32.8705 0.0000 . 1 . . . . . 17 LYS CB . 52368 1 60 . 1 . 1 17 17 LYS N N 15 121.9548 0.0000 . 1 . . . . . 17 LYS N . 52368 1 61 . 1 . 1 18 18 GLN H H 1 8.5769 0.0000 . 1 . . . . . 18 GLN H . 52368 1 62 . 1 . 1 18 18 GLN CA C 13 55.5812 0.0000 . 1 . . . . . 18 GLN CA . 52368 1 63 . 1 . 1 18 18 GLN CB C 13 29.3411 0.0000 . 1 . . . . . 18 GLN CB . 52368 1 64 . 1 . 1 18 18 GLN N N 15 124.6009 0.0000 . 1 . . . . . 18 GLN N . 52368 1 65 . 1 . 1 19 19 VAL H H 1 8.2601 0.0000 . 1 . . . . . 19 VAL H . 52368 1 66 . 1 . 1 19 19 VAL CA C 13 62.3376 0.0000 . 1 . . . . . 19 VAL CA . 52368 1 67 . 1 . 1 19 19 VAL CB C 13 32.7422 0.0000 . 1 . . . . . 19 VAL CB . 52368 1 68 . 1 . 1 19 19 VAL N N 15 122.3045 0.0000 . 1 . . . . . 19 VAL N . 52368 1 69 . 1 . 1 20 20 GLN H H 1 8.5538 0.0000 . 1 . . . . . 20 GLN H . 52368 1 70 . 1 . 1 20 20 GLN CA C 13 55.4720 0.0000 . 1 . . . . . 20 GLN CA . 52368 1 71 . 1 . 1 20 20 GLN CB C 13 29.4002 0.0000 . 1 . . . . . 20 GLN CB . 52368 1 72 . 1 . 1 20 20 GLN N N 15 124.7809 0.0000 . 1 . . . . . 20 GLN N . 52368 1 73 . 1 . 1 21 21 GLN H H 1 8.5708 0.0000 . 1 . . . . . 21 GLN H . 52368 1 74 . 1 . 1 21 21 GLN CA C 13 53.6507 0.0000 . 1 . . . . . 21 GLN CA . 52368 1 75 . 1 . 1 21 21 GLN CB C 13 28.7777 0.0000 . 1 . . . . . 21 GLN CB . 52368 1 76 . 1 . 1 21 21 GLN N N 15 123.7805 0.0000 . 1 . . . . . 21 GLN N . 52368 1 77 . 1 . 1 23 23 VAL H H 1 8.3516 0.0000 . 1 . . . . . 23 VAL H . 52368 1 78 . 1 . 1 23 23 VAL CA C 13 62.4167 0.0000 . 1 . . . . . 23 VAL CA . 52368 1 79 . 1 . 1 23 23 VAL CB C 13 32.8705 0.0000 . 1 . . . . . 23 VAL CB . 52368 1 80 . 1 . 1 23 23 VAL N N 15 121.5664 0.0000 . 1 . . . . . 23 VAL N . 52368 1 81 . 1 . 1 24 24 MET H H 1 8.5899 0.0000 . 1 . . . . . 24 MET H . 52368 1 82 . 1 . 1 24 24 MET CA C 13 55.4015 0.0000 . 1 . . . . . 24 MET CA . 52368 1 83 . 1 . 1 24 24 MET CB C 13 32.6685 0.0000 . 1 . . . . . 24 MET CB . 52368 1 84 . 1 . 1 24 24 MET N N 15 124.7971 0.0000 . 1 . . . . . 24 MET N . 52368 1 85 . 1 . 1 26 26 ARG H H 1 8.2048 0.0000 . 1 . . . . . 26 ARG H . 52368 1 86 . 1 . 1 26 26 ARG CA C 13 56.3010 0.0000 . 1 . . . . . 26 ARG CA . 52368 1 87 . 1 . 1 26 26 ARG CB C 13 30.4617 0.0000 . 1 . . . . . 26 ARG CB . 52368 1 88 . 1 . 1 26 26 ARG N N 15 120.6100 0.0000 . 1 . . . . . 26 ARG N . 52368 1 89 . 1 . 1 27 27 TYR H H 1 8.3194 0.0000 . 1 . . . . . 27 TYR H . 52368 1 90 . 1 . 1 27 27 TYR CA C 13 56.0684 0.0000 . 1 . . . . . 27 TYR CA . 52368 1 91 . 1 . 1 27 27 TYR CB C 13 32.9533 0.0000 . 1 . . . . . 27 TYR CB . 52368 1 92 . 1 . 1 27 27 TYR N N 15 122.9361 0.0000 . 1 . . . . . 27 TYR N . 52368 1 93 . 1 . 1 28 28 GLN H H 1 8.4321 0.0000 . 1 . . . . . 28 GLN H . 52368 1 94 . 1 . 1 28 28 GLN CA C 13 56.2270 0.0000 . 1 . . . . . 28 GLN CA . 52368 1 95 . 1 . 1 28 28 GLN CB C 13 29.6996 0.0000 . 1 . . . . . 28 GLN CB . 52368 1 96 . 1 . 1 28 28 GLN N N 15 121.8401 0.0000 . 1 . . . . . 28 GLN N . 52368 1 97 . 1 . 1 29 29 GLN H H 1 8.5319 0.0000 . 1 . . . . . 29 GLN H . 52368 1 98 . 1 . 1 29 29 GLN CA C 13 56.3230 0.0000 . 1 . . . . . 29 GLN CA . 52368 1 99 . 1 . 1 29 29 GLN CB C 13 29.6919 0.0000 . 1 . . . . . 29 GLN CB . 52368 1 100 . 1 . 1 29 29 GLN N N 15 122.6179 0.0000 . 1 . . . . . 29 GLN N . 52368 1 101 . 1 . 1 30 30 HIS H H 1 8.4961 0.0000 . 1 . . . . . 30 HIS H . 52368 1 102 . 1 . 1 30 30 HIS CA C 13 56.0660 0.0000 . 1 . . . . . 30 HIS CA . 52368 1 103 . 1 . 1 30 30 HIS CB C 13 30.2634 0.0000 . 1 . . . . . 30 HIS CB . 52368 1 104 . 1 . 1 30 30 HIS N N 15 120.7100 0.0000 . 1 . . . . . 30 HIS N . 52368 1 105 . 1 . 1 31 31 GLY H H 1 8.5146 0.0000 . 1 . . . . . 31 GLY H . 52368 1 106 . 1 . 1 31 31 GLY CA C 13 45.2018 0.0000 . 1 . . . . . 31 GLY CA . 52368 1 107 . 1 . 1 31 31 GLY N N 15 110.5553 0.0000 . 1 . . . . . 31 GLY N . 52368 1 108 . 1 . 1 32 32 MET H H 1 8.2484 0.0000 . 1 . . . . . 32 MET H . 52368 1 109 . 1 . 1 32 32 MET CA C 13 55.0419 0.0000 . 1 . . . . . 32 MET CA . 52368 1 110 . 1 . 1 32 32 MET CB C 13 33.0494 0.0000 . 1 . . . . . 32 MET CB . 52368 1 111 . 1 . 1 32 32 MET N N 15 119.7792 0.0000 . 1 . . . . . 32 MET N . 52368 1 112 . 1 . 1 33 33 ALA H H 1 8.4026 0.0000 . 1 . . . . . 33 ALA H . 52368 1 113 . 1 . 1 33 33 ALA CA C 13 50.4991 0.0000 . 1 . . . . . 33 ALA CA . 52368 1 114 . 1 . 1 33 33 ALA CB C 13 17.8990 0.0000 . 1 . . . . . 33 ALA CB . 52368 1 115 . 1 . 1 33 33 ALA N N 15 127.0650 0.0000 . 1 . . . . . 33 ALA N . 52368 1 116 . 1 . 1 35 35 LEU H H 1 8.4879 0.0000 . 1 . . . . . 35 LEU H . 52368 1 117 . 1 . 1 35 35 LEU CA C 13 55.4356 0.0000 . 1 . . . . . 35 LEU CA . 52368 1 118 . 1 . 1 35 35 LEU CB C 13 42.1738 0.0000 . 1 . . . . . 35 LEU CB . 52368 1 119 . 1 . 1 35 35 LEU N N 15 122.5895 0.0000 . 1 . . . . . 35 LEU N . 52368 1 120 . 1 . 1 36 36 THR H H 1 8.1822 0.0000 . 1 . . . . . 36 THR H . 52368 1 121 . 1 . 1 36 36 THR CA C 13 61.5650 0.0000 . 1 . . . . . 36 THR CA . 52368 1 122 . 1 . 1 36 36 THR CB C 13 69.8936 0.0000 . 1 . . . . . 36 THR CB . 52368 1 123 . 1 . 1 36 36 THR N N 15 115.0098 0.0000 . 1 . . . . . 36 THR N . 52368 1 124 . 1 . 1 37 37 GLN H H 1 8.4947 0.0000 . 1 . . . . . 37 GLN H . 52368 1 125 . 1 . 1 37 37 GLN CA C 13 55.5579 0.0000 . 1 . . . . . 37 GLN CA . 52368 1 126 . 1 . 1 37 37 GLN CB C 13 29.5669 0.0000 . 1 . . . . . 37 GLN CB . 52368 1 127 . 1 . 1 37 37 GLN N N 15 122.3854 0.0000 . 1 . . . . . 37 GLN N . 52368 1 128 . 1 . 1 42 42 VAL CA C 13 62.0326 0.0000 . 1 . . . . . 42 VAL CA . 52368 1 129 . 1 . 1 42 42 VAL CB C 13 32.9664 0.0000 . 1 . . . . . 42 VAL CB . 52368 1 130 . 1 . 1 43 43 ALA H H 1 8.4524 0.0000 . 1 . . . . . 43 ALA H . 52368 1 131 . 1 . 1 43 43 ALA CA C 13 52.1512 0.0000 . 1 . . . . . 43 ALA CA . 52368 1 132 . 1 . 1 43 43 ALA CB C 13 19.2524 0.0000 . 1 . . . . . 43 ALA CB . 52368 1 133 . 1 . 1 43 43 ALA N N 15 128.8052 0.0000 . 1 . . . . . 43 ALA N . 52368 1 134 . 1 . 1 44 44 LYS H H 1 8.3886 0.0000 . 1 . . . . . 44 LYS H . 52368 1 135 . 1 . 1 44 44 LYS CA C 13 56.1316 0.0000 . 1 . . . . . 44 LYS CA . 52368 1 136 . 1 . 1 44 44 LYS CB C 13 32.9664 0.0000 . 1 . . . . . 44 LYS CB . 52368 1 137 . 1 . 1 44 44 LYS N N 15 121.9991 0.0000 . 1 . . . . . 44 LYS N . 52368 1 138 . 1 . 1 45 45 VAL H H 1 8.3541 0.0000 . 1 . . . . . 45 VAL H . 52368 1 139 . 1 . 1 45 45 VAL CA C 13 62.2995 0.0000 . 1 . . . . . 45 VAL CA . 52368 1 140 . 1 . 1 45 45 VAL CB C 13 32.8456 0.0000 . 1 . . . . . 45 VAL CB . 52368 1 141 . 1 . 1 45 45 VAL N N 15 123.6364 0.0000 . 1 . . . . . 45 VAL N . 52368 1 142 . 1 . 1 46 46 VAL H H 1 8.4128 0.0000 . 1 . . . . . 46 VAL H . 52368 1 143 . 1 . 1 46 46 VAL CA C 13 62.1642 0.0000 . 1 . . . . . 46 VAL CA . 52368 1 144 . 1 . 1 46 46 VAL CB C 13 32.8529 0.0000 . 1 . . . . . 46 VAL CB . 52368 1 145 . 1 . 1 46 46 VAL N N 15 125.5460 0.0000 . 1 . . . . . 46 VAL N . 52368 1 146 . 1 . 1 47 47 ASN H H 1 8.6275 0.0000 . 1 . . . . . 47 ASN H . 52368 1 147 . 1 . 1 47 47 ASN CA C 13 52.9589 0.0000 . 1 . . . . . 47 ASN CA . 52368 1 148 . 1 . 1 47 47 ASN CB C 13 38.9310 0.0000 . 1 . . . . . 47 ASN CB . 52368 1 149 . 1 . 1 47 47 ASN N N 15 123.4642 0.0000 . 1 . . . . . 47 ASN N . 52368 1 150 . 1 . 1 48 48 ASP H H 1 8.4572 0.0000 . 1 . . . . . 48 ASP H . 52368 1 151 . 1 . 1 48 48 ASP CA C 13 54.2851 0.0000 . 1 . . . . . 48 ASP CA . 52368 1 152 . 1 . 1 48 48 ASP CB C 13 40.8428 0.0000 . 1 . . . . . 48 ASP CB . 52368 1 153 . 1 . 1 48 48 ASP N N 15 121.8820 0.0000 . 1 . . . . . 48 ASP N . 52368 1 154 . 1 . 1 49 49 ASN H H 1 8.3865 0.0000 . 1 . . . . . 49 ASN H . 52368 1 155 . 1 . 1 49 49 ASN CA C 13 52.9525 0.0000 . 1 . . . . . 49 ASN CA . 52368 1 156 . 1 . 1 49 49 ASN CB C 13 38.7788 0.0000 . 1 . . . . . 49 ASN CB . 52368 1 157 . 1 . 1 49 49 ASN N N 15 118.6275 0.0000 . 1 . . . . . 49 ASN N . 52368 1 158 . 1 . 1 50 50 ALA H H 1 8.1434 0.0000 . 1 . . . . . 50 ALA H . 52368 1 159 . 1 . 1 50 50 ALA CA C 13 50.7181 0.0000 . 1 . . . . . 50 ALA CA . 52368 1 160 . 1 . 1 50 50 ALA CB C 13 17.9449 0.0000 . 1 . . . . . 50 ALA CB . 52368 1 161 . 1 . 1 50 50 ALA N N 15 125.2805 0.0000 . 1 . . . . . 50 ALA N . 52368 1 162 . 1 . 1 52 52 GLN H H 1 8.6553 0.0000 . 1 . . . . . 52 GLN H . 52368 1 163 . 1 . 1 52 52 GLN CA C 13 55.6970 0.0000 . 1 . . . . . 52 GLN CA . 52368 1 164 . 1 . 1 52 52 GLN CB C 13 29.4941 0.0000 . 1 . . . . . 52 GLN CB . 52368 1 165 . 1 . 1 52 52 GLN N N 15 121.1609 0.0000 . 1 . . . . . 52 GLN N . 52368 1 166 . 1 . 1 53 53 THR H H 1 8.2468 0.0000 . 1 . . . . . 53 THR H . 52368 1 167 . 1 . 1 53 53 THR CA C 13 61.7390 0.0000 . 1 . . . . . 53 THR CA . 52368 1 168 . 1 . 1 53 53 THR CB C 13 69.8678 0.0000 . 1 . . . . . 53 THR CB . 52368 1 169 . 1 . 1 53 53 THR N N 15 116.2293 0.0000 . 1 . . . . . 53 THR N . 52368 1 170 . 1 . 1 54 54 ALA H H 1 8.4283 0.0000 . 1 . . . . . 54 ALA H . 52368 1 171 . 1 . 1 54 54 ALA CA C 13 52.2567 0.0000 . 1 . . . . . 54 ALA CA . 52368 1 172 . 1 . 1 54 54 ALA CB C 13 19.2466 0.0000 . 1 . . . . . 54 ALA CB . 52368 1 173 . 1 . 1 54 54 ALA N N 15 127.1680 0.0000 . 1 . . . . . 54 ALA N . 52368 1 174 . 1 . 1 55 55 LYS H H 1 8.3518 0.0000 . 1 . . . . . 55 LYS H . 52368 1 175 . 1 . 1 55 55 LYS CA C 13 55.8746 0.0000 . 1 . . . . . 55 LYS CA . 52368 1 176 . 1 . 1 55 55 LYS CB C 13 33.0015 0.0000 . 1 . . . . . 55 LYS CB . 52368 1 177 . 1 . 1 55 55 LYS N N 15 121.6081 0.0000 . 1 . . . . . 55 LYS N . 52368 1 178 . 1 . 1 56 56 GLU H H 1 8.4715 0.0000 . 1 . . . . . 56 GLU H . 52368 1 179 . 1 . 1 56 56 GLU CA C 13 55.7439 0.0000 . 1 . . . . . 56 GLU CA . 52368 1 180 . 1 . 1 56 56 GLU CB C 13 29.5078 0.0000 . 1 . . . . . 56 GLU CB . 52368 1 181 . 1 . 1 56 56 GLU N N 15 122.6705 0.0000 . 1 . . . . . 56 GLU N . 52368 1 182 . 1 . 1 58 58 ASP H H 1 8.3845 0.0000 . 1 . . . . . 58 ASP H . 52368 1 183 . 1 . 1 58 58 ASP CA C 13 54.0783 0.0000 . 1 . . . . . 58 ASP CA . 52368 1 184 . 1 . 1 58 58 ASP CB C 13 41.0759 0.0000 . 1 . . . . . 58 ASP CB . 52368 1 185 . 1 . 1 58 58 ASP N N 15 120.1947 0.0000 . 1 . . . . . 58 ASP N . 52368 1 186 . 1 . 1 59 59 TYR H H 1 8.0744 0.0000 . 1 . . . . . 59 TYR H . 52368 1 187 . 1 . 1 59 59 TYR CA C 13 58.1207 0.0000 . 1 . . . . . 59 TYR CA . 52368 1 188 . 1 . 1 59 59 TYR CB C 13 38.3567 0.0000 . 1 . . . . . 59 TYR CB . 52368 1 189 . 1 . 1 59 59 TYR N N 15 120.3744 0.0000 . 1 . . . . . 59 TYR N . 52368 1 190 . 1 . 1 60 60 LEU H H 1 8.0325 0.0000 . 1 . . . . . 60 LEU H . 52368 1 191 . 1 . 1 60 60 LEU CA C 13 55.0388 0.0000 . 1 . . . . . 60 LEU CA . 52368 1 192 . 1 . 1 60 60 LEU CB C 13 42.3243 0.0000 . 1 . . . . . 60 LEU CB . 52368 1 193 . 1 . 1 60 60 LEU N N 15 123.1757 0.0000 . 1 . . . . . 60 LEU N . 52368 1 194 . 1 . 1 61 61 ASP H H 1 8.1845 0.0000 . 1 . . . . . 61 ASP H . 52368 1 195 . 1 . 1 61 61 ASP CA C 13 54.2584 0.0000 . 1 . . . . . 61 ASP CA . 52368 1 196 . 1 . 1 61 61 ASP CB C 13 40.9225 0.0000 . 1 . . . . . 61 ASP CB . 52368 1 197 . 1 . 1 61 61 ASP N N 15 121.1765 0.0000 . 1 . . . . . 61 ASP N . 52368 1 198 . 1 . 1 62 62 ILE H H 1 7.9710 0.0000 . 1 . . . . . 62 ILE H . 52368 1 199 . 1 . 1 62 62 ILE CA C 13 59.2010 0.0000 . 1 . . . . . 62 ILE CA . 52368 1 200 . 1 . 1 62 62 ILE CB C 13 38.4219 0.0000 . 1 . . . . . 62 ILE CB . 52368 1 201 . 1 . 1 62 62 ILE N N 15 122.9386 0.0000 . 1 . . . . . 62 ILE N . 52368 1 202 . 1 . 1 64 64 ALA H H 1 8.4308 0.0000 . 1 . . . . . 64 ALA H . 52368 1 203 . 1 . 1 64 64 ALA CA C 13 53.7078 0.0000 . 1 . . . . . 64 ALA CA . 52368 1 204 . 1 . 1 64 64 ALA CB C 13 18.7659 0.0000 . 1 . . . . . 64 ALA CB . 52368 1 205 . 1 . 1 64 64 ALA N N 15 123.6887 0.0000 . 1 . . . . . 64 ALA N . 52368 1 206 . 1 . 1 65 65 PHE H H 1 8.0220 0.0000 . 1 . . . . . 65 PHE H . 52368 1 207 . 1 . 1 65 65 PHE CA C 13 57.9910 0.0000 . 1 . . . . . 65 PHE CA . 52368 1 208 . 1 . 1 65 65 PHE CB C 13 38.8368 0.0000 . 1 . . . . . 65 PHE CB . 52368 1 209 . 1 . 1 65 65 PHE N N 15 117.1156 0.0000 . 1 . . . . . 65 PHE N . 52368 1 210 . 1 . 1 66 66 LEU H H 1 7.8878 0.0000 . 1 . . . . . 66 LEU H . 52368 1 211 . 1 . 1 66 66 LEU CA C 13 50.7132 0.0000 . 1 . . . . . 66 LEU CA . 52368 1 212 . 1 . 1 66 66 LEU CB C 13 42.4050 0.0000 . 1 . . . . . 66 LEU CB . 52368 1 213 . 1 . 1 66 66 LEU N N 15 122.6858 0.0000 . 1 . . . . . 66 LEU N . 52368 1 214 . 1 . 1 67 67 ARG H H 1 7.9625 0.0000 . 1 . . . . . 67 ARG H . 52368 1 215 . 1 . 1 67 67 ARG CA C 13 56.3283 0.0000 . 1 . . . . . 67 ARG CA . 52368 1 216 . 1 . 1 67 67 ARG CB C 13 30.6910 0.0000 . 1 . . . . . 67 ARG CB . 52368 1 217 . 1 . 1 67 67 ARG N N 15 121.9494 0.0000 . 1 . . . . . 67 ARG N . 52368 1 218 . 1 . 1 68 68 LYS H H 1 8.3575 0.0000 . 1 . . . . . 68 LYS H . 52368 1 219 . 1 . 1 68 68 LYS CA C 13 57.7955 0.0000 . 1 . . . . . 68 LYS CA . 52368 1 220 . 1 . 1 68 68 LYS CB C 13 38.4562 0.0000 . 1 . . . . . 68 LYS CB . 52368 1 221 . 1 . 1 68 68 LYS N N 15 121.1228 0.0000 . 1 . . . . . 68 LYS N . 52368 1 222 . 1 . 1 69 69 GLN H H 1 8.2131 0.0000 . 1 . . . . . 69 GLN H . 52368 1 223 . 1 . 1 69 69 GLN CA C 13 55.7713 0.0000 . 1 . . . . . 69 GLN CA . 52368 1 224 . 1 . 1 69 69 GLN CB C 13 29.5092 0.0000 . 1 . . . . . 69 GLN CB . 52368 1 225 . 1 . 1 69 69 GLN N N 15 122.3876 0.0000 . 1 . . . . . 69 GLN N . 52368 1 226 . 1 . 1 70 70 ALA H H 1 8.4029 0.0000 . 1 . . . . . 70 ALA H . 52368 1 227 . 1 . 1 70 70 ALA CA C 13 52.2495 0.0000 . 1 . . . . . 70 ALA CA . 52368 1 228 . 1 . 1 70 70 ALA CB C 13 19.4450 0.0000 . 1 . . . . . 70 ALA CB . 52368 1 229 . 1 . 1 70 70 ALA N N 15 126.3247 0.0000 . 1 . . . . . 70 ALA N . 52368 1 230 . 1 . 1 71 71 ASP H H 1 8.0108 0.0000 . 1 . . . . . 71 ASP H . 52368 1 231 . 1 . 1 71 71 ASP CA C 13 55.8860 0.0000 . 1 . . . . . 71 ASP CA . 52368 1 232 . 1 . 1 71 71 ASP CB C 13 41.9997 0.0000 . 1 . . . . . 71 ASP CB . 52368 1 233 . 1 . 1 71 71 ASP N N 15 125.7442 0.0000 . 1 . . . . . 71 ASP N . 52368 1 stop_ save_