################################### # 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 50730 _Assigned_chem_shift_list.ID 1 _Assigned_chem_shift_list.Name PpcAF6L _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-1H TOCSY' . . . 50730 1 2 '2D 1H-1H NOESY' . . . 50730 1 3 '2D 1H-15N HSQC' . . . 50730 1 4 '2D 1H-1H TOCSY' . . . 50730 1 5 '2D 1H-1H NOESY' . . . 50730 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 . . 50730 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 GLU H H 1 7.626 0.000 . 1 . . . . . 3 GLU HN . 50730 1 2 . 1 . 1 3 3 GLU N N 15 119.144 0.000 . 1 . . . . . 3 GLU N . 50730 1 3 . 1 . 1 4 4 LEU H H 1 8.304 0.000 . 1 . . . . . 4 LEU HN . 50730 1 4 . 1 . 1 4 4 LEU N N 15 123.005 0.000 . 1 . . . . . 4 LEU N . 50730 1 5 . 1 . 1 5 5 THR H H 1 8.958 0.000 . 1 . . . . . 5 THR HN . 50730 1 6 . 1 . 1 5 5 THR N N 15 120.167 0.000 . 1 . . . . . 5 THR N . 50730 1 7 . 1 . 1 6 6 LEU H H 1 9.653 0.000 . 1 . . . . . 6 LEU HN . 50730 1 8 . 1 . 1 6 6 LEU N N 15 131.979 0.000 . 1 . . . . . 6 LEU N . 50730 1 9 . 1 . 1 7 7 LYS H H 1 8.521 0.000 . 1 . . . . . 7 LYS HN . 50730 1 10 . 1 . 1 7 7 LYS N N 15 124.965 0.000 . 1 . . . . . 7 LYS N . 50730 1 11 . 1 . 1 8 8 ALA H H 1 8.545 0.000 . 1 . . . . . 8 ALA HN . 50730 1 12 . 1 . 1 8 8 ALA N N 15 123.659 0.000 . 1 . . . . . 8 ALA N . 50730 1 13 . 1 . 1 9 9 LYS H H 1 10.345 0.000 . 1 . . . . . 9 LYS HN . 50730 1 14 . 1 . 1 9 9 LYS N N 15 125.411 0.000 . 1 . . . . . 9 LYS N . 50730 1 15 . 1 . 1 10 10 ASN H H 1 9.014 0.000 . 1 . . . . . 10 ASN HN . 50730 1 16 . 1 . 1 10 10 ASN HD21 H 1 0.804 0.000 . 1 . . . . . 10 ASN HD21 . 50730 1 17 . 1 . 1 10 10 ASN HD22 H 1 5.571 0.000 . 1 . . . . . 10 ASN HD22 . 50730 1 18 . 1 . 1 10 10 ASN N N 15 113.891 0.000 . 1 . . . . . 10 ASN N . 50730 1 19 . 1 . 1 10 10 ASN ND2 N 15 108.394 0.002 . 1 . . . . . 10 ASN ND2 . 50730 1 20 . 1 . 1 11 11 GLY H H 1 7.017 0.000 . 1 . . . . . 11 GLY HN . 50730 1 21 . 1 . 1 11 11 GLY N N 15 110.630 0.000 . 1 . . . . . 11 GLY N . 50730 1 22 . 1 . 1 12 12 ASP H H 1 8.111 0.000 . 1 . . . . . 12 ASP HN . 50730 1 23 . 1 . 1 12 12 ASP N N 15 129.519 0.000 . 1 . . . . . 12 ASP N . 50730 1 24 . 1 . 1 13 13 VAL H H 1 8.696 0.000 . 1 . . . . . 13 VAL HN . 50730 1 25 . 1 . 1 13 13 VAL N N 15 121.533 0.000 . 1 . . . . . 13 VAL N . 50730 1 26 . 1 . 1 14 14 LYS H H 1 9.066 0.000 . 1 . . . . . 14 LYS HN . 50730 1 27 . 1 . 1 14 14 LYS N N 15 129.648 0.000 . 1 . . . . . 14 LYS N . 50730 1 28 . 1 . 1 15 15 PHE H H 1 9.257 0.000 . 1 . . . . . 15 PHE HN . 50730 1 29 . 1 . 1 15 15 PHE N N 15 127.049 0.000 . 1 . . . . . 15 PHE N . 50730 1 30 . 1 . 1 17 17 HIS H H 1 6.509 0.000 . 1 . . . . . 17 HIS HN . 50730 1 31 . 1 . 1 17 17 HIS HD1 H 1 8.719 0.000 . 1 . . . . . 17 HIS HD1 . 50730 1 32 . 1 . 1 17 17 HIS N N 15 132.649 0.000 . 1 . . . . . 17 HIS N . 50730 1 33 . 1 . 1 17 17 HIS ND1 N 15 166.282 0.000 . 1 . . . . . 17 HIS ND1 . 50730 1 34 . 1 . 1 18 18 LYS H H 1 7.357 0.000 . 1 . . . . . 18 LYS HN . 50730 1 35 . 1 . 1 18 18 LYS N N 15 119.376 0.000 . 1 . . . . . 18 LYS N . 50730 1 36 . 1 . 1 19 19 LYS H H 1 7.321 0.000 . 1 . . . . . 19 LYS HN . 50730 1 37 . 1 . 1 19 19 LYS N N 15 118.319 0.000 . 1 . . . . . 19 LYS N . 50730 1 38 . 1 . 1 20 20 HIS H H 1 6.256 0.000 . 1 . . . . . 20 HIS HN . 50730 1 39 . 1 . 1 20 20 HIS HD1 H 1 8.033 0.000 . 1 . . . . . 20 HIS HD1 . 50730 1 40 . 1 . 1 20 20 HIS N N 15 114.073 0.000 . 1 . . . . . 20 HIS N . 50730 1 41 . 1 . 1 20 20 HIS ND1 N 15 162.701 0.000 . 1 . . . . . 20 HIS ND1 . 50730 1 42 . 1 . 1 21 21 GLN H H 1 7.369 0.000 . 1 . . . . . 21 GLN HN . 50730 1 43 . 1 . 1 21 21 GLN HE21 H 1 1.068 0.000 . 2 . . . . . 21 GLN HE21 . 50730 1 44 . 1 . 1 21 21 GLN N N 15 119.394 0.000 . 1 . . . . . 21 GLN N . 50730 1 45 . 1 . 1 21 21 GLN NE2 N 15 105.195 0.000 . 1 . . . . . 21 GLN NE2 . 50730 1 46 . 1 . 1 22 22 GLN H H 1 7.087 0.000 . 1 . . . . . 22 GLN HN . 50730 1 47 . 1 . 1 22 22 GLN HE21 H 1 6.702 0.000 . 2 . . . . . 22 GLN HE21 . 50730 1 48 . 1 . 1 22 22 GLN HE22 H 1 7.287 0.000 . 2 . . . . . 22 GLN HE22 . 50730 1 49 . 1 . 1 22 22 GLN N N 15 116.638 0.000 . 1 . . . . . 22 GLN N . 50730 1 50 . 1 . 1 22 22 GLN NE2 N 15 111.339 0.006 . 1 . . . . . 22 GLN NE2 . 50730 1 51 . 1 . 1 23 23 VAL H H 1 8.123 0.000 . 1 . . . . . 23 VAL HN . 50730 1 52 . 1 . 1 23 23 VAL N N 15 117.862 0.000 . 1 . . . . . 23 VAL N . 50730 1 53 . 1 . 1 24 24 VAL H H 1 8.721 0.000 . 1 . . . . . 24 VAL HN . 50730 1 54 . 1 . 1 24 24 VAL N N 15 120.105 0.000 . 1 . . . . . 24 VAL N . 50730 1 55 . 1 . 1 25 25 GLY H H 1 7.283 0.000 . 1 . . . . . 25 GLY HN . 50730 1 56 . 1 . 1 25 25 GLY N N 15 105.898 0.000 . 1 . . . . . 25 GLY N . 50730 1 57 . 1 . 1 26 26 ASN H H 1 7.759 0.000 . 1 . . . . . 26 ASN HN . 50730 1 58 . 1 . 1 26 26 ASN HD21 H 1 7.077 0.000 . 2 . . . . . 26 ASN HD21 . 50730 1 59 . 1 . 1 26 26 ASN HD22 H 1 7.905 0.000 . 2 . . . . . 26 ASN HD22 . 50730 1 60 . 1 . 1 26 26 ASN N N 15 116.974 0.000 . 1 . . . . . 26 ASN N . 50730 1 61 . 1 . 1 26 26 ASN ND2 N 15 111.795 0.001 . 1 . . . . . 26 ASN ND2 . 50730 1 62 . 1 . 1 27 27 CYS H H 1 9.013 0.000 . 1 . . . . . 27 CYS HN . 50730 1 63 . 1 . 1 27 27 CYS N N 15 122.627 0.000 . 1 . . . . . 27 CYS N . 50730 1 64 . 1 . 1 28 28 LYS H H 1 7.936 0.000 . 1 . . . . . 28 LYS HN . 50730 1 65 . 1 . 1 28 28 LYS N N 15 115.145 0.000 . 1 . . . . . 28 LYS N . 50730 1 66 . 1 . 1 29 29 LYS H H 1 7.525 0.000 . 1 . . . . . 29 LYS HN . 50730 1 67 . 1 . 1 29 29 LYS N N 15 117.608 0.000 . 1 . . . . . 29 LYS N . 50730 1 68 . 1 . 1 30 30 CYS H H 1 6.366 0.000 . 1 . . . . . 30 CYS HN . 50730 1 69 . 1 . 1 30 30 CYS N N 15 111.706 0.000 . 1 . . . . . 30 CYS N . 50730 1 70 . 1 . 1 31 31 HIS H H 1 7.174 0.000 . 1 . . . . . 31 HIS HN . 50730 1 71 . 1 . 1 31 31 HIS HD1 H 1 8.540 0.000 . 1 . . . . . 31 HIS HD1 . 50730 1 72 . 1 . 1 31 31 HIS N N 15 117.204 0.000 . 1 . . . . . 31 HIS N . 50730 1 73 . 1 . 1 31 31 HIS ND1 N 15 163.963 0.000 . 1 . . . . . 31 HIS ND1 . 50730 1 74 . 1 . 1 32 32 GLU H H 1 8.293 0.000 . 1 . . . . . 32 GLU HN . 50730 1 75 . 1 . 1 32 32 GLU N N 15 125.461 0.000 . 1 . . . . . 32 GLU N . 50730 1 76 . 1 . 1 33 33 LYS H H 1 8.288 0.000 . 1 . . . . . 33 LYS HN . 50730 1 77 . 1 . 1 33 33 LYS N N 15 115.458 0.000 . 1 . . . . . 33 LYS N . 50730 1 78 . 1 . 1 34 34 GLY H H 1 6.708 0.000 . 1 . . . . . 34 GLY HN . 50730 1 79 . 1 . 1 34 34 GLY N N 15 107.394 0.000 . 1 . . . . . 34 GLY N . 50730 1 80 . 1 . 1 36 36 GLY H H 1 3.840 0.000 . 1 . . . . . 36 GLY HN . 50730 1 81 . 1 . 1 36 36 GLY N N 15 109.002 0.000 . 1 . . . . . 36 GLY N . 50730 1 82 . 1 . 1 37 37 LYS H H 1 7.905 0.000 . 1 . . . . . 37 LYS HN . 50730 1 83 . 1 . 1 37 37 LYS N N 15 116.936 0.000 . 1 . . . . . 37 LYS N . 50730 1 84 . 1 . 1 38 38 ILE H H 1 9.935 0.000 . 1 . . . . . 38 ILE HN . 50730 1 85 . 1 . 1 38 38 ILE N N 15 128.800 0.000 . 1 . . . . . 38 ILE N . 50730 1 86 . 1 . 1 39 39 GLU H H 1 8.623 0.000 . 1 . . . . . 39 GLU HN . 50730 1 87 . 1 . 1 39 39 GLU N N 15 131.662 0.000 . 1 . . . . . 39 GLU N . 50730 1 88 . 1 . 1 40 40 GLY H H 1 9.156 0.000 . 1 . . . . . 40 GLY HN . 50730 1 89 . 1 . 1 40 40 GLY N N 15 113.477 0.000 . 1 . . . . . 40 GLY N . 50730 1 90 . 1 . 1 41 41 PHE H H 1 7.741 0.000 . 1 . . . . . 41 PHE HN . 50730 1 91 . 1 . 1 41 41 PHE N N 15 120.403 0.000 . 1 . . . . . 41 PHE N . 50730 1 92 . 1 . 1 42 42 GLY H H 1 6.098 0.000 . 1 . . . . . 42 GLY HN . 50730 1 93 . 1 . 1 42 42 GLY N N 15 114.612 0.000 . 1 . . . . . 42 GLY N . 50730 1 94 . 1 . 1 43 43 LYS H H 1 8.984 0.000 . 1 . . . . . 43 LYS HN . 50730 1 95 . 1 . 1 43 43 LYS N N 15 122.684 0.000 . 1 . . . . . 43 LYS N . 50730 1 96 . 1 . 1 44 44 ASP H H 1 7.886 0.000 . 1 . . . . . 44 ASP HN . 50730 1 97 . 1 . 1 44 44 ASP N N 15 116.101 0.000 . 1 . . . . . 44 ASP N . 50730 1 98 . 1 . 1 45 45 TRP H H 1 8.349 0.000 . 1 . . . . . 45 TRP HN . 50730 1 99 . 1 . 1 45 45 TRP HE1 H 1 10.269 0.000 . 1 . . . . . 45 TRP HE1 . 50730 1 100 . 1 . 1 45 45 TRP N N 15 121.492 0.000 . 1 . . . . . 45 TRP N . 50730 1 101 . 1 . 1 45 45 TRP NE1 N 15 130.924 0.000 . 1 . . . . . 45 TRP NE1 . 50730 1 102 . 1 . 1 46 46 ALA H H 1 8.613 0.000 . 1 . . . . . 46 ALA HN . 50730 1 103 . 1 . 1 46 46 ALA N N 15 121.695 0.000 . 1 . . . . . 46 ALA N . 50730 1 104 . 1 . 1 47 47 HIS H H 1 7.722 0.000 . 1 . . . . . 47 HIS HN . 50730 1 105 . 1 . 1 47 47 HIS N N 15 117.085 0.000 . 1 . . . . . 47 HIS N . 50730 1 106 . 1 . 1 48 48 LYS H H 1 6.980 0.000 . 1 . . . . . 48 LYS HN . 50730 1 107 . 1 . 1 48 48 LYS N N 15 117.634 0.000 . 1 . . . . . 48 LYS N . 50730 1 108 . 1 . 1 49 49 THR H H 1 8.323 0.000 . 1 . . . . . 49 THR HN . 50730 1 109 . 1 . 1 49 49 THR N N 15 115.812 0.000 . 1 . . . . . 49 THR N . 50730 1 110 . 1 . 1 50 50 CYS H H 1 8.466 0.000 . 1 . . . . . 50 CYS HN . 50730 1 111 . 1 . 1 50 50 CYS N N 15 121.752 0.000 . 1 . . . . . 50 CYS N . 50730 1 112 . 1 . 1 51 51 LYS H H 1 5.980 0.000 . 1 . . . . . 51 LYS HN . 50730 1 113 . 1 . 1 51 51 LYS N N 15 112.746 0.000 . 1 . . . . . 51 LYS N . 50730 1 114 . 1 . 1 52 52 GLY H H 1 6.167 0.000 . 1 . . . . . 52 GLY HN . 50730 1 115 . 1 . 1 52 52 GLY N N 15 101.245 0.000 . 1 . . . . . 52 GLY N . 50730 1 116 . 1 . 1 53 53 CYS H H 1 7.065 0.000 . 1 . . . . . 53 CYS HN . 50730 1 117 . 1 . 1 53 53 CYS N N 15 121.558 0.000 . 1 . . . . . 53 CYS N . 50730 1 118 . 1 . 1 54 54 HIS H H 1 6.081 0.000 . 1 . . . . . 54 HIS HN . 50730 1 119 . 1 . 1 54 54 HIS HD1 H 1 9.642 0.000 . 1 . . . . . 54 HIS HD1 . 50730 1 120 . 1 . 1 54 54 HIS N N 15 117.330 0.000 . 1 . . . . . 54 HIS N . 50730 1 121 . 1 . 1 54 54 HIS ND1 N 15 165.494 0.000 . 1 . . . . . 54 HIS ND1 . 50730 1 122 . 1 . 1 55 55 GLU H H 1 7.933 0.000 . 1 . . . . . 55 GLU HN . 50730 1 123 . 1 . 1 55 55 GLU N N 15 117.681 0.000 . 1 . . . . . 55 GLU N . 50730 1 124 . 1 . 1 56 56 GLU H H 1 7.709 0.000 . 1 . . . . . 56 GLU HN . 50730 1 125 . 1 . 1 56 56 GLU N N 15 120.789 0.000 . 1 . . . . . 56 GLU N . 50730 1 126 . 1 . 1 57 57 MET H H 1 8.978 0.000 . 1 . . . . . 57 MET HN . 50730 1 127 . 1 . 1 57 57 MET N N 15 115.143 0.000 . 1 . . . . . 57 MET N . 50730 1 128 . 1 . 1 58 58 LYS H H 1 7.753 0.000 . 1 . . . . . 58 LYS HN . 50730 1 129 . 1 . 1 58 58 LYS N N 15 114.682 0.000 . 1 . . . . . 58 LYS N . 50730 1 130 . 1 . 1 59 59 LYS H H 1 7.658 0.000 . 1 . . . . . 59 LYS HN . 50730 1 131 . 1 . 1 59 59 LYS N N 15 118.875 0.000 . 1 . . . . . 59 LYS N . 50730 1 132 . 1 . 1 60 60 GLY H H 1 7.622 0.000 . 1 . . . . . 60 GLY HN . 50730 1 133 . 1 . 1 60 60 GLY N N 15 103.516 0.000 . 1 . . . . . 60 GLY N . 50730 1 134 . 1 . 1 62 62 THR H H 1 8.742 0.000 . 1 . . . . . 62 THR HN . 50730 1 135 . 1 . 1 62 62 THR N N 15 110.299 0.000 . 1 . . . . . 62 THR N . 50730 1 136 . 1 . 1 63 63 LYS H H 1 8.326 0.000 . 1 . . . . . 63 LYS HN . 50730 1 137 . 1 . 1 63 63 LYS N N 15 124.483 0.000 . 1 . . . . . 63 LYS N . 50730 1 138 . 1 . 1 64 64 CYS H H 1 8.758 0.000 . 1 . . . . . 64 CYS HN . 50730 1 139 . 1 . 1 64 64 CYS N N 15 118.671 0.000 . 1 . . . . . 64 CYS N . 50730 1 140 . 1 . 1 65 65 GLY H H 1 8.866 0.000 . 1 . . . . . 65 GLY HN . 50730 1 141 . 1 . 1 65 65 GLY N N 15 102.284 0.000 . 1 . . . . . 65 GLY N . 50730 1 142 . 1 . 1 66 66 ASP H H 1 7.732 0.000 . 1 . . . . . 66 ASP HN . 50730 1 143 . 1 . 1 66 66 ASP N N 15 117.483 0.000 . 1 . . . . . 66 ASP N . 50730 1 144 . 1 . 1 67 67 CYS H H 1 6.618 0.000 . 1 . . . . . 67 CYS HN . 50730 1 145 . 1 . 1 67 67 CYS N N 15 115.663 0.000 . 1 . . . . . 67 CYS N . 50730 1 146 . 1 . 1 68 68 HIS H H 1 6.956 0.000 . 1 . . . . . 68 HIS HN . 50730 1 147 . 1 . 1 68 68 HIS HD1 H 1 8.967 0.000 . 1 . . . . . 68 HIS HD1 . 50730 1 148 . 1 . 1 68 68 HIS N N 15 118.025 0.000 . 1 . . . . . 68 HIS N . 50730 1 149 . 1 . 1 68 68 HIS ND1 N 15 166.245 0.000 . 1 . . . . . 68 HIS ND1 . 50730 1 150 . 1 . 1 69 69 LYS H H 1 7.122 0.000 . 1 . . . . . 69 LYS HN . 50730 1 151 . 1 . 1 69 69 LYS N N 15 124.153 0.000 . 1 . . . . . 69 LYS N . 50730 1 152 . 1 . 1 70 70 LYS H H 1 7.905 0.000 . 1 . . . . . 70 LYS HN . 50730 1 153 . 1 . 1 70 70 LYS N N 15 128.342 0.000 . 1 . . . . . 70 LYS N . 50730 1 154 . 2 . 2 1 1 HEM HHC H 1 9.423 0.000 . 1 . . . . . 1 HEM HHC . 50730 1 155 . 2 . 2 1 1 HEM HHD H 1 9.164 0.001 . 1 . . . . . 1 HEM HHD . 50730 1 156 . 2 . 2 1 1 HEM HHB H 1 9.509 0.001 . 1 . . . . . 1 HEM HHB . 50730 1 157 . 2 . 2 1 1 HEM HHA H 1 9.215 0.000 . 1 . . . . . 1 HEM HHA . 50730 1 158 . 2 . 2 1 1 HEM HAB H 1 5.966 0.001 . 1 . . . . . 1 HEM HAB . 50730 1 159 . 2 . 2 1 1 HEM HAC H 1 6.402 0.001 . 1 . . . . . 1 HEM HAC . 50730 1 160 . 2 . 2 1 1 HEM HMB H 1 3.532 0.001 . 1 . . . . . 1 HEM HMB . 50730 1 161 . 2 . 2 1 1 HEM HMC H 1 3.502 0.002 . 1 . . . . . 1 HEM HMC . 50730 1 162 . 2 . 2 1 1 HEM HMD H 1 2.674 0.000 . 1 . . . . . 1 HEM HMD . 50730 1 163 . 2 . 2 1 1 HEM HMA H 1 3.317 0.001 . 1 . . . . . 1 HEM HMA . 50730 1 164 . 2 . 2 1 1 HEM HBB H 1 2.107 0.002 . 1 . . . . . 1 HEM HBB . 50730 1 165 . 2 . 2 1 1 HEM HBC H 1 1.993 0.001 . 1 . . . . . 1 HEM HBC . 50730 1 166 . 3 . 2 1 1 HEM HHC H 1 9.762 0.001 . 1 . . . . . 1 HEM HHC . 50730 1 167 . 3 . 2 1 1 HEM HHD H 1 9.843 0.001 . 1 . . . . . 1 HEM HHD . 50730 1 168 . 3 . 2 1 1 HEM HHB H 1 10.151 0.003 . 1 . . . . . 1 HEM HHB . 50730 1 169 . 3 . 2 1 1 HEM HHA H 1 9.506 0.000 . 1 . . . . . 1 HEM HHA . 50730 1 170 . 3 . 2 1 1 HEM HAB H 1 6.706 0.001 . 1 . . . . . 1 HEM HAB . 50730 1 171 . 3 . 2 1 1 HEM HAC H 1 6.565 0.001 . 1 . . . . . 1 HEM HAC . 50730 1 172 . 3 . 2 1 1 HEM HMB H 1 4.336 0.002 . 1 . . . . . 1 HEM HMB . 50730 1 173 . 3 . 2 1 1 HEM HMC H 1 3.938 0.002 . 1 . . . . . 1 HEM HMC . 50730 1 174 . 3 . 2 1 1 HEM HMD H 1 3.460 0.001 . 1 . . . . . 1 HEM HMD . 50730 1 175 . 3 . 2 1 1 HEM HMA H 1 3.910 0.002 . 1 . . . . . 1 HEM HMA . 50730 1 176 . 3 . 2 1 1 HEM HBB H 1 2.457 0.007 . 1 . . . . . 1 HEM HBB . 50730 1 177 . 3 . 2 1 1 HEM HBC H 1 2.932 0.001 . 1 . . . . . 1 HEM HBC . 50730 1 178 . 4 . 2 1 1 HEM HHC H 1 9.005 0.001 . 1 . . . . . 1 HEM HHC . 50730 1 179 . 4 . 2 1 1 HEM HHD H 1 9.350 0.001 . 1 . . . . . 1 HEM HHD . 50730 1 180 . 4 . 2 1 1 HEM HHB H 1 9.431 0.002 . 1 . . . . . 1 HEM HHB . 50730 1 181 . 4 . 2 1 1 HEM HHA H 1 9.499 0.000 . 1 . . . . . 1 HEM HHA . 50730 1 182 . 4 . 2 1 1 HEM HAB H 1 5.945 0.001 . 1 . . . . . 1 HEM HAB . 50730 1 183 . 4 . 2 1 1 HEM HAC H 1 6.310 0.001 . 1 . . . . . 1 HEM HAC . 50730 1 184 . 4 . 2 1 1 HEM HMB H 1 3.622 0.000 . 1 . . . . . 1 HEM HMB . 50730 1 185 . 4 . 2 1 1 HEM HMC H 1 3.006 0.001 . 1 . . . . . 1 HEM HMC . 50730 1 186 . 4 . 2 1 1 HEM HMD H 1 3.902 0.002 . 1 . . . . . 1 HEM HMD . 50730 1 187 . 4 . 2 1 1 HEM HMA H 1 3.333 0.001 . 1 . . . . . 1 HEM HMA . 50730 1 188 . 4 . 2 1 1 HEM HBB H 1 2.063 0.003 . 1 . . . . . 1 HEM HBB . 50730 1 189 . 4 . 2 1 1 HEM HBC H 1 1.499 0.001 . 1 . . . . . 1 HEM HBC . 50730 1 stop_ save_