###################################
# 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 50732
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name PpcAF6LW45M
_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' . . . 50732 1
2 '2D 1H-1H NOESY' . . . 50732 1
3 '2D 1H-1H TOCSY' . . . 50732 1
4 '2D 1H-1H NOESY' . . . 50732 1
5 '2D 1H-15N HSQC' . . . 50732 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 . . 50732 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 7.606 0.000 . 1 . . . . . 3 GLU HN . 50732 1
2 . 1 . 1 3 3 GLU N N 15 119.143 0.000 . 1 . . . . . 3 GLU N . 50732 1
3 . 1 . 1 4 4 LEU H H 1 8.268 0.000 . 1 . . . . . 4 LEU HN . 50732 1
4 . 1 . 1 4 4 LEU N N 15 122.915 0.000 . 1 . . . . . 4 LEU N . 50732 1
5 . 1 . 1 5 5 THR H H 1 8.933 0.000 . 1 . . . . . 5 THR HN . 50732 1
6 . 1 . 1 5 5 THR N N 15 119.882 0.000 . 1 . . . . . 5 THR N . 50732 1
7 . 1 . 1 6 6 LEU H H 1 9.640 0.000 . 1 . . . . . 6 LEU HN . 50732 1
8 . 1 . 1 6 6 LEU N N 15 132.006 0.000 . 1 . . . . . 6 LEU N . 50732 1
9 . 1 . 1 7 7 LYS H H 1 8.596 0.000 . 1 . . . . . 7 LYS HN . 50732 1
10 . 1 . 1 7 7 LYS N N 15 124.969 0.000 . 1 . . . . . 7 LYS N . 50732 1
11 . 1 . 1 8 8 ALA H H 1 8.638 0.000 . 1 . . . . . 8 ALA HN . 50732 1
12 . 1 . 1 8 8 ALA N N 15 123.771 0.000 . 1 . . . . . 8 ALA N . 50732 1
13 . 1 . 1 9 9 LYS H H 1 10.306 0.000 . 1 . . . . . 9 LYS HN . 50732 1
14 . 1 . 1 9 9 LYS N N 15 125.378 0.000 . 1 . . . . . 9 LYS N . 50732 1
15 . 1 . 1 10 10 ASN H H 1 9.015 0.000 . 1 . . . . . 10 ASN HN . 50732 1
16 . 1 . 1 10 10 ASN HD21 H 1 0.687 0.000 . 2 . . . . . 10 ASN HD21 . 50732 1
17 . 1 . 1 10 10 ASN HD22 H 1 5.556 0.000 . 2 . . . . . 10 ASN HD22 . 50732 1
18 . 1 . 1 10 10 ASN N N 15 113.900 0.000 . 1 . . . . . 10 ASN N . 50732 1
19 . 1 . 1 10 10 ASN ND2 N 15 108.124 0.040 . 1 . . . . . 10 ASN ND2 . 50732 1
20 . 1 . 1 11 11 GLY H H 1 7.002 0.000 . 1 . . . . . 11 GLY HN . 50732 1
21 . 1 . 1 11 11 GLY N N 15 110.691 0.000 . 1 . . . . . 11 GLY N . 50732 1
22 . 1 . 1 12 12 ASP H H 1 8.112 0.000 . 1 . . . . . 12 ASP HN . 50732 1
23 . 1 . 1 12 12 ASP N N 15 129.537 0.000 . 1 . . . . . 12 ASP N . 50732 1
24 . 1 . 1 13 13 VAL H H 1 8.653 0.000 . 1 . . . . . 13 VAL HN . 50732 1
25 . 1 . 1 13 13 VAL N N 15 121.505 0.000 . 1 . . . . . 13 VAL N . 50732 1
26 . 1 . 1 14 14 LYS H H 1 9.023 0.000 . 1 . . . . . 14 LYS HN . 50732 1
27 . 1 . 1 14 14 LYS N N 15 129.653 0.000 . 1 . . . . . 14 LYS N . 50732 1
28 . 1 . 1 15 15 PHE H H 1 9.237 0.000 . 1 . . . . . 15 PHE HN . 50732 1
29 . 1 . 1 15 15 PHE N N 15 127.288 0.000 . 1 . . . . . 15 PHE N . 50732 1
30 . 1 . 1 17 17 HIS H H 1 6.506 0.000 . 1 . . . . . 17 HIS HN . 50732 1
31 . 1 . 1 17 17 HIS HD1 H 1 8.748 0.000 . 1 . . . . . 17 HIS HD1 . 50732 1
32 . 1 . 1 17 17 HIS N N 15 132.608 0.000 . 1 . . . . . 17 HIS N . 50732 1
33 . 1 . 1 17 17 HIS ND1 N 15 166.410 0.000 . 1 . . . . . 17 HIS ND1 . 50732 1
34 . 1 . 1 18 18 LYS H H 1 7.316 0.000 . 1 . . . . . 18 LYS HN . 50732 1
35 . 1 . 1 18 18 LYS N N 15 119.234 0.000 . 1 . . . . . 18 LYS N . 50732 1
36 . 1 . 1 19 19 LYS H H 1 7.335 0.000 . 1 . . . . . 19 LYS HN . 50732 1
37 . 1 . 1 19 19 LYS N N 15 118.301 0.000 . 1 . . . . . 19 LYS N . 50732 1
38 . 1 . 1 20 20 HIS H H 1 6.230 0.000 . 1 . . . . . 20 HIS HN . 50732 1
39 . 1 . 1 20 20 HIS HD1 H 1 8.024 0.000 . 1 . . . . . 20 HIS HD1 . 50732 1
40 . 1 . 1 20 20 HIS N N 15 113.992 0.000 . 1 . . . . . 20 HIS N . 50732 1
41 . 1 . 1 20 20 HIS ND1 N 15 162.673 0.000 . 1 . . . . . 20 HIS ND1 . 50732 1
42 . 1 . 1 21 21 GLN H H 1 7.377 0.000 . 1 . . . . . 21 GLN HN . 50732 1
43 . 1 . 1 21 21 GLN HE21 H 1 1.026 0.000 . 2 . . . . . 21 GLN HE21 . 50732 1
44 . 1 . 1 21 21 GLN N N 15 119.565 0.000 . 1 . . . . . 21 GLN N . 50732 1
45 . 1 . 1 21 21 GLN NE2 N 15 105.130 0.000 . 1 . . . . . 21 GLN NE2 . 50732 1
46 . 1 . 1 22 22 GLN H H 1 7.037 0.000 . 1 . . . . . 22 GLN HN . 50732 1
47 . 1 . 1 22 22 GLN HE21 H 1 6.682 0.000 . 2 . . . . . 22 GLN HE21 . 50732 1
48 . 1 . 1 22 22 GLN HE22 H 1 7.262 0.000 . 2 . . . . . 22 GLN HE22 . 50732 1
49 . 1 . 1 22 22 GLN N N 15 116.570 0.000 . 1 . . . . . 22 GLN N . 50732 1
50 . 1 . 1 22 22 GLN NE2 N 15 111.305 0.004 . 1 . . . . . 22 GLN NE2 . 50732 1
51 . 1 . 1 23 23 VAL H H 1 8.032 0.000 . 1 . . . . . 23 VAL HN . 50732 1
52 . 1 . 1 23 23 VAL N N 15 117.972 0.000 . 1 . . . . . 23 VAL N . 50732 1
53 . 1 . 1 24 24 VAL H H 1 8.700 0.000 . 1 . . . . . 24 VAL HN . 50732 1
54 . 1 . 1 24 24 VAL N N 15 119.886 0.000 . 1 . . . . . 24 VAL N . 50732 1
55 . 1 . 1 25 25 GLY H H 1 7.280 0.000 . 1 . . . . . 25 GLY HN . 50732 1
56 . 1 . 1 25 25 GLY N N 15 105.970 0.000 . 1 . . . . . 25 GLY N . 50732 1
57 . 1 . 1 26 26 ASN H H 1 7.726 0.000 . 1 . . . . . 26 ASN HN . 50732 1
58 . 1 . 1 26 26 ASN HD21 H 1 7.052 0.000 . 2 . . . . . 26 ASN HD21 . 50732 1
59 . 1 . 1 26 26 ASN HD22 H 1 7.886 0.000 . 2 . . . . . 26 ASN HD22 . 50732 1
60 . 1 . 1 26 26 ASN N N 15 117.054 0.000 . 1 . . . . . 26 ASN N . 50732 1
61 . 1 . 1 26 26 ASN ND2 N 15 111.762 0.003 . 1 . . . . . 26 ASN ND2 . 50732 1
62 . 1 . 1 27 27 CYS H H 1 9.015 0.000 . 1 . . . . . 27 CYS HN . 50732 1
63 . 1 . 1 27 27 CYS N N 15 122.230 0.000 . 1 . . . . . 27 CYS N . 50732 1
64 . 1 . 1 28 28 LYS H H 1 7.891 0.000 . 1 . . . . . 28 LYS HN . 50732 1
65 . 1 . 1 28 28 LYS N N 15 115.175 0.000 . 1 . . . . . 28 LYS N . 50732 1
66 . 1 . 1 29 29 LYS H H 1 7.507 0.000 . 1 . . . . . 29 LYS HN . 50732 1
67 . 1 . 1 29 29 LYS N N 15 117.612 0.000 . 1 . . . . . 29 LYS N . 50732 1
68 . 1 . 1 30 30 CYS H H 1 6.275 0.000 . 1 . . . . . 30 CYS HN . 50732 1
69 . 1 . 1 30 30 CYS N N 15 111.475 0.000 . 1 . . . . . 30 CYS N . 50732 1
70 . 1 . 1 31 31 HIS H H 1 7.056 0.000 . 1 . . . . . 31 HIS HN . 50732 1
71 . 1 . 1 31 31 HIS HD1 H 1 8.534 0.000 . 1 . . . . . 31 HIS HD1 . 50732 1
72 . 1 . 1 31 31 HIS N N 15 117.627 0.000 . 1 . . . . . 31 HIS N . 50732 1
73 . 1 . 1 31 31 HIS ND1 N 15 164.098 0.000 . 1 . . . . . 31 HIS ND1 . 50732 1
74 . 1 . 1 32 32 GLU H H 1 8.142 0.000 . 1 . . . . . 32 GLU HN . 50732 1
75 . 1 . 1 32 32 GLU N N 15 125.543 0.000 . 1 . . . . . 32 GLU N . 50732 1
76 . 1 . 1 33 33 LYS H H 1 8.245 0.000 . 1 . . . . . 33 LYS HN . 50732 1
77 . 1 . 1 33 33 LYS N N 15 115.184 0.000 . 1 . . . . . 33 LYS N . 50732 1
78 . 1 . 1 34 34 GLY H H 1 6.663 0.000 . 1 . . . . . 34 GLY HN . 50732 1
79 . 1 . 1 34 34 GLY N N 15 107.223 0.000 . 1 . . . . . 34 GLY N . 50732 1
80 . 1 . 1 36 36 GLY H H 1 3.891 0.000 . 1 . . . . . 36 GLY HN . 50732 1
81 . 1 . 1 36 36 GLY N N 15 109.083 0.000 . 1 . . . . . 36 GLY N . 50732 1
82 . 1 . 1 37 37 LYS H H 1 8.078 0.000 . 1 . . . . . 37 LYS HN . 50732 1
83 . 1 . 1 37 37 LYS N N 15 116.902 0.000 . 1 . . . . . 37 LYS N . 50732 1
84 . 1 . 1 38 38 ILE H H 1 10.271 0.000 . 1 . . . . . 38 ILE HN . 50732 1
85 . 1 . 1 38 38 ILE N N 15 128.386 0.000 . 1 . . . . . 38 ILE N . 50732 1
86 . 1 . 1 39 39 GLU H H 1 8.693 0.000 . 1 . . . . . 39 GLU HN . 50732 1
87 . 1 . 1 39 39 GLU N N 15 131.362 0.000 . 1 . . . . . 39 GLU N . 50732 1
88 . 1 . 1 40 40 GLY H H 1 9.242 0.000 . 1 . . . . . 40 GLY HN . 50732 1
89 . 1 . 1 40 40 GLY N N 15 113.584 0.000 . 1 . . . . . 40 GLY N . 50732 1
90 . 1 . 1 41 41 PHE H H 1 8.017 0.000 . 1 . . . . . 41 PHE HN . 50732 1
91 . 1 . 1 41 41 PHE N N 15 121.506 0.000 . 1 . . . . . 41 PHE N . 50732 1
92 . 1 . 1 42 42 GLY H H 1 6.112 0.000 . 1 . . . . . 42 GLY HN . 50732 1
93 . 1 . 1 42 42 GLY N N 15 114.159 0.000 . 1 . . . . . 42 GLY N . 50732 1
94 . 1 . 1 43 43 LYS H H 1 8.959 0.000 . 1 . . . . . 43 LYS HN . 50732 1
95 . 1 . 1 43 43 LYS N N 15 122.606 0.000 . 1 . . . . . 43 LYS N . 50732 1
96 . 1 . 1 44 44 ASP H H 1 7.914 0.000 . 1 . . . . . 44 ASP HN . 50732 1
97 . 1 . 1 44 44 ASP N N 15 115.333 0.000 . 1 . . . . . 44 ASP N . 50732 1
98 . 1 . 1 45 45 MET H H 1 7.987 0.000 . 1 . . . . . 45 MET HN . 50732 1
99 . 1 . 1 45 45 MET N N 15 119.039 0.000 . 1 . . . . . 45 MET N . 50732 1
100 . 1 . 1 46 46 ALA H H 1 8.375 0.000 . 1 . . . . . 46 ALA HN . 50732 1
101 . 1 . 1 46 46 ALA N N 15 122.353 0.000 . 1 . . . . . 46 ALA N . 50732 1
102 . 1 . 1 47 47 HIS H H 1 7.433 0.000 . 1 . . . . . 47 HIS HN . 50732 1
103 . 1 . 1 47 47 HIS N N 15 116.370 0.000 . 1 . . . . . 47 HIS N . 50732 1
104 . 1 . 1 48 48 LYS H H 1 7.022 0.000 . 1 . . . . . 48 LYS HN . 50732 1
105 . 1 . 1 48 48 LYS N N 15 118.371 0.000 . 1 . . . . . 48 LYS N . 50732 1
106 . 1 . 1 49 49 THR H H 1 8.556 0.000 . 1 . . . . . 49 THR HN . 50732 1
107 . 1 . 1 49 49 THR N N 15 115.119 0.000 . 1 . . . . . 49 THR N . 50732 1
108 . 1 . 1 50 50 CYS H H 1 8.858 0.000 . 1 . . . . . 50 CYS HN . 50732 1
109 . 1 . 1 50 50 CYS N N 15 121.175 0.000 . 1 . . . . . 50 CYS N . 50732 1
110 . 1 . 1 51 51 LYS H H 1 5.931 0.000 . 1 . . . . . 51 LYS HN . 50732 1
111 . 1 . 1 51 51 LYS N N 15 113.170 0.000 . 1 . . . . . 51 LYS N . 50732 1
112 . 1 . 1 52 52 GLY H H 1 6.380 0.000 . 1 . . . . . 52 GLY HN . 50732 1
113 . 1 . 1 52 52 GLY N N 15 101.503 0.000 . 1 . . . . . 52 GLY N . 50732 1
114 . 1 . 1 53 53 CYS H H 1 6.984 0.000 . 1 . . . . . 53 CYS HN . 50732 1
115 . 1 . 1 53 53 CYS N N 15 121.193 0.000 . 1 . . . . . 53 CYS N . 50732 1
116 . 1 . 1 54 54 HIS H H 1 6.022 0.000 . 1 . . . . . 54 HIS HN . 50732 1
117 . 1 . 1 54 54 HIS HD1 H 1 9.594 0.000 . 1 . . . . . 54 HIS HD1 . 50732 1
118 . 1 . 1 54 54 HIS N N 15 117.263 0.000 . 1 . . . . . 54 HIS N . 50732 1
119 . 1 . 1 54 54 HIS ND1 N 15 165.370 0.000 . 1 . . . . . 54 HIS ND1 . 50732 1
120 . 1 . 1 55 55 GLU H H 1 7.967 0.000 . 1 . . . . . 55 GLU HN . 50732 1
121 . 1 . 1 55 55 GLU N N 15 117.541 0.000 . 1 . . . . . 55 GLU N . 50732 1
122 . 1 . 1 56 56 GLU H H 1 7.669 0.000 . 1 . . . . . 56 GLU HN . 50732 1
123 . 1 . 1 56 56 GLU N N 15 120.735 0.000 . 1 . . . . . 56 GLU N . 50732 1
124 . 1 . 1 57 57 MET H H 1 8.956 0.000 . 1 . . . . . 57 MET HN . 50732 1
125 . 1 . 1 57 57 MET N N 15 115.122 0.000 . 1 . . . . . 57 MET N . 50732 1
126 . 1 . 1 58 58 LYS H H 1 7.753 0.000 . 1 . . . . . 58 LYS HN . 50732 1
127 . 1 . 1 58 58 LYS N N 15 114.666 0.000 . 1 . . . . . 58 LYS N . 50732 1
128 . 1 . 1 59 59 LYS H H 1 7.628 0.000 . 1 . . . . . 59 LYS HN . 50732 1
129 . 1 . 1 59 59 LYS N N 15 118.869 0.000 . 1 . . . . . 59 LYS N . 50732 1
130 . 1 . 1 60 60 GLY H H 1 7.609 0.000 . 1 . . . . . 60 GLY HN . 50732 1
131 . 1 . 1 60 60 GLY N N 15 103.550 0.000 . 1 . . . . . 60 GLY N . 50732 1
132 . 1 . 1 62 62 THR H H 1 8.707 0.000 . 1 . . . . . 62 THR HN . 50732 1
133 . 1 . 1 62 62 THR N N 15 110.101 0.000 . 1 . . . . . 62 THR N . 50732 1
134 . 1 . 1 63 63 LYS H H 1 8.329 0.000 . 1 . . . . . 63 LYS HN . 50732 1
135 . 1 . 1 63 63 LYS N N 15 124.551 0.000 . 1 . . . . . 63 LYS N . 50732 1
136 . 1 . 1 64 64 CYS H H 1 8.748 0.000 . 1 . . . . . 64 CYS HN . 50732 1
137 . 1 . 1 64 64 CYS N N 15 118.715 0.000 . 1 . . . . . 64 CYS N . 50732 1
138 . 1 . 1 65 65 GLY H H 1 8.846 0.000 . 1 . . . . . 65 GLY HN . 50732 1
139 . 1 . 1 65 65 GLY N N 15 102.243 0.000 . 1 . . . . . 65 GLY N . 50732 1
140 . 1 . 1 66 66 ASP H H 1 7.719 0.000 . 1 . . . . . 66 ASP HN . 50732 1
141 . 1 . 1 66 66 ASP N N 15 117.666 0.000 . 1 . . . . . 66 ASP N . 50732 1
142 . 1 . 1 67 67 CYS H H 1 6.587 0.000 . 1 . . . . . 67 CYS HN . 50732 1
143 . 1 . 1 67 67 CYS N N 15 115.575 0.000 . 1 . . . . . 67 CYS N . 50732 1
144 . 1 . 1 68 68 HIS H H 1 6.930 0.000 . 1 . . . . . 68 HIS HN . 50732 1
145 . 1 . 1 68 68 HIS HD1 H 1 8.966 0.000 . 1 . . . . . 68 HIS HD1 . 50732 1
146 . 1 . 1 68 68 HIS N N 15 118.120 0.000 . 1 . . . . . 68 HIS N . 50732 1
147 . 1 . 1 68 68 HIS ND1 N 15 166.267 0.000 . 1 . . . . . 68 HIS ND1 . 50732 1
148 . 1 . 1 69 69 LYS H H 1 7.063 0.000 . 1 . . . . . 69 LYS HN . 50732 1
149 . 1 . 1 69 69 LYS N N 15 124.047 0.000 . 1 . . . . . 69 LYS N . 50732 1
150 . 1 . 1 70 70 LYS H H 1 7.879 0.000 . 1 . . . . . 70 LYS HN . 50732 1
151 . 1 . 1 70 70 LYS N N 15 128.271 0.000 . 1 . . . . . 70 LYS N . 50732 1
152 . 2 . 2 1 1 HEM HHC H 1 9.384 0.000 . 1 . . . . . 1 HEM HHC . 50732 1
153 . 2 . 2 1 1 HEM HHD H 1 9.047 0.000 . 1 . . . . . 1 HEM HHD . 50732 1
154 . 2 . 2 1 1 HEM HHB H 1 9.508 0.001 . 1 . . . . . 1 HEM HHB . 50732 1
155 . 2 . 2 1 1 HEM HHA H 1 9.260 0.000 . 1 . . . . . 1 HEM HHA . 50732 1
156 . 2 . 2 1 1 HEM HAB H 1 5.932 0.001 . 1 . . . . . 1 HEM HAB . 50732 1
157 . 2 . 2 1 1 HEM HAC H 1 6.242 0.002 . 1 . . . . . 1 HEM HAC . 50732 1
158 . 2 . 2 1 1 HEM HMB H 1 3.519 0.000 . 1 . . . . . 1 HEM HMB . 50732 1
159 . 2 . 2 1 1 HEM HMC H 1 3.453 0.002 . 1 . . . . . 1 HEM HMC . 50732 1
160 . 2 . 2 1 1 HEM HMD H 1 2.564 0.003 . 1 . . . . . 1 HEM HMD . 50732 1
161 . 2 . 2 1 1 HEM HMA H 1 3.341 0.000 . 1 . . . . . 1 HEM HMA . 50732 1
162 . 2 . 2 1 1 HEM HBB H 1 2.102 0.001 . 1 . . . . . 1 HEM HBB . 50732 1
163 . 2 . 2 1 1 HEM HBC H 1 1.931 0.001 . 1 . . . . . 1 HEM HBC . 50732 1
164 . 3 . 2 1 1 HEM HHC H 1 9.731 0.001 . 1 . . . . . 1 HEM HHC . 50732 1
165 . 3 . 2 1 1 HEM HHD H 1 9.836 0.000 . 1 . . . . . 1 HEM HHD . 50732 1
166 . 3 . 2 1 1 HEM HHB H 1 10.122 0.000 . 1 . . . . . 1 HEM HHB . 50732 1
167 . 3 . 2 1 1 HEM HHA H 1 9.514 0.000 . 1 . . . . . 1 HEM HHA . 50732 1
168 . 3 . 2 1 1 HEM HAB H 1 6.566 0.001 . 1 . . . . . 1 HEM HAB . 50732 1
169 . 3 . 2 1 1 HEM HAC H 1 6.564 0.001 . 1 . . . . . 1 HEM HAC . 50732 1
170 . 3 . 2 1 1 HEM HMB H 1 4.257 0.003 . 1 . . . . . 1 HEM HMB . 50732 1
171 . 3 . 2 1 1 HEM HMC H 1 3.994 0.001 . 1 . . . . . 1 HEM HMC . 50732 1
172 . 3 . 2 1 1 HEM HMD H 1 3.456 0.001 . 1 . . . . . 1 HEM HMD . 50732 1
173 . 3 . 2 1 1 HEM HMA H 1 3.906 0.001 . 1 . . . . . 1 HEM HMA . 50732 1
174 . 3 . 2 1 1 HEM HBB H 1 2.199 0.002 . 1 . . . . . 1 HEM HBB . 50732 1
175 . 3 . 2 1 1 HEM HBC H 1 2.946 0.001 . 1 . . . . . 1 HEM HBC . 50732 1
176 . 4 . 2 1 1 HEM HHC H 1 8.982 0.001 . 1 . . . . . 1 HEM HHC . 50732 1
177 . 4 . 2 1 1 HEM HHD H 1 9.314 0.001 . 1 . . . . . 1 HEM HHD . 50732 1
178 . 4 . 2 1 1 HEM HHB H 1 9.428 0.000 . 1 . . . . . 1 HEM HHB . 50732 1
179 . 4 . 2 1 1 HEM HHA H 1 9.435 0.000 . 1 . . . . . 1 HEM HHA . 50732 1
180 . 4 . 2 1 1 HEM HAB H 1 5.922 0.001 . 1 . . . . . 1 HEM HAB . 50732 1
181 . 4 . 2 1 1 HEM HAC H 1 6.267 0.000 . 1 . . . . . 1 HEM HAC . 50732 1
182 . 4 . 2 1 1 HEM HMB H 1 3.624 0.001 . 1 . . . . . 1 HEM HMB . 50732 1
183 . 4 . 2 1 1 HEM HMC H 1 2.994 0.001 . 1 . . . . . 1 HEM HMC . 50732 1
184 . 4 . 2 1 1 HEM HMD H 1 3.902 0.001 . 1 . . . . . 1 HEM HMD . 50732 1
185 . 4 . 2 1 1 HEM HMA H 1 3.326 0.000 . 1 . . . . . 1 HEM HMA . 50732 1
186 . 4 . 2 1 1 HEM HBB H 1 2.069 0.001 . 1 . . . . . 1 HEM HBB . 50732 1
187 . 4 . 2 1 1 HEM HBC H 1 1.460 0.001 . 1 . . . . . 1 HEM HBC . 50732 1
stop_
save_