Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
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 36158
_Assigned_chem_shift_list.ID 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-1H TOCSY' 1 $sample_1 isotropic 36158 1
2 '2D 1H-1H NOESY' 1 $sample_1 isotropic 36158 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_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 LYS HA H 1 3.778 0.010 . . . . . . A 1 LYS HA . 36158 1
2 . 1 1 1 1 LYS HB2 H 1 1.663 0.006 . . . . . . A 1 LYS HB2 . 36158 1
3 . 1 1 1 1 LYS HB3 H 1 1.663 0.006 . . . . . . A 1 LYS HB3 . 36158 1
4 . 1 1 1 1 LYS HG2 H 1 1.231 0.000 . . . . . . A 1 LYS HG2 . 36158 1
5 . 1 1 1 1 LYS HG3 H 1 1.231 0.000 . . . . . . A 1 LYS HG3 . 36158 1
6 . 1 1 1 1 LYS HD2 H 1 1.478 0.000 . . . . . . A 1 LYS HD2 . 36158 1
7 . 1 1 1 1 LYS HD3 H 1 1.478 0.000 . . . . . . A 1 LYS HD3 . 36158 1
8 . 1 1 1 1 LYS HE2 H 1 2.779 0.000 . . . . . . A 1 LYS HE2 . 36158 1
9 . 1 1 1 1 LYS HE3 H 1 2.779 0.000 . . . . . . A 1 LYS HE3 . 36158 1
10 . 1 1 2 2 LYS H H 1 8.592 0.002 . . . . . . A 2 LYS H . 36158 1
11 . 1 1 2 2 LYS HA H 1 4.087 0.000 . . . . . . A 2 LYS HA . 36158 1
12 . 1 1 2 2 LYS HB2 H 1 1.536 0.000 . . . . . . A 2 LYS HB2 . 36158 1
13 . 1 1 2 2 LYS HB3 H 1 1.536 0.000 . . . . . . A 2 LYS HB3 . 36158 1
14 . 1 1 2 2 LYS HG2 H 1 1.199 0.000 . . . . . . A 2 LYS HG2 . 36158 1
15 . 1 1 2 2 LYS HG3 H 1 1.199 0.000 . . . . . . A 2 LYS HG3 . 36158 1
16 . 1 1 2 2 LYS HD2 H 1 2.334 0.000 . . . . . . A 2 LYS HD2 . 36158 1
17 . 1 1 2 2 LYS HD3 H 1 2.334 0.000 . . . . . . A 2 LYS HD3 . 36158 1
18 . 1 1 2 2 LYS HE2 H 1 2.739 0.000 . . . . . . A 2 LYS HE2 . 36158 1
19 . 1 1 2 2 LYS HE3 H 1 2.739 0.000 . . . . . . A 2 LYS HE3 . 36158 1
20 . 1 1 3 3 LYS H H 1 8.465 0.000 . . . . . . A 3 LYS H . 36158 1
21 . 1 1 3 3 LYS HA H 1 4.092 0.006 . . . . . . A 3 LYS HA . 36158 1
22 . 1 1 3 3 LYS HB2 H 1 1.559 0.010 . . . . . . A 3 LYS HB2 . 36158 1
23 . 1 1 3 3 LYS HB3 H 1 1.559 0.010 . . . . . . A 3 LYS HB3 . 36158 1
24 . 1 1 3 3 LYS HG2 H 1 1.227 0.005 . . . . . . A 3 LYS HG2 . 36158 1
25 . 1 1 3 3 LYS HG3 H 1 1.227 0.005 . . . . . . A 3 LYS HG3 . 36158 1
26 . 1 1 3 3 LYS HD2 H 1 2.334 0.000 . . . . . . A 3 LYS HD2 . 36158 1
27 . 1 1 3 3 LYS HD3 H 1 2.334 0.000 . . . . . . A 3 LYS HD3 . 36158 1
28 . 1 1 3 3 LYS HE2 H 1 2.748 0.000 . . . . . . A 3 LYS HE2 . 36158 1
29 . 1 1 3 3 LYS HE3 H 1 2.748 0.000 . . . . . . A 3 LYS HE3 . 36158 1
30 . 1 1 4 4 SER H H 1 8.274 0.000 . . . . . . A 4 SER H . 36158 1
31 . 1 1 4 4 SER HA H 1 4.180 0.006 . . . . . . A 4 SER HA . 36158 1
32 . 1 1 4 4 SER HB2 H 1 3.597 0.005 . . . . . . A 4 SER HB2 . 36158 1
33 . 1 1 4 4 SER HB3 H 1 3.597 0.005 . . . . . . A 4 SER HB3 . 36158 1
34 . 1 1 5 5 GLY H H 1 8.268 0.001 . . . . . . A 5 GLY H . 36158 1
35 . 1 1 5 5 GLY HA2 H 1 3.685 0.000 . . . . . . A 5 GLY HA2 . 36158 1
36 . 1 1 5 5 GLY HA3 H 1 3.594 0.000 . . . . . . A 5 GLY HA3 . 36158 1
37 . 1 1 6 6 VAL H H 1 7.522 0.001 . . . . . . A 6 VAL H . 36158 1
38 . 1 1 6 6 VAL HA H 1 3.594 0.009 . . . . . . A 6 VAL HA . 36158 1
39 . 1 1 6 6 VAL HB H 1 0.939 0.017 . . . . . . A 6 VAL HB . 36158 1
40 . 1 1 6 6 VAL HG11 H 1 0.262 0.010 . . . . . . A 6 VAL HG11 . 36158 1
41 . 1 1 6 6 VAL HG12 H 1 0.262 0.010 . . . . . . A 6 VAL HG12 . 36158 1
42 . 1 1 6 6 VAL HG13 H 1 0.262 0.010 . . . . . . A 6 VAL HG13 . 36158 1
43 . 1 1 6 6 VAL HG21 H 1 0.178 0.012 . . . . . . A 6 VAL HG21 . 36158 1
44 . 1 1 6 6 VAL HG22 H 1 0.178 0.012 . . . . . . A 6 VAL HG22 . 36158 1
45 . 1 1 6 6 VAL HG23 H 1 0.178 0.012 . . . . . . A 6 VAL HG23 . 36158 1
46 . 1 1 7 7 ILE H H 1 7.758 0.002 . . . . . . A 7 ILE H . 36158 1
47 . 1 1 7 7 ILE HA H 1 4.441 0.010 . . . . . . A 7 ILE HA . 36158 1
48 . 1 1 7 7 ILE HB H 1 1.614 0.014 . . . . . . A 7 ILE HB . 36158 1
49 . 1 1 7 7 ILE HG12 H 1 0.790 0.011 . . . . . . A 7 ILE HG12 . 36158 1
50 . 1 1 7 7 ILE HG13 H 1 0.790 0.011 . . . . . . A 7 ILE HG13 . 36158 1
51 . 1 1 7 7 ILE HG21 H 1 0.709 0.008 . . . . . . A 7 ILE HG21 . 36158 1
52 . 1 1 7 7 ILE HG22 H 1 0.709 0.008 . . . . . . A 7 ILE HG22 . 36158 1
53 . 1 1 7 7 ILE HG23 H 1 0.709 0.008 . . . . . . A 7 ILE HG23 . 36158 1
54 . 1 1 7 7 ILE HD11 H 1 0.617 0.000 . . . . . . A 7 ILE HD11 . 36158 1
55 . 1 1 7 7 ILE HD12 H 1 0.617 0.000 . . . . . . A 7 ILE HD12 . 36158 1
56 . 1 1 7 7 ILE HD13 H 1 0.617 0.000 . . . . . . A 7 ILE HD13 . 36158 1
57 . 1 1 8 8 PRO HA H 1 4.110 0.010 . . . . . . A 8 PRO HA . 36158 1
58 . 1 1 8 8 PRO HB2 H 1 2.086 0.003 . . . . . . A 8 PRO HB2 . 36158 1
59 . 1 1 8 8 PRO HB3 H 1 1.967 0.011 . . . . . . A 8 PRO HB3 . 36158 1
60 . 1 1 8 8 PRO HG2 H 1 1.769 0.024 . . . . . . A 8 PRO HG2 . 36158 1
61 . 1 1 8 8 PRO HG3 H 1 1.769 0.024 . . . . . . A 8 PRO HG3 . 36158 1
62 . 1 1 8 8 PRO HD2 H 1 3.819 0.013 . . . . . . A 8 PRO HD2 . 36158 1
63 . 1 1 8 8 PRO HD3 H 1 3.553 0.017 . . . . . . A 8 PRO HD3 . 36158 1
64 . 1 1 9 9 DBB H H 1 6.928 0.001 . . . . . . A 9 DBB H . 36158 1
65 . 1 1 9 9 DBB HA H 1 4.349 0.013 . . . . . . A 9 DBB HA . 36158 1
66 . 1 1 9 9 DBB HB2 H 1 3.356 0.012 . . . . . . A 9 DBB HB2 . 36158 1
67 . 1 1 9 9 DBB HG1 H 1 1.032 0.021 . . . . . . A 9 DBB HG1 . 36158 1
68 . 1 1 10 10 VAL H H 1 7.509 0.001 . . . . . . A 10 VAL H . 36158 1
69 . 1 1 10 10 VAL HA H 1 4.113 0.010 . . . . . . A 10 VAL HA . 36158 1
70 . 1 1 10 10 VAL HB H 1 2.095 0.011 . . . . . . A 10 VAL HB . 36158 1
71 . 1 1 10 10 VAL HG11 H 1 0.867 0.010 . . . . . . A 10 VAL HG11 . 36158 1
72 . 1 1 10 10 VAL HG12 H 1 0.867 0.010 . . . . . . A 10 VAL HG12 . 36158 1
73 . 1 1 10 10 VAL HG13 H 1 0.867 0.010 . . . . . . A 10 VAL HG13 . 36158 1
74 . 1 1 10 10 VAL HG21 H 1 0.755 0.011 . . . . . . A 10 VAL HG21 . 36158 1
75 . 1 1 10 10 VAL HG22 H 1 0.755 0.011 . . . . . . A 10 VAL HG22 . 36158 1
76 . 1 1 10 10 VAL HG23 H 1 0.755 0.011 . . . . . . A 10 VAL HG23 . 36158 1
77 . 1 1 11 11 DAL H H 1 8.935 0.003 . . . . . . A 11 DAL H . 36158 1
78 . 1 1 11 11 DAL HA H 1 4.456 0.013 . . . . . . A 11 DAL HA . 36158 1
79 . 1 1 11 11 DAL HB1 H 1 2.875 0.015 . . . . . . A 11 DAL HB1 . 36158 1
80 . 1 1 11 11 DAL HB2 H 1 2.442 0.021 . . . . . . A 11 DAL HB2 . 36158 1
81 . 1 1 12 12 HIS H H 1 8.505 0.006 . . . . . . A 12 HIS H . 36158 1
82 . 1 1 12 12 HIS HA H 1 4.214 0.006 . . . . . . A 12 HIS HA . 36158 1
83 . 1 1 12 12 HIS HB2 H 1 2.945 0.002 . . . . . . A 12 HIS HB2 . 36158 1
84 . 1 1 12 12 HIS HB3 H 1 2.945 0.002 . . . . . . A 12 HIS HB3 . 36158 1
85 . 1 1 12 12 HIS HD2 H 1 6.984 0.008 . . . . . . A 12 HIS HD2 . 36158 1
86 . 1 1 13 13 ASP H H 1 8.964 0.004 . . . . . . A 13 ASP H . 36158 1
87 . 1 1 13 13 ASP HA H 1 4.059 0.014 . . . . . . A 13 ASP HA . 36158 1
88 . 1 1 13 13 ASP HB2 H 1 2.848 0.003 . . . . . . A 13 ASP HB2 . 36158 1
89 . 1 1 13 13 ASP HB3 H 1 2.412 0.034 . . . . . . A 13 ASP HB3 . 36158 1
90 . 1 1 14 14 CYS H H 1 8.118 0.001 . . . . . . A 14 CYS H . 36158 1
91 . 1 1 14 14 CYS HA H 1 3.939 0.010 . . . . . . A 14 CYS HA . 36158 1
92 . 1 1 14 14 CYS HB2 H 1 2.555 0.009 . . . . . . A 14 CYS HB2 . 36158 1
93 . 1 1 14 14 CYS HB3 H 1 2.555 0.009 . . . . . . A 14 CYS HB3 . 36158 1
94 . 1 1 15 15 HIS H H 1 8.479 0.002 . . . . . . A 15 HIS H . 36158 1
95 . 1 1 15 15 HIS HA H 1 4.063 0.010 . . . . . . A 15 HIS HA . 36158 1
96 . 1 1 15 15 HIS HB2 H 1 3.025 0.006 . . . . . . A 15 HIS HB2 . 36158 1
97 . 1 1 15 15 HIS HB3 H 1 3.025 0.006 . . . . . . A 15 HIS HB3 . 36158 1
98 . 1 1 15 15 HIS HD2 H 1 7.104 0.002 . . . . . . A 15 HIS HD2 . 36158 1
99 . 1 1 16 16 MET H H 1 7.030 0.004 . . . . . . A 16 MET H . 36158 1
100 . 1 1 16 16 MET HA H 1 4.539 0.013 . . . . . . A 16 MET HA . 36158 1
101 . 1 1 16 16 MET HB2 H 1 1.564 0.010 . . . . . . A 16 MET HB2 . 36158 1
102 . 1 1 16 16 MET HB3 H 1 1.564 0.010 . . . . . . A 16 MET HB3 . 36158 1
103 . 1 1 16 16 MET HG2 H 1 2.221 0.009 . . . . . . A 16 MET HG2 . 36158 1
104 . 1 1 16 16 MET HG3 H 1 2.008 0.004 . . . . . . A 16 MET HG3 . 36158 1
105 . 1 1 17 17 ASN H H 1 8.312 0.001 . . . . . . A 17 ASN H . 36158 1
106 . 1 1 17 17 ASN HA H 1 3.933 0.010 . . . . . . A 17 ASN HA . 36158 1
107 . 1 1 17 17 ASN HB2 H 1 2.316 0.014 . . . . . . A 17 ASN HB2 . 36158 1
108 . 1 1 17 17 ASN HB3 H 1 2.171 0.026 . . . . . . A 17 ASN HB3 . 36158 1
109 . 1 1 17 17 ASN HD21 H 1 7.309 0.000 . . . . . . A 17 ASN HD21 . 36158 1
110 . 1 1 17 17 ASN HD22 H 1 6.759 0.002 . . . . . . A 17 ASN HD22 . 36158 1
111 . 1 1 18 18 DAL H H 1 7.422 0.003 . . . . . . A 18 DAL H . 36158 1
112 . 1 1 18 18 DAL HA H 1 3.863 0.012 . . . . . . A 18 DAL HA . 36158 1
113 . 1 1 18 18 DAL HB1 H 1 3.166 0.016 . . . . . . A 18 DAL HB1 . 36158 1
114 . 1 1 18 18 DAL HB2 H 1 2.084 0.015 . . . . . . A 18 DAL HB2 . 36158 1
115 . 1 1 19 19 PHE H H 1 8.147 0.001 . . . . . . A 19 PHE H . 36158 1
116 . 1 1 19 19 PHE HA H 1 4.373 0.013 . . . . . . A 19 PHE HA . 36158 1
117 . 1 1 19 19 PHE HB2 H 1 3.047 0.011 . . . . . . A 19 PHE HB2 . 36158 1
118 . 1 1 19 19 PHE HB3 H 1 2.793 0.003 . . . . . . A 19 PHE HB3 . 36158 1
119 . 1 1 19 19 PHE HD1 H 1 6.932 0.006 . . . . . . A 19 PHE HD1 . 36158 1
120 . 1 1 19 19 PHE HD2 H 1 6.932 0.006 . . . . . . A 19 PHE HD2 . 36158 1
121 . 1 1 19 19 PHE HE1 H 1 7.114 0.005 . . . . . . A 19 PHE HE1 . 36158 1
122 . 1 1 19 19 PHE HE2 H 1 7.114 0.005 . . . . . . A 19 PHE HE2 . 36158 1
123 . 1 1 19 19 PHE HZ H 1 7.053 0.002 . . . . . . A 19 PHE HZ . 36158 1
124 . 1 1 20 20 GLN H H 1 7.343 0.002 . . . . . . A 20 GLN H . 36158 1
125 . 1 1 20 20 GLN HA H 1 4.347 0.005 . . . . . . A 20 GLN HA . 36158 1
126 . 1 1 20 20 GLN HB2 H 1 1.627 0.000 . . . . . . A 20 GLN HB2 . 36158 1
127 . 1 1 20 20 GLN HB3 H 1 1.627 0.000 . . . . . . A 20 GLN HB3 . 36158 1
128 . 1 1 20 20 GLN HG2 H 1 1.985 0.015 . . . . . . A 20 GLN HG2 . 36158 1
129 . 1 1 20 20 GLN HG3 H 1 1.985 0.015 . . . . . . A 20 GLN HG3 . 36158 1
130 . 1 1 21 21 PHE H H 1 8.467 0.002 . . . . . . A 21 PHE H . 36158 1
131 . 1 1 21 21 PHE HA H 1 4.819 0.016 . . . . . . A 21 PHE HA . 36158 1
132 . 1 1 21 21 PHE HB2 H 1 2.268 0.012 . . . . . . A 21 PHE HB2 . 36158 1
133 . 1 1 21 21 PHE HB3 H 1 2.442 0.009 . . . . . . A 21 PHE HB3 . 36158 1
134 . 1 1 21 21 PHE HD1 H 1 6.585 0.008 . . . . . . A 21 PHE HD1 . 36158 1
135 . 1 1 21 21 PHE HD2 H 1 6.585 0.008 . . . . . . A 21 PHE HD2 . 36158 1
136 . 1 1 21 21 PHE HE1 H 1 6.938 0.009 . . . . . . A 21 PHE HE1 . 36158 1
137 . 1 1 21 21 PHE HE2 H 1 6.938 0.009 . . . . . . A 21 PHE HE2 . 36158 1
138 . 1 1 21 21 PHE HZ H 1 6.734 0.012 . . . . . . A 21 PHE HZ . 36158 1
139 . 1 1 22 22 VAL H H 1 8.704 0.004 . . . . . . A 22 VAL H . 36158 1
140 . 1 1 22 22 VAL HA H 1 3.844 0.010 . . . . . . A 22 VAL HA . 36158 1
141 . 1 1 22 22 VAL HB H 1 1.646 0.016 . . . . . . A 22 VAL HB . 36158 1
142 . 1 1 22 22 VAL HG11 H 1 0.603 0.013 . . . . . . A 22 VAL HG11 . 36158 1
143 . 1 1 22 22 VAL HG12 H 1 0.603 0.013 . . . . . . A 22 VAL HG12 . 36158 1
144 . 1 1 22 22 VAL HG13 H 1 0.603 0.013 . . . . . . A 22 VAL HG13 . 36158 1
145 . 1 1 22 22 VAL HG21 H 1 0.558 0.029 . . . . . . A 22 VAL HG21 . 36158 1
146 . 1 1 22 22 VAL HG22 H 1 0.558 0.029 . . . . . . A 22 VAL HG22 . 36158 1
147 . 1 1 22 22 VAL HG23 H 1 0.558 0.029 . . . . . . A 22 VAL HG23 . 36158 1
148 . 1 1 23 23 PHE H H 1 9.350 0.001 . . . . . . A 23 PHE H . 36158 1
149 . 1 1 23 23 PHE HA H 1 4.277 0.007 . . . . . . A 23 PHE HA . 36158 1
150 . 1 1 23 23 PHE HB2 H 1 3.215 0.006 . . . . . . A 23 PHE HB2 . 36158 1
151 . 1 1 23 23 PHE HB3 H 1 2.847 0.012 . . . . . . A 23 PHE HB3 . 36158 1
152 . 1 1 23 23 PHE HD1 H 1 7.071 0.006 . . . . . . A 23 PHE HD1 . 36158 1
153 . 1 1 23 23 PHE HD2 H 1 7.071 0.006 . . . . . . A 23 PHE HD2 . 36158 1
154 . 1 1 23 23 PHE HE1 H 1 7.168 0.000 . . . . . . A 23 PHE HE1 . 36158 1
155 . 1 1 23 23 PHE HE2 H 1 7.168 0.000 . . . . . . A 23 PHE HE2 . 36158 1
156 . 1 1 23 23 PHE HZ H 1 7.098 0.000 . . . . . . A 23 PHE HZ . 36158 1
157 . 1 1 24 24 DBU H H 1 9.347 0.002 . . . . . . A 24 DBU H . 36158 1
158 . 1 1 24 24 DBU HB H 1 6.757 0.011 . . . . . . A 24 DBU HB . 36158 1
159 . 1 1 24 24 DBU HG1 H 1 1.490 0.006 . . . . . . A 24 DBU HG1 . 36158 1
160 . 1 1 25 25 CYS H H 1 7.785 0.006 . . . . . . A 25 CYS H . 36158 1
161 . 1 1 25 25 CYS HA H 1 5.008 0.015 . . . . . . A 25 CYS HA . 36158 1
162 . 1 1 25 25 CYS HB2 H 1 3.263 0.017 . . . . . . A 25 CYS HB2 . 36158 1
163 . 1 1 25 25 CYS HB3 H 1 2.541 0.014 . . . . . . A 25 CYS HB3 . 36158 1
164 . 1 1 26 26 CYS H H 1 8.724 0.006 . . . . . . A 26 CYS H . 36158 1
165 . 1 1 26 26 CYS HA H 1 3.817 0.003 . . . . . . A 26 CYS HA . 36158 1
166 . 1 1 26 26 CYS HB2 H 1 3.072 0.020 . . . . . . A 26 CYS HB2 . 36158 1
167 . 1 1 26 26 CYS HB3 H 1 2.985 0.013 . . . . . . A 26 CYS HB3 . 36158 1
168 . 1 1 27 27 SER H H 1 8.396 0.000 . . . . . . A 27 SER H . 36158 1
169 . 1 1 27 27 SER HA H 1 4.297 0.000 . . . . . . A 27 SER HA . 36158 1
170 . 1 1 27 27 SER HB2 H 1 3.721 0.000 . . . . . . A 27 SER HB2 . 36158 1
171 . 1 1 27 27 SER HB3 H 1 3.721 0.000 . . . . . . A 27 SER HB3 . 36158 1
stop_
save_