Content for NMR-STAR saveframe, "chemical_shift_assignment_data_set_one"
save_chemical_shift_assignment_data_set_one
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode 'chemical_shift_assignment_data_set_one'
_Assigned_chem_shift_list.Entry_ID 1500
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_condition_set_one
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_par_set_one
_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 $sample_one . 1500 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.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 3.83 . . 1 . . . . . . . . 1500 1
2 . 1 1 1 1 LYS HB2 H 1 1.68 . . 2 . . . . . . . . 1500 1
3 . 1 1 1 1 LYS HB3 H 1 1.63 . . 2 . . . . . . . . 1500 1
4 . 1 1 1 1 LYS HG2 H 1 1.05 . . 1 . . . . . . . . 1500 1
5 . 1 1 1 1 LYS HG3 H 1 1.05 . . 1 . . . . . . . . 1500 1
6 . 1 1 1 1 LYS HD2 H 1 1.52 . . 1 . . . . . . . . 1500 1
7 . 1 1 1 1 LYS HD3 H 1 1.52 . . 1 . . . . . . . . 1500 1
8 . 1 1 1 1 LYS HE2 H 1 2.75 . . 1 . . . . . . . . 1500 1
9 . 1 1 1 1 LYS HE3 H 1 2.75 . . 1 . . . . . . . . 1500 1
10 . 1 1 2 2 THR H H 1 8.14 . . 1 . . . . . . . . 1500 1
11 . 1 1 2 2 THR HA H 1 4.25 . . 1 . . . . . . . . 1500 1
12 . 1 1 2 2 THR HB H 1 3.75 . . 1 . . . . . . . . 1500 1
13 . 1 1 2 2 THR HG21 H 1 .95 . . 1 . . . . . . . . 1500 1
14 . 1 1 2 2 THR HG22 H 1 .95 . . 1 . . . . . . . . 1500 1
15 . 1 1 2 2 THR HG23 H 1 .95 . . 1 . . . . . . . . 1500 1
16 . 1 1 3 3 TYR H H 1 8.8 . . 1 . . . . . . . . 1500 1
17 . 1 1 3 3 TYR HA H 1 4.4 . . 1 . . . . . . . . 1500 1
18 . 1 1 3 3 TYR HB2 H 1 2.75 . . 2 . . . . . . . . 1500 1
19 . 1 1 3 3 TYR HB3 H 1 2.85 . . 2 . . . . . . . . 1500 1
20 . 1 1 3 3 TYR HD1 H 1 6.88 . . 1 . . . . . . . . 1500 1
21 . 1 1 3 3 TYR HD2 H 1 6.88 . . 1 . . . . . . . . 1500 1
22 . 1 1 3 3 TYR HE1 H 1 6.72 . . 1 . . . . . . . . 1500 1
23 . 1 1 3 3 TYR HE2 H 1 6.72 . . 1 . . . . . . . . 1500 1
24 . 1 1 4 4 GLN H H 1 8.46 . . 1 . . . . . . . . 1500 1
25 . 1 1 4 4 GLN HA H 1 4.55 . . 1 . . . . . . . . 1500 1
26 . 1 1 4 4 GLN HB2 H 1 1.85 . . 2 . . . . . . . . 1500 1
27 . 1 1 4 4 GLN HB3 H 1 1.92 . . 2 . . . . . . . . 1500 1
28 . 1 1 4 4 GLN HG2 H 1 2.11 . . 2 . . . . . . . . 1500 1
29 . 1 1 4 4 GLN HG3 H 1 2.28 . . 2 . . . . . . . . 1500 1
30 . 1 1 5 5 CYS H H 1 8.9 . . 1 . . . . . . . . 1500 1
31 . 1 1 5 5 CYS HA H 1 4.15 . . 1 . . . . . . . . 1500 1
32 . 1 1 5 5 CYS HB2 H 1 2.75 . . 2 . . . . . . . . 1500 1
33 . 1 1 5 5 CYS HB3 H 1 3.48 . . 2 . . . . . . . . 1500 1
34 . 1 1 6 6 GLN H H 1 8.82 . . 1 . . . . . . . . 1500 1
35 . 1 1 6 6 GLN HA H 1 4.18 . . 1 . . . . . . . . 1500 1
36 . 1 1 6 6 GLN HB2 H 1 1.58 . . 1 . . . . . . . . 1500 1
37 . 1 1 6 6 GLN HB3 H 1 1.58 . . 1 . . . . . . . . 1500 1
38 . 1 1 6 6 GLN HG2 H 1 1.52 . . 2 . . . . . . . . 1500 1
39 . 1 1 6 6 GLN HG3 H 1 1.7 . . 2 . . . . . . . . 1500 1
40 . 1 1 7 7 TYR H H 1 9.65 . . 1 . . . . . . . . 1500 1
41 . 1 1 7 7 TYR HA H 1 4.5 . . 1 . . . . . . . . 1500 1
42 . 1 1 7 7 TYR HB2 H 1 1.2 . . 2 . . . . . . . . 1500 1
43 . 1 1 7 7 TYR HB3 H 1 2.57 . . 2 . . . . . . . . 1500 1
44 . 1 1 7 7 TYR HD1 H 1 6.84 . . 1 . . . . . . . . 1500 1
45 . 1 1 7 7 TYR HD2 H 1 6.84 . . 1 . . . . . . . . 1500 1
46 . 1 1 7 7 TYR HE1 H 1 6.69 . . 1 . . . . . . . . 1500 1
47 . 1 1 7 7 TYR HE2 H 1 6.69 . . 1 . . . . . . . . 1500 1
48 . 1 1 8 8 CYS H H 1 7.9 . . 1 . . . . . . . . 1500 1
49 . 1 1 8 8 CYS HA H 1 4.93 . . 1 . . . . . . . . 1500 1
50 . 1 1 8 8 CYS HB2 H 1 3.23 . . 2 . . . . . . . . 1500 1
51 . 1 1 8 8 CYS HB3 H 1 3.35 . . 2 . . . . . . . . 1500 1
52 . 1 1 9 9 GLU H H 1 8.46 . . 1 . . . . . . . . 1500 1
53 . 1 1 9 9 GLU HA H 1 4.18 . . 1 . . . . . . . . 1500 1
54 . 1 1 9 9 GLU HB2 H 1 1.88 . . 2 . . . . . . . . 1500 1
55 . 1 1 9 9 GLU HB3 H 1 2.02 . . 2 . . . . . . . . 1500 1
56 . 1 1 9 9 GLU HG2 H 1 2.13 . . 2 . . . . . . . . 1500 1
57 . 1 1 9 9 GLU HG3 H 1 2.25 . . 2 . . . . . . . . 1500 1
58 . 1 1 10 10 TYR H H 1 9.08 . . 1 . . . . . . . . 1500 1
59 . 1 1 10 10 TYR HA H 1 3.93 . . 1 . . . . . . . . 1500 1
60 . 1 1 10 10 TYR HB2 H 1 2.05 . . 2 . . . . . . . . 1500 1
61 . 1 1 10 10 TYR HB3 H 1 2.73 . . 2 . . . . . . . . 1500 1
62 . 1 1 10 10 TYR HD1 H 1 6.42 . . 1 . . . . . . . . 1500 1
63 . 1 1 10 10 TYR HD2 H 1 6.42 . . 1 . . . . . . . . 1500 1
64 . 1 1 10 10 TYR HE1 H 1 6.42 . . 1 . . . . . . . . 1500 1
65 . 1 1 10 10 TYR HE2 H 1 6.42 . . 1 . . . . . . . . 1500 1
66 . 1 1 11 11 ARG H H 1 6.91 . . 1 . . . . . . . . 1500 1
67 . 1 1 11 11 ARG HA H 1 4.92 . . 1 . . . . . . . . 1500 1
68 . 1 1 11 11 ARG HB2 H 1 1.32 . . 2 . . . . . . . . 1500 1
69 . 1 1 11 11 ARG HB3 H 1 1.58 . . 2 . . . . . . . . 1500 1
70 . 1 1 11 11 ARG HG2 H 1 1.48 . . 1 . . . . . . . . 1500 1
71 . 1 1 11 11 ARG HG3 H 1 1.48 . . 1 . . . . . . . . 1500 1
72 . 1 1 11 11 ARG HD2 H 1 3 . . 1 . . . . . . . . 1500 1
73 . 1 1 11 11 ARG HD3 H 1 3 . . 1 . . . . . . . . 1500 1
74 . 1 1 12 12 SER H H 1 8.39 . . 1 . . . . . . . . 1500 1
75 . 1 1 12 12 SER HA H 1 4.45 . . 1 . . . . . . . . 1500 1
76 . 1 1 12 12 SER HB2 H 1 3.43 . . 2 . . . . . . . . 1500 1
77 . 1 1 12 12 SER HB3 H 1 3.88 . . 2 . . . . . . . . 1500 1
78 . 1 1 13 13 ALA H H 1 8.65 . . 1 . . . . . . . . 1500 1
79 . 1 1 13 13 ALA HA H 1 4.9 . . 1 . . . . . . . . 1500 1
80 . 1 1 13 13 ALA HB1 H 1 1.45 . . 1 . . . . . . . . 1500 1
81 . 1 1 13 13 ALA HB2 H 1 1.45 . . 1 . . . . . . . . 1500 1
82 . 1 1 13 13 ALA HB3 H 1 1.45 . . 1 . . . . . . . . 1500 1
83 . 1 1 14 14 ASP H H 1 8.21 . . 1 . . . . . . . . 1500 1
84 . 1 1 14 14 ASP HA H 1 4.88 . . 1 . . . . . . . . 1500 1
85 . 1 1 14 14 ASP HB2 H 1 2.5 . . 2 . . . . . . . . 1500 1
86 . 1 1 14 14 ASP HB3 H 1 2.7 . . 2 . . . . . . . . 1500 1
87 . 1 1 15 15 SER H H 1 8.65 . . 1 . . . . . . . . 1500 1
88 . 1 1 15 15 SER HA H 1 3.25 . . 1 . . . . . . . . 1500 1
89 . 1 1 15 15 SER HB2 H 1 3.04 . . 2 . . . . . . . . 1500 1
90 . 1 1 15 15 SER HB3 H 1 3.4 . . 2 . . . . . . . . 1500 1
91 . 1 1 16 16 SER H H 1 8.33 . . 1 . . . . . . . . 1500 1
92 . 1 1 16 16 SER HA H 1 4.13 . . 1 . . . . . . . . 1500 1
93 . 1 1 16 16 SER HB2 H 1 3.95 . . 1 . . . . . . . . 1500 1
94 . 1 1 16 16 SER HB3 H 1 3.95 . . 1 . . . . . . . . 1500 1
95 . 1 1 17 17 ASN H H 1 8.17 . . 1 . . . . . . . . 1500 1
96 . 1 1 17 17 ASN HA H 1 4.42 . . 1 . . . . . . . . 1500 1
97 . 1 1 17 17 ASN HB2 H 1 3.05 . . 1 . . . . . . . . 1500 1
98 . 1 1 17 17 ASN HB3 H 1 3.05 . . 1 . . . . . . . . 1500 1
99 . 1 1 18 18 LEU H H 1 7.49 . . 1 . . . . . . . . 1500 1
100 . 1 1 18 18 LEU HA H 1 4.32 . . 1 . . . . . . . . 1500 1
101 . 1 1 18 18 LEU HB2 H 1 1.48 . . 2 . . . . . . . . 1500 1
102 . 1 1 18 18 LEU HB3 H 1 2.03 . . 2 . . . . . . . . 1500 1
103 . 1 1 18 18 LEU HG H 1 1.78 . . 1 . . . . . . . . 1500 1
104 . 1 1 18 18 LEU HD11 H 1 .93 . . 2 . . . . . . . . 1500 1
105 . 1 1 18 18 LEU HD12 H 1 .93 . . 2 . . . . . . . . 1500 1
106 . 1 1 18 18 LEU HD13 H 1 .93 . . 2 . . . . . . . . 1500 1
107 . 1 1 18 18 LEU HD21 H 1 1.02 . . 2 . . . . . . . . 1500 1
108 . 1 1 18 18 LEU HD22 H 1 1.02 . . 2 . . . . . . . . 1500 1
109 . 1 1 18 18 LEU HD23 H 1 1.02 . . 2 . . . . . . . . 1500 1
110 . 1 1 19 19 LYS H H 1 7.96 . . 1 . . . . . . . . 1500 1
111 . 1 1 19 19 LYS HA H 1 3.95 . . 1 . . . . . . . . 1500 1
112 . 1 1 19 19 LYS HB2 H 1 1.95 . . 1 . . . . . . . . 1500 1
113 . 1 1 19 19 LYS HB3 H 1 1.95 . . 1 . . . . . . . . 1500 1
114 . 1 1 19 19 LYS HG2 H 1 1.4 . . 1 . . . . . . . . 1500 1
115 . 1 1 19 19 LYS HG3 H 1 1.4 . . 1 . . . . . . . . 1500 1
116 . 1 1 19 19 LYS HD2 H 1 1.6 . . 1 . . . . . . . . 1500 1
117 . 1 1 19 19 LYS HD3 H 1 1.6 . . 1 . . . . . . . . 1500 1
118 . 1 1 19 19 LYS HE2 H 1 2.92 . . 1 . . . . . . . . 1500 1
119 . 1 1 19 19 LYS HE3 H 1 2.92 . . 1 . . . . . . . . 1500 1
120 . 1 1 20 20 THR H H 1 8.1 . . 1 . . . . . . . . 1500 1
121 . 1 1 20 20 THR HA H 1 3.86 . . 1 . . . . . . . . 1500 1
122 . 1 1 20 20 THR HB H 1 4.2 . . 1 . . . . . . . . 1500 1
123 . 1 1 20 20 THR HG21 H 1 1.16 . . 1 . . . . . . . . 1500 1
124 . 1 1 20 20 THR HG22 H 1 1.16 . . 1 . . . . . . . . 1500 1
125 . 1 1 20 20 THR HG23 H 1 1.16 . . 1 . . . . . . . . 1500 1
126 . 1 1 21 21 HIS H H 1 8.26 . . 1 . . . . . . . . 1500 1
127 . 1 1 21 21 HIS HA H 1 3.92 . . 1 . . . . . . . . 1500 1
128 . 1 1 21 21 HIS HB2 H 1 2.6 . . 2 . . . . . . . . 1500 1
129 . 1 1 21 21 HIS HB3 H 1 3.55 . . 2 . . . . . . . . 1500 1
130 . 1 1 21 21 HIS HD2 H 1 7.11 . . 1 . . . . . . . . 1500 1
131 . 1 1 21 21 HIS HE1 H 1 7.47 . . 1 . . . . . . . . 1500 1
132 . 1 1 22 22 ILE H H 1 8.65 . . 1 . . . . . . . . 1500 1
133 . 1 1 22 22 ILE HA H 1 3.48 . . 1 . . . . . . . . 1500 1
134 . 1 1 22 22 ILE HB H 1 1.92 . . 1 . . . . . . . . 1500 1
135 . 1 1 22 22 ILE HG12 H 1 1.25 . . 2 . . . . . . . . 1500 1
136 . 1 1 22 22 ILE HG13 H 1 1.58 . . 2 . . . . . . . . 1500 1
137 . 1 1 22 22 ILE HG21 H 1 1.03 . . 1 . . . . . . . . 1500 1
138 . 1 1 22 22 ILE HG22 H 1 1.03 . . 1 . . . . . . . . 1500 1
139 . 1 1 22 22 ILE HG23 H 1 1.03 . . 1 . . . . . . . . 1500 1
140 . 1 1 22 22 ILE HD11 H 1 1.17 . . 1 . . . . . . . . 1500 1
141 . 1 1 22 22 ILE HD12 H 1 1.17 . . 1 . . . . . . . . 1500 1
142 . 1 1 22 22 ILE HD13 H 1 1.17 . . 1 . . . . . . . . 1500 1
143 . 1 1 23 23 LYS H H 1 7.72 . . 1 . . . . . . . . 1500 1
144 . 1 1 23 23 LYS HA H 1 4 . . 1 . . . . . . . . 1500 1
145 . 1 1 23 23 LYS HB2 H 1 1.85 . . 1 . . . . . . . . 1500 1
146 . 1 1 23 23 LYS HB3 H 1 1.85 . . 1 . . . . . . . . 1500 1
147 . 1 1 23 23 LYS HG2 H 1 1.42 . . 1 . . . . . . . . 1500 1
148 . 1 1 23 23 LYS HG3 H 1 1.42 . . 1 . . . . . . . . 1500 1
149 . 1 1 23 23 LYS HD2 H 1 1.6 . . 1 . . . . . . . . 1500 1
150 . 1 1 23 23 LYS HD3 H 1 1.6 . . 1 . . . . . . . . 1500 1
151 . 1 1 23 23 LYS HE2 H 1 2.88 . . 1 . . . . . . . . 1500 1
152 . 1 1 23 23 LYS HE3 H 1 2.88 . . 1 . . . . . . . . 1500 1
153 . 1 1 24 24 THR H H 1 7.87 . . 1 . . . . . . . . 1500 1
154 . 1 1 24 24 THR HA H 1 3.96 . . 1 . . . . . . . . 1500 1
155 . 1 1 24 24 THR HB H 1 3.96 . . 1 . . . . . . . . 1500 1
156 . 1 1 24 24 THR HG21 H 1 1.15 . . 1 . . . . . . . . 1500 1
157 . 1 1 24 24 THR HG22 H 1 1.15 . . 1 . . . . . . . . 1500 1
158 . 1 1 24 24 THR HG23 H 1 1.15 . . 1 . . . . . . . . 1500 1
159 . 1 1 25 25 LYS H H 1 8.17 . . 1 . . . . . . . . 1500 1
160 . 1 1 25 25 LYS HA H 1 4.06 . . 1 . . . . . . . . 1500 1
161 . 1 1 25 25 LYS HB2 H 1 .48 . . 2 . . . . . . . . 1500 1
162 . 1 1 25 25 LYS HB3 H 1 .67 . . 2 . . . . . . . . 1500 1
163 . 1 1 25 25 LYS HG2 H 1 .67 . . 1 . . . . . . . . 1500 1
164 . 1 1 25 25 LYS HG3 H 1 .67 . . 1 . . . . . . . . 1500 1
165 . 1 1 25 25 LYS HD2 H 1 .93 . . 1 . . . . . . . . 1500 1
166 . 1 1 25 25 LYS HD3 H 1 .93 . . 1 . . . . . . . . 1500 1
167 . 1 1 25 25 LYS HE2 H 1 2.85 . . 1 . . . . . . . . 1500 1
168 . 1 1 25 25 LYS HE3 H 1 2.85 . . 1 . . . . . . . . 1500 1
169 . 1 1 26 26 HIS H H 1 7.37 . . 1 . . . . . . . . 1500 1
170 . 1 1 26 26 HIS HA H 1 5.07 . . 1 . . . . . . . . 1500 1
171 . 1 1 26 26 HIS HB2 H 1 2.65 . . 2 . . . . . . . . 1500 1
172 . 1 1 26 26 HIS HB3 H 1 2.92 . . 2 . . . . . . . . 1500 1
173 . 1 1 26 26 HIS HD2 H 1 6.59 . . 1 . . . . . . . . 1500 1
174 . 1 1 26 26 HIS HE1 H 1 7.82 . . 1 . . . . . . . . 1500 1
175 . 1 1 27 27 SER H H 1 7.64 . . 1 . . . . . . . . 1500 1
176 . 1 1 27 27 SER HA H 1 4.25 . . 1 . . . . . . . . 1500 1
177 . 1 1 27 27 SER HB2 H 1 3.88 . . 1 . . . . . . . . 1500 1
178 . 1 1 27 27 SER HB3 H 1 3.88 . . 1 . . . . . . . . 1500 1
179 . 1 1 28 28 LYS H H 1 8.03 . . 1 . . . . . . . . 1500 1
180 . 1 1 28 28 LYS HA H 1 4.33 . . 1 . . . . . . . . 1500 1
181 . 1 1 28 28 LYS HB2 H 1 1.57 . . 2 . . . . . . . . 1500 1
182 . 1 1 28 28 LYS HB3 H 1 1.8 . . 2 . . . . . . . . 1500 1
183 . 1 1 28 28 LYS HG2 H 1 1.26 . . 1 . . . . . . . . 1500 1
184 . 1 1 28 28 LYS HG3 H 1 1.26 . . 1 . . . . . . . . 1500 1
185 . 1 1 28 28 LYS HD2 H 1 1.48 . . 1 . . . . . . . . 1500 1
186 . 1 1 28 28 LYS HD3 H 1 1.48 . . 1 . . . . . . . . 1500 1
187 . 1 1 28 28 LYS HE2 H 1 2.8 . . 1 . . . . . . . . 1500 1
188 . 1 1 28 28 LYS HE3 H 1 2.8 . . 1 . . . . . . . . 1500 1
189 . 1 1 29 29 GLU H H 1 8.06 . . 1 . . . . . . . . 1500 1
190 . 1 1 29 29 GLU HA H 1 4.15 . . 1 . . . . . . . . 1500 1
191 . 1 1 29 29 GLU HB2 H 1 1.85 . . 2 . . . . . . . . 1500 1
192 . 1 1 29 29 GLU HB3 H 1 2 . . 2 . . . . . . . . 1500 1
193 . 1 1 29 29 GLU HG2 H 1 2.15 . . 2 . . . . . . . . 1500 1
194 . 1 1 29 29 GLU HG3 H 1 2.25 . . 2 . . . . . . . . 1500 1
195 . 1 1 30 30 LYS H H 1 7.8 . . 1 . . . . . . . . 1500 1
196 . 1 1 30 30 LYS HA H 1 4.08 . . 1 . . . . . . . . 1500 1
197 . 1 1 30 30 LYS HB2 H 1 1.65 . . 2 . . . . . . . . 1500 1
198 . 1 1 30 30 LYS HB3 H 1 1.75 . . 2 . . . . . . . . 1500 1
199 . 1 1 30 30 LYS HG2 H 1 1.3 . . 1 . . . . . . . . 1500 1
200 . 1 1 30 30 LYS HG3 H 1 1.3 . . 1 . . . . . . . . 1500 1
201 . 1 1 30 30 LYS HD2 H 1 1.6 . . 1 . . . . . . . . 1500 1
202 . 1 1 30 30 LYS HD3 H 1 1.6 . . 1 . . . . . . . . 1500 1
203 . 1 1 30 30 LYS HE2 H 1 2.92 . . 1 . . . . . . . . 1500 1
204 . 1 1 30 30 LYS HE3 H 1 2.92 . . 1 . . . . . . . . 1500 1
stop_
save_