Content for NMR-STAR saveframe, "set_1"
save_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode set_1
_Assigned_chem_shift_list.Entry_ID 17796
_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 $chemical_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 '3D HNCACB' . . . 17796 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 ASP HA H 1 4.19 . . 1 . . . . 1 ASP HA . 17796 1
2 . 1 1 1 1 ASP CA C 13 52.50 . . 1 . . . . 1 ASP CA . 17796 1
3 . 1 1 1 1 ASP CB C 13 40.65 . . 1 . . . . 1 ASP CB . 17796 1
4 . 1 1 2 2 ALA H H 1 8.17 . . 1 . . . . 2 ALA H . 17796 1
5 . 1 1 2 2 ALA HA H 1 4.30 . . 1 . . . . 2 ALA HA . 17796 1
6 . 1 1 2 2 ALA CA C 13 52.81 . . 1 . . . . 2 ALA CA . 17796 1
7 . 1 1 2 2 ALA CB C 13 19.32 . . 1 . . . . 2 ALA CB . 17796 1
8 . 1 1 2 2 ALA N N 15 123.60 . . 1 . . . . 2 ALA N . 17796 1
9 . 1 1 3 3 GLU H H 1 8.58 . . 1 . . . . 3 GLU H . 17796 1
10 . 1 1 3 3 GLU HA H 1 4.19 . . 1 . . . . 3 GLU HA . 17796 1
11 . 1 1 3 3 GLU CA C 13 56.39 . . 1 . . . . 3 GLU CA . 17796 1
12 . 1 1 3 3 GLU CB C 13 30.44 . . 1 . . . . 3 GLU CB . 17796 1
13 . 1 1 3 3 GLU N N 15 120.70 . . 1 . . . . 3 GLU N . 17796 1
14 . 1 1 4 4 PHE H H 1 8.47 . . 1 . . . . 4 PHE H . 17796 1
15 . 1 1 4 4 PHE HA H 1 4.55 . . 1 . . . . 4 PHE HA . 17796 1
16 . 1 1 4 4 PHE CA C 13 57.53 . . 1 . . . . 4 PHE CA . 17796 1
17 . 1 1 4 4 PHE CB C 13 39.44 . . 1 . . . . 4 PHE CB . 17796 1
18 . 1 1 4 4 PHE N N 15 122.10 . . 1 . . . . 4 PHE N . 17796 1
19 . 1 1 5 5 ARG H H 1 8.28 . . 1 . . . . 5 ARG H . 17796 1
20 . 1 1 5 5 ARG HA H 1 4.25 . . 1 . . . . 5 ARG HA . 17796 1
21 . 1 1 5 5 ARG CA C 13 55.62 . . 1 . . . . 5 ARG CA . 17796 1
22 . 1 1 5 5 ARG CB C 13 31.25 . . 1 . . . . 5 ARG CB . 17796 1
23 . 1 1 5 5 ARG N N 15 124.00 . . 1 . . . . 5 ARG N . 17796 1
24 . 1 1 6 6 HIS HA H 1 4.53 . . 1 . . . . 6 HIS HA . 17796 1
25 . 1 1 6 6 HIS CA C 13 56.28 . . 1 . . . . 6 HIS CA . 17796 1
26 . 1 1 6 6 HIS CB C 13 30.48 . . 1 . . . . 6 HIS CB . 17796 1
27 . 1 1 7 7 ASP H H 1 8.50 . . 1 . . . . 7 ASP H . 17796 1
28 . 1 1 7 7 ASP HA H 1 4.63 . . 1 . . . . 7 ASP HA . 17796 1
29 . 1 1 7 7 ASP CA C 13 53.96 . . 1 . . . . 7 ASP CA . 17796 1
30 . 1 1 7 7 ASP CB C 13 41.14 . . 1 . . . . 7 ASP CB . 17796 1
31 . 1 1 7 7 ASP N N 15 121.80 . . 1 . . . . 7 ASP N . 17796 1
32 . 1 1 8 8 SER H H 1 8.57 . . 1 . . . . 8 SER H . 17796 1
33 . 1 1 8 8 SER HA H 1 4.37 . . 1 . . . . 8 SER HA . 17796 1
34 . 1 1 8 8 SER CA C 13 58.93 . . 1 . . . . 8 SER CA . 17796 1
35 . 1 1 8 8 SER CB C 13 63.48 . . 1 . . . . 8 SER CB . 17796 1
36 . 1 1 8 8 SER N N 15 116.80 . . 1 . . . . 8 SER N . 17796 1
37 . 1 1 9 9 GLY H H 1 8.67 . . 1 . . . . 9 GLY H . 17796 1
38 . 1 1 9 9 GLY HA2 H 1 3.88 . . 2 . . . . 9 GLY HA1 . 17796 1
39 . 1 1 9 9 GLY HA3 H 1 3.95 . . 2 . . . . 9 GLY HA2 . 17796 1
40 . 1 1 9 9 GLY CA C 13 45.32 . . 1 . . . . 9 GLY CA . 17796 1
41 . 1 1 9 9 GLY N N 15 110.90 . . 1 . . . . 9 GLY N . 17796 1
42 . 1 1 10 10 TYR H H 1 8.07 . . 1 . . . . 10 TYR H . 17796 1
43 . 1 1 10 10 TYR HA H 1 4.51 . . 1 . . . . 10 TYR HA . 17796 1
44 . 1 1 10 10 TYR CA C 13 58.15 . . 1 . . . . 10 TYR CA . 17796 1
45 . 1 1 10 10 TYR CB C 13 38.84 . . 1 . . . . 10 TYR CB . 17796 1
46 . 1 1 10 10 TYR N N 15 120.30 . . 1 . . . . 10 TYR N . 17796 1
47 . 1 1 11 11 GLU H H 1 8.50 . . 1 . . . . 11 GLU H . 17796 1
48 . 1 1 11 11 GLU HA H 1 4.19 . . 1 . . . . 11 GLU HA . 17796 1
49 . 1 1 11 11 GLU CA C 13 56.38 . . 1 . . . . 11 GLU CA . 17796 1
50 . 1 1 11 11 GLU CB C 13 30.36 . . 1 . . . . 11 GLU CB . 17796 1
51 . 1 1 11 11 GLU N N 15 122.50 . . 1 . . . . 11 GLU N . 17796 1
52 . 1 1 12 12 VAL H H 1 8.21 . . 1 . . . . 12 VAL H . 17796 1
53 . 1 1 12 12 VAL HA H 1 3.92 . . 1 . . . . 12 VAL HA . 17796 1
54 . 1 1 12 12 VAL CA C 13 62.80 . . 1 . . . . 12 VAL CA . 17796 1
55 . 1 1 12 12 VAL CB C 13 32.71 . . 1 . . . . 12 VAL CB . 17796 1
56 . 1 1 12 12 VAL N N 15 121.40 . . 1 . . . . 12 VAL N . 17796 1
57 . 1 1 13 13 HIS H H 1 8.42 . . 1 . . . . 13 HIS H . 17796 1
58 . 1 1 13 13 HIS HA H 1 4.59 . . 1 . . . . 13 HIS HA . 17796 1
59 . 1 1 13 13 HIS CA C 13 55.79 . . 1 . . . . 13 HIS CA . 17796 1
60 . 1 1 13 13 HIS CB C 13 30.47 . . 1 . . . . 13 HIS CB . 17796 1
61 . 1 1 13 13 HIS N N 15 122.50 . . 1 . . . . 13 HIS N . 17796 1
62 . 1 1 14 14 HIS H H 1 8.37 . . 1 . . . . 14 HIS H . 17796 1
63 . 1 1 14 14 HIS HA H 1 4.56 . . 1 . . . . 14 HIS HA . 17796 1
64 . 1 1 14 14 HIS CA C 13 56.03 . . 1 . . . . 14 HIS CA . 17796 1
65 . 1 1 14 14 HIS CB C 13 30.66 . . 1 . . . . 14 HIS CB . 17796 1
66 . 1 1 14 14 HIS N N 15 121.10 . . 1 . . . . 14 HIS N . 17796 1
67 . 1 1 15 15 GLN H H 1 8.55 . . 1 . . . . 15 GLN H . 17796 1
68 . 1 1 15 15 GLN HA H 1 4.26 . . 1 . . . . 15 GLN HA . 17796 1
69 . 1 1 15 15 GLN CA C 13 56.20 . . 1 . . . . 15 GLN CA . 17796 1
70 . 1 1 15 15 GLN CB C 13 29.46 . . 1 . . . . 15 GLN CB . 17796 1
71 . 1 1 15 15 GLN N N 15 121.70 . . 1 . . . . 15 GLN N . 17796 1
72 . 1 1 16 16 LYS H H 1 8.55 . . 1 . . . . 16 LYS H . 17796 1
73 . 1 1 16 16 LYS HA H 1 4.26 . . 1 . . . . 16 LYS HA . 17796 1
74 . 1 1 16 16 LYS CA C 13 56.35 . . 1 . . . . 16 LYS CA . 17796 1
75 . 1 1 16 16 LYS CB C 13 33.11 . . 1 . . . . 16 LYS CB . 17796 1
76 . 1 1 16 16 LYS N N 15 123.30 . . 1 . . . . 16 LYS N . 17796 1
77 . 1 1 17 17 LEU H H 1 8.42 . . 1 . . . . 17 LEU H . 17796 1
78 . 1 1 17 17 LEU HA H 1 4.33 . . 1 . . . . 17 LEU HA . 17796 1
79 . 1 1 17 17 LEU CA C 13 55.04 . . 1 . . . . 17 LEU CA . 17796 1
80 . 1 1 17 17 LEU CB C 13 42.40 . . 1 . . . . 17 LEU CB . 17796 1
81 . 1 1 17 17 LEU N N 15 124.20 . . 1 . . . . 17 LEU N . 17796 1
82 . 1 1 18 18 VAL H H 1 8.15 . . 1 . . . . 18 VAL H . 17796 1
83 . 1 1 18 18 VAL HA H 1 4.03 . . 1 . . . . 18 VAL HA . 17796 1
84 . 1 1 18 18 VAL CA C 13 61.87 . . 1 . . . . 18 VAL CA . 17796 1
85 . 1 1 18 18 VAL CB C 13 33.22 . . 1 . . . . 18 VAL CB . 17796 1
86 . 1 1 18 18 VAL N N 15 121.80 . . 1 . . . . 18 VAL N . 17796 1
87 . 1 1 19 19 PHE H H 1 8.42 . . 1 . . . . 19 PHE H . 17796 1
88 . 1 1 19 19 PHE HA H 1 4.57 . . 1 . . . . 19 PHE HA . 17796 1
89 . 1 1 19 19 PHE CA C 13 57.31 . . 1 . . . . 19 PHE CA . 17796 1
90 . 1 1 19 19 PHE CB C 13 40.20 . . 1 . . . . 19 PHE CB . 17796 1
91 . 1 1 19 19 PHE N N 15 124.70 . . 1 . . . . 19 PHE N . 17796 1
92 . 1 1 20 20 PHE H H 1 8.36 . . 1 . . . . 20 PHE H . 17796 1
93 . 1 1 20 20 PHE HA H 1 4.56 . . 1 . . . . 20 PHE HA . 17796 1
94 . 1 1 20 20 PHE CA C 13 57.23 . . 1 . . . . 20 PHE CA . 17796 1
95 . 1 1 20 20 PHE CB C 13 40.07 . . 1 . . . . 20 PHE CB . 17796 1
96 . 1 1 20 20 PHE N N 15 123.30 . . 1 . . . . 20 PHE N . 17796 1
97 . 1 1 21 21 ALA H H 1 8.39 . . 1 . . . . 21 ALA H . 17796 1
98 . 1 1 21 21 ALA HA H 1 4.21 . . 1 . . . . 21 ALA HA . 17796 1
99 . 1 1 21 21 ALA CA C 13 52.51 . . 1 . . . . 21 ALA CA . 17796 1
100 . 1 1 21 21 ALA CB C 13 19.59 . . 1 . . . . 21 ALA CB . 17796 1
101 . 1 1 21 21 ALA N N 15 126.50 . . 1 . . . . 21 ALA N . 17796 1
102 . 1 1 22 22 GLU H H 1 8.50 . . 1 . . . . 22 GLU H . 17796 1
103 . 1 1 22 22 GLU HA H 1 4.20 . . 1 . . . . 22 GLU HA . 17796 1
104 . 1 1 22 22 GLU CA C 13 56.29 . . 1 . . . . 22 GLU CA . 17796 1
105 . 1 1 22 22 GLU CB C 13 30.44 . . 1 . . . . 22 GLU CB . 17796 1
106 . 1 1 22 22 GLU N N 15 120.00 . . 1 . . . . 22 GLU N . 17796 1
107 . 1 1 23 23 ASP H H 1 8.57 . . 1 . . . . 23 ASP H . 17796 1
108 . 1 1 23 23 ASP HA H 1 4.65 . . 1 . . . . 23 ASP HA . 17796 1
109 . 1 1 23 23 ASP CA C 13 53.97 . . 1 . . . . 23 ASP CA . 17796 1
110 . 1 1 23 23 ASP CB C 13 41.12 . . 1 . . . . 23 ASP CB . 17796 1
111 . 1 1 23 23 ASP N N 15 122.00 . . 1 . . . . 23 ASP N . 17796 1
112 . 1 1 24 24 VAL H H 1 8.31 . . 1 . . . . 24 VAL H . 17796 1
113 . 1 1 24 24 VAL HA H 1 4.15 . . 1 . . . . 24 VAL HA . 17796 1
114 . 1 1 24 24 VAL CA C 13 62.86 . . 1 . . . . 24 VAL CA . 17796 1
115 . 1 1 24 24 VAL CB C 13 32.37 . . 1 . . . . 24 VAL CB . 17796 1
116 . 1 1 24 24 VAL N N 15 120.80 . . 1 . . . . 24 VAL N . 17796 1
117 . 1 1 25 25 GLY H H 1 8.69 . . 1 . . . . 25 GLY H . 17796 1
118 . 1 1 25 25 GLY HA2 H 1 3.98 . . 2 . . . . 25 GLY HA1 . 17796 1
119 . 1 1 25 25 GLY HA3 H 1 3.98 . . 2 . . . . 25 GLY HA2 . 17796 1
120 . 1 1 25 25 GLY CA C 13 45.40 . . 1 . . . . 25 GLY CA . 17796 1
121 . 1 1 25 25 GLY N N 15 111.80 . . 1 . . . . 25 GLY N . 17796 1
122 . 1 1 26 26 SER H H 1 8.27 . . 1 . . . . 26 SER H . 17796 1
123 . 1 1 26 26 SER HA H 1 4.43 . . 1 . . . . 26 SER HA . 17796 1
124 . 1 1 26 26 SER CA C 13 58.47 . . 1 . . . . 26 SER CA . 17796 1
125 . 1 1 26 26 SER CB C 13 63.65 . . 1 . . . . 26 SER CB . 17796 1
126 . 1 1 26 26 SER N N 15 115.70 . . 1 . . . . 26 SER N . 17796 1
127 . 1 1 27 27 ASN H H 1 8.62 . . 1 . . . . 27 ASN H . 17796 1
128 . 1 1 27 27 ASN HA H 1 4.74 . . 1 . . . . 27 ASN HA . 17796 1
129 . 1 1 27 27 ASN CA C 13 53.39 . . 1 . . . . 27 ASN CA . 17796 1
130 . 1 1 27 27 ASN CB C 13 38.53 . . 1 . . . . 27 ASN CB . 17796 1
131 . 1 1 27 27 ASN N N 15 120.70 . . 1 . . . . 27 ASN N . 17796 1
132 . 1 1 28 28 LYS H H 1 8.47 . . 1 . . . . 28 LYS H . 17796 1
133 . 1 1 28 28 LYS HA H 1 4.26 . . 1 . . . . 28 LYS HA . 17796 1
134 . 1 1 28 28 LYS CA C 13 56.57 . . 1 . . . . 28 LYS CA . 17796 1
135 . 1 1 28 28 LYS CB C 13 32.55 . . 1 . . . . 28 LYS CB . 17796 1
136 . 1 1 28 28 LYS N N 15 121.80 . . 1 . . . . 28 LYS N . 17796 1
137 . 1 1 29 29 GLY H H 1 8.56 . . 1 . . . . 29 GLY H . 17796 1
138 . 1 1 29 29 GLY HA2 H 1 3.93 . . 2 . . . . 29 GLY HA1 . 17796 1
139 . 1 1 29 29 GLY HA3 H 1 3.93 . . 2 . . . . 29 GLY HA2 . 17796 1
140 . 1 1 29 29 GLY CA C 13 45.09 . . 1 . . . . 29 GLY CA . 17796 1
141 . 1 1 29 29 GLY N N 15 109.60 . . 1 . . . . 29 GLY N . 17796 1
142 . 1 1 30 30 ALA H H 1 8.17 . . 1 . . . . 30 ALA H . 17796 1
143 . 1 1 30 30 ALA HA H 1 4.31 . . 1 . . . . 30 ALA HA . 17796 1
144 . 1 1 30 30 ALA CA C 13 52.56 . . 1 . . . . 30 ALA CA . 17796 1
145 . 1 1 30 30 ALA CB C 13 19.47 . . 1 . . . . 30 ALA CB . 17796 1
146 . 1 1 30 30 ALA N N 15 123.60 . . 1 . . . . 30 ALA N . 17796 1
147 . 1 1 31 31 ILE H H 1 8.34 . . 1 . . . . 31 ILE H . 17796 1
148 . 1 1 31 31 ILE HA H 1 4.15 . . 1 . . . . 31 ILE HA . 17796 1
149 . 1 1 31 31 ILE CA C 13 61.01 . . 1 . . . . 31 ILE CA . 17796 1
150 . 1 1 31 31 ILE CB C 13 38.47 . . 1 . . . . 31 ILE CB . 17796 1
151 . 1 1 31 31 ILE N N 15 121.10 . . 1 . . . . 31 ILE N . 17796 1
152 . 1 1 32 32 ILE H H 1 8.45 . . 1 . . . . 32 ILE H . 17796 1
153 . 1 1 32 32 ILE HA H 1 4.15 . . 1 . . . . 32 ILE HA . 17796 1
154 . 1 1 32 32 ILE CA C 13 61.02 . . 1 . . . . 32 ILE CA . 17796 1
155 . 1 1 32 32 ILE CB C 13 38.48 . . 1 . . . . 32 ILE CB . 17796 1
156 . 1 1 32 32 ILE N N 15 126.50 . . 1 . . . . 32 ILE N . 17796 1
157 . 1 1 33 33 GLY H H 1 8.63 . . 1 . . . . 33 GLY H . 17796 1
158 . 1 1 33 33 GLY HA2 H 1 3.92 . . 2 . . . . 33 GLY HA1 . 17796 1
159 . 1 1 33 33 GLY HA3 H 1 3.95 . . 2 . . . . 33 GLY HA2 . 17796 1
160 . 1 1 33 33 GLY CA C 13 45.09 . . 1 . . . . 33 GLY CA . 17796 1
161 . 1 1 33 33 GLY N N 15 113.20 . . 1 . . . . 33 GLY N . 17796 1
162 . 1 1 34 34 LEU H H 1 8.21 . . 1 . . . . 34 LEU H . 17796 1
163 . 1 1 34 34 LEU HA H 1 4.34 . . 1 . . . . 34 LEU HA . 17796 1
164 . 1 1 34 34 LEU CA C 13 55.17 . . 1 . . . . 34 LEU CA . 17796 1
165 . 1 1 34 34 LEU CB C 13 42.62 . . 1 . . . . 34 LEU CB . 17796 1
166 . 1 1 34 34 LEU N N 15 121.80 . . 1 . . . . 34 LEU N . 17796 1
167 . 1 1 35 35 MET H H 1 8.60 . . 1 . . . . 35 MET H . 17796 1
168 . 1 1 35 35 MET HA H 1 4.54 . . 1 . . . . 35 MET HA . 17796 1
169 . 1 1 35 35 MET CA C 13 55.54 . . 1 . . . . 35 MET CA . 17796 1
170 . 1 1 35 35 MET CB C 13 32.72 . . 1 . . . . 35 MET CB . 17796 1
171 . 1 1 35 35 MET N N 15 122.20 . . 1 . . . . 35 MET N . 17796 1
172 . 1 1 36 36 VAL H H 1 8.41 . . 1 . . . . 36 VAL H . 17796 1
173 . 1 1 36 36 VAL HA H 1 4.12 . . 1 . . . . 36 VAL HA . 17796 1
174 . 1 1 36 36 VAL CA C 13 62.51 . . 1 . . . . 36 VAL CA . 17796 1
175 . 1 1 36 36 VAL CB C 13 32.79 . . 1 . . . . 36 VAL CB . 17796 1
176 . 1 1 36 36 VAL N N 15 122.60 . . 1 . . . . 36 VAL N . 17796 1
177 . 1 1 37 37 GLY H H 1 8.77 . . 1 . . . . 37 GLY H . 17796 1
178 . 1 1 37 37 GLY HA2 H 1 4.00 . . 2 . . . . 37 GLY HA1 . 17796 1
179 . 1 1 37 37 GLY HA3 H 1 4.00 . . 2 . . . . 37 GLY HA2 . 17796 1
180 . 1 1 37 37 GLY CA C 13 45.16 . . 1 . . . . 37 GLY CA . 17796 1
181 . 1 1 37 37 GLY N N 15 113.30 . . 1 . . . . 37 GLY N . 17796 1
182 . 1 1 38 38 GLY H H 1 8.39 . . 1 . . . . 38 GLY H . 17796 1
183 . 1 1 38 38 GLY HA2 H 1 3.94 . . 2 . . . . 38 GLY HA1 . 17796 1
184 . 1 1 38 38 GLY HA3 H 1 4.01 . . 2 . . . . 38 GLY HA2 . 17796 1
185 . 1 1 38 38 GLY CA C 13 45.00 . . 1 . . . . 38 GLY CA . 17796 1
186 . 1 1 38 38 GLY N N 15 108.90 . . 1 . . . . 38 GLY N . 17796 1
187 . 1 1 39 39 VAL H H 1 8.23 . . 1 . . . . 39 VAL H . 17796 1
188 . 1 1 39 39 VAL HA H 1 4.18 . . 1 . . . . 39 VAL HA . 17796 1
189 . 1 1 39 39 VAL CA C 13 62.32 . . 1 . . . . 39 VAL CA . 17796 1
190 . 1 1 39 39 VAL CB C 13 33.03 . . 1 . . . . 39 VAL CB . 17796 1
191 . 1 1 39 39 VAL N N 15 120.00 . . 1 . . . . 39 VAL N . 17796 1
192 . 1 1 40 40 VAL H H 1 7.98 . . 1 . . . . 40 VAL H . 17796 1
193 . 1 1 40 40 VAL HA H 1 4.05 . . 1 . . . . 40 VAL HA . 17796 1
194 . 1 1 40 40 VAL CA C 13 63.79 . . 1 . . . . 40 VAL CA . 17796 1
195 . 1 1 40 40 VAL CB C 13 33.27 . . 1 . . . . 40 VAL CB . 17796 1
196 . 1 1 40 40 VAL N N 15 128.60 . . 1 . . . . 40 VAL N . 17796 1
stop_
save_