save_assigned_chem_shift_list_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list_1
_Assigned_chem_shift_list.Entry_ID 18861
_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 $L1
_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-15N HSQC' . . . 18861 1
2 '2D 1H-13C HSQC aliphatic' . . . 18861 1
3 '3D HNCO' . . . 18861 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 ACE C C 13 176.007 0.1 . 1 . . . A 1 ACE C . 18861 1
2 . 1 1 1 1 ACE CH3 C 13 24.206 0.1 . 1 . . . A 1 ACE CA . 18861 1
3 . 1 1 1 1 ACE H1 H 1 2.105 0.02 . 1 . . . A 1 ACE QA . 18861 1
4 . 1 1 1 1 ACE H2 H 1 2.105 0.02 . 1 . . . A 1 ACE QA . 18861 1
5 . 1 1 1 1 ACE H3 H 1 2.105 0.02 . 1 . . . A 1 ACE QA . 18861 1
6 . 1 1 2 2 PHE H H 1 8.444 0.02 . 1 . . . A 2 PHE H . 18861 1
7 . 1 1 2 2 PHE HA H 1 4.284 0.02 . 1 . . . A 2 PHE HA . 18861 1
8 . 1 1 2 2 PHE HB2 H 1 3.145 0.02 . 1 . . . A 2 PHE HB2 . 18861 1
9 . 1 1 2 2 PHE HB3 H 1 3.077 0.02 . 1 . . . A 2 PHE HB3 . 18861 1
10 . 1 1 2 2 PHE C C 13 174.710 0.1 . 1 . . . A 2 PHE C . 18861 1
11 . 1 1 2 2 PHE CA C 13 59.730 0.1 . 1 . . . A 2 PHE CA . 18861 1
12 . 1 1 2 2 PHE CB C 13 39.004 0.1 . 1 . . . A 2 PHE CB . 18861 1
13 . 1 1 2 2 PHE N N 15 126.457 0.1 . 1 . . . A 2 PHE N . 18861 1
14 . 1 1 3 3 AIB C C 13 178.508 0.1 . 1 . . . A 3 AIB C . 18861 1
15 . 1 1 3 3 AIB CA C 13 58.549 0.1 . 1 . . . A 3 AIB CA . 18861 1
16 . 1 1 3 3 AIB CB1 C 13 25.521 0.1 . 1 . . . A 3 AIB CB1 . 18861 1
17 . 1 1 3 3 AIB CB2 C 13 26.927 0.1 . 1 . . . A 3 AIB CB2 . 18861 1
18 . 1 1 3 3 AIB H H 1 8.417 0.02 . 1 . . . A 3 AIB H . 18861 1
19 . 1 1 3 3 AIB N N 15 130.821 0.1 . 1 . . . A 3 AIB N . 18861 1
20 . 1 1 3 3 AIB HB11 H 1 1.345 0.02 . 1 . . . A 3 AIB QB1 . 18861 1
21 . 1 1 3 3 AIB HB12 H 1 1.345 0.02 . 1 . . . A 3 AIB QB1 . 18861 1
22 . 1 1 3 3 AIB HB13 H 1 1.345 0.02 . 1 . . . A 3 AIB QB1 . 18861 1
23 . 1 1 3 3 AIB HB21 H 1 1.390 0.02 . 1 . . . A 3 AIB QB2 . 18861 1
24 . 1 1 3 3 AIB HB22 H 1 1.390 0.02 . 1 . . . A 3 AIB QB2 . 18861 1
25 . 1 1 3 3 AIB HB23 H 1 1.390 0.02 . 1 . . . A 3 AIB QB2 . 18861 1
26 . 1 1 4 4 AIB C C 13 179.166 0.1 . 1 . . . A 4 AIB C . 18861 1
27 . 1 1 4 4 AIB CA C 13 58.463 0.1 . 1 . . . A 4 AIB CA . 18861 1
28 . 1 1 4 4 AIB CB1 C 13 24.894 0.1 . 1 . . . A 4 AIB CB1 . 18861 1
29 . 1 1 4 4 AIB CB2 C 13 27.554 0.1 . 1 . . . A 4 AIB CB2 . 18861 1
30 . 1 1 4 4 AIB H H 1 7.672 0.02 . 1 . . . A 4 AIB H . 18861 1
31 . 1 1 4 4 AIB N N 15 126.759 0.1 . 1 . . . A 4 AIB N . 18861 1
32 . 1 1 4 4 AIB HB11 H 1 1.436 0.02 . 1 . . . A 4 AIB QB1 . 18861 1
33 . 1 1 4 4 AIB HB12 H 1 1.436 0.02 . 1 . . . A 4 AIB QB1 . 18861 1
34 . 1 1 4 4 AIB HB13 H 1 1.436 0.02 . 1 . . . A 4 AIB QB1 . 18861 1
35 . 1 1 4 4 AIB HB21 H 1 1.436 0.02 . 1 . . . A 4 AIB QB2 . 18861 1
36 . 1 1 4 4 AIB HB22 H 1 1.436 0.02 . 1 . . . A 4 AIB QB2 . 18861 1
37 . 1 1 4 4 AIB HB23 H 1 1.436 0.02 . 1 . . . A 4 AIB QB2 . 18861 1
38 . 1 1 5 5 AIB C C 13 178.556 0.1 . 1 . . . A 5 AIB C . 18861 1
39 . 1 1 5 5 AIB CA C 13 58.619 0.1 . 1 . . . A 5 AIB CA . 18861 1
40 . 1 1 5 5 AIB CB1 C 13 25.098 0.1 . 1 . . . A 5 AIB CB1 . 18861 1
41 . 1 1 5 5 AIB CB2 C 13 28.107 0.1 . 1 . . . A 5 AIB CB2 . 18861 1
42 . 1 1 5 5 AIB H H 1 7.935 0.02 . 1 . . . A 5 AIB H . 18861 1
43 . 1 1 5 5 AIB N N 15 127.651 0.1 . 1 . . . A 5 AIB N . 18861 1
44 . 1 1 5 5 AIB HB11 H 1 1.458 0.02 . 1 . . . A 5 AIB QB1 . 18861 1
45 . 1 1 5 5 AIB HB12 H 1 1.458 0.02 . 1 . . . A 5 AIB QB1 . 18861 1
46 . 1 1 5 5 AIB HB13 H 1 1.458 0.02 . 1 . . . A 5 AIB QB1 . 18861 1
47 . 1 1 5 5 AIB HB21 H 1 1.458 0.02 . 1 . . . A 5 AIB QB2 . 18861 1
48 . 1 1 5 5 AIB HB22 H 1 1.458 0.02 . 1 . . . A 5 AIB QB2 . 18861 1
49 . 1 1 5 5 AIB HB23 H 1 1.458 0.02 . 1 . . . A 5 AIB QB2 . 18861 1
50 . 1 1 6 6 DIV C C 13 180.157 0.1 . 1 . . . A 6 DIV C . 18861 1
51 . 1 1 6 6 DIV CA C 13 61.178 0.1 . 1 . . . A 6 DIV CA . 18861 1
52 . 1 1 6 6 DIV CB1 C 13 28.497 0.1 . 1 . . . A 6 DIV CB1 . 18861 1
53 . 1 1 6 6 DIV CB2 C 13 24.071 0.1 . 1 . . . A 6 DIV CB2 . 18861 1
54 . 1 1 6 6 DIV CG1 C 13 7.219 0.1 . 1 . . . A 6 DIV CG1 . 18861 1
55 . 1 1 6 6 DIV H H 1 7.830 0.02 . 1 . . . A 6 DIV H . 18861 1
56 . 1 1 6 6 DIV HB11 H 1 2.235 0.02 . 1 . . . A 6 DIV HB12 . 18861 1
57 . 1 1 6 6 DIV HB12 H 1 1.734 0.02 . 1 . . . A 6 DIV HB13 . 18861 1
58 . 1 1 6 6 DIV N N 15 120.786 0.1 . 1 . . . A 6 DIV N . 18861 1
59 . 1 1 6 6 DIV HB21 H 1 1.368 0.02 . 1 . . . A 6 DIV QB2 . 18861 1
60 . 1 1 6 6 DIV HB22 H 1 1.368 0.02 . 1 . . . A 6 DIV QB2 . 18861 1
61 . 1 1 6 6 DIV HB23 H 1 1.368 0.02 . 1 . . . A 6 DIV QB2 . 18861 1
62 . 1 1 6 6 DIV HG11 H 1 0.758 0.02 . 1 . . . A 6 DIV QG1 . 18861 1
63 . 1 1 6 6 DIV HG12 H 1 0.758 0.02 . 1 . . . A 6 DIV QG1 . 18861 1
64 . 1 1 6 6 DIV HG13 H 1 0.758 0.02 . 1 . . . A 6 DIV QG1 . 18861 1
65 . 1 1 7 7 GLY H H 1 8.023 0.02 . 1 . . . A 7 GLY H . 18861 1
66 . 1 1 7 7 GLY HA2 H 1 3.916 0.02 . 1 . . . A 7 GLY HA2 . 18861 1
67 . 1 1 7 7 GLY HA3 H 1 3.916 0.02 . 1 . . . A 7 GLY HA3 . 18861 1
68 . 1 1 7 7 GLY C C 13 175.244 0.1 . 1 . . . A 7 GLY C . 18861 1
69 . 1 1 7 7 GLY CA C 13 46.125 0.1 . 1 . . . A 7 GLY CA . 18861 1
70 . 1 1 7 7 GLY N N 15 102.056 0.1 . 1 . . . A 7 GLY N . 18861 1
71 . 1 1 8 8 LEU H H 1 7.939 0.02 . 1 . . . A 8 LEU H . 18861 1
72 . 1 1 8 8 LEU HA H 1 4.254 0.02 . 1 . . . A 8 LEU HA . 18861 1
73 . 1 1 8 8 LEU HB2 H 1 1.671 0.02 . 2 . . . A 8 LEU HB2 . 18861 1
74 . 1 1 8 8 LEU HB3 H 1 1.809 0.02 . 2 . . . A 8 LEU HB3 . 18861 1
75 . 1 1 8 8 LEU HG H 1 1.769 0.02 . 1 . . . A 8 LEU HG . 18861 1
76 . 1 1 8 8 LEU HD11 H 1 0.952 0.02 . 2 . . . A 8 LEU HD11 . 18861 1
77 . 1 1 8 8 LEU HD12 H 1 0.952 0.02 . 2 . . . A 8 LEU HD12 . 18861 1
78 . 1 1 8 8 LEU HD13 H 1 0.952 0.02 . 2 . . . A 8 LEU HD13 . 18861 1
79 . 1 1 8 8 LEU HD21 H 1 0.921 0.02 . 2 . . . A 8 LEU HD21 . 18861 1
80 . 1 1 8 8 LEU HD22 H 1 0.921 0.02 . 2 . . . A 8 LEU HD22 . 18861 1
81 . 1 1 8 8 LEU HD23 H 1 0.921 0.02 . 2 . . . A 8 LEU HD23 . 18861 1
82 . 1 1 8 8 LEU C C 13 176.481 0.1 . 1 . . . A 8 LEU C . 18861 1
83 . 1 1 8 8 LEU CA C 13 56.275 0.1 . 1 . . . A 8 LEU CA . 18861 1
84 . 1 1 8 8 LEU CB C 13 41.930 0.1 . 1 . . . A 8 LEU CB . 18861 1
85 . 1 1 8 8 LEU CG C 13 26.433 0.1 . 1 . . . A 8 LEU CG . 18861 1
86 . 1 1 8 8 LEU CD1 C 13 24.348 0.1 . 1 . . . A 8 LEU CD1 . 18861 1
87 . 1 1 8 8 LEU CD2 C 13 23.295 0.1 . 1 . . . A 8 LEU CD2 . 18861 1
88 . 1 1 8 8 LEU N N 15 120.995 0.1 . 1 . . . A 8 LEU N . 18861 1
89 . 1 1 9 9 AIB C C 13 178.713 0.1 . 1 . . . A 9 AIB C . 18861 1
90 . 1 1 9 9 AIB CA C 13 58.680 0.1 . 1 . . . A 9 AIB CA . 18861 1
91 . 1 1 9 9 AIB CB1 C 13 24.919 0.1 . 1 . . . A 9 AIB CB1 . 18861 1
92 . 1 1 9 9 AIB CB2 C 13 28.937 0.1 . 1 . . . A 9 AIB CB2 . 18861 1
93 . 1 1 9 9 AIB H H 1 7.464 0.02 . 1 . . . A 9 AIB H . 18861 1
94 . 1 1 9 9 AIB N N 15 124.512 0.1 . 1 . . . A 9 AIB N . 18861 1
95 . 1 1 9 9 AIB HB11 H 1 1.548 0.02 . 1 . . . A 9 AIB QB1 . 18861 1
96 . 1 1 9 9 AIB HB12 H 1 1.548 0.02 . 1 . . . A 9 AIB QB1 . 18861 1
97 . 1 1 9 9 AIB HB13 H 1 1.548 0.02 . 1 . . . A 9 AIB QB1 . 18861 1
98 . 1 1 9 9 AIB HB21 H 1 1.464 0.02 . 1 . . . A 9 AIB QB2 . 18861 1
99 . 1 1 9 9 AIB HB22 H 1 1.464 0.02 . 1 . . . A 9 AIB QB2 . 18861 1
100 . 1 1 9 9 AIB HB23 H 1 1.464 0.02 . 1 . . . A 9 AIB QB2 . 18861 1
101 . 1 1 10 10 AIB CA C 13 59.146 0.1 . 1 . . . A 10 AIB CA . 18861 1
102 . 1 1 10 10 AIB CB1 C 13 27.709 0.1 . 1 . . . A 10 AIB CB1 . 18861 1
103 . 1 1 10 10 AIB CB2 C 13 25.228 0.1 . 1 . . . A 10 AIB CB2 . 18861 1
104 . 1 1 10 10 AIB H H 1 7.731 0.02 . 1 . . . A 10 AIB H . 18861 1
105 . 1 1 10 10 AIB N N 15 127.758 0.1 . 1 . . . A 10 AIB N . 18861 1
106 . 1 1 10 10 AIB HB11 H 1 1.504 0.02 . 1 . . . A 10 AIB QB1 . 18861 1
107 . 1 1 10 10 AIB HB12 H 1 1.504 0.02 . 1 . . . A 10 AIB QB1 . 18861 1
108 . 1 1 10 10 AIB HB13 H 1 1.504 0.02 . 1 . . . A 10 AIB QB1 . 18861 1
109 . 1 1 10 10 AIB HB21 H 1 1.634 0.02 . 1 . . . A 10 AIB QB2 . 18861 1
110 . 1 1 10 10 AIB HB22 H 1 1.634 0.02 . 1 . . . A 10 AIB QB2 . 18861 1
111 . 1 1 10 10 AIB HB23 H 1 1.634 0.02 . 1 . . . A 10 AIB QB2 . 18861 1
112 . 1 1 11 11 HYP C C 13 176.757 0.1 . 1 . . . A 11 HYP C . 18861 1
113 . 1 1 11 11 HYP CA C 13 63.311 0.1 . 1 . . . A 11 HYP CA . 18861 1
114 . 1 1 11 11 HYP CB C 13 38.383 0.1 . 1 . . . A 11 HYP CB . 18861 1
115 . 1 1 11 11 HYP CD C 13 58.568 0.1 . 1 . . . A 11 HYP CD . 18861 1
116 . 1 1 11 11 HYP HA H 1 4.687 0.02 . 1 . . . A 11 HYP HA . 18861 1
117 . 1 1 11 11 HYP HB2 H 1 2.049 0.02 . 1 . . . A 11 HYP HB2 . 18861 1
118 . 1 1 11 11 HYP HB3 H 1 2.472 0.02 . 1 . . . A 11 HYP HB3 . 18861 1
119 . 1 1 11 11 HYP HD22 H 1 3.730 0.02 . 1 . . . A 11 HYP HD2 . 18861 1
120 . 1 1 11 11 HYP HD23 H 1 4.018 0.02 . 1 . . . A 11 HYP HD3 . 18861 1
121 . 1 1 11 11 HYP HG H 1 4.643 0.02 . 1 . . . A 11 HYP HG . 18861 1
122 . 1 1 12 12 GLN H H 1 8.197 0.02 . 1 . . . A 12 GLN H . 18861 1
123 . 1 1 12 12 GLN HA H 1 4.466 0.02 . 1 . . . A 12 GLN HA . 18861 1
124 . 1 1 12 12 GLN HB2 H 1 2.041 0.02 . 1 . . . A 12 GLN HB2 . 18861 1
125 . 1 1 12 12 GLN HB3 H 1 2.419 0.02 . 1 . . . A 12 GLN HB3 . 18861 1
126 . 1 1 12 12 GLN HG2 H 1 2.373 0.02 . 1 . . . A 12 GLN HG2 . 18861 1
127 . 1 1 12 12 GLN HG3 H 1 2.373 0.02 . 1 . . . A 12 GLN HG3 . 18861 1
128 . 1 1 12 12 GLN HE21 H 1 7.413 0.02 . 1 . . . A 12 GLN HE21 . 18861 1
129 . 1 1 12 12 GLN HE22 H 1 6.672 0.02 . 1 . . . A 12 GLN HE22 . 18861 1
130 . 1 1 12 12 GLN C C 13 174.245 0.1 . 1 . . . A 12 GLN C . 18861 1
131 . 1 1 12 12 GLN CA C 13 54.762 0.1 . 1 . . . A 12 GLN CA . 18861 1
132 . 1 1 12 12 GLN CB C 13 28.845 0.1 . 1 . . . A 12 GLN CB . 18861 1
133 . 1 1 12 12 GLN CG C 13 33.265 0.1 . 1 . . . A 12 GLN CG . 18861 1
134 . 1 1 12 12 GLN N N 15 112.272 0.1 . 1 . . . A 12 GLN N . 18861 1
135 . 1 1 12 12 GLN NE2 N 15 110.061 0.1 . 1 . . . A 12 GLN NE2 . 18861 1
136 . 1 1 13 13 DIV CA C 13 61.204 0.1 . 1 . . . A 13 DIV CA . 18861 1
137 . 1 1 13 13 DIV CB1 C 13 30.221 0.1 . 1 . . . A 13 DIV CB1 . 18861 1
138 . 1 1 13 13 DIV CB2 C 13 22.523 0.1 . 1 . . . A 13 DIV CB2 . 18861 1
139 . 1 1 13 13 DIV CG1 C 13 7.203 0.1 . 1 . . . A 13 DIV CG1 . 18861 1
140 . 1 1 13 13 DIV H H 1 7.414 0.02 . 1 . . . A 13 DIV H . 18861 1
141 . 1 1 13 13 DIV HB11 H 1 2.288 0.02 . 1 . . . A 13 DIV HB12 . 18861 1
142 . 1 1 13 13 DIV HB12 H 1 1.922 0.02 . 1 . . . A 13 DIV HB13 . 18861 1
143 . 1 1 13 13 DIV N N 15 125.447 0.1 . 1 . . . A 13 DIV N . 18861 1
144 . 1 1 13 13 DIV HB21 H 1 1.515 0.02 . 1 . . . A 13 DIV QB2 . 18861 1
145 . 1 1 13 13 DIV HB22 H 1 1.515 0.02 . 1 . . . A 13 DIV QB2 . 18861 1
146 . 1 1 13 13 DIV HB23 H 1 1.515 0.02 . 1 . . . A 13 DIV QB2 . 18861 1
147 . 1 1 13 13 DIV HG11 H 1 0.844 0.02 . 1 . . . A 13 DIV QG1 . 18861 1
148 . 1 1 13 13 DIV HG12 H 1 0.844 0.02 . 1 . . . A 13 DIV QG1 . 18861 1
149 . 1 1 13 13 DIV HG13 H 1 0.844 0.02 . 1 . . . A 13 DIV QG1 . 18861 1
150 . 1 1 14 14 HYP C C 13 177.173 0.1 . 1 . . . A 14 HYP C . 18861 1
151 . 1 1 14 14 HYP CA C 13 63.635 0.1 . 1 . . . A 14 HYP CA . 18861 1
152 . 1 1 14 14 HYP CB C 13 38.826 0.1 . 1 . . . A 14 HYP CB . 18861 1
153 . 1 1 14 14 HYP CD C 13 58.705 0.1 . 1 . . . A 14 HYP CD . 18861 1
154 . 1 1 14 14 HYP HA H 1 4.727 0.02 . 1 . . . A 14 HYP HA . 18861 1
155 . 1 1 14 14 HYP HB2 H 1 1.953 0.02 . 1 . . . A 14 HYP HB2 . 18861 1
156 . 1 1 14 14 HYP HB3 H 1 2.425 0.02 . 1 . . . A 14 HYP HB3 . 18861 1
157 . 1 1 14 14 HYP HD22 H 1 3.544 0.02 . 1 . . . A 14 HYP HD2 . 18861 1
158 . 1 1 14 14 HYP HD23 H 1 3.850 0.02 . 1 . . . A 14 HYP HD3 . 18861 1
159 . 1 1 14 14 HYP HG H 1 4.534 0.02 . 1 . . . A 14 HYP HG . 18861 1
160 . 1 1 15 15 AIB CA C 13 58.636 0.1 . 1 . . . A 15 AIB CA . 18861 1
161 . 1 1 15 15 AIB CB1 C 13 26.874 0.1 . 1 . . . A 15 AIB CB1 . 18861 1
162 . 1 1 15 15 AIB CB2 C 13 25.103 0.1 . 1 . . . A 15 AIB CB2 . 18861 1
163 . 1 1 15 15 AIB H H 1 7.969 0.02 . 1 . . . A 15 AIB H . 18861 1
164 . 1 1 15 15 AIB N N 15 129.139 0.1 . 1 . . . A 15 AIB N . 18861 1
165 . 1 1 15 15 AIB HB11 H 1 1.473 0.02 . 1 . . . A 15 AIB QB1 . 18861 1
166 . 1 1 15 15 AIB HB12 H 1 1.473 0.02 . 1 . . . A 15 AIB QB1 . 18861 1
167 . 1 1 15 15 AIB HB13 H 1 1.473 0.02 . 1 . . . A 15 AIB QB1 . 18861 1
168 . 1 1 15 15 AIB HB21 H 1 1.546 0.02 . 1 . . . A 15 AIB QB2 . 18861 1
169 . 1 1 15 15 AIB HB22 H 1 1.546 0.02 . 1 . . . A 15 AIB QB2 . 18861 1
170 . 1 1 15 15 AIB HB23 H 1 1.546 0.02 . 1 . . . A 15 AIB QB2 . 18861 1
171 . 1 1 16 16 PRO HA H 1 4.339 0.02 . 1 . . . A 16 PRO HA . 18861 1
172 . 1 1 16 16 PRO HB2 H 1 0.892 0.02 . 1 . . . A 16 PRO HB2 . 18861 1
173 . 1 1 16 16 PRO HB3 H 1 1.919 0.02 . 1 . . . A 16 PRO HB3 . 18861 1
174 . 1 1 16 16 PRO HG2 H 1 1.425 0.02 . 1 . . . A 16 PRO HG2 . 18861 1
175 . 1 1 16 16 PRO HG3 H 1 1.578 0.02 . 1 . . . A 16 PRO HG3 . 18861 1
176 . 1 1 16 16 PRO HD2 H 1 3.808 0.02 . 1 . . . A 16 PRO HD2 . 18861 1
177 . 1 1 16 16 PRO HD3 H 1 3.725 0.02 . 1 . . . A 16 PRO HD3 . 18861 1
178 . 1 1 16 16 PRO C C 13 175.130 0.1 . 1 . . . A 16 PRO C . 18861 1
179 . 1 1 16 16 PRO CA C 13 64.330 0.1 . 1 . . . A 16 PRO CA . 18861 1
180 . 1 1 16 16 PRO CB C 13 30.613 0.1 . 1 . . . A 16 PRO CB . 18861 1
181 . 1 1 16 16 PRO CG C 13 26.994 0.1 . 1 . . . A 16 PRO CG . 18861 1
182 . 1 1 16 16 PRO CD C 13 50.384 0.1 . 1 . . . A 16 PRO CD . 18861 1
183 . 1 1 17 17 PHL C C 13 66.318 0.1 . 1 . . . A 17 PHL C . 18861 1
184 . 1 1 17 17 PHL CA C 13 55.354 0.1 . 1 . . . A 17 PHL CA . 18861 1
185 . 1 1 17 17 PHL CB C 13 38.905 0.1 . 1 . . . A 17 PHL CB . 18861 1
186 . 1 1 17 17 PHL H H 1 7.147 0.02 . 1 . . . A 17 PHL H . 18861 1
187 . 1 1 17 17 PHL H2 H 1 3.711 0.02 . 1 . . . A 17 PHL H2 . 18861 1
188 . 1 1 17 17 PHL HA H 1 4.185 0.02 . 1 . . . A 17 PHL HA . 18861 1
189 . 1 1 17 17 PHL HB2 H 1 2.635 0.02 . 1 . . . A 17 PHL HB2 . 18861 1
190 . 1 1 17 17 PHL HB3 H 1 3.105 0.02 . 1 . . . A 17 PHL HB3 . 18861 1
191 . 1 1 17 17 PHL N N 15 118.335 0.1 . 1 . . . A 17 PHL N . 18861 1
stop_
save_