Content for NMR-STAR saveframe, "chemical_shift_set_1"
save_chemical_shift_set_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode chemical_shift_set_1
_Assigned_chem_shift_list.Entry_ID 6596
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_cond_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chemical_shift_reference
_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 NOESY' 1 $sample_1 . 6596 1
2 '2D TOCSY' 1 $sample_1 . 6596 1
3 DQF-COSY 1 $sample_1 . 6596 1
4 E-COSY 1 $sample_1 . 6596 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 CYS H H 1 8.943 0.004 . 1 . . . . . . . . . 6596 1
2 . 1 1 1 1 CYS HA H 1 4.576 0.001 . 1 . . . . . . . . . 6596 1
3 . 1 1 1 1 CYS HB2 H 1 3.058 0.008 . 1 . . . . . . . . . 6596 1
4 . 1 1 1 1 CYS HB3 H 1 3.120 0.008 . 1 . . . . . . . . . 6596 1
5 . 1 1 2 2 GLY H H 1 8.488 0.002 . 1 . . . . . . . . . 6596 1
6 . 1 1 2 2 GLY HA2 H 1 3.786 0.004 . 1 . . . . . . . . . 6596 1
7 . 1 1 2 2 GLY HA3 H 1 3.454 0.003 . 1 . . . . . . . . . 6596 1
8 . 1 1 3 3 GLU H H 1 6.740 0.002 . 1 . . . . . . . . . 6596 1
9 . 1 1 3 3 GLU HA H 1 4.461 0.001 . 1 . . . . . . . . . 6596 1
10 . 1 1 3 3 GLU HB2 H 1 1.374 0.005 . 1 . . . . . . . . . 6596 1
11 . 1 1 3 3 GLU HB3 H 1 1.680 0.003 . 1 . . . . . . . . . 6596 1
12 . 1 1 3 3 GLU HG2 H 1 2.484 0.005 . 1 . . . . . . . . . 6596 1
13 . 1 1 3 3 GLU HG3 H 1 2.484 0.005 . 1 . . . . . . . . . 6596 1
14 . 1 1 4 4 SER H H 1 8.786 0.003 . 1 . . . . . . . . . 6596 1
15 . 1 1 4 4 SER HA H 1 4.527 0.006 . 1 . . . . . . . . . 6596 1
16 . 1 1 4 4 SER HB2 H 1 3.943 0.001 . 1 . . . . . . . . . 6596 1
17 . 1 1 4 4 SER HB3 H 1 3.842 0.007 . 1 . . . . . . . . . 6596 1
18 . 1 1 5 5 CYS H H 1 8.236 0.002 . 1 . . . . . . . . . 6596 1
19 . 1 1 5 5 CYS HA H 1 5.150 0.002 . 1 . . . . . . . . . 6596 1
20 . 1 1 5 5 CYS HB2 H 1 3.225 0.009 . 1 . . . . . . . . . 6596 1
21 . 1 1 5 5 CYS HB3 H 1 3.308 0.011 . 1 . . . . . . . . . 6596 1
22 . 1 1 6 6 ALA H H 1 7.928 0.002 . 1 . . . . . . . . . 6596 1
23 . 1 1 6 6 ALA HA H 1 3.961 0.002 . 1 . . . . . . . . . 6596 1
24 . 1 1 6 6 ALA HB1 H 1 1.428 0.002 . 1 . . . . . . . . . 6596 1
25 . 1 1 6 6 ALA HB2 H 1 1.428 0.002 . 1 . . . . . . . . . 6596 1
26 . 1 1 6 6 ALA HB3 H 1 1.428 0.002 . 1 . . . . . . . . . 6596 1
27 . 1 1 7 7 MET H H 1 8.357 0.001 . 1 . . . . . . . . . 6596 1
28 . 1 1 7 7 MET HA H 1 4.400 0.002 . 1 . . . . . . . . . 6596 1
29 . 1 1 7 7 MET HB2 H 1 2.235 0.007 . 1 . . . . . . . . . 6596 1
30 . 1 1 7 7 MET HB3 H 1 2.160 0.002 . 1 . . . . . . . . . 6596 1
31 . 1 1 7 7 MET HG2 H 1 2.817 0.004 . 1 . . . . . . . . . 6596 1
32 . 1 1 7 7 MET HG3 H 1 2.817 0.004 . 1 . . . . . . . . . 6596 1
33 . 1 1 8 8 ILE H H 1 7.773 0.003 . 1 . . . . . . . . . 6596 1
34 . 1 1 8 8 ILE HA H 1 4.291 0.002 . 1 . . . . . . . . . 6596 1
35 . 1 1 8 8 ILE HB H 1 1.820 0.003 . 1 . . . . . . . . . 6596 1
36 . 1 1 8 8 ILE HG12 H 1 1.050 0.003 . 1 . . . . . . . . . 6596 1
37 . 1 1 8 8 ILE HG13 H 1 1.417 0.002 . 1 . . . . . . . . . 6596 1
38 . 1 1 8 8 ILE HG21 H 1 0.864 0.002 . 1 . . . . . . . . . 6596 1
39 . 1 1 8 8 ILE HG22 H 1 0.864 0.002 . 1 . . . . . . . . . 6596 1
40 . 1 1 8 8 ILE HG23 H 1 0.864 0.002 . 1 . . . . . . . . . 6596 1
41 . 1 1 8 8 ILE HD11 H 1 0.788 0.005 . 1 . . . . . . . . . 6596 1
42 . 1 1 8 8 ILE HD12 H 1 0.788 0.005 . 1 . . . . . . . . . 6596 1
43 . 1 1 8 8 ILE HD13 H 1 0.788 0.005 . 1 . . . . . . . . . 6596 1
44 . 1 1 9 9 SER H H 1 8.235 0.003 . 1 . . . . . . . . . 6596 1
45 . 1 1 9 9 SER HA H 1 4.640 0.002 . 1 . . . . . . . . . 6596 1
46 . 1 1 9 9 SER HB2 H 1 3.814 0.006 . 1 . . . . . . . . . 6596 1
47 . 1 1 9 9 SER HB3 H 1 3.865 0.004 . 1 . . . . . . . . . 6596 1
48 . 1 1 10 10 PHE H H 1 7.829 0.003 . 1 . . . . . . . . . 6596 1
49 . 1 1 10 10 PHE HA H 1 4.403 0.005 . 1 . . . . . . . . . 6596 1
50 . 1 1 10 10 PHE HB2 H 1 2.447 0.008 . 1 . . . . . . . . . 6596 1
51 . 1 1 10 10 PHE HB3 H 1 2.857 0.005 . 1 . . . . . . . . . 6596 1
52 . 1 1 10 10 PHE HD1 H 1 6.802 0.003 . 1 . . . . . . . . . 6596 1
53 . 1 1 10 10 PHE HD2 H 1 6.802 0.003 . 1 . . . . . . . . . 6596 1
54 . 1 1 10 10 PHE HE1 H 1 6.610 0.001 . 1 . . . . . . . . . 6596 1
55 . 1 1 10 10 PHE HE2 H 1 6.610 0.001 . 1 . . . . . . . . . 6596 1
56 . 1 1 10 10 PHE HZ H 1 6.951 0.001 . 1 . . . . . . . . . 6596 1
57 . 1 1 11 11 CYS H H 1 7.482 0.004 . 1 . . . . . . . . . 6596 1
58 . 1 1 11 11 CYS HA H 1 4.489 0.003 . 1 . . . . . . . . . 6596 1
59 . 1 1 11 11 CYS HB2 H 1 2.337 0.010 . 1 . . . . . . . . . 6596 1
60 . 1 1 11 11 CYS HB3 H 1 2.735 0.003 . 1 . . . . . . . . . 6596 1
61 . 1 1 12 12 PHE H H 1 10.931 0.005 . 1 . . . . . . . . . 6596 1
62 . 1 1 12 12 PHE HA H 1 4.182 0.005 . 1 . . . . . . . . . 6596 1
63 . 1 1 12 12 PHE HB2 H 1 3.102 0.003 . 1 . . . . . . . . . 6596 1
64 . 1 1 12 12 PHE HB3 H 1 3.102 0.003 . 1 . . . . . . . . . 6596 1
65 . 1 1 12 12 PHE HD1 H 1 7.442 0.003 . 1 . . . . . . . . . 6596 1
66 . 1 1 12 12 PHE HD2 H 1 7.442 0.003 . 1 . . . . . . . . . 6596 1
67 . 1 1 12 12 PHE HE1 H 1 7.367 0.014 . 1 . . . . . . . . . 6596 1
68 . 1 1 12 12 PHE HE2 H 1 7.367 0.014 . 1 . . . . . . . . . 6596 1
69 . 1 1 12 12 PHE HZ H 1 7.265 0.003 . 1 . . . . . . . . . 6596 1
70 . 1 1 13 13 THR H H 1 9.174 0.001 . 1 . . . . . . . . . 6596 1
71 . 1 1 13 13 THR HA H 1 3.953 0.001 . 1 . . . . . . . . . 6596 1
72 . 1 1 13 13 THR HB H 1 4.536 0.000 . 1 . . . . . . . . . 6596 1
73 . 1 1 13 13 THR HG1 H 1 4.796 0.001 . 1 . . . . . . . . . 6596 1
74 . 1 1 13 13 THR HG21 H 1 1.271 0.004 . 1 . . . . . . . . . 6596 1
75 . 1 1 13 13 THR HG22 H 1 1.271 0.004 . 1 . . . . . . . . . 6596 1
76 . 1 1 13 13 THR HG23 H 1 1.271 0.004 . 1 . . . . . . . . . 6596 1
77 . 1 1 14 14 GLU H H 1 8.023 0.001 . 1 . . . . . . . . . 6596 1
78 . 1 1 14 14 GLU HA H 1 4.686 0.002 . 1 . . . . . . . . . 6596 1
79 . 1 1 14 14 GLU HB2 H 1 2.066 0.002 . 1 . . . . . . . . . 6596 1
80 . 1 1 14 14 GLU HB3 H 1 2.066 0.002 . 1 . . . . . . . . . 6596 1
81 . 1 1 14 14 GLU HG2 H 1 2.295 0.002 . 1 . . . . . . . . . 6596 1
82 . 1 1 14 14 GLU HG3 H 1 2.572 0.003 . 1 . . . . . . . . . 6596 1
83 . 1 1 15 15 VAL H H 1 7.220 0.002 . 1 . . . . . . . . . 6596 1
84 . 1 1 15 15 VAL HA H 1 3.971 0.004 . 1 . . . . . . . . . 6596 1
85 . 1 1 15 15 VAL HB H 1 2.188 0.002 . 1 . . . . . . . . . 6596 1
86 . 1 1 15 15 VAL HG11 H 1 1.018 0.003 . 1 . . . . . . . . . 6596 1
87 . 1 1 15 15 VAL HG12 H 1 1.018 0.003 . 1 . . . . . . . . . 6596 1
88 . 1 1 15 15 VAL HG13 H 1 1.018 0.003 . 1 . . . . . . . . . 6596 1
89 . 1 1 15 15 VAL HG21 H 1 1.018 0.003 . 1 . . . . . . . . . 6596 1
90 . 1 1 15 15 VAL HG22 H 1 1.018 0.003 . 1 . . . . . . . . . 6596 1
91 . 1 1 15 15 VAL HG23 H 1 1.018 0.003 . 1 . . . . . . . . . 6596 1
92 . 1 1 16 16 ILE H H 1 7.185 0.003 . 1 . . . . . . . . . 6596 1
93 . 1 1 16 16 ILE HA H 1 4.518 0.002 . 1 . . . . . . . . . 6596 1
94 . 1 1 16 16 ILE HB H 1 2.187 0.003 . 1 . . . . . . . . . 6596 1
95 . 1 1 16 16 ILE HG12 H 1 1.561 0.006 . 1 . . . . . . . . . 6596 1
96 . 1 1 16 16 ILE HG13 H 1 1.561 0.006 . 1 . . . . . . . . . 6596 1
97 . 1 1 16 16 ILE HG21 H 1 0.974 0.005 . 1 . . . . . . . . . 6596 1
98 . 1 1 16 16 ILE HG22 H 1 0.974 0.005 . 1 . . . . . . . . . 6596 1
99 . 1 1 16 16 ILE HG23 H 1 0.974 0.005 . 1 . . . . . . . . . 6596 1
100 . 1 1 16 16 ILE HD11 H 1 0.855 0.003 . 1 . . . . . . . . . 6596 1
101 . 1 1 16 16 ILE HD12 H 1 0.855 0.003 . 1 . . . . . . . . . 6596 1
102 . 1 1 16 16 ILE HD13 H 1 0.855 0.003 . 1 . . . . . . . . . 6596 1
103 . 1 1 17 17 GLY H H 1 7.629 0.002 . 1 . . . . . . . . . 6596 1
104 . 1 1 17 17 GLY HA2 H 1 4.280 0.019 . 1 . . . . . . . . . 6596 1
105 . 1 1 17 17 GLY HA3 H 1 3.566 0.004 . 1 . . . . . . . . . 6596 1
106 . 1 1 18 18 CYS H H 1 7.498 0.003 . 1 . . . . . . . . . 6596 1
107 . 1 1 18 18 CYS HA H 1 4.691 0.002 . 1 . . . . . . . . . 6596 1
108 . 1 1 18 18 CYS HB2 H 1 3.278 0.002 . 1 . . . . . . . . . 6596 1
109 . 1 1 18 18 CYS HB3 H 1 2.189 0.002 . 1 . . . . . . . . . 6596 1
110 . 1 1 19 19 SER H H 1 9.004 0.002 . 1 . . . . . . . . . 6596 1
111 . 1 1 19 19 SER HA H 1 4.485 0.001 . 1 . . . . . . . . . 6596 1
112 . 1 1 19 19 SER HB2 H 1 3.699 0.007 . 1 . . . . . . . . . 6596 1
113 . 1 1 19 19 SER HB3 H 1 3.699 0.007 . 1 . . . . . . . . . 6596 1
114 . 1 1 20 20 CYS H H 1 8.608 0.005 . 1 . . . . . . . . . 6596 1
115 . 1 1 20 20 CYS HA H 1 4.415 0.006 . 1 . . . . . . . . . 6596 1
116 . 1 1 20 20 CYS HB2 H 1 2.710 0.004 . 1 . . . . . . . . . 6596 1
117 . 1 1 20 20 CYS HB3 H 1 2.880 0.003 . 1 . . . . . . . . . 6596 1
118 . 1 1 21 21 LYS H H 1 9.533 0.002 . 1 . . . . . . . . . 6596 1
119 . 1 1 21 21 LYS HA H 1 4.480 0.003 . 1 . . . . . . . . . 6596 1
120 . 1 1 21 21 LYS HB2 H 1 1.702 0.018 . 1 . . . . . . . . . 6596 1
121 . 1 1 21 21 LYS HB3 H 1 1.766 0.008 . 1 . . . . . . . . . 6596 1
122 . 1 1 21 21 LYS HG2 H 1 1.220 0.003 . 1 . . . . . . . . . 6596 1
123 . 1 1 21 21 LYS HG3 H 1 1.341 0.011 . 1 . . . . . . . . . 6596 1
124 . 1 1 21 21 LYS HD2 H 1 1.455 0.007 . 1 . . . . . . . . . 6596 1
125 . 1 1 21 21 LYS HD3 H 1 1.455 0.007 . 1 . . . . . . . . . 6596 1
126 . 1 1 21 21 LYS HE2 H 1 2.751 0.000 . 1 . . . . . . . . . 6596 1
127 . 1 1 21 21 LYS HE3 H 1 2.751 0.000 . 1 . . . . . . . . . 6596 1
128 . 1 1 22 22 ASN H H 1 9.043 0.002 . 1 . . . . . . . . . 6596 1
129 . 1 1 22 22 ASN HA H 1 4.204 0.004 . 1 . . . . . . . . . 6596 1
130 . 1 1 22 22 ASN HB2 H 1 2.885 0.107 . 1 . . . . . . . . . 6596 1
131 . 1 1 22 22 ASN HB3 H 1 2.671 0.005 . 1 . . . . . . . . . 6596 1
132 . 1 1 22 22 ASN HD21 H 1 6.731 0.000 . 1 . . . . . . . . . 6596 1
133 . 1 1 22 22 ASN HD22 H 1 7.344 0.002 . 1 . . . . . . . . . 6596 1
134 . 1 1 23 23 LYS H H 1 8.118 0.003 . 1 . . . . . . . . . 6596 1
135 . 1 1 23 23 LYS HA H 1 3.392 0.001 . 1 . . . . . . . . . 6596 1
136 . 1 1 23 23 LYS HB2 H 1 1.760 0.006 . 1 . . . . . . . . . 6596 1
137 . 1 1 23 23 LYS HB3 H 1 2.252 0.003 . 1 . . . . . . . . . 6596 1
138 . 1 1 23 23 LYS HG2 H 1 1.255 0.009 . 1 . . . . . . . . . 6596 1
139 . 1 1 23 23 LYS HG3 H 1 1.255 0.009 . 1 . . . . . . . . . 6596 1
140 . 1 1 23 23 LYS HD2 H 1 1.604 0.005 . 1 . . . . . . . . . 6596 1
141 . 1 1 23 23 LYS HD3 H 1 1.604 0.005 . 1 . . . . . . . . . 6596 1
142 . 1 1 23 23 LYS HE2 H 1 2.941 0.004 . 1 . . . . . . . . . 6596 1
143 . 1 1 23 23 LYS HE3 H 1 2.941 0.004 . 1 . . . . . . . . . 6596 1
144 . 1 1 24 24 VAL H H 1 7.935 0.003 . 1 . . . . . . . . . 6596 1
145 . 1 1 24 24 VAL HA H 1 4.164 0.006 . 1 . . . . . . . . . 6596 1
146 . 1 1 24 24 VAL HB H 1 1.884 0.002 . 1 . . . . . . . . . 6596 1
147 . 1 1 24 24 VAL HG11 H 1 0.865 0.003 . 1 . . . . . . . . . 6596 1
148 . 1 1 24 24 VAL HG12 H 1 0.865 0.003 . 1 . . . . . . . . . 6596 1
149 . 1 1 24 24 VAL HG13 H 1 0.865 0.003 . 1 . . . . . . . . . 6596 1
150 . 1 1 24 24 VAL HG21 H 1 0.412 0.001 . 1 . . . . . . . . . 6596 1
151 . 1 1 24 24 VAL HG22 H 1 0.412 0.001 . 1 . . . . . . . . . 6596 1
152 . 1 1 24 24 VAL HG23 H 1 0.412 0.001 . 1 . . . . . . . . . 6596 1
153 . 1 1 25 25 CYS H H 1 7.890 0.001 . 1 . . . . . . . . . 6596 1
154 . 1 1 25 25 CYS HA H 1 4.710 0.009 . 1 . . . . . . . . . 6596 1
155 . 1 1 25 25 CYS HB2 H 1 2.441 0.005 . 1 . . . . . . . . . 6596 1
156 . 1 1 25 25 CYS HB3 H 1 2.913 0.007 . 1 . . . . . . . . . 6596 1
157 . 1 1 26 26 TYR H H 1 9.264 0.002 . 1 . . . . . . . . . 6596 1
158 . 1 1 26 26 TYR HA H 1 5.071 0.001 . 1 . . . . . . . . . 6596 1
159 . 1 1 26 26 TYR HB2 H 1 2.609 0.005 . 1 . . . . . . . . . 6596 1
160 . 1 1 26 26 TYR HB3 H 1 2.842 0.004 . 1 . . . . . . . . . 6596 1
161 . 1 1 26 26 TYR HD1 H 1 6.842 0.001 . 1 . . . . . . . . . 6596 1
162 . 1 1 26 26 TYR HD2 H 1 6.842 0.001 . 1 . . . . . . . . . 6596 1
163 . 1 1 26 26 TYR HE1 H 1 6.777 0.003 . 1 . . . . . . . . . 6596 1
164 . 1 1 26 26 TYR HE2 H 1 6.777 0.003 . 1 . . . . . . . . . 6596 1
165 . 1 1 27 27 LEU H H 1 9.113 0.002 . 1 . . . . . . . . . 6596 1
166 . 1 1 27 27 LEU HA H 1 4.505 0.004 . 1 . . . . . . . . . 6596 1
167 . 1 1 27 27 LEU HB2 H 1 1.735 0.002 . 1 . . . . . . . . . 6596 1
168 . 1 1 27 27 LEU HB3 H 1 1.473 0.009 . 1 . . . . . . . . . 6596 1
169 . 1 1 27 27 LEU HG H 1 1.412 0.000 . 1 . . . . . . . . . 6596 1
170 . 1 1 27 27 LEU HD11 H 1 0.818 0.003 . 1 . . . . . . . . . 6596 1
171 . 1 1 27 27 LEU HD12 H 1 0.818 0.003 . 1 . . . . . . . . . 6596 1
172 . 1 1 27 27 LEU HD13 H 1 0.818 0.003 . 1 . . . . . . . . . 6596 1
173 . 1 1 27 27 LEU HD21 H 1 0.818 0.003 . 1 . . . . . . . . . 6596 1
174 . 1 1 27 27 LEU HD22 H 1 0.818 0.003 . 1 . . . . . . . . . 6596 1
175 . 1 1 27 27 LEU HD23 H 1 0.818 0.003 . 1 . . . . . . . . . 6596 1
176 . 1 1 28 28 ASN H H 1 9.251 0.006 . 1 . . . . . . . . . 6596 1
177 . 1 1 28 28 ASN HA H 1 4.105 0.006 . 1 . . . . . . . . . 6596 1
178 . 1 1 28 28 ASN HB2 H 1 2.969 0.012 . 1 . . . . . . . . . 6596 1
179 . 1 1 28 28 ASN HB3 H 1 2.905 0.015 . 1 . . . . . . . . . 6596 1
180 . 1 1 28 28 ASN HD21 H 1 6.864 0.002 . 1 . . . . . . . . . 6596 1
181 . 1 1 28 28 ASN HD22 H 1 7.439 0.005 . 1 . . . . . . . . . 6596 1
182 . 1 1 29 29 SER H H 1 8.141 0.003 . 1 . . . . . . . . . 6596 1
183 . 1 1 29 29 SER HA H 1 4.056 0.001 . 1 . . . . . . . . . 6596 1
184 . 1 1 29 29 SER HB2 H 1 3.994 0.004 . 1 . . . . . . . . . 6596 1
185 . 1 1 29 29 SER HB3 H 1 3.822 0.003 . 1 . . . . . . . . . 6596 1
186 . 1 1 30 30 ILE H H 1 8.191 0.003 . 1 . . . . . . . . . 6596 1
187 . 1 1 30 30 ILE HA H 1 4.243 0.007 . 1 . . . . . . . . . 6596 1
188 . 1 1 30 30 ILE HB H 1 2.052 0.002 . 1 . . . . . . . . . 6596 1
189 . 1 1 30 30 ILE HG12 H 1 1.174 0.004 . 1 . . . . . . . . . 6596 1
190 . 1 1 30 30 ILE HG13 H 1 1.544 0.003 . 1 . . . . . . . . . 6596 1
191 . 1 1 30 30 ILE HG21 H 1 0.907 0.002 . 1 . . . . . . . . . 6596 1
192 . 1 1 30 30 ILE HG22 H 1 0.907 0.002 . 1 . . . . . . . . . 6596 1
193 . 1 1 30 30 ILE HG23 H 1 0.907 0.002 . 1 . . . . . . . . . 6596 1
194 . 1 1 30 30 ILE HD11 H 1 0.814 0.002 . 1 . . . . . . . . . 6596 1
195 . 1 1 30 30 ILE HD12 H 1 0.814 0.002 . 1 . . . . . . . . . 6596 1
196 . 1 1 30 30 ILE HD13 H 1 0.814 0.002 . 1 . . . . . . . . . 6596 1
197 . 1 1 31 31 SER H H 1 8.619 0.004 . 1 . . . . . . . . . 6596 1
198 . 1 1 31 31 SER HA H 1 3.683 0.006 . 1 . . . . . . . . . 6596 1
199 . 1 1 31 31 SER HB2 H 1 3.630 0.012 . 1 . . . . . . . . . 6596 1
200 . 1 1 31 31 SER HB3 H 1 3.630 0.012 . 1 . . . . . . . . . 6596 1
stop_
save_