Content for NMR-STAR saveframe, "assigned_chem_shift_list"
save_assigned_chem_shift_list
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chem_shift_list
_Assigned_chem_shift_list.Entry_ID 15299
_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
_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 DQF-COSY' . . . 15299 1
2 '2D 1H-1H TOCSY' . . . 15299 1
3 '2D 1H-1H NOESY' . . . 15299 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $XEASY . . 15299 1
2 $ARIA . . 15299 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 2 2 VAL H H 1 8.423 0.001 . 1 . . . . 2 V HN . 15299 1
2 . 1 1 2 2 VAL HA H 1 4.460 0.001 . 1 . . . . 2 V HA . 15299 1
3 . 1 1 2 2 VAL HB H 1 2.011 0.001 . 1 . . . . 2 V HB . 15299 1
4 . 1 1 2 2 VAL HG11 H 1 0.868 0.001 . 1 . . . . 2 V QQG . 15299 1
5 . 1 1 2 2 VAL HG12 H 1 0.868 0.001 . 1 . . . . 2 V QQG . 15299 1
6 . 1 1 2 2 VAL HG13 H 1 0.868 0.001 . 1 . . . . 2 V QQG . 15299 1
7 . 1 1 2 2 VAL HG21 H 1 0.868 0.001 . 1 . . . . 2 V QQG . 15299 1
8 . 1 1 2 2 VAL HG22 H 1 0.868 0.001 . 1 . . . . 2 V QQG . 15299 1
9 . 1 1 2 2 VAL HG23 H 1 0.868 0.001 . 1 . . . . 2 V QQG . 15299 1
10 . 1 1 3 3 PRO HA H 1 4.448 0.004 . 1 . . . . 3 P HA . 15299 1
11 . 1 1 3 3 PRO HB2 H 1 2.204 0.001 . 1 . . . . 3 P HB2 . 15299 1
12 . 1 1 3 3 PRO HB3 H 1 1.838 0.001 . 1 . . . . 3 P HB3 . 15299 1
13 . 1 1 3 3 PRO HG2 H 1 2.025 0.001 . 1 . . . . 3 P HG2 . 15299 1
14 . 1 1 3 3 PRO HG3 H 1 1.937 0.001 . 1 . . . . 3 P HG3 . 15299 1
15 . 1 1 3 3 PRO HD2 H 1 3.828 0.001 . 1 . . . . 3 P HD2 . 15299 1
16 . 1 1 3 3 PRO HD3 H 1 3.661 0.004 . 1 . . . . 3 P HD3 . 15299 1
17 . 1 1 4 4 ILE H H 1 8.062 0.001 . 1 . . . . 4 I HN . 15299 1
18 . 1 1 4 4 ILE HA H 1 4.179 0.001 . 1 . . . . 4 I HA . 15299 1
19 . 1 1 4 4 ILE HB H 1 1.761 0.002 . 1 . . . . 4 I HB . 15299 1
20 . 1 1 4 4 ILE HG21 H 1 0.829 0.001 . 1 . . . . 4 I QG2 . 15299 1
21 . 1 1 4 4 ILE HG22 H 1 0.829 0.001 . 1 . . . . 4 I QG2 . 15299 1
22 . 1 1 4 4 ILE HG23 H 1 0.829 0.001 . 1 . . . . 4 I QG2 . 15299 1
23 . 1 1 4 4 ILE HG12 H 1 1.097 0.001 . 1 . . . . 4 I QG1 . 15299 1
24 . 1 1 4 4 ILE HG13 H 1 1.097 0.001 . 1 . . . . 4 I QG1 . 15299 1
25 . 1 1 4 4 ILE HD11 H 1 0.756 0.003 . 1 . . . . 4 I QD1 . 15299 1
26 . 1 1 4 4 ILE HD12 H 1 0.756 0.003 . 1 . . . . 4 I QD1 . 15299 1
27 . 1 1 4 4 ILE HD13 H 1 0.756 0.003 . 1 . . . . 4 I QD1 . 15299 1
28 . 1 1 5 5 ASN H H 1 8.479 0.001 . 1 . . . . 5 N HN . 15299 1
29 . 1 1 5 5 ASN HA H 1 4.745 0.001 . 1 . . . . 5 N HA . 15299 1
30 . 1 1 5 5 ASN HB2 H 1 2.615 0.001 . 1 . . . . 5 N HB2 . 15299 1
31 . 1 1 5 5 ASN HB3 H 1 2.729 0.001 . 1 . . . . 5 N HB3 . 15299 1
32 . 1 1 6 6 VAL H H 1 8.350 0.001 . 1 . . . . 6 V HN . 15299 1
33 . 1 1 6 6 VAL HA H 1 4.094 0.001 . 1 . . . . 6 V HA . 15299 1
34 . 1 1 6 6 VAL HB H 1 1.694 0.001 . 1 . . . . 6 V HB . 15299 1
35 . 1 1 6 6 VAL HG11 H 1 0.835 0.002 . 1 . . . . 6 V QG1 . 15299 1
36 . 1 1 6 6 VAL HG12 H 1 0.835 0.002 . 1 . . . . 6 V QG1 . 15299 1
37 . 1 1 6 6 VAL HG13 H 1 0.835 0.002 . 1 . . . . 6 V QG1 . 15299 1
38 . 1 1 6 6 VAL HG21 H 1 0.905 0.001 . 1 . . . . 6 V QG2 . 15299 1
39 . 1 1 6 6 VAL HG22 H 1 0.905 0.001 . 1 . . . . 6 V QG2 . 15299 1
40 . 1 1 6 6 VAL HG23 H 1 0.905 0.001 . 1 . . . . 6 V QG2 . 15299 1
41 . 1 1 7 7 SER H H 1 8.375 0.001 . 1 . . . . 7 S HN . 15299 1
42 . 1 1 7 7 SER HA H 1 4.885 0.001 . 1 . . . . 7 S HA . 15299 1
43 . 1 1 7 7 SER HB2 H 1 3.851 0.001 . 1 . . . . 7 S QB . 15299 1
44 . 1 1 7 7 SER HB3 H 1 3.851 0.001 . 1 . . . . 7 S QB . 15299 1
45 . 1 1 8 8 CYS H H 1 7.827 0.001 . 1 . . . . 8 C HN . 15299 1
46 . 1 1 8 8 CYS HA H 1 4.843 0.001 . 1 . . . . 8 C HA . 15299 1
47 . 1 1 8 8 CYS HB2 H 1 2.918 0.001 . 1 . . . . 8 C HB2 . 15299 1
48 . 1 1 8 8 CYS HB3 H 1 3.258 0.002 . 1 . . . . 8 C HB3 . 15299 1
49 . 1 1 9 9 THR H H 1 9.165 0.003 . 1 . . . . 9 T HN . 15299 1
50 . 1 1 9 9 THR HA H 1 4.373 0.001 . 1 . . . . 9 T HA . 15299 1
51 . 1 1 9 9 THR HB H 1 4.184 0.001 . 1 . . . . 9 T HB . 15299 1
52 . 1 1 9 9 THR HG21 H 1 1.139 0.002 . 1 . . . . 9 T QG2 . 15299 1
53 . 1 1 9 9 THR HG22 H 1 1.139 0.002 . 1 . . . . 9 T QG2 . 15299 1
54 . 1 1 9 9 THR HG23 H 1 1.139 0.002 . 1 . . . . 9 T QG2 . 15299 1
55 . 1 1 10 10 GLY H H 1 7.827 0.001 . 1 . . . . 10 G HN . 15299 1
56 . 1 1 10 10 GLY HA2 H 1 3.909 0.002 . 1 . . . . 10 G HA1 . 15299 1
57 . 1 1 10 10 GLY HA3 H 1 4.396 0.001 . 1 . . . . 10 G HA2 . 15299 1
58 . 1 1 11 11 SER H H 1 9.007 0.001 . 1 . . . . 11 S HN . 15299 1
59 . 1 1 11 11 SER HA H 1 3.645 0.001 . 1 . . . . 11 S HA . 15299 1
60 . 1 1 11 11 SER HB2 H 1 3.867 0.001 . 1 . . . . 11 S QB . 15299 1
61 . 1 1 11 11 SER HB3 H 1 3.867 0.001 . 1 . . . . 11 S QB . 15299 1
62 . 1 1 12 12 LYS H H 1 8.408 0.001 . 1 . . . . 12 K HN . 15299 1
63 . 1 1 12 12 LYS HA H 1 2.900 0.001 . 1 . . . . 12 K HA . 15299 1
64 . 1 1 13 13 ASP H H 1 7.299 0.001 . 1 . . . . 13 D HN . 15299 1
65 . 1 1 13 13 ASP HA H 1 4.290 0.002 . 1 . . . . 13 D HA . 15299 1
66 . 1 1 13 13 ASP HB2 H 1 2.762 0.001 . 1 . . . . 13 D HB2 . 15299 1
67 . 1 1 13 13 ASP HB3 H 1 2.851 0.001 . 1 . . . . 13 D HB3 . 15299 1
68 . 1 1 14 14 CYS H H 1 7.741 0.001 . 1 . . . . 14 C HN . 15299 1
69 . 1 1 14 14 CYS HA H 1 4.545 0.002 . 1 . . . . 14 C HA . 15299 1
70 . 1 1 14 14 CYS HB2 H 1 2.643 0.001 . 1 . . . . 14 C HB2 . 15299 1
71 . 1 1 14 14 CYS HB3 H 1 2.970 0.003 . 1 . . . . 14 C HB3 . 15299 1
72 . 1 1 15 15 TYR H H 1 6.902 0.001 . 1 . . . . 15 Y HN . 15299 1
73 . 1 1 15 15 TYR HA H 1 4.907 0.001 . 1 . . . . 15 Y HA . 15299 1
74 . 1 1 15 15 TYR HB2 H 1 3.014 0.001 . 1 . . . . 15 Y HB2 . 15299 1
75 . 1 1 15 15 TYR HB3 H 1 3.170 0.003 . 1 . . . . 15 Y HB3 . 15299 1
76 . 1 1 16 16 ALA H H 1 9.048 0.001 . 1 . . . . 16 A HN . 15299 1
77 . 1 1 16 16 ALA HA H 1 4.357 0.006 . 1 . . . . 16 A HA . 15299 1
78 . 1 1 16 16 ALA HB1 H 1 1.454 0.001 . 1 . . . . 16 A QB . 15299 1
79 . 1 1 16 16 ALA HB2 H 1 1.454 0.001 . 1 . . . . 16 A QB . 15299 1
80 . 1 1 16 16 ALA HB3 H 1 1.454 0.001 . 1 . . . . 16 A QB . 15299 1
81 . 1 1 17 17 PRO HA H 1 4.327 0.002 . 1 . . . . 17 P HA . 15299 1
82 . 1 1 17 17 PRO HB2 H 1 2.318 0.001 . 1 . . . . 17 P HB2 . 15299 1
83 . 1 1 17 17 PRO HB3 H 1 2.240 0.001 . 1 . . . . 17 P HB3 . 15299 1
84 . 1 1 17 17 PRO HG2 H 1 2.108 0.001 . 1 . . . . 17 P HG2 . 15299 1
85 . 1 1 17 17 PRO HG3 H 1 1.776 0.001 . 1 . . . . 17 P HG3 . 15299 1
86 . 1 1 17 17 PRO HD2 H 1 3.636 0.001 . 1 . . . . 17 P QD . 15299 1
87 . 1 1 17 17 PRO HD3 H 1 3.636 0.001 . 1 . . . . 17 P QD . 15299 1
88 . 1 1 18 18 CYS H H 1 8.232 0.001 . 1 . . . . 18 C HN . 15299 1
89 . 1 1 18 18 CYS HA H 1 4.656 0.001 . 1 . . . . 18 C HA . 15299 1
90 . 1 1 18 18 CYS HB2 H 1 3.004 0.001 . 1 . . . . 18 C HB2 . 15299 1
91 . 1 1 18 18 CYS HB3 H 1 3.433 0.001 . 1 . . . . 18 C HB3 . 15299 1
92 . 1 1 19 19 ARG H H 1 8.765 0.001 . 1 . . . . 19 R HN . 15299 1
93 . 1 1 19 19 ARG HA H 1 3.547 0.001 . 1 . . . . 19 R HA . 15299 1
94 . 1 1 19 19 ARG HB2 H 1 1.534 0.001 . 1 . . . . 19 R HB2 . 15299 1
95 . 1 1 19 19 ARG HB3 H 1 1.876 0.001 . 1 . . . . 19 R HB3 . 15299 1
96 . 1 1 19 19 ARG HG2 H 1 1.191 0.004 . 1 . . . . 19 R HG2 . 15299 1
97 . 1 1 19 19 ARG HG3 H 1 1.352 0.001 . 1 . . . . 19 R HG3 . 15299 1
98 . 1 1 19 19 ARG HD2 H 1 3.094 0.001 . 1 . . . . 19 R QD . 15299 1
99 . 1 1 19 19 ARG HD3 H 1 3.094 0.001 . 1 . . . . 19 R QD . 15299 1
100 . 1 1 19 19 ARG HE H 1 7.285 0.001 . 1 . . . . 19 R HE . 15299 1
101 . 1 1 20 20 LYS H H 1 7.950 0.001 . 1 . . . . 20 K HN . 15299 1
102 . 1 1 20 20 LYS HA H 1 3.963 0.001 . 1 . . . . 20 K HA . 15299 1
103 . 1 1 20 20 LYS HB2 H 1 1.861 0.001 . 1 . . . . 20 K HB2 . 15299 1
104 . 1 1 20 20 LYS HB3 H 1 1.953 0.001 . 1 . . . . 20 K HB3 . 15299 1
105 . 1 1 20 20 LYS HG2 H 1 1.474 0.001 . 1 . . . . 20 K HG2 . 15299 1
106 . 1 1 20 20 LYS HG3 H 1 1.420 0.001 . 1 . . . . 20 K HG3 . 15299 1
107 . 1 1 20 20 LYS HD2 H 1 1.640 0.001 . 1 . . . . 20 K QD . 15299 1
108 . 1 1 20 20 LYS HD3 H 1 1.640 0.001 . 1 . . . . 20 K QD . 15299 1
109 . 1 1 20 20 LYS HE2 H 1 2.932 0.001 . 1 . . . . 20 K QE . 15299 1
110 . 1 1 20 20 LYS HE3 H 1 2.932 0.001 . 1 . . . . 20 K QE . 15299 1
111 . 1 1 20 20 LYS HZ1 H 1 7.497 0.001 . 1 . . . . 20 K QZ . 15299 1
112 . 1 1 20 20 LYS HZ2 H 1 7.497 0.001 . 1 . . . . 20 K QZ . 15299 1
113 . 1 1 20 20 LYS HZ3 H 1 7.497 0.001 . 1 . . . . 20 K QZ . 15299 1
114 . 1 1 21 21 GLN H H 1 7.825 0.001 . 1 . . . . 21 Q HN . 15299 1
115 . 1 1 21 21 GLN HA H 1 4.153 0.001 . 1 . . . . 21 Q HA . 15299 1
116 . 1 1 21 21 GLN HB2 H 1 2.174 0.001 . 1 . . . . 21 Q QB . 15299 1
117 . 1 1 21 21 GLN HB3 H 1 2.174 0.001 . 1 . . . . 21 Q QB . 15299 1
118 . 1 1 21 21 GLN HG2 H 1 2.294 0.001 . 1 . . . . 21 Q HG2 . 15299 1
119 . 1 1 21 21 GLN HG3 H 1 2.470 0.002 . 1 . . . . 21 Q HG3 . 15299 1
120 . 1 1 22 22 THR H H 1 8.336 0.001 . 1 . . . . 22 T HN . 15299 1
121 . 1 1 22 22 THR HA H 1 4.764 0.001 . 1 . . . . 22 T HA . 15299 1
122 . 1 1 22 22 THR HB H 1 4.436 0.001 . 1 . . . . 22 T HB . 15299 1
123 . 1 1 22 22 THR HG21 H 1 1.190 0.004 . 1 . . . . 22 T QG2 . 15299 1
124 . 1 1 22 22 THR HG22 H 1 1.190 0.004 . 1 . . . . 22 T QG2 . 15299 1
125 . 1 1 22 22 THR HG23 H 1 1.190 0.004 . 1 . . . . 22 T QG2 . 15299 1
126 . 1 1 23 23 GLY H H 1 8.165 0.001 . 1 . . . . 23 G HN . 15299 1
127 . 1 1 23 23 GLY HA2 H 1 3.727 0.001 . 1 . . . . 23 G HA1 . 15299 1
128 . 1 1 23 23 GLY HA3 H 1 3.543 0.001 . 1 . . . . 23 G HA2 . 15299 1
129 . 1 1 24 24 CYS H H 1 8.251 0.001 . 1 . . . . 24 C HN . 15299 1
130 . 1 1 24 24 CYS HA H 1 5.025 0.001 . 1 . . . . 24 C HA . 15299 1
131 . 1 1 24 24 CYS HB2 H 1 2.117 0.004 . 1 . . . . 24 C HB2 . 15299 1
132 . 1 1 24 24 CYS HB3 H 1 3.657 0.001 . 1 . . . . 24 C HB3 . 15299 1
133 . 1 1 25 25 PRO HA H 1 3.402 1.323 . 1 . . . . 25 P HA . 15299 1
134 . 1 1 25 25 PRO HB2 H 1 2.051 0.919 . 1 . . . . 25 P QB . 15299 1
135 . 1 1 25 25 PRO HB3 H 1 2.051 0.919 . 1 . . . . 25 P QB . 15299 1
136 . 1 1 25 25 PRO HG2 H 1 2.517 1.134 . 1 . . . . 25 P QG . 15299 1
137 . 1 1 25 25 PRO HG3 H 1 2.517 1.134 . 1 . . . . 25 P QG . 15299 1
138 . 1 1 25 25 PRO HD2 H 1 3.725 0.001 . 1 . . . . 25 P HD2 . 15299 1
139 . 1 1 25 25 PRO HD3 H 1 3.303 0.001 . 1 . . . . 25 P HD3 . 15299 1
140 . 1 1 26 26 ASN H H 1 7.126 0.001 . 1 . . . . 26 N HN . 15299 1
141 . 1 1 26 26 ASN HA H 1 4.282 0.001 . 1 . . . . 26 N HA . 15299 1
142 . 1 1 26 26 ASN HB2 H 1 2.710 0.001 . 1 . . . . 26 N HB2 . 15299 1
143 . 1 1 26 26 ASN HB3 H 1 2.784 0.001 . 1 . . . . 26 N HB3 . 15299 1
144 . 1 1 26 26 ASN HD21 H 1 7.624 0.001 . 1 . . . . 26 N HD21 . 15299 1
145 . 1 1 26 26 ASN HD22 H 1 6.889 0.001 . 1 . . . . 26 N HD22 . 15299 1
146 . 1 1 27 27 ALA H H 1 8.147 0.001 . 1 . . . . 27 A HN . 15299 1
147 . 1 1 27 27 ALA HA H 1 5.331 0.001 . 1 . . . . 27 A HA . 15299 1
148 . 1 1 27 27 ALA HB1 H 1 1.413 0.005 . 1 . . . . 27 A QB . 15299 1
149 . 1 1 27 27 ALA HB2 H 1 1.413 0.005 . 1 . . . . 27 A QB . 15299 1
150 . 1 1 27 27 ALA HB3 H 1 1.413 0.005 . 1 . . . . 27 A QB . 15299 1
151 . 1 1 28 28 LYS H H 1 8.344 0.001 . 1 . . . . 28 K HN . 15299 1
152 . 1 1 28 28 LYS HA H 1 4.619 0.001 . 1 . . . . 28 K HA . 15299 1
153 . 1 1 29 29 CYS H H 1 8.331 0.001 . 1 . . . . 29 C HN . 15299 1
154 . 1 1 29 29 CYS HA H 1 4.813 0.001 . 1 . . . . 29 C HA . 15299 1
155 . 1 1 29 29 CYS HB2 H 1 2.342 0.150 . 1 . . . . 29 C HB2 . 15299 1
156 . 1 1 29 29 CYS HB3 H 1 2.737 0.006 . 1 . . . . 29 C HB3 . 15299 1
157 . 1 1 30 30 ILE H H 1 8.728 0.001 . 1 . . . . 30 I HN . 15299 1
158 . 1 1 30 30 ILE HA H 1 4.255 0.001 . 1 . . . . 30 I HA . 15299 1
159 . 1 1 30 30 ILE HB H 1 1.661 0.001 . 1 . . . . 30 I HB . 15299 1
160 . 1 1 30 30 ILE HG21 H 1 0.818 0.003 . 1 . . . . 30 I QG2 . 15299 1
161 . 1 1 30 30 ILE HG22 H 1 0.818 0.003 . 1 . . . . 30 I QG2 . 15299 1
162 . 1 1 30 30 ILE HG23 H 1 0.818 0.003 . 1 . . . . 30 I QG2 . 15299 1
163 . 1 1 30 30 ILE HG12 H 1 0.943 0.001 . 1 . . . . 30 I QG1 . 15299 1
164 . 1 1 30 30 ILE HG13 H 1 0.943 0.001 . 1 . . . . 30 I QG1 . 15299 1
165 . 1 1 30 30 ILE HD11 H 1 1.357 0.001 . 1 . . . . 30 I QD1 . 15299 1
166 . 1 1 30 30 ILE HD12 H 1 1.357 0.001 . 1 . . . . 30 I QD1 . 15299 1
167 . 1 1 30 30 ILE HD13 H 1 1.357 0.001 . 1 . . . . 30 I QD1 . 15299 1
168 . 1 1 31 31 ASN H H 1 9.385 0.001 . 1 . . . . 31 N HN . 15299 1
169 . 1 1 31 31 ASN HA H 1 4.277 0.001 . 1 . . . . 31 N HA . 15299 1
170 . 1 1 31 31 ASN HB2 H 1 2.689 0.001 . 1 . . . . 31 N HB2 . 15299 1
171 . 1 1 31 31 ASN HB3 H 1 2.999 0.001 . 1 . . . . 31 N HB3 . 15299 1
172 . 1 1 32 32 LYS H H 1 8.403 0.001 . 1 . . . . 32 K HN . 15299 1
173 . 1 1 32 32 LYS HA H 1 3.891 0.001 . 1 . . . . 32 K HA . 15299 1
174 . 1 1 32 32 LYS HB2 H 1 2.104 0.001 . 1 . . . . 32 K HB2 . 15299 1
175 . 1 1 32 32 LYS HB3 H 1 2.207 0.003 . 1 . . . . 32 K HB3 . 15299 1
176 . 1 1 32 32 LYS HG2 H 1 1.265 0.002 . 1 . . . . 32 K HG2 . 15299 1
177 . 1 1 32 32 LYS HG3 H 1 1.354 0.002 . 1 . . . . 32 K HG3 . 15299 1
178 . 1 1 32 32 LYS HD2 H 1 1.606 0.001 . 1 . . . . 32 K HD2 . 15299 1
179 . 1 1 32 32 LYS HD3 H 1 1.679 0.001 . 1 . . . . 32 K HD3 . 15299 1
180 . 1 1 32 32 LYS HE2 H 1 2.900 0.001 . 1 . . . . 32 K QE . 15299 1
181 . 1 1 32 32 LYS HE3 H 1 2.900 0.001 . 1 . . . . 32 K QE . 15299 1
182 . 1 1 32 32 LYS HZ1 H 1 7.440 0.001 . 1 . . . . 32 K QZ . 15299 1
183 . 1 1 32 32 LYS HZ2 H 1 7.440 0.001 . 1 . . . . 32 K QZ . 15299 1
184 . 1 1 32 32 LYS HZ3 H 1 7.440 0.001 . 1 . . . . 32 K QZ . 15299 1
185 . 1 1 33 33 SER H H 1 7.750 0.002 . 1 . . . . 33 S HN . 15299 1
186 . 1 1 33 33 SER HA H 1 5.190 0.002 . 1 . . . . 33 S HA . 15299 1
187 . 1 1 33 33 SER HB2 H 1 3.633 0.002 . 1 . . . . 33 S HB2 . 15299 1
188 . 1 1 33 33 SER HB3 H 1 3.727 0.001 . 1 . . . . 33 S HB3 . 15299 1
189 . 1 1 34 34 CYS H H 1 8.703 0.002 . 1 . . . . 34 C HN . 15299 1
190 . 1 1 34 34 CYS HA H 1 4.653 0.001 . 1 . . . . 34 C HA . 15299 1
191 . 1 1 34 34 CYS HB2 H 1 2.468 0.002 . 1 . . . . 34 C HB2 . 15299 1
192 . 1 1 34 34 CYS HB3 H 1 2.766 0.003 . 1 . . . . 34 C HB3 . 15299 1
193 . 1 1 35 35 LYS H H 1 9.045 0.001 . 1 . . . . 35 K HN . 15299 1
194 . 1 1 35 35 LYS HA H 1 4.491 0.001 . 1 . . . . 35 K HA . 15299 1
195 . 1 1 35 35 LYS HB2 H 1 1.706 0.001 . 1 . . . . 35 K HB2 . 15299 1
196 . 1 1 35 35 LYS HB3 H 1 1.619 0.001 . 1 . . . . 35 K HB3 . 15299 1
197 . 1 1 35 35 LYS HG2 H 1 1.051 0.001 . 1 . . . . 35 K HG2 . 15299 1
198 . 1 1 35 35 LYS HG3 H 1 0.940 0.001 . 1 . . . . 35 K HG3 . 15299 1
199 . 1 1 35 35 LYS HD2 H 1 1.495 0.001 . 1 . . . . 35 K QD . 15299 1
200 . 1 1 35 35 LYS HD3 H 1 1.495 0.001 . 1 . . . . 35 K QD . 15299 1
201 . 1 1 35 35 LYS HE2 H 1 2.800 0.001 . 1 . . . . 35 K HE2 . 15299 1
202 . 1 1 35 35 LYS HE3 H 1 2.703 0.001 . 1 . . . . 35 K HE3 . 15299 1
203 . 1 1 36 36 CYS H H 1 8.695 0.001 . 1 . . . . 36 C HN . 15299 1
204 . 1 1 36 36 CYS HA H 1 4.972 0.001 . 1 . . . . 36 C HA . 15299 1
205 . 1 1 36 36 CYS HB2 H 1 2.543 0.001 . 1 . . . . 36 C HB2 . 15299 1
206 . 1 1 36 36 CYS HB3 H 1 3.641 0.003 . 1 . . . . 36 C HB3 . 15299 1
207 . 1 1 37 37 TYR H H 1 8.197 0.001 . 1 . . . . 37 Y HN . 15299 1
208 . 1 1 37 37 TYR HA H 1 4.438 0.001 . 1 . . . . 37 Y HA . 15299 1
209 . 1 1 37 37 TYR HB2 H 1 2.488 0.246 . 1 . . . . 37 Y HB2 . 15299 1
210 . 1 1 37 37 TYR HB3 H 1 3.185 0.001 . 1 . . . . 37 Y HB3 . 15299 1
211 . 1 1 38 38 GLY H H 1 9.434 0.001 . 1 . . . . 38 G HN . 15299 1
212 . 1 1 38 38 GLY HA2 H 1 3.809 0.001 . 1 . . . . 38 G HA1 . 15299 1
213 . 1 1 38 38 GLY HA3 H 1 4.221 0.001 . 1 . . . . 38 G HA2 . 15299 1
214 . 1 1 39 39 CYS H H 1 8.762 0.001 . 1 . . . . 39 C HN . 15299 1
215 . 1 1 39 39 CYS HA H 1 4.481 0.001 . 1 . . . . 39 C HA . 15299 1
216 . 1 1 39 39 CYS HB2 H 1 2.802 0.001 . 1 . . . . 39 C HB2 . 15299 1
217 . 1 1 39 39 CYS HB3 H 1 3.160 0.001 . 1 . . . . 39 C HB3 . 15299 1
stop_
save_