Content for NMR-STAR saveframe, "assigned_chem_shift_list_1"
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 18203
_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 '2D 1H-1H TOCSY' . . . 18203 1
3 '2D 1H-1H NOESY' . . . 18203 1
4 '2D 1H-15N HSQC' . . . 18203 1
5 '2D 1H-13C HSQC' . . . 18203 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 VAL HA H 1 3.691 0.020 . 1 . . . A 1 VAL HA . 18203 1
2 . 1 1 1 1 VAL HB H 1 2.106 0.020 . 1 . . . A 1 VAL HB . 18203 1
3 . 1 1 1 1 VAL HG11 H 1 0.959 0.020 . 1 . . . A 1 VAL HG11 . 18203 1
4 . 1 1 1 1 VAL HG12 H 1 0.959 0.020 . 1 . . . A 1 VAL HG12 . 18203 1
5 . 1 1 1 1 VAL HG13 H 1 0.959 0.020 . 1 . . . A 1 VAL HG13 . 18203 1
6 . 1 1 1 1 VAL HG21 H 1 0.959 0.020 . 1 . . . A 1 VAL HG21 . 18203 1
7 . 1 1 1 1 VAL HG22 H 1 0.959 0.020 . 1 . . . A 1 VAL HG22 . 18203 1
8 . 1 1 1 1 VAL HG23 H 1 0.959 0.020 . 1 . . . A 1 VAL HG23 . 18203 1
9 . 1 1 1 1 VAL CA C 13 61.685 0.400 . 1 . . . A 1 VAL CA . 18203 1
10 . 1 1 1 1 VAL CB C 13 32.626 0.400 . 1 . . . A 1 VAL CB . 18203 1
11 . 1 1 1 1 VAL CG1 C 13 20.266 0.400 . 2 . . . A 1 VAL CG1 . 18203 1
12 . 1 1 1 1 VAL CG2 C 13 19.879 0.400 . 2 . . . A 1 VAL CG2 . 18203 1
13 . 1 1 2 2 GLY H H 1 8.729 0.020 . 1 . . . A 2 GLY H . 18203 1
14 . 1 1 2 2 GLY HA2 H 1 3.856 0.020 . 2 . . . A 2 GLY HA2 . 18203 1
15 . 1 1 2 2 GLY HA3 H 1 4.023 0.020 . 2 . . . A 2 GLY HA3 . 18203 1
16 . 1 1 2 2 GLY CA C 13 45.400 0.400 . 1 . . . A 2 GLY CA . 18203 1
17 . 1 1 2 2 GLY N N 15 113.101 0.400 . 1 . . . A 2 GLY N . 18203 1
18 . 1 1 3 3 GLU H H 1 8.866 0.020 . 1 . . . A 3 GLU H . 18203 1
19 . 1 1 3 3 GLU HA H 1 4.115 0.020 . 1 . . . A 3 GLU HA . 18203 1
20 . 1 1 3 3 GLU HB2 H 1 1.992 0.020 . 1 . . . A 3 GLU HB2 . 18203 1
21 . 1 1 3 3 GLU HB3 H 1 1.992 0.020 . 1 . . . A 3 GLU HB3 . 18203 1
22 . 1 1 3 3 GLU HG2 H 1 2.345 0.020 . 2 . . . A 3 GLU HG2 . 18203 1
23 . 1 1 3 3 GLU HG3 H 1 2.231 0.020 . 2 . . . A 3 GLU HG3 . 18203 1
24 . 1 1 3 3 GLU CA C 13 58.528 0.400 . 1 . . . A 3 GLU CA . 18203 1
25 . 1 1 3 3 GLU CB C 13 29.582 0.400 . 1 . . . A 3 GLU CB . 18203 1
26 . 1 1 3 3 GLU CG C 13 36.558 0.400 . 1 . . . A 3 GLU CG . 18203 1
27 . 1 1 3 3 GLU N N 15 121.656 0.400 . 1 . . . A 3 GLU N . 18203 1
28 . 1 1 4 4 ARG H H 1 8.778 0.020 . 1 . . . A 4 ARG H . 18203 1
29 . 1 1 4 4 ARG HA H 1 4.345 0.020 . 1 . . . A 4 ARG HA . 18203 1
30 . 1 1 4 4 ARG HB2 H 1 1.925 0.020 . 2 . . . A 4 ARG HB2 . 18203 1
31 . 1 1 4 4 ARG HB3 H 1 1.855 0.020 . 2 . . . A 4 ARG HB3 . 18203 1
32 . 1 1 4 4 ARG HG2 H 1 1.679 0.020 . 2 . . . A 4 ARG HG2 . 18203 1
33 . 1 1 4 4 ARG HG3 H 1 1.631 0.020 . 2 . . . A 4 ARG HG3 . 18203 1
34 . 1 1 4 4 ARG HD2 H 1 3.128 0.020 . 1 . . . A 4 ARG HD2 . 18203 1
35 . 1 1 4 4 ARG HD3 H 1 3.128 0.020 . 1 . . . A 4 ARG HD3 . 18203 1
36 . 1 1 4 4 ARG HE H 1 7.177 0.020 . 1 . . . A 4 ARG HE . 18203 1
37 . 1 1 4 4 ARG CA C 13 56.846 0.400 . 1 . . . A 4 ARG CA . 18203 1
38 . 1 1 4 4 ARG CB C 13 30.275 0.400 . 1 . . . A 4 ARG CB . 18203 1
39 . 1 1 4 4 ARG CG C 13 27.062 0.400 . 1 . . . A 4 ARG CG . 18203 1
40 . 1 1 4 4 ARG CD C 13 43.493 0.400 . 1 . . . A 4 ARG CD . 18203 1
41 . 1 1 4 4 ARG N N 15 121.188 0.400 . 1 . . . A 4 ARG N . 18203 1
42 . 1 1 4 4 ARG NE N 15 84.391 0.400 . 1 . . . A 4 ARG NE . 18203 1
43 . 1 1 5 5 CYS H H 1 8.483 0.020 . 1 . . . A 5 CYS H . 18203 1
44 . 1 1 5 5 CYS HA H 1 4.793 0.020 . 1 . . . A 5 CYS HA . 18203 1
45 . 1 1 5 5 CYS HB2 H 1 3.226 0.020 . 2 . . . A 5 CYS HB2 . 18203 1
46 . 1 1 5 5 CYS HB3 H 1 3.129 0.020 . 2 . . . A 5 CYS HB3 . 18203 1
47 . 1 1 5 5 CYS CA C 13 56.003 0.400 . 1 . . . A 5 CYS CA . 18203 1
48 . 1 1 5 5 CYS CB C 13 39.191 0.400 . 1 . . . A 5 CYS CB . 18203 1
49 . 1 1 5 5 CYS N N 15 118.492 0.400 . 1 . . . A 5 CYS N . 18203 1
50 . 1 1 6 6 CYS H H 1 8.506 0.020 . 1 . . . A 6 CYS H . 18203 1
51 . 1 1 6 6 CYS HA H 1 4.506 0.020 . 1 . . . A 6 CYS HA . 18203 1
52 . 1 1 6 6 CYS HB2 H 1 3.534 0.020 . 2 . . . A 6 CYS HB2 . 18203 1
53 . 1 1 6 6 CYS HB3 H 1 3.147 0.020 . 2 . . . A 6 CYS HB3 . 18203 1
54 . 1 1 6 6 CYS CA C 13 56.808 0.400 . 1 . . . A 6 CYS CA . 18203 1
55 . 1 1 6 6 CYS CB C 13 42.915 0.400 . 1 . . . A 6 CYS CB . 18203 1
56 . 1 1 6 6 CYS N N 15 114.976 0.400 . 1 . . . A 6 CYS N . 18203 1
57 . 1 1 7 7 LYS H H 1 8.003 0.020 . 1 . . . A 7 LYS H . 18203 1
58 . 1 1 7 7 LYS HA H 1 4.313 0.020 . 1 . . . A 7 LYS HA . 18203 1
59 . 1 1 7 7 LYS HB2 H 1 1.882 0.020 . 2 . . . A 7 LYS HB2 . 18203 1
60 . 1 1 7 7 LYS HB3 H 1 1.789 0.020 . 2 . . . A 7 LYS HB3 . 18203 1
61 . 1 1 7 7 LYS HG2 H 1 1.395 0.020 . 1 . . . A 7 LYS HG2 . 18203 1
62 . 1 1 7 7 LYS HG3 H 1 1.395 0.020 . 1 . . . A 7 LYS HG3 . 18203 1
63 . 1 1 7 7 LYS HD2 H 1 1.676 0.020 . 1 . . . A 7 LYS HD2 . 18203 1
64 . 1 1 7 7 LYS HD3 H 1 1.676 0.020 . 1 . . . A 7 LYS HD3 . 18203 1
65 . 1 1 7 7 LYS HE2 H 1 2.992 0.020 . 1 . . . A 7 LYS HE2 . 18203 1
66 . 1 1 7 7 LYS HE3 H 1 2.992 0.020 . 1 . . . A 7 LYS HE3 . 18203 1
67 . 1 1 7 7 LYS CA C 13 56.888 0.400 . 1 . . . A 7 LYS CA . 18203 1
68 . 1 1 7 7 LYS CB C 13 32.691 0.400 . 1 . . . A 7 LYS CB . 18203 1
69 . 1 1 7 7 LYS CG C 13 24.620 0.400 . 1 . . . A 7 LYS CG . 18203 1
70 . 1 1 7 7 LYS CD C 13 29.191 0.400 . 1 . . . A 7 LYS CD . 18203 1
71 . 1 1 7 7 LYS CE C 13 42.050 0.400 . 1 . . . A 7 LYS CE . 18203 1
72 . 1 1 7 7 LYS N N 15 120.758 0.400 . 1 . . . A 7 LYS N . 18203 1
73 . 1 1 8 8 ASN H H 1 8.635 0.020 . 1 . . . A 8 ASN H . 18203 1
74 . 1 1 8 8 ASN HA H 1 4.809 0.020 . 1 . . . A 8 ASN HA . 18203 1
75 . 1 1 8 8 ASN HB2 H 1 2.911 0.020 . 2 . . . A 8 ASN HB2 . 18203 1
76 . 1 1 8 8 ASN HB3 H 1 2.726 0.020 . 2 . . . A 8 ASN HB3 . 18203 1
77 . 1 1 8 8 ASN HD21 H 1 7.076 0.020 . 1 . . . A 8 ASN HD21 . 18203 1
78 . 1 1 8 8 ASN HD22 H 1 7.728 0.020 . 1 . . . A 8 ASN HD22 . 18203 1
79 . 1 1 8 8 ASN CA C 13 53.017 0.400 . 1 . . . A 8 ASN CA . 18203 1
80 . 1 1 8 8 ASN CB C 13 38.733 0.400 . 1 . . . A 8 ASN CB . 18203 1
81 . 1 1 8 8 ASN N N 15 118.023 0.400 . 1 . . . A 8 ASN N . 18203 1
82 . 1 1 8 8 ASN ND2 N 15 113.569 0.400 . 1 . . . A 8 ASN ND2 . 18203 1
83 . 1 1 9 9 GLY H H 1 8.273 0.020 . 1 . . . A 9 GLY H . 18203 1
84 . 1 1 9 9 GLY HA2 H 1 3.823 0.020 . 2 . . . A 9 GLY HA2 . 18203 1
85 . 1 1 9 9 GLY HA3 H 1 4.099 0.020 . 2 . . . A 9 GLY HA3 . 18203 1
86 . 1 1 9 9 GLY CA C 13 45.431 0.400 . 1 . . . A 9 GLY CA . 18203 1
87 . 1 1 9 9 GLY N N 15 108.647 0.400 . 1 . . . A 9 GLY N . 18203 1
88 . 1 1 10 10 LYS H H 1 8.595 0.020 . 1 . . . A 10 LYS H . 18203 1
89 . 1 1 10 10 LYS HA H 1 4.285 0.020 . 1 . . . A 10 LYS HA . 18203 1
90 . 1 1 10 10 LYS HB2 H 1 1.826 0.020 . 1 . . . A 10 LYS HB2 . 18203 1
91 . 1 1 10 10 LYS HB3 H 1 1.826 0.020 . 1 . . . A 10 LYS HB3 . 18203 1
92 . 1 1 10 10 LYS HG2 H 1 1.484 0.020 . 1 . . . A 10 LYS HG2 . 18203 1
93 . 1 1 10 10 LYS HG3 H 1 1.484 0.020 . 1 . . . A 10 LYS HG3 . 18203 1
94 . 1 1 10 10 LYS HD2 H 1 1.694 0.020 . 1 . . . A 10 LYS HD2 . 18203 1
95 . 1 1 10 10 LYS HD3 H 1 1.694 0.020 . 1 . . . A 10 LYS HD3 . 18203 1
96 . 1 1 10 10 LYS HE2 H 1 2.998 0.020 . 1 . . . A 10 LYS HE2 . 18203 1
97 . 1 1 10 10 LYS HE3 H 1 2.998 0.020 . 1 . . . A 10 LYS HE3 . 18203 1
98 . 1 1 10 10 LYS CA C 13 57.307 0.400 . 1 . . . A 10 LYS CA . 18203 1
99 . 1 1 10 10 LYS CB C 13 30.004 0.400 . 1 . . . A 10 LYS CB . 18203 1
100 . 1 1 10 10 LYS CG C 13 25.008 0.400 . 1 . . . A 10 LYS CG . 18203 1
101 . 1 1 10 10 LYS CD C 13 29.250 0.400 . 1 . . . A 10 LYS CD . 18203 1
102 . 1 1 10 10 LYS CE C 13 42.121 0.400 . 1 . . . A 10 LYS CE . 18203 1
103 . 1 1 10 10 LYS N N 15 121.969 0.400 . 1 . . . A 10 LYS N . 18203 1
104 . 1 1 11 11 ARG H H 1 8.377 0.020 . 1 . . . A 11 ARG H . 18203 1
105 . 1 1 11 11 ARG HA H 1 4.270 0.020 . 1 . . . A 11 ARG HA . 18203 1
106 . 1 1 11 11 ARG HB2 H 1 1.924 0.020 . 2 . . . A 11 ARG HB2 . 18203 1
107 . 1 1 11 11 ARG HB3 H 1 1.866 0.020 . 2 . . . A 11 ARG HB3 . 18203 1
108 . 1 1 11 11 ARG HG2 H 1 1.715 0.020 . 2 . . . A 11 ARG HG2 . 18203 1
109 . 1 1 11 11 ARG HG3 H 1 1.671 0.020 . 2 . . . A 11 ARG HG3 . 18203 1
110 . 1 1 11 11 ARG HD2 H 1 3.229 0.020 . 1 . . . A 11 ARG HD2 . 18203 1
111 . 1 1 11 11 ARG HD3 H 1 3.229 0.020 . 1 . . . A 11 ARG HD3 . 18203 1
112 . 1 1 11 11 ARG HE H 1 7.268 0.020 . 1 . . . A 11 ARG HE . 18203 1
113 . 1 1 11 11 ARG CA C 13 57.382 0.400 . 1 . . . A 11 ARG CA . 18203 1
114 . 1 1 11 11 ARG CB C 13 30.037 0.400 . 1 . . . A 11 ARG CB . 18203 1
115 . 1 1 11 11 ARG CG C 13 27.091 0.400 . 1 . . . A 11 ARG CG . 18203 1
116 . 1 1 11 11 ARG CD C 13 43.161 0.400 . 1 . . . A 11 ARG CD . 18203 1
117 . 1 1 11 11 ARG N N 15 119.937 0.400 . 1 . . . A 11 ARG N . 18203 1
118 . 1 1 11 11 ARG NE N 15 84.444 0.400 . 1 . . . A 11 ARG NE . 18203 1
119 . 1 1 12 12 GLY H H 1 8.045 0.020 . 1 . . . A 12 GLY H . 18203 1
120 . 1 1 12 12 GLY HA2 H 1 3.902 0.020 . 2 . . . A 12 GLY HA2 . 18203 1
121 . 1 1 12 12 GLY HA3 H 1 4.103 0.020 . 2 . . . A 12 GLY HA3 . 18203 1
122 . 1 1 12 12 GLY CA C 13 45.191 0.400 . 1 . . . A 12 GLY CA . 18203 1
123 . 1 1 12 12 GLY N N 15 107.866 0.400 . 1 . . . A 12 GLY N . 18203 1
124 . 1 1 13 13 CYS H H 1 8.174 0.020 . 1 . . . A 13 CYS H . 18203 1
125 . 1 1 13 13 CYS HA H 1 4.706 0.020 . 1 . . . A 13 CYS HA . 18203 1
126 . 1 1 13 13 CYS HB2 H 1 3.378 0.020 . 2 . . . A 13 CYS HB2 . 18203 1
127 . 1 1 13 13 CYS HB3 H 1 3.110 0.020 . 2 . . . A 13 CYS HB3 . 18203 1
128 . 1 1 13 13 CYS CA C 13 56.393 0.400 . 1 . . . A 13 CYS CA . 18203 1
129 . 1 1 13 13 CYS CB C 13 43.530 0.400 . 1 . . . A 13 CYS CB . 18203 1
130 . 1 1 13 13 CYS N N 15 118.687 0.400 . 1 . . . A 13 CYS N . 18203 1
131 . 1 1 14 14 GLY H H 1 8.595 0.020 . 1 . . . A 14 GLY H . 18203 1
132 . 1 1 14 14 GLY HA2 H 1 3.972 0.020 . 2 . . . A 14 GLY HA2 . 18203 1
133 . 1 1 14 14 GLY HA3 H 1 4.286 0.020 . 2 . . . A 14 GLY HA3 . 18203 1
134 . 1 1 14 14 GLY CA C 13 44.357 0.400 . 1 . . . A 14 GLY CA . 18203 1
135 . 1 1 14 14 GLY N N 15 111.655 0.400 . 1 . . . A 14 GLY N . 18203 1
136 . 1 1 15 15 ARG H H 1 8.603 0.020 . 1 . . . A 15 ARG H . 18203 1
137 . 1 1 15 15 ARG HA H 1 3.807 0.020 . 1 . . . A 15 ARG HA . 18203 1
138 . 1 1 15 15 ARG HB2 H 1 1.932 0.020 . 1 . . . A 15 ARG HB2 . 18203 1
139 . 1 1 15 15 ARG HB3 H 1 1.932 0.020 . 1 . . . A 15 ARG HB3 . 18203 1
140 . 1 1 15 15 ARG HG2 H 1 1.718 0.020 . 2 . . . A 15 ARG HG2 . 18203 1
141 . 1 1 15 15 ARG HG3 H 1 1.628 0.020 . 2 . . . A 15 ARG HG3 . 18203 1
142 . 1 1 15 15 ARG HD2 H 1 3.234 0.020 . 1 . . . A 15 ARG HD2 . 18203 1
143 . 1 1 15 15 ARG HD3 H 1 3.234 0.020 . 1 . . . A 15 ARG HD3 . 18203 1
144 . 1 1 15 15 ARG HE H 1 7.583 0.020 . 1 . . . A 15 ARG HE . 18203 1
145 . 1 1 15 15 ARG CA C 13 60.024 0.400 . 1 . . . A 15 ARG CA . 18203 1
146 . 1 1 15 15 ARG CB C 13 30.106 0.400 . 1 . . . A 15 ARG CB . 18203 1
147 . 1 1 15 15 ARG CG C 13 27.068 0.400 . 1 . . . A 15 ARG CG . 18203 1
148 . 1 1 15 15 ARG CD C 13 43.330 0.400 . 1 . . . A 15 ARG CD . 18203 1
149 . 1 1 15 15 ARG N N 15 119.859 0.400 . 1 . . . A 15 ARG N . 18203 1
150 . 1 1 15 15 ARG NE N 15 85.641 0.400 . 1 . . . A 15 ARG NE . 18203 1
151 . 1 1 16 16 TRP H H 1 8.771 0.020 . 1 . . . A 16 TRP H . 18203 1
152 . 1 1 16 16 TRP HA H 1 4.409 0.020 . 1 . . . A 16 TRP HA . 18203 1
153 . 1 1 16 16 TRP HB2 H 1 3.392 0.020 . 1 . . . A 16 TRP HB2 . 18203 1
154 . 1 1 16 16 TRP HB3 H 1 3.392 0.020 . 1 . . . A 16 TRP HB3 . 18203 1
155 . 1 1 16 16 TRP HD1 H 1 7.252 0.020 . 1 . . . A 16 TRP HD1 . 18203 1
156 . 1 1 16 16 TRP HE1 H 1 10.089 0.020 . 1 . . . A 16 TRP HE1 . 18203 1
157 . 1 1 16 16 TRP HE3 H 1 7.489 0.020 . 1 . . . A 16 TRP HE3 . 18203 1
158 . 1 1 16 16 TRP HZ2 H 1 7.092 0.020 . 1 . . . A 16 TRP HZ2 . 18203 1
159 . 1 1 16 16 TRP HZ3 H 1 7.134 0.020 . 1 . . . A 16 TRP HZ3 . 18203 1
160 . 1 1 16 16 TRP HH2 H 1 7.071 0.020 . 1 . . . A 16 TRP HH2 . 18203 1
161 . 1 1 16 16 TRP CA C 13 62.774 0.400 . 1 . . . A 16 TRP CA . 18203 1
162 . 1 1 16 16 TRP CB C 13 28.631 0.400 . 1 . . . A 16 TRP CB . 18203 1
163 . 1 1 16 16 TRP CD1 C 13 127.125 0.400 . 1 . . . A 16 TRP CD1 . 18203 1
164 . 1 1 16 16 TRP CE3 C 13 120.929 0.400 . 1 . . . A 16 TRP CE3 . 18203 1
165 . 1 1 16 16 TRP CZ2 C 13 114.426 0.400 . 1 . . . A 16 TRP CZ2 . 18203 1
166 . 1 1 16 16 TRP CZ3 C 13 122.268 0.400 . 1 . . . A 16 TRP CZ3 . 18203 1
167 . 1 1 16 16 TRP CH2 C 13 124.524 0.400 . 1 . . . A 16 TRP CH2 . 18203 1
168 . 1 1 16 16 TRP N N 15 118.804 0.400 . 1 . . . A 16 TRP N . 18203 1
169 . 1 1 16 16 TRP NE1 N 15 130.407 0.400 . 1 . . . A 16 TRP NE1 . 18203 1
170 . 1 1 17 17 CYS H H 1 9.036 0.020 . 1 . . . A 17 CYS H . 18203 1
171 . 1 1 17 17 CYS HA H 1 4.434 0.020 . 1 . . . A 17 CYS HA . 18203 1
172 . 1 1 17 17 CYS HB2 H 1 3.308 0.020 . 2 . . . A 17 CYS HB2 . 18203 1
173 . 1 1 17 17 CYS HB3 H 1 3.111 0.020 . 2 . . . A 17 CYS HB3 . 18203 1
174 . 1 1 17 17 CYS CA C 13 59.097 0.400 . 1 . . . A 17 CYS CA . 18203 1
175 . 1 1 17 17 CYS CB C 13 38.378 0.400 . 1 . . . A 17 CYS CB . 18203 1
176 . 1 1 17 17 CYS N N 15 118.922 0.400 . 1 . . . A 17 CYS N . 18203 1
177 . 1 1 18 18 ARG H H 1 8.843 0.020 . 1 . . . A 18 ARG H . 18203 1
178 . 1 1 18 18 ARG HA H 1 3.945 0.020 . 1 . . . A 18 ARG HA . 18203 1
179 . 1 1 18 18 ARG HB2 H 1 1.907 0.020 . 2 . . . A 18 ARG HB2 . 18203 1
180 . 1 1 18 18 ARG HB3 H 1 1.810 0.020 . 2 . . . A 18 ARG HB3 . 18203 1
181 . 1 1 18 18 ARG HG2 H 1 1.510 0.020 . 1 . . . A 18 ARG HG2 . 18203 1
182 . 1 1 18 18 ARG HG3 H 1 1.510 0.020 . 1 . . . A 18 ARG HG3 . 18203 1
183 . 1 1 18 18 ARG HD2 H 1 3.239 0.020 . 1 . . . A 18 ARG HD2 . 18203 1
184 . 1 1 18 18 ARG HD3 H 1 3.239 0.020 . 1 . . . A 18 ARG HD3 . 18203 1
185 . 1 1 18 18 ARG HE H 1 7.279 0.020 . 1 . . . A 18 ARG HE . 18203 1
186 . 1 1 18 18 ARG CA C 13 59.951 0.400 . 1 . . . A 18 ARG CA . 18203 1
187 . 1 1 18 18 ARG CB C 13 29.969 0.400 . 1 . . . A 18 ARG CB . 18203 1
188 . 1 1 18 18 ARG CG C 13 28.334 0.400 . 1 . . . A 18 ARG CG . 18203 1
189 . 1 1 18 18 ARG CD C 13 43.253 0.400 . 1 . . . A 18 ARG CD . 18203 1
190 . 1 1 18 18 ARG N N 15 122.086 0.400 . 1 . . . A 18 ARG N . 18203 1
191 . 1 1 18 18 ARG NE N 15 83.961 0.400 . 1 . . . A 18 ARG NE . 18203 1
192 . 1 1 19 19 ASP H H 1 7.696 0.020 . 1 . . . A 19 ASP H . 18203 1
193 . 1 1 19 19 ASP HA H 1 4.433 0.020 . 1 . . . A 19 ASP HA . 18203 1
194 . 1 1 19 19 ASP HB2 H 1 2.345 0.020 . 2 . . . A 19 ASP HB2 . 18203 1
195 . 1 1 19 19 ASP HB3 H 1 2.075 0.020 . 2 . . . A 19 ASP HB3 . 18203 1
196 . 1 1 19 19 ASP CA C 13 55.196 0.400 . 1 . . . A 19 ASP CA . 18203 1
197 . 1 1 19 19 ASP CB C 13 40.879 0.400 . 1 . . . A 19 ASP CB . 18203 1
198 . 1 1 19 19 ASP N N 15 116.226 0.400 . 1 . . . A 19 ASP N . 18203 1
199 . 1 1 20 20 HIS H H 1 7.545 0.020 . 1 . . . A 20 HIS H . 18203 1
200 . 1 1 20 20 HIS HA H 1 4.503 0.020 . 1 . . . A 20 HIS HA . 18203 1
201 . 1 1 20 20 HIS HB2 H 1 2.792 0.020 . 2 . . . A 20 HIS HB2 . 18203 1
202 . 1 1 20 20 HIS HB3 H 1 1.372 0.020 . 2 . . . A 20 HIS HB3 . 18203 1
203 . 1 1 20 20 HIS HD2 H 1 6.495 0.020 . 1 . . . A 20 HIS HD2 . 18203 1
204 . 1 1 20 20 HIS HE1 H 1 8.286 0.020 . 1 . . . A 20 HIS HE1 . 18203 1
205 . 1 1 20 20 HIS CA C 13 56.641 0.400 . 1 . . . A 20 HIS CA . 18203 1
206 . 1 1 20 20 HIS CB C 13 28.971 0.400 . 1 . . . A 20 HIS CB . 18203 1
207 . 1 1 20 20 HIS CD2 C 13 119.865 0.400 . 1 . . . A 20 HIS CD2 . 18203 1
208 . 1 1 20 20 HIS CE1 C 13 135.604 0.400 . 1 . . . A 20 HIS CE1 . 18203 1
209 . 1 1 20 20 HIS N N 15 113.726 0.400 . 1 . . . A 20 HIS N . 18203 1
210 . 1 1 21 21 SER H H 1 8.156 0.020 . 1 . . . A 21 SER H . 18203 1
211 . 1 1 21 21 SER HA H 1 4.865 0.020 . 1 . . . A 21 SER HA . 18203 1
212 . 1 1 21 21 SER HB2 H 1 4.029 0.020 . 2 . . . A 21 SER HB2 . 18203 1
213 . 1 1 21 21 SER HB3 H 1 3.965 0.020 . 2 . . . A 21 SER HB3 . 18203 1
214 . 1 1 21 21 SER CA C 13 57.689 0.400 . 1 . . . A 21 SER CA . 18203 1
215 . 1 1 21 21 SER CB C 13 66.139 0.400 . 1 . . . A 21 SER CB . 18203 1
216 . 1 1 21 21 SER N N 15 115.523 0.400 . 1 . . . A 21 SER N . 18203 1
217 . 1 1 22 22 ARG H H 1 9.179 0.020 . 1 . . . A 22 ARG H . 18203 1
218 . 1 1 22 22 ARG HA H 1 4.402 0.020 . 1 . . . A 22 ARG HA . 18203 1
219 . 1 1 22 22 ARG HB2 H 1 1.989 0.020 . 2 . . . A 22 ARG HB2 . 18203 1
220 . 1 1 22 22 ARG HB3 H 1 1.794 0.020 . 2 . . . A 22 ARG HB3 . 18203 1
221 . 1 1 22 22 ARG HG2 H 1 1.681 0.020 . 1 . . . A 22 ARG HG2 . 18203 1
222 . 1 1 22 22 ARG HG3 H 1 1.681 0.020 . 1 . . . A 22 ARG HG3 . 18203 1
223 . 1 1 22 22 ARG HD2 H 1 3.204 0.020 . 1 . . . A 22 ARG HD2 . 18203 1
224 . 1 1 22 22 ARG HD3 H 1 3.204 0.020 . 1 . . . A 22 ARG HD3 . 18203 1
225 . 1 1 22 22 ARG HE H 1 7.252 0.020 . 1 . . . A 22 ARG HE . 18203 1
226 . 1 1 22 22 ARG CA C 13 56.964 0.400 . 1 . . . A 22 ARG CA . 18203 1
227 . 1 1 22 22 ARG CB C 13 29.771 0.400 . 1 . . . A 22 ARG CB . 18203 1
228 . 1 1 22 22 ARG CG C 13 27.078 0.400 . 1 . . . A 22 ARG CG . 18203 1
229 . 1 1 22 22 ARG CD C 13 43.186 0.400 . 1 . . . A 22 ARG CD . 18203 1
230 . 1 1 22 22 ARG N N 15 125.719 0.400 . 1 . . . A 22 ARG N . 18203 1
231 . 1 1 22 22 ARG NE N 15 84.315 0.400 . 1 . . . A 22 ARG NE . 18203 1
232 . 1 1 23 23 CYS H H 1 8.354 0.020 . 1 . . . A 23 CYS H . 18203 1
233 . 1 1 23 23 CYS HA H 1 4.504 0.020 . 1 . . . A 23 CYS HA . 18203 1
234 . 1 1 23 23 CYS HB2 H 1 3.421 0.020 . 2 . . . A 23 CYS HB2 . 18203 1
235 . 1 1 23 23 CYS HB3 H 1 3.287 0.020 . 2 . . . A 23 CYS HB3 . 18203 1
236 . 1 1 23 23 CYS CA C 13 56.750 0.400 . 1 . . . A 23 CYS CA . 18203 1
237 . 1 1 23 23 CYS CB C 13 44.086 0.400 . 1 . . . A 23 CYS CB . 18203 1
238 . 1 1 23 23 CYS N N 15 116.539 0.400 . 1 . . . A 23 CYS N . 18203 1
239 . 1 1 24 24 CYS H H 1 7.780 0.020 . 1 . . . A 24 CYS H . 18203 1
240 . 1 1 24 24 CYS HA H 1 4.649 0.020 . 1 . . . A 24 CYS HA . 18203 1
241 . 1 1 24 24 CYS HB2 H 1 3.182 0.020 . 2 . . . A 24 CYS HB2 . 18203 1
242 . 1 1 24 24 CYS HB3 H 1 2.952 0.020 . 2 . . . A 24 CYS HB3 . 18203 1
243 . 1 1 24 24 CYS CA C 13 55.445 0.400 . 1 . . . A 24 CYS CA . 18203 1
244 . 1 1 24 24 CYS CB C 13 41.605 0.400 . 1 . . . A 24 CYS CB . 18203 1
245 . 1 1 24 24 CYS N N 15 119.195 0.400 . 1 . . . A 24 CYS N . 18203 1
stop_
save_