Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 30557
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name .
_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 $chem_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 NOESY' . . . 30557 1
2 '2D 1H-1H TOCSY' . . . 30557 1
3 '2D DQF-COSY' . . . 30557 1
4 '2D 1H-15N HSQC' . . . 30557 1
5 '2D 1H-13C HSQC' . . . 30557 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_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 TRP HA H 1 3.5887 . . . . . . . A 1 TRP HA . 30557 1
2 . 1 . 1 1 1 TRP HB2 H 1 2.4901 . . . . . . . A 1 TRP HB2 . 30557 1
3 . 1 . 1 1 1 TRP HB3 H 1 2.8285 . . . . . . . A 1 TRP HB3 . 30557 1
4 . 1 . 1 1 1 TRP HD1 H 1 7.3610 . . . . . . . A 1 TRP HD1 . 30557 1
5 . 1 . 1 1 1 TRP HE1 H 1 10.7497 . . . . . . . A 1 TRP HE1 . 30557 1
6 . 1 . 1 1 1 TRP HE3 H 1 7.2320 . . . . . . . A 1 TRP HE3 . 30557 1
7 . 1 . 1 1 1 TRP HZ2 H 1 7.4805 . . . . . . . A 1 TRP HZ2 . 30557 1
8 . 1 . 1 1 1 TRP HZ3 H 1 6.9695 . . . . . . . A 1 TRP HZ3 . 30557 1
9 . 1 . 1 1 1 TRP HH2 H 1 7.0750 . . . . . . . A 1 TRP HH2 . 30557 1
10 . 1 . 1 1 1 TRP CA C 13 57.2218 . . . . . . . A 1 TRP CA . 30557 1
11 . 1 . 1 1 1 TRP CB C 13 32.0444 . . . . . . . A 1 TRP CB . 30557 1
12 . 1 . 1 1 1 TRP CD1 C 13 127.5395 . . . . . . . A 1 TRP CD1 . 30557 1
13 . 1 . 1 1 1 TRP CE3 C 13 121.1824 . . . . . . . A 1 TRP CE3 . 30557 1
14 . 1 . 1 1 1 TRP CZ2 C 13 114.7493 . . . . . . . A 1 TRP CZ2 . 30557 1
15 . 1 . 1 1 1 TRP CZ3 C 13 121.3796 . . . . . . . A 1 TRP CZ3 . 30557 1
16 . 1 . 1 1 1 TRP CH2 C 13 124.0601 . . . . . . . A 1 TRP CH2 . 30557 1
17 . 1 . 1 1 1 TRP NE1 N 15 131.1013 . . . . . . . A 1 TRP NE1 . 30557 1
18 . 1 . 1 2 2 TRP HA H 1 4.3027 . . . . . . . A 2 TRP HA . 30557 1
19 . 1 . 1 2 2 TRP HB2 H 1 3.3565 . . . . . . . A 2 TRP HB2 . 30557 1
20 . 1 . 1 2 2 TRP HB3 H 1 3.3914 . . . . . . . A 2 TRP HB3 . 30557 1
21 . 1 . 1 2 2 TRP HD1 H 1 7.5273 . . . . . . . A 2 TRP HD1 . 30557 1
22 . 1 . 1 2 2 TRP HE1 H 1 10.9549 . . . . . . . A 2 TRP HE1 . 30557 1
23 . 1 . 1 2 2 TRP HE3 H 1 7.4085 . . . . . . . A 2 TRP HE3 . 30557 1
24 . 1 . 1 2 2 TRP HZ2 H 1 7.5728 . . . . . . . A 2 TRP HZ2 . 30557 1
25 . 1 . 1 2 2 TRP HZ3 H 1 7.0515 . . . . . . . A 2 TRP HZ3 . 30557 1
26 . 1 . 1 2 2 TRP HH2 H 1 7.2030 . . . . . . . A 2 TRP HH2 . 30557 1
27 . 1 . 1 2 2 TRP CA C 13 59.3027 . . . . . . . A 2 TRP CA . 30557 1
28 . 1 . 1 2 2 TRP CB C 13 28.3175 . . . . . . . A 2 TRP CB . 30557 1
29 . 1 . 1 2 2 TRP CD1 C 13 128.3566 . . . . . . . A 2 TRP CD1 . 30557 1
30 . 1 . 1 2 2 TRP CE3 C 13 120.8729 . . . . . . . A 2 TRP CE3 . 30557 1
31 . 1 . 1 2 2 TRP CZ2 C 13 115.2332 . . . . . . . A 2 TRP CZ2 . 30557 1
32 . 1 . 1 2 2 TRP CZ3 C 13 121.8557 . . . . . . . A 2 TRP CZ3 . 30557 1
33 . 1 . 1 2 2 TRP CH2 C 13 124.6161 . . . . . . . A 2 TRP CH2 . 30557 1
34 . 1 . 1 2 2 TRP NE1 N 15 131.9467 . . . . . . . A 2 TRP NE1 . 30557 1
35 . 1 . 1 3 3 TRP H H 1 6.6149 . . . . . . . A 3 TRP H . 30557 1
36 . 1 . 1 3 3 TRP HA H 1 3.9303 . . . . . . . A 3 TRP HA . 30557 1
37 . 1 . 1 3 3 TRP HB2 H 1 1.9836 . . . . . . . A 3 TRP HB2 . 30557 1
38 . 1 . 1 3 3 TRP HB3 H 1 2.9064 . . . . . . . A 3 TRP HB3 . 30557 1
39 . 1 . 1 3 3 TRP HD1 H 1 6.4907 . . . . . . . A 3 TRP HD1 . 30557 1
40 . 1 . 1 3 3 TRP HE1 H 1 10.4270 . . . . . . . A 3 TRP HE1 . 30557 1
41 . 1 . 1 3 3 TRP HE3 H 1 7.0720 . . . . . . . A 3 TRP HE3 . 30557 1
42 . 1 . 1 3 3 TRP HZ2 H 1 7.0104 . . . . . . . A 3 TRP HZ2 . 30557 1
43 . 1 . 1 3 3 TRP HZ3 H 1 6.8225 . . . . . . . A 3 TRP HZ3 . 30557 1
44 . 1 . 1 3 3 TRP HH2 H 1 6.8425 . . . . . . . A 3 TRP HH2 . 30557 1
45 . 1 . 1 3 3 TRP CA C 13 57.1829 . . . . . . . A 3 TRP CA . 30557 1
46 . 1 . 1 3 3 TRP CB C 13 27.6919 . . . . . . . A 3 TRP CB . 30557 1
47 . 1 . 1 3 3 TRP CD1 C 13 127.2193 . . . . . . . A 3 TRP CD1 . 30557 1
48 . 1 . 1 3 3 TRP CE3 C 13 120.7767 . . . . . . . A 3 TRP CE3 . 30557 1
49 . 1 . 1 3 3 TRP CZ2 C 13 114.7721 . . . . . . . A 3 TRP CZ2 . 30557 1
50 . 1 . 1 3 3 TRP CZ3 C 13 121.7382 . . . . . . . A 3 TRP CZ3 . 30557 1
51 . 1 . 1 3 3 TRP CH2 C 13 124.1556 . . . . . . . A 3 TRP CH2 . 30557 1
52 . 1 . 1 3 3 TRP N N 15 119.0160 . . . . . . . A 3 TRP N . 30557 1
53 . 1 . 1 3 3 TRP NE1 N 15 131.2832 . . . . . . . A 3 TRP NE1 . 30557 1
54 . 1 . 1 4 4 LEU H H 1 6.8911 . . . . . . . A 4 LEU H . 30557 1
55 . 1 . 1 4 4 LEU HA H 1 3.9720 . . . . . . . A 4 LEU HA . 30557 1
56 . 1 . 1 4 4 LEU HB2 H 1 1.2640 . . . . . . . A 4 LEU HB2 . 30557 1
57 . 1 . 1 4 4 LEU HB3 H 1 1.4390 . . . . . . . A 4 LEU HB3 . 30557 1
58 . 1 . 1 4 4 LEU HD11 H 1 0.7670 . . . . . . . A 4 LEU HD11 . 30557 1
59 . 1 . 1 4 4 LEU HD12 H 1 0.7670 . . . . . . . A 4 LEU HD12 . 30557 1
60 . 1 . 1 4 4 LEU HD13 H 1 0.7670 . . . . . . . A 4 LEU HD13 . 30557 1
61 . 1 . 1 4 4 LEU HD21 H 1 0.8590 . . . . . . . A 4 LEU HD21 . 30557 1
62 . 1 . 1 4 4 LEU HD22 H 1 0.8590 . . . . . . . A 4 LEU HD22 . 30557 1
63 . 1 . 1 4 4 LEU HD23 H 1 0.8590 . . . . . . . A 4 LEU HD23 . 30557 1
64 . 1 . 1 4 4 LEU CA C 13 57.1662 . . . . . . . A 4 LEU CA . 30557 1
65 . 1 . 1 4 4 LEU CB C 13 41.9176 . . . . . . . A 4 LEU CB . 30557 1
66 . 1 . 1 4 4 LEU CD1 C 13 24.7559 . . . . . . . A 4 LEU CD1 . 30557 1
67 . 1 . 1 4 4 LEU CD2 C 13 25.2393 . . . . . . . A 4 LEU CD2 . 30557 1
68 . 1 . 1 4 4 LEU N N 15 121.2910 . . . . . . . A 4 LEU N . 30557 1
69 . 1 . 1 5 5 ARG H H 1 7.6024 . . . . . . . A 5 ARG H . 30557 1
70 . 1 . 1 5 5 ARG HA H 1 4.0050 . . . . . . . A 5 ARG HA . 30557 1
71 . 1 . 1 5 5 ARG HB2 H 1 1.8290 . . . . . . . A 5 ARG HB2 . 30557 1
72 . 1 . 1 5 5 ARG HB3 H 1 1.9060 . . . . . . . A 5 ARG HB3 . 30557 1
73 . 1 . 1 5 5 ARG HG2 H 1 1.6585 . . . . . . . A 5 ARG HG2 . 30557 1
74 . 1 . 1 5 5 ARG HG3 H 1 1.6585 . . . . . . . A 5 ARG HG3 . 30557 1
75 . 1 . 1 5 5 ARG HD2 H 1 3.1650 . . . . . . . A 5 ARG HD2 . 30557 1
76 . 1 . 1 5 5 ARG HD3 H 1 3.1650 . . . . . . . A 5 ARG HD3 . 30557 1
77 . 1 . 1 5 5 ARG CA C 13 58.1798 . . . . . . . A 5 ARG CA . 30557 1
78 . 1 . 1 5 5 ARG CB C 13 30.0806 . . . . . . . A 5 ARG CB . 30557 1
79 . 1 . 1 5 5 ARG CG C 13 27.7459 . . . . . . . A 5 ARG CG . 30557 1
80 . 1 . 1 5 5 ARG CD C 13 43.4806 . . . . . . . A 5 ARG CD . 30557 1
81 . 1 . 1 5 5 ARG N N 15 116.4023 . . . . . . . A 5 ARG N . 30557 1
82 . 1 . 1 6 6 LYS H H 1 7.7287 . . . . . . . A 6 LYS H . 30557 1
83 . 1 . 1 6 6 LYS HA H 1 4.1090 . . . . . . . A 6 LYS HA . 30557 1
84 . 1 . 1 6 6 LYS HB2 H 1 1.8730 . . . . . . . A 6 LYS HB2 . 30557 1
85 . 1 . 1 6 6 LYS HB3 H 1 1.8730 . . . . . . . A 6 LYS HB3 . 30557 1
86 . 1 . 1 6 6 LYS HG2 H 1 1.4655 . . . . . . . A 6 LYS HG2 . 30557 1
87 . 1 . 1 6 6 LYS HG3 H 1 1.4655 . . . . . . . A 6 LYS HG3 . 30557 1
88 . 1 . 1 6 6 LYS HD2 H 1 1.7390 . . . . . . . A 6 LYS HD2 . 30557 1
89 . 1 . 1 6 6 LYS HD3 H 1 1.7390 . . . . . . . A 6 LYS HD3 . 30557 1
90 . 1 . 1 6 6 LYS HE2 H 1 2.9880 . . . . . . . A 6 LYS HE2 . 30557 1
91 . 1 . 1 6 6 LYS HE3 H 1 2.9880 . . . . . . . A 6 LYS HE3 . 30557 1
92 . 1 . 1 6 6 LYS CA C 13 57.6041 . . . . . . . A 6 LYS CA . 30557 1
93 . 1 . 1 6 6 LYS CB C 13 32.4357 . . . . . . . A 6 LYS CB . 30557 1
94 . 1 . 1 6 6 LYS CG C 13 25.0450 . . . . . . . A 6 LYS CG . 30557 1
95 . 1 . 1 6 6 LYS CD C 13 28.9688 . . . . . . . A 6 LYS CD . 30557 1
96 . 1 . 1 6 6 LYS CE C 13 42.0750 . . . . . . . A 6 LYS CE . 30557 1
97 . 1 . 1 6 6 LYS N N 15 117.4544 . . . . . . . A 6 LYS N . 30557 1
98 . 1 . 1 7 7 ILE H H 1 7.4775 . . . . . . . A 7 ILE H . 30557 1
99 . 1 . 1 7 7 ILE HA H 1 3.9740 . . . . . . . A 7 ILE HA . 30557 1
100 . 1 . 1 7 7 ILE HB H 1 1.9150 . . . . . . . A 7 ILE HB . 30557 1
101 . 1 . 1 7 7 ILE HG12 H 1 1.2435 . . . . . . . A 7 ILE HG12 . 30557 1
102 . 1 . 1 7 7 ILE HG13 H 1 1.6130 . . . . . . . A 7 ILE HG13 . 30557 1
103 . 1 . 1 7 7 ILE HG21 H 1 0.7865 . . . . . . . A 7 ILE HG21 . 30557 1
104 . 1 . 1 7 7 ILE HG22 H 1 0.7865 . . . . . . . A 7 ILE HG22 . 30557 1
105 . 1 . 1 7 7 ILE HG23 H 1 0.7865 . . . . . . . A 7 ILE HG23 . 30557 1
106 . 1 . 1 7 7 ILE HD11 H 1 0.8970 . . . . . . . A 7 ILE HD11 . 30557 1
107 . 1 . 1 7 7 ILE HD12 H 1 0.8970 . . . . . . . A 7 ILE HD12 . 30557 1
108 . 1 . 1 7 7 ILE HD13 H 1 0.8970 . . . . . . . A 7 ILE HD13 . 30557 1
109 . 1 . 1 7 7 ILE CA C 13 63.1688 . . . . . . . A 7 ILE CA . 30557 1
110 . 1 . 1 7 7 ILE CB C 13 38.6928 . . . . . . . A 7 ILE CB . 30557 1
111 . 1 . 1 7 7 ILE CG1 C 13 27.5902 . . . . . . . A 7 ILE CG1 . 30557 1
112 . 1 . 1 7 7 ILE CG2 C 13 17.8126 . . . . . . . A 7 ILE CG2 . 30557 1
113 . 1 . 1 7 7 ILE CD1 C 13 13.8873 . . . . . . . A 7 ILE CD1 . 30557 1
114 . 1 . 1 7 7 ILE N N 15 116.0646 . . . . . . . A 7 ILE N . 30557 1
115 . 1 . 1 8 8 TRP H H 1 7.5899 . . . . . . . A 8 TRP H . 30557 1
116 . 1 . 1 8 8 TRP HA H 1 4.5730 . . . . . . . A 8 TRP HA . 30557 1
117 . 1 . 1 8 8 TRP HB2 H 1 3.1471 . . . . . . . A 8 TRP HB2 . 30557 1
118 . 1 . 1 8 8 TRP HB3 H 1 3.2581 . . . . . . . A 8 TRP HB3 . 30557 1
119 . 1 . 1 8 8 TRP HD1 H 1 7.2407 . . . . . . . A 8 TRP HD1 . 30557 1
120 . 1 . 1 8 8 TRP HE1 H 1 10.5545 . . . . . . . A 8 TRP HE1 . 30557 1
121 . 1 . 1 8 8 TRP HE3 H 1 7.5050 . . . . . . . A 8 TRP HE3 . 30557 1
122 . 1 . 1 8 8 TRP HZ2 H 1 7.4389 . . . . . . . A 8 TRP HZ2 . 30557 1
123 . 1 . 1 8 8 TRP HZ3 H 1 6.9700 . . . . . . . A 8 TRP HZ3 . 30557 1
124 . 1 . 1 8 8 TRP HH2 H 1 7.0610 . . . . . . . A 8 TRP HH2 . 30557 1
125 . 1 . 1 8 8 TRP CA C 13 57.8159 . . . . . . . A 8 TRP CA . 30557 1
126 . 1 . 1 8 8 TRP CB C 13 30.5187 . . . . . . . A 8 TRP CB . 30557 1
127 . 1 . 1 8 8 TRP CD1 C 13 127.2991 . . . . . . . A 8 TRP CD1 . 30557 1
128 . 1 . 1 8 8 TRP CE3 C 13 120.7457 . . . . . . . A 8 TRP CE3 . 30557 1
129 . 1 . 1 8 8 TRP CZ2 C 13 114.7185 . . . . . . . A 8 TRP CZ2 . 30557 1
130 . 1 . 1 8 8 TRP CZ3 C 13 121.5091 . . . . . . . A 8 TRP CZ3 . 30557 1
131 . 1 . 1 8 8 TRP CH2 C 13 124.0080 . . . . . . . A 8 TRP CH2 . 30557 1
132 . 1 . 1 8 8 TRP N N 15 119.0111 . . . . . . . A 8 TRP N . 30557 1
133 . 1 . 1 8 8 TRP NE1 N 15 130.1639 . . . . . . . A 8 TRP NE1 . 30557 1
134 . 1 . 1 9 9 NH2 N N 15 106.0312 . . . . . . . A 9 NH2 N . 30557 1
135 . 1 . 1 9 9 NH2 HN1 H 1 7.2180 . . . . . . . A 9 NH2 HN1 . 30557 1
136 . 1 . 1 9 9 NH2 HN2 H 1 7.0380 . . . . . . . A 9 NH2 HN2 . 30557 1
stop_
save_