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 19973
_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 NOESY' . . . 19973 1
2 '2D 1H-1H TOCSY' . . . 19973 1
3 '2D 1H-15N HSQC' . . . 19973 1
4 '2D 1H-13C HSQC' . . . 19973 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
2 $CARA . . 19973 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 SER HA H 1 4.181 0.000 . 1 . . . A 1 SER HA . 19973 1
2 . 1 1 1 1 SER HB2 H 1 3.993 0.000 . 1 . . . A 1 SER HB2 . 19973 1
3 . 1 1 1 1 SER HB3 H 1 3.993 0.000 . 1 . . . A 1 SER HB3 . 19973 1
4 . 1 1 1 1 SER CA C 13 57.061 0.000 . 1 . . . A 1 SER CA . 19973 1
5 . 1 1 1 1 SER CB C 13 62.954 0.000 . 1 . . . A 1 SER CB . 19973 1
6 . 1 1 2 2 ARG H H 1 8.794 0.000 . 1 . . . A 2 ARG H . 19973 1
7 . 1 1 2 2 ARG HA H 1 4.419 0.000 . 1 . . . A 2 ARG HA . 19973 1
8 . 1 1 2 2 ARG HB2 H 1 1.877 0.000 . 2 . . . A 2 ARG HB2 . 19973 1
9 . 1 1 2 2 ARG HB3 H 1 1.797 0.000 . 2 . . . A 2 ARG HB3 . 19973 1
10 . 1 1 2 2 ARG HG2 H 1 1.654 0.000 . 1 . . . A 2 ARG HG2 . 19973 1
11 . 1 1 2 2 ARG HG3 H 1 1.654 0.000 . 1 . . . A 2 ARG HG3 . 19973 1
12 . 1 1 2 2 ARG HD2 H 1 3.211 0.000 . 1 . . . A 2 ARG HD2 . 19973 1
13 . 1 1 2 2 ARG HD3 H 1 3.211 0.000 . 1 . . . A 2 ARG HD3 . 19973 1
14 . 1 1 2 2 ARG HH21 H 1 7.538 0.000 . 1 . . . A 2 ARG HH21 . 19973 1
15 . 1 1 2 2 ARG HH22 H 1 7.538 0.000 . 1 . . . A 2 ARG HH22 . 19973 1
16 . 1 1 2 2 ARG CA C 13 56.402 0.000 . 1 . . . A 2 ARG CA . 19973 1
17 . 1 1 2 2 ARG CB C 13 30.752 0.000 . 1 . . . A 2 ARG CB . 19973 1
18 . 1 1 2 2 ARG CG C 13 26.982 0.000 . 1 . . . A 2 ARG CG . 19973 1
19 . 1 1 2 2 ARG CD C 13 43.256 0.000 . 1 . . . A 2 ARG CD . 19973 1
20 . 1 1 2 2 ARG N N 15 121.897 0.000 . 1 . . . A 2 ARG N . 19973 1
21 . 1 1 3 3 SER H H 1 8.484 0.000 . 1 . . . A 3 SER H . 19973 1
22 . 1 1 3 3 SER HA H 1 4.426 0.000 . 1 . . . A 3 SER HA . 19973 1
23 . 1 1 3 3 SER HB2 H 1 3.846 0.000 . 1 . . . A 3 SER HB2 . 19973 1
24 . 1 1 3 3 SER HB3 H 1 3.846 0.000 . 1 . . . A 3 SER HB3 . 19973 1
25 . 1 1 3 3 SER CA C 13 58.301 0.000 . 1 . . . A 3 SER CA . 19973 1
26 . 1 1 3 3 SER CB C 13 63.603 0.000 . 1 . . . A 3 SER CB . 19973 1
27 . 1 1 3 3 SER N N 15 117.780 0.000 . 1 . . . A 3 SER N . 19973 1
28 . 1 1 4 4 GLU H H 1 8.453 0.000 . 1 . . . A 4 GLU H . 19973 1
29 . 1 1 4 4 GLU HA H 1 4.372 0.000 . 1 . . . A 4 GLU HA . 19973 1
30 . 1 1 4 4 GLU HB2 H 1 2.095 0.000 . 2 . . . A 4 GLU HB2 . 19973 1
31 . 1 1 4 4 GLU HB3 H 1 1.957 0.000 . 2 . . . A 4 GLU HB3 . 19973 1
32 . 1 1 4 4 GLU HG2 H 1 2.419 0.000 . 1 . . . A 4 GLU HG2 . 19973 1
33 . 1 1 4 4 GLU HG3 H 1 2.419 0.000 . 1 . . . A 4 GLU HG3 . 19973 1
34 . 1 1 4 4 GLU CA C 13 55.776 0.000 . 1 . . . A 4 GLU CA . 19973 1
35 . 1 1 4 4 GLU CB C 13 29.211 0.000 . 1 . . . A 4 GLU CB . 19973 1
36 . 1 1 4 4 GLU CG C 13 33.330 0.000 . 1 . . . A 4 GLU CG . 19973 1
37 . 1 1 4 4 GLU N N 15 122.780 0.000 . 1 . . . A 4 GLU N . 19973 1
38 . 1 1 5 5 LEU H H 1 8.209 0.000 . 1 . . . A 5 LEU H . 19973 1
39 . 1 1 5 5 LEU HA H 1 4.319 0.000 . 1 . . . A 5 LEU HA . 19973 1
40 . 1 1 5 5 LEU HB2 H 1 1.572 0.000 . 1 . . . A 5 LEU HB2 . 19973 1
41 . 1 1 5 5 LEU HB3 H 1 1.572 0.000 . 1 . . . A 5 LEU HB3 . 19973 1
42 . 1 1 5 5 LEU HG H 1 1.563 0.000 . 1 . . . A 5 LEU HG . 19973 1
43 . 1 1 5 5 LEU HD11 H 1 0.913 0.000 . 2 . . . A 5 LEU HD11 . 19973 1
44 . 1 1 5 5 LEU HD12 H 1 0.913 0.000 . 2 . . . A 5 LEU HD12 . 19973 1
45 . 1 1 5 5 LEU HD13 H 1 0.913 0.000 . 2 . . . A 5 LEU HD13 . 19973 1
46 . 1 1 5 5 LEU HD21 H 1 0.852 0.000 . 2 . . . A 5 LEU HD21 . 19973 1
47 . 1 1 5 5 LEU HD22 H 1 0.852 0.000 . 2 . . . A 5 LEU HD22 . 19973 1
48 . 1 1 5 5 LEU HD23 H 1 0.852 0.000 . 2 . . . A 5 LEU HD23 . 19973 1
49 . 1 1 5 5 LEU CA C 13 55.074 0.000 . 1 . . . A 5 LEU CA . 19973 1
50 . 1 1 5 5 LEU CB C 13 42.314 0.000 . 1 . . . A 5 LEU CB . 19973 1
51 . 1 1 5 5 LEU CG C 13 26.747 0.000 . 1 . . . A 5 LEU CG . 19973 1
52 . 1 1 5 5 LEU CD1 C 13 24.613 0.000 . 2 . . . A 5 LEU CD1 . 19973 1
53 . 1 1 5 5 LEU CD2 C 13 23.664 0.000 . 2 . . . A 5 LEU CD2 . 19973 1
54 . 1 1 5 5 LEU N N 15 123.566 0.000 . 1 . . . A 5 LEU N . 19973 1
55 . 1 1 6 6 ILE H H 1 8.138 0.000 . 1 . . . A 6 ILE H . 19973 1
56 . 1 1 6 6 ILE HA H 1 4.122 0.000 . 1 . . . A 6 ILE HA . 19973 1
57 . 1 1 6 6 ILE HB H 1 1.800 0.000 . 1 . . . A 6 ILE HB . 19973 1
58 . 1 1 6 6 ILE HG12 H 1 1.448 0.000 . 2 . . . A 6 ILE HG12 . 19973 1
59 . 1 1 6 6 ILE HG13 H 1 1.161 0.000 . 2 . . . A 6 ILE HG13 . 19973 1
60 . 1 1 6 6 ILE HG21 H 1 0.756 0.000 . 1 . . . A 6 ILE HG21 . 19973 1
61 . 1 1 6 6 ILE HG22 H 1 0.756 0.000 . 1 . . . A 6 ILE HG22 . 19973 1
62 . 1 1 6 6 ILE HG23 H 1 0.756 0.000 . 1 . . . A 6 ILE HG23 . 19973 1
63 . 1 1 6 6 ILE HD11 H 1 0.833 0.000 . 1 . . . A 6 ILE HD11 . 19973 1
64 . 1 1 6 6 ILE HD12 H 1 0.833 0.000 . 1 . . . A 6 ILE HD12 . 19973 1
65 . 1 1 6 6 ILE HD13 H 1 0.833 0.000 . 1 . . . A 6 ILE HD13 . 19973 1
66 . 1 1 6 6 ILE CA C 13 60.736 0.000 . 1 . . . A 6 ILE CA . 19973 1
67 . 1 1 6 6 ILE CB C 13 38.396 0.000 . 1 . . . A 6 ILE CB . 19973 1
68 . 1 1 6 6 ILE CG1 C 13 27.311 0.000 . 1 . . . A 6 ILE CG1 . 19973 1
69 . 1 1 6 6 ILE CG2 C 13 17.290 0.000 . 1 . . . A 6 ILE CG2 . 19973 1
70 . 1 1 6 6 ILE CD1 C 13 12.395 0.000 . 1 . . . A 6 ILE CD1 . 19973 1
71 . 1 1 6 6 ILE N N 15 123.187 0.000 . 1 . . . A 6 ILE N . 19973 1
72 . 1 1 7 7 VAL H H 1 8.201 0.000 . 1 . . . A 7 VAL H . 19973 1
73 . 1 1 7 7 VAL HA H 1 4.025 0.000 . 1 . . . A 7 VAL HA . 19973 1
74 . 1 1 7 7 VAL HB H 1 1.970 0.000 . 1 . . . A 7 VAL HB . 19973 1
75 . 1 1 7 7 VAL HG11 H 1 0.882 0.000 . 2 . . . A 7 VAL HG11 . 19973 1
76 . 1 1 7 7 VAL HG12 H 1 0.882 0.000 . 2 . . . A 7 VAL HG12 . 19973 1
77 . 1 1 7 7 VAL HG13 H 1 0.882 0.000 . 2 . . . A 7 VAL HG13 . 19973 1
78 . 1 1 7 7 VAL HG21 H 1 0.846 0.000 . 2 . . . A 7 VAL HG21 . 19973 1
79 . 1 1 7 7 VAL HG22 H 1 0.846 0.000 . 2 . . . A 7 VAL HG22 . 19973 1
80 . 1 1 7 7 VAL HG23 H 1 0.846 0.000 . 2 . . . A 7 VAL HG23 . 19973 1
81 . 1 1 7 7 VAL CA C 13 62.175 0.000 . 1 . . . A 7 VAL CA . 19973 1
82 . 1 1 7 7 VAL CB C 13 32.798 0.000 . 1 . . . A 7 VAL CB . 19973 1
83 . 1 1 7 7 VAL CG1 C 13 20.634 0.000 . 2 . . . A 7 VAL CG1 . 19973 1
84 . 1 1 7 7 VAL CG2 C 13 21.055 0.000 . 2 . . . A 7 VAL CG2 . 19973 1
85 . 1 1 7 7 VAL N N 15 125.074 0.000 . 1 . . . A 7 VAL N . 19973 1
86 . 1 1 8 8 HIS H H 1 8.630 0.000 . 1 . . . A 8 HIS H . 19973 1
87 . 1 1 8 8 HIS HA H 1 4.692 0.000 . 1 . . . A 8 HIS HA . 19973 1
88 . 1 1 8 8 HIS HB2 H 1 3.250 0.000 . 2 . . . A 8 HIS HB2 . 19973 1
89 . 1 1 8 8 HIS HB3 H 1 3.159 0.000 . 2 . . . A 8 HIS HB3 . 19973 1
90 . 1 1 8 8 HIS HD2 H 1 7.309 0.000 . 1 . . . A 8 HIS HD2 . 19973 1
91 . 1 1 8 8 HIS HE1 H 1 8.610 0.000 . 1 . . . A 8 HIS HE1 . 19973 1
92 . 1 1 8 8 HIS CA C 13 55.089 0.000 . 1 . . . A 8 HIS CA . 19973 1
93 . 1 1 8 8 HIS CB C 13 28.902 0.000 . 1 . . . A 8 HIS CB . 19973 1
94 . 1 1 8 8 HIS CD2 C 13 119.954 0.000 . 1 . . . A 8 HIS CD2 . 19973 1
95 . 1 1 8 8 HIS CE1 C 13 136.161 0.000 . 1 . . . A 8 HIS CE1 . 19973 1
96 . 1 1 8 8 HIS N N 15 122.621 0.000 . 1 . . . A 8 HIS N . 19973 1
97 . 1 1 9 9 GLN H H 1 8.480 0.000 . 1 . . . A 9 GLN H . 19973 1
98 . 1 1 9 9 GLN HA H 1 4.291 0.000 . 1 . . . A 9 GLN HA . 19973 1
99 . 1 1 9 9 GLN HB2 H 1 2.045 0.000 . 2 . . . A 9 GLN HB2 . 19973 1
100 . 1 1 9 9 GLN HB3 H 1 1.961 0.000 . 2 . . . A 9 GLN HB3 . 19973 1
101 . 1 1 9 9 GLN HG2 H 1 2.332 0.000 . 1 . . . A 9 GLN HG2 . 19973 1
102 . 1 1 9 9 GLN HG3 H 1 2.332 0.000 . 1 . . . A 9 GLN HG3 . 19973 1
103 . 1 1 9 9 GLN CA C 13 55.861 0.000 . 1 . . . A 9 GLN CA . 19973 1
104 . 1 1 9 9 GLN CB C 13 29.490 0.000 . 1 . . . A 9 GLN CB . 19973 1
105 . 1 1 9 9 GLN CG C 13 33.602 0.000 . 1 . . . A 9 GLN CG . 19973 1
106 . 1 1 9 9 GLN N N 15 122.144 0.000 . 1 . . . A 9 GLN N . 19973 1
107 . 1 1 10 10 ARG H H 1 8.468 0.000 . 1 . . . A 10 ARG H . 19973 1
108 . 1 1 10 10 ARG HA H 1 4.261 0.000 . 1 . . . A 10 ARG HA . 19973 1
109 . 1 1 10 10 ARG HB2 H 1 1.738 0.000 . 1 . . . A 10 ARG HB2 . 19973 1
110 . 1 1 10 10 ARG HB3 H 1 1.738 0.000 . 1 . . . A 10 ARG HB3 . 19973 1
111 . 1 1 10 10 ARG HG2 H 1 1.573 0.000 . 2 . . . A 10 ARG HG2 . 19973 1
112 . 1 1 10 10 ARG HG3 H 1 1.523 0.000 . 2 . . . A 10 ARG HG3 . 19973 1
113 . 1 1 10 10 ARG HD2 H 1 3.168 0.000 . 1 . . . A 10 ARG HD2 . 19973 1
114 . 1 1 10 10 ARG HD3 H 1 3.168 0.000 . 1 . . . A 10 ARG HD3 . 19973 1
115 . 1 1 10 10 ARG HH21 H 1 7.522 0.000 . 1 . . . A 10 ARG HH21 . 19973 1
116 . 1 1 10 10 ARG HH22 H 1 7.522 0.000 . 1 . . . A 10 ARG HH22 . 19973 1
117 . 1 1 10 10 ARG CA C 13 56.105 0.000 . 1 . . . A 10 ARG CA . 19973 1
118 . 1 1 10 10 ARG CB C 13 30.796 0.000 . 1 . . . A 10 ARG CB . 19973 1
119 . 1 1 10 10 ARG CG C 13 27.301 0.000 . 1 . . . A 10 ARG CG . 19973 1
120 . 1 1 10 10 ARG CD C 13 43.261 0.000 . 1 . . . A 10 ARG CD . 19973 1
121 . 1 1 10 10 ARG N N 15 123.145 0.000 . 1 . . . A 10 ARG N . 19973 1
122 . 1 1 11 11 LEU H H 1 8.266 0.000 . 1 . . . A 11 LEU H . 19973 1
123 . 1 1 11 11 LEU HA H 1 4.303 0.000 . 1 . . . A 11 LEU HA . 19973 1
124 . 1 1 11 11 LEU HB2 H 1 1.530 0.000 . 2 . . . A 11 LEU HB2 . 19973 1
125 . 1 1 11 11 LEU HB3 H 1 1.432 0.000 . 2 . . . A 11 LEU HB3 . 19973 1
126 . 1 1 11 11 LEU HG H 1 1.546 0.000 . 1 . . . A 11 LEU HG . 19973 1
127 . 1 1 11 11 LEU HD11 H 1 0.881 0.000 . 2 . . . A 11 LEU HD11 . 19973 1
128 . 1 1 11 11 LEU HD12 H 1 0.881 0.000 . 2 . . . A 11 LEU HD12 . 19973 1
129 . 1 1 11 11 LEU HD13 H 1 0.881 0.000 . 2 . . . A 11 LEU HD13 . 19973 1
130 . 1 1 11 11 LEU HD21 H 1 0.812 0.000 . 2 . . . A 11 LEU HD21 . 19973 1
131 . 1 1 11 11 LEU HD22 H 1 0.812 0.000 . 2 . . . A 11 LEU HD22 . 19973 1
132 . 1 1 11 11 LEU HD23 H 1 0.812 0.000 . 2 . . . A 11 LEU HD23 . 19973 1
133 . 1 1 11 11 LEU CA C 13 55.101 0.000 . 1 . . . A 11 LEU CA . 19973 1
134 . 1 1 11 11 LEU CB C 13 42.305 0.000 . 1 . . . A 11 LEU CB . 19973 1
135 . 1 1 11 11 LEU CG C 13 26.738 0.000 . 1 . . . A 11 LEU CG . 19973 1
136 . 1 1 11 11 LEU CD1 C 13 24.833 0.000 . 2 . . . A 11 LEU CD1 . 19973 1
137 . 1 1 11 11 LEU CD2 C 13 23.310 0.000 . 2 . . . A 11 LEU CD2 . 19973 1
138 . 1 1 11 11 LEU N N 15 123.771 0.000 . 1 . . . A 11 LEU N . 19973 1
139 . 1 1 12 12 PHE H H 1 8.215 0.000 . 1 . . . A 12 PHE H . 19973 1
140 . 1 1 12 12 PHE HA H 1 4.584 0.000 . 1 . . . A 12 PHE HA . 19973 1
141 . 1 1 12 12 PHE HB2 H 1 3.154 0.000 . 2 . . . A 12 PHE HB2 . 19973 1
142 . 1 1 12 12 PHE HB3 H 1 2.981 0.000 . 2 . . . A 12 PHE HB3 . 19973 1
143 . 1 1 12 12 PHE HE1 H 1 7.287 0.000 . 1 . . . A 12 PHE HE1 . 19973 1
144 . 1 1 12 12 PHE HZ H 1 7.290 0.000 . 1 . . . A 12 PHE HZ . 19973 1
145 . 1 1 12 12 PHE CA C 13 57.242 0.000 . 1 . . . A 12 PHE CA . 19973 1
146 . 1 1 12 12 PHE CB C 13 39.793 0.000 . 1 . . . A 12 PHE CB . 19973 1
147 . 1 1 12 12 PHE CD1 C 13 131.947 0.000 . 1 . . . A 12 PHE CD1 . 19973 1
148 . 1 1 12 12 PHE CE1 C 13 129.829 0.000 . 1 . . . A 12 PHE CE1 . 19973 1
149 . 1 1 12 12 PHE CZ C 13 131.399 0.000 . 1 . . . A 12 PHE CZ . 19973 1
150 . 1 1 12 12 PHE N N 15 121.193 0.000 . 1 . . . A 12 PHE N . 19973 1
stop_
save_