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 51999
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name openB3701_b2m.str
_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-13C HMQC' . . . 51999 1
2 '3D Cm-CmHM NOESY-HMQC' . . . 51999 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 $software_2 . . 51999 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 2 2 ILE HD11 H 1 0.872 . . 1 . . . . . 2 I QD1 . 51999 1
2 . 1 . 1 2 2 ILE HD12 H 1 0.872 . . 1 . . . . . 2 I QD1 . 51999 1
3 . 1 . 1 2 2 ILE HD13 H 1 0.872 . . 1 . . . . . 2 I QD1 . 51999 1
4 . 1 . 1 2 2 ILE CD1 C 13 11.696 . . 1 . . . . . 2 I CD1 . 51999 1
5 . 1 . 1 8 8 ILE HD11 H 1 0.674 . . 1 . . . . . 8 I QD1 . 51999 1
6 . 1 . 1 8 8 ILE HD12 H 1 0.674 . . 1 . . . . . 8 I QD1 . 51999 1
7 . 1 . 1 8 8 ILE HD13 H 1 0.674 . . 1 . . . . . 8 I QD1 . 51999 1
8 . 1 . 1 8 8 ILE CD1 C 13 15.007 . . 1 . . . . . 8 I CD1 . 51999 1
9 . 1 . 1 10 10 VAL HG11 H 1 0.990 . . 1 . . . . . 10 V QG1 . 51999 1
10 . 1 . 1 10 10 VAL HG12 H 1 0.990 . . 1 . . . . . 10 V QG1 . 51999 1
11 . 1 . 1 10 10 VAL HG13 H 1 0.990 . . 1 . . . . . 10 V QG1 . 51999 1
12 . 1 . 1 10 10 VAL HG21 H 1 1.005 . . 1 . . . . . 10 V QG2 . 51999 1
13 . 1 . 1 10 10 VAL HG22 H 1 1.005 . . 1 . . . . . 10 V QG2 . 51999 1
14 . 1 . 1 10 10 VAL HG23 H 1 1.005 . . 1 . . . . . 10 V QG2 . 51999 1
15 . 1 . 1 10 10 VAL CG1 C 13 20.595 . . 1 . . . . . 10 V CG1 . 51999 1
16 . 1 . 1 10 10 VAL CG2 C 13 23.966 . . 1 . . . . . 10 V CG2 . 51999 1
17 . 1 . 1 16 16 ALA HB1 H 1 1.681 . . 1 . . . . . 16 A HB# . 51999 1
18 . 1 . 1 16 16 ALA HB2 H 1 1.681 . . 1 . . . . . 16 A HB# . 51999 1
19 . 1 . 1 16 16 ALA HB3 H 1 1.681 . . 1 . . . . . 16 A HB# . 51999 1
20 . 1 . 1 24 24 LEU HD11 H 1 -0.003 . . 1 . . . . . 24 L QD1 . 51999 1
21 . 1 . 1 24 24 LEU HD12 H 1 -0.003 . . 1 . . . . . 24 L QD1 . 51999 1
22 . 1 . 1 24 24 LEU HD13 H 1 -0.003 . . 1 . . . . . 24 L QD1 . 51999 1
23 . 1 . 1 24 24 LEU HD21 H 1 -0.662 . . 1 . . . . . 24 L QD2 . 51999 1
24 . 1 . 1 24 24 LEU HD22 H 1 -0.662 . . 1 . . . . . 24 L QD2 . 51999 1
25 . 1 . 1 24 24 LEU HD23 H 1 -0.662 . . 1 . . . . . 24 L QD2 . 51999 1
26 . 1 . 1 24 24 LEU CD1 C 13 26.239 . . 1 . . . . . 24 L CD1 . 51999 1
27 . 1 . 1 24 24 LEU CD2 C 13 20.423 . . 1 . . . . . 24 L CD2 . 51999 1
28 . 1 . 1 28 28 VAL HG11 H 1 1.015 . . 1 . . . . . 28 V QG1 . 51999 1
29 . 1 . 1 28 28 VAL HG12 H 1 1.015 . . 1 . . . . . 28 V QG1 . 51999 1
30 . 1 . 1 28 28 VAL HG13 H 1 1.015 . . 1 . . . . . 28 V QG1 . 51999 1
31 . 1 . 1 28 28 VAL HG21 H 1 0.751 . . 1 . . . . . 28 V QG2 . 51999 1
32 . 1 . 1 28 28 VAL HG22 H 1 0.751 . . 1 . . . . . 28 V QG2 . 51999 1
33 . 1 . 1 28 28 VAL HG23 H 1 0.751 . . 1 . . . . . 28 V QG2 . 51999 1
34 . 1 . 1 28 28 VAL CG1 C 13 21.026 . . 1 . . . . . 28 V CG1 . 51999 1
35 . 1 . 1 28 28 VAL CG2 C 13 23.721 . . 1 . . . . . 28 V CG2 . 51999 1
36 . 1 . 1 36 36 ILE HD11 H 1 -0.533 . . 1 . . . . . 36 I QD1 . 51999 1
37 . 1 . 1 36 36 ILE HD12 H 1 -0.533 . . 1 . . . . . 36 I QD1 . 51999 1
38 . 1 . 1 36 36 ILE HD13 H 1 -0.533 . . 1 . . . . . 36 I QD1 . 51999 1
39 . 1 . 1 36 36 ILE CD1 C 13 12.630 . . 1 . . . . . 36 I CD1 . 51999 1
40 . 1 . 1 38 38 VAL HG11 H 1 0.217 . . 1 . . . . . 38 V QG1 . 51999 1
41 . 1 . 1 38 38 VAL HG12 H 1 0.217 . . 1 . . . . . 38 V QG1 . 51999 1
42 . 1 . 1 38 38 VAL HG13 H 1 0.217 . . 1 . . . . . 38 V QG1 . 51999 1
43 . 1 . 1 38 38 VAL HG21 H 1 0.402 . . 1 . . . . . 38 V QG2 . 51999 1
44 . 1 . 1 38 38 VAL HG22 H 1 0.402 . . 1 . . . . . 38 V QG2 . 51999 1
45 . 1 . 1 38 38 VAL HG23 H 1 0.402 . . 1 . . . . . 38 V QG2 . 51999 1
46 . 1 . 1 38 38 VAL CG1 C 13 21.753 . . 1 . . . . . 38 V CG1 . 51999 1
47 . 1 . 1 38 38 VAL CG2 C 13 22.004 . . 1 . . . . . 38 V CG2 . 51999 1
48 . 1 . 1 40 40 LEU HD11 H 1 0.733 . . 1 . . . . . 40 L QD1 . 51999 1
49 . 1 . 1 40 40 LEU HD12 H 1 0.733 . . 1 . . . . . 40 L QD1 . 51999 1
50 . 1 . 1 40 40 LEU HD13 H 1 0.733 . . 1 . . . . . 40 L QD1 . 51999 1
51 . 1 . 1 40 40 LEU HD21 H 1 0.711 . . 1 . . . . . 40 L QD2 . 51999 1
52 . 1 . 1 40 40 LEU HD22 H 1 0.711 . . 1 . . . . . 40 L QD2 . 51999 1
53 . 1 . 1 40 40 LEU HD23 H 1 0.711 . . 1 . . . . . 40 L QD2 . 51999 1
54 . 1 . 1 40 40 LEU CD1 C 13 24.655 . . 1 . . . . . 40 L CD1 . 51999 1
55 . 1 . 1 40 40 LEU CD2 C 13 26.216 . . 1 . . . . . 40 L CD2 . 51999 1
56 . 1 . 1 41 41 LEU HD11 H 1 0.581 . . 1 . . . . . 41 L QD1 . 51999 1
57 . 1 . 1 41 41 LEU HD12 H 1 0.581 . . 1 . . . . . 41 L QD1 . 51999 1
58 . 1 . 1 41 41 LEU HD13 H 1 0.581 . . 1 . . . . . 41 L QD1 . 51999 1
59 . 1 . 1 41 41 LEU HD21 H 1 0.394 . . 1 . . . . . 41 L QD2 . 51999 1
60 . 1 . 1 41 41 LEU HD22 H 1 0.394 . . 1 . . . . . 41 L QD2 . 51999 1
61 . 1 . 1 41 41 LEU HD23 H 1 0.394 . . 1 . . . . . 41 L QD2 . 51999 1
62 . 1 . 1 41 41 LEU CD1 C 13 25.765 . . 1 . . . . . 41 L CD1 . 51999 1
63 . 1 . 1 41 41 LEU CD2 C 13 22.518 . . 1 . . . . . 41 L CD2 . 51999 1
64 . 1 . 1 47 47 ILE HD11 H 1 0.818 . . 1 . . . . . 47 I QD1 . 51999 1
65 . 1 . 1 47 47 ILE HD12 H 1 0.818 . . 1 . . . . . 47 I QD1 . 51999 1
66 . 1 . 1 47 47 ILE HD13 H 1 0.818 . . 1 . . . . . 47 I QD1 . 51999 1
67 . 1 . 1 47 47 ILE CD1 C 13 13.658 . . 1 . . . . . 47 I CD1 . 51999 1
68 . 1 . 1 50 50 VAL HG11 H 1 1.127 . . 1 . . . . . 50 V QG1 . 51999 1
69 . 1 . 1 50 50 VAL HG12 H 1 1.127 . . 1 . . . . . 50 V QG1 . 51999 1
70 . 1 . 1 50 50 VAL HG13 H 1 1.127 . . 1 . . . . . 50 V QG1 . 51999 1
71 . 1 . 1 50 50 VAL HG21 H 1 0.987 . . 1 . . . . . 50 V QG2 . 51999 1
72 . 1 . 1 50 50 VAL HG22 H 1 0.987 . . 1 . . . . . 50 V QG2 . 51999 1
73 . 1 . 1 50 50 VAL HG23 H 1 0.987 . . 1 . . . . . 50 V QG2 . 51999 1
74 . 1 . 1 50 50 VAL CG1 C 13 22.387 . . 1 . . . . . 50 V CG1 . 51999 1
75 . 1 . 1 50 50 VAL CG2 C 13 22.182 . . 1 . . . . . 50 V CG2 . 51999 1
76 . 1 . 1 55 55 LEU HD11 H 1 1.011 . . 2 . . . . . 55 L QD1 . 51999 1
77 . 1 . 1 55 55 LEU HD12 H 1 1.011 . . 2 . . . . . 55 L QD1 . 51999 1
78 . 1 . 1 55 55 LEU HD13 H 1 1.011 . . 2 . . . . . 55 L QD1 . 51999 1
79 . 1 . 1 55 55 LEU HD21 H 1 0.582 . . 2 . . . . . 55 L QD2 . 51999 1
80 . 1 . 1 55 55 LEU HD22 H 1 0.582 . . 2 . . . . . 55 L QD2 . 51999 1
81 . 1 . 1 55 55 LEU HD23 H 1 0.582 . . 2 . . . . . 55 L QD2 . 51999 1
82 . 1 . 1 55 55 LEU CD1 C 13 23.651 . . 2 . . . . . 55 L CD1 . 51999 1
83 . 1 . 1 55 55 LEU CD2 C 13 25.049 . . 2 . . . . . 55 L CD2 . 51999 1
84 . 1 . 1 65 65 LEU HD11 H 1 0.996 . . 1 . . . . . 65 L QD1 . 51999 1
85 . 1 . 1 65 65 LEU HD12 H 1 0.996 . . 1 . . . . . 65 L QD1 . 51999 1
86 . 1 . 1 65 65 LEU HD13 H 1 0.996 . . 1 . . . . . 65 L QD1 . 51999 1
87 . 1 . 1 65 65 LEU HD21 H 1 1.059 . . 1 . . . . . 65 L QD2 . 51999 1
88 . 1 . 1 65 65 LEU HD22 H 1 1.059 . . 1 . . . . . 65 L QD2 . 51999 1
89 . 1 . 1 65 65 LEU HD23 H 1 1.059 . . 1 . . . . . 65 L QD2 . 51999 1
90 . 1 . 1 65 65 LEU CD1 C 13 25.524 . . 1 . . . . . 65 L CD1 . 51999 1
91 . 1 . 1 65 65 LEU CD2 C 13 27.099 . . 1 . . . . . 65 L CD2 . 51999 1
92 . 1 . 1 66 66 LEU HD11 H 1 0.924 . . 1 . . . . . 66 L QD1 . 51999 1
93 . 1 . 1 66 66 LEU HD12 H 1 0.924 . . 1 . . . . . 66 L QD1 . 51999 1
94 . 1 . 1 66 66 LEU HD13 H 1 0.924 . . 1 . . . . . 66 L QD1 . 51999 1
95 . 1 . 1 66 66 LEU HD21 H 1 0.727 . . 1 . . . . . 66 L QD2 . 51999 1
96 . 1 . 1 66 66 LEU HD22 H 1 0.727 . . 1 . . . . . 66 L QD2 . 51999 1
97 . 1 . 1 66 66 LEU HD23 H 1 0.727 . . 1 . . . . . 66 L QD2 . 51999 1
98 . 1 . 1 66 66 LEU CD1 C 13 22.732 . . 1 . . . . . 66 L CD1 . 51999 1
99 . 1 . 1 66 66 LEU CD2 C 13 25.686 . . 1 . . . . . 66 L CD2 . 51999 1
100 . 1 . 1 80 80 ALA HB1 H 1 1.216 . . 1 . . . . . 80 A HB# . 51999 1
101 . 1 . 1 80 80 ALA HB2 H 1 1.216 . . 1 . . . . . 80 A HB# . 51999 1
102 . 1 . 1 80 80 ALA HB3 H 1 1.216 . . 1 . . . . . 80 A HB# . 51999 1
103 . 1 . 1 83 83 VAL HG11 H 1 0.546 . . 1 . . . . . 83 V QG1 . 51999 1
104 . 1 . 1 83 83 VAL HG12 H 1 0.546 . . 1 . . . . . 83 V QG1 . 51999 1
105 . 1 . 1 83 83 VAL HG13 H 1 0.546 . . 1 . . . . . 83 V QG1 . 51999 1
106 . 1 . 1 83 83 VAL HG21 H 1 0.760 . . 1 . . . . . 83 V QG2 . 51999 1
107 . 1 . 1 83 83 VAL HG22 H 1 0.760 . . 1 . . . . . 83 V QG2 . 51999 1
108 . 1 . 1 83 83 VAL HG23 H 1 0.760 . . 1 . . . . . 83 V QG2 . 51999 1
109 . 1 . 1 83 83 VAL CG1 C 13 21.197 . . 1 . . . . . 83 V CG1 . 51999 1
110 . 1 . 1 83 83 VAL CG2 C 13 22.914 . . 1 . . . . . 83 V CG2 . 51999 1
111 . 1 . 1 86 86 VAL HG11 H 1 0.539 . . 1 . . . . . 86 V QG1 . 51999 1
112 . 1 . 1 86 86 VAL HG12 H 1 0.539 . . 1 . . . . . 86 V QG1 . 51999 1
113 . 1 . 1 86 86 VAL HG13 H 1 0.539 . . 1 . . . . . 86 V QG1 . 51999 1
114 . 1 . 1 86 86 VAL HG21 H 1 0.818 . . 1 . . . . . 86 V QG2 . 51999 1
115 . 1 . 1 86 86 VAL HG22 H 1 0.818 . . 1 . . . . . 86 V QG2 . 51999 1
116 . 1 . 1 86 86 VAL HG23 H 1 0.818 . . 1 . . . . . 86 V QG2 . 51999 1
117 . 1 . 1 86 86 VAL CG1 C 13 19.411 . . 1 . . . . . 86 V CG1 . 51999 1
118 . 1 . 1 86 86 VAL CG2 C 13 20.546 . . 1 . . . . . 86 V CG2 . 51999 1
119 . 1 . 1 88 88 LEU HD11 H 1 0.915 . . 1 . . . . . 88 L QD1 . 51999 1
120 . 1 . 1 88 88 LEU HD12 H 1 0.915 . . 1 . . . . . 88 L QD1 . 51999 1
121 . 1 . 1 88 88 LEU HD13 H 1 0.915 . . 1 . . . . . 88 L QD1 . 51999 1
122 . 1 . 1 88 88 LEU HD21 H 1 0.934 . . 1 . . . . . 88 L QD2 . 51999 1
123 . 1 . 1 88 88 LEU HD22 H 1 0.934 . . 1 . . . . . 88 L QD2 . 51999 1
124 . 1 . 1 88 88 LEU HD23 H 1 0.934 . . 1 . . . . . 88 L QD2 . 51999 1
125 . 1 . 1 88 88 LEU CD1 C 13 26.277 . . 1 . . . . . 88 L CD1 . 51999 1
126 . 1 . 1 88 88 LEU CD2 C 13 23.137 . . 1 . . . . . 88 L CD2 . 51999 1
127 . 1 . 1 93 93 ILE HD11 H 1 0.726 . . 1 . . . . . 93 I QD1 . 51999 1
128 . 1 . 1 93 93 ILE HD12 H 1 0.726 . . 1 . . . . . 93 I QD1 . 51999 1
129 . 1 . 1 93 93 ILE HD13 H 1 0.726 . . 1 . . . . . 93 I QD1 . 51999 1
130 . 1 . 1 93 93 ILE CD1 C 13 12.984 . . 1 . . . . . 93 I CD1 . 51999 1
131 . 1 . 1 94 94 VAL HG11 H 1 1.055 . . 1 . . . . . 94 V QG1 . 51999 1
132 . 1 . 1 94 94 VAL HG12 H 1 1.055 . . 1 . . . . . 94 V QG1 . 51999 1
133 . 1 . 1 94 94 VAL HG13 H 1 1.055 . . 1 . . . . . 94 V QG1 . 51999 1
134 . 1 . 1 94 94 VAL HG21 H 1 0.893 . . 1 . . . . . 94 V QG2 . 51999 1
135 . 1 . 1 94 94 VAL HG22 H 1 0.893 . . 1 . . . . . 94 V QG2 . 51999 1
136 . 1 . 1 94 94 VAL HG23 H 1 0.893 . . 1 . . . . . 94 V QG2 . 51999 1
137 . 1 . 1 94 94 VAL CG1 C 13 21.451 . . 1 . . . . . 94 V CG1 . 51999 1
138 . 1 . 1 94 94 VAL CG2 C 13 21.468 . . 1 . . . . . 94 V CG2 . 51999 1
stop_
save_