Content for NMR-STAR saveframe, "SubA_shifts"
save_SubA_shifts
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode SubA_shifts
_Assigned_chem_shift_list.Entry_ID 5860
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $cond_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 $sample_1 . 5860 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 ASN N N 15 116.219 0.2 . 1 . . . . . . . . 5860 1
2 . 1 1 1 1 ASN H H 1 7.450 0.01 . 1 . . . . . . . . 5860 1
3 . 1 1 1 1 ASN CA C 13 52.377 0.2 . 1 . . . . . . . . 5860 1
4 . 1 1 1 1 ASN HA H 1 4.708 0.01 . 1 . . . . . . . . 5860 1
5 . 1 1 1 1 ASN CB C 13 39.328 0.2 . 1 . . . . . . . . 5860 1
6 . 1 1 1 1 ASN HB3 H 1 2.491 0.01 . 2 . . . . . . . . 5860 1
7 . 1 1 1 1 ASN HB2 H 1 3.880 0.01 . 2 . . . . . . . . 5860 1
8 . 1 1 1 1 ASN ND2 N 15 107.758 0.2 . 1 . . . . . . . . 5860 1
9 . 1 1 1 1 ASN HD21 H 1 7.968 0.01 . 2 . . . . . . . . 5860 1
10 . 1 1 1 1 ASN HD22 H 1 7.092 0.01 . 2 . . . . . . . . 5860 1
11 . 1 1 2 2 LYS N N 15 127.218 0.2 . 1 . . . . . . . . 5860 1
12 . 1 1 2 2 LYS H H 1 9.257 0.01 . 1 . . . . . . . . 5860 1
13 . 1 1 2 2 LYS CA C 13 59.068 0.2 . 1 . . . . . . . . 5860 1
14 . 1 1 2 2 LYS HA H 1 3.933 0.01 . 1 . . . . . . . . 5860 1
15 . 1 1 2 2 LYS CB C 13 32.258 0.2 . 1 . . . . . . . . 5860 1
16 . 1 1 2 2 LYS HB3 H 1 1.836 0.01 . 2 . . . . . . . . 5860 1
17 . 1 1 2 2 LYS HB2 H 1 1.730 0.01 . 2 . . . . . . . . 5860 1
18 . 1 1 2 2 LYS CG C 13 25.692 0.2 . 1 . . . . . . . . 5860 1
19 . 1 1 2 2 LYS HG3 H 1 1.473 0.01 . 2 . . . . . . . . 5860 1
20 . 1 1 2 2 LYS HG2 H 1 1.581 0.01 . 2 . . . . . . . . 5860 1
21 . 1 1 2 2 LYS CD C 13 29.435 0.2 . 1 . . . . . . . . 5860 1
22 . 1 1 2 2 LYS HD2 H 1 1.618 0.01 . 2 . . . . . . . . 5860 1
23 . 1 1 2 2 LYS CE C 13 41.909 0.2 . 1 . . . . . . . . 5860 1
24 . 1 1 2 2 LYS HE2 H 1 2.887 0.01 . 2 . . . . . . . . 5860 1
25 . 1 1 3 3 GLY N N 15 105.736 0.2 . 1 . . . . . . . . 5860 1
26 . 1 1 3 3 GLY H H 1 9.133 0.01 . 1 . . . . . . . . 5860 1
27 . 1 1 3 3 GLY CA C 13 46.573 0.2 . 1 . . . . . . . . 5860 1
28 . 1 1 3 3 GLY HA3 H 1 3.749 0.01 . 2 . . . . . . . . 5860 1
29 . 1 1 3 3 GLY HA2 H 1 3.827 0.01 . 2 . . . . . . . . 5860 1
30 . 1 1 4 4 CYS N N 15 118.627 0.2 . 1 . . . . . . . . 5860 1
31 . 1 1 4 4 CYS H H 1 7.769 0.01 . 1 . . . . . . . . 5860 1
32 . 1 1 4 4 CYS CA C 13 57.701 0.2 . 1 . . . . . . . . 5860 1
33 . 1 1 4 4 CYS HA H 1 3.974 0.01 . 1 . . . . . . . . 5860 1
34 . 1 1 4 4 CYS CB C 13 33.339 0.2 . 1 . . . . . . . . 5860 1
35 . 1 1 4 4 CYS HB3 H 1 3.145 0.01 . 2 . . . . . . . . 5860 1
36 . 1 1 4 4 CYS HB2 H 1 3.453 0.01 . 2 . . . . . . . . 5860 1
37 . 1 1 5 5 ALA N N 15 120.179 0.2 . 1 . . . . . . . . 5860 1
38 . 1 1 5 5 ALA H H 1 7.827 0.01 . 1 . . . . . . . . 5860 1
39 . 1 1 5 5 ALA CA C 13 54.716 0.2 . 1 . . . . . . . . 5860 1
40 . 1 1 5 5 ALA HA H 1 4.104 0.01 . 1 . . . . . . . . 5860 1
41 . 1 1 5 5 ALA CB C 13 17.879 0.2 . 1 . . . . . . . . 5860 1
42 . 1 1 5 5 ALA HB1 H 1 1.474 0.01 . 1 . . . . . . . . 5860 1
43 . 1 1 5 5 ALA HB2 H 1 1.474 0.01 . 1 . . . . . . . . 5860 1
44 . 1 1 5 5 ALA HB3 H 1 1.474 0.01 . 1 . . . . . . . . 5860 1
45 . 1 1 6 6 THR N N 15 111.274 0.2 . 1 . . . . . . . . 5860 1
46 . 1 1 6 6 THR H H 1 7.783 0.01 . 1 . . . . . . . . 5860 1
47 . 1 1 6 6 THR CA C 13 65.206 0.2 . 1 . . . . . . . . 5860 1
48 . 1 1 6 6 THR HA H 1 3.895 0.01 . 1 . . . . . . . . 5860 1
49 . 1 1 6 6 THR CB C 13 68.745 0.2 . 1 . . . . . . . . 5860 1
50 . 1 1 6 6 THR HB H 1 4.128 0.01 . 1 . . . . . . . . 5860 1
51 . 1 1 6 6 THR CG2 C 13 21.609 0.2 . 1 . . . . . . . . 5860 1
52 . 1 1 6 6 THR HG21 H 1 1.237 0.01 . 1 . . . . . . . . 5860 1
53 . 1 1 6 6 THR HG22 H 1 1.237 0.01 . 1 . . . . . . . . 5860 1
54 . 1 1 6 6 THR HG23 H 1 1.237 0.01 . 1 . . . . . . . . 5860 1
55 . 1 1 7 7 CYS N N 15 117.128 0.2 . 1 . . . . . . . . 5860 1
56 . 1 1 7 7 CYS H H 1 7.147 0.01 . 1 . . . . . . . . 5860 1
57 . 1 1 7 7 CYS CA C 13 56.913 0.2 . 1 . . . . . . . . 5860 1
58 . 1 1 7 7 CYS HA H 1 4.025 0.01 . 1 . . . . . . . . 5860 1
59 . 1 1 7 7 CYS CB C 13 31.841 0.2 . 1 . . . . . . . . 5860 1
60 . 1 1 7 7 CYS HB3 H 1 3.610 0.01 . 2 . . . . . . . . 5860 1
61 . 1 1 7 7 CYS HB2 H 1 2.840 0.01 . 2 . . . . . . . . 5860 1
62 . 1 1 8 8 SER N N 15 116.232 0.2 . 1 . . . . . . . . 5860 1
63 . 1 1 8 8 SER H H 1 8.000 0.01 . 1 . . . . . . . . 5860 1
64 . 1 1 8 8 SER CA C 13 61.886 0.2 . 1 . . . . . . . . 5860 1
65 . 1 1 8 8 SER HA H 1 4.045 0.01 . 1 . . . . . . . . 5860 1
66 . 1 1 8 8 SER CB C 13 62.614 0.2 . 1 . . . . . . . . 5860 1
67 . 1 1 8 8 SER HB3 H 1 3.936 0.01 . 2 . . . . . . . . 5860 1
68 . 1 1 9 9 ILE N N 15 119.568 0.2 . 1 . . . . . . . . 5860 1
69 . 1 1 9 9 ILE H H 1 7.468 0.01 . 1 . . . . . . . . 5860 1
70 . 1 1 9 9 ILE CA C 13 62.826 0.2 . 1 . . . . . . . . 5860 1
71 . 1 1 9 9 ILE HA H 1 4.053 0.01 . 1 . . . . . . . . 5860 1
72 . 1 1 9 9 ILE CB C 13 38.438 0.2 . 1 . . . . . . . . 5860 1
73 . 1 1 9 9 ILE HB H 1 1.912 0.01 . 1 . . . . . . . . 5860 1
74 . 1 1 9 9 ILE CG1 C 13 27.658 0.2 . 1 . . . . . . . . 5860 1
75 . 1 1 9 9 ILE HG13 H 1 1.446 0.01 . 2 . . . . . . . . 5860 1
76 . 1 1 9 9 ILE HG12 H 1 1.450 0.01 . 2 . . . . . . . . 5860 1
77 . 1 1 9 9 ILE CD1 C 13 13.412 0.2 . 1 . . . . . . . . 5860 1
78 . 1 1 9 9 ILE HD11 H 1 0.875 0.01 . 1 . . . . . . . . 5860 1
79 . 1 1 9 9 ILE HD12 H 1 0.875 0.01 . 1 . . . . . . . . 5860 1
80 . 1 1 9 9 ILE HD13 H 1 0.875 0.01 . 1 . . . . . . . . 5860 1
81 . 1 1 9 9 ILE CG2 C 13 17.439 0.2 . 1 . . . . . . . . 5860 1
82 . 1 1 9 9 ILE HG21 H 1 0.935 0.01 . 1 . . . . . . . . 5860 1
83 . 1 1 9 9 ILE HG22 H 1 0.935 0.01 . 1 . . . . . . . . 5860 1
84 . 1 1 9 9 ILE HG23 H 1 0.935 0.01 . 1 . . . . . . . . 5860 1
85 . 1 1 10 10 GLY N N 15 106.889 0.2 . 1 . . . . . . . . 5860 1
86 . 1 1 10 10 GLY H H 1 7.948 0.01 . 1 . . . . . . . . 5860 1
87 . 1 1 10 10 GLY CA C 13 47.134 0.2 . 1 . . . . . . . . 5860 1
88 . 1 1 10 10 GLY HA3 H 1 3.455 0.01 . 2 . . . . . . . . 5860 1
89 . 1 1 10 10 GLY HA2 H 1 4.008 0.01 . 2 . . . . . . . . 5860 1
90 . 1 1 11 11 ALA N N 15 121.647 0.2 . 1 . . . . . . . . 5860 1
91 . 1 1 11 11 ALA H H 1 7.988 0.01 . 1 . . . . . . . . 5860 1
92 . 1 1 11 11 ALA CA C 13 54.686 0.2 . 1 . . . . . . . . 5860 1
93 . 1 1 11 11 ALA HA H 1 3.981 0.01 . 1 . . . . . . . . 5860 1
94 . 1 1 11 11 ALA CB C 13 17.697 0.2 . 1 . . . . . . . . 5860 1
95 . 1 1 11 11 ALA HB1 H 1 1.427 0.01 . 1 . . . . . . . . 5860 1
96 . 1 1 11 11 ALA HB2 H 1 1.427 0.01 . 1 . . . . . . . . 5860 1
97 . 1 1 11 11 ALA HB3 H 1 1.427 0.01 . 1 . . . . . . . . 5860 1
98 . 1 1 12 12 ALA N N 15 118.722 0.2 . 1 . . . . . . . . 5860 1
99 . 1 1 12 12 ALA H H 1 8.023 0.01 . 1 . . . . . . . . 5860 1
100 . 1 1 12 12 ALA CA C 13 54.664 0.2 . 1 . . . . . . . . 5860 1
101 . 1 1 12 12 ALA HA H 1 3.998 0.01 . 1 . . . . . . . . 5860 1
102 . 1 1 12 12 ALA CB C 13 17.434 0.2 . 1 . . . . . . . . 5860 1
103 . 1 1 12 12 ALA HB1 H 1 1.471 0.01 . 1 . . . . . . . . 5860 1
104 . 1 1 12 12 ALA HB2 H 1 1.471 0.01 . 1 . . . . . . . . 5860 1
105 . 1 1 12 12 ALA HB3 H 1 1.471 0.01 . 1 . . . . . . . . 5860 1
106 . 1 1 13 13 CYS N N 15 110.215 0.2 . 1 . . . . . . . . 5860 1
107 . 1 1 13 13 CYS H H 1 7.515 0.01 . 1 . . . . . . . . 5860 1
108 . 1 1 13 13 CYS CA C 13 56.141 0.2 . 1 . . . . . . . . 5860 1
109 . 1 1 13 13 CYS HA H 1 4.175 0.01 . 1 . . . . . . . . 5860 1
110 . 1 1 13 13 CYS CB C 13 32.111 0.2 . 1 . . . . . . . . 5860 1
111 . 1 1 13 13 CYS HB3 H 1 3.281 0.01 . 2 . . . . . . . . 5860 1
112 . 1 1 13 13 CYS HB2 H 1 3.492 0.01 . 2 . . . . . . . . 5860 1
113 . 1 1 14 14 LEU N N 15 125.160 0.2 . 1 . . . . . . . . 5860 1
114 . 1 1 14 14 LEU H H 1 8.073 0.01 . 1 . . . . . . . . 5860 1
115 . 1 1 14 14 LEU CA C 13 56.668 0.2 . 1 . . . . . . . . 5860 1
116 . 1 1 14 14 LEU HA H 1 4.222 0.01 . 1 . . . . . . . . 5860 1
117 . 1 1 14 14 LEU CB C 13 40.939 0.2 . 1 . . . . . . . . 5860 1
118 . 1 1 14 14 LEU HB3 H 1 1.904 0.01 . 2 . . . . . . . . 5860 1
119 . 1 1 14 14 LEU HB2 H 1 1.506 0.01 . 2 . . . . . . . . 5860 1
120 . 1 1 14 14 LEU CG C 13 27.597 0.2 . 1 . . . . . . . . 5860 1
121 . 1 1 14 14 LEU HG H 1 1.691 0.01 . 1 . . . . . . . . 5860 1
122 . 1 1 14 14 LEU CD1 C 13 24.815 0.2 . 4 . . . . . . . . 5860 1
123 . 1 1 14 14 LEU HD11 H 1 0.900 0.01 . 2 . . . . . . . . 5860 1
124 . 1 1 14 14 LEU HD12 H 1 0.900 0.01 . 2 . . . . . . . . 5860 1
125 . 1 1 14 14 LEU HD13 H 1 0.900 0.01 . 2 . . . . . . . . 5860 1
126 . 1 1 14 14 LEU CD2 C 13 22.353 0.2 . 4 . . . . . . . . 5860 1
127 . 1 1 14 14 LEU HD21 H 1 0.857 0.01 . 2 . . . . . . . . 5860 1
128 . 1 1 14 14 LEU HD22 H 1 0.857 0.01 . 2 . . . . . . . . 5860 1
129 . 1 1 14 14 LEU HD23 H 1 0.857 0.01 . 2 . . . . . . . . 5860 1
130 . 1 1 15 15 VAL N N 15 118.019 0.2 . 1 . . . . . . . . 5860 1
131 . 1 1 15 15 VAL H H 1 7.516 0.01 . 1 . . . . . . . . 5860 1
132 . 1 1 15 15 VAL CA C 13 65.064 0.2 . 1 . . . . . . . . 5860 1
133 . 1 1 15 15 VAL HA H 1 3.817 0.01 . 1 . . . . . . . . 5860 1
134 . 1 1 15 15 VAL CB C 13 31.525 0.2 . 1 . . . . . . . . 5860 1
135 . 1 1 15 15 VAL HB H 1 2.225 0.01 . 1 . . . . . . . . 5860 1
136 . 1 1 15 15 VAL CG2 C 13 20.872 0.2 . 4 . . . . . . . . 5860 1
137 . 1 1 15 15 VAL HG21 H 1 1.020 0.01 . 2 . . . . . . . . 5860 1
138 . 1 1 15 15 VAL HG22 H 1 1.020 0.01 . 2 . . . . . . . . 5860 1
139 . 1 1 15 15 VAL HG23 H 1 1.020 0.01 . 2 . . . . . . . . 5860 1
140 . 1 1 15 15 VAL CG1 C 13 20.123 0.2 . 4 . . . . . . . . 5860 1
141 . 1 1 15 15 VAL HG11 H 1 0.951 0.01 . 2 . . . . . . . . 5860 1
142 . 1 1 15 15 VAL HG12 H 1 0.951 0.01 . 2 . . . . . . . . 5860 1
143 . 1 1 15 15 VAL HG13 H 1 0.951 0.01 . 2 . . . . . . . . 5860 1
144 . 1 1 16 16 ASP N N 15 114.415 0.2 . 1 . . . . . . . . 5860 1
145 . 1 1 16 16 ASP H H 1 6.758 0.01 . 1 . . . . . . . . 5860 1
146 . 1 1 16 16 ASP CA C 13 50.473 0.2 . 1 . . . . . . . . 5860 1
147 . 1 1 16 16 ASP HA H 1 4.804 0.01 . 1 . . . . . . . . 5860 1
148 . 1 1 16 16 ASP CB C 13 38.405 0.2 . 1 . . . . . . . . 5860 1
149 . 1 1 16 16 ASP HB3 H 1 2.420 0.01 . 2 . . . . . . . . 5860 1
150 . 1 1 16 16 ASP HB2 H 1 3.197 0.01 . 2 . . . . . . . . 5860 1
151 . 1 1 17 17 GLY N N 15 104.272 0.2 . 1 . . . . . . . . 5860 1
152 . 1 1 17 17 GLY H H 1 7.897 0.01 . 1 . . . . . . . . 5860 1
153 . 1 1 17 17 GLY CA C 13 44.130 0.2 . 1 . . . . . . . . 5860 1
154 . 1 1 17 17 GLY HA3 H 1 3.727 0.01 . 2 . . . . . . . . 5860 1
155 . 1 1 17 17 GLY HA2 H 1 4.402 0.01 . 2 . . . . . . . . 5860 1
156 . 1 1 18 18 PRO CA C 13 63.577 0.2 . 1 . . . . . . . . 5860 1
157 . 1 1 18 18 PRO HA H 1 4.497 0.01 . 1 . . . . . . . . 5860 1
158 . 1 1 18 18 PRO CB C 13 30.965 0.2 . 1 . . . . . . . . 5860 1
159 . 1 1 18 18 PRO HB3 H 1 1.940 0.01 . 2 . . . . . . . . 5860 1
160 . 1 1 18 18 PRO HB2 H 1 2.093 0.01 . 2 . . . . . . . . 5860 1
161 . 1 1 18 18 PRO CG C 13 26.391 0.2 . 1 . . . . . . . . 5860 1
162 . 1 1 18 18 PRO HG3 H 1 1.753 0.01 . 2 . . . . . . . . 5860 1
163 . 1 1 18 18 PRO HG2 H 1 1.920 0.01 . 2 . . . . . . . . 5860 1
164 . 1 1 18 18 PRO CD C 13 49.738 0.2 . 1 . . . . . . . . 5860 1
165 . 1 1 18 18 PRO HD3 H 1 3.500 0.01 . 2 . . . . . . . . 5860 1
166 . 1 1 18 18 PRO HD2 H 1 3.765 0.01 . 2 . . . . . . . . 5860 1
167 . 1 1 19 19 ILE N N 15 121.987 0.2 . 1 . . . . . . . . 5860 1
168 . 1 1 19 19 ILE H H 1 7.067 0.01 . 1 . . . . . . . . 5860 1
169 . 1 1 19 19 ILE CA C 13 60.079 0.2 . 1 . . . . . . . . 5860 1
170 . 1 1 19 19 ILE HA H 1 4.036 0.01 . 1 . . . . . . . . 5860 1
171 . 1 1 19 19 ILE CB C 13 38.228 0.2 . 1 . . . . . . . . 5860 1
172 . 1 1 19 19 ILE HB H 1 1.563 0.01 . 1 . . . . . . . . 5860 1
173 . 1 1 19 19 ILE CG1 C 13 28.186 0.2 . 1 . . . . . . . . 5860 1
174 . 1 1 19 19 ILE HG13 H 1 1.543 0.01 . 2 . . . . . . . . 5860 1
175 . 1 1 19 19 ILE HG12 H 1 1.050 0.01 . 2 . . . . . . . . 5860 1
176 . 1 1 19 19 ILE CD1 C 13 12.892 0.2 . 1 . . . . . . . . 5860 1
177 . 1 1 19 19 ILE HD11 H 1 0.858 0.01 . 1 . . . . . . . . 5860 1
178 . 1 1 19 19 ILE HD12 H 1 0.858 0.01 . 1 . . . . . . . . 5860 1
179 . 1 1 19 19 ILE HD13 H 1 0.858 0.01 . 1 . . . . . . . . 5860 1
180 . 1 1 19 19 ILE CG2 C 13 16.157 0.2 . 1 . . . . . . . . 5860 1
181 . 1 1 19 19 ILE HG21 H 1 0.726 0.01 . 1 . . . . . . . . 5860 1
182 . 1 1 19 19 ILE HG22 H 1 0.726 0.01 . 1 . . . . . . . . 5860 1
183 . 1 1 19 19 ILE HG23 H 1 0.726 0.01 . 1 . . . . . . . . 5860 1
184 . 1 1 20 20 PRO CA C 13 63.046 0.2 . 1 . . . . . . . . 5860 1
185 . 1 1 20 20 PRO HA H 1 4.115 0.01 . 1 . . . . . . . . 5860 1
186 . 1 1 20 20 PRO CB C 13 30.602 0.2 . 1 . . . . . . . . 5860 1
187 . 1 1 20 20 PRO HB3 H 1 1.887 0.01 . 2 . . . . . . . . 5860 1
188 . 1 1 20 20 PRO HB2 H 1 1.952 0.01 . 2 . . . . . . . . 5860 1
189 . 1 1 20 20 PRO CG C 13 27.704 0.2 . 1 . . . . . . . . 5860 1
190 . 1 1 20 20 PRO HG3 H 1 2.281 0.01 . 2 . . . . . . . . 5860 1
191 . 1 1 20 20 PRO HG2 H 1 1.948 0.01 . 2 . . . . . . . . 5860 1
192 . 1 1 20 20 PRO CD C 13 51.552 0.2 . 1 . . . . . . . . 5860 1
193 . 1 1 20 20 PRO HD3 H 1 3.545 0.01 . 2 . . . . . . . . 5860 1
194 . 1 1 20 20 PRO HD2 H 1 3.873 0.01 . 2 . . . . . . . . 5860 1
195 . 1 1 21 21 ASP N N 15 122.249 0.2 . 1 . . . . . . . . 5860 1
196 . 1 1 21 21 ASP H H 1 8.917 0.01 . 1 . . . . . . . . 5860 1
197 . 1 1 21 21 ASP CA C 13 54.223 0.2 . 1 . . . . . . . . 5860 1
198 . 1 1 21 21 ASP HA H 1 4.447 0.01 . 1 . . . . . . . . 5860 1
199 . 1 1 21 21 ASP CB C 13 38.190 0.2 . 1 . . . . . . . . 5860 1
200 . 1 1 21 21 ASP HB3 H 1 2.244 0.01 . 2 . . . . . . . . 5860 1
201 . 1 1 21 21 ASP HB2 H 1 2.759 0.01 . 2 . . . . . . . . 5860 1
202 . 1 1 22 22 PHE N N 15 124.887 0.2 . 1 . . . . . . . . 5860 1
203 . 1 1 22 22 PHE H H 1 7.979 0.01 . 1 . . . . . . . . 5860 1
204 . 1 1 22 22 PHE CA C 13 69.380 0.2 . 1 . . . . . . . . 5860 1
205 . 1 1 22 22 PHE CB C 13 40.743 0.2 . 1 . . . . . . . . 5860 1
206 . 1 1 22 22 PHE HB3 H 1 3.752 0.01 . 2 . . . . . . . . 5860 1
207 . 1 1 22 22 PHE HB2 H 1 3.213 0.01 . 2 . . . . . . . . 5860 1
208 . 1 1 22 22 PHE HD1 H 1 7.120 0.01 . 3 . . . . . . . . 5860 1
209 . 1 1 23 23 GLU N N 15 120.458 0.2 . 1 . . . . . . . . 5860 1
210 . 1 1 23 23 GLU H H 1 10.482 0.01 . 1 . . . . . . . . 5860 1
211 . 1 1 23 23 GLU CA C 13 61.498 0.2 . 1 . . . . . . . . 5860 1
212 . 1 1 23 23 GLU HA H 1 3.853 0.01 . 1 . . . . . . . . 5860 1
213 . 1 1 23 23 GLU CB C 13 28.737 0.2 . 1 . . . . . . . . 5860 1
214 . 1 1 23 23 GLU HB3 H 1 1.729 0.01 . 2 . . . . . . . . 5860 1
215 . 1 1 23 23 GLU HB2 H 1 1.883 0.01 . 2 . . . . . . . . 5860 1
216 . 1 1 23 23 GLU CG C 13 36.879 0.2 . 1 . . . . . . . . 5860 1
217 . 1 1 23 23 GLU HG3 H 1 2.119 0.01 . 2 . . . . . . . . 5860 1
218 . 1 1 23 23 GLU HG2 H 1 2.514 0.01 . 2 . . . . . . . . 5860 1
219 . 1 1 24 24 ILE N N 15 117.787 0.2 . 1 . . . . . . . . 5860 1
220 . 1 1 24 24 ILE H H 1 7.771 0.01 . 1 . . . . . . . . 5860 1
221 . 1 1 24 24 ILE CA C 13 63.861 0.2 . 1 . . . . . . . . 5860 1
222 . 1 1 24 24 ILE HA H 1 3.791 0.01 . 1 . . . . . . . . 5860 1
223 . 1 1 24 24 ILE CB C 13 38.086 0.2 . 1 . . . . . . . . 5860 1
224 . 1 1 24 24 ILE HB H 1 1.908 0.01 . 1 . . . . . . . . 5860 1
225 . 1 1 24 24 ILE CG1 C 13 28.629 0.2 . 1 . . . . . . . . 5860 1
226 . 1 1 24 24 ILE HG13 H 1 1.323 0.01 . 2 . . . . . . . . 5860 1
227 . 1 1 24 24 ILE HG12 H 1 1.495 0.01 . 2 . . . . . . . . 5860 1
228 . 1 1 24 24 ILE CD1 C 13 17.093 0.2 . 1 . . . . . . . . 5860 1
229 . 1 1 24 24 ILE HD11 H 1 0.947 0.01 . 1 . . . . . . . . 5860 1
230 . 1 1 24 24 ILE HD12 H 1 0.947 0.01 . 1 . . . . . . . . 5860 1
231 . 1 1 24 24 ILE HD13 H 1 0.947 0.01 . 1 . . . . . . . . 5860 1
232 . 1 1 24 24 ILE CG2 C 13 20.030 0.2 . 1 . . . . . . . . 5860 1
233 . 1 1 24 24 ILE HG21 H 1 0.905 0.01 . 1 . . . . . . . . 5860 1
234 . 1 1 24 24 ILE HG22 H 1 0.905 0.01 . 1 . . . . . . . . 5860 1
235 . 1 1 24 24 ILE HG23 H 1 0.905 0.01 . 1 . . . . . . . . 5860 1
236 . 1 1 25 25 ALA N N 15 120.818 0.2 . 1 . . . . . . . . 5860 1
237 . 1 1 25 25 ALA H H 1 8.017 0.01 . 1 . . . . . . . . 5860 1
238 . 1 1 25 25 ALA CA C 13 53.946 0.2 . 1 . . . . . . . . 5860 1
239 . 1 1 25 25 ALA HA H 1 4.116 0.01 . 1 . . . . . . . . 5860 1
240 . 1 1 25 25 ALA CB C 13 17.953 0.2 . 1 . . . . . . . . 5860 1
241 . 1 1 25 25 ALA HB1 H 1 1.440 0.01 . 1 . . . . . . . . 5860 1
242 . 1 1 25 25 ALA HB2 H 1 1.440 0.01 . 1 . . . . . . . . 5860 1
243 . 1 1 25 25 ALA HB3 H 1 1.440 0.01 . 1 . . . . . . . . 5860 1
244 . 1 1 26 26 GLY N N 15 102.808 0.2 . 1 . . . . . . . . 5860 1
245 . 1 1 26 26 GLY H H 1 8.137 0.01 . 1 . . . . . . . . 5860 1
246 . 1 1 26 26 GLY CA C 13 45.993 0.2 . 1 . . . . . . . . 5860 1
247 . 1 1 26 26 GLY HA3 H 1 3.783 0.01 . 2 . . . . . . . . 5860 1
248 . 1 1 26 26 GLY HA2 H 1 4.228 0.01 . 2 . . . . . . . . 5860 1
249 . 1 1 27 27 ALA N N 15 123.622 0.2 . 1 . . . . . . . . 5860 1
250 . 1 1 27 27 ALA H H 1 7.748 0.01 . 1 . . . . . . . . 5860 1
251 . 1 1 27 27 ALA CA C 13 54.881 0.2 . 1 . . . . . . . . 5860 1
252 . 1 1 27 27 ALA HA H 1 3.946 0.01 . 1 . . . . . . . . 5860 1
253 . 1 1 27 27 ALA CB C 13 17.850 0.2 . 1 . . . . . . . . 5860 1
254 . 1 1 27 27 ALA HB1 H 1 1.429 0.01 . 1 . . . . . . . . 5860 1
255 . 1 1 27 27 ALA HB2 H 1 1.429 0.01 . 1 . . . . . . . . 5860 1
256 . 1 1 27 27 ALA HB3 H 1 1.429 0.01 . 1 . . . . . . . . 5860 1
257 . 1 1 28 28 THR N N 15 120.253 0.2 . 1 . . . . . . . . 5860 1
258 . 1 1 28 28 THR H H 1 8.105 0.01 . 1 . . . . . . . . 5860 1
259 . 1 1 28 28 THR CA C 13 72.797 0.2 . 1 . . . . . . . . 5860 1
260 . 1 1 28 28 THR CB C 13 70.885 0.2 . 1 . . . . . . . . 5860 1
261 . 1 1 28 28 THR HB H 1 4.228 0.01 . 1 . . . . . . . . 5860 1
262 . 1 1 28 28 THR CG2 C 13 18.425 0.2 . 1 . . . . . . . . 5860 1
263 . 1 1 28 28 THR HG21 H 1 0.995 0.01 . 1 . . . . . . . . 5860 1
264 . 1 1 28 28 THR HG22 H 1 0.995 0.01 . 1 . . . . . . . . 5860 1
265 . 1 1 28 28 THR HG23 H 1 0.995 0.01 . 1 . . . . . . . . 5860 1
266 . 1 1 29 29 GLY N N 15 108.686 0.2 . 1 . . . . . . . . 5860 1
267 . 1 1 29 29 GLY H H 1 8.115 0.01 . 1 . . . . . . . . 5860 1
268 . 1 1 29 29 GLY CA C 13 46.828 0.2 . 1 . . . . . . . . 5860 1
269 . 1 1 29 29 GLY HA3 H 1 3.889 0.01 . 2 . . . . . . . . 5860 1
270 . 1 1 29 29 GLY HA2 H 1 3.808 0.01 . 2 . . . . . . . . 5860 1
271 . 1 1 30 30 LEU N N 15 120.842 0.2 . 1 . . . . . . . . 5860 1
272 . 1 1 30 30 LEU H H 1 7.616 0.01 . 1 . . . . . . . . 5860 1
273 . 1 1 30 30 LEU CA C 13 57.845 0.2 . 1 . . . . . . . . 5860 1
274 . 1 1 30 30 LEU HA H 1 3.943 0.01 . 1 . . . . . . . . 5860 1
275 . 1 1 30 30 LEU CB C 13 42.402 0.2 . 1 . . . . . . . . 5860 1
276 . 1 1 30 30 LEU HB2 H 1 1.491 0.01 . 2 . . . . . . . . 5860 1
277 . 1 1 30 30 LEU CG C 13 27.057 0.2 . 1 . . . . . . . . 5860 1
278 . 1 1 30 30 LEU HG H 1 1.840 0.01 . 1 . . . . . . . . 5860 1
279 . 1 1 30 30 LEU CD1 C 13 25.476 0.2 . 4 . . . . . . . . 5860 1
280 . 1 1 30 30 LEU HD11 H 1 0.865 0.01 . 2 . . . . . . . . 5860 1
281 . 1 1 30 30 LEU HD12 H 1 0.865 0.01 . 2 . . . . . . . . 5860 1
282 . 1 1 30 30 LEU HD13 H 1 0.865 0.01 . 2 . . . . . . . . 5860 1
283 . 1 1 30 30 LEU CD2 C 13 24.985 0.2 . 4 . . . . . . . . 5860 1
284 . 1 1 30 30 LEU HD21 H 1 0.945 0.01 . 2 . . . . . . . . 5860 1
285 . 1 1 30 30 LEU HD22 H 1 0.945 0.01 . 2 . . . . . . . . 5860 1
286 . 1 1 30 30 LEU HD23 H 1 0.945 0.01 . 2 . . . . . . . . 5860 1
287 . 1 1 31 31 PHE N N 15 122.357 0.2 . 1 . . . . . . . . 5860 1
288 . 1 1 31 31 PHE H H 1 8.430 0.01 . 1 . . . . . . . . 5860 1
289 . 1 1 31 31 PHE CA C 13 69.821 0.2 . 1 . . . . . . . . 5860 1
290 . 1 1 31 31 PHE CB C 13 42.503 0.2 . 1 . . . . . . . . 5860 1
291 . 1 1 31 31 PHE HB3 H 1 3.896 0.01 . 2 . . . . . . . . 5860 1
292 . 1 1 31 31 PHE HB2 H 1 3.323 0.01 . 2 . . . . . . . . 5860 1
293 . 1 1 31 31 PHE HD1 H 1 6.997 0.01 . 3 . . . . . . . . 5860 1
294 . 1 1 31 31 PHE HE1 H 1 7.100 0.01 . 3 . . . . . . . . 5860 1
295 . 1 1 32 32 GLY N N 15 107.682 0.2 . 1 . . . . . . . . 5860 1
296 . 1 1 32 32 GLY H H 1 8.147 0.01 . 1 . . . . . . . . 5860 1
297 . 1 1 32 32 GLY CA C 13 47.161 0.2 . 1 . . . . . . . . 5860 1
298 . 1 1 32 32 GLY HA3 H 1 3.809 0.01 . 2 . . . . . . . . 5860 1
299 . 1 1 32 32 GLY HA2 H 1 4.014 0.01 . 2 . . . . . . . . 5860 1
300 . 1 1 33 33 LEU N N 15 120.187 0.2 . 1 . . . . . . . . 5860 1
301 . 1 1 33 33 LEU H H 1 7.893 0.01 . 1 . . . . . . . . 5860 1
302 . 1 1 33 33 LEU CA C 13 57.029 0.2 . 1 . . . . . . . . 5860 1
303 . 1 1 33 33 LEU HA H 1 3.977 0.01 . 1 . . . . . . . . 5860 1
304 . 1 1 33 33 LEU CB C 13 40.867 0.2 . 1 . . . . . . . . 5860 1
305 . 1 1 33 33 LEU HB3 H 1 1.188 0.01 . 2 . . . . . . . . 5860 1
306 . 1 1 33 33 LEU HB2 H 1 1.773 0.01 . 2 . . . . . . . . 5860 1
307 . 1 1 33 33 LEU CG C 13 27.187 0.2 . 1 . . . . . . . . 5860 1
308 . 1 1 33 33 LEU HG H 1 1.634 0.01 . 1 . . . . . . . . 5860 1
309 . 1 1 33 33 LEU CD1 C 13 22.219 0.2 . 4 . . . . . . . . 5860 1
310 . 1 1 33 33 LEU HD11 H 1 0.747 0.01 . 2 . . . . . . . . 5860 1
311 . 1 1 33 33 LEU HD12 H 1 0.747 0.01 . 2 . . . . . . . . 5860 1
312 . 1 1 33 33 LEU HD13 H 1 0.747 0.01 . 2 . . . . . . . . 5860 1
313 . 1 1 33 33 LEU CD2 C 13 25.199 0.2 . 4 . . . . . . . . 5860 1
314 . 1 1 33 33 LEU HD21 H 1 0.875 0.01 . 2 . . . . . . . . 5860 1
315 . 1 1 33 33 LEU HD22 H 1 0.875 0.01 . 2 . . . . . . . . 5860 1
316 . 1 1 33 33 LEU HD23 H 1 0.875 0.01 . 2 . . . . . . . . 5860 1
317 . 1 1 34 34 TRP N N 15 114.289 0.2 . 1 . . . . . . . . 5860 1
318 . 1 1 34 34 TRP H H 1 7.124 0.01 . 1 . . . . . . . . 5860 1
319 . 1 1 34 34 TRP CA C 13 56.045 0.2 . 1 . . . . . . . . 5860 1
320 . 1 1 34 34 TRP HA H 1 4.722 0.01 . 1 . . . . . . . . 5860 1
321 . 1 1 34 34 TRP CB C 13 29.924 0.2 . 1 . . . . . . . . 5860 1
322 . 1 1 34 34 TRP HB3 H 1 3.700 0.01 . 2 . . . . . . . . 5860 1
323 . 1 1 34 34 TRP HB2 H 1 2.985 0.01 . 2 . . . . . . . . 5860 1
324 . 1 1 34 34 TRP HD1 H 1 7.243 0.01 . 1 . . . . . . . . 5860 1
325 . 1 1 34 34 TRP NE1 N 15 127.108 0.2 . 1 . . . . . . . . 5860 1
326 . 1 1 34 34 TRP HE1 H 1 10.406 0.01 . 1 . . . . . . . . 5860 1
327 . 1 1 34 34 TRP HZ2 H 1 7.050 0.01 . 1 . . . . . . . . 5860 1
328 . 1 1 34 34 TRP HH2 H 1 7.457 0.01 . 1 . . . . . . . . 5860 1
329 . 1 1 34 34 TRP HZ3 H 1 6.895 0.01 . 1 . . . . . . . . 5860 1
330 . 1 1 34 34 TRP HE3 H 1 7.050 0.01 . 1 . . . . . . . . 5860 1
331 . 1 1 35 35 GLY N N 15 105.341 0.2 . 1 . . . . . . . . 5860 1
332 . 1 1 35 35 GLY H H 1 7.813 0.01 . 1 . . . . . . . . 5860 1
333 . 1 1 35 35 GLY CA C 13 45.836 0.2 . 1 . . . . . . . . 5860 1
334 . 1 1 35 35 GLY HA3 H 1 3.664 0.01 . 2 . . . . . . . . 5860 1
335 . 1 1 35 35 GLY HA2 H 1 4.038 0.01 . 2 . . . . . . . . 5860 1
stop_
loop_
_Ambiguous_atom_chem_shift.Ambiguous_shift_set_ID
_Ambiguous_atom_chem_shift.Atom_chem_shift_ID
_Ambiguous_atom_chem_shift.Entry_ID
_Ambiguous_atom_chem_shift.Assigned_chem_shift_list_ID
1 126 5860 1
1 122 5860 1
2 140 5860 1
2 136 5860 1
3 283 5860 1
3 279 5860 1
4 294 5860 1
4 293 5860 1
5 313 5860 1
5 309 5860 1
stop_
save_