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 17159
_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-15N HSQC' . . . 17159 1
2 '3D HNCO' . . . 17159 1
3 '3D HN(CO)CA' . . . 17159 1
4 '3D HNCA' . . . 17159 1
5 '3D HCACO' . . . 17159 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 3 3 GLU H H 1 8.358 0.004 . 1 . . . . 3 E H . 17159 1
2 . 1 1 3 3 GLU C C 13 176.028 0.004 . 1 . . . . 3 E CO . 17159 1
3 . 1 1 3 3 GLU CA C 13 56.674 0.003 . 1 . . . . 3 E CA . 17159 1
4 . 1 1 3 3 GLU N N 15 120.146 0.009 . 1 . . . . 3 E N . 17159 1
5 . 1 1 4 4 PHE H H 1 8.180 0.000 . 1 . . . . 4 F H . 17159 1
6 . 1 1 4 4 PHE C C 13 175.254 0.021 . 1 . . . . 4 F CO . 17159 1
7 . 1 1 4 4 PHE CA C 13 57.638 0.008 . 1 . . . . 4 F CA . 17159 1
8 . 1 1 4 4 PHE N N 15 121.452 0.006 . 1 . . . . 4 F N . 17159 1
9 . 1 1 5 5 ARG H H 1 8.049 0.001 . 1 . . . . 5 R H . 17159 1
10 . 1 1 5 5 ARG C C 13 175.566 0.006 . 1 . . . . 5 R CO . 17159 1
11 . 1 1 5 5 ARG CA C 13 55.586 0.006 . 1 . . . . 5 R CA . 17159 1
12 . 1 1 5 5 ARG N N 15 123.404 0.033 . 1 . . . . 5 R N . 17159 1
13 . 1 1 7 7 ASP H H 1 8.266 0.001 . 1 . . . . 7 D H . 17159 1
14 . 1 1 7 7 ASP C C 13 175.053 0.021 . 1 . . . . 7 D CO . 17159 1
15 . 1 1 7 7 ASP CA C 13 54.177 0.006 . 1 . . . . 7 D CA . 17159 1
16 . 1 1 7 7 ASP N N 15 121.553 0.007 . 1 . . . . 7 D N . 17159 1
17 . 1 1 8 8 SER H H 1 8.279 0.002 . 1 . . . . 8 S H . 17159 1
18 . 1 1 8 8 SER C C 13 175.080 0.006 . 1 . . . . 8 S CO . 17159 1
19 . 1 1 8 8 SER CA C 13 58.971 0.003 . 1 . . . . 8 S CA . 17159 1
20 . 1 1 8 8 SER N N 15 116.252 0.008 . 1 . . . . 8 S N . 17159 1
21 . 1 1 9 9 GLY H H 1 8.422 0.004 . 1 . . . . 9 G H . 17159 1
22 . 1 1 9 9 GLY C C 13 173.923 0.014 . 1 . . . . 9 G CO . 17159 1
23 . 1 1 9 9 GLY CA C 13 45.368 0.052 . 1 . . . . 9 G CA . 17159 1
24 . 1 1 9 9 GLY N N 15 110.539 0.026 . 1 . . . . 9 G N . 17159 1
25 . 1 1 10 10 TYR H H 1 7.861 0.001 . 1 . . . . 10 Y H . 17159 1
26 . 1 1 10 10 TYR C C 13 175.618 0.007 . 1 . . . . 10 Y CO . 17159 1
27 . 1 1 10 10 TYR CA C 13 58.002 0.020 . 1 . . . . 10 Y CA . 17159 1
28 . 1 1 10 10 TYR N N 15 119.831 0.009 . 1 . . . . 10 Y N . 17159 1
29 . 1 1 11 11 GLU H H 1 8.276 0.001 . 1 . . . . 11 E H . 17159 1
30 . 1 1 11 11 GLU C C 13 176.039 0.025 . 1 . . . . 11 E CO . 17159 1
31 . 1 1 11 11 GLU CA C 13 56.484 0.001 . 1 . . . . 11 E CA . 17159 1
32 . 1 1 11 11 GLU N N 15 122.438 0.004 . 1 . . . . 11 E N . 17159 1
33 . 1 1 12 12 VAL H H 1 7.945 0.001 . 1 . . . . 12 V H . 17159 1
34 . 1 1 12 12 VAL C C 13 175.713 0.033 . 1 . . . . 12 V CO . 17159 1
35 . 1 1 12 12 VAL CA C 13 62.483 0.008 . 1 . . . . 12 V CA . 17159 1
36 . 1 1 12 12 VAL N N 15 120.612 0.024 . 1 . . . . 12 V N . 17159 1
37 . 1 1 13 13 HIS H H 1 8.187 0.007 . 1 . . . . 13 H H . 17159 1
38 . 1 1 13 13 HIS C C 13 174.969 0.006 . 1 . . . . 13 H CO . 17159 1
39 . 1 1 13 13 HIS CA C 13 55.944 0.006 . 1 . . . . 13 H CA . 17159 1
40 . 1 1 13 13 HIS N N 15 122.351 0.059 . 1 . . . . 13 H N . 17159 1
41 . 1 1 15 15 GLN H H 1 8.293 0.001 . 1 . . . . 15 Q H . 17159 1
42 . 1 1 15 15 GLN C C 13 175.214 0.003 . 1 . . . . 15 Q CO . 17159 1
43 . 1 1 15 15 GLN CA C 13 55.701 0.001 . 1 . . . . 15 Q CA . 17159 1
44 . 1 1 15 15 GLN N N 15 120.993 0.057 . 1 . . . . 15 Q N . 17159 1
45 . 1 1 16 16 LYS H H 1 8.371 0.001 . 1 . . . . 16 K H . 17159 1
46 . 1 1 16 16 LYS C C 13 175.207 0.005 . 1 . . . . 16 K CO . 17159 1
47 . 1 1 16 16 LYS CA C 13 56.383 0.017 . 1 . . . . 16 K CA . 17159 1
48 . 1 1 16 16 LYS N N 15 123.503 0.018 . 1 . . . . 16 K N . 17159 1
49 . 1 1 17 17 LEU H H 1 8.292 0.000 . 1 . . . . 17 L H . 17159 1
50 . 1 1 17 17 LEU C C 13 175.945 0.015 . 1 . . . . 17 L CO . 17159 1
51 . 1 1 17 17 LEU CA C 13 54.487 0.005 . 1 . . . . 17 L CA . 17159 1
52 . 1 1 17 17 LEU N N 15 124.409 0.030 . 1 . . . . 17 L N . 17159 1
53 . 1 1 18 18 VAL H H 1 8.350 0.001 . 1 . . . . 18 V H . 17159 1
54 . 1 1 18 18 VAL C C 13 174.868 0.000 . 1 . . . . 18 V CO . 17159 1
55 . 1 1 18 18 VAL CA C 13 61.284 0.022 . 1 . . . . 18 V CA . 17159 1
56 . 1 1 18 18 VAL N N 15 123.212 0.024 . 1 . . . . 18 V N . 17159 1
57 . 1 1 19 19 PHE H H 1 9.314 0.003 . 1 . . . . 19 F H . 17159 1
58 . 1 1 19 19 PHE C C 13 174.551 0.002 . 1 . . . . 19 F CO . 17159 1
59 . 1 1 19 19 PHE CA C 13 59.134 0.007 . 1 . . . . 19 F CA . 17159 1
60 . 1 1 19 19 PHE N N 15 127.548 0.050 . 1 . . . . 19 F N . 17159 1
61 . 1 1 20 20 PHE H H 1 8.659 0.004 . 1 . . . . 20 F H . 17159 1
62 . 1 1 20 20 PHE C C 13 171.764 0.016 . 1 . . . . 20 F CO . 17159 1
63 . 1 1 20 20 PHE CA C 13 55.382 0.003 . 1 . . . . 20 F CA . 17159 1
64 . 1 1 20 20 PHE N N 15 116.606 0.028 . 1 . . . . 20 F N . 17159 1
65 . 1 1 21 21 ALA H H 1 8.529 0.002 . 1 . . . . 21 A H . 17159 1
66 . 1 1 21 21 ALA C C 13 175.265 0.031 . 1 . . . . 21 A CO . 17159 1
67 . 1 1 21 21 ALA CA C 13 49.588 0.016 . 1 . . . . 21 A CA . 17159 1
68 . 1 1 21 21 ALA N N 15 119.144 0.065 . 1 . . . . 21 A N . 17159 1
69 . 1 1 22 22 GLU H H 1 9.360 0.002 . 1 . . . . 22 E H . 17159 1
70 . 1 1 22 22 GLU C C 13 175.224 0.010 . 1 . . . . 22 E CO . 17159 1
71 . 1 1 22 22 GLU CA C 13 54.246 0.003 . 1 . . . . 22 E CA . 17159 1
72 . 1 1 22 22 GLU N N 15 123.515 0.045 . 1 . . . . 22 E N . 17159 1
73 . 1 1 23 23 ASP H H 1 8.748 0.002 . 1 . . . . 23 D H . 17159 1
74 . 1 1 23 23 ASP C C 13 176.651 0.021 . 1 . . . . 23 D CO . 17159 1
75 . 1 1 23 23 ASP CA C 13 54.227 0.007 . 1 . . . . 23 D CA . 17159 1
76 . 1 1 23 23 ASP N N 15 126.602 0.027 . 1 . . . . 23 D N . 17159 1
77 . 1 1 24 24 VAL H H 1 8.420 0.002 . 1 . . . . 24 V H . 17159 1
78 . 1 1 24 24 VAL C C 13 177.062 0.006 . 1 . . . . 24 V CO . 17159 1
79 . 1 1 24 24 VAL CA C 13 62.281 0.016 . 1 . . . . 24 V CA . 17159 1
80 . 1 1 24 24 VAL N N 15 122.764 0.025 . 1 . . . . 24 V N . 17159 1
81 . 1 1 25 25 GLY H H 1 8.434 0.002 . 1 . . . . 25 G H . 17159 1
82 . 1 1 25 25 GLY C C 13 174.082 0.029 . 1 . . . . 25 G CO . 17159 1
83 . 1 1 25 25 GLY CA C 13 45.234 0.012 . 1 . . . . 25 G CA . 17159 1
84 . 1 1 25 25 GLY N N 15 110.653 0.030 . 1 . . . . 25 G N . 17159 1
85 . 1 1 26 26 SER H H 1 8.409 0.004 . 1 . . . . 26 S H . 17159 1
86 . 1 1 26 26 SER C C 13 174.709 0.000 . 1 . . . . 26 S CO . 17159 1
87 . 1 1 26 26 SER CA C 13 58.476 0.000 . 1 . . . . 26 S CA . 17159 1
88 . 1 1 26 26 SER N N 15 113.230 0.039 . 1 . . . . 26 S N . 17159 1
89 . 1 1 28 28 LYS H H 1 7.853 0.000 . 1 . . . . 28 K H . 17159 1
90 . 1 1 28 28 LYS C C 13 176.822 0.006 . 1 . . . . 28 K CO . 17159 1
91 . 1 1 28 28 LYS CA C 13 56.203 0.001 . 1 . . . . 28 K CA . 17159 1
92 . 1 1 28 28 LYS N N 15 117.651 0.011 . 1 . . . . 28 K N . 17159 1
93 . 1 1 29 29 GLY H H 1 8.138 0.001 . 1 . . . . 29 G H . 17159 1
94 . 1 1 29 29 GLY C C 13 172.297 0.003 . 1 . . . . 29 G CO . 17159 1
95 . 1 1 29 29 GLY CA C 13 45.159 0.001 . 1 . . . . 29 G CA . 17159 1
96 . 1 1 29 29 GLY N N 15 108.726 0.047 . 1 . . . . 29 G N . 17159 1
97 . 1 1 30 30 ALA H H 1 7.906 0.002 . 1 . . . . 30 A H . 17159 1
98 . 1 1 30 30 ALA C C 13 175.950 0.001 . 1 . . . . 30 A CO . 17159 1
99 . 1 1 30 30 ALA CA C 13 51.226 0.014 . 1 . . . . 30 A CA . 17159 1
100 . 1 1 30 30 ALA N N 15 121.726 0.014 . 1 . . . . 30 A N . 17159 1
101 . 1 1 31 31 ILE H H 1 8.607 0.002 . 1 . . . . 31 I H . 17159 1
102 . 1 1 31 31 ILE C C 13 174.248 0.009 . 1 . . . . 31 I CO . 17159 1
103 . 1 1 31 31 ILE CA C 13 59.627 0.005 . 1 . . . . 31 I CA . 17159 1
104 . 1 1 31 31 ILE N N 15 117.522 0.039 . 1 . . . . 31 I N . 17159 1
105 . 1 1 32 32 ILE H H 1 8.370 0.003 . 1 . . . . 32 I H . 17159 1
106 . 1 1 32 32 ILE C C 13 175.202 0.000 . 1 . . . . 32 I CO . 17159 1
107 . 1 1 32 32 ILE CA C 13 57.213 0.003 . 1 . . . . 32 I CA . 17159 1
108 . 1 1 32 32 ILE N N 15 123.855 0.061 . 1 . . . . 32 I N . 17159 1
109 . 1 1 33 33 GLY H H 1 7.595 0.003 . 1 . . . . 33 G H . 17159 1
110 . 1 1 33 33 GLY C C 13 169.339 0.018 . 1 . . . . 33 G CO . 17159 1
111 . 1 1 33 33 GLY CA C 13 44.356 0.002 . 1 . . . . 33 G CA . 17159 1
112 . 1 1 33 33 GLY N N 15 112.877 0.032 . 1 . . . . 33 G N . 17159 1
113 . 1 1 34 34 LEU H H 1 8.455 0.001 . 1 . . . . 34 L H . 17159 1
114 . 1 1 34 34 LEU C C 13 174.486 0.000 . 1 . . . . 34 L CO . 17159 1
115 . 1 1 34 34 LEU CA C 13 53.585 0.001 . 1 . . . . 34 L CA . 17159 1
116 . 1 1 34 34 LEU N N 15 116.284 0.019 . 1 . . . . 34 L N . 17159 1
117 . 1 1 35 35 MET H H 1 9.280 0.002 . 1 . . . . 35 M H . 17159 1
118 . 1 1 35 35 MET C C 13 175.119 0.003 . 1 . . . . 35 M CO . 17159 1
119 . 1 1 35 35 MET CA C 13 53.772 0.047 . 1 . . . . 35 M CA . 17159 1
120 . 1 1 35 35 MET N N 15 122.834 0.014 . 1 . . . . 35 M N . 17159 1
121 . 1 1 36 36 VAL H H 1 8.960 0.003 . 1 . . . . 36 V H . 17159 1
122 . 1 1 36 36 VAL C C 13 176.553 0.002 . 1 . . . . 36 V CO . 17159 1
123 . 1 1 36 36 VAL CA C 13 61.502 0.007 . 1 . . . . 36 V CA . 17159 1
124 . 1 1 36 36 VAL N N 15 127.341 0.017 . 1 . . . . 36 V N . 17159 1
125 . 1 1 37 37 GLY H H 1 8.771 0.002 . 1 . . . . 37 G H . 17159 1
126 . 1 1 37 37 GLY C C 13 173.834 0.006 . 1 . . . . 37 G CO . 17159 1
127 . 1 1 37 37 GLY CA C 13 45.444 0.004 . 1 . . . . 37 G CA . 17159 1
128 . 1 1 37 37 GLY N N 15 115.386 0.016 . 1 . . . . 37 G N . 17159 1
129 . 1 1 38 38 GLY H H 1 8.098 0.001 . 1 . . . . 38 G H . 17159 1
130 . 1 1 38 38 GLY C C 13 173.289 0.005 . 1 . . . . 38 G CO . 17159 1
131 . 1 1 38 38 GLY CA C 13 44.794 0.002 . 1 . . . . 38 G CA . 17159 1
132 . 1 1 38 38 GLY N N 15 107.275 0.005 . 1 . . . . 38 G N . 17159 1
133 . 1 1 39 39 VAL H H 1 7.924 0.001 . 1 . . . . 39 V H . 17159 1
134 . 1 1 39 39 VAL C C 13 175.162 0.003 . 1 . . . . 39 V CO . 17159 1
135 . 1 1 39 39 VAL CA C 13 62.117 0.006 . 1 . . . . 39 V CA . 17159 1
136 . 1 1 39 39 VAL N N 15 118.453 0.015 . 1 . . . . 39 V N . 17159 1
137 . 1 1 40 40 VAL H H 1 7.611 0.002 . 1 . . . . 40 V H . 17159 1
138 . 1 1 40 40 VAL C C 13 180.725 0.006 . 1 . . . . 40 V CO . 17159 1
139 . 1 1 40 40 VAL CA C 13 63.745 0.006 . 1 . . . . 40 V CA . 17159 1
140 . 1 1 40 40 VAL N N 15 127.502 0.011 . 1 . . . . 40 V N . 17159 1
stop_
save_