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 52454
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'chem shift list 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 $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-15N HSQC' . . . 52454 1
2 '3D HNCO' . . . 52454 1
3 '3D HNCA' . . . 52454 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
1 $software_1 . . 52454 1
2 $software_2 . . 52454 1
3 $software_3 . . 52454 1
4 $software_4 . . 52454 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 GLY C C 13 170.504 0 . 1 . . . . . 422 GLY C . 52454 1
2 . 1 . 1 1 1 GLY CA C 13 43.616 0 . 1 . . . . . 422 GLY CA . 52454 1
3 . 1 . 1 2 2 SER H H 1 8.765 0 . 1 . . . . . 423 SER H . 52454 1
4 . 1 . 1 2 2 SER C C 13 175.014 0 . 1 . . . . . 423 SER C . 52454 1
5 . 1 . 1 2 2 SER CA C 13 58.674 0.01 . 1 . . . . . 423 SER CA . 52454 1
6 . 1 . 1 2 2 SER N N 15 115.885 0.02 . 1 . . . . . 423 SER N . 52454 1
7 . 1 . 1 3 3 GLY H H 1 8.59 0 . 1 . . . . . 424 GLY H . 52454 1
8 . 1 . 1 3 3 GLY C C 13 173.854 0 . 1 . . . . . 424 GLY C . 52454 1
9 . 1 . 1 3 3 GLY CA C 13 45.486 0 . 1 . . . . . 424 GLY CA . 52454 1
10 . 1 . 1 3 3 GLY N N 15 111.094 0.01 . 1 . . . . . 424 GLY N . 52454 1
11 . 1 . 1 4 4 LYS H H 1 8.195 0 . 1 . . . . . 425 LYS H . 52454 1
12 . 1 . 1 4 4 LYS C C 13 176.351 0 . 1 . . . . . 425 LYS C . 52454 1
13 . 1 . 1 4 4 LYS CA C 13 56.187 0 . 1 . . . . . 425 LYS CA . 52454 1
14 . 1 . 1 4 4 LYS N N 15 120.368 0.02 . 1 . . . . . 425 LYS N . 52454 1
15 . 1 . 1 5 5 THR H H 1 8.139 0 . 1 . . . . . 426 THR H . 52454 1
16 . 1 . 1 5 5 THR CA C 13 60.006 0 . 1 . . . . . 426 THR CA . 52454 1
17 . 1 . 1 5 5 THR N N 15 114.998 0.01 . 1 . . . . . 426 THR N . 52454 1
18 . 1 . 1 6 6 PRO C C 13 176.726 0 . 1 . . . . . 427 PRO C . 52454 1
19 . 1 . 1 6 6 PRO CA C 13 64.298 0 . 1 . . . . . 427 PRO CA . 52454 1
20 . 1 . 1 7 7 LEU H H 1 7.984 0 . 1 . . . . . 428 LEU H . 52454 1
21 . 1 . 1 7 7 LEU C C 13 178.078 0 . 1 . . . . . 428 LEU C . 52454 1
22 . 1 . 1 7 7 LEU CA C 13 56.692 0.01 . 1 . . . . . 428 LEU CA . 52454 1
23 . 1 . 1 7 7 LEU N N 15 117.61 0.03 . 1 . . . . . 428 LEU N . 52454 1
24 . 1 . 1 8 8 GLY H H 1 8.13 0 . 1 . . . . . 429 GLY H . 52454 1
25 . 1 . 1 8 8 GLY C C 13 174.575 0 . 1 . . . . . 429 GLY C . 52454 1
26 . 1 . 1 8 8 GLY CA C 13 46.088 0 . 1 . . . . . 429 GLY CA . 52454 1
27 . 1 . 1 8 8 GLY N N 15 105.757 0.01 . 1 . . . . . 429 GLY N . 52454 1
28 . 1 . 1 9 9 LEU H H 1 7.746 0 . 1 . . . . . 430 LEU H . 52454 1
29 . 1 . 1 9 9 LEU C C 13 177.136 0 . 1 . . . . . 430 LEU C . 52454 1
30 . 1 . 1 9 9 LEU CA C 13 55.627 0.03 . 1 . . . . . 430 LEU CA . 52454 1
31 . 1 . 1 9 9 LEU N N 15 119.206 0.01 . 1 . . . . . 430 LEU N . 52454 1
32 . 1 . 1 10 10 VAL H H 1 7.664 0 . 1 . . . . . 431 VAL H . 52454 1
33 . 1 . 1 10 10 VAL CA C 13 63.347 0 . 1 . . . . . 431 VAL CA . 52454 1
34 . 1 . 1 10 10 VAL N N 15 118.275 0.05 . 1 . . . . . 431 VAL N . 52454 1
35 . 1 . 1 12 12 LEU C C 13 179.257 0 . 1 . . . . . 433 LEU C . 52454 1
36 . 1 . 1 12 12 LEU CA C 13 58.04 0 . 1 . . . . . 433 LEU CA . 52454 1
37 . 1 . 1 13 13 PHE H H 1 8.144 0.01 . 1 . . . . . 434 PHE H . 52454 1
38 . 1 . 1 13 13 PHE C C 13 177.924 0 . 1 . . . . . 434 PHE C . 52454 1
39 . 1 . 1 13 13 PHE CA C 13 59.874 0.03 . 1 . . . . . 434 PHE CA . 52454 1
40 . 1 . 1 13 13 PHE N N 15 116.595 0.02 . 1 . . . . . 434 PHE N . 52454 1
41 . 1 . 1 14 14 VAL H H 1 7.764 0.01 . 1 . . . . . 435 VAL H . 52454 1
42 . 1 . 1 14 14 VAL C C 13 177.678 0 . 1 . . . . . 435 VAL C . 52454 1
43 . 1 . 1 14 14 VAL CA C 13 65.976 0 . 1 . . . . . 435 VAL CA . 52454 1
44 . 1 . 1 14 14 VAL N N 15 121.015 0.04 . 1 . . . . . 435 VAL N . 52454 1
45 . 1 . 1 15 15 PHE H H 1 7.867 0.01 . 1 . . . . . 436 PHE H . 52454 1
46 . 1 . 1 15 15 PHE C C 13 177.132 0 . 1 . . . . . 436 PHE C . 52454 1
47 . 1 . 1 15 15 PHE CA C 13 60.808 0.05 . 1 . . . . . 436 PHE CA . 52454 1
48 . 1 . 1 15 15 PHE N N 15 120.052 0.05 . 1 . . . . . 436 PHE N . 52454 1
49 . 1 . 1 16 16 SER H H 1 8.412 0 . 1 . . . . . 437 SER H . 52454 1
50 . 1 . 1 16 16 SER C C 13 177.032 0 . 1 . . . . . 437 SER C . 52454 1
51 . 1 . 1 16 16 SER CA C 13 61.525 0.03 . 1 . . . . . 437 SER CA . 52454 1
52 . 1 . 1 16 16 SER N N 15 114.206 0 . 1 . . . . . 437 SER N . 52454 1
53 . 1 . 1 17 17 THR H H 1 8.047 0 . 1 . . . . . 438 THR H . 52454 1
54 . 1 . 1 17 17 THR C C 13 175.938 0 . 1 . . . . . 438 THR C . 52454 1
55 . 1 . 1 17 17 THR CA C 13 66.095 0 . 1 . . . . . 438 THR CA . 52454 1
56 . 1 . 1 17 17 THR N N 15 116.959 0.05 . 1 . . . . . 438 THR N . 52454 1
57 . 1 . 1 18 18 SER H H 1 7.976 0.01 . 1 . . . . . 439 SER H . 52454 1
58 . 1 . 1 18 18 SER C C 13 175.251 0 . 1 . . . . . 439 SER C . 52454 1
59 . 1 . 1 18 18 SER CA C 13 63.142 0.05 . 1 . . . . . 439 SER CA . 52454 1
60 . 1 . 1 18 18 SER N N 15 117.549 0.04 . 1 . . . . . 439 SER N . 52454 1
61 . 1 . 1 19 19 PHE H H 1 8.187 0 . 1 . . . . . 440 PHE H . 52454 1
62 . 1 . 1 19 19 PHE C C 13 177.787 0 . 1 . . . . . 440 PHE C . 52454 1
63 . 1 . 1 19 19 PHE CA C 13 60.995 0 . 1 . . . . . 440 PHE CA . 52454 1
64 . 1 . 1 19 19 PHE N N 15 121.05 0.01 . 1 . . . . . 440 PHE N . 52454 1
65 . 1 . 1 20 20 TYR H H 1 7.991 0 . 1 . . . . . 441 TYR H . 52454 1
66 . 1 . 1 20 20 TYR C C 13 177.621 0 . 1 . . . . . 441 TYR C . 52454 1
67 . 1 . 1 20 20 TYR CA C 13 61.213 0.03 . 1 . . . . . 441 TYR CA . 52454 1
68 . 1 . 1 20 20 TYR N N 15 120.716 0.03 . 1 . . . . . 441 TYR N . 52454 1
69 . 1 . 1 21 21 LEU H H 1 8.062 0 . 1 . . . . . 442 LEU H . 52454 1
70 . 1 . 1 21 21 LEU C C 13 178.6 0 . 1 . . . . . 442 LEU C . 52454 1
71 . 1 . 1 21 21 LEU CA C 13 57.969 0.01 . 1 . . . . . 442 LEU CA . 52454 1
72 . 1 . 1 21 21 LEU N N 15 118.577 0.03 . 1 . . . . . 442 LEU N . 52454 1
73 . 1 . 1 22 22 ILE H H 1 8.267 0 . 1 . . . . . 443 ILE H . 52454 1
74 . 1 . 1 22 22 ILE C C 13 177.283 0 . 1 . . . . . 443 ILE C . 52454 1
75 . 1 . 1 22 22 ILE CA C 13 65.204 0 . 1 . . . . . 443 ILE CA . 52454 1
76 . 1 . 1 22 22 ILE N N 15 117.907 0.01 . 1 . . . . . 443 ILE N . 52454 1
77 . 1 . 1 23 23 SER H H 1 7.896 0 . 1 . . . . . 444 SER H . 52454 1
78 . 1 . 1 23 23 SER C C 13 176.972 0 . 1 . . . . . 444 SER C . 52454 1
79 . 1 . 1 23 23 SER CA C 13 62.351 0.03 . 1 . . . . . 444 SER CA . 52454 1
80 . 1 . 1 23 23 SER N N 15 114.799 0.02 . 1 . . . . . 444 SER N . 52454 1
81 . 1 . 1 24 24 ILE H H 1 7.663 0 . 1 . . . . . 445 ILE H . 52454 1
82 . 1 . 1 24 24 ILE C C 13 178.239 0 . 1 . . . . . 445 ILE C . 52454 1
83 . 1 . 1 24 24 ILE CA C 13 64.775 0.03 . 1 . . . . . 445 ILE CA . 52454 1
84 . 1 . 1 24 24 ILE N N 15 121.411 0.02 . 1 . . . . . 445 ILE N . 52454 1
85 . 1 . 1 25 25 PHE H H 1 8.108 0 . 1 . . . . . 446 PHE H . 52454 1
86 . 1 . 1 25 25 PHE C C 13 176.966 0 . 1 . . . . . 446 PHE C . 52454 1
87 . 1 . 1 25 25 PHE CA C 13 61.654 0.02 . 1 . . . . . 446 PHE CA . 52454 1
88 . 1 . 1 25 25 PHE N N 15 120.292 0.01 . 1 . . . . . 446 PHE N . 52454 1
89 . 1 . 1 26 26 LEU H H 1 8.482 0 . 1 . . . . . 447 LEU H . 52454 1
90 . 1 . 1 26 26 LEU C C 13 178.415 0 . 1 . . . . . 447 LEU C . 52454 1
91 . 1 . 1 26 26 LEU CA C 13 57.298 0 . 1 . . . . . 447 LEU CA . 52454 1
92 . 1 . 1 26 26 LEU N N 15 116.58 0.02 . 1 . . . . . 447 LEU N . 52454 1
93 . 1 . 1 27 27 HIS H H 1 7.74 0 . 1 . . . . . 448 HIS H . 52454 1
94 . 1 . 1 27 27 HIS C C 13 175.734 0 . 1 . . . . . 448 HIS C . 52454 1
95 . 1 . 1 27 27 HIS CA C 13 57.593 0.01 . 1 . . . . . 448 HIS CA . 52454 1
96 . 1 . 1 27 27 HIS N N 15 114.211 0 . 1 . . . . . 448 HIS N . 52454 1
97 . 1 . 1 28 28 LEU H H 1 7.893 0 . 1 . . . . . 449 LEU H . 52454 1
98 . 1 . 1 28 28 LEU C C 13 177.313 0 . 1 . . . . . 449 LEU C . 52454 1
99 . 1 . 1 28 28 LEU CA C 13 56.606 0.01 . 1 . . . . . 449 LEU CA . 52454 1
100 . 1 . 1 28 28 LEU N N 15 119.059 0.01 . 1 . . . . . 449 LEU N . 52454 1
101 . 1 . 1 29 29 VAL H H 1 7.57 0 . 1 . . . . . 450 VAL H . 52454 1
102 . 1 . 1 29 29 VAL C C 13 174.564 0 . 1 . . . . . 450 VAL C . 52454 1
103 . 1 . 1 29 29 VAL CA C 13 62.705 0.01 . 1 . . . . . 450 VAL CA . 52454 1
104 . 1 . 1 29 29 VAL N N 15 114.777 0.01 . 1 . . . . . 450 VAL N . 52454 1
105 . 1 . 1 30 30 LYS H H 1 7.539 0 . 1 . . . . . 451 LYS H . 52454 1
106 . 1 . 1 30 30 LYS C C 13 175.981 0 . 1 . . . . . 451 LYS C . 52454 1
107 . 1 . 1 30 30 LYS CA C 13 55.51 0.02 . 1 . . . . . 451 LYS CA . 52454 1
108 . 1 . 1 30 30 LYS N N 15 121.407 0.01 . 1 . . . . . 451 LYS N . 52454 1
109 . 1 . 1 31 31 ILE H H 1 8.012 0 . 1 . . . . . 452 ILE H . 52454 1
110 . 1 . 1 31 31 ILE CA C 13 59.952 0 . 1 . . . . . 452 ILE CA . 52454 1
111 . 1 . 1 31 31 ILE N N 15 122.084 0.01 . 1 . . . . . 452 ILE N . 52454 1
112 . 1 . 1 32 32 PRO C C 13 176.251 0 . 1 . . . . . 453 PRO C . 52454 1
113 . 1 . 1 32 32 PRO CA C 13 63.481 0 . 1 . . . . . 453 PRO CA . 52454 1
114 . 1 . 1 33 33 THR H H 1 7.895 0 . 1 . . . . . 454 THR H . 52454 1
115 . 1 . 1 33 33 THR C C 13 174.501 0 . 1 . . . . . 454 THR C . 52454 1
116 . 1 . 1 33 33 THR CA C 13 62.06 0 . 1 . . . . . 454 THR CA . 52454 1
117 . 1 . 1 33 33 THR N N 15 111.519 0.01 . 1 . . . . . 454 THR N . 52454 1
118 . 1 . 1 34 34 HIS H H 1 8.271 0 . 1 . . . . . 455 HIS H . 52454 1
119 . 1 . 1 34 34 HIS C C 13 174.18 0 . 1 . . . . . 455 HIS C . 52454 1
120 . 1 . 1 34 34 HIS CA C 13 55.454 0 . 1 . . . . . 455 HIS CA . 52454 1
121 . 1 . 1 34 34 HIS N N 15 118.827 0.02 . 1 . . . . . 455 HIS N . 52454 1
122 . 1 . 1 35 35 ARG H H 1 8.25 0 . 1 . . . . . 456 ARG H . 52454 1
123 . 1 . 1 35 35 ARG C C 13 175.653 0 . 1 . . . . . 456 ARG C . 52454 1
124 . 1 . 1 35 35 ARG CA C 13 56.201 0.01 . 1 . . . . . 456 ARG CA . 52454 1
125 . 1 . 1 35 35 ARG N N 15 120.35 0.02 . 1 . . . . . 456 ARG N . 52454 1
126 . 1 . 1 36 36 HIS H H 1 8.516 0 . 1 . . . . . 457 HIS H . 52454 1
127 . 1 . 1 36 36 HIS C C 13 174.178 0 . 1 . . . . . 457 HIS C . 52454 1
128 . 1 . 1 36 36 HIS CA C 13 55.407 0.01 . 1 . . . . . 457 HIS CA . 52454 1
129 . 1 . 1 36 36 HIS N N 15 119.218 0 . 1 . . . . . 457 HIS N . 52454 1
130 . 1 . 1 37 37 ILE H H 1 8.303 0 . 1 . . . . . 458 ILE H . 52454 1
131 . 1 . 1 37 37 ILE C C 13 175.582 0 . 1 . . . . . 458 ILE C . 52454 1
132 . 1 . 1 37 37 ILE CA C 13 61.768 0 . 1 . . . . . 458 ILE CA . 52454 1
133 . 1 . 1 37 37 ILE N N 15 122.427 0 . 1 . . . . . 458 ILE N . 52454 1
134 . 1 . 1 38 38 VAL H H 1 7.981 0 . 1 . . . . . 459 VAL H . 52454 1
135 . 1 . 1 38 38 VAL C C 13 175.991 0 . 1 . . . . . 459 VAL C . 52454 1
136 . 1 . 1 38 38 VAL CA C 13 62.151 0 . 1 . . . . . 459 VAL CA . 52454 1
137 . 1 . 1 38 38 VAL N N 15 121.208 0 . 1 . . . . . 459 VAL N . 52454 1
138 . 1 . 1 39 39 GLY H H 1 8.345 0 . 1 . . . . . 460 GLY H . 52454 1
139 . 1 . 1 39 39 GLY C C 13 173.094 0 . 1 . . . . . 460 GLY C . 52454 1
140 . 1 . 1 39 39 GLY CA C 13 45.362 0 . 1 . . . . . 460 GLY CA . 52454 1
141 . 1 . 1 39 39 GLY N N 15 112.18 0 . 1 . . . . . 460 GLY N . 52454 1
142 . 1 . 1 40 40 LYS H H 1 7.792 0 . 1 . . . . . 461 LYS H . 52454 1
143 . 1 . 1 40 40 LYS CA C 13 57.443 0 . 1 . . . . . 461 LYS CA . 52454 1
144 . 1 . 1 40 40 LYS N N 15 125.632 0.01 . 1 . . . . . 461 LYS N . 52454 1
stop_
save_