Content for NMR-STAR saveframe, assigned_chemical_shifts_2
save_assigned_chemical_shifts_2
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_2
_Assigned_chem_shift_list.Entry_ID 53520
_Assigned_chem_shift_list.ID 2
_Assigned_chem_shift_list.Name assigned_chemical_shifts_NTD_15C
_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
6 '3D HNCO' . . . 53520 2
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 . . 53520 2
2 $software_2 . . 53520 2
3 $software_3 . . 53520 2
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 ALA H H 1 8.583409665 . . 1 . . . . . 2 ALA H . 53520 2
2 . 1 . 1 2 2 ALA N N 15 127.3577565 . . 1 . . . . . 2 ALA N . 53520 2
3 . 1 . 1 3 3 ALA H H 1 8.332628045 . . 1 . . . . . 3 ALA H . 53520 2
4 . 1 . 1 3 3 ALA N N 15 124.4192392 . . 1 . . . . . 3 ALA N . 53520 2
5 . 1 . 1 4 4 ARG H H 1 8.277262688 . . 1 . . . . . 4 ARG H . 53520 2
6 . 1 . 1 4 4 ARG N N 15 121.019783 . . 1 . . . . . 4 ARG N . 53520 2
7 . 1 . 1 5 5 ARG H H 1 8.301279068 . . 1 . . . . . 5 ARG H . 53520 2
8 . 1 . 1 5 5 ARG N N 15 123.0884705 . . 1 . . . . . 5 ARG N . 53520 2
9 . 1 . 1 6 6 ARG H H 1 8.365543365 . . 1 . . . . . 6 ARG H . 53520 2
10 . 1 . 1 6 6 ARG N N 15 123.405014 . . 1 . . . . . 6 ARG N . 53520 2
11 . 1 . 1 7 7 ARG H H 1 8.401126862 . . 1 . . . . . 7 ARG H . 53520 2
12 . 1 . 1 7 7 ARG N N 15 123.3561859 . . 1 . . . . . 7 ARG N . 53520 2
13 . 1 . 1 8 8 SER H H 1 8.399643898 . . 1 . . . . . 8 SER H . 53520 2
14 . 1 . 1 8 8 SER N N 15 117.9567108 . . 1 . . . . . 8 SER N . 53520 2
15 . 1 . 1 9 9 THR H H 1 8.186331749 . . 1 . . . . . 9 THR H . 53520 2
16 . 1 . 1 9 9 THR N N 15 115.6072845 . . 1 . . . . . 9 THR N . 53520 2
17 . 1 . 1 10 10 GLY H H 1 8.332051277 . . 1 . . . . . 10 GLY H . 53520 2
18 . 1 . 1 10 10 GLY N N 15 110.8127441 . . 1 . . . . . 10 GLY N . 53520 2
19 . 1 . 1 11 11 GLY H H 1 8.251099586 . . 1 . . . . . 11 GLY H . 53520 2
20 . 1 . 1 11 11 GLY N N 15 108.7943649 . . 1 . . . . . 11 GLY N . 53520 2
21 . 1 . 1 12 12 GLY H H 1 8.240582466 . . 1 . . . . . 12 GLY H . 53520 2
22 . 1 . 1 12 12 GLY N N 15 108.7920532 . . 1 . . . . . 12 GLY N . 53520 2
23 . 1 . 1 13 13 ARG H H 1 8.106378555 . . 1 . . . . . 13 ARG H . 53520 2
24 . 1 . 1 13 13 ARG N N 15 120.7242889 . . 1 . . . . . 13 ARG N . 53520 2
25 . 1 . 1 15 15 ARG H H 1 8.140637398 . . 1 . . . . . 15 ARG H . 53520 2
26 . 1 . 1 15 15 ARG N N 15 120.6557083 . . 1 . . . . . 15 ARG N . 53520 2
27 . 1 . 1 16 16 ALA H H 1 8.228087072 . . 1 . . . . . 16 ALA H . 53520 2
28 . 1 . 1 16 16 ALA N N 15 125.3260922 . . 1 . . . . . 16 ALA N . 53520 2
29 . 1 . 1 17 17 LEU H H 1 8.152808189 . . 1 . . . . . 17 LEU H . 53520 2
30 . 1 . 1 17 17 LEU N N 15 121.5497513 . . 1 . . . . . 17 LEU N . 53520 2
31 . 1 . 1 18 18 ASN H H 1 8.264202118 . . 1 . . . . . 18 ASN H . 53520 2
32 . 1 . 1 18 18 ASN N N 15 118.4949875 . . 1 . . . . . 18 ASN N . 53520 2
33 . 1 . 1 19 19 GLU H H 1 8.161172867 . . 1 . . . . . 19 GLU H . 53520 2
34 . 1 . 1 19 19 GLU N N 15 121.1914749 . . 1 . . . . . 19 GLU N . 53520 2
35 . 1 . 1 20 20 SER H H 1 8.195062569 . . 1 . . . . . 20 SER H . 53520 2
36 . 1 . 1 20 20 SER N N 15 116.8182583 . . 1 . . . . . 20 SER N . 53520 2
37 . 1 . 1 21 21 LYS H H 1 8.12279129 . . 1 . . . . . 21 LYS H . 53520 2
38 . 1 . 1 21 21 LYS N N 15 122.8280334 . . 1 . . . . . 21 LYS N . 53520 2
39 . 1 . 1 22 22 ARG H H 1 8.117895126 . . 1 . . . . . 22 ARG H . 53520 2
40 . 1 . 1 22 22 ARG N N 15 122.3923569 . . 1 . . . . . 22 ARG N . 53520 2
41 . 1 . 1 23 23 VAL H H 1 8.106358528 . . 1 . . . . . 23 VAL H . 53520 2
42 . 1 . 1 23 23 VAL N N 15 121.577179 . . 1 . . . . . 23 VAL N . 53520 2
43 . 1 . 1 24 24 ASN H H 1 8.450659752 . . 1 . . . . . 24 ASN H . 53520 2
44 . 1 . 1 24 24 ASN N N 15 122.5460205 . . 1 . . . . . 24 ASN N . 53520 2
45 . 1 . 1 25 25 ASN H H 1 8.376084328 . . 1 . . . . . 25 ASN H . 53520 2
46 . 1 . 1 25 25 ASN N N 15 119.9275589 . . 1 . . . . . 25 ASN N . 53520 2
47 . 1 . 1 26 26 GLY H H 1 8.255083084 . . 1 . . . . . 26 GLY H . 53520 2
48 . 1 . 1 26 26 GLY N N 15 108.6209946 . . 1 . . . . . 26 GLY N . 53520 2
49 . 1 . 1 27 27 ASN H H 1 8.173033714 . . 1 . . . . . 27 ASN H . 53520 2
50 . 1 . 1 27 27 ASN N N 15 118.673172 . . 1 . . . . . 27 ASN N . 53520 2
51 . 1 . 1 28 28 THR H H 1 8.015836716 . . 1 . . . . . 28 THR H . 53520 2
52 . 1 . 1 28 28 THR N N 15 114.7198181 . . 1 . . . . . 28 THR N . 53520 2
53 . 1 . 1 29 29 ALA H H 1 8.286524837 . . 1 . . . . . 29 ALA H . 53520 2
54 . 1 . 1 29 29 ALA N N 15 128.208817 . . 1 . . . . . 29 ALA N . 53520 2
55 . 1 . 1 31 31 GLU H H 1 8.512326241 . . 1 . . . . . 31 GLU H . 53520 2
56 . 1 . 1 31 31 GLU N N 15 120.8357544 . . 1 . . . . . 31 GLU N . 53520 2
57 . 1 . 1 32 32 ASP H H 1 8.221438369 . . 1 . . . . . 32 ASP H . 53520 2
58 . 1 . 1 32 32 ASP N N 15 121.5443811 . . 1 . . . . . 32 ASP N . 53520 2
59 . 1 . 1 33 33 SER H H 1 8.098047056 . . 1 . . . . . 33 SER H . 53520 2
60 . 1 . 1 33 33 SER N N 15 116.5026931 . . 1 . . . . . 33 SER N . 53520 2
61 . 1 . 1 34 34 SER H H 1 8.153402328 . . 1 . . . . . 34 SER H . 53520 2
62 . 1 . 1 34 34 SER N N 15 118.7102814 . . 1 . . . . . 34 SER N . 53520 2
63 . 1 . 1 36 36 ALA H H 1 8.08027935 . . 1 . . . . . 36 ALA H . 53520 2
64 . 1 . 1 36 36 ALA N N 15 122.8121567 . . 1 . . . . . 36 ALA N . 53520 2
65 . 1 . 1 37 37 LYS H H 1 7.993843079 . . 1 . . . . . 37 LYS H . 53520 2
66 . 1 . 1 37 37 LYS N N 15 119.9264297 . . 1 . . . . . 37 LYS N . 53520 2
67 . 1 . 1 38 38 LYS H H 1 8.110873222 . . 1 . . . . . 38 LYS H . 53520 2
68 . 1 . 1 38 38 LYS N N 15 121.9121857 . . 1 . . . . . 38 LYS N . 53520 2
69 . 1 . 1 39 39 THR H H 1 7.986924974 . . 1 . . . . . 39 THR H . 53520 2
70 . 1 . 1 39 39 THR N N 15 115.5511447 . . 1 . . . . . 39 THR N . 53520 2
71 . 1 . 1 40 40 ARG H H 1 8.241649628 . . 1 . . . . . 40 ARG H . 53520 2
72 . 1 . 1 40 40 ARG N N 15 123.838028 . . 1 . . . . . 40 ARG N . 53520 2
73 . 1 . 1 41 41 ARG H H 1 8.329462051 . . 1 . . . . . 41 ARG H . 53520 2
74 . 1 . 1 41 41 ARG N N 15 123.0807419 . . 1 . . . . . 41 ARG N . 53520 2
75 . 1 . 1 42 42 CYS H H 1 8.335469246 . . 1 . . . . . 42 CYS H . 53520 2
76 . 1 . 1 42 42 CYS N N 15 120.9873047 . . 1 . . . . . 42 CYS N . 53520 2
77 . 1 . 1 43 43 GLN H H 1 8.409550667 . . 1 . . . . . 43 GLN H . 53520 2
78 . 1 . 1 43 43 GLN N N 15 123.3489075 . . 1 . . . . . 43 GLN N . 53520 2
79 . 1 . 1 44 44 ARG H H 1 8.296081543 . . 1 . . . . . 44 ARG H . 53520 2
80 . 1 . 1 44 44 ARG N N 15 122.769516 . . 1 . . . . . 44 ARG N . 53520 2
81 . 1 . 1 45 45 GLN H H 1 8.401343346 . . 1 . . . . . 45 GLN H . 53520 2
82 . 1 . 1 45 45 GLN N N 15 122.4727707 . . 1 . . . . . 45 GLN N . 53520 2
83 . 1 . 1 46 46 GLU H H 1 8.444407463 . . 1 . . . . . 46 GLU H . 53520 2
84 . 1 . 1 46 46 GLU N N 15 123.1679764 . . 1 . . . . . 46 GLU N . 53520 2
85 . 1 . 1 47 47 SER H H 1 8.32493776 . . 1 . . . . . 47 SER H . 53520 2
86 . 1 . 1 47 47 SER N N 15 117.705214 . . 1 . . . . . 47 SER N . 53520 2
87 . 1 . 1 48 48 LYS H H 1 8.247203827 . . 1 . . . . . 48 LYS H . 53520 2
88 . 1 . 1 48 48 LYS N N 15 123.5413055 . . 1 . . . . . 48 LYS N . 53520 2
89 . 1 . 1 49 49 LYS H H 1 8.200849979 . . 1 . . . . . 49 LYS H . 53520 2
90 . 1 . 1 49 49 LYS N N 15 123.0236126 . . 1 . . . . . 49 LYS N . 53520 2
91 . 1 . 1 50 50 MET H H 1 8.310073853 . . 1 . . . . . 50 MET H . 53520 2
92 . 1 . 1 50 50 MET N N 15 123.7882462 . . 1 . . . . . 50 MET N . 53520 2
93 . 1 . 1 52 52 VAL H H 1 8.151456833 . . 1 . . . . . 52 VAL H . 53520 2
94 . 1 . 1 52 52 VAL N N 15 120.8632355 . . 1 . . . . . 52 VAL N . 53520 2
95 . 1 . 1 53 53 ALA H H 1 8.370963119 . . 1 . . . . . 53 ALA H . 53520 2
96 . 1 . 1 53 53 ALA N N 15 128.5750346 . . 1 . . . . . 53 ALA N . 53520 2
97 . 1 . 1 54 54 GLY H H 1 8.309185556 . . 1 . . . . . 54 GLY H . 53520 2
98 . 1 . 1 54 54 GLY N N 15 108.7899619 . . 1 . . . . . 54 GLY N . 53520 2
99 . 1 . 1 55 55 GLY H H 1 8.141627312 . . 1 . . . . . 55 GLY H . 53520 2
100 . 1 . 1 55 55 GLY N N 15 108.47229 . . 1 . . . . . 55 GLY N . 53520 2
101 . 1 . 1 56 56 LYS H H 1 8.106856346 . . 1 . . . . . 56 LYS H . 53520 2
102 . 1 . 1 56 56 LYS N N 15 120.7997971 . . 1 . . . . . 56 LYS N . 53520 2
103 . 1 . 1 57 57 ALA H H 1 8.249895453 . . 1 . . . . . 57 ALA H . 53520 2
104 . 1 . 1 57 57 ALA N N 15 124.9766129 . . 1 . . . . . 57 ALA N . 53520 2
105 . 1 . 1 58 58 ASN H H 1 8.252408028 . . 1 . . . . . 58 ASN H . 53520 2
106 . 1 . 1 58 58 ASN N N 15 118.3103104 . . 1 . . . . . 58 ASN N . 53520 2
107 . 1 . 1 59 59 LYS H H 1 8.187474625 . . 1 . . . . . 59 LYS H . 53520 2
108 . 1 . 1 59 59 LYS N N 15 121.7131309 . . 1 . . . . . 59 LYS N . 53520 2
109 . 1 . 1 60 60 ASP H H 1 8.196900368 . . 1 . . . . . 60 ASP H . 53520 2
110 . 1 . 1 60 60 ASP N N 15 121.0127182 . . 1 . . . . . 60 ASP N . 53520 2
111 . 1 . 1 61 61 ARG H H 1 8.128578186 . . 1 . . . . . 61 ARG H . 53520 2
112 . 1 . 1 61 61 ARG N N 15 121.1706696 . . 1 . . . . . 61 ARG N . 53520 2
113 . 1 . 1 62 62 THR H H 1 8.153728132 . . 1 . . . . . 62 THR H . 53520 2
114 . 1 . 1 62 62 THR N N 15 115.9621323 . . 1 . . . . . 62 THR N . 53520 2
115 . 1 . 1 63 63 GLU H H 1 8.387604713 . . 1 . . . . . 63 GLU H . 53520 2
116 . 1 . 1 63 63 GLU N N 15 122.6345901 . . 1 . . . . . 63 GLU N . 53520 2
117 . 1 . 1 64 64 ASP H H 1 8.163947105 . . 1 . . . . . 64 ASP H . 53520 2
118 . 1 . 1 64 64 ASP N N 15 121.6091614 . . 1 . . . . . 64 ASP N . 53520 2
119 . 1 . 1 65 65 LYS H H 1 8.128954887 . . 1 . . . . . 65 LYS H . 53520 2
120 . 1 . 1 65 65 LYS N N 15 121.7363281 . . 1 . . . . . 65 LYS N . 53520 2
121 . 1 . 1 66 66 GLN H H 1 8.309947968 . . 1 . . . . . 66 GLN H . 53520 2
122 . 1 . 1 66 66 GLN N N 15 121.0186996 . . 1 . . . . . 66 GLN N . 53520 2
123 . 1 . 1 67 67 ASP H H 1 8.196900368 . . 1 . . . . . 67 ASP H . 53520 2
124 . 1 . 1 67 67 ASP N N 15 121.1198196 . . 1 . . . . . 67 ASP N . 53520 2
125 . 1 . 1 68 68 GLY H H 1 8.174293518 . . 1 . . . . . 68 GLY H . 53520 2
126 . 1 . 1 68 68 GLY N N 15 108.7943726 . . 1 . . . . . 68 GLY N . 53520 2
127 . 1 . 1 69 69 MET H H 1 7.971007824 . . 1 . . . . . 69 MET H . 53520 2
128 . 1 . 1 69 69 MET N N 15 120.6538925 . . 1 . . . . . 69 MET N . 53520 2
129 . 1 . 1 71 71 GLY H H 1 8.353610992 . . 1 . . . . . 71 GLY H . 53520 2
130 . 1 . 1 71 71 GLY N N 15 109.1598587 . . 1 . . . . . 71 GLY N . 53520 2
131 . 1 . 1 72 72 ARG H H 1 7.940785408 . . 1 . . . . . 72 ARG H . 53520 2
132 . 1 . 1 72 72 ARG N N 15 120.1245346 . . 1 . . . . . 72 ARG N . 53520 2
133 . 1 . 1 73 73 SER H H 1 8.198309898 . . 1 . . . . . 73 SER H . 53520 2
134 . 1 . 1 73 73 SER N N 15 116.6139832 . . 1 . . . . . 73 SER N . 53520 2
135 . 1 . 1 74 74 TRP H H 1 8.043470383 . . 1 . . . . . 74 TRP H . 53520 2
136 . 1 . 1 74 74 TRP N N 15 123.0410004 . . 1 . . . . . 74 TRP N . 53520 2
137 . 1 . 1 75 75 ALA H H 1 7.891650438 . . 1 . . . . . 75 ALA H . 53520 2
138 . 1 . 1 75 75 ALA N N 15 124.4709493 . . 1 . . . . . 75 ALA N . 53520 2
139 . 1 . 1 76 76 SER H H 1 7.926361084 . . 1 . . . . . 76 SER H . 53520 2
140 . 1 . 1 76 76 SER N N 15 114.5409698 . . 1 . . . . . 76 SER N . 53520 2
141 . 1 . 1 77 77 LYS H H 1 8.049365997 . . 1 . . . . . 77 LYS H . 53520 2
142 . 1 . 1 77 77 LYS N N 15 122.9354401 . . 1 . . . . . 77 LYS N . 53520 2
143 . 1 . 1 78 78 ARG H H 1 8.11837101 . . 1 . . . . . 78 ARG H . 53520 2
144 . 1 . 1 78 78 ARG N N 15 122.3269577 . . 1 . . . . . 78 ARG N . 53520 2
145 . 1 . 1 79 79 VAL H H 1 8.072072029 . . 1 . . . . . 79 VAL H . 53520 2
146 . 1 . 1 79 79 VAL N N 15 121.9047775 . . 1 . . . . . 79 VAL N . 53520 2
147 . 1 . 1 80 80 SER H H 1 8.241565704 . . 1 . . . . . 80 SER H . 53520 2
148 . 1 . 1 80 80 SER N N 15 119.107254 . . 1 . . . . . 80 SER N . 53520 2
149 . 1 . 1 81 81 GLU H H 1 8.346452713 . . 1 . . . . . 81 GLU H . 53520 2
150 . 1 . 1 81 81 GLU N N 15 122.8236389 . . 1 . . . . . 81 GLU N . 53520 2
151 . 1 . 1 82 82 SER H H 1 8.17787838 . . 1 . . . . . 82 SER H . 53520 2
152 . 1 . 1 82 82 SER N N 15 116.685524 . . 1 . . . . . 82 SER N . 53520 2
153 . 1 . 1 83 83 VAL H H 1 7.923547268 . . 1 . . . . . 83 VAL H . 53520 2
154 . 1 . 1 83 83 VAL N N 15 122.2711868 . . 1 . . . . . 83 VAL N . 53520 2
155 . 1 . 1 84 84 LYS H H 1 8.113490262 . . 1 . . . . . 84 LYS H . 53520 2
156 . 1 . 1 84 84 LYS N N 15 124.5754901 . . 1 . . . . . 84 LYS N . 53520 2
157 . 1 . 1 85 85 ALA H H 1 8.027485273 . . 1 . . . . . 85 ALA H . 53520 2
158 . 1 . 1 85 85 ALA N N 15 124.3970547 . . 1 . . . . . 85 ALA N . 53520 2
159 . 1 . 1 86 86 LEU H H 1 7.91615963 . . 1 . . . . . 86 LEU H . 53520 2
160 . 1 . 1 86 86 LEU N N 15 121.0089569 . . 1 . . . . . 86 LEU N . 53520 2
161 . 1 . 1 87 87 LEU H H 1 7.932726383 . . 1 . . . . . 87 LEU H . 53520 2
162 . 1 . 1 87 87 LEU N N 15 122.6067657 . . 1 . . . . . 87 LEU N . 53520 2
163 . 1 . 1 88 88 LEU H H 1 7.98242569 . . 1 . . . . . 88 LEU H . 53520 2
164 . 1 . 1 88 88 LEU N N 15 123.5301666 . . 1 . . . . . 88 LEU N . 53520 2
165 . 1 . 1 89 89 LYS H H 1 7.646695807 . . 1 . . . . . 89 LYS H . 53520 2
166 . 1 . 1 89 89 LYS N N 15 126.7511611 . . 1 . . . . . 89 LYS N . 53520 2
stop_
save_