data_19932
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19932
_Entry.PDB_ID 2MOA
save_
save_delta_chem_shifts
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts
_Entity_delta_chem_shifts.Model_type single
_Entity_delta_chem_shifts.Entry_ID 19932
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 4 4 SER HA H 4 4.202 4.202 4.564 -0.362 19932
2 1 1 . 1 1 4 4 SER H H 4 7.502 7.502 8.307 -0.805 19932
3 1 1 . 1 1 5 5 ASP HA H 5 4.662 4.662 5.027 -0.365 19932
4 1 1 . 1 1 5 5 ASP H H 5 7.282 7.282 8.076 -0.794 19932
5 1 1 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.233 -0.111 19932
6 1 1 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.438 -0.471 19932
7 1 1 . 1 1 7 7 ARG H H 7 8.158 8.158 8.653 -0.495 19932
8 1 1 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.368 -0.265 19932
9 1 1 . 1 1 8 8 CYS H H 8 7.513 7.513 8.442 -0.929 19932
10 1 1 . 1 1 9 9 ALA HA H 9 3.848 3.848 3.986 -0.138 19932
11 1 1 . 1 1 9 9 ALA H H 9 7.805 7.805 8.379 -0.574 19932
12 1 1 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.349 0.072 19932
13 1 1 . 1 1 10 10 TRP H H 10 7.454 7.454 7.574 -0.120 19932
14 1 1 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.234 -0.336 19932
15 1 1 . 1 1 11 11 ARG H H 11 7.694 7.694 7.042 0.652 19932
16 1 2 . 1 1 4 4 SER HA H 4 4.202 4.202 4.480 -0.278 19932
17 1 2 . 1 1 4 4 SER H H 4 7.502 7.502 8.204 -0.702 19932
18 1 2 . 1 1 5 5 ASP HA H 5 4.662 4.662 5.036 -0.374 19932
19 1 2 . 1 1 5 5 ASP H H 5 7.282 7.282 7.873 -0.591 19932
20 1 2 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.167 -0.045 19932
21 1 2 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.175 -0.208 19932
22 1 2 . 1 1 7 7 ARG H H 7 8.158 8.158 8.459 -0.301 19932
23 1 2 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.751 -0.648 19932
24 1 2 . 1 1 8 8 CYS H H 8 7.513 7.513 8.156 -0.643 19932
25 1 2 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.043 -0.195 19932
26 1 2 . 1 1 9 9 ALA H H 9 7.805 7.805 8.472 -0.667 19932
27 1 2 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.177 0.244 19932
28 1 2 . 1 1 10 10 TRP H H 10 7.454 7.454 7.758 -0.304 19932
29 1 2 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.624 -0.726 19932
30 1 2 . 1 1 11 11 ARG H H 11 7.694 7.694 8.142 -0.448 19932
31 1 3 . 1 1 4 4 SER HA H 4 4.202 4.202 4.477 -0.275 19932
32 1 3 . 1 1 4 4 SER H H 4 7.502 7.502 8.343 -0.841 19932
33 1 3 . 1 1 5 5 ASP HA H 5 4.662 4.662 5.075 -0.413 19932
34 1 3 . 1 1 5 5 ASP H H 5 7.282 7.282 8.006 -0.724 19932
35 1 3 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.221 -0.099 19932
36 1 3 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.309 -0.342 19932
37 1 3 . 1 1 7 7 ARG H H 7 8.158 8.158 8.542 -0.384 19932
38 1 3 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.746 -0.643 19932
39 1 3 . 1 1 8 8 CYS H H 8 7.513 7.513 8.128 -0.615 19932
40 1 3 . 1 1 9 9 ALA HA H 9 3.848 3.848 3.996 -0.148 19932
41 1 3 . 1 1 9 9 ALA H H 9 7.805 7.805 8.569 -0.764 19932
42 1 3 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.235 0.186 19932
43 1 3 . 1 1 10 10 TRP H H 10 7.454 7.454 7.690 -0.236 19932
44 1 3 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.604 -0.706 19932
45 1 3 . 1 1 11 11 ARG H H 11 7.694 7.694 7.899 -0.205 19932
46 1 4 . 1 1 4 4 SER HA H 4 4.202 4.202 4.579 -0.377 19932
47 1 4 . 1 1 4 4 SER H H 4 7.502 7.502 8.304 -0.802 19932
48 1 4 . 1 1 5 5 ASP HA H 5 4.662 4.662 5.004 -0.342 19932
49 1 4 . 1 1 5 5 ASP H H 5 7.282 7.282 7.944 -0.662 19932
50 1 4 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.292 -0.170 19932
51 1 4 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.459 -0.492 19932
52 1 4 . 1 1 7 7 ARG H H 7 8.158 8.158 8.110 0.048 19932
53 1 4 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.621 -0.518 19932
54 1 4 . 1 1 8 8 CYS H H 8 7.513 7.513 8.402 -0.889 19932
55 1 4 . 1 1 9 9 ALA HA H 9 3.848 3.848 3.973 -0.125 19932
56 1 4 . 1 1 9 9 ALA H H 9 7.805 7.805 8.560 -0.755 19932
57 1 4 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.361 0.060 19932
58 1 4 . 1 1 10 10 TRP H H 10 7.454 7.454 8.099 -0.645 19932
59 1 4 . 1 1 11 11 ARG HA H 11 3.898 3.898 3.837 0.061 19932
60 1 4 . 1 1 11 11 ARG H H 11 7.694 7.694 6.889 0.805 19932
61 1 5 . 1 1 4 4 SER HA H 4 4.202 4.202 4.487 -0.285 19932
62 1 5 . 1 1 4 4 SER H H 4 7.502 7.502 8.112 -0.610 19932
63 1 5 . 1 1 5 5 ASP HA H 5 4.662 4.662 5.002 -0.340 19932
64 1 5 . 1 1 5 5 ASP H H 5 7.282 7.282 7.845 -0.563 19932
65 1 5 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.335 -0.213 19932
66 1 5 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.605 -0.638 19932
67 1 5 . 1 1 7 7 ARG H H 7 8.158 8.158 8.108 0.050 19932
68 1 5 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.703 -0.600 19932
69 1 5 . 1 1 8 8 CYS H H 8 7.513 7.513 8.283 -0.770 19932
70 1 5 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.025 -0.177 19932
71 1 5 . 1 1 9 9 ALA H H 9 7.805 7.805 8.490 -0.685 19932
72 1 5 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.449 -0.028 19932
73 1 5 . 1 1 10 10 TRP H H 10 7.454 7.454 7.754 -0.300 19932
74 1 5 . 1 1 11 11 ARG HA H 11 3.898 3.898 3.844 0.054 19932
75 1 5 . 1 1 11 11 ARG H H 11 7.694 7.694 6.981 0.713 19932
76 1 6 . 1 1 4 4 SER HA H 4 4.202 4.202 4.513 -0.311 19932
77 1 6 . 1 1 4 4 SER H H 4 7.502 7.502 8.214 -0.712 19932
78 1 6 . 1 1 5 5 ASP HA H 5 4.662 4.662 5.013 -0.351 19932
79 1 6 . 1 1 5 5 ASP H H 5 7.282 7.282 7.842 -0.560 19932
80 1 6 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.316 -0.194 19932
81 1 6 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.403 -0.436 19932
82 1 6 . 1 1 7 7 ARG H H 7 8.158 8.158 8.377 -0.219 19932
83 1 6 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.357 -0.254 19932
84 1 6 . 1 1 8 8 CYS H H 8 7.513 7.513 8.449 -0.936 19932
85 1 6 . 1 1 9 9 ALA HA H 9 3.848 3.848 3.970 -0.122 19932
86 1 6 . 1 1 9 9 ALA H H 9 7.805 7.805 8.419 -0.614 19932
87 1 6 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.378 0.043 19932
88 1 6 . 1 1 10 10 TRP H H 10 7.454 7.454 7.926 -0.472 19932
89 1 6 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.023 -0.125 19932
90 1 6 . 1 1 11 11 ARG H H 11 7.694 7.694 7.046 0.648 19932
91 1 7 . 1 1 4 4 SER HA H 4 4.202 4.202 4.567 -0.365 19932
92 1 7 . 1 1 4 4 SER H H 4 7.502 7.502 8.099 -0.597 19932
93 1 7 . 1 1 5 5 ASP HA H 5 4.662 4.662 5.020 -0.358 19932
94 1 7 . 1 1 5 5 ASP H H 5 7.282 7.282 7.929 -0.647 19932
95 1 7 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.426 -0.304 19932
96 1 7 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.901 -0.934 19932
97 1 7 . 1 1 7 7 ARG H H 7 8.158 8.158 7.993 0.165 19932
98 1 7 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.588 -0.485 19932
99 1 7 . 1 1 8 8 CYS H H 8 7.513 7.513 8.632 -1.119 19932
100 1 7 . 1 1 9 9 ALA HA H 9 3.848 3.848 3.976 -0.128 19932
101 1 7 . 1 1 9 9 ALA H H 9 7.805 7.805 8.482 -0.677 19932
102 1 7 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.352 0.069 19932
103 1 7 . 1 1 10 10 TRP H H 10 7.454 7.454 7.983 -0.529 19932
104 1 7 . 1 1 11 11 ARG HA H 11 3.898 3.898 3.956 -0.058 19932
105 1 7 . 1 1 11 11 ARG H H 11 7.694 7.694 6.795 0.899 19932
106 1 8 . 1 1 4 4 SER HA H 4 4.202 4.202 4.491 -0.289 19932
107 1 8 . 1 1 4 4 SER H H 4 7.502 7.502 8.189 -0.687 19932
108 1 8 . 1 1 5 5 ASP HA H 5 4.662 4.662 4.987 -0.325 19932
109 1 8 . 1 1 5 5 ASP H H 5 7.282 7.282 7.752 -0.470 19932
110 1 8 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.394 -0.272 19932
111 1 8 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.895 -0.928 19932
112 1 8 . 1 1 7 7 ARG H H 7 8.158 8.158 8.848 -0.690 19932
113 1 8 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.919 -0.816 19932
114 1 8 . 1 1 8 8 CYS H H 8 7.513 7.513 7.807 -0.294 19932
115 1 8 . 1 1 9 9 ALA HA H 9 3.848 3.848 3.979 -0.131 19932
116 1 8 . 1 1 9 9 ALA H H 9 7.805 7.805 7.958 -0.153 19932
117 1 8 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.372 0.049 19932
118 1 8 . 1 1 10 10 TRP H H 10 7.454 7.454 7.852 -0.398 19932
119 1 8 . 1 1 11 11 ARG HA H 11 3.898 3.898 3.741 0.157 19932
120 1 8 . 1 1 11 11 ARG H H 11 7.694 7.694 6.824 0.870 19932
121 1 9 . 1 1 4 4 SER HA H 4 4.202 4.202 4.510 -0.308 19932
122 1 9 . 1 1 4 4 SER H H 4 7.502 7.502 7.867 -0.365 19932
123 1 9 . 1 1 5 5 ASP HA H 5 4.662 4.662 4.896 -0.234 19932
124 1 9 . 1 1 5 5 ASP H H 5 7.282 7.282 7.907 -0.625 19932
125 1 9 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.367 -0.245 19932
126 1 9 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.853 -0.886 19932
127 1 9 . 1 1 7 7 ARG H H 7 8.158 8.158 8.617 -0.459 19932
128 1 9 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.825 -0.722 19932
129 1 9 . 1 1 8 8 CYS H H 8 7.513 7.513 7.728 -0.215 19932
130 1 9 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.246 -0.398 19932
131 1 9 . 1 1 9 9 ALA H H 9 7.805 7.805 7.598 0.207 19932
132 1 9 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.471 -0.050 19932
133 1 9 . 1 1 10 10 TRP H H 10 7.454 7.454 7.788 -0.334 19932
134 1 9 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.451 -0.553 19932
135 1 9 . 1 1 11 11 ARG H H 11 7.694 7.694 7.624 0.070 19932
136 1 10 . 1 1 4 4 SER HA H 4 4.202 4.202 4.541 -0.339 19932
137 1 10 . 1 1 4 4 SER H H 4 7.502 7.502 8.360 -0.858 19932
138 1 10 . 1 1 5 5 ASP HA H 5 4.662 4.662 4.980 -0.318 19932
139 1 10 . 1 1 5 5 ASP H H 5 7.282 7.282 7.772 -0.490 19932
140 1 10 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.374 -0.252 19932
141 1 10 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.834 -0.867 19932
142 1 10 . 1 1 7 7 ARG H H 7 8.158 8.158 8.539 -0.381 19932
143 1 10 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.120 -0.017 19932
144 1 10 . 1 1 8 8 CYS H H 8 7.513 7.513 7.698 -0.185 19932
145 1 10 . 1 1 9 9 ALA HA H 9 3.848 3.848 3.955 -0.107 19932
146 1 10 . 1 1 9 9 ALA H H 9 7.805 7.805 7.498 0.307 19932
147 1 10 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.443 -0.022 19932
148 1 10 . 1 1 10 10 TRP H H 10 7.454 7.454 7.669 -0.215 19932
149 1 10 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.286 -0.388 19932
150 1 10 . 1 1 11 11 ARG H H 11 7.694 7.694 6.840 0.854 19932
151 1 11 . 1 1 4 4 SER HA H 4 4.202 4.202 4.540 -0.338 19932
152 1 11 . 1 1 4 4 SER H H 4 7.502 7.502 8.342 -0.840 19932
153 1 11 . 1 1 5 5 ASP HA H 5 4.662 4.662 4.911 -0.249 19932
154 1 11 . 1 1 5 5 ASP H H 5 7.282 7.282 7.820 -0.538 19932
155 1 11 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.334 -0.212 19932
156 1 11 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.693 -0.726 19932
157 1 11 . 1 1 7 7 ARG H H 7 8.158 8.158 8.985 -0.827 19932
158 1 11 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.493 -0.390 19932
159 1 11 . 1 1 8 8 CYS H H 8 7.513 7.513 7.645 -0.132 19932
160 1 11 . 1 1 9 9 ALA HA H 9 3.848 3.848 3.904 -0.056 19932
161 1 11 . 1 1 9 9 ALA H H 9 7.805 7.805 7.568 0.237 19932
162 1 11 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.422 -0.001 19932
163 1 11 . 1 1 10 10 TRP H H 10 7.454 7.454 7.684 -0.230 19932
164 1 11 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.252 -0.354 19932
165 1 11 . 1 1 11 11 ARG H H 11 7.694 7.694 6.993 0.701 19932
166 1 12 . 1 1 4 4 SER HA H 4 4.202 4.202 4.460 -0.258 19932
167 1 12 . 1 1 4 4 SER H H 4 7.502 7.502 8.376 -0.874 19932
168 1 12 . 1 1 5 5 ASP HA H 5 4.662 4.662 5.055 -0.393 19932
169 1 12 . 1 1 5 5 ASP H H 5 7.282 7.282 7.900 -0.618 19932
170 1 12 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.323 -0.201 19932
171 1 12 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.368 -0.401 19932
172 1 12 . 1 1 7 7 ARG H H 7 8.158 8.158 8.300 -0.142 19932
173 1 12 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.797 -0.694 19932
174 1 12 . 1 1 8 8 CYS H H 8 7.513 7.513 8.104 -0.591 19932
175 1 12 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.043 -0.195 19932
176 1 12 . 1 1 9 9 ALA H H 9 7.805 7.805 8.697 -0.892 19932
177 1 12 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.197 0.224 19932
178 1 12 . 1 1 10 10 TRP H H 10 7.454 7.454 7.835 -0.381 19932
179 1 12 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.630 -0.732 19932
180 1 12 . 1 1 11 11 ARG H H 11 7.694 7.694 8.087 -0.393 19932
181 1 13 . 1 1 4 4 SER HA H 4 4.202 4.202 4.394 -0.192 19932
182 1 13 . 1 1 4 4 SER H H 4 7.502 7.502 8.172 -0.670 19932
183 1 13 . 1 1 5 5 ASP HA H 5 4.662 4.662 4.855 -0.193 19932
184 1 13 . 1 1 5 5 ASP H H 5 7.282 7.282 7.657 -0.375 19932
185 1 13 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.282 -0.160 19932
186 1 13 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.440 -0.473 19932
187 1 13 . 1 1 7 7 ARG H H 7 8.158 8.158 8.703 -0.545 19932
188 1 13 . 1 1 8 8 CYS HA H 8 4.103 4.103 2.744 1.359 19932
189 1 13 . 1 1 8 8 CYS H H 8 7.513 7.513 7.780 -0.267 19932
190 1 13 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.175 -0.327 19932
191 1 13 . 1 1 9 9 ALA H H 9 7.805 7.805 7.259 0.546 19932
192 1 13 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.400 0.021 19932
193 1 13 . 1 1 10 10 TRP H H 10 7.454 7.454 7.612 -0.158 19932
194 1 13 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.605 -0.707 19932
195 1 13 . 1 1 11 11 ARG H H 11 7.694 7.694 7.862 -0.168 19932
196 1 14 . 1 1 4 4 SER HA H 4 4.202 4.202 4.536 -0.334 19932
197 1 14 . 1 1 4 4 SER H H 4 7.502 7.502 8.102 -0.600 19932
198 1 14 . 1 1 5 5 ASP HA H 5 4.662 4.662 4.902 -0.240 19932
199 1 14 . 1 1 5 5 ASP H H 5 7.282 7.282 7.867 -0.585 19932
200 1 14 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.341 -0.219 19932
201 1 14 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.679 -0.712 19932
202 1 14 . 1 1 7 7 ARG H H 7 8.158 8.158 8.913 -0.755 19932
203 1 14 . 1 1 8 8 CYS HA H 8 4.103 4.103 5.156 -1.053 19932
204 1 14 . 1 1 8 8 CYS H H 8 7.513 7.513 7.815 -0.302 19932
205 1 14 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.082 -0.234 19932
206 1 14 . 1 1 9 9 ALA H H 9 7.805 7.805 7.623 0.182 19932
207 1 14 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.399 0.022 19932
208 1 14 . 1 1 10 10 TRP H H 10 7.454 7.454 8.103 -0.649 19932
209 1 14 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.294 -0.396 19932
210 1 14 . 1 1 11 11 ARG H H 11 7.694 7.694 7.365 0.329 19932
211 1 15 . 1 1 4 4 SER HA H 4 4.202 4.202 4.532 -0.330 19932
212 1 15 . 1 1 4 4 SER H H 4 7.502 7.502 8.090 -0.588 19932
213 1 15 . 1 1 5 5 ASP HA H 5 4.662 4.662 4.855 -0.193 19932
214 1 15 . 1 1 5 5 ASP H H 5 7.282 7.282 7.939 -0.657 19932
215 1 15 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.320 -0.198 19932
216 1 15 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.525 -0.558 19932
217 1 15 . 1 1 7 7 ARG H H 7 8.158 8.158 8.764 -0.606 19932
218 1 15 . 1 1 8 8 CYS HA H 8 4.103 4.103 5.077 -0.974 19932
219 1 15 . 1 1 8 8 CYS H H 8 7.513 7.513 8.247 -0.734 19932
220 1 15 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.173 -0.325 19932
221 1 15 . 1 1 9 9 ALA H H 9 7.805 7.805 7.473 0.332 19932
222 1 15 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.295 0.126 19932
223 1 15 . 1 1 10 10 TRP H H 10 7.454 7.454 8.511 -1.057 19932
224 1 15 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.374 -0.476 19932
225 1 15 . 1 1 11 11 ARG H H 11 7.694 7.694 8.393 -0.699 19932
226 1 16 . 1 1 4 4 SER HA H 4 4.202 4.202 4.387 -0.185 19932
227 1 16 . 1 1 4 4 SER H H 4 7.502 7.502 8.159 -0.656 19932
228 1 16 . 1 1 5 5 ASP HA H 5 4.662 4.662 5.031 -0.369 19932
229 1 16 . 1 1 5 5 ASP H H 5 7.282 7.282 7.566 -0.284 19932
230 1 16 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.370 -0.248 19932
231 1 16 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.525 -0.558 19932
232 1 16 . 1 1 7 7 ARG H H 7 8.158 8.158 8.897 -0.739 19932
233 1 16 . 1 1 8 8 CYS HA H 8 4.103 4.103 5.093 -0.990 19932
234 1 16 . 1 1 8 8 CYS H H 8 7.513 7.513 7.695 -0.182 19932
235 1 16 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.213 -0.365 19932
236 1 16 . 1 1 9 9 ALA H H 9 7.805 7.805 7.888 -0.083 19932
237 1 16 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.303 0.118 19932
238 1 16 . 1 1 10 10 TRP H H 10 7.454 7.454 7.981 -0.527 19932
239 1 16 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.325 -0.427 19932
240 1 16 . 1 1 11 11 ARG H H 11 7.694 7.694 7.746 -0.052 19932
241 1 17 . 1 1 4 4 SER HA H 4 4.202 4.202 4.480 -0.278 19932
242 1 17 . 1 1 4 4 SER H H 4 7.502 7.502 8.041 -0.539 19932
243 1 17 . 1 1 5 5 ASP HA H 5 4.662 4.662 5.148 -0.486 19932
244 1 17 . 1 1 5 5 ASP H H 5 7.282 7.282 7.777 -0.495 19932
245 1 17 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.196 -0.074 19932
246 1 17 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.460 -0.493 19932
247 1 17 . 1 1 7 7 ARG H H 7 8.158 8.158 8.579 -0.421 19932
248 1 17 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.721 -0.618 19932
249 1 17 . 1 1 8 8 CYS H H 8 7.513 7.513 8.187 -0.674 19932
250 1 17 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.083 -0.235 19932
251 1 17 . 1 1 9 9 ALA H H 9 7.805 7.805 7.882 -0.077 19932
252 1 17 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.393 0.028 19932
253 1 17 . 1 1 10 10 TRP H H 10 7.454 7.454 8.033 -0.579 19932
254 1 17 . 1 1 11 11 ARG HA H 11 3.898 3.898 3.794 0.104 19932
255 1 17 . 1 1 11 11 ARG H H 11 7.694 7.694 6.784 0.910 19932
256 1 18 . 1 1 4 4 SER HA H 4 4.202 4.202 4.536 -0.334 19932
257 1 18 . 1 1 4 4 SER H H 4 7.502 7.502 8.265 -0.763 19932
258 1 18 . 1 1 5 5 ASP HA H 5 4.662 4.662 4.959 -0.297 19932
259 1 18 . 1 1 5 5 ASP H H 5 7.282 7.282 7.821 -0.539 19932
260 1 18 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.457 -0.335 19932
261 1 18 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.565 -0.598 19932
262 1 18 . 1 1 7 7 ARG H H 7 8.158 8.158 8.749 -0.591 19932
263 1 18 . 1 1 8 8 CYS HA H 8 4.103 4.103 5.109 -1.006 19932
264 1 18 . 1 1 8 8 CYS H H 8 7.513 7.513 8.581 -1.068 19932
265 1 18 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.086 -0.238 19932
266 1 18 . 1 1 9 9 ALA H H 9 7.805 7.805 7.745 0.060 19932
267 1 18 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.281 0.140 19932
268 1 18 . 1 1 10 10 TRP H H 10 7.454 7.454 8.601 -1.147 19932
269 1 18 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.395 -0.497 19932
270 1 18 . 1 1 11 11 ARG H H 11 7.694 7.694 8.432 -0.738 19932
271 1 19 . 1 1 4 4 SER HA H 4 4.202 4.202 4.661 -0.459 19932
272 1 19 . 1 1 4 4 SER H H 4 7.502 7.502 8.295 -0.793 19932
273 1 19 . 1 1 5 5 ASP HA H 5 4.662 4.662 5.004 -0.342 19932
274 1 19 . 1 1 5 5 ASP H H 5 7.282 7.282 8.166 -0.884 19932
275 1 19 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.324 -0.202 19932
276 1 19 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.550 -0.583 19932
277 1 19 . 1 1 7 7 ARG H H 7 8.158 8.158 8.453 -0.295 19932
278 1 19 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.422 -0.319 19932
279 1 19 . 1 1 8 8 CYS H H 8 7.513 7.513 8.355 -0.842 19932
280 1 19 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.043 -0.195 19932
281 1 19 . 1 1 9 9 ALA H H 9 7.805 7.805 8.486 -0.681 19932
282 1 19 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.423 -0.002 19932
283 1 19 . 1 1 10 10 TRP H H 10 7.454 7.454 7.608 -0.154 19932
284 1 19 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.582 -0.684 19932
285 1 19 . 1 1 11 11 ARG H H 11 7.694 7.694 7.302 0.392 19932
286 1 20 . 1 1 4 4 SER HA H 4 4.202 4.202 4.612 -0.410 19932
287 1 20 . 1 1 4 4 SER H H 4 7.502 7.502 8.144 -0.642 19932
288 1 20 . 1 1 5 5 ASP HA H 5 4.662 4.662 5.058 -0.396 19932
289 1 20 . 1 1 5 5 ASP H H 5 7.282 7.282 8.122 -0.840 19932
290 1 20 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.333 -0.211 19932
291 1 20 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.332 -0.365 19932
292 1 20 . 1 1 7 7 ARG H H 7 8.158 8.158 8.520 -0.362 19932
293 1 20 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.545 -0.442 19932
294 1 20 . 1 1 8 8 CYS H H 8 7.513 7.513 8.529 -1.016 19932
295 1 20 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.456 -0.608 19932
296 1 20 . 1 1 9 9 ALA H H 9 7.805 7.805 7.474 0.331 19932
297 1 20 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.496 -0.075 19932
298 1 20 . 1 1 10 10 TRP H H 10 7.454 7.454 7.924 -0.470 19932
299 1 20 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.447 -0.549 19932
300 1 20 . 1 1 11 11 ARG H H 11 7.694 7.694 7.470 0.224 19932
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 0 0.000 0.000 0.000 19932
2 1 1 "Average Difference" HA 8 0.297 0.247 0.176 19932
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19932
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19932
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19932
6 1 1 "Average Difference" HN 7 0.671 0.438 0.550 19932
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19932
8 1 2 "Average Difference" HA 8 0.404 0.279 0.313 19932
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19932
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19932
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19932
12 1 2 "Average Difference" HN 7 0.546 0.522 0.171 19932
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19932
14 1 3 "Average Difference" HA 8 0.410 0.305 0.292 19932
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19932
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19932
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19932
18 1 3 "Average Difference" HN 7 0.590 0.538 0.261 19932
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19932
20 1 4 "Average Difference" HA 8 0.320 0.238 0.229 19932
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19932
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19932
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19932
24 1 4 "Average Difference" HN 7 0.708 0.414 0.620 19932
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19932
26 1 5 "Average Difference" HA 8 0.361 0.278 0.246 19932
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19932
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19932
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19932
30 1 5 "Average Difference" HN 7 0.580 0.309 0.530 19932
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19932
32 1 6 "Average Difference" HA 8 0.261 0.219 0.152 19932
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19932
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19932
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19932
36 1 6 "Average Difference" HN 7 0.629 0.409 0.515 19932
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19932
38 1 7 "Average Difference" HA 8 0.431 0.320 0.308 19932
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19932
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19932
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19932
42 1 7 "Average Difference" HN 7 0.717 0.358 0.671 19932
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19932
44 1 8 "Average Difference" HA 8 0.479 0.319 0.381 19932
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19932
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19932
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19932
48 1 8 "Average Difference" HN 7 0.560 0.261 0.535 19932
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19932
50 1 9 "Average Difference" HA 8 0.498 0.424 0.278 19932
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19932
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19932
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19932
54 1 9 "Average Difference" HN 7 0.366 0.246 0.294 19932
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19932
56 1 10 "Average Difference" HA 8 0.386 0.289 0.274 19932
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19932
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19932
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19932
60 1 10 "Average Difference" HN 7 0.538 0.138 0.562 19932
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19932
62 1 11 "Average Difference" HA 8 0.358 0.291 0.224 19932
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19932
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 19932
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 19932
66 1 11 "Average Difference" HN 7 0.573 0.233 0.565 19932
67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19932
68 1 12 "Average Difference" HA 8 0.437 0.331 0.305 19932
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19932
70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 19932
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 19932
72 1 12 "Average Difference" HN 7 0.611 0.556 0.273 19932
73 1 13 "Average Difference" N 0 0.000 0.000 0.000 19932
74 1 13 "Average Difference" HA 8 0.589 0.084 0.624 19932
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19932
76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 19932
77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 19932
78 1 13 "Average Difference" HN 7 0.433 0.234 0.393 19932
79 1 14 "Average Difference" N 0 0.000 0.000 0.000 19932
80 1 14 "Average Difference" HA 8 0.506 0.396 0.336 19932
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19932
82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 19932
83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 19932
84 1 14 "Average Difference" HN 7 0.524 0.340 0.431 19932
85 1 15 "Average Difference" N 0 0.000 0.000 0.000 19932
86 1 15 "Average Difference" HA 8 0.473 0.366 0.321 19932
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19932
88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 19932
89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 19932
90 1 15 "Average Difference" HN 7 0.697 0.573 0.429 19932
91 1 16 "Average Difference" N 0 0.000 0.000 0.000 19932
92 1 16 "Average Difference" HA 8 0.481 0.378 0.318 19932
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19932
94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 19932
95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 19932
96 1 16 "Average Difference" HN 7 0.444 0.361 0.279 19932
97 1 17 "Average Difference" N 0 0.000 0.000 0.000 19932
98 1 17 "Average Difference" HA 8 0.356 0.257 0.263 19932
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19932
100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 19932
101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 19932
102 1 17 "Average Difference" HN 7 0.578 0.268 0.553 19932
103 1 18 "Average Difference" N 0 0.000 0.000 0.000 19932
104 1 18 "Average Difference" HA 8 0.500 0.396 0.328 19932
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19932
106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 19932
107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 19932
108 1 18 "Average Difference" HN 7 0.777 0.684 0.399 19932
109 1 19 "Average Difference" N 0 0.000 0.000 0.000 19932
110 1 19 "Average Difference" HA 8 0.406 0.348 0.222 19932
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19932
112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 19932
113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 19932
114 1 19 "Average Difference" HN 7 0.638 0.465 0.471 19932
115 1 20 "Average Difference" N 0 0.000 0.000 0.000 19932
116 1 20 "Average Difference" HA 8 0.415 0.382 0.172 19932
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19932
118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 19932
119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 19932
120 1 20 "Average Difference" HN 7 0.617 0.397 0.510 19932
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Model_type average
_Entity_delta_chem_shifts.Entry_ID 19932
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 4 4 SER HA H 4 4.202 4.202 4.517 -0.315 19932
2 1 . 1 1 4 4 SER H H 4 7.502 7.502 8.199 -0.697 19932
3 1 . 1 1 5 5 ASP HA H 5 4.662 4.662 4.991 -0.329 19932
4 1 . 1 1 5 5 ASP H H 5 7.282 7.282 7.879 -0.597 19932
5 1 . 1 1 6 6 PRO HA H 6 4.122 4.122 4.320 -0.198 19932
6 1 . 1 1 7 7 ARG HA H 7 3.967 3.967 4.550 -0.583 19932
7 1 . 1 1 7 7 ARG H H 7 8.158 8.158 8.555 -0.397 19932
8 1 . 1 1 8 8 CYS HA H 8 4.103 4.103 4.608 -0.505 19932
9 1 . 1 1 8 8 CYS H H 8 7.513 7.513 8.133 -0.620 19932
10 1 . 1 1 9 9 ALA HA H 9 3.848 3.848 4.070 -0.222 19932
11 1 . 1 1 9 9 ALA H H 9 7.805 7.805 8.026 -0.221 19932
12 1 . 1 1 10 10 TRP HA H 10 4.421 4.421 4.360 0.061 19932
13 1 . 1 1 10 10 TRP H H 10 7.454 7.454 7.899 -0.445 19932
14 1 . 1 1 11 11 ARG HA H 11 3.898 3.898 4.265 -0.367 19932
15 1 . 1 1 11 11 ARG H H 11 7.694 7.694 7.426 0.268 19932
stop_
save_