data_19471
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19471
_Entry.PDB_ID 2MD4
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 19471
_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 2 2 LYS HA H 2 4.100 4.100 3.978 0.122 19471
2 1 1 . 1 1 2 2 LYS H H 2 8.017 8.017 8.830 -0.813 19471
3 1 1 . 1 1 3 3 LEU HA H 3 4.230 4.230 3.960 0.270 19471
4 1 1 . 1 1 3 3 LEU H H 3 7.929 7.929 6.890 1.039 19471
5 1 1 . 1 1 4 4 LEU HA H 4 4.376 4.376 4.175 0.201 19471
6 1 1 . 1 1 4 4 LEU H H 4 8.143 8.143 7.607 0.536 19471
7 1 1 . 1 1 5 5 SER HA H 5 4.425 4.425 4.187 0.238 19471
8 1 1 . 1 1 5 5 SER H H 5 8.205 8.205 8.684 -0.479 19471
9 1 1 . 1 1 6 6 LYS HA H 6 4.276 4.276 3.992 0.284 19471
10 1 1 . 1 1 6 6 LYS H H 6 8.284 8.284 7.988 0.296 19471
11 1 1 . 1 1 7 7 ALA HA H 7 4.274 4.274 3.992 0.282 19471
12 1 1 . 1 1 7 7 ALA H H 7 8.275 8.275 7.686 0.589 19471
13 1 1 . 1 1 8 8 GLN HA H 8 4.276 4.276 4.222 0.054 19471
14 1 1 . 1 1 8 8 GLN H H 8 8.350 8.350 7.821 0.529 19471
15 1 1 . 1 1 9 9 GLU HA H 9 4.315 4.315 4.020 0.295 19471
16 1 1 . 1 1 9 9 GLU H H 9 8.362 8.362 7.992 0.371 19471
17 1 1 . 1 1 10 10 LYS HA H 10 4.256 4.256 4.205 0.051 19471
18 1 1 . 1 1 10 10 LYS H H 10 8.364 8.364 7.437 0.927 19471
19 1 1 . 1 1 11 11 PHE HA H 11 4.633 4.633 4.770 -0.137 19471
20 1 1 . 1 1 11 11 PHE H H 11 8.363 8.363 8.119 0.244 19471
21 1 2 . 1 1 2 2 LYS HA H 2 4.100 4.100 3.978 0.122 19471
22 1 2 . 1 1 2 2 LYS H H 2 8.017 8.017 8.831 -0.814 19471
23 1 2 . 1 1 3 3 LEU HA H 3 4.230 4.230 3.960 0.270 19471
24 1 2 . 1 1 3 3 LEU H H 3 7.929 7.929 6.889 1.040 19471
25 1 2 . 1 1 4 4 LEU HA H 4 4.376 4.376 4.186 0.190 19471
26 1 2 . 1 1 4 4 LEU H H 4 8.143 8.143 7.593 0.550 19471
27 1 2 . 1 1 5 5 SER HA H 5 4.425 4.425 4.219 0.206 19471
28 1 2 . 1 1 5 5 SER H H 5 8.205 8.205 8.697 -0.492 19471
29 1 2 . 1 1 6 6 LYS HA H 6 4.276 4.276 3.999 0.277 19471
30 1 2 . 1 1 6 6 LYS H H 6 8.284 8.284 8.071 0.213 19471
31 1 2 . 1 1 7 7 ALA HA H 7 4.274 4.274 3.986 0.288 19471
32 1 2 . 1 1 7 7 ALA H H 7 8.275 8.275 7.785 0.490 19471
33 1 2 . 1 1 8 8 GLN HA H 8 4.276 4.276 4.226 0.050 19471
34 1 2 . 1 1 8 8 GLN H H 8 8.350 8.350 7.822 0.528 19471
35 1 2 . 1 1 9 9 GLU HA H 9 4.315 4.315 4.021 0.294 19471
36 1 2 . 1 1 9 9 GLU H H 9 8.362 8.362 7.991 0.371 19471
37 1 2 . 1 1 10 10 LYS HA H 10 4.256 4.256 4.249 0.007 19471
38 1 2 . 1 1 10 10 LYS H H 10 8.364 8.364 7.418 0.946 19471
39 1 2 . 1 1 11 11 PHE HA H 11 4.633 4.633 4.762 -0.129 19471
40 1 2 . 1 1 11 11 PHE H H 11 8.363 8.363 8.118 0.245 19471
41 1 3 . 1 1 2 2 LYS HA H 2 4.100 4.100 3.973 0.127 19471
42 1 3 . 1 1 2 2 LYS H H 2 8.017 8.017 8.828 -0.811 19471
43 1 3 . 1 1 3 3 LEU HA H 3 4.230 4.230 3.952 0.278 19471
44 1 3 . 1 1 3 3 LEU H H 3 7.929 7.929 6.898 1.031 19471
45 1 3 . 1 1 4 4 LEU HA H 4 4.376 4.376 4.169 0.207 19471
46 1 3 . 1 1 4 4 LEU H H 4 8.143 8.143 7.585 0.558 19471
47 1 3 . 1 1 5 5 SER HA H 5 4.425 4.425 4.173 0.252 19471
48 1 3 . 1 1 5 5 SER H H 5 8.205 8.205 8.701 -0.496 19471
49 1 3 . 1 1 6 6 LYS HA H 6 4.276 4.276 4.073 0.203 19471
50 1 3 . 1 1 6 6 LYS H H 6 8.284 8.284 7.959 0.325 19471
51 1 3 . 1 1 7 7 ALA HA H 7 4.274 4.274 4.052 0.222 19471
52 1 3 . 1 1 7 7 ALA H H 7 8.275 8.275 7.646 0.629 19471
53 1 3 . 1 1 8 8 GLN HA H 8 4.276 4.276 4.203 0.073 19471
54 1 3 . 1 1 8 8 GLN H H 8 8.350 8.350 7.736 0.614 19471
55 1 3 . 1 1 9 9 GLU HA H 9 4.315 4.315 4.017 0.298 19471
56 1 3 . 1 1 9 9 GLU H H 9 8.362 8.362 7.920 0.442 19471
57 1 3 . 1 1 10 10 LYS HA H 10 4.256 4.256 4.186 0.070 19471
58 1 3 . 1 1 10 10 LYS H H 10 8.364 8.364 7.549 0.815 19471
59 1 3 . 1 1 11 11 PHE HA H 11 4.633 4.633 4.780 -0.147 19471
60 1 3 . 1 1 11 11 PHE H H 11 8.363 8.363 8.126 0.237 19471
61 1 4 . 1 1 2 2 LYS HA H 2 4.100 4.100 3.961 0.139 19471
62 1 4 . 1 1 2 2 LYS H H 2 8.017 8.017 8.848 -0.831 19471
63 1 4 . 1 1 3 3 LEU HA H 3 4.230 4.230 3.949 0.281 19471
64 1 4 . 1 1 3 3 LEU H H 3 7.929 7.929 6.905 1.024 19471
65 1 4 . 1 1 4 4 LEU HA H 4 4.376 4.376 4.136 0.240 19471
66 1 4 . 1 1 4 4 LEU H H 4 8.143 8.143 7.491 0.652 19471
67 1 4 . 1 1 5 5 SER HA H 5 4.425 4.425 4.192 0.233 19471
68 1 4 . 1 1 5 5 SER H H 5 8.205 8.205 8.697 -0.492 19471
69 1 4 . 1 1 6 6 LYS HA H 6 4.276 4.276 4.079 0.197 19471
70 1 4 . 1 1 6 6 LYS H H 6 8.284 8.284 8.092 0.192 19471
71 1 4 . 1 1 7 7 ALA HA H 7 4.274 4.274 4.000 0.274 19471
72 1 4 . 1 1 7 7 ALA H H 7 8.275 8.275 7.600 0.675 19471
73 1 4 . 1 1 8 8 GLN HA H 8 4.276 4.276 4.154 0.122 19471
74 1 4 . 1 1 8 8 GLN H H 8 8.350 8.350 7.670 0.680 19471
75 1 4 . 1 1 9 9 GLU HA H 9 4.315 4.315 4.013 0.302 19471
76 1 4 . 1 1 9 9 GLU H H 9 8.362 8.362 7.980 0.382 19471
77 1 4 . 1 1 10 10 LYS HA H 10 4.256 4.256 4.187 0.069 19471
78 1 4 . 1 1 10 10 LYS H H 10 8.364 8.364 7.618 0.746 19471
79 1 4 . 1 1 11 11 PHE HA H 11 4.633 4.633 4.770 -0.137 19471
80 1 4 . 1 1 11 11 PHE H H 11 8.363 8.363 8.089 0.274 19471
81 1 5 . 1 1 2 2 LYS HA H 2 4.100 4.100 3.963 0.137 19471
82 1 5 . 1 1 2 2 LYS H H 2 8.017 8.017 8.849 -0.832 19471
83 1 5 . 1 1 3 3 LEU HA H 3 4.230 4.230 3.951 0.279 19471
84 1 5 . 1 1 3 3 LEU H H 3 7.929 7.929 6.904 1.025 19471
85 1 5 . 1 1 4 4 LEU HA H 4 4.376 4.376 4.148 0.228 19471
86 1 5 . 1 1 4 4 LEU H H 4 8.143 8.143 7.504 0.639 19471
87 1 5 . 1 1 5 5 SER HA H 5 4.425 4.425 4.229 0.196 19471
88 1 5 . 1 1 5 5 SER H H 5 8.205 8.205 8.673 -0.468 19471
89 1 5 . 1 1 6 6 LYS HA H 6 4.276 4.276 4.029 0.247 19471
90 1 5 . 1 1 6 6 LYS H H 6 8.284 8.284 8.106 0.178 19471
91 1 5 . 1 1 7 7 ALA HA H 7 4.274 4.274 3.999 0.275 19471
92 1 5 . 1 1 7 7 ALA H H 7 8.275 8.275 7.681 0.594 19471
93 1 5 . 1 1 8 8 GLN HA H 8 4.276 4.276 4.125 0.151 19471
94 1 5 . 1 1 8 8 GLN H H 8 8.350 8.350 7.818 0.532 19471
95 1 5 . 1 1 9 9 GLU HA H 9 4.315 4.315 3.978 0.337 19471
96 1 5 . 1 1 9 9 GLU H H 9 8.362 8.362 8.057 0.305 19471
97 1 5 . 1 1 10 10 LYS HA H 10 4.256 4.256 4.203 0.053 19471
98 1 5 . 1 1 10 10 LYS H H 10 8.364 8.364 7.422 0.942 19471
99 1 5 . 1 1 11 11 PHE HA H 11 4.633 4.633 4.749 -0.116 19471
100 1 5 . 1 1 11 11 PHE H H 11 8.363 8.363 8.130 0.233 19471
101 1 6 . 1 1 2 2 LYS HA H 2 4.100 4.100 3.977 0.123 19471
102 1 6 . 1 1 2 2 LYS H H 2 8.017 8.017 8.830 -0.813 19471
103 1 6 . 1 1 3 3 LEU HA H 3 4.230 4.230 3.959 0.271 19471
104 1 6 . 1 1 3 3 LEU H H 3 7.929 7.929 6.888 1.041 19471
105 1 6 . 1 1 4 4 LEU HA H 4 4.376 4.376 4.190 0.186 19471
106 1 6 . 1 1 4 4 LEU H H 4 8.143 8.143 7.672 0.471 19471
107 1 6 . 1 1 5 5 SER HA H 5 4.425 4.425 4.228 0.197 19471
108 1 6 . 1 1 5 5 SER H H 5 8.205 8.205 8.661 -0.456 19471
109 1 6 . 1 1 6 6 LYS HA H 6 4.276 4.276 3.991 0.285 19471
110 1 6 . 1 1 6 6 LYS H H 6 8.284 8.284 7.975 0.309 19471
111 1 6 . 1 1 7 7 ALA HA H 7 4.274 4.274 3.976 0.298 19471
112 1 6 . 1 1 7 7 ALA H H 7 8.275 8.275 7.725 0.550 19471
113 1 6 . 1 1 8 8 GLN HA H 8 4.276 4.276 4.154 0.122 19471
114 1 6 . 1 1 8 8 GLN H H 8 8.350 8.350 7.929 0.421 19471
115 1 6 . 1 1 9 9 GLU HA H 9 4.315 4.315 4.015 0.300 19471
116 1 6 . 1 1 9 9 GLU H H 9 8.362 8.362 7.976 0.386 19471
117 1 6 . 1 1 10 10 LYS HA H 10 4.256 4.256 4.213 0.043 19471
118 1 6 . 1 1 10 10 LYS H H 10 8.364 8.364 7.492 0.872 19471
119 1 6 . 1 1 11 11 PHE HA H 11 4.633 4.633 4.795 -0.162 19471
120 1 6 . 1 1 11 11 PHE H H 11 8.363 8.363 8.144 0.219 19471
121 1 7 . 1 1 2 2 LYS HA H 2 4.100 4.100 3.968 0.132 19471
122 1 7 . 1 1 2 2 LYS H H 2 8.017 8.017 8.824 -0.807 19471
123 1 7 . 1 1 3 3 LEU HA H 3 4.230 4.230 3.945 0.285 19471
124 1 7 . 1 1 3 3 LEU H H 3 7.929 7.929 6.879 1.050 19471
125 1 7 . 1 1 4 4 LEU HA H 4 4.376 4.376 4.128 0.248 19471
126 1 7 . 1 1 4 4 LEU H H 4 8.143 8.143 7.605 0.538 19471
127 1 7 . 1 1 5 5 SER HA H 5 4.425 4.425 4.162 0.263 19471
128 1 7 . 1 1 5 5 SER H H 5 8.205 8.205 8.659 -0.454 19471
129 1 7 . 1 1 6 6 LYS HA H 6 4.276 4.276 3.984 0.292 19471
130 1 7 . 1 1 6 6 LYS H H 6 8.284 8.284 7.978 0.306 19471
131 1 7 . 1 1 7 7 ALA HA H 7 4.274 4.274 3.852 0.422 19471
132 1 7 . 1 1 7 7 ALA H H 7 8.275 8.275 7.692 0.583 19471
133 1 7 . 1 1 8 8 GLN HA H 8 4.276 4.276 3.905 0.371 19471
134 1 7 . 1 1 8 8 GLN H H 8 8.350 8.350 7.828 0.522 19471
135 1 7 . 1 1 9 9 GLU HA H 9 4.315 4.315 4.015 0.300 19471
136 1 7 . 1 1 9 9 GLU H H 9 8.362 8.362 7.980 0.382 19471
137 1 7 . 1 1 10 10 LYS HA H 10 4.256 4.256 4.266 -0.011 19471
138 1 7 . 1 1 10 10 LYS H H 10 8.364 8.364 7.674 0.690 19471
139 1 7 . 1 1 11 11 PHE HA H 11 4.633 4.633 4.747 -0.114 19471
140 1 7 . 1 1 11 11 PHE H H 11 8.363 8.363 8.181 0.182 19471
141 1 8 . 1 1 2 2 LYS HA H 2 4.100 4.100 3.954 0.146 19471
142 1 8 . 1 1 2 2 LYS H H 2 8.017 8.017 8.843 -0.826 19471
143 1 8 . 1 1 3 3 LEU HA H 3 4.230 4.230 3.935 0.295 19471
144 1 8 . 1 1 3 3 LEU H H 3 7.929 7.929 6.893 1.036 19471
145 1 8 . 1 1 4 4 LEU HA H 4 4.376 4.376 4.093 0.283 19471
146 1 8 . 1 1 4 4 LEU H H 4 8.143 8.143 7.565 0.578 19471
147 1 8 . 1 1 5 5 SER HA H 5 4.425 4.425 4.148 0.277 19471
148 1 8 . 1 1 5 5 SER H H 5 8.205 8.205 8.697 -0.492 19471
149 1 8 . 1 1 6 6 LYS HA H 6 4.276 4.276 3.997 0.279 19471
150 1 8 . 1 1 6 6 LYS H H 6 8.284 8.284 8.060 0.224 19471
151 1 8 . 1 1 7 7 ALA HA H 7 4.274 4.274 3.870 0.404 19471
152 1 8 . 1 1 7 7 ALA H H 7 8.275 8.275 7.484 0.791 19471
153 1 8 . 1 1 8 8 GLN HA H 8 4.276 4.276 3.932 0.344 19471
154 1 8 . 1 1 8 8 GLN H H 8 8.350 8.350 7.518 0.832 19471
155 1 8 . 1 1 9 9 GLU HA H 9 4.315 4.315 3.969 0.346 19471
156 1 8 . 1 1 9 9 GLU H H 9 8.362 8.362 7.998 0.364 19471
157 1 8 . 1 1 10 10 LYS HA H 10 4.256 4.256 4.268 -0.012 19471
158 1 8 . 1 1 10 10 LYS H H 10 8.364 8.364 7.630 0.734 19471
159 1 8 . 1 1 11 11 PHE HA H 11 4.633 4.633 4.718 -0.085 19471
160 1 8 . 1 1 11 11 PHE H H 11 8.363 8.363 8.279 0.084 19471
161 1 9 . 1 1 2 2 LYS HA H 2 4.100 4.100 3.980 0.120 19471
162 1 9 . 1 1 2 2 LYS H H 2 8.017 8.017 8.832 -0.815 19471
163 1 9 . 1 1 3 3 LEU HA H 3 4.230 4.230 3.960 0.270 19471
164 1 9 . 1 1 3 3 LEU H H 3 7.929 7.929 6.891 1.038 19471
165 1 9 . 1 1 4 4 LEU HA H 4 4.376 4.376 4.190 0.186 19471
166 1 9 . 1 1 4 4 LEU H H 4 8.143 8.143 7.572 0.571 19471
167 1 9 . 1 1 5 5 SER HA H 5 4.425 4.425 4.219 0.206 19471
168 1 9 . 1 1 5 5 SER H H 5 8.205 8.205 8.668 -0.463 19471
169 1 9 . 1 1 6 6 LYS HA H 6 4.276 4.276 4.031 0.245 19471
170 1 9 . 1 1 6 6 LYS H H 6 8.284 8.284 8.008 0.276 19471
171 1 9 . 1 1 7 7 ALA HA H 7 4.274 4.274 3.989 0.285 19471
172 1 9 . 1 1 7 7 ALA H H 7 8.275 8.275 7.689 0.586 19471
173 1 9 . 1 1 8 8 GLN HA H 8 4.276 4.276 4.317 -0.041 19471
174 1 9 . 1 1 8 8 GLN H H 8 8.350 8.350 7.810 0.540 19471
175 1 9 . 1 1 9 9 GLU HA H 9 4.315 4.315 4.031 0.284 19471
176 1 9 . 1 1 9 9 GLU H H 9 8.362 8.362 8.103 0.259 19471
177 1 9 . 1 1 10 10 LYS HA H 10 4.256 4.256 4.234 0.022 19471
178 1 9 . 1 1 10 10 LYS H H 10 8.364 8.364 7.462 0.902 19471
179 1 9 . 1 1 11 11 PHE HA H 11 4.633 4.633 4.758 -0.125 19471
180 1 9 . 1 1 11 11 PHE H H 11 8.363 8.363 8.168 0.195 19471
181 1 10 . 1 1 2 2 LYS HA H 2 4.100 4.100 3.965 0.135 19471
182 1 10 . 1 1 2 2 LYS H H 2 8.017 8.017 8.850 -0.833 19471
183 1 10 . 1 1 3 3 LEU HA H 3 4.230 4.230 3.961 0.269 19471
184 1 10 . 1 1 3 3 LEU H H 3 7.929 7.929 6.920 1.009 19471
185 1 10 . 1 1 4 4 LEU HA H 4 4.376 4.376 4.105 0.271 19471
186 1 10 . 1 1 4 4 LEU H H 4 8.143 8.143 7.640 0.503 19471
187 1 10 . 1 1 5 5 SER HA H 5 4.425 4.425 4.186 0.239 19471
188 1 10 . 1 1 5 5 SER H H 5 8.205 8.205 8.694 -0.489 19471
189 1 10 . 1 1 6 6 LYS HA H 6 4.276 4.276 3.975 0.301 19471
190 1 10 . 1 1 6 6 LYS H H 6 8.284 8.284 8.054 0.230 19471
191 1 10 . 1 1 7 7 ALA HA H 7 4.274 4.274 3.993 0.281 19471
192 1 10 . 1 1 7 7 ALA H H 7 8.275 8.275 7.560 0.715 19471
193 1 10 . 1 1 8 8 GLN HA H 8 4.276 4.276 4.229 0.047 19471
194 1 10 . 1 1 8 8 GLN H H 8 8.350 8.350 7.802 0.548 19471
195 1 10 . 1 1 9 9 GLU HA H 9 4.315 4.315 4.024 0.291 19471
196 1 10 . 1 1 9 9 GLU H H 9 8.362 8.362 8.053 0.309 19471
197 1 10 . 1 1 10 10 LYS HA H 10 4.256 4.256 4.186 0.070 19471
198 1 10 . 1 1 10 10 LYS H H 10 8.364 8.364 7.514 0.850 19471
199 1 10 . 1 1 11 11 PHE HA H 11 4.633 4.633 4.771 -0.138 19471
200 1 10 . 1 1 11 11 PHE H H 11 8.363 8.363 8.115 0.248 19471
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 19471
2 1 1 "Average Difference" HA 10 0.214 -0.166 0.142 19471
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19471
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19471
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19471
6 1 1 "Average Difference" HN 10 0.635 -0.324 0.575 19471
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19471
8 1 2 "Average Difference" HA 10 0.208 -0.158 0.143 19471
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19471
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19471
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19471
12 1 2 "Average Difference" HN 10 0.628 -0.308 0.577 19471
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19471
14 1 3 "Average Difference" HA 10 0.203 -0.158 0.134 19471
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19471
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19471
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19471
18 1 3 "Average Difference" HN 10 0.638 -0.334 0.573 19471
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19471
20 1 4 "Average Difference" HA 10 0.213 -0.172 0.133 19471
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19471
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19471
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19471
24 1 4 "Average Difference" HN 10 0.643 -0.330 0.582 19471
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19471
26 1 5 "Average Difference" HA 10 0.218 -0.179 0.132 19471
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19471
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19471
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19471
30 1 5 "Average Difference" HN 10 0.638 -0.315 0.585 19471
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19471
32 1 6 "Average Difference" HA 10 0.216 -0.166 0.145 19471
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19471
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19471
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19471
36 1 6 "Average Difference" HN 10 0.609 -0.300 0.558 19471
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19471
38 1 7 "Average Difference" HA 10 0.271 -0.219 0.168 19471
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19471
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19471
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19471
42 1 7 "Average Difference" HN 10 0.601 -0.299 0.549 19471
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19471
44 1 8 "Average Difference" HA 10 0.274 -0.228 0.161 19471
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19471
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19471
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19471
48 1 8 "Average Difference" HN 10 0.662 -0.333 0.603 19471
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19471
50 1 9 "Average Difference" HA 10 0.201 -0.145 0.146 19471
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19471
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19471
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19471
54 1 9 "Average Difference" HN 10 0.626 -0.309 0.573 19471
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19471
56 1 10 "Average Difference" HA 10 0.224 -0.177 0.145 19471
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19471
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19471
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19471
60 1 10 "Average Difference" HN 10 0.628 -0.309 0.577 19471
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 19471
_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 2 2 LYS HA H 2 4.100 4.100 3.970 0.130 19471
2 1 . 1 1 2 2 LYS H H 2 8.017 8.017 8.837 -0.820 19471
3 1 . 1 1 3 3 LEU HA H 3 4.230 4.230 3.953 0.277 19471
4 1 . 1 1 3 3 LEU H H 3 7.929 7.929 6.896 1.033 19471
5 1 . 1 1 4 4 LEU HA H 4 4.376 4.376 4.152 0.224 19471
6 1 . 1 1 4 4 LEU H H 4 8.143 8.143 7.583 0.560 19471
7 1 . 1 1 5 5 SER HA H 5 4.425 4.425 4.194 0.231 19471
8 1 . 1 1 5 5 SER H H 5 8.205 8.205 8.683 -0.478 19471
9 1 . 1 1 6 6 LYS HA H 6 4.276 4.276 4.015 0.261 19471
10 1 . 1 1 6 6 LYS H H 6 8.284 8.284 8.029 0.255 19471
11 1 . 1 1 7 7 ALA HA H 7 4.274 4.274 3.971 0.303 19471
12 1 . 1 1 7 7 ALA H H 7 8.275 8.275 7.655 0.620 19471
13 1 . 1 1 8 8 GLN HA H 8 4.276 4.276 4.147 0.129 19471
14 1 . 1 1 8 8 GLN H H 8 8.350 8.350 7.775 0.575 19471
15 1 . 1 1 9 9 GLU HA H 9 4.315 4.315 4.010 0.305 19471
16 1 . 1 1 9 9 GLU H H 9 8.362 8.362 8.005 0.357 19471
17 1 . 1 1 10 10 LYS HA H 10 4.256 4.256 4.220 0.036 19471
18 1 . 1 1 10 10 LYS H H 10 8.364 8.364 7.522 0.842 19471
19 1 . 1 1 11 11 PHE HA H 11 4.633 4.633 4.762 -0.129 19471
20 1 . 1 1 11 11 PHE H H 11 8.363 8.363 8.147 0.216 19471
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