data_18418
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18418
_Entry.PDB_ID 2LS9
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 18418
_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 TRP HA H 2 4.595 4.595 5.282 -0.687 18418
2 1 1 . 1 1 2 2 TRP H H 2 8.575 8.575 8.001 0.574 18418
3 1 1 . 1 1 3 3 GLY H H 3 8.113 8.113 8.067 0.046 18418
4 1 1 . 1 1 4 4 SER HA H 4 4.803 4.803 4.041 0.762 18418
5 1 1 . 1 1 4 4 SER H H 4 8.490 8.490 8.225 0.265 18418
6 1 1 . 1 1 5 5 PHE HA H 5 4.284 4.284 4.620 -0.336 18418
7 1 1 . 1 1 5 5 PHE H H 5 8.067 8.067 7.252 0.815 18418
8 1 1 . 1 1 6 6 PHE HA H 6 4.183 4.183 4.336 -0.153 18418
9 1 1 . 1 1 6 6 PHE H H 6 8.306 8.306 7.534 0.772 18418
10 1 1 . 1 1 7 7 LYS HA H 7 4.028 4.028 4.000 0.028 18418
11 1 1 . 1 1 7 7 LYS H H 7 8.100 8.100 8.756 -0.656 18418
12 1 1 . 1 1 8 8 LYS HA H 8 4.159 4.159 4.077 0.082 18418
13 1 1 . 1 1 8 8 LYS H H 8 7.734 7.734 7.835 -0.101 18418
14 1 1 . 1 1 9 9 ALA HA H 9 3.970 3.970 4.414 -0.444 18418
15 1 1 . 1 1 9 9 ALA H H 9 8.328 8.328 8.260 0.068 18418
16 1 1 . 1 1 10 10 ALA HA H 10 3.988 3.988 4.131 -0.143 18418
17 1 1 . 1 1 10 10 ALA H H 10 8.295 8.295 7.745 0.550 18418
18 1 1 . 1 1 11 11 HIS HA H 11 4.415 4.415 4.296 0.119 18418
19 1 1 . 1 1 11 11 HIS H H 11 7.890 7.890 8.238 -0.348 18418
20 1 1 . 1 1 12 12 VAL HA H 12 3.848 3.848 4.024 -0.176 18418
21 1 1 . 1 1 12 12 VAL H H 12 8.154 8.154 7.538 0.616 18418
22 1 1 . 1 1 13 13 GLY H H 13 8.869 8.869 8.215 0.654 18418
23 1 1 . 1 1 14 14 LYS HA H 14 4.002 4.002 3.905 0.097 18418
24 1 1 . 1 1 14 14 LYS H H 14 8.321 8.321 8.093 0.228 18418
25 1 1 . 1 1 15 15 HIS HA H 15 4.413 4.413 4.245 0.168 18418
26 1 1 . 1 1 15 15 HIS H H 15 7.749 7.749 7.484 0.265 18418
27 1 1 . 1 1 16 16 VAL HA H 16 3.829 3.829 4.410 -0.581 18418
28 1 1 . 1 1 16 16 VAL H H 16 8.540 8.540 7.542 0.998 18418
29 1 1 . 1 1 17 17 GLY H H 17 8.711 8.711 7.932 0.779 18418
30 1 1 . 1 1 18 18 LYS HA H 18 4.065 4.065 4.017 0.048 18418
31 1 1 . 1 1 18 18 LYS H H 18 8.312 8.312 8.127 0.185 18418
32 1 1 . 1 1 19 19 ALA HA H 19 4.215 4.215 4.506 -0.291 18418
33 1 1 . 1 1 19 19 ALA H H 19 7.968 7.968 7.664 0.304 18418
34 1 1 . 1 1 20 20 ALA HA H 20 4.162 4.162 4.144 0.018 18418
35 1 1 . 1 1 20 20 ALA H H 20 8.562 8.562 7.638 0.924 18418
36 1 1 . 1 1 21 21 LEU HA H 21 4.175 4.175 4.146 0.029 18418
37 1 1 . 1 1 21 21 LEU H H 21 8.437 8.437 7.319 1.118 18418
38 1 1 . 1 1 22 22 THR HA H 22 3.960 3.960 4.243 -0.283 18418
39 1 1 . 1 1 22 22 THR H H 22 8.338 8.338 7.915 0.423 18418
40 1 1 . 1 1 23 23 HIS HA H 23 4.333 4.333 4.942 -0.609 18418
41 1 1 . 1 1 23 23 HIS H H 23 8.067 8.067 7.762 0.305 18418
42 1 1 . 1 1 24 24 TYR HA H 24 4.306 4.306 4.488 -0.182 18418
43 1 1 . 1 1 24 24 TYR H H 24 8.333 8.333 8.165 0.168 18418
44 1 2 . 1 1 2 2 TRP HA H 2 4.595 4.595 5.042 -0.447 18418
45 1 2 . 1 1 2 2 TRP H H 2 8.575 8.575 8.430 0.145 18418
46 1 2 . 1 1 3 3 GLY H H 3 8.113 8.113 8.980 -0.867 18418
47 1 2 . 1 1 4 4 SER HA H 4 4.803 4.803 4.723 0.080 18418
48 1 2 . 1 1 4 4 SER H H 4 8.490 8.490 7.612 0.878 18418
49 1 2 . 1 1 5 5 PHE HA H 5 4.284 4.284 4.546 -0.262 18418
50 1 2 . 1 1 5 5 PHE H H 5 8.067 8.067 7.961 0.106 18418
51 1 2 . 1 1 6 6 PHE HA H 6 4.183 4.183 4.362 -0.179 18418
52 1 2 . 1 1 6 6 PHE H H 6 8.306 8.306 7.627 0.679 18418
53 1 2 . 1 1 7 7 LYS HA H 7 4.028 4.028 4.067 -0.039 18418
54 1 2 . 1 1 7 7 LYS H H 7 8.100 8.100 7.989 0.111 18418
55 1 2 . 1 1 8 8 LYS HA H 8 4.159 4.159 4.642 -0.483 18418
56 1 2 . 1 1 8 8 LYS H H 8 7.734 7.734 7.615 0.119 18418
57 1 2 . 1 1 9 9 ALA HA H 9 3.970 3.970 4.160 -0.190 18418
58 1 2 . 1 1 9 9 ALA H H 9 8.328 8.328 7.335 0.993 18418
59 1 2 . 1 1 10 10 ALA HA H 10 3.988 3.988 4.066 -0.078 18418
60 1 2 . 1 1 10 10 ALA H H 10 8.295 8.295 8.748 -0.453 18418
61 1 2 . 1 1 11 11 HIS HA H 11 4.415 4.415 4.279 0.136 18418
62 1 2 . 1 1 11 11 HIS H H 11 7.890 7.890 7.884 0.006 18418
63 1 2 . 1 1 12 12 VAL HA H 12 3.848 3.848 3.911 -0.063 18418
64 1 2 . 1 1 12 12 VAL H H 12 8.154 8.154 7.516 0.638 18418
65 1 2 . 1 1 13 13 GLY H H 13 8.869 8.869 8.746 0.123 18418
66 1 2 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.282 -0.280 18418
67 1 2 . 1 1 14 14 LYS H H 14 8.321 8.321 7.555 0.766 18418
68 1 2 . 1 1 15 15 HIS HA H 15 4.413 4.413 4.311 0.102 18418
69 1 2 . 1 1 15 15 HIS H H 15 7.749 7.749 7.579 0.170 18418
70 1 2 . 1 1 16 16 VAL HA H 16 3.829 3.829 3.742 0.087 18418
71 1 2 . 1 1 16 16 VAL H H 16 8.540 8.540 8.001 0.539 18418
72 1 2 . 1 1 17 17 GLY H H 17 8.711 8.711 8.643 0.068 18418
73 1 2 . 1 1 18 18 LYS HA H 18 4.065 4.065 4.057 0.008 18418
74 1 2 . 1 1 18 18 LYS H H 18 8.312 8.312 8.150 0.162 18418
75 1 2 . 1 1 19 19 ALA HA H 19 4.215 4.215 4.322 -0.107 18418
76 1 2 . 1 1 19 19 ALA H H 19 7.968 7.968 7.959 0.009 18418
77 1 2 . 1 1 20 20 ALA HA H 20 4.162 4.162 4.336 -0.174 18418
78 1 2 . 1 1 20 20 ALA H H 20 8.562 8.562 7.597 0.965 18418
79 1 2 . 1 1 21 21 LEU HA H 21 4.175 4.175 3.321 0.854 18418
80 1 2 . 1 1 21 21 LEU H H 21 8.437 8.437 8.249 0.188 18418
81 1 2 . 1 1 22 22 THR HA H 22 3.960 3.960 4.104 -0.144 18418
82 1 2 . 1 1 22 22 THR H H 22 8.338 8.338 7.512 0.826 18418
83 1 2 . 1 1 23 23 HIS HA H 23 4.333 4.333 4.515 -0.182 18418
84 1 2 . 1 1 23 23 HIS H H 23 8.067 8.067 7.561 0.506 18418
85 1 2 . 1 1 24 24 TYR HA H 24 4.306 4.306 4.612 -0.306 18418
86 1 2 . 1 1 24 24 TYR H H 24 8.333 8.333 7.351 0.982 18418
87 1 3 . 1 1 2 2 TRP HA H 2 4.595 4.595 5.057 -0.462 18418
88 1 3 . 1 1 2 2 TRP H H 2 8.575 8.575 8.771 -0.196 18418
89 1 3 . 1 1 3 3 GLY H H 3 8.113 8.113 8.260 -0.147 18418
90 1 3 . 1 1 4 4 SER HA H 4 4.803 4.803 4.163 0.640 18418
91 1 3 . 1 1 4 4 SER H H 4 8.490 8.490 8.649 -0.159 18418
92 1 3 . 1 1 5 5 PHE HA H 5 4.284 4.284 4.578 -0.294 18418
93 1 3 . 1 1 5 5 PHE H H 5 8.067 8.067 7.902 0.165 18418
94 1 3 . 1 1 6 6 PHE HA H 6 4.183 4.183 3.422 0.761 18418
95 1 3 . 1 1 6 6 PHE H H 6 8.306 8.306 7.700 0.606 18418
96 1 3 . 1 1 7 7 LYS HA H 7 4.028 4.028 3.839 0.189 18418
97 1 3 . 1 1 7 7 LYS H H 7 8.100 8.100 8.422 -0.322 18418
98 1 3 . 1 1 8 8 LYS HA H 8 4.159 4.159 3.849 0.310 18418
99 1 3 . 1 1 8 8 LYS H H 8 7.734 7.734 7.172 0.562 18418
100 1 3 . 1 1 9 9 ALA HA H 9 3.970 3.970 4.094 -0.124 18418
101 1 3 . 1 1 9 9 ALA H H 9 8.328 8.328 7.550 0.778 18418
102 1 3 . 1 1 10 10 ALA HA H 10 3.988 3.988 3.878 0.110 18418
103 1 3 . 1 1 10 10 ALA H H 10 8.295 8.295 7.788 0.507 18418
104 1 3 . 1 1 11 11 HIS HA H 11 4.415 4.415 4.226 0.189 18418
105 1 3 . 1 1 11 11 HIS H H 11 7.890 7.890 7.599 0.291 18418
106 1 3 . 1 1 12 12 VAL HA H 12 3.848 3.848 4.001 -0.153 18418
107 1 3 . 1 1 12 12 VAL H H 12 8.154 8.154 7.333 0.821 18418
108 1 3 . 1 1 13 13 GLY H H 13 8.869 8.869 8.428 0.441 18418
109 1 3 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.108 -0.106 18418
110 1 3 . 1 1 14 14 LYS H H 14 8.321 8.321 7.898 0.423 18418
111 1 3 . 1 1 15 15 HIS HA H 15 4.413 4.413 4.361 0.052 18418
112 1 3 . 1 1 15 15 HIS H H 15 7.749 7.749 7.665 0.084 18418
113 1 3 . 1 1 16 16 VAL HA H 16 3.829 3.829 4.432 -0.603 18418
114 1 3 . 1 1 16 16 VAL H H 16 8.540 8.540 7.866 0.674 18418
115 1 3 . 1 1 17 17 GLY H H 17 8.711 8.711 7.705 1.006 18418
116 1 3 . 1 1 18 18 LYS HA H 18 4.065 4.065 4.211 -0.146 18418
117 1 3 . 1 1 18 18 LYS H H 18 8.312 8.312 8.243 0.069 18418
118 1 3 . 1 1 19 19 ALA HA H 19 4.215 4.215 4.719 -0.504 18418
119 1 3 . 1 1 19 19 ALA H H 19 7.968 7.968 7.361 0.607 18418
120 1 3 . 1 1 20 20 ALA HA H 20 4.162 4.162 4.409 -0.247 18418
121 1 3 . 1 1 20 20 ALA H H 20 8.562 8.562 8.100 0.462 18418
122 1 3 . 1 1 21 21 LEU HA H 21 4.175 4.175 4.157 0.018 18418
123 1 3 . 1 1 21 21 LEU H H 21 8.437 8.437 8.581 -0.144 18418
124 1 3 . 1 1 22 22 THR HA H 22 3.960 3.960 4.254 -0.294 18418
125 1 3 . 1 1 22 22 THR H H 22 8.338 8.338 8.420 -0.082 18418
126 1 3 . 1 1 23 23 HIS HA H 23 4.333 4.333 4.857 -0.524 18418
127 1 3 . 1 1 23 23 HIS H H 23 8.067 8.067 8.168 -0.101 18418
128 1 3 . 1 1 24 24 TYR HA H 24 4.306 4.306 4.502 -0.196 18418
129 1 3 . 1 1 24 24 TYR H H 24 8.333 8.333 8.102 0.231 18418
130 1 4 . 1 1 2 2 TRP HA H 2 4.595 4.595 5.115 -0.520 18418
131 1 4 . 1 1 2 2 TRP H H 2 8.575 8.575 8.083 0.492 18418
132 1 4 . 1 1 3 3 GLY H H 3 8.113 8.113 8.121 -0.008 18418
133 1 4 . 1 1 4 4 SER HA H 4 4.803 4.803 4.158 0.645 18418
134 1 4 . 1 1 4 4 SER H H 4 8.490 8.490 7.958 0.532 18418
135 1 4 . 1 1 5 5 PHE HA H 5 4.284 4.284 4.482 -0.198 18418
136 1 4 . 1 1 5 5 PHE H H 5 8.067 8.067 7.099 0.968 18418
137 1 4 . 1 1 6 6 PHE HA H 6 4.183 4.183 4.666 -0.483 18418
138 1 4 . 1 1 6 6 PHE H H 6 8.306 8.306 8.363 -0.057 18418
139 1 4 . 1 1 7 7 LYS HA H 7 4.028 4.028 4.355 -0.327 18418
140 1 4 . 1 1 7 7 LYS H H 7 8.100 8.100 8.730 -0.630 18418
141 1 4 . 1 1 8 8 LYS HA H 8 4.159 4.159 4.178 -0.020 18418
142 1 4 . 1 1 8 8 LYS H H 8 7.734 7.734 8.715 -0.981 18418
143 1 4 . 1 1 9 9 ALA HA H 9 3.970 3.970 4.313 -0.343 18418
144 1 4 . 1 1 9 9 ALA H H 9 8.328 8.328 8.195 0.133 18418
145 1 4 . 1 1 10 10 ALA HA H 10 3.988 3.988 4.270 -0.282 18418
146 1 4 . 1 1 10 10 ALA H H 10 8.295 8.295 7.603 0.692 18418
147 1 4 . 1 1 11 11 HIS HA H 11 4.415 4.415 4.642 -0.227 18418
148 1 4 . 1 1 11 11 HIS H H 11 7.890 7.890 7.761 0.130 18418
149 1 4 . 1 1 12 12 VAL HA H 12 3.848 3.848 3.963 -0.115 18418
150 1 4 . 1 1 12 12 VAL H H 12 8.154 8.154 8.452 -0.298 18418
151 1 4 . 1 1 13 13 GLY H H 13 8.869 8.869 8.593 0.276 18418
152 1 4 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.239 -0.237 18418
153 1 4 . 1 1 14 14 LYS H H 14 8.321 8.321 7.483 0.838 18418
154 1 4 . 1 1 15 15 HIS HA H 15 4.413 4.413 4.300 0.113 18418
155 1 4 . 1 1 15 15 HIS H H 15 7.749 7.749 7.657 0.092 18418
156 1 4 . 1 1 16 16 VAL HA H 16 3.829 3.829 3.623 0.205 18418
157 1 4 . 1 1 16 16 VAL H H 16 8.540 8.540 7.808 0.732 18418
158 1 4 . 1 1 17 17 GLY H H 17 8.711 8.711 8.093 0.618 18418
159 1 4 . 1 1 18 18 LYS HA H 18 4.065 4.065 4.306 -0.241 18418
160 1 4 . 1 1 18 18 LYS H H 18 8.312 8.312 8.114 0.198 18418
161 1 4 . 1 1 19 19 ALA HA H 19 4.215 4.215 4.476 -0.261 18418
162 1 4 . 1 1 19 19 ALA H H 19 7.968 7.968 7.842 0.126 18418
163 1 4 . 1 1 20 20 ALA HA H 20 4.162 4.162 4.536 -0.374 18418
164 1 4 . 1 1 20 20 ALA H H 20 8.562 8.562 7.206 1.356 18418
165 1 4 . 1 1 21 21 LEU HA H 21 4.175 4.175 3.351 0.824 18418
166 1 4 . 1 1 21 21 LEU H H 21 8.437 8.437 7.667 0.770 18418
167 1 4 . 1 1 22 22 THR HA H 22 3.960 3.960 3.895 0.065 18418
168 1 4 . 1 1 22 22 THR H H 22 8.338 8.338 7.803 0.535 18418
169 1 4 . 1 1 23 23 HIS HA H 23 4.333 4.333 4.349 -0.016 18418
170 1 4 . 1 1 23 23 HIS H H 23 8.067 8.067 7.671 0.396 18418
171 1 4 . 1 1 24 24 TYR HA H 24 4.306 4.306 4.782 -0.476 18418
172 1 4 . 1 1 24 24 TYR H H 24 8.333 8.333 7.235 1.098 18418
173 1 5 . 1 1 2 2 TRP HA H 2 4.595 4.595 4.727 -0.132 18418
174 1 5 . 1 1 2 2 TRP H H 2 8.575 8.575 8.737 -0.162 18418
175 1 5 . 1 1 3 3 GLY H H 3 8.113 8.113 8.051 0.062 18418
176 1 5 . 1 1 4 4 SER HA H 4 4.803 4.803 4.257 0.546 18418
177 1 5 . 1 1 4 4 SER H H 4 8.490 8.490 7.809 0.681 18418
178 1 5 . 1 1 5 5 PHE HA H 5 4.284 4.284 4.266 0.018 18418
179 1 5 . 1 1 5 5 PHE H H 5 8.067 8.067 7.545 0.522 18418
180 1 5 . 1 1 6 6 PHE HA H 6 4.183 4.183 3.843 0.340 18418
181 1 5 . 1 1 6 6 PHE H H 6 8.306 8.306 8.424 -0.118 18418
182 1 5 . 1 1 7 7 LYS HA H 7 4.028 4.028 3.866 0.162 18418
183 1 5 . 1 1 7 7 LYS H H 7 8.100 8.100 7.970 0.130 18418
184 1 5 . 1 1 8 8 LYS HA H 8 4.159 4.159 4.267 -0.108 18418
185 1 5 . 1 1 8 8 LYS H H 8 7.734 7.734 7.717 0.017 18418
186 1 5 . 1 1 9 9 ALA HA H 9 3.970 3.970 4.490 -0.520 18418
187 1 5 . 1 1 9 9 ALA H H 9 8.328 8.328 7.660 0.668 18418
188 1 5 . 1 1 10 10 ALA HA H 10 3.988 3.988 4.719 -0.731 18418
189 1 5 . 1 1 10 10 ALA H H 10 8.295 8.295 8.623 -0.328 18418
190 1 5 . 1 1 11 11 HIS HA H 11 4.415 4.415 4.282 0.133 18418
191 1 5 . 1 1 11 11 HIS H H 11 7.890 7.890 8.437 -0.547 18418
192 1 5 . 1 1 12 12 VAL HA H 12 3.848 3.848 4.183 -0.335 18418
193 1 5 . 1 1 12 12 VAL H H 12 8.154 8.154 7.951 0.203 18418
194 1 5 . 1 1 13 13 GLY H H 13 8.869 8.869 8.549 0.320 18418
195 1 5 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.246 -0.244 18418
196 1 5 . 1 1 14 14 LYS H H 14 8.321 8.321 7.658 0.663 18418
197 1 5 . 1 1 15 15 HIS HA H 15 4.413 4.413 4.349 0.064 18418
198 1 5 . 1 1 15 15 HIS H H 15 7.749 7.749 7.585 0.164 18418
199 1 5 . 1 1 16 16 VAL HA H 16 3.829 3.829 3.811 0.018 18418
200 1 5 . 1 1 16 16 VAL H H 16 8.540 8.540 7.657 0.883 18418
201 1 5 . 1 1 17 17 GLY H H 17 8.711 8.711 8.376 0.335 18418
202 1 5 . 1 1 18 18 LYS HA H 18 4.065 4.065 4.293 -0.228 18418
203 1 5 . 1 1 18 18 LYS H H 18 8.312 8.312 8.143 0.169 18418
204 1 5 . 1 1 19 19 ALA HA H 19 4.215 4.215 4.341 -0.126 18418
205 1 5 . 1 1 19 19 ALA H H 19 7.968 7.968 8.296 -0.328 18418
206 1 5 . 1 1 20 20 ALA HA H 20 4.162 4.162 4.416 -0.254 18418
207 1 5 . 1 1 20 20 ALA H H 20 8.562 8.562 7.953 0.609 18418
208 1 5 . 1 1 21 21 LEU HA H 21 4.175 4.175 3.716 0.459 18418
209 1 5 . 1 1 21 21 LEU H H 21 8.437 8.437 7.330 1.107 18418
210 1 5 . 1 1 22 22 THR HA H 22 3.960 3.960 4.088 -0.128 18418
211 1 5 . 1 1 22 22 THR H H 22 8.338 8.338 7.367 0.971 18418
212 1 5 . 1 1 23 23 HIS HA H 23 4.333 4.333 4.534 -0.201 18418
213 1 5 . 1 1 23 23 HIS H H 23 8.067 8.067 7.409 0.658 18418
214 1 5 . 1 1 24 24 TYR HA H 24 4.306 4.306 4.774 -0.468 18418
215 1 5 . 1 1 24 24 TYR H H 24 8.333 8.333 7.236 1.097 18418
216 1 6 . 1 1 2 2 TRP HA H 2 4.595 4.595 5.110 -0.515 18418
217 1 6 . 1 1 2 2 TRP H H 2 8.575 8.575 8.347 0.228 18418
218 1 6 . 1 1 3 3 GLY H H 3 8.113 8.113 7.492 0.621 18418
219 1 6 . 1 1 4 4 SER HA H 4 4.803 4.803 4.230 0.573 18418
220 1 6 . 1 1 4 4 SER H H 4 8.490 8.490 8.059 0.431 18418
221 1 6 . 1 1 5 5 PHE HA H 5 4.284 4.284 4.501 -0.217 18418
222 1 6 . 1 1 5 5 PHE H H 5 8.067 8.067 7.512 0.555 18418
223 1 6 . 1 1 6 6 PHE HA H 6 4.183 4.183 3.996 0.187 18418
224 1 6 . 1 1 6 6 PHE H H 6 8.306 8.306 7.384 0.922 18418
225 1 6 . 1 1 7 7 LYS HA H 7 4.028 4.028 3.714 0.314 18418
226 1 6 . 1 1 7 7 LYS H H 7 8.100 8.100 8.578 -0.478 18418
227 1 6 . 1 1 8 8 LYS HA H 8 4.159 4.159 4.556 -0.397 18418
228 1 6 . 1 1 8 8 LYS H H 8 7.734 7.734 7.589 0.145 18418
229 1 6 . 1 1 9 9 ALA HA H 9 3.970 3.970 4.126 -0.156 18418
230 1 6 . 1 1 9 9 ALA H H 9 8.328 8.328 8.045 0.283 18418
231 1 6 . 1 1 10 10 ALA HA H 10 3.988 3.988 4.215 -0.227 18418
232 1 6 . 1 1 10 10 ALA H H 10 8.295 8.295 8.508 -0.213 18418
233 1 6 . 1 1 11 11 HIS HA H 11 4.415 4.415 4.625 -0.210 18418
234 1 6 . 1 1 11 11 HIS H H 11 7.890 7.890 7.640 0.250 18418
235 1 6 . 1 1 12 12 VAL HA H 12 3.848 3.848 4.253 -0.405 18418
236 1 6 . 1 1 12 12 VAL H H 12 8.154 8.154 8.345 -0.191 18418
237 1 6 . 1 1 13 13 GLY H H 13 8.869 8.869 8.161 0.708 18418
238 1 6 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.045 -0.043 18418
239 1 6 . 1 1 14 14 LYS H H 14 8.321 8.321 8.215 0.106 18418
240 1 6 . 1 1 15 15 HIS HA H 15 4.413 4.413 4.301 0.112 18418
241 1 6 . 1 1 15 15 HIS H H 15 7.749 7.749 7.557 0.192 18418
242 1 6 . 1 1 16 16 VAL HA H 16 3.829 3.829 4.459 -0.630 18418
243 1 6 . 1 1 16 16 VAL H H 16 8.540 8.540 7.623 0.917 18418
244 1 6 . 1 1 17 17 GLY H H 17 8.711 8.711 7.638 1.073 18418
245 1 6 . 1 1 18 18 LYS HA H 18 4.065 4.065 4.189 -0.124 18418
246 1 6 . 1 1 18 18 LYS H H 18 8.312 8.312 7.809 0.503 18418
247 1 6 . 1 1 19 19 ALA HA H 19 4.215 4.215 4.457 -0.242 18418
248 1 6 . 1 1 19 19 ALA H H 19 7.968 7.968 8.027 -0.059 18418
249 1 6 . 1 1 20 20 ALA HA H 20 4.162 4.162 4.292 -0.130 18418
250 1 6 . 1 1 20 20 ALA H H 20 8.562 8.562 7.775 0.787 18418
251 1 6 . 1 1 21 21 LEU HA H 21 4.175 4.175 4.109 0.066 18418
252 1 6 . 1 1 21 21 LEU H H 21 8.437 8.437 7.359 1.078 18418
253 1 6 . 1 1 22 22 THR HA H 22 3.960 3.960 4.180 -0.220 18418
254 1 6 . 1 1 22 22 THR H H 22 8.338 8.338 7.615 0.723 18418
255 1 6 . 1 1 23 23 HIS HA H 23 4.333 4.333 4.509 -0.176 18418
256 1 6 . 1 1 23 23 HIS H H 23 8.067 8.067 7.479 0.588 18418
257 1 6 . 1 1 24 24 TYR HA H 24 4.306 4.306 4.918 -0.612 18418
258 1 6 . 1 1 24 24 TYR H H 24 8.333 8.333 7.390 0.943 18418
259 1 7 . 1 1 2 2 TRP HA H 2 4.595 4.595 4.451 0.144 18418
260 1 7 . 1 1 2 2 TRP H H 2 8.575 8.575 8.436 0.139 18418
261 1 7 . 1 1 3 3 GLY H H 3 8.113 8.113 7.998 0.115 18418
262 1 7 . 1 1 4 4 SER HA H 4 4.803 4.803 4.131 0.672 18418
263 1 7 . 1 1 4 4 SER H H 4 8.490 8.490 8.525 -0.035 18418
264 1 7 . 1 1 5 5 PHE HA H 5 4.284 4.284 4.601 -0.317 18418
265 1 7 . 1 1 5 5 PHE H H 5 8.067 8.067 7.955 0.112 18418
266 1 7 . 1 1 6 6 PHE HA H 6 4.183 4.183 4.610 -0.427 18418
267 1 7 . 1 1 6 6 PHE H H 6 8.306 8.306 7.870 0.436 18418
268 1 7 . 1 1 7 7 LYS HA H 7 4.028 4.028 3.836 0.192 18418
269 1 7 . 1 1 7 7 LYS H H 7 8.100 8.100 8.783 -0.683 18418
270 1 7 . 1 1 8 8 LYS HA H 8 4.159 4.159 4.320 -0.161 18418
271 1 7 . 1 1 8 8 LYS H H 8 7.734 7.734 8.198 -0.464 18418
272 1 7 . 1 1 9 9 ALA HA H 9 3.970 3.970 4.182 -0.212 18418
273 1 7 . 1 1 9 9 ALA H H 9 8.328 8.328 7.378 0.950 18418
274 1 7 . 1 1 10 10 ALA HA H 10 3.988 3.988 4.389 -0.401 18418
275 1 7 . 1 1 10 10 ALA H H 10 8.295 8.295 8.006 0.289 18418
276 1 7 . 1 1 11 11 HIS HA H 11 4.415 4.415 4.241 0.174 18418
277 1 7 . 1 1 11 11 HIS H H 11 7.890 7.890 7.569 0.321 18418
278 1 7 . 1 1 12 12 VAL HA H 12 3.848 3.848 3.796 0.052 18418
279 1 7 . 1 1 12 12 VAL H H 12 8.154 8.154 7.797 0.357 18418
280 1 7 . 1 1 13 13 GLY H H 13 8.869 8.869 8.706 0.163 18418
281 1 7 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.053 -0.051 18418
282 1 7 . 1 1 14 14 LYS H H 14 8.321 8.321 7.433 0.888 18418
283 1 7 . 1 1 15 15 HIS HA H 15 4.413 4.413 4.348 0.065 18418
284 1 7 . 1 1 15 15 HIS H H 15 7.749 7.749 7.599 0.150 18418
285 1 7 . 1 1 16 16 VAL HA H 16 3.829 3.829 3.637 0.192 18418
286 1 7 . 1 1 16 16 VAL H H 16 8.540 8.540 7.517 1.023 18418
287 1 7 . 1 1 17 17 GLY H H 17 8.711 8.711 8.003 0.708 18418
288 1 7 . 1 1 18 18 LYS HA H 18 4.065 4.065 4.095 -0.030 18418
289 1 7 . 1 1 18 18 LYS H H 18 8.312 8.312 8.216 0.096 18418
290 1 7 . 1 1 19 19 ALA HA H 19 4.215 4.215 4.463 -0.248 18418
291 1 7 . 1 1 19 19 ALA H H 19 7.968 7.968 8.238 -0.270 18418
292 1 7 . 1 1 20 20 ALA HA H 20 4.162 4.162 4.553 -0.391 18418
293 1 7 . 1 1 20 20 ALA H H 20 8.562 8.562 7.390 1.172 18418
294 1 7 . 1 1 21 21 LEU HA H 21 4.175 4.175 4.260 -0.085 18418
295 1 7 . 1 1 21 21 LEU H H 21 8.437 8.437 7.481 0.956 18418
296 1 7 . 1 1 22 22 THR HA H 22 3.960 3.960 4.191 -0.231 18418
297 1 7 . 1 1 22 22 THR H H 22 8.338 8.338 8.298 0.040 18418
298 1 7 . 1 1 23 23 HIS HA H 23 4.333 4.333 4.867 -0.534 18418
299 1 7 . 1 1 23 23 HIS H H 23 8.067 8.067 7.846 0.221 18418
300 1 7 . 1 1 24 24 TYR HA H 24 4.306 4.306 4.535 -0.229 18418
301 1 7 . 1 1 24 24 TYR H H 24 8.333 8.333 7.908 0.425 18418
302 1 8 . 1 1 2 2 TRP HA H 2 4.595 4.595 5.189 -0.594 18418
303 1 8 . 1 1 2 2 TRP H H 2 8.575 8.575 8.272 0.303 18418
304 1 8 . 1 1 3 3 GLY H H 3 8.113 8.113 8.279 -0.166 18418
305 1 8 . 1 1 4 4 SER HA H 4 4.803 4.803 4.231 0.573 18418
306 1 8 . 1 1 4 4 SER H H 4 8.490 8.490 7.908 0.582 18418
307 1 8 . 1 1 5 5 PHE HA H 5 4.284 4.284 4.540 -0.256 18418
308 1 8 . 1 1 5 5 PHE H H 5 8.067 8.067 7.876 0.191 18418
309 1 8 . 1 1 6 6 PHE HA H 6 4.183 4.183 4.277 -0.094 18418
310 1 8 . 1 1 6 6 PHE H H 6 8.306 8.306 8.068 0.238 18418
311 1 8 . 1 1 7 7 LYS HA H 7 4.028 4.028 3.952 0.076 18418
312 1 8 . 1 1 7 7 LYS H H 7 8.100 8.100 8.432 -0.332 18418
313 1 8 . 1 1 8 8 LYS HA H 8 4.159 4.159 4.285 -0.126 18418
314 1 8 . 1 1 8 8 LYS H H 8 7.734 7.734 8.135 -0.401 18418
315 1 8 . 1 1 9 9 ALA HA H 9 3.970 3.970 4.483 -0.513 18418
316 1 8 . 1 1 9 9 ALA H H 9 8.328 8.328 7.462 0.866 18418
317 1 8 . 1 1 10 10 ALA HA H 10 3.988 3.988 3.953 0.035 18418
318 1 8 . 1 1 10 10 ALA H H 10 8.295 8.295 7.783 0.512 18418
319 1 8 . 1 1 11 11 HIS HA H 11 4.415 4.415 4.228 0.187 18418
320 1 8 . 1 1 11 11 HIS H H 11 7.890 7.890 7.584 0.306 18418
321 1 8 . 1 1 12 12 VAL HA H 12 3.848 3.848 4.120 -0.272 18418
322 1 8 . 1 1 12 12 VAL H H 12 8.154 8.154 7.642 0.512 18418
323 1 8 . 1 1 13 13 GLY H H 13 8.869 8.869 7.456 1.413 18418
324 1 8 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.084 -0.082 18418
325 1 8 . 1 1 14 14 LYS H H 14 8.321 8.321 7.854 0.467 18418
326 1 8 . 1 1 15 15 HIS HA H 15 4.413 4.413 4.183 0.230 18418
327 1 8 . 1 1 15 15 HIS H H 15 7.749 7.749 7.333 0.416 18418
328 1 8 . 1 1 16 16 VAL HA H 16 3.829 3.829 3.762 0.067 18418
329 1 8 . 1 1 16 16 VAL H H 16 8.540 8.540 7.273 1.267 18418
330 1 8 . 1 1 17 17 GLY H H 17 8.711 8.711 8.451 0.260 18418
331 1 8 . 1 1 18 18 LYS HA H 18 4.065 4.065 3.858 0.207 18418
332 1 8 . 1 1 18 18 LYS H H 18 8.312 8.312 7.978 0.334 18418
333 1 8 . 1 1 19 19 ALA HA H 19 4.215 4.215 4.607 -0.392 18418
334 1 8 . 1 1 19 19 ALA H H 19 7.968 7.968 7.268 0.700 18418
335 1 8 . 1 1 20 20 ALA HA H 20 4.162 4.162 3.937 0.225 18418
336 1 8 . 1 1 20 20 ALA H H 20 8.562 8.562 7.370 1.192 18418
337 1 8 . 1 1 21 21 LEU HA H 21 4.175 4.175 4.216 -0.041 18418
338 1 8 . 1 1 21 21 LEU H H 21 8.437 8.437 7.919 0.518 18418
339 1 8 . 1 1 22 22 THR HA H 22 3.960 3.960 4.066 -0.106 18418
340 1 8 . 1 1 22 22 THR H H 22 8.338 8.338 8.133 0.205 18418
341 1 8 . 1 1 23 23 HIS HA H 23 4.333 4.333 4.893 -0.560 18418
342 1 8 . 1 1 23 23 HIS H H 23 8.067 8.067 7.608 0.459 18418
343 1 8 . 1 1 24 24 TYR HA H 24 4.306 4.306 4.589 -0.283 18418
344 1 8 . 1 1 24 24 TYR H H 24 8.333 8.333 7.967 0.366 18418
345 1 9 . 1 1 2 2 TRP HA H 2 4.595 4.595 5.025 -0.430 18418
346 1 9 . 1 1 2 2 TRP H H 2 8.575 8.575 8.601 -0.026 18418
347 1 9 . 1 1 3 3 GLY H H 3 8.113 8.113 8.085 0.028 18418
348 1 9 . 1 1 4 4 SER HA H 4 4.803 4.803 4.362 0.441 18418
349 1 9 . 1 1 4 4 SER H H 4 8.490 8.490 8.352 0.138 18418
350 1 9 . 1 1 5 5 PHE HA H 5 4.284 4.284 4.643 -0.359 18418
351 1 9 . 1 1 5 5 PHE H H 5 8.067 8.067 7.841 0.226 18418
352 1 9 . 1 1 6 6 PHE HA H 6 4.183 4.183 4.456 -0.273 18418
353 1 9 . 1 1 6 6 PHE H H 6 8.306 8.306 7.820 0.486 18418
354 1 9 . 1 1 7 7 LYS HA H 7 4.028 4.028 4.036 -0.008 18418
355 1 9 . 1 1 7 7 LYS H H 7 8.100 8.100 8.500 -0.400 18418
356 1 9 . 1 1 8 8 LYS HA H 8 4.159 4.159 4.137 0.022 18418
357 1 9 . 1 1 8 8 LYS H H 8 7.734 7.734 8.728 -0.994 18418
358 1 9 . 1 1 9 9 ALA HA H 9 3.970 3.970 4.181 -0.211 18418
359 1 9 . 1 1 9 9 ALA H H 9 8.328 8.328 8.248 0.080 18418
360 1 9 . 1 1 10 10 ALA HA H 10 3.988 3.988 4.161 -0.173 18418
361 1 9 . 1 1 10 10 ALA H H 10 8.295 8.295 8.143 0.152 18418
362 1 9 . 1 1 11 11 HIS HA H 11 4.415 4.415 4.442 -0.027 18418
363 1 9 . 1 1 11 11 HIS H H 11 7.890 7.890 7.960 -0.070 18418
364 1 9 . 1 1 12 12 VAL HA H 12 3.848 3.848 4.038 -0.190 18418
365 1 9 . 1 1 12 12 VAL H H 12 8.154 8.154 7.851 0.303 18418
366 1 9 . 1 1 13 13 GLY H H 13 8.869 8.869 7.773 1.096 18418
367 1 9 . 1 1 14 14 LYS HA H 14 4.002 4.002 3.982 0.020 18418
368 1 9 . 1 1 14 14 LYS H H 14 8.321 8.321 7.328 0.993 18418
369 1 9 . 1 1 15 15 HIS HA H 15 4.413 4.413 4.287 0.126 18418
370 1 9 . 1 1 15 15 HIS H H 15 7.749 7.749 7.693 0.056 18418
371 1 9 . 1 1 16 16 VAL HA H 16 3.829 3.829 3.783 0.046 18418
372 1 9 . 1 1 16 16 VAL H H 16 8.540 8.540 7.466 1.074 18418
373 1 9 . 1 1 17 17 GLY H H 17 8.711 8.711 8.611 0.100 18418
374 1 9 . 1 1 18 18 LYS HA H 18 4.065 4.065 3.828 0.237 18418
375 1 9 . 1 1 18 18 LYS H H 18 8.312 8.312 7.981 0.331 18418
376 1 9 . 1 1 19 19 ALA HA H 19 4.215 4.215 3.856 0.359 18418
377 1 9 . 1 1 19 19 ALA H H 19 7.968 7.968 8.835 -0.867 18418
378 1 9 . 1 1 20 20 ALA HA H 20 4.162 4.162 3.669 0.493 18418
379 1 9 . 1 1 20 20 ALA H H 20 8.562 8.562 7.912 0.650 18418
380 1 9 . 1 1 21 21 LEU HA H 21 4.175 4.175 4.386 -0.211 18418
381 1 9 . 1 1 21 21 LEU H H 21 8.437 8.437 7.826 0.611 18418
382 1 9 . 1 1 22 22 THR HA H 22 3.960 3.960 4.098 -0.138 18418
383 1 9 . 1 1 22 22 THR H H 22 8.338 8.338 8.383 -0.045 18418
384 1 9 . 1 1 23 23 HIS HA H 23 4.333 4.333 4.921 -0.588 18418
385 1 9 . 1 1 23 23 HIS H H 23 8.067 8.067 7.799 0.268 18418
386 1 9 . 1 1 24 24 TYR HA H 24 4.306 4.306 4.500 -0.194 18418
387 1 9 . 1 1 24 24 TYR H H 24 8.333 8.333 7.737 0.596 18418
388 1 10 . 1 1 2 2 TRP HA H 2 4.595 4.595 4.972 -0.377 18418
389 1 10 . 1 1 2 2 TRP H H 2 8.575 8.575 7.464 1.111 18418
390 1 10 . 1 1 3 3 GLY H H 3 8.113 8.113 8.660 -0.547 18418
391 1 10 . 1 1 4 4 SER HA H 4 4.803 4.803 3.810 0.993 18418
392 1 10 . 1 1 4 4 SER H H 4 8.490 8.490 8.157 0.333 18418
393 1 10 . 1 1 5 5 PHE HA H 5 4.284 4.284 4.482 -0.198 18418
394 1 10 . 1 1 5 5 PHE H H 5 8.067 8.067 7.720 0.347 18418
395 1 10 . 1 1 6 6 PHE HA H 6 4.183 4.183 4.231 -0.048 18418
396 1 10 . 1 1 6 6 PHE H H 6 8.306 8.306 7.452 0.854 18418
397 1 10 . 1 1 7 7 LYS HA H 7 4.028 4.028 4.403 -0.375 18418
398 1 10 . 1 1 7 7 LYS H H 7 8.100 8.100 8.679 -0.579 18418
399 1 10 . 1 1 8 8 LYS HA H 8 4.159 4.159 4.775 -0.616 18418
400 1 10 . 1 1 8 8 LYS H H 8 7.734 7.734 7.808 -0.074 18418
401 1 10 . 1 1 9 9 ALA HA H 9 3.970 3.970 4.300 -0.330 18418
402 1 10 . 1 1 9 9 ALA H H 9 8.328 8.328 7.804 0.524 18418
403 1 10 . 1 1 10 10 ALA HA H 10 3.988 3.988 4.208 -0.220 18418
404 1 10 . 1 1 10 10 ALA H H 10 8.295 8.295 8.466 -0.171 18418
405 1 10 . 1 1 11 11 HIS HA H 11 4.415 4.415 4.384 0.031 18418
406 1 10 . 1 1 11 11 HIS H H 11 7.890 7.890 8.031 -0.141 18418
407 1 10 . 1 1 12 12 VAL HA H 12 3.848 3.848 3.767 0.081 18418
408 1 10 . 1 1 12 12 VAL H H 12 8.154 8.154 7.697 0.457 18418
409 1 10 . 1 1 13 13 GLY H H 13 8.869 8.869 7.701 1.168 18418
410 1 10 . 1 1 14 14 LYS HA H 14 4.002 4.002 3.960 0.042 18418
411 1 10 . 1 1 14 14 LYS H H 14 8.321 8.321 7.329 0.992 18418
412 1 10 . 1 1 15 15 HIS HA H 15 4.413 4.413 4.432 -0.019 18418
413 1 10 . 1 1 15 15 HIS H H 15 7.749 7.749 7.438 0.311 18418
414 1 10 . 1 1 16 16 VAL HA H 16 3.829 3.829 3.663 0.166 18418
415 1 10 . 1 1 16 16 VAL H H 16 8.540 8.540 7.624 0.916 18418
416 1 10 . 1 1 17 17 GLY H H 17 8.711 8.711 8.042 0.669 18418
417 1 10 . 1 1 18 18 LYS HA H 18 4.065 4.065 4.054 0.011 18418
418 1 10 . 1 1 18 18 LYS H H 18 8.312 8.312 7.938 0.374 18418
419 1 10 . 1 1 19 19 ALA HA H 19 4.215 4.215 3.863 0.352 18418
420 1 10 . 1 1 19 19 ALA H H 19 7.968 7.968 8.567 -0.599 18418
421 1 10 . 1 1 20 20 ALA HA H 20 4.162 4.162 4.555 -0.393 18418
422 1 10 . 1 1 20 20 ALA H H 20 8.562 8.562 8.015 0.547 18418
423 1 10 . 1 1 21 21 LEU HA H 21 4.175 4.175 4.139 0.036 18418
424 1 10 . 1 1 21 21 LEU H H 21 8.437 8.437 7.792 0.645 18418
425 1 10 . 1 1 22 22 THR HA H 22 3.960 3.960 4.215 -0.255 18418
426 1 10 . 1 1 22 22 THR H H 22 8.338 8.338 7.809 0.529 18418
427 1 10 . 1 1 23 23 HIS HA H 23 4.333 4.333 4.471 -0.138 18418
428 1 10 . 1 1 23 23 HIS H H 23 8.067 8.067 7.826 0.241 18418
429 1 10 . 1 1 24 24 TYR HA H 24 4.306 4.306 4.697 -0.391 18418
430 1 10 . 1 1 24 24 TYR H H 24 8.333 8.333 7.465 0.868 18418
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 18418
2 1 1 "Average Difference" HA 24 0.340 0.065 0.341 18418
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18418
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 18418
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18418
6 1 1 "Average Difference" HN 23 0.575 -0.389 0.432 18418
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18418
8 1 2 "Average Difference" HA 24 0.277 0.040 0.280 18418
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18418
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 18418
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18418
12 1 2 "Average Difference" HN 23 0.570 -0.333 0.473 18418
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18418
14 1 3 "Average Difference" HA 24 0.335 0.043 0.339 18418
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18418
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 18418
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18418
18 1 3 "Average Difference" HN 23 0.468 -0.286 0.379 18418
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18418
20 1 4 "Average Difference" HA 24 0.342 0.064 0.343 18418
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18418
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 18418
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18418
24 1 4 "Average Difference" HN 23 0.635 -0.348 0.543 18418
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18418
26 1 5 "Average Difference" HA 24 0.322 0.033 0.327 18418
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18418
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 18418
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18418
30 1 5 "Average Difference" HN 23 0.570 -0.338 0.469 18418
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18418
32 1 6 "Average Difference" HA 24 0.307 0.115 0.291 18418
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18418
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 18418
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18418
36 1 6 "Average Difference" HN 23 0.611 -0.440 0.434 18418
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18418
38 1 7 "Average Difference" HA 24 0.282 0.043 0.285 18418
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18418
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 18418
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18418
42 1 7 "Average Difference" HN 23 0.556 -0.309 0.473 18418
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18418
44 1 8 "Average Difference" HA 24 0.338 0.010 0.345 18418
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18418
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 18418
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18418
48 1 8 "Average Difference" HN 23 0.623 -0.444 0.447 18418
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18418
50 1 9 "Average Difference" HA 24 0.268 0.027 0.273 18418
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18418
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 18418
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18418
54 1 9 "Average Difference" HN 23 0.553 -0.208 0.523 18418
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18418
56 1 10 "Average Difference" HA 24 0.345 0.026 0.351 18418
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18418
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 18418
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18418
60 1 10 "Average Difference" HN 23 0.639 -0.382 0.525 18418
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 18418
_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 TRP HA H 2 4.595 4.595 4.997 -0.402 18418
2 1 . 1 1 2 2 TRP H H 2 8.575 8.575 8.314 0.261 18418
3 1 . 1 1 3 3 GLY H H 3 8.113 8.113 8.199 -0.086 18418
4 1 . 1 1 4 4 SER HA H 4 4.803 4.803 4.211 0.593 18418
5 1 . 1 1 4 4 SER H H 4 8.490 8.490 8.125 0.365 18418
6 1 . 1 1 5 5 PHE HA H 5 4.284 4.284 4.526 -0.242 18418
7 1 . 1 1 5 5 PHE H H 5 8.067 8.067 7.666 0.401 18418
8 1 . 1 1 6 6 PHE HA H 6 4.183 4.183 4.220 -0.037 18418
9 1 . 1 1 6 6 PHE H H 6 8.306 8.306 7.824 0.482 18418
10 1 . 1 1 7 7 LYS HA H 7 4.028 4.028 4.007 0.021 18418
11 1 . 1 1 7 7 LYS H H 7 8.100 8.100 8.484 -0.384 18418
12 1 . 1 1 8 8 LYS HA H 8 4.159 4.159 4.309 -0.150 18418
13 1 . 1 1 8 8 LYS H H 8 7.734 7.734 7.951 -0.217 18418
14 1 . 1 1 9 9 ALA HA H 9 3.970 3.970 4.274 -0.304 18418
15 1 . 1 1 9 9 ALA H H 9 8.328 8.328 7.794 0.534 18418
16 1 . 1 1 10 10 ALA HA H 10 3.988 3.988 4.199 -0.211 18418
17 1 . 1 1 10 10 ALA H H 10 8.295 8.295 8.141 0.154 18418
18 1 . 1 1 11 11 HIS HA H 11 4.415 4.415 4.364 0.050 18418
19 1 . 1 1 11 11 HIS H H 11 7.890 7.890 7.870 0.020 18418
20 1 . 1 1 12 12 VAL HA H 12 3.848 3.848 4.006 -0.158 18418
21 1 . 1 1 12 12 VAL H H 12 8.154 8.154 7.812 0.342 18418
22 1 . 1 1 13 13 GLY H H 13 8.869 8.869 8.233 0.636 18418
23 1 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.090 -0.088 18418
24 1 . 1 1 14 14 LYS H H 14 8.321 8.321 7.685 0.636 18418
25 1 . 1 1 15 15 HIS HA H 15 4.413 4.413 4.312 0.101 18418
26 1 . 1 1 15 15 HIS H H 15 7.749 7.749 7.559 0.190 18418
27 1 . 1 1 16 16 VAL HA H 16 3.829 3.829 3.932 -0.103 18418
28 1 . 1 1 16 16 VAL H H 16 8.540 8.540 7.638 0.902 18418
29 1 . 1 1 17 17 GLY H H 17 8.711 8.711 8.149 0.562 18418
30 1 . 1 1 18 18 LYS HA H 18 4.065 4.065 4.091 -0.026 18418
31 1 . 1 1 18 18 LYS H H 18 8.312 8.312 8.070 0.242 18418
32 1 . 1 1 19 19 ALA HA H 19 4.215 4.215 4.361 -0.146 18418
33 1 . 1 1 19 19 ALA H H 19 7.968 7.968 8.006 -0.038 18418
34 1 . 1 1 20 20 ALA HA H 20 4.162 4.162 4.285 -0.123 18418
35 1 . 1 1 20 20 ALA H H 20 8.562 8.562 7.696 0.866 18418
36 1 . 1 1 21 21 LEU HA H 21 4.175 4.175 3.980 0.195 18418
37 1 . 1 1 21 21 LEU H H 21 8.437 8.437 7.752 0.685 18418
38 1 . 1 1 22 22 THR HA H 22 3.960 3.960 4.133 -0.173 18418
39 1 . 1 1 22 22 THR H H 22 8.338 8.338 7.925 0.412 18418
40 1 . 1 1 23 23 HIS HA H 23 4.333 4.333 4.686 -0.353 18418
41 1 . 1 1 23 23 HIS H H 23 8.067 8.067 7.713 0.354 18418
42 1 . 1 1 24 24 TYR HA H 24 4.306 4.306 4.640 -0.334 18418
43 1 . 1 1 24 24 TYR H H 24 8.333 8.333 7.656 0.677 18418
stop_
save_