data_18999
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18999
_Entry.PDB_ID 2M4D
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 18999
_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 ILE HA H 2 4.161 4.161 3.870 0.291 18999
2 1 1 . 1 1 2 2 ILE H H 2 9.119 9.119 8.134 0.985 18999
3 1 1 . 1 1 3 3 ALA HA H 3 4.996 4.996 4.124 0.872 18999
4 1 1 . 1 1 3 3 ALA H H 3 8.456 8.456 8.172 0.284 18999
5 1 1 . 1 1 4 4 HIS HA H 4 3.941 3.941 4.225 -0.284 18999
6 1 1 . 1 1 4 4 HIS H H 4 8.397 8.397 7.980 0.417 18999
7 1 1 . 1 1 5 5 TYR HA H 5 4.819 4.819 3.957 0.862 18999
8 1 1 . 1 1 5 5 TYR H H 5 7.986 7.986 8.464 -0.478 18999
9 1 1 . 1 1 6 6 GLY H H 6 8.644 8.644 7.496 1.148 18999
10 1 1 . 1 1 7 7 LYS HA H 7 4.259 4.259 4.735 -0.476 18999
11 1 1 . 1 1 7 7 LYS H H 7 8.343 8.343 8.374 -0.031 18999
12 1 1 . 1 1 8 8 CYS HA H 8 4.849 4.849 4.590 0.259 18999
13 1 1 . 1 1 8 8 CYS H H 8 8.496 8.496 8.584 -0.088 18999
14 1 1 . 1 1 9 9 ASP HA H 9 5.022 5.022 4.388 0.634 18999
15 1 1 . 1 1 9 9 ASP H H 9 8.434 8.434 7.617 0.817 18999
16 1 1 . 1 1 10 10 GLY H H 10 8.437 8.437 8.697 -0.260 18999
17 1 1 . 1 1 11 11 ILE HA H 11 4.132 4.132 3.658 0.474 18999
18 1 1 . 1 1 11 11 ILE H H 11 8.348 8.348 8.036 0.312 18999
19 1 1 . 1 1 12 12 ILE HA H 12 4.655 4.655 4.263 0.392 18999
20 1 1 . 1 1 12 12 ILE H H 12 8.123 8.123 7.810 0.313 18999
21 1 1 . 1 1 13 13 ASN HA H 13 3.714 3.714 4.790 -1.076 18999
22 1 1 . 1 1 13 13 ASN H H 13 9.607 9.607 8.003 1.604 18999
23 1 1 . 1 1 14 14 GLN HA H 14 4.534 4.534 4.651 -0.117 18999
24 1 1 . 1 1 14 14 GLN H H 14 8.644 8.644 8.553 0.091 18999
25 1 1 . 1 1 15 15 CYS HA H 15 4.877 4.877 4.417 0.460 18999
26 1 1 . 1 1 15 15 CYS H H 15 8.744 8.744 8.495 0.249 18999
27 1 1 . 1 1 16 16 CYS HA H 16 4.621 4.621 4.172 0.449 18999
28 1 1 . 1 1 16 16 CYS H H 16 10.077 10.077 8.556 1.521 18999
29 1 1 . 1 1 17 17 ASP HA H 17 5.534 5.534 4.845 0.689 18999
30 1 1 . 1 1 17 17 ASP H H 17 8.683 8.683 7.958 0.725 18999
31 1 1 . 1 1 19 19 TRP HA H 19 4.740 4.740 4.500 0.240 18999
32 1 1 . 1 1 19 19 TRP H H 19 8.781 8.781 7.710 1.071 18999
33 1 1 . 1 1 20 20 LEU HA H 20 4.557 4.557 4.940 -0.383 18999
34 1 1 . 1 1 20 20 LEU H H 20 8.713 8.713 7.876 0.837 18999
35 1 1 . 1 1 21 21 CYS HA H 21 4.097 4.097 5.175 -1.078 18999
36 1 1 . 1 1 21 21 CYS H H 21 8.047 8.047 8.923 -0.876 18999
37 1 1 . 1 1 22 22 THR HA H 22 4.434 4.434 4.201 0.233 18999
38 1 1 . 1 1 22 22 THR H H 22 9.382 9.382 8.403 0.979 18999
39 1 1 . 1 1 23 23 PRO HA H 23 5.142 5.142 4.692 0.450 18999
40 1 1 . 1 1 24 24 PRO HA H 24 3.976 3.976 4.436 -0.460 18999
41 1 1 . 1 1 25 25 ILE HA H 25 5.364 5.364 4.296 1.068 18999
42 1 1 . 1 1 25 25 ILE H H 25 7.997 7.997 8.091 -0.094 18999
43 1 1 . 1 1 26 26 ILE HA H 26 4.389 4.389 4.242 0.147 18999
44 1 1 . 1 1 26 26 ILE H H 26 7.824 7.824 7.791 0.033 18999
45 1 1 . 1 1 27 27 GLY H H 27 7.701 7.701 8.370 -0.669 18999
46 1 1 . 1 1 28 28 PHE HA H 28 5.485 5.485 4.951 0.534 18999
47 1 1 . 1 1 28 28 PHE H H 28 8.221 8.221 7.873 0.348 18999
48 1 1 . 1 1 29 29 CYS HA H 29 4.845 4.845 4.576 0.269 18999
49 1 1 . 1 1 29 29 CYS H H 29 8.885 8.885 8.356 0.529 18999
50 1 2 . 1 1 2 2 ILE HA H 2 4.161 4.161 3.864 0.297 18999
51 1 2 . 1 1 2 2 ILE H H 2 9.119 9.119 8.077 1.042 18999
52 1 2 . 1 1 3 3 ALA HA H 3 4.996 4.996 4.197 0.799 18999
53 1 2 . 1 1 3 3 ALA H H 3 8.456 8.456 8.182 0.274 18999
54 1 2 . 1 1 4 4 HIS HA H 4 3.941 3.941 4.287 -0.346 18999
55 1 2 . 1 1 4 4 HIS H H 4 8.397 8.397 8.205 0.192 18999
56 1 2 . 1 1 5 5 TYR HA H 5 4.819 4.819 4.343 0.476 18999
57 1 2 . 1 1 5 5 TYR H H 5 7.986 7.986 8.642 -0.656 18999
58 1 2 . 1 1 6 6 GLY H H 6 8.644 8.644 7.701 0.943 18999
59 1 2 . 1 1 7 7 LYS HA H 7 4.259 4.259 4.328 -0.069 18999
60 1 2 . 1 1 7 7 LYS H H 7 8.343 8.343 8.397 -0.054 18999
61 1 2 . 1 1 8 8 CYS HA H 8 4.849 4.849 4.558 0.291 18999
62 1 2 . 1 1 8 8 CYS H H 8 8.496 8.496 8.918 -0.422 18999
63 1 2 . 1 1 9 9 ASP HA H 9 5.022 5.022 4.396 0.626 18999
64 1 2 . 1 1 9 9 ASP H H 9 8.434 8.434 7.511 0.923 18999
65 1 2 . 1 1 10 10 GLY H H 10 8.437 8.437 8.491 -0.054 18999
66 1 2 . 1 1 11 11 ILE HA H 11 4.132 4.132 3.650 0.482 18999
67 1 2 . 1 1 11 11 ILE H H 11 8.348 8.348 8.186 0.162 18999
68 1 2 . 1 1 12 12 ILE HA H 12 4.655 4.655 4.259 0.396 18999
69 1 2 . 1 1 12 12 ILE H H 12 8.123 8.123 7.816 0.307 18999
70 1 2 . 1 1 13 13 ASN HA H 13 3.714 3.714 4.781 -1.067 18999
71 1 2 . 1 1 13 13 ASN H H 13 9.607 9.607 7.957 1.649 18999
72 1 2 . 1 1 14 14 GLN HA H 14 4.534 4.534 4.657 -0.123 18999
73 1 2 . 1 1 14 14 GLN H H 14 8.644 8.644 8.557 0.087 18999
74 1 2 . 1 1 15 15 CYS HA H 15 4.877 4.877 4.397 0.480 18999
75 1 2 . 1 1 15 15 CYS H H 15 8.744 8.744 8.537 0.207 18999
76 1 2 . 1 1 16 16 CYS HA H 16 4.621 4.621 4.219 0.402 18999
77 1 2 . 1 1 16 16 CYS H H 16 10.077 10.077 8.722 1.355 18999
78 1 2 . 1 1 17 17 ASP HA H 17 5.534 5.534 4.812 0.722 18999
79 1 2 . 1 1 17 17 ASP H H 17 8.683 8.683 7.597 1.086 18999
80 1 2 . 1 1 19 19 TRP HA H 19 4.740 4.740 4.495 0.245 18999
81 1 2 . 1 1 19 19 TRP H H 19 8.781 8.781 7.949 0.832 18999
82 1 2 . 1 1 20 20 LEU HA H 20 4.557 4.557 4.693 -0.136 18999
83 1 2 . 1 1 20 20 LEU H H 20 8.713 8.713 7.807 0.906 18999
84 1 2 . 1 1 21 21 CYS HA H 21 4.097 4.097 5.157 -1.060 18999
85 1 2 . 1 1 21 21 CYS H H 21 8.047 8.047 8.918 -0.871 18999
86 1 2 . 1 1 22 22 THR HA H 22 4.434 4.434 4.320 0.114 18999
87 1 2 . 1 1 22 22 THR H H 22 9.382 9.382 8.483 0.899 18999
88 1 2 . 1 1 23 23 PRO HA H 23 5.142 5.142 4.663 0.479 18999
89 1 2 . 1 1 24 24 PRO HA H 24 3.976 3.976 4.435 -0.459 18999
90 1 2 . 1 1 25 25 ILE HA H 25 5.364 5.364 4.418 0.946 18999
91 1 2 . 1 1 25 25 ILE H H 25 7.997 7.997 7.911 0.086 18999
92 1 2 . 1 1 26 26 ILE HA H 26 4.389 4.389 4.033 0.356 18999
93 1 2 . 1 1 26 26 ILE H H 26 7.824 7.824 7.612 0.212 18999
94 1 2 . 1 1 27 27 GLY H H 27 7.701 7.701 8.281 -0.580 18999
95 1 2 . 1 1 28 28 PHE HA H 28 5.485 5.485 4.776 0.709 18999
96 1 2 . 1 1 28 28 PHE H H 28 8.221 8.221 7.681 0.540 18999
97 1 2 . 1 1 29 29 CYS HA H 29 4.845 4.845 4.711 0.134 18999
98 1 2 . 1 1 29 29 CYS H H 29 8.885 8.885 8.679 0.206 18999
99 1 3 . 1 1 2 2 ILE HA H 2 4.161 4.161 3.910 0.251 18999
100 1 3 . 1 1 2 2 ILE H H 2 9.119 9.119 8.130 0.989 18999
101 1 3 . 1 1 3 3 ALA HA H 3 4.996 4.996 4.227 0.769 18999
102 1 3 . 1 1 3 3 ALA H H 3 8.456 8.456 8.225 0.231 18999
103 1 3 . 1 1 4 4 HIS HA H 4 3.941 3.941 4.281 -0.340 18999
104 1 3 . 1 1 4 4 HIS H H 4 8.397 8.397 8.150 0.247 18999
105 1 3 . 1 1 5 5 TYR HA H 5 4.819 4.819 4.273 0.546 18999
106 1 3 . 1 1 5 5 TYR H H 5 7.986 7.986 8.593 -0.607 18999
107 1 3 . 1 1 6 6 GLY H H 6 8.644 8.644 7.675 0.969 18999
108 1 3 . 1 1 7 7 LYS HA H 7 4.259 4.259 4.310 -0.051 18999
109 1 3 . 1 1 7 7 LYS H H 7 8.343 8.343 8.342 0.001 18999
110 1 3 . 1 1 8 8 CYS HA H 8 4.849 4.849 4.542 0.307 18999
111 1 3 . 1 1 8 8 CYS H H 8 8.496 8.496 8.864 -0.368 18999
112 1 3 . 1 1 9 9 ASP HA H 9 5.022 5.022 4.380 0.642 18999
113 1 3 . 1 1 9 9 ASP H H 9 8.434 8.434 7.515 0.919 18999
114 1 3 . 1 1 10 10 GLY H H 10 8.437 8.437 8.718 -0.281 18999
115 1 3 . 1 1 11 11 ILE HA H 11 4.132 4.132 3.702 0.430 18999
116 1 3 . 1 1 11 11 ILE H H 11 8.348 8.348 7.947 0.401 18999
117 1 3 . 1 1 12 12 ILE HA H 12 4.655 4.655 4.192 0.463 18999
118 1 3 . 1 1 12 12 ILE H H 12 8.123 8.123 7.784 0.339 18999
119 1 3 . 1 1 13 13 ASN HA H 13 3.714 3.714 4.803 -1.089 18999
120 1 3 . 1 1 13 13 ASN H H 13 9.607 9.607 7.997 1.610 18999
121 1 3 . 1 1 14 14 GLN HA H 14 4.534 4.534 4.664 -0.130 18999
122 1 3 . 1 1 14 14 GLN H H 14 8.644 8.644 8.578 0.066 18999
123 1 3 . 1 1 15 15 CYS HA H 15 4.877 4.877 4.430 0.447 18999
124 1 3 . 1 1 15 15 CYS H H 15 8.744 8.744 8.554 0.190 18999
125 1 3 . 1 1 16 16 CYS HA H 16 4.621 4.621 4.281 0.340 18999
126 1 3 . 1 1 16 16 CYS H H 16 10.077 10.077 8.850 1.227 18999
127 1 3 . 1 1 17 17 ASP HA H 17 5.534 5.534 4.841 0.693 18999
128 1 3 . 1 1 17 17 ASP H H 17 8.683 8.683 7.637 1.046 18999
129 1 3 . 1 1 19 19 TRP HA H 19 4.740 4.740 4.470 0.270 18999
130 1 3 . 1 1 19 19 TRP H H 19 8.781 8.781 7.623 1.158 18999
131 1 3 . 1 1 20 20 LEU HA H 20 4.557 4.557 4.740 -0.183 18999
132 1 3 . 1 1 20 20 LEU H H 20 8.713 8.713 8.245 0.468 18999
133 1 3 . 1 1 21 21 CYS HA H 21 4.097 4.097 4.980 -0.883 18999
134 1 3 . 1 1 21 21 CYS H H 21 8.047 8.047 8.984 -0.937 18999
135 1 3 . 1 1 22 22 THR HA H 22 4.434 4.434 4.297 0.137 18999
136 1 3 . 1 1 22 22 THR H H 22 9.382 9.382 8.469 0.913 18999
137 1 3 . 1 1 23 23 PRO HA H 23 5.142 5.142 4.640 0.502 18999
138 1 3 . 1 1 24 24 PRO HA H 24 3.976 3.976 4.381 -0.405 18999
139 1 3 . 1 1 25 25 ILE HA H 25 5.364 5.364 4.239 1.125 18999
140 1 3 . 1 1 25 25 ILE H H 25 7.997 7.997 7.539 0.458 18999
141 1 3 . 1 1 26 26 ILE HA H 26 4.389 4.389 3.893 0.496 18999
142 1 3 . 1 1 26 26 ILE H H 26 7.824 7.824 7.750 0.074 18999
143 1 3 . 1 1 27 27 GLY H H 27 7.701 7.701 8.114 -0.413 18999
144 1 3 . 1 1 28 28 PHE HA H 28 5.485 5.485 4.721 0.764 18999
145 1 3 . 1 1 28 28 PHE H H 28 8.221 8.221 7.614 0.607 18999
146 1 3 . 1 1 29 29 CYS HA H 29 4.845 4.845 4.597 0.248 18999
147 1 3 . 1 1 29 29 CYS H H 29 8.885 8.885 8.568 0.317 18999
148 1 4 . 1 1 2 2 ILE HA H 2 4.161 4.161 3.742 0.419 18999
149 1 4 . 1 1 2 2 ILE H H 2 9.119 9.119 8.131 0.988 18999
150 1 4 . 1 1 3 3 ALA HA H 3 4.996 4.996 4.180 0.816 18999
151 1 4 . 1 1 3 3 ALA H H 3 8.456 8.456 8.193 0.263 18999
152 1 4 . 1 1 4 4 HIS HA H 4 3.941 3.941 4.283 -0.342 18999
153 1 4 . 1 1 4 4 HIS H H 4 8.397 8.397 8.473 -0.076 18999
154 1 4 . 1 1 5 5 TYR HA H 5 4.819 4.819 4.189 0.630 18999
155 1 4 . 1 1 5 5 TYR H H 5 7.986 7.986 8.281 -0.295 18999
156 1 4 . 1 1 6 6 GLY H H 6 8.644 8.644 7.734 0.910 18999
157 1 4 . 1 1 7 7 LYS HA H 7 4.259 4.259 4.606 -0.347 18999
158 1 4 . 1 1 7 7 LYS H H 7 8.343 8.343 8.281 0.062 18999
159 1 4 . 1 1 8 8 CYS HA H 8 4.849 4.849 4.590 0.259 18999
160 1 4 . 1 1 8 8 CYS H H 8 8.496 8.496 8.706 -0.210 18999
161 1 4 . 1 1 9 9 ASP HA H 9 5.022 5.022 4.404 0.618 18999
162 1 4 . 1 1 9 9 ASP H H 9 8.434 8.434 7.538 0.896 18999
163 1 4 . 1 1 10 10 GLY H H 10 8.437 8.437 8.598 -0.161 18999
164 1 4 . 1 1 11 11 ILE HA H 11 4.132 4.132 3.670 0.462 18999
165 1 4 . 1 1 11 11 ILE H H 11 8.348 8.348 8.183 0.165 18999
166 1 4 . 1 1 12 12 ILE HA H 12 4.655 4.655 4.142 0.513 18999
167 1 4 . 1 1 12 12 ILE H H 12 8.123 8.123 7.848 0.275 18999
168 1 4 . 1 1 13 13 ASN HA H 13 3.714 3.714 4.790 -1.076 18999
169 1 4 . 1 1 13 13 ASN H H 13 9.607 9.607 7.985 1.622 18999
170 1 4 . 1 1 14 14 GLN HA H 14 4.534 4.534 4.644 -0.110 18999
171 1 4 . 1 1 14 14 GLN H H 14 8.644 8.644 8.560 0.084 18999
172 1 4 . 1 1 15 15 CYS HA H 15 4.877 4.877 4.372 0.505 18999
173 1 4 . 1 1 15 15 CYS H H 15 8.744 8.744 8.509 0.235 18999
174 1 4 . 1 1 16 16 CYS HA H 16 4.621 4.621 4.082 0.539 18999
175 1 4 . 1 1 16 16 CYS H H 16 10.077 10.077 8.629 1.448 18999
176 1 4 . 1 1 17 17 ASP HA H 17 5.534 5.534 4.798 0.736 18999
177 1 4 . 1 1 17 17 ASP H H 17 8.683 8.683 7.806 0.877 18999
178 1 4 . 1 1 19 19 TRP HA H 19 4.740 4.740 4.401 0.339 18999
179 1 4 . 1 1 19 19 TRP H H 19 8.781 8.781 7.941 0.840 18999
180 1 4 . 1 1 20 20 LEU HA H 20 4.557 4.557 4.774 -0.217 18999
181 1 4 . 1 1 20 20 LEU H H 20 8.713 8.713 7.949 0.764 18999
182 1 4 . 1 1 21 21 CYS HA H 21 4.097 4.097 5.124 -1.027 18999
183 1 4 . 1 1 21 21 CYS H H 21 8.047 8.047 8.817 -0.770 18999
184 1 4 . 1 1 22 22 THR HA H 22 4.434 4.434 4.283 0.151 18999
185 1 4 . 1 1 22 22 THR H H 22 9.382 9.382 8.531 0.851 18999
186 1 4 . 1 1 23 23 PRO HA H 23 5.142 5.142 4.694 0.448 18999
187 1 4 . 1 1 24 24 PRO HA H 24 3.976 3.976 4.380 -0.404 18999
188 1 4 . 1 1 25 25 ILE HA H 25 5.364 5.364 4.159 1.205 18999
189 1 4 . 1 1 25 25 ILE H H 25 7.997 7.997 7.574 0.423 18999
190 1 4 . 1 1 26 26 ILE HA H 26 4.389 4.389 3.923 0.466 18999
191 1 4 . 1 1 26 26 ILE H H 26 7.824 7.824 7.832 -0.008 18999
192 1 4 . 1 1 27 27 GLY H H 27 7.701 7.701 8.141 -0.440 18999
193 1 4 . 1 1 28 28 PHE HA H 28 5.485 5.485 4.970 0.515 18999
194 1 4 . 1 1 28 28 PHE H H 28 8.221 8.221 7.609 0.612 18999
195 1 4 . 1 1 29 29 CYS HA H 29 4.845 4.845 4.699 0.146 18999
196 1 4 . 1 1 29 29 CYS H H 29 8.885 8.885 8.981 -0.096 18999
197 1 5 . 1 1 2 2 ILE HA H 2 4.161 4.161 3.869 0.292 18999
198 1 5 . 1 1 2 2 ILE H H 2 9.119 9.119 8.083 1.036 18999
199 1 5 . 1 1 3 3 ALA HA H 3 4.996 4.996 4.188 0.808 18999
200 1 5 . 1 1 3 3 ALA H H 3 8.456 8.456 8.192 0.264 18999
201 1 5 . 1 1 4 4 HIS HA H 4 3.941 3.941 4.284 -0.343 18999
202 1 5 . 1 1 4 4 HIS H H 4 8.397 8.397 8.135 0.262 18999
203 1 5 . 1 1 5 5 TYR HA H 5 4.819 4.819 4.339 0.480 18999
204 1 5 . 1 1 5 5 TYR H H 5 7.986 7.986 8.635 -0.649 18999
205 1 5 . 1 1 6 6 GLY H H 6 8.644 8.644 7.720 0.924 18999
206 1 5 . 1 1 7 7 LYS HA H 7 4.259 4.259 4.319 -0.060 18999
207 1 5 . 1 1 7 7 LYS H H 7 8.343 8.343 8.409 -0.066 18999
208 1 5 . 1 1 8 8 CYS HA H 8 4.849 4.849 4.575 0.274 18999
209 1 5 . 1 1 8 8 CYS H H 8 8.496 8.496 8.826 -0.330 18999
210 1 5 . 1 1 9 9 ASP HA H 9 5.022 5.022 4.410 0.612 18999
211 1 5 . 1 1 9 9 ASP H H 9 8.434 8.434 7.512 0.922 18999
212 1 5 . 1 1 10 10 GLY H H 10 8.437 8.437 8.616 -0.179 18999
213 1 5 . 1 1 11 11 ILE HA H 11 4.132 4.132 3.644 0.488 18999
214 1 5 . 1 1 11 11 ILE H H 11 8.348 8.348 8.062 0.286 18999
215 1 5 . 1 1 12 12 ILE HA H 12 4.655 4.655 4.278 0.377 18999
216 1 5 . 1 1 12 12 ILE H H 12 8.123 8.123 7.686 0.437 18999
217 1 5 . 1 1 13 13 ASN HA H 13 3.714 3.714 4.756 -1.042 18999
218 1 5 . 1 1 13 13 ASN H H 13 9.607 9.607 8.016 1.591 18999
219 1 5 . 1 1 14 14 GLN HA H 14 4.534 4.534 4.624 -0.090 18999
220 1 5 . 1 1 14 14 GLN H H 14 8.644 8.644 8.582 0.062 18999
221 1 5 . 1 1 15 15 CYS HA H 15 4.877 4.877 4.402 0.475 18999
222 1 5 . 1 1 15 15 CYS H H 15 8.744 8.744 8.554 0.190 18999
223 1 5 . 1 1 16 16 CYS HA H 16 4.621 4.621 4.222 0.399 18999
224 1 5 . 1 1 16 16 CYS H H 16 10.077 10.077 8.722 1.355 18999
225 1 5 . 1 1 17 17 ASP HA H 17 5.534 5.534 4.813 0.721 18999
226 1 5 . 1 1 17 17 ASP H H 17 8.683 8.683 7.636 1.047 18999
227 1 5 . 1 1 19 19 TRP HA H 19 4.740 4.740 4.420 0.320 18999
228 1 5 . 1 1 19 19 TRP H H 19 8.781 8.781 7.883 0.898 18999
229 1 5 . 1 1 20 20 LEU HA H 20 4.557 4.557 4.921 -0.364 18999
230 1 5 . 1 1 20 20 LEU H H 20 8.713 8.713 7.750 0.963 18999
231 1 5 . 1 1 21 21 CYS HA H 21 4.097 4.097 5.113 -1.016 18999
232 1 5 . 1 1 21 21 CYS H H 21 8.047 8.047 8.889 -0.842 18999
233 1 5 . 1 1 22 22 THR HA H 22 4.434 4.434 4.387 0.047 18999
234 1 5 . 1 1 22 22 THR H H 22 9.382 9.382 8.592 0.790 18999
235 1 5 . 1 1 23 23 PRO HA H 23 5.142 5.142 4.697 0.445 18999
236 1 5 . 1 1 24 24 PRO HA H 24 3.976 3.976 4.436 -0.460 18999
237 1 5 . 1 1 25 25 ILE HA H 25 5.364 5.364 4.396 0.968 18999
238 1 5 . 1 1 25 25 ILE H H 25 7.997 7.997 8.002 -0.005 18999
239 1 5 . 1 1 26 26 ILE HA H 26 4.389 4.389 4.047 0.342 18999
240 1 5 . 1 1 26 26 ILE H H 26 7.824 7.824 7.840 -0.016 18999
241 1 5 . 1 1 27 27 GLY H H 27 7.701 7.701 8.273 -0.572 18999
242 1 5 . 1 1 28 28 PHE HA H 28 5.485 5.485 4.780 0.705 18999
243 1 5 . 1 1 28 28 PHE H H 28 8.221 8.221 7.669 0.552 18999
244 1 5 . 1 1 29 29 CYS HA H 29 4.845 4.845 4.732 0.113 18999
245 1 5 . 1 1 29 29 CYS H H 29 8.885 8.885 8.641 0.244 18999
246 1 6 . 1 1 2 2 ILE HA H 2 4.161 4.161 3.928 0.233 18999
247 1 6 . 1 1 2 2 ILE H H 2 9.119 9.119 8.182 0.937 18999
248 1 6 . 1 1 3 3 ALA HA H 3 4.996 4.996 4.428 0.568 18999
249 1 6 . 1 1 3 3 ALA H H 3 8.456 8.456 8.275 0.181 18999
250 1 6 . 1 1 4 4 HIS HA H 4 3.941 3.941 4.214 -0.273 18999
251 1 6 . 1 1 4 4 HIS H H 4 8.397 8.397 8.504 -0.107 18999
252 1 6 . 1 1 5 5 TYR HA H 5 4.819 4.819 4.393 0.426 18999
253 1 6 . 1 1 5 5 TYR H H 5 7.986 7.986 8.545 -0.559 18999
254 1 6 . 1 1 6 6 GLY H H 6 8.644 8.644 8.042 0.602 18999
255 1 6 . 1 1 7 7 LYS HA H 7 4.259 4.259 4.524 -0.265 18999
256 1 6 . 1 1 7 7 LYS H H 7 8.343 8.343 8.464 -0.121 18999
257 1 6 . 1 1 8 8 CYS HA H 8 4.849 4.849 4.493 0.356 18999
258 1 6 . 1 1 8 8 CYS H H 8 8.496 8.496 8.679 -0.183 18999
259 1 6 . 1 1 9 9 ASP HA H 9 5.022 5.022 4.426 0.596 18999
260 1 6 . 1 1 9 9 ASP H H 9 8.434 8.434 7.504 0.930 18999
261 1 6 . 1 1 10 10 GLY H H 10 8.437 8.437 8.567 -0.130 18999
262 1 6 . 1 1 11 11 ILE HA H 11 4.132 4.132 3.640 0.492 18999
263 1 6 . 1 1 11 11 ILE H H 11 8.348 8.348 8.053 0.295 18999
264 1 6 . 1 1 12 12 ILE HA H 12 4.655 4.655 4.211 0.444 18999
265 1 6 . 1 1 12 12 ILE H H 12 8.123 8.123 7.640 0.483 18999
266 1 6 . 1 1 13 13 ASN HA H 13 3.714 3.714 4.779 -1.065 18999
267 1 6 . 1 1 13 13 ASN H H 13 9.607 9.607 8.027 1.580 18999
268 1 6 . 1 1 14 14 GLN HA H 14 4.534 4.534 4.713 -0.179 18999
269 1 6 . 1 1 14 14 GLN H H 14 8.644 8.644 8.493 0.151 18999
270 1 6 . 1 1 15 15 CYS HA H 15 4.877 4.877 4.355 0.522 18999
271 1 6 . 1 1 15 15 CYS H H 15 8.744 8.744 8.541 0.203 18999
272 1 6 . 1 1 16 16 CYS HA H 16 4.621 4.621 4.190 0.431 18999
273 1 6 . 1 1 16 16 CYS H H 16 10.077 10.077 8.611 1.466 18999
274 1 6 . 1 1 17 17 ASP HA H 17 5.534 5.534 4.848 0.686 18999
275 1 6 . 1 1 17 17 ASP H H 17 8.683 8.683 7.827 0.856 18999
276 1 6 . 1 1 19 19 TRP HA H 19 4.740 4.740 4.525 0.215 18999
277 1 6 . 1 1 19 19 TRP H H 19 8.781 8.781 7.755 1.026 18999
278 1 6 . 1 1 20 20 LEU HA H 20 4.557 4.557 4.695 -0.138 18999
279 1 6 . 1 1 20 20 LEU H H 20 8.713 8.713 7.982 0.731 18999
280 1 6 . 1 1 21 21 CYS HA H 21 4.097 4.097 5.135 -1.038 18999
281 1 6 . 1 1 21 21 CYS H H 21 8.047 8.047 8.928 -0.881 18999
282 1 6 . 1 1 22 22 THR HA H 22 4.434 4.434 4.228 0.206 18999
283 1 6 . 1 1 22 22 THR H H 22 9.382 9.382 8.566 0.816 18999
284 1 6 . 1 1 23 23 PRO HA H 23 5.142 5.142 4.680 0.462 18999
285 1 6 . 1 1 24 24 PRO HA H 24 3.976 3.976 4.439 -0.463 18999
286 1 6 . 1 1 25 25 ILE HA H 25 5.364 5.364 4.401 0.963 18999
287 1 6 . 1 1 25 25 ILE H H 25 7.997 7.997 7.709 0.288 18999
288 1 6 . 1 1 26 26 ILE HA H 26 4.389 4.389 4.228 0.161 18999
289 1 6 . 1 1 26 26 ILE H H 26 7.824 7.824 7.769 0.055 18999
290 1 6 . 1 1 27 27 GLY H H 27 7.701 7.701 8.329 -0.628 18999
291 1 6 . 1 1 28 28 PHE HA H 28 5.485 5.485 4.941 0.544 18999
292 1 6 . 1 1 28 28 PHE H H 28 8.221 8.221 7.773 0.448 18999
293 1 6 . 1 1 29 29 CYS HA H 29 4.845 4.845 4.624 0.221 18999
294 1 6 . 1 1 29 29 CYS H H 29 8.885 8.885 8.694 0.191 18999
295 1 7 . 1 1 2 2 ILE HA H 2 4.161 4.161 3.775 0.386 18999
296 1 7 . 1 1 2 2 ILE H H 2 9.119 9.119 8.270 0.849 18999
297 1 7 . 1 1 3 3 ALA HA H 3 4.996 4.996 4.173 0.823 18999
298 1 7 . 1 1 3 3 ALA H H 3 8.456 8.456 8.152 0.304 18999
299 1 7 . 1 1 4 4 HIS HA H 4 3.941 3.941 4.311 -0.370 18999
300 1 7 . 1 1 4 4 HIS H H 4 8.397 8.397 8.308 0.089 18999
301 1 7 . 1 1 5 5 TYR HA H 5 4.819 4.819 4.152 0.667 18999
302 1 7 . 1 1 5 5 TYR H H 5 7.986 7.986 8.265 -0.279 18999
303 1 7 . 1 1 6 6 GLY H H 6 8.644 8.644 7.707 0.937 18999
304 1 7 . 1 1 7 7 LYS HA H 7 4.259 4.259 4.638 -0.379 18999
305 1 7 . 1 1 7 7 LYS H H 7 8.343 8.343 8.355 -0.012 18999
306 1 7 . 1 1 8 8 CYS HA H 8 4.849 4.849 4.537 0.312 18999
307 1 7 . 1 1 8 8 CYS H H 8 8.496 8.496 8.519 -0.023 18999
308 1 7 . 1 1 9 9 ASP HA H 9 5.022 5.022 4.397 0.625 18999
309 1 7 . 1 1 9 9 ASP H H 9 8.434 8.434 7.529 0.905 18999
310 1 7 . 1 1 10 10 GLY H H 10 8.437 8.437 8.335 0.102 18999
311 1 7 . 1 1 11 11 ILE HA H 11 4.132 4.132 3.652 0.480 18999
312 1 7 . 1 1 11 11 ILE H H 11 8.348 8.348 8.179 0.169 18999
313 1 7 . 1 1 12 12 ILE HA H 12 4.655 4.655 4.188 0.467 18999
314 1 7 . 1 1 12 12 ILE H H 12 8.123 8.123 7.792 0.331 18999
315 1 7 . 1 1 13 13 ASN HA H 13 3.714 3.714 4.808 -1.094 18999
316 1 7 . 1 1 13 13 ASN H H 13 9.607 9.607 8.049 1.558 18999
317 1 7 . 1 1 14 14 GLN HA H 14 4.534 4.534 4.645 -0.111 18999
318 1 7 . 1 1 14 14 GLN H H 14 8.644 8.644 8.562 0.082 18999
319 1 7 . 1 1 15 15 CYS HA H 15 4.877 4.877 4.357 0.520 18999
320 1 7 . 1 1 15 15 CYS H H 15 8.744 8.744 8.548 0.196 18999
321 1 7 . 1 1 16 16 CYS HA H 16 4.621 4.621 4.106 0.515 18999
322 1 7 . 1 1 16 16 CYS H H 16 10.077 10.077 8.647 1.430 18999
323 1 7 . 1 1 17 17 ASP HA H 17 5.534 5.534 4.827 0.707 18999
324 1 7 . 1 1 17 17 ASP H H 17 8.683 8.683 7.873 0.810 18999
325 1 7 . 1 1 19 19 TRP HA H 19 4.740 4.740 4.409 0.331 18999
326 1 7 . 1 1 19 19 TRP H H 19 8.781 8.781 7.912 0.869 18999
327 1 7 . 1 1 20 20 LEU HA H 20 4.557 4.557 4.782 -0.225 18999
328 1 7 . 1 1 20 20 LEU H H 20 8.713 8.713 8.112 0.601 18999
329 1 7 . 1 1 21 21 CYS HA H 21 4.097 4.097 5.213 -1.116 18999
330 1 7 . 1 1 21 21 CYS H H 21 8.047 8.047 8.814 -0.767 18999
331 1 7 . 1 1 22 22 THR HA H 22 4.434 4.434 4.262 0.172 18999
332 1 7 . 1 1 22 22 THR H H 22 9.382 9.382 8.545 0.837 18999
333 1 7 . 1 1 23 23 PRO HA H 23 5.142 5.142 4.692 0.450 18999
334 1 7 . 1 1 24 24 PRO HA H 24 3.976 3.976 4.381 -0.405 18999
335 1 7 . 1 1 25 25 ILE HA H 25 5.364 5.364 4.281 1.083 18999
336 1 7 . 1 1 25 25 ILE H H 25 7.997 7.997 7.561 0.436 18999
337 1 7 . 1 1 26 26 ILE HA H 26 4.389 4.389 3.894 0.495 18999
338 1 7 . 1 1 26 26 ILE H H 26 7.824 7.824 7.733 0.091 18999
339 1 7 . 1 1 27 27 GLY H H 27 7.701 7.701 8.092 -0.391 18999
340 1 7 . 1 1 28 28 PHE HA H 28 5.485 5.485 5.288 0.197 18999
341 1 7 . 1 1 28 28 PHE H H 28 8.221 8.221 7.892 0.329 18999
342 1 7 . 1 1 29 29 CYS HA H 29 4.845 4.845 4.575 0.270 18999
343 1 7 . 1 1 29 29 CYS H H 29 8.885 8.885 8.765 0.120 18999
344 1 8 . 1 1 2 2 ILE HA H 2 4.161 4.161 3.895 0.266 18999
345 1 8 . 1 1 2 2 ILE H H 2 9.119 9.119 8.156 0.963 18999
346 1 8 . 1 1 3 3 ALA HA H 3 4.996 4.996 4.180 0.816 18999
347 1 8 . 1 1 3 3 ALA H H 3 8.456 8.456 8.189 0.267 18999
348 1 8 . 1 1 4 4 HIS HA H 4 3.941 3.941 4.248 -0.307 18999
349 1 8 . 1 1 4 4 HIS H H 4 8.397 8.397 8.031 0.366 18999
350 1 8 . 1 1 5 5 TYR HA H 5 4.819 4.819 3.903 0.916 18999
351 1 8 . 1 1 5 5 TYR H H 5 7.986 7.986 8.346 -0.360 18999
352 1 8 . 1 1 6 6 GLY H H 6 8.644 8.644 7.843 0.801 18999
353 1 8 . 1 1 7 7 LYS HA H 7 4.259 4.259 4.704 -0.445 18999
354 1 8 . 1 1 7 7 LYS H H 7 8.343 8.343 8.448 -0.105 18999
355 1 8 . 1 1 8 8 CYS HA H 8 4.849 4.849 4.573 0.276 18999
356 1 8 . 1 1 8 8 CYS H H 8 8.496 8.496 8.716 -0.220 18999
357 1 8 . 1 1 9 9 ASP HA H 9 5.022 5.022 4.505 0.517 18999
358 1 8 . 1 1 9 9 ASP H H 9 8.434 8.434 7.576 0.858 18999
359 1 8 . 1 1 10 10 GLY H H 10 8.437 8.437 8.674 -0.237 18999
360 1 8 . 1 1 11 11 ILE HA H 11 4.132 4.132 3.703 0.429 18999
361 1 8 . 1 1 11 11 ILE H H 11 8.348 8.348 8.223 0.125 18999
362 1 8 . 1 1 12 12 ILE HA H 12 4.655 4.655 4.210 0.445 18999
363 1 8 . 1 1 12 12 ILE H H 12 8.123 8.123 7.723 0.400 18999
364 1 8 . 1 1 13 13 ASN HA H 13 3.714 3.714 4.789 -1.075 18999
365 1 8 . 1 1 13 13 ASN H H 13 9.607 9.607 8.032 1.575 18999
366 1 8 . 1 1 14 14 GLN HA H 14 4.534 4.534 4.718 -0.184 18999
367 1 8 . 1 1 14 14 GLN H H 14 8.644 8.644 8.486 0.158 18999
368 1 8 . 1 1 15 15 CYS HA H 15 4.877 4.877 4.376 0.501 18999
369 1 8 . 1 1 15 15 CYS H H 15 8.744 8.744 8.527 0.217 18999
370 1 8 . 1 1 16 16 CYS HA H 16 4.621 4.621 4.168 0.453 18999
371 1 8 . 1 1 16 16 CYS H H 16 10.077 10.077 8.675 1.402 18999
372 1 8 . 1 1 17 17 ASP HA H 17 5.534 5.534 4.824 0.710 18999
373 1 8 . 1 1 17 17 ASP H H 17 8.683 8.683 8.096 0.587 18999
374 1 8 . 1 1 19 19 TRP HA H 19 4.740 4.740 4.475 0.265 18999
375 1 8 . 1 1 19 19 TRP H H 19 8.781 8.781 7.445 1.336 18999
376 1 8 . 1 1 20 20 LEU HA H 20 4.557 4.557 4.792 -0.235 18999
377 1 8 . 1 1 20 20 LEU H H 20 8.713 8.713 8.368 0.345 18999
378 1 8 . 1 1 21 21 CYS HA H 21 4.097 4.097 5.115 -1.018 18999
379 1 8 . 1 1 21 21 CYS H H 21 8.047 8.047 8.935 -0.888 18999
380 1 8 . 1 1 22 22 THR HA H 22 4.434 4.434 4.279 0.155 18999
381 1 8 . 1 1 22 22 THR H H 22 9.382 9.382 8.578 0.804 18999
382 1 8 . 1 1 23 23 PRO HA H 23 5.142 5.142 4.676 0.466 18999
383 1 8 . 1 1 24 24 PRO HA H 24 3.976 3.976 4.458 -0.482 18999
384 1 8 . 1 1 25 25 ILE HA H 25 5.364 5.364 4.234 1.130 18999
385 1 8 . 1 1 25 25 ILE H H 25 7.997 7.997 7.969 0.028 18999
386 1 8 . 1 1 26 26 ILE HA H 26 4.389 4.389 4.201 0.188 18999
387 1 8 . 1 1 26 26 ILE H H 26 7.824 7.824 7.804 0.020 18999
388 1 8 . 1 1 27 27 GLY H H 27 7.701 7.701 8.337 -0.636 18999
389 1 8 . 1 1 28 28 PHE HA H 28 5.485 5.485 4.869 0.616 18999
390 1 8 . 1 1 28 28 PHE H H 28 8.221 8.221 7.849 0.372 18999
391 1 8 . 1 1 29 29 CYS HA H 29 4.845 4.845 4.436 0.409 18999
392 1 8 . 1 1 29 29 CYS H H 29 8.885 8.885 8.318 0.567 18999
393 1 9 . 1 1 2 2 ILE HA H 2 4.161 4.161 3.847 0.314 18999
394 1 9 . 1 1 2 2 ILE H H 2 9.119 9.119 8.209 0.910 18999
395 1 9 . 1 1 3 3 ALA HA H 3 4.996 4.996 4.358 0.638 18999
396 1 9 . 1 1 3 3 ALA H H 3 8.456 8.456 8.219 0.237 18999
397 1 9 . 1 1 4 4 HIS HA H 4 3.941 3.941 4.372 -0.431 18999
398 1 9 . 1 1 4 4 HIS H H 4 8.397 8.397 8.716 -0.319 18999
399 1 9 . 1 1 5 5 TYR HA H 5 4.819 4.819 4.223 0.596 18999
400 1 9 . 1 1 5 5 TYR H H 5 7.986 7.986 8.321 -0.335 18999
401 1 9 . 1 1 6 6 GLY H H 6 8.644 8.644 7.720 0.924 18999
402 1 9 . 1 1 7 7 LYS HA H 7 4.259 4.259 4.582 -0.323 18999
403 1 9 . 1 1 7 7 LYS H H 7 8.343 8.343 8.106 0.237 18999
404 1 9 . 1 1 8 8 CYS HA H 8 4.849 4.849 4.621 0.228 18999
405 1 9 . 1 1 8 8 CYS H H 8 8.496 8.496 8.620 -0.124 18999
406 1 9 . 1 1 9 9 ASP HA H 9 5.022 5.022 4.400 0.622 18999
407 1 9 . 1 1 9 9 ASP H H 9 8.434 8.434 7.522 0.912 18999
408 1 9 . 1 1 10 10 GLY H H 10 8.437 8.437 8.612 -0.175 18999
409 1 9 . 1 1 11 11 ILE HA H 11 4.132 4.132 3.677 0.455 18999
410 1 9 . 1 1 11 11 ILE H H 11 8.348 8.348 8.188 0.160 18999
411 1 9 . 1 1 12 12 ILE HA H 12 4.655 4.655 4.210 0.445 18999
412 1 9 . 1 1 12 12 ILE H H 12 8.123 8.123 7.716 0.407 18999
413 1 9 . 1 1 13 13 ASN HA H 13 3.714 3.714 4.774 -1.060 18999
414 1 9 . 1 1 13 13 ASN H H 13 9.607 9.607 8.003 1.604 18999
415 1 9 . 1 1 14 14 GLN HA H 14 4.534 4.534 4.716 -0.182 18999
416 1 9 . 1 1 14 14 GLN H H 14 8.644 8.644 8.497 0.147 18999
417 1 9 . 1 1 15 15 CYS HA H 15 4.877 4.877 4.346 0.531 18999
418 1 9 . 1 1 15 15 CYS H H 15 8.744 8.744 8.559 0.185 18999
419 1 9 . 1 1 16 16 CYS HA H 16 4.621 4.621 4.118 0.503 18999
420 1 9 . 1 1 16 16 CYS H H 16 10.077 10.077 8.582 1.495 18999
421 1 9 . 1 1 17 17 ASP HA H 17 5.534 5.534 4.887 0.647 18999
422 1 9 . 1 1 17 17 ASP H H 17 8.683 8.683 7.923 0.760 18999
423 1 9 . 1 1 19 19 TRP HA H 19 4.740 4.740 4.396 0.344 18999
424 1 9 . 1 1 19 19 TRP H H 19 8.781 8.781 7.924 0.857 18999
425 1 9 . 1 1 20 20 LEU HA H 20 4.557 4.557 4.755 -0.199 18999
426 1 9 . 1 1 20 20 LEU H H 20 8.713 8.713 7.870 0.843 18999
427 1 9 . 1 1 21 21 CYS HA H 21 4.097 4.097 5.097 -1.000 18999
428 1 9 . 1 1 21 21 CYS H H 21 8.047 8.047 8.822 -0.775 18999
429 1 9 . 1 1 22 22 THR HA H 22 4.434 4.434 4.273 0.161 18999
430 1 9 . 1 1 22 22 THR H H 22 9.382 9.382 8.504 0.878 18999
431 1 9 . 1 1 23 23 PRO HA H 23 5.142 5.142 4.690 0.452 18999
432 1 9 . 1 1 24 24 PRO HA H 24 3.976 3.976 4.379 -0.403 18999
433 1 9 . 1 1 25 25 ILE HA H 25 5.364 5.364 4.208 1.156 18999
434 1 9 . 1 1 25 25 ILE H H 25 7.997 7.997 7.557 0.440 18999
435 1 9 . 1 1 26 26 ILE HA H 26 4.389 4.389 3.930 0.459 18999
436 1 9 . 1 1 26 26 ILE H H 26 7.824 7.824 7.815 0.009 18999
437 1 9 . 1 1 27 27 GLY H H 27 7.701 7.701 8.163 -0.462 18999
438 1 9 . 1 1 28 28 PHE HA H 28 5.485 5.485 4.924 0.561 18999
439 1 9 . 1 1 28 28 PHE H H 28 8.221 8.221 7.615 0.606 18999
440 1 9 . 1 1 29 29 CYS HA H 29 4.845 4.845 4.709 0.136 18999
441 1 9 . 1 1 29 29 CYS H H 29 8.885 8.885 9.021 -0.136 18999
442 1 10 . 1 1 2 2 ILE HA H 2 4.161 4.161 3.762 0.399 18999
443 1 10 . 1 1 2 2 ILE H H 2 9.119 9.119 8.287 0.832 18999
444 1 10 . 1 1 3 3 ALA HA H 3 4.996 4.996 4.267 0.729 18999
445 1 10 . 1 1 3 3 ALA H H 3 8.456 8.456 8.190 0.266 18999
446 1 10 . 1 1 4 4 HIS HA H 4 3.941 3.941 4.579 -0.638 18999
447 1 10 . 1 1 4 4 HIS H H 4 8.397 8.397 8.371 0.026 18999
448 1 10 . 1 1 5 5 TYR HA H 5 4.819 4.819 4.266 0.553 18999
449 1 10 . 1 1 5 5 TYR H H 5 7.986 7.986 8.528 -0.542 18999
450 1 10 . 1 1 6 6 GLY H H 6 8.644 8.644 7.751 0.893 18999
451 1 10 . 1 1 7 7 LYS HA H 7 4.259 4.259 4.544 -0.285 18999
452 1 10 . 1 1 7 7 LYS H H 7 8.343 8.343 8.218 0.125 18999
453 1 10 . 1 1 8 8 CYS HA H 8 4.849 4.849 4.622 0.227 18999
454 1 10 . 1 1 8 8 CYS H H 8 8.496 8.496 8.609 -0.113 18999
455 1 10 . 1 1 9 9 ASP HA H 9 5.022 5.022 4.406 0.616 18999
456 1 10 . 1 1 9 9 ASP H H 9 8.434 8.434 7.549 0.885 18999
457 1 10 . 1 1 10 10 GLY H H 10 8.437 8.437 8.607 -0.170 18999
458 1 10 . 1 1 11 11 ILE HA H 11 4.132 4.132 3.604 0.528 18999
459 1 10 . 1 1 11 11 ILE H H 11 8.348 8.348 8.163 0.185 18999
460 1 10 . 1 1 12 12 ILE HA H 12 4.655 4.655 4.154 0.501 18999
461 1 10 . 1 1 12 12 ILE H H 12 8.123 8.123 7.836 0.287 18999
462 1 10 . 1 1 13 13 ASN HA H 13 3.714 3.714 4.797 -1.083 18999
463 1 10 . 1 1 13 13 ASN H H 13 9.607 9.607 7.981 1.626 18999
464 1 10 . 1 1 14 14 GLN HA H 14 4.534 4.534 4.661 -0.127 18999
465 1 10 . 1 1 14 14 GLN H H 14 8.644 8.644 8.568 0.076 18999
466 1 10 . 1 1 15 15 CYS HA H 15 4.877 4.877 4.433 0.444 18999
467 1 10 . 1 1 15 15 CYS H H 15 8.744 8.744 8.510 0.234 18999
468 1 10 . 1 1 16 16 CYS HA H 16 4.621 4.621 4.139 0.482 18999
469 1 10 . 1 1 16 16 CYS H H 16 10.077 10.077 8.634 1.443 18999
470 1 10 . 1 1 17 17 ASP HA H 17 5.534 5.534 4.805 0.729 18999
471 1 10 . 1 1 17 17 ASP H H 17 8.683 8.683 7.910 0.773 18999
472 1 10 . 1 1 19 19 TRP HA H 19 4.740 4.740 4.521 0.219 18999
473 1 10 . 1 1 19 19 TRP H H 19 8.781 8.781 7.699 1.082 18999
474 1 10 . 1 1 20 20 LEU HA H 20 4.557 4.557 4.907 -0.350 18999
475 1 10 . 1 1 20 20 LEU H H 20 8.713 8.713 8.163 0.550 18999
476 1 10 . 1 1 21 21 CYS HA H 21 4.097 4.097 5.052 -0.955 18999
477 1 10 . 1 1 21 21 CYS H H 21 8.047 8.047 9.028 -0.981 18999
478 1 10 . 1 1 22 22 THR HA H 22 4.434 4.434 4.211 0.223 18999
479 1 10 . 1 1 22 22 THR H H 22 9.382 9.382 8.516 0.866 18999
480 1 10 . 1 1 23 23 PRO HA H 23 5.142 5.142 4.688 0.454 18999
481 1 10 . 1 1 24 24 PRO HA H 24 3.976 3.976 4.422 -0.446 18999
482 1 10 . 1 1 25 25 ILE HA H 25 5.364 5.364 4.278 1.086 18999
483 1 10 . 1 1 25 25 ILE H H 25 7.997 7.997 7.898 0.099 18999
484 1 10 . 1 1 26 26 ILE HA H 26 4.389 4.389 4.166 0.223 18999
485 1 10 . 1 1 26 26 ILE H H 26 7.824 7.824 7.864 -0.040 18999
486 1 10 . 1 1 27 27 GLY H H 27 7.701 7.701 8.190 -0.489 18999
487 1 10 . 1 1 28 28 PHE HA H 28 5.485 5.485 4.903 0.582 18999
488 1 10 . 1 1 28 28 PHE H H 28 8.221 8.221 7.632 0.589 18999
489 1 10 . 1 1 29 29 CYS HA H 29 4.845 4.845 4.654 0.192 18999
490 1 10 . 1 1 29 29 CYS H H 29 8.885 8.885 8.862 0.023 18999
491 1 11 . 1 1 2 2 ILE HA H 2 4.161 4.161 3.861 0.300 18999
492 1 11 . 1 1 2 2 ILE H H 2 9.119 9.119 8.071 1.048 18999
493 1 11 . 1 1 3 3 ALA HA H 3 4.996 4.996 4.213 0.783 18999
494 1 11 . 1 1 3 3 ALA H H 3 8.456 8.456 8.197 0.259 18999
495 1 11 . 1 1 4 4 HIS HA H 4 3.941 3.941 4.370 -0.429 18999
496 1 11 . 1 1 4 4 HIS H H 4 8.397 8.397 8.338 0.059 18999
497 1 11 . 1 1 5 5 TYR HA H 5 4.819 4.819 4.365 0.454 18999
498 1 11 . 1 1 5 5 TYR H H 5 7.986 7.986 8.650 -0.664 18999
499 1 11 . 1 1 6 6 GLY H H 6 8.644 8.644 7.672 0.972 18999
500 1 11 . 1 1 7 7 LYS HA H 7 4.259 4.259 4.312 -0.053 18999
501 1 11 . 1 1 7 7 LYS H H 7 8.343 8.343 8.395 -0.052 18999
502 1 11 . 1 1 8 8 CYS HA H 8 4.849 4.849 4.561 0.288 18999
503 1 11 . 1 1 8 8 CYS H H 8 8.496 8.496 8.841 -0.345 18999
504 1 11 . 1 1 9 9 ASP HA H 9 5.022 5.022 4.404 0.618 18999
505 1 11 . 1 1 9 9 ASP H H 9 8.434 8.434 7.518 0.916 18999
506 1 11 . 1 1 10 10 GLY H H 10 8.437 8.437 8.543 -0.106 18999
507 1 11 . 1 1 11 11 ILE HA H 11 4.132 4.132 3.654 0.478 18999
508 1 11 . 1 1 11 11 ILE H H 11 8.348 8.348 8.181 0.167 18999
509 1 11 . 1 1 12 12 ILE HA H 12 4.655 4.655 4.320 0.335 18999
510 1 11 . 1 1 12 12 ILE H H 12 8.123 8.123 7.737 0.386 18999
511 1 11 . 1 1 13 13 ASN HA H 13 3.714 3.714 4.754 -1.040 18999
512 1 11 . 1 1 13 13 ASN H H 13 9.607 9.607 7.964 1.643 18999
513 1 11 . 1 1 14 14 GLN HA H 14 4.534 4.534 4.653 -0.119 18999
514 1 11 . 1 1 14 14 GLN H H 14 8.644 8.644 8.561 0.083 18999
515 1 11 . 1 1 15 15 CYS HA H 15 4.877 4.877 4.390 0.487 18999
516 1 11 . 1 1 15 15 CYS H H 15 8.744 8.744 8.540 0.204 18999
517 1 11 . 1 1 16 16 CYS HA H 16 4.621 4.621 4.216 0.405 18999
518 1 11 . 1 1 16 16 CYS H H 16 10.077 10.077 8.711 1.366 18999
519 1 11 . 1 1 17 17 ASP HA H 17 5.534 5.534 4.812 0.722 18999
520 1 11 . 1 1 17 17 ASP H H 17 8.683 8.683 7.614 1.069 18999
521 1 11 . 1 1 19 19 TRP HA H 19 4.740 4.740 4.530 0.210 18999
522 1 11 . 1 1 19 19 TRP H H 19 8.781 8.781 8.013 0.768 18999
523 1 11 . 1 1 20 20 LEU HA H 20 4.557 4.557 4.670 -0.113 18999
524 1 11 . 1 1 20 20 LEU H H 20 8.713 8.713 7.831 0.882 18999
525 1 11 . 1 1 21 21 CYS HA H 21 4.097 4.097 5.021 -0.924 18999
526 1 11 . 1 1 21 21 CYS H H 21 8.047 8.047 8.927 -0.880 18999
527 1 11 . 1 1 22 22 THR HA H 22 4.434 4.434 4.411 0.023 18999
528 1 11 . 1 1 22 22 THR H H 22 9.382 9.382 8.567 0.815 18999
529 1 11 . 1 1 23 23 PRO HA H 23 5.142 5.142 4.715 0.427 18999
530 1 11 . 1 1 24 24 PRO HA H 24 3.976 3.976 4.453 -0.477 18999
531 1 11 . 1 1 25 25 ILE HA H 25 5.364 5.364 4.343 1.021 18999
532 1 11 . 1 1 25 25 ILE H H 25 7.997 7.997 7.815 0.182 18999
533 1 11 . 1 1 26 26 ILE HA H 26 4.389 4.389 4.015 0.374 18999
534 1 11 . 1 1 26 26 ILE H H 26 7.824 7.824 7.786 0.038 18999
535 1 11 . 1 1 27 27 GLY H H 27 7.701 7.701 8.271 -0.570 18999
536 1 11 . 1 1 28 28 PHE HA H 28 5.485 5.485 4.779 0.706 18999
537 1 11 . 1 1 28 28 PHE H H 28 8.221 8.221 7.664 0.557 18999
538 1 11 . 1 1 29 29 CYS HA H 29 4.845 4.845 4.708 0.137 18999
539 1 11 . 1 1 29 29 CYS H H 29 8.885 8.885 8.626 0.259 18999
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 18999
2 1 1 "Average Difference" HA 30 0.550 -0.200 0.521 18999
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18999
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 18999
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18999
6 1 1 "Average Difference" HN 25 0.738 -0.391 0.639 18999
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18999
8 1 2 "Average Difference" HA 30 0.529 -0.215 0.492 18999
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18999
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 18999
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18999
12 1 2 "Average Difference" HN 25 0.728 -0.371 0.640 18999
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18999
14 1 3 "Average Difference" HA 30 0.538 -0.239 0.489 18999
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18999
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 18999
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18999
18 1 3 "Average Difference" HN 25 0.724 -0.385 0.625 18999
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18999
20 1 4 "Average Difference" HA 30 0.561 -0.236 0.518 18999
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18999
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 18999
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18999
24 1 4 "Average Difference" HN 25 0.689 -0.370 0.593 18999
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18999
26 1 5 "Average Difference" HA 30 0.532 -0.213 0.496 18999
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18999
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 18999
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18999
30 1 5 "Average Difference" HN 25 0.722 -0.367 0.634 18999
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18999
32 1 6 "Average Difference" HA 30 0.514 -0.192 0.485 18999
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18999
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 18999
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18999
36 1 6 "Average Difference" HN 25 0.694 -0.345 0.614 18999
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18999
38 1 7 "Average Difference" HA 30 0.547 -0.209 0.515 18999
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18999
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 18999
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18999
42 1 7 "Average Difference" HN 25 0.657 -0.383 0.545 18999
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18999
44 1 8 "Average Difference" HA 30 0.553 -0.215 0.518 18999
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18999
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 18999
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18999
48 1 8 "Average Difference" HN 25 0.693 -0.350 0.610 18999
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18999
50 1 9 "Average Difference" HA 30 0.544 -0.217 0.507 18999
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18999
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 18999
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18999
54 1 9 "Average Difference" HN 25 0.697 -0.371 0.601 18999
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18999
56 1 10 "Average Difference" HA 30 0.549 -0.207 0.518 18999
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18999
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 18999
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18999
60 1 10 "Average Difference" HN 25 0.692 -0.341 0.615 18999
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18999
62 1 11 "Average Difference" HA 30 0.525 -0.217 0.486 18999
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18999
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 18999
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 18999
66 1 11 "Average Difference" HN 25 0.721 -0.362 0.637 18999
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 18999
_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 ILE HA H 2 4.161 4.161 3.848 0.313 18999
2 1 . 1 1 2 2 ILE H H 2 9.119 9.119 8.157 0.962 18999
3 1 . 1 1 3 3 ALA HA H 3 4.996 4.996 4.230 0.766 18999
4 1 . 1 1 3 3 ALA H H 3 8.456 8.456 8.199 0.257 18999
5 1 . 1 1 4 4 HIS HA H 4 3.941 3.941 4.314 -0.373 18999
6 1 . 1 1 4 4 HIS H H 4 8.397 8.397 8.292 0.105 18999
7 1 . 1 1 5 5 TYR HA H 5 4.819 4.819 4.218 0.601 18999
8 1 . 1 1 5 5 TYR H H 5 7.986 7.986 8.479 -0.493 18999
9 1 . 1 1 6 6 GLY H H 6 8.644 8.644 7.733 0.911 18999
10 1 . 1 1 7 7 LYS HA H 7 4.259 4.259 4.509 -0.250 18999
11 1 . 1 1 7 7 LYS H H 7 8.343 8.343 8.344 -0.001 18999
12 1 . 1 1 8 8 CYS HA H 8 4.849 4.849 4.569 0.280 18999
13 1 . 1 1 8 8 CYS H H 8 8.496 8.496 8.717 -0.221 18999
14 1 . 1 1 9 9 ASP HA H 9 5.022 5.022 4.411 0.611 18999
15 1 . 1 1 9 9 ASP H H 9 8.434 8.434 7.536 0.898 18999
16 1 . 1 1 10 10 GLY H H 10 8.437 8.437 8.587 -0.150 18999
17 1 . 1 1 11 11 ILE HA H 11 4.132 4.132 3.659 0.473 18999
18 1 . 1 1 11 11 ILE H H 11 8.348 8.348 8.127 0.221 18999
19 1 . 1 1 12 12 ILE HA H 12 4.655 4.655 4.221 0.434 18999
20 1 . 1 1 12 12 ILE H H 12 8.123 8.123 7.763 0.360 18999
21 1 . 1 1 13 13 ASN HA H 13 3.714 3.714 4.784 -1.070 18999
22 1 . 1 1 13 13 ASN H H 13 9.607 9.607 8.001 1.606 18999
23 1 . 1 1 14 14 GLN HA H 14 4.534 4.534 4.668 -0.134 18999
24 1 . 1 1 14 14 GLN H H 14 8.644 8.644 8.545 0.099 18999
25 1 . 1 1 15 15 CYS HA H 15 4.877 4.877 4.389 0.488 18999
26 1 . 1 1 15 15 CYS H H 15 8.744 8.744 8.534 0.210 18999
27 1 . 1 1 16 16 CYS HA H 16 4.621 4.621 4.174 0.447 18999
28 1 . 1 1 16 16 CYS H H 16 10.077 10.077 8.667 1.410 18999
29 1 . 1 1 17 17 ASP HA H 17 5.534 5.534 4.828 0.706 18999
30 1 . 1 1 17 17 ASP H H 17 8.683 8.683 7.807 0.876 18999
31 1 . 1 1 19 19 TRP HA H 19 4.740 4.740 4.467 0.273 18999
32 1 . 1 1 19 19 TRP H H 19 8.781 8.781 7.805 0.976 18999
33 1 . 1 1 20 20 LEU HA H 20 4.557 4.557 4.788 -0.231 18999
34 1 . 1 1 20 20 LEU H H 20 8.713 8.713 7.996 0.717 18999
35 1 . 1 1 21 21 CYS HA H 21 4.097 4.097 5.107 -1.010 18999
36 1 . 1 1 21 21 CYS H H 21 8.047 8.047 8.908 -0.861 18999
37 1 . 1 1 22 22 THR HA H 22 4.434 4.434 4.287 0.147 18999
38 1 . 1 1 22 22 THR H H 22 9.382 9.382 8.523 0.859 18999
39 1 . 1 1 23 23 PRO HA H 23 5.142 5.142 4.684 0.458 18999
40 1 . 1 1 24 24 PRO HA H 24 3.976 3.976 4.418 -0.442 18999
41 1 . 1 1 25 25 ILE HA H 25 5.364 5.364 4.296 1.068 18999
42 1 . 1 1 25 25 ILE H H 25 7.997 7.997 7.784 0.213 18999
43 1 . 1 1 26 26 ILE HA H 26 4.389 4.389 4.052 0.337 18999
44 1 . 1 1 26 26 ILE H H 26 7.824 7.824 7.781 0.043 18999
45 1 . 1 1 27 27 GLY H H 27 7.701 7.701 8.233 -0.532 18999
46 1 . 1 1 28 28 PHE HA H 28 5.485 5.485 4.900 0.585 18999
47 1 . 1 1 28 28 PHE H H 28 8.221 8.221 7.716 0.505 18999
48 1 . 1 1 29 29 CYS HA H 29 4.845 4.845 4.638 0.207 18999
49 1 . 1 1 29 29 CYS H H 29 8.885 8.885 8.683 0.202 18999
stop_
save_