data_19846
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19846
_Entry.PDB_ID 2MM5
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 19846
_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 VAL HA H 2 4.334 4.334 4.379 -0.045 19846
2 1 1 . 1 1 2 2 VAL H H 2 9.114 9.114 8.318 0.796 19846
3 1 1 . 1 1 3 3 PRO HA H 3 4.419 4.419 4.340 0.079 19846
4 1 1 . 1 1 4 4 GLN HA H 4 2.659 2.659 4.134 -1.475 19846
5 1 1 . 1 1 4 4 GLN H H 4 7.676 7.676 7.564 0.112 19846
6 1 1 . 1 1 5 5 TYR HA H 5 3.966 3.966 4.338 -0.372 19846
7 1 1 . 1 1 5 5 TYR H H 5 9.487 9.487 8.409 1.078 19846
8 1 1 . 1 1 6 6 GLY H H 6 8.520 8.520 7.755 0.765 19846
9 1 1 . 1 1 7 7 VAL HA H 7 3.917 3.917 3.111 0.806 19846
10 1 1 . 1 1 7 7 VAL H H 7 8.178 8.178 8.031 0.147 19846
11 1 1 . 1 1 8 8 CYS HA H 8 4.954 4.954 4.715 0.239 19846
12 1 1 . 1 1 8 8 CYS H H 8 8.016 8.016 8.368 -0.352 19846
13 1 1 . 1 1 9 9 ASP HA H 9 4.779 4.779 4.613 0.166 19846
14 1 1 . 1 1 9 9 ASP H H 9 8.509 8.509 8.104 0.405 19846
15 1 1 . 1 1 10 10 GLY H H 10 8.160 8.160 8.491 -0.331 19846
16 1 1 . 1 1 11 11 ILE HA H 11 4.158 4.158 4.588 -0.430 19846
17 1 1 . 1 1 11 11 ILE H H 11 8.264 8.264 8.173 0.091 19846
18 1 1 . 1 1 12 12 ILE HA H 12 4.068 4.068 4.240 -0.172 19846
19 1 1 . 1 1 12 12 ILE H H 12 8.195 8.195 7.903 0.292 19846
20 1 1 . 1 1 13 13 ASN HA H 13 4.807 4.807 4.856 -0.049 19846
21 1 1 . 1 1 13 13 ASN H H 13 8.524 8.524 8.145 0.379 19846
22 1 1 . 1 1 14 14 GLN HA H 14 4.478 4.478 4.378 0.100 19846
23 1 1 . 1 1 14 14 GLN H H 14 8.524 8.524 8.759 -0.235 19846
24 1 1 . 1 1 15 15 CYS HA H 15 4.857 4.857 4.756 0.101 19846
25 1 1 . 1 1 15 15 CYS H H 15 8.733 8.733 7.927 0.806 19846
26 1 1 . 1 1 16 16 CYS HA H 16 4.562 4.562 4.806 -0.244 19846
27 1 1 . 1 1 16 16 CYS H H 16 9.798 9.798 8.726 1.072 19846
28 1 1 . 1 1 17 17 ASP HA H 17 4.655 4.655 5.062 -0.407 19846
29 1 1 . 1 1 17 17 ASP H H 17 8.785 8.785 8.547 0.238 19846
30 1 1 . 1 1 18 18 PRO HA H 18 4.651 4.651 4.281 0.370 19846
31 1 1 . 1 1 19 19 TYR HA H 19 4.608 4.608 3.962 0.646 19846
32 1 1 . 1 1 19 19 TYR H H 19 8.512 8.512 7.230 1.282 19846
33 1 1 . 1 1 20 20 TYR HA H 20 4.857 4.857 4.762 0.095 19846
34 1 1 . 1 1 20 20 TYR H H 20 8.478 8.478 8.385 0.093 19846
35 1 1 . 1 1 21 21 CYS HA H 21 4.405 4.405 4.411 -0.006 19846
36 1 1 . 1 1 21 21 CYS H H 21 8.527 8.527 8.650 -0.123 19846
37 1 1 . 1 1 22 22 SER HA H 22 4.657 4.657 5.096 -0.439 19846
38 1 1 . 1 1 22 22 SER H H 22 8.559 8.559 8.692 -0.133 19846
39 1 1 . 1 1 23 23 PRO HA H 23 5.082 5.082 4.635 0.447 19846
40 1 1 . 1 1 24 24 PRO HA H 24 3.960 3.960 4.497 -0.537 19846
41 1 1 . 1 1 25 25 ILE HA H 25 3.737 3.737 4.143 -0.406 19846
42 1 1 . 1 1 25 25 ILE H H 25 7.609 7.609 8.315 -0.706 19846
43 1 1 . 1 1 26 26 TYR HA H 26 4.723 4.723 4.853 -0.130 19846
44 1 1 . 1 1 26 26 TYR H H 26 7.326 7.326 8.199 -0.873 19846
45 1 1 . 1 1 27 27 GLY H H 27 8.048 8.048 7.851 0.197 19846
46 1 1 . 1 1 28 28 HIS HA H 28 5.594 5.594 5.037 0.557 19846
47 1 1 . 1 1 28 28 HIS H H 28 8.125 8.125 8.079 0.046 19846
48 1 1 . 1 1 29 29 CYS HA H 29 4.778 4.778 4.483 0.295 19846
49 1 1 . 1 1 29 29 CYS H H 29 8.373 8.373 8.424 -0.051 19846
50 1 2 . 1 1 2 2 VAL HA H 2 4.334 4.334 4.484 -0.150 19846
51 1 2 . 1 1 2 2 VAL H H 2 9.114 9.114 7.974 1.140 19846
52 1 2 . 1 1 3 3 PRO HA H 3 4.419 4.419 4.303 0.116 19846
53 1 2 . 1 1 4 4 GLN HA H 4 2.659 2.659 4.188 -1.529 19846
54 1 2 . 1 1 4 4 GLN H H 4 7.676 7.676 7.587 0.089 19846
55 1 2 . 1 1 5 5 TYR HA H 5 3.966 3.966 4.321 -0.355 19846
56 1 2 . 1 1 5 5 TYR H H 5 9.487 9.487 8.417 1.070 19846
57 1 2 . 1 1 6 6 GLY H H 6 8.520 8.520 7.845 0.675 19846
58 1 2 . 1 1 7 7 VAL HA H 7 3.917 3.917 3.376 0.541 19846
59 1 2 . 1 1 7 7 VAL H H 7 8.178 8.178 8.176 0.002 19846
60 1 2 . 1 1 8 8 CYS HA H 8 4.954 4.954 4.781 0.173 19846
61 1 2 . 1 1 8 8 CYS H H 8 8.016 8.016 8.816 -0.800 19846
62 1 2 . 1 1 9 9 ASP HA H 9 4.779 4.779 4.740 0.039 19846
63 1 2 . 1 1 9 9 ASP H H 9 8.509 8.509 8.121 0.388 19846
64 1 2 . 1 1 10 10 GLY H H 10 8.160 8.160 8.023 0.137 19846
65 1 2 . 1 1 11 11 ILE HA H 11 4.158 4.158 4.320 -0.162 19846
66 1 2 . 1 1 11 11 ILE H H 11 8.264 8.264 8.286 -0.022 19846
67 1 2 . 1 1 12 12 ILE HA H 12 4.068 4.068 4.060 0.008 19846
68 1 2 . 1 1 12 12 ILE H H 12 8.195 8.195 8.262 -0.067 19846
69 1 2 . 1 1 13 13 ASN HA H 13 4.807 4.807 4.728 0.079 19846
70 1 2 . 1 1 13 13 ASN H H 13 8.524 8.524 7.765 0.759 19846
71 1 2 . 1 1 14 14 GLN HA H 14 4.478 4.478 4.389 0.089 19846
72 1 2 . 1 1 14 14 GLN H H 14 8.524 8.524 8.504 0.020 19846
73 1 2 . 1 1 15 15 CYS HA H 15 4.857 4.857 4.631 0.226 19846
74 1 2 . 1 1 15 15 CYS H H 15 8.733 8.733 8.106 0.627 19846
75 1 2 . 1 1 16 16 CYS HA H 16 4.562 4.562 4.742 -0.180 19846
76 1 2 . 1 1 16 16 CYS H H 16 9.798 9.798 8.731 1.067 19846
77 1 2 . 1 1 17 17 ASP HA H 17 4.655 4.655 5.072 -0.417 19846
78 1 2 . 1 1 17 17 ASP H H 17 8.785 8.785 8.569 0.216 19846
79 1 2 . 1 1 18 18 PRO HA H 18 4.651 4.651 4.301 0.350 19846
80 1 2 . 1 1 19 19 TYR HA H 19 4.608 4.608 3.892 0.716 19846
81 1 2 . 1 1 19 19 TYR H H 19 8.512 8.512 7.385 1.127 19846
82 1 2 . 1 1 20 20 TYR HA H 20 4.857 4.857 4.816 0.041 19846
83 1 2 . 1 1 20 20 TYR H H 20 8.478 8.478 8.342 0.136 19846
84 1 2 . 1 1 21 21 CYS HA H 21 4.405 4.405 4.475 -0.070 19846
85 1 2 . 1 1 21 21 CYS H H 21 8.527 8.527 8.744 -0.217 19846
86 1 2 . 1 1 22 22 SER HA H 22 4.657 4.657 5.213 -0.556 19846
87 1 2 . 1 1 22 22 SER H H 22 8.559 8.559 8.745 -0.186 19846
88 1 2 . 1 1 23 23 PRO HA H 23 5.082 5.082 4.700 0.382 19846
89 1 2 . 1 1 24 24 PRO HA H 24 3.960 3.960 4.491 -0.531 19846
90 1 2 . 1 1 25 25 ILE HA H 25 3.737 3.737 4.188 -0.451 19846
91 1 2 . 1 1 25 25 ILE H H 25 7.609 7.609 8.198 -0.589 19846
92 1 2 . 1 1 26 26 TYR HA H 26 4.723 4.723 5.120 -0.398 19846
93 1 2 . 1 1 26 26 TYR H H 26 7.326 7.326 8.235 -0.909 19846
94 1 2 . 1 1 27 27 GLY H H 27 8.048 8.048 7.900 0.148 19846
95 1 2 . 1 1 28 28 HIS HA H 28 5.594 5.594 5.264 0.330 19846
96 1 2 . 1 1 28 28 HIS H H 28 8.125 8.125 8.102 0.023 19846
97 1 2 . 1 1 29 29 CYS HA H 29 4.778 4.778 4.410 0.368 19846
98 1 2 . 1 1 29 29 CYS H H 29 8.373 8.373 8.334 0.039 19846
99 1 3 . 1 1 2 2 VAL HA H 2 4.334 4.334 4.427 -0.093 19846
100 1 3 . 1 1 2 2 VAL H H 2 9.114 9.114 8.324 0.790 19846
101 1 3 . 1 1 3 3 PRO HA H 3 4.419 4.419 4.388 0.031 19846
102 1 3 . 1 1 4 4 GLN HA H 4 2.659 2.659 4.021 -1.362 19846
103 1 3 . 1 1 4 4 GLN H H 4 7.676 7.676 7.582 0.094 19846
104 1 3 . 1 1 5 5 TYR HA H 5 3.966 3.966 4.386 -0.420 19846
105 1 3 . 1 1 5 5 TYR H H 5 9.487 9.487 8.301 1.186 19846
106 1 3 . 1 1 6 6 GLY H H 6 8.520 8.520 8.025 0.495 19846
107 1 3 . 1 1 7 7 VAL HA H 7 3.917 3.917 3.216 0.701 19846
108 1 3 . 1 1 7 7 VAL H H 7 8.178 8.178 7.514 0.664 19846
109 1 3 . 1 1 8 8 CYS HA H 8 4.954 4.954 4.714 0.240 19846
110 1 3 . 1 1 8 8 CYS H H 8 8.016 8.016 7.806 0.210 19846
111 1 3 . 1 1 9 9 ASP HA H 9 4.779 4.779 4.604 0.175 19846
112 1 3 . 1 1 9 9 ASP H H 9 8.509 8.509 8.021 0.488 19846
113 1 3 . 1 1 10 10 GLY H H 10 8.160 8.160 8.318 -0.158 19846
114 1 3 . 1 1 11 11 ILE HA H 11 4.158 4.158 4.382 -0.224 19846
115 1 3 . 1 1 11 11 ILE H H 11 8.264 8.264 8.347 -0.083 19846
116 1 3 . 1 1 12 12 ILE HA H 12 4.068 4.068 4.204 -0.136 19846
117 1 3 . 1 1 12 12 ILE H H 12 8.195 8.195 7.924 0.271 19846
118 1 3 . 1 1 13 13 ASN HA H 13 4.807 4.807 4.840 -0.033 19846
119 1 3 . 1 1 13 13 ASN H H 13 8.524 8.524 8.060 0.464 19846
120 1 3 . 1 1 14 14 GLN HA H 14 4.478 4.478 4.342 0.136 19846
121 1 3 . 1 1 14 14 GLN H H 14 8.524 8.524 8.865 -0.341 19846
122 1 3 . 1 1 15 15 CYS HA H 15 4.857 4.857 4.935 -0.078 19846
123 1 3 . 1 1 15 15 CYS H H 15 8.733 8.733 7.929 0.804 19846
124 1 3 . 1 1 16 16 CYS HA H 16 4.562 4.562 4.781 -0.219 19846
125 1 3 . 1 1 16 16 CYS H H 16 9.798 9.798 8.747 1.051 19846
126 1 3 . 1 1 17 17 ASP HA H 17 4.655 4.655 4.821 -0.166 19846
127 1 3 . 1 1 17 17 ASP H H 17 8.785 8.785 8.554 0.231 19846
128 1 3 . 1 1 18 18 PRO HA H 18 4.651 4.651 4.152 0.499 19846
129 1 3 . 1 1 19 19 TYR HA H 19 4.608 4.608 3.950 0.658 19846
130 1 3 . 1 1 19 19 TYR H H 19 8.512 8.512 7.149 1.363 19846
131 1 3 . 1 1 20 20 TYR HA H 20 4.857 4.857 4.736 0.121 19846
132 1 3 . 1 1 20 20 TYR H H 20 8.478 8.478 8.512 -0.034 19846
133 1 3 . 1 1 21 21 CYS HA H 21 4.405 4.405 4.340 0.065 19846
134 1 3 . 1 1 21 21 CYS H H 21 8.527 8.527 8.310 0.217 19846
135 1 3 . 1 1 22 22 SER HA H 22 4.657 4.657 5.246 -0.589 19846
136 1 3 . 1 1 22 22 SER H H 22 8.559 8.559 9.059 -0.500 19846
137 1 3 . 1 1 23 23 PRO HA H 23 5.082 5.082 4.691 0.391 19846
138 1 3 . 1 1 24 24 PRO HA H 24 3.960 3.960 4.496 -0.536 19846
139 1 3 . 1 1 25 25 ILE HA H 25 3.737 3.737 4.168 -0.431 19846
140 1 3 . 1 1 25 25 ILE H H 25 7.609 7.609 8.287 -0.678 19846
141 1 3 . 1 1 26 26 TYR HA H 26 4.723 4.723 4.900 -0.177 19846
142 1 3 . 1 1 26 26 TYR H H 26 7.326 7.326 8.167 -0.841 19846
143 1 3 . 1 1 27 27 GLY H H 27 8.048 8.048 7.814 0.234 19846
144 1 3 . 1 1 28 28 HIS HA H 28 5.594 5.594 4.963 0.631 19846
145 1 3 . 1 1 28 28 HIS H H 28 8.125 8.125 8.076 0.049 19846
146 1 3 . 1 1 29 29 CYS HA H 29 4.778 4.778 4.575 0.203 19846
147 1 3 . 1 1 29 29 CYS H H 29 8.373 8.373 8.859 -0.486 19846
148 1 4 . 1 1 2 2 VAL HA H 2 4.334 4.334 4.467 -0.133 19846
149 1 4 . 1 1 2 2 VAL H H 2 9.114 9.114 8.265 0.849 19846
150 1 4 . 1 1 3 3 PRO HA H 3 4.419 4.419 4.315 0.104 19846
151 1 4 . 1 1 4 4 GLN HA H 4 2.659 2.659 4.172 -1.513 19846
152 1 4 . 1 1 4 4 GLN H H 4 7.676 7.676 7.585 0.091 19846
153 1 4 . 1 1 5 5 TYR HA H 5 3.966 3.966 4.297 -0.331 19846
154 1 4 . 1 1 5 5 TYR H H 5 9.487 9.487 8.341 1.146 19846
155 1 4 . 1 1 6 6 GLY H H 6 8.520 8.520 7.814 0.706 19846
156 1 4 . 1 1 7 7 VAL HA H 7 3.917 3.917 3.121 0.796 19846
157 1 4 . 1 1 7 7 VAL H H 7 8.178 8.178 8.191 -0.013 19846
158 1 4 . 1 1 8 8 CYS HA H 8 4.954 4.954 4.750 0.204 19846
159 1 4 . 1 1 8 8 CYS H H 8 8.016 8.016 8.750 -0.734 19846
160 1 4 . 1 1 9 9 ASP HA H 9 4.779 4.779 4.658 0.121 19846
161 1 4 . 1 1 9 9 ASP H H 9 8.509 8.509 8.011 0.498 19846
162 1 4 . 1 1 10 10 GLY H H 10 8.160 8.160 8.262 -0.102 19846
163 1 4 . 1 1 11 11 ILE HA H 11 4.158 4.158 4.368 -0.210 19846
164 1 4 . 1 1 11 11 ILE H H 11 8.264 8.264 8.345 -0.081 19846
165 1 4 . 1 1 12 12 ILE HA H 12 4.068 4.068 4.214 -0.146 19846
166 1 4 . 1 1 12 12 ILE H H 12 8.195 8.195 7.974 0.221 19846
167 1 4 . 1 1 13 13 ASN HA H 13 4.807 4.807 4.840 -0.033 19846
168 1 4 . 1 1 13 13 ASN H H 13 8.524 8.524 8.196 0.328 19846
169 1 4 . 1 1 14 14 GLN HA H 14 4.478 4.478 4.364 0.114 19846
170 1 4 . 1 1 14 14 GLN H H 14 8.524 8.524 8.660 -0.136 19846
171 1 4 . 1 1 15 15 CYS HA H 15 4.857 4.857 4.730 0.127 19846
172 1 4 . 1 1 15 15 CYS H H 15 8.733 8.733 7.893 0.840 19846
173 1 4 . 1 1 16 16 CYS HA H 16 4.562 4.562 4.743 -0.181 19846
174 1 4 . 1 1 16 16 CYS H H 16 9.798 9.798 8.874 0.924 19846
175 1 4 . 1 1 17 17 ASP HA H 17 4.655 4.655 5.042 -0.387 19846
176 1 4 . 1 1 17 17 ASP H H 17 8.785 8.785 8.582 0.203 19846
177 1 4 . 1 1 18 18 PRO HA H 18 4.651 4.651 4.302 0.349 19846
178 1 4 . 1 1 19 19 TYR HA H 19 4.608 4.608 3.914 0.694 19846
179 1 4 . 1 1 19 19 TYR H H 19 8.512 8.512 7.237 1.275 19846
180 1 4 . 1 1 20 20 TYR HA H 20 4.857 4.857 4.829 0.028 19846
181 1 4 . 1 1 20 20 TYR H H 20 8.478 8.478 8.099 0.379 19846
182 1 4 . 1 1 21 21 CYS HA H 21 4.405 4.405 4.440 -0.035 19846
183 1 4 . 1 1 21 21 CYS H H 21 8.527 8.527 8.890 -0.363 19846
184 1 4 . 1 1 22 22 SER HA H 22 4.657 4.657 5.208 -0.551 19846
185 1 4 . 1 1 22 22 SER H H 22 8.559 8.559 8.709 -0.150 19846
186 1 4 . 1 1 23 23 PRO HA H 23 5.082 5.082 4.605 0.477 19846
187 1 4 . 1 1 24 24 PRO HA H 24 3.960 3.960 4.501 -0.541 19846
188 1 4 . 1 1 25 25 ILE HA H 25 3.737 3.737 4.157 -0.420 19846
189 1 4 . 1 1 25 25 ILE H H 25 7.609 7.609 8.303 -0.694 19846
190 1 4 . 1 1 26 26 TYR HA H 26 4.723 4.723 5.032 -0.309 19846
191 1 4 . 1 1 26 26 TYR H H 26 7.326 7.326 8.234 -0.908 19846
192 1 4 . 1 1 27 27 GLY H H 27 8.048 8.048 7.808 0.240 19846
193 1 4 . 1 1 28 28 HIS HA H 28 5.594 5.594 5.229 0.365 19846
194 1 4 . 1 1 28 28 HIS H H 28 8.125 8.125 8.099 0.026 19846
195 1 4 . 1 1 29 29 CYS HA H 29 4.778 4.778 4.413 0.364 19846
196 1 4 . 1 1 29 29 CYS H H 29 8.373 8.373 8.387 -0.014 19846
197 1 5 . 1 1 2 2 VAL HA H 2 4.334 4.334 4.490 -0.156 19846
198 1 5 . 1 1 2 2 VAL H H 2 9.114 9.114 8.264 0.850 19846
199 1 5 . 1 1 3 3 PRO HA H 3 4.419 4.419 4.347 0.072 19846
200 1 5 . 1 1 4 4 GLN HA H 4 2.659 2.659 3.974 -1.315 19846
201 1 5 . 1 1 4 4 GLN H H 4 7.676 7.676 7.600 0.076 19846
202 1 5 . 1 1 5 5 TYR HA H 5 3.966 3.966 4.378 -0.412 19846
203 1 5 . 1 1 5 5 TYR H H 5 9.487 9.487 8.741 0.746 19846
204 1 5 . 1 1 6 6 GLY H H 6 8.520 8.520 8.157 0.363 19846
205 1 5 . 1 1 7 7 VAL HA H 7 3.917 3.917 3.125 0.792 19846
206 1 5 . 1 1 7 7 VAL H H 7 8.178 8.178 7.254 0.924 19846
207 1 5 . 1 1 8 8 CYS HA H 8 4.954 4.954 4.725 0.229 19846
208 1 5 . 1 1 8 8 CYS H H 8 8.016 8.016 7.841 0.175 19846
209 1 5 . 1 1 9 9 ASP HA H 9 4.779 4.779 4.661 0.118 19846
210 1 5 . 1 1 9 9 ASP H H 9 8.509 8.509 7.939 0.570 19846
211 1 5 . 1 1 10 10 GLY H H 10 8.160 8.160 8.363 -0.203 19846
212 1 5 . 1 1 11 11 ILE HA H 11 4.158 4.158 4.393 -0.235 19846
213 1 5 . 1 1 11 11 ILE H H 11 8.264 8.264 8.461 -0.197 19846
214 1 5 . 1 1 12 12 ILE HA H 12 4.068 4.068 4.331 -0.263 19846
215 1 5 . 1 1 12 12 ILE H H 12 8.195 8.195 7.827 0.368 19846
216 1 5 . 1 1 13 13 ASN HA H 13 4.807 4.807 4.887 -0.080 19846
217 1 5 . 1 1 13 13 ASN H H 13 8.524 8.524 8.275 0.249 19846
218 1 5 . 1 1 14 14 GLN HA H 14 4.478 4.478 4.338 0.140 19846
219 1 5 . 1 1 14 14 GLN H H 14 8.524 8.524 8.723 -0.199 19846
220 1 5 . 1 1 15 15 CYS HA H 15 4.857 4.857 4.883 -0.026 19846
221 1 5 . 1 1 15 15 CYS H H 15 8.733 8.733 8.020 0.713 19846
222 1 5 . 1 1 16 16 CYS HA H 16 4.562 4.562 4.737 -0.175 19846
223 1 5 . 1 1 16 16 CYS H H 16 9.798 9.798 8.651 1.147 19846
224 1 5 . 1 1 17 17 ASP HA H 17 4.655 4.655 4.831 -0.176 19846
225 1 5 . 1 1 17 17 ASP H H 17 8.785 8.785 8.583 0.202 19846
226 1 5 . 1 1 18 18 PRO HA H 18 4.651 4.651 4.204 0.447 19846
227 1 5 . 1 1 19 19 TYR HA H 19 4.608 4.608 3.718 0.890 19846
228 1 5 . 1 1 19 19 TYR H H 19 8.512 8.512 7.007 1.505 19846
229 1 5 . 1 1 20 20 TYR HA H 20 4.857 4.857 4.756 0.101 19846
230 1 5 . 1 1 20 20 TYR H H 20 8.478 8.478 8.434 0.044 19846
231 1 5 . 1 1 21 21 CYS HA H 21 4.405 4.405 4.361 0.044 19846
232 1 5 . 1 1 21 21 CYS H H 21 8.527 8.527 8.480 0.047 19846
233 1 5 . 1 1 22 22 SER HA H 22 4.657 4.657 5.119 -0.462 19846
234 1 5 . 1 1 22 22 SER H H 22 8.559 8.559 8.721 -0.162 19846
235 1 5 . 1 1 23 23 PRO HA H 23 5.082 5.082 4.630 0.452 19846
236 1 5 . 1 1 24 24 PRO HA H 24 3.960 3.960 4.491 -0.531 19846
237 1 5 . 1 1 25 25 ILE HA H 25 3.737 3.737 4.149 -0.412 19846
238 1 5 . 1 1 25 25 ILE H H 25 7.609 7.609 8.310 -0.701 19846
239 1 5 . 1 1 26 26 TYR HA H 26 4.723 4.723 4.989 -0.266 19846
240 1 5 . 1 1 26 26 TYR H H 26 7.326 7.326 8.162 -0.836 19846
241 1 5 . 1 1 27 27 GLY H H 27 8.048 8.048 7.831 0.217 19846
242 1 5 . 1 1 28 28 HIS HA H 28 5.594 5.594 4.958 0.636 19846
243 1 5 . 1 1 28 28 HIS H H 28 8.125 8.125 8.105 0.020 19846
244 1 5 . 1 1 29 29 CYS HA H 29 4.778 4.778 4.604 0.174 19846
245 1 5 . 1 1 29 29 CYS H H 29 8.373 8.373 8.847 -0.474 19846
246 1 6 . 1 1 2 2 VAL HA H 2 4.334 4.334 4.436 -0.102 19846
247 1 6 . 1 1 2 2 VAL H H 2 9.114 9.114 8.213 0.901 19846
248 1 6 . 1 1 3 3 PRO HA H 3 4.419 4.419 4.296 0.123 19846
249 1 6 . 1 1 4 4 GLN HA H 4 2.659 2.659 4.056 -1.397 19846
250 1 6 . 1 1 4 4 GLN H H 4 7.676 7.676 7.467 0.209 19846
251 1 6 . 1 1 5 5 TYR HA H 5 3.966 3.966 3.470 0.496 19846
252 1 6 . 1 1 5 5 TYR H H 5 9.487 9.487 8.355 1.132 19846
253 1 6 . 1 1 6 6 GLY H H 6 8.520 8.520 7.989 0.531 19846
254 1 6 . 1 1 7 7 VAL HA H 7 3.917 3.917 4.122 -0.205 19846
255 1 6 . 1 1 7 7 VAL H H 7 8.178 8.178 7.024 1.154 19846
256 1 6 . 1 1 8 8 CYS HA H 8 4.954 4.954 4.919 0.035 19846
257 1 6 . 1 1 8 8 CYS H H 8 8.016 8.016 8.260 -0.244 19846
258 1 6 . 1 1 9 9 ASP HA H 9 4.779 4.779 5.265 -0.486 19846
259 1 6 . 1 1 9 9 ASP H H 9 8.509 8.509 8.230 0.279 19846
260 1 6 . 1 1 10 10 GLY H H 10 8.160 8.160 8.439 -0.279 19846
261 1 6 . 1 1 11 11 ILE HA H 11 4.158 4.158 4.462 -0.304 19846
262 1 6 . 1 1 11 11 ILE H H 11 8.264 8.264 8.318 -0.054 19846
263 1 6 . 1 1 12 12 ILE HA H 12 4.068 4.068 4.245 -0.177 19846
264 1 6 . 1 1 12 12 ILE H H 12 8.195 8.195 8.351 -0.156 19846
265 1 6 . 1 1 13 13 ASN HA H 13 4.807 4.807 4.879 -0.072 19846
266 1 6 . 1 1 13 13 ASN H H 13 8.524 8.524 7.762 0.762 19846
267 1 6 . 1 1 14 14 GLN HA H 14 4.478 4.478 4.384 0.094 19846
268 1 6 . 1 1 14 14 GLN H H 14 8.524 8.524 8.832 -0.308 19846
269 1 6 . 1 1 15 15 CYS HA H 15 4.857 4.857 4.762 0.095 19846
270 1 6 . 1 1 15 15 CYS H H 15 8.733 8.733 7.720 1.013 19846
271 1 6 . 1 1 16 16 CYS HA H 16 4.562 4.562 4.784 -0.222 19846
272 1 6 . 1 1 16 16 CYS H H 16 9.798 9.798 8.852 0.946 19846
273 1 6 . 1 1 17 17 ASP HA H 17 4.655 4.655 4.898 -0.243 19846
274 1 6 . 1 1 17 17 ASP H H 17 8.785 8.785 8.761 0.024 19846
275 1 6 . 1 1 18 18 PRO HA H 18 4.651 4.651 4.127 0.524 19846
276 1 6 . 1 1 19 19 TYR HA H 19 4.608 4.608 3.874 0.734 19846
277 1 6 . 1 1 19 19 TYR H H 19 8.512 8.512 7.203 1.309 19846
278 1 6 . 1 1 20 20 TYR HA H 20 4.857 4.857 4.948 -0.091 19846
279 1 6 . 1 1 20 20 TYR H H 20 8.478 8.478 8.621 -0.143 19846
280 1 6 . 1 1 21 21 CYS HA H 21 4.405 4.405 4.397 0.008 19846
281 1 6 . 1 1 21 21 CYS H H 21 8.527 8.527 8.370 0.157 19846
282 1 6 . 1 1 22 22 SER HA H 22 4.657 4.657 5.227 -0.570 19846
283 1 6 . 1 1 22 22 SER H H 22 8.559 8.559 9.026 -0.467 19846
284 1 6 . 1 1 23 23 PRO HA H 23 5.082 5.082 4.675 0.407 19846
285 1 6 . 1 1 24 24 PRO HA H 24 3.960 3.960 4.439 -0.479 19846
286 1 6 . 1 1 25 25 ILE HA H 25 3.737 3.737 4.024 -0.287 19846
287 1 6 . 1 1 25 25 ILE H H 25 7.609 7.609 8.124 -0.515 19846
288 1 6 . 1 1 26 26 TYR HA H 26 4.723 4.723 5.147 -0.424 19846
289 1 6 . 1 1 26 26 TYR H H 26 7.326 7.326 7.855 -0.529 19846
290 1 6 . 1 1 27 27 GLY H H 27 8.048 8.048 7.904 0.144 19846
291 1 6 . 1 1 28 28 HIS HA H 28 5.594 5.594 5.016 0.578 19846
292 1 6 . 1 1 28 28 HIS H H 28 8.125 8.125 8.072 0.053 19846
293 1 6 . 1 1 29 29 CYS HA H 29 4.778 4.778 4.650 0.128 19846
294 1 6 . 1 1 29 29 CYS H H 29 8.373 8.373 8.758 -0.385 19846
295 1 7 . 1 1 2 2 VAL HA H 2 4.334 4.334 4.407 -0.072 19846
296 1 7 . 1 1 2 2 VAL H H 2 9.114 9.114 8.353 0.761 19846
297 1 7 . 1 1 3 3 PRO HA H 3 4.419 4.419 4.381 0.038 19846
298 1 7 . 1 1 4 4 GLN HA H 4 2.659 2.659 3.960 -1.301 19846
299 1 7 . 1 1 4 4 GLN H H 4 7.676 7.676 7.621 0.055 19846
300 1 7 . 1 1 5 5 TYR HA H 5 3.966 3.966 4.332 -0.366 19846
301 1 7 . 1 1 5 5 TYR H H 5 9.487 9.487 8.750 0.737 19846
302 1 7 . 1 1 6 6 GLY H H 6 8.520 8.520 8.167 0.353 19846
303 1 7 . 1 1 7 7 VAL HA H 7 3.917 3.917 3.162 0.755 19846
304 1 7 . 1 1 7 7 VAL H H 7 8.178 8.178 7.456 0.722 19846
305 1 7 . 1 1 8 8 CYS HA H 8 4.954 4.954 4.669 0.285 19846
306 1 7 . 1 1 8 8 CYS H H 8 8.016 8.016 7.744 0.272 19846
307 1 7 . 1 1 9 9 ASP HA H 9 4.779 4.779 4.663 0.116 19846
308 1 7 . 1 1 9 9 ASP H H 9 8.509 8.509 8.089 0.420 19846
309 1 7 . 1 1 10 10 GLY H H 10 8.160 8.160 8.338 -0.178 19846
310 1 7 . 1 1 11 11 ILE HA H 11 4.158 4.158 4.379 -0.221 19846
311 1 7 . 1 1 11 11 ILE H H 11 8.264 8.264 8.340 -0.076 19846
312 1 7 . 1 1 12 12 ILE HA H 12 4.068 4.068 4.221 -0.153 19846
313 1 7 . 1 1 12 12 ILE H H 12 8.195 8.195 7.971 0.224 19846
314 1 7 . 1 1 13 13 ASN HA H 13 4.807 4.807 4.828 -0.021 19846
315 1 7 . 1 1 13 13 ASN H H 13 8.524 8.524 8.131 0.393 19846
316 1 7 . 1 1 14 14 GLN HA H 14 4.478 4.478 4.425 0.053 19846
317 1 7 . 1 1 14 14 GLN H H 14 8.524 8.524 8.759 -0.235 19846
318 1 7 . 1 1 15 15 CYS HA H 15 4.857 4.857 4.851 0.006 19846
319 1 7 . 1 1 15 15 CYS H H 15 8.733 8.733 7.762 0.971 19846
320 1 7 . 1 1 16 16 CYS HA H 16 4.562 4.562 4.748 -0.186 19846
321 1 7 . 1 1 16 16 CYS H H 16 9.798 9.798 8.761 1.037 19846
322 1 7 . 1 1 17 17 ASP HA H 17 4.655 4.655 4.811 -0.156 19846
323 1 7 . 1 1 17 17 ASP H H 17 8.785 8.785 8.542 0.243 19846
324 1 7 . 1 1 18 18 PRO HA H 18 4.651 4.651 4.122 0.529 19846
325 1 7 . 1 1 19 19 TYR HA H 19 4.608 4.608 3.916 0.692 19846
326 1 7 . 1 1 19 19 TYR H H 19 8.512 8.512 7.015 1.497 19846
327 1 7 . 1 1 20 20 TYR HA H 20 4.857 4.857 4.772 0.085 19846
328 1 7 . 1 1 20 20 TYR H H 20 8.478 8.478 8.443 0.035 19846
329 1 7 . 1 1 21 21 CYS HA H 21 4.405 4.405 4.354 0.051 19846
330 1 7 . 1 1 21 21 CYS H H 21 8.527 8.527 8.304 0.223 19846
331 1 7 . 1 1 22 22 SER HA H 22 4.657 4.657 5.105 -0.448 19846
332 1 7 . 1 1 22 22 SER H H 22 8.559 8.559 8.795 -0.236 19846
333 1 7 . 1 1 23 23 PRO HA H 23 5.082 5.082 4.632 0.450 19846
334 1 7 . 1 1 24 24 PRO HA H 24 3.960 3.960 4.492 -0.532 19846
335 1 7 . 1 1 25 25 ILE HA H 25 3.737 3.737 4.155 -0.418 19846
336 1 7 . 1 1 25 25 ILE H H 25 7.609 7.609 8.287 -0.678 19846
337 1 7 . 1 1 26 26 TYR HA H 26 4.723 4.723 4.896 -0.173 19846
338 1 7 . 1 1 26 26 TYR H H 26 7.326 7.326 8.172 -0.846 19846
339 1 7 . 1 1 27 27 GLY H H 27 8.048 8.048 7.821 0.227 19846
340 1 7 . 1 1 28 28 HIS HA H 28 5.594 5.594 4.964 0.630 19846
341 1 7 . 1 1 28 28 HIS H H 28 8.125 8.125 8.091 0.034 19846
342 1 7 . 1 1 29 29 CYS HA H 29 4.778 4.778 4.619 0.159 19846
343 1 7 . 1 1 29 29 CYS H H 29 8.373 8.373 8.844 -0.471 19846
344 1 8 . 1 1 2 2 VAL HA H 2 4.334 4.334 4.532 -0.198 19846
345 1 8 . 1 1 2 2 VAL H H 2 9.114 9.114 8.085 1.029 19846
346 1 8 . 1 1 3 3 PRO HA H 3 4.419 4.419 4.375 0.044 19846
347 1 8 . 1 1 4 4 GLN HA H 4 2.659 2.659 3.960 -1.301 19846
348 1 8 . 1 1 4 4 GLN H H 4 7.676 7.676 7.623 0.053 19846
349 1 8 . 1 1 5 5 TYR HA H 5 3.966 3.966 4.335 -0.369 19846
350 1 8 . 1 1 5 5 TYR H H 5 9.487 9.487 8.751 0.736 19846
351 1 8 . 1 1 6 6 GLY H H 6 8.520 8.520 8.155 0.365 19846
352 1 8 . 1 1 7 7 VAL HA H 7 3.917 3.917 3.152 0.765 19846
353 1 8 . 1 1 7 7 VAL H H 7 8.178 8.178 7.414 0.764 19846
354 1 8 . 1 1 8 8 CYS HA H 8 4.954 4.954 4.725 0.229 19846
355 1 8 . 1 1 8 8 CYS H H 8 8.016 8.016 7.838 0.178 19846
356 1 8 . 1 1 9 9 ASP HA H 9 4.779 4.779 4.675 0.104 19846
357 1 8 . 1 1 9 9 ASP H H 9 8.509 8.509 7.948 0.561 19846
358 1 8 . 1 1 10 10 GLY H H 10 8.160 8.160 8.288 -0.128 19846
359 1 8 . 1 1 11 11 ILE HA H 11 4.158 4.158 4.416 -0.258 19846
360 1 8 . 1 1 11 11 ILE H H 11 8.264 8.264 8.386 -0.122 19846
361 1 8 . 1 1 12 12 ILE HA H 12 4.068 4.068 4.302 -0.234 19846
362 1 8 . 1 1 12 12 ILE H H 12 8.195 8.195 8.018 0.177 19846
363 1 8 . 1 1 13 13 ASN HA H 13 4.807 4.807 4.903 -0.096 19846
364 1 8 . 1 1 13 13 ASN H H 13 8.524 8.524 8.231 0.293 19846
365 1 8 . 1 1 14 14 GLN HA H 14 4.478 4.478 4.288 0.190 19846
366 1 8 . 1 1 14 14 GLN H H 14 8.524 8.524 8.462 0.062 19846
367 1 8 . 1 1 15 15 CYS HA H 15 4.857 4.857 4.553 0.304 19846
368 1 8 . 1 1 15 15 CYS H H 15 8.733 8.733 8.290 0.443 19846
369 1 8 . 1 1 16 16 CYS HA H 16 4.562 4.562 4.649 -0.087 19846
370 1 8 . 1 1 16 16 CYS H H 16 9.798 9.798 8.548 1.250 19846
371 1 8 . 1 1 17 17 ASP HA H 17 4.655 4.655 4.843 -0.188 19846
372 1 8 . 1 1 17 17 ASP H H 17 8.785 8.785 8.595 0.190 19846
373 1 8 . 1 1 18 18 PRO HA H 18 4.651 4.651 4.224 0.427 19846
374 1 8 . 1 1 19 19 TYR HA H 19 4.608 4.608 3.746 0.862 19846
375 1 8 . 1 1 19 19 TYR H H 19 8.512 8.512 7.092 1.420 19846
376 1 8 . 1 1 20 20 TYR HA H 20 4.857 4.857 4.726 0.131 19846
377 1 8 . 1 1 20 20 TYR H H 20 8.478 8.478 8.470 0.008 19846
378 1 8 . 1 1 21 21 CYS HA H 21 4.405 4.405 4.355 0.050 19846
379 1 8 . 1 1 21 21 CYS H H 21 8.527 8.527 8.403 0.124 19846
380 1 8 . 1 1 22 22 SER HA H 22 4.657 4.657 5.118 -0.461 19846
381 1 8 . 1 1 22 22 SER H H 22 8.559 8.559 8.759 -0.200 19846
382 1 8 . 1 1 23 23 PRO HA H 23 5.082 5.082 4.630 0.452 19846
383 1 8 . 1 1 24 24 PRO HA H 24 3.960 3.960 4.491 -0.531 19846
384 1 8 . 1 1 25 25 ILE HA H 25 3.737 3.737 4.144 -0.407 19846
385 1 8 . 1 1 25 25 ILE H H 25 7.609 7.609 8.297 -0.688 19846
386 1 8 . 1 1 26 26 TYR HA H 26 4.723 4.723 4.989 -0.266 19846
387 1 8 . 1 1 26 26 TYR H H 26 7.326 7.326 8.154 -0.828 19846
388 1 8 . 1 1 27 27 GLY H H 27 8.048 8.048 7.823 0.225 19846
389 1 8 . 1 1 28 28 HIS HA H 28 5.594 5.594 4.963 0.631 19846
390 1 8 . 1 1 28 28 HIS H H 28 8.125 8.125 8.091 0.034 19846
391 1 8 . 1 1 29 29 CYS HA H 29 4.778 4.778 4.564 0.214 19846
392 1 8 . 1 1 29 29 CYS H H 29 8.373 8.373 8.858 -0.485 19846
393 1 9 . 1 1 2 2 VAL HA H 2 4.334 4.334 4.505 -0.171 19846
394 1 9 . 1 1 2 2 VAL H H 2 9.114 9.114 8.175 0.939 19846
395 1 9 . 1 1 3 3 PRO HA H 3 4.419 4.419 4.339 0.080 19846
396 1 9 . 1 1 4 4 GLN HA H 4 2.659 2.659 4.118 -1.459 19846
397 1 9 . 1 1 4 4 GLN H H 4 7.676 7.676 7.589 0.087 19846
398 1 9 . 1 1 5 5 TYR HA H 5 3.966 3.966 4.370 -0.404 19846
399 1 9 . 1 1 5 5 TYR H H 5 9.487 9.487 8.721 0.766 19846
400 1 9 . 1 1 6 6 GLY H H 6 8.520 8.520 8.159 0.361 19846
401 1 9 . 1 1 7 7 VAL HA H 7 3.917 3.917 3.142 0.775 19846
402 1 9 . 1 1 7 7 VAL H H 7 8.178 8.178 7.307 0.871 19846
403 1 9 . 1 1 8 8 CYS HA H 8 4.954 4.954 4.746 0.208 19846
404 1 9 . 1 1 8 8 CYS H H 8 8.016 8.016 7.908 0.108 19846
405 1 9 . 1 1 9 9 ASP HA H 9 4.779 4.779 4.680 0.099 19846
406 1 9 . 1 1 9 9 ASP H H 9 8.509 8.509 7.945 0.564 19846
407 1 9 . 1 1 10 10 GLY H H 10 8.160 8.160 8.261 -0.101 19846
408 1 9 . 1 1 11 11 ILE HA H 11 4.158 4.158 4.520 -0.362 19846
409 1 9 . 1 1 11 11 ILE H H 11 8.264 8.264 8.319 -0.055 19846
410 1 9 . 1 1 12 12 ILE HA H 12 4.068 4.068 4.132 -0.064 19846
411 1 9 . 1 1 12 12 ILE H H 12 8.195 8.195 8.264 -0.069 19846
412 1 9 . 1 1 13 13 ASN HA H 13 4.807 4.807 4.753 0.054 19846
413 1 9 . 1 1 13 13 ASN H H 13 8.524 8.524 7.847 0.677 19846
414 1 9 . 1 1 14 14 GLN HA H 14 4.478 4.478 4.392 0.086 19846
415 1 9 . 1 1 14 14 GLN H H 14 8.524 8.524 8.604 -0.080 19846
416 1 9 . 1 1 15 15 CYS HA H 15 4.857 4.857 4.756 0.101 19846
417 1 9 . 1 1 15 15 CYS H H 15 8.733 8.733 8.125 0.608 19846
418 1 9 . 1 1 16 16 CYS HA H 16 4.562 4.562 4.649 -0.087 19846
419 1 9 . 1 1 16 16 CYS H H 16 9.798 9.798 8.652 1.146 19846
420 1 9 . 1 1 17 17 ASP HA H 17 4.655 4.655 4.811 -0.156 19846
421 1 9 . 1 1 17 17 ASP H H 17 8.785 8.785 8.546 0.239 19846
422 1 9 . 1 1 18 18 PRO HA H 18 4.651 4.651 4.112 0.539 19846
423 1 9 . 1 1 19 19 TYR HA H 19 4.608 4.608 3.898 0.710 19846
424 1 9 . 1 1 19 19 TYR H H 19 8.512 8.512 6.955 1.557 19846
425 1 9 . 1 1 20 20 TYR HA H 20 4.857 4.857 4.765 0.092 19846
426 1 9 . 1 1 20 20 TYR H H 20 8.478 8.478 8.441 0.037 19846
427 1 9 . 1 1 21 21 CYS HA H 21 4.405 4.405 4.348 0.057 19846
428 1 9 . 1 1 21 21 CYS H H 21 8.527 8.527 8.527 0.000 19846
429 1 9 . 1 1 22 22 SER HA H 22 4.657 4.657 5.109 -0.452 19846
430 1 9 . 1 1 22 22 SER H H 22 8.559 8.559 8.721 -0.162 19846
431 1 9 . 1 1 23 23 PRO HA H 23 5.082 5.082 4.629 0.453 19846
432 1 9 . 1 1 24 24 PRO HA H 24 3.960 3.960 4.490 -0.530 19846
433 1 9 . 1 1 25 25 ILE HA H 25 3.737 3.737 4.219 -0.482 19846
434 1 9 . 1 1 25 25 ILE H H 25 7.609 7.609 8.241 -0.632 19846
435 1 9 . 1 1 26 26 TYR HA H 26 4.723 4.723 5.003 -0.280 19846
436 1 9 . 1 1 26 26 TYR H H 26 7.326 7.326 8.169 -0.843 19846
437 1 9 . 1 1 27 27 GLY H H 27 8.048 8.048 7.820 0.228 19846
438 1 9 . 1 1 28 28 HIS HA H 28 5.594 5.594 4.954 0.640 19846
439 1 9 . 1 1 28 28 HIS H H 28 8.125 8.125 8.096 0.029 19846
440 1 9 . 1 1 29 29 CYS HA H 29 4.778 4.778 4.598 0.180 19846
441 1 9 . 1 1 29 29 CYS H H 29 8.373 8.373 8.848 -0.475 19846
442 1 10 . 1 1 2 2 VAL HA H 2 4.334 4.334 4.321 0.013 19846
443 1 10 . 1 1 2 2 VAL H H 2 9.114 9.114 8.132 0.982 19846
444 1 10 . 1 1 3 3 PRO HA H 3 4.419 4.419 4.384 0.035 19846
445 1 10 . 1 1 4 4 GLN HA H 4 2.659 2.659 4.005 -1.346 19846
446 1 10 . 1 1 4 4 GLN H H 4 7.676 7.676 7.526 0.150 19846
447 1 10 . 1 1 5 5 TYR HA H 5 3.966 3.966 3.883 0.083 19846
448 1 10 . 1 1 5 5 TYR H H 5 9.487 9.487 8.297 1.190 19846
449 1 10 . 1 1 6 6 GLY H H 6 8.520 8.520 7.748 0.772 19846
450 1 10 . 1 1 7 7 VAL HA H 7 3.917 3.917 3.885 0.032 19846
451 1 10 . 1 1 7 7 VAL H H 7 8.178 8.178 8.448 -0.270 19846
452 1 10 . 1 1 8 8 CYS HA H 8 4.954 4.954 4.818 0.136 19846
453 1 10 . 1 1 8 8 CYS H H 8 8.016 8.016 8.602 -0.586 19846
454 1 10 . 1 1 9 9 ASP HA H 9 4.779 4.779 4.765 0.014 19846
455 1 10 . 1 1 9 9 ASP H H 9 8.509 8.509 8.089 0.420 19846
456 1 10 . 1 1 10 10 GLY H H 10 8.160 8.160 8.021 0.139 19846
457 1 10 . 1 1 11 11 ILE HA H 11 4.158 4.158 4.345 -0.187 19846
458 1 10 . 1 1 11 11 ILE H H 11 8.264 8.264 8.333 -0.069 19846
459 1 10 . 1 1 12 12 ILE HA H 12 4.068 4.068 4.240 -0.172 19846
460 1 10 . 1 1 12 12 ILE H H 12 8.195 8.195 7.968 0.227 19846
461 1 10 . 1 1 13 13 ASN HA H 13 4.807 4.807 4.888 -0.080 19846
462 1 10 . 1 1 13 13 ASN H H 13 8.524 8.524 8.091 0.433 19846
463 1 10 . 1 1 14 14 GLN HA H 14 4.478 4.478 4.367 0.111 19846
464 1 10 . 1 1 14 14 GLN H H 14 8.524 8.524 8.854 -0.330 19846
465 1 10 . 1 1 15 15 CYS HA H 15 4.857 4.857 4.849 0.008 19846
466 1 10 . 1 1 15 15 CYS H H 15 8.733 8.733 7.825 0.908 19846
467 1 10 . 1 1 16 16 CYS HA H 16 4.562 4.562 4.761 -0.199 19846
468 1 10 . 1 1 16 16 CYS H H 16 9.798 9.798 8.655 1.143 19846
469 1 10 . 1 1 17 17 ASP HA H 17 4.655 4.655 4.871 -0.216 19846
470 1 10 . 1 1 17 17 ASP H H 17 8.785 8.785 8.607 0.178 19846
471 1 10 . 1 1 18 18 PRO HA H 18 4.651 4.651 4.186 0.465 19846
472 1 10 . 1 1 19 19 TYR HA H 19 4.608 4.608 3.922 0.686 19846
473 1 10 . 1 1 19 19 TYR H H 19 8.512 8.512 7.137 1.375 19846
474 1 10 . 1 1 20 20 TYR HA H 20 4.857 4.857 4.758 0.099 19846
475 1 10 . 1 1 20 20 TYR H H 20 8.478 8.478 7.893 0.585 19846
476 1 10 . 1 1 21 21 CYS HA H 21 4.405 4.405 4.342 0.063 19846
477 1 10 . 1 1 21 21 CYS H H 21 8.527 8.527 8.349 0.178 19846
478 1 10 . 1 1 22 22 SER HA H 22 4.657 4.657 4.891 -0.234 19846
479 1 10 . 1 1 22 22 SER H H 22 8.559 8.559 9.023 -0.464 19846
480 1 10 . 1 1 23 23 PRO HA H 23 5.082 5.082 4.711 0.371 19846
481 1 10 . 1 1 24 24 PRO HA H 24 3.960 3.960 4.398 -0.438 19846
482 1 10 . 1 1 25 25 ILE HA H 25 3.737 3.737 4.361 -0.624 19846
483 1 10 . 1 1 25 25 ILE H H 25 7.609 7.609 7.964 -0.355 19846
484 1 10 . 1 1 26 26 TYR HA H 26 4.723 4.723 5.092 -0.369 19846
485 1 10 . 1 1 26 26 TYR H H 26 7.326 7.326 8.260 -0.934 19846
486 1 10 . 1 1 27 27 GLY H H 27 8.048 8.048 7.704 0.344 19846
487 1 10 . 1 1 28 28 HIS HA H 28 5.594 5.594 5.047 0.547 19846
488 1 10 . 1 1 28 28 HIS H H 28 8.125 8.125 7.960 0.165 19846
489 1 10 . 1 1 29 29 CYS HA H 29 4.778 4.778 4.574 0.204 19846
490 1 10 . 1 1 29 29 CYS H H 29 8.373 8.373 8.509 -0.136 19846
491 1 11 . 1 1 2 2 VAL HA H 2 4.334 4.334 4.436 -0.102 19846
492 1 11 . 1 1 2 2 VAL H H 2 9.114 9.114 8.155 0.959 19846
493 1 11 . 1 1 3 3 PRO HA H 3 4.419 4.419 4.352 0.067 19846
494 1 11 . 1 1 4 4 GLN HA H 4 2.659 2.659 4.139 -1.480 19846
495 1 11 . 1 1 4 4 GLN H H 4 7.676 7.676 7.507 0.169 19846
496 1 11 . 1 1 5 5 TYR HA H 5 3.966 3.966 4.291 -0.325 19846
497 1 11 . 1 1 5 5 TYR H H 5 9.487 9.487 8.481 1.006 19846
498 1 11 . 1 1 6 6 GLY H H 6 8.520 8.520 8.127 0.393 19846
499 1 11 . 1 1 7 7 VAL HA H 7 3.917 3.917 3.472 0.445 19846
500 1 11 . 1 1 7 7 VAL H H 7 8.178 8.178 7.624 0.554 19846
501 1 11 . 1 1 8 8 CYS HA H 8 4.954 4.954 4.763 0.192 19846
502 1 11 . 1 1 8 8 CYS H H 8 8.016 8.016 7.841 0.175 19846
503 1 11 . 1 1 9 9 ASP HA H 9 4.779 4.779 4.756 0.023 19846
504 1 11 . 1 1 9 9 ASP H H 9 8.509 8.509 8.024 0.485 19846
505 1 11 . 1 1 10 10 GLY H H 10 8.160 8.160 8.459 -0.299 19846
506 1 11 . 1 1 11 11 ILE HA H 11 4.158 4.158 4.305 -0.147 19846
507 1 11 . 1 1 11 11 ILE H H 11 8.264 8.264 8.340 -0.076 19846
508 1 11 . 1 1 12 12 ILE HA H 12 4.068 4.068 4.265 -0.197 19846
509 1 11 . 1 1 12 12 ILE H H 12 8.195 8.195 7.957 0.238 19846
510 1 11 . 1 1 13 13 ASN HA H 13 4.807 4.807 4.879 -0.072 19846
511 1 11 . 1 1 13 13 ASN H H 13 8.524 8.524 8.087 0.437 19846
512 1 11 . 1 1 14 14 GLN HA H 14 4.478 4.478 4.350 0.128 19846
513 1 11 . 1 1 14 14 GLN H H 14 8.524 8.524 8.857 -0.333 19846
514 1 11 . 1 1 15 15 CYS HA H 15 4.857 4.857 4.753 0.104 19846
515 1 11 . 1 1 15 15 CYS H H 15 8.733 8.733 7.771 0.962 19846
516 1 11 . 1 1 16 16 CYS HA H 16 4.562 4.562 4.777 -0.215 19846
517 1 11 . 1 1 16 16 CYS H H 16 9.798 9.798 8.832 0.966 19846
518 1 11 . 1 1 17 17 ASP HA H 17 4.655 4.655 4.982 -0.327 19846
519 1 11 . 1 1 17 17 ASP H H 17 8.785 8.785 8.710 0.075 19846
520 1 11 . 1 1 18 18 PRO HA H 18 4.651 4.651 4.142 0.509 19846
521 1 11 . 1 1 19 19 TYR HA H 19 4.608 4.608 3.947 0.661 19846
522 1 11 . 1 1 19 19 TYR H H 19 8.512 8.512 7.099 1.413 19846
523 1 11 . 1 1 20 20 TYR HA H 20 4.857 4.857 4.816 0.041 19846
524 1 11 . 1 1 20 20 TYR H H 20 8.478 8.478 8.581 -0.103 19846
525 1 11 . 1 1 21 21 CYS HA H 21 4.405 4.405 4.303 0.102 19846
526 1 11 . 1 1 21 21 CYS H H 21 8.527 8.527 8.502 0.025 19846
527 1 11 . 1 1 22 22 SER HA H 22 4.657 4.657 5.084 -0.427 19846
528 1 11 . 1 1 22 22 SER H H 22 8.559 8.559 8.933 -0.374 19846
529 1 11 . 1 1 23 23 PRO HA H 23 5.082 5.082 4.636 0.446 19846
530 1 11 . 1 1 24 24 PRO HA H 24 3.960 3.960 4.496 -0.536 19846
531 1 11 . 1 1 25 25 ILE HA H 25 3.737 3.737 4.201 -0.464 19846
532 1 11 . 1 1 25 25 ILE H H 25 7.609 7.609 8.308 -0.699 19846
533 1 11 . 1 1 26 26 TYR HA H 26 4.723 4.723 4.942 -0.219 19846
534 1 11 . 1 1 26 26 TYR H H 26 7.326 7.326 8.325 -0.999 19846
535 1 11 . 1 1 27 27 GLY H H 27 8.048 8.048 7.820 0.228 19846
536 1 11 . 1 1 28 28 HIS HA H 28 5.594 5.594 4.854 0.740 19846
537 1 11 . 1 1 28 28 HIS H H 28 8.125 8.125 8.100 0.025 19846
538 1 11 . 1 1 29 29 CYS HA H 29 4.778 4.778 4.768 0.010 19846
539 1 11 . 1 1 29 29 CYS H H 29 8.373 8.373 8.811 -0.438 19846
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 19846
2 1 1 "Average Difference" HA 31 0.443 0.068 0.445 19846
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19846
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19846
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19846
6 1 1 "Average Difference" HN 24 0.576 -0.208 0.548 19846
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19846
8 1 2 "Average Difference" HA 31 0.438 0.097 0.434 19846
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19846
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19846
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19846
12 1 2 "Average Difference" HN 24 0.593 -0.203 0.569 19846
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19846
14 1 3 "Average Difference" HA 31 0.419 0.044 0.423 19846
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19846
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19846
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19846
18 1 3 "Average Difference" HN 24 0.608 -0.229 0.575 19846
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19846
20 1 4 "Average Difference" HA 31 0.443 0.075 0.444 19846
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19846
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19846
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19846
24 1 4 "Average Difference" HN 24 0.592 -0.189 0.573 19846
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19846
26 1 5 "Average Difference" HA 31 0.436 0.055 0.439 19846
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19846
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19846
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19846
30 1 5 "Average Difference" HN 24 0.597 -0.227 0.565 19846
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19846
32 1 6 "Average Difference" HA 31 0.418 0.087 0.416 19846
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19846
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19846
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19846
36 1 6 "Average Difference" HN 24 0.622 -0.231 0.590 19846
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19846
38 1 7 "Average Difference" HA 31 0.414 0.044 0.419 19846
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19846
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19846
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19846
42 1 7 "Average Difference" HN 24 0.584 -0.228 0.549 19846
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19846
44 1 8 "Average Difference" HA 31 0.432 0.041 0.438 19846
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19846
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19846
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19846
48 1 8 "Average Difference" HN 24 0.582 -0.227 0.547 19846
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19846
50 1 9 "Average Difference" HA 31 0.444 0.055 0.447 19846
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19846
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19846
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19846
54 1 9 "Average Difference" HN 24 0.604 -0.242 0.565 19846
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19846
56 1 10 "Average Difference" HA 31 0.379 0.061 0.380 19846
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19846
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19846
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19846
60 1 10 "Average Difference" HN 24 0.638 -0.252 0.599 19846
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19846
62 1 11 "Average Difference" HA 31 0.418 0.054 0.422 19846
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19846
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 19846
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 19846
66 1 11 "Average Difference" HN 24 0.608 -0.200 0.587 19846
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 19846
_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 VAL HA H 2 4.334 4.334 4.444 -0.110 19846
2 1 . 1 1 2 2 VAL H H 2 9.114 9.114 8.205 0.909 19846
3 1 . 1 1 3 3 PRO HA H 3 4.419 4.419 4.347 0.072 19846
4 1 . 1 1 4 4 GLN HA H 4 2.659 2.659 4.066 -1.407 19846
5 1 . 1 1 4 4 GLN H H 4 7.676 7.676 7.568 0.108 19846
6 1 . 1 1 5 5 TYR HA H 5 3.966 3.966 4.218 -0.252 19846
7 1 . 1 1 5 5 TYR H H 5 9.487 9.487 8.506 0.981 19846
8 1 . 1 1 6 6 GLY H H 6 8.520 8.520 7.995 0.525 19846
9 1 . 1 1 7 7 VAL HA H 7 3.917 3.917 3.353 0.564 19846
10 1 . 1 1 7 7 VAL H H 7 8.178 8.178 7.676 0.502 19846
11 1 . 1 1 8 8 CYS HA H 8 4.954 4.954 4.757 0.197 19846
12 1 . 1 1 8 8 CYS H H 8 8.016 8.016 8.161 -0.145 19846
13 1 . 1 1 9 9 ASP HA H 9 4.779 4.779 4.735 0.044 19846
14 1 . 1 1 9 9 ASP H H 9 8.509 8.509 8.047 0.462 19846
15 1 . 1 1 10 10 GLY H H 10 8.160 8.160 8.297 -0.137 19846
16 1 . 1 1 11 11 ILE HA H 11 4.158 4.158 4.407 -0.249 19846
17 1 . 1 1 11 11 ILE H H 11 8.264 8.264 8.332 -0.068 19846
18 1 . 1 1 12 12 ILE HA H 12 4.068 4.068 4.223 -0.155 19846
19 1 . 1 1 12 12 ILE H H 12 8.195 8.195 8.038 0.157 19846
20 1 . 1 1 13 13 ASN HA H 13 4.807 4.807 4.844 -0.037 19846
21 1 . 1 1 13 13 ASN H H 13 8.524 8.524 8.054 0.470 19846
22 1 . 1 1 14 14 GLN HA H 14 4.478 4.478 4.365 0.113 19846
23 1 . 1 1 14 14 GLN H H 14 8.524 8.524 8.716 -0.192 19846
24 1 . 1 1 15 15 CYS HA H 15 4.857 4.857 4.769 0.088 19846
25 1 . 1 1 15 15 CYS H H 15 8.733 8.733 7.943 0.790 19846
26 1 . 1 1 16 16 CYS HA H 16 4.562 4.562 4.743 -0.181 19846
27 1 . 1 1 16 16 CYS H H 16 9.798 9.798 8.730 1.068 19846
28 1 . 1 1 17 17 ASP HA H 17 4.655 4.655 4.913 -0.258 19846
29 1 . 1 1 17 17 ASP H H 17 8.785 8.785 8.600 0.185 19846
30 1 . 1 1 18 18 PRO HA H 18 4.651 4.651 4.196 0.455 19846
31 1 . 1 1 19 19 TYR HA H 19 4.608 4.608 3.885 0.723 19846
32 1 . 1 1 19 19 TYR H H 19 8.512 8.512 7.137 1.375 19846
33 1 . 1 1 20 20 TYR HA H 20 4.857 4.857 4.789 0.068 19846
34 1 . 1 1 20 20 TYR H H 20 8.478 8.478 8.384 0.094 19846
35 1 . 1 1 21 21 CYS HA H 21 4.405 4.405 4.375 0.030 19846
36 1 . 1 1 21 21 CYS H H 21 8.527 8.527 8.503 0.024 19846
37 1 . 1 1 22 22 SER HA H 22 4.657 4.657 5.129 -0.472 19846
38 1 . 1 1 22 22 SER H H 22 8.559 8.559 8.835 -0.276 19846
39 1 . 1 1 23 23 PRO HA H 23 5.082 5.082 4.652 0.430 19846
40 1 . 1 1 24 24 PRO HA H 24 3.960 3.960 4.480 -0.520 19846
41 1 . 1 1 25 25 ILE HA H 25 3.737 3.737 4.174 -0.437 19846
42 1 . 1 1 25 25 ILE H H 25 7.609 7.609 8.239 -0.630 19846
43 1 . 1 1 26 26 TYR HA H 26 4.723 4.723 4.997 -0.274 19846
44 1 . 1 1 26 26 TYR H H 26 7.326 7.326 8.176 -0.850 19846
45 1 . 1 1 27 27 GLY H H 27 8.048 8.048 7.827 0.221 19846
46 1 . 1 1 28 28 HIS HA H 28 5.594 5.594 5.023 0.571 19846
47 1 . 1 1 28 28 HIS H H 28 8.125 8.125 8.079 0.046 19846
48 1 . 1 1 29 29 CYS HA H 29 4.778 4.778 4.569 0.209 19846
49 1 . 1 1 29 29 CYS H H 29 8.373 8.373 8.680 -0.307 19846
stop_
save_