data_18757
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18757
_Entry.PDB_ID 2LZI
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 18757
_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 N N 2 120.907 120.907 120.516 0.391 18757
2 1 1 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.532 -0.038 18757
3 1 1 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.233 -0.277 18757
4 1 1 . 1 1 2 2 ILE CB C 2 40.197 40.197 40.412 -0.215 18757
5 1 1 . 1 1 2 2 ILE H H 2 7.927 7.927 7.500 0.427 18757
6 1 1 . 1 1 3 3 CYS N N 3 124.107 124.107 123.715 0.392 18757
7 1 1 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.432 -0.124 18757
8 1 1 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.670 -1.657 18757
9 1 1 . 1 1 3 3 CYS H H 3 8.899 8.899 8.576 0.323 18757
10 1 1 . 1 1 4 4 ARG N N 4 123.254 123.254 122.538 0.716 18757
11 1 1 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.658 0.005 18757
12 1 1 . 1 1 4 4 ARG CA C 4 55.267 55.267 54.392 0.875 18757
13 1 1 . 1 1 4 4 ARG CB C 4 31.817 31.817 31.205 0.612 18757
14 1 1 . 1 1 4 4 ARG H H 4 8.714 8.714 8.865 -0.151 18757
15 1 1 . 1 1 5 5 CYS N N 5 123.464 123.464 126.435 -2.971 18757
16 1 1 . 1 1 5 5 CYS HA H 5 5.404 5.404 4.766 0.638 18757
17 1 1 . 1 1 5 5 CYS CA C 5 55.641 55.641 59.137 -3.496 18757
18 1 1 . 1 1 5 5 CYS CB C 5 46.464 46.464 25.747 20.717 18757
19 1 1 . 1 1 5 5 CYS H H 5 9.020 9.020 9.022 -0.002 18757
20 1 1 . 1 1 6 6 ILE N N 6 124.141 124.141 127.760 -3.619 18757
21 1 1 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.303 0.061 18757
22 1 1 . 1 1 6 6 ILE CA C 6 60.712 60.712 61.002 -0.290 18757
23 1 1 . 1 1 6 6 ILE CB C 6 39.591 39.591 39.347 0.244 18757
24 1 1 . 1 1 6 6 ILE H H 6 8.780 8.780 8.932 -0.152 18757
25 1 1 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.464 -0.133 18757
26 1 1 . 1 1 7 7 CYS CA C 7 55.862 55.862 57.915 -2.053 18757
27 1 1 . 1 1 7 7 CYS H H 7 9.135 9.135 8.902 0.233 18757
28 1 1 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.547 -0.405 18757
29 1 1 . 1 1 8 8 GLY H H 8 8.588 8.588 8.817 -0.229 18757
30 1 1 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.486 -0.356 18757
31 1 1 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.270 0.106 18757
32 1 1 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.032 -0.411 18757
33 1 1 . 1 1 9 9 ARG H H 9 8.873 8.873 8.346 0.527 18757
34 1 1 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.474 -0.135 18757
35 1 1 . 1 1 10 10 ARG CA C 10 56.589 56.589 55.393 1.196 18757
36 1 1 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.831 -0.413 18757
37 1 1 . 1 1 10 10 ARG H H 10 8.382 8.382 8.047 0.335 18757
38 1 1 . 1 1 11 11 ILE N N 11 119.146 119.146 122.833 -3.687 18757
39 1 1 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.265 0.218 18757
40 1 1 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.586 -0.445 18757
41 1 1 . 1 1 11 11 ILE CB C 11 40.197 40.197 38.153 2.045 18757
42 1 1 . 1 1 11 11 ILE H H 11 8.002 8.002 7.737 0.265 18757
43 1 1 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.575 -0.273 18757
44 1 1 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.655 -1.642 18757
45 1 1 . 1 1 12 12 CYS H H 12 8.821 8.821 8.600 0.221 18757
46 1 1 . 1 1 13 13 ARG N N 13 122.886 122.886 120.919 1.967 18757
47 1 1 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.666 -0.002 18757
48 1 1 . 1 1 13 13 ARG CA C 13 55.267 55.267 54.585 0.682 18757
49 1 1 . 1 1 13 13 ARG CB C 13 31.817 31.817 32.229 -0.412 18757
50 1 1 . 1 1 13 13 ARG H H 13 8.680 8.680 9.004 -0.324 18757
51 1 1 . 1 1 14 14 CYS N N 14 123.464 123.464 124.349 -0.885 18757
52 1 1 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.076 0.328 18757
53 1 1 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.410 -2.769 18757
54 1 1 . 1 1 14 14 CYS CB C 14 46.464 46.464 26.176 20.288 18757
55 1 1 . 1 1 14 14 CYS H H 14 9.020 9.020 8.965 0.055 18757
56 1 1 . 1 1 15 15 ILE N N 15 124.141 124.141 122.547 1.594 18757
57 1 1 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.560 -0.198 18757
58 1 1 . 1 1 15 15 ILE CA C 15 60.712 60.712 60.543 0.169 18757
59 1 1 . 1 1 15 15 ILE CB C 15 39.591 39.591 38.730 0.861 18757
60 1 1 . 1 1 15 15 ILE H H 15 8.780 8.780 8.587 0.193 18757
61 1 1 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.374 0.173 18757
62 1 1 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.291 -3.193 18757
63 1 1 . 1 1 16 16 CYS H H 16 8.973 8.973 9.016 -0.043 18757
64 1 1 . 1 1 17 17 GLY N N 17 111.815 111.815 113.052 -1.237 18757
65 1 1 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.301 0.760 18757
66 1 1 . 1 1 17 17 GLY H H 17 8.760 8.760 8.666 0.094 18757
67 1 2 . 1 1 2 2 ILE N N 2 120.907 120.907 120.584 0.323 18757
68 1 2 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.543 -0.049 18757
69 1 2 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.349 -0.392 18757
70 1 2 . 1 1 2 2 ILE CB C 2 40.197 40.197 40.389 -0.192 18757
71 1 2 . 1 1 2 2 ILE H H 2 7.927 7.927 7.519 0.408 18757
72 1 2 . 1 1 3 3 CYS N N 3 124.107 124.107 124.350 -0.243 18757
73 1 2 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.403 -0.095 18757
74 1 2 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.662 -1.649 18757
75 1 2 . 1 1 3 3 CYS H H 3 8.899 8.899 8.678 0.221 18757
76 1 2 . 1 1 4 4 ARG N N 4 123.254 123.254 122.464 0.790 18757
77 1 2 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.725 -0.062 18757
78 1 2 . 1 1 4 4 ARG CA C 4 55.267 55.267 55.388 -0.121 18757
79 1 2 . 1 1 4 4 ARG CB C 4 31.817 31.817 33.722 -1.905 18757
80 1 2 . 1 1 4 4 ARG H H 4 8.714 8.714 8.828 -0.114 18757
81 1 2 . 1 1 5 5 CYS N N 5 123.464 123.464 126.338 -2.874 18757
82 1 2 . 1 1 5 5 CYS HA H 5 5.404 5.404 4.921 0.483 18757
83 1 2 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.498 -2.857 18757
84 1 2 . 1 1 5 5 CYS CB C 5 46.464 46.464 25.987 20.477 18757
85 1 2 . 1 1 5 5 CYS H H 5 9.020 9.020 8.961 0.059 18757
86 1 2 . 1 1 6 6 ILE N N 6 124.141 124.141 127.138 -2.997 18757
87 1 2 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.341 0.022 18757
88 1 2 . 1 1 6 6 ILE CA C 6 60.712 60.712 60.986 -0.274 18757
89 1 2 . 1 1 6 6 ILE CB C 6 39.591 39.591 39.930 -0.339 18757
90 1 2 . 1 1 6 6 ILE H H 6 8.780 8.780 8.815 -0.035 18757
91 1 2 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.554 -0.223 18757
92 1 2 . 1 1 7 7 CYS CA C 7 55.862 55.862 57.856 -1.994 18757
93 1 2 . 1 1 7 7 CYS H H 7 9.135 9.135 8.772 0.363 18757
94 1 2 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.758 -0.616 18757
95 1 2 . 1 1 8 8 GLY H H 8 8.588 8.588 8.874 -0.286 18757
96 1 2 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.573 -0.443 18757
97 1 2 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.596 -0.220 18757
98 1 2 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.830 -1.209 18757
99 1 2 . 1 1 9 9 ARG H H 9 8.873 8.873 8.257 0.616 18757
100 1 2 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.459 -0.120 18757
101 1 2 . 1 1 10 10 ARG CA C 10 56.589 56.589 55.709 0.880 18757
102 1 2 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.840 -0.422 18757
103 1 2 . 1 1 10 10 ARG H H 10 8.382 8.382 7.974 0.408 18757
104 1 2 . 1 1 11 11 ILE N N 11 119.146 119.146 121.788 -2.642 18757
105 1 2 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.321 0.162 18757
106 1 2 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.666 -0.525 18757
107 1 2 . 1 1 11 11 ILE CB C 11 40.197 40.197 39.325 0.872 18757
108 1 2 . 1 1 11 11 ILE H H 11 8.002 8.002 7.683 0.319 18757
109 1 2 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.643 -0.341 18757
110 1 2 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.562 -1.549 18757
111 1 2 . 1 1 12 12 CYS H H 12 8.821 8.821 8.594 0.227 18757
112 1 2 . 1 1 13 13 ARG N N 13 122.886 122.886 121.682 1.204 18757
113 1 2 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.640 0.024 18757
114 1 2 . 1 1 13 13 ARG CA C 13 55.267 55.267 56.342 -1.075 18757
115 1 2 . 1 1 13 13 ARG CB C 13 31.817 31.817 32.728 -0.911 18757
116 1 2 . 1 1 13 13 ARG H H 13 8.680 8.680 9.049 -0.369 18757
117 1 2 . 1 1 14 14 CYS N N 14 123.464 123.464 126.230 -2.766 18757
118 1 2 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.032 0.372 18757
119 1 2 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.176 -2.535 18757
120 1 2 . 1 1 14 14 CYS CB C 14 46.464 46.464 25.787 20.677 18757
121 1 2 . 1 1 14 14 CYS H H 14 9.020 9.020 8.782 0.238 18757
122 1 2 . 1 1 15 15 ILE N N 15 124.141 124.141 126.049 -1.908 18757
123 1 2 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.479 -0.117 18757
124 1 2 . 1 1 15 15 ILE CA C 15 60.712 60.712 60.531 0.181 18757
125 1 2 . 1 1 15 15 ILE CB C 15 39.591 39.591 40.576 -0.985 18757
126 1 2 . 1 1 15 15 ILE H H 15 8.780 8.780 9.054 -0.274 18757
127 1 2 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.159 0.388 18757
128 1 2 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.325 -3.227 18757
129 1 2 . 1 1 16 16 CYS H H 16 8.973 8.973 9.059 -0.086 18757
130 1 2 . 1 1 17 17 GLY N N 17 111.815 111.815 113.539 -1.724 18757
131 1 2 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.677 0.384 18757
132 1 2 . 1 1 17 17 GLY H H 17 8.760 8.760 8.986 -0.226 18757
133 1 3 . 1 1 2 2 ILE N N 2 120.907 120.907 121.621 -0.714 18757
134 1 3 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.420 0.074 18757
135 1 3 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.398 -0.441 18757
136 1 3 . 1 1 2 2 ILE CB C 2 40.197 40.197 40.708 -0.511 18757
137 1 3 . 1 1 2 2 ILE H H 2 7.927 7.927 7.583 0.344 18757
138 1 3 . 1 1 3 3 CYS N N 3 124.107 124.107 123.021 1.086 18757
139 1 3 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.382 -0.074 18757
140 1 3 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.733 -1.720 18757
141 1 3 . 1 1 3 3 CYS H H 3 8.899 8.899 8.701 0.198 18757
142 1 3 . 1 1 4 4 ARG N N 4 123.254 123.254 122.763 0.491 18757
143 1 3 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.683 -0.020 18757
144 1 3 . 1 1 4 4 ARG CA C 4 55.267 55.267 54.098 1.169 18757
145 1 3 . 1 1 4 4 ARG CB C 4 31.817 31.817 31.194 0.623 18757
146 1 3 . 1 1 4 4 ARG H H 4 8.714 8.714 9.143 -0.429 18757
147 1 3 . 1 1 5 5 CYS N N 5 123.464 123.464 126.819 -3.355 18757
148 1 3 . 1 1 5 5 CYS HA H 5 5.404 5.404 4.816 0.588 18757
149 1 3 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.837 -3.196 18757
150 1 3 . 1 1 5 5 CYS CB C 5 46.464 46.464 25.935 20.529 18757
151 1 3 . 1 1 5 5 CYS H H 5 9.020 9.020 8.987 0.033 18757
152 1 3 . 1 1 6 6 ILE N N 6 124.141 124.141 127.378 -3.237 18757
153 1 3 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.315 0.049 18757
154 1 3 . 1 1 6 6 ILE CA C 6 60.712 60.712 59.912 0.800 18757
155 1 3 . 1 1 6 6 ILE CB C 6 39.591 39.591 38.703 0.888 18757
156 1 3 . 1 1 6 6 ILE H H 6 8.780 8.780 8.934 -0.154 18757
157 1 3 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.217 0.114 18757
158 1 3 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.008 -2.146 18757
159 1 3 . 1 1 7 7 CYS H H 7 9.135 9.135 8.822 0.313 18757
160 1 3 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.215 -0.073 18757
161 1 3 . 1 1 8 8 GLY H H 8 8.588 8.588 8.711 -0.123 18757
162 1 3 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.357 -0.227 18757
163 1 3 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.819 -0.443 18757
164 1 3 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.503 -0.882 18757
165 1 3 . 1 1 9 9 ARG H H 9 8.873 8.873 8.193 0.680 18757
166 1 3 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.391 -0.052 18757
167 1 3 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.078 0.511 18757
168 1 3 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.652 -0.234 18757
169 1 3 . 1 1 10 10 ARG H H 10 8.382 8.382 7.915 0.467 18757
170 1 3 . 1 1 11 11 ILE N N 11 119.146 119.146 122.720 -3.574 18757
171 1 3 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.132 0.351 18757
172 1 3 . 1 1 11 11 ILE CA C 11 60.141 60.141 61.578 -1.437 18757
173 1 3 . 1 1 11 11 ILE CB C 11 40.197 40.197 38.591 1.606 18757
174 1 3 . 1 1 11 11 ILE H H 11 8.002 8.002 7.799 0.203 18757
175 1 3 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.415 -0.113 18757
176 1 3 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.609 -1.596 18757
177 1 3 . 1 1 12 12 CYS H H 12 8.821 8.821 8.384 0.437 18757
178 1 3 . 1 1 13 13 ARG N N 13 122.886 122.886 122.285 0.601 18757
179 1 3 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.708 -0.044 18757
180 1 3 . 1 1 13 13 ARG CA C 13 55.267 55.267 54.328 0.939 18757
181 1 3 . 1 1 13 13 ARG CB C 13 31.817 31.817 31.542 0.275 18757
182 1 3 . 1 1 13 13 ARG H H 13 8.680 8.680 9.285 -0.605 18757
183 1 3 . 1 1 14 14 CYS N N 14 123.464 123.464 126.842 -3.378 18757
184 1 3 . 1 1 14 14 CYS HA H 14 5.404 5.404 4.991 0.413 18757
185 1 3 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.944 -3.303 18757
186 1 3 . 1 1 14 14 CYS CB C 14 46.464 46.464 26.050 20.414 18757
187 1 3 . 1 1 14 14 CYS H H 14 9.020 9.020 9.025 -0.005 18757
188 1 3 . 1 1 15 15 ILE N N 15 124.141 124.141 126.771 -2.630 18757
189 1 3 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.359 0.003 18757
190 1 3 . 1 1 15 15 ILE CA C 15 60.712 60.712 60.292 0.420 18757
191 1 3 . 1 1 15 15 ILE CB C 15 39.591 39.591 40.480 -0.889 18757
192 1 3 . 1 1 15 15 ILE H H 15 8.780 8.780 8.778 0.002 18757
193 1 3 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.165 0.382 18757
194 1 3 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.022 -2.924 18757
195 1 3 . 1 1 16 16 CYS H H 16 8.973 8.973 9.005 -0.032 18757
196 1 3 . 1 1 17 17 GLY N N 17 111.815 111.815 113.088 -1.273 18757
197 1 3 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.643 0.418 18757
198 1 3 . 1 1 17 17 GLY H H 17 8.760 8.760 8.925 -0.165 18757
199 1 4 . 1 1 2 2 ILE N N 2 120.907 120.907 121.326 -0.419 18757
200 1 4 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.420 0.074 18757
201 1 4 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.319 -0.363 18757
202 1 4 . 1 1 2 2 ILE CB C 2 40.197 40.197 40.880 -0.683 18757
203 1 4 . 1 1 2 2 ILE H H 2 7.927 7.927 7.562 0.365 18757
204 1 4 . 1 1 3 3 CYS N N 3 124.107 124.107 122.859 1.248 18757
205 1 4 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.234 0.074 18757
206 1 4 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.670 -1.657 18757
207 1 4 . 1 1 3 3 CYS H H 3 8.899 8.899 8.700 0.199 18757
208 1 4 . 1 1 4 4 ARG N N 4 123.254 123.254 123.554 -0.300 18757
209 1 4 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.528 0.135 18757
210 1 4 . 1 1 4 4 ARG CA C 4 55.267 55.267 54.540 0.727 18757
211 1 4 . 1 1 4 4 ARG CB C 4 31.817 31.817 29.795 2.022 18757
212 1 4 . 1 1 4 4 ARG H H 4 8.714 8.714 9.077 -0.363 18757
213 1 4 . 1 1 5 5 CYS N N 5 123.464 123.464 126.458 -2.994 18757
214 1 4 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.375 0.029 18757
215 1 4 . 1 1 5 5 CYS CA C 5 55.641 55.641 57.442 -1.801 18757
216 1 4 . 1 1 5 5 CYS CB C 5 46.464 46.464 27.202 19.262 18757
217 1 4 . 1 1 5 5 CYS H H 5 9.020 9.020 8.558 0.462 18757
218 1 4 . 1 1 6 6 ILE N N 6 124.141 124.141 121.400 2.741 18757
219 1 4 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.712 -0.348 18757
220 1 4 . 1 1 6 6 ILE CA C 6 60.712 60.712 59.750 0.962 18757
221 1 4 . 1 1 6 6 ILE CB C 6 39.591 39.591 40.859 -1.268 18757
222 1 4 . 1 1 6 6 ILE H H 6 8.780 8.780 8.975 -0.195 18757
223 1 4 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.145 0.186 18757
224 1 4 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.288 -2.426 18757
225 1 4 . 1 1 7 7 CYS H H 7 9.135 9.135 8.713 0.422 18757
226 1 4 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.435 -0.293 18757
227 1 4 . 1 1 8 8 GLY H H 8 8.588 8.588 9.088 -0.500 18757
228 1 4 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.439 -0.309 18757
229 1 4 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.631 -0.255 18757
230 1 4 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.910 -1.289 18757
231 1 4 . 1 1 9 9 ARG H H 9 8.873 8.873 8.441 0.432 18757
232 1 4 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.384 -0.045 18757
233 1 4 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.227 0.361 18757
234 1 4 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.301 0.117 18757
235 1 4 . 1 1 10 10 ARG H H 10 8.382 8.382 7.765 0.617 18757
236 1 4 . 1 1 11 11 ILE N N 11 119.146 119.146 122.477 -3.331 18757
237 1 4 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.280 0.203 18757
238 1 4 . 1 1 11 11 ILE CA C 11 60.141 60.141 61.166 -1.025 18757
239 1 4 . 1 1 11 11 ILE CB C 11 40.197 40.197 39.321 0.876 18757
240 1 4 . 1 1 11 11 ILE H H 11 8.002 8.002 7.953 0.049 18757
241 1 4 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.223 0.079 18757
242 1 4 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.584 -1.571 18757
243 1 4 . 1 1 12 12 CYS H H 12 8.821 8.821 8.385 0.436 18757
244 1 4 . 1 1 13 13 ARG N N 13 122.886 122.886 122.033 0.853 18757
245 1 4 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.735 -0.071 18757
246 1 4 . 1 1 13 13 ARG CA C 13 55.267 55.267 55.158 0.109 18757
247 1 4 . 1 1 13 13 ARG CB C 13 31.817 31.817 32.588 -0.771 18757
248 1 4 . 1 1 13 13 ARG H H 13 8.680 8.680 9.172 -0.492 18757
249 1 4 . 1 1 14 14 CYS N N 14 123.464 123.464 127.007 -3.543 18757
250 1 4 . 1 1 14 14 CYS HA H 14 5.404 5.404 4.995 0.409 18757
251 1 4 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.134 -2.493 18757
252 1 4 . 1 1 14 14 CYS CB C 14 46.464 46.464 26.675 19.789 18757
253 1 4 . 1 1 14 14 CYS H H 14 9.020 9.020 9.030 -0.010 18757
254 1 4 . 1 1 15 15 ILE N N 15 124.141 124.141 126.668 -2.527 18757
255 1 4 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.260 0.102 18757
256 1 4 . 1 1 15 15 ILE CA C 15 60.712 60.712 59.528 1.184 18757
257 1 4 . 1 1 15 15 ILE CB C 15 39.591 39.591 37.914 1.677 18757
258 1 4 . 1 1 15 15 ILE H H 15 8.780 8.780 8.844 -0.064 18757
259 1 4 . 1 1 16 16 CYS HA H 16 5.547 5.547 4.844 0.703 18757
260 1 4 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.913 -3.815 18757
261 1 4 . 1 1 16 16 CYS H H 16 8.973 8.973 9.023 -0.050 18757
262 1 4 . 1 1 17 17 GLY N N 17 111.815 111.815 113.316 -1.501 18757
263 1 4 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.372 0.689 18757
264 1 4 . 1 1 17 17 GLY H H 17 8.760 8.760 9.154 -0.394 18757
265 1 5 . 1 1 2 2 ILE N N 2 120.907 120.907 122.015 -1.108 18757
266 1 5 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.498 -0.004 18757
267 1 5 . 1 1 2 2 ILE CA C 2 59.956 59.956 59.626 0.331 18757
268 1 5 . 1 1 2 2 ILE CB C 2 40.197 40.197 40.055 0.142 18757
269 1 5 . 1 1 2 2 ILE H H 2 7.927 7.927 7.609 0.318 18757
270 1 5 . 1 1 3 3 CYS N N 3 124.107 124.107 123.474 0.633 18757
271 1 5 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.391 -0.083 18757
272 1 5 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.666 -1.653 18757
273 1 5 . 1 1 3 3 CYS H H 3 8.899 8.899 8.789 0.110 18757
274 1 5 . 1 1 4 4 ARG N N 4 123.254 123.254 122.063 1.191 18757
275 1 5 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.653 0.010 18757
276 1 5 . 1 1 4 4 ARG CA C 4 55.267 55.267 54.816 0.451 18757
277 1 5 . 1 1 4 4 ARG CB C 4 31.817 31.817 31.527 0.290 18757
278 1 5 . 1 1 4 4 ARG H H 4 8.714 8.714 9.031 -0.317 18757
279 1 5 . 1 1 5 5 CYS N N 5 123.464 123.464 124.573 -1.109 18757
280 1 5 . 1 1 5 5 CYS HA H 5 5.404 5.404 4.938 0.466 18757
281 1 5 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.637 -2.996 18757
282 1 5 . 1 1 5 5 CYS CB C 5 46.464 46.464 26.137 20.326 18757
283 1 5 . 1 1 5 5 CYS H H 5 9.020 9.020 9.055 -0.035 18757
284 1 5 . 1 1 6 6 ILE N N 6 124.141 124.141 123.096 1.045 18757
285 1 5 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.681 -0.317 18757
286 1 5 . 1 1 6 6 ILE CA C 6 60.712 60.712 60.310 0.402 18757
287 1 5 . 1 1 6 6 ILE CB C 6 39.591 39.591 39.474 0.117 18757
288 1 5 . 1 1 6 6 ILE H H 6 8.780 8.780 8.601 0.179 18757
289 1 5 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.459 -0.128 18757
290 1 5 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.030 -2.168 18757
291 1 5 . 1 1 7 7 CYS H H 7 9.135 9.135 8.883 0.252 18757
292 1 5 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.434 -0.292 18757
293 1 5 . 1 1 8 8 GLY H H 8 8.588 8.588 8.681 -0.093 18757
294 1 5 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.382 -0.252 18757
295 1 5 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.575 -0.199 18757
296 1 5 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.468 -0.847 18757
297 1 5 . 1 1 9 9 ARG H H 9 8.873 8.873 8.145 0.728 18757
298 1 5 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.496 -0.157 18757
299 1 5 . 1 1 10 10 ARG CA C 10 56.589 56.589 55.801 0.788 18757
300 1 5 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.712 -0.294 18757
301 1 5 . 1 1 10 10 ARG H H 10 8.382 8.382 8.135 0.247 18757
302 1 5 . 1 1 11 11 ILE N N 11 119.146 119.146 120.666 -1.520 18757
303 1 5 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.415 0.068 18757
304 1 5 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.316 -0.175 18757
305 1 5 . 1 1 11 11 ILE CB C 11 40.197 40.197 40.611 -0.414 18757
306 1 5 . 1 1 11 11 ILE H H 11 8.002 8.002 7.675 0.327 18757
307 1 5 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.481 -0.179 18757
308 1 5 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.661 -1.648 18757
309 1 5 . 1 1 12 12 CYS H H 12 8.821 8.821 8.643 0.178 18757
310 1 5 . 1 1 13 13 ARG N N 13 122.886 122.886 121.995 0.891 18757
311 1 5 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.678 -0.014 18757
312 1 5 . 1 1 13 13 ARG CA C 13 55.267 55.267 55.056 0.211 18757
313 1 5 . 1 1 13 13 ARG CB C 13 31.817 31.817 31.910 -0.093 18757
314 1 5 . 1 1 13 13 ARG H H 13 8.680 8.680 9.019 -0.339 18757
315 1 5 . 1 1 14 14 CYS N N 14 123.464 123.464 126.396 -2.932 18757
316 1 5 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.134 0.270 18757
317 1 5 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.916 -3.275 18757
318 1 5 . 1 1 14 14 CYS CB C 14 46.464 46.464 26.204 20.260 18757
319 1 5 . 1 1 14 14 CYS H H 14 9.020 9.020 8.918 0.102 18757
320 1 5 . 1 1 15 15 ILE N N 15 124.141 124.141 126.673 -2.532 18757
321 1 5 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.451 -0.089 18757
322 1 5 . 1 1 15 15 ILE CA C 15 60.712 60.712 59.682 1.030 18757
323 1 5 . 1 1 15 15 ILE CB C 15 39.591 39.591 41.182 -1.591 18757
324 1 5 . 1 1 15 15 ILE H H 15 8.780 8.780 8.847 -0.067 18757
325 1 5 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.072 0.475 18757
326 1 5 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.351 -3.253 18757
327 1 5 . 1 1 16 16 CYS H H 16 8.973 8.973 9.021 -0.048 18757
328 1 5 . 1 1 17 17 GLY N N 17 111.815 111.815 113.604 -1.789 18757
329 1 5 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.681 0.380 18757
330 1 5 . 1 1 17 17 GLY H H 17 8.760 8.760 9.143 -0.383 18757
331 1 6 . 1 1 2 2 ILE N N 2 120.907 120.907 120.953 -0.046 18757
332 1 6 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.630 -0.136 18757
333 1 6 . 1 1 2 2 ILE CA C 2 59.956 59.956 59.590 0.366 18757
334 1 6 . 1 1 2 2 ILE CB C 2 40.197 40.197 40.893 -0.696 18757
335 1 6 . 1 1 2 2 ILE H H 2 7.927 7.927 7.294 0.633 18757
336 1 6 . 1 1 3 3 CYS N N 3 124.107 124.107 123.809 0.298 18757
337 1 6 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.022 0.286 18757
338 1 6 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.585 -1.572 18757
339 1 6 . 1 1 3 3 CYS H H 3 8.899 8.899 8.403 0.496 18757
340 1 6 . 1 1 4 4 ARG N N 4 123.254 123.254 122.471 0.783 18757
341 1 6 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.659 0.004 18757
342 1 6 . 1 1 4 4 ARG CA C 4 55.267 55.267 54.819 0.448 18757
343 1 6 . 1 1 4 4 ARG CB C 4 31.817 31.817 31.776 0.042 18757
344 1 6 . 1 1 4 4 ARG H H 4 8.714 8.714 8.877 -0.163 18757
345 1 6 . 1 1 5 5 CYS N N 5 123.464 123.464 124.595 -1.131 18757
346 1 6 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.079 0.325 18757
347 1 6 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.729 -3.088 18757
348 1 6 . 1 1 5 5 CYS CB C 5 46.464 46.464 25.780 20.684 18757
349 1 6 . 1 1 5 5 CYS H H 5 9.020 9.020 9.016 0.004 18757
350 1 6 . 1 1 6 6 ILE N N 6 124.141 124.141 122.694 1.447 18757
351 1 6 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.685 -0.321 18757
352 1 6 . 1 1 6 6 ILE CA C 6 60.712 60.712 60.282 0.430 18757
353 1 6 . 1 1 6 6 ILE CB C 6 39.591 39.591 40.291 -0.700 18757
354 1 6 . 1 1 6 6 ILE H H 6 8.780 8.780 8.800 -0.020 18757
355 1 6 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.251 0.080 18757
356 1 6 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.235 -2.373 18757
357 1 6 . 1 1 7 7 CYS H H 7 9.135 9.135 8.678 0.457 18757
358 1 6 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.978 -0.837 18757
359 1 6 . 1 1 8 8 GLY H H 8 8.588 8.588 8.994 -0.406 18757
360 1 6 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.425 -0.295 18757
361 1 6 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.871 -0.495 18757
362 1 6 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.564 -0.943 18757
363 1 6 . 1 1 9 9 ARG H H 9 8.873 8.873 8.478 0.395 18757
364 1 6 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.404 -0.065 18757
365 1 6 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.036 0.553 18757
366 1 6 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.641 -0.223 18757
367 1 6 . 1 1 10 10 ARG H H 10 8.382 8.382 7.931 0.451 18757
368 1 6 . 1 1 11 11 ILE N N 11 119.146 119.146 121.929 -2.783 18757
369 1 6 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.391 0.092 18757
370 1 6 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.346 -0.205 18757
371 1 6 . 1 1 11 11 ILE CB C 11 40.197 40.197 40.358 -0.161 18757
372 1 6 . 1 1 11 11 ILE H H 11 8.002 8.002 7.621 0.381 18757
373 1 6 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.438 -0.136 18757
374 1 6 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.651 -1.637 18757
375 1 6 . 1 1 12 12 CYS H H 12 8.821 8.821 8.711 0.110 18757
376 1 6 . 1 1 13 13 ARG N N 13 122.886 122.886 120.882 2.004 18757
377 1 6 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.697 -0.033 18757
378 1 6 . 1 1 13 13 ARG CA C 13 55.267 55.267 55.122 0.145 18757
379 1 6 . 1 1 13 13 ARG CB C 13 31.817 31.817 33.461 -1.644 18757
380 1 6 . 1 1 13 13 ARG H H 13 8.680 8.680 9.205 -0.525 18757
381 1 6 . 1 1 14 14 CYS N N 14 123.464 123.464 124.259 -0.795 18757
382 1 6 . 1 1 14 14 CYS HA H 14 5.404 5.404 4.940 0.464 18757
383 1 6 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.854 -3.213 18757
384 1 6 . 1 1 14 14 CYS CB C 14 46.464 46.464 26.156 20.308 18757
385 1 6 . 1 1 14 14 CYS H H 14 9.020 9.020 8.988 0.032 18757
386 1 6 . 1 1 15 15 ILE N N 15 124.141 124.141 126.112 -1.971 18757
387 1 6 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.449 -0.087 18757
388 1 6 . 1 1 15 15 ILE CA C 15 60.712 60.712 60.457 0.255 18757
389 1 6 . 1 1 15 15 ILE CB C 15 39.591 39.591 40.436 -0.845 18757
390 1 6 . 1 1 15 15 ILE H H 15 8.780 8.780 9.039 -0.259 18757
391 1 6 . 1 1 16 16 CYS HA H 16 5.547 5.547 4.839 0.708 18757
392 1 6 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.725 -3.627 18757
393 1 6 . 1 1 16 16 CYS H H 16 8.973 8.973 9.088 -0.115 18757
394 1 6 . 1 1 17 17 GLY N N 17 111.815 111.815 113.393 -1.578 18757
395 1 6 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.381 0.680 18757
396 1 6 . 1 1 17 17 GLY H H 17 8.760 8.760 8.924 -0.164 18757
397 1 7 . 1 1 2 2 ILE N N 2 120.907 120.907 120.973 -0.066 18757
398 1 7 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.666 -0.172 18757
399 1 7 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.303 -0.347 18757
400 1 7 . 1 1 2 2 ILE CB C 2 40.197 40.197 41.332 -1.135 18757
401 1 7 . 1 1 2 2 ILE H H 2 7.927 7.927 7.565 0.362 18757
402 1 7 . 1 1 3 3 CYS N N 3 124.107 124.107 124.510 -0.403 18757
403 1 7 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.269 0.039 18757
404 1 7 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.561 -1.548 18757
405 1 7 . 1 1 3 3 CYS H H 3 8.899 8.899 8.397 0.502 18757
406 1 7 . 1 1 4 4 ARG N N 4 123.254 123.254 122.561 0.693 18757
407 1 7 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.722 -0.059 18757
408 1 7 . 1 1 4 4 ARG CA C 4 55.267 55.267 55.189 0.078 18757
409 1 7 . 1 1 4 4 ARG CB C 4 31.817 31.817 31.773 0.044 18757
410 1 7 . 1 1 4 4 ARG H H 4 8.714 8.714 9.174 -0.460 18757
411 1 7 . 1 1 5 5 CYS N N 5 123.464 123.464 126.105 -2.641 18757
412 1 7 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.260 0.144 18757
413 1 7 . 1 1 5 5 CYS CA C 5 55.641 55.641 57.987 -2.346 18757
414 1 7 . 1 1 5 5 CYS CB C 5 46.464 46.464 26.855 19.609 18757
415 1 7 . 1 1 5 5 CYS H H 5 9.020 9.020 8.932 0.088 18757
416 1 7 . 1 1 6 6 ILE N N 6 124.141 124.141 122.852 1.289 18757
417 1 7 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.680 -0.316 18757
418 1 7 . 1 1 6 6 ILE CA C 6 60.712 60.712 60.563 0.149 18757
419 1 7 . 1 1 6 6 ILE CB C 6 39.591 39.591 39.997 -0.406 18757
420 1 7 . 1 1 6 6 ILE H H 6 8.780 8.780 8.684 0.096 18757
421 1 7 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.264 0.067 18757
422 1 7 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.178 -2.316 18757
423 1 7 . 1 1 7 7 CYS H H 7 9.135 9.135 8.625 0.510 18757
424 1 7 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.237 -0.095 18757
425 1 7 . 1 1 8 8 GLY H H 8 8.588 8.588 8.866 -0.278 18757
426 1 7 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.300 -0.170 18757
427 1 7 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.641 -0.265 18757
428 1 7 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.677 -1.056 18757
429 1 7 . 1 1 9 9 ARG H H 9 8.873 8.873 8.154 0.719 18757
430 1 7 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.394 -0.055 18757
431 1 7 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.417 0.172 18757
432 1 7 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.039 0.379 18757
433 1 7 . 1 1 10 10 ARG H H 10 8.382 8.382 7.842 0.540 18757
434 1 7 . 1 1 11 11 ILE N N 11 119.146 119.146 123.519 -4.373 18757
435 1 7 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.245 0.238 18757
436 1 7 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.749 -0.609 18757
437 1 7 . 1 1 11 11 ILE CB C 11 40.197 40.197 38.395 1.802 18757
438 1 7 . 1 1 11 11 ILE H H 11 8.002 8.002 8.019 -0.017 18757
439 1 7 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.346 -0.044 18757
440 1 7 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.492 -1.480 18757
441 1 7 . 1 1 12 12 CYS H H 12 8.821 8.821 8.371 0.450 18757
442 1 7 . 1 1 13 13 ARG N N 13 122.886 122.886 122.049 0.837 18757
443 1 7 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.737 -0.073 18757
444 1 7 . 1 1 13 13 ARG CA C 13 55.267 55.267 55.407 -0.141 18757
445 1 7 . 1 1 13 13 ARG CB C 13 31.817 31.817 32.528 -0.711 18757
446 1 7 . 1 1 13 13 ARG H H 13 8.680 8.680 9.192 -0.512 18757
447 1 7 . 1 1 14 14 CYS N N 14 123.464 123.464 125.598 -2.134 18757
448 1 7 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.274 0.130 18757
449 1 7 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.451 -2.810 18757
450 1 7 . 1 1 14 14 CYS CB C 14 46.464 46.464 27.190 19.274 18757
451 1 7 . 1 1 14 14 CYS H H 14 9.020 9.020 8.937 0.083 18757
452 1 7 . 1 1 15 15 ILE N N 15 124.141 124.141 126.215 -2.074 18757
453 1 7 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.599 -0.237 18757
454 1 7 . 1 1 15 15 ILE CA C 15 60.712 60.712 60.396 0.316 18757
455 1 7 . 1 1 15 15 ILE CB C 15 39.591 39.591 41.363 -1.772 18757
456 1 7 . 1 1 15 15 ILE H H 15 8.780 8.780 8.918 -0.138 18757
457 1 7 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.278 0.269 18757
458 1 7 . 1 1 16 16 CYS CA C 16 55.098 55.098 57.828 -2.730 18757
459 1 7 . 1 1 16 16 CYS H H 16 8.973 8.973 8.846 0.127 18757
460 1 7 . 1 1 17 17 GLY N N 17 111.815 111.815 110.821 0.994 18757
461 1 7 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.693 0.368 18757
462 1 7 . 1 1 17 17 GLY H H 17 8.760 8.760 8.601 0.159 18757
463 1 8 . 1 1 2 2 ILE N N 2 120.907 120.907 122.893 -1.986 18757
464 1 8 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.286 0.208 18757
465 1 8 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.830 -0.874 18757
466 1 8 . 1 1 2 2 ILE CB C 2 40.197 40.197 39.016 1.181 18757
467 1 8 . 1 1 2 2 ILE H H 2 7.927 7.927 7.567 0.360 18757
468 1 8 . 1 1 3 3 CYS N N 3 124.107 124.107 124.977 -0.870 18757
469 1 8 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.578 -0.270 18757
470 1 8 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.544 -1.531 18757
471 1 8 . 1 1 3 3 CYS H H 3 8.899 8.899 8.641 0.258 18757
472 1 8 . 1 1 4 4 ARG N N 4 123.254 123.254 122.669 0.585 18757
473 1 8 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.748 -0.085 18757
474 1 8 . 1 1 4 4 ARG CA C 4 55.267 55.267 55.372 -0.105 18757
475 1 8 . 1 1 4 4 ARG CB C 4 31.817 31.817 33.633 -1.816 18757
476 1 8 . 1 1 4 4 ARG H H 4 8.714 8.714 9.217 -0.503 18757
477 1 8 . 1 1 5 5 CYS N N 5 123.464 123.464 125.682 -2.218 18757
478 1 8 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.259 0.145 18757
479 1 8 . 1 1 5 5 CYS CA C 5 55.641 55.641 57.602 -1.961 18757
480 1 8 . 1 1 5 5 CYS CB C 5 46.464 46.464 26.715 19.750 18757
481 1 8 . 1 1 5 5 CYS H H 5 9.020 9.020 8.843 0.177 18757
482 1 8 . 1 1 6 6 ILE N N 6 124.141 124.141 121.883 2.258 18757
483 1 8 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.784 -0.420 18757
484 1 8 . 1 1 6 6 ILE CA C 6 60.712 60.712 59.776 0.937 18757
485 1 8 . 1 1 6 6 ILE CB C 6 39.591 39.591 40.598 -1.007 18757
486 1 8 . 1 1 6 6 ILE H H 6 8.780 8.780 8.997 -0.217 18757
487 1 8 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.394 -0.063 18757
488 1 8 . 1 1 7 7 CYS CA C 7 55.862 55.862 57.983 -2.121 18757
489 1 8 . 1 1 7 7 CYS H H 7 9.135 9.135 8.617 0.518 18757
490 1 8 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.466 -0.324 18757
491 1 8 . 1 1 8 8 GLY H H 8 8.588 8.588 8.840 -0.252 18757
492 1 8 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.244 -0.114 18757
493 1 8 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.645 -0.269 18757
494 1 8 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.605 -0.984 18757
495 1 8 . 1 1 9 9 ARG H H 9 8.873 8.873 8.108 0.765 18757
496 1 8 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.358 -0.019 18757
497 1 8 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.396 0.193 18757
498 1 8 . 1 1 10 10 ARG CB C 10 31.418 31.418 30.731 0.687 18757
499 1 8 . 1 1 10 10 ARG H H 10 8.382 8.382 7.766 0.616 18757
500 1 8 . 1 1 11 11 ILE N N 11 119.146 119.146 122.960 -3.814 18757
501 1 8 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.221 0.262 18757
502 1 8 . 1 1 11 11 ILE CA C 11 60.141 60.141 61.389 -1.248 18757
503 1 8 . 1 1 11 11 ILE CB C 11 40.197 40.197 38.768 1.429 18757
504 1 8 . 1 1 11 11 ILE H H 11 8.002 8.002 7.903 0.099 18757
505 1 8 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.477 -0.175 18757
506 1 8 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.471 -1.458 18757
507 1 8 . 1 1 12 12 CYS H H 12 8.821 8.821 8.221 0.600 18757
508 1 8 . 1 1 13 13 ARG N N 13 122.886 122.886 121.674 1.212 18757
509 1 8 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.736 -0.072 18757
510 1 8 . 1 1 13 13 ARG CA C 13 55.267 55.267 55.537 -0.270 18757
511 1 8 . 1 1 13 13 ARG CB C 13 31.817 31.817 33.510 -1.693 18757
512 1 8 . 1 1 13 13 ARG H H 13 8.680 8.680 9.171 -0.491 18757
513 1 8 . 1 1 14 14 CYS N N 14 123.464 123.464 126.490 -3.026 18757
514 1 8 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.226 0.178 18757
515 1 8 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.002 -2.361 18757
516 1 8 . 1 1 14 14 CYS CB C 14 46.464 46.464 25.963 20.501 18757
517 1 8 . 1 1 14 14 CYS H H 14 9.020 9.020 8.902 0.118 18757
518 1 8 . 1 1 15 15 ILE N N 15 124.141 124.141 122.618 1.523 18757
519 1 8 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.586 -0.224 18757
520 1 8 . 1 1 15 15 ILE CA C 15 60.712 60.712 60.964 -0.252 18757
521 1 8 . 1 1 15 15 ILE CB C 15 39.591 39.591 39.612 -0.021 18757
522 1 8 . 1 1 15 15 ILE H H 15 8.780 8.780 8.710 0.070 18757
523 1 8 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.558 -0.011 18757
524 1 8 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.138 -3.040 18757
525 1 8 . 1 1 16 16 CYS H H 16 8.973 8.973 8.584 0.389 18757
526 1 8 . 1 1 17 17 GLY N N 17 111.815 111.815 110.765 1.050 18757
527 1 8 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.501 0.560 18757
528 1 8 . 1 1 17 17 GLY H H 17 8.760 8.760 8.773 -0.013 18757
529 1 9 . 1 1 2 2 ILE N N 2 120.907 120.907 121.596 -0.689 18757
530 1 9 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.465 0.029 18757
531 1 9 . 1 1 2 2 ILE CA C 2 59.956 59.956 59.696 0.260 18757
532 1 9 . 1 1 2 2 ILE CB C 2 40.197 40.197 40.480 -0.283 18757
533 1 9 . 1 1 2 2 ILE H H 2 7.927 7.927 7.573 0.354 18757
534 1 9 . 1 1 3 3 CYS N N 3 124.107 124.107 125.019 -0.912 18757
535 1 9 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.577 -0.269 18757
536 1 9 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.652 -1.639 18757
537 1 9 . 1 1 3 3 CYS H H 3 8.899 8.899 8.810 0.089 18757
538 1 9 . 1 1 4 4 ARG N N 4 123.254 123.254 120.592 2.662 18757
539 1 9 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.685 -0.022 18757
540 1 9 . 1 1 4 4 ARG CA C 4 55.267 55.267 55.110 0.157 18757
541 1 9 . 1 1 4 4 ARG CB C 4 31.817 31.817 32.106 -0.289 18757
542 1 9 . 1 1 4 4 ARG H H 4 8.714 8.714 9.260 -0.546 18757
543 1 9 . 1 1 5 5 CYS N N 5 123.464 123.464 122.488 0.976 18757
544 1 9 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.153 0.251 18757
545 1 9 . 1 1 5 5 CYS CA C 5 55.641 55.641 57.845 -2.204 18757
546 1 9 . 1 1 5 5 CYS CB C 5 46.464 46.464 26.356 20.108 18757
547 1 9 . 1 1 5 5 CYS H H 5 9.020 9.020 8.790 0.230 18757
548 1 9 . 1 1 6 6 ILE N N 6 124.141 124.141 126.745 -2.604 18757
549 1 9 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.220 0.144 18757
550 1 9 . 1 1 6 6 ILE CA C 6 60.712 60.712 60.111 0.601 18757
551 1 9 . 1 1 6 6 ILE CB C 6 39.591 39.591 37.654 1.937 18757
552 1 9 . 1 1 6 6 ILE H H 6 8.780 8.780 8.876 -0.096 18757
553 1 9 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.286 0.045 18757
554 1 9 . 1 1 7 7 CYS CA C 7 55.862 55.862 57.908 -2.046 18757
555 1 9 . 1 1 7 7 CYS H H 7 9.135 9.135 8.892 0.243 18757
556 1 9 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.504 -0.362 18757
557 1 9 . 1 1 8 8 GLY H H 8 8.588 8.588 9.038 -0.450 18757
558 1 9 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.460 -0.330 18757
559 1 9 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.568 -0.192 18757
560 1 9 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.765 -1.144 18757
561 1 9 . 1 1 9 9 ARG H H 9 8.873 8.873 8.338 0.535 18757
562 1 9 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.402 -0.063 18757
563 1 9 . 1 1 10 10 ARG CA C 10 56.589 56.589 55.812 0.777 18757
564 1 9 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.805 -0.387 18757
565 1 9 . 1 1 10 10 ARG H H 10 8.382 8.382 7.909 0.473 18757
566 1 9 . 1 1 11 11 ILE N N 11 119.146 119.146 122.570 -3.424 18757
567 1 9 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.323 0.160 18757
568 1 9 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.306 -0.165 18757
569 1 9 . 1 1 11 11 ILE CB C 11 40.197 40.197 38.773 1.424 18757
570 1 9 . 1 1 11 11 ILE H H 11 8.002 8.002 7.634 0.368 18757
571 1 9 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.493 -0.191 18757
572 1 9 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.679 -1.666 18757
573 1 9 . 1 1 12 12 CYS H H 12 8.821 8.821 8.607 0.214 18757
574 1 9 . 1 1 13 13 ARG N N 13 122.886 122.886 121.005 1.881 18757
575 1 9 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.680 -0.016 18757
576 1 9 . 1 1 13 13 ARG CA C 13 55.267 55.267 53.928 1.339 18757
577 1 9 . 1 1 13 13 ARG CB C 13 31.817 31.817 31.723 0.094 18757
578 1 9 . 1 1 13 13 ARG H H 13 8.680 8.680 8.993 -0.313 18757
579 1 9 . 1 1 14 14 CYS N N 14 123.464 123.464 124.701 -1.237 18757
580 1 9 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.054 0.350 18757
581 1 9 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.346 -2.705 18757
582 1 9 . 1 1 14 14 CYS CB C 14 46.464 46.464 25.809 20.655 18757
583 1 9 . 1 1 14 14 CYS H H 14 9.020 9.020 8.920 0.100 18757
584 1 9 . 1 1 15 15 ILE N N 15 124.141 124.141 121.213 2.928 18757
585 1 9 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.763 -0.401 18757
586 1 9 . 1 1 15 15 ILE CA C 15 60.712 60.712 59.424 1.288 18757
587 1 9 . 1 1 15 15 ILE CB C 15 39.591 39.591 40.975 -1.384 18757
588 1 9 . 1 1 15 15 ILE H H 15 8.780 8.780 9.104 -0.324 18757
589 1 9 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.286 0.261 18757
590 1 9 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.208 -3.110 18757
591 1 9 . 1 1 16 16 CYS H H 16 8.973 8.973 8.630 0.343 18757
592 1 9 . 1 1 17 17 GLY N N 17 111.815 111.815 113.680 -1.865 18757
593 1 9 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.632 0.429 18757
594 1 9 . 1 1 17 17 GLY H H 17 8.760 8.760 9.019 -0.259 18757
595 1 10 . 1 1 2 2 ILE N N 2 120.907 120.907 121.917 -1.010 18757
596 1 10 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.486 0.008 18757
597 1 10 . 1 1 2 2 ILE CA C 2 59.956 59.956 59.699 0.258 18757
598 1 10 . 1 1 2 2 ILE CB C 2 40.197 40.197 39.959 0.238 18757
599 1 10 . 1 1 2 2 ILE H H 2 7.927 7.927 7.573 0.354 18757
600 1 10 . 1 1 3 3 CYS N N 3 124.107 124.107 123.187 0.920 18757
601 1 10 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.341 -0.033 18757
602 1 10 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.819 -1.806 18757
603 1 10 . 1 1 3 3 CYS H H 3 8.899 8.899 8.677 0.222 18757
604 1 10 . 1 1 4 4 ARG N N 4 123.254 123.254 122.714 0.540 18757
605 1 10 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.732 -0.069 18757
606 1 10 . 1 1 4 4 ARG CA C 4 55.267 55.267 54.402 0.865 18757
607 1 10 . 1 1 4 4 ARG CB C 4 31.817 31.817 32.122 -0.305 18757
608 1 10 . 1 1 4 4 ARG H H 4 8.714 8.714 9.061 -0.347 18757
609 1 10 . 1 1 5 5 CYS N N 5 123.464 123.464 125.990 -2.526 18757
610 1 10 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.396 0.008 18757
611 1 10 . 1 1 5 5 CYS CA C 5 55.641 55.641 57.960 -2.319 18757
612 1 10 . 1 1 5 5 CYS CB C 5 46.464 46.464 26.969 19.495 18757
613 1 10 . 1 1 5 5 CYS H H 5 9.020 9.020 8.927 0.093 18757
614 1 10 . 1 1 6 6 ILE N N 6 124.141 124.141 122.992 1.149 18757
615 1 10 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.648 -0.284 18757
616 1 10 . 1 1 6 6 ILE CA C 6 60.712 60.712 60.603 0.109 18757
617 1 10 . 1 1 6 6 ILE CB C 6 39.591 39.591 39.425 0.166 18757
618 1 10 . 1 1 6 6 ILE H H 6 8.780 8.780 8.727 0.053 18757
619 1 10 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.234 0.097 18757
620 1 10 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.174 -2.312 18757
621 1 10 . 1 1 7 7 CYS H H 7 9.135 9.135 8.697 0.438 18757
622 1 10 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.456 -0.314 18757
623 1 10 . 1 1 8 8 GLY H H 8 8.588 8.588 8.967 -0.379 18757
624 1 10 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.325 -0.195 18757
625 1 10 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.211 0.165 18757
626 1 10 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.051 -0.430 18757
627 1 10 . 1 1 9 9 ARG H H 9 8.873 8.873 8.441 0.432 18757
628 1 10 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.497 -0.158 18757
629 1 10 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.094 0.495 18757
630 1 10 . 1 1 10 10 ARG CB C 10 31.418 31.418 30.931 0.487 18757
631 1 10 . 1 1 10 10 ARG H H 10 8.382 8.382 7.942 0.440 18757
632 1 10 . 1 1 11 11 ILE N N 11 119.146 119.146 121.626 -2.480 18757
633 1 10 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.544 -0.061 18757
634 1 10 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.345 -0.204 18757
635 1 10 . 1 1 11 11 ILE CB C 11 40.197 40.197 41.497 -1.300 18757
636 1 10 . 1 1 11 11 ILE H H 11 8.002 8.002 7.773 0.229 18757
637 1 10 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.402 -0.100 18757
638 1 10 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.496 -1.483 18757
639 1 10 . 1 1 12 12 CYS H H 12 8.821 8.821 8.434 0.387 18757
640 1 10 . 1 1 13 13 ARG N N 13 122.886 122.886 121.014 1.872 18757
641 1 10 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.688 -0.024 18757
642 1 10 . 1 1 13 13 ARG CA C 13 55.267 55.267 54.980 0.286 18757
643 1 10 . 1 1 13 13 ARG CB C 13 31.817 31.817 32.041 -0.224 18757
644 1 10 . 1 1 13 13 ARG H H 13 8.680 8.680 9.040 -0.360 18757
645 1 10 . 1 1 14 14 CYS N N 14 123.464 123.464 124.428 -0.964 18757
646 1 10 . 1 1 14 14 CYS HA H 14 5.404 5.404 4.845 0.559 18757
647 1 10 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.678 -3.037 18757
648 1 10 . 1 1 14 14 CYS CB C 14 46.464 46.464 26.686 19.778 18757
649 1 10 . 1 1 14 14 CYS H H 14 9.020 9.020 8.976 0.044 18757
650 1 10 . 1 1 15 15 ILE N N 15 124.141 124.141 127.655 -3.514 18757
651 1 10 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.316 0.046 18757
652 1 10 . 1 1 15 15 ILE CA C 15 60.712 60.712 59.715 0.997 18757
653 1 10 . 1 1 15 15 ILE CB C 15 39.591 39.591 37.447 2.144 18757
654 1 10 . 1 1 15 15 ILE H H 15 8.780 8.780 8.997 -0.217 18757
655 1 10 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.406 0.141 18757
656 1 10 . 1 1 16 16 CYS CA C 16 55.098 55.098 57.495 -2.397 18757
657 1 10 . 1 1 16 16 CYS H H 16 8.973 8.973 9.036 -0.063 18757
658 1 10 . 1 1 17 17 GLY N N 17 111.815 111.815 111.443 0.372 18757
659 1 10 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.469 0.592 18757
660 1 10 . 1 1 17 17 GLY H H 17 8.760 8.760 9.030 -0.270 18757
661 1 11 . 1 1 2 2 ILE N N 2 120.907 120.907 120.254 0.653 18757
662 1 11 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.393 0.101 18757
663 1 11 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.154 -0.198 18757
664 1 11 . 1 1 2 2 ILE CB C 2 40.197 40.197 42.041 -1.844 18757
665 1 11 . 1 1 2 2 ILE H H 2 7.927 7.927 7.547 0.380 18757
666 1 11 . 1 1 3 3 CYS N N 3 124.107 124.107 122.650 1.457 18757
667 1 11 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.439 -0.131 18757
668 1 11 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.559 -1.546 18757
669 1 11 . 1 1 3 3 CYS H H 3 8.899 8.899 8.421 0.478 18757
670 1 11 . 1 1 4 4 ARG N N 4 123.254 123.254 122.488 0.766 18757
671 1 11 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.696 -0.033 18757
672 1 11 . 1 1 4 4 ARG CA C 4 55.267 55.267 54.779 0.488 18757
673 1 11 . 1 1 4 4 ARG CB C 4 31.817 31.817 32.276 -0.459 18757
674 1 11 . 1 1 4 4 ARG H H 4 8.714 8.714 9.237 -0.523 18757
675 1 11 . 1 1 5 5 CYS N N 5 123.464 123.464 126.642 -3.178 18757
676 1 11 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.226 0.178 18757
677 1 11 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.253 -2.612 18757
678 1 11 . 1 1 5 5 CYS CB C 5 46.464 46.464 25.849 20.615 18757
679 1 11 . 1 1 5 5 CYS H H 5 9.020 9.020 8.917 0.103 18757
680 1 11 . 1 1 6 6 ILE N N 6 124.141 124.141 122.602 1.539 18757
681 1 11 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.609 -0.245 18757
682 1 11 . 1 1 6 6 ILE CA C 6 60.712 60.712 60.639 0.073 18757
683 1 11 . 1 1 6 6 ILE CB C 6 39.591 39.591 39.921 -0.330 18757
684 1 11 . 1 1 6 6 ILE H H 6 8.780 8.780 8.688 0.092 18757
685 1 11 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.426 -0.095 18757
686 1 11 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.239 -2.377 18757
687 1 11 . 1 1 7 7 CYS H H 7 9.135 9.135 8.562 0.573 18757
688 1 11 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.255 -0.113 18757
689 1 11 . 1 1 8 8 GLY H H 8 8.588 8.588 8.833 -0.245 18757
690 1 11 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.527 -0.397 18757
691 1 11 . 1 1 9 9 ARG CA C 9 57.376 57.376 56.786 0.590 18757
692 1 11 . 1 1 9 9 ARG CB C 9 29.621 29.621 31.229 -1.608 18757
693 1 11 . 1 1 9 9 ARG H H 9 8.873 8.873 8.581 0.292 18757
694 1 11 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.434 -0.095 18757
695 1 11 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.041 0.548 18757
696 1 11 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.422 -0.004 18757
697 1 11 . 1 1 10 10 ARG H H 10 8.382 8.382 7.888 0.494 18757
698 1 11 . 1 1 11 11 ILE N N 11 119.146 119.146 121.150 -2.004 18757
699 1 11 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.412 0.071 18757
700 1 11 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.342 -0.201 18757
701 1 11 . 1 1 11 11 ILE CB C 11 40.197 40.197 40.750 -0.553 18757
702 1 11 . 1 1 11 11 ILE H H 11 8.002 8.002 7.595 0.407 18757
703 1 11 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.640 -0.338 18757
704 1 11 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.654 -1.641 18757
705 1 11 . 1 1 12 12 CYS H H 12 8.821 8.821 8.614 0.207 18757
706 1 11 . 1 1 13 13 ARG N N 13 122.886 122.886 121.126 1.760 18757
707 1 11 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.582 0.082 18757
708 1 11 . 1 1 13 13 ARG CA C 13 55.267 55.267 56.583 -1.316 18757
709 1 11 . 1 1 13 13 ARG CB C 13 31.817 31.817 33.199 -1.382 18757
710 1 11 . 1 1 13 13 ARG H H 13 8.680 8.680 9.035 -0.355 18757
711 1 11 . 1 1 14 14 CYS N N 14 123.464 123.464 125.968 -2.504 18757
712 1 11 . 1 1 14 14 CYS HA H 14 5.404 5.404 4.981 0.423 18757
713 1 11 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.268 -2.627 18757
714 1 11 . 1 1 14 14 CYS CB C 14 46.464 46.464 25.965 20.499 18757
715 1 11 . 1 1 14 14 CYS H H 14 9.020 9.020 8.734 0.286 18757
716 1 11 . 1 1 15 15 ILE N N 15 124.141 124.141 127.270 -3.129 18757
717 1 11 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.310 0.052 18757
718 1 11 . 1 1 15 15 ILE CA C 15 60.712 60.712 60.958 -0.246 18757
719 1 11 . 1 1 15 15 ILE CB C 15 39.591 39.591 40.115 -0.524 18757
720 1 11 . 1 1 15 15 ILE H H 15 8.780 8.780 9.011 -0.231 18757
721 1 11 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.286 0.261 18757
722 1 11 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.160 -3.062 18757
723 1 11 . 1 1 16 16 CYS H H 16 8.973 8.973 9.027 -0.054 18757
724 1 11 . 1 1 17 17 GLY N N 17 111.815 111.815 113.207 -1.392 18757
725 1 11 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.510 0.551 18757
726 1 11 . 1 1 17 17 GLY H H 17 8.760 8.760 8.475 0.285 18757
727 1 12 . 1 1 2 2 ILE N N 2 120.907 120.907 122.298 -1.391 18757
728 1 12 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.469 0.025 18757
729 1 12 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.414 -0.458 18757
730 1 12 . 1 1 2 2 ILE CB C 2 40.197 40.197 40.505 -0.308 18757
731 1 12 . 1 1 2 2 ILE H H 2 7.927 7.927 7.603 0.324 18757
732 1 12 . 1 1 3 3 CYS N N 3 124.107 124.107 124.153 -0.046 18757
733 1 12 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.623 -0.315 18757
734 1 12 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.597 -1.584 18757
735 1 12 . 1 1 3 3 CYS H H 3 8.899 8.899 8.697 0.202 18757
736 1 12 . 1 1 4 4 ARG N N 4 123.254 123.254 121.216 2.038 18757
737 1 12 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.704 -0.041 18757
738 1 12 . 1 1 4 4 ARG CA C 4 55.267 55.267 55.197 0.070 18757
739 1 12 . 1 1 4 4 ARG CB C 4 31.817 31.817 33.954 -2.137 18757
740 1 12 . 1 1 4 4 ARG H H 4 8.714 8.714 9.168 -0.454 18757
741 1 12 . 1 1 5 5 CYS N N 5 123.464 123.464 122.574 0.890 18757
742 1 12 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.312 0.092 18757
743 1 12 . 1 1 5 5 CYS CA C 5 55.641 55.641 57.946 -2.305 18757
744 1 12 . 1 1 5 5 CYS CB C 5 46.464 46.464 26.069 20.395 18757
745 1 12 . 1 1 5 5 CYS H H 5 9.020 9.020 8.690 0.330 18757
746 1 12 . 1 1 6 6 ILE N N 6 124.141 124.141 122.538 1.603 18757
747 1 12 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.700 -0.336 18757
748 1 12 . 1 1 6 6 ILE CA C 6 60.712 60.712 60.062 0.650 18757
749 1 12 . 1 1 6 6 ILE CB C 6 39.591 39.591 40.321 -0.730 18757
750 1 12 . 1 1 6 6 ILE H H 6 8.780 8.780 8.763 0.017 18757
751 1 12 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.500 -0.169 18757
752 1 12 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.172 -2.310 18757
753 1 12 . 1 1 7 7 CYS H H 7 9.135 9.135 8.684 0.451 18757
754 1 12 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.146 -0.004 18757
755 1 12 . 1 1 8 8 GLY H H 8 8.588 8.588 9.040 -0.452 18757
756 1 12 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.543 -0.413 18757
757 1 12 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.252 0.124 18757
758 1 12 . 1 1 9 9 ARG CB C 9 29.621 29.621 31.042 -1.421 18757
759 1 12 . 1 1 9 9 ARG H H 9 8.873 8.873 8.509 0.364 18757
760 1 12 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.327 0.012 18757
761 1 12 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.141 0.449 18757
762 1 12 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.461 -0.043 18757
763 1 12 . 1 1 10 10 ARG H H 10 8.382 8.382 7.742 0.640 18757
764 1 12 . 1 1 11 11 ILE N N 11 119.146 119.146 122.509 -3.363 18757
765 1 12 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.200 0.283 18757
766 1 12 . 1 1 11 11 ILE CA C 11 60.141 60.141 61.372 -1.231 18757
767 1 12 . 1 1 11 11 ILE CB C 11 40.197 40.197 38.858 1.339 18757
768 1 12 . 1 1 11 11 ILE H H 11 8.002 8.002 7.773 0.229 18757
769 1 12 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.729 -0.426 18757
770 1 12 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.456 -1.444 18757
771 1 12 . 1 1 12 12 CYS H H 12 8.821 8.821 8.501 0.320 18757
772 1 12 . 1 1 13 13 ARG N N 13 122.886 122.886 121.362 1.524 18757
773 1 12 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.591 0.073 18757
774 1 12 . 1 1 13 13 ARG CA C 13 55.267 55.267 56.475 -1.208 18757
775 1 12 . 1 1 13 13 ARG CB C 13 31.817 31.817 33.413 -1.596 18757
776 1 12 . 1 1 13 13 ARG H H 13 8.680 8.680 8.995 -0.315 18757
777 1 12 . 1 1 14 14 CYS N N 14 123.464 123.464 125.338 -1.874 18757
778 1 12 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.232 0.172 18757
779 1 12 . 1 1 14 14 CYS CA C 14 55.641 55.641 57.743 -2.102 18757
780 1 12 . 1 1 14 14 CYS CB C 14 46.464 46.464 25.775 20.689 18757
781 1 12 . 1 1 14 14 CYS H H 14 9.020 9.020 8.650 0.370 18757
782 1 12 . 1 1 15 15 ILE N N 15 124.141 124.141 122.699 1.442 18757
783 1 12 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.555 -0.193 18757
784 1 12 . 1 1 15 15 ILE CA C 15 60.712 60.712 61.105 -0.393 18757
785 1 12 . 1 1 15 15 ILE CB C 15 39.591 39.591 39.568 0.023 18757
786 1 12 . 1 1 15 15 ILE H H 15 8.780 8.780 8.894 -0.114 18757
787 1 12 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.368 0.179 18757
788 1 12 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.201 -3.103 18757
789 1 12 . 1 1 16 16 CYS H H 16 8.973 8.973 8.512 0.461 18757
790 1 12 . 1 1 17 17 GLY N N 17 111.815 111.815 112.569 -0.754 18757
791 1 12 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.072 0.989 18757
792 1 12 . 1 1 17 17 GLY H H 17 8.760 8.760 8.885 -0.125 18757
793 1 13 . 1 1 2 2 ILE N N 2 120.907 120.907 122.736 -1.829 18757
794 1 13 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.332 0.162 18757
795 1 13 . 1 1 2 2 ILE CA C 2 59.956 59.956 61.010 -1.054 18757
796 1 13 . 1 1 2 2 ILE CB C 2 40.197 40.197 39.191 1.006 18757
797 1 13 . 1 1 2 2 ILE H H 2 7.927 7.927 7.648 0.279 18757
798 1 13 . 1 1 3 3 CYS N N 3 124.107 124.107 125.785 -1.678 18757
799 1 13 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.525 -0.217 18757
800 1 13 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.427 -1.414 18757
801 1 13 . 1 1 3 3 CYS H H 3 8.899 8.899 8.766 0.133 18757
802 1 13 . 1 1 4 4 ARG N N 4 123.254 123.254 120.976 2.278 18757
803 1 13 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.715 -0.052 18757
804 1 13 . 1 1 4 4 ARG CA C 4 55.267 55.267 54.200 1.067 18757
805 1 13 . 1 1 4 4 ARG CB C 4 31.817 31.817 30.798 1.019 18757
806 1 13 . 1 1 4 4 ARG H H 4 8.714 8.714 9.273 -0.559 18757
807 1 13 . 1 1 5 5 CYS N N 5 123.464 123.464 123.478 -0.014 18757
808 1 13 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.300 0.104 18757
809 1 13 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.118 -2.477 18757
810 1 13 . 1 1 5 5 CYS CB C 5 46.464 46.464 26.717 19.747 18757
811 1 13 . 1 1 5 5 CYS H H 5 9.020 9.020 8.601 0.419 18757
812 1 13 . 1 1 6 6 ILE N N 6 124.141 124.141 123.303 0.838 18757
813 1 13 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.689 -0.325 18757
814 1 13 . 1 1 6 6 ILE CA C 6 60.712 60.712 59.309 1.403 18757
815 1 13 . 1 1 6 6 ILE CB C 6 39.591 39.591 40.319 -0.728 18757
816 1 13 . 1 1 6 6 ILE H H 6 8.780 8.780 8.747 0.033 18757
817 1 13 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.240 0.091 18757
818 1 13 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.092 -2.229 18757
819 1 13 . 1 1 7 7 CYS H H 7 9.135 9.135 8.557 0.578 18757
820 1 13 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.545 -0.403 18757
821 1 13 . 1 1 8 8 GLY H H 8 8.588 8.588 8.937 -0.349 18757
822 1 13 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.546 -0.416 18757
823 1 13 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.094 0.282 18757
824 1 13 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.940 -1.319 18757
825 1 13 . 1 1 9 9 ARG H H 9 8.873 8.873 8.336 0.537 18757
826 1 13 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.389 -0.050 18757
827 1 13 . 1 1 10 10 ARG CA C 10 56.589 56.589 55.907 0.682 18757
828 1 13 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.546 -0.128 18757
829 1 13 . 1 1 10 10 ARG H H 10 8.382 8.382 7.800 0.583 18757
830 1 13 . 1 1 11 11 ILE N N 11 119.146 119.146 122.050 -2.904 18757
831 1 13 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.252 0.231 18757
832 1 13 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.667 -0.526 18757
833 1 13 . 1 1 11 11 ILE CB C 11 40.197 40.197 39.189 1.008 18757
834 1 13 . 1 1 11 11 ILE H H 11 8.002 8.002 7.607 0.395 18757
835 1 13 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.323 -0.021 18757
836 1 13 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.707 -1.694 18757
837 1 13 . 1 1 12 12 CYS H H 12 8.821 8.821 8.664 0.157 18757
838 1 13 . 1 1 13 13 ARG N N 13 122.886 122.886 121.150 1.736 18757
839 1 13 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.702 -0.038 18757
840 1 13 . 1 1 13 13 ARG CA C 13 55.267 55.267 55.299 -0.032 18757
841 1 13 . 1 1 13 13 ARG CB C 13 31.817 31.817 33.169 -1.353 18757
842 1 13 . 1 1 13 13 ARG H H 13 8.680 8.680 9.262 -0.582 18757
843 1 13 . 1 1 14 14 CYS N N 14 123.464 123.464 124.001 -0.537 18757
844 1 13 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.244 0.160 18757
845 1 13 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.404 -2.763 18757
846 1 13 . 1 1 14 14 CYS CB C 14 46.464 46.464 26.352 20.112 18757
847 1 13 . 1 1 14 14 CYS H H 14 9.020 9.020 8.895 0.125 18757
848 1 13 . 1 1 15 15 ILE N N 15 124.141 124.141 122.605 1.536 18757
849 1 13 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.717 -0.355 18757
850 1 13 . 1 1 15 15 ILE CA C 15 60.712 60.712 59.989 0.723 18757
851 1 13 . 1 1 15 15 ILE CB C 15 39.591 39.591 40.667 -1.076 18757
852 1 13 . 1 1 15 15 ILE H H 15 8.780 8.780 8.755 0.025 18757
853 1 13 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.340 0.207 18757
854 1 13 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.163 -3.065 18757
855 1 13 . 1 1 16 16 CYS H H 16 8.973 8.973 8.566 0.407 18757
856 1 13 . 1 1 17 17 GLY N N 17 111.815 111.815 111.686 0.129 18757
857 1 13 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.142 0.919 18757
858 1 13 . 1 1 17 17 GLY H H 17 8.760 8.760 8.945 -0.185 18757
859 1 14 . 1 1 2 2 ILE N N 2 120.907 120.907 122.153 -1.246 18757
860 1 14 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.428 0.066 18757
861 1 14 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.180 -0.224 18757
862 1 14 . 1 1 2 2 ILE CB C 2 40.197 40.197 40.576 -0.379 18757
863 1 14 . 1 1 2 2 ILE H H 2 7.927 7.927 7.538 0.389 18757
864 1 14 . 1 1 3 3 CYS N N 3 124.107 124.107 123.845 0.262 18757
865 1 14 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.692 -0.384 18757
866 1 14 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.593 -1.580 18757
867 1 14 . 1 1 3 3 CYS H H 3 8.899 8.899 8.650 0.249 18757
868 1 14 . 1 1 4 4 ARG N N 4 123.254 123.254 122.139 1.115 18757
869 1 14 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.685 -0.022 18757
870 1 14 . 1 1 4 4 ARG CA C 4 55.267 55.267 54.200 1.067 18757
871 1 14 . 1 1 4 4 ARG CB C 4 31.817 31.817 33.092 -1.275 18757
872 1 14 . 1 1 4 4 ARG H H 4 8.714 8.714 9.158 -0.444 18757
873 1 14 . 1 1 5 5 CYS N N 5 123.464 123.464 124.250 -0.786 18757
874 1 14 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.091 0.313 18757
875 1 14 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.616 -2.975 18757
876 1 14 . 1 1 5 5 CYS CB C 5 46.464 46.464 26.136 20.328 18757
877 1 14 . 1 1 5 5 CYS H H 5 9.020 9.020 8.881 0.139 18757
878 1 14 . 1 1 6 6 ILE N N 6 124.141 124.141 126.846 -2.705 18757
879 1 14 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.214 0.150 18757
880 1 14 . 1 1 6 6 ILE CA C 6 60.712 60.712 61.531 -0.818 18757
881 1 14 . 1 1 6 6 ILE CB C 6 39.591 39.591 39.447 0.144 18757
882 1 14 . 1 1 6 6 ILE H H 6 8.780 8.780 8.744 0.036 18757
883 1 14 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.557 -0.226 18757
884 1 14 . 1 1 7 7 CYS CA C 7 55.862 55.862 57.894 -2.032 18757
885 1 14 . 1 1 7 7 CYS H H 7 9.135 9.135 8.616 0.519 18757
886 1 14 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.006 0.136 18757
887 1 14 . 1 1 8 8 GLY H H 8 8.588 8.588 8.934 -0.346 18757
888 1 14 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.349 -0.219 18757
889 1 14 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.999 -0.623 18757
890 1 14 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.477 -0.856 18757
891 1 14 . 1 1 9 9 ARG H H 9 8.873 8.873 8.616 0.257 18757
892 1 14 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.431 -0.092 18757
893 1 14 . 1 1 10 10 ARG CA C 10 56.589 56.589 55.927 0.662 18757
894 1 14 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.362 0.056 18757
895 1 14 . 1 1 10 10 ARG H H 10 8.382 8.382 7.927 0.455 18757
896 1 14 . 1 1 11 11 ILE N N 11 119.146 119.146 122.284 -3.138 18757
897 1 14 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.383 0.100 18757
898 1 14 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.433 -0.292 18757
899 1 14 . 1 1 11 11 ILE CB C 11 40.197 40.197 39.954 0.243 18757
900 1 14 . 1 1 11 11 ILE H H 11 8.002 8.002 7.656 0.346 18757
901 1 14 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.774 -0.472 18757
902 1 14 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.714 -1.701 18757
903 1 14 . 1 1 12 12 CYS H H 12 8.821 8.821 8.664 0.157 18757
904 1 14 . 1 1 13 13 ARG N N 13 122.886 122.886 121.252 1.634 18757
905 1 14 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.588 0.076 18757
906 1 14 . 1 1 13 13 ARG CA C 13 55.267 55.267 56.624 -1.357 18757
907 1 14 . 1 1 13 13 ARG CB C 13 31.817 31.817 33.464 -1.647 18757
908 1 14 . 1 1 13 13 ARG H H 13 8.680 8.680 8.936 -0.256 18757
909 1 14 . 1 1 14 14 CYS N N 14 123.464 123.464 124.592 -1.128 18757
910 1 14 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.233 0.171 18757
911 1 14 . 1 1 14 14 CYS CA C 14 55.641 55.641 57.874 -2.233 18757
912 1 14 . 1 1 14 14 CYS CB C 14 46.464 46.464 26.612 19.852 18757
913 1 14 . 1 1 14 14 CYS H H 14 9.020 9.020 8.619 0.401 18757
914 1 14 . 1 1 15 15 ILE N N 15 124.141 124.141 126.911 -2.770 18757
915 1 14 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.319 0.043 18757
916 1 14 . 1 1 15 15 ILE CA C 15 60.712 60.712 60.347 0.365 18757
917 1 14 . 1 1 15 15 ILE CB C 15 39.591 39.591 39.970 -0.379 18757
918 1 14 . 1 1 15 15 ILE H H 15 8.780 8.780 9.036 -0.256 18757
919 1 14 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.421 0.126 18757
920 1 14 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.153 -3.055 18757
921 1 14 . 1 1 16 16 CYS H H 16 8.973 8.973 9.012 -0.039 18757
922 1 14 . 1 1 17 17 GLY N N 17 111.815 111.815 113.987 -2.172 18757
923 1 14 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.313 0.748 18757
924 1 14 . 1 1 17 17 GLY H H 17 8.760 8.760 8.853 -0.093 18757
925 1 15 . 1 1 2 2 ILE N N 2 120.907 120.907 121.105 -0.198 18757
926 1 15 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.418 0.076 18757
927 1 15 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.330 -0.374 18757
928 1 15 . 1 1 2 2 ILE CB C 2 40.197 40.197 40.922 -0.725 18757
929 1 15 . 1 1 2 2 ILE H H 2 7.927 7.927 7.537 0.390 18757
930 1 15 . 1 1 3 3 CYS N N 3 124.107 124.107 123.190 0.917 18757
931 1 15 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.184 0.124 18757
932 1 15 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.892 -1.879 18757
933 1 15 . 1 1 3 3 CYS H H 3 8.899 8.899 8.803 0.096 18757
934 1 15 . 1 1 4 4 ARG N N 4 123.254 123.254 121.965 1.289 18757
935 1 15 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.726 -0.063 18757
936 1 15 . 1 1 4 4 ARG CA C 4 55.267 55.267 55.094 0.173 18757
937 1 15 . 1 1 4 4 ARG CB C 4 31.817 31.817 32.542 -0.725 18757
938 1 15 . 1 1 4 4 ARG H H 4 8.714 8.714 9.047 -0.333 18757
939 1 15 . 1 1 5 5 CYS N N 5 123.464 123.464 123.117 0.347 18757
940 1 15 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.514 -0.110 18757
941 1 15 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.109 -2.468 18757
942 1 15 . 1 1 5 5 CYS CB C 5 46.464 46.464 28.138 18.326 18757
943 1 15 . 1 1 5 5 CYS H H 5 9.020 9.020 8.908 0.112 18757
944 1 15 . 1 1 6 6 ILE N N 6 124.141 124.141 123.045 1.096 18757
945 1 15 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.741 -0.377 18757
946 1 15 . 1 1 6 6 ILE CA C 6 60.712 60.712 60.238 0.474 18757
947 1 15 . 1 1 6 6 ILE CB C 6 39.591 39.591 39.801 -0.210 18757
948 1 15 . 1 1 6 6 ILE H H 6 8.780 8.780 9.031 -0.251 18757
949 1 15 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.341 -0.010 18757
950 1 15 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.315 -2.453 18757
951 1 15 . 1 1 7 7 CYS H H 7 9.135 9.135 8.687 0.448 18757
952 1 15 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.238 -0.096 18757
953 1 15 . 1 1 8 8 GLY H H 8 8.588 8.588 8.914 -0.326 18757
954 1 15 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.546 -0.416 18757
955 1 15 . 1 1 9 9 ARG CA C 9 57.376 57.376 56.143 1.233 18757
956 1 15 . 1 1 9 9 ARG CB C 9 29.621 29.621 31.521 -1.900 18757
957 1 15 . 1 1 9 9 ARG H H 9 8.873 8.873 8.130 0.743 18757
958 1 15 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.436 -0.097 18757
959 1 15 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.736 -0.147 18757
960 1 15 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.278 0.140 18757
961 1 15 . 1 1 10 10 ARG H H 10 8.382 8.382 7.886 0.496 18757
962 1 15 . 1 1 11 11 ILE N N 11 119.146 119.146 122.125 -2.979 18757
963 1 15 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.298 0.185 18757
964 1 15 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.876 -0.735 18757
965 1 15 . 1 1 11 11 ILE CB C 11 40.197 40.197 38.896 1.301 18757
966 1 15 . 1 1 11 11 ILE H H 11 8.002 8.002 7.873 0.129 18757
967 1 15 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.459 -0.157 18757
968 1 15 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.568 -1.555 18757
969 1 15 . 1 1 12 12 CYS H H 12 8.821 8.821 8.501 0.320 18757
970 1 15 . 1 1 13 13 ARG N N 13 122.886 122.886 120.427 2.459 18757
971 1 15 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.674 -0.010 18757
972 1 15 . 1 1 13 13 ARG CA C 13 55.267 55.267 55.264 0.003 18757
973 1 15 . 1 1 13 13 ARG CB C 13 31.817 31.817 32.454 -0.637 18757
974 1 15 . 1 1 13 13 ARG H H 13 8.680 8.680 9.114 -0.434 18757
975 1 15 . 1 1 14 14 CYS N N 14 123.464 123.464 123.838 -0.374 18757
976 1 15 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.357 0.047 18757
977 1 15 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.018 -2.377 18757
978 1 15 . 1 1 14 14 CYS CB C 14 46.464 46.464 28.097 18.367 18757
979 1 15 . 1 1 14 14 CYS H H 14 9.020 9.020 8.736 0.284 18757
980 1 15 . 1 1 15 15 ILE N N 15 124.141 124.141 127.190 -3.049 18757
981 1 15 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.387 -0.025 18757
982 1 15 . 1 1 15 15 ILE CA C 15 60.712 60.712 59.174 1.538 18757
983 1 15 . 1 1 15 15 ILE CB C 15 39.591 39.591 38.602 0.989 18757
984 1 15 . 1 1 15 15 ILE H H 15 8.780 8.780 9.298 -0.518 18757
985 1 15 . 1 1 16 16 CYS HA H 16 5.547 5.547 4.943 0.604 18757
986 1 15 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.419 -3.321 18757
987 1 15 . 1 1 16 16 CYS H H 16 8.973 8.973 9.127 -0.154 18757
988 1 15 . 1 1 17 17 GLY N N 17 111.815 111.815 114.277 -2.462 18757
989 1 15 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.538 0.523 18757
990 1 15 . 1 1 17 17 GLY H H 17 8.760 8.760 9.088 -0.328 18757
991 1 16 . 1 1 2 2 ILE N N 2 120.907 120.907 121.956 -1.049 18757
992 1 16 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.361 0.133 18757
993 1 16 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.517 -0.561 18757
994 1 16 . 1 1 2 2 ILE CB C 2 40.197 40.197 39.612 0.585 18757
995 1 16 . 1 1 2 2 ILE H H 2 7.927 7.927 7.622 0.305 18757
996 1 16 . 1 1 3 3 CYS N N 3 124.107 124.107 124.265 -0.158 18757
997 1 16 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.267 0.041 18757
998 1 16 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.937 -1.923 18757
999 1 16 . 1 1 3 3 CYS H H 3 8.899 8.899 8.767 0.132 18757
1000 1 16 . 1 1 4 4 ARG N N 4 123.254 123.254 122.463 0.791 18757
1001 1 16 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.710 -0.047 18757
1002 1 16 . 1 1 4 4 ARG CA C 4 55.267 55.267 55.171 0.096 18757
1003 1 16 . 1 1 4 4 ARG CB C 4 31.817 31.817 33.154 -1.337 18757
1004 1 16 . 1 1 4 4 ARG H H 4 8.714 8.714 8.860 -0.146 18757
1005 1 16 . 1 1 5 5 CYS N N 5 123.464 123.464 126.396 -2.932 18757
1006 1 16 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.107 0.297 18757
1007 1 16 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.317 -2.676 18757
1008 1 16 . 1 1 5 5 CYS CB C 5 46.464 46.464 25.711 20.753 18757
1009 1 16 . 1 1 5 5 CYS H H 5 9.020 9.020 8.924 0.096 18757
1010 1 16 . 1 1 6 6 ILE N N 6 124.141 124.141 122.247 1.894 18757
1011 1 16 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.716 -0.352 18757
1012 1 16 . 1 1 6 6 ILE CA C 6 60.712 60.712 59.925 0.787 18757
1013 1 16 . 1 1 6 6 ILE CB C 6 39.591 39.591 40.879 -1.288 18757
1014 1 16 . 1 1 6 6 ILE H H 6 8.780 8.780 8.834 -0.054 18757
1015 1 16 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.358 -0.027 18757
1016 1 16 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.161 -2.299 18757
1017 1 16 . 1 1 7 7 CYS H H 7 9.135 9.135 8.538 0.597 18757
1018 1 16 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.574 -0.432 18757
1019 1 16 . 1 1 8 8 GLY H H 8 8.588 8.588 8.986 -0.398 18757
1020 1 16 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.320 -0.190 18757
1021 1 16 . 1 1 9 9 ARG CA C 9 57.376 57.376 58.418 -1.042 18757
1022 1 16 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.447 -0.826 18757
1023 1 16 . 1 1 9 9 ARG H H 9 8.873 8.873 8.535 0.338 18757
1024 1 16 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.400 -0.061 18757
1025 1 16 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.098 0.491 18757
1026 1 16 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.496 -0.078 18757
1027 1 16 . 1 1 10 10 ARG H H 10 8.382 8.382 7.972 0.410 18757
1028 1 16 . 1 1 11 11 ILE N N 11 119.146 119.146 122.464 -3.318 18757
1029 1 16 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.360 0.123 18757
1030 1 16 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.455 -0.314 18757
1031 1 16 . 1 1 11 11 ILE CB C 11 40.197 40.197 39.710 0.487 18757
1032 1 16 . 1 1 11 11 ILE H H 11 8.002 8.002 7.654 0.348 18757
1033 1 16 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.551 -0.249 18757
1034 1 16 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.447 -1.435 18757
1035 1 16 . 1 1 12 12 CYS H H 12 8.821 8.821 8.758 0.063 18757
1036 1 16 . 1 1 13 13 ARG N N 13 122.886 122.886 119.057 3.829 18757
1037 1 16 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.707 -0.043 18757
1038 1 16 . 1 1 13 13 ARG CA C 13 55.267 55.267 55.178 0.089 18757
1039 1 16 . 1 1 13 13 ARG CB C 13 31.817 31.817 31.820 -0.003 18757
1040 1 16 . 1 1 13 13 ARG H H 13 8.680 8.680 9.197 -0.517 18757
1041 1 16 . 1 1 14 14 CYS N N 14 123.464 123.464 123.592 -0.128 18757
1042 1 16 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.186 0.218 18757
1043 1 16 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.191 -2.550 18757
1044 1 16 . 1 1 14 14 CYS CB C 14 46.464 46.464 26.206 20.258 18757
1045 1 16 . 1 1 14 14 CYS H H 14 9.020 9.020 8.822 0.198 18757
1046 1 16 . 1 1 15 15 ILE N N 15 124.141 124.141 126.768 -2.627 18757
1047 1 16 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.430 -0.068 18757
1048 1 16 . 1 1 15 15 ILE CA C 15 60.712 60.712 60.776 -0.064 18757
1049 1 16 . 1 1 15 15 ILE CB C 15 39.591 39.591 40.288 -0.697 18757
1050 1 16 . 1 1 15 15 ILE H H 15 8.780 8.780 8.861 -0.081 18757
1051 1 16 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.495 0.052 18757
1052 1 16 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.513 -3.415 18757
1053 1 16 . 1 1 16 16 CYS H H 16 8.973 8.973 9.035 -0.062 18757
1054 1 16 . 1 1 17 17 GLY N N 17 111.815 111.815 112.988 -1.173 18757
1055 1 16 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.389 0.672 18757
1056 1 16 . 1 1 17 17 GLY H H 17 8.760 8.760 8.680 0.080 18757
1057 1 17 . 1 1 2 2 ILE N N 2 120.907 120.907 120.627 0.280 18757
1058 1 17 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.340 0.154 18757
1059 1 17 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.280 -0.324 18757
1060 1 17 . 1 1 2 2 ILE CB C 2 40.197 40.197 41.876 -1.679 18757
1061 1 17 . 1 1 2 2 ILE H H 2 7.927 7.927 7.528 0.399 18757
1062 1 17 . 1 1 3 3 CYS N N 3 124.107 124.107 122.627 1.480 18757
1063 1 17 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.292 0.016 18757
1064 1 17 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.587 -1.574 18757
1065 1 17 . 1 1 3 3 CYS H H 3 8.899 8.899 8.352 0.547 18757
1066 1 17 . 1 1 4 4 ARG N N 4 123.254 123.254 123.090 0.164 18757
1067 1 17 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.738 -0.075 18757
1068 1 17 . 1 1 4 4 ARG CA C 4 55.267 55.267 55.146 0.121 18757
1069 1 17 . 1 1 4 4 ARG CB C 4 31.817 31.817 33.459 -1.642 18757
1070 1 17 . 1 1 4 4 ARG H H 4 8.714 8.714 9.191 -0.477 18757
1071 1 17 . 1 1 5 5 CYS N N 5 123.464 123.464 126.416 -2.952 18757
1072 1 17 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.081 0.323 18757
1073 1 17 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.353 -2.712 18757
1074 1 17 . 1 1 5 5 CYS CB C 5 46.464 46.464 26.294 20.170 18757
1075 1 17 . 1 1 5 5 CYS H H 5 9.020 9.020 8.915 0.105 18757
1076 1 17 . 1 1 6 6 ILE N N 6 124.141 124.141 126.902 -2.761 18757
1077 1 17 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.274 0.090 18757
1078 1 17 . 1 1 6 6 ILE CA C 6 60.712 60.712 59.977 0.735 18757
1079 1 17 . 1 1 6 6 ILE CB C 6 39.591 39.591 38.751 0.840 18757
1080 1 17 . 1 1 6 6 ILE H H 6 8.780 8.780 9.154 -0.374 18757
1081 1 17 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.096 0.235 18757
1082 1 17 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.153 -2.291 18757
1083 1 17 . 1 1 7 7 CYS H H 7 9.135 9.135 8.791 0.344 18757
1084 1 17 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.569 -0.427 18757
1085 1 17 . 1 1 8 8 GLY H H 8 8.588 8.588 9.075 -0.487 18757
1086 1 17 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.403 -0.273 18757
1087 1 17 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.533 -0.157 18757
1088 1 17 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.731 -1.110 18757
1089 1 17 . 1 1 9 9 ARG H H 9 8.873 8.873 8.483 0.390 18757
1090 1 17 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.421 -0.082 18757
1091 1 17 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.215 0.374 18757
1092 1 17 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.485 -0.067 18757
1093 1 17 . 1 1 10 10 ARG H H 10 8.382 8.382 8.023 0.359 18757
1094 1 17 . 1 1 11 11 ILE N N 11 119.146 119.146 121.850 -2.704 18757
1095 1 17 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.395 0.088 18757
1096 1 17 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.352 -0.212 18757
1097 1 17 . 1 1 11 11 ILE CB C 11 40.197 40.197 40.165 0.032 18757
1098 1 17 . 1 1 11 11 ILE H H 11 8.002 8.002 7.634 0.368 18757
1099 1 17 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.616 -0.314 18757
1100 1 17 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.523 -1.510 18757
1101 1 17 . 1 1 12 12 CYS H H 12 8.821 8.821 8.758 0.063 18757
1102 1 17 . 1 1 13 13 ARG N N 13 122.886 122.886 118.371 4.515 18757
1103 1 17 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.660 0.004 18757
1104 1 17 . 1 1 13 13 ARG CA C 13 55.267 55.267 55.502 -0.235 18757
1105 1 17 . 1 1 13 13 ARG CB C 13 31.817 31.817 31.767 0.050 18757
1106 1 17 . 1 1 13 13 ARG H H 13 8.680 8.680 9.095 -0.415 18757
1107 1 17 . 1 1 14 14 CYS N N 14 123.464 123.464 123.393 0.071 18757
1108 1 17 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.166 0.238 18757
1109 1 17 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.109 -2.468 18757
1110 1 17 . 1 1 14 14 CYS CB C 14 46.464 46.464 26.115 20.349 18757
1111 1 17 . 1 1 14 14 CYS H H 14 9.020 9.020 8.796 0.224 18757
1112 1 17 . 1 1 15 15 ILE N N 15 124.141 124.141 127.239 -3.098 18757
1113 1 17 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.327 0.035 18757
1114 1 17 . 1 1 15 15 ILE CA C 15 60.712 60.712 61.163 -0.451 18757
1115 1 17 . 1 1 15 15 ILE CB C 15 39.591 39.591 39.797 -0.206 18757
1116 1 17 . 1 1 15 15 ILE H H 15 8.780 8.780 9.158 -0.378 18757
1117 1 17 . 1 1 16 16 CYS HA H 16 5.547 5.547 4.902 0.645 18757
1118 1 17 . 1 1 16 16 CYS CA C 16 55.098 55.098 57.739 -2.641 18757
1119 1 17 . 1 1 16 16 CYS H H 16 8.973 8.973 9.024 -0.051 18757
1120 1 17 . 1 1 17 17 GLY N N 17 111.815 111.815 110.935 0.880 18757
1121 1 17 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.189 0.872 18757
1122 1 17 . 1 1 17 17 GLY H H 17 8.760 8.760 8.532 0.228 18757
1123 1 18 . 1 1 2 2 ILE N N 2 120.907 120.907 121.258 -0.351 18757
1124 1 18 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.550 -0.056 18757
1125 1 18 . 1 1 2 2 ILE CA C 2 59.956 59.956 59.507 0.449 18757
1126 1 18 . 1 1 2 2 ILE CB C 2 40.197 40.197 41.461 -1.264 18757
1127 1 18 . 1 1 2 2 ILE H H 2 7.927 7.927 7.586 0.341 18757
1128 1 18 . 1 1 3 3 CYS N N 3 124.107 124.107 122.707 1.400 18757
1129 1 18 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.181 0.127 18757
1130 1 18 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.554 -1.542 18757
1131 1 18 . 1 1 3 3 CYS H H 3 8.899 8.899 8.536 0.363 18757
1132 1 18 . 1 1 4 4 ARG N N 4 123.254 123.254 122.942 0.312 18757
1133 1 18 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.687 -0.024 18757
1134 1 18 . 1 1 4 4 ARG CA C 4 55.267 55.267 55.085 0.182 18757
1135 1 18 . 1 1 4 4 ARG CB C 4 31.817 31.817 31.457 0.360 18757
1136 1 18 . 1 1 4 4 ARG H H 4 8.714 8.714 9.235 -0.521 18757
1137 1 18 . 1 1 5 5 CYS N N 5 123.464 123.464 127.039 -3.575 18757
1138 1 18 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.052 0.352 18757
1139 1 18 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.234 -2.593 18757
1140 1 18 . 1 1 5 5 CYS CB C 5 46.464 46.464 26.367 20.096 18757
1141 1 18 . 1 1 5 5 CYS H H 5 9.020 9.020 9.030 -0.010 18757
1142 1 18 . 1 1 6 6 ILE N N 6 124.141 124.141 127.384 -3.243 18757
1143 1 18 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.136 0.228 18757
1144 1 18 . 1 1 6 6 ILE CA C 6 60.712 60.712 60.345 0.367 18757
1145 1 18 . 1 1 6 6 ILE CB C 6 39.591 39.591 36.610 2.981 18757
1146 1 18 . 1 1 6 6 ILE H H 6 8.780 8.780 8.861 -0.081 18757
1147 1 18 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.479 -0.148 18757
1148 1 18 . 1 1 7 7 CYS CA C 7 55.862 55.862 57.771 -1.909 18757
1149 1 18 . 1 1 7 7 CYS H H 7 9.135 9.135 8.696 0.439 18757
1150 1 18 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.037 0.105 18757
1151 1 18 . 1 1 8 8 GLY H H 8 8.588 8.588 9.019 -0.431 18757
1152 1 18 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.349 -0.219 18757
1153 1 18 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.816 -0.440 18757
1154 1 18 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.637 -1.016 18757
1155 1 18 . 1 1 9 9 ARG H H 9 8.873 8.873 8.475 0.398 18757
1156 1 18 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.433 -0.094 18757
1157 1 18 . 1 1 10 10 ARG CA C 10 56.589 56.589 55.949 0.640 18757
1158 1 18 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.755 -0.337 18757
1159 1 18 . 1 1 10 10 ARG H H 10 8.382 8.382 7.874 0.508 18757
1160 1 18 . 1 1 11 11 ILE N N 11 119.146 119.146 121.963 -2.817 18757
1161 1 18 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.329 0.154 18757
1162 1 18 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.466 -0.325 18757
1163 1 18 . 1 1 11 11 ILE CB C 11 40.197 40.197 39.656 0.541 18757
1164 1 18 . 1 1 11 11 ILE H H 11 8.002 8.002 7.622 0.380 18757
1165 1 18 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.709 -0.407 18757
1166 1 18 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.733 -1.720 18757
1167 1 18 . 1 1 12 12 CYS H H 12 8.821 8.821 8.556 0.265 18757
1168 1 18 . 1 1 13 13 ARG N N 13 122.886 122.886 121.636 1.250 18757
1169 1 18 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.576 0.088 18757
1170 1 18 . 1 1 13 13 ARG CA C 13 55.267 55.267 56.021 -0.754 18757
1171 1 18 . 1 1 13 13 ARG CB C 13 31.817 31.817 31.864 -0.047 18757
1172 1 18 . 1 1 13 13 ARG H H 13 8.680 8.680 8.811 -0.131 18757
1173 1 18 . 1 1 14 14 CYS N N 14 123.464 123.464 126.129 -2.665 18757
1174 1 18 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.085 0.319 18757
1175 1 18 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.162 -2.521 18757
1176 1 18 . 1 1 14 14 CYS CB C 14 46.464 46.464 26.750 19.715 18757
1177 1 18 . 1 1 14 14 CYS H H 14 9.020 9.020 8.675 0.345 18757
1178 1 18 . 1 1 15 15 ILE N N 15 124.141 124.141 127.478 -3.337 18757
1179 1 18 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.301 0.061 18757
1180 1 18 . 1 1 15 15 ILE CA C 15 60.712 60.712 60.251 0.461 18757
1181 1 18 . 1 1 15 15 ILE CB C 15 39.591 39.591 39.506 0.085 18757
1182 1 18 . 1 1 15 15 ILE H H 15 8.780 8.780 8.987 -0.207 18757
1183 1 18 . 1 1 16 16 CYS HA H 16 5.547 5.547 4.955 0.592 18757
1184 1 18 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.805 -3.707 18757
1185 1 18 . 1 1 16 16 CYS H H 16 8.973 8.973 9.080 -0.107 18757
1186 1 18 . 1 1 17 17 GLY N N 17 111.815 111.815 113.229 -1.414 18757
1187 1 18 . 1 1 17 17 GLY CA C 17 46.061 46.061 44.578 1.483 18757
1188 1 18 . 1 1 17 17 GLY H H 17 8.760 8.760 8.844 -0.084 18757
1189 1 19 . 1 1 2 2 ILE N N 2 120.907 120.907 121.652 -0.745 18757
1190 1 19 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.447 0.047 18757
1191 1 19 . 1 1 2 2 ILE CA C 2 59.956 59.956 59.692 0.264 18757
1192 1 19 . 1 1 2 2 ILE CB C 2 40.197 40.197 40.209 -0.012 18757
1193 1 19 . 1 1 2 2 ILE H H 2 7.927 7.927 7.657 0.270 18757
1194 1 19 . 1 1 3 3 CYS N N 3 124.107 124.107 126.318 -2.211 18757
1195 1 19 . 1 1 3 3 CYS HA H 3 5.308 5.308 4.858 0.450 18757
1196 1 19 . 1 1 3 3 CYS CA C 3 56.013 56.013 58.198 -2.185 18757
1197 1 19 . 1 1 3 3 CYS H H 3 8.899 8.899 8.729 0.170 18757
1198 1 19 . 1 1 4 4 ARG N N 4 123.254 123.254 123.965 -0.711 18757
1199 1 19 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.626 0.037 18757
1200 1 19 . 1 1 4 4 ARG CA C 4 55.267 55.267 55.206 0.061 18757
1201 1 19 . 1 1 4 4 ARG CB C 4 31.817 31.817 31.609 0.208 18757
1202 1 19 . 1 1 4 4 ARG H H 4 8.714 8.714 8.942 -0.228 18757
1203 1 19 . 1 1 5 5 CYS N N 5 123.464 123.464 126.546 -3.082 18757
1204 1 19 . 1 1 5 5 CYS HA H 5 5.404 5.404 4.856 0.548 18757
1205 1 19 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.498 -2.857 18757
1206 1 19 . 1 1 5 5 CYS CB C 5 46.464 46.464 25.643 20.821 18757
1207 1 19 . 1 1 5 5 CYS H H 5 9.020 9.020 8.972 0.048 18757
1208 1 19 . 1 1 6 6 ILE N N 6 124.141 124.141 123.044 1.097 18757
1209 1 19 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.660 -0.296 18757
1210 1 19 . 1 1 6 6 ILE CA C 6 60.712 60.712 60.295 0.417 18757
1211 1 19 . 1 1 6 6 ILE CB C 6 39.591 39.591 39.680 -0.089 18757
1212 1 19 . 1 1 6 6 ILE H H 6 8.780 8.780 8.695 0.085 18757
1213 1 19 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.252 0.079 18757
1214 1 19 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.191 -2.329 18757
1215 1 19 . 1 1 7 7 CYS H H 7 9.135 9.135 8.814 0.321 18757
1216 1 19 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.133 0.009 18757
1217 1 19 . 1 1 8 8 GLY H H 8 8.588 8.588 8.691 -0.103 18757
1218 1 19 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.376 -0.246 18757
1219 1 19 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.597 -0.221 18757
1220 1 19 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.495 -0.874 18757
1221 1 19 . 1 1 9 9 ARG H H 9 8.873 8.873 8.478 0.395 18757
1222 1 19 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.413 -0.074 18757
1223 1 19 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.079 0.510 18757
1224 1 19 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.505 -0.087 18757
1225 1 19 . 1 1 10 10 ARG H H 10 8.382 8.382 8.085 0.297 18757
1226 1 19 . 1 1 11 11 ILE N N 11 119.146 119.146 122.548 -3.402 18757
1227 1 19 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.308 0.175 18757
1228 1 19 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.597 -0.456 18757
1229 1 19 . 1 1 11 11 ILE CB C 11 40.197 40.197 39.263 0.934 18757
1230 1 19 . 1 1 11 11 ILE H H 11 8.002 8.002 7.649 0.353 18757
1231 1 19 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.211 0.091 18757
1232 1 19 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.718 -1.705 18757
1233 1 19 . 1 1 12 12 CYS H H 12 8.821 8.821 8.724 0.097 18757
1234 1 19 . 1 1 13 13 ARG N N 13 122.886 122.886 121.424 1.462 18757
1235 1 19 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.671 -0.007 18757
1236 1 19 . 1 1 13 13 ARG CA C 13 55.267 55.267 54.879 0.388 18757
1237 1 19 . 1 1 13 13 ARG CB C 13 31.817 31.817 31.626 0.191 18757
1238 1 19 . 1 1 13 13 ARG H H 13 8.680 8.680 9.155 -0.475 18757
1239 1 19 . 1 1 14 14 CYS N N 14 123.464 123.464 124.462 -0.998 18757
1240 1 19 . 1 1 14 14 CYS HA H 14 5.404 5.404 4.840 0.564 18757
1241 1 19 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.479 -2.838 18757
1242 1 19 . 1 1 14 14 CYS CB C 14 46.464 46.464 25.997 20.467 18757
1243 1 19 . 1 1 14 14 CYS H H 14 9.020 9.020 9.112 -0.092 18757
1244 1 19 . 1 1 15 15 ILE N N 15 124.141 124.141 122.391 1.750 18757
1245 1 19 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.612 -0.250 18757
1246 1 19 . 1 1 15 15 ILE CA C 15 60.712 60.712 59.878 0.834 18757
1247 1 19 . 1 1 15 15 ILE CB C 15 39.591 39.591 38.799 0.792 18757
1248 1 19 . 1 1 15 15 ILE H H 15 8.780 8.780 8.607 0.173 18757
1249 1 19 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.322 0.225 18757
1250 1 19 . 1 1 16 16 CYS CA C 16 55.098 55.098 59.252 -4.154 18757
1251 1 19 . 1 1 16 16 CYS H H 16 8.973 8.973 9.090 -0.117 18757
1252 1 19 . 1 1 17 17 GLY N N 17 111.815 111.815 109.253 2.562 18757
1253 1 19 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.678 0.383 18757
1254 1 19 . 1 1 17 17 GLY H H 17 8.760 8.760 8.614 0.146 18757
1255 1 20 . 1 1 2 2 ILE N N 2 120.907 120.907 119.347 1.560 18757
1256 1 20 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.297 0.197 18757
1257 1 20 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.456 -0.500 18757
1258 1 20 . 1 1 2 2 ILE CB C 2 40.197 40.197 42.171 -1.974 18757
1259 1 20 . 1 1 2 2 ILE H H 2 7.927 7.927 7.474 0.453 18757
1260 1 20 . 1 1 3 3 CYS N N 3 124.107 124.107 121.506 2.601 18757
1261 1 20 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.398 -0.090 18757
1262 1 20 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.253 -1.240 18757
1263 1 20 . 1 1 3 3 CYS H H 3 8.899 8.899 8.381 0.518 18757
1264 1 20 . 1 1 4 4 ARG N N 4 123.254 123.254 121.600 1.654 18757
1265 1 20 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.688 -0.025 18757
1266 1 20 . 1 1 4 4 ARG CA C 4 55.267 55.267 53.714 1.553 18757
1267 1 20 . 1 1 4 4 ARG CB C 4 31.817 31.817 31.884 -0.067 18757
1268 1 20 . 1 1 4 4 ARG H H 4 8.714 8.714 9.073 -0.359 18757
1269 1 20 . 1 1 5 5 CYS N N 5 123.464 123.464 124.447 -0.983 18757
1270 1 20 . 1 1 5 5 CYS HA H 5 5.404 5.404 4.988 0.416 18757
1271 1 20 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.926 -3.285 18757
1272 1 20 . 1 1 5 5 CYS CB C 5 46.464 46.464 25.773 20.691 18757
1273 1 20 . 1 1 5 5 CYS H H 5 9.020 9.020 8.948 0.072 18757
1274 1 20 . 1 1 6 6 ILE N N 6 124.141 124.141 122.405 1.736 18757
1275 1 20 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.751 -0.387 18757
1276 1 20 . 1 1 6 6 ILE CA C 6 60.712 60.712 59.790 0.922 18757
1277 1 20 . 1 1 6 6 ILE CB C 6 39.591 39.591 41.218 -1.627 18757
1278 1 20 . 1 1 6 6 ILE H H 6 8.780 8.780 8.711 0.069 18757
1279 1 20 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.443 -0.112 18757
1280 1 20 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.246 -2.384 18757
1281 1 20 . 1 1 7 7 CYS H H 7 9.135 9.135 8.621 0.514 18757
1282 1 20 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.873 -0.731 18757
1283 1 20 . 1 1 8 8 GLY H H 8 8.588 8.588 9.052 -0.464 18757
1284 1 20 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.468 -0.338 18757
1285 1 20 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.280 0.096 18757
1286 1 20 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.795 -1.174 18757
1287 1 20 . 1 1 9 9 ARG H H 9 8.873 8.873 8.256 0.617 18757
1288 1 20 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.459 -0.120 18757
1289 1 20 . 1 1 10 10 ARG CA C 10 56.589 56.589 55.852 0.737 18757
1290 1 20 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.669 -0.251 18757
1291 1 20 . 1 1 10 10 ARG H H 10 8.382 8.382 8.134 0.248 18757
1292 1 20 . 1 1 11 11 ILE N N 11 119.146 119.146 122.267 -3.121 18757
1293 1 20 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.225 0.258 18757
1294 1 20 . 1 1 11 11 ILE CA C 11 60.141 60.141 61.001 -0.860 18757
1295 1 20 . 1 1 11 11 ILE CB C 11 40.197 40.197 39.022 1.175 18757
1296 1 20 . 1 1 11 11 ILE H H 11 8.002 8.002 7.630 0.372 18757
1297 1 20 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.585 -0.283 18757
1298 1 20 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.593 -1.580 18757
1299 1 20 . 1 1 12 12 CYS H H 12 8.821 8.821 8.556 0.265 18757
1300 1 20 . 1 1 13 13 ARG N N 13 122.886 122.886 121.356 1.530 18757
1301 1 20 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.580 0.084 18757
1302 1 20 . 1 1 13 13 ARG CA C 13 55.267 55.267 55.813 -0.546 18757
1303 1 20 . 1 1 13 13 ARG CB C 13 31.817 31.817 32.506 -0.689 18757
1304 1 20 . 1 1 13 13 ARG H H 13 8.680 8.680 9.107 -0.427 18757
1305 1 20 . 1 1 14 14 CYS N N 14 123.464 123.464 126.182 -2.718 18757
1306 1 20 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.083 0.321 18757
1307 1 20 . 1 1 14 14 CYS CA C 14 55.641 55.641 57.988 -2.347 18757
1308 1 20 . 1 1 14 14 CYS CB C 14 46.464 46.464 25.877 20.587 18757
1309 1 20 . 1 1 14 14 CYS H H 14 9.020 9.020 8.704 0.316 18757
1310 1 20 . 1 1 15 15 ILE N N 15 124.141 124.141 126.756 -2.615 18757
1311 1 20 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.309 0.053 18757
1312 1 20 . 1 1 15 15 ILE CA C 15 60.712 60.712 61.347 -0.635 18757
1313 1 20 . 1 1 15 15 ILE CB C 15 39.591 39.591 39.453 0.138 18757
1314 1 20 . 1 1 15 15 ILE H H 15 8.780 8.780 8.884 -0.104 18757
1315 1 20 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.071 0.476 18757
1316 1 20 . 1 1 16 16 CYS CA C 16 55.098 55.098 57.587 -2.489 18757
1317 1 20 . 1 1 16 16 CYS H H 16 8.973 8.973 8.947 0.026 18757
1318 1 20 . 1 1 17 17 GLY N N 17 111.815 111.815 108.482 3.333 18757
1319 1 20 . 1 1 17 17 GLY CA C 17 46.061 46.061 44.919 1.141 18757
1320 1 20 . 1 1 17 17 GLY H H 17 8.760 8.760 8.620 0.140 18757
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 10 2.123 0.734 2.100 18757
2 1 1 "Average Difference" HA 18 0.241 0.022 0.247 18757
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18757
4 1 1 "Average Difference" CA 16 1.650 0.777 1.503 18757
5 1 1 "Average Difference" CB 10 9.202 -4.331 8.558 18757
6 1 1 "Average Difference" HN 16 0.263 -0.111 0.246 18757
7 1 2 "Average Difference" N 10 2.018 1.284 1.641 18757
8 1 2 "Average Difference" HA 18 0.240 0.001 0.247 18757
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18757
10 1 2 "Average Difference" CA 16 1.524 0.974 1.210 18757
11 1 2 "Average Difference" CB 10 9.246 -3.606 8.974 18757
12 1 2 "Average Difference" HN 16 0.303 -0.092 0.299 18757
13 1 3 "Average Difference" N 10 2.382 1.598 1.862 18757
14 1 3 "Average Difference" HA 18 0.241 -0.050 0.243 18757
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18757
16 1 3 "Average Difference" CA 16 1.691 0.814 1.531 18757
17 1 3 "Average Difference" CB 10 9.186 -4.182 8.622 18757
18 1 3 "Average Difference" HN 16 0.334 -0.073 0.337 18757
19 1 4 "Average Difference" N 10 2.265 0.977 2.154 18757
20 1 4 "Average Difference" HA 18 0.251 -0.046 0.254 18757
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18757
22 1 4 "Average Difference" CA 16 1.579 0.729 1.447 18757
23 1 4 "Average Difference" CB 10 8.801 -3.973 8.278 18757
24 1 4 "Average Difference" HN 16 0.366 -0.057 0.374 18757
25 1 5 "Average Difference" N 10 1.633 0.723 1.544 18757
26 1 5 "Average Difference" HA 18 0.236 0.034 0.240 18757
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18757
28 1 5 "Average Difference" CA 16 1.638 0.754 1.502 18757
29 1 5 "Average Difference" CB 10 9.095 -3.790 8.715 18757
30 1 5 "Average Difference" HN 16 0.288 -0.072 0.288 18757
31 1 6 "Average Difference" N 10 1.511 0.377 1.543 18757
32 1 6 "Average Difference" HA 18 0.279 -0.027 0.286 18757
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18757
34 1 6 "Average Difference" CA 16 1.699 0.886 1.497 18757
35 1 6 "Average Difference" CB 10 9.196 -3.582 8.927 18757
36 1 6 "Average Difference" HN 16 0.349 -0.082 0.350 18757
37 1 7 "Average Difference" N 10 1.974 0.788 1.907 18757
38 1 7 "Average Difference" HA 18 0.180 0.047 0.179 18757
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18757
40 1 7 "Average Difference" CA 16 1.407 0.850 1.158 18757
41 1 7 "Average Difference" CB 10 8.750 -3.603 8.405 18757
42 1 7 "Average Difference" HN 16 0.378 -0.140 0.363 18757
43 1 8 "Average Difference" N 10 2.089 0.529 2.131 18757
44 1 8 "Average Difference" HA 18 0.195 0.066 0.188 18757
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18757
46 1 8 "Average Difference" CA 16 1.403 0.883 1.126 18757
47 1 8 "Average Difference" CB 10 9.069 -3.803 8.678 18757
48 1 8 "Average Difference" HN 16 0.403 -0.156 0.384 18757
49 1 9 "Average Difference" N 10 2.121 0.228 2.222 18757
50 1 9 "Average Difference" HA 18 0.211 0.024 0.216 18757
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18757
52 1 9 "Average Difference" CA 16 1.508 0.577 1.439 18757
53 1 9 "Average Difference" CB 10 9.167 -4.073 8.656 18757
54 1 9 "Average Difference" HN 16 0.339 -0.060 0.345 18757
55 1 10 "Average Difference" N 10 1.815 0.564 1.818 18757
56 1 10 "Average Difference" HA 18 0.200 0.043 0.201 18757
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18757
58 1 10 "Average Difference" CA 16 1.454 0.632 1.353 18757
59 1 10 "Average Difference" CB 10 8.821 -4.005 8.285 18757
60 1 10 "Average Difference" HN 16 0.304 -0.066 0.307 18757
61 1 11 "Average Difference" N 10 2.018 0.603 2.030 18757
62 1 11 "Average Difference" HA 18 0.244 0.059 0.243 18757
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18757
64 1 11 "Average Difference" CA 16 1.519 0.856 1.296 18757
65 1 11 "Average Difference" CB 10 9.241 -3.441 9.040 18757
66 1 11 "Average Difference" HN 16 0.348 -0.137 0.330 18757
67 1 12 "Average Difference" N 10 1.710 -0.007 1.803 18757
68 1 12 "Average Difference" HA 18 0.241 0.097 0.227 18757
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18757
70 1 12 "Average Difference" CA 16 1.463 0.866 1.218 18757
71 1 12 "Average Difference" CB 10 9.249 -3.621 8.972 18757
72 1 12 "Average Difference" HN 16 0.357 -0.140 0.339 18757
73 1 13 "Average Difference" N 10 1.618 0.045 1.704 18757
74 1 13 "Average Difference" HA 18 0.212 0.060 0.210 18757
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18757
76 1 13 "Average Difference" CA 16 1.573 0.661 1.474 18757
77 1 13 "Average Difference" CB 10 8.960 -3.829 8.539 18757
78 1 13 "Average Difference" HN 16 0.388 -0.125 0.379 18757
79 1 14 "Average Difference" N 10 1.923 1.093 1.667 18757
80 1 14 "Average Difference" HA 18 0.210 0.046 0.211 18757
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18757
82 1 14 "Average Difference" CA 16 1.541 0.870 1.314 18757
83 1 14 "Average Difference" CB 10 9.015 -3.609 8.709 18757
84 1 14 "Average Difference" HN 16 0.310 -0.095 0.305 18757
85 1 15 "Average Difference" N 10 1.852 0.295 1.927 18757
86 1 15 "Average Difference" HA 18 0.236 0.052 0.237 18757
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18757
88 1 15 "Average Difference" CA 16 1.578 0.716 1.453 18757
89 1 15 "Average Difference" CB 10 8.252 -3.493 7.881 18757
90 1 15 "Average Difference" HN 16 0.374 -0.042 0.384 18757
91 1 16 "Average Difference" N 10 2.189 0.487 2.249 18757
92 1 16 "Average Difference" HA 18 0.182 0.042 0.182 18757
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18757
94 1 16 "Average Difference" CA 16 1.569 0.911 1.319 18757
95 1 16 "Average Difference" CB 10 9.199 -3.785 8.838 18757
96 1 16 "Average Difference" HN 16 0.295 -0.082 0.292 18757
97 1 17 "Average Difference" N 10 2.381 0.412 2.472 18757
98 1 17 "Average Difference" HA 18 0.233 -0.058 0.232 18757
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18757
100 1 17 "Average Difference" CA 16 1.425 0.806 1.214 18757
101 1 17 "Average Difference" CB 10 9.102 -3.674 8.778 18757
102 1 17 "Average Difference" HN 16 0.357 -0.053 0.364 18757
103 1 18 "Average Difference" N 10 2.350 1.444 1.954 18757
104 1 18 "Average Difference" HA 18 0.257 -0.006 0.264 18757
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18757
106 1 18 "Average Difference" CA 16 1.579 0.739 1.441 18757
107 1 18 "Average Difference" CB 10 8.970 -4.111 8.403 18757
108 1 18 "Average Difference" HN 16 0.329 -0.092 0.327 18757
109 1 19 "Average Difference" N 10 2.024 0.428 2.086 18757
110 1 19 "Average Difference" HA 18 0.266 -0.053 0.268 18757
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18757
112 1 19 "Average Difference" CA 16 1.738 0.867 1.555 18757
113 1 19 "Average Difference" CB 10 9.245 -4.235 8.663 18757
114 1 19 "Average Difference" HN 16 0.244 -0.084 0.237 18757
115 1 20 "Average Difference" N 10 2.309 -0.298 2.414 18757
116 1 20 "Average Difference" HA 18 0.255 -0.049 0.258 18757
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18757
118 1 20 "Average Difference" CA 16 1.572 0.759 1.422 18757
119 1 20 "Average Difference" CB 10 9.284 -3.681 8.984 18757
120 1 20 "Average Difference" HN 16 0.358 -0.141 0.340 18757
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 18757
_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 N N 2 120.907 120.907 121.389 -0.482 18757
2 1 . 1 1 2 2 ILE HA H 2 4.494 4.494 4.449 0.045 18757
3 1 . 1 1 2 2 ILE CA C 2 59.956 59.956 60.179 -0.223 18757
4 1 . 1 1 2 2 ILE CB C 2 40.197 40.197 40.634 -0.437 18757
5 1 . 1 1 2 2 ILE H H 2 7.927 7.927 7.554 0.373 18757
6 1 . 1 1 3 3 CYS N N 3 124.107 124.107 123.798 0.309 18757
7 1 . 1 1 3 3 CYS HA H 3 5.308 5.308 5.354 -0.046 18757
8 1 . 1 1 3 3 CYS CA C 3 56.013 56.013 57.658 -1.645 18757
9 1 . 1 1 3 3 CYS H H 3 8.899 8.899 8.624 0.275 18757
10 1 . 1 1 4 4 ARG N N 4 123.254 123.254 122.362 0.892 18757
11 1 . 1 1 4 4 ARG HA H 4 4.663 4.663 4.688 -0.025 18757
12 1 . 1 1 4 4 ARG CA C 4 55.267 55.267 54.796 0.471 18757
13 1 . 1 1 4 4 ARG CB C 4 31.817 31.817 32.154 -0.337 18757
14 1 . 1 1 4 4 ARG H H 4 8.714 8.714 9.086 -0.372 18757
15 1 . 1 1 5 5 CYS N N 5 123.464 123.464 125.319 -1.855 18757
16 1 . 1 1 5 5 CYS HA H 5 5.404 5.404 5.124 0.280 18757
17 1 . 1 1 5 5 CYS CA C 5 55.641 55.641 58.302 -2.661 18757
18 1 . 1 1 5 5 CYS CB C 5 46.464 46.464 26.319 20.145 18757
19 1 . 1 1 5 5 CYS H H 5 9.020 9.020 8.894 0.126 18757
20 1 . 1 1 6 6 ILE N N 6 124.141 124.141 124.213 -0.072 18757
21 1 . 1 1 6 6 ILE HA H 6 4.364 4.364 4.543 -0.179 18757
22 1 . 1 1 6 6 ILE CA C 6 60.712 60.712 60.270 0.442 18757
23 1 . 1 1 6 6 ILE CB C 6 39.591 39.591 39.661 -0.070 18757
24 1 . 1 1 6 6 ILE H H 6 8.780 8.780 8.828 -0.048 18757
25 1 . 1 1 7 7 CYS HA H 7 5.331 5.331 5.348 -0.017 18757
26 1 . 1 1 7 7 CYS CA C 7 55.862 55.862 58.090 -2.228 18757
27 1 . 1 1 7 7 CYS H H 7 9.135 9.135 8.708 0.427 18757
28 1 . 1 1 8 8 GLY CA C 8 45.142 45.142 45.420 -0.278 18757
29 1 . 1 1 8 8 GLY H H 8 8.588 8.588 8.918 -0.330 18757
30 1 . 1 1 9 9 ARG HA H 9 4.130 4.130 4.421 -0.291 18757
31 1 . 1 1 9 9 ARG CA C 9 57.376 57.376 57.487 -0.111 18757
32 1 . 1 1 9 9 ARG CB C 9 29.621 29.621 30.686 -1.065 18757
33 1 . 1 1 9 9 ARG H H 9 8.873 8.873 8.365 0.508 18757
34 1 . 1 1 10 10 ARG HA H 10 4.339 4.339 4.420 -0.081 18757
35 1 . 1 1 10 10 ARG CA C 10 56.589 56.589 56.045 0.544 18757
36 1 . 1 1 10 10 ARG CB C 10 31.418 31.418 31.473 -0.055 18757
37 1 . 1 1 10 10 ARG H H 10 8.382 8.382 7.928 0.454 18757
38 1 . 1 1 11 11 ILE N N 11 119.146 119.146 122.215 -3.069 18757
39 1 . 1 1 11 11 ILE HA H 11 4.483 4.483 4.315 0.168 18757
40 1 . 1 1 11 11 ILE CA C 11 60.141 60.141 60.700 -0.559 18757
41 1 . 1 1 11 11 ILE CB C 11 40.197 40.197 39.463 0.734 18757
42 1 . 1 1 11 11 ILE H H 11 8.002 8.002 7.725 0.278 18757
43 1 . 1 1 12 12 CYS HA H 12 5.302 5.302 5.505 -0.202 18757
44 1 . 1 1 12 12 CYS CA C 12 56.013 56.013 57.599 -1.586 18757
45 1 . 1 1 12 12 CYS H H 12 8.821 8.821 8.562 0.259 18757
46 1 . 1 1 13 13 ARG N N 13 122.886 122.886 121.135 1.751 18757
47 1 . 1 1 13 13 ARG HA H 13 4.664 4.664 4.665 -0.001 18757
48 1 . 1 1 13 13 ARG CA C 13 55.267 55.267 55.404 -0.137 18757
49 1 . 1 1 13 13 ARG CB C 13 31.817 31.817 32.477 -0.660 18757
50 1 . 1 1 13 13 ARG H H 13 8.680 8.680 9.092 -0.412 18757
51 1 . 1 1 14 14 CYS N N 14 123.464 123.464 125.190 -1.726 18757
52 1 . 1 1 14 14 CYS HA H 14 5.404 5.404 5.099 0.305 18757
53 1 . 1 1 14 14 CYS CA C 14 55.641 55.641 58.307 -2.666 18757
54 1 . 1 1 14 14 CYS CB C 14 46.464 46.464 26.322 20.142 18757
55 1 . 1 1 14 14 CYS H H 14 9.020 9.020 8.859 0.161 18757
56 1 . 1 1 15 15 ILE N N 15 124.141 124.141 125.491 -1.350 18757
57 1 . 1 1 15 15 ILE HA H 15 4.362 4.362 4.454 -0.092 18757
58 1 . 1 1 15 15 ILE CA C 15 60.712 60.712 60.326 0.386 18757
59 1 . 1 1 15 15 ILE CB C 15 39.591 39.591 39.774 -0.183 18757
60 1 . 1 1 15 15 ILE H H 15 8.780 8.780 8.918 -0.138 18757
61 1 . 1 1 16 16 CYS HA H 16 5.547 5.547 5.204 0.343 18757
62 1 . 1 1 16 16 CYS CA C 16 55.098 55.098 58.264 -3.166 18757
63 1 . 1 1 16 16 CYS H H 16 8.973 8.973 8.936 0.037 18757
64 1 . 1 1 17 17 GLY N N 17 111.815 111.815 112.366 -0.551 18757
65 1 . 1 1 17 17 GLY CA C 17 46.061 46.061 45.384 0.677 18757
66 1 . 1 1 17 17 GLY H H 17 8.760 8.760 8.838 -0.078 18757
stop_
save_