Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | type | subsubtype |
|
|
5774 | 1hy8 RC | 4989 | cing | recoord | 1-original | 5 | chemical shift | format 3 |
1 -5 GLY CA C 43.5300 . .
2 -5 GLY HA1|2 H 4.0400 . .
3 -4 PRO CA C 63.2000 . .
4 -4 PRO CB C 32.3700 . .
5 -4 PRO CG C 27.0500 . .
6 -4 PRO CD C 49.6300 . .
7 -4 PRO HA H 4.5300 . .
8 -4 PRO HB1|2 H 2.3178 . .
9 -4 PRO HG1|2 H 2.0400 . .
10 -4 PRO HD1|2 H 3.6200 . .
11 -3 LEU HN H 8.6200 . .
12 -3 LEU N N 122.6100 . .
13 -3 LEU CA C 55.2500 . .
14 -3 LEU CB C 42.3400 . .
15 -3 LEU CG C 27.0700 . .
16 -3 LEU CD1|2 C 25.0500 . .
17 -3 LEU CD1|2 C 23.5000 . .
18 -3 LEU HA H 4.4363 . .
19 -3 LEU HB1|2 H 1.7309 . .
20 -3 LEU HG H 1.6317 . .
21 -3 LEU HD1#|2# H 0.9565 . .
22 -2 GLY HN H 8.5200 . .
23 -2 GLY N N 110.2000 . .
24 -2 GLY CA C 45.2500 . .
25 -2 GLY HA1|2 H 4.0770 . .
26 -1 SER HN H 8.4000 . .
27 -1 SER N N 116.8400 . .
28 -1 SER CA C 59.4000 . .
29 -1 SER CB C 63.3460 . .
30 -1 SER HA H 4.3522 . .
31 -1 SER HB1|2 H 3.9247 . .
32 1 ALA HN H 8.4600 . .
33 1 ALA N N 126.0900 . .
34 1 ALA CA C 53.7885 . .
35 1 ALA CB C 18.8033 . .
36 1 ALA HA H 4.3491 . .
37 1 ALA HB# H 1.4860 . .
38 2 ASP HN H 8.2500 . .
39 2 ASP N N 119.9000 . .
40 2 ASP CA C 55.4285 . .
41 2 ASP CB C 41.4332 . .
42 2 ASP HA H 4.6202 . .
43 2 ASP HB1|2 H 2.8817 . .
44 2 ASP HB1|2 H 2.7724 . .
45 3 THR HN H 8.1500 . .
46 3 THR N N 117.0800 . .
47 3 THR CA C 67.7352 . .
48 3 THR CB C 68.2100 . .
49 3 THR 2 2 23.3870 . .
50 3 THR HA H 3.9529 . .
51 3 THR HB H 4.1633 . .
52 3 THR 2# 2 1.1180 . .
53 4 LEU HN H 8.5374 . .
54 4 LEU N N 121.3981 . .
55 4 LEU CA C 58.4930 . .
56 4 LEU CB C 40.7890 . .
57 4 LEU CG C 27.2552 . .
58 4 LEU CD1|2 C 22.6690 . .
59 4 LEU CD1|2 C 25.5125 . .
60 4 LEU HA H 3.9866 . .
61 4 LEU HB1|2 H 1.9854 . .
62 4 LEU 2|HB1 2 1.5600 . .
63 4 LEU HG H 1.5509 . .
64 4 LEU HD1#|2# H 0.7700 . .
65 4 LEU HD1#|2# H 0.9600 . .
66 5 GLU HN H 8.7000 . .
67 5 GLU N N 124.1800 . .
68 5 GLU CA C 60.2906 . .
69 5 GLU CB C 29.3541 . .
70 5 GLU CG C 36.2910 . .
71 5 GLU HA H 4.0247 . .
72 5 GLU HB1|2 H 2.1800 . .
73 5 GLU HB1|2 H 2.2300 . .
74 5 GLU HG1|2 H 2.3100 . .
75 5 GLU HG1|2 H 2.4200 . .
76 6 ARG HN H 8.1200 . .
77 6 ARG N N 119.7400 . .
78 6 ARG CA C 59.7246 . .
79 6 ARG CB C 32.5726 . .
80 6 ARG CG C 27.2190 . .
81 6 ARG CD C 44.6792 . .
82 6 ARG HA H 4.0843 . .
83 6 ARG HB1|2 H 2.0789 . .
84 6 ARG HB1|2 H 1.9608 . .
85 6 ARG HG1|2 H 1.7141 . .
86 6 ARG HG1|2 H 1.9800 . .
87 6 ARG HD1|2 H 3.3015 . .
88 6 ARG HD1|2 H 3.0257 . .
89 7 VAL HN H 8.7900 . .
90 7 VAL N N 119.2200 . .
91 7 VAL CA C 66.9383 . .
92 7 VAL CB C 31.9191 . .
93 7 VAL CG1|2 C 24.3348 . .
94 7 VAL CG1|2 C 21.4790 . .
95 7 VAL HA H 3.6607 . .
96 7 VAL HB H 2.1885 . .
97 7 VAL HG1#|2# H 1.1000 . .
98 7 VAL HG1#|2# H 0.9500 . .
99 8 THR HN H 8.6500 . .
100 8 THR N N 116.8600 . .
101 8 THR CA C 68.4050 . .
102 8 THR CB C 68.5100 . .
103 8 THR 2 2 20.4200 . .
104 8 THR HA H 3.7100 . .
105 8 THR HB H 4.4300 . .
106 8 THR 2# 2 1.2508 . .
107 9 LYS HN H 7.6039 . .
108 9 LYS N N 120.3407 . .
109 9 LYS CA C 59.6130 . .
110 9 LYS CB C 32.1445 . .
111 9 LYS CG C 24.7739 . .
112 9 LYS CD C 28.9239 . .
113 9 LYS CE C 42.2060 . .
114 9 LYS HA H 3.9581 . .
115 9 LYS HB1|2 H 1.9560 . .
116 9 LYS HG1|2 H 1.4525 . .
117 9 LYS HG1|2 H 1.5800 . .
118 9 LYS HD1|2 H 1.6565 . .
119 9 LYS HE1|2 H 3.0046 . .
120 10 ILE HN H 7.1800 . .
121 10 ILE N N 118.4300 . .
122 10 ILE CA C 64.5400 . .
123 10 ILE CB C 38.4500 . .
124 10 ILE CG1 C 29.5214 . .
125 10 ILE CG2 C 17.1736 . .
126 10 ILE CD C 14.1182 . .
127 10 ILE HA H 3.8757 . .
128 10 ILE HB H 2.0135 . .
129 10 ILE HG11|12 H 1.8000 . .
130 10 ILE HG11|12 H 1.3100 . .
131 10 ILE HG2# H 0.8900 . .
132 10 ILE HD# H 0.8800 . .
133 11 ILE HN H 8.1627 . .
134 11 ILE N N 120.1274 . .
135 11 ILE CA C 66.1900 . .
136 11 ILE CB C 38.0900 . .
137 11 ILE CG1 C 30.0393 . .
138 11 ILE CG2 C 18.6231 . .
139 11 ILE CD C 16.6970 . .
140 11 ILE HA H 3.4970 . .
141 11 ILE HB H 2.0413 . .
142 11 ILE HG11|12 H 2.0900 . .
143 11 ILE HG11|12 H 1.0400 . .
144 11 ILE HG2# H 0.9100 . .
145 11 ILE HD# H 0.9155 . .
146 12 VAL HN H 8.7870 . .
147 12 VAL N N 120.9983 . .
148 12 VAL CA C 66.8968 . .
149 12 VAL CB C 32.0926 . .
150 12 VAL CG1|2 C 20.5609 . .
151 12 VAL CG1|2 C 22.5660 . .
152 12 VAL HA H 3.5299 . .
153 12 VAL HB H 2.1953 . .
154 12 VAL HG1#|2# H 1.0865 . .
155 12 VAL HG1#|2# H 0.9876 . .
156 13 ASP HN H 8.1600 . .
157 13 ASP N N 119.4400 . .
158 13 ASP CA C 57.1600 . .
159 13 ASP CB C 40.8400 . .
160 13 ASP HA H 4.4033 . .
161 13 ASP HB1|2 H 2.8353 . .
162 13 ASP HB1|2 H 2.6861 . .
163 14 ARG HN H 8.3200 . .
164 14 ARG N N 116.4000 . .
165 14 ARG CA C 57.4000 . .
166 14 ARG CB C 30.4258 . .
167 14 ARG CG C 26.6580 . .
168 14 ARG CD C 42.0691 . .
169 14 ARG HA H 4.3434 . .
170 14 ARG HB1|2 H 2.0615 . .
171 14 ARG HB1|2 H 1.8969 . .
172 14 ARG HG1|2 H 1.5687 . .
173 14 ARG HG1|2 H 1.6605 . .
174 14 ARG HD1|2 H 3.2000 . .
175 14 ARG HD1|2 H 3.3000 . .
176 15 LEU HN H 8.7400 . .
177 15 LEU N N 114.5500 . .
178 15 LEU CA C 54.6100 . .
179 15 LEU CB C 42.3000 . .
180 15 LEU CG C 26.7210 . .
181 15 LEU CD1|2 C 22.2021 . .
182 15 LEU HA H 4.6180 . .
183 15 LEU HB1|2 H 1.9902 . .
184 15 LEU 2|HB1 2 1.7580 . .
185 15 LEU HD1#|2# H 0.8227 . .
186 15 LEU HD1#|2# H 0.9935 . .
187 16 GLY HN H 8.0400 . .
188 16 GLY N N 108.9600 . .
189 16 GLY CA C 47.0084 . .
190 16 GLY HA1|2 H 4.0624 . .
191 16 GLY HA1|2 H 3.9487 . .
192 17 VAL HN H 6.4000 . .
193 17 VAL N N 109.4500 . .
194 17 VAL CA C 58.8975 . .
195 17 VAL CB C 32.6744 . .
196 17 VAL CG1|2 C 19.4285 . .
197 17 VAL CG1|2 C 22.4646 . .
198 17 VAL HA H 4.4320 . .
199 17 VAL HB H 2.4872 . .
200 17 VAL HG1#|2# H 0.6950 . .
201 17 VAL HG1#|2# H 0.9700 . .
202 18 ASP HN H 8.5635 . .
203 18 ASP N N 121.1378 . .
204 18 ASP CA C 53.9500 . .
205 18 ASP CB C 42.5500 . .
206 18 ASP HA H 4.5844 . .
207 18 ASP HB1|2 H 2.5682 . .
208 18 ASP HB1|2 H 2.6697 . .
209 19 GLU HN H 8.9600 . .
210 19 GLU N N 125.6200 . .
211 19 GLU CA C 60.2381 . .
212 19 GLU CB C 29.2443 . .
213 19 GLU CG C 36.2356 . .
214 19 GLU HA H 3.6353 . .
215 19 GLU HB1|2 H 2.0245 . .
216 19 GLU HB1|2 H 1.9800 . .
217 19 GLU HG1|2 H 2.2585 . .
218 20 ALA HN H 8.7104 . .
219 20 ALA N N 120.2743 . .
220 20 ALA CA C 53.9615 . .
221 20 ALA CB C 18.5750 . .
222 20 ALA HA H 4.0690 . .
223 20 ALA HB# H 1.3773 . .
224 21 ASP HN H 7.7552 . .
225 21 ASP N N 114.9379 . .
226 21 ASP CA C 54.8256 . .
227 21 ASP CB C 40.9824 . .
228 21 ASP HA H 4.5786 . .
229 21 ASP HB1|2 H 2.6869 . .
230 22 VAL HN H 7.6000 . .
231 22 VAL N N 121.5400 . .
232 22 VAL CA C 63.8477 . .
233 22 VAL CB C 29.2863 . .
234 22 VAL CG1|2 C 24.0204 . .
235 22 VAL CG1|2 C 22.3278 . .
236 22 VAL HA H 3.5340 . .
237 22 VAL HB H 2.3698 . .
238 22 VAL HG1#|2# H 0.9300 . .
239 22 VAL HG1#|2# H 0.8800 . .
240 23 LYS HN H 6.7100 . .
241 23 LYS N N 125.2300 . .
242 23 LYS CA C 53.4424 . .
243 23 LYS CB C 35.2857 . .
244 23 LYS CG C 24.5975 . .
245 23 LYS CD C 29.0238 . .
246 23 LYS CE C 42.2352 . .
247 23 LYS HA H 4.6457 . .
248 23 LYS HB1|2 H 2.1148 . .
249 23 LYS HB1|2 H 1.4828 . .
250 23 LYS HG1 H 1.3000 . .
251 23 LYS 2 2 1.3800 . .
252 23 LYS HD1|2 H 1.7100 . .
253 23 LYS HE1|2 H 3.0251 . .
254 24 LEU HN H 8.8133 . .
255 24 LEU N N 121.3330 . .
256 24 LEU CA C 58.0785 . .
257 24 LEU CB C 41.2714 . .
258 24 LEU CG C 26.9730 . .
259 24 LEU CD1|2 C 23.0091 . .
260 24 LEU CD1|2 C 25.2563 . .
261 24 LEU HA H 3.6800 . .
262 24 LEU HB1|2 H 1.8000 . .
263 24 LEU HB1|2 H 1.4200 . .
264 24 LEU HG H 1.8300 . .
265 24 LEU HD1#|2# H 0.8500 . .
266 24 LEU HD1#|2# H 0.9600 . .
267 25 GLU HN H 9.0400 . .
268 25 GLU N N 114.2600 . .
269 25 GLU CA C 56.7800 . .
270 25 GLU CB C 28.8120 . .
271 25 GLU CG C 36.0469 . .
272 25 GLU HA H 4.1964 . .
273 25 GLU HB1|2 H 2.0000 . .
274 25 GLU HB1|2 H 2.0800 . .
275 25 GLU HG1|2 H 2.2500 . .
276 26 ALA HN H 7.6900 . .
277 26 ALA N N 123.1000 . .
278 26 ALA CA C 52.2181 . .
279 26 ALA CB C 18.7904 . .
280 26 ALA HA H 4.3491 . .
281 26 ALA HB# H 1.4044 . .
282 27 SER HN H 10.0100 . .
283 27 SER N N 118.5700 . .
284 27 SER CA C 55.9287 . .
285 27 SER CB C 63.5943 . .
286 27 SER HA H 4.7630 . .
287 27 SER HB1|2 H 3.9156 . .
288 27 SER HB1|2 H 4.0782 . .
289 28 PHE HN H 8.2233 . .
290 28 PHE N N 125.9693 . .
291 28 PHE CA C 61.9737 . .
292 28 PHE CB C 38.2329 . .
293 28 PHE CD C 130.7500 . .
294 28 PHE CE C 127.7200 . .
295 28 PHE HA H 4.1367 . .
296 28 PHE HB1|2 H 2.8759 . .
297 28 PHE HB1|2 H 2.9881 . .
298 28 PHE HD1|2 H 6.9700 . .
299 28 PHE HE1|2 H 6.7800 . .
300 29 LYS HN H 8.7200 . .
301 29 LYS N N 115.8600 . .
302 29 LYS CA C 58.4806 . .
303 29 LYS CB C 33.0113 . .
304 29 LYS CG C 25.1185 . .
305 29 LYS CD C 29.4451 . .
306 29 LYS CE C 41.9547 . .
307 29 LYS HA H 4.7572 . .
308 29 LYS HB1|2 H 1.8320 . .
309 29 LYS HG1|2 H 1.5489 . .
310 29 LYS HG1|2 H 1.3000 . .
311 29 LYS HD1|2 H 1.7400 . .
312 29 LYS HE1|2 H 2.9542 . .
313 30 GLU HN H 8.1800 . .
314 30 GLU N N 115.5900 . .
315 30 GLU CA C 59.3800 . .
316 30 GLU CB C 29.7610 . .
317 30 GLU CG C 36.8294 . .
318 30 GLU HA H 4.2049 . .
319 30 GLU HB1|2 H 2.0786 . .
320 30 GLU HB1|2 H 1.9079 . .
321 30 GLU HG1|2 H 2.3278 . .
322 31 ASP HN H 7.8700 . .
323 31 ASP N N 114.8400 . .
324 31 ASP CA C 56.2510 . .
325 31 ASP CB C 42.0997 . .
326 31 ASP HA H 4.9900 . .
327 31 ASP HB1|2 H 2.7740 . .
328 31 ASP HB1|2 H 3.1416 . .
329 32 LEU HN H 7.3700 . .
330 32 LEU N N 115.5900 . .
331 32 LEU CA C 54.3359 . .
332 32 LEU CB C 41.4647 . .
333 32 LEU CG C 26.4600 . .
334 32 LEU CD1|2 C 22.4000 . .
335 32 LEU CD1|2 C 26.2900 . .
336 32 LEU HA H 4.5850 . .
337 32 LEU HB1|2 H 2.3229 . .
338 32 LEU HB1|2 H 1.7106 . .
339 32 LEU HG H 1.5200 . .
340 32 LEU HD1#|2# H 0.7450 . .
341 32 LEU HD1#|2# H 0.6900 . .
342 33 GLY HN H 7.2600 . .
343 33 GLY N N 105.8600 . .
344 33 GLY CA C 46.4980 . .
345 33 GLY HA1|2 H 3.8674 . .
346 33 GLY HA1|2 H 3.9528 . .
347 34 ALA HN H 8.4600 . .
348 34 ALA N N 123.3500 . .
349 34 ALA CA C 51.4851 . .
350 34 ALA CB C 20.5511 . .
351 34 ALA HA H 4.5962 . .
352 34 ALA HB# H 1.2508 . .
353 35 ASP HN H 9.2400 . .
354 35 ASP N N 122.5100 . .
355 35 ASP CA C 52.1307 . .
356 35 ASP CB C 41.8246 . .
357 35 ASP HA H 4.9020 . .
358 35 ASP HB1|2 H 3.1981 . .
359 35 ASP HB1|2 H 2.8247 . .
360 36 SER HN H 8.7600 . .
361 36 SER N N 112.7300 . .
362 36 SER CA C 60.9389 . .
363 36 SER CB C 65.5145 . .
364 36 SER HA H 4.1796 . .
365 36 SER HB1|2 H 4.1280 . .
366 37 LEU HN H 7.9900 . .
367 37 LEU N N 124.4100 . .
368 37 LEU CA C 57.6143 . .
369 37 LEU CB C 40.8533 . .
370 37 LEU CG C 27.1738 . .
371 37 LEU CD1|2 C 24.1673 . .
372 37 LEU CD1|2 C 24.3700 . .
373 37 LEU HA H 4.1987 . .
374 37 LEU HB1|2 H 1.7690 . .
375 37 LEU HG H 1.6600 . .
376 37 LEU HD1#|2# H 0.9407 . .
377 37 LEU HD1#|2# H 0.9000 . .
378 38 ASP HN H 8.3455 . .
379 38 ASP N N 119.9904 . .
380 38 ASP CA C 57.4600 . .
381 38 ASP CB C 41.6700 . .
382 38 ASP HA H 4.3200 . .
383 38 ASP HB1|2 H 2.3300 . .
384 38 ASP HB1|2 H 3.1500 . .
385 39 VAL HN H 7.8100 . .
386 39 VAL N N 117.5100 . .
387 39 VAL CA C 67.3524 . .
388 39 VAL CB C 31.1756 . .
389 39 VAL CG1|2 C 23.1085 . .
390 39 VAL CG1|2 C 21.4147 . .
391 39 VAL HA H 3.3027 . .
392 39 VAL HB H 2.1159 . .
393 39 VAL HG1#|2# H 0.8653 . .
394 39 VAL HG1#|2# H 0.8100 . .
395 40 VAL HN H 7.4000 . .
396 40 VAL N N 119.8000 . .
397 40 VAL CA C 66.5814 . .
398 40 VAL CB C 31.7889 . .
399 40 VAL CG1|2 C 22.9102 . .
400 40 VAL CG1|2 C 21.1243 . .
401 40 VAL HA H 3.5869 . .
402 40 VAL HB H 2.2681 . .
403 40 VAL HG1#|2# H 1.1219 . .
404 40 VAL HG1#|2# H 1.0167 . .
405 41 GLU HN H 7.9600 . .
406 41 GLU N N 118.7100 . .
407 41 GLU CA C 59.3822 . .
408 41 GLU CB C 28.8964 . .
409 41 GLU CG C 36.3286 . .
410 41 GLU HA H 4.0812 . .
411 41 GLU HB1|2 H 2.0800 . .
412 41 GLU HG1|2 H 2.5189 . .
413 41 GLU HG1|2 H 2.2700 . .
414 42 LEU HN H 8.5000 . .
415 42 LEU N N 121.9700 . .
416 42 LEU CA C 58.3224 . .
417 42 LEU CB C 41.9720 . .
418 42 LEU CG C 27.0072 . .
419 42 LEU CD1|2 C 25.3810 . .
420 42 LEU HA H 3.8922 . .
421 42 LEU HB1|2 H 1.6805 . .
422 42 LEU HB1|2 H 1.5149 . .
423 42 LEU HG H 1.5600 . .
424 42 LEU HD1#|2# H 0.5404 . .
425 42 LEU HD1#|2# H 0.4900 . .
426 43 VAL HN H 8.4621 . .
427 43 VAL N N 119.9763 . .
428 43 VAL CA C 67.7089 . .
429 43 VAL CB C 30.9822 . .
430 43 VAL CG1|2 C 23.1656 . .
431 43 VAL CG1|2 C 21.7771 . .
432 43 VAL HA H 3.3715 . .
433 43 VAL HB H 2.2236 . .
434 43 VAL HG1#|2# H 0.9200 . .
435 43 VAL HG1#|2# H 0.8200 . .
436 44 MET HN H 7.7613 . .
437 44 MET N N 118.3709 . .
438 44 MET CA C 59.2503 . .
439 44 MET CB C 32.8491 . .
440 44 MET CG C 32.3337 . .
441 44 MET CE C 16.9800 . .
442 44 MET HA H 4.4569 . .
443 44 MET HB1|2 H 2.2610 . .
444 44 MET HG1|2 H 2.8200 . .
445 44 MET HG1|2 H 2.6100 . .
446 44 MET HE# H 2.1200 . .
447 45 GLU HN H 8.0700 . .
448 45 GLU N N 120.0500 . .
449 45 GLU CA C 59.6273 . .
450 45 GLU CB C 29.1870 . .
451 45 GLU CG C 35.9909 . .
452 45 GLU HA H 4.2785 . .
453 45 GLU HB1|2 H 2.2545 . .
454 45 GLU HB1|2 H 2.1605 . .
455 45 GLU HG1|2 H 2.4245 . .
456 45 GLU HG1|2 H 2.5200 . .
457 46 LEU HN H 8.6500 . .
458 46 LEU N N 121.3800 . .
459 46 LEU CA C 58.4227 . .
460 46 LEU CB C 41.3227 . .
461 46 LEU CG C 26.2046 . .
462 46 LEU CD1|2 C 24.1527 . .
463 46 LEU CD1|2 C 24.9277 . .
464 46 LEU HA H 4.2027 . .
465 46 LEU HB1|2 H 2.3200 . .
466 46 LEU HB1|2 H 1.3600 . .
467 46 LEU HG H 0.9800 . .
468 46 LEU HD1#|2# H 1.0264 . .
469 46 LEU HD1#|2# H 0.7700 . .
470 47 GLU HN H 8.5500 . .
471 47 GLU N N 119.0600 . .
472 47 GLU CA C 60.1410 . .
473 47 GLU CB C 30.1427 . .
474 47 GLU CG C 37.1136 . .
475 47 GLU HA H 3.9667 . .
476 47 GLU HB1|2 H 2.2300 . .
477 47 GLU HB1|2 H 2.5800 . .
478 47 GLU HG1|2 H 2.8000 . .
479 47 GLU HG1|2 H 2.2100 . .
480 48 ASP HN H 7.6284 . .
481 48 ASP N N 117.4887 . .
482 48 ASP CA C 56.5762 . .
483 48 ASP CB C 41.2471 . .
484 48 ASP HA H 4.5681 . .
485 48 ASP HB1|2 H 2.8267 . .
486 49 GLU HN H 8.4700 . .
487 49 GLU N N 120.4500 . .
488 49 GLU CA C 58.1193 . .
489 49 GLU CB C 29.4366 . .
490 49 GLU CG C 34.6928 . .
491 49 GLU HA H 4.0107 . .
492 49 GLU HB1|2 H 2.1200 . .
493 49 GLU HB1|2 H 1.7049 . .
494 49 GLU HG1|2 H 1.8900 . .
495 49 GLU HG1|2 H 0.9928 . .
496 50 PHE HN H 8.0600 . .
497 50 PHE N N 112.7100 . .
498 50 PHE CA C 58.4982 . .
499 50 PHE CB C 38.7773 . .
500 50 PHE CD C 132.4400 . .
501 50 PHE CE C 130.1300 . .
502 50 PHE HA H 4.4932 . .
503 50 PHE HB1|2 H 3.4188 . .
504 50 PHE HB1|2 H 2.7690 . .
505 50 PHE HD1|2 H 7.5800 . .
506 50 PHE HE1|2 H 7.1800 . .
507 51 ASP HN H 7.7864 . .
508 51 ASP N N 121.7356 . .
509 51 ASP CA C 54.8934 . .
510 51 ASP CB C 38.9500 . .
511 51 ASP HA H 4.4690 . .
512 51 ASP HB1|2 H 3.1510 . .
513 51 ASP HB1|2 H 2.5310 . .
514 52 MET HN H 8.4500 . .
515 52 MET N N 115.6500 . .
516 52 MET CA C 54.0768 . .
517 52 MET CB C 36.3670 . .
518 52 MET CG C 31.2293 . .
519 52 MET CE C 17.4600 . .
520 52 MET HA H 4.8938 . .
521 52 MET HB1|2 H 2.0900 . .
522 52 MET HB1|2 H 1.9500 . .
523 52 MET HG1|2 H 2.4842 . .
524 52 MET HG1|2 H 2.3380 . .
525 52 MET HE# H 2.0000 . .
526 53 GLU HN H 8.3645 . .
527 53 GLU N N 120.2770 . .
528 53 GLU CA C 55.1955 . .
529 53 GLU CB C 31.5860 . .
530 53 GLU CG C 36.1564 . .
531 53 GLU HA H 4.6500 . .
532 53 GLU HB1|2 H 2.1193 . .
533 53 GLU HB1|2 H 2.2074 . .
534 53 GLU HG1|2 H 1.9013 . .
535 54 ILE HN H 9.5600 . .
536 54 ILE N N 127.8600 . .
537 54 ILE CA C 60.7349 . .
538 54 ILE CB C 38.5086 . .
539 54 ILE CG1 C 27.4838 . .
540 54 ILE CG2 C 16.0969 . .
541 54 ILE CD C 12.5051 . .
542 54 ILE HA H 4.2891 . .
543 54 ILE HB H 1.5583 . .
544 54 ILE HG11|12 H 1.5000 . .
545 54 ILE HG11|12 H 0.9600 . .
546 54 ILE HG2# H 0.5700 . .
547 54 ILE HD# H 0.5830 . .
548 55 SER HN H 9.0500 . .
549 55 SER N N 125.4900 . .
550 55 SER CA C 57.9456 . .
551 55 SER CB C 64.4839 . .
552 55 SER HA H 4.4000 . .
553 55 SER HB1|2 H 4.3000 . .
554 55 SER HB1|2 H 4.0900 . .
555 56 ASP HN H 8.8600 . .
556 56 ASP N N 122.7500 . .
557 56 ASP CA C 57.7270 . .
558 56 ASP CB C 39.7000 . .
559 56 ASP HA H 4.3084 . .
560 56 ASP HB1|2 H 2.7206 . .
561 56 ASP HB1|2 H 2.6110 . .
562 57 GLU HN H 8.5800 . .
563 57 GLU N N 118.5700 . .
564 57 GLU CA C 59.3360 . .
565 57 GLU CB C 29.2075 . .
566 57 GLU CG C 36.5248 . .
567 57 GLU HA H 4.0198 . .
568 57 GLU HB1|2 H 1.9606 . .
569 57 GLU HG1|2 H 2.3009 . .
570 58 ASP HN H 7.6649 . .
571 58 ASP N N 120.2465 . .
572 58 ASP CA C 56.6600 . .
573 58 ASP CB C 40.0926 . .
574 58 ASP HA H 4.4435 . .
575 58 ASP HB1|2 H 2.7022 . .
576 58 ASP HB1|2 H 2.2713 . .
577 59 ALA HN H 8.6172 . .
578 59 ALA N N 123.3045 . .
579 59 ALA CA C 54.9506 . .
580 59 ALA CB C 18.2274 . .
581 59 ALA HA H 3.6719 . .
582 59 ALA HB# H 1.3933 . .
583 60 GLU HN H 7.4900 . .
584 60 GLU N N 115.3200 . .
585 60 GLU CA C 57.9956 . .
586 60 GLU CB C 29.6806 . .
587 60 GLU CG C 36.0403 . .
588 60 GLU HA H 4.0250 . .
589 60 GLU HB1|2 H 2.0862 . .
590 60 GLU HG1|2 H 2.3482 . .
591 60 GLU HG1|2 H 2.4254 . .
592 61 LYS HN H 7.1900 . .
593 61 LYS N N 115.6200 . .
594 61 LYS CA C 55.8446 . .
595 61 LYS CB C 32.7785 . .
596 61 LYS CG C 25.1594 . .
597 61 LYS CD C 29.3103 . .
598 61 LYS CE C 42.2884 . .
599 61 LYS HA H 4.3166 . .
600 61 LYS HB1|2 H 2.1055 . .
601 61 LYS HB1|2 H 1.8855 . .
602 61 LYS HG1|2 H 1.6802 . .
603 61 LYS HG1|2 H 1.7000 . .
604 61 LYS HD1|2 H 1.4872 . .
605 61 LYS HE1|2 H 3.0407 . .
606 62 ILE HN H 7.3100 . .
607 62 ILE N N 121.6100 . .
608 62 ILE CA C 61.8550 . .
609 62 ILE CB C 36.7340 . .
610 62 ILE CG1 C 27.5037 . .
611 62 ILE CG2 C 17.3997 . .
612 62 ILE CD C 12.2600 . .
613 62 ILE HA H 3.9587 . .
614 62 ILE HB H 1.9630 . .
615 62 ILE HG11|12 H 1.6966 . .
616 62 ILE HG11|12 H 0.7500 . .
617 62 ILE HG2# H 0.8826 . .
618 62 ILE HD# H 0.4184 . .
619 63 ALA HN H 9.0700 . .
620 63 ALA N N 130.8100 . .
621 63 ALA CA C 52.8011 . .
622 63 ALA CB C 21.5856 . .
623 63 ALA HA H 4.8220 . .
624 63 ALA HB# H 1.6000 . .
625 64 THR HN H 8.4300 . .
626 64 THR N N 110.2500 . .
627 64 THR CA C 58.1844 . .
628 64 THR CB C 73.5000 . .
629 64 THR 2 2 21.2065 . .
630 64 THR HA H 5.0110 . .
631 64 THR HB H 4.2780 . .
632 64 THR 2# 2 1.0070 . .
633 65 VAL HN H 7.9468 . .
634 65 VAL N N 120.6196 . .
635 65 VAL CA C 66.6823 . .
636 65 VAL CB C 31.4222 . .
637 65 VAL CG1|2 C 23.1125 . .
638 65 VAL CG1|2 C 20.3657 . .
639 65 VAL HA H 3.2987 . .
640 65 VAL HB H 2.4422 . .
641 65 VAL HG1#|2# H 0.7921 . .
642 65 VAL HG1#|2# H 0.5854 . .
643 66 GLY HN H 9.3800 . .
644 66 GLY N N 107.7600 . .
645 66 GLY CA C 47.4230 . .
646 66 GLY HA1|2 H 3.6930 . .
647 66 GLY HA1|2 H 3.8946 . .
648 67 ASP HN H 8.2200 . .
649 67 ASP N N 122.1100 . .
650 67 ASP CA C 57.2803 . .
651 67 ASP CB C 41.8680 . .
652 67 ASP HA H 4.5089 . .
653 67 ASP HB1|2 H 2.8687 . .
654 67 ASP HB1|2 H 3.2668 . .
655 68 ALA HN H 7.7817 . .
656 68 ALA N N 122.8589 . .
657 68 ALA CA C 55.4620 . .
658 68 ALA CB C 16.7754 . .
659 68 ALA HA H 4.0200 . .
660 68 ALA HB# H 1.5700 . .
661 69 VAL HN H 8.3000 . .
662 69 VAL N N 117.1200 . .
663 69 VAL CA C 66.8134 . .
664 69 VAL CB C 31.8068 . .
665 69 VAL CG1|2 C 23.1962 . .
666 69 VAL CG1|2 C 20.8322 . .
667 69 VAL HA H 3.2930 . .
668 69 VAL HB H 2.0770 . .
669 69 VAL HG1#|2# H 0.9200 . .
670 69 VAL HG1#|2# H 0.8955 . .
671 70 ASN HN H 8.7100 . .
672 70 ASN N N 117.2600 . .
673 70 ASN CA C 55.9496 . .
674 70 ASN CB C 38.0840 . .
675 70 ASN HA H 4.3744 . .
676 70 ASN HB1|2 H 2.7562 . .
677 70 ASN HB1|2 H 2.8747 . .
678 70 ASN ND2 N 111.9500 . .
679 70 ASN 21|HD22 2 7.5600 . .
680 70 ASN 21|HD22 2 6.8100 . .
681 71 TYR HN H 7.9519 . .
682 71 TYR N N 120.2556 . .
683 71 TYR CA C 62.1013 . .
684 71 TYR CB C 38.1900 . .
685 71 TYR CD C 132.3000 . .
686 71 TYR CE C 118.2000 . .
687 71 TYR HA H 4.0052 . .
688 71 TYR HB1|2 H 3.0828 . .
689 71 TYR HD1|2 H 6.9200 . .
690 71 TYR HE1|2 H 6.7300 . .
691 72 ILE HN H 7.8600 . .
692 72 ILE N N 119.0300 . .
693 72 ILE CA C 64.5374 . .
694 72 ILE CB C 38.1800 . .
695 72 ILE CG1 C 28.8876 . .
696 72 ILE CG2 C 17.4149 . .
697 72 ILE CD C 14.0131 . .
698 72 ILE HA H 3.3770 . .
699 72 ILE HB H 1.5290 . .
700 72 ILE HG11|12 H 1.5300 . .
701 72 ILE HG11|12 H 0.8300 . .
702 72 ILE HG2# H 0.1800 . .
703 72 ILE HD# H 0.2000 . .
704 73 GLN HN H 8.3600 . .
705 73 GLN N N 117.0800 . .
706 73 GLN CA C 58.0560 . .
707 73 GLN CB C 29.0270 . .
708 73 GLN CG C 34.8047 . .
709 73 GLN HA H 4.0290 . .
710 73 GLN HB1|2 H 2.1300 . .
711 73 GLN HB1|2 H 2.0800 . .
712 73 GLN HG1|2 H 2.5300 . .
713 73 GLN HG1|2 H 2.3500 . .
714 73 GLN NE2 N 110.4100 . .
715 73 GLN HE21|22 H 7.3200 . .
716 73 GLN HE21|22 H 6.8200 . .
717 74 ASN HN H 7.7704 . .
718 74 ASN N N 116.2448 . .
719 74 ASN CA C 53.9296 . .
720 74 ASN CB C 38.7038 . .
721 74 ASN HA H 4.6838 . .
722 74 ASN HB1|2 H 2.7695 . .
723 74 ASN ND2 N 112.3800 . .
724 74 ASN HD21|22 H 7.5000 . .
725 74 ASN HD21|22 H 6.8100 . .
726 75 GLN HN H 7.5300 . .
727 75 GLN N N 118.6100 . .
728 75 GLN CA C 55.3476 . .
729 75 GLN CB C 28.9238 . .
730 75 GLN CG C 33.4702 . .
731 75 GLN HA H 4.2820 . .
732 75 GLN HB1|2 H 2.2197 . .
733 75 GLN HB1|2 H 1.8918 . .
734 75 GLN HG1|2 H 2.3252 . .
735 75 GLN HG1|2 H 2.2300 . .
736 75 GLN NE2 N 113.3500 . .
737 75 GLN HE21|22 H 7.0800 . .
738 75 GLN HE21|22 H 6.6900 . .
739 76 GLN HN H 7.6300 . .
740 76 GLN N N 125.3500 . .
741 76 GLN CA C 57.3795 . .
742 76 GLN CB C 30.2137 . .
743 76 GLN CG C 34.2900 . .
744 76 GLN HA H 4.1300 . .
745 76 GLN HB1|2 H 2.1700 . .
746 76 GLN HB1|2 H 1.9900 . .
747 76 GLN HG1|2 H 2.3900 . .
748 76 GLN NE2 N 111.8800 . .
749 76 GLN HE21|22 H 7.4200 . .
750 76 GLN HE21|22 H 6.8400 . .
stop_