Project name: C419Y_5_4D

Status: done

Started: 2026-05-19 00:19:45
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQYGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
input PDB
Selected Chain(s) A
Distance of aggregation 5 Å
FoldX usage Yes
pH calculations No
alphaCutter usage No
Dynamic mode Yes
Automated mutations No
Downloads Download all the data
Simulation log
[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:07)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:07)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:07)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:07)
[INFO]       FoldX:    Starting FoldX energy minimization                                          (00:00:08)
[INFO]       CABS:     Running CABS flex simulation                                                (00:30:30)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (15:18:47)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (15:19:25)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (15:20:04)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (15:20:43)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (15:21:22)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (15:22:01)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (15:22:40)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (15:23:19)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (15:23:57)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (15:24:35)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (15:25:14)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (15:25:53)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (15:26:32)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (15:27:48)
[INFO]       Main:     Simulation completed successfully.                                          (15:28:26)
Show buried residues

Minimal score value
-2.4053
Maximal score value
2.1609
Average score
-0.207
Total score value
-480.4657

The table below lists A4D score for protein residues. Residues with A4D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan4D score mutation
1 M A 0.9653
2 G A -0.2739
3 P A -0.2107
4 G A -0.4692
5 A A -0.4342
6 R A -1.8618
7 G A -0.7339
8 R A -1.4068
9 R A 0.0000
10 R A -1.8759
11 R A 0.0000
12 R A -2.1355
13 R A -2.2126
14 P A -0.5121
15 M A 0.2637
16 S A 0.0254
17 P A -0.4900
18 P A 0.0000
19 P A -0.2728
20 P A -0.1962
21 P A -0.2749
22 P A 0.0000
23 P A 0.0746
24 V A 1.6912
25 R A 0.1571
26 A A 0.0173
27 L A 0.0000
28 P A -0.1171
29 L A 0.8286
30 L A 1.3564
31 L A 0.8422
32 L A 1.9049
33 L A 1.8533
34 A A 0.3068
35 G A -0.2225
36 P A -0.1710
37 G A -0.4712
38 A A -0.0465
39 A A 0.0674
40 A A -0.0197
41 P A -0.3193
42 P A -0.2700
43 C A 0.2645
44 L A -0.0092
45 D A -1.1718
46 G A 0.0000
47 S A 0.0000
48 P A 0.0000
49 C A 0.0000
50 A A 0.0238
51 N A 0.0000
52 G A -0.4941
53 G A -0.4615
54 R A -1.2243
55 C A 0.0000
56 T A 0.0698
57 Q A -0.0186
58 L A 1.4256
59 P A 0.1347
60 S A -0.4783
61 R A -1.8609
62 E A 0.0000
63 A A 0.0000
64 A A 0.0000
65 C A 0.0000
66 L A 0.7424
67 C A 0.0000
68 P A -0.1026
69 P A -0.1390
70 G A -0.4400
71 W A -0.0937
72 V A 0.3450
73 G A -0.1582
74 E A -0.8281
75 R A 0.0000
76 C A 0.0000
77 Q A 0.0000
78 L A -0.1952
79 E A -1.8080
80 D A -0.6008
81 P A -0.0999
82 C A 0.3525
83 H A -0.1351
84 S A -0.2665
85 G A -0.2083
86 P A -0.1393
87 C A 0.0000
88 A A -0.0305
89 G A -0.7004
90 R A -1.4776
91 G A -0.5954
92 V A 0.6758
93 C A 0.6420
94 Q A -1.0508
95 S A -0.0976
96 S A -0.2247
97 V A 0.0000
98 V A 0.0000
99 A A 0.0000
100 G A -0.2410
101 T A -0.1083
102 A A -0.3574
103 R A -1.5930
104 F A 0.9928
105 S A 0.0833
106 C A -0.1631
107 R A -1.8039
108 C A -0.3382
109 P A -0.6029
110 R A -1.9165
111 G A -0.3389
112 F A 0.1724
113 R A -1.2518
114 G A -0.4383
115 P A -0.3233
116 D A -0.2552
117 C A 0.0201
118 S A 0.0635
119 L A 0.2985
120 P A -0.0937
121 D A -0.3977
122 P A -0.0284
123 C A 1.0058
124 L A 1.6455
125 S A 0.0409
126 S A -0.2901
127 P A 0.0000
128 C A 0.2985
129 A A -0.1132
130 H A -1.0292
131 G A -0.4411
132 A A -0.3856
133 R A -1.7732
134 C A -0.0258
135 S A 0.0781
136 V A 1.1896
137 G A 0.1128
138 P A -0.5544
139 D A -1.8594
140 G A -0.8132
141 R A -1.8233
142 F A 0.3459
143 L A 1.6252
144 C A 0.4637
145 S A -0.0059
146 C A 0.0000
147 P A 0.0000
148 P A -0.2644
149 G A 0.1578
150 Y A 1.0791
151 Q A -1.0062
152 G A -1.0703
153 R A -1.9743
154 S A -0.5818
155 C A -0.0021
156 R A -0.7076
157 S A -0.3561
158 D A -1.7573
159 V A 0.0000
160 D A -0.6298
161 E A -0.5344
162 C A 0.0000
163 R A -1.5426
164 V A 1.2804
165 G A -0.4798
166 E A -1.9301
167 P A -0.5415
168 C A 0.0000
169 R A -2.0344
170 H A -1.4321
171 G A -0.7403
172 G A -0.5546
173 T A 0.0000
174 C A 0.3930
175 L A 1.4751
176 N A -0.1794
177 T A -0.2088
178 P A -0.1969
179 G A 0.0000
180 S A 0.2379
181 F A 1.7387
182 R A -0.5766
183 C A 0.0000
184 Q A -1.1731
185 C A -0.1434
186 P A -0.2259
187 A A 0.0082
188 G A -0.2108
189 Y A 1.0545
190 T A 0.1670
191 G A -0.0921
192 P A 0.1240
193 L A 1.5673
194 C A 0.3241
195 E A -1.0635
196 N A -0.7561
197 P A -0.3419
198 A A 0.3167
199 V A 1.7498
200 P A 0.2838
201 C A 0.2100
202 A A 0.0546
203 P A -0.2493
204 S A -0.0960
205 P A -0.2604
206 C A 0.0000
207 R A -0.4760
208 N A -1.3396
209 G A -0.4482
210 G A -0.4966
211 T A -0.0138
212 C A 0.2532
213 R A -2.0185
214 Q A -1.5333
215 S A -0.4623
216 G A -0.8318
217 D A -1.5849
218 L A 1.2048
219 T A 0.1364
220 Y A -0.1040
221 D A -0.7194
222 C A 0.0606
223 A A 0.0000
224 C A 0.0000
225 L A 1.5477
226 P A 0.0000
227 G A -0.1204
228 F A -0.1777
229 E A -1.8674
230 G A -1.0313
231 Q A -1.4310
232 N A -0.9808
233 C A -0.3689
234 E A -1.5860
235 V A 0.7577
236 N A 0.3028
237 V A 1.6025
238 D A -0.6171
239 D A -1.7694
240 C A 0.3812
241 P A -0.0224
242 G A -0.5453
243 H A -0.7371
244 R A -1.5960
245 C A -0.1214
246 L A 0.2715
247 N A -0.5137
248 G A -0.5575
249 G A -0.2915
250 T A -0.0925
251 C A 0.0000
252 V A 0.6588
253 D A 0.0000
254 G A -0.1402
255 V A 0.2230
256 N A -0.6620
257 T A 0.0202
258 Y A 0.9259
259 N A -0.9987
260 C A -0.2340
261 Q A -1.1131
262 C A -0.0839
263 P A -0.0674
264 P A -0.3876
265 E A -0.6989
266 W A 0.0842
267 T A -0.0412
268 G A -0.4823
269 Q A -1.0070
270 F A 0.9869
271 C A 0.0000
272 T A -0.3715
273 E A -1.8227
274 D A 0.0000
275 V A 0.0970
276 D A -0.5668
277 E A -0.6594
278 C A -0.2241
279 Q A -1.1160
280 L A 0.0763
281 Q A -0.6266
282 P A -0.5321
283 N A -0.3047
284 A A 0.0341
285 C A -0.1152
286 H A -1.0837
287 N A -0.4676
288 G A -0.4864
289 G A -0.4524
290 T A -0.0526
291 C A 0.7449
292 F A 1.8679
293 N A -0.3522
294 T A 0.1131
295 L A 1.4351
296 G A -0.1734
297 G A -0.1258
298 H A -0.5315
299 S A 0.0140
300 C A 0.0000
301 V A 1.6805
302 C A 0.6975
303 V A 1.7545
304 N A 0.1892
305 G A -0.1554
306 W A 0.1019
307 T A -0.0246
308 G A -0.4131
309 E A -1.8628
310 S A -0.5310
311 C A -0.1646
312 S A -0.2770
313 Q A -0.6878
314 N A 0.0000
315 I A 0.1152
316 D A -0.5773
317 D A -0.3101
318 C A 0.0000
319 A A 0.0000
320 T A 0.0112
321 A A 0.0202
322 V A 0.0000
323 C A 0.0000
324 F A 1.5955
325 H A -0.5756
326 G A -0.4461
327 A A 0.0000
328 T A 0.0050
329 C A 0.0082
330 H A -0.3296
331 D A 0.0000
332 R A -0.2982
333 V A 0.4330
334 A A 0.1075
335 S A -0.0206
336 F A 0.0000
337 Y A 0.1453
338 C A 0.0000
339 A A 0.0000
340 C A 0.0000
341 P A -0.1125
342 M A 0.0000
343 G A -0.4999
344 K A -0.2625
345 T A 0.0000
346 G A 0.0000
347 L A 0.3294
348 L A 0.0000
349 C A 0.0000
350 H A 0.0000
351 L A 1.0146
352 D A -0.3441
353 D A -0.4867
354 A A -0.0487
355 C A 0.0000
356 V A 1.0078
357 S A -0.2594
358 N A -1.3624
359 P A -0.4760
360 C A 0.0595
361 H A -0.4285
362 E A -1.8398
363 D A 0.0000
364 A A 0.0000
365 I A 0.0000
366 C A 0.0000
367 D A -0.1885
368 T A 0.0000
369 N A 0.0000
370 P A -0.0363
371 V A 0.0000
372 N A 0.0000
373 G A -0.3354
374 R A -0.9957
375 A A -0.1627
376 I A 0.0000
377 C A 0.0974
378 T A 0.0000
379 C A 0.0000
380 P A -0.0507
381 P A 0.0000
382 G A -0.0718
383 F A 0.0000
384 T A -0.1348
385 G A -0.5594
386 G A -0.5489
387 A A -0.0956
388 C A -0.2316
389 D A -1.8233
390 Q A -0.9793
391 D A -1.8503
392 V A 0.0000
393 D A 0.0000
394 E A 0.0000
395 C A 0.0000
396 S A -0.0626
397 I A 0.0000
398 G A -0.0528
399 A A 0.0000
400 N A -0.1405
401 P A 0.0000
402 C A 0.0000
403 E A -0.7780
404 H A -1.1784
405 L A 0.0000
406 G A -0.4369
407 R A -1.7001
408 C A 0.0000
409 V A 0.2439
410 N A 0.0000
411 T A 0.0000
412 Q A -0.2951
413 G A 0.0000
414 S A 0.0000
415 F A 0.3874
416 L A 0.4639
417 C A 0.0241
418 Q A -0.9107
419 Y A 0.9993
420 G A -0.3467
421 R A -0.7723
422 G A -0.1174
423 Y A 0.3045
424 T A -0.0317
425 G A -0.3752
426 P A -0.4517
427 R A -0.6767
428 C A 0.0000
429 E A 0.0000
430 T A -0.0629
431 D A -0.1961
432 V A 0.1418
433 N A -0.1889
434 E A -0.3571
435 C A 0.0000
436 L A 0.1532
437 S A -0.1123
438 G A -0.2009
439 P A -0.0774
440 C A 0.0000
441 R A -0.4251
442 N A -0.4110
443 Q A 0.0000
444 A A 0.0000
445 T A -0.0113
446 C A 0.0000
447 L A 0.0000
448 D A 0.0000
449 R A -1.0941
450 I A 1.6765
451 G A -0.1896
452 Q A -1.1897
453 F A 0.1520
454 T A 0.0000
455 C A 0.0000
456 I A 0.0000
457 C A 0.0000
458 M A 0.0000
459 A A 0.0138
460 G A -0.0197
461 F A 0.2400
462 T A -0.0170
463 G A -0.2878
464 T A -0.0478
465 Y A 0.1414
466 C A 0.0000
467 E A -0.2150
468 V A 0.0000
469 D A 0.0000
470 I A 1.8122
471 D A 0.0415
472 E A -0.3333
473 C A 0.0000
474 Q A -0.4449
475 S A -0.1259
476 S A -0.0282
477 P A 0.0000
478 C A 0.0000
479 V A 0.7872
480 N A -0.0903
481 G A -0.5229
482 G A -0.2145
483 V A 0.2104
484 C A 0.0000
485 K A -0.4786
486 D A 0.0000
487 R A -0.9840
488 V A 0.6490
489 N A -0.4633
490 G A -0.2386
491 F A 0.4106
492 S A -0.0389
493 C A 0.1094
494 T A 0.0098
495 C A 0.1073
496 P A -0.2373
497 S A -0.1483
498 G A 0.2833
499 F A 1.8979
500 S A 0.2157
501 G A -0.1658
502 S A -0.2169
503 T A -0.0169
504 C A 0.1777
505 Q A 0.1394
506 L A 1.0629
507 D A 0.0000
508 V A 0.2255
509 D A -0.6389
510 E A -1.8817
511 C A 0.0000
512 A A -0.1670
513 S A -0.2158
514 T A -0.1214
515 P A -0.0558
516 C A 0.0000
517 R A -2.0844
518 N A -1.7121
519 G A -0.7038
520 A A -0.2910
521 K A -1.2920
522 C A 0.2395
523 V A 0.9558
524 D A -1.0779
525 Q A -1.3660
526 P A -0.7099
527 D A -1.8421
528 G A -0.2985
529 Y A 1.1578
530 E A -0.3497
531 C A -0.0887
532 R A -0.6124
533 C A -0.0440
534 A A -0.3098
535 E A -1.6446
536 G A -0.3609
537 F A 1.1848
538 E A -1.4309
539 G A -0.7966
540 T A 0.0361
541 L A 1.0285
542 C A 0.0000
543 D A -0.6912
544 R A -1.4142
545 N A -1.4717
546 V A -0.1550
547 D A -2.0526
548 D A -1.9927
549 C A 0.3553
550 S A -0.1053
551 P A -0.3481
552 D A -0.8445
553 P A -0.3536
554 C A 0.0123
555 H A -1.1355
556 H A -1.1885
557 G A -0.6904
558 R A -1.7837
559 C A 0.2611
560 V A 0.9774
561 D A -1.6067
562 G A -0.2827
563 I A 1.9608
564 A A 0.3610
565 S A -0.1498
566 F A 0.2191
567 S A -0.0477
568 C A 0.0000
569 A A -0.1380
570 C A 0.1156
571 A A 0.0642
572 P A -0.0787
573 G A -0.0393
574 Y A 0.0306
575 T A -0.0978
576 G A -0.6242
577 T A -0.3880
578 R A -1.3414
579 C A 0.0000
580 E A -1.8964
581 S A -0.7151
582 Q A -1.0532
583 V A 0.2612
584 D A -1.5247
585 E A -0.9295
586 C A -0.4110
587 R A -1.8645
588 S A -0.5942
589 Q A -0.3007
590 P A -0.2626
591 C A 0.1004
592 R A -0.3528
593 H A -1.1300
594 G A -0.6781
595 G A -0.6342
596 K A -1.7015
597 C A 0.1012
598 L A 1.4072
599 D A -0.4061
600 L A 0.6170
601 V A 0.6416
602 D A -1.6289
603 K A -1.9278
604 Y A 0.0312
605 L A 1.1562
606 C A 0.0618
607 R A -1.8060
608 C A 0.0000
609 P A -0.2637
610 S A -0.1841
611 G A -0.3353
612 T A -0.1156
613 T A -0.1232
614 G A -0.1427
615 V A 1.4938
616 N A -0.7512
617 C A 0.0000
618 E A -0.6578
619 V A 0.4631
620 N A 0.0000
621 I A 0.9094
622 D A -0.9207
623 D A -1.2586
624 C A 0.3152
625 A A 0.1348
626 S A -0.3679
627 N A -1.3435
628 P A -0.4504
629 C A 0.0921
630 T A 0.3593
631 F A 1.9016
632 G A 0.4748
633 V A 1.5788
634 C A 0.3444
635 R A -1.8994
636 D A -1.0202
637 G A 0.0785
638 I A 1.8716
639 N A -0.5331
640 R A -1.9605
641 Y A -0.4049
642 D A -1.6842
643 C A 0.0727
644 V A 0.8797
645 C A 0.1774
646 Q A -0.4444
647 P A -0.3657
648 G A 0.0077
649 F A 0.1735
650 T A -0.0182
651 G A -0.2399
652 P A 0.1876
653 L A 1.6614
654 C A 0.7696
655 N A -0.8767
656 V A 0.9596
657 E A -0.1053
658 I A 1.3357
659 N A -0.5200
660 E A -1.8577
661 C A 0.0000
662 A A 0.0173
663 S A -0.2093
664 S A -0.1291
665 P A -0.2297
666 C A 0.1173
667 G A -0.4540
668 E A -1.9688
669 G A -0.8618
670 G A -0.5770
671 S A -0.2336
672 C A 0.2316
673 V A 0.7470
674 D A -0.3530
675 G A -0.5709
676 E A -2.0032
677 N A -1.2132
678 G A 0.0843
679 F A 1.5687
680 R A -1.4582
681 C A 0.0323
682 L A 1.5786
683 C A 0.2867
684 P A -0.3111
685 P A -0.2564
686 G A -0.5529
687 S A -0.2174
688 L A 0.4410
689 P A -0.1933
690 P A -0.2859
691 L A 0.1521
692 C A 0.0000
693 L A 0.1722
694 P A -0.1050
695 P A -0.3123
696 S A -0.4453
697 H A -1.0783
698 P A -0.4227
699 C A 0.0747
700 A A -0.1110
701 H A -1.3198
702 E A -2.0554
703 P A -0.5537
704 C A 0.2083
705 S A -0.1219
706 H A -0.2298
707 G A -0.1259
708 I A 1.9545
709 C A 0.8129
710 Y A 0.8105
711 D A -1.0653
712 A A -0.3867
713 P A -0.3223
714 G A -0.5871
715 G A -0.1828
716 F A 1.3336
717 R A -1.2999
718 C A 0.1969
719 V A 1.6466
720 C A 0.4997
721 E A -1.7798
722 P A -0.8439
723 G A -0.2897
724 W A 1.0590
725 S A -0.0812
726 G A -0.5576
727 P A -0.7013
728 R A -1.7534
729 C A 0.3390
730 S A -0.3048
731 Q A -1.2802
732 S A -0.2413
733 L A 1.0285
734 A A -0.0819
735 R A -2.1744
736 D A -2.0237
737 A A -0.3470
738 C A 0.0227
739 E A -0.9478
740 S A -0.5280
741 Q A -1.2751
742 P A -0.4917
743 C A 0.1179
744 R A -0.8308
745 A A -0.2364
746 G A -0.5168
747 G A -0.3878
748 T A 0.0118
749 C A 0.6907
750 S A -0.0465
751 S A -0.5810
752 D A -1.7966
753 G A -0.6034
754 M A 0.7492
755 G A 0.1250
756 F A 0.6228
757 H A -0.6148
758 C A -0.0891
759 T A 0.0918
760 C A 0.4671
761 P A 0.0193
762 P A -0.2853
763 G A 0.2018
764 V A 1.6150
765 Q A -0.5017
766 G A -0.8487
767 R A -1.7929
768 Q A -1.3768
769 C A 0.0000
770 E A 0.0000
771 L A 0.2933
772 L A 0.0000
773 S A -0.1174
774 P A -0.2250
775 C A 0.1817
776 T A -0.0611
777 P A -0.3114
778 N A -0.3418
779 P A -0.1329
780 C A 0.5371
781 E A -0.7094
782 H A -1.1128
783 G A 0.0000
784 G A -0.5474
785 R A -1.7945
786 C A -0.2384
787 E A -1.7384
788 S A -0.3739
789 A A 0.0044
790 P A -0.1812
791 G A -0.3438
792 Q A -0.9131
793 L A 1.3149
794 P A 0.0000
795 V A 0.8114
796 C A 0.0000
797 S A -0.1623
798 C A 0.0000
799 P A 0.0000
800 Q A -0.2808
801 G A -0.4950
802 W A 0.0000
803 Q A -1.2729
804 G A -0.8485
805 P A -0.5893
806 R A -1.2717
807 C A 0.0000
808 Q A -1.3103
809 Q A -0.9071
810 D A -0.2132
811 V A 1.6461
812 D A -0.2400
813 E A -1.8273
814 C A -0.1511
815 A A 0.0543
816 G A -0.1121
817 P A -0.0762
818 A A 0.0011
819 P A -0.2438
820 C A 0.0000
821 G A -0.1044
822 P A -0.0929
823 H A -0.2443
824 G A 0.0000
825 I A 0.6953
826 C A 0.0000
827 T A 0.0000
828 N A -0.1938
829 L A 0.2979
830 A A 0.1259
831 G A 0.0000
832 S A 0.0000
833 F A 0.4062
834 S A 0.0000
835 C A 0.0770
836 T A 0.0155
837 C A 0.0677
838 H A 0.0000
839 G A -0.4946
840 G A -0.2545
841 Y A -0.0230
842 T A -0.0085
843 G A -0.1440
844 P A -0.0445
845 S A -0.0444
846 C A 0.0620
847 D A -1.4604
848 Q A -0.8563
849 D A -1.2204
850 I A 0.0000
851 N A -0.7178
852 D A -1.8411
853 C A -0.5842
854 D A -1.7849
855 P A -0.6522
856 N A -0.4012
857 P A -0.1457
858 C A 0.0000
859 L A 0.1508
860 N A -0.2517
861 G A -0.5384
862 G A -0.3185
863 S A -0.0549
864 C A -0.0743
865 Q A -1.5080
866 D A -2.0429
867 G A -0.1485
868 V A 1.7366
869 G A 0.2758
870 S A 0.1629
871 F A 0.1726
872 S A 0.0055
873 C A 0.0000
874 S A -0.1582
875 C A 0.0000
876 L A 1.2211
877 P A -0.0256
878 G A -0.1477
879 F A 0.0000
880 A A 0.0000
881 G A -0.2963
882 P A -0.3977
883 R A -0.5988
884 C A 0.0000
885 A A -0.2932
886 R A -1.8672
887 D A -0.5322
888 V A 0.0000
889 D A -0.3108
890 E A 0.0000
891 C A 0.9794
892 L A 1.4632
893 S A 0.2247
894 N A 0.0000
895 P A 0.0000
896 C A 0.0000
897 G A -0.1883
898 P A -0.3516
899 G A -0.4274
900 T A -0.0800
901 C A 0.2991
902 T A -0.0748
903 D A -0.6265
904 H A -0.1675
905 V A 0.2580
906 A A 0.0496
907 S A 0.0000
908 F A 0.0000
909 T A 0.0000
910 C A 0.0000
911 T A -0.0165
912 C A 0.0000
913 P A -0.1305
914 P A -0.2892
915 G A -0.0959
916 Y A 0.0000
917 G A -0.0496
918 G A 0.0000
919 F A 0.0000
920 H A 0.0000
921 C A 0.0000
922 E A 0.0000
923 Q A -0.4284
924 D A 0.0000
925 L A 0.4413
926 P A -0.2988
927 D A -1.7800
928 C A -0.2935
929 S A -0.2330
930 P A -0.2335
931 S A -0.0837
932 S A 0.0000
933 C A 0.0000
934 F A 0.0000
935 N A -0.8595
936 G A -0.6484
937 G A -0.2915
938 T A -0.0107
939 C A 0.3393
940 V A 0.7516
941 D A 0.0000
942 G A 0.1155
943 V A 1.0223
944 N A -0.0138
945 S A -0.2087
946 F A 0.1429
947 S A 0.0084
948 C A 0.0000
949 L A 0.7233
950 C A 0.0000
951 R A -1.8702
952 P A -0.5484
953 G A -0.2996
954 Y A 0.2118
955 T A 0.0019
956 G A 0.0000
957 A A 0.0000
958 H A -0.0850
959 C A 0.0269
960 Q A -0.2725
961 H A -0.4922
962 E A -0.5605
963 A A -0.1221
964 D A -0.4232
965 P A -0.3087
966 C A 0.3400
967 L A 1.5339
968 S A 0.0092
969 R A -0.6382
970 P A -0.1442
971 C A 0.4640
972 L A 1.5580
973 H A 0.1222
974 G A -0.5244
975 G A 0.0920
976 V A 1.7851
977 C A 0.5551
978 S A 0.0255
979 A A 0.1607
980 A A -0.1033
981 H A -0.6211
982 P A -0.3950
983 G A -0.2377
984 F A 1.3114
985 R A 0.0000
986 C A 0.0000
987 T A 0.0000
988 C A 0.2367
989 L A -0.1639
990 E A -1.7911
991 S A -0.3909
992 F A 0.0000
993 T A 0.0684
994 G A 0.0000
995 P A -0.1902
996 Q A -1.0666
997 C A 0.2635
998 Q A -1.0669
999 T A 0.0179
1000 L A 1.6954
1001 V A 1.0211
1002 D A -0.3419
1003 W A 0.5345
1004 C A 0.7997
1005 S A -0.3275
1006 R A -1.9482
1007 Q A -0.7743
1008 P A -0.2711
1009 C A -0.1773
1010 Q A -1.4214
1011 N A -1.5881
1012 G A -0.8001
1013 G A -0.5558
1014 R A 0.0000
1015 C A 0.6875
1016 V A 0.7137
1017 Q A -0.5581
1018 T A -0.1920
1019 G A -0.1325
1020 A A 0.1804
1021 Y A 1.3799
1022 C A 0.0000
1023 L A 1.3350
1024 C A 0.7952
1025 P A -0.1523
1026 P A -0.3634
1027 G A -0.3001
1028 W A 0.0471
1029 S A 0.0075
1030 G A 0.0000
1031 R A -1.7891
1032 L A -0.0517
1033 C A 0.0000
1034 D A -0.4452
1035 I A 0.0000
1036 R A -1.8121
1037 S A -0.5083
1038 L A 0.0528
1039 P A -0.1712
1040 C A 0.0000
1041 R A -2.1483
1042 E A -1.9461
1043 A A 0.0000
1044 A A -0.1222
1045 A A -0.2353
1046 Q A -0.8092
1047 I A 1.7003
1048 G A 0.0153
1049 V A 0.0784
1050 R A -1.7428
1051 L A -0.2059
1052 E A -1.8888
1053 Q A -1.4435
1054 L A 0.0000
1055 C A 0.0000
1056 Q A -0.4872
1057 A A -0.0578
1058 G A -0.2438
1059 G A -0.7244
1060 Q A -1.2719
1061 C A -0.0333
1062 V A 0.4376
1063 D A -0.8806
1064 E A -2.2829
1065 D A -2.1762
1066 S A -0.5588
1067 S A 0.0000
1068 H A 0.0000
1069 Y A 0.2671
1070 C A 0.0000
1071 V A 0.6554
1072 C A 0.0000
1073 P A -0.3996
1074 E A -0.8099
1075 G A -0.3285
1076 R A -0.5652
1077 T A -0.0844
1078 G A 0.0000
1079 S A 0.0000
1080 H A -0.1859
1081 C A -0.1438
1082 E A -1.2299
1083 Q A -1.0950
1084 E A -1.1817
1085 V A 0.6032
1086 D A -1.2397
1087 P A -0.2750
1088 C A 0.3068
1089 L A 0.7064
1090 A A 0.1435
1091 Q A 0.0000
1092 P A 0.0446
1093 C A 0.6530
1094 Q A -0.3031
1095 H A -0.7975
1096 G A -0.2133
1097 G A -0.1218
1098 T A -0.0173
1099 C A -0.1845
1100 R A -1.8001
1101 G A -0.5394
1102 Y A 1.2482
1103 M A 0.1744
1104 G A -0.4559
1105 G A -0.0056
1106 Y A 0.3430
1107 M A 0.7916
1108 C A 0.1957
1109 E A -0.4501
1110 C A 0.0000
1111 L A 0.5832
1112 P A 0.0585
1113 G A -0.1642
1114 Y A 0.3201
1115 N A -1.2326
1116 G A -0.8732
1117 D A -1.2061
1118 N A -1.3933
1119 C A -0.1199
1120 E A -0.8721
1121 D A -1.4320
1122 D A -0.1113
1123 V A 0.6752
1124 D A -1.8026
1125 E A -1.4210
1126 C A -0.0071
1127 A A -0.0726
1128 S A -0.2173
1129 Q A -0.2996
1130 P A -0.2903
1131 C A 0.0000
1132 Q A -0.3398
1133 H A -0.3168
1134 G A -0.4986
1135 G A 0.0000
1136 S A -0.0262
1137 C A 0.0000
1138 I A 0.0000
1139 D A -0.2408
1140 L A 0.0000
1141 V A 0.2807
1142 A A -0.2672
1143 R A -1.7291
1144 Y A -0.1385
1145 L A 0.0000
1146 C A 0.0000
1147 S A 0.0000
1148 C A 0.0000
1149 P A 0.0000
1150 P A 0.0000
1151 G A -0.2118
1152 T A 0.0000
1153 L A 0.0000
1154 G A 0.0000
1155 V A 0.8525
1156 L A 1.6524
1157 C A 0.0000
1158 E A -0.9455
1159 I A 0.1699
1160 N A -1.0472
1161 E A -2.1226
1162 D A -1.4664
1163 D A -1.9333
1164 C A 0.0000
1165 G A -0.2627
1166 P A -0.3206
1167 G A -0.1030
1168 P A -0.0916
1169 P A -0.2605
1170 L A 0.0000
1171 D A -1.8031
1172 S A -0.4957
1173 G A -0.4802
1174 P A 0.0000
1175 R A -0.7806
1176 C A 0.0000
1177 L A 1.4734
1178 H A -0.3480
1179 N A -1.4352
1180 G A -0.7118
1181 T A -0.1461
1182 C A 0.2794
1183 V A 1.0475
1184 D A 0.1705
1185 L A 1.4276
1186 V A 1.2439
1187 G A 0.2675
1188 G A -0.1196
1189 F A 0.0000
1190 R A -1.7414
1191 C A 0.0000
1192 T A -0.0461
1193 C A 0.0966
1194 P A -0.1024
1195 P A -0.2559
1196 G A -0.1034
1197 Y A 0.2107
1198 T A 0.0050
1199 G A 0.0768
1200 L A 0.8197
1201 R A 0.0000
1202 C A 0.0000
1203 E A -0.2116
1204 A A 0.0000
1205 D A -0.0593
1206 I A 0.3914
1207 N A 0.0000
1208 E A -1.7624
1209 C A -0.3879
1210 R A -1.8270
1211 S A -0.5821
1212 G A -0.1272
1213 A A 0.0000
1214 C A 0.7041
1215 H A 0.0064
1216 A A -0.0136
1217 A A 0.0339
1218 H A -0.4616
1219 T A 0.0000
1220 R A -0.5364
1221 D A 0.0000
1222 C A 0.0000
1223 L A 0.2079
1224 Q A -0.4361
1225 D A -0.4570
1226 P A -0.3514
1227 G A -0.2213
1228 G A -0.1767
1229 G A 0.0085
1230 F A 0.5529
1231 R A -1.6162
1232 C A 0.0000
1233 L A 1.5014
1234 C A 0.2227
1235 H A -0.9598
1236 A A -0.1962
1237 G A -0.1578
1238 F A 0.0000
1239 S A -0.0792
1240 G A -0.2537
1241 P A -0.5047
1242 R A -1.1952
1243 C A 0.0000
1244 Q A 0.0000
1245 T A 0.0000
1246 V A 0.0000
1247 L A 0.5853
1248 S A 0.0000
1249 P A 0.0000
1250 C A -0.1362
1251 E A -1.5528
1252 S A -0.6029
1253 Q A -0.6981
1254 P A -0.2631
1255 C A -0.0818
1256 Q A -0.8053
1257 H A -0.2831
1258 G A -0.3091
1259 G A -0.5397
1260 Q A -0.7597
1261 C A 0.0000
1262 R A -0.2711
1263 P A 0.0000
1264 S A 0.0000
1265 P A 0.0000
1266 G A -0.3800
1267 P A -0.4099
1268 G A -0.5982
1269 G A -0.5489
1270 G A -0.1542
1271 L A 0.1732
1272 T A 0.2146
1273 F A 1.0268
1274 T A 0.1926
1275 C A 0.0000
1276 H A -0.2053
1277 C A 0.0000
1278 A A 0.0142
1279 Q A 0.0000
1280 P A 0.0000
1281 F A 0.0000
1282 W A 0.1663
1283 G A -0.3164
1284 P A -0.4828
1285 R A -1.4134
1286 C A 0.0000
1287 E A -2.2963
1288 R A -2.1538
1289 V A -0.1154
1290 A A 0.0000
1291 R A -0.5567
1292 S A -0.1656
1293 C A 0.0000
1294 R A 0.0000
1295 E A 0.0000
1296 L A 0.0000
1297 Q A 0.0000
1298 C A 0.0000
1299 P A 0.1028
1300 V A 0.6384
1301 G A -0.2883
1302 V A 0.1206
1303 P A -0.1225
1304 C A 0.0024
1305 Q A -0.2812
1306 Q A -0.4223
1307 T A 0.0000
1308 P A -0.5992
1309 R A -1.9120
1310 G A -0.4625
1311 P A -0.1439
1312 R A -0.3143
1313 C A 0.0000
1314 A A 0.0333
1315 C A 0.1216
1316 P A -0.0535
1317 P A -0.3465
1318 G A -0.5137
1319 L A 0.0000
1320 S A 0.0000
1321 G A -0.1077
1322 P A -0.0803
1323 S A -0.0376
1324 C A 0.0000
1325 R A -1.0877
1326 S A -0.1820
1327 F A 0.3522
1328 P A -0.0887
1329 G A -0.5044
1330 S A -0.2620
1331 P A -0.3081
1332 P A -0.2331
1333 G A -0.1905
1334 A A -0.0319
1335 S A -0.2756
1336 N A -1.2775
1337 A A -0.2165
1338 S A 0.0000
1339 C A 0.1336
1340 A A 0.0866
1341 A A 0.0320
1342 A A -0.0507
1343 P A -0.2338
1344 C A 0.0859
1345 L A 0.0315
1346 H A -1.0397
1347 G A -0.7157
1348 G A -0.4434
1349 S A -0.2729
1350 C A 0.0000
1351 R A -2.0797
1352 P A -0.5321
1353 A A -0.0739
1354 P A 0.0186
1355 L A 1.4473
1356 A A 0.2812
1357 P A 0.0000
1358 F A 0.6908
1359 F A 0.3376
1360 R A -1.8459
1361 C A 0.0685
1362 A A 0.1265
1363 C A 0.1225
1364 A A -0.0764
1365 Q A -0.1080
1366 G A 0.0603
1367 W A 1.1351
1368 T A 0.0761
1369 G A -0.4982
1370 P A -0.3680
1371 R A -1.0248
1372 C A -0.3986
1373 E A -1.5719
1374 A A -0.3101
1375 P A -0.0667
1376 A A 0.0038
1377 A A 0.0000
1378 A A -0.0027
1379 P A 0.0179
1380 E A -0.1192
1381 V A 1.6523
1382 S A 0.0904
1383 E A -0.8385
1384 E A -0.5274
1385 P A -0.4908
1386 R A -0.5226
1387 C A 0.0165
1388 P A -0.5598
1389 R A -1.8814
1390 A A -0.4043
1391 A A 0.0433
1392 C A 0.0000
1393 Q A -1.1814
1394 A A -0.2537
1395 K A -0.8068
1396 R A -1.9329
1397 G A 0.0000
1398 D A -0.5815
1399 Q A -0.6769
1400 R A -0.7466
1401 C A 0.0000
1402 D A -0.8407
1403 R A 0.0000
1404 E A -0.8730
1405 C A 0.0000
1406 N A 0.0000
1407 S A 0.0000
1408 P A 0.0000
1409 G A -0.4340
1410 C A 0.1345
1411 G A -0.1383
1412 W A 0.0000
1413 D A 0.0000
1414 G A -0.5228
1415 G A -0.4902
1416 D A -0.5492
1417 C A 0.0000
1418 S A -0.0917
1419 L A 0.0000
1420 S A 0.3030
1421 V A 1.7654
1422 G A 0.0000
1423 D A -0.2136
1424 P A 0.0000
1425 W A 0.0000
1426 R A -2.3101
1427 Q A -1.5335
1428 C A -0.4693
1429 E A -2.0460
1430 A A -0.1581
1431 L A 0.6650
1432 Q A -0.2563
1433 C A 0.0000
1434 W A 0.0000
1435 R A -0.6016
1436 L A 0.0000
1437 F A 0.0000
1438 N A -0.4931
1439 N A -1.3257
1440 S A -0.5442
1441 R A -1.5023
1442 C A 0.0000
1443 D A -0.5981
1444 P A -0.3454
1445 A A 0.0114
1446 C A 0.0000
1447 S A -0.2191
1448 S A -0.0956
1449 P A -0.1246
1450 A A -0.0182
1451 C A 0.0000
1452 L A 0.0000
1453 Y A 0.0000
1454 D A 0.0000
1455 N A 0.0000
1456 F A 0.0000
1457 D A 0.0000
1458 C A 0.1491
1459 H A -0.3360
1460 A A 0.0000
1461 G A -0.2223
1462 G A -0.6629
1463 R A -1.4020
1464 E A -2.1480
1465 R A -1.1713
1466 T A 0.0000
1467 C A 0.0000
1468 N A -0.9593
1469 P A -0.4865
1470 V A 0.0000
1471 Y A 0.0000
1472 E A -1.9314
1473 K A -1.2003
1474 Y A 0.0000
1475 C A 0.0000
1476 A A 0.0000
1477 D A -0.3704
1478 H A 0.1761
1479 F A 1.9258
1480 A A 0.0809
1481 D A -1.7807
1482 G A 0.0000
1483 R A -1.5648
1484 C A -0.2859
1485 D A -0.3755
1486 Q A 0.0000
1487 G A -0.1241
1488 C A 0.0688
1489 N A 0.0000
1490 T A 0.0000
1491 E A 0.0000
1492 E A -0.2836
1493 C A 0.0305
1494 G A 0.0000
1495 W A 0.0810
1496 D A -0.2244
1497 G A -0.0944
1498 L A 0.0000
1499 D A -1.0495
1500 C A 0.1616
1501 A A 0.0434
1502 S A -0.6948
1503 E A -1.7959
1504 V A -0.0650
1505 P A -0.1873
1506 A A 0.0537
1507 L A 0.5538
1508 L A 0.6209
1509 A A 0.0828
1510 R A -0.1929
1511 G A 0.0000
1512 V A 0.0000
1513 L A 0.0000
1514 V A 0.0000
1515 L A 0.1800
1516 T A 0.0000
1517 V A 0.0000
1518 L A 0.0000
1519 L A 0.2451
1520 P A 0.0101
1521 P A 0.0000
1522 E A -1.6649
1523 E A -2.0677
1524 L A 0.0000
1525 L A 0.4691
1526 R A -1.7109
1527 S A -0.5121
1528 S A 0.0293
1529 A A -0.0523
1530 D A -0.3250
1531 F A 0.4300
1532 L A 0.2447
1533 Q A -0.2168
1534 R A -0.4271
1535 L A 0.0000
1536 S A 0.0000
1537 A A -0.0769
1538 I A 0.0000
1539 L A 0.0000
1540 R A 0.0000
1541 T A 0.0000
1542 S A 0.0000
1543 L A 0.0000
1544 R A -0.2373
1545 F A -0.0351
1546 R A -0.9199
1547 L A 0.0000
1548 D A -1.5351
1549 A A -0.3411
1550 H A -0.4990
1551 G A -0.8357
1552 Q A -0.7860
1553 A A -0.2502
1554 M A 0.0000
1555 V A 0.2094
1556 F A 0.2286
1557 P A 0.0000
1558 Y A 0.0000
1559 H A -1.1081
1560 R A -1.4653
1561 P A -0.3369
1562 S A -0.1001
1563 P A -0.0758
1564 G A -0.1708
1565 S A -0.1993
1566 E A -0.3745
1567 P A -0.4401
1568 R A -0.6823
1569 A A -0.1319
1570 R A -0.5907
1571 R A -1.6384
1572 E A -1.7606
1573 L A 1.2101
1574 A A 0.2911
1575 P A -0.5126
1576 E A -1.8523
1577 V A 0.0000
1578 I A 0.7879
1579 G A 0.0000
1580 S A 0.0000
1581 V A 0.0000
1582 V A 0.0000
1583 M A 0.0000
1584 L A 0.0000
1585 E A 0.0000
1586 I A 0.0000
1587 D A -0.2174
1588 N A -0.5975
1589 R A -1.7776
1590 L A 0.2086
1591 C A 0.0000
1592 L A -0.0144
1593 Q A -1.1846
1594 S A -0.3728
1595 P A 0.0000
1596 E A -1.8783
1597 N A -0.9211
1598 D A -1.4812
1599 H A 0.0000
1600 C A 0.4278
1601 F A 0.0000
1602 P A -0.3886
1603 D A -1.7995
1604 A A 0.0000
1605 Q A -0.6521
1606 S A -0.1445
1607 A A 0.0000
1608 A A 0.0000
1609 D A 0.0000
1610 Y A 0.0000
1611 L A 0.0000
1612 G A 0.0000
1613 A A 0.0000
1614 L A 0.0000
1615 S A 0.0000
1616 A A 0.0000
1617 V A 0.0000
1618 E A -1.4049
1619 R A -1.9692
1620 L A 0.0000
1621 D A -1.2687
1622 F A 0.0000
1623 P A -0.1235
1624 Y A 0.4340
1625 P A 0.0556
1626 L A 0.0000
1627 R A -0.1787
1628 D A 0.0000
1629 V A 0.0000
1630 R A -1.0783
1631 G A 0.0000
1632 E A -0.3189
1633 P A -0.0272
1634 L A 1.1499
1635 E A -1.5861
1636 P A -0.8056
1637 P A 0.0000
1638 E A -1.8825
1639 P A -0.7397
1640 S A 0.0711
1641 V A 1.6852
1642 P A 0.3652
1643 L A 1.7842
1644 L A 1.9997
1645 P A 0.9368
1646 L A 1.8338
1647 L A 2.1609
1648 V A 1.1048
1649 A A 0.4820
1650 G A -0.2895
1651 A A 0.4415
1652 V A 2.0758
1653 L A 1.9915
1654 L A 1.3185
1655 L A 0.7155
1656 V A 1.2082
1657 I A 1.6866
1658 L A 0.5710
1659 V A 0.7108
1660 L A 1.6737
1661 G A 0.2300
1662 V A 0.0000
1663 M A 1.0787
1664 V A 1.8888
1665 A A 0.2314
1666 R A -0.6783
1667 R A -0.5586
1668 K A -0.9954
1669 R A 0.0000
1670 E A -1.2235
1671 H A -1.2263
1672 S A -0.4047
1673 T A 0.1633
1674 L A 1.2849
1675 W A 1.2868
1676 F A 2.0341
1677 P A 0.0406
1678 E A -1.9200
1679 G A -0.6588
1680 F A 0.2252
1681 S A 0.0275
1682 L A 0.7115
1683 H A -1.1228
1684 K A -1.9419
1685 D A -0.5780
1686 V A 0.3391
1687 A A 0.0000
1688 S A 0.0000
1689 G A 0.0000
1690 H A 0.0000
1691 K A -1.4518
1692 G A -1.0333
1693 R A -2.4053
1694 R A -2.2908
1695 E A -0.8881
1696 P A -0.2686
1697 V A 0.3252
1698 G A -0.2675
1699 Q A -1.0658
1700 D A -1.9074
1701 A A -0.1970
1702 L A 0.3699
1703 G A -0.3505
1704 M A -0.2719
1705 K A -1.5234
1706 N A -0.4537
1707 M A 0.1379
1708 A A -0.1128
1709 K A -1.0943
1710 G A -0.3650
1711 E A 0.0000
1712 S A 0.2011
1713 L A 1.3621
1714 M A 0.3231
1715 G A -0.5127
1716 E A -0.2686
1717 V A 1.1367
1718 A A 0.2564
1719 T A -0.3397
1720 D A -1.7031
1721 W A 0.1579
1722 M A -0.0362
1723 D A -1.3132
1724 T A -0.6117
1725 E A -1.7757
1726 C A 0.0220
1727 P A -0.2951
1728 E A -0.6402
1729 A A -0.1841
1730 K A -0.9706
1731 R A -1.5332
1732 L A 1.1578
1733 K A 0.2630
1734 V A 1.7051
1735 E A 0.0000
1736 E A -1.7388
1737 P A -0.4244
1738 G A -0.3202
1739 M A 0.7531
1740 G A 0.0721
1741 A A 0.1657
1742 E A -0.2332
1743 E A 0.0000
1744 A A -0.1450
1745 V A 0.0000
1746 D A 0.0000
1747 C A 0.7316
1748 R A 0.0000
1749 Q A -0.4581
1750 W A 0.0000
1751 T A 0.0000
1752 Q A 0.0000
1753 H A 0.0000
1754 H A 0.0000
1755 L A 0.0000
1756 V A 0.0000
1757 A A 0.0000
1758 A A 0.0000
1759 D A -0.3594
1760 I A 0.0000
1761 R A -1.2781
1762 V A 1.4663
1763 A A 0.1484
1764 P A -0.0278
1765 A A 0.0503
1766 M A 0.0000
1767 A A 0.0364
1768 L A 0.0000
1769 T A -0.1201
1770 P A -0.2835
1771 P A -0.3531
1772 Q A -1.2128
1773 G A 0.0000
1774 D A -0.4946
1775 A A 0.0000
1776 D A -1.8106
1777 A A -0.3438
1778 D A -0.4671
1779 G A -0.5162
1780 M A -0.2379
1781 D A -1.3870
1782 V A -0.0895
1783 N A 0.0000
1784 V A 0.0000
1785 R A 0.0000
1786 G A 0.0000
1787 P A -0.0250
1788 D A 0.0000
1789 G A 0.0000
1790 F A 0.0000
1791 T A 0.0000
1792 P A 0.0000
1793 L A 0.0000
1794 M A 0.0000
1795 L A 0.0000
1796 A A 0.0000
1797 S A 0.0000
1798 F A 0.0000
1799 C A 0.0000
1800 G A 0.0000
1801 G A 0.0000
1802 A A 0.0000
1803 L A 0.0000
1804 E A 0.0000
1805 P A -0.0264
1806 M A 0.0000
1807 P A 0.0000
1808 T A -0.4544
1809 E A -1.9974
1810 E A -1.6154
1811 D A -2.0037
1812 E A -0.5413
1813 A A 0.0000
1814 D A 0.0000
1815 D A 0.0000
1816 T A 0.0000
1817 S A 0.0000
1818 A A 0.0000
1819 S A 0.0000
1820 I A 0.2216
1821 I A 0.0000
1822 S A 0.0000
1823 D A -0.2105
1824 L A 0.0000
1825 I A 0.8541
1826 C A 0.7463
1827 Q A -0.3693
1828 G A -0.3010
1829 A A -0.1368
1830 Q A -0.5090
1831 L A 0.0046
1832 G A -0.4278
1833 A A -0.1902
1834 R A -0.5706
1835 T A -0.4694
1836 D A -2.1591
1837 R A -2.1943
1838 T A -0.3720
1839 G A -0.4141
1840 E A 0.0000
1841 T A 0.0000
1842 A A 0.0000
1843 L A 0.0000
1844 H A 0.0000
1845 L A 0.0000
1846 A A 0.0000
1847 A A 0.0000
1848 R A -0.1352
1849 Y A 0.4051
1850 A A 0.1043
1851 R A 0.0000
1852 A A 0.0086
1853 D A 0.0000
1854 A A 0.0000
1855 A A 0.0000
1856 K A 0.0000
1857 R A 0.0000
1858 L A 0.0000
1859 L A 0.0000
1860 D A -0.4093
1861 A A -0.0724
1862 G A -0.2400
1863 A A -0.0801
1864 D A -0.2656
1865 T A 0.0000
1866 N A -1.4620
1867 A A -0.2816
1868 Q A -0.9154
1869 D A -2.0651
1870 H A 0.0000
1871 S A -0.1497
1872 G A -0.1782
1873 R A 0.0000
1874 T A 0.0000
1875 P A 0.0000
1876 L A 0.0000
1877 H A 0.0000
1878 T A 0.0000
1879 A A 0.0000
1880 V A 0.0000
1881 T A -0.0075
1882 A A 0.0107
1883 D A 0.0000
1884 A A 0.0000
1885 Q A -0.3906
1886 G A -0.1611
1887 V A 0.0000
1888 F A 0.0000
1889 Q A -0.1568
1890 I A 0.0000
1891 L A 0.0000
1892 I A 0.0000
1893 R A -0.1853
1894 N A 0.0000
1895 R A -0.5601
1896 S A -0.1477
1897 T A -0.1108
1898 D A -0.4501
1899 L A 0.0000
1900 D A -0.6797
1901 A A 0.0000
1902 R A -1.2279
1903 M A -0.1009
1904 A A -0.3452
1905 D A -1.9340
1906 G A -0.4511
1907 S A 0.0000
1908 T A 0.0000
1909 A A 0.0000
1910 L A 0.0000
1911 I A 0.0000
1912 L A 0.0000
1913 A A 0.0000
1914 A A 0.0000
1915 R A 0.0000
1916 L A 0.0000
1917 A A 0.0000
1918 V A 0.0000
1919 E A -1.8310
1920 G A -0.4037
1921 M A 0.0000
1922 V A -0.0416
1923 E A -1.1299
1924 E A 0.0000
1925 L A 0.0000
1926 I A 0.2478
1927 A A -0.0291
1928 S A -0.1804
1929 H A -0.8292
1930 A A 0.0000
1931 D A -0.7665
1932 V A -0.0782
1933 N A -1.3123
1934 A A 0.0000
1935 V A 0.0000
1936 D A -2.0008
1937 E A -1.6269
1938 L A 0.0000
1939 G A -0.2627
1940 K A -0.2894
1941 S A 0.0000
1942 A A 0.0000
1943 L A 0.0000
1944 H A 0.0000
1945 W A 0.0000
1946 A A 0.0000
1947 A A 0.0000
1948 A A 0.0000
1949 V A 0.0000
1950 N A 0.0000
1951 N A 0.0000
1952 V A 0.1149
1953 E A -0.3008
1954 A A 0.0000
1955 T A 0.0000
1956 L A 0.2227
1957 A A 0.0607
1958 L A 0.0000
1959 L A 0.2128
1960 K A -0.4359
1961 N A -0.6722
1962 G A -0.2550
1963 A A 0.0000
1964 N A -0.3022
1965 K A 0.0000
1966 D A 0.0000
1967 M A 0.0000
1968 Q A -0.5009
1969 D A -0.5693
1970 S A -0.5284
1971 K A -2.1059
1972 E A -2.2476
1973 E A -0.8833
1974 T A 0.0000
1975 P A 0.0000
1976 L A 0.0000
1977 F A 0.2002
1978 L A 0.0000
1979 A A 0.0000
1980 A A 0.0000
1981 R A -1.2727
1982 E A -0.6463
1983 G A -0.1539
1984 S A 0.0000
1985 Y A 0.0000
1986 E A 0.0000
1987 A A 0.0000
1988 A A 0.0000
1989 K A 0.0000
1990 L A 0.0000
1991 L A 0.0000
1992 L A 0.0000
1993 D A -1.9762
1994 H A -1.2545
1995 F A 0.2086
1996 A A 0.0810
1997 N A 0.0000
1998 R A -0.3608
1999 E A -0.6128
2000 I A 0.0000
2001 T A -0.2165
2002 D A -0.9405
2003 H A 0.0000
2004 L A 1.2066
2005 D A -1.7246
2006 R A -1.4929
2007 L A -0.0216
2008 P A 0.0000
2009 R A -1.5703
2010 D A -1.1639
2011 V A 0.0000
2012 A A 0.0000
2013 Q A -1.4427
2014 E A -2.3978
2015 R A -1.8956
2016 L A 1.0204
2017 H A -0.0903
2018 Q A -1.3125
2019 D A -0.8450
2020 I A 0.0000
2021 V A -0.1825
2022 R A -2.0047
2023 L A 0.0000
2024 L A 0.0000
2025 D A -2.2374
2026 Q A -1.5431
2027 P A -0.2766
2028 S A -0.1367
2029 G A -0.1907
2030 P A -0.5485
2031 R A -1.4878
2032 S A -0.4520
2033 P A -0.0993
2034 P A -0.1266
2035 G A -0.3465
2036 P A -0.2971
2037 H A -1.0863
2038 G A -0.3682
2039 L A 1.3754
2040 G A -0.2193
2041 P A -0.0062
2042 L A 1.5616
2043 L A 0.5866
2044 C A 0.0000
2045 P A -0.1740
2046 P A -0.2232
2047 G A -0.4837
2048 A A 0.0711
2049 F A 0.8625
2050 L A 0.5347
2051 P A 0.0000
2052 G A 0.2015
2053 L A 1.2988
2054 K A -0.4360
2055 A A -0.1049
2056 A A -0.0072
2057 Q A -0.1305
2058 S A -0.1148
2059 G A -0.1193
2060 S A -0.4980
2061 K A -2.0696
2062 K A -2.0786
2063 S A -0.8671
2064 R A -1.8839
2065 R A -0.6120
2066 P A -0.3096
2067 P A 0.0000
2068 G A -0.8402
2069 K A -1.7852
2070 A A -0.3864
2071 G A -0.5127
2072 L A 0.0000
2073 G A -0.2323
2074 P A -0.3259
2075 Q A -0.3206
2076 G A -0.5071
2077 P A -0.4801
2078 R A -1.8988
2079 G A -0.9646
2080 R A -1.9831
2081 G A -1.0694
2082 K A -1.7008
2083 K A -1.6564
2084 L A 1.2253
2085 T A 0.3785
2086 L A 0.4920
2087 A A 0.0000
2088 C A 0.2325
2089 P A 0.0000
2090 G A 0.0000
2091 P A -0.0049
2092 L A 0.3586
2093 A A 0.0388
2094 D A -0.4617
2095 S A -0.1463
2096 S A 0.2956
2097 V A 1.7649
2098 T A 0.6141
2099 L A 1.5184
2100 S A 0.0894
2101 P A -0.2203
2102 V A -0.0357
2103 D A -1.6512
2104 S A -0.2422
2105 L A 1.1941
2106 D A -1.3940
2107 S A -0.4917
2108 P A -0.3807
2109 R A -1.6828
2110 P A -0.2347
2111 F A 1.6039
2112 G A -0.2188
2113 G A -0.5605
2114 P A -0.3684
2115 P A -0.2952
2116 A A -0.0286
2117 S A -0.2653
2118 P A -0.3860
2119 G A -0.6023
2120 G A -0.3630
2121 F A 0.7443
2122 P A -0.0565
2123 L A 0.0713
2124 E A -1.0040
2125 G A -0.3464
2126 P A -0.2051
2127 Y A 0.3117
2128 A A 0.1352
2129 A A 0.0704
2130 A A 0.0144
2131 T A -0.0108
2132 A A 0.0134
2133 T A 0.0000
2134 A A 0.1370
2135 V A 0.6189
2136 S A 0.0521
2137 L A 0.3096
2138 A A -0.0248
2139 Q A -0.5233
2140 L A 0.3718
2141 G A -0.3825
2142 G A -0.2707
2143 P A -0.2676
2144 G A -0.6850
2145 R A -1.0955
2146 A A -0.2246
2147 G A -0.4245
2148 L A 0.0466
2149 G A -0.2689
2150 R A -0.8190
2151 Q A -0.3155
2152 P A 0.0000
2153 P A -0.0412
2154 G A -0.1436
2155 G A -0.4617
2156 C A -0.0142
2157 V A 0.0000
2158 L A 1.6191
2159 S A 0.3662
2160 L A 0.8559
2161 G A -0.0019
2162 L A 0.0000
2163 L A 0.0000
2164 N A -0.4232
2165 P A -0.3497
2166 V A 0.0000
2167 A A 0.1017
2168 V A 0.1845
2169 P A -0.1976
2170 L A 0.0000
2171 D A -1.1372
2172 W A 0.0000
2173 A A -0.3384
2174 R A -1.8408
2175 L A 0.0000
2176 P A -0.0549
2177 P A -0.0846
2178 P A -0.2790
2179 A A -0.0761
2180 P A -0.2912
2181 P A -0.3426
2182 G A -0.2359
2183 P A -0.1166
2184 S A -0.1560
2185 F A 0.6004
2186 L A 1.9071
2187 L A 1.7926
2188 P A 0.2653
2189 L A 1.1556
2190 A A 0.2388
2191 P A -0.2000
2192 G A -0.5006
2193 P A -0.3749
2194 Q A -0.9205
2195 L A 1.3936
2196 L A 0.4128
2197 N A -1.2155
2198 P A -0.3833
2199 G A -0.4901
2200 T A -0.1848
2201 P A 0.1549
2202 V A 1.7250
2203 S A 0.1568
2204 P A -0.2403
2205 Q A -0.6434
2206 E A -2.1059
2207 R A -1.4945
2208 P A -0.4425
2209 P A -0.2381
2210 P A 0.0808
2211 Y A 1.5840
2212 L A 1.8062
2213 A A 0.4026
2214 V A 0.5129
2215 P A -0.2368
2216 G A -0.7074
2217 H A -1.1714
2218 G A -0.7014
2219 E A -0.3713
2220 E A -0.2703
2221 Y A 0.4929
2222 P A 0.1163
2223 A A 0.0302
2224 A A -0.0293
2225 G A -0.2516
2226 A A -0.0619
2227 H A -0.2285
2228 S A -0.2549
2229 S A -0.1187
2230 P A -0.2792
2231 P A -0.3514
2232 K A -1.1811
2233 A A 0.0000
2234 R A -1.6594
2235 F A 0.8721
2236 L A 1.4590
2237 R A -0.9269
2238 V A 0.4871
2239 P A 0.0502
2240 S A -0.4598
2241 E A -2.0296
2242 H A -1.3920
2243 P A -0.2903
2244 Y A 0.8490
2245 L A 0.3379
2246 T A -0.0663
2247 P A -0.1792
2248 S A -0.1114
2249 P A -0.5642
2250 E A -1.6975
2251 S A -0.4991
2252 P A -0.2713
2253 E A -1.2292
2254 H A -1.0083
2255 W A 0.7556
2256 A A 0.1798
2257 S A -0.0858
2258 P A -0.2748
2259 S A -0.2715
2260 P A -0.1465
2261 P A -0.1439
2262 S A 0.1277
2263 L A 1.0450
2264 S A -0.2363
2265 D A -1.7271
2266 W A 0.0378
2267 S A -0.2437
2268 E A -0.6567
2269 S A -0.3345
2270 T A -0.1614
2271 P A -0.2892
2272 S A -0.1815
2273 P A -0.1417
2274 A A 0.2199
2275 T A -0.0477
2276 A A -0.0040
2277 T A -0.0886
2278 G A -0.4659
2279 A A -0.0027
2280 M A 0.4124
2281 A A 0.1221
2282 T A 0.0000
2283 T A -0.0746
2284 T A -0.1224
2285 G A -0.4589
2286 A A 0.2377
2287 L A 1.5377
2288 P A 0.1915
2289 A A -0.0536
2290 Q A -0.5412
2291 P A -0.0990
2292 L A 1.4776
2293 P A 0.3514
2294 L A 0.9935
2295 S A 0.1504
2296 V A 0.0000
2297 P A -0.2359
2298 S A -0.1129
2299 S A 0.1081
2300 L A 1.5174
2301 A A 0.1186
2302 Q A -1.2104
2303 A A -0.4087
2304 Q A -0.9911
2305 T A 0.0000
2306 Q A 0.0000
2307 L A 0.3926
2308 G A 0.0000
2309 P A -0.3797
2310 Q A -1.3983
2311 P A -0.7804
2312 E A -1.3372
2313 V A -0.1782
2314 T A -0.0117
2315 P A -0.3671
2316 K A -1.8837
2317 R A -1.4936
2318 Q A -1.0433
2319 V A 1.6527
2320 L A 0.9138
2321 A A 0.1667
Download PDB file
View in 3Dmol

CABS-flex predictions of flexibility of input structure

In dynamic mode, A4D analysis is performed on the set of models reflecting fluctuations of the input structure (predicted by CABS-flex method, models are numbered from 0 to 11) and the input model. Their A4D scores are provided below in the table.
The right panel presents comparison of the most aggregation prone model (with the highest A4D score, -0.207 in this case) with the input model (the most aggregation prone model in blue, input in red) and RMSF plot which shows the extent of residue fluctuations in Angstroms (predicted by CABS-flex).

Model
Average A4D Score
model_10 -0.207 View CSV PDB
model_6 -0.2161 View CSV PDB
model_3 -0.2188 View CSV PDB
model_2 -0.2201 View CSV PDB
model_0 -0.2219 View CSV PDB
model_5 -0.2237 View CSV PDB
CABS_average -0.2237 View CSV PDB
model_8 -0.2251 View CSV PDB
model_4 -0.2255 View CSV PDB
model_9 -0.229 View CSV PDB
model_1 -0.2297 View CSV PDB
model_7 -0.2305 View CSV PDB
model_11 -0.2368 View CSV PDB
input -0.277 View CSV PDB