Project name: S414C_4D

Status: done

Started: 2026-05-10 08:22:06
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPCHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGCFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
input PDB
Selected Chain(s) A
Distance of aggregation 10 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]                                                (00:00:00)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:00)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with A chain(s) selected             (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       FoldX:    Starting FoldX energy minimization                                          (00:00:01)
[INFO]       CABS:     Running CABS flex simulation                                                (00:26:43)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (13:01:27)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (13:02:13)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (13:02:58)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (13:03:44)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (13:04:30)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (13:05:15)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (13:06:00)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (13:06:46)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (13:07:31)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (13:08:17)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (13:09:02)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (13:09:47)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (13:10:33)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (13:12:03)
[INFO]       Main:     Simulation completed successfully.                                          (13:12:47)
Show buried residues

Minimal score value
-4.654
Maximal score value
5.2118
Average score
-0.5265
Total score value
-1222.1032

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 0.4383
2 G A -0.3591
3 P A -0.9059
4 G A -1.4483
5 A A -1.7938
6 R A -2.6911
7 G A -2.7017
8 R A -3.9275
9 R A -4.4508
10 R A -3.8046
11 R A -4.6540
12 R A -3.9236
13 R A -3.2151
14 P A -1.4005
15 M A 0.1205
16 S A 0.0192
17 P A -0.3797
18 P A -0.7518
19 P A -0.9043
20 P A -0.8654
21 P A -0.1463
22 P A 0.2147
23 P A 0.0000
24 V A 0.0000
25 R A 0.0696
26 A A 0.7013
27 L A 0.0000
28 P A 0.8377
29 L A 1.8961
30 L A 1.4983
31 L A 1.5590
32 L A 0.0000
33 L A 1.9840
34 A A 0.8353
35 G A 0.0704
36 P A 0.0000
37 G A -0.4976
38 A A -0.4711
39 A A -0.4913
40 A A -0.5101
41 P A -0.7948
42 P A -0.5459
43 C A -0.2815
44 L A 0.3221
45 D A -0.7087
46 G A -0.7630
47 S A -0.6300
48 P A -0.6546
49 C A -0.7224
50 A A -1.0231
51 N A -1.6963
52 G A -1.4306
53 G A -1.2154
54 R A -1.6512
55 C A 0.0000
56 T A -0.5423
57 Q A -1.0932
58 L A 0.0000
59 P A -1.0323
60 S A -1.1329
61 R A -1.9487
62 E A -2.1582
63 A A 0.0000
64 A A -0.5642
65 C A -0.0076
66 L A 0.5824
67 C A 0.0000
68 P A -0.7089
69 P A -0.8439
70 G A -1.1122
71 W A -0.9615
72 V A -0.6170
73 G A -0.4986
74 E A 0.0000
75 R A -0.9335
76 C A 0.0000
77 Q A -0.9819
78 L A -1.2004
79 E A -2.0062
80 D A -1.7468
81 P A -1.2065
82 C A -1.4471
83 H A -1.9257
84 S A -1.3766
85 G A -1.4661
86 P A -1.8975
87 C A 0.0000
88 A A -1.7321
89 G A -1.8603
90 R A -2.8037
91 G A -1.7765
92 V A -1.3337
93 C A -1.1733
94 Q A -1.1687
95 S A -0.6185
96 S A 0.0000
97 V A 0.0000
98 V A -0.2430
99 A A -0.5158
100 G A -0.4386
101 T A -0.4948
102 A A -0.8386
103 R A -1.2638
104 F A -0.6879
105 S A 0.0000
106 C A 0.0000
107 R A -3.4610
108 C A 0.0000
109 P A -2.4529
110 R A -2.5896
111 G A -2.1807
112 F A 0.0000
113 R A -2.9908
114 G A 0.0000
115 P A -1.5144
116 D A -2.0413
117 C A -1.3560
118 S A -0.6472
119 L A -0.9581
120 P A -0.6993
121 D A -1.3807
122 P A -0.1635
123 C A 0.0170
124 L A 1.0785
125 S A 0.1089
126 S A -0.1629
127 P A -0.4447
128 C A -0.5558
129 A A -0.2262
130 H A -0.4033
131 G A -0.5949
132 A A 0.0000
133 R A -1.9661
134 C A 0.0000
135 S A -0.7907
136 V A 0.0000
137 G A -1.1620
138 P A -1.6210
139 D A -2.3063
140 G A -1.6315
141 R A -1.4564
142 F A 1.0376
143 L A 0.9087
144 C A 0.0234
145 S A -0.7192
146 C A 0.0000
147 P A -0.8556
148 P A -0.3354
149 G A 0.0000
150 Y A -1.4787
151 Q A -2.1497
152 G A -2.3053
153 R A -2.9124
154 S A -1.7717
155 C A -1.9154
156 R A -2.7714
157 S A -2.1827
158 D A -2.0280
159 V A -1.3308
160 D A -1.9804
161 E A -1.1527
162 C A -0.8673
163 R A -1.8605
164 V A 0.0274
165 G A -0.6300
166 E A -2.0749
167 P A -1.4648
168 C A -0.5794
169 R A -1.7205
170 H A -2.1590
171 G A -1.5584
172 G A -1.3834
173 T A -1.1556
174 C A 0.0000
175 L A 0.7028
176 N A -0.5633
177 T A -0.4311
178 P A -0.5877
179 G A -0.3498
180 S A 0.2051
181 F A 0.6898
182 R A -0.7682
183 C A -0.8739
184 Q A -1.4284
185 C A -1.3271
186 P A -0.7206
187 A A 0.1417
188 G A -0.0811
189 Y A 0.1179
190 T A -0.7531
191 G A -0.7775
192 P A -1.0265
193 L A -1.2470
194 C A -1.6761
195 E A -3.0507
196 N A -2.1744
197 P A 0.0000
198 A A 0.3053
199 V A 1.6182
200 P A -0.0196
201 C A -0.5134
202 A A -0.1964
203 P A -0.2943
204 S A -0.6897
205 P A -0.5148
206 C A 0.0000
207 R A -1.7415
208 N A -1.8505
209 G A -1.1193
210 G A 0.0000
211 T A -0.9810
212 C A -1.9354
213 R A -3.3506
214 Q A -3.2274
215 S A -2.4723
216 G A -2.2988
217 D A -2.1552
218 L A 0.2410
219 T A -0.6901
220 Y A 0.0000
221 D A -2.5388
222 C A -1.7455
223 A A -0.8154
224 C A -0.6404
225 L A -0.2097
226 P A -0.5528
227 G A -0.5227
228 F A 0.0000
229 E A -2.4838
230 G A -1.9811
231 Q A -2.4274
232 N A -2.3205
233 C A -1.5376
234 E A -2.1558
235 V A -0.5864
236 N A 0.0000
237 V A 0.5831
238 D A -0.5679
239 D A -1.6346
240 C A -1.2498
241 P A -1.1746
242 G A -1.7241
243 H A -1.5621
244 R A -2.2176
245 C A -0.8737
246 L A -0.4032
247 N A -1.3933
248 G A -1.2027
249 G A -0.8058
250 T A -0.2753
251 C A 0.2326
252 V A 0.7261
253 D A 0.1249
254 G A 0.3935
255 V A 0.8626
256 N A -0.0590
257 T A -0.1715
258 Y A -0.0631
259 N A -0.0443
260 C A 0.0000
261 Q A -0.4592
262 C A 0.0000
263 P A -0.5912
264 P A 0.0000
265 E A -0.2698
266 W A 0.2629
267 T A 0.0589
268 G A -0.0838
269 Q A -0.2440
270 F A 0.8109
271 C A 0.0000
272 T A -0.5768
273 E A -0.4949
274 D A -0.6816
275 V A 0.7461
276 D A -0.1497
277 E A -0.3217
278 C A 0.0000
279 Q A -0.4969
280 L A 0.2764
281 Q A -0.2428
282 P A -0.6315
283 N A 0.0000
284 A A -0.1597
285 C A 0.2768
286 H A 0.0074
287 N A 0.0000
288 G A -0.4258
289 G A 0.0960
290 T A 0.8588
291 C A 1.0433
292 F A 1.4855
293 N A 0.2173
294 T A 0.4414
295 L A 1.2543
296 G A 0.1809
297 G A -0.0043
298 H A -0.2080
299 S A 0.5717
300 C A 0.0000
301 V A 1.2277
302 C A 1.0314
303 V A 1.5810
304 N A 0.0000
305 G A 0.0000
306 W A 0.0000
307 T A -0.3118
308 G A -0.8723
309 E A -2.0572
310 S A -0.9755
311 C A 0.0000
312 S A 0.0000
313 Q A -1.2646
314 N A 0.0000
315 I A 0.0000
316 D A 0.0000
317 D A 0.0000
318 C A 0.2634
319 A A 0.3587
320 T A 0.7887
321 A A 0.6952
322 V A 1.7541
323 C A 0.0000
324 F A 1.3270
325 H A 0.3179
326 G A -0.0543
327 A A 0.0960
328 T A -0.6258
329 C A 0.0000
330 H A 0.0000
331 D A 0.0000
332 R A 0.0000
333 V A 0.3348
334 A A -0.0728
335 S A 0.0000
336 F A 0.0000
337 Y A 0.0000
338 C A 0.0000
339 A A 0.0000
340 C A 0.0445
341 P A 0.0033
342 M A 0.7239
343 G A -0.0563
344 K A -0.4841
345 T A 0.0000
346 G A 0.0000
347 L A 0.0000
348 L A 0.0000
349 C A 0.0000
350 H A 0.3261
351 L A 0.4976
352 D A -1.0892
353 D A -1.7888
354 A A 0.0000
355 C A -0.1355
356 V A 0.7213
357 S A -0.5414
358 N A -0.7596
359 P A 0.0123
360 C A -0.1354
361 H A -1.2667
362 E A -2.6047
363 D A -2.3531
364 A A -0.3562
365 I A 1.5099
366 C A 0.0000
367 D A -0.1043
368 T A 0.0000
369 N A 0.0000
370 P A 0.0000
371 V A 0.0000
372 N A -0.7796
373 G A -1.6091
374 R A -2.4732
375 A A -0.9727
376 I A 0.0000
377 C A 0.0000
378 T A 0.2625
379 C A 0.0015
380 P A -0.6679
381 P A 0.0418
382 G A -0.2355
383 F A 0.0000
384 T A -0.1641
385 G A 0.0000
386 G A -0.3972
387 A A -0.0110
388 C A 0.0000
389 D A 0.0000
390 Q A 0.3352
391 D A 0.1416
392 V A 0.0000
393 D A 0.0000
394 E A 0.0000
395 C A 0.0000
396 S A 0.0000
397 I A 0.0000
398 G A 0.0715
399 A A 0.0000
400 N A -0.6755
401 P A 0.0000
402 C A 0.0000
403 E A -2.2341
404 H A -1.6076
405 L A 0.0000
406 G A -2.0863
407 R A -2.4730
408 C A 0.0000
409 V A 0.3247
410 N A 0.0889
411 T A 0.3149
412 Q A -0.2832
413 G A 0.0000
414 C A 1.1124
415 F A 0.0000
416 L A 1.4159
417 C A -0.1289
418 Q A -1.5109
419 C A 0.0000
420 G A -1.2896
421 R A -1.0840
422 G A -0.8113
423 Y A -0.4262
424 T A -0.3278
425 G A -0.6212
426 P A -0.7395
427 R A -0.8591
428 C A -0.6712
429 E A 0.0000
430 T A 0.0000
431 D A -0.1922
432 V A 0.0828
433 N A -0.7138
434 E A -0.9920
435 C A -0.4935
436 L A -0.2553
437 S A -0.5080
438 G A -0.9343
439 P A -0.5116
440 C A -0.3013
441 R A -1.3894
442 N A -2.1509
443 Q A -1.6251
444 A A -0.2238
445 T A 0.3637
446 C A 0.0000
447 L A -0.1895
448 D A 0.0000
449 R A -1.9011
450 I A -0.6785
451 G A -1.0368
452 Q A -1.2162
453 F A 0.0000
454 T A 0.2387
455 C A 0.0000
456 I A 1.8997
457 C A 1.0302
458 M A 1.1328
459 A A 0.5548
460 G A -0.1118
461 F A 1.3828
462 T A -0.0539
463 G A 0.1295
464 T A 0.1283
465 Y A 1.1210
466 C A 0.4759
467 E A -0.9618
468 V A -0.3898
469 D A -1.5964
470 I A -1.4704
471 D A -3.1033
472 E A -2.5103
473 C A -1.8727
474 Q A -2.2698
475 S A -1.4624
476 S A -0.9461
477 P A -0.6910
478 C A 0.3811
479 V A 1.5535
480 N A 0.7134
481 G A 0.0311
482 G A 0.2806
483 V A 1.0767
484 C A 0.0000
485 K A -2.4918
486 D A -2.7944
487 R A -2.2615
488 V A 0.0371
489 N A -0.8061
490 G A -1.2761
491 F A -1.5019
492 S A -1.1711
493 C A -0.1386
494 T A 0.3466
495 C A 0.0000
496 P A 0.5140
497 S A -0.1633
498 G A -0.2253
499 F A 1.0069
500 S A -0.1749
501 G A -0.0477
502 S A -0.2605
503 T A -0.3629
504 C A 0.0000
505 Q A -0.9096
506 L A -0.3191
507 D A -1.1463
508 V A -0.2783
509 D A -2.5675
510 E A -2.8865
511 C A -1.2895
512 A A -1.0095
513 S A -0.7491
514 T A -0.8899
515 P A -0.5945
516 C A -0.5527
517 R A -1.5788
518 N A -1.8696
519 G A -1.8215
520 A A -2.1616
521 K A -2.5805
522 C A -1.7232
523 V A -1.4165
524 D A -2.8286
525 Q A -2.9229
526 P A -2.2863
527 D A -3.1037
528 G A -2.5790
529 Y A -2.3651
530 E A -2.8949
531 C A 0.0000
532 R A -2.8441
533 C A 0.0000
534 A A -1.6757
535 E A -1.5209
536 G A -0.5303
537 F A -0.0548
538 E A -0.9538
539 G A -0.7862
540 T A -0.0333
541 L A 0.9040
542 C A -0.4900
543 D A 0.0000
544 R A -1.3252
545 N A 0.0000
546 V A 0.2801
547 D A -0.6424
548 D A -1.3906
549 C A 0.0000
550 S A -1.2163
551 P A -1.8671
552 D A -2.0929
553 P A -1.4418
554 C A -0.5785
555 H A -1.3923
556 H A -1.5190
557 G A -1.5100
558 R A -1.9308
559 C A -1.1633
560 V A -0.5173
561 D A -0.7941
562 G A 0.2476
563 I A 0.2026
564 A A 0.2603
565 S A 0.4750
566 F A 0.7849
567 S A -0.3298
568 C A 0.0000
569 A A -1.2908
570 C A -1.0381
571 A A -0.6663
572 P A -0.7104
573 G A -1.3006
574 Y A 0.0000
575 T A -1.5860
576 G A -0.9154
577 T A -1.0221
578 R A -2.3133
579 C A -2.3825
580 E A -2.8924
581 S A -2.1830
582 Q A -2.1294
583 V A -0.9984
584 D A -2.4742
585 E A -2.3837
586 C A -1.4302
587 R A -2.1438
588 S A -1.1773
589 Q A -1.0647
590 P A -0.7518
591 C A 0.0000
592 R A -2.5409
593 H A -3.0323
594 G A -1.7520
595 G A -2.2078
596 K A -1.7296
597 C A -0.6915
598 L A 0.2674
599 D A -0.2244
600 L A 0.9244
601 V A 0.3121
602 D A -0.8797
603 K A -0.0133
604 Y A 0.4184
605 L A 0.8419
606 C A -0.5629
607 R A -1.6591
608 C A -1.6016
609 P A -1.5033
610 S A -1.2551
611 G A -0.8004
612 T A -0.2133
613 T A 0.1848
614 G A -0.1289
615 V A -0.0619
616 N A -0.8579
617 C A -0.6226
618 E A -0.3152
619 V A 0.3917
620 N A -0.1538
621 I A 0.6050
622 D A -1.1034
623 D A -1.8944
624 C A -1.5518
625 A A -1.1301
626 S A -0.9659
627 N A -1.6530
628 P A -1.0067
629 C A -0.1152
630 T A 0.0064
631 F A 0.0000
632 G A 0.6779
633 V A 1.2777
634 C A -0.4766
635 R A -2.6084
636 D A -3.3794
637 G A 0.0000
638 I A 0.0000
639 N A -2.6963
640 R A -3.7486
641 Y A -3.0701
642 D A -2.9520
643 C A -1.0130
644 V A 0.5057
645 C A 0.7584
646 Q A -0.1267
647 P A -0.6373
648 G A -0.8343
649 F A -0.0593
650 T A -0.0818
651 G A 0.1574
652 P A 0.1961
653 L A 1.2370
654 C A 0.4915
655 N A 0.0541
656 V A 0.5520
657 E A -1.2761
658 I A -1.0877
659 N A -2.8570
660 E A -2.7679
661 C A -1.3187
662 A A -0.5683
663 S A -0.4539
664 S A 0.0000
665 P A -0.7636
666 C A 0.0000
667 G A -1.4792
668 E A -2.2585
669 G A -1.6843
670 G A -1.0852
671 S A -0.6155
672 C A -0.0701
673 V A 0.0449
674 D A -1.9558
675 G A -2.5298
676 E A -3.3335
677 N A -3.2128
678 G A -2.0178
679 F A -1.0156
680 R A -0.0894
681 C A 0.0000
682 L A 0.9924
683 C A 0.0000
684 P A -0.4368
685 P A -0.4231
686 G A -0.7423
687 S A -0.3574
688 L A 0.7262
689 P A 0.3616
690 P A 0.4728
691 L A 1.6322
692 C A 1.6355
693 L A 1.7676
694 P A 0.3723
695 P A 0.0460
696 S A -0.1524
697 H A -0.0338
698 P A -0.7560
699 C A 0.0000
700 A A -1.5785
701 H A -2.1577
702 E A -2.6327
703 P A -1.7743
704 C A 0.0000
705 S A -0.9014
706 H A -0.4421
707 G A 0.0431
708 I A 0.7992
709 C A 0.0000
710 Y A 0.1589
711 D A -1.0552
712 A A -0.7826
713 P A -0.5953
714 G A -0.7602
715 G A -1.1086
716 F A -1.4053
717 R A -1.6104
718 C A 0.0000
719 V A 0.5901
720 C A -0.1461
721 E A -1.6659
722 P A -1.2168
723 G A -0.6068
724 W A -0.5241
725 S A -1.0520
726 G A -1.4361
727 P A -1.9259
728 R A -2.8191
729 C A 0.0000
730 S A -1.8876
731 Q A -1.9478
732 S A -0.4287
733 L A 0.4921
734 A A -0.7315
735 R A -2.1972
736 D A -2.4498
737 A A -1.3375
738 C A -0.5819
739 E A -1.4670
740 S A -0.7661
741 Q A -0.9919
742 P A -1.0372
743 C A 0.0000
744 R A -2.1363
745 A A -1.2489
746 G A -1.0396
747 G A -1.0148
748 T A 0.0000
749 C A -0.4247
750 S A -0.3145
751 S A -0.4722
752 D A -1.4598
753 G A -0.7180
754 M A 0.5529
755 G A 0.1674
756 F A 1.3430
757 H A 0.3363
758 C A 0.1510
759 T A -0.1359
760 C A -0.4281
761 P A -0.6678
762 P A -0.9414
763 G A -1.0203
764 V A -0.5802
765 Q A -1.1186
766 G A -1.1636
767 R A -1.3751
768 Q A -1.6792
769 C A -1.2783
770 E A -1.6087
771 L A 0.0000
772 L A -0.7036
773 S A -0.2948
774 P A -0.1414
775 C A -0.1838
776 T A -0.5867
777 P A -0.4883
778 N A -1.0156
779 P A -1.1919
780 C A -1.7341
781 E A -2.0892
782 H A 0.0000
783 G A 0.0000
784 G A 0.0000
785 R A -0.6416
786 C A -0.3603
787 E A -0.0662
788 S A 0.0238
789 A A 0.0000
790 P A -0.6201
791 G A -0.7705
792 Q A -0.5336
793 L A 0.9935
794 P A 0.6128
795 V A 0.9028
796 C A 0.2821
797 S A 0.0239
798 C A 0.0000
799 P A -0.7029
800 Q A 0.0000
801 G A -0.0693
802 W A 0.1642
803 Q A -1.0832
804 G A -1.4092
805 P A -1.4856
806 R A -2.5546
807 C A 0.0000
808 Q A 0.0000
809 Q A -1.2145
810 D A 0.0000
811 V A 1.0382
812 D A -0.5502
813 E A 0.0000
814 C A 0.0000
815 A A -0.3034
816 G A -0.4999
817 P A -0.4939
818 A A -0.5507
819 P A -1.1587
820 C A -0.5222
821 G A -0.2796
822 P A -0.1739
823 H A -0.4490
824 G A 0.0262
825 I A 1.4981
826 C A 0.7559
827 T A 0.3542
828 N A 0.1448
829 L A 0.6972
830 A A 0.2036
831 G A 0.0000
832 S A -0.1131
833 F A 0.0000
834 S A 0.1075
835 C A 0.0000
836 T A -0.0024
837 C A -0.5951
838 H A -1.1731
839 G A -1.2315
840 G A -0.7198
841 Y A -0.6494
842 T A -1.1105
843 G A -0.8503
844 P A -0.7291
845 S A -0.7987
846 C A 0.0000
847 D A -2.0215
848 Q A -1.2110
849 D A -0.7038
850 I A 0.1565
851 N A -0.7722
852 D A -1.8366
853 C A -1.2694
854 D A -1.2478
855 P A -0.8652
856 N A -1.2233
857 P A -0.8848
858 C A -0.8520
859 L A -0.4394
860 N A 0.0000
861 G A 0.0000
862 G A 0.0000
863 S A -0.4207
864 C A -1.0056
865 Q A -1.3228
866 D A -1.3484
867 G A -0.6115
868 V A 0.5364
869 G A -0.1853
870 S A -0.3767
871 F A -0.7910
872 S A 0.0000
873 C A 0.0000
874 S A 0.0000
875 C A 0.0000
876 L A 0.0000
877 P A 0.0000
878 G A 0.0000
879 F A -0.9253
880 A A 0.0000
881 G A -1.5426
882 P A -1.6028
883 R A -1.9620
884 C A -1.3998
885 A A -1.7026
886 R A -2.8170
887 D A -2.5865
888 V A 0.0000
889 D A -1.8237
890 E A 0.0000
891 C A 0.0000
892 L A 1.2793
893 S A 0.6057
894 N A 0.0000
895 P A 0.0000
896 C A 0.8376
897 G A -0.0293
898 P A -0.5683
899 G A -0.6143
900 T A -0.4385
901 C A -0.1650
902 T A -0.4365
903 D A -1.0685
904 H A -0.8004
905 V A -0.7660
906 A A 0.0000
907 S A 0.0000
908 F A 0.0000
909 T A 0.0000
910 C A 0.0000
911 T A 0.0000
912 C A 0.0000
913 P A 0.0448
914 P A -0.0899
915 G A -0.1868
916 Y A 0.0000
917 G A 0.0000
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 0.0000
924 D A -0.7156
925 L A 0.1201
926 P A 0.0000
927 D A -0.7726
928 C A 0.0000
929 S A -0.2159
930 P A -0.2335
931 S A 0.0000
932 S A 0.0000
933 C A 0.0000
934 F A 0.0000
935 N A 0.0000
936 G A -0.8374
937 G A -0.5169
938 T A 0.1934
939 C A 0.8541
940 V A 1.5353
941 D A 0.3878
942 G A 0.3742
943 V A 1.3003
944 N A -0.3616
945 S A -0.3207
946 F A 0.2363
947 S A 0.4873
948 C A 0.4551
949 L A 0.8641
950 C A 0.0000
951 R A -1.4813
952 P A -0.8799
953 G A -0.2667
954 Y A 0.5845
955 T A -0.0454
956 G A -0.4245
957 A A -0.2427
958 H A -0.3295
959 C A 0.0000
960 Q A 0.0000
961 H A -0.4017
962 E A 0.0000
963 A A -0.0353
964 D A -0.1410
965 P A 0.0000
966 C A 0.9287
967 L A 1.3221
968 S A 0.2152
969 R A 0.0879
970 P A -0.1633
971 C A 0.0249
972 L A 0.2260
973 H A -0.2767
974 G A -0.7292
975 G A -0.5543
976 V A 0.3058
977 C A 0.5471
978 S A 0.1832
979 A A 0.4499
980 A A 0.0000
981 H A -0.3939
982 P A 0.0000
983 G A 0.0098
984 F A 0.3349
985 R A 0.0000
986 C A 0.3324
987 T A 0.1648
988 C A 0.6230
989 L A 0.5213
990 E A -0.5679
991 S A 0.3705
992 F A 1.7349
993 T A 0.4526
994 G A -0.1461
995 P A -0.4277
996 Q A -1.3185
997 C A 0.0000
998 Q A 0.0000
999 T A 0.6070
1000 L A 1.2961
1001 V A 0.5525
1002 D A -0.5775
1003 W A -0.2633
1004 C A -0.7317
1005 S A -0.9455
1006 R A -1.6301
1007 Q A -1.1064
1008 P A -0.8237
1009 C A -0.9125
1010 Q A -1.9000
1011 N A -2.0904
1012 G A -1.4456
1013 G A -1.0953
1014 R A -1.0413
1015 C A 0.2214
1016 V A 0.4768
1017 Q A -0.2366
1018 T A -0.1511
1019 G A -0.2399
1020 A A 0.6718
1021 Y A 1.4182
1022 C A 1.0109
1023 L A 1.2409
1024 C A 0.0000
1025 P A -0.9560
1026 P A -1.3375
1027 G A -1.2120
1028 W A -1.0601
1029 S A -0.8560
1030 G A -0.5681
1031 R A -0.5088
1032 L A 0.1245
1033 C A 0.0000
1034 D A -0.9573
1035 I A 0.0000
1036 R A -1.1281
1037 S A -0.9425
1038 L A -1.0864
1039 P A -2.0914
1040 C A 0.0000
1041 R A -3.0701
1042 E A -2.5452
1043 A A 0.0000
1044 A A 0.0000
1045 A A -1.2456
1046 Q A -0.9361
1047 I A 0.7176
1048 G A -0.0448
1049 V A -0.3842
1050 R A -2.1415
1051 L A -1.8499
1052 E A -2.9131
1053 Q A -2.3441
1054 L A 0.0000
1055 C A -1.5079
1056 Q A -2.3552
1057 A A -1.6468
1058 G A -1.5019
1059 G A -1.4736
1060 Q A -1.2634
1061 C A -1.1101
1062 V A -0.8408
1063 D A -2.5271
1064 E A -3.0526
1065 D A -2.8191
1066 S A -1.9737
1067 S A -1.6079
1068 H A 0.0000
1069 Y A -0.2389
1070 C A 0.0000
1071 V A -0.3212
1072 C A 0.0000
1073 P A -1.1602
1074 E A -1.8421
1075 G A -1.4295
1076 R A -2.1078
1077 T A -1.6712
1078 G A 0.0000
1079 S A 0.0000
1080 H A -0.9372
1081 C A 0.0000
1082 E A -3.0242
1083 Q A -2.9104
1084 E A -2.3950
1085 V A -0.6584
1086 D A -0.2225
1087 P A 0.2003
1088 C A 0.0000
1089 L A 0.0739
1090 A A -0.0631
1091 Q A -0.4354
1092 P A -0.4390
1093 C A -0.1694
1094 Q A -0.5833
1095 H A -0.7121
1096 G A -0.7009
1097 G A -0.8066
1098 T A -0.8497
1099 C A -0.8041
1100 R A -1.2932
1101 G A 0.0856
1102 Y A 1.3180
1103 M A 1.2203
1104 G A 0.4531
1105 G A 0.2991
1106 Y A -0.4520
1107 M A 0.0000
1108 C A 0.0000
1109 E A -1.8866
1110 C A 0.0000
1111 L A -1.0502
1112 P A 0.0000
1113 G A 0.0000
1114 Y A -2.1321
1115 N A -2.7653
1116 G A 0.0000
1117 D A -2.6933
1118 N A -2.0808
1119 C A -1.6248
1120 E A -2.1815
1121 D A -2.5619
1122 D A -2.7206
1123 V A -1.5217
1124 D A -1.9139
1125 E A 0.0000
1126 C A 0.2414
1127 A A 0.1092
1128 S A -0.3311
1129 Q A -0.7461
1130 P A -0.4067
1131 C A -0.2900
1132 Q A -0.7054
1133 H A -1.0292
1134 G A -0.5094
1135 G A -0.5061
1136 S A -0.3399
1137 C A 0.0581
1138 I A 0.0000
1139 D A -0.7305
1140 L A 0.0000
1141 V A -0.1501
1142 A A 0.0000
1143 R A 0.0000
1144 Y A 0.0000
1145 L A 0.0000
1146 C A 0.0000
1147 S A 0.0000
1148 C A 0.0000
1149 P A -0.3095
1150 P A -0.3130
1151 G A 0.0000
1152 T A 0.0000
1153 L A 0.0000
1154 G A 0.0000
1155 V A 0.0000
1156 L A 1.4952
1157 C A 0.6218
1158 E A -1.2548
1159 I A 0.0000
1160 N A -1.1142
1161 E A 0.0000
1162 D A 0.0000
1163 D A -1.4231
1164 C A -0.4017
1165 G A 0.0000
1166 P A -0.4550
1167 G A 0.0000
1168 P A -0.0678
1169 P A 0.8136
1170 L A 1.9318
1171 D A 0.0000
1172 S A 0.0000
1173 G A 0.0000
1174 P A -0.2266
1175 R A -0.3221
1176 C A 0.0103
1177 L A -0.1277
1178 H A 0.0000
1179 N A -1.3612
1180 G A -0.9762
1181 T A -0.7147
1182 C A -0.3528
1183 V A -0.8739
1184 D A -1.4640
1185 L A -0.1979
1186 V A 0.7201
1187 G A -0.3114
1188 G A -0.4358
1189 F A 0.0000
1190 R A -0.4234
1191 C A 0.0000
1192 T A -0.3799
1193 C A 0.0000
1194 P A -0.8601
1195 P A -0.7052
1196 G A -0.4736
1197 Y A 0.0000
1198 T A -0.1669
1199 G A 0.0000
1200 L A 0.0000
1201 R A 0.0000
1202 C A 0.0000
1203 E A 0.0000
1204 A A 0.0000
1205 D A 0.0000
1206 I A 0.1545
1207 N A 0.0000
1208 E A -0.7305
1209 C A 0.0000
1210 R A -1.4136
1211 S A -1.0895
1212 G A -0.9574
1213 A A -0.8533
1214 C A 0.0000
1215 H A 0.0000
1216 A A -0.5222
1217 A A 0.0422
1218 H A -0.6954
1219 T A 0.0000
1220 R A 0.0000
1221 D A -0.4362
1222 C A 0.0000
1223 L A -0.1374
1224 Q A 0.0000
1225 D A -0.5795
1226 P A 0.0000
1227 G A 0.0000
1228 G A -0.3110
1229 G A -0.5798
1230 F A -0.5508
1231 R A -1.5977
1232 C A -0.8330
1233 L A 0.0765
1234 C A -0.3885
1235 H A -0.5518
1236 A A 0.0363
1237 G A 0.4262
1238 F A 0.0000
1239 S A -0.1181
1240 G A -0.5890
1241 P A -1.2289
1242 R A -2.2963
1243 C A 0.0000
1244 Q A 0.0000
1245 T A 0.1955
1246 V A 1.1792
1247 L A 1.4861
1248 S A -0.0071
1249 P A -0.7923
1250 C A -1.5121
1251 E A -2.1557
1252 S A -1.1977
1253 Q A -1.2580
1254 P A -1.0598
1255 C A 0.0000
1256 Q A 0.0000
1257 H A 0.0000
1258 G A -0.7311
1259 G A -1.0789
1260 Q A -1.0624
1261 C A -1.6672
1262 R A -2.4081
1263 P A -1.1886
1264 S A -0.7818
1265 P A -0.7326
1266 G A -0.7577
1267 P A -0.6953
1268 G A -0.9320
1269 G A -1.0419
1270 G A -0.7036
1271 L A 0.1180
1272 T A -0.5567
1273 F A -0.9828
1274 T A -1.4100
1275 C A 0.0000
1276 H A 0.0000
1277 C A 0.0000
1278 A A 0.0000
1279 Q A 0.0000
1280 P A 0.0000
1281 F A 0.0000
1282 W A 0.0000
1283 G A 0.0000
1284 P A -2.0092
1285 R A -2.6533
1286 C A 0.0000
1287 E A -2.4515
1288 R A -1.3985
1289 V A -0.0999
1290 A A -0.0129
1291 R A 0.0000
1292 S A -0.9727
1293 C A 0.0000
1294 R A -2.1535
1295 E A -1.6290
1296 L A 0.0000
1297 Q A -0.5297
1298 C A 0.0000
1299 P A -0.1782
1300 V A 0.7838
1301 G A 0.2201
1302 V A -0.0904
1303 P A -0.4754
1304 C A -0.9354
1305 Q A -1.2754
1306 Q A -1.3312
1307 T A -0.9198
1308 P A -1.0659
1309 R A -1.6964
1310 G A -1.0360
1311 P A 0.0000
1312 R A -0.7672
1313 C A 0.0000
1314 A A -0.0844
1315 C A 0.0000
1316 P A 0.4160
1317 P A 0.2709
1318 G A 0.2270
1319 L A 1.1217
1320 S A 0.2947
1321 G A 0.0521
1322 P A -0.3262
1323 S A -0.5117
1324 C A 0.0000
1325 R A -0.8653
1326 S A -0.6207
1327 F A -0.4608
1328 P A -0.6672
1329 G A -1.0298
1330 S A -0.8790
1331 P A -0.9436
1332 P A -0.9763
1333 G A -1.0550
1334 A A -0.9791
1335 S A -1.0173
1336 N A -1.4551
1337 A A -0.7614
1338 S A -0.8066
1339 C A -0.8856
1340 A A -0.5988
1341 A A 0.0000
1342 A A -0.0957
1343 P A -0.1634
1344 C A 0.1052
1345 L A 0.9415
1346 H A -0.5674
1347 G A -0.7956
1348 G A -0.7419
1349 S A -0.7660
1350 C A -1.1992
1351 R A -2.4465
1352 P A -1.4203
1353 A A -0.7911
1354 P A -0.3614
1355 L A 0.0000
1356 A A -0.2180
1357 P A 0.0000
1358 F A 0.0000
1359 F A -1.1040
1360 R A -2.4064
1361 C A -1.1697
1362 A A -0.3245
1363 C A 0.2376
1364 A A 0.1969
1365 Q A -0.2996
1366 G A -0.1307
1367 W A 0.4730
1368 T A -0.3315
1369 G A -0.7928
1370 P A -0.9641
1371 R A -1.5408
1372 C A -0.7202
1373 E A -1.1566
1374 A A -0.2746
1375 P A -0.2907
1376 A A -0.2599
1377 A A -0.0776
1378 A A -0.5500
1379 P A -0.7426
1380 E A -1.4371
1381 V A 0.2251
1382 S A -0.5982
1383 E A 0.0000
1384 E A -1.4719
1385 P A -1.2913
1386 R A -2.4803
1387 C A 0.0000
1388 P A -1.7615
1389 R A -2.5272
1390 A A -1.2925
1391 A A -1.4264
1392 C A 0.0000
1393 Q A -2.1400
1394 A A -1.3512
1395 K A -2.0074
1396 R A -1.6893
1397 G A -1.2137
1398 D A -2.0591
1399 Q A 0.0000
1400 R A -2.7252
1401 C A 0.0000
1402 D A -1.4681
1403 R A 0.0000
1404 E A -1.3045
1405 C A 0.0000
1406 N A 0.0000
1407 S A 0.0000
1408 P A -1.4626
1409 G A -1.3371
1410 C A -1.3880
1411 G A -0.7678
1412 W A 0.0000
1413 D A 0.0000
1414 G A -1.2478
1415 G A -0.7597
1416 D A -0.9772
1417 C A 0.0000
1418 S A 0.0000
1419 L A 0.0000
1420 S A -0.7465
1421 V A -0.7532
1422 G A -1.4467
1423 D A -1.4810
1424 P A -1.0136
1425 W A 0.0000
1426 R A -1.4641
1427 Q A -2.1920
1428 C A -1.6197
1429 E A -2.2997
1430 A A -1.1998
1431 L A -1.3250
1432 Q A -1.0951
1433 C A 0.0000
1434 W A 0.0000
1435 R A -1.3023
1436 L A 0.0000
1437 F A 0.0000
1438 N A -1.7213
1439 N A -2.0780
1440 S A -1.6620
1441 R A -2.2923
1442 C A 0.0000
1443 D A -1.0939
1444 P A -0.6839
1445 A A -0.5258
1446 C A -0.6542
1447 S A -0.3200
1448 S A 0.0000
1449 P A -0.5797
1450 A A -0.6714
1451 C A 0.0000
1452 L A 0.0000
1453 Y A 0.0000
1454 D A 0.0000
1455 N A -0.5798
1456 F A -0.2359
1457 D A -1.0109
1458 C A -0.6467
1459 H A 0.0000
1460 A A 0.0000
1461 G A -0.9416
1462 G A -0.9607
1463 R A 0.0000
1464 E A -1.2540
1465 R A 0.0000
1466 T A -1.1509
1467 C A 0.0000
1468 N A -1.1365
1469 P A -0.6808
1470 V A 0.0279
1471 Y A 0.0000
1472 E A -1.7295
1473 K A -1.8756
1474 Y A 0.0000
1475 C A 0.0000
1476 A A 0.0000
1477 D A -2.2628
1478 H A 0.0000
1479 F A -0.5060
1480 A A -0.9706
1481 D A -1.8393
1482 G A -1.3744
1483 R A 0.0000
1484 C A 0.1754
1485 D A -0.4089
1486 Q A -0.6210
1487 G A 0.0000
1488 C A 0.0000
1489 N A 0.0000
1490 T A 0.0000
1491 E A 0.0000
1492 E A -2.1765
1493 C A 0.0000
1494 G A 0.0000
1495 W A 0.0000
1496 D A 0.0000
1497 G A 0.0000
1498 L A -0.2276
1499 D A 0.0000
1500 C A 0.0000
1501 A A -0.6197
1502 S A -1.0601
1503 E A -1.5199
1504 V A 0.0105
1505 P A 0.1434
1506 A A 0.5486
1507 L A 1.1438
1508 L A 1.1169
1509 A A 0.0000
1510 R A -2.1526
1511 G A -1.4123
1512 V A 0.0000
1513 L A 0.0000
1514 V A 0.0000
1515 L A 0.0000
1516 T A 0.0000
1517 V A 0.0000
1518 L A 0.2784
1519 L A -0.2292
1520 P A -0.7512
1521 P A -1.3621
1522 E A -2.5856
1523 E A -2.7525
1524 L A 0.0000
1525 L A -0.4285
1526 R A -2.1797
1527 S A -1.5030
1528 S A -0.6904
1529 A A -0.6862
1530 D A -1.5385
1531 F A 0.0000
1532 L A 0.0000
1533 Q A 0.0000
1534 R A -1.3730
1535 L A 0.0000
1536 S A 0.0000
1537 A A -0.6535
1538 I A -0.5414
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 0.0004
1545 F A 0.4619
1546 R A 0.0000
1547 L A 0.6543
1548 D A 0.0000
1549 A A 1.1760
1550 H A 0.3365
1551 G A -0.4005
1552 Q A 0.0000
1553 A A 0.5427
1554 M A 0.5074
1555 V A 0.5935
1556 F A -0.4826
1557 P A 0.0000
1558 Y A -0.8700
1559 H A 0.0000
1560 R A -0.1700
1561 P A 0.0000
1562 S A 0.0000
1563 P A -0.2467
1564 G A -0.6705
1565 S A -0.4732
1566 E A -0.5282
1567 P A -0.5823
1568 R A -0.6587
1569 A A -1.2804
1570 R A -2.4250
1571 R A -2.7936
1572 E A -2.1972
1573 L A -0.0152
1574 A A -0.4571
1575 P A -0.2381
1576 E A 0.0000
1577 V A -0.3072
1578 I A 0.0947
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 -0.3483
1586 I A 0.0000
1587 D A 0.0000
1588 N A 0.0550
1589 R A -0.6318
1590 L A -0.3740
1591 C A 0.0000
1592 L A -0.9909
1593 Q A -1.1218
1594 S A 0.0000
1595 P A -0.5646
1596 E A -1.2124
1597 N A -1.8671
1598 D A -2.4145
1599 H A -1.3956
1600 C A -0.6010
1601 F A 0.0000
1602 P A -0.4479
1603 D A -1.2206
1604 A A 0.0000
1605 Q A -1.7225
1606 S A -0.7575
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 -2.0682
1619 R A -2.4971
1620 L A 0.0000
1621 D A -2.4389
1622 F A 0.0000
1623 P A 0.0000
1624 Y A 0.0000
1625 P A 0.0000
1626 L A 0.0000
1627 R A -0.6098
1628 D A -0.8090
1629 V A 0.0000
1630 R A -1.8452
1631 G A -2.0488
1632 E A -2.5821
1633 P A -1.4856
1634 L A -0.0464
1635 E A -1.5780
1636 P A -1.1482
1637 P A -1.3197
1638 E A -2.1160
1639 P A -0.3097
1640 S A 0.7034
1641 V A 1.3562
1642 P A 1.2675
1643 L A 2.4626
1644 L A 2.0360
1645 P A 1.5406
1646 L A 2.3319
1647 L A 0.0000
1648 V A 1.5692
1649 A A 1.3074
1650 G A 1.3820
1651 A A 0.0000
1652 V A 2.1544
1653 L A 3.4442
1654 L A 3.7879
1655 L A 0.0000
1656 V A 4.3478
1657 I A 5.2118
1658 L A 4.8958
1659 V A 4.5663
1660 L A 4.4644
1661 G A 3.8209
1662 V A 3.6712
1663 M A 2.8184
1664 V A 2.6250
1665 A A 0.6257
1666 R A -1.1985
1667 R A -3.6449
1668 K A -4.6503
1669 R A -4.6033
1670 E A -3.7820
1671 H A -2.2682
1672 S A -0.6705
1673 T A 0.0689
1674 L A 0.7366
1675 W A 1.5237
1676 F A 0.9758
1677 P A 0.0000
1678 E A 0.0000
1679 G A 0.2523
1680 F A 0.0000
1681 S A 0.6132
1682 L A 0.1513
1683 H A 0.0000
1684 K A -0.2581
1685 D A 0.0000
1686 V A -0.2766
1687 A A -1.0180
1688 S A -2.4873
1689 G A -2.7561
1690 H A -3.7332
1691 K A -3.5730
1692 G A 0.0000
1693 R A -3.3300
1694 R A -3.1983
1695 E A -2.6044
1696 P A -1.1062
1697 V A 0.5176
1698 G A 0.0389
1699 Q A -0.4340
1700 D A -0.4181
1701 A A 0.0526
1702 L A 0.1615
1703 G A -0.6123
1704 M A -1.1950
1705 K A -2.5421
1706 N A -2.6641
1707 M A 0.0000
1708 A A -1.1217
1709 K A -0.9436
1710 G A -0.9570
1711 E A -0.9381
1712 S A -0.7584
1713 L A 0.0000
1714 M A -0.9318
1715 G A -1.5431
1716 E A -2.4195
1717 V A -1.2690
1718 A A 0.0000
1719 T A -0.7012
1720 D A -1.0697
1721 W A -0.2876
1722 M A -1.1401
1723 D A -2.2503
1724 T A -1.7965
1725 E A -2.2758
1726 C A -1.3731
1727 P A -1.3633
1728 E A -1.3411
1729 A A -1.2863
1730 K A -2.2689
1731 R A -1.9076
1732 L A -0.8856
1733 K A -1.3379
1734 V A -0.4543
1735 E A -1.5108
1736 E A -2.1797
1737 P A -1.5506
1738 G A -0.8640
1739 M A -0.5371
1740 G A 0.0000
1741 A A -0.9700
1742 E A -1.2901
1743 E A -0.7023
1744 A A -0.3567
1745 V A 0.0000
1746 D A -1.2962
1747 C A 0.0000
1748 R A -0.7740
1749 Q A 0.0000
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 0.0000
1760 I A 0.0000
1761 R A -0.6097
1762 V A 0.3888
1763 A A 0.0000
1764 P A 0.0000
1765 A A 0.2988
1766 M A 0.9686
1767 A A 0.0000
1768 L A 0.0000
1769 T A 0.0000
1770 P A -0.5483
1771 P A -0.5141
1772 Q A -0.2514
1773 G A -0.3038
1774 D A 0.0000
1775 A A -0.7914
1776 D A -1.3177
1777 A A 0.0000
1778 D A -2.4186
1779 G A -2.0551
1780 M A 0.0000
1781 D A -2.2723
1782 V A -0.9071
1783 N A 0.0000
1784 V A -0.0975
1785 R A -1.6627
1786 G A -1.0364
1787 P A -0.8165
1788 D A -0.6763
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 -0.7449
1802 A A -0.7041
1803 L A 0.0000
1804 E A -2.1575
1805 P A -1.7521
1806 M A 0.0000
1807 P A -1.4333
1808 T A -2.0901
1809 E A -3.7917
1810 E A -4.1440
1811 D A -4.4825
1812 E A 0.0000
1813 A A 0.0000
1814 D A -3.1450
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 0.0000
1821 I A 0.0000
1822 S A 0.0000
1823 D A 0.0000
1824 L A 0.0000
1825 I A 0.0000
1826 C A -0.2918
1827 Q A -1.4671
1828 G A -1.4720
1829 A A 0.0000
1830 Q A -0.5617
1831 L A -0.2415
1832 G A -0.4729
1833 A A -0.0650
1834 R A 0.0000
1835 T A -1.1122
1836 D A -2.0332
1837 R A -1.5700
1838 T A -0.8901
1839 G A -1.0090
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 -0.1457
1849 Y A 0.2823
1850 A A -0.2169
1851 R A -0.3068
1852 A A -0.4743
1853 D A -1.0008
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 -1.1116
1861 A A -0.6253
1862 G A -1.1520
1863 A A 0.0000
1864 D A -1.6183
1865 T A 0.0000
1866 N A -1.7223
1867 A A -1.1396
1868 Q A 0.0000
1869 D A -1.7408
1870 H A -1.9980
1871 S A 0.0000
1872 G A -1.2998
1873 R A -0.7359
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 0.0000
1882 A A -0.4650
1883 D A -1.3472
1884 A A -1.0156
1885 Q A -1.7751
1886 G A -1.0165
1887 V A 0.0000
1888 F A 0.0000
1889 Q A -1.2369
1890 I A 0.0000
1891 L A 0.0000
1892 I A 0.0000
1893 R A 0.0000
1894 N A -1.5871
1895 R A -1.8389
1896 S A 0.0000
1897 T A 0.0000
1898 D A -1.0087
1899 L A 0.0000
1900 D A 0.0000
1901 A A -0.6529
1902 R A -1.3718
1903 M A 0.0077
1904 A A -0.1501
1905 D A 0.0000
1906 G A 0.0000
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 -1.2864
1918 V A 0.0000
1919 E A -2.5372
1920 G A -1.9943
1921 M A 0.0000
1922 V A 0.0000
1923 E A -3.0669
1924 E A -2.7304
1925 L A 0.0000
1926 I A 0.0000
1927 A A -1.7321
1928 S A 0.0000
1929 H A 0.0000
1930 A A 0.0000
1931 D A 0.0000
1932 V A 0.0000
1933 N A 0.0000
1934 A A -0.4879
1935 V A 0.0000
1936 D A -1.3544
1937 E A -1.1668
1938 L A 0.0000
1939 G A -0.9105
1940 K A 0.0000
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 0.0000
1953 E A -1.1638
1954 A A 0.0000
1955 T A 0.0000
1956 L A -0.5814
1957 A A 0.0000
1958 L A 0.0000
1959 L A -1.0684
1960 K A -2.3802
1961 N A -2.3311
1962 G A -0.9059
1963 A A 0.0000
1964 N A 0.0000
1965 K A 0.0000
1966 D A -0.3053
1967 M A 0.0000
1968 Q A 0.0000
1969 D A -1.7337
1970 S A -1.1674
1971 K A -1.0417
1972 E A -1.0068
1973 E A 0.0000
1974 T A 0.0000
1975 P A 0.0000
1976 L A 0.0000
1977 F A 0.0000
1978 L A 0.0000
1979 A A 0.0000
1980 A A 0.0000
1981 R A 0.0000
1982 E A -0.7839
1983 G A -0.8656
1984 S A 0.0000
1985 Y A -0.3468
1986 E A -0.5790
1987 A A 0.0000
1988 A A 0.0000
1989 K A -0.6000
1990 L A 0.0000
1991 L A 0.0000
1992 L A 0.0000
1993 D A -0.7264
1994 H A -0.4300
1995 F A -0.0068
1996 A A 0.0000
1997 N A 0.0000
1998 R A 0.0000
1999 E A 0.0000
2000 I A 0.0000
2001 T A 0.0000
2002 D A -0.8833
2003 H A 0.0000
2004 L A -0.3912
2005 D A -0.7808
2006 R A -0.8669
2007 L A 0.0000
2008 P A 0.0000
2009 R A -1.1029
2010 D A 0.0000
2011 V A 0.0000
2012 A A 0.0000
2013 Q A -0.9850
2014 E A -1.1946
2015 R A -0.6428
2016 L A 0.2197
2017 H A -1.2908
2018 Q A -2.2176
2019 D A -2.6179
2020 I A 0.0000
2021 V A -2.0973
2022 R A -3.4666
2023 L A 0.0000
2024 L A 0.0000
2025 D A -2.8708
2026 Q A -2.0964
2027 P A 0.0000
2028 S A -1.2289
2029 G A 0.0000
2030 P A -1.1802
2031 R A -2.0144
2032 S A -1.2398
2033 P A -0.9627
2034 P A -0.9640
2035 G A -0.9086
2036 P A -1.0125
2037 H A -0.8354
2038 G A 0.0000
2039 L A 0.0000
2040 G A -0.8759
2041 P A 0.0199
2042 L A 0.0929
2043 L A 0.0000
2044 C A 0.0000
2045 P A 0.2404
2046 P A -0.4088
2047 G A -0.1000
2048 A A 0.6073
2049 F A 1.2147
2050 L A 1.7792
2051 P A 0.3057
2052 G A -0.8035
2053 L A -1.3451
2054 K A -2.3127
2055 A A -1.3215
2056 A A 0.0000
2057 Q A -1.0891
2058 S A -0.8082
2059 G A -1.4418
2060 S A -1.8856
2061 K A -3.0827
2062 K A -3.2760
2063 S A -2.7162
2064 R A -3.4616
2065 R A -2.4730
2066 P A -2.1661
2067 P A -2.0191
2068 G A -2.7940
2069 K A -2.7731
2070 A A -1.1224
2071 G A -0.3756
2072 L A -0.0795
2073 G A -1.2554
2074 P A -0.5591
2075 Q A 0.0000
2076 G A -1.1928
2077 P A 0.0000
2078 R A -1.5163
2079 G A -1.8401
2080 R A -2.7582
2081 G A -1.7192
2082 K A -1.6787
2083 K A 0.0000
2084 L A 0.0000
2085 T A -0.5424
2086 L A 1.1020
2087 A A 0.5399
2088 C A 0.5666
2089 P A -0.0701
2090 G A -0.5071
2091 P A -0.6212
2092 L A 0.0000
2093 A A -0.4981
2094 D A -1.3717
2095 S A -1.4189
2096 S A 0.0000
2097 V A 0.0000
2098 T A -1.4259
2099 L A 0.0000
2100 S A -1.1747
2101 P A -1.3991
2102 V A -1.2063
2103 D A -2.1809
2104 S A -1.7135
2105 L A 0.0000
2106 D A -2.5064
2107 S A -1.3891
2108 P A -0.7091
2109 R A -1.6168
2110 P A 0.0000
2111 F A 0.0000
2112 G A -0.0261
2113 G A -0.1971
2114 P A -0.2814
2115 P A -0.2325
2116 A A 0.1654
2117 S A -0.1123
2118 P A 0.3549
2119 G A 0.0363
2120 G A -0.1309
2121 F A 0.8615
2122 P A 0.0000
2123 L A 0.5547
2124 E A 0.0963
2125 G A 0.1183
2126 P A -0.1802
2127 Y A 0.9540
2128 A A 0.2691
2129 A A 0.0000
2130 A A 0.2049
2131 T A -0.1854
2132 A A -0.2000
2133 T A -0.1869
2134 A A -0.0110
2135 V A 0.0000
2136 S A -0.1000
2137 L A 0.8168
2138 A A 0.0619
2139 Q A -0.6572
2140 L A 0.1176
2141 G A 0.0146
2142 G A 0.1523
2143 P A 0.2158
2144 G A -0.1742
2145 R A 0.0000
2146 A A 0.0000
2147 G A 0.0000
2148 L A 0.0000
2149 G A -1.7050
2150 R A -1.5653
2151 Q A -1.1610
2152 P A -0.5125
2153 P A -0.3340
2154 G A -0.2833
2155 G A 0.1999
2156 C A 0.9628
2157 V A 1.9415
2158 L A 1.3440
2159 S A 0.7414
2160 L A 1.1734
2161 G A 0.6698
2162 L A 1.4975
2163 L A 1.3315
2164 N A -0.3328
2165 P A 0.4312
2166 V A 0.0000
2167 A A 0.0000
2168 V A 1.0892
2169 P A 0.0000
2170 L A 0.7696
2171 D A -0.7004
2172 W A -0.2845
2173 A A -1.0942
2174 R A -1.6896
2175 L A -0.2319
2176 P A -0.0569
2177 P A 0.1644
2178 P A 0.5003
2179 A A 0.4908
2180 P A -0.0596
2181 P A -0.3423
2182 G A -0.4659
2183 P A -0.1363
2184 S A 0.1389
2185 F A 1.2169
2186 L A 1.8984
2187 L A 1.1479
2188 P A 0.5325
2189 L A 0.4815
2190 A A 0.0786
2191 P A -0.6120
2192 G A -0.3366
2193 P A -0.0287
2194 Q A 0.0789
2195 L A 0.9322
2196 L A -0.1409
2197 N A -1.2176
2198 P A -0.9680
2199 G A -0.9488
2200 T A -0.7074
2201 P A -0.5474
2202 V A -0.2950
2203 S A -0.8141
2204 P A -1.5931
2205 Q A -3.0937
2206 E A -3.3766
2207 R A -3.2165
2208 P A -2.2304
2209 P A 0.0000
2210 P A -0.3201
2211 Y A 0.0000
2212 L A 1.6884
2213 A A 1.3812
2214 V A 1.8067
2215 P A -0.2065
2216 G A -0.9843
2217 H A -2.1120
2218 G A -2.2710
2219 E A -2.7514
2220 E A -2.4281
2221 Y A -0.2512
2222 P A 0.0000
2223 A A 0.1467
2224 A A 0.2167
2225 G A -0.1160
2226 A A -0.2638
2227 H A -0.4936
2228 S A -0.5401
2229 S A -0.3737
2230 P A -0.4120
2231 P A -0.6266
2232 K A -1.5763
2233 A A -0.6070
2234 R A 0.4444
2235 F A 2.4073
2236 L A 2.6865
2237 R A 0.0000
2238 V A 2.4894
2239 P A 0.9530
2240 S A 0.4750
2241 E A 0.0000
2242 H A 0.2930
2243 P A 0.4613
2244 Y A 1.5353
2245 L A 2.2420
2246 T A 0.0000
2247 P A 0.4834
2248 S A -0.1993
2249 P A -0.3066
2250 E A -0.3594
2251 S A -0.4968
2252 P A -0.5006
2253 E A -0.2665
2254 H A 0.0000
2255 W A 0.8600
2256 A A 0.3524
2257 S A 0.2143
2258 P A -0.0460
2259 S A 0.0000
2260 P A -0.3428
2261 P A 0.0000
2262 S A -0.2154
2263 L A 0.9301
2264 S A -0.2207
2265 D A -1.0364
2266 W A 0.1987
2267 S A -0.2827
2268 E A -0.3566
2269 S A 0.0744
2270 T A 0.0000
2271 P A -0.0518
2272 S A -0.2476
2273 P A -0.2699
2274 A A -0.3043
2275 T A -0.2976
2276 A A -0.3278
2277 T A -0.4570
2278 G A -0.5074
2279 A A -0.2169
2280 M A 0.6356
2281 A A 0.3603
2282 T A -0.1878
2283 T A -0.5838
2284 T A -0.5431
2285 G A -0.6163
2286 A A -0.0171
2287 L A 0.3331
2288 P A 0.2548
2289 A A -0.0209
2290 Q A 0.0000
2291 P A -0.4793
2292 L A 0.0000
2293 P A 0.0000
2294 L A 0.3567
2295 S A 0.0418
2296 V A 0.0000
2297 P A 0.0000
2298 S A -0.0671
2299 S A 0.1015
2300 L A 0.5475
2301 A A 0.5477
2302 Q A 0.0379
2303 A A -0.3456
2304 Q A -0.6456
2305 T A -0.4771
2306 Q A -0.0473
2307 L A 0.9929
2308 G A 0.5278
2309 P A 0.0000
2310 Q A -1.0105
2311 P A -1.2352
2312 E A -1.4798
2313 V A -0.7912
2314 T A -0.4707
2315 P A -1.3484
2316 K A -2.5433
2317 R A -2.7281
2318 Q A -1.4843
2319 V A 0.1973
2320 L A 1.3831
2321 A A 0.9438
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, -0.5265 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_1 -0.5265 View CSV PDB
model_3 -0.5327 View CSV PDB
model_6 -0.551 View CSV PDB
model_0 -0.5593 View CSV PDB
model_2 -0.5678 View CSV PDB
model_4 -0.5731 View CSV PDB
model_7 -0.5888 View CSV PDB
CABS_average -0.592 View CSV PDB
model_5 -0.6054 View CSV PDB
model_8 -0.6302 View CSV PDB
model_11 -0.6456 View CSV PDB
model_9 -0.6534 View CSV PDB
model_10 -0.6698 View CSV PDB
input -0.753 View CSV PDB