Project name: C360R_5_4D

Status: done

Started: 2026-06-02 01:55:31
Chain sequence(s) A: MGPGARGRRRRRRPMSPPPPPPPVRALPLLLLLAGPGAAAPPCLDGSPCANGGRCTQLPSREAACLCPPGWVGERCQLEDPCHSGPCAGRGVCQSSVVAGTARFSCRCPRGFRGPDCSLPDPCLSSPCAHGARCSVGPDGRFLCSCPPGYQGRSCRSDVDECRVGEPCRHGGTCLNTPGSFRCQCPAGYTGPLCENPAVPCAPSPCRNGGTCRQSGDLTYDCACLPGFEGQNCEVNVDDCPGHRCLNGGTCVDGVNTYNCQCPPEWTGQFCTEDVDECQLQPNACHNGGTCFNTLGGHSCVCVNGWTGESCSQNIDDCATAVCFHGATCHDRVASFYCACPMGKTGLLCHLDDACVSNPRHEDAICDTNPVNGRAICTCPPGFTGGACDQDVDECSIGANPCEHLGRCVNTQGSFLCQCGRGYTGPRCETDVNECLSGPCRNQATCLDRIGQFTCICMAGFTGTYCEVDIDECQSSPCVNGGVCKDRVNGFSCTCPSGFSGSTCQLDVDECASTPCRNGAKCVDQPDGYECRCAEGFEGTLCDRNVDDCSPDPCHHGRCVDGIASFSCACAPGYTGTRCESQVDECRSQPCRHGGKCLDLVDKYLCRCPSGTTGVNCEVNIDDCASNPCTFGVCRDGINRYDCVCQPGFTGPLCNVEINECASSPCGEGGSCVDGENGFRCLCPPGSLPPLCLPPSHPCAHEPCSHGICYDAPGGFRCVCEPGWSGPRCSQSLARDACESQPCRAGGTCSSDGMGFHCTCPPGVQGRQCELLSPCTPNPCEHGGRCESAPGQLPVCSCPQGWQGPRCQQDVDECAGPAPCGPHGICTNLAGSFSCTCHGGYTGPSCDQDINDCDPNPCLNGGSCQDGVGSFSCSCLPGFAGPRCARDVDECLSNPCGPGTCTDHVASFTCTCPPGYGGFHCEQDLPDCSPSSCFNGGTCVDGVNSFSCLCRPGYTGAHCQHEADPCLSRPCLHGGVCSAAHPGFRCTCLESFTGPQCQTLVDWCSRQPCQNGGRCVQTGAYCLCPPGWSGRLCDIRSLPCREAAAQIGVRLEQLCQAGGQCVDEDSSHYCVCPEGRTGSHCEQEVDPCLAQPCQHGGTCRGYMGGYMCECLPGYNGDNCEDDVDECASQPCQHGGSCIDLVARYLCSCPPGTLGVLCEINEDDCGPGPPLDSGPRCLHNGTCVDLVGGFRCTCPPGYTGLRCEADINECRSGACHAAHTRDCLQDPGGGFRCLCHAGFSGPRCQTVLSPCESQPCQHGGQCRPSPGPGGGLTFTCHCAQPFWGPRCERVARSCRELQCPVGVPCQQTPRGPRCACPPGLSGPSCRSFPGSPPGASNASCAAAPCLHGGSCRPAPLAPFFRCACAQGWTGPRCEAPAAAPEVSEEPRCPRAACQAKRGDQRCDRECNSPGCGWDGGDCSLSVGDPWRQCEALQCWRLFNNSRCDPACSSPACLYDNFDCHAGGRERTCNPVYEKYCADHFADGRCDQGCNTEECGWDGLDCASEVPALLARGVLVLTVLLPPEELLRSSADFLQRLSAILRTSLRFRLDAHGQAMVFPYHRPSPGSEPRARRELAPEVIGSVVMLEIDNRLCLQSPENDHCFPDAQSAADYLGALSAVERLDFPYPLRDVRGEPLEPPEPSVPLLPLLVAGAVLLLVILVLGVMVARRKREHSTLWFPEGFSLHKDVASGHKGRREPVGQDALGMKNMAKGESLMGEVATDWMDTECPEAKRLKVEEPGMGAEEAVDCRQWTQHHLVAADIRVAPAMALTPPQGDADADGMDVNVRGPDGFTPLMLASFCGGALEPMPTEEDEADDTSASIISDLICQGAQLGARTDRTGETALHLAARYARADAAKRLLDAGADTNAQDHSGRTPLHTAVTADAQGVFQILIRNRSTDLDARMADGSTALILAARLAVEGMVEELIASHADVNAVDELGKSALHWAAAVNNVEATLALLKNGANKDMQDSKEETPLFLAAREGSYEAAKLLLDHFANREITDHLDRLPRDVAQERLHQDIVRLLDQPSGPRSPPGPHGLGPLLCPPGAFLPGLKAAQSGSKKSRRPPGKAGLGPQGPRGRGKKLTLACPGPLADSSVTLSPVDSLDSPRPFGGPPASPGGFPLEGPYAAATATAVSLAQLGGPGRAGLGRQPPGGCVLSLGLLNPVAVPLDWARLPPPAPPGPSFLLPLAPGPQLLNPGTPVSPQERPPPYLAVPGHGEEYPAAGAHSSPPKARFLRVPSEHPYLTPSPESPEHWASPSPPSLSDWSESTPSPATATGAMATTTGALPAQPLPLSVPSSLAQAQTQLGPQPEVTPKRQVLA
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]                                                (00:00:00)
[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                                                (00:24:12)
[INFO]       Analysis: Starting Aggrescan4D on model_8.pdb                                         (15:01:21)
[INFO]       Analysis: Starting Aggrescan4D on model_6.pdb                                         (15:02:10)
[INFO]       Analysis: Starting Aggrescan4D on model_11.pdb                                        (15:02:58)
[INFO]       Analysis: Starting Aggrescan4D on model_7.pdb                                         (15:03:50)
[INFO]       Analysis: Starting Aggrescan4D on model_3.pdb                                         (15:04:43)
[INFO]       Analysis: Starting Aggrescan4D on model_5.pdb                                         (15:05:34)
[INFO]       Analysis: Starting Aggrescan4D on model_1.pdb                                         (15:06:24)
[INFO]       Analysis: Starting Aggrescan4D on model_0.pdb                                         (15:07:13)
[INFO]       Analysis: Starting Aggrescan4D on model_2.pdb                                         (15:07:59)
[INFO]       Analysis: Starting Aggrescan4D on model_4.pdb                                         (15:08:44)
[INFO]       Analysis: Starting Aggrescan4D on model_10.pdb                                        (15:09:29)
[INFO]       Analysis: Starting Aggrescan4D on model_9.pdb                                         (15:10:15)
[INFO]       Analysis: Starting Aggrescan4D on input.pdb                                           (15:11:00)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (15:12:28)
[INFO]       Main:     Simulation completed successfully.                                          (15:13:14)
Show buried residues

Minimal score value
-2.5157
Maximal score value
2.6259
Average score
-0.2153
Total score value
-499.7601

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 1.0069
2 G A -0.1155
3 P A -0.1954
4 G A -0.5042
5 A A -0.1733
6 R A -0.6469
7 G A -0.9125
8 R A -2.0068
9 R A -0.9335
10 R A -0.9093
11 R A -1.1017
12 R A -2.1295
13 R A -1.3082
14 P A -0.4179
15 M A 0.1174
16 S A -0.0373
17 P A -0.2451
18 P A -0.2631
19 P A -0.2612
20 P A -0.3449
21 P A -0.3699
22 P A -0.3708
23 P A 0.0328
24 V A 1.3733
25 R A -1.4954
26 A A -0.0008
27 L A 1.5310
28 P A 0.3457
29 L A 1.1594
30 L A 1.2827
31 L A 1.7868
32 L A 1.0170
33 L A 1.6368
34 A A 0.0000
35 G A 0.0000
36 P A 0.0000
37 G A -0.4554
38 A A -0.0173
39 A A 0.0807
40 A A 0.0468
41 P A -0.1523
42 P A -0.1858
43 C A 0.0000
44 L A 1.2157
45 D A -1.5912
46 G A -0.8228
47 S A -0.2128
48 P A -0.2247
49 C A 0.0285
50 A A -0.2234
51 N A -1.3023
52 G A -0.4757
53 G A -0.7617
54 R A -1.8830
55 C A -0.1936
56 T A -0.2387
57 Q A -0.9995
58 L A 0.7954
59 P A -0.2071
60 S A -0.4460
61 R A -1.1041
62 E A -0.5130
63 A A -0.2408
64 A A 0.0034
65 C A 0.0000
66 L A 1.5477
67 C A 0.0000
68 P A -0.2678
69 P A -0.1380
70 G A -0.0965
71 W A -0.0473
72 V A 0.2266
73 G A -0.1258
74 E A -0.5259
75 R A 0.0000
76 C A 0.0000
77 Q A -0.3153
78 L A 0.0000
79 E A -2.1374
80 D A -2.1315
81 P A 0.0000
82 C A 0.4184
83 H A -0.1682
84 S A -0.3419
85 G A -0.5530
86 P A -0.3100
87 C A 0.1053
88 A A -0.0027
89 G A -0.6911
90 R A -1.4231
91 G A -0.4892
92 V A 1.0486
93 C A 0.2205
94 Q A -0.8823
95 S A -0.1952
96 S A -0.0551
97 V A 0.0000
98 V A 0.5913
99 A A 0.0453
100 G A -0.4759
101 T A -0.1530
102 A A -0.3324
103 R A -1.7721
104 F A -0.0389
105 S A -0.0632
106 C A 0.0000
107 R A -1.8704
108 C A 0.0000
109 P A -0.6713
110 R A -1.9878
111 G A -0.3965
112 F A 0.7119
113 R A -1.4530
114 G A 0.0000
115 P A -0.7817
116 D A -1.8199
117 C A -0.2862
118 S A -0.0085
119 L A 0.9550
120 P A 0.2227
121 D A -0.4135
122 P A -0.0730
123 C A 0.4860
124 L A 0.4344
125 S A -0.1584
126 S A -0.1287
127 P A -0.0774
128 C A 0.0869
129 A A -0.1086
130 H A -1.0692
131 G A -0.6557
132 A A -0.4215
133 R A -1.8127
134 C A -0.2165
135 S A 0.3440
136 V A 1.6185
137 G A 0.0184
138 P A -0.4959
139 D A -1.9051
140 G A -1.1649
141 R A -1.8963
142 F A 0.1576
143 L A 1.4119
144 C A 0.0000
145 S A -0.0731
146 C A -0.0648
147 P A 0.0000
148 P A -0.2836
149 G A -0.1985
150 Y A 0.0000
151 Q A -1.3249
152 G A -0.7864
153 R A -1.9247
154 S A -0.4630
155 C A 0.3011
156 R A -0.8921
157 S A -0.3699
158 D A 0.0000
159 V A 1.4404
160 D A -1.4601
161 E A 0.0000
162 C A -0.2229
163 R A -1.4950
164 V A 1.4013
165 G A -0.1722
166 E A -1.9053
167 P A -0.6044
168 C A -0.1918
169 R A -1.8790
170 H A -0.8195
171 G A -0.6281
172 G A -0.5566
173 T A -0.1435
174 C A 0.3868
175 L A 0.3048
176 N A -1.1436
177 T A -0.2817
178 P A -0.1795
179 G A -0.2221
180 S A -0.1734
181 F A -0.0140
182 R A -1.6596
183 C A -0.3213
184 Q A -0.8238
185 C A 0.1641
186 P A -0.1484
187 A A -0.0510
188 G A 0.1392
189 Y A 1.2751
190 T A 0.2251
191 G A -0.1469
192 P A -0.1402
193 L A 1.5644
194 C A 0.2448
195 E A -1.7799
196 N A 0.0000
197 P A 0.1160
198 A A 0.0447
199 V A 0.1899
200 P A -0.0423
201 C A 0.0000
202 A A -0.0248
203 P A -0.2519
204 S A -0.1508
205 P A -0.1145
206 C A -0.2444
207 R A -2.0621
208 N A -1.7185
209 G A -0.7474
210 G A -0.2968
211 T A -0.0760
212 C A -0.2034
213 R A -1.9219
214 Q A -0.8868
215 S A -0.1975
216 G A -0.5785
217 D A -1.5378
218 L A 1.1932
219 T A 0.2595
220 Y A -0.1778
221 D A -1.5230
222 C A -0.0338
223 A A 0.1703
224 C A 0.7634
225 L A 1.6128
226 P A 0.0939
227 G A -0.1292
228 F A 1.5064
229 E A -1.5377
230 G A -1.1224
231 Q A -1.5288
232 N A -1.4757
233 C A -0.1487
234 E A -0.1881
235 V A 0.0000
236 N A -0.7050
237 V A -0.2894
238 D A -2.0918
239 D A -2.1144
240 C A -0.3067
241 P A -0.2761
242 G A -0.4131
243 H A -1.3752
244 R A -2.0034
245 C A 0.0600
246 L A 1.3376
247 N A -1.0730
248 G A -0.7976
249 G A -0.5583
250 T A -0.0746
251 C A 0.4561
252 V A 1.3868
253 D A -0.2388
254 G A -0.2316
255 V A 0.8503
256 N A -1.0768
257 T A -0.3055
258 Y A 0.0000
259 N A -1.1149
260 C A 0.0000
261 Q A -1.1825
262 C A -0.1986
263 P A -0.4775
264 P A -0.6325
265 E A -1.7613
266 W A -0.2435
267 T A -0.1280
268 G A -0.7018
269 Q A -1.0724
270 F A 0.9249
271 C A 0.0000
272 T A -0.1283
273 E A -0.6690
274 D A -0.6903
275 V A 0.2979
276 D A -0.7512
277 E A -0.7760
278 C A 0.0000
279 Q A -0.2322
280 L A 1.2225
281 Q A -0.9073
282 P A 0.0000
283 N A -0.5559
284 A A -0.0435
285 C A 0.1216
286 H A -0.2349
287 N A -0.2301
288 G A -0.1315
289 G A -0.0986
290 T A -0.0220
291 C A 0.5574
292 F A 1.8267
293 N A -0.4301
294 T A 0.0934
295 L A 1.5087
296 G A 0.1826
297 G A -0.3635
298 H A -1.1100
299 S A -0.0488
300 C A 0.5245
301 V A 1.1224
302 C A 0.7272
303 V A 0.9987
304 N A -0.4464
305 G A -0.0372
306 W A 0.6939
307 T A -0.0182
308 G A -0.6462
309 E A -1.9169
310 S A -0.5555
311 C A 0.0000
312 S A 0.0000
313 Q A -0.5364
314 N A -0.2353
315 I A 0.0747
316 D A -0.9936
317 D A 0.0000
318 C A 0.5537
319 A A 0.0813
320 T A -0.0092
321 A A 0.0000
322 V A 0.0000
323 C A 0.4494
324 F A 1.8322
325 H A -0.2491
326 G A -0.4533
327 A A 0.0000
328 T A 0.0193
329 C A 0.1795
330 H A -0.1550
331 D A -0.7328
332 R A -0.2491
333 V A 0.8330
334 A A 0.2055
335 S A -0.0400
336 F A 0.0000
337 Y A 1.3112
338 C A 0.3804
339 A A 0.0668
340 C A 0.1121
341 P A -0.1556
342 M A 0.2473
343 G A -0.3901
344 K A 0.0000
345 T A 0.0000
346 G A -0.2775
347 L A 0.9110
348 L A 0.0000
349 C A 0.0000
350 H A 0.1339
351 L A 0.4014
352 D A 0.0000
353 D A 0.0000
354 A A 0.0000
355 C A 0.7316
356 V A 0.0000
357 S A 0.0000
358 N A 0.0000
359 P A -0.1799
360 R A -0.2491
361 H A 0.0000
362 E A 0.0000
363 D A -1.5627
364 A A 0.0000
365 I A 2.0328
366 C A 0.2472
367 D A -1.3183
368 T A -0.2651
369 N A 0.0000
370 P A 0.0000
371 V A 0.0000
372 N A 0.0000
373 G A 0.0000
374 R A 0.0000
375 A A 0.0000
376 I A 0.3327
377 C A 0.1639
378 T A 0.0089
379 C A 0.1784
380 P A 0.0000
381 P A -0.2701
382 G A -0.1354
383 F A 0.0000
384 T A -0.0652
385 G A -0.1648
386 G A -0.4065
387 A A -0.1525
388 C A 0.0000
389 D A -0.8744
390 Q A -0.7424
391 D A -1.8405
392 V A 0.0000
393 D A -1.8115
394 E A 0.0000
395 C A 0.1470
396 S A -0.3650
397 I A 0.0000
398 G A -0.4650
399 A A -0.1851
400 N A -0.5993
401 P A -0.1726
402 C A -0.2400
403 E A -1.9159
404 H A -0.6647
405 L A 1.3951
406 G A -0.2231
407 R A -1.9103
408 C A 0.0013
409 V A 0.8145
410 N A -1.0808
411 T A -0.5065
412 Q A -1.3976
413 G A -0.2970
414 S A -0.0996
415 F A 0.0000
416 L A 1.4324
417 C A 0.2589
418 Q A -0.7027
419 C A -0.0071
420 G A -0.5246
421 R A -1.9773
422 G A -0.7690
423 Y A 0.1298
424 T A 0.0055
425 G A -0.1039
426 P A -0.1984
427 R A 0.0000
428 C A 0.0000
429 E A -1.7096
430 T A 0.0000
431 D A -0.4697
432 V A 0.5018
433 N A -0.2920
434 E A -1.2786
435 C A 0.1464
436 L A 1.5260
437 S A 0.0524
438 G A -0.1577
439 P A -0.0800
440 C A 0.0360
441 R A -0.3890
442 N A 0.0000
443 Q A -0.4185
444 A A 0.0000
445 T A -0.1605
446 C A 0.0000
447 L A 0.4345
448 D A -0.4017
449 R A -0.5538
450 I A 1.7744
451 G A -0.1385
452 Q A -0.6667
453 F A 0.0000
454 T A 0.0000
455 C A 0.0000
456 I A 1.0770
457 C A 0.0000
458 M A 0.8352
459 A A 0.0771
460 G A -0.4935
461 F A 0.7983
462 T A 0.0413
463 G A -0.3043
464 T A 0.1641
465 Y A 1.3100
466 C A 0.0000
467 E A -1.6918
468 V A 0.0083
469 D A -1.6344
470 I A -0.1774
471 D A -1.0683
472 E A -0.4660
473 C A -0.0969
474 Q A -1.1960
475 S A -0.4214
476 S A -0.1097
477 P A -0.1253
478 C A 0.7644
479 V A 0.3186
480 N A -1.2919
481 G A -0.7261
482 G A -0.1584
483 V A 0.8599
484 C A 0.2389
485 K A -0.5203
486 D A -2.1637
487 R A -1.9986
488 V A 0.0755
489 N A -0.5624
490 G A 0.0000
491 F A 1.9410
492 S A 0.0000
493 C A 0.0860
494 T A 0.0000
495 C A 0.0000
496 P A -0.1593
497 S A -0.2979
498 G A -0.3805
499 F A 0.0000
500 S A -0.1118
501 G A -0.4834
502 S A -0.1539
503 T A 0.0000
504 C A 0.1514
505 Q A -0.8472
506 L A 1.1738
507 D A 0.0797
508 V A 1.5765
509 D A -0.5218
510 E A -1.9031
511 C A -0.2834
512 A A 0.0315
513 S A -0.1950
514 T A -0.0907
515 P A -0.2384
516 C A -0.3056
517 R A -2.0655
518 N A -1.7071
519 G A -0.7052
520 A A 0.0000
521 K A -1.6684
522 C A 0.0968
523 V A 1.0904
524 D A -1.5492
525 Q A -0.8048
526 P A -0.4652
527 D A -0.7694
528 G A -0.1552
529 Y A -0.0073
530 E A -1.6844
531 C A -0.5155
532 R A -1.6913
533 C A 0.0000
534 A A -0.2908
535 E A -1.8573
536 G A -0.2347
537 F A 1.7565
538 E A -0.4403
539 G A -0.6125
540 T A -0.0006
541 L A 1.1059
542 C A 0.5167
543 D A -1.5765
544 R A -0.7657
545 N A -0.5589
546 V A 0.1242
547 D A -0.5896
548 D A -0.3610
549 C A -0.0014
550 S A -0.1480
551 P A -0.2765
552 D A 0.0000
553 P A -0.2220
554 C A -0.0620
555 H A -1.1537
556 H A -1.2777
557 G A -1.0130
558 R A -1.8406
559 C A 0.3519
560 V A 0.9102
561 D A -1.5856
562 G A -0.4264
563 I A 1.9339
564 A A 0.4338
565 S A 0.1087
566 F A 0.4447
567 S A 0.0000
568 C A 0.0000
569 A A 0.0152
570 C A 0.0000
571 A A 0.0832
572 P A -0.2491
573 G A -0.3829
574 Y A 0.5442
575 T A 0.0483
576 G A -0.2823
577 T A -0.2541
578 R A -0.9184
579 C A 0.0000
580 E A -1.8609
581 S A -0.6303
582 Q A -0.0545
583 V A 1.6477
584 D A -0.1753
585 E A -1.0861
586 C A -0.4455
587 R A -1.8695
588 S A -0.8023
589 Q A -1.2889
590 P A -0.4824
591 C A 0.0000
592 R A -2.0326
593 H A -1.3978
594 G A -0.5280
595 G A -0.5909
596 K A -1.7399
597 C A 0.0000
598 L A 0.1540
599 D A -0.6865
600 L A 1.2074
601 V A 1.6689
602 D A -1.7744
603 K A -1.8515
604 Y A 0.2952
605 L A 1.6267
606 C A 0.0415
607 R A -1.8248
608 C A 0.0000
609 P A -0.2945
610 S A -0.3475
611 G A -0.5104
612 T A -0.1466
613 T A -0.1271
614 G A -0.1452
615 V A 1.4967
616 N A -0.5640
617 C A 0.2411
618 E A -0.0536
619 V A 0.4985
620 N A 0.3020
621 I A 1.9325
622 D A -0.2906
623 D A -1.8281
624 C A 0.0000
625 A A -0.1745
626 S A -0.2748
627 N A -0.4781
628 P A -0.3149
629 C A 0.0179
630 T A 0.3287
631 F A 1.9205
632 G A 0.6584
633 V A 1.8252
634 C A 0.4109
635 R A -1.6560
636 D A -1.1878
637 G A -0.2378
638 I A 1.1252
639 N A -1.1029
640 R A -1.8051
641 Y A -0.0798
642 D A -1.0998
643 C A 0.1455
644 V A 0.6962
645 C A 0.0000
646 Q A -0.3522
647 P A -0.4145
648 G A -0.3757
649 F A 0.4147
650 T A 0.1114
651 G A -0.3137
652 P A -0.0202
653 L A 1.5008
654 C A 0.0000
655 N A -0.5376
656 V A -0.0893
657 E A -1.2908
658 I A 1.4273
659 N A -1.0540
660 E A -0.9523
661 C A 0.5818
662 A A 0.1686
663 S A -0.1506
664 S A -0.1489
665 P A -0.2504
666 C A -0.0411
667 G A -0.4484
668 E A 0.0000
669 G A -0.5423
670 G A -0.4674
671 S A -0.1756
672 C A 0.2781
673 V A 0.4350
674 D A -0.6970
675 G A -0.9598
676 E A -2.1471
677 N A -1.6648
678 G A -0.4059
679 F A 0.2412
680 R A -0.6852
681 C A 0.0000
682 L A 0.7271
683 C A 0.0000
684 P A -0.1457
685 P A -0.1682
686 G A -0.5201
687 S A -0.2630
688 L A 0.1620
689 P A -0.0904
690 P A 0.0170
691 L A 1.5304
692 C A 0.4528
693 L A 0.0000
694 P A -0.1104
695 P A -0.3077
696 S A -0.3523
697 H A -0.5142
698 P A -0.1303
699 C A 0.0000
700 A A -0.1800
701 H A -1.3218
702 E A -2.0390
703 P A -0.5962
704 C A -0.1678
705 S A -0.3922
706 H A -0.9809
707 G A 0.0550
708 I A 1.9902
709 C A 0.6176
710 Y A 0.8303
711 D A -0.0351
712 A A -0.0891
713 P A -0.3404
714 G A -0.5366
715 G A -0.0497
716 F A 0.5343
717 R A -1.2384
718 C A 0.0000
719 V A 0.2533
720 C A -0.1966
721 E A -1.7840
722 P A -0.8437
723 G A -0.3652
724 W A 0.4759
725 S A 0.0432
726 G A -0.0772
727 P A -0.6173
728 R A -1.7519
729 C A 0.3290
730 S A -0.3095
731 Q A -1.2780
732 S A -0.1365
733 L A 1.3305
734 A A -0.0037
735 R A -1.8603
736 D A -1.5206
737 A A -0.1147
738 C A -0.0228
739 E A -1.9119
740 S A -0.7305
741 Q A -0.8964
742 P A -0.2080
743 C A 0.0000
744 R A -1.9307
745 A A -0.4051
746 G A -0.5514
747 G A -0.7707
748 T A -0.0860
749 C A 0.1105
750 S A -0.2358
751 S A -0.2731
752 D A -1.9097
753 G A -0.6066
754 M A 0.9392
755 G A 0.2459
756 F A 1.7177
757 H A -0.6062
758 C A -0.0446
759 T A 0.0935
760 C A 0.5425
761 P A 0.0068
762 P A -0.1237
763 G A 0.0000
764 V A 1.5608
765 Q A -0.8502
766 G A -1.0265
767 R A -2.1088
768 Q A -1.4564
769 C A 0.0954
770 E A -0.4491
771 L A 0.0000
772 L A 1.3335
773 S A 0.0870
774 P A -0.1380
775 C A 0.6842
776 T A 0.0000
777 P A -0.2051
778 N A -0.2345
779 P A -0.2411
780 C A -0.1767
781 E A -1.7766
782 H A 0.0000
783 G A 0.0000
784 G A 0.0000
785 R A -1.8129
786 C A -0.5040
787 E A -1.7126
788 S A -0.4063
789 A A -0.0506
790 P A -0.3427
791 G A -0.7041
792 Q A -0.7627
793 L A 1.3442
794 P A 0.3564
795 V A 0.6396
796 C A 0.2574
797 S A -0.0686
798 C A 0.0000
799 P A -0.1736
800 Q A -0.2017
801 G A -0.2855
802 W A 1.0357
803 Q A -0.0380
804 G A -0.2352
805 P A -0.6227
806 R A -1.8911
807 C A 0.0000
808 Q A -0.5666
809 Q A -0.3323
810 D A 0.0000
811 V A 1.7223
812 D A -0.2479
813 E A -1.7920
814 C A -0.2165
815 A A -0.0046
816 G A -0.4734
817 P A -0.2027
818 A A 0.0000
819 P A -0.2401
820 C A -0.0553
821 G A -0.5010
822 P A -0.5390
823 H A -1.0588
824 G A -0.0149
825 I A 2.0355
826 C A 0.5992
827 T A -0.1158
828 N A -0.5934
829 L A 0.2139
830 A A 0.1223
831 G A 0.0000
832 S A 0.0000
833 F A 0.0000
834 S A 0.0000
835 C A 0.0000
836 T A -0.0232
837 C A 0.0000
838 H A -0.8860
839 G A -0.3246
840 G A -0.0197
841 Y A 1.1744
842 T A 0.2297
843 G A -0.0784
844 P A -0.1438
845 S A -0.2302
846 C A 0.0000
847 D A -1.6113
848 Q A -1.0557
849 D A -0.2262
850 I A 1.8569
851 N A -0.3300
852 D A -1.8422
853 C A -0.4177
854 D A -0.8978
855 P A -0.4111
856 N A 0.0000
857 P A 0.0000
858 C A 0.0000
859 L A 0.0000
860 N A -0.1947
861 G A -0.2904
862 G A -0.4126
863 S A -0.2605
864 C A -0.1890
865 Q A -1.3080
866 D A -0.9048
867 G A -0.3330
868 V A 0.6193
869 G A -0.3592
870 S A -0.1863
871 F A 0.4509
872 S A 0.0370
873 C A 0.0461
874 S A -0.0743
875 C A 0.2868
876 L A 1.0390
877 P A 0.1046
878 G A -0.3947
879 F A 0.3208
880 A A 0.0403
881 G A -0.5559
882 P A -0.6697
883 R A -1.9281
884 C A 0.0000
885 A A 0.0066
886 R A 0.0000
887 D A -0.1874
888 V A 0.0000
889 D A -0.3993
890 E A -0.3171
891 C A 0.0000
892 L A 0.3681
893 S A -0.0098
894 N A -0.1588
895 P A 0.0000
896 C A 0.0000
897 G A -0.1216
898 P A -0.1970
899 G A -0.4968
900 T A -0.1452
901 C A 0.0000
902 T A 0.0000
903 D A 0.0000
904 H A 0.0000
905 V A 0.0000
906 A A 0.0000
907 S A -0.0358
908 F A 0.0000
909 T A 0.0000
910 C A 0.0000
911 T A -0.0157
912 C A 0.0819
913 P A -0.0647
914 P A -0.2742
915 G A -0.1135
916 Y A 0.0000
917 G A -0.1185
918 G A 0.0000
919 F A 0.3761
920 H A 0.0000
921 C A -0.0074
922 E A -0.6066
923 Q A 0.0000
924 D A 0.0000
925 L A 0.0000
926 P A 0.0000
927 D A 0.0000
928 C A 0.0000
929 S A -0.0204
930 P A 0.0000
931 S A 0.0000
932 S A 0.0000
933 C A 0.0000
934 F A 0.0000
935 N A -0.2894
936 G A -0.3020
937 G A -0.2331
938 T A -0.0346
939 C A 0.4212
940 V A 1.6152
941 D A 0.0000
942 G A 0.0604
943 V A 0.6048
944 N A -0.1146
945 S A 0.1179
946 F A 1.8824
947 S A 0.4471
948 C A 0.3916
949 L A 1.5838
950 C A 0.0354
951 R A -1.8561
952 P A -0.5891
953 G A -0.4528
954 Y A 0.0537
955 T A -0.0842
956 G A -0.4699
957 A A -0.1835
958 H A -0.5844
959 C A 0.0000
960 Q A -0.6548
961 H A 0.0000
962 E A -0.4910
963 A A -0.2242
964 D A -0.8779
965 P A -0.3031
966 C A 0.0000
967 L A 1.5072
968 S A -0.2690
969 R A -1.9249
970 P A -0.5990
971 C A 0.1394
972 L A 0.5896
973 H A -0.9348
974 G A -0.6669
975 G A -0.2457
976 V A 0.0000
977 C A 0.2250
978 S A 0.0000
979 A A 0.1760
980 A A -0.1179
981 H A -0.7518
982 P A -0.4949
983 G A -0.1255
984 F A 1.1345
985 R A -0.7680
986 C A -0.0917
987 T A 0.0053
988 C A 0.0000
989 L A 0.2377
990 E A -1.1443
991 S A -0.0718
992 F A 0.9568
993 T A 0.1099
994 G A -0.3412
995 P A -0.5225
996 Q A -1.2203
997 C A -0.0774
998 Q A -0.2463
999 T A 0.0292
1000 L A 0.6282
1001 V A 0.1711
1002 D A -1.5187
1003 W A 1.0021
1004 C A 0.8440
1005 S A -0.3262
1006 R A -1.9323
1007 Q A -0.7155
1008 P A -0.2552
1009 C A 0.0607
1010 Q A -1.1737
1011 N A -0.5821
1012 G A -0.6063
1013 G A -0.9120
1014 R A -1.8744
1015 C A 0.0137
1016 V A 0.1529
1017 Q A -0.8477
1018 T A -0.3241
1019 G A -0.4763
1020 A A -0.1346
1021 Y A 0.3958
1022 C A 0.0000
1023 L A 0.1992
1024 C A 0.1060
1025 P A -0.1076
1026 P A -0.2818
1027 G A 0.0677
1028 W A 0.8969
1029 S A 0.1301
1030 G A -0.2341
1031 R A -0.6764
1032 L A 0.4990
1033 C A 0.1904
1034 D A 0.0000
1035 I A 0.0000
1036 R A -0.1068
1037 S A 0.1470
1038 L A 1.4916
1039 P A 0.2712
1040 C A 0.0000
1041 R A -2.1406
1042 E A -1.9231
1043 A A -0.4739
1044 A A -0.2049
1045 A A -0.3539
1046 Q A -0.8157
1047 I A 1.6987
1048 G A 0.0925
1049 V A 0.4478
1050 R A -1.4406
1051 L A 0.8212
1052 E A -0.4262
1053 Q A -1.2337
1054 L A -0.0041
1055 C A 0.0000
1056 Q A -0.5804
1057 A A -0.1813
1058 G A -0.5515
1059 G A -0.5812
1060 Q A -0.2120
1061 C A 0.2494
1062 V A 0.9068
1063 D A -0.7537
1064 E A -2.2806
1065 D A -2.1648
1066 S A -0.4999
1067 S A -0.2461
1068 H A 0.0000
1069 Y A 0.3806
1070 C A 0.0000
1071 V A 1.0312
1072 C A 0.0000
1073 P A -0.5879
1074 E A -1.9140
1075 G A -0.6450
1076 R A -0.4792
1077 T A -0.0592
1078 G A 0.0000
1079 S A -0.1647
1080 H A -0.3769
1081 C A 0.0000
1082 E A -1.8876
1083 Q A -0.9288
1084 E A -1.0534
1085 V A 0.9173
1086 D A -0.9263
1087 P A -0.2592
1088 C A 0.2826
1089 L A 0.6344
1090 A A 0.1487
1091 Q A 0.0000
1092 P A -0.1738
1093 C A 0.3970
1094 Q A 0.0000
1095 H A -0.1570
1096 G A -0.1467
1097 G A -0.0470
1098 T A -0.0094
1099 C A -0.2020
1100 R A -1.7332
1101 G A -0.1705
1102 Y A 1.4673
1103 M A 1.2616
1104 G A -0.0827
1105 G A 0.1944
1106 Y A 0.7573
1107 M A 0.4954
1108 C A -0.0922
1109 E A -1.7508
1110 C A -0.0926
1111 L A 0.4121
1112 P A -0.2606
1113 G A -0.2446
1114 Y A 0.9736
1115 N A -1.0506
1116 G A -0.7959
1117 D A -1.9487
1118 N A -0.9812
1119 C A 0.0000
1120 E A -0.4343
1121 D A 0.0000
1122 D A -0.8810
1123 V A 0.0000
1124 D A -1.8358
1125 E A -0.5397
1126 C A 0.1102
1127 A A 0.0613
1128 S A -0.1024
1129 Q A -0.3405
1130 P A -0.2074
1131 C A 0.0000
1132 Q A -1.3728
1133 H A -0.9547
1134 G A -0.6672
1135 G A -0.7816
1136 S A -0.0744
1137 C A 0.2622
1138 I A 0.2992
1139 D A -0.6008
1140 L A 0.0000
1141 V A 0.2083
1142 A A -0.0237
1143 R A -0.4233
1144 Y A 0.0000
1145 L A 0.0000
1146 C A 0.0000
1147 S A -0.0439
1148 C A 0.0000
1149 P A 0.0000
1150 P A -0.0332
1151 G A 0.0000
1152 T A 0.0000
1153 L A 0.0000
1154 G A 0.0000
1155 V A 0.5524
1156 L A 1.5969
1157 C A 0.3722
1158 E A 0.0364
1159 I A 0.3361
1160 N A -0.4323
1161 E A -0.9580
1162 D A 0.0000
1163 D A 0.0000
1164 C A 0.0000
1165 G A -0.1848
1166 P A -0.3032
1167 G A -0.1318
1168 P A 0.0000
1169 P A 0.0281
1170 L A 0.5310
1171 D A 0.0000
1172 S A -0.0517
1173 G A -0.5200
1174 P A -0.3456
1175 R A 0.0000
1176 C A 0.3672
1177 L A 1.5050
1178 H A -0.2282
1179 N A -1.3596
1180 G A -0.4541
1181 T A -0.0584
1182 C A 0.3357
1183 V A 0.4054
1184 D A -0.5713
1185 L A 1.4658
1186 V A 0.9377
1187 G A 0.0000
1188 G A 0.0873
1189 F A -0.2164
1190 R A -1.5144
1191 C A -0.1618
1192 T A -0.0042
1193 C A 0.0114
1194 P A -0.2689
1195 P A -0.3811
1196 G A -0.3522
1197 Y A 0.6266
1198 T A 0.0568
1199 G A -0.1389
1200 L A 0.9730
1201 R A -0.2871
1202 C A -0.0716
1203 E A -0.3103
1204 A A -0.0475
1205 D A 0.0000
1206 I A 0.0000
1207 N A -0.3564
1208 E A -0.3045
1209 C A -0.1588
1210 R A -1.0185
1211 S A -0.4871
1212 G A -0.4764
1213 A A 0.0132
1214 C A 0.0915
1215 H A -0.8224
1216 A A -0.1017
1217 A A -0.0654
1218 H A -0.1950
1219 T A -0.1082
1220 R A -0.3093
1221 D A 0.0000
1222 C A 0.0000
1223 L A 0.5152
1224 Q A 0.0000
1225 D A -0.6430
1226 P A -0.2106
1227 G A -0.5607
1228 G A -0.6035
1229 G A 0.0488
1230 F A 1.5231
1231 R A -1.4888
1232 C A 0.0000
1233 L A 0.4057
1234 C A 0.0000
1235 H A -0.2654
1236 A A -0.0471
1237 G A 0.0206
1238 F A 0.0000
1239 S A -0.1138
1240 G A -0.4835
1241 P A -0.5075
1242 R A -1.7135
1243 C A 0.3490
1244 Q A -0.0217
1245 T A 0.0269
1246 V A 0.8888
1247 L A 1.3728
1248 S A 0.1896
1249 P A -0.0520
1250 C A -0.2128
1251 E A -1.8236
1252 S A -0.7371
1253 Q A -1.2767
1254 P A -0.4596
1255 C A -0.0074
1256 Q A -0.4308
1257 H A -0.2813
1258 G A -0.3835
1259 G A 0.0000
1260 Q A -0.4045
1261 C A -0.2464
1262 R A -1.8364
1263 P A -0.4768
1264 S A -0.1559
1265 P A -0.3321
1266 G A -0.5300
1267 P A -0.2348
1268 G A -0.4134
1269 G A -0.2840
1270 G A 0.0000
1271 L A 0.1842
1272 T A 0.0728
1273 F A 0.2256
1274 T A 0.0454
1275 C A -0.0012
1276 H A -0.6881
1277 C A 0.0000
1278 A A 0.0032
1279 Q A -0.1225
1280 P A 0.0000
1281 F A 0.0000
1282 W A 0.1346
1283 G A -0.1853
1284 P A -0.6193
1285 R A -1.8922
1286 C A 0.0000
1287 E A 0.0000
1288 R A -0.6217
1289 V A 0.0863
1290 A A -0.0756
1291 R A -0.6589
1292 S A 0.0000
1293 C A 0.0000
1294 R A -0.7127
1295 E A -0.4264
1296 L A 0.0664
1297 Q A -0.1292
1298 C A 0.0000
1299 P A -0.0224
1300 V A 0.6011
1301 G A -0.3284
1302 V A 0.0000
1303 P A -0.0385
1304 C A 0.0000
1305 Q A 0.0000
1306 Q A 0.0000
1307 T A 0.0000
1308 P A -0.5450
1309 R A -1.6249
1310 G A -0.3377
1311 P A 0.0000
1312 R A -0.3104
1313 C A 0.0000
1314 A A 0.0000
1315 C A 0.0619
1316 P A -0.3003
1317 P A -0.3215
1318 G A -0.1353
1319 L A 0.1302
1320 S A -0.2155
1321 G A -0.5689
1322 P A -0.4256
1323 S A -0.2597
1324 C A 0.0000
1325 R A 0.0000
1326 S A -0.2129
1327 F A 0.0000
1328 P A -0.1351
1329 G A -0.4820
1330 S A -0.1731
1331 P A -0.2665
1332 P A -0.0840
1333 G A -0.0980
1334 A A 0.0000
1335 S A 0.0000
1336 N A -0.2518
1337 A A 0.0000
1338 S A 0.0000
1339 C A 0.0000
1340 A A 0.0452
1341 A A 0.0176
1342 A A 0.0000
1343 P A -0.0472
1344 C A 0.4180
1345 L A 1.3534
1346 H A -0.7938
1347 G A -0.6667
1348 G A -0.3252
1349 S A -0.1614
1350 C A 0.0000
1351 R A -1.8570
1352 P A -0.5165
1353 A A 0.0886
1354 P A 0.0029
1355 L A 1.3297
1356 A A 0.2640
1357 P A -0.2452
1358 F A 0.0000
1359 F A 0.4427
1360 R A -1.6715
1361 C A -0.2491
1362 A A 0.1155
1363 C A 0.2116
1364 A A -0.1336
1365 Q A -1.2757
1366 G A -0.6939
1367 W A 0.0000
1368 T A -0.0138
1369 G A 0.0000
1370 P A -0.4258
1371 R A -0.9741
1372 C A 0.0000
1373 E A -0.7113
1374 A A -0.1878
1375 P A -0.0494
1376 A A 0.0310
1377 A A 0.0245
1378 A A -0.0243
1379 P A -0.3954
1380 E A -0.5479
1381 V A 1.6001
1382 S A 0.2852
1383 E A 0.0000
1384 E A -1.8372
1385 P A -0.7314
1386 R A -1.5687
1387 C A -0.2439
1388 P A -0.4875
1389 R A -1.8632
1390 A A -0.3953
1391 A A 0.0462
1392 C A 0.0000
1393 Q A -1.1815
1394 A A -0.3201
1395 K A -1.1859
1396 R A -2.0949
1397 G A -1.1483
1398 D A -1.9438
1399 Q A -0.9904
1400 R A -1.7153
1401 C A 0.0000
1402 D A -1.8498
1403 R A -0.8076
1404 E A -0.7988
1405 C A 0.0000
1406 N A 0.0000
1407 S A 0.0000
1408 P A 0.0000
1409 G A -0.4180
1410 C A 0.1611
1411 G A 0.0013
1412 W A 0.0000
1413 D A 0.0000
1414 G A -0.5549
1415 G A -0.5883
1416 D A -0.2444
1417 C A 0.0650
1418 S A 0.2586
1419 L A 1.5369
1420 S A 0.0000
1421 V A 0.0000
1422 G A 0.0000
1423 D A -0.1885
1424 P A 0.0000
1425 W A -0.1829
1426 R A -1.9263
1427 Q A -0.9799
1428 C A -0.3841
1429 E A -1.7934
1430 A A -0.2425
1431 L A 0.2241
1432 Q A -0.2370
1433 C A 0.0000
1434 W A 0.0000
1435 R A -0.2629
1436 L A 0.0000
1437 F A 0.0000
1438 N A -0.3892
1439 N A -0.9167
1440 S A -0.5862
1441 R A -1.8542
1442 C A 0.0000
1443 D A -1.8134
1444 P A -0.4552
1445 A A 0.0346
1446 C A 0.0000
1447 S A -0.0208
1448 S A 0.0000
1449 P A 0.0000
1450 A A 0.0096
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 0.0223
1459 H A -0.9178
1460 A A -0.2534
1461 G A -0.4637
1462 G A 0.0000
1463 R A -0.6681
1464 E A -2.0911
1465 R A -1.4618
1466 T A -0.2826
1467 C A 0.0000
1468 N A -0.8043
1469 P A -0.1782
1470 V A 1.8486
1471 Y A 0.9157
1472 E A -0.8282
1473 K A -1.5688
1474 Y A 1.0586
1475 C A 0.0000
1476 A A -0.4020
1477 D A -1.7881
1478 H A 0.0000
1479 F A 1.9519
1480 A A 0.2068
1481 D A -1.2081
1482 G A -0.7171
1483 R A -0.3837
1484 C A 0.4854
1485 D A -1.2036
1486 Q A -1.3853
1487 G A -0.3953
1488 C A 0.0000
1489 N A -1.2730
1490 T A 0.0000
1491 E A 0.0000
1492 E A -0.5104
1493 C A 0.0000
1494 G A 0.0000
1495 W A 0.0000
1496 D A 0.0000
1497 G A -0.0684
1498 L A 0.3062
1499 D A -0.3655
1500 C A 0.1594
1501 A A 0.0000
1502 S A -0.5632
1503 E A -1.7311
1504 V A 0.5012
1505 P A -0.2701
1506 A A -0.0191
1507 L A 0.0000
1508 L A 0.3911
1509 A A 0.0000
1510 R A -0.3784
1511 G A 0.0000
1512 V A 0.0000
1513 L A 0.0000
1514 V A 0.2323
1515 L A 0.0000
1516 T A 0.0000
1517 V A 0.0000
1518 L A 0.6981
1519 L A 1.5491
1520 P A 0.2034
1521 P A 0.0000
1522 E A -2.1660
1523 E A -2.1660
1524 L A 0.0000
1525 L A 0.2466
1526 R A -1.7442
1527 S A -0.3630
1528 S A 0.0538
1529 A A -0.0693
1530 D A -0.4745
1531 F A 0.0000
1532 L A 0.1637
1533 Q A 0.0000
1534 R A -0.4091
1535 L A 0.0000
1536 S A 0.0000
1537 A A 0.0000
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 -1.3991
1545 F A 0.0000
1546 R A -1.8035
1547 L A -0.4711
1548 D A -1.7402
1549 A A -0.4686
1550 H A -1.0670
1551 G A -0.6945
1552 Q A -0.3015
1553 A A -0.2019
1554 M A 0.1204
1555 V A 0.0000
1556 F A 1.6603
1557 P A 0.3973
1558 Y A 0.8594
1559 H A -1.0312
1560 R A -2.1034
1561 P A -0.8034
1562 S A -0.1332
1563 P A -0.0526
1564 G A 0.0000
1565 S A -0.0081
1566 E A 0.0000
1567 P A -0.4168
1568 R A -1.0858
1569 A A -0.3048
1570 R A -0.8509
1571 R A 0.0000
1572 E A -1.0017
1573 L A 1.2650
1574 A A 0.0000
1575 P A -0.4464
1576 E A -0.9747
1577 V A 0.7449
1578 I A 0.9845
1579 G A 0.0000
1580 S A 0.0000
1581 V A 0.0000
1582 V A 0.0000
1583 M A 0.3077
1584 L A 0.0000
1585 E A -0.2398
1586 I A 0.0000
1587 D A 0.0000
1588 N A 0.0000
1589 R A 0.0000
1590 L A 0.0000
1591 C A 0.0000
1592 L A 0.3609
1593 Q A -0.2452
1594 S A 0.0000
1595 P A -0.4942
1596 E A -2.0391
1597 N A -1.3804
1598 D A -0.3866
1599 H A 0.0000
1600 C A 0.0000
1601 F A 0.0000
1602 P A 0.0000
1603 D A -0.3280
1604 A A 0.0000
1605 Q A -0.4385
1606 S A 0.0000
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 -0.1551
1618 E A -1.8935
1619 R A -0.8906
1620 L A -0.0886
1621 D A -0.6243
1622 F A 0.0000
1623 P A -0.0064
1624 Y A 1.2194
1625 P A 0.0199
1626 L A 0.0000
1627 R A -0.6402
1628 D A 0.0000
1629 V A 0.0000
1630 R A -0.5003
1631 G A -0.4154
1632 E A -0.9816
1633 P A -0.1103
1634 L A 1.1832
1635 E A -1.5559
1636 P A -0.4834
1637 P A -0.3802
1638 E A -1.8257
1639 P A 0.0000
1640 S A -0.1723
1641 V A 0.2539
1642 P A 0.0643
1643 L A 1.6625
1644 L A 1.7643
1645 P A 0.3270
1646 L A 1.7875
1647 L A 1.7950
1648 V A 0.0000
1649 A A 0.1569
1650 G A -0.0294
1651 A A 0.0000
1652 V A 0.7488
1653 L A 1.7766
1654 L A 1.4777
1655 L A 1.3620
1656 V A 1.9880
1657 I A 2.6259
1658 L A 2.0481
1659 V A 1.9346
1660 L A 1.6515
1661 G A 0.4985
1662 V A 1.9429
1663 M A 1.5320
1664 V A 0.9475
1665 A A 0.0355
1666 R A -2.1837
1667 R A -2.5157
1668 K A -2.3940
1669 R A -2.5053
1670 E A -2.3175
1671 H A -1.2308
1672 S A -0.2193
1673 T A 0.0315
1674 L A 0.3972
1675 W A 0.6275
1676 F A 1.4846
1677 P A 0.0087
1678 E A -1.2304
1679 G A -0.0722
1680 F A 1.1631
1681 S A 0.4849
1682 L A 1.3543
1683 H A -0.9489
1684 K A -1.8463
1685 D A -1.9389
1686 V A 0.1585
1687 A A 0.1119
1688 S A -0.2158
1689 G A -0.3043
1690 H A -1.2170
1691 K A -1.3856
1692 G A -1.0738
1693 R A -2.2906
1694 R A -2.2505
1695 E A -0.6295
1696 P A -0.2649
1697 V A 0.2628
1698 G A -0.4667
1699 Q A -0.8601
1700 D A -1.8687
1701 A A -0.1654
1702 L A 1.5122
1703 G A 0.2658
1704 M A 0.9343
1705 K A -1.2927
1706 N A -1.4190
1707 M A 0.5701
1708 A A 0.0961
1709 K A -0.5903
1710 G A -0.3663
1711 E A 0.0000
1712 S A 0.1722
1713 L A 1.5778
1714 M A 0.4907
1715 G A -0.7568
1716 E A -1.7231
1717 V A 0.6598
1718 A A 0.2389
1719 T A -0.3595
1720 D A -1.5702
1721 W A 1.0485
1722 M A 1.1349
1723 D A -0.5838
1724 T A -0.5561
1725 E A -1.7011
1726 C A 0.3322
1727 P A -0.5069
1728 E A -1.8578
1729 A A -0.5905
1730 K A -1.8032
1731 R A -1.8735
1732 L A 0.5833
1733 K A -1.1934
1734 V A 0.8147
1735 E A -1.6929
1736 E A -1.2987
1737 P A -0.5039
1738 G A -0.3145
1739 M A 0.8772
1740 G A -0.2576
1741 A A -0.3698
1742 E A -2.1517
1743 E A -2.1515
1744 A A -0.1825
1745 V A 0.4777
1746 D A -0.3627
1747 C A 0.0000
1748 R A -0.7704
1749 Q A -0.5475
1750 W A 0.0000
1751 T A 0.0000
1752 Q A -0.3206
1753 H A 0.0000
1754 H A 0.0000
1755 L A 0.3216
1756 V A 0.9181
1757 A A 0.0000
1758 A A 0.0000
1759 D A -0.8105
1760 I A 0.0000
1761 R A -1.4103
1762 V A -0.0205
1763 A A 0.0000
1764 P A -0.0649
1765 A A 0.2729
1766 M A 1.0758
1767 A A 0.2476
1768 L A 0.0000
1769 T A -0.1369
1770 P A -0.2481
1771 P A -0.3708
1772 Q A -0.5575
1773 G A -0.6452
1774 D A -0.5959
1775 A A -0.3783
1776 D A -1.9629
1777 A A -0.6631
1778 D A -2.0234
1779 G A -0.6252
1780 M A -0.0287
1781 D A -0.5405
1782 V A 0.0642
1783 N A -0.5212
1784 V A 1.2317
1785 R A -1.5069
1786 G A -0.4991
1787 P A -0.3822
1788 D A -0.7964
1789 G A 0.0000
1790 F A 0.2625
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 0.3371
1799 C A 0.0000
1800 G A -0.1225
1801 G A -0.1734
1802 A A 0.0699
1803 L A 0.0000
1804 E A -0.5973
1805 P A -0.2064
1806 M A 0.0351
1807 P A -0.2363
1808 T A -0.0661
1809 E A 0.0000
1810 E A -0.5672
1811 D A -0.9100
1812 E A -1.8656
1813 A A -0.6739
1814 D A -1.8531
1815 D A -0.5271
1816 T A -0.0577
1817 S A -0.0302
1818 A A 0.0000
1819 S A -0.0587
1820 I A 0.0391
1821 I A 0.0000
1822 S A -0.2757
1823 D A -1.1587
1824 L A 0.0000
1825 I A 0.2338
1826 C A 0.5002
1827 Q A -0.5760
1828 G A -0.5504
1829 A A 0.0000
1830 Q A -1.1687
1831 L A 0.0000
1832 G A -0.1666
1833 A A 0.0076
1834 R A 0.0000
1835 T A -0.1995
1836 D A -1.3053
1837 R A -2.0384
1838 T A -0.4157
1839 G A -0.1233
1840 E A -0.2899
1841 T A 0.0000
1842 A A 0.0000
1843 L A 0.2323
1844 H A 0.0000
1845 L A 0.0000
1846 A A 0.0000
1847 A A 0.0000
1848 R A -1.7811
1849 Y A -0.0097
1850 A A 0.0836
1851 R A 0.0000
1852 A A 0.0088
1853 D A 0.0000
1854 A A 0.0000
1855 A A 0.0000
1856 K A -0.3461
1857 R A -0.4917
1858 L A 0.0000
1859 L A 0.2867
1860 D A -1.6710
1861 A A -0.4065
1862 G A -0.4613
1863 A A -0.1359
1864 D A -0.2431
1865 T A 0.0000
1866 N A -1.0395
1867 A A -0.5668
1868 Q A -1.5251
1869 D A -2.1622
1870 H A -0.5275
1871 S A 0.0000
1872 G A -0.1512
1873 R A -0.4008
1874 T A 0.0000
1875 P A 0.0000
1876 L A 0.0000
1877 H A -0.1411
1878 T A 0.0000
1879 A A 0.0000
1880 V A 0.0000
1881 T A -0.0159
1882 A A -0.2787
1883 D A -1.6054
1884 A A -0.5333
1885 Q A -1.2201
1886 G A -0.4488
1887 V A 0.0000
1888 F A 0.0000
1889 Q A -0.8484
1890 I A -0.1621
1891 L A 0.0000
1892 I A -0.0693
1893 R A -1.8854
1894 N A -1.2211
1895 R A -1.5137
1896 S A -0.4757
1897 T A 0.0000
1898 D A -0.3521
1899 L A 0.0000
1900 D A -1.0084
1901 A A -0.4845
1902 R A -1.8329
1903 M A 0.0000
1904 A A -0.1186
1905 D A -0.8700
1906 G A 0.0000
1907 S A -0.0597
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 -1.5597
1916 L A 1.0892
1917 A A 0.3003
1918 V A 0.0000
1919 E A -1.8867
1920 G A -0.6972
1921 M A 0.0000
1922 V A 0.0000
1923 E A -1.8780
1924 E A -0.6515
1925 L A 0.0000
1926 I A 0.0000
1927 A A 0.0194
1928 S A -0.2182
1929 H A -0.6146
1930 A A -0.4500
1931 D A -1.7452
1932 V A -0.3363
1933 N A -1.2305
1934 A A 0.0000
1935 V A 0.0000
1936 D A -1.0859
1937 E A -1.8041
1938 L A 0.4600
1939 G A -0.0463
1940 K A -0.3097
1941 S A 0.0000
1942 A A 0.0000
1943 L A 0.0000
1944 H A 0.0000
1945 W A 0.3347
1946 A A 0.0000
1947 A A 0.0000
1948 A A 0.0000
1949 V A 1.5756
1950 N A -0.3902
1951 N A -0.2075
1952 V A 0.0123
1953 E A -1.6605
1954 A A 0.0000
1955 T A 0.0000
1956 L A 0.6651
1957 A A 0.0000
1958 L A 0.0000
1959 L A -0.0899
1960 K A -1.8592
1961 N A -1.3537
1962 G A -0.3834
1963 A A 0.0000
1964 N A -0.1533
1965 K A 0.0000
1966 D A -0.5665
1967 M A -0.0471
1968 Q A -0.3494
1969 D A -0.4715
1970 S A -0.5988
1971 K A -1.7394
1972 E A 0.0000
1973 E A -0.4101
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 -0.7187
1982 E A -0.7235
1983 G A -0.5656
1984 S A 0.0000
1985 Y A 0.5531
1986 E A -0.7932
1987 A A 0.0000
1988 A A 0.0000
1989 K A -0.6513
1990 L A -0.1252
1991 L A 0.0000
1992 L A -0.1307
1993 D A -1.4636
1994 H A 0.0000
1995 F A 0.0000
1996 A A 0.0000
1997 N A -0.1568
1998 R A 0.0000
1999 E A -0.4276
2000 I A 0.0000
2001 T A 0.0000
2002 D A -0.5867
2003 H A 0.0054
2004 L A 0.7392
2005 D A -1.8230
2006 R A -1.6125
2007 L A 0.0000
2008 P A 0.0000
2009 R A 0.0000
2010 D A -1.2850
2011 V A -0.2140
2012 A A 0.0000
2013 Q A 0.0000
2014 E A -2.0784
2015 R A -1.6388
2016 L A 0.6228
2017 H A -0.0471
2018 Q A 0.0000
2019 D A -0.6897
2020 I A 0.0000
2021 V A 0.0000
2022 R A -0.8210
2023 L A 0.0463
2024 L A 0.0000
2025 D A -1.2828
2026 Q A -1.3829
2027 P A 0.0000
2028 S A -0.2695
2029 G A -0.2971
2030 P A -0.5020
2031 R A -1.1799
2032 S A -0.2917
2033 P A -0.0522
2034 P A -0.0780
2035 G A -0.2440
2036 P A -0.4782
2037 H A -1.0669
2038 G A -0.1533
2039 L A 0.9876
2040 G A -0.0007
2041 P A -0.1074
2042 L A 0.0000
2043 L A 0.0400
2044 C A 0.0000
2045 P A -0.0686
2046 P A -0.3440
2047 G A -0.4905
2048 A A -0.0476
2049 F A 0.0000
2050 L A 1.4992
2051 P A -0.0041
2052 G A -0.1533
2053 L A 0.2629
2054 K A -1.5780
2055 A A -0.4041
2056 A A -0.1731
2057 Q A -1.2797
2058 S A -0.5278
2059 G A -0.6597
2060 S A -0.6176
2061 K A -1.9086
2062 K A -1.2109
2063 S A 0.0000
2064 R A 0.0000
2065 R A -1.2289
2066 P A -0.3449
2067 P A -0.3539
2068 G A -0.8421
2069 K A -1.7802
2070 A A -0.3338
2071 G A 0.2195
2072 L A 1.4792
2073 G A -0.0582
2074 P A -0.3757
2075 Q A -0.2737
2076 G A -0.2228
2077 P A -0.6193
2078 R A -1.9785
2079 G A -1.1855
2080 R A -1.9567
2081 G A -0.8017
2082 K A -2.0255
2083 K A -1.7370
2084 L A 1.1835
2085 T A 0.3819
2086 L A 0.9266
2087 A A 0.1990
2088 C A 0.0000
2089 P A -0.0723
2090 G A 0.0000
2091 P A 0.0418
2092 L A 1.5072
2093 A A 0.0051
2094 D A -1.8235
2095 S A -0.5519
2096 S A 0.0855
2097 V A 1.7667
2098 T A 0.6354
2099 L A 1.5461
2100 S A 0.0000
2101 P A 0.1007
2102 V A 0.5994
2103 D A -0.4347
2104 S A -0.0946
2105 L A 0.4179
2106 D A -1.6494
2107 S A -0.4117
2108 P A -0.1865
2109 R A 0.0000
2110 P A 0.1533
2111 F A 1.8809
2112 G A 0.1970
2113 G A -0.3313
2114 P A -0.2446
2115 P A -0.2684
2116 A A -0.0552
2117 S A -0.0692
2118 P A -0.3473
2119 G A -0.6031
2120 G A -0.5153
2121 F A 0.1008
2122 P A 0.2104
2123 L A 1.1919
2124 E A -1.5769
2125 G A -0.6147
2126 P A -0.0599
2127 Y A 1.2743
2128 A A 0.2823
2129 A A 0.0669
2130 A A 0.0145
2131 T A -0.0636
2132 A A 0.0088
2133 T A 0.0000
2134 A A 0.0000
2135 V A 0.6731
2136 S A 0.0000
2137 L A 1.6148
2138 A A 0.1304
2139 Q A -1.2064
2140 L A -0.1424
2141 G A -0.5218
2142 G A -0.6924
2143 P A -0.2105
2144 G A -0.4837
2145 R A 0.0000
2146 A A 0.0000
2147 G A 0.0000
2148 L A 0.4468
2149 G A -0.4366
2150 R A -0.6803
2151 Q A -1.2985
2152 P A -0.4290
2153 P A -0.3722
2154 G A -0.6027
2155 G A -0.5383
2156 C A 0.2774
2157 V A 1.8277
2158 L A 0.5002
2159 S A 0.0279
2160 L A 0.8830
2161 G A -0.1969
2162 L A 0.4596
2163 L A 0.6217
2164 N A -1.1744
2165 P A -0.4905
2166 V A 0.0000
2167 A A 0.0000
2168 V A 0.0000
2169 P A -0.1197
2170 L A 0.0176
2171 D A -0.6871
2172 W A 0.0000
2173 A A 0.0000
2174 R A 0.0000
2175 L A 0.9539
2176 P A 0.2163
2177 P A 0.0000
2178 P A -0.1057
2179 A A 0.0000
2180 P A -0.2047
2181 P A -0.1742
2182 G A -0.5221
2183 P A -0.3837
2184 S A -0.0363
2185 F A 1.1084
2186 L A 0.0000
2187 L A 0.1670
2188 P A 0.1689
2189 L A 0.9372
2190 A A 0.0000
2191 P A -0.2486
2192 G A -0.5117
2193 P A -0.3929
2194 Q A -1.2130
2195 L A 0.0000
2196 L A 1.5138
2197 N A 0.0000
2198 P A -0.3438
2199 G A -0.5230
2200 T A -0.1837
2201 P A -0.0037
2202 V A 0.2078
2203 S A -0.1182
2204 P A -0.4681
2205 Q A -1.4432
2206 E A -2.3713
2207 R A -2.2502
2208 P A -0.7337
2209 P A -0.2557
2210 P A -0.0467
2211 Y A 1.5600
2212 L A 1.8053
2213 A A 0.6879
2214 V A 1.7344
2215 P A -0.0066
2216 G A -0.7054
2217 H A -1.1682
2218 G A -0.7245
2219 E A -0.8050
2220 E A -1.6460
2221 Y A 0.9105
2222 P A 0.1191
2223 A A -0.0099
2224 A A 0.0222
2225 G A -0.1025
2226 A A -0.1024
2227 H A -0.7160
2228 S A -0.2105
2229 S A -0.1130
2230 P A -0.1603
2231 P A -0.4826
2232 K A -1.2394
2233 A A -0.5300
2234 R A -1.7703
2235 F A 0.0820
2236 L A 0.5241
2237 R A 0.0000
2238 V A 1.7676
2239 P A 0.3036
2240 S A 0.0000
2241 E A -1.8182
2242 H A -0.5827
2243 P A -0.0452
2244 Y A 1.2677
2245 L A 0.0000
2246 T A 0.0000
2247 P A -0.1672
2248 S A 0.0000
2249 P A -0.1949
2250 E A -0.2759
2251 S A -0.2998
2252 P A -0.4726
2253 E A -1.1800
2254 H A -1.0779
2255 W A 0.3270
2256 A A 0.1409
2257 S A -0.1167
2258 P A -0.2913
2259 S A -0.1764
2260 P A -0.1756
2261 P A -0.2945
2262 S A 0.0614
2263 L A 0.9960
2264 S A -0.1942
2265 D A -0.7604
2266 W A 0.9694
2267 S A -0.3406
2268 E A -1.9026
2269 S A -0.5706
2270 T A -0.2884
2271 P A -0.2637
2272 S A -0.1356
2273 P A -0.3029
2274 A A -0.0448
2275 T A -0.3053
2276 A A 0.0428
2277 T A -0.0905
2278 G A -0.4574
2279 A A -0.0308
2280 M A 0.0000
2281 A A -0.0463
2282 T A 0.0000
2283 T A -0.0728
2284 T A -0.1431
2285 G A -0.5844
2286 A A 0.1897
2287 L A 1.1922
2288 P A -0.0309
2289 A A -0.0389
2290 Q A -1.2366
2291 P A -0.3842
2292 L A 0.4734
2293 P A 0.1732
2294 L A 1.4731
2295 S A 0.1661
2296 V A 0.2456
2297 P A -0.1999
2298 S A -0.0885
2299 S A 0.0396
2300 L A 0.4681
2301 A A 0.0095
2302 Q A -0.6159
2303 A A -0.2936
2304 Q A -1.1952
2305 T A -0.3536
2306 Q A -0.1162
2307 L A 1.4177
2308 G A 0.0328
2309 P A 0.0000
2310 Q A 0.0090
2311 P A -0.3077
2312 E A 0.0411
2313 V A 1.7107
2314 T A -0.0134
2315 P A -0.5877
2316 K A -2.1016
2317 R A -2.3917
2318 Q A -1.3250
2319 V A 1.2406
2320 L A 1.5219
2321 A A 0.2991
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, -0.2153 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_5 -0.2153 View CSV PDB
model_7 -0.2205 View CSV PDB
model_4 -0.2226 View CSV PDB
model_10 -0.2238 View CSV PDB
model_9 -0.2247 View CSV PDB
model_2 -0.2247 View CSV PDB
CABS_average -0.2288 View CSV PDB
model_6 -0.2315 View CSV PDB
model_8 -0.2338 View CSV PDB
model_0 -0.2355 View CSV PDB
model_3 -0.2364 View CSV PDB
model_1 -0.2369 View CSV PDB
model_11 -0.24 View CSV PDB
input -0.2813 View CSV PDB