Project name: aaaaa

Chain sequence(s)	A: MGARSAAAAAAGGWEGVRPVPPPRRPGPRGGREGTVPYKPWFSGLGRSRRLRFARGGGGALVASGDEGTCSHNFFRPLLPLCPSTLPLPHHPALTLLEVLEGDSARRLRREPNLSGKLPHRLKMLGGPGPGLLLLLAVLSLGTAVPSAGASKSRRQAQQIVQPQSPLTVSQSKPGCYDNGKHYQINQQWERTYLGSALVCTCYGGSRGFNCESKPEPEETCFDKYTGNTYRVGDTYERPKDSMIWDCTCIGAGRGRISCTIANRCHEGGQSYKIGDTWRRPHETGGYMLECVCLGNGKGEWTCKPIAEKCFDQAAGTSYVVGETWEKPYQGWMMVDCTCLGEGSGRITCTSRNRCNDQDTRTSYRIGDTWSKKDNRGNLLQCICTGNGRGEWKCERHTSLQTTSAGSGSFTDVRTAIYQPQPHPQPPPYGHCVTDSGVVYSVGMQWLKTQGNKQMLCTCLGNGVSCQETAVTQTYGGNSNGEPCVLPFTYNGKTFYSCTTEGRQDGHLWCSTTSNYEQDQKYSFCTDHTVLVQTRGGNSNGALCHFPFLYNNHNYTDCTSEGRRDNMKWCGTTQNYDADQKFGFCPMAAHEEICTTNEGVMYRIGDQWDKQHDMGHMMRCTCVGNGRGEWTCVAYSQLRDQCIVDGITYNVNDTFHKRHEEGHMLNCTCFGQGRGRWKCDPVDQCQDSETRTFYQIGDSWEKYLQGVRYQCYCYGRGIGEWACQPLQTYPDTSGPVQVIITETPSQPNSHPIQWSAPESSHISKYILRWKPKNSPNRWKEATIPGHLNSYTIKGLRPGVVYEGQLISVQHYGQREVTRFDFTTTSTSPAVTSNTVTGETTPLSPVVATSESVTEITASSFVVSWVSASDTVSGFRVEYELSEEGDEPQYLDLPSTATSVNIPDLLPGRKYTVNVYEISEEGEQNLILSTSQTTAPDAPPDPTVDQVDDTSIVVRWSRPRAPITGYRIVYSPSVEGSSTELNLPETANSVTLSDLQPGVQYNITIYAVEENQESTPVFIQQETTGVPRSDKVPPPRDLQFVEVTDVKITIMWTPPESPVTGYRVDVIPVNLPGEHGQRLPVSRNTFAEVTGLSPGVTYHFKVFAVNQGRESKPLTAQQATKLDAPTNLQFINETDTTVIVTWTPPRARIVGYRLTVGLTRGGQPKQYNVGPAASQYPLRNLQPGSEYAVSLVAVKGNQQSPRVTGVFTTLQPLGSIPHYNTEVTETTIVITWTPAPRIGFKLGVRPSQGGEAPREVTSESGSIVVSGLTPGVEYVYTISVLRDGQERDAPIVKKVVTPLSPPTNLHLEANPDTGVLTVSWERSTTPDITGYRITTTPTNGQQGYSLEEVVHADQSSCTFENLSPGLEYNVSVYTVKDDKESVPISDTIIPAVPPPTDLRFTNVGPDTMRVTWAPPSSIELTNLLVRYSPVKNEEDVAELSISPSDNAVVLTNLLPGTEYLVSVSSVYEQHESIPLRGRQKTALDSPSGIDFSDITANSFTVHWIAPRATITGYRIRHHPENMGGRPREDRVPPSRNSITLTNLNPGTEYVVSIVALNSKEESLPLVGQQSTVSDVPRDLEVIAATPTSLLISWDAPAVTVRYYRITYGETGGSSPVQEFTVPGSKSTATISGLKPGVDYTITVYAVTGRGDSPASSKPVSINYRTEIDKPSQMQVTDVQDNSISVRWLPSSSPVTGYRVTTAPKNGPGPSKTKTVGPDQTEMTIEGLQPTVEYVVSVYAQNQNGESQPLVQTAVTTIPAPTNLKFTQVTPTSLTAQWTAPNVQLTGYRVRVTPKEKTGPMKEINLAPDSSSVVVSGLMVATKYEVSVYALKDTLTSRPAQGVVTTLENVSPPRRARVTDATETTITISWRTKTETITGFQVDAIPANGQTPIQRTIRPDVRSYTITGLQPGTDYKIHLYTLNDNARSSPVVIDASTAIDAPSNLRFLATTPNSLLVSWQPPRARITGYIIKYEKPGSPPREVVPRPRPGVTEATITGLEPGTEYTIQVIALKNNQKSEPLIGRKKTDELPQLVTLPHPNLHGPEILDVPSTVQKTPFITNPGYDTGNGIQLPGTSGQQPSLGQQMIFEEHGFRRTTPPTTATPVRHRPRPYPPNVNEEIQIGHVPRGDVDHHLYPHVVGLNPNASTGQEALSQTTISWTPFQESSEYIISCHPVGIDEEPLQFRVPGTSASATLTGLTRGATYNIIVEAVKDQQRQKVREEVVTVGNSVDQGLSQPTDDSCFDPYTVSHYAIGEEWERLSDSGFKLSCQCLGFGSGHFRCDSSKWCHDNGVNYKIGEKWDRQGENGQMMSCTCLGNGKGEFKCDPHEATCYDDGKTYHVGEQWQKEYLGAICSCTCFGGQRGWRCDNCRRPGAEPGNEGSTAHSYNQYSQRYHQRTNTNVNCPIECFMPLDVQADREDSRE; C: MNLQLIFWIGLISSVCCVFGQADENRCLKANAKSCGECIQAGPNCGWCTNSTFLQEGMPTSARCDDLEALKKKGCHPNDIENPRGSKDIKKNKNVTNRSKGTAEKLQPEDITQIQPQQLVLQLRSGEPQTFTLKFKRAEDYPIDLYYLMDLSYSMKDDLENVKSLGTDLMNEMRRITSDFRIGFGSFVEKTVMPYISTTPAKLRNPCTNEQNCTSPFSYKNVLSLTDKGEVFNELVGKQRISGNLDSPEGGFDAIMQVAVCGSLIGWRNVTRLLVFSTDAGFHFAGDGKLGGIVLPNDGQCHLENDVYTMSHYYDYPSIAHLVQKLSENNIQTIFAVTEEFQPVYKELKNLIPKSAVGTLSANSSNVIQLIIDAYNSLSSEVILENSKLPEGVTINYKSYCKNGVNGTGENGRKCSNISIGDEVQFEISITANKCPNKNSETIKIKPLGFTEEVEIILQFICECECQGEGIPGSPKCHDGNGTFECGACRCNEGRVGRHCECSTDEVNSEDMDAYCRKENSSEICSNNGECVCGQCVCRKRDNTNEIYSGKFCECDNFNCDRSNGLICGGNGVCKCRVCECNPNYTGSACDCSLDTTSCMAVNGQICNGRGVCECGACKCTDPKFQGPTCEMCQTCLGVCAEHKECVQCRAFNKGEKKDTCAQECSHFNITKVENRDKLPQPGQVDPLSHCKEKDVDDCWFYFTYSVNGNNEATVHVVETPECPTGPDIIPIVAGVVAGIVLIGLALLLIWKLLMIIHDRREFAKFEKEKMNAKWDTGENPIYKSPINNFKNPNYGRKAGL; B: REFGKLLPALSHSPLGGLGSGSGSVAPGQGRAGAMGSRTPGSPLHAVQLRRGARRRPRLLPLLPPLLLLLLPPPPRVGGFNLDAEAPAVLSGPPGSFFGFSVEFYRPGTDGVSVLVGAPKANTSQPGVLQGGAVYLCPWGTSPAQCTPIEFDSKGSRIFESSTSSSEGEEPVEYKSLQWFGATVRAHGSSILACAPLYSWRTEKEPQSDPVGTCYLSTGNFTQILEYAPCRSDFSQEAGQGYCQGGFSAEFTKTGRVVLGGPGSYFWQGQILSATQEQIAESYYPGYLINPVRGQLQTRQASSIYDDSYLGYSVAVGEFSGDDREDFVAGVPKGNLTYGYVTILNGSDIRSLYNFSGEQMASYFGYAVAATDINGDGLDDLLVGAPLLMERTADGRPQEVGRVYIYLQRLAGMEPTPTLTLTGQDEFGRFGSSLTPLGDLDQDGYNDVAIGAAFGGENRQGVVFIFPGGPGGLASKPSQVLLPLWAAGHTPDFFGSALRGGRDLDGNGYPDLIVGSFGVDKAVVYRGRPIVSASASLTIFPAMFNPEEHSCSLEGNPVTCINLSFCLNASGKHVPDSIGFTVELQLDWQKQKGGVRRALFLASRQATLTQTLLIQNGAREDCREMKIYLRNESEFRDKLSPIHIALNFSLDPQAPVDSHGLRPVLHYQSKSRIEDKAQILLDCGEDNICVPDLQLEVFGEQNHVYLGDKNSLNLTFHAQNVGEGGAYEAELRVTAPPEAEYSGLVRHPGNFSSLSCDYFAVNQSRLLVCDLGNPMKAGASLWGGLRFTVPHLRDTKKTIQFDFQILSKNLNNSQSDVVSFRLSVEAQAQVSLNGVSKPEAVLFPMSDWHPQDQPQEEGDVGPAVHHVYELINLGPSSISQGVLELSCPHALDGQQLLYVTRVTGLSNCTTSHPPNPEGLELDPEGSQHHRLQRRDVPGRSPASSGPQILKCPEAECFKLRCELGPLHRQESRSLQLHFRVWAKTFLQREHQPFSLQCEAVYEALKMPYKILPRQLPQKALQVATAVQWIKAEGSHGVPLWIIILAILIGLLLLGLLIYILYKLGFFKRSLPYGTAMEKAQLKPPATSDA
Selected Chain(s)	A,B,C
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:01)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:01)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:01)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:01)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:17)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (01:45:54)
[INFO]       Main:     Simulation completed successfully.                                          (01:50:43)

• Minimal score value: -4.453
• Maximal score value: 4.9036
• Average score: -0.7339
• Total score value: -3163.287

The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.

residue index	residue name	chain	Aggrescan3D score	mutation
1	M	A	0.8095
2	G	A	-0.2374
3	A	A	-0.8786
4	R	A	-2.0205
5	S	A	-1.1929
6	A	A	-0.4034
7	A	A	0.0871
8	A	A	0.1420
9	A	A	0.1424
10	A	A	0.0342
11	A	A	-0.2385
12	G	A	-0.4271
13	G	A	-0.4613
14	W	A	-0.1414
15	E	A	-1.2021
16	G	A	-0.6581
17	V	A	0.2331
18	R	A	-0.8392
19	P	A	-0.0821
20	V	A	1.0545
21	P	A	0.4526
22	P	A	-0.5276
23	P	A	-1.6810
24	R	A	-2.9705
25	R	A	-3.0300
26	P	A	-1.9637
27	G	A	-1.5242
28	P	A	-1.5348
29	R	A	-2.4043
30	G	A	-2.0873
31	G	A	-2.3527
32	R	A	-3.1766
33	E	A	-3.0934
34	G	A	-1.4556
35	T	A	0.1939
36	V	A	1.7781
37	P	A	1.0253
38	Y	A	0.6648
39	K	A	-0.9718
40	P	A	0.0404
41	W	A	1.6042
42	F	A	2.2784
43	S	A	1.0958
44	G	A	0.5146
45	L	A	0.6407
46	G	A	-0.7075
47	R	A	-2.2345
48	S	A	-2.5386
49	R	A	-2.9542
50	R	A	-2.4681
51	L	A	-0.3484
52	R	A	-0.4266
53	F	A	0.9676
54	A	A	-0.2792
55	R	A	-1.8376
56	G	A	-1.6825
57	G	A	-1.5296
58	G	A	-1.2602
59	G	A	-0.4687
60	A	A	0.9944
61	L	A	2.4126
62	V	A	2.5269
63	A	A	1.1497
64	S	A	-0.4285
65	G	A	-1.6629
66	D	A	-3.1823
67	E	A	-3.1785
68	G	A	-1.7934
69	T	A	-0.3528
70	C	A	0.2928
71	S	A	-0.6007
72	H	A	-1.2170
73	N	A	-0.4807
74	F	A	1.6805
75	F	A	1.6816
76	R	A	-0.3069
77	P	A	0.2214
78	L	A	1.7191
79	L	A	2.4394
80	P	A	1.8588
81	L	A	2.0591
82	C	A	1.2413
83	P	A	0.3859
84	S	A	0.0902
85	T	A	0.4800
86	L	A	1.6799
87	P	A	1.2876
88	L	A	1.3139
89	P	A	-0.1465
90	H	A	-1.2997
91	H	A	-1.4895
92	P	A	-0.7007
93	A	A	0.4699
94	L	A	1.8174
95	T	A	1.8589
96	L	A	2.1958
97	L	A	1.6992
98	E	A	0.5927
99	V	A	1.4708
100	L	A	0.9055
101	E	A	-1.2173
102	G	A	-2.0984
103	D	A	-2.5458
104	S	A	-1.5306
105	A	A	-1.7136
106	R	A	-2.4863
107	R	A	-2.3648
108	L	A	-1.0625
109	R	A	-2.7294
110	R	A	-3.4536
111	E	A	-3.5941
112	P	A	-2.0565
113	N	A	-0.9952
114	L	A	0.5793
115	S	A	-0.3339
116	G	A	-0.8216
117	K	A	-1.5986
118	L	A	-1.1730
119	P	A	0.0000
120	H	A	0.0000
121	R	A	-1.4944
122	L	A	-0.5891
123	K	A	-0.9371
124	M	A	1.1452
125	L	A	1.4605
126	G	A	0.2274
127	G	A	-0.6423
128	P	A	-0.8908
129	G	A	-0.9327
130	P	A	-0.4758
131	G	A	0.5038
132	L	A	2.2883
133	L	A	3.2963
134	L	A	3.7132
135	L	A	3.4301
136	L	A	3.1106
137	A	A	2.3768
138	V	A	2.8478
139	L	A	2.5928
140	S	A	1.6924
141	L	A	1.4970
142	G	A	0.4897
143	T	A	0.4512
144	A	A	0.7044
145	V	A	1.5977
146	P	A	0.6501
147	S	A	-0.0339
148	A	A	-0.3589
149	G	A	-0.4995
150	A	A	-0.6252
151	S	A	-1.1457
152	K	A	-2.2916
153	S	A	-2.4511
154	R	A	-3.4790
155	R	A	-3.4044
156	Q	A	-2.6867
157	A	A	-1.8323
158	Q	A	-1.6611
159	Q	A	-0.5180
160	I	A	1.8197
161	V	A	1.9234
162	Q	A	-0.3241
163	P	A	-1.1572
164	Q	A	-1.7398
165	S	A	-0.6425
166	P	A	0.0919
167	L	A	1.7197
168	T	A	1.5220
169	V	A	1.6895
170	S	A	-0.1127
171	Q	A	-1.4868
172	S	A	-1.5526
173	K	A	-2.4607
174	P	A	-1.4584
175	G	A	-0.8996
176	C	A	0.0000
177	Y	A	0.1390
178	D	A	0.0000
179	N	A	-1.8462
180	G	A	-1.6484
181	K	A	-2.0985
182	H	A	-1.4697
183	Y	A	0.0000
184	Q	A	-1.4831
185	I	A	-0.6358
186	N	A	-1.5991
187	Q	A	-1.8976
188	Q	A	-2.1092
189	W	A	-1.6311
190	E	A	-2.3862
191	R	A	-1.7225
192	T	A	0.0937
193	Y	A	1.5121
194	L	A	1.9177
195	G	A	0.5536
196	S	A	0.2080
197	A	A	-0.7493
198	L	A	-1.1571
199	V	A	-1.7505
200	C	A	0.0000
201	T	A	-1.2512
202	C	A	0.0000
203	Y	A	-0.7685
204	G	A	-0.9087
205	G	A	-1.0379
206	S	A	-1.2596
207	R	A	-2.0021
208	G	A	-0.6883
209	F	A	-0.1640
210	N	A	-0.7568
211	C	A	-1.1301
212	E	A	-2.3682
213	S	A	-1.9559
214	K	A	-2.5832
215	P	A	-2.3555
216	E	A	-3.0025
217	P	A	-2.4920
218	E	A	-3.0692
219	E	A	-2.5679
220	T	A	-1.4405
221	C	A	0.0000
222	F	A	0.7458
223	D	A	0.0000
224	K	A	-0.9207
225	Y	A	0.3190
226	T	A	-0.4617
227	G	A	-0.7137
228	N	A	-0.6926
229	T	A	-0.2651
230	Y	A	-0.4095
231	R	A	-1.6461
232	V	A	-1.0163
233	G	A	-0.8045
234	D	A	-1.3289
235	T	A	-0.9783
236	Y	A	-1.0633
237	E	A	-1.7769
238	R	A	0.0000
239	P	A	-0.8000
240	K	A	-1.2058
241	D	A	-2.0311
242	S	A	-1.4289
243	M	A	-0.7342
244	I	A	-0.6232
245	W	A	-0.4326
246	D	A	-0.8938
247	C	A	0.0000
248	T	A	-0.6025
249	C	A	0.0000
250	I	A	0.0431
251	G	A	0.0000
252	A	A	-0.9316
253	G	A	-1.7001
254	R	A	-2.3870
255	G	A	-1.4314
256	R	A	-1.5935
257	I	A	-0.1141
258	S	A	-0.0237
259	C	A	0.1340
260	T	A	-0.2354
261	I	A	-0.0794
262	A	A	-1.3021
263	N	A	-1.4686
264	R	A	0.0000
265	C	A	0.0000
266	H	A	-0.9976
267	E	A	-1.1242
268	G	A	-1.3161
269	G	A	-1.5572
270	Q	A	-1.6060
271	S	A	-1.0114
272	Y	A	-0.7056
273	K	A	-1.0026
274	I	A	0.3298
275	G	A	-0.0833
276	D	A	-0.4725
277	T	A	-0.5898
278	W	A	0.0000
279	R	A	-2.3099
280	R	A	-1.7053
281	P	A	-1.2998
282	H	A	-1.4900
283	E	A	-2.0792
284	T	A	-1.1222
285	G	A	-0.7038
286	G	A	-0.5265
287	Y	A	0.2974
288	M	A	-0.7234
289	L	A	-1.2063
290	E	A	-1.5953
291	C	A	0.0000
292	V	A	-0.1902
293	C	A	0.0000
294	L	A	-0.2518
295	G	A	0.0000
296	N	A	-2.0630
297	G	A	-2.0841
298	K	A	-2.6398
299	G	A	-1.7866
300	E	A	-1.7037
301	W	A	-0.1357
302	T	A	-0.1744
303	C	A	-0.8554
304	K	A	-1.8737
305	P	A	-1.2677
306	I	A	-1.1231
307	A	A	-1.5666
308	E	A	-2.1966
309	K	A	-1.8453
310	C	A	0.0000
311	F	A	0.6835
312	D	A	0.0000
313	Q	A	-0.6747
314	A	A	-0.7128
315	A	A	-0.5115
316	G	A	-0.4876
317	T	A	-0.1390
318	S	A	-0.1595
319	Y	A	0.0418
320	V	A	0.1480
321	V	A	-0.0210
322	G	A	-0.0435
323	E	A	-0.5524
324	T	A	-0.6455
325	W	A	0.0000
326	E	A	-2.0581
327	K	A	-1.3871
328	P	A	-0.9903
329	Y	A	-0.9891
330	Q	A	-1.3101
331	G	A	-1.1286
332	W	A	-0.9147
333	M	A	-0.9301
334	M	A	-0.9223
335	V	A	0.0000
336	D	A	-1.4137
337	C	A	0.0000
338	T	A	-0.3234
339	C	A	0.0000
340	L	A	-0.3622
341	G	A	0.0000
342	E	A	-2.3942
343	G	A	-2.3729
344	S	A	-1.7013
345	G	A	-1.5565
346	R	A	-1.9099
347	I	A	-0.2663
348	T	A	-0.0961
349	C	A	-0.3949
350	T	A	-1.4767
351	S	A	0.0000
352	R	A	-3.3317
353	N	A	-2.6646
354	R	A	-2.2004
355	C	A	0.0000
356	N	A	0.0000
357	D	A	0.0000
358	Q	A	-2.7290
359	D	A	-3.2378
360	T	A	-2.3893
361	R	A	-2.8323
362	T	A	-1.3232
363	S	A	-0.9093
364	Y	A	-0.5985
365	R	A	-1.4464
366	I	A	-0.2685
367	G	A	-0.1821
368	D	A	-0.5118
369	T	A	-0.3657
370	W	A	0.0000
371	S	A	-0.7992
372	K	A	-1.4315
373	K	A	-2.8785
374	D	A	-2.7690
375	N	A	-2.7659
376	R	A	-3.0352
377	G	A	-2.2331
378	N	A	-2.1948
379	L	A	-1.2363
380	L	A	-1.9096
381	Q	A	-1.7095
382	C	A	0.0000
383	I	A	-0.4822
384	C	A	0.0000
385	T	A	-1.2863
386	G	A	0.0000
387	N	A	-2.5741
388	G	A	-2.6788
389	R	A	-4.0204
390	G	A	-3.1096
391	E	A	-2.7130
392	W	A	-1.1909
393	K	A	-1.9387
394	C	A	-1.6709
395	E	A	-3.0258
396	R	A	-3.2884
397	H	A	-2.0911
398	T	A	-0.8059
399	S	A	-0.2497
400	L	A	0.7214
401	Q	A	-0.5500
402	T	A	-0.3939
403	T	A	-0.4620
404	S	A	-0.3242
405	A	A	-0.3336
406	G	A	-0.6797
407	S	A	-0.6999
408	G	A	-0.3497
409	S	A	0.2719
410	F	A	1.5235
411	T	A	0.1527
412	D	A	-1.1147
413	V	A	0.2107
414	R	A	-1.2537
415	T	A	0.0358
416	A	A	0.9326
417	I	A	2.0617
418	Y	A	1.5031
419	Q	A	-0.4682
420	P	A	-1.0346
421	Q	A	-1.8398
422	P	A	-1.7180
423	H	A	-1.8394
424	P	A	-1.6490
425	Q	A	-1.8123
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1200	P	A	-1.5395
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1400	T	A	-0.9410
1401	N	A	-1.0720
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1404	P	A	-0.6106
1405	D	A	-1.0369
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1412	A	A	-1.1961
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1499	T	A	-0.6364
1500	V	A	0.0000
1501	H	A	-0.8848
1502	W	A	0.0000
1503	I	A	1.0104
1504	A	A	-0.0402
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1506	R	A	-1.4342
1507	A	A	0.0000
1508	T	A	-0.4826
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1524	R	A	-2.5497
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1535	N	A	-1.4512
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1538	T	A	-0.1669
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1547	E	A	-2.0649
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1559	E	A	-3.1432
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1593	D	A	-2.9541
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1598	T	A	-0.1856
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1600	R	A	-1.6738
1601	Y	A	-0.9022
1602	Y	A	0.0000
1603	R	A	-0.7720
1604	I	A	0.0000
1605	T	A	-0.6737
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1607	G	A	-0.6986
1608	E	A	-1.4765
1609	T	A	-1.0584
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1611	G	A	-0.9374
1612	S	A	-0.5296
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1615	V	A	0.4333
1616	Q	A	-1.2276
1617	E	A	-1.8556
1618	F	A	-0.7413
1619	T	A	-0.3597
1620	V	A	0.0000
1621	P	A	-1.0983
1622	G	A	-1.2726
1623	S	A	-1.3146
1624	K	A	-2.0599
1625	S	A	-1.4346
1626	T	A	-0.7309
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1630	S	A	-0.6323
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1632	L	A	0.0000
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1635	G	A	0.0000
1636	V	A	-1.0639
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1646	T	A	-1.1656
1647	G	A	0.0000
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1652	P	A	-1.6416
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1672	M	A	-1.2553
1673	Q	A	-1.8688
1674	V	A	-0.9280
1675	T	A	-1.1016
1676	D	A	-1.3021
1677	V	A	-0.2909
1678	Q	A	-1.5125
1679	D	A	-1.5031
1680	N	A	-2.2556
1681	S	A	-1.8056
1682	I	A	0.0000
1683	S	A	-1.3226
1684	V	A	0.0000
1685	R	A	-2.1985
1686	W	A	0.0000
1687	L	A	-0.5093
1688	P	A	-0.8147
1689	S	A	-0.6989
1690	S	A	-0.6890
1691	S	A	-0.8513
1692	P	A	-0.5771
1693	V	A	-0.9054
1694	T	A	-0.9095
1695	G	A	0.0000
1696	Y	A	0.0000
1697	R	A	-0.7226
1698	V	A	0.0000
1699	T	A	-0.3649
1700	T	A	0.0000
1701	A	A	-1.0248
1702	P	A	-1.7327
1703	K	A	-2.4615
1704	N	A	-2.5312
1705	G	A	-1.7757
1706	P	A	-1.1837
1707	G	A	-1.3321
1708	P	A	-0.8932
1709	S	A	-0.6643
1710	K	A	-1.3399
1711	T	A	-1.1370
1712	K	A	-1.3847
1713	T	A	-0.7163
1714	V	A	-1.0000
1715	G	A	-0.9732
1716	P	A	-1.3589
1717	D	A	-2.5230
1718	Q	A	-2.4087
1719	T	A	0.0000
1720	E	A	-2.6774
1721	M	A	0.0000
1722	T	A	-1.1930
1723	I	A	0.0000
1724	E	A	-2.7945
1725	G	A	-2.0459
1726	L	A	0.0000
1727	Q	A	-2.0539
1728	P	A	-1.3105
1729	T	A	-0.3871
1730	V	A	-0.7520
1731	E	A	-1.0164
1732	Y	A	0.0000
1733	V	A	-0.2993
1734	V	A	0.0000
1735	S	A	0.0000
1736	V	A	0.0000
1737	Y	A	-0.7214
1738	A	A	0.0000
1739	Q	A	-1.3834
1740	N	A	-1.4715
1741	Q	A	-1.9862
1742	N	A	-1.9665
1743	G	A	-1.5739
1744	E	A	-2.0902
1745	S	A	0.0000
1746	Q	A	-1.6573
1747	P	A	-0.7106
1748	L	A	-0.0723
1749	V	A	0.4705
1750	Q	A	-0.3734
1751	T	A	-0.2415
1752	A	A	0.0000
1753	V	A	0.9599
1754	T	A	0.0000
1755	T	A	-0.3124
1756	I	A	0.0000
1757	P	A	-1.0111
1758	A	A	-0.7932
1759	P	A	0.0000
1760	T	A	-0.9961
1761	N	A	-1.8460
1762	L	A	-1.4056
1763	K	A	-1.8534
1764	F	A	-0.2854
1765	T	A	-0.5454
1766	Q	A	-0.7379
1767	V	A	0.0598
1768	T	A	-0.6977
1769	P	A	-0.5585
1770	T	A	-0.2551
1771	S	A	0.1538
1772	L	A	0.0000
1773	T	A	0.0000
1774	A	A	0.0000
1775	Q	A	-0.8367
1776	W	A	0.0000
1777	T	A	-0.8722
1778	A	A	-0.9401
1779	P	A	-0.7572
1780	N	A	-1.5604
1781	V	A	-1.1749
1782	Q	A	-1.6533
1783	L	A	0.0000
1784	T	A	-1.0206
1785	G	A	0.0000
1786	Y	A	0.0000
1787	R	A	-1.3195
1788	V	A	0.0000
1789	R	A	-1.8597
1790	V	A	0.0000
1791	T	A	-1.2549
1792	P	A	-1.7559
1793	K	A	-2.8760
1794	E	A	-3.4257
1795	K	A	-2.8834
1796	T	A	-1.4807
1797	G	A	-1.0407
1798	P	A	-0.4944
1799	M	A	-0.3598
1800	K	A	-1.3865
1801	E	A	-2.4365
1802	I	A	-1.2537
1803	N	A	-1.5932
1804	L	A	-0.6570
1805	A	A	-0.7455
1806	P	A	-1.2965
1807	D	A	-1.9836
1808	S	A	-1.1036
1809	S	A	-0.6910
1810	S	A	-0.2484
1811	V	A	0.0000
1812	V	A	1.6193
1813	V	A	0.0000
1814	S	A	-0.0418
1815	G	A	-0.4880
1816	L	A	0.0000
1817	M	A	0.2644
1818	V	A	0.1633
1819	A	A	-0.2857
1820	T	A	0.0000
1821	K	A	-1.3072
1822	Y	A	0.0000
1823	E	A	-0.9992
1824	V	A	0.0000
1825	S	A	0.0000
1826	V	A	0.0000
1827	Y	A	-0.8259
1828	A	A	0.0000
1829	L	A	-0.7480
1830	K	A	-1.1700
1831	D	A	-1.7668
1832	T	A	-0.6665
1833	L	A	0.0386
1834	T	A	-0.4308
1835	S	A	0.0000
1836	R	A	-1.9223
1837	P	A	-1.3259
1838	A	A	-1.1320
1839	Q	A	-1.6797
1840	G	A	-0.5789
1841	V	A	0.2377
1842	V	A	0.1764
1843	T	A	-0.0908
1844	T	A	0.0000
1845	L	A	-0.8446
1846	E	A	-2.3651
1847	N	A	-2.0331
1848	V	A	-1.2997
1849	S	A	-0.9736
1850	P	A	-0.8417
1851	P	A	0.0000
1852	R	A	-3.1504
1853	R	A	-3.2687
1854	A	A	-2.1628
1855	R	A	-2.6691
1856	V	A	-1.3578
1857	T	A	-1.2228
1858	D	A	-1.9405
1859	A	A	-1.0866
1860	T	A	-1.1386
1861	E	A	-1.5653
1862	T	A	-1.0914
1863	T	A	-0.9323
1864	I	A	0.0000
1865	T	A	-0.7925
1866	I	A	0.0000
1867	S	A	-1.5463
1868	W	A	0.0000
1869	R	A	-3.0012
1870	T	A	-2.3210
1871	K	A	-2.3523
1872	T	A	-1.2697
1873	E	A	-1.0507
1874	T	A	-0.4701
1875	I	A	-0.9399
1876	T	A	-1.2726
1877	G	A	0.0000
1878	F	A	0.0000
1879	Q	A	-1.2005
1880	V	A	0.0000
1881	D	A	-0.9480
1882	A	A	0.0000
1883	I	A	-1.1295
1884	P	A	0.0000
1885	A	A	-1.7222
1886	N	A	-1.9673
1887	G	A	-1.5708
1888	Q	A	-1.7144
1889	T	A	-0.9229
1890	P	A	-0.8141
1891	I	A	-0.7765
1892	Q	A	-1.7031
1893	R	A	-1.7148
1894	T	A	-1.3336
1895	I	A	0.0000
1896	R	A	-2.3720
1897	P	A	-1.7800
1898	D	A	-2.3070
1899	V	A	-1.3870
1900	R	A	-1.3566
1901	S	A	-0.7197
1902	Y	A	0.1215
1903	T	A	-0.1556
1904	I	A	0.0000
1905	T	A	-0.4700
1906	G	A	-0.8021
1907	L	A	0.0000
1908	Q	A	-1.7457
1909	P	A	0.0000
1910	G	A	-1.6962
1911	T	A	-1.5763
1912	D	A	-2.2238
1913	Y	A	0.0000
1914	K	A	-2.1282
1915	I	A	0.0000
1916	H	A	-0.2422
1917	L	A	0.0000
1918	Y	A	-0.0227
1919	T	A	0.0000
1920	L	A	-1.2622
1921	N	A	-2.0900
1922	D	A	-2.6692
1923	N	A	-2.6219
1924	A	A	-2.1905
1925	R	A	-2.1079
1926	S	A	0.0000
1927	S	A	-0.2118
1928	P	A	0.1861
1929	V	A	0.3782
1930	V	A	0.7827
1931	I	A	0.0000
1932	D	A	-2.4354
1933	A	A	-1.8415
1934	S	A	-1.4729
1935	T	A	0.0000
1936	A	A	-1.4366
1937	I	A	0.0000
1938	D	A	-1.8424
1939	A	A	-1.4077
1940	P	A	0.0000
1941	S	A	-1.2819
1942	N	A	-1.8078
1943	L	A	-1.3603
1944	R	A	-2.0634
1945	F	A	-0.3247
1946	L	A	0.8754
1947	A	A	0.4449
1948	T	A	-0.6229
1949	T	A	-1.4905
1950	P	A	-2.2710
1951	N	A	-2.2344
1952	S	A	-1.3534
1953	L	A	0.0000
1954	L	A	0.2810
1955	V	A	0.0000
1956	S	A	0.0000
1957	W	A	0.0000
1958	Q	A	-2.2014
1959	P	A	-1.5892
1960	P	A	-1.6786
1961	R	A	-2.6597
1962	A	A	0.0000
1963	R	A	-2.3833
1964	I	A	0.0000
1965	T	A	-1.4697
1966	G	A	0.0000
1967	Y	A	0.0000
1968	I	A	0.0000
1969	I	A	0.0000
1970	K	A	-1.1270
1971	Y	A	0.0000
1972	E	A	-2.4259
1973	K	A	-2.2811
1974	P	A	-1.1632
1975	G	A	-0.9618
1976	S	A	-1.1614
1977	P	A	-1.3312
1978	P	A	-2.0636
1979	R	A	-2.4170
1980	E	A	-1.4272
1981	V	A	-0.1385
1982	V	A	0.8147
1983	P	A	-0.1712
1984	R	A	-1.3712
1985	P	A	-1.4542
1986	R	A	-2.1422
1987	P	A	-1.4220
1988	G	A	-0.8786
1989	V	A	-0.7751
1990	T	A	-1.0314
1991	E	A	-1.3742
1992	A	A	-0.4668
1993	T	A	-0.0222
1994	I	A	0.0000
1995	T	A	-0.7404
1996	G	A	-1.2204
1997	L	A	0.0000
1998	E	A	-2.8760
1999	P	A	-2.4317
2000	G	A	-2.4611
2001	T	A	-2.4665
2002	E	A	-3.0396
2003	Y	A	0.0000
2004	T	A	-1.5381
2005	I	A	0.0000
2006	Q	A	-0.2425
2007	V	A	0.0000
2008	I	A	-0.4671
2009	A	A	0.0000
2010	L	A	-1.9039
2011	K	A	-2.1724
2012	N	A	-2.4236
2013	N	A	-2.6015
2014	Q	A	-2.4447
2015	K	A	-2.8620
2016	S	A	0.0000
2017	E	A	-1.9412
2018	P	A	-0.6305
2019	L	A	0.4852
2020	I	A	1.1709
2021	G	A	-0.4877
2022	R	A	-2.5970
2023	K	A	-2.8932
2024	K	A	-3.7244
2025	T	A	0.0000
2026	D	A	-3.3920
2027	E	A	-2.7831
2028	L	A	-0.1749
2029	P	A	-0.2120
2030	Q	A	0.0402
2031	L	A	1.9142
2032	V	A	2.4754
2033	T	A	1.7106
2034	L	A	1.5871
2035	P	A	-0.0327
2036	H	A	-1.2635
2037	P	A	-1.1858
2038	N	A	-1.0153
2039	L	A	0.2656
2040	H	A	-0.7870
2041	G	A	-1.1820
2042	P	A	-1.2057
2043	E	A	-0.6453
2044	I	A	1.3450
2045	L	A	1.5183
2046	D	A	0.2540
2047	V	A	1.0714
2048	P	A	0.2129
2049	S	A	0.3381
2050	T	A	0.4122
2051	V	A	0.7754
2052	Q	A	-1.2271
2053	K	A	-2.0322
2054	T	A	-0.8699
2055	P	A	0.6367
2056	F	A	2.7823
2057	I	A	2.6497
2058	T	A	0.5758
2059	N	A	-1.1759
2060	P	A	-0.9677
2061	G	A	-0.6125
2062	Y	A	0.0471
2063	D	A	-1.3000
2064	T	A	-1.2360
2065	G	A	-1.6014
2066	N	A	-1.3275
2067	G	A	-0.5608
2068	I	A	1.2162
2069	Q	A	0.4103
2070	L	A	1.0720
2071	P	A	0.0616
2072	G	A	-0.4179
2073	T	A	-0.5556
2074	S	A	-0.8273
2075	G	A	-1.4090
2076	Q	A	-2.1076
2077	Q	A	-2.0599
2078	P	A	-1.0047
2079	S	A	0.0639
2080	L	A	0.9189
2081	G	A	-0.5746
2082	Q	A	-1.4925
2083	Q	A	-0.9607
2084	M	A	1.6491
2085	I	A	2.9098
2086	F	A	1.9614
2087	E	A	-1.6170
2088	E	A	-2.9443
2089	H	A	-2.0712
2090	G	A	-0.7721
2091	F	A	0.2045
2092	R	A	-1.9042
2093	R	A	-2.4124
2094	T	A	-1.2657
2095	T	A	-0.7220
2096	P	A	-0.6297
2097	P	A	-0.4780
2098	T	A	-0.2955
2099	T	A	-0.5223
2100	A	A	0.0000
2101	T	A	-0.2103
2102	P	A	-0.2826
2103	V	A	0.0734
2104	R	A	-2.2716
2105	H	A	-2.6686
2106	R	A	-3.2816
2107	P	A	-2.1730
2108	R	A	-2.3462
2109	P	A	-0.6214
2110	Y	A	0.5831
2111	P	A	-0.1283
2112	P	A	-0.3680
2113	N	A	-0.7748
2114	V	A	0.0376
2115	N	A	-2.0583
2116	E	A	-2.6957
2117	E	A	-2.3703
2118	I	A	0.5080
2119	Q	A	0.3938
2120	I	A	1.3825
2121	G	A	0.2969
2122	H	A	0.0290
2123	V	A	0.6386
2124	P	A	-0.4760
2125	R	A	-2.1847
2126	G	A	-1.9269
2127	D	A	-1.8927
2128	V	A	-0.2735
2129	D	A	-1.9576
2130	H	A	-1.7217
2131	H	A	-0.7558
2132	L	A	1.4058
2133	Y	A	1.4921
2134	P	A	0.7119
2135	H	A	0.5322
2136	V	A	1.9507
2137	V	A	2.5184
2138	G	A	1.2527
2139	L	A	1.0348
2140	N	A	-1.0458
2141	P	A	-1.2363
2142	N	A	-1.7076
2143	A	A	-0.8935
2144	S	A	-0.7641
2145	T	A	-0.9012
2146	G	A	-1.6133
2147	Q	A	-2.1096
2148	E	A	-2.3848
2149	A	A	-0.8865
2150	L	A	0.1793
2151	S	A	-0.8235
2152	Q	A	-1.2613
2153	T	A	-1.0638
2154	T	A	-0.4243
2155	I	A	0.0000
2156	S	A	-0.3913
2157	W	A	0.0000
2158	T	A	-0.1573
2159	P	A	-0.3043
2160	F	A	-0.6878
2161	Q	A	-1.8829
2162	E	A	-2.8776
2163	S	A	-2.7692
2164	S	A	-2.0324
2165	E	A	-2.1341
2166	Y	A	0.0000
2167	I	A	0.0000
2168	I	A	0.0000
2169	S	A	-0.7369
2170	C	A	0.0000
2171	H	A	-0.9420
2172	P	A	0.0000
2173	V	A	1.0783
2174	G	A	0.0694
2175	I	A	-0.3369
2176	D	A	-2.0381
2177	E	A	-2.2470
2178	E	A	-2.9471
2179	P	A	-1.9721
2180	L	A	-1.0746
2181	Q	A	-1.1637
2182	F	A	0.0000
2183	R	A	-1.9028
2184	V	A	0.0000
2185	P	A	-1.0574
2186	G	A	-1.4727
2187	T	A	-0.6933
2188	S	A	0.0000
2189	A	A	-0.1578
2190	S	A	-0.3251
2191	A	A	0.0000
2192	T	A	-0.4717
2193	L	A	0.0000
2194	T	A	-0.2415
2195	G	A	-0.1418
2196	L	A	0.0000
2197	T	A	-1.2700
2198	R	A	-2.4855
2199	G	A	-1.6712
2200	A	A	0.0000
2201	T	A	0.3537
2202	Y	A	0.0000
2203	N	A	0.2085
2204	I	A	0.0000
2205	I	A	-0.7600
2206	V	A	0.0000
2207	E	A	0.0000
2208	A	A	0.0000
2209	V	A	0.0000
2210	K	A	-4.2786
2211	D	A	-3.9242
2212	Q	A	-3.7235
2213	Q	A	-3.9183
2214	R	A	-4.1983
2215	Q	A	-3.2046
2216	K	A	-2.5409
2217	V	A	-1.3126
2218	R	A	-1.8250
2219	E	A	-1.5922
2220	E	A	-0.4363
2221	V	A	1.3915
2222	V	A	0.6322
2223	T	A	-0.3095
2224	V	A	0.0000
2225	G	A	-1.7381
2226	N	A	-1.6054
2227	S	A	-0.6176
2228	V	A	0.1337
2229	D	A	-1.8020
2230	Q	A	-1.6042
2231	G	A	-0.7306
2232	L	A	0.6793
2233	S	A	-0.3486
2234	Q	A	-1.3715
2235	P	A	-1.5144
2236	T	A	-1.5456
2237	D	A	-2.2259
2238	D	A	-0.9582
2239	S	A	-0.3160
2240	C	A	0.0000
2241	F	A	1.2380
2242	D	A	0.0000
2243	P	A	1.2280
2244	Y	A	1.8218
2245	T	A	1.3993
2246	V	A	2.1158
2247	S	A	0.8700
2248	H	A	-0.1008
2249	Y	A	-0.2223
2250	A	A	-0.0227
2251	I	A	1.1932
2252	G	A	-0.2350
2253	E	A	-1.5557
2254	E	A	-2.4216
2255	W	A	0.0000
2256	E	A	-1.1943
2257	R	A	0.0415
2258	L	A	0.7351
2259	S	A	-0.1053
2260	D	A	-1.4210
2261	S	A	-0.7809
2262	G	A	-0.0327
2263	F	A	0.7321
2264	K	A	0.0280
2265	L	A	-0.2313
2266	S	A	-1.1742
2267	C	A	0.0000
2268	Q	A	-1.4226
2269	C	A	0.0000
2270	L	A	0.5361
2271	G	A	0.0000
2272	F	A	1.7167
2273	G	A	-0.2666
2274	S	A	-0.2186
2275	G	A	0.0280
2276	H	A	-0.2005
2277	F	A	-0.0968
2278	R	A	-1.4250
2279	C	A	-1.0230
2280	D	A	-1.3434
2281	S	A	-1.0010
2282	S	A	-1.6109
2283	K	A	-1.2707
2284	W	A	-0.9237
2285	C	A	0.0000
2286	H	A	-0.2669
2287	D	A	0.0000
2288	N	A	-1.2378
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738	A	C	2.3502
739	G	C	1.8709
740	I	C	2.7240
741	V	C	3.6828
742	L	C	3.3067
743	I	C	0.0000
744	G	C	1.9445
745	L	C	3.2156
746	A	C	2.1218
747	L	C	0.0000
748	L	C	2.2307
749	L	C	2.8197
750	I	C	2.5899
751	W	C	2.1934
752	K	C	1.1931
753	L	C	2.4259
754	L	C	1.9870
755	M	C	0.8518
756	I	C	0.1755
757	I	C	0.0564
758	H	C	-1.0355
759	D	C	-2.0277
760	R	C	-3.1050
761	R	C	-2.6785
762	E	C	0.0000
763	F	C	-2.1621
764	A	C	0.0000
765	K	C	0.0000
766	F	C	0.0000
767	E	C	0.0000
768	K	C	0.0000
769	E	C	0.0000
770	K	C	-0.5910
771	M	C	-0.6285
772	N	C	0.0000
773	A	C	0.0000
774	K	C	-0.5208
775	W	C	-0.0482
776	D	C	0.0000
777	T	C	-0.1534
778	G	C	0.0000
779	E	C	0.0000
780	N	C	0.0000
781	P	C	0.0355
782	I	C	0.0000
783	Y	C	0.0000
784	K	C	0.0000
785	S	C	0.0000
786	P	C	0.0000
787	I	C	0.0000
788	N	C	0.0000
789	N	C	-0.4134
790	F	C	0.6045
791	K	C	-1.1230
792	N	C	-0.9336
793	P	C	-1.2139
794	N	C	-1.9903
795	Y	C	-0.6933
796	G	C	-1.6525
797	R	C	-3.0051
798	K	C	-2.6158
799	A	C	-1.1028
800	G	C	-0.4038
801	L	C	1.1255