Project name: pS-KP-309-663F

Chain sequence(s)	A: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYYPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSNRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVFKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKAAIHVKGTLVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIAILLGYAGLMLLTNVLKAIGGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCRQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSFFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARSIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVSGCYSCMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQIFRSR; C: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYYPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSNRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVFKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKAAIHVKGTLVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIAILLGYAGLMLLTNVWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCRQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSFFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARSIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVSGCYSCMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFRWILGVIGVLLGGLALFFLIMSLFKLGTKQIFRSR; E: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYYPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSNRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVFKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKAAIHVKGTLVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIAILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCRQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSFFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARSIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVSGCYSCMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQIFRSR; G: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYYPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSNRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVFKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKAAIHVKGTLVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIAILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCRQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSFFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARSIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVSGCYSCMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQIFRSR; I: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYYPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSNRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVFKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKAAIHVKGTLVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIAILLGYAGLMLLTNVLWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCRQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSFFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARSIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVSGCYSCMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQIFRSR; K: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYYPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSNRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVFKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKAAIHVKGTLVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIAILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCRQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSFFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARSIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVSGCYSCMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKFVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQIFRSR
Selected Chain(s)	A,C,E,G,I,K
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                                        (00:01:28)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (02:05:06)
[INFO]       Main:     Simulation completed successfully.                                          (02:14:17)

• Minimal score value: -3.3466
• Maximal score value: 3.5819
• Average score: -0.4232
• Total score value: -2552.887

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
21	T	A	-0.6151
22	G	A	-0.4392
23	P	A	-0.1367
24	I	A	0.5855
25	I	A	0.2482
26	C	A	0.1267
27	A	A	-0.1395
28	G	A	-0.1033
29	P	A	0.5213
30	I	A	1.3117
31	H	A	-0.3476
32	S	A	-0.7026
33	N	A	-2.0043
34	K	A	-2.4339
35	S	A	-1.9412
36	A	A	-1.7521
37	N	A	-2.0024
38	I	A	-0.6689
39	P	A	-0.6882
40	H	A	-0.6830
41	L	A	0.5682
42	L	A	1.4120
43	G	A	0.0000
44	Y	A	0.7109
45	S	A	0.0000
46	E	A	0.1811
47	K	A	0.2674
48	I	A	0.0000
49	C	A	0.0000
50	Q	A	0.0000
51	I	A	0.0000
52	D	A	0.0000
53	R	A	-0.5606
54	L	A	0.0000
55	I	A	0.0000
56	H	A	0.0000
57	V	A	0.0000
58	S	A	0.0000
59	S	A	-1.3436
60	W	A	0.0000
61	L	A	0.0000
62	R	A	-3.3428
63	N	A	-2.7691
64	H	A	-2.0944
65	S	A	-1.9003
66	Q	A	-2.6511
67	F	A	0.0000
68	Q	A	-2.6789
69	G	A	0.0000
70	Y	A	0.0000
71	V	A	0.0000
72	G	A	0.0000
73	Q	A	-0.4715
74	R	A	-0.8967
75	G	A	-1.2610
76	G	A	0.0000
77	R	A	0.0000
78	S	A	-1.1066
79	Q	A	-1.8215
80	V	A	0.0000
81	S	A	-0.9025
82	Y	A	-0.5932
83	Y	A	-0.3663
84	P	A	-0.7279
85	A	A	-0.7076
86	E	A	-1.6699
87	N	A	-1.2104
88	S	A	-0.9940
89	Y	A	-0.6915
90	S	A	-0.9518
91	R	A	-0.9697
92	W	A	0.0000
93	S	A	0.0111
94	G	A	0.3505
95	L	A	0.0000
96	L	A	0.0565
97	S	A	-0.0633
98	P	A	0.0000
99	C	A	0.0000
100	D	A	0.0000
101	A	A	0.0000
102	D	A	-0.0210
103	W	A	0.0821
104	L	A	0.4327
105	G	A	-0.0615
106	M	A	0.1872
107	L	A	0.0000
108	V	A	1.1775
109	V	A	-0.0237
110	K	A	-1.7543
111	K	A	-2.2444
112	A	A	-2.0087
113	K	A	-2.7453
114	G	A	-1.9682
115	S	A	-1.5317
116	D	A	-1.4666
117	M	A	-0.9614
118	I	A	0.0000
119	V	A	0.0000
120	P	A	0.0000
121	G	A	-0.6064
122	P	A	0.0000
123	S	A	-1.2037
124	Y	A	0.0000
125	K	A	-2.3811
126	G	A	-1.7950
127	K	A	-1.4596
128	V	A	0.0000
129	F	A	0.0000
130	F	A	0.0000
131	E	A	0.0000
132	R	A	0.0000
133	P	A	0.0000
134	T	A	0.0000
135	F	A	0.0000
136	D	A	-1.3064
137	G	A	-0.6623
138	Y	A	0.0000
139	V	A	0.0000
140	G	A	0.0000
141	W	A	0.0000
142	G	A	-0.7119
143	C	A	0.0000
144	G	A	-1.6871
145	S	A	-1.5199
146	G	A	-1.4018
147	K	A	-1.6068
148	S	A	0.0000
149	R	A	-1.4101
150	T	A	-1.7996
151	E	A	-2.0099
152	S	A	-1.5300
153	G	A	0.0000
154	E	A	-1.1331
155	L	A	-0.8915
156	C	A	-0.9012
157	S	A	-1.1194
158	S	A	-1.1165
159	D	A	-1.3735
160	S	A	-1.0765
161	G	A	-1.0353
162	T	A	0.0000
163	S	A	-0.8593
164	S	A	-0.6300
165	G	A	0.0000
166	L	A	-0.3793
167	L	A	0.0000
168	P	A	-0.9372
169	S	A	0.0000
170	N	A	-1.7819
171	R	A	-1.4039
172	V	A	0.0000
173	L	A	0.0000
174	W	A	0.0000
175	I	A	0.0000
176	G	A	-0.3593
177	D	A	-0.6154
178	V	A	0.0000
179	A	A	0.0000
180	C	A	0.0000
181	Q	A	0.0000
182	P	A	-0.3221
183	M	A	-0.1744
184	T	A	-0.2559
185	P	A	-0.7178
186	I	A	-1.2238
187	P	A	-1.5613
188	E	A	-2.7063
189	E	A	-2.7704
190	T	A	-2.0432
191	F	A	0.0000
192	L	A	-0.7673
193	E	A	-2.0618
194	L	A	0.0000
195	K	A	-0.7896
196	S	A	-0.7968
197	F	A	0.0000
198	S	A	0.0000
199	Q	A	-0.5447
200	S	A	-0.5339
201	E	A	0.0000
202	F	A	0.0000
203	P	A	-0.2347
204	D	A	-0.1592
205	I	A	0.0000
206	C	A	0.0000
207	K	A	0.1676
208	I	A	0.0000
209	D	A	-0.5030
210	G	A	-0.2253
211	I	A	0.7597
212	V	A	1.7182
213	F	A	0.8170
214	N	A	0.0643
215	Q	A	-0.8185
216	C	A	-1.2304
217	E	A	-2.4277
218	S	A	-1.5464
219	E	A	-1.4033
220	S	A	-0.4395
221	L	A	-0.0883
222	P	A	-0.5159
223	Q	A	-0.5079
224	P	A	-0.4579
225	F	A	-0.4775
226	D	A	-1.1473
227	V	A	0.0000
228	A	A	0.0000
229	W	A	0.0000
230	M	A	0.0000
231	D	A	-0.7096
232	V	A	0.0000
233	G	A	-0.8279
234	H	A	-0.9895
235	S	A	-0.7978
236	H	A	-0.8940
237	K	A	0.0000
238	I	A	0.0000
239	I	A	0.0000
240	M	A	0.0000
241	R	A	0.0000
242	E	A	-0.6037
243	H	A	-0.6436
244	K	A	-0.9550
245	T	A	0.0000
246	K	A	-0.9552
247	W	A	0.0000
248	V	A	-0.6060
249	Q	A	-1.2739
250	E	A	-1.9784
251	S	A	-1.5410
252	S	A	-1.4112
253	S	A	-1.3276
254	K	A	-1.6495
255	D	A	0.0000
256	F	A	0.0000
257	V	A	0.0000
258	C	A	0.0000
259	Y	A	-0.7965
260	K	A	-1.9345
261	E	A	-2.6045
262	G	A	-1.8182
263	T	A	-1.3647
264	G	A	-0.8330
265	P	A	-0.7051
266	C	A	0.0000
267	S	A	-0.4331
268	E	A	-0.8466
269	S	A	-1.1918
270	E	A	-1.6442
271	E	A	-1.5144
272	K	A	-2.3492
273	T	A	-1.4796
274	C	A	0.0000
275	K	A	-1.2893
276	T	A	-0.9522
277	S	A	-0.7104
278	G	A	-0.8149
279	S	A	-0.9724
280	C	A	-0.9228
281	R	A	-0.9829
282	G	A	0.0000
283	D	A	-0.4815
284	M	A	-0.2122
285	Q	A	-0.6564
286	F	A	0.0000
287	C	A	-0.9614
288	K	A	-1.4597
289	V	A	-0.8630
290	A	A	-0.5344
291	G	A	-0.9384
292	C	A	-1.2541
293	E	A	-2.3828
294	H	A	-2.3731
295	G	A	-2.5206
296	E	A	-2.5133
297	E	A	-2.6662
298	A	A	-1.7219
299	S	A	-1.7222
300	E	A	-2.4364
301	A	A	-2.0889
302	K	A	-2.3846
303	C	A	0.0000
304	R	A	-1.1071
305	C	A	0.0000
306	S	A	0.0585
307	L	A	0.3254
308	V	A	0.6241
309	F	A	0.9242
310	K	A	0.2165
311	P	A	0.0000
312	G	A	0.0000
313	E	A	-0.6641
314	V	A	0.0000
315	V	A	0.0000
316	V	A	0.0000
317	S	A	-1.2681
318	Y	A	0.0000
319	G	A	-0.9706
320	G	A	-1.1595
321	M	A	-1.3383
322	R	A	-1.9711
323	V	A	0.0000
324	R	A	-0.8874
325	P	A	0.0000
326	K	A	-0.4320
327	C	A	0.0000
328	Y	A	0.0000
329	G	A	-0.1503
330	F	A	-0.3791
331	S	A	0.0000
332	R	A	-0.5395
333	M	A	0.0000
334	M	A	0.0000
335	A	A	0.0000
336	T	A	0.0439
337	L	A	0.1552
338	E	A	-0.9688
339	V	A	-0.5643
340	N	A	-1.4991
341	P	A	-1.7279
342	P	A	-2.1588
343	E	A	-3.2106
344	Q	A	-2.7249
345	R	A	-2.7989
346	I	A	-0.9551
347	G	A	-0.7611
348	Q	A	-0.8045
349	C	A	0.1852
350	T	A	0.0440
351	G	A	-0.0396
352	C	A	0.0000
353	H	A	-1.0956
354	L	A	-1.0990
355	E	A	-1.1267
356	C	A	-0.3120
357	I	A	-0.8272
358	N	A	-1.2479
359	G	A	-1.0912
360	G	A	0.0000
361	V	A	0.0000
362	R	A	-1.7017
363	L	A	0.0000
364	I	A	-0.9495
365	T	A	0.0000
366	L	A	0.3413
367	T	A	0.1693
368	S	A	-1.1285
369	E	A	-2.4189
370	L	A	0.0000
371	K	A	-2.5324
372	S	A	0.0000
373	A	A	0.0000
374	T	A	-0.4188
375	V	A	0.0000
376	C	A	-0.3852
377	A	A	0.0000
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385	T	A	-1.4737
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389	K	A	-2.1117
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392	E	A	-2.0759
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394	Q	A	-1.4696
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409	K	A	-1.2863
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415	G	A	-1.6736
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419	T	A	-0.9940
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465	A	A	2.1110
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476	A	A	1.1074
477	I	A	2.0034
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561	E	A	-2.1861
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573	L	A	0.0028
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591	R	A	-0.8050
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598	N	A	-0.9325
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623	K	A	-1.4200
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735	E	A	-0.7081
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795	Q	A	-1.0299
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893	N	A	-0.6807
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904	I	A	1.3146
905	T	A	0.1276
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913	T	A	-1.9875
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916	S	A	-1.4708
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919	Y	A	-0.4424
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953	L	A	-0.1035
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957	H	A	-0.0459
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977	N	A	-2.2903
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999	F	A	0.7818
1000	V	A	0.9897
1001	D	A	-0.9132
1002	G	A	-0.8826
1003	S	A	0.0000
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1009	H	A	0.0000
1010	S	A	-0.0770
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1012	V	A	0.0371
1013	P	A	0.0673
1014	T	A	0.1997
1015	G	A	-0.2633
1016	A	A	0.2997
1017	N	A	0.9363
1018	I	A	1.9052
1019	P	A	0.5476
1020	S	A	-0.2327
1021	P	A	-0.1535
1022	T	A	-0.5006
1023	D	A	0.0000
1024	W	A	-0.5216
1025	L	A	0.0000
1026	N	A	-0.2281
1027	A	A	-0.1198
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1030	G	A	-0.5496
1031	N	A	-0.5165
1032	G	A	-0.0339
1033	L	A	1.0263
1034	S	A	0.1875
1035	R	A	-0.3709
1036	W	A	1.5405
1037	I	A	2.3633
1038	L	A	2.2294
1039	G	A	1.4370
1040	V	A	2.3871
1041	I	A	2.7541
1042	G	A	1.6206
1043	V	A	1.9806
1044	L	A	2.4216
1045	L	A	2.3056
1046	G	A	1.2901
1047	G	A	0.0000
1048	L	A	2.3052
1049	A	A	1.9276
1050	L	A	2.4729
1051	F	A	0.0000
1052	F	A	3.2171
1053	L	A	3.2217
1054	I	A	2.7571
1055	M	A	2.1824
1056	S	A	1.9848
1057	L	A	2.4651
1058	F	A	1.9432
1059	K	A	-0.2949
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1062	T	A	0.2092
1063	K	A	-0.9396
1064	Q	A	-1.0577
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1066	F	A	0.6821
1067	R	A	-1.7653
1068	S	A	-1.5800
1069	R	A	-1.7957
21	T	C	-0.5426
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