Project name: 115-3Ms-T3

Chain sequence(s)	A: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAIGGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKPVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR; C: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKPVDGSYMQTYHSSVPTGANIPSPTDWLNALFRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR; E: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKPVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR; G: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKPVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR; I: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKPVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR; K: TGPIICAGPIHSNKSANIPHLLGYSEKICQIDRLIHVSSWLRNHSQFQGYVGQRGGRSQVSYFPAENSYSRWSGLLSPCDADWLGMLVVKKAKGSDMIVPGPSYKGKVFFERPTFDGYVGWGCGSGKSRTESGELCSSDSGTSSGLLPSDRVLWIGDVACQPMTPIPEETFLELKSFSQSEFPDICKIDGIVFNQCESESLPQPFDVAWMDVGHSHKIIMREHKTKWVQESSSKDFVCYKEGTGPCSESEEKTCKTSGSCRGDMQFCKVAGCEHGEEASEAKCRCSLVHKPGEVVVSYGGMRVRPKCYGFSRMMATLEVNPPEQRIGQCTGCHLECINGGVRLITLTSELKSATVCASHFCSSATSGKKSTEIQFHSGSLVGKTAIHVKGALVDGTEFTFEGSCMFPDGCDAVDCTFCREFLKNPQCYPAKKWLFIIIVILLGYAGLMLLTNVLKAWGSWVIAPVKLMFAIIKKLMRSVSCLMGKLMDRGRQVIHEEIEGCDEMVHADSKLVSCKQGSGNMKECVTTGRALLPAVNPGQEACLHFTAPGSPDSKCLKIKVKRINLKCKKSSSYFVPDARSRCTSVRRCRWAGDCQSGCPSHFTSNSFSDDWAGKMDRAGLGFSGCSDGCGGAACGCFNAAPSCIFWRKWVENPHGIIWKVSPCAAWVPSAVIELTMPSGEVRTFHPMSGIPTQVFKGVSVTYLGSDMEVSGLTDLCEIEELKSKKLALAPCNQAGMGVVGKVGEIQCSSEESARTIKKDGCIWNADLVGIELRVDDAVCYSKITSVEAVANYSAIPTTIGGLRFERSHDSQGKISGSPLDITAIRGSFSVNYRGLRLSLSEITATCTGEVTNVTGCYSSMTGAKVSIKLHSSKNSTAHVRCKGDETAFSVLEGVHSYTVSLSFDHAVVDEQCQLNCGGHESQVTLKGNLIFLDVPKPVDGSYMQTYHSSVPTGANIPSPTDWLNALFGNGLSRWILGVIGVLLGGLALFFLIMSLFKLGTKQVFRSR
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]                                                (00:00:02)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:02)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:02)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:02)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:03:03)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (02:52:31)
[INFO]       Main:     Simulation completed successfully.                                          (03:03:23)

• Minimal score value: -3.6561
• Maximal score value: 3.9284
• Average score: -0.4522
• Total score value: -2728.3322

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	-0.7184
22	G	A	-0.4505
23	P	A	-0.2003
24	I	A	0.6070
25	I	A	0.7455
26	C	A	0.0842
27	A	A	-0.5636
28	G	A	0.0000
29	P	A	0.3027
30	I	A	1.0649
31	H	A	-0.2149
32	S	A	-0.7861
33	N	A	-2.1352
34	K	A	-2.5445
35	S	A	-1.9089
36	A	A	-1.6799
37	N	A	-1.7376
38	I	A	-0.5653
39	P	A	-0.6165
40	H	A	-0.7252
41	L	A	0.3639
42	L	A	1.2506
43	G	A	0.0000
44	Y	A	0.1177
45	S	A	0.0000
46	E	A	0.0112
47	K	A	-0.0138
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	-0.5837
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	-1.0012
60	W	A	0.0000
61	L	A	0.0000
62	R	A	-2.2506
63	N	A	-2.3215
64	H	A	-1.8802
65	S	A	-1.6954
66	Q	A	-2.3017
67	F	A	0.0000
68	Q	A	-2.0512
69	G	A	0.0000
70	Y	A	0.0000
71	V	A	0.0000
72	G	A	0.0000
73	Q	A	-0.9584
74	R	A	-1.7686
75	G	A	0.0000
76	G	A	0.0000
77	R	A	-0.9159
78	S	A	-1.2126
79	Q	A	-2.0669
80	V	A	0.0000
81	S	A	-1.0204
82	Y	A	-0.5769
83	F	A	-0.4143
84	P	A	-0.8453
85	A	A	-0.6459
86	E	A	-1.5074
87	N	A	-1.2021
88	S	A	0.0000
89	Y	A	0.0000
90	S	A	-1.0812
91	R	A	-1.4561
92	W	A	-0.7999
93	S	A	-0.4436
94	G	A	0.0000
95	L	A	0.0000
96	L	A	0.1123
97	S	A	-0.0816
98	P	A	0.1835
99	C	A	0.0000
100	D	A	0.0000
101	A	A	0.0000
102	D	A	0.3654
103	W	A	0.3640
104	L	A	0.4344
105	G	A	0.0292
106	M	A	0.2918
107	L	A	0.0000
108	V	A	1.3414
109	V	A	0.0736
110	K	A	-1.6777
111	K	A	-2.3250
112	A	A	-2.0228
113	K	A	-2.7022
114	G	A	-1.9311
115	S	A	-1.4792
116	D	A	0.0000
117	M	A	0.0000
118	I	A	0.0000
119	V	A	0.0000
120	P	A	0.0000
121	G	A	-0.8177
122	P	A	-0.8143
123	S	A	-1.2382
124	Y	A	0.0000
125	K	A	-2.3223
126	G	A	-1.8182
127	K	A	-1.5139
128	V	A	0.0000
129	F	A	0.0000
130	F	A	0.0000
131	E	A	-0.4811
132	R	A	0.0000
133	P	A	0.0000
134	T	A	0.0000
135	F	A	0.0000
136	D	A	-1.2205
137	G	A	-0.5736
138	Y	A	0.0000
139	V	A	0.0000
140	G	A	0.0000
141	W	A	0.0000
142	G	A	-0.6346
143	C	A	0.0000
144	G	A	0.0000
145	S	A	-1.2971
146	G	A	-1.1927
147	K	A	-1.5052
148	S	A	0.0000
149	R	A	-1.3689
150	T	A	-1.5949
151	E	A	-1.6858
152	S	A	-1.3799
153	G	A	0.0000
154	E	A	-1.3244
155	L	A	-0.9105
156	C	A	-0.8761
157	S	A	-1.0874
158	S	A	-1.0325
159	D	A	-1.3207
160	S	A	-1.0349
161	G	A	-0.9305
162	T	A	0.0000
163	S	A	-0.9623
164	S	A	-0.7755
165	G	A	-0.8179
166	L	A	-0.3089
167	L	A	0.0000
168	P	A	-1.0550
169	S	A	0.0000
170	D	A	-2.2807
171	R	A	-1.6518
172	V	A	0.0000
173	L	A	0.0000
174	W	A	0.0000
175	I	A	0.0000
176	G	A	-0.6513
177	D	A	-0.7665
178	V	A	0.0000
179	A	A	0.0000
180	C	A	0.0000
181	Q	A	0.0000
182	P	A	-0.4474
183	M	A	-0.2253
184	T	A	-0.3008
185	P	A	-0.5461
186	I	A	-1.0136
187	P	A	-1.4459
188	E	A	-2.6403
189	E	A	-2.6733
190	T	A	-1.9720
191	F	A	0.0000
192	L	A	-0.6249
193	E	A	-1.8955
194	L	A	0.0000
195	K	A	-0.6712
196	S	A	-0.5922
197	F	A	-0.5284
198	S	A	0.0000
199	Q	A	-0.2281
200	S	A	-0.7021
201	E	A	-0.5866
202	F	A	0.0000
203	P	A	-0.6909
204	D	A	-0.6878
205	I	A	0.0000
206	C	A	0.0000
207	K	A	-0.2573
208	I	A	0.0000
209	D	A	-0.4632
210	G	A	-0.3343
211	I	A	0.4331
212	V	A	1.1707
213	F	A	0.0000
214	N	A	-0.5595
215	Q	A	-1.7124
216	C	A	0.0000
217	E	A	-2.7836
218	S	A	-1.8926
219	E	A	-1.7783
220	S	A	-0.5974
221	L	A	-0.0937
222	P	A	-0.5572
223	Q	A	-0.5771
224	P	A	-0.7162
225	F	A	0.0000
226	D	A	-1.5172
227	V	A	0.0000
228	A	A	0.0000
229	W	A	0.0000
230	M	A	0.0000
231	D	A	0.0000
232	V	A	0.0000
233	G	A	-0.7782
234	H	A	-1.0487
235	S	A	-0.9077
236	H	A	-0.9629
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	-0.7438
243	H	A	0.0000
244	K	A	-1.3758
245	T	A	-1.1404
246	K	A	-1.3641
247	W	A	0.0000
248	V	A	-0.7518
249	Q	A	-1.3937
250	E	A	-2.0863
251	S	A	-1.3798
252	S	A	-1.3945
253	S	A	-1.3103
254	K	A	-1.7782
255	D	A	0.0000
256	F	A	0.0000
257	V	A	0.0000
258	C	A	0.0000
259	Y	A	-0.5046
260	K	A	-1.6180
261	E	A	-2.1585
262	G	A	-1.5509
263	T	A	-1.1587
264	G	A	-0.5647
265	P	A	-0.3810
266	C	A	0.0000
267	S	A	-0.4136
268	E	A	-0.7693
269	S	A	-1.0411
270	E	A	-1.4223
271	E	A	0.0000
272	K	A	-2.1882
273	T	A	-1.3944
274	C	A	0.0000
275	K	A	-1.2697
276	T	A	-0.8924
277	S	A	-0.7069
278	G	A	-0.8484
279	S	A	-1.0919
280	C	A	0.0000
281	R	A	-1.3747
282	G	A	-0.8836
283	D	A	-0.5562
284	M	A	-0.2560
285	Q	A	-0.7761
286	F	A	0.0000
287	C	A	-1.0387
288	K	A	-1.7731
289	V	A	-0.4626
290	A	A	-0.4777
291	G	A	-1.0252
292	C	A	-1.4463
293	E	A	-2.7475
294	H	A	-2.8890
295	G	A	-2.8017
296	E	A	-3.6561
297	E	A	-3.2159
298	A	A	-1.9732
299	S	A	-1.6921
300	E	A	-2.3555
301	A	A	-1.9326
302	K	A	-2.2319
303	C	A	0.0000
304	R	A	-1.1243
305	C	A	0.0000
306	S	A	-0.1638
307	L	A	-0.2192
308	V	A	-0.0010
309	H	A	-0.8046
310	K	A	-0.7152
311	P	A	0.0000
312	G	A	0.0000
313	E	A	-0.8316
314	V	A	0.0000
315	V	A	0.0000
316	V	A	0.0000
317	S	A	-1.4182
318	Y	A	0.0000
319	G	A	-1.1789
320	G	A	-1.1885
321	M	A	-1.5183
322	R	A	-2.1094
323	V	A	0.0000
324	R	A	-1.1131
325	P	A	0.0000
326	K	A	-0.5013
327	C	A	0.0000
328	Y	A	0.0000
329	G	A	0.0000
330	F	A	0.0000
331	S	A	0.0000
332	R	A	-1.5692
333	M	A	0.0000
334	M	A	0.0000
335	A	A	0.0000
336	T	A	-0.2687
337	L	A	-0.7763
338	E	A	-1.8601
339	V	A	-0.9167
340	N	A	-1.9658
341	P	A	-1.7826
342	P	A	-2.0211
343	E	A	-3.1218
344	Q	A	-2.6755
345	R	A	-2.2420
346	I	A	-0.2257
347	G	A	-1.0341
348	Q	A	-1.1658
349	C	A	0.0182
350	T	A	-0.0021
351	G	A	0.4171
352	C	A	0.0199
353	H	A	-0.9378
354	L	A	0.0000
355	E	A	-0.8621
356	C	A	0.0384
357	I	A	-0.5028
358	N	A	-1.1229
359	G	A	-1.0897
360	G	A	0.0000
361	V	A	0.0000
362	R	A	-1.3210
363	L	A	0.0000
364	I	A	-0.5741
365	T	A	0.0000
366	L	A	1.0171
367	T	A	0.2511
368	S	A	-1.0083
369	E	A	-2.2597
370	L	A	0.0000
371	K	A	-2.2478
372	S	A	-1.3307
373	A	A	0.0000
374	T	A	-0.7201
375	V	A	0.0000
376	C	A	-0.4265
377	A	A	0.0000
378	S	A	-0.5523
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383	S	A	-0.4059
384	A	A	-0.5701
385	T	A	-1.2900
386	S	A	-1.6306
387	G	A	-1.9378
388	K	A	-3.0555
389	K	A	-2.1634
390	S	A	-1.5291
391	T	A	0.0000
392	E	A	-1.8205
393	I	A	0.0000
394	Q	A	-1.3994
395	F	A	0.0000
396	H	A	-1.0069
397	S	A	-1.2355
398	G	A	-0.6937
399	S	A	0.0000
400	L	A	0.0000
401	V	A	-0.9775
402	G	A	-1.4659
403	K	A	-1.7198
404	T	A	-0.5803
405	A	A	-1.0260
406	I	A	0.0000
407	H	A	-1.7786
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409	K	A	-2.3432
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411	A	A	-1.8685
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413	V	A	-1.9314
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415	G	A	-1.9802
416	T	A	-1.7028
417	E	A	-2.6295
418	F	A	0.0000
419	T	A	-1.5915
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421	E	A	-2.5569
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425	M	A	0.1594
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432	A	A	-0.8094
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444	N	A	-0.7268
445	P	A	-0.5903
446	Q	A	-0.4196
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448	Y	A	1.2265
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450	A	A	-0.5346
451	K	A	-0.9361
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457	I	A	3.0853
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460	I	A	2.8853
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465	A	A	2.0162
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467	L	A	2.5770
468	M	A	2.1776
469	L	A	2.7323
470	L	A	2.5845
471	T	A	1.3379
472	N	A	0.6744
473	V	A	2.2964
474	L	A	1.8641
475	K	A	-0.3129
476	A	A	0.7954
477	I	A	1.9162
478	G	A	1.3758
481	G	A	0.5020
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483	W	A	1.4791
484	V	A	0.0000
485	I	A	0.3942
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489	K	A	-0.2477
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493	A	A	0.2679
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496	K	A	-1.3074
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500	R	A	-1.3030
501	S	A	0.0367
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503	S	A	0.5589
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514	R	A	-0.4049
515	Q	A	-0.1746
516	V	A	0.4852
517	I	A	0.4704
518	H	A	0.1023
519	E	A	-1.3884
520	E	A	-1.0794
521	I	A	1.0347
561	E	A	-2.0340
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564	D	A	-1.3215
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566	M	A	-0.4259
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569	A	A	-0.6842
570	D	A	-1.2422
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573	L	A	0.0585
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575	S	A	-0.2608
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579	G	A	-2.4041
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582	N	A	-1.6692
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584	K	A	-2.5275
585	E	A	0.0000
586	C	A	-0.1978
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592	A	A	0.0000
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600	G	A	-0.8346
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616	K	A	-0.3678
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619	K	A	-0.6397
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621	K	A	-1.0675
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623	K	A	-0.6474
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639	D	A	-0.5347
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643	R	A	-0.2099
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646	S	A	-0.7358
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648	R	A	-1.1367
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653	A	A	-1.0646
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664	F	A	1.2015
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735	E	A	-1.1424
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744	R	A	-1.4137
745	T	A	-0.9561
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749	M	A	0.0434
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768	D	A	-1.7299
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770	E	A	-2.1003
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783	L	A	-1.4035
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893	N	A	-1.0902
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902	S	A	-0.7840
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904	I	A	1.0709
905	T	A	0.2963
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913	T	A	-1.4757
914	N	A	-2.2008
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916	T	A	-1.3169
917	G	A	-1.2204
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920	S	A	-0.7207
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935	K	A	-1.0559
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957	H	A	-0.1128
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971	D	A	-2.8899
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980	G	A	-0.7414
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986	T	A	-1.9583
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988	K	A	-3.0737
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998	K	A	-1.5864
999	P	A	-1.2283
1000	V	A	-1.1352
1001	D	A	-1.8413
1002	G	A	-1.1656
1003	S	A	-0.4518
1004	Y	A	0.5407
1005	M	A	0.0000
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1009	H	A	0.0000
1010	S	A	-0.1379
1011	S	A	-0.0433
1012	V	A	0.2364
1013	P	A	0.0287
1014	T	A	0.0463
1015	G	A	-0.2447
1016	A	A	0.1814
1017	N	A	0.1950
1018	I	A	1.2857
1019	P	A	0.1390
1020	S	A	0.0000
1021	P	A	-0.1480
1022	T	A	-0.1936
1023	D	A	0.0000
1024	W	A	-0.2487
1025	L	A	-0.4356
1026	N	A	-0.4344
1027	A	A	-0.2356
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1030	G	A	-0.1915
1031	N	A	-0.7906
1032	G	A	-0.3538
1033	L	A	0.7901
1034	S	A	-0.0234
1035	R	A	-0.6674
1036	W	A	0.8069
1037	I	A	1.8354
1038	L	A	1.9992
1039	G	A	1.3208
1040	V	A	2.1500
1041	I	A	2.8614
1042	G	A	1.6276
1043	V	A	1.6432
1044	L	A	2.1331
1045	L	A	2.2247
1046	G	A	1.2429
1047	G	A	0.0000
1048	L	A	2.0098
1049	A	A	1.7770
1050	L	A	1.9862
1051	F	A	0.0000
1052	F	A	2.5574
1053	L	A	2.8701
1054	I	A	2.6231
1055	M	A	2.0772
1056	S	A	1.8940
1057	L	A	2.5386
1058	F	A	2.2339
1059	K	A	-0.1096
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1061	G	A	0.7699
1062	T	A	0.2553
1063	K	A	-1.0065
1064	Q	A	-1.0916
1065	V	A	0.7930
1066	F	A	0.4087
1067	R	A	-1.8615
1068	S	A	-1.5698
1069	R	A	-1.8375
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