Project name: ca2abb58ee203db [mutate: GP389A, SG390A, GS391A, GP389C, SG390C, GS391C, GP389B, SG390B, GS391B]

Status: done

Started: 2026-08-11 13:26:58
Chain sequence(s) A: MNETRYNATVQEQQTLSNPKAVGPDIDKLKDKFKEGSIPLQTDFNELIDIADIGRKACGQAPQQNGPGEGLKLADDGTLNLKIGTFSNKDFSPLILKDDVLSVDLGSGLTNETNGICVGQGDGITVNTSNVAVKQGNGISVTSSGGVAVKVSANKGLSVDSSGVAVKVNTDKGISVDGNGVAVKVNTSKGISVDNTGVAVIANASKGISVDGSGVAVIANTSKGISVDGSGVAVIANTSKGISVDNTGVAVIANASKGISVDGSGVAVIANTSKGISVDGSGVAVIANTSKGISVDSSGVAVKVKANGGIKVDANGVAIDPNNVLPKGVIVMFSGSTAPTGWALCDGNNGTPNLIDRFILGGKGTDINGVSTNTASGTKNSKLFDFSGGSGGNAVPNLRGDLQVLAQKVARTGGSGGKNKVTVPYYILAFIIKL
C: MNETRYNATVQEQQTLSNPKAVGPDIDKLKDKFKEGSIPLQTDFNELIDIADIGRKACGQAPQQNGPGEGLKLADDGTLNLKIGTFSNKDFSPLILKDDVLSVDLGSGLTNETNGICVGQGDGITVNTSNVAVKQGNGISVTSSGGVAVKVSANKGLSVDSSGVAVKVNTDKGISVDGNGVAVKVNTSKGISVDNTGVAVIANASKGISVDGSGVAVIANTSKGISVDGSGVAVIANTSKGISVDNTGVAVIANASKGISVDGSGVAVIANTSKGISVDGSGVAVIANTSKGISVDSSGVAVKVKANGGIKVDANGVAIDPNNVLPKGVIVMFSGSTAPTGWALCDGNNGTPNLIDRFILGGKGTDINGVSTNTASGTKNSKLFDFSGGSGGNAVPNLRGDLQVLAQKVARTGGSGGKNKVTVPYYILAFIIKL
B: MNETRYNATVQEQQTLSNPKAVGPDIDKLKDKFKEGSIPLQTDFNELIDIADIGRKACGQAPQQNGPGEGLKLADDGTLNLKIGTFSNKDFSPLILKDDVLSVDLGSGLTNETNGICVGQGDGITVNTSNVAVKQGNGISVTSSGGVAVKVSANKGLSVDSSGVAVKVNTDKGISVDGNGVAVKVNTSKGISVDNTGVAVIANASKGISVDGSGVAVIANTSKGISVDGSGVAVIANTSKGISVDNTGVAVIANASKGISVDGSGVAVIANTSKGISVDGSGVAVIANTSKGISVDSSGVAVKVKANGGIKVDANGVAIDPNNVLPKGVIVMFSGSTAPTGWALCDGNNGTPNLIDRFILGGKGTDINGVSTNTASGTKNSKLFDFSGGSGGNAVPNLRGDLQVLAQKVARTGGSGGKNKVTVPYYILAFIIKL
input PDB
Selected Chain(s) A,B,C
Distance of aggregation 10 Å
FoldX usage Yes
pH calculations No
alphaCutter usage No
Dynamic mode No
Automated mutations No
Mutated residues GP389A,SG390B,GS391B,GP389B,GS391A,SG390A,GS391C,SG390C,GP389C
Energy difference between WT (input) and mutated protein (by FoldX) -4.17299 kcal/mol
Downloads Download all the data
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 minimization                                          (00:00:01)
[INFO]       FoldX:    Building mutant model                                                       (00:16:10)
[INFO]       Analysis: Starting Aggrescan4D on folded.pdb                                          (00:17:11)
[INFO]       Main:     Simulation completed successfully.                                          (00:17:25)
Show buried residues

Minimal score value
-3.9269
Maximal score value
1.5691
Average score
-0.8263
Total score value
-1075.876

The table below lists A4D score for protein residues. Residues with A4D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan4D score mutation
1 M A -0.1122
2 N A -1.9401
3 E A -2.5488
4 T A -1.9173
5 R A -2.3862
6 Y A -0.5209
7 N A -0.9592
8 A A -0.1831
9 T A -0.0541
10 V A 0.1996
11 Q A -1.7496
12 E A -2.8649
13 Q A -3.2091
14 Q A -2.6407
15 T A -1.6308
16 L A -1.0931
17 S A -1.2489
18 N A -2.1941
19 P A -1.9689
20 K A -2.3718
21 A A -1.5210
22 V A -0.4308
23 G A -0.8870
24 P A -1.2727
25 D A -2.0769
26 I A -2.0182
27 D A -3.5003
28 K A -3.6702
29 L A 0.0000
30 K A -3.1087
31 D A -3.9269
32 K A -2.4034
33 F A 0.0000
34 K A -2.4367
35 E A -2.4027
36 G A -1.1355
37 S A -0.5257
38 I A 1.5160
39 P A 0.4282
40 L A 0.3980
41 Q A -1.2544
42 T A -0.7415
43 D A 0.0000
44 F A 0.0000
45 N A -1.4036
46 E A -1.0806
47 L A 0.0000
48 I A 0.0000
49 D A -0.9447
50 I A 0.0000
51 A A 0.0000
52 D A 0.0000
53 I A 0.0000
54 G A 0.0000
55 R A 0.0000
56 K A -1.1754
57 A A 0.0000
58 C A 0.0000
59 G A 0.0000
60 Q A -1.2784
61 A A 0.0000
62 P A -1.3794
63 Q A -1.9328
64 Q A -2.0693
65 N A -2.2760
66 G A 0.0000
67 P A -1.1810
68 G A 0.0000
69 E A -2.0828
70 G A 0.0000
71 L A 0.0000
72 K A -1.4607
73 L A 0.0000
74 A A -1.5566
75 D A -2.3788
76 D A -2.4166
77 G A -1.5531
78 T A 0.0000
79 L A 0.0000
80 N A -0.8894
81 L A 0.0000
82 K A -1.3063
83 I A -0.2836
84 G A -0.4607
85 T A -0.5454
86 F A -0.4965
87 S A -0.5286
88 N A -1.6475
89 K A -2.2082
90 D A -2.6491
91 F A -1.1692
92 S A 0.0000
93 P A 0.0414
94 L A 0.0000
95 I A 0.0446
96 L A -0.7334
97 K A -1.6699
98 D A -2.8366
99 D A -3.0243
100 V A 0.0000
101 L A 0.0000
102 S A 0.0000
103 V A 0.0000
104 D A -1.1932
105 L A 0.0000
106 G A -1.2871
107 S A -1.0460
108 G A 0.0000
109 L A 0.0000
110 T A -1.5020
111 N A -1.9082
112 E A -1.8710
113 T A -1.3019
114 N A -1.9122
115 G A 0.0000
116 I A 0.0000
117 C A 0.0000
118 V A 0.0000
119 G A 0.0000
120 Q A -1.6762
121 G A -1.2688
122 D A -1.6313
123 G A 0.0000
124 I A 0.0000
125 T A -1.0786
126 V A -0.7522
127 N A -1.0674
128 T A -0.7596
129 S A -1.1941
130 N A -1.1536
131 V A 0.0000
132 A A 0.0000
133 V A 0.0000
134 K A -1.4154
135 Q A -1.8211
136 G A -1.6798
137 N A -2.1636
138 G A 0.0000
139 I A 0.0000
140 S A -0.9463
141 V A -0.9898
142 T A -0.7859
143 S A -1.0277
144 S A -0.6394
145 G A -0.9702
146 G A 0.0000
147 V A 0.0000
148 A A -1.2295
149 V A 0.0000
150 K A -0.9496
151 V A -0.5181
152 S A 0.0000
153 A A -1.1145
154 N A -2.6448
155 K A -2.2179
156 G A 0.0000
157 L A 0.0000
158 S A -0.9426
159 V A -1.0496
160 D A -2.1416
161 S A -1.6071
162 S A -1.0350
163 G A 0.0000
164 V A 0.0000
165 A A 0.0000
166 V A 0.0000
167 K A -1.8076
168 V A -1.1385
169 N A -1.7519
170 T A -1.7675
171 D A -2.7206
172 K A -2.1187
173 G A 0.0000
174 I A 0.0000
175 S A -0.8996
176 V A -1.4770
177 D A -2.3458
178 G A -2.1771
179 N A -2.4566
180 G A 0.0000
181 V A 0.0000
182 A A 0.0000
183 V A 0.0000
184 K A -1.2208
185 V A -0.5612
186 N A 0.0000
187 T A -0.6445
188 S A -1.0361
189 K A -1.0541
190 G A 0.0000
191 I A 0.0000
192 S A -0.5045
193 V A 0.0000
194 D A -2.3629
195 N A -2.6001
196 T A -1.5429
197 G A 0.0000
198 V A 0.0000
199 A A 0.0000
200 V A 0.0000
201 I A -0.0022
202 A A -0.1606
203 N A 0.0000
204 A A -0.4914
205 S A -1.0673
206 K A -1.1071
207 G A 0.0000
208 I A 0.0000
209 S A -0.4888
210 V A -0.8519
211 D A -2.0589
212 G A -1.4910
213 S A -1.0221
214 G A 0.0000
215 V A 0.0000
216 A A 0.0000
217 V A 0.0000
218 I A -0.0054
219 A A -0.2090
220 N A 0.0000
221 T A -0.8989
222 S A -1.6301
223 K A -1.5021
224 G A 0.0000
225 I A 0.0000
226 S A -0.6625
227 V A -0.8786
228 D A -2.1085
229 G A -1.4881
230 S A -1.1059
231 G A 0.0000
232 V A 0.0000
233 A A 0.0000
234 V A 0.0000
235 I A -0.1945
236 A A -0.1091
237 N A 0.0000
238 T A -0.6085
239 S A -1.1578
240 K A -1.2320
241 G A 0.0000
242 I A 0.0000
243 S A -0.3135
244 V A -0.6662
245 D A -1.6735
246 N A -1.9400
247 T A -1.0855
248 G A 0.0000
249 V A 0.0000
250 A A 0.0000
251 V A 0.0000
252 I A -0.0179
253 A A -0.1152
254 N A 0.0000
255 A A -0.5971
256 S A -1.3133
257 K A -1.3803
258 G A 0.0000
259 I A 0.0000
260 S A -0.3844
261 V A -0.6865
262 D A -1.9177
263 G A -1.4411
264 S A -0.9905
265 G A 0.0000
266 V A 0.0000
267 A A 0.0000
268 V A 0.0000
269 I A -0.0941
270 A A -0.1741
271 N A 0.0000
272 T A -0.5575
273 S A -1.0863
274 K A -1.2355
275 G A 0.0000
276 I A 0.0000
277 S A -0.4132
278 V A -0.7097
279 D A -1.8451
280 G A -1.3627
281 S A -0.9741
282 G A 0.0000
283 V A 0.0000
284 A A 0.0000
285 V A 0.0000
286 I A -0.0461
287 A A -0.2335
288 N A -0.5769
289 T A -0.8180
290 S A -1.1761
291 K A -1.6212
292 G A 0.0000
293 I A 0.0000
294 S A -0.7314
295 V A -0.8122
296 D A -1.7375
297 S A -1.1207
298 S A -0.8586
299 G A 0.0000
300 V A 0.0000
301 A A 0.0000
302 V A 0.0000
303 K A -1.3274
304 V A -1.1113
305 K A -1.6810
306 A A -1.2412
307 N A -1.6892
308 G A -1.4434
309 G A 0.0000
310 I A 0.0000
311 K A -2.1728
312 V A -1.6516
313 D A -1.8607
314 A A -1.2963
315 N A -1.8263
316 G A 0.0000
317 V A 0.0000
318 A A 0.0000
319 I A 0.0000
320 D A 0.0000
321 P A -0.7072
322 N A -0.4095
323 N A -0.7629
324 V A 0.0000
325 L A 0.0000
326 P A -0.7467
327 K A -1.2946
328 G A -0.5602
329 V A 0.0000
330 I A 0.0000
331 V A 0.0000
332 M A 0.0000
333 F A -0.1399
334 S A -0.5249
335 G A -0.7627
336 S A -0.8458
337 T A -0.3923
338 A A -0.0390
339 P A -0.3284
340 T A -0.0418
341 G A -0.1105
342 W A 0.0000
343 A A 0.0611
344 L A -0.5135
345 C A 0.0000
346 D A -1.5804
347 G A -1.8553
348 N A -2.4081
349 N A -2.1908
350 G A -1.7300
351 T A -1.2517
352 P A -1.3172
353 N A -1.6015
354 L A 0.0000
355 I A -0.6663
356 D A -0.7418
357 R A -0.4796
358 F A 0.0000
359 I A 0.0000
360 L A 0.0000
361 G A 0.0000
362 G A 0.0000
363 K A -1.9744
364 G A -1.5372
365 T A -1.1657
366 D A -1.7397
367 I A 0.0000
368 N A -1.6983
369 G A 0.0000
370 V A -0.6052
371 S A 0.0000
372 T A -0.1956
373 N A 0.0000
374 T A -0.2498
375 A A -0.2772
376 S A -0.5117
377 G A -0.9273
378 T A -1.2224
379 K A -2.1202
380 N A -1.8047
381 S A -1.1231
382 K A 0.0000
383 L A -0.4982
384 F A 0.0000
385 D A 0.0000
386 F A 0.0000
387 S A -1.5886
388 G A -1.6712
389 P A -1.1321 mutated: GP389A
390 G A -1.4394 mutated: SG390A
391 S A -1.4832 mutated: GS391A
392 G A -1.4345
393 N A -1.8497
394 A A -0.8129
395 V A -0.5995
396 P A -1.2299
397 N A -1.5885
398 L A -1.7314
399 R A -2.5151
400 G A -1.8848
401 D A -1.8567
402 L A -1.1775
403 Q A -1.5888
404 V A -0.3967
405 L A 0.0000
406 A A 0.0000
407 Q A -1.3732
408 K A -1.2786
409 V A -0.5045
410 A A -1.2301
411 R A -2.5946
412 T A -1.7138
413 G A -1.8845
414 G A -1.8770
415 S A -1.4673
416 G A -1.7511
417 G A -2.2178
418 K A -2.9528
419 N A -2.8563
420 K A -1.9510
421 V A -0.8526
422 T A -0.2694
423 V A 0.0000
424 P A 0.0000
425 Y A 0.0000
426 Y A 0.0000
427 I A 0.0000
428 L A 0.0000
429 A A 0.0000
430 F A 0.0000
431 I A 0.0000
432 I A 0.0000
433 K A 0.0000
434 L A 0.8456
1 M B -0.1113
2 N B -1.9402
3 E B -2.5482
4 T B -1.9176
5 R B -2.3814
6 Y B -0.5384
7 N B -0.9769
8 A B -0.1075
9 T B 0.1300
10 V B 0.4988
11 Q B -1.1797
12 E B -2.4532
13 Q B -2.7561
14 Q B -2.4089
15 T B -1.5401
16 L B -1.1053
17 S B -1.1873
18 N B -2.1825
19 P B -1.9879
20 K B -2.2585
21 A B -1.5181
22 V B -0.5343
23 G B -0.8653
24 P B -1.2309
25 D B -2.0399
26 I B -1.9778
27 D B -3.4757
28 K B -3.6507
29 L B 0.0000
30 K B -3.0940
31 D B -3.9227
32 K B -2.3376
33 F B 0.0000
34 K B -2.4905
35 E B -2.4633
36 G B -1.1585
37 S B -0.4926
38 I B 1.5691
39 P B 0.5191
40 L B 0.5738
41 Q B -1.1987
42 T B -0.6880
43 D B 0.0000
44 F B 0.0000
45 N B -1.4145
46 E B -1.0753
47 L B 0.0000
48 I B 0.0000
49 D B -1.0521
50 I B 0.0000
51 A B 0.0000
52 D B 0.0000
53 I B 0.0000
54 G B 0.0000
55 R B 0.0000
56 K B -1.1147
57 A B 0.0000
58 C B 0.0000
59 G B 0.0000
60 Q B -1.2732
61 A B 0.0000
62 P B -1.3674
63 Q B -2.1087
64 Q B -2.1012
65 N B -2.3143
66 G B 0.0000
67 P B -1.2705
68 G B 0.0000
69 E B -2.0499
70 G B 0.0000
71 L B 0.0000
72 K B -1.6164
73 L B 0.0000
74 A B -1.6099
75 D B -2.4129
76 D B -2.3051
77 G B -1.5171
78 T B 0.0000
79 L B 0.0000
80 N B -1.0320
81 L B 0.0000
82 K B -1.3722
83 I B -0.2696
84 G B -0.3361
85 T B -0.3202
86 F B -0.7523
87 S B -0.9069
88 N B -2.0022
89 K B -2.7921
90 D B -2.9921
91 F B -1.3721
92 S B 0.0000
93 P B 0.0105
94 L B 0.0000
95 I B 0.1186
96 L B -0.5910
97 K B -1.4186
98 D B -2.4239
99 D B -2.7957
100 V B -1.0982
101 L B 0.0000
102 S B 0.0000
103 V B 0.0000
104 D B -1.1021
105 L B 0.0000
106 G B 0.0000
107 S B -1.0183
108 G B 0.0000
109 L B 0.0000
110 T B -1.3658
111 N B -1.7308
112 E B -1.7626
113 T B -1.2446
114 N B -1.9070
115 G B 0.0000
116 I B 0.0000
117 C B 0.0000
118 V B 0.0000
119 G B 0.0000
120 Q B -1.6658
121 G B -1.2711
122 D B -1.6195
123 G B 0.0000
124 I B 0.0000
125 T B -1.0385
126 V B -0.7155
127 N B -0.9910
128 T B -0.8500
129 S B -1.1512
130 N B -1.1172
131 V B 0.0000
132 A B 0.0000
133 V B 0.0000
134 K B -1.3770
135 Q B -1.6898
136 G B -1.4496
137 N B -1.7017
138 G B 0.0000
139 I B 0.0000
140 S B -0.8889
141 V B -0.9526
142 T B -0.7419
143 S B -0.9743
144 S B -0.6367
145 G B -1.0314
146 G B 0.0000
147 V B 0.0000
148 A B -1.3035
149 V B 0.0000
150 K B -0.9289
151 V B -0.5048
152 S B 0.0000
153 A B -1.0307
154 N B -2.4025
155 K B -2.0592
156 G B 0.0000
157 L B 0.0000
158 S B -0.9252
159 V B -1.0888
160 D B -2.1452
161 S B -1.6437
162 S B -1.0485
163 G B 0.0000
164 V B 0.0000
165 A B -0.8655
166 V B 0.0000
167 K B -1.6982
168 V B -1.1031
169 N B -1.8470
170 T B -2.0275
171 D B -3.2507
172 K B -2.5388
173 G B 0.0000
174 I B 0.0000
175 S B -1.0829
176 V B -1.7518
177 D B -2.9665
178 G B -2.4399
179 N B -2.6644
180 G B 0.0000
181 V B 0.0000
182 A B -1.1131
183 V B 0.0000
184 K B -1.3140
185 V B -0.6457
186 N B -1.0733
187 T B -0.8820
188 S B -1.4204
189 K B -1.4826
190 G B 0.0000
191 I B 0.0000
192 S B -0.4564
193 V B 0.0000
194 D B -2.0443
195 N B -2.4723
196 T B -1.4136
197 G B 0.0000
198 V B 0.0000
199 A B 0.0000
200 V B 0.0000
201 I B -0.1124
202 A B -0.0558
203 N B 0.0000
204 A B -0.5253
205 S B -1.1719
206 K B -1.2569
207 G B 0.0000
208 I B 0.0000
209 S B -0.2437
210 V B -0.3737
211 D B -1.2622
212 G B -1.1211
213 S B -0.7770
214 G B 0.0000
215 V B 0.0000
216 A B 0.0000
217 V B 0.0000
218 I B -0.0312
219 A B -0.1132
220 N B 0.0000
221 T B -0.8746
222 S B -1.5910
223 K B -1.5768
224 G B 0.0000
225 I B 0.0000
226 S B -0.2960
227 V B -0.4138
228 D B -1.3134
229 G B -1.1270
230 S B -0.7994
231 G B 0.0000
232 V B 0.0000
233 A B 0.0000
234 V B 0.0000
235 I B -0.1479
236 A B -0.1209
237 N B 0.0000
238 T B -0.6566
239 S B -1.2781
240 K B -1.3777
241 G B 0.0000
242 I B 0.0000
243 S B -0.3735
244 V B -0.7811
245 D B -2.0727
246 N B -2.1126
247 T B -1.2180
248 G B 0.0000
249 V B 0.0000
250 A B -0.2914
251 V B 0.0000
252 I B -0.0589
253 A B -0.1098
254 N B 0.0000
255 A B -0.5983
256 S B -1.3048
257 K B -1.3904
258 G B 0.0000
259 I B 0.0000
260 S B -0.3712
261 V B -0.6486
262 D B -1.6938
263 G B -1.2957
264 S B -0.8865
265 G B 0.0000
266 V B 0.0000
267 A B 0.0000
268 V B 0.0000
269 I B -0.0948
270 A B -0.2205
271 N B 0.0000
272 T B -0.5752
273 S B -1.1036
274 K B -1.2664
275 G B 0.0000
276 I B 0.0000
277 S B -0.5097
278 V B -0.9172
279 D B -2.2242
280 G B -1.5500
281 S B -1.1301
282 G B 0.0000
283 V B 0.0000
284 A B -0.4156
285 V B 0.0000
286 I B -0.0074
287 A B -0.1819
288 N B 0.0000
289 T B -0.7875
290 S B -1.1872
291 K B -1.7475
292 G B 0.0000
293 I B 0.0000
294 S B -0.7161
295 V B -0.8211
296 D B -1.7614
297 S B -1.1408
298 S B -0.8861
299 G B 0.0000
300 V B 0.0000
301 A B 0.0000
302 V B 0.0000
303 K B -1.3123
304 V B -1.1279
305 K B -1.6771
306 A B -1.2407
307 N B -1.6795
308 G B -1.4459
309 G B 0.0000
310 I B 0.0000
311 K B -2.1568
312 V B -1.5956
313 D B -1.8024
314 A B -1.2772
315 N B -1.7936
316 G B 0.0000
317 V B 0.0000
318 A B 0.0000
319 I B 0.0000
320 D B 0.0000
321 P B -0.7128
322 N B -0.4315
323 N B -0.7565
324 V B 0.0000
325 L B 0.0000
326 P B 0.0000
327 K B -1.2695
328 G B -0.5174
329 V B 0.0000
330 I B 0.0000
331 V B 0.0000
332 M B 0.0000
333 F B 0.0000
334 S B -0.6032
335 G B -0.8253
336 S B -0.8883
337 T B -0.4242
338 A B -0.0658
339 P B -0.3576
340 T B -0.0489
341 G B 0.0162
342 W B 0.0000
343 A B 0.0596
344 L B -0.5593
345 C B 0.0000
346 D B -1.6856
347 G B -1.8978
348 N B -2.4276
349 N B -2.1971
350 G B -1.7422
351 T B -1.2696
352 P B -1.3370
353 N B -1.6639
354 L B 0.0000
355 I B -0.7856
356 D B -0.8201
357 R B -0.5166
358 F B 0.0000
359 I B 0.0000
360 L B 0.0000
361 G B 0.0000
362 G B 0.0000
363 K B -1.9737
364 G B -1.5455
365 T B -1.1692
366 D B -1.7783
367 I B 0.0000
368 N B -1.7161
369 G B 0.0000
370 V B -0.6658
371 S B 0.0000
372 T B -0.2325
373 N B 0.0000
374 T B -0.2646
375 A B -0.3068
376 S B -0.5276
377 G B -0.8892
378 T B -1.1002
379 K B -1.9817
380 N B -1.5340
381 S B -0.9888
382 K B 0.0000
383 L B -0.5290
384 F B 0.0000
385 D B 0.0000
386 F B 0.0000
387 S B -1.5767
388 G B -1.6421
389 P B -1.0646 mutated: GP389B
390 G B -1.2741 mutated: SG390B
391 S B -1.4562 mutated: GS391B
392 G B -1.3911
393 N B -1.6518
394 A B -0.7185
395 V B -0.6007
396 P B -1.1964
397 N B -1.5285
398 L B -1.6359
399 R B -2.4535
400 G B -1.8458
401 D B -1.6533
402 L B -0.9622
403 Q B -1.3026
404 V B 0.1088
405 L B 0.0000
406 A B 0.0000
407 Q B -1.1251
408 K B -1.1210
409 V B -0.4741
410 A B -1.1913
411 R B -2.5404
412 T B -1.7277
413 G B -1.8783
414 G B -1.8652
415 S B -1.4609
416 G B -1.8003
417 G B -2.2021
418 K B -2.9600
419 N B -2.8790
420 K B -2.0074
421 V B -0.8886
422 T B -0.2708
423 V B 0.0000
424 P B 0.0000
425 Y B 0.0000
426 Y B 0.0000
427 I B 0.0000
428 L B 0.0000
429 A B 0.0000
430 F B 0.0000
431 I B 0.0000
432 I B 0.0000
433 K B 0.0000
434 L B 0.8556
1 M C -0.1073
2 N C -1.9477
3 E C -2.5547
4 T C -1.9317
5 R C -2.3994
6 Y C -0.5433
7 N C -0.9774
8 A C -0.1395
9 T C 0.0226
10 V C 0.2904
11 Q C -1.6042
12 E C -2.7323
13 Q C -2.9281
14 Q C -2.5206
15 T C -1.7375
16 L C -1.0164
17 S C -1.1182
18 N C -2.1344
19 P C -1.9516
20 K C -2.2600
21 A C -1.5342
22 V C -0.5314
23 G C -0.8747
24 P C -1.2843
25 D C -2.1304
26 I C -2.0312
27 D C -3.5024
28 K C -3.6778
29 L C 0.0000
30 K C -3.0962
31 D C -3.9025
32 K C -2.3780
33 F C 0.0000
34 K C -2.4609
35 E C -2.4397
36 G C -1.1548
37 S C -0.5258
38 I C 1.5072
39 P C 0.4053
40 L C 0.3519
41 Q C -1.3040
42 T C -0.7452
43 D C 0.0000
44 F C 0.0000
45 N C -1.3425
46 E C -1.0049
47 L C 0.0000
48 I C 0.0000
49 D C -0.8953
50 I C 0.0000
51 A C 0.0000
52 D C 0.0000
53 I C 0.0000
54 G C 0.0000
55 R C 0.0000
56 K C -1.0102
57 A C 0.0000
58 C C 0.0000
59 G C 0.0000
60 Q C -1.2517
61 A C 0.0000
62 P C -1.3497
63 Q C -1.9347
64 Q C -2.0424
65 N C -2.2711
66 G C 0.0000
67 P C -1.2085
68 G C 0.0000
69 E C -1.8647
70 G C 0.0000
71 L C 0.0000
72 K C -1.5703
73 L C 0.0000
74 A C -1.6387
75 D C -2.4042
76 D C -2.4070
77 G C -1.5790
78 T C 0.0000
79 L C 0.0000
80 N C -0.9892
81 L C 0.0000
82 K C -1.3756
83 I C -0.3003
84 G C -0.4712
85 T C -0.4727
86 F C -0.7373
87 S C -0.8184
88 N C -1.9378
89 K C -2.6436
90 D C -2.9186
91 F C -1.3726
92 S C 0.0000
93 P C -0.0394
94 L C 0.0000
95 I C 0.0781
96 L C -0.6709
97 K C -1.5683
98 D C -2.8161
99 D C -2.9946
100 V C -1.0570
101 L C 0.0000
102 S C 0.0000
103 V C 0.0000
104 D C -1.2345
105 L C 0.0000
106 G C -1.3056
107 S C -1.0562
108 G C 0.0000
109 L C 0.0000
110 T C -1.5463
111 N C -1.9420
112 E C -1.8616
113 T C -1.2901
114 N C -1.8613
115 G C 0.0000
116 I C 0.0000
117 C C 0.0000
118 V C 0.0000
119 G C 0.0000
120 Q C -1.7196
121 G C -1.3649
122 D C -1.7974
123 G C 0.0000
124 I C 0.0000
125 T C -1.0811
126 V C -0.7397
127 N C -1.0484
128 T C -0.7344
129 S C -1.1016
130 N C -1.1151
131 V C 0.0000
132 A C 0.0000
133 V C 0.0000
134 K C -1.4032
135 Q C -1.7548
136 G C -1.5918
137 N C -1.9969
138 G C 0.0000
139 I C 0.0000
140 S C -0.8729
141 V C -0.9489
142 T C -0.7317
143 S C -0.9630
144 S C -0.6200
145 G C -0.9062
146 G C 0.0000
147 V C 0.0000
148 A C 0.0000
149 V C 0.0000
150 K C -0.9008
151 V C -0.5543
152 S C 0.0000
153 A C -1.0834
154 N C -2.4893
155 K C -2.2195
156 G C 0.0000
157 L C 0.0000
158 S C -0.9707
159 V C -1.0227
160 D C -2.0616
161 S C -1.5075
162 S C -0.9885
163 G C 0.0000
164 V C 0.0000
165 A C -0.8903
166 V C 0.0000
167 K C -1.7106
168 V C -1.0182
169 N C -1.6381
170 T C -1.7591
171 D C -2.7186
172 K C -2.1636
173 G C 0.0000
174 I C 0.0000
175 S C -0.8906
176 V C -1.4236
177 D C -2.2721
178 G C -2.1207
179 N C -2.5027
180 G C 0.0000
181 V C 0.0000
182 A C 0.0000
183 V C 0.0000
184 K C -1.3057
185 V C -0.6671
186 N C -1.0306
187 T C -0.7965
188 S C -1.3140
189 K C -1.3092
190 G C 0.0000
191 I C 0.0000
192 S C -0.4908
193 V C -1.3183
194 D C -2.5546
195 N C -2.8402
196 T C -1.6473
197 G C 0.0000
198 V C 0.0000
199 A C 0.0000
200 V C 0.0000
201 I C -0.1048
202 A C -0.1898
203 N C 0.0000
204 A C -0.5910
205 S C -1.2848
206 K C -1.3629
207 G C 0.0000
208 I C 0.0000
209 S C -0.4867
210 V C -0.8883
211 D C -2.1022
212 G C -1.5360
213 S C -1.0389
214 G C 0.0000
215 V C 0.0000
216 A C 0.0000
217 V C 0.0000
218 I C -0.1200
219 A C -0.2621
220 N C -0.9626
221 T C -0.9261
222 S C -1.5655
223 K C -1.5054
224 G C 0.0000
225 I C 0.0000
226 S C -0.6175
227 V C -0.7291
228 D C -1.7981
229 G C -1.3331
230 S C -0.9609
231 G C 0.0000
232 V C 0.0000
233 A C 0.0000
234 V C 0.0000
235 I C -0.1386
236 A C -0.1518
237 N C 0.0000
238 T C -0.6491
239 S C -1.2947
240 K C -1.2672
241 G C 0.0000
242 I C 0.0000
243 S C -0.4045
244 V C -0.8156
245 D C -2.1221
246 N C -2.1119
247 T C -1.2348
248 G C 0.0000
249 V C 0.0000
250 A C -0.3146
251 V C 0.0000
252 I C -0.0550
253 A C -0.1461
254 N C 0.0000
255 A C -0.5325
256 S C -1.1764
257 K C -1.2691
258 G C 0.0000
259 I C 0.0000
260 S C -0.4456
261 V C -0.7761
262 D C -2.0096
263 G C -1.4629
264 S C -1.0096
265 G C 0.0000
266 V C 0.0000
267 A C 0.0000
268 V C 0.0000
269 I C -0.0556
270 A C -0.2117
271 N C 0.0000
272 T C -0.5565
273 S C -1.0762
274 K C -1.2350
275 G C 0.0000
276 I C 0.0000
277 S C -0.5058
278 V C -0.9038
279 D C -2.2184
280 G C -1.5472
281 S C -1.1303
282 G C 0.0000
283 V C 0.0000
284 A C -0.4254
285 V C 0.0000
286 I C -0.0039
287 A C -0.1838
288 N C 0.0000
289 T C -0.7951
290 S C -1.1968
291 K C -1.7480
292 G C 0.0000
293 I C 0.0000
294 S C -0.7328
295 V C -0.8042
296 D C -1.7477
297 S C -1.1261
298 S C -0.8605
299 G C 0.0000
300 V C 0.0000
301 A C 0.0000
302 V C 0.0000
303 K C -1.3825
304 V C -1.1829
305 K C -1.7131
306 A C -1.2858
307 N C -1.7032
308 G C -1.4581
309 G C 0.0000
310 I C 0.0000
311 K C -2.1860
312 V C -1.6546
313 D C -1.8364
314 A C -1.2781
315 N C -1.8059
316 G C 0.0000
317 V C 0.0000
318 A C 0.0000
319 I C 0.0000
320 D C 0.0000
321 P C -0.7036
322 N C -0.4080
323 N C -0.7672
324 V C 0.0000
325 L C 0.0000
326 P C 0.0000
327 K C -1.2687
328 G C -0.5009
329 V C 0.0000
330 I C 0.0000
331 V C 0.0000
332 M C 0.0000
333 F C -0.1384
334 S C -0.5133
335 G C -0.7836
336 S C -0.8789
337 T C -0.4122
338 A C -0.0370
339 P C -0.3286
340 T C -0.0404
341 G C -0.1191
342 W C 0.0000
343 A C 0.0693
344 L C -0.5294
345 C C 0.0000
346 D C -1.6631
347 G C -1.8892
348 N C -2.4242
349 N C -2.1972
350 G C -1.7413
351 T C -1.2619
352 P C -1.3418
353 N C -1.6499
354 L C 0.0000
355 I C -0.7665
356 D C -0.8101
357 R C -0.5096
358 F C 0.0000
359 I C 0.0000
360 L C 0.0000
361 G C 0.0000
362 G C 0.0000
363 K C -1.8157
364 G C -1.4757
365 T C -1.1398
366 D C -1.7463
367 I C 0.0000
368 N C -1.7699
369 G C 0.0000
370 V C -0.6907
371 S C 0.0000
372 T C -0.2399
373 N C 0.0000
374 T C -0.2546
375 A C -0.2872
376 S C -0.5144
377 G C -0.9182
378 T C -1.2105
379 K C -2.1062
380 N C -1.7508
381 S C -1.0996
382 K C 0.0000
383 L C -0.4870
384 F C 0.0000
385 D C 0.0000
386 F C 0.0000
387 S C -1.5621
388 G C -1.5996
389 P C -1.0738 mutated: GP389C
390 G C -1.4222 mutated: SG390C
391 S C -1.5178 mutated: GS391C
392 G C -1.4240
393 N C -1.8494
394 A C -0.8058
395 V C -0.7692
396 P C -1.3005
397 N C -1.7148
398 L C 0.0000
399 R C -2.6159
400 G C -1.8859
401 D C -1.8490
402 L C -1.3835
403 Q C -1.7571
404 V C -0.1843
405 L C 0.0000
406 A C 0.0000
407 Q C -1.5998
408 K C -1.4465
409 V C -0.6395
410 A C -1.3083
411 R C -2.5718
412 T C -1.7324
413 G C -1.8567
414 G C -1.7859
415 S C -1.4505
416 G C -1.8026
417 G C -2.1944
418 K C -2.9547
419 N C -2.8111
420 K C -1.9647
421 V C -0.8485
422 T C -0.2600
423 V C 0.0000
424 P C 0.0000
425 Y C 0.0000
426 Y C 0.0000
427 I C 0.0000
428 L C 0.0000
429 A C 0.0000
430 F C 0.0000
431 I C 0.0000
432 I C 0.0000
433 K C 0.0000
434 L C 0.8624
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