Project name: aa2aa5cdaaa16ba

Status: done

Started: 2025-11-16 01:06:53
Settings
Chain sequence(s) A: EVQLVESGGGLVQPGRSLRLSCAASGFTFDDYAMHWVRQAPGKGLEWVSAITWNSGHIDYADSVEGRFTISRDNAKNSLYLQMNSLRAEDTAVYYCAKVSYLSTASSLDYWGQGTLVTVSSASTKGPSVFPLTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSTQTYICNVNHKPSNT
C: EVQLVESGGGLVQPGRSLRLSCAASGFTFDDYAMHWVRQAPGKGLEWVSAITWNSGHIDYADSVEGRFTISRDNAKNSLYLQMNSLRAEDTAVYYCAKVSYLSTASSLDYWGQGTLVTVSSASTKGPSVFPLAPGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVE
B: DIQMTQSPSSLSASVGDRVTITCRASQGIRNYLAWYQQKPGKAPKLLIYAASTLQSGVPSRFSGSGSGTDFTLTISSLQPEDVATYYCQRYNRAPYTFGQGTKVEIKRTVAAPSVFI
E: EVQLVESGGGLVQPGRSLRLSCAASGFTFDDYAMHWVRQAPGKGLEWVSAITWNSGHHIDYADSVEGRFTISRDNAKNSLYLQMNSLRAEDTAVYYCAKVSYLSTASSLDYWGQGTLVTVSSASTKGPKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYS
D: DIQMTQSPSSLSASVGDRVTITCRASQGIRNYLAWYQQKPGKAPKLLIYAASTLQSGVPSRFSGSGSGTDFTLTISSLQPEDVATYYCQRYNRAPYTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR
F: DIQMTQSPSSLSASVGDRVTITCRASQGIRNYLAWYQQKPGKAPKLLIYAASTLQSGVPSRFSGSGSGTDFTLTISSLQPEDVATYYCQRYNRAPYTFGQGTKVEIKRTSVTEQDSKDSTYSLS
H: EVQLVESGGGLVQPGRSLRLSCAASGFTFDDYAMHWVRQAPGKGLEWVSAITWNSGHIDYADSVEGRFTISRDNAKNSLYLQMNSLRAEDTAVYYCAKVSYLSTASSLDYWGQGTLVTVSSASTKGPSVFPLAPGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKV
L: IQMTQSPSSLSASVGDRVTITCRASQGIRNYLAWYQQKPGKAPKLLIYAASTLQSGVPSRFSGSGSGTDFTLTISSLQPEDVATYYCQRYNRAPYTFGQGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNRG
input PDB
Selected Chain(s) A,C,B,E,D,F,H,L
Distance of aggregation 10 Å
FoldX usage Yes
Dynamic mode No
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 all chain(s) selected           (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:01)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:15:49)
[INFO]       Main:     Simulation completed successfully.                                          (00:16:12)
Show buried residues

Minimal score value
-4.0382
Maximal score value
3.7204
Average score
-0.6306
Total score value
-913.7964

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
residue index residue name chain Aggrescan3D score
mutation
2 I L 1.1329
3 Q L -0.8763
4 M L 0.0000
5 T L -1.3902
6 Q L 0.0000
7 S L -0.7741
8 P L -0.5850
9 S L -0.8129
10 S L -0.6514
11 L L -0.3287
12 S L -0.7562
13 A L -1.0083
14 S L -1.2155
15 V L -0.8066
16 G L -1.0138
17 D L -1.8828
18 R L -2.2542
19 V L 0.0000
20 T L -0.6338
21 I L 0.0000
22 T L -0.8543
23 C L 0.0000
24 R L -2.7862
25 A L 0.0000
26 S L -1.2226
27 Q L -1.8715
28 G L -2.1431
29 I L 0.0000
30 R L -2.6424
31 N L -1.5805
32 Y L -0.9379
33 L L 0.0000
34 A L 0.0000
35 W L 0.0000
36 Y L 0.0000
37 Q L 0.0000
38 Q L -1.2539
39 K L -1.7906
40 P L -1.6128
41 G L -1.8416
42 K L -2.5333
43 A L -1.6607
44 P L 0.0000
45 K L -1.6033
46 L L 0.0000
47 L L 0.0000
48 I L 0.0000
49 Y L 0.1111
50 A L -0.3382
51 A L 0.0000
52 S L -0.3082
53 T L -0.0219
54 L L 0.2042
55 Q L -0.3613
56 S L -0.3702
57 G L -0.3349
58 V L 0.0000
59 P L -0.1243
60 S L -0.3625
61 R L 0.0000
62 F L 0.0000
63 S L -0.2202
64 G L -0.2690
65 S L -0.6957
66 G L -1.3584
67 S L -1.5439
68 G L -2.0661
69 T L -2.2216
70 D L -2.3717
71 F L 0.0000
72 T L -0.7391
73 L L 0.0000
74 T L -0.5371
75 I L 0.0000
76 S L -1.1076
77 S L 0.0000
78 L L 0.0000
79 Q L 0.0000
80 P L -1.4606
81 E L -1.5220
82 D L 0.0000
83 V L 0.0000
84 A L 0.0000
85 T L -0.7757
86 Y L 0.0000
87 Y L 0.0000
88 C L 0.0000
89 Q L 0.0000
90 R L 0.0000
91 Y L 0.0000
92 N L -1.6476
93 R L -2.0733
94 A L -0.7301
95 P L -0.6677
96 Y L 0.0000
97 T L -0.4251
98 F L 0.0000
99 G L 0.0000
100 Q L -1.8933
101 G L 0.0000
102 T L 0.0000
103 K L -1.1714
104 V L 0.0000
105 E L -0.9925
106 I L 0.0000
107 K L -1.5377
108 R L -1.1286
109 T L -0.2037
110 V L 0.1056
111 A L -0.0144
112 A L -0.2003
113 P L 0.0000
114 S L -0.1373
115 V L 0.0000
116 F L 0.0156
117 I L 0.0213
118 F L 0.0000
119 P L -0.7494
120 P L 0.0000
121 S L -1.6188
122 D L -2.9157
123 E L -2.9275
124 Q L 0.0000
125 L L -2.2493
126 K L -2.8179
127 S L -1.8021
128 G L -1.2758
129 T L -0.9154
130 A L 0.0000
131 S L 0.0000
132 V L 0.0000
133 V L 0.0000
134 C L 0.0000
135 L L 0.0000
136 L L 0.0000
137 N L 0.0000
138 N L -0.9657
139 F L 0.0000
140 Y L -1.0302
141 P L -1.4482
142 R L -2.3635
143 E L -2.9619
144 A L -2.1513
145 K L -2.1392
146 V L -0.9243
147 Q L -0.3853
148 W L 0.0000
149 K L -0.5615
150 V L 0.0000
151 D L -2.1114
152 N L -1.6595
153 A L -0.3730
154 L L 0.7078
155 Q L -0.4276
156 S L -0.6993
157 G L -1.3478
158 N L -1.7566
159 S L -1.4251
160 Q L -1.3061
161 E L -1.3290
162 S L -0.6609
163 V L -0.4767
164 T L -1.0165
165 E L -2.1705
166 Q L 0.0000
167 D L -2.0994
168 S L -2.1278
169 K L -2.6497
170 D L -2.4064
171 S L 0.0000
172 T L 0.0000
173 Y L 0.0000
174 S L 0.0000
175 L L 0.0000
176 S L 0.0000
177 S L 0.0000
178 T L -0.6840
179 L L 0.0000
180 T L -0.5778
181 L L -0.6943
182 S L -1.1291
183 K L -2.3761
184 A L -1.9506
185 D L -2.6882
186 Y L 0.0000
187 E L -4.0382
188 K L -3.8144
189 H L -3.6204
190 K L -3.8261
191 V L -2.0420
192 Y L 0.0000
193 A L 0.0000
194 C L 0.0000
195 E L -0.5590
196 V L 0.0000
197 T L -1.0958
198 H L 0.0000
199 Q L -1.7412
200 G L -0.5282
201 L L -0.2866
202 S L -0.4796
203 S L -0.4038
204 P L -0.4379
205 V L 0.1047
206 T L -0.4314
207 K L -0.8039
208 S L -0.6709
209 F L -1.2396
210 N L -2.6030
211 R L -3.4459
212 G L -3.4930
1 E H -1.5104
2 V H -0.0969
3 Q H -0.5399
4 L H 0.0000
5 V H 0.6912
6 E H 0.0000
7 S H -0.3764
8 G H -1.0185
9 G H -0.5892
10 G H -0.3609
11 L H 0.0032
12 V H 0.0000
13 Q H -1.1231
14 P H -1.0893
15 G H 0.0000
16 R H -1.5941
17 S H 0.0000
18 L H -1.3786
19 R H -2.2409
20 L H 0.0000
21 S H -0.5739
22 C H 0.0000
23 A H -0.2368
24 A H 0.0000
25 S H -0.3896
26 G H -0.5822
27 F H -0.4700
28 T H -1.0703
29 F H 0.0000
30 D H -2.9324
31 D H -1.7233
32 Y H -0.2084
33 A H 0.0000
34 M H 0.0000
35 H H 0.0000
36 W H 0.0000
37 V H 0.0000
38 R H 0.0000
39 Q H -0.7991
40 A H -1.2527
41 P H -1.1986
42 G H -1.4842
43 K H -2.3893
44 G H -1.6976
45 L H 0.0000
46 E H -1.2587
47 W H 0.0000
48 V H 0.0000
49 S H 0.0000
50 A H 0.0000
51 I H 0.0000
52 T H -0.6809
53 W H -1.0384
54 N H -1.9994
55 S H -1.1278
56 G H -1.1700
57 H H -1.0813
58 I H -0.0456
59 D H -0.8532
60 Y H -0.9028
61 A H -1.5262
62 D H -2.5059
63 S H -1.5863
64 V H 0.0000
65 E H -2.7173
66 G H -1.8044
67 R H -1.2214
68 F H 0.0000
69 T H -0.7459
70 I H 0.0000
71 S H -0.4517
72 R H -1.2811
73 D H -1.9617
74 N H -2.2599
75 A H -1.5828
76 K H -2.4039
77 N H -2.0052
78 S H 0.0000
79 L H 0.0000
80 Y H 0.0000
81 L H 0.0000
82 Q H -1.4255
83 M H 0.0000
84 N H -1.3397
85 S H 0.0000
86 L H 0.0000
87 R H -1.7335
88 A H -1.4076
89 E H -2.1133
90 D H 0.0000
91 T H -0.7761
92 A H 0.0000
93 V H 0.2638
94 Y H 0.0000
95 Y H 0.0000
96 C H 0.0000
97 A H 0.0000
98 K H 0.0000
99 V H 0.0000
100 S H 0.8743
101 Y H 1.8510
102 L H 1.9895
103 S H 0.9838
104 T H 0.1466
105 A H -0.0832
106 S H 0.0000
107 S H 0.0000
108 L H 0.0000
109 D H -0.3594
110 Y H -0.1598
111 W H 0.0000
112 G H 0.0000
113 Q H -1.3283
114 G H 0.0000
115 T H -0.0705
116 L H 0.0545
117 V H 0.0000
118 T H -0.3710
119 V H 0.0000
120 S H -0.6381
121 S H -0.4433
122 A H -0.4524
123 S H -0.6965
124 T H -1.0908
125 K H -1.9430
126 G H -1.8492
127 P H -0.8957
128 S H -0.4908
129 V H 0.0000
130 F H 0.0000
131 P H -0.6822
132 L H 0.0000
133 A H 0.0528
134 P H -0.0381
142 G H -0.6113
143 T H -0.4406
144 A H 0.0000
145 A H 0.0000
146 L H 0.0000
147 G H 0.0000
148 C H 0.0000
149 L H 0.0000
150 V H 0.0000
151 K H 0.0000
152 D H -0.6502
153 Y H 0.0000
154 F H 0.0000
155 P H 0.0000
156 E H -0.4974
157 P H -0.7302
158 V H -0.7280
159 T H -0.4193
160 V H -0.4113
161 S H -0.4345
162 W H 0.0000
163 N H -0.8096
164 S H -0.7006
165 G H -0.5451
166 A H -0.2835
167 L H 0.0109
168 T H -0.1208
169 S H -0.1425
170 G H -0.0917
171 V H 0.2683
172 H H -0.0751
173 T H 0.0349
174 F H 0.0000
175 P H -0.1773
176 A H 0.3379
177 V H 0.6285
178 L H 1.3556
179 Q H 0.3301
180 S H -0.0580
181 S H -0.2376
182 G H 0.0237
183 L H -0.0170
184 Y H 0.4264
185 S H 0.0000
186 L H 0.0000
187 S H 0.0000
188 S H 0.0000
189 V H 0.0000
190 V H 0.0000
191 T H -0.0669
192 V H 0.0000
193 P H -0.3715
194 S H -0.4049
195 S H -0.3955
196 S H 0.0000
197 L H 0.1485
198 G H -0.3409
199 T H -0.2868
200 Q H -0.3221
201 T H -0.3445
202 Y H 0.0000
203 I H -0.9783
204 C H 0.0000
205 N H -1.6484
206 V H 0.0000
207 N H -2.0287
208 H H 0.0000
209 K H -2.8223
210 P H -1.7245
211 S H -2.0527
212 N H -2.7250
213 T H -2.0318
214 K H -2.7348
215 V H -1.7573
216 D H -2.6514
217 K H -1.9204
218 K H -1.9736
219 V H -0.4417
1 D B -2.3101
2 I B 0.0000
3 Q B -2.3771
4 M B 0.0000
5 T B -1.5273
6 Q B 0.0000
7 S B -0.8032
8 P B -0.6375
9 S B -0.8965
10 S B -0.9770
11 L B -0.8614
12 S B -1.2403
13 A B -1.1707
14 S B -0.9721
15 V B 0.3465
16 G B -0.4876
17 D B -1.2984
18 R B -2.0521
19 V B -0.9991
20 T B -0.5534
21 I B 0.0000
22 T B -0.7334
23 C B 0.0000
24 R B -2.6874
25 A B 0.0000
26 S B -2.0521
27 Q B -2.3845
28 G B -1.8734
29 I B 0.0000
30 R B -2.5133
31 N B -1.6228
32 Y B -0.7433
33 L B 0.0000
34 A B 0.0000
35 W B 0.0000
36 Y B 0.0000
37 Q B 0.0000
38 Q B 0.0000
39 K B -2.0213
40 P B -1.4897
41 G B -1.9430
42 K B -2.7272
43 A B -1.7187
44 P B 0.0000
45 K B -1.4858
46 L B 0.0000
47 L B 0.0000
48 I B 0.0000
49 Y B 0.1529
50 A B -0.3077
51 A B 0.0000
52 S B -0.3263
53 T B 0.0100
54 L B 0.2101
55 Q B -0.3618
56 S B -0.4481
57 G B -0.6097
58 V B 0.0000
59 P B -0.5352
60 S B -0.5479
61 R B -0.8248
62 F B 0.0000
63 S B -0.3601
64 G B -0.2723
65 S B -0.7187
66 G B -1.3553
67 S B -1.5241
68 G B -1.9386
69 T B -2.0432
70 D B -2.1694
71 F B 0.0000
72 T B -0.6521
73 L B 0.0000
74 T B -0.5980
75 I B 0.0000
76 S B -1.2112
77 S B -0.9279
78 L B 0.0000
79 Q B -0.6670
80 P B -1.0374
81 E B -2.0683
82 D B 0.0000
83 V B -0.8961
84 A B 0.0000
85 T B 0.0000
86 Y B 0.0000
87 Y B 0.0000
88 C B 0.0000
89 Q B 0.0000
90 R B 0.0000
91 Y B 0.0000
92 N B -1.3846
93 R B -1.9740
94 A B -0.9889
95 P B -1.0674
96 Y B 0.0000
97 T B -0.7972
98 F B 0.0000
99 G B 0.0000
100 Q B -1.9123
101 G B 0.0000
102 T B 0.0000
103 K B -1.6889
104 V B 0.0000
105 E B -2.1564
106 I B -1.2513
107 K B -2.1712
108 R B -2.0328
109 T B -0.3583
110 V B 1.0742
111 A B 0.5734
112 A B 0.5154
113 P B 0.5350
114 S B 0.9812
115 V B 2.9839
116 F B 3.7204
117 I B 3.5639
1 E A -1.9797
2 V A -0.9150
3 Q A -0.7668
4 L A 0.0000
5 V A 1.2796
6 E A 0.0000
7 S A 0.0180
8 G A -0.6431
9 G A -0.4532
10 G A -0.3902
11 L A -0.2111
12 V A 0.0000
13 Q A -1.2414
14 P A -1.4537
15 G A -1.5449
16 R A -2.0043
17 S A 0.0000
18 L A 0.0000
19 R A -0.7863
20 L A 0.0000
21 S A 0.0572
22 C A 0.0000
23 A A 0.0426
24 A A 0.0000
25 S A -0.6593
26 G A -1.0126
27 F A -0.6394
28 T A -0.8940
29 F A 0.0000
30 D A -2.6670
31 D A -1.2916
32 Y A -0.1641
33 A A 0.0000
34 M A 0.0000
35 H A 0.0000
36 W A 0.0000
37 V A 0.0000
38 R A 0.0000
39 Q A -0.8578
40 A A -1.2315
41 P A -0.9548
42 G A -1.5475
43 K A -2.3917
44 G A -1.7619
45 L A 0.0000
46 E A -1.1650
47 W A 0.0000
48 V A 0.0000
49 S A 0.0000
50 A A 0.0000
51 I A 0.0000
52 T A -0.7259
53 W A -1.0861
54 N A -1.9424
55 S A -1.0586
56 G A -1.1218
57 H A -1.0752
58 I A -0.0772
59 D A -0.9913
60 Y A -1.0388
61 A A -1.5584
62 D A -2.5535
63 S A -1.6936
64 V A 0.0000
65 E A -2.7755
66 G A -1.7964
67 R A -1.0595
68 F A 0.0000
69 T A -0.4182
70 I A 0.0000
71 S A -0.2967
72 R A -1.1334
73 D A -1.7292
74 N A -2.1173
75 A A -1.5116
76 K A -2.3263
77 N A -1.9144
78 S A -1.0066
79 L A 0.0000
80 Y A -0.0760
81 L A 0.0000
82 Q A 0.0000
83 M A 0.0000
84 N A -1.2057
85 S A -1.2602
86 L A 0.0000
87 R A -2.4537
88 A A -1.7422
89 E A -2.2881
90 D A 0.0000
91 T A -0.8013
92 A A 0.0000
93 V A 0.0823
94 Y A 0.0000
95 Y A 0.0000
96 C A 0.0000
97 A A 0.0000
98 K A 0.0000
99 V A 0.0000
100 S A 0.8526
101 Y A 1.6289
102 L A 1.4629
103 S A 0.7245
104 T A 0.0112
105 A A -0.0899
106 S A 0.0000
107 S A 0.0000
108 L A 0.0000
109 D A -0.0153
110 Y A 0.3395
111 W A 0.0000
112 G A 0.0000
113 Q A -1.3507
114 G A 0.0000
115 T A 0.0350
116 L A 0.0839
117 V A 0.0000
118 T A -0.4340
119 V A 0.0000
120 S A -0.5486
121 S A -0.5118
122 A A -0.4507
123 S A -0.6765
124 T A -1.0337
125 K A -2.1427
126 G A -1.7859
127 P A -0.7864
128 S A -0.0756
129 V A 1.0557
130 F A 1.6018
131 P A 1.4809
132 L A 2.3217
143 T A -0.2486
144 A A 0.1121
145 A A 1.0161
146 L A 1.3036
147 G A 0.0000
148 C A 0.0000
149 L A 1.1728
150 V A 0.0000
151 K A -0.5451
152 D A -0.5824
153 Y A 0.0000
154 F A 0.0000
155 P A 0.0000
156 E A -0.6221
157 P A -0.8119
158 V A 0.0000
159 T A -0.9031
160 V A 0.0000
161 S A -0.5260
162 W A 0.0000
163 N A -0.1777
164 S A -0.4475
165 G A -0.7308
166 A A -0.1997
167 L A 0.1325
168 T A -0.1143
169 S A -0.2879
170 G A -0.3268
171 V A 0.2416
172 H A -0.2214
173 T A 0.2352
174 F A 0.9005
175 P A 0.5029
176 A A 1.1494
177 V A 2.2861
178 L A 1.7571
179 Q A 0.1572
180 S A -0.1370
181 S A -0.3277
182 G A 0.1666
183 L A 0.0486
184 Y A 0.7490
185 S A 0.4859
186 L A 0.0000
187 S A 0.6290
188 S A 0.0000
189 V A 0.9139
190 V A 0.0000
191 T A -0.0673
192 V A 0.0000
193 P A -0.5122
194 S A -0.3594
199 T A -0.6319
200 Q A -1.0380
201 T A -0.2264
202 Y A 0.5637
203 I A 1.1674
204 C A 0.6536
205 N A -0.8983
206 V A -0.6252
207 N A -2.1113
208 H A 0.0000
209 K A -2.6434
210 P A -1.8933
211 S A -1.9503
212 N A -2.3835
213 T A -1.4167
1 D D -1.9835
2 I D -1.1032
3 Q D -1.9204
4 M D 0.0000
5 T D -1.5265
6 Q D 0.0000
7 S D 0.0000
8 P D 0.0000
9 S D -1.2843
10 S D -1.0711
11 L D -0.9229
12 S D -1.2218
13 A D -1.3501
14 S D -1.3668
15 V D -0.6543
16 G D -0.9795
17 D D -1.9561
18 R D -2.3671
19 V D 0.0000
20 T D -0.6122
21 I D 0.0000
22 T D -0.8316
23 C D 0.0000
24 R D -2.7871
25 A D 0.0000
26 S D -1.9945
27 Q D -2.4514
28 G D -2.1727
29 I D 0.0000
30 R D -2.7774
31 N D -1.8865
32 Y D -0.8797
33 L D 0.0000
34 A D 0.0000
35 W D 0.0000
36 Y D 0.0000
37 Q D 0.0000
38 Q D 0.0000
39 K D -1.7793
40 P D -1.5622
41 G D -1.7729
42 K D -2.3446
43 A D -1.4693
44 P D 0.0000
45 K D -1.0979
46 L D 0.0000
47 L D 0.0000
48 I D 0.0000
49 Y D 0.0782
50 A D -0.3473
51 A D 0.0000
52 S D -0.3490
53 T D -0.0148
54 L D 0.1399
55 Q D -0.3363
56 S D -0.3801
57 G D -0.3183
58 V D 0.0000
59 P D -0.1053
60 S D -0.1449
61 R D 0.0000
62 F D 0.0000
63 S D -0.2592
64 G D -0.2956
65 S D -0.7813
66 G D -1.3376
67 S D -1.8080
68 G D -2.2474
69 T D -2.4055
70 D D -2.7121
71 F D 0.0000
72 T D -0.7819
73 L D 0.0000
74 T D -0.5425
75 I D 0.0000
76 S D -1.1865
77 S D 0.0000
78 L D 0.0000
79 Q D -0.8386
80 P D -1.9448
81 E D -2.0694
82 D D 0.0000
83 V D 0.0000
84 A D 0.0000
85 T D 0.0000
86 Y D 0.0000
87 Y D 0.0000
88 C D 0.0000
89 Q D 0.0000
90 R D 0.0000
91 Y D 0.0000
92 N D -1.4126
93 R D -1.8986
94 A D -0.9197
95 P D -0.9345
96 Y D 0.0000
97 T D -0.6078
98 F D 0.0000
99 G D 0.0000
100 Q D -1.4866
101 G D 0.0000
102 T D 0.0000
103 K D -2.1099
104 V D 0.0000
105 E D -1.8956
106 I D 0.0000
107 K D -1.8973
108 R D -1.3342
109 T D -0.1799
110 V D 0.3472
111 A D 0.1410
112 A D -0.1241
113 P D 0.0000
114 S D -0.0756
115 V D 0.1047
116 F D 0.2066
117 I D 0.1428
118 F D 0.0000
119 P D -0.7503
120 P D -0.6170
121 S D -1.4499
122 D D -2.7754
123 E D -2.7055
124 Q D 0.0000
125 L D -2.1564
126 K D -2.7581
127 S D -1.8067
128 G D -1.2221
129 T D -0.9650
130 A D 0.0000
131 S D 0.0000
132 V D 0.0000
133 V D 0.0000
134 C D 0.0000
135 L D 0.0000
136 L D 0.0000
137 N D 0.0000
138 N D -1.1805
139 F D 0.0000
140 Y D -1.2026
141 P D -1.6365
142 R D -2.6330
143 E D -2.9940
144 A D -2.0971
145 K D -1.8541
146 V D -1.0025
147 Q D -0.3076
148 W D 0.0000
149 K D -0.5283
150 V D 0.0000
151 D D -1.9019
152 N D -1.6027
153 A D -0.3472
154 L D 0.7190
155 Q D -0.4180
156 S D -0.7083
157 G D -1.3918
158 N D -1.7966
159 S D -1.6391
160 Q D -1.7278
161 E D -2.0366
162 S D -0.9258
163 V D -0.9011
164 T D -1.2250
165 E D -2.3546
166 Q D 0.0000
167 D D -2.5247
168 S D -2.5288
169 K D -3.1138
170 D D -3.1156
171 S D 0.0000
172 T D 0.0000
173 Y D 0.0000
174 S D 0.0000
175 L D 0.0000
176 S D 0.0000
177 S D 0.0000
178 T D -0.8387
179 L D 0.0000
180 T D -0.5782
181 L D -0.8258
182 S D -1.0033
183 K D -2.0352
184 A D -1.7728
185 D D -2.4914
186 Y D 0.0000
187 E D -3.7563
188 K D -3.6971
189 H D -3.3240
190 K D -3.7392
191 V D -2.0739
192 Y D 0.0000
193 A D 0.0000
194 C D 0.0000
195 E D -0.4384
196 V D 0.0000
197 T D -1.0023
198 H D 0.0000
199 Q D -1.6816
200 G D -0.4431
201 L D -0.2494
202 S D -0.4703
203 S D -0.4175
204 P D -0.4438
205 V D 0.0601
206 T D -0.3750
207 K D -0.7131
208 S D -0.8398
209 F D -1.2573
210 N D -2.9002
211 R D -3.6011
1 E C -2.1629
2 V C -1.3740
3 Q C -1.2892
4 L C 0.0000
5 V C 1.1987
6 E C 0.0000
7 S C -0.1365
8 G C -0.8579
9 G C -0.5301
10 G C -0.3270
11 L C -0.0982
12 V C 0.0000
13 Q C -1.8519
14 P C -1.9066
15 G C -2.1279
16 R C -2.7561
17 S C -2.1728
18 L C -1.5742
19 R C -2.1425
20 L C 0.0000
21 S C -0.3470
22 C C 0.0000
23 A C 0.0128
24 A C 0.0000
25 S C -0.8009
26 G C -1.3806
27 F C -0.7869
28 T C -0.7010
29 F C 0.0000
30 D C -2.0410
31 D C -1.0257
32 Y C 0.0353
33 A C 0.0000
34 M C 0.0000
35 H C 0.0000
36 W C 0.0000
37 V C 0.0000
38 R C 0.0000
39 Q C -0.7880
40 A C -1.2227
41 P C -0.9490
42 G C -1.4975
43 K C -2.3334
44 G C -1.6010
45 L C 0.0000
46 E C -1.1020
47 W C 0.0000
48 V C 0.0000
49 S C 0.0000
50 A C 0.0000
51 I C 0.0000
52 T C 0.0000
53 W C -0.9246
54 N C -1.8471
55 S C -1.1042
56 G C -1.1740
57 H C -1.1389
58 I C -0.1827
59 D C -1.1187
60 Y C -1.1073
61 A C 0.0000
62 D C -2.5394
63 S C -1.7768
64 V C 0.0000
65 E C -2.8295
66 G C -1.8820
67 R C -1.5335
68 F C 0.0000
69 T C -0.9220
70 I C 0.0000
71 S C -0.3731
72 R C -1.0575
73 D C -1.6061
74 N C -1.8733
75 A C -1.3631
76 K C -2.2013
77 N C -1.6846
78 S C 0.0000
79 L C 0.0000
80 Y C -0.5933
81 L C 0.0000
82 Q C -1.4067
83 M C 0.0000
84 N C -2.1113
85 S C -1.8409
86 L C 0.0000
87 R C -2.8734
88 A C -1.8527
89 E C -2.3472
90 D C 0.0000
91 T C -0.8376
92 A C 0.0000
93 V C 0.1855
94 Y C 0.0000
95 Y C 0.0000
96 C C 0.0000
97 A C 0.0000
98 K C 0.0000
99 V C 0.0000
100 S C 0.0000
101 Y C 1.7193
102 L C 1.6225
103 S C 0.8443
104 T C 0.0809
105 A C -0.0218
106 S C 0.0000
107 S C 0.0000
108 L C 0.0000
109 D C -0.0939
110 Y C 0.0775
111 W C 0.0000
112 G C 0.0000
113 Q C -1.3182
114 G C 0.0000
115 T C 0.0068
116 L C 0.0018
117 V C 0.0000
118 T C -0.5176
119 V C 0.0000
120 S C -0.6953
121 S C -0.5492
122 A C -0.4354
123 S C -0.6353
124 T C -0.8494
125 K C -1.6465
126 G C -1.6394
127 P C -0.7427
128 S C -0.4912
129 V C 0.0000
130 F C 0.0000
131 P C -1.0648
132 L C 0.0000
133 A C -0.7885
134 P C -0.4728
142 G C -0.5950
143 T C -0.4218
144 A C -0.1696
145 A C 0.0000
146 L C 0.0000
147 G C 0.0000
148 C C 0.0000
149 L C 0.0000
150 V C 0.0000
151 K C 0.0000
152 D C -0.5040
153 Y C 0.0000
154 F C 0.0000
155 P C 0.0000
156 E C -0.4683
157 P C -0.7036
158 V C -0.7261
159 T C -0.6431
160 V C 0.0000
161 S C -0.4304
162 W C 0.0000
163 N C -0.6001
164 S C -0.6474
165 G C -0.6080
166 A C -0.2957
167 L C -0.0189
168 T C -0.1897
169 S C -0.1810
170 G C -0.1133
171 V C 0.1904
172 H C -0.1098
173 T C -0.0456
174 F C 0.0000
175 P C -0.3226
176 A C 0.2416
177 V C 0.4858
178 L C 1.2877
179 Q C 0.3335
180 S C -0.0181
181 S C -0.1969
182 G C 0.0673
183 L C 0.0665
184 Y C 0.4919
185 S C 0.0000
186 L C 0.0000
187 S C 0.0000
188 S C 0.0000
189 V C 0.0000
190 V C 0.0000
191 T C -0.0874
192 V C 0.0000
193 P C -0.3390
194 S C -0.3669
195 S C -0.4224
196 S C 0.0000
197 L C -0.2432
198 G C -0.6233
199 T C -0.3548
200 Q C -0.5368
201 T C -0.7018
202 Y C 0.0000
203 I C -0.9154
204 C C 0.0000
205 N C -1.3236
206 V C 0.0000
207 N C -1.8749
208 H C 0.0000
209 K C -2.7713
210 P C -1.7197
211 S C -1.9513
212 N C -2.6184
213 T C -1.9797
214 K C -2.5709
215 V C -1.3442
216 D C -2.0977
217 K C -1.8783
218 K C -2.1748
219 V C 0.0000
220 E C -2.1897
1 D F -1.9004
2 I F -1.0677
3 Q F -1.2039
4 M F 0.0000
5 T F -0.9688
6 Q F 0.0000
7 S F -0.5438
8 P F -0.4859
9 S F -0.8817
10 S F -0.9210
11 L F -0.7626
12 S F -1.2125
13 A F 0.0000
14 S F -1.0001
15 V F -0.0545
16 G F -0.5657
17 D F -1.3057
18 R F -1.9888
19 V F -0.7915
20 T F -0.3829
21 I F 0.0000
22 T F -0.7353
23 C F 0.0000
24 R F -1.9974
25 A F 0.0000
26 S F -1.3166
27 Q F -1.8155
28 G F -1.8579
29 I F 0.0000
30 R F -2.5470
31 N F -1.4887
32 Y F -0.7402
33 L F 0.0000
34 A F 0.0000
35 W F 0.0000
36 Y F 0.0000
37 Q F 0.0000
38 Q F 0.0000
39 K F -2.4537
40 P F -1.7822
41 G F -1.6487
42 K F -2.4955
43 A F -1.7924
44 P F 0.0000
45 K F -1.9836
46 L F 0.0000
47 L F 0.0000
48 I F 0.0000
49 Y F 0.1751
50 A F -0.2343
51 A F 0.0000
52 S F -0.2407
53 T F 0.0348
54 L F 0.2443
55 Q F -0.3461
56 S F -0.3781
57 G F -0.5090
58 V F -0.2110
59 P F -0.3538
60 S F -0.4182
61 R F -0.7195
62 F F 0.0000
63 S F -0.2809
64 G F -0.2687
65 S F -0.8080
66 G F -1.5482
67 S F -1.8877
68 G F -2.0854
69 T F -2.1963
70 D F -2.8222
71 F F 0.0000
72 T F -0.7894
73 L F 0.0000
74 T F -0.4610
75 I F 0.0000
76 S F -1.2667
77 S F -0.9681
78 L F 0.0000
79 Q F -1.0580
80 P F -1.7580
81 E F -2.5602
82 D F 0.0000
83 V F 0.0000
84 A F 0.0000
85 T F -1.1442
86 Y F 0.0000
87 Y F 0.0000
88 C F 0.0000
89 Q F 0.0000
90 R F 0.0000
91 Y F 0.0000
92 N F -1.5333
93 R F -2.0767
94 A F 0.0000
95 P F -1.1611
96 Y F 0.0000
97 T F -0.5677
98 F F 0.0000
99 G F 0.0000
100 Q F -1.6866
101 G F -1.3415
102 T F 0.0000
103 K F -1.8207
104 V F 0.0000
105 E F -2.0579
106 I F 0.0000
107 K F -2.5997
108 R F -2.7110
109 T F -1.3452
162 S F 1.4738
163 V F 2.4594
164 T F 0.7935
165 E F -1.0038
166 Q F -1.1064
167 D F -1.8963
168 S F -2.4439
169 K F -2.7609
170 D F -1.9720
171 S F -2.2715
172 T F -1.0719
173 Y F 1.0630
174 S F 1.4303
175 L F 2.3317
176 S F 1.1114
1 E E -2.1842
2 V E -1.3236
3 Q E -1.3127
4 L E 0.0000
5 V E 1.0368
6 E E 0.0992
7 S E -0.2703
8 G E -0.8960
9 G E -0.4958
10 G E -0.1079
11 L E -0.0574
12 V E 0.0000
13 Q E -1.9859
14 P E -2.0340
15 G E -2.2588
16 R E -2.8766
17 S E -2.1268
18 L E -1.5063
19 R E -1.9274
20 L E 0.0000
21 S E -0.3893
22 C E 0.0000
23 A E -0.1870
24 A E 0.0000
25 S E -0.8853
26 G E -1.3084
27 F E -0.8227
28 T E -1.0070
29 F E 0.0000
30 D E -2.8225
31 D E -1.4591
32 Y E -0.1582
33 A E 0.0000
34 M E 0.0000
35 H E 0.0000
36 W E 0.0000
37 V E 0.0000
38 R E 0.0000
39 Q E -0.8298
40 A E -1.2174
41 P E -1.0173
42 G E -1.5092
43 K E -2.4110
44 G E -1.7520
45 L E 0.0000
46 E E -1.2274
47 W E 0.0000
48 V E 0.0000
49 S E 0.0000
50 A E 0.0000
51 I E 0.0000
52 T E 0.0000
53 W E -0.9686
54 N E -1.9953
55 S E -1.1614
56 G E -1.1985
57 H E -1.2180
58 I E -0.2600
59 D E -1.0454
60 Y E -0.9087
61 A E -1.4286
62 D E -2.5045
63 S E -1.6859
64 V E 0.0000
65 E E -2.7342
66 G E -1.8114
67 R E -1.3879
68 F E 0.0000
69 T E -0.8765
70 I E 0.0000
71 S E -0.4260
72 R E -1.1617
73 D E -1.7444
74 N E -2.1876
75 A E -1.5358
76 K E -2.3779
77 N E -2.0321
78 S E 0.0000
79 L E 0.0000
80 Y E -0.5837
81 L E 0.0000
82 Q E -1.5959
83 M E 0.0000
84 N E -2.2453
85 S E -1.7850
86 L E 0.0000
87 R E -2.5009
88 A E -1.6923
89 E E -2.2348
90 D E 0.0000
91 T E -0.8186
92 A E 0.0000
93 V E 0.1898
94 Y E 0.0000
95 Y E 0.0000
96 C E 0.0000
97 A E 0.0000
98 K E 0.0000
99 V E 0.0000
100 S E 0.0000
101 Y E 1.8845
102 L E 1.9998
103 S E 1.0214
104 T E 0.2401
105 A E -0.0933
106 S E 0.0000
107 S E 0.0000
108 L E 0.0000
109 D E -0.1831
110 Y E -0.1704
111 W E 0.0000
112 G E 0.0000
113 Q E -1.3465
114 G E -0.5746
115 T E -0.1016
116 L E -0.0400
117 V E 0.0000
118 T E 0.0000
119 V E 0.0000
120 S E -0.6353
121 S E -0.6584
122 A E -0.5539
123 S E -0.7968
124 T E -1.1056
125 K E -2.2013
126 G E -1.8316
127 P E -1.6228
151 K E -2.0669
152 D E -2.0393
153 Y E 0.0000
154 F E 0.0000
155 P E -0.6824
156 E E -0.5150
157 P E 0.0838
158 V E 0.9829
159 T E 1.2867
160 V E 2.1602
161 S E 1.0555
162 W E 1.1066
163 N E -0.4881
164 S E -0.3804
165 G E -0.4693
166 A E 0.0637
167 L E 0.8723
168 T E 0.2323
169 S E -0.1006
170 G E -0.3643
171 V E 0.2039
172 H E -0.1114
173 T E 0.6080
174 F E 1.5835
175 P E 1.1011
176 A E 1.1643
177 V E 1.8535
178 L E 1.7862
179 Q E 0.4360
180 S E 0.1323
181 S E -0.2463
182 G E -0.2387
183 L E -0.5922
184 Y E 0.0907
185 S E -0.2313
Download PDB file
View in 3Dmol
Play the video

Laboratory of Theory of Biopolymers 2018