Project name: 3QWO

Chain sequence(s)	A: QVTLRESGPALVKPTQTLTLTCTFSGFSLSTAGMSVGWIRQPPGKALEWLADIWWDDKKHYNPSLKDRLTISKDTSKNQVVLKVTNMDPADTATYYCARDMIFNFYFDVWGQGTTVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEP; C: SYNDEKKLASNEIANLPNLNEEQRSAFLSSINDDPSQSANLLAEAKKLNDAQA; B: DIQMTQSPSTLSASVGDRVTITCSASSRVGYMHWYQQKPGKAPKLLIYDTSKLASGVPSRFSGSGSGTEFTLTISSLQPDDFATYYCFQGSGYPFTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR; H: QVTLRESGPALVKPTQTLTLTCTFSGFSLSTAGMSVGWIRQPPGKALEWLADIWWDDKKHYNPSLKDRLTISKDTSKNQVVLKVTNMDPADTATYYCARDMIFNFYFDVWGQGTTVTVSSASTKGPSVFPLAPSSKSTSGGTAALGCLVKDYFPEPVTVSWNSGALTSGVHTFPAVLQSSGLYSLSSVVTVPSSSLGTQTYICNVNHKPSNTKVDKKVEP; L: DIQMTQSPSTLSASVGDRVTITCSASSRVGYMHWYQQKPGKAPKLLIYDTSKLASGVPSRFSGSGSGTEFTLTISSLQPDDFATYYCFQGSGYPFTFGGGTKVEIKRTVAAPSVFIFPPSDEQLKSGTASVVCLLNNFYPREAKVQWKVDNALQSGNSQESVTEQDSKDSTYSLSSTLTLSKADYEKHKVYACEVTHQGLSSPVTKSFNR; P: SYNDEKKLASNEIANLPNLNEEQRSAFLSSINDDPSQSANLLAEAKKLNDAQA
Selected Chain(s)	A,C,B,H,L,P
Distance of aggregation	10 Å
FoldX usage	Yes
Dynamic mode	No
Automated mutations	No

Simulation log

[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:00)
[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                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:11:01)
[INFO]       Main:     Simulation completed successfully.                                          (00:11:12)

• Minimal score value: -3.9153
• Maximal score value: 1.3568
• Average score: -0.7451
• Total score value: -719.7697

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	D	L	-2.0084
2	I	L	-1.6134
3	Q	L	-1.7200
4	M	L	0.0000
5	T	L	-0.7593
6	Q	L	0.0000
7	S	L	-0.5284
8	P	L	-0.5227
9	S	L	-0.6589
10	T	L	-0.6341
11	L	L	-0.5858
12	S	L	-0.9133
13	A	L	-1.1532
14	S	L	-1.1745
15	V	L	-0.5763
16	G	L	-0.9791
17	D	L	-1.8869
18	R	L	-2.3460
19	V	L	0.0000
20	T	L	-0.6091
21	I	L	0.0000
22	T	L	-0.5793
23	C	L	0.0000
24	S	L	-1.3085
25	A	L	0.0000
26	S	L	-1.4977
27	S	L	-1.8134
29	R	L	-2.3848
30	V	L	0.0000
31	G	L	-1.2303
32	Y	L	-0.6043
33	M	L	0.0000
34	H	L	0.0000
35	W	L	0.0000
36	Y	L	0.0000
37	Q	L	0.0000
38	Q	L	-1.1803
39	K	L	-1.6480
40	P	L	-1.4259
41	G	L	-1.7611
42	K	L	-2.5052
43	A	L	-1.6505
44	P	L	0.0000
45	K	L	-1.3323
46	L	L	0.0000
47	L	L	0.0000
48	I	L	0.0000
49	Y	L	0.0000
50	D	L	-0.5550
51	T	L	-0.5343
52	S	L	-0.5342
53	K	L	-0.4192
54	L	L	0.1124
55	A	L	0.0000
56	S	L	-0.3493
57	G	L	-0.0534
58	V	L	-0.0844
59	P	L	-0.0949
60	S	L	-0.2115
61	R	L	-0.6982
62	F	L	0.0000
63	S	L	-0.3408
64	G	L	0.0000
65	S	L	-0.8321
66	G	L	-1.1505
67	S	L	-1.3392
68	G	L	-1.6305
69	T	L	-1.8140
70	E	L	-2.1981
71	F	L	0.0000
72	T	L	-0.6653
73	L	L	0.0000
74	T	L	-0.6037
75	I	L	0.0000
76	S	L	-1.2931
77	S	L	-1.1730
78	L	L	0.0000
79	Q	L	-1.2020
80	P	L	-1.7468
81	D	L	-1.8983
82	D	L	0.0000
83	F	L	0.0000
84	A	L	0.0000
85	T	L	-0.6721
86	Y	L	0.0000
87	Y	L	0.0000
88	C	L	0.0000
89	F	L	0.0000
90	Q	L	0.0000
91	G	L	0.0000
92	S	L	0.0000
93	G	L	0.0024
94	Y	L	0.1073
95	P	L	0.0000
96	F	L	0.0000
97	T	L	-0.6302
98	F	L	0.0000
99	G	L	0.0000
100	G	L	-1.1228
101	G	L	0.0000
102	T	L	0.0000
103	K	L	-1.2185
104	V	L	0.0000
105	E	L	-1.3342
106	I	L	0.0000
107	K	L	-1.6982
108	R	L	-1.0835
109	T	L	-0.1519
110	V	L	0.3300
111	A	L	0.1827
112	A	L	-0.0725
113	P	L	0.0000
114	S	L	-0.1372
115	V	L	0.0000
116	F	L	0.0000
117	I	L	0.0000
118	F	L	0.0000
119	P	L	-0.8812
120	P	L	0.0000
121	S	L	-1.4953
122	D	L	-2.8170
123	E	L	-2.6795
124	Q	L	0.0000
125	L	L	-2.1990
126	K	L	-2.7020
127	S	L	-1.6622
128	G	L	-1.4035
129	T	L	-1.1761
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	-0.8337
139	F	L	0.0000
140	Y	L	-1.1266
141	P	L	-1.7269
142	R	L	-2.8469
143	E	L	-3.2356
144	A	L	-2.3229
145	K	L	-2.2610
146	V	L	-1.0639
147	Q	L	-0.6510
148	W	L	0.0000
149	K	L	-0.5522
150	V	L	0.0000
151	D	L	-1.8021
152	N	L	-1.4619
153	A	L	-0.2407
154	L	L	0.6711
155	Q	L	-0.3034
156	S	L	-0.6950
157	G	L	-1.1834
158	N	L	-1.3821
159	S	L	-1.2982
160	Q	L	-1.2645
161	E	L	-1.4108
162	S	L	-0.6324
163	V	L	-0.4403
164	T	L	-0.9135
165	E	L	-1.9528
166	Q	L	0.0000
167	D	L	-1.9853
168	S	L	-2.1060
169	K	L	-2.6822
170	D	L	-2.0009
171	S	L	0.0000
172	T	L	0.0000
173	Y	L	0.0000
174	S	L	0.0000
175	L	L	-0.4364
176	S	L	0.0000
177	S	L	0.0000
178	T	L	-0.6511
179	L	L	0.0000
180	T	L	-0.5698
181	L	L	-0.7711
182	S	L	-0.9924
183	K	L	-2.0488
184	A	L	-1.8104
185	D	L	-2.3880
186	Y	L	0.0000
187	E	L	-3.8629
188	K	L	-3.7774
189	H	L	-3.2072
190	K	L	-3.6109
191	V	L	-1.8690
192	Y	L	0.0000
193	A	L	-0.7731
194	C	L	0.0000
195	E	L	-0.5992
196	V	L	0.0000
197	T	L	-1.1945
198	H	L	0.0000
199	Q	L	-1.7309
200	G	L	-0.4266
201	L	L	-0.2270
202	S	L	-0.4483
203	S	L	-0.4202
204	P	L	-0.5379
205	V	L	0.1067
206	T	L	-0.3145
207	K	L	-0.5216
208	S	L	-0.8201
209	F	L	0.0000
210	N	L	-2.6191
211	R	L	-3.5144
1	Q	H	-1.4512
2	V	H	-0.6040
3	T	H	-0.8866
4	L	H	0.0000
5	R	H	-2.2616
6	E	H	0.0000
7	S	H	-0.6497
8	G	H	-0.2352
9	P	H	-0.3576
10	A	H	-0.4255
11	L	H	-0.2273
12	V	H	0.0000
13	K	H	-1.7936
14	P	H	-1.7178
15	T	H	-1.7065
16	Q	H	-1.8328
17	T	H	-1.4442
18	L	H	0.0000
19	T	H	-0.5241
20	L	H	0.0000
21	T	H	-0.5192
22	C	H	0.0000
23	T	H	-1.2397
24	F	H	0.0000
25	S	H	-1.0813
26	G	H	-0.8672
27	F	H	-0.3488
28	S	H	-0.4859
29	L	H	0.0000
30	S	H	-0.6503
31	T	H	-0.7060
32	A	H	-0.9135
33	G	H	0.0000
34	M	H	0.0000
35	S	H	0.0000
35A	V	H	0.0000
35B	G	H	0.0000
36	W	H	0.0000
37	I	H	0.0000
38	R	H	0.0000
39	Q	H	-0.8679
40	P	H	-0.9783
41	P	H	-1.0614
42	G	H	-1.4511
43	K	H	-2.1798
44	A	H	-1.2526
45	L	H	0.0000
46	E	H	-0.7423
47	W	H	0.0000
48	L	H	0.0000
49	A	H	0.0000
50	D	H	0.0000
51	I	H	0.0000
52	W	H	0.0000
53	W	H	0.0000
54	D	H	-1.7496
55	D	H	-2.4665
56	K	H	-2.2850
57	K	H	-1.5012
58	H	H	-0.4080
59	Y	H	-0.3949
60	N	H	0.0000
61	P	H	-1.3606
62	S	H	-1.0803
63	L	H	0.0000
64	K	H	-2.7212
65	D	H	-2.7558
66	R	H	-2.1287
67	L	H	0.0000
68	T	H	-0.7475
69	I	H	0.0000
70	S	H	-0.9871
71	K	H	-1.3870
72	D	H	-1.5379
73	T	H	-1.3119
74	S	H	-1.4558
75	K	H	-2.3062
76	N	H	-1.6581
77	Q	H	-1.5411
78	V	H	0.0000
79	V	H	-0.1904
80	L	H	0.0000
81	K	H	-0.9970
82	V	H	0.0000
82A	T	H	-1.8183
82B	N	H	-2.1340
82C	M	H	0.0000
83	D	H	-2.0808
84	P	H	-1.0728
85	A	H	-0.5341
86	D	H	0.0000
87	T	H	-0.3944
88	A	H	0.0000
89	T	H	-0.2660
90	Y	H	0.0000
91	Y	H	0.0000
92	C	H	0.0000
93	A	H	0.0000
94	R	H	0.0000
95	D	H	0.0000
96	M	H	0.0000
97	I	H	0.0000
98	F	H	0.0000
99	N	H	-0.1666
100	F	H	0.0000
100A	Y	H	0.0000
100B	F	H	0.0000
101	D	H	-0.3412
102	V	H	-0.2384
103	W	H	0.0000
104	G	H	0.0000
105	Q	H	-2.0835
106	G	H	0.0000
107	T	H	-0.6675
108	T	H	-0.3448
109	V	H	0.0000
110	T	H	-0.4538
111	V	H	0.0000
112	S	H	-0.7769
113	S	H	-0.6287
114	A	H	-0.5001
115	S	H	-0.6973
116	T	H	-0.8987
117	K	H	-1.8015
118	G	H	-1.8423
119	P	H	-0.9562
120	S	H	-0.4475
121	V	H	0.0000
122	F	H	-0.6294
123	P	H	-1.0193
124	L	H	0.0000
125	A	H	-0.8696
126	P	H	0.0000
127	S	H	-0.7463
128	S	H	-0.6536
129	K	H	-0.9177
130	S	H	0.0000
131	T	H	-0.6384
132	S	H	-0.6658
133	G	H	-0.8612
134	G	H	-1.1494
135	T	H	-0.7673
136	A	H	0.0000
137	A	H	0.0000
138	L	H	0.0000
139	G	H	0.0000
140	C	H	0.0000
141	L	H	0.0000
142	V	H	0.0000
143	K	H	-0.4735
144	D	H	-0.9761
145	Y	H	0.0000
146	F	H	0.0000
147	P	H	0.0000
148	E	H	-0.6129
149	P	H	-0.7054
150	V	H	-0.5444
151	T	H	-0.6487
152	V	H	-0.2375
153	S	H	-0.4473
154	W	H	0.0000
155	N	H	-0.7689
156	S	H	-0.6818
157	G	H	-0.5361
158	A	H	-0.2621
159	L	H	0.0095
160	T	H	-0.1026
161	S	H	-0.2886
162	G	H	-0.2222
163	V	H	0.2591
164	H	H	-0.1990
165	T	H	0.0557
166	F	H	0.0000
167	P	H	-0.1862
168	A	H	0.2898
169	V	H	0.6230
170	L	H	1.1425
171	Q	H	0.1875
172	S	H	-0.0930
173	S	H	-0.3091
174	G	H	-0.0756
175	L	H	-0.1460
176	Y	H	0.2541
177	S	H	0.0000
178	L	H	0.0000
179	S	H	0.0000
180	S	H	0.0000
181	V	H	0.0000
182	V	H	0.0000
183	T	H	-0.1451
184	V	H	0.0000
185	P	H	-1.0334
186	S	H	-0.5351
187	S	H	-0.5210
188	S	H	-0.4825
189	L	H	-0.6846
190	G	H	-0.8938
191	T	H	-0.6051
192	Q	H	-1.0216
193	T	H	-1.0002
194	Y	H	0.0000
195	I	H	-1.2859
196	C	H	0.0000
197	N	H	-1.5656
198	V	H	0.0000
199	N	H	-2.1800
200	H	H	0.0000
201	K	H	-2.8422
202	P	H	-1.6906
203	S	H	-2.0268
204	N	H	-2.6872
205	T	H	-2.2415
206	K	H	-2.8470
207	V	H	-1.6551
208	D	H	-2.5600
209	K	H	-2.1184
210	K	H	-2.3701
211	V	H	0.0000
212	E	H	-2.4001
213	P	H	-1.1893
1	D	B	-2.0079
2	I	B	-1.5371
3	Q	B	-1.6883
4	M	B	0.0000
5	T	B	-0.7489
6	Q	B	0.0000
7	S	B	-0.6022
8	P	B	-0.6047
9	S	B	-0.8311
10	T	B	-0.8159
11	L	B	-0.6012
12	S	B	-0.8253
13	A	B	0.0000
14	S	B	-1.0550
15	V	B	-0.3567
16	G	B	-0.9193
17	D	B	-1.9632
18	R	B	-2.3916
19	V	B	0.0000
20	T	B	-0.5992
21	I	B	0.0000
22	T	B	-0.5702
23	C	B	0.0000
24	S	B	-1.3096
25	A	B	0.0000
26	S	B	-1.5019
27	S	B	-1.8124
29	R	B	-2.3570
30	V	B	0.0000
31	G	B	-1.0204
32	Y	B	-0.4750
33	M	B	0.0000
34	H	B	0.0000
35	W	B	0.0000
36	Y	B	0.0000
37	Q	B	0.0000
38	Q	B	-1.2588
39	K	B	-1.7333
40	P	B	-1.3331
41	G	B	-1.7514
42	K	B	-2.5254
43	A	B	-1.6634
44	P	B	0.0000
45	K	B	-1.5822
46	L	B	0.0000
47	L	B	0.0000
48	I	B	0.0000
49	Y	B	-0.4827
50	D	B	-0.7202
51	T	B	-0.7284
52	S	B	-1.0269
53	K	B	-1.5032
54	L	B	-0.4147
55	A	B	0.0000
56	S	B	-0.4713
57	G	B	-0.4399
58	V	B	-0.2747
59	P	B	-0.3322
60	S	B	-0.4306
61	R	B	-0.8810
62	F	B	0.0000
63	S	B	-0.5831
64	G	B	-0.6116
65	S	B	-0.9365
66	G	B	-1.0609
67	S	B	-1.2726
68	G	B	-1.5435
69	T	B	-1.7990
70	E	B	-2.2062
71	F	B	0.0000
72	T	B	-0.6477
73	L	B	0.0000
74	T	B	-0.6291
75	I	B	0.0000
76	S	B	-1.6036
77	S	B	-1.3760
78	L	B	0.0000
79	Q	B	-1.3182
80	P	B	-1.9824
81	D	B	-2.5190
82	D	B	0.0000
83	F	B	-1.4292
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	F	B	0.0000
90	Q	B	0.0000
91	G	B	0.0000
92	S	B	0.0000
93	G	B	0.0000
94	Y	B	0.1752
95	P	B	0.0000
96	F	B	0.0000
97	T	B	-0.5666
98	F	B	-0.2609
99	G	B	0.0000
100	G	B	-1.1581
101	G	B	0.0000
102	T	B	0.0000
103	K	B	-1.7291
104	V	B	0.0000
105	E	B	-1.4561
106	I	B	0.0000
107	K	B	-1.5816
108	R	B	-1.0120
109	T	B	-0.1588
110	V	B	0.3021
111	A	B	0.1646
112	A	B	-0.0789
113	P	B	0.0000
114	S	B	-0.1976
115	V	B	0.0000
116	F	B	0.0000
117	I	B	0.0000
118	F	B	0.0000
119	P	B	-0.9897
120	P	B	-0.8878
121	S	B	-1.3737
122	D	B	-2.6522
123	E	B	-2.2341
124	Q	B	0.0000
125	L	B	-2.0964
126	K	B	-2.6428
127	S	B	-1.6243
128	G	B	-1.2900
129	T	B	-1.0941
130	A	B	0.0000
131	S	B	0.0000
132	V	B	0.0000
133	V	B	0.0000
134	C	B	0.0000
135	L	B	0.0000
136	L	B	0.0000
137	N	B	0.0000
138	N	B	-0.8219
139	F	B	0.0000
140	Y	B	0.0000
141	P	B	-1.8196
142	R	B	-2.9096
143	E	B	-3.2255
144	A	B	-2.3978
145	K	B	-2.4226
146	V	B	0.0000
147	Q	B	-0.9312
148	W	B	0.0000
149	K	B	-0.7060
150	V	B	0.0000
151	D	B	-2.0585
152	N	B	-1.5815
153	A	B	-0.2989
154	L	B	0.6329
155	Q	B	-0.2240
156	S	B	-0.5063
157	G	B	-1.2631
158	N	B	-1.1676
159	S	B	-1.2493
160	Q	B	-1.4476
161	E	B	-1.9543
162	S	B	-0.9321
163	V	B	-0.8418
164	T	B	-1.0002
165	E	B	-1.9874
166	Q	B	0.0000
167	D	B	-2.0151
168	S	B	-2.3408
169	K	B	-2.7342
170	D	B	-1.9736
171	S	B	0.0000
172	T	B	0.0000
173	Y	B	0.0000
174	S	B	0.0000
175	L	B	0.0000
176	S	B	0.0000
177	S	B	0.0000
178	T	B	-0.7187
179	L	B	0.0000
180	T	B	-0.4471
181	L	B	-0.6441
182	S	B	-1.1040
183	K	B	-1.9977
184	A	B	-1.8716
185	D	B	-2.4426
186	Y	B	0.0000
187	E	B	-3.8436
188	K	B	-3.9153
189	H	B	-3.3625
190	K	B	-3.7624
191	V	B	-2.1251
192	Y	B	0.0000
193	A	B	0.0000
194	C	B	0.0000
195	E	B	-0.9109
196	V	B	0.0000
197	T	B	-1.3280
198	H	B	0.0000
199	Q	B	-1.7356
200	G	B	-0.4072
201	L	B	-0.2212
202	S	B	-0.4605
203	S	B	-0.4542
204	P	B	-0.6433
205	V	B	-0.1032
206	T	B	-0.5399
207	K	B	-0.8697
208	S	B	-1.0607
209	F	B	0.0000
210	N	B	-2.7423
211	R	B	-3.5622
1	Q	A	-1.2059
2	V	A	-0.5342
3	T	A	-0.8350
4	L	A	0.0000
5	R	A	-2.2283
6	E	A	0.0000
7	S	A	-0.6052
8	G	A	-0.1926
9	P	A	-0.3453
10	A	A	-0.4173
11	L	A	-0.2936
12	V	A	0.0000
13	K	A	-2.0000
14	P	A	-1.2841
15	T	A	-1.0983
16	Q	A	-1.4248
17	T	A	-1.0231
18	L	A	0.0000
19	T	A	-0.4468
20	L	A	0.0000
21	T	A	-0.4715
22	C	A	0.0000
23	T	A	-1.1921
24	F	A	0.0000
25	S	A	-0.8756
26	G	A	-0.8312
27	F	A	0.0000
28	S	A	-0.5937
29	L	A	0.0000
30	S	A	-0.6622
31	T	A	-0.6990
32	A	A	-0.8557
33	G	A	0.0000
34	M	A	0.0850
35	S	A	0.0000
35A	V	A	0.0000
35B	G	A	0.0000
36	W	A	0.0000
37	I	A	0.0000
38	R	A	0.0000
39	Q	A	-0.8929
40	P	A	-0.9783
41	P	A	-1.0808
42	G	A	-1.4555
43	K	A	-2.1972
44	A	A	-1.2415
45	L	A	0.0000
46	E	A	-0.7740
47	W	A	0.0000
48	L	A	0.0000
49	A	A	0.0000
50	D	A	0.0000
51	I	A	0.0000
52	W	A	0.0000
53	W	A	0.0000
54	D	A	-1.5401
55	D	A	-2.0899
56	K	A	-1.8145
57	K	A	-1.3152
58	H	A	-0.8591
59	Y	A	-0.8670
60	N	A	-1.1189
61	P	A	-1.4205
62	S	A	-1.0003
63	L	A	0.0000
64	K	A	-2.3994
65	D	A	-2.1131
66	R	A	-1.5966
67	L	A	0.0000
68	T	A	-0.8544
69	I	A	0.0000
70	S	A	-0.8215
71	K	A	-1.2859
72	D	A	-1.5058
73	T	A	-1.4011
74	S	A	-1.4977
75	K	A	-2.3546
76	N	A	-1.8298
77	Q	A	-1.5381
78	V	A	0.0000
79	V	A	-0.1304
80	L	A	0.0000
81	K	A	-0.8398
82	V	A	0.0000
82A	T	A	0.0000
82B	N	A	-1.1119
82C	M	A	0.0000
83	D	A	-1.0635
84	P	A	-0.6029
85	A	A	-0.2641
86	D	A	0.0000
87	T	A	-0.1998
88	A	A	0.0000
89	T	A	-0.2658
90	Y	A	0.0000
91	Y	A	0.0000
92	C	A	0.0000
93	A	A	0.0000
94	R	A	0.0000
95	D	A	0.0000
96	M	A	0.2172
97	I	A	0.0000
98	F	A	0.3614
99	N	A	0.0687
100	F	A	0.0000
100A	Y	A	0.0000
100B	F	A	0.0000
101	D	A	-0.3966
102	V	A	-0.1904
103	W	A	-0.5860
104	G	A	0.0000
105	Q	A	-2.0468
106	G	A	0.0000
107	T	A	-0.6435
108	T	A	-0.3123
109	V	A	0.0000
110	T	A	-0.3787
111	V	A	0.0000
112	S	A	0.0000
113	S	A	-0.9212
114	A	A	-0.7261
115	S	A	-0.8633
116	T	A	-0.7204
117	K	A	-1.0087
118	G	A	-1.2894
119	P	A	-0.5326
120	S	A	-0.2266
121	V	A	-0.1813
122	F	A	-0.4499
123	P	A	-0.9140
124	L	A	0.0000
125	A	A	-0.9601
126	P	A	0.0000
127	S	A	-0.9510
128	S	A	-0.9250
129	K	A	-1.4978
130	S	A	0.0000
131	T	A	-0.7896
132	S	A	-0.7220
133	G	A	-0.8648
134	G	A	-0.9166
135	T	A	-0.6031
136	A	A	0.0000
137	A	A	0.0000
138	L	A	0.0000
139	G	A	0.0000
140	C	A	0.0000
141	L	A	0.0000
142	V	A	0.0000
143	K	A	-0.1831
144	D	A	-0.3304
145	Y	A	0.0000
146	F	A	0.0000
147	P	A	0.0000
148	E	A	-0.6006
149	P	A	-0.6979
150	V	A	-0.6939
151	T	A	-0.6143
152	V	A	-0.3943
153	S	A	-0.4235
154	W	A	0.0000
155	N	A	-0.7448
156	S	A	-0.6654
157	G	A	-0.5441
158	A	A	-0.2273
159	L	A	0.0230
160	T	A	-0.1627
161	S	A	-0.1872
162	G	A	-0.0774
163	V	A	0.1873
164	H	A	-0.2706
165	T	A	-0.1334
166	F	A	0.0000
167	P	A	-0.2765
168	A	A	0.2670
169	V	A	0.5900
170	L	A	1.3568
171	Q	A	0.3296
172	S	A	-0.2429
173	S	A	-0.1347
174	G	A	0.1726
175	L	A	0.2756
176	Y	A	0.5528
177	S	A	0.0000
178	L	A	0.0000
179	S	A	0.0000
180	S	A	0.0000
181	V	A	0.0000
182	V	A	0.0000
183	T	A	-0.1606
184	V	A	0.0000
185	P	A	-0.6284
186	S	A	-0.5741
187	S	A	-0.5373
188	S	A	-0.5315
189	L	A	-0.7937
190	G	A	-1.1285
191	T	A	-0.8631
192	Q	A	-1.1456
193	T	A	-1.1118
194	Y	A	0.0000
195	I	A	-1.2972
196	C	A	0.0000
197	N	A	-1.5037
198	V	A	0.0000
199	N	A	-2.0414
200	H	A	0.0000
201	K	A	-2.8058
202	P	A	-1.5931
203	S	A	-1.8018
204	N	A	-2.5602
205	T	A	-2.1022
206	K	A	-2.7036
207	V	A	-1.5255
208	D	A	-2.5132
209	K	A	-2.0673
210	K	A	-2.5069
211	V	A	0.0000
212	E	A	-2.4859
213	P	A	-1.2393
4	S	C	-0.3898
5	Y	C	0.4117
6	N	C	0.0000
7	D	C	-0.4459
8	E	C	-1.2801
9	K	C	0.0000
10	K	C	0.0000
11	L	C	0.5504
12	A	C	0.0000
13	S	C	0.0000
14	N	C	-0.6239
15	E	C	-1.0527
16	I	C	0.0000
17	A	C	-0.9094
18	N	C	-1.7108
19	L	C	-1.3957
20	P	C	-1.1943
21	N	C	-1.6001
22	L	C	0.0000
23	N	C	-2.7025
24	E	C	-3.3909
25	E	C	-3.1882
26	Q	C	-2.1182
27	R	C	-1.8714
28	S	C	-1.6159
29	A	C	-0.9651
30	F	C	0.0000
31	L	C	0.0000
32	S	C	-1.0349
33	S	C	-1.1537
34	I	C	0.0000
35	N	C	0.0000
36	D	C	-2.3797
37	D	C	-1.8801
38	P	C	0.0000
39	S	C	-1.3076
40	Q	C	-1.8705
41	S	C	-1.3064
42	A	C	-0.9905
43	N	C	-1.9632
44	L	C	0.0000
45	L	C	-1.4016
46	A	C	-1.7573
47	E	C	-2.5980
48	A	C	0.0000
49	K	C	-2.8298
50	K	C	-3.1110
51	L	C	-1.8290
52	N	C	0.0000
53	D	C	-2.7032
54	A	C	-1.5684
55	Q	C	-1.5643
56	A	C	-0.9018
1	S	P	-0.3196
2	Y	P	0.5641
3	N	P	0.0000
4	D	P	-0.4011
5	E	P	-1.0615
6	K	P	0.0000
7	K	P	0.0000
8	L	P	0.3196
9	A	P	0.0000
10	S	P	0.0000
11	N	P	-0.3471
12	E	P	-0.8575
13	I	P	0.0000
14	A	P	0.0000
15	N	P	-1.1834
16	L	P	0.0000
17	P	P	-1.1063
18	N	P	-1.4104
19	L	P	0.0000
20	N	P	-2.6285
21	E	P	-3.3407
22	E	P	-3.1769
23	Q	P	-2.1022
24	R	P	-1.8743
25	S	P	-1.5946
26	A	P	-0.9601
27	F	P	0.0000
28	L	P	0.0000
29	S	P	-1.0941
30	S	P	-1.0374
31	I	P	0.0000
32	N	P	0.0000
33	D	P	-2.3599
34	D	P	-1.6915
35	P	P	0.0000
36	S	P	-1.1653
37	Q	P	-1.6960
38	S	P	-1.2200
39	A	P	-1.1014
40	N	P	-1.8308
41	L	P	-1.5165
42	L	P	-1.3456
43	A	P	-1.7534
44	E	P	-2.6893
45	A	P	0.0000
46	K	P	-2.5295
47	K	P	-3.0709
48	L	P	-1.8933
49	N	P	0.0000
50	D	P	-2.6655
51	A	P	-1.5722
52	Q	P	-1.5932
53	A	P	-0.9322