Analysis of pair 1dzlA_5keqF

1dzlA vs 5keqF

Figure 1: Two structures (Fold1 & Fold2)

Figure 2: Two structures aligned

Missing: Fold1 vs best AF2
Missing: Fold2 vs best AF2
Missing: Fold1 vs best AF3
Missing: Fold2 vs best AF3
Missing: Fold1 vs best ESM2
Missing: Fold2 vs best ESM2
Missing: Fold1 vs best ESM3
Missing: Fold2 vs best ESM3
[missing] 1dzlA vs. 5keqF (unaligned) — interactive
[missing] 1dzlA vs. 5keqF (aligned) — interactive

Figure 3: Deep-MSA contact map panel

Figure 4: Best clusters contact map panel

Figure 5: All clusters contact-map mosaic (small multiples).

Per-cluster contact maps

Figure 6: Aligned per-residue ΔΔG (seq alignment overlay).

Figure 7: Phylogenetic tree with per-cluster heatmap.

Cluster metrics table

clusternneffAF2_TM1AF2_TM2AF3_TM1AF3_TM2RE-MSAT-COMRE-MSAT1RE-MSAT2ESM_SEQIDSESM_TM1_LISTESM_TM2_LIST
Deep--0.920.920.930.920.260.240.25---
000--0.90.870.910.880.00.00.0003; 003; 005; 001; 006; 007; 007; 008; 010; 0050.40; 0.40; 0.25; 0.24; 0.24; 0.24; 0.24; 0.23; 0.23; 0.220.39; 0.37; 0.17; 0.24; 0.24; 0.24; 0.22; 0.23; 0.22; 0.21
001--0.860.830.910.870.00.00.0002; 002; 006; 006; 005; 010; 003; 010; 003; 0050.29; 0.28; 0.26; 0.26; 0.25; 0.25; 0.25; 0.24; 0.24; 0.240.28; 0.27; 0.25; 0.25; 0.24; 0.24; 0.23; 0.25; 0.23; 0.23
002--0.920.880.930.890.00.00.0002; 002; 001; 001; 006; 006; 010; 004; 003; 0040.32; 0.32; 0.26; 0.25; 0.24; 0.23; 0.22; 0.22; 0.22; 0.220.32; 0.32; 0.25; 0.25; 0.24; 0.23; 0.23; 0.22; 0.22; 0.22
003--0.350.340.510.490.00.00.0004; 004; 008; 002; 006; 001; 003; 002; 008; 0050.21; 0.21; 0.19; 0.19; 0.19; 0.18; 0.18; 0.18; 0.18; 0.180.21; 0.20; 0.18; 0.18; 0.18; 0.20; 0.16; 0.19; 0.18; 0.16
004--0.350.340.550.520.00.00.0004; 004; 008; 002; 006; 001; 003; 002; 008; 0050.21; 0.21; 0.19; 0.19; 0.19; 0.18; 0.18; 0.18; 0.18; 0.180.21; 0.20; 0.18; 0.18; 0.18; 0.20; 0.16; 0.19; 0.18; 0.16
005--0.760.730.880.84---002; 010; 010; 002; 008; 008; 009; 009; 007; 0010.29; 0.27; 0.27; 0.26; 0.26; 0.26; 0.24; 0.24; 0.24; 0.230.28; 0.27; 0.27; 0.26; 0.27; 0.27; 0.25; 0.25; 0.23; 0.24

Aligned per-residue ΔΔG

aln_posaa1aa2E1E2dEdiff
1-Y-6.01-
2-L-19.42-
3-P-110.43-
4-P-105.88-
5-V-51.57-
6-P-46.54-
7-V-32.16-
8-S-5.65-
9KK-0.546.82-7.35
10VV5.4620.0-14.55
11VV26.497.1819.31
12SS13.098.874.22
13TT15.2911.623.67
14DD4.643.091.55
15EE5.72.732.98
16YY4.434.63-0.2
17VV4.131.762.37
18AA9.750.79.05
19RR12.457.445.01
20TT8.032.395.64
21NN4.572.32.27
22II5.473.671.8
23YY-2.438.09-10.52
24YY0.84.37-3.57
25HH3.153.17-0.02
26AA-2.4314.83-17.26
27GG-1.20.62-1.82
28TT36.9413.2323.71
29SS12.3611.930.43
30RR14.277.666.61
31LL12.492.3310.16
32LL21.319.8111.5
33AA-0.533.98-4.51
34VV1.5611.78-10.23
35GG-2.68-0.45-2.24
36HH13.5414.46-0.92
37PP-0.012.4-2.41
38YY22.4213.448.98
39FF8.016.541.47
40PP-1.52-1.38-0.15
41II16.7716.82-0.05
42KK16.584.3212.26
43KK40.0417.4422.6
44PP8.0913.36-5.27
45NN8.526.81.72
46NN20.498.5811.91
47NN19.063.0815.98
48KK11.021.519.5
49II33.0310.3822.65
50LL4.218.94-4.73
51VV8.5615.17-6.61
52PP-0.2312.31-12.54
53KK10.996.844.15
54VV8.911.297.62
55SS20.681.3319.34
56GG0.782.4-1.62
57LL9.620.678.95
58QQ13.825.198.64
59YY-1.482.43-3.92
60RR25.657.917.74
61VV9.415.094.32
62FF-1.945.22-7.16
63RR19.111.417.69
64II22.2115.177.04
65HH-1.534.88-6.41
66LL2.616.51-3.9
67PP-4.03-0.28-3.75
68DD4.524.110.41
69PP3.548.15-4.61
70NN5.670.585.08
71KK26.422.923.51
72FF2.656.06-3.42
73GG3.673.110.56
74FF4.0729.9-25.82
75PP8.217.950.25
76DD4.954.790.16
77TT10.6521.0-10.35
78SS5.691.244.45
79FF5.556.8-1.25
80YY7.614.26-6.66
81NN4.971.593.38
82PP-1.512.07-3.58
83DD1.0-0.181.18
84TT7.380.936.46
85QQ25.16.3918.71
86RR8.3812.28-3.89
87LL-2.5410.04-12.59
88VV2.97.47-4.57
89WW-0.82-0.63-0.19
90AA-0.918.67-9.57
91CC3.381.22.18
92VV46.691.4445.25
93GG1.931.760.17
94VV5.652.772.88
95EE28.125.4222.7
96VV0.01-0.730.74
97GG2.076.59-4.51
98RR11.6911.650.04
99GG4.31.642.66
100QQ7.6814.47-6.79
101PP-3.01-0.9-2.11
102LL4.682.362.32
103GG-0.850.98-1.83
104VV2.873.63-0.76
105GG-0.50.34-0.83
106II8.094.094.0
107SS5.714.661.05
108GG12.3-1.5613.87
109HH17.9212.025.91
110PP27.053.7223.33
111LL19.579.0310.54
112LL10.430.739.71
113NN4.041.192.85
114KK16.813.4213.39
115LL21.659.412.26
116DD13.474.618.86
117DD4.631.143.49
118TT5.670.694.98
119EE12.1810.971.22
120NN2.491.570.92
121AA2.612.360.25
122SS8.570.58.07
123AA1.810.71.11
124YY7.864.073.8
125AA1.170.560.6
126AA4.22.461.74
127NN11.122.978.15
128AA2.961.161.8
129GG2.37-0.592.97
130VV18.833.6415.19
131DD12.911.5911.32
132NN5.143.831.31
133RR41.76.8134.89
134EE13.893.010.9
135CC12.124.997.13
136II18.943.1215.82
137SS12.87-0.3613.23
138MM41.61.1840.42
139DD10.974.316.66
140YY8.492.056.44
141KK25.093.2721.81
142QQ7.13.613.49
143TT11.753.038.72
144QQ12.05-0.0112.06
145LL16.861.8914.97
146CC10.970.9210.06
147LL16.01.1314.87
148II27.046.4520.59
149GG-0.414.07-4.48
150CC3.563.050.51
151KK9.2719.06-9.79
152PP-4.48.78-13.18
153PP5.3511.93-6.58
154II9.265.453.81
155GG0.893.75-2.86
156EE3.592.231.36
157HH11.673.218.47
158WW3.158.17-5.02
159GG4.31.472.84
160KK3.161.51.66
161GG2.94-1.023.96
162SS7.7319.73-12.0
163PP3.4718.94-15.46
164CC12.123.478.64
165TT26.634.4422.19
166-N-4.19-
167-V-7.83-
168-A-1.9-
169-V-10.97-
170-N-3.76-
171-P--0.19-
172-G--0.71-
173-D-1.85-
174-C-3.87-
175-P--2.19-
176-P--0.38-
177-L-1.4-
178-E-0.55-
179-L--0.15-
180-I-1.23-
181-N-0.57-
182-T-0.37-
183-V--0.3-
184-I-14.52-
185QQ18.152.5815.56
186-D-3.97-
187-G--1.74-
188-D--0.79-
189-M--0.59-
190VV8.63-0.689.31
191-D-7.18-
192-T-1.32-
193-G--0.29-
194-F-3.49-
195-G--0.64-
196AA4.073.090.98
197-M-7.79-
198-D--0.49-
199-F-4.4-
200-T-3.18-
201-T-4.66-
202-L-1.69-
203-Q-3.48-
204-A-2.36-
205-N-6.92-
206-K-6.42-
207-S-2.38-
208-E-1.01-
209VV30.24.2225.98
210-P-10.02-
211-L-5.25-
212-D-2.17-
213-I-4.13-
214-C-4.13-
215-T-8.37-
216-S-3.46-
217-I-2.72-
218-C--0.46-
219-K-8.38-
220-Y-4.78-
221-P-3.52-
222-D-1.91-
223-Y-5.28-
224-I-7.13-
225-K-10.67-
226-M-1.8-
227-V-6.56-
228-S-3.17-
229-E-6.86-
230-P-37.18-
231-Y-5.81-
232-G-3.11-
233-D-6.01-
234-S-14.35-
235-L-11.93-
236-F-3.11-
237-F-1.44-
238-Y-0.83-
239-L-3.65-
240-R-3.93-
241-R-1.99-
242-E-0.7-
243QQ6.692.054.64
244-M-2.37-
245-F-4.53-
246-V-2.41-
247-R-10.5-
248-H-12.71-
249-L-12.99-
250-F-1.59-
251-N-10.09-
252-R-1.35-
253-A-1.37-
254-G-0.22-
255-A-0.57-
256-V-1.14-
257-G-1.95-
258-E-1.65-
259-N-0.78-
260-V-6.54-
261PP5.560.165.4
262-D-4.44-
263-D-3.97-
264-L-3.41-
265-Y-8.94-
266-I-3.4-
267-K-10.33-
268GG0.99-0.681.68
269-S-3.85-
270-G-0.36-
271-S-0.64-
272-T-5.06-
273-A-1.51-
274-N-2.28-
275-L-4.05-
276-A-0.18-
277-S-4.59-
278-S--0.21-
279-N-1.34-
280-Y-2.73-
281-F-0.23-
282-P--3.52-
283-T-5.4-
284-P--2.82-
285-S-1.96-
286-G-1.7-
287-S-8.4-
288-M-5.92-
289-V-3.99-
290-T-6.1-
291-S-1.49-
292DD6.620.835.79
293-A-3.37-
294-Q-10.82-
295-I-9.99-
296-F-7.26-
297-N--0.95-
298-K-7.21-
299-P-2.83-
300-Y-4.58-
301-W-7.17-
302-L-1.49-
303-Q-9.16-
304-R-4.48-
305-A-1.25-
306-Q-10.16-
307-G-5.54-
308-H-10.92-
309-N-5.28-
310-N-5.14-
311-G--1.24-
312-I--2.36-
313CC5.161.743.42
314-W-6.73-
315-G-0.96-
316-N-6.47-
317-Q-3.02-
318-L-1.63-
319-F-9.15-
320-V-12.1-
321-T-2.15-
322-V-0.83-
323-V-0.39-
324-D--2.02-
325-T--0.27-
326-T-0.97-
327-R-18.89-
328-S-0.65-
329-T-3.26-
330-N-1.8-
331-M-5.6-
332-S--0.17-
333-L-4.47-
334-C-5.66-
335-A-2.98-
336-A--0.05-
337-I-3.57-
338-S-4.12-
339-T-2.03-
340-S-3.5-
341-E-8.47-
342-T-1.04-
343-T-1.59-
344-Y-1.17-
345-K-4.33-
346-N-3.72-
347-T-1.89-
348-N-5.33-
349-F--0.07-
350-K-0.33-
351-E-2.91-
352-Y-7.56-
353-L-2.18-
354-R-1.01-
355-H-9.06-
356-G-5.52-
357-E-10.2-
358-E-2.91-
359-Y-10.22-
360-D-13.84-
361-L-7.08-
362-Q-3.35-
363-F-7.65-
364-I-3.12-
365-F--0.77-
366-Q-21.4-
367-L-0.67-
368-C-1.53-
369-K-4.88-
370-I-3.23-
371-T-1.31-
372-L-3.56-
373-T-9.19-
374-A-5.16-
375-D-9.7-
376-V-3.52-
377-M-8.1-
378-T-16.74-
379-Y-10.4-
380-I-13.13-
381-H-8.75-
382-S-7.22-
383-M-6.68-
384-N-3.26-
385-S-2.19-
386-T-0.68-
387-I-12.17-
388-L-21.57-
389-E-3.78-
390-D-5.17-
391-W-7.77-
392-N-8.65-
393-F-21.12-
394-G-0.92-
395-L-24.17-
396-Q-33.36-
397PP-2.1948.29-50.48
398PP0.1626.06-25.91
399-P-20.52-
400-G-7.02-
401-G-4.42-
402-T-9.66-
403LL3.064.19-1.14
404EE4.2313.63-9.41
405-D-4.8-
406-T-5.78-
407-Y-4.25-
408-R-5.6-
409-F-7.69-
410-V-15.66-
411-T-5.95-
412-S-4.85-
413-Q-16.87-
414-A-4.52-
415-I-10.15-
416-A-11.07-
417-C-16.82-
418-Q-8.72-
419-K-22.67-
420-H-27.52-
421-T-19.68-
422-P-12.48-
423-P--0.31-
424-A-7.36-
425-P-6.41-
426-K-12.05-
427-E-17.06-
428-D-11.44-
429-P--1.86-
430LL2.752.83-0.08
431-K-14.62-
432-K-3.21-
433-Y-2.16-
434-T-2.44-
435-F-7.95-
436-W-5.34-
437-E-7.47-
438-V-5.96-
439-N-1.41-
440-L-12.71-
441-K-1.85-
442-E-1.72-
443-K-9.87-
444-F-10.59-
445-S-1.51-
446-A-4.76-
447-D-4.76-
448-L-3.7-
449-D-3.92-
450-Q-2.7-
451-F-2.57-
452-P-10.37-
453-L-3.54-
454-G-1.31-
455-R-12.12-
456-K-1.19-
457-F-1.73-
458-L-8.99-
459-L-4.42-
460-Q-6.85-
461-A-1.17-
462-G-0.04-
463-L-6.15-
464-K-2.9-
465-A-2.63-
466-K-8.07-
467-P-4.78-
468-K-1.36-
469-F-3.79-
470-T-4.03-
471-L-6.11-
472-G-0.04-
473-K-1.14-
474-R-1.88-
475-V-17.82-
476-S-7.92-
477-K-20.07-
478-V-9.65-
479-V-2.51-
480-S-7.1-
481-T-4.94-
482-D-1.05-
483-E-6.14-
484-Y-3.4-
485-V-1.22-
486-A-0.72-
487-R-2.42-
488-T-1.45-
489-N-2.91-
490II26.392.4623.93
491-Y-4.78-
492-Y-10.3-
493-H-2.67-
494-A-7.22-
495-G--0.73-
496-T-4.42-
497-S-4.7-
498-R-4.08-
499-L-20.88-
500-L-23.28-
501-A-21.71-
502-V-0.17-
503-G-2.07-
504-H-15.95-
505-P-8.02-
506-Y-12.46-
507-F-1.27-
508-P-4.28-
509-I-2.41-
510-K-3.12-
511-K-19.9-
512-P-10.65-
513NN2.627.06-4.44
514-N-15.13-
515-N-3.36-
516-K-2.31-
517-I-6.02-
518-L-5.11-
519-V-4.28-
520-P--2.65-
521-K-8.87-
522-V-8.25-
523-S-3.64-
524-G-2.33-
525-L-1.33-
526-Q-3.38-
527-Y-11.66-
528-R-10.7-
529-V--0.43-
530-F-2.03-
531-R-16.36-
532-I-1.21-
533-H-1.68-
534-L-4.05-
535-P-1.7-
536-D-3.9-
537-P-4.65-
538-N-5.01-
539-K-6.41-
540-F-21.17-
541-G-1.61-
542-F-19.59-
543-P-10.9-
544-D-2.46-
545TT9.053.835.22
546-S-1.02-
547-F-6.55-
548-Y-1.01-
549-N-0.74-
550-P--1.78-
551-D-1.22-
552-T-3.2-
553-Q-6.17-
554-R-3.54-
555-L-3.81-
556VV5.68-0.285.95
557-W-7.59-
558-A--1.36-
559-C-0.51-
560-V--0.08-
561-G-1.91-
562-V-1.94-
563-E-4.91-
564-V--2.59-
565-G-2.88-
566-R-21.97-
567-G-2.53-
568-Q-16.79-
569-P--1.1-
570-L-2.95-
571-G-4.66-
572-V-1.7-
573-G-2.2-
574II25.686.1319.55
575-S-1.84-
576-G--1.47-
577-H-21.15-
578-P-3.6-
579-L-4.27-
580-L--0.27-
581-N-2.79-
582-K-2.54-
583-L-7.86-
584-D-4.38-
585-D-0.79-
586-T-0.01-
587-E--0.51-
588-N-2.29-
589-A-2.4-
590-S-0.33-
591-A--0.07-
592-Y-3.55-
593-A-1.64-
594-A-2.7-
595-N-2.99-
596-A-1.41-
597-G-0.03-
598-V-3.04-
599-D-1.27-
600-N-3.52-
601-R-1.52-
602-E-3.51-
603-C-2.84-
604-I-1.1-
605-S-2.25-
606-M--1.08-
607-D-7.89-
608-Y-2.43-
609-K-1.26-
610QQ14.495.269.23
611-T-1.66-
612-Q-0.34-
613-L--0.84-
614-C-1.01-
615-L-7.29-
616-I--0.49-
617-G--0.99-
618-C-2.57-
619-K-17.47-
620-P-5.98-
621-P-4.66-
622-I--0.44-
623-G--1.63-
624-E-5.77-
625-H-2.85-
626-W-5.38-
627-G--0.05-
628-K-3.76-
629-G-0.12-
630-S-4.9-
631-P-0.88-
632-C-3.12-
633-T-5.06-
634-N-4.25-
635-V-4.0-
636-A-1.07-
637-V-1.93-
638-N-2.24-
639-P--0.47-
640-G--2.13-
641DD8.55-0.088.64
642-C-2.59-
643-P--3.53-
644-P--2.56-
645-L--1.07-
646-E-0.55-
647-L--0.16-
648-I-1.84-
649-N-0.87-
650-T-1.87-
651-V--0.28-
652-I-6.57-
653-Q-1.88-
654-D-3.43-
655GG3.54-1.24.74
656DD0.314.56-4.25
657MM11.94-2.1514.09
658VV7.668.42-0.76
659DD-1.767.02-8.78
660TT3.383.63-0.25
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1936-N-3.25-
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1953-I-0.83-
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1957-D-3.24-
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1965-D-2.94-
1966-T-4.27-
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1977-V-0.54-
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1980-C-0.7-
1981-V-0.8-
1982-G-2.36-
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1992-G-4.04-
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1994-G-1.7-
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1996-S-2.99-
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1998-H-19.57-
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2000-L-4.12-
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2003-K-2.6-
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2009-N-2.09-
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2011-S-0.49-
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2014-A-1.6-
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