Analysis of pair 2lv1A_6lniA

2lv1A vs 6lniA

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] 2lv1A vs. 6lniA (unaligned) — interactive
[missing] 2lv1A vs. 6lniA (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--0.590.280.60.280.240.130.21---
000--0.360.260.350.250.00.020.0003; 003; 002; 002; 004; 004; 005; 005; 006; 0060.52; 0.52; 0.50; 0.50; 0.48; 0.48; 0.47; 0.47; 0.46; 0.450.31; 0.31; 0.29; 0.28; 0.27; 0.27; 0.24; 0.25; 0.29; 0.28
001--0.610.340.60.280.150.090.13001; 001; 004; 004; 003; 003; 008; 008; 005; 0020.59; 0.59; 0.56; 0.56; 0.46; 0.46; 0.33; 0.33; 0.29; 0.280.32; 0.32; 0.28; 0.26; 0.27; 0.27; 0.27; 0.27; 0.26; 0.26
002--0.250.260.330.220.00.00.0001; 001; 002; 002; 004; 003; 004; 003; 005; 0050.57; 0.57; 0.54; 0.54; 0.51; 0.51; 0.51; 0.51; 0.47; 0.470.28; 0.26; 0.27; 0.28; 0.25; 0.27; 0.26; 0.28; 0.24; 0.27

Aligned per-residue ΔΔG

aln_posaa1aa2E1E2dEdiff
1G-0.75--
2A-1.08--
3M-3.34--
4D-5.06--
5P--0.54--
6G-1.26--
7Q-3.72--
8G--0.62--
9G--0.09--
10G--0.47--
11T-2.71--
12H-4.8--
13S-0.63--
14Q-2.0--
15W-4.83--
16N-3.12--
17K-3.33--
18P--2.81--
19S-0.75--
20K-1.9--
21P--2.74--
22K-1.49--
23T-1.54--
24N-2.44--
25M-4.16--
26K-619.59--
27H-183.7--
28M-300.97--
29A-224.92--
30G-338.25--
31A-500.81--
32A-1295.17--
33A-1949.48--
34A-4363.2--
35G-3063.27--
36A-7754.65--
37V-29272.18--
38V-33167.82--
39G-22554.04--
40G-17999.71--
41L-49229.92--
42G-18391.04--
43G-28992.96--
44Y-73369.53--
45M-65407.71--
46L-58667.28--
47G-31615.99--
48S-40859.57--
49A-37911.18--
50M-65125.18--
51S-41842.66--
52R-62749.91--
53P-53304.25--
54I-59446.3--
55I-60226.76--
56H-46556.59--
57F-70418.3--
58G-29767.09--
59S-42232.33--
60D-40945.8--
61Y-71611.51--
62E-60442.52--
63D-49648.96--
64R-67774.24--
65Y-67150.2--
66Y-73663.72--
67R-74620.99--
68E-53726.46--
69N-51588.55--
70M-68379.49--
71H-54584.0--
72R-73357.31--
73Y-74210.68--
74P-54185.05--
75N-57241.73--
76Q-66936.86--
77V-52898.14--
78Y-72756.52--
79Y-71936.36--
80R-50966.73--
81P-43899.7--
82M-46557.67--
83D-9568.08--
84E-29723.56--
85Y-15020.48--
86SS25586.763.5525583.21
87NN43135.571.3243134.25
88QQ56800.951.6956799.26
89NN53319.154.5353314.62
90NN54878.013.9654874.05
91FF70517.570.3170517.26
92VV52072.141.2852070.85
93HH66597.664.0566593.61
94DD49861.833.4949858.34
95CC55262.954.2355258.73
96VV52731.51-0.4852731.99
97NN60492.131.5360490.6
98II60432.10.2160431.89
99TT50136.790.6950136.11
100II58996.670.5758996.1
101KK65804.442.1965802.25
102QQ63748.09-0.5963748.68
103HH68372.014.4268367.59
104TT50557.791.3650556.43
105VV52414.91.4452413.46
106TT48755.841.4548754.39
107TT48405.350.7948404.55
108TT46101.352.5646098.79
109TT46016.315.7246010.58
110KK59900.03.759896.3
111GG27155.040.5127154.53
112EE58225.943.3558222.59
113NN56922.32.4856919.82
114FF69555.174.2969550.88
115TT49928.388.1949920.18
116EE56854.098.156845.99
117TT50495.135.8850489.24
118DD55811.832.2855809.55
119V-52587.42--
120K-65769.14--
121M-70121.59--
122M-70871.8--
123E-62001.39--
124R-74097.61--
125VV53727.725.3753722.35
126I-60210.28--
127E-60164.18--
128Q-65991.75--
129M-69631.03--
130C-54370.18--
131I-59157.82--
132T-49716.26--
133Q-66547.47--
134Y-70666.41--
135E-58896.58--
136R-69957.25--
137E-54742.85--
138S-37343.77--
139Q-51561.63--
140A-34323.3--
141Y-38995.77--
142Y-42324.45--
143Q-45524.44--
144R-44214.85--
145G-12492.28--
146S-6277.96--
147S-2948.25--
148G-0.66--
149A-1.29--
150M-4.03--
151D-3.68--
152P--0.79--
153G-2.09--
154Q-2.07--
155G-0.21--
156G-3.6--
157G-9.45--
158T-29.15--
159H-272.21--
160S-2.21--
161Q-1521.31--
162W-4.73--
163N-1.95--
164K-9.45--
165P--3.03--
166S-1.0--
167K-1.52--
168P--2.75--
169K-0.0--
170T-2.05--
171N-1.23--
172M-6.51--
173KK24.5811.3213.26
174H-573.93--
175M-672.37--
176A-1207.87--
177G-382.59--
178A-546.42--
179A-625.07--
180A-1318.7--
181A-3713.62--
182G-3851.45--
183A-12391.0--
184V-22544.25--
185V-44033.47--
186G-8195.85--
187G-15047.27--
188L-48737.84--
189G-17083.29--
190G-28713.72--
191Y-73145.19--
192MM64311.955.8364306.12
193L-58303.45--
194G-30830.58--
195S-41571.39--
196A-37852.4--
197MM66795.754.7766790.98
198S-41658.43--
199R-65534.09--
200P-54010.03--
201I-58440.73--
202I-59873.36--
203H-56393.43--
204F-65064.03--
205G-30767.82--
206S-40691.78--
207D-47049.36--
208Y-73923.25--
209E-59977.03--
210D-51544.32--
211R-72563.39--
212Y-74663.61--
213Y-75660.88--
214R-69277.27--
215EE54788.4411.3654777.08
216N-59833.42--
217M-67450.88--
218H-60064.41--
219R-78378.88--
220Y-74738.13--
221P-53022.05--
222N-58879.59--
223Q-67048.45--
224V-53778.82--
225Y-72988.16--
226Y-73654.35--
227RR50832.6712.2450820.43
228P-50125.59--
229M-46044.46--
230D-10339.39--
231E-29105.48--
232Y-23236.84--
233S-27446.45--
234N-38998.99--
235Q-54779.91--
236N-53789.58--
237N-55336.86--
238F-69921.14--
239V-52371.5--
240H-65343.71--
241D-47106.05--
242C-55629.42--
243V-52010.2--
244N-57637.41--
245I-59487.06--
246T-51124.76--
247I-59283.81--
248K-66062.77--
249Q-64142.75--
250H-66993.99--
251T-50780.31--
252V-51977.89--
253T-43068.84--
254T-45621.89--
255T-49021.14--
256T-38535.08--
257K-53043.99--
258G-30421.76--
259E-49834.52--
260N-53349.23--
261F-69192.65--
262T-49825.44--
263E-58610.51--
264T-49782.71--
265D-55030.15--
266VV52983.543.2952980.24
267K-63419.99--
268M-70384.46--
269M-70580.3--
270E-57058.5--
271R-74947.24--
272VV54379.190.6554378.54
273I-59902.76--
274EE59316.014.7259311.29
275QQ67309.13.3867305.73
276MM69082.338.9469073.4
277CC54534.87.7754527.03
278II59892.639.5559883.07
279TT50355.153.650351.55
280QQ66702.984.366698.68
281YY69685.184.9769680.21
282EE56059.06.5856052.42
283RR63004.926.6162998.31
284EE51005.484.9151000.57
285SS39891.951.6939890.26
286QQ46682.051.5246680.53
287AA21821.04-1.7321822.77
288YY45322.470.8445321.63
289YY53197.18-0.3653197.54
290Q-27718.83--
291R-17283.96--
292G-9417.55--
293S-5383.31--
294S-1288.44--
295G-1.03--
296A-1.53--
297M-7.77--
298D-6.11--
299P--2.67--
300G-2.76--
301Q-1.79--
302G--0.71--
303G--0.11--
304G--0.11--
305T-11.21--
306H-0.65--
307S--0.44--
308QQ1.221.41-0.19
309W-3.66--
310N-1.67--
311K-3.65--
312P--2.48--
313S--0.59--
314K-1.96--
315P--2.4--
316K-1.07--
317T-274.56--
318N-10.78--
319M-8.73--
320K-4.61--
321H-1.04--
322M-62.78--
323A-0.86--
324G-0.49--
325A-43.27--
326A-8.13--
327A-1409.98--
328A-3414.18--
329G-6122.22--
330A-18545.29--
331V-27135.71--
332V-38007.72--
333G-3844.37--
334G-10300.58--
335L-39809.88--
336G-15790.03--
337G-29118.65--
338Y-70338.82--
339M-65057.77--
340L-58455.09--
341G-30710.35--
342S-38165.42--
343A-37838.09--
344M-62184.7--
345S-43925.86--
346RR57406.878.5257398.35
347P-54861.71--
348I-55813.68--
349I-60025.47--
350H-47525.31--
351F-70160.39--
352GG29933.782.4829931.3
353S-42382.34--
354D-40935.26--
355Y-75220.63--
356E-60329.15--
357D-46832.71--
358R-72774.59--
359Y-73369.7--
360Y-75274.98--
361R-67090.04--
362E-57346.51--
363N-59379.09--
364M-66632.54--
365H-63548.64--
366R-78154.26--
367Y-75347.68--
368P-54619.35--
369N-55016.29--
370Q-65836.1--
371V-52280.36--
372Y-73523.03--
373Y-73557.4--
374R-46754.88--
375P-50454.44--
376M-39691.42--
377D-36776.78--
378E-19360.06--
379Y-30860.9--
380SS24549.813.7624546.05
381NN40640.761.4440639.31
382QQ53230.210.353229.91
383NN54697.534.2454693.29
384NN53786.213.753782.51
385FF68843.83-1.6768845.5
386VV53563.150.3253562.82
387HH63902.13.2463898.86
388DD46150.164.4546145.71
389CC54182.584.0754178.51
390VV53415.0-1.3153416.31
391NN60261.050.960260.14
392II59541.33-1.3459542.68
393TT50690.66-0.1850690.85
394II60110.85-1.6260112.47
395KK66656.291.9466654.35
396QQ63284.39-1.5563285.94
397HH67289.63.3867286.23
398TT51269.770.4151269.36
399VV49950.22-0.8849951.1
400TT45778.520.6545777.87
401TT49560.090.0749560.02
402TT46960.211.6446958.57
403TT40395.65.3540390.25
404KK55807.394.5555802.84
405GG29019.020.2929018.73
406EE57344.752.657342.14
407NN56160.612.2756158.35
408FF69032.562.1569030.41
409TT50482.457.1250475.33
410EE58961.646.9558954.69
411TT50947.545.7850941.76
412DD54245.712.754243.0
413V-53010.95--
414K-67091.43--
415M-71186.65--
416M-70786.43--
417E-60888.52--
418R-66864.83--
419VV53858.423.7853854.63
420I-60049.55--
421E-60625.98--
422Q-66139.41--
423M-69467.61--
424C-55271.98--
425I-57834.44--
426T-49651.35--
427Q-66699.3--
428Y-69573.2--
429E-56867.5--
430R-68178.41--
431E-54512.55--
432S-40473.32--
433Q-42585.04--
434A-23209.01--
435Y-48949.29--
436Y-53178.93--
437Q-26886.02--
438R-26298.96--
439G-16743.31--
440S-5545.48--
441S-3418.38--
442G--0.02--
443A-1.2--
444M-5.37--
445D-8.61--
446P--0.11--
447G-3.47--
448Q-4.05--
449G-1.01--
450G-0.05--
451G--0.34--
452T-2.04--
453H-5.0--
454S-1.38--
455Q-1.55--
456W-3.63--
457N-2.1--
458K-3.52--
459P--2.75--
460S-1.18--
461K-2.28--
462P--2.81--
463K-1.61--
464T-1.13--
465N-0.62--
466M-7.21--
467KK2.2711.13-8.85
468H-2.14--
469M-1.59--
470A-0.85--
471G-2.54--
472A-5.68--
473A-50.89--
474A-103.69--
475A-2164.58--
476G-1403.59--
477A-6960.0--
478V-25743.56--
479V-31035.78--
480G-21344.71--
481G-16482.63--
482L-43319.51--
483G-3602.57--
484G-26128.43--
485Y-71483.72--
486MM63400.824.2463396.58
487L-59667.27--
488G-31407.65--
489S-42530.52--
490A-37555.07--
491MM66521.263.5566517.7
492S-42610.38--
493R-54760.35--
494P-53463.41--
495I-57122.38--
496I-60616.78--
497H-48987.09--
498F-69920.88--
499G-30946.51--
500S-41779.54--
501D-48386.6--
502Y-71015.68--
503E-61531.28--
504D-50642.22--
505R-71410.02--
506Y-72143.28--
507Y-75679.58--
508R-71897.29--
509EE56519.811.9856507.82
510N-59163.05--
511M-69027.09--
512H-64487.73--
513R-72157.63--
514Y-75716.68--
515P-54537.23--
516N-57662.42--
517Q-67517.09--
518V-53571.32--
519Y-73047.52--
520Y-73108.74--
521RR50118.6513.2350105.43
522P-49812.34--
523M-46433.32--
524D-33295.51--
525E-21846.49--
526Y-20758.49--
527S-29967.88--
528N-44899.36--
529Q-52143.85--
530N-54929.89--
531N-53979.7--
532F-69902.35--
533V-53662.23--
534H-66150.93--
535D-46413.07--
536C-55121.31--
537V-53340.41--
538N-60092.05--
539I-59908.58--
540T-51557.19--
541I-59759.38--
542K-66852.64--
543Q-63854.95--
544H-68048.53--
545T-49102.01--
546V-50822.14--
547T-48891.1--
548T-47732.01--
549T-44433.07--
550T-39547.63--
551K-51968.5--
552G-24715.27--
553E-52748.98--
554N-56032.8--
555F-70129.43--
556T-48488.84--
557E-57467.77--
558T-49198.55--
559D-54526.04--
560VV53412.431.253411.24
561K-65074.73--
562M-69731.95--
563M-71257.67--
564E-61838.85--
565R-72298.41--
566VV54537.83-2.3254540.15
567I-59483.73--
568EE60318.864.4760314.39
569QQ68435.761.5168434.24
570MM70393.615.6470387.97
571CC54537.986.054531.97
572II59353.237.9359345.3
573TT51201.753.651198.15
574QQ65277.782.3765275.41
575YY66518.854.8166514.05
576EE59742.017.859734.22
577RR68393.97.3368386.56
578EE50445.934.7450441.2
579SS39915.531.6139913.92
580QQ42097.521.0242096.5
581AA29018.22-2.5329020.75
582YY51524.59-1.9951526.57
583YY32492.01-2.1432494.15
584Q-28124.39--
585R-39855.59--
586G-14462.17--
587S-20753.19--
588S-10538.68--
589G--1.02--
590A-1.19--
591M-8.58--
592D--0.32--
593P--2.45--
594G-0.05--
595Q-0.08--
596G--6.2--
597G--2.72--
598G--0.36--
599T-1.08--
600H-4.27--
601S-875.61--
602QQ177.550.18177.37
603W-701.65--
604N-3.72--
605K-45.83--
606P-37.32--
607S-751.16--
608K-5262.77--
609P-1919.97--
610K-334.21--
611T-1.6--
612N-31.09--
613M-1487.44--
614K-174.47--
615H-855.43--
616M-312.62--
617A-5.58--
618G-0.28--
619A-35.16--
620A-167.63--
621A-2942.53--
622A-5610.14--
623G-3375.26--
624A-3066.36--
625V-21039.29--
626V-31854.13--
627G-21169.8--
628G-17853.22--
629L-48350.95--
630G-14372.55--
631G-28520.24--
632Y-68636.39--
633M-62492.54--
634L-56107.88--
635G-31585.91--
636S-38162.16--
637A-36093.66--
638M-65688.16--
639S-43295.0--
640RR59456.828.0759448.75
641P-55144.25--
642I-57405.55--
643I-60726.93--
644H-56512.76--
645F-67599.87--
646GG29365.283.3729361.91
647S-40228.79--
648D-41843.86--
649Y-71306.45--
650E-57345.75--
651D-43617.29--
652R-67817.38--
653Y-71600.37--
654Y-73940.17--
655R-66876.48--
656E-53709.1--
657N-57641.49--
658M-67664.05--
659H-58464.66--
660R-74010.41--
661Y-75360.25--
662P-53453.52--
663N-52405.53--
664Q-63867.98--
665V-52144.88--
666Y-72424.61--
667Y-68549.35--
668R-50140.06--
669P-44181.05--
670M-34857.02--
671D-29314.82--
672E-31304.03--
673Y-26049.1--
674SS14175.933.8614172.08
675NN40893.461.4440892.02
676QQ58284.230.2558283.98
677NN51821.014.2651816.75
678NN50344.823.7650341.06
679FF69749.69-1.669751.28
680VV50746.930.4650746.46
681HH65546.853.4165543.44
682DD47877.654.5347873.12
683CC55403.84.6155399.19
684VV52659.38-1.3752660.75
685NN60238.160.8660237.3
686II60506.78-1.4260508.2
687TT50498.22-0.2350498.45
688II59548.12-1.4459549.55
689KK66094.441.9766092.47
690QQ63442.77-1.4963444.26
691HH63545.83.4463542.36
692TT48798.380.3748798.01
693VV50705.4-0.9250706.32
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