Analysis of pair 2jmrA_4j3oF

2jmrA vs 4j3oF

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] 2jmrA vs. 4j3oF (unaligned) — interactive
[missing] 2jmrA vs. 4j3oF (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--0.850.810.850.830.470.410.47---
000--0.60.720.640.770.010.010.02001; 001; 004; 004; 009; 003; 003; 009; 002; 0020.72; 0.72; 0.69; 0.69; 0.68; 0.68; 0.68; 0.68; 0.66; 0.660.83; 0.83; 0.81; 0.81; 0.77; 0.80; 0.80; 0.77; 0.80; 0.80
001--0.640.720.630.720.240.220.26001; 001; 007; 003; 007; 003; 006; 006; 004; 0020.68; 0.68; 0.67; 0.67; 0.67; 0.67; 0.66; 0.66; 0.63; 0.630.81; 0.81; 0.79; 0.80; 0.79; 0.80; 0.82; 0.82; 0.73; 0.74
002--0.690.80.690.80.110.120.13005; 005; 002; 002; 008; 008; 001; 001; 004; 0040.73; 0.72; 0.70; 0.70; 0.69; 0.69; 0.69; 0.69; 0.67; 0.670.79; 0.79; 0.82; 0.82; 0.79; 0.79; 0.81; 0.81; 0.78; 0.78
003--0.660.770.660.750.20.20.24003; 003; 004; 001; 004; 001; 010; 010; 002; 0020.71; 0.71; 0.69; 0.69; 0.69; 0.69; 0.68; 0.68; 0.67; 0.670.80; 0.80; 0.81; 0.81; 0.81; 0.81; 0.76; 0.76; 0.77; 0.77
004--0.850.820.850.820.480.420.47001; 001; 008; 008; 006; 006; 010; 010; 002; 0020.84; 0.84; 0.70; 0.70; 0.67; 0.67; 0.66; 0.66; 0.65; 0.650.81; 0.81; 0.83; 0.83; 0.79; 0.79; 0.81; 0.81; 0.77; 0.77
005--0.720.820.720.830.00.00.0001; 001; 006; 002; 002; 003; 006; 003; 004; 0040.72; 0.72; 0.70; 0.70; 0.70; 0.69; 0.69; 0.69; 0.68; 0.680.81; 0.81; 0.80; 0.83; 0.83; 0.81; 0.80; 0.81; 0.78; 0.78
006--0.650.750.640.730.110.110.13001; 003; 004; 008; 008; 001; 004; 003; 002; 0020.69; 0.69; 0.69; 0.69; 0.69; 0.69; 0.69; 0.69; 0.67; 0.670.80; 0.82; 0.82; 0.80; 0.80; 0.80; 0.82; 0.82; 0.80; 0.80
007--0.680.790.680.780.00.00.0006; 006; 001; 002; 010; 010; 001; 002; 004; 0030.71; 0.71; 0.68; 0.68; 0.68; 0.68; 0.68; 0.68; 0.67; 0.670.83; 0.83; 0.80; 0.82; 0.78; 0.78; 0.80; 0.82; 0.80; 0.78
008--0.690.780.680.780.240.220.21001; 007; 001; 007; 002; 003; 002; 005; 008; 0080.71; 0.71; 0.71; 0.71; 0.70; 0.70; 0.70; 0.69; 0.69; 0.690.79; 0.81; 0.79; 0.81; 0.81; 0.83; 0.81; 0.82; 0.81; 0.81
009--0.680.760.680.780.040.040.08002; 002; 006; 006; 004; 003; 001; 010; 001; 0040.70; 0.70; 0.69; 0.69; 0.68; 0.68; 0.68; 0.68; 0.68; 0.680.81; 0.81; 0.78; 0.78; 0.81; 0.79; 0.80; 0.81; 0.80; 0.81
010--0.630.740.630.750.010.010.02003; 009; 008; 005; 008; 009; 005; 003; 006; 0010.68; 0.68; 0.68; 0.68; 0.68; 0.68; 0.68; 0.68; 0.67; 0.670.82; 0.84; 0.80; 0.80; 0.80; 0.84; 0.80; 0.82; 0.78; 0.81
011--0.70.810.710.820.040.060.08001; 001; 008; 007; 007; 008; 002; 002; 005; 0090.71; 0.71; 0.69; 0.69; 0.69; 0.69; 0.68; 0.68; 0.67; 0.670.82; 0.82; 0.79; 0.83; 0.83; 0.79; 0.80; 0.80; 0.78; 0.80
012--0.60.710.630.770.00.00.0002; 002; 005; 001; 007; 005; 001; 007; 003; 0030.68; 0.68; 0.67; 0.67; 0.67; 0.67; 0.67; 0.67; 0.66; 0.660.77; 0.77; 0.80; 0.78; 0.79; 0.80; 0.78; 0.79; 0.77; 0.77
013--0.660.780.660.760.010.010.02002; 002; 003; 001; 003; 001; 004; 005; 007; 0050.71; 0.71; 0.70; 0.70; 0.70; 0.70; 0.68; 0.68; 0.68; 0.680.80; 0.80; 0.81; 0.81; 0.80; 0.81; 0.78; 0.79; 0.83; 0.79
014--0.750.820.740.830.190.170.2001; 001; 008; 007; 007; 008; 004; 004; 003; 0030.74; 0.74; 0.70; 0.70; 0.70; 0.70; 0.69; 0.69; 0.68; 0.680.82; 0.82; 0.81; 0.81; 0.81; 0.81; 0.83; 0.83; 0.80; 0.80
015--0.570.680.560.650.020.020.02001; 001; 005; 003; 005; 007; 007; 003; 008; 0020.69; 0.69; 0.67; 0.67; 0.67; 0.67; 0.67; 0.67; 0.66; 0.660.80; 0.80; 0.80; 0.78; 0.80; 0.77; 0.77; 0.78; 0.77; 0.79
016--0.640.760.680.810.020.020.04001; 002; 003; 001; 010; 002; 010; 003; 005; 0050.70; 0.70; 0.70; 0.70; 0.70; 0.70; 0.70; 0.70; 0.68; 0.680.81; 0.80; 0.80; 0.81; 0.79; 0.80; 0.79; 0.80; 0.80; 0.80
017--0.660.790.650.830.240.220.26001; 001; 009; 009; 004; 004; 002; 002; 003; 0030.70; 0.69; 0.69; 0.69; 0.67; 0.67; 0.67; 0.67; 0.65; 0.650.82; 0.82; 0.83; 0.83; 0.80; 0.80; 0.80; 0.80; 0.76; 0.76
018--0.680.770.680.770.010.00.02002; 004; 004; 002; 001; 001; 003; 005; 003; 0050.69; 0.69; 0.69; 0.69; 0.68; 0.68; 0.67; 0.67; 0.67; 0.670.80; 0.80; 0.80; 0.80; 0.78; 0.78; 0.80; 0.80; 0.80; 0.80
019--0.610.730.60.750.210.190.24001; 001; 004; 004; 008; 008; 010; 010; 005; 0020.70; 0.70; 0.69; 0.69; 0.68; 0.68; 0.68; 0.67; 0.66; 0.660.83; 0.83; 0.80; 0.80; 0.78; 0.78; 0.80; 0.79; 0.79; 0.78

Aligned per-residue ΔΔG

aln_posaa1aa2E1E2dEdiff
1M-129.87--
2AA2.34-0.542.88
3DD225.431.19224.24
4S-2507.52--
5-V--1.59-
6TT20679.832.0620677.77
7II34816.31-3.234819.51
8TT20038.83-2.2220041.05
9I-18139.67--
10R-11011.36--
11G-10451.08--
12Y-39255.19--
13VV36404.97-4.5536409.52
14R-34749.83--
15D-34860.61--
16NN22355.04-2.7722357.81
17GG20268.751.5420267.21
18C-33313.77--
19S-26522.07--
20-K-4.11-
21VV47762.06-3.7847765.84
22A-35931.94--
23A-33452.34--
24E-40785.36--
25S-31218.81--
26T-40746.85--
27N-31058.39--
28F-58119.63--
29T-44062.51--
30VV45114.370.5345113.83
31D-41960.91--
32L-41033.15--
33M-54349.97--
34E-44472.48--
35N-38495.37--
36A-33520.4--
37AA33076.2-1.2733077.47
38KK40234.796.7940228.0
39Q-56265.7--
40F-63745.28--
41N-47891.93--
42N-46648.05--
43I-52594.74--
44G-25328.84--
45A-37371.48--
46T-42417.6--
47T-47329.19--
48P-41732.69--
49V-44929.97--
50V-47919.26--
51P-45706.75--
52F-65122.35--
53R-65608.1--
54I-55826.99--
55L-53459.65--
56L-56836.33--
57S-38645.11--
58PP47342.66-3.1147345.77
59CC42672.484.3242668.16
60G-22363.02--
61N-41506.7--
62A-30398.37--
63-T-4.98-
64VV42854.526.6842847.83
65SS22916.092.1722913.92
66-T-3.25-
67-T-3.5-
68-N-3.37-
69AA32653.730.9732652.76
70V-44956.9--
71K-40322.33--
72V-41237.0--
73G-30360.18--
74F-61937.0--
75TT44700.13-0.1844700.31
76G-26597.58--
77VV43879.42-2.1643881.58
78A-36191.41--
79DD47801.741.2847800.46
80S-34799.37--
81H-63934.71--
82N-46942.52--
83A-33942.93--
84N-49196.11--
85L-56013.39--
86LL54813.76-3.4654817.22
87A-36698.45--
88-G--1.79-
89-D-2.09-
90LL55911.06-3.255914.26
91E-47177.4--
92N-43164.79--
93T-43406.43--
94V-42312.29--
95-Y-1.22-
96SS34391.21-0.0834391.28
97A-29068.86--
98A-35430.88--
99-F-3.84-
100SS38282.38-0.0438282.42
101G-28755.86--
102LL56427.25-3.2856430.54
103-M-5.17-
104-S--0.63-
105-A--0.44-
106GG29467.91-2.0729469.98
107I-55409.28--
108Q-52754.75--
109L-53036.29--
110L-53795.37--
111N-47536.49--
112E-40239.9--
113Q-54362.17--
114Q-45032.14--
115N-49692.66--
116Q-57439.56--
117I-52325.89--
118P-49479.95--
119L-46539.81--
120N-42500.92--
121AA30503.34-1.5830504.92
122P-30626.49--
123S-16875.76--
124S-32356.05--
125AA30026.91-1.3530028.26
126L-48101.3--
127SS30433.481.1330432.36
128-A-1.66-
129WW76791.93-2.2776794.2
130T-38014.51--
131T-37358.66--
132-H--0.1-
133-D-3.46-
134-V--0.28-
135-A--0.38-
136LL50898.40.3750898.03
137-E--0.99-
138-L-0.45-
139TT42503.76-0.2742504.03
140-N-1.01-
141-C-2.48-
142PP44550.12-2.944553.02
143-V-2.23-
144GG21189.46-2.221191.66
145K-47591.01--
146P-41648.74--
147N-49262.09--
148TT44059.541.6344057.92
149L-46713.39--
150N-45338.38--
151F-54737.09--
152Y-64912.21--
153A-34326.9--
154-S--0.95-
155RR72177.981.0572176.93
156L-51092.03--
157M-63888.38--
158A-36220.05--
159T-46954.42--
160Q-56663.74--
161V-47707.07--
162P-49873.38--
163VV47120.74-4.347125.04
164T-41593.93--
165A-32182.34--
166G-28317.38--
167H-64645.13--
168I-55488.39--
169N-46642.97--
170A-35296.22--
171TT46066.03-0.6846066.71
172AA34095.12-0.8534095.97
173T-38386.31--
174-S--0.29-
175FF58867.070.9158866.16
176T-38392.83--
177L-50687.14--
178E-31739.84--
179Y-64066.92--
180Q-32641.8--
181D-30978.85--
182N-19224.42--
183H-16131.89--
184H-14911.06--
185H-15623.41--
186H-10298.76--
187H-15635.99--
188H-22283.22--
189K-24535.75--
190Q-45205.64--
191A-28809.24--
192D-37838.97--
193SS35650.5-1.6835652.17
194T-42573.37--
195I-53470.75--
196T-44918.28--
197I-56409.06--
198R-56524.74--
199GG28558.99-1.8128560.8
200Y-64728.99--
201V-44721.43--
202R-61609.26--
203D-39437.55--
204N-33972.99--
205M-13.49--
206AA49.3-0.6149.91
207-A--1.0-
208DD2116.364.712111.65
209SS4958.991.914957.08
210T-12205.23--
211I-28715.62--
212TT22214.870.9922213.88
213I-28680.53--
214R-17769.56--
215GG11867.0-1.3511868.36
216YY42835.220.142835.13
217V-16924.29--
218R-27585.97--
219D-40863.8--
220-Y--3.49-
221-K-0.49-
222NN39932.09-1.739933.79
223-Q-1.95-
224GG24550.52-0.6524551.17
225C-42103.65--
226S-21795.37--
227V-47252.46--
228A-33575.12--
229A-33277.93--
230E-40252.83--
231S-32469.86--
232T-42912.5--
233N-34396.28--
234F-58193.46--
235TT45646.391.7545644.65
236V-45869.75--
237D-42191.27--
238L-42747.86--
239M-53836.44--
240E-42305.33--
241N-22633.8--
242A-32155.93--
243AA33383.15-1.4633384.62
244K-40657.05--
245QQ55158.421.0255157.39
246F-63574.05--
247N-39874.72--
248NN45674.680.3445674.34
249I-53936.32--
250G-25350.24--
251A-32576.58--
252T-40469.87--
253T-46794.34--
254P-44502.68--
255V-44084.46--
256V-47282.05--
257P-45787.12--
258F-63592.53--
259R-62652.91--
260II55003.73-1.1755004.9
261-Q-1.44-
262LL54681.5-0.2654681.76
263-E--3.53-
264LL57224.1-4.257228.31
265-Q-0.14-
266-D-1.31-
267-D-3.56-
268SS36663.272.436660.86
269P-42449.96--
270C-41754.98--
271GG18072.931.2918071.63
272NN41048.153.6441044.51
273A-24147.45--
274V-42711.5--
275S-33234.31--
276A-33462.91--
277V-46483.2--
278K-48648.16--
279V-45189.0--
280G-26801.04--
281F-63704.65--
282TT44019.351.044018.35
283G-23592.88--
284V-47162.61--
285A-35214.22--
286D-46533.68--
287S-33148.87--
288H-64230.54--
289N-46655.42--
290A-34840.64--
291N-51133.79--
292L-55197.03--
293L-55646.41--
294A-35168.75--
295LL55245.99-3.3455249.33
296E-45019.75--
297NN39978.871.5439977.33
298TT42803.618.4142795.21
299-G-2.06-
300-A-1.84-
301-T--0.99-
302-K--1.82-
303-T--0.24-
304VV43902.11-2.6843904.79
305-Q-1.64-
306-V-0.4-
307-D-0.8-
308-D-4.9-
309SS31650.052.9131647.14
310A-32746.15--
311A-35368.34--
312SS38373.910.838373.11
313G-29162.42--
314L-55502.4--
315G-29009.31--
316I-55585.23--
317Q-51787.55--
318L-52106.63--
319L-52377.69--
320N-48092.51--
321E-36152.88--
322Q-49469.46--
323Q-49219.08--
324N-51295.12--
325QQ55901.010.5955900.42
326I-51630.13--
327P-50354.96--
328L-50977.94--
329N-43899.04--
330A-35498.93--
331P-42296.91--
332S-34122.11--
333SS28163.6-1.9228165.52
334AA23967.121.8623965.26
335L-47792.85--
336S-29684.79--
337W-75964.35--
338T-41385.79--
339T-38487.38--
340L-46373.54--
341T-38683.44--
342P-37676.58--
343G-23616.38--
344K-48074.38--
345-H-5.55-
346-F--2.66-
347PP41686.45-2.8741689.32
348N-48201.67--
349T-43827.84--
350LL44844.52-0.8344845.36
351N-45085.65--
352F-49411.89--
353Y-66435.71--
354A-33986.76--
355-Q--0.09-
356-V--2.37-
357RR69325.53-4.5169330.03
358L-50470.59--
359M-63241.42--
360AA34531.27-2.9134534.18
361-L--1.48-
362TT45434.21.6845432.52
363Q-56900.35--
364V-48491.15--
365P-48418.07--
366VV46294.351.0846293.27
367T-43195.18--
368A-33699.95--
369G-24180.07--
370H-54704.13--
371I-46150.21--
372NN47283.37-0.3247283.69
373A-33759.71--
374T-46026.42--
375-G--1.57-
376-G-1.93-
377AA35044.61-0.635045.21
378T-45009.53--
379F-62070.4--
380TT41932.58-0.541933.07
381L-56121.34--
382E-39176.71--
383Y-60131.68--
384QQ39529.82.5439527.26
385D-22158.74--
386N-18642.49--
387H-17852.47--
388H-20838.13--
389H-4632.31--
390H-2380.81--
391H-19652.26--
392H-16204.11--
393K-31279.13--
394-G--1.94-
395-T--1.54-
396-I--2.92-
397QQ44019.9511.2144008.75
398AA28621.970.6728621.3
399D-37812.52--
400-V--0.62-
401-I--2.47-
402SS30846.76-1.5730848.32
403T-36054.34--
404II52370.783.0352367.74
405TT46305.210.846304.41
406I-54217.61--
407R-56425.66--
408G-27789.37--
409YY62471.88-6.3362478.21
410V-50089.24--
411R-61712.79--
412D-34309.57--
413N-36487.08--
414M-1148.13--
415A-1034.8--
416D-2544.4--
417S-6186.86--
418T-4994.44--
419I-26552.39--
420TT18832.92.1718830.73
421I-28136.07--
422R-18508.97--
423G-14078.16--
424YY31254.970.0231254.95
425V-35136.57--
426R-34105.18--
427D-37692.89--
428N-29477.86--
429G-19781.63--
430C-40954.91--
431S-30008.47--
432V-46655.19--
433A-34296.57--
434A-27745.13--
435E-40395.49--
436SS35652.260.7135651.55
437T-40862.99--
438N-39620.42--
439FF60542.5-1.4160543.92
440T-35981.13--
441V-42304.2--
442D-27251.66--
443L-39137.88--
444M-49477.19--
445E-45398.87--
446N-44894.6--
447A-32424.92--
448AA30122.880.7430122.14
449-C-1.62-
450KK41507.352.941504.45
451Q-59971.37--
452F-62366.89--
453N-48527.66--
454-T-3.72-
455-A-3.16-
456NN48123.579.4848114.09
457I-51507.29--
458GG27243.815.7727238.04
459A-34670.14--
460T-40238.45--
461TT44990.3420.2744970.08
462P-45114.02--
463V-45014.59--
464V-47014.56--
465P-48130.55--
466F-60366.77--
467R-69452.22--
468-A-5.5-
469II52734.432.5852731.85
470L-53711.85--
471L-56842.62--
472S-38841.67--
473PP47335.253.3247331.93
474C-44511.69--
475-I-7.85-
476GG23844.431.1223843.31
477N-43588.93--
478A-21328.2--
479V-37420.32--
480S-32959.84--
481A-29601.91--
482V-45880.56--
483K-42065.42--
484V-46690.27--
485GG27249.04-0.1327249.17
486F-62329.88--
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