Analysis of pair 1mnmD_1mnmC

1mnmD vs 1mnmC

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] 1mnmD vs. 1mnmC (unaligned) — interactive
[missing] 1mnmD vs. 1mnmC (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--0.720.750.710.720.480.380.4---
000--0.710.740.710.720.450.360.38001; 001; 004; 004; 009; 009; 008; 002; 002; 0080.70; 0.70; 0.66; 0.66; 0.65; 0.65; 0.63; 0.63; 0.63; 0.630.71; 0.71; 0.65; 0.65; 0.65; 0.65; 0.65; 0.64; 0.64; 0.65
001--0.720.750.720.730.430.350.37001; 001; 002; 002; 005; 005; 008; 008; 003; 0030.71; 0.71; 0.68; 0.68; 0.65; 0.65; 0.64; 0.64; 0.63; 0.630.73; 0.73; 0.67; 0.67; 0.66; 0.66; 0.64; 0.64; 0.66; 0.66
002--0.70.730.670.680.030.020.02002; 003; 003; 002; 005; 001; 001; 005; 004; 0040.70; 0.70; 0.70; 0.70; 0.66; 0.66; 0.66; 0.66; 0.62; 0.620.71; 0.71; 0.71; 0.71; 0.65; 0.69; 0.69; 0.65; 0.65; 0.65
003--0.670.670.660.640.00.00.0001; 002; 004; 001; 004; 002; 005; 005; 006; 0060.67; 0.67; 0.67; 0.67; 0.67; 0.67; 0.64; 0.64; 0.63; 0.630.68; 0.67; 0.70; 0.68; 0.70; 0.66; 0.65; 0.65; 0.64; 0.64
004--0.640.670.640.650.10.080.08004; 010; 004; 010; 001; 005; 001; 005; 003; 0030.64; 0.64; 0.64; 0.64; 0.63; 0.63; 0.63; 0.63; 0.62; 0.620.68; 0.67; 0.68; 0.67; 0.66; 0.65; 0.66; 0.65; 0.65; 0.65
005--0.620.640.510.520.470.380.4002; 001; 001; 002; 010; 010; 008; 008; 004; 0030.69; 0.68; 0.68; 0.68; 0.63; 0.63; 0.62; 0.62; 0.61; 0.610.70; 0.70; 0.70; 0.70; 0.65; 0.65; 0.66; 0.66; 0.63; 0.65
006--0.670.690.640.640.430.360.38010; 010; 001; 001; 009; 009; 002; 003; 006; 0020.67; 0.67; 0.65; 0.65; 0.65; 0.65; 0.64; 0.64; 0.64; 0.640.68; 0.68; 0.67; 0.67; 0.67; 0.67; 0.68; 0.67; 0.65; 0.68
007--0.650.670.620.660.00.00.0001; 005; 001; 005; 004; 008; 004; 008; 006; 0060.68; 0.68; 0.68; 0.68; 0.67; 0.67; 0.67; 0.67; 0.66; 0.660.71; 0.70; 0.71; 0.70; 0.69; 0.66; 0.69; 0.66; 0.67; 0.67
008--0.580.580.580.570.00.00.0008; 008; 001; 007; 009; 007; 006; 006; 001; 0090.63; 0.63; 0.62; 0.62; 0.62; 0.62; 0.62; 0.62; 0.62; 0.620.65; 0.65; 0.65; 0.65; 0.63; 0.65; 0.65; 0.65; 0.65; 0.63
009--0.70.730.70.70.00.00.0004; 004; 002; 002; 008; 008; 003; 003; 001; 0010.73; 0.73; 0.68; 0.68; 0.67; 0.67; 0.66; 0.66; 0.65; 0.650.76; 0.76; 0.71; 0.71; 0.68; 0.68; 0.69; 0.70; 0.68; 0.68
010--0.290.280.450.390.070.080.05006; 006; 001; 002; 008; 010; 001; 002; 010; 0050.63; 0.63; 0.62; 0.62; 0.62; 0.62; 0.62; 0.62; 0.62; 0.610.65; 0.65; 0.65; 0.64; 0.65; 0.65; 0.65; 0.64; 0.65; 0.64
011--0.690.70.660.670.440.350.38007; 007; 001; 001; 009; 009; 002; 002; 003; 0030.71; 0.71; 0.68; 0.68; 0.66; 0.66; 0.65; 0.65; 0.64; 0.640.76; 0.76; 0.71; 0.71; 0.67; 0.67; 0.67; 0.67; 0.66; 0.66
012--0.30.30.260.280.00.00.0002; 003; 004; 002; 010; 010; 004; 003; 001; 0070.63; 0.63; 0.63; 0.63; 0.63; 0.63; 0.63; 0.63; 0.62; 0.620.66; 0.64; 0.66; 0.66; 0.65; 0.65; 0.66; 0.64; 0.64; 0.63
013--0.650.640.650.640.00.030.03002; 002; 004; 004; 008; 008; 001; 001; 005; 0050.70; 0.70; 0.68; 0.68; 0.67; 0.67; 0.66; 0.66; 0.66; 0.660.74; 0.74; 0.71; 0.71; 0.69; 0.69; 0.67; 0.67; 0.69; 0.69
014--0.550.520.520.520.00.00.0004; 004; 005; 005; 002; 002; 003; 003; 001; 0010.71; 0.71; 0.67; 0.67; 0.65; 0.65; 0.64; 0.64; 0.62; 0.620.67; 0.67; 0.68; 0.68; 0.67; 0.67; 0.67; 0.67; 0.64; 0.64
015--0.720.710.670.670.040.030.03001; 001; 005; 005; 003; 010; 003; 010; 009; 0040.70; 0.70; 0.64; 0.64; 0.62; 0.62; 0.62; 0.62; 0.60; 0.600.72; 0.72; 0.65; 0.65; 0.63; 0.64; 0.63; 0.64; 0.54; 0.63
016--0.520.520.530.550.00.00.0006; 006; 008; 008; 010; 010; 007; 005; 007; 0050.65; 0.65; 0.62; 0.62; 0.61; 0.61; 0.60; 0.60; 0.60; 0.600.65; 0.65; 0.65; 0.65; 0.63; 0.63; 0.62; 0.64; 0.62; 0.64
017--0.60.620.490.50.00.00.0004; 005; 009; 005; 009; 004; 003; 003; 001; 0020.63; 0.63; 0.63; 0.63; 0.63; 0.63; 0.62; 0.62; 0.61; 0.610.65; 0.65; 0.65; 0.65; 0.65; 0.65; 0.64; 0.64; 0.63; 0.63
018--0.670.670.690.650.330.290.25006; 005; 006; 005; 002; 010; 010; 002; 009; 0090.63; 0.63; 0.63; 0.63; 0.62; 0.62; 0.62; 0.62; 0.61; 0.610.65; 0.65; 0.65; 0.65; 0.65; 0.64; 0.64; 0.65; 0.64; 0.64
019--0.60.60.560.550.00.030.03001; 001; 004; 004; 007; 003; 010; 007; 003; 0100.67; 0.67; 0.64; 0.64; 0.63; 0.63; 0.63; 0.63; 0.63; 0.630.68; 0.69; 0.65; 0.65; 0.65; 0.65; 0.65; 0.65; 0.65; 0.65

Aligned per-residue ΔΔG

aln_posaa1aa2E1E2dEdiff
1XX6.716.710.0
2XX30.1730.170.0
3XX20.9520.950.0
4XX4.424.420.0
5XX9.649.640.0
6XX-0.81-0.810.0
7XX-1.28-1.280.0
8XX1.041.040.0
9XX3.333.330.0
10XX-0.6-0.60.0
11XX-1.59-1.590.0
12XX10.1510.150.0
13XX0.150.150.0
14XX0.180.180.0
15XX-0.07-0.070.0
16XX2.112.110.0
17XX4.14.10.0
18XX4.124.120.0
19XX1.021.020.0
20XX-1.37-1.370.0
21XX-4.98-4.980.0
22XX15.715.70.0
23XX20.6720.670.0
24XX10.2910.290.0
25XX2.722.720.0
26XX4.044.040.0
27XX21.7821.780.0
28XX20.4920.490.0
29XX18.7518.750.0
30XX17.2817.280.0
31XX0.250.250.0
32XX-0.73-0.730.0
33XX1.861.860.0
34XX-0.13-0.130.0
35XX3.343.340.0
36XX0.20.20.0
37XX-3.45-3.450.0
38XX-0.7-0.70.0
39XX2.892.890.0
40XX0.40.40.0
41XX6.626.620.0
42XX10.3710.370.0
43XX-0.02-0.020.0
44XX-0.6-0.60.0
45XX4.364.360.0
46XX1.61.60.0
47XX0.190.190.0
48XX2.792.790.0
49XX1.341.340.0
50XX2.562.560.0
51XX-1.35-1.350.0
52XX-1.35-1.350.0
53QQ7.997.990.0
54KK14.7314.730.0
55EE9.119.110.0
56RR16.3216.320.0
57RR12.6112.610.0
58KK8.788.780.0
59II5.575.570.0
60EE1.061.060.0
61II-0.15-0.150.0
62KK-0.92-0.920.0
63FF-1.58-1.580.0
64II-2.38-2.380.0
65EE1.891.890.0
66NN0.130.130.0
67KK8.278.270.0
68TT3.043.040.0
69RR-0.19-0.190.0
70RR-2.16-2.160.0
71HH1.851.850.0
72VV-1.31-1.310.0
73TT-0.65-0.650.0
74FF-2.83-2.830.0
75SS-0.66-0.660.0
76KK0.450.450.0
77RR-0.92-0.920.0
78KK4.564.560.0
79HH2.222.220.0
80GG0.320.320.0
81II-0.18-0.180.0
82MM5.215.210.0
83KK1.021.020.0
84KK4.214.210.0
85AA-3.26-3.260.0
86FF-1.04-1.040.0
87EE-5.4-5.40.0
88LL-3.61-3.610.0
89SS-1.39-1.390.0
90VV-1.66-1.65-0.0
91LL-4.81-4.820.01
92TT-1.63-1.630.0
93GG1.331.330.0
94TT0.70.70.0
95QQ-2.47-2.470.0
96VV-5.01-5.010.0
97LL-4.82-4.820.0
98LL-4.8-4.80.0
99LL-4.06-4.060.0
100VV-4.27-4.270.0
101VV-1.77-1.770.0
102SS-1.77-1.770.0
103EE-0.09-0.090.0
104TT3.03.00.0
105GG-1.77-1.770.0
106LL5.135.130.0
107VV-0.09-0.090.0
108YY-0.75-0.750.0
109TT1.861.860.0
110FF-2.08-2.080.0
111SS-1.63-1.630.0
112TT2.062.060.0
113PP3.793.790.0
114KK0.970.970.0
115FF-4.18-4.180.0
116EE9.039.030.0
117PP3.763.760.0
118II-0.05-0.050.0
119VV-2.35-2.350.0
120TT0.750.750.0
121QQ3.073.070.0
122QQ0.320.320.0
123EE8.448.440.0
124GG0.280.280.0
125RR3.533.530.0
126NN1.391.390.0
127LL-1.12-1.120.0
128II-3.12-3.120.0
129QQ1.121.120.0
130AA-0.05-0.050.0
131CC0.720.720.0
132LL-2.83-2.830.0
133NN-0.6-0.60.0
134AA0.840.840.0
135PP-0.42-0.420.0
136DD2.922.920.0
137DD4.794.790.0
138RR4.234.230.0
139RR1.961.98-0.02
140KK1.391.390.0
141II2.542.540.0
142EE-0.37-0.50.13
143II-1.01-1.0-0.02
144KK-0.160.11-0.27
145FF-1.05-1.190.14
146II-2.26-2.280.02
147EE1.331.34-0.01
148NN-0.87-0.870.0
149KK2.012.010.0
150TT2.642.640.0
151RR-0.28-0.280.0
152RR-0.5-0.50.0
153HH2.832.830.0
154VV-0.65-0.650.0
155TT0.790.790.0
156FF-2.92-2.920.0
157SS-0.53-0.530.0
158KK0.070.070.0
159RR-1.22-1.220.0
160KK1.931.930.0
161HH2.272.270.0
162GG-0.36-0.360.0
163II-0.11-0.110.0
164MM-0.93-0.930.0
165KK1.121.120.0
166KK11.8511.850.0
167AA-3.87-3.870.0
168FF-2.87-2.870.0
169EE-2.72-2.720.0
170LL-3.62-3.620.0
171SS0.050.050.0
172VV-0.66-0.660.0
173LL-4.38-4.380.0
174TT-1.43-1.430.0
175GG1.511.510.0
176TT1.311.310.0
177QQ-2.25-2.250.0
178VV-5.07-5.070.0
179LL-4.33-4.330.0
180LL-4.09-4.090.0
181LL-4.17-4.170.0
182VV-4.55-4.550.0
183VV-2.67-2.670.0
184SS-2.19-2.190.0
185EE15.3315.330.0
186TT3.153.150.0
187GG-1.9-1.90.0
188LL-1.63-1.630.0
189VV-3.53-3.530.0
190YY-2.8-2.80.0
191TT7.67.60.0
192FF-2.67-2.670.0
193SS-2.66-2.660.0
194TT2.552.550.0
195PP4.134.130.0
196KK-0.53-0.530.0
197FF-3.32-3.320.0
198EE6.66.60.0
199PP1.771.770.0
200II1.191.190.0
201VV4.394.390.0
202TT-0.91-0.910.0
203QQ0.470.470.0
204QQ2.582.580.0
205EE15.315.30.0
206GG0.180.180.0
207RR0.040.040.0
208NN3.283.280.0
209LL-1.97-1.970.0
210II-3.66-3.660.0
211QQ0.020.020.0
212AA0.490.490.0
213CC2.032.030.0
214LL-1.63-1.630.0
215NN5.985.980.0
216AA16.9716.970.0
217PP11.7211.720.0
218DD-0.16-0.160.0
219GG0.180.180.0
220LL2.172.170.0
221VV-2.41-2.410.0
222FF-2.01-2.010.0
223NN-0.8-0.80.0
224VV0.380.380.0
225VV-0.64-0.640.0
226TT-0.58-0.580.0
227QQ1.721.720.0
228DD5.845.840.0
229MM17.4417.440.0
230II2.092.090.0
231NN2.092.090.0
232KK0.390.390.0
233SS1.051.050.0
234TT1.221.220.0
235KK1.471.470.0
236PP-0.11-0.110.0
237YY5.175.170.0
238RR3.173.170.0
239GG-1.97-1.970.0
240HH4.734.730.0
241RR9.039.030.0
242FF1.691.690.0
243TT1.781.780.0
244KK-0.09-0.090.0
245EE-0.21-0.210.0
246NN1.331.330.0
247VV0.320.320.0
248RR-0.15-0.150.0
249II-1.08-1.080.0
250LL-5.04-5.040.0
251EE-0.77-0.770.0
252SS0.610.610.0
253WW-1.38-1.380.0
254FF-1.25-1.250.0
255AA0.450.450.0
256KK-0.37-0.370.0
257NN4.494.490.0
258II3.343.340.0
259EE0.390.390.0
260NN4.084.080.0
261PP-3.29-3.290.0
262YY4.394.390.0
263LL6.226.220.0
264DD0.860.860.0
265TT5.155.150.0
266KK0.460.460.0
267GG-1.06-1.060.0
268LL-0.78-0.780.0
269EE11.1411.140.0
270NN0.950.950.0
271LL-1.88-1.880.0
272MM1.171.170.0
273KK-0.24-0.240.0
274NN0.520.520.0
275TT-0.42-0.420.0
276SS1.861.860.0
277LL-1.99-1.990.0
278SS2.462.460.0
279RR2.122.120.0
280II5.495.490.0
281QQ2.452.450.0
282II-0.47-0.470.0
283KK-0.44-0.440.0
284NN2.942.940.0
285WW-3.06-3.060.0
286VV-2.15-2.150.0
287SS0.180.180.0
288NN4.194.190.0
289RR2.392.390.0
290RR2.562.560.0
291RR7.797.790.0
292KK1.971.970.0
293EE1.51.50.0
294KK0.740.740.0
295TT5.125.120.0
296GG0.430.430.0
297LL12.9212.920.0
298VV17.8817.880.0
299FF1.251.250.0
300NN6.986.980.0
301VV2.022.020.0
302VV-0.19-0.190.0
303TT0.150.150.0
304QQ1.171.170.0
305DD0.710.710.0
306MM6.986.980.0
307II17.317.30.0
308NN1.921.920.0
309KK-1.28-1.280.0
310SS-1.14-1.140.0
311TT-0.44-0.440.0
312KK2.672.670.0
313PP-2.16-2.160.0
314YY8.38.30.0
315RR3.273.270.0
316GG-1.56-1.560.0
317HH3.483.480.0
318RR-0.02-0.020.0
319FF1.551.550.0
320TT3.533.530.0
321KK0.140.140.0
322EE-0.42-0.420.0
323NN-1.65-1.650.0
324VV1.561.560.0
325RR1.751.750.0
326II-1.45-1.450.0
327LL-5.62-5.620.0
328EE-1.56-1.560.0
329SS-0.49-0.490.0
330WW-3.27-3.270.0
331FF-2.34-2.340.0
332AA-0.67-0.670.0
333KK-1.21-1.210.0
334NN-1.5-1.50.0
335II1.951.950.0
336EE1.411.410.0
337NN1.041.040.0
338PP-4.49-4.490.0
339YY-0.62-0.620.0
340LL-1.2-1.20.0
341DD1.161.160.0
342TT3.713.710.0
343KK-0.48-0.480.0
344GG0.020.020.0
345LL-0.23-0.230.0
346EE-0.89-0.890.0
347NN3.263.260.0
348LL-4.12-4.120.0
349MM0.880.880.0
350KK1.311.310.0
351NN2.942.940.0
352TT-1.98-1.980.0
353SS0.90.90.0
354LL-3.48-3.480.0
355SS-1.21-1.210.0
356RR7.897.890.0
357II3.673.670.0
358QQ-2.43-2.430.0
359II1.51.50.0
360KK-1.29-1.290.0
361NN0.650.650.0
362WW-3.7-3.70.0
363VV-2.4-2.40.0
364SS-0.34-0.340.0
365NN-2.25-2.250.0
366RR-0.63-0.630.0
367RR-0.29-0.290.0
368RR4.64.60.0
369KK3.083.080.0
370EE3.573.570.0
371KK9.749.740.0
372TT5.05.00.0