Q9HHJ9 - HALSA - GREMLIN Contacts

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Q9HHJ9 - Neutral proteinase

UniProt:	Q9HHJ9	Sequences: MKRTNTFAVRPLSETGEQLLRDLLDASAALWNEVNYQRLMRYNDEDGFEGGIWDADTGRLEGRYKGVLGASTAQQVIRKNSEAWRSFSHLKDQYHDESNTSVTEHPNPPGFRGNEDDGRQLRTVIRNDAYTTEWGDRSRLEILVGSELKDRYDHTGRLRLEIAGNPNWPDYEKQGRLELWYDETESTFRASQPVTVPDSARATPLADETAALDIGANNLVACTTTTGEQYLYEGRELFQRFRETTREIARLQSKLPEGRYSSERIRRLYRKRTRRRDHAQEALCRDLLDRLYAEGVDTVYIGGLTDVLDTHWSVKTNAKTHNFWAFKKFTERLACTAEEYGISVEVRSEAWTSQECPRCGSTDRTTRHQDTLTCPCGFQGHADLTASETFLERHTKQAVRPMARPVRFQWDDHTWSESPRSQESPKEQRTDPSTVHHGNVALRESA	Download Alignment We filter this alignment to remove sites that have many gaps before running GREMLIN. Date: 2015_01
Length:	446 (350)
Sequences:	4303 (2738)
Seq/√Len:	146.4

ECOLI - INSQ
HALSA - Q9HHJ9 Q9HSW9 Q9HM87 Q9HSW7 Q9HHG8 Q9HSZ6 Q9HSD4 Q9HHU6 Q9HSY4 Q9HHX8
SULSO - Q7LXD9 Q97Y67 Q97WZ3 Q7LXH2 Q97YI2 Q97Y44 Q97YU1 Q97XP1 Q97V47 Q97V25 Q97X39 Q97XQ8 Q97U51 Q97U68 Q97XQ0 Q97Y48 Q97YI5 Q97Z61 Q97UQ8 Q97WY6 Q97YW9 Q97XB6 Q97YW4 Q97XA4 Q97V53 Q7LXH6 Y2105 Q97YF7 Q97U09 Q7LX59 Q7LXH9

GREMLIN Results:

Legend: The darker and larger the blue dots, the higher coevolution strength.

Residue pairs sorted by coevolution strength:

i	j	Sco	Prob
278_H	282_A	5.424	1.00
305_T	309_D	4.382	1.00
357_P	385_T	4.325	1.00
337_A	344_V	3.803	1.00
300_Y	394_H	3.301	1.00
219_L	329_F	3.092	1.00
330_T	346_V	3.046	1.00
301_I	333_L	3.035	1.00
328_K	332_R	2.945	1.00
285_R	289_D	2.849	1.00
3_R	339_E	2.758	1.00
328_K	331_E	2.458	1.00
334_A	346_V	2.436	1.00
177_L	190_A	2.430	1.00
355_E	362_T	2.424	1.00
351_W	354_Q	2.385	1.00
329_F	333_L	2.360	1.00
393_R	396_K	2.285	1.00
36_Y	40_M	2.274	1.00
347_R	390_F	2.250	1.00
288_L	337_A	2.250	1.00
244_T	261_S	2.207	1.00
301_I	344_V	2.163	1.00
299_V	337_A	2.106	1.00
39_L	108_P	2.097	1.00
281_E	332_R	2.091	1.00
352_T	390_F	2.088	1.00
359_C	376_C	2.087	1.00
373_T	379_Q	2.082	1.00
175_G	195_T	2.075	1.00
281_E	335_C	2.055	1.00
354_Q	366_T	2.021	1.00
34_V	77_I	1.998	1.00
313_S	317_N	1.994	1.00
22_D	67_V	1.911	1.00
297_D	342_I	1.883	1.00
219_L	279_A	1.871	1.00
256_P	259_R	1.868	1.00
314_V	317_N	1.861	1.00
277_D	328_K	1.853	1.00
261_S	265_I	1.851	1.00
284_C	332_R	1.834	1.00
12_L	16_G	1.829	1.00
21_R	188_F	1.806	1.00
35_N	80_N	1.757	1.00
280_Q	332_R	1.752	1.00
356_C	376_C	1.745	1.00
359_C	374_C	1.736	1.00
354_Q	364_R	1.725	1.00
8_A	187_T	1.713	1.00
356_C	359_C	1.713	1.00
334_A	338_E	1.706	1.00
372_L	380_G	1.693	1.00
358_R	378_F	1.692	1.00
281_E	284_C	1.690	1.00
281_E	336_T	1.688	1.00
140_L	190_A	1.678	1.00
212_L	220_V	1.668	1.00
356_C	374_C	1.656	1.00
251_L	261_S	1.652	1.00
259_R	262_S	1.651	1.00
363_D	366_T	1.642	1.00
247_E	251_L	1.637	1.00
301_I	346_V	1.634	1.00
370_D	382_A	1.628	1.00
280_Q	328_K	1.593	1.00
371_T	379_Q	1.585	1.00
18_Q	22_D	1.584	1.00
367_R	382_A	1.578	1.00
363_D	372_L	1.554	1.00
113_G	118_G	1.551	1.00
4_T	191_S	1.549	1.00
20_L	188_F	1.535	1.00
29_A	64_Y	1.519	1.00
79_K	124_V	1.516	1.00
301_I	330_T	1.502	1.00
209_T	391_L	1.499	1.00
303_G	346_V	1.498	1.00
221_A	384_L	1.479	1.00
51_G	54_D	1.461	1.00
90_L	106_P	1.455	1.00
17_E	21_R	1.443	1.00
372_L	378_F	1.436	1.00
134_W	138_S	1.434	1.00
71_S	126_R	1.433	1.00
284_C	335_C	1.413	1.00
248_I	262_S	1.407	1.00
222_C	226_T	1.402	1.00
187_T	270_R	1.394	1.00
388_E	392_E	1.388	1.00
270_R	274_R	1.387	1.00
218_N	221_A	1.379	1.00
334_A	344_V	1.377	1.00
24_L	188_F	1.367	1.00
13_S	17_E	1.364	1.00
254_K	258_G	1.356	1.00
81_S	85_R	1.356	1.00
311_H	317_N	1.354	1.00
384_L	388_E	1.342	1.00
357_P	388_E	1.339	1.00
89_H	105_H	1.324	1.00
34_V	80_N	1.316	1.00
244_T	268_L	1.302	1.00
320_T	326_F	1.299	1.00
71_S	128_D	1.291	1.00
210_A	222_C	1.283	1.00
357_P	380_G	1.280	1.00
40_M	44_D	1.274	1.00
247_E	250_R	1.267	1.00
86_S	106_P	1.265	1.00
284_C	336_T	1.261	1.00
84_W	108_P	1.258	1.00
290_R	296_V	1.254	1.00
58_G	61_E	1.251	1.00
288_L	340_Y	1.249	1.00
302_G	349_E	1.249	1.00
230_Y	381_H	1.245	1.00
311_H	321_H	1.242	1.00
82_E	86_S	1.233	1.00
363_D	367_R	1.226	1.00
85_R	89_H	1.225	1.00
366_T	369_Q	1.207	1.00
248_I	261_S	1.197	1.00
185_E	270_R	1.196	1.00
284_C	329_F	1.186	1.00
209_T	298_T	1.185	1.00
286_D	290_R	1.178	1.00
305_T	349_E	1.173	1.00
141_E	159_R	1.172	1.00
69_G	72_T	1.158	1.00
131_T	141_E	1.154	1.00
214_I	326_F	1.149	1.00
206_A	297_D	1.148	1.00
355_E	393_R	1.140	0.99
75_Q	78_R	1.137	0.99
57_T	60_L	1.133	0.99
310_T	317_N	1.130	0.99
285_R	340_Y	1.128	0.99
221_A	230_Y	1.124	0.99
169_P	172_E	1.122	0.99
39_L	43_N	1.121	0.99
75_Q	126_R	1.121	0.99
11_P	16_G	1.117	0.99
180_W	191_S	1.116	0.99
354_Q	362_T	1.110	0.99
277_D	332_R	1.103	0.99
332_R	335_C	1.094	0.99
31_W	76_V	1.093	0.99
311_H	314_V	1.091	0.99
211_A	391_L	1.090	0.99
55_A	58_G	1.087	0.99
310_T	313_S	1.087	0.99
27_S	76_V	1.079	0.99
216_A	324_W	1.078	0.99
209_T	395_T	1.071	0.99
380_G	388_E	1.066	0.99
273_T	277_D	1.062	0.99
357_P	378_F	1.059	0.99
352_T	393_R	1.058	0.99
90_L	105_H	1.057	0.99
86_S	105_H	1.052	0.99
243_E	247_E	1.051	0.99
244_T	247_E	1.051	0.99
284_C	333_L	1.041	0.99
347_R	394_H	1.040	0.99
139_R	159_R	1.031	0.99
142_I	179_L	1.030	0.99
280_Q	329_F	1.027	0.99
45_E	48_F	1.024	0.99
289_D	340_Y	1.018	0.99
131_T	134_W	1.014	0.99
228_E	286_D	1.010	0.99
129_A	143_L	1.010	0.99
87_F	108_P	1.009	0.99
288_L	342_I	1.004	0.99
214_I	330_T	1.001	0.99
367_R	370_D	0.999	0.99
361_S	375_P	0.997	0.99
303_G	349_E	0.994	0.99
248_I	265_I	0.994	0.99
241_F	249_A	0.984	0.98
86_S	90_L	0.982	0.98
380_G	384_L	0.979	0.98
288_L	299_V	0.977	0.98
61_E	73_A	0.975	0.98
212_L	222_C	0.974	0.98
347_R	393_R	0.973	0.98
336_T	339_E	0.971	0.98
244_T	265_I	0.971	0.98
369_Q	382_A	0.970	0.98
29_A	33_E	0.966	0.98
35_N	84_W	0.965	0.98
5_N	194_V	0.962	0.98
258_G	262_S	0.961	0.98
298_T	343_S	0.960	0.98
11_P	20_L	0.957	0.98
79_K	178_E	0.955	0.98
164_G	167_N	0.953	0.98
218_N	232_Y	0.945	0.98
365_T	369_Q	0.943	0.98
241_F	265_I	0.931	0.98
39_L	84_W	0.930	0.98
370_D	381_H	0.930	0.98
129_A	132_T	0.928	0.98
37_Q	56_D	0.927	0.98
52_I	55_A	0.925	0.98
241_F	269_Y	0.924	0.98
41_R	45_E	0.921	0.98
280_Q	284_C	0.908	0.97
307_V	327_K	0.907	0.97
162_I	165_N	0.905	0.97
209_T	300_Y	0.905	0.97
337_A	342_I	0.904	0.97
56_D	59_R	0.902	0.97
331_E	334_A	0.897	0.97
71_S	75_Q	0.896	0.97
90_L	107_N	0.892	0.97
37_Q	41_R	0.892	0.97
166_P	169_P	0.886	0.97
124_V	178_E	0.884	0.97
369_Q	372_L	0.883	0.97
183_E	186_S	0.883	0.97
17_E	188_F	0.882	0.97
216_A	319_K	0.880	0.97
86_S	89_H	0.879	0.97
300_Y	390_F	0.878	0.97
384_L	387_S	0.876	0.97
210_A	299_V	0.869	0.97
240_R	244_T	0.867	0.97
7_F	190_A	0.864	0.97
25_D	28_A	0.863	0.97
351_W	393_R	0.856	0.96
349_E	352_T	0.854	0.96
280_Q	325_A	0.852	0.96
366_T	382_A	0.848	0.96
210_A	225_T	0.848	0.96
57_T	61_E	0.847	0.96
247_E	264_R	0.847	0.96
246_R	249_A	0.847	0.96
160_L	163_A	0.847	0.96
125_I	142_I	0.845	0.96
371_T	380_G	0.845	0.96
221_A	231_L	0.843	0.96
179_L	190_A	0.842	0.96
238_F	318_A	0.842	0.96
71_S	127_N	0.841	0.96
183_E	270_R	0.841	0.96
31_W	80_N	0.839	0.96
248_I	251_L	0.834	0.96
31_W	83_A	0.831	0.96
220_V	283_L	0.829	0.96
59_R	63_R	0.829	0.96
316_T	320_T	0.829	0.96
38_R	81_S	0.825	0.96
230_Y	384_L	0.824	0.95
68_L	71_S	0.824	0.95
158_L	161_E	0.824	0.95
367_R	372_L	0.819	0.95
214_I	220_V	0.819	0.95
51_G	55_A	0.817	0.95
283_L	286_D	0.816	0.95
38_R	84_W	0.815	0.95
124_V	176_R	0.814	0.95
74_Q	78_R	0.807	0.95
393_R	397_Q	0.807	0.95
30_L	76_V	0.805	0.95
133_E	141_E	0.805	0.95
268_L	272_R	0.805	0.95
372_L	382_A	0.804	0.95
303_G	330_T	0.804	0.95
271_K	275_R	0.803	0.95
208_E	297_D	0.800	0.95
313_S	316_T	0.796	0.95
178_E	191_S	0.796	0.95
357_P	386_A	0.796	0.95
287_L	299_V	0.792	0.94
354_Q	363_D	0.789	0.94
158_L	165_N	0.786	0.94
262_S	266_R	0.784	0.94
9_V	190_A	0.782	0.94
358_R	388_E	0.781	0.94
173_K	195_T	0.780	0.94
357_P	392_E	0.779	0.94
241_F	272_R	0.777	0.94
75_Q	124_V	0.776	0.94
396_K	399_V	0.776	0.94
21_R	182_D	0.775	0.94
327_K	331_E	0.775	0.94
365_T	372_L	0.773	0.94
312_W	316_T	0.773	0.94
279_A	283_L	0.769	0.94
33_E	37_Q	0.768	0.93
311_H	315_K	0.766	0.93
158_L	162_I	0.764	0.93
386_A	389_T	0.764	0.93
26_A	68_L	0.762	0.93
313_S	320_T	0.760	0.93
36_Y	111_F	0.759	0.93
65_K	73_A	0.757	0.93
228_E	231_L	0.754	0.93
388_E	391_L	0.749	0.93
264_R	267_R	0.748	0.93
298_T	345_E	0.747	0.93
299_V	333_L	0.747	0.93
285_R	336_T	0.746	0.92
364_R	367_R	0.742	0.92
385_T	389_T	0.741	0.92
345_E	394_H	0.741	0.92
289_D	298_T	0.740	0.92
26_A	64_Y	0.738	0.92
220_V	329_F	0.737	0.92
22_D	26_A	0.735	0.92
213_D	383_D	0.733	0.92
19_L	23_L	0.731	0.92
87_F	109_P	0.731	0.92
307_V	326_F	0.730	0.92
203_T	206_A	0.729	0.92
77_I	81_S	0.725	0.91
176_R	193_P	0.724	0.91
121_L	124_V	0.723	0.91
355_E	389_T	0.719	0.91
140_L	177_L	0.714	0.91
50_G	54_D	0.711	0.91
26_A	29_A	0.710	0.91
23_L	27_S	0.709	0.90
25_D	29_A	0.708	0.90
46_D	49_E	0.706	0.90
313_S	321_H	0.706	0.90
158_L	163_A	0.705	0.90
251_L	255_L	0.704	0.90
75_Q	79_K	0.702	0.90
21_R	183_E	0.700	0.90
245_T	265_I	0.696	0.90
23_L	68_L	0.696	0.90
183_E	187_T	0.694	0.89
225_T	384_L	0.693	0.89
71_S	74_Q	0.692	0.89
71_S	129_A	0.692	0.89
300_Y	391_L	0.692	0.89
205_L	208_E	0.690	0.89
42_Y	84_W	0.689	0.89
8_A	189_R	0.689	0.89
351_W	355_E	0.689	0.89
333_L	344_V	0.686	0.89
123_T	126_R	0.686	0.89
33_E	63_R	0.685	0.89
26_A	65_K	0.682	0.89
236_E	275_R	0.680	0.89
314_V	321_H	0.678	0.88
207_D	297_D	0.677	0.88
233_E	324_W	0.677	0.88
80_N	84_W	0.675	0.88
142_I	145_G	0.675	0.88
58_G	62_G	0.666	0.88
300_Y	345_E	0.666	0.88
208_E	226_T	0.665	0.87
304_L	349_E	0.663	0.87
42_Y	45_E	0.661	0.87
272_R	322_N	0.660	0.87
251_L	257_E	0.660	0.87
37_Q	40_M	0.660	0.87
255_L	258_G	0.659	0.87
395_T	399_V	0.654	0.87
353_S	367_R	0.653	0.86
130_Y	134_W	0.652	0.86
162_I	167_N	0.651	0.86
215_G	220_V	0.651	0.86
219_L	324_W	0.648	0.86
276_R	322_N	0.648	0.86
76_V	80_N	0.646	0.86
23_L	123_T	0.646	0.86
49_E	53_W	0.645	0.86
363_D	369_Q	0.645	0.86
215_G	221_A	0.642	0.86
4_T	193_P	0.639	0.85
42_Y	46_D	0.637	0.85
84_W	87_F	0.637	0.85
290_R	297_D	0.637	0.85
355_E	360_G	0.635	0.85
159_R	162_I	0.633	0.85
6_T	180_W	0.632	0.85
23_L	69_G	0.632	0.85
210_A	296_V	0.631	0.85
362_T	366_T	0.631	0.85
259_R	263_E	0.630	0.84
392_E	395_T	0.629	0.84
242_R	249_A	0.629	0.84
84_W	88_S	0.626	0.84
54_D	77_I	0.626	0.84
58_G	77_I	0.626	0.84
130_Y	143_L	0.624	0.84
33_E	64_Y	0.624	0.84
230_Y	233_E	0.623	0.84
217_N	221_A	0.623	0.84
47_G	50_G	0.618	0.83
165_N	168_W	0.616	0.83
310_T	315_K	0.616	0.83
123_T	127_N	0.614	0.83
230_Y	234_G	0.614	0.83
128_D	131_T	0.612	0.83
353_S	363_D	0.612	0.83
258_G	265_I	0.610	0.83
20_L	123_T	0.607	0.82
70_A	128_D	0.606	0.82
241_F	245_T	0.606	0.82
237_L	318_A	0.605	0.82
395_T	398_A	0.604	0.82
83_A	109_P	0.604	0.82
335_C	339_E	0.603	0.82
54_D	57_T	0.601	0.82
54_D	58_G	0.600	0.82
351_W	362_T	0.599	0.81
218_N	230_Y	0.599	0.81
13_S	18_Q	0.598	0.81
41_R	49_E	0.598	0.81
394_H	398_A	0.596	0.81
118_G	121_L	0.595	0.81
245_T	248_I	0.595	0.81
213_D	353_S	0.595	0.81
77_I	80_N	0.594	0.81
203_T	342_I	0.594	0.81
4_T	180_W	0.594	0.81
159_R	164_G	0.592	0.81
337_A	340_Y	0.592	0.81
247_E	261_S	0.591	0.81
122_R	126_R	0.591	0.81
20_L	24_L	0.588	0.80
251_L	256_P	0.586	0.80
219_L	284_C	0.586	0.80
219_L	280_Q	0.585	0.80
172_E	194_V	0.584	0.80
269_Y	276_R	0.583	0.80
222_C	225_T	0.583	0.80
10_R	163_A	0.582	0.80
22_D	68_L	0.582	0.80
274_R	278_H	0.580	0.79
277_D	281_E	0.580	0.79
14_E	18_Q	0.578	0.79
244_T	251_L	0.578	0.79
381_H	386_A	0.578	0.79
70_A	129_A	0.575	0.79
145_G	158_L	0.573	0.78
26_A	73_A	0.570	0.78
254_K	259_R	0.569	0.78
309_D	320_T	0.569	0.78
355_E	364_R	0.569	0.78
125_I	128_D	0.568	0.78
120_Q	123_T	0.568	0.78
22_D	25_D	0.566	0.78
220_V	231_L	0.565	0.78
217_N	370_D	0.564	0.77
119_R	122_R	0.564	0.77
11_P	17_E	0.564	0.77
234_G	238_F	0.563	0.77
72_T	123_T	0.563	0.77
239_Q	243_E	0.562	0.77
280_Q	283_L	0.561	0.77
300_Y	393_R	0.561	0.77
56_D	61_E	0.561	0.77
125_I	129_A	0.560	0.77
43_N	46_D	0.558	0.77
68_L	73_A	0.558	0.77
332_R	336_T	0.557	0.77
330_T	334_A	0.557	0.77
44_D	48_F	0.556	0.76
233_E	236_E	0.556	0.76
250_R	299_V	0.554	0.76
142_I	177_L	0.551	0.76
231_L	286_D	0.546	0.75
41_R	44_D	0.543	0.75
353_S	366_T	0.543	0.75
365_T	382_A	0.543	0.75
309_D	349_E	0.542	0.75
312_W	321_H	0.542	0.75
6_T	191_S	0.542	0.75
73_A	76_V	0.540	0.74
311_H	320_T	0.540	0.74
358_R	364_R	0.539	0.74
348_S	351_W	0.538	0.74
69_G	123_T	0.538	0.74
300_Y	395_T	0.535	0.74
369_Q	381_H	0.533	0.73
242_R	246_R	0.533	0.73
245_T	269_Y	0.532	0.73
327_K	330_T	0.531	0.73
296_V	342_I	0.529	0.73
234_G	279_A	0.529	0.73
309_D	316_T	0.529	0.73
315_K	319_K	0.528	0.73
354_Q	365_T	0.528	0.73
42_Y	87_F	0.527	0.73
316_T	319_K	0.526	0.72
231_L	283_L	0.525	0.72
262_S	265_I	0.525	0.72
251_L	258_G	0.524	0.72
119_R	123_T	0.522	0.72
312_W	320_T	0.521	0.72
11_P	160_L	0.520	0.72
274_R	277_D	0.520	0.72
282_A	285_R	0.520	0.72
164_G	168_W	0.520	0.72
133_E	139_R	0.519	0.71
130_Y	177_L	0.519	0.71
37_Q	60_L	0.518	0.71
269_Y	273_T	0.517	0.71
310_T	314_V	0.517	0.71
211_A	387_S	0.517	0.71
9_V	160_L	0.516	0.71
244_T	264_R	0.516	0.71
70_A	126_R	0.513	0.71
352_T	355_E	0.513	0.71
19_L	22_D	0.513	0.71
7_F	166_P	0.511	0.70
248_I	258_G	0.511	0.70
87_F	90_L	0.509	0.70
27_S	123_T	0.508	0.70
7_F	168_W	0.508	0.70
120_Q	180_W	0.507	0.70
182_D	186_S	0.506	0.70
161_E	165_N	0.505	0.69
215_G	218_N	0.504	0.69
215_G	219_L	0.503	0.69
380_G	385_T	0.502	0.69
160_L	164_G	0.502	0.69
358_R	380_G	0.500	0.69

Legend: The i and j are positions as given in the UniProt sequence. Only predictions with Prob ≥ 0.7 are listed. For all 3L/2 predictions, click on one of the links below.

Sco = ((raw_sco - min_sco)/(avg_sco - min_sco))/2 + 0.5
Prob = P(contact | Sco, seq80/√len)
seq80 = effective number of sequences, after reducing redundancy to 80% identity

Text file of predictions (all 3L/2 predictions)
Generate restraints for ROSETTA Structure Modeling
Upload PDB model overlay contacts on the model

HHsearch Results:

Legend: GREMLIN results (Prob ≥ 0.7) overlaid on top PDB hits. The grey/red filled circles underneath are pdb residue contacts (min distance < 5 Angstroms). The shade of the circles is based on the top 10 (or top 20 if e-value < 1E-20) HHsearch results which uses the overall probability and per-site alignment prob. Inter oligomeric contacts in the pdb are in shades of red.

PDB	Chains	Cov	%	HHΔ
1nu0A	1	0.2915	96.4	0.926	Contact Map
1vhxA	2	0.3072	95.9	0.929	Contact Map
1iv0A	1	0.2175	94.7	0.934	Contact Map
4ep4A	2	0.3498	73.2	0.954	Contact Map
1qypA	1	0.0987	66.5	0.956	Contact Map
1hjrA	2	0.343	59.8	0.957	Contact Map
4aybP	1	0.0919	57	0.958	Contact Map
3j20Y	1	0.1099	54.6	0.959	Contact Map
2k4xA	1	0.1211	48.8	0.96	Contact Map
1ffkW	1	0.1592	48.6	0.96	Contact Map

Sequence Conservation (Image Generated using WebLogo v3)

Legend: Color is used to show Hydrophobicity (Blue: Hydrophilic, Green: Neutral and Black: Hydrophobic). Amount of gaps is represented by width.

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