A0A087X8Y2_POEFO Loading...

MARVEL domain containing 2-like

AlphaFold DB , UniProt , Accession A0A087X8Y2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 553 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	30.9	Very low	243 Å²	243	176.9 Å²	176.9	100%	1.197	87%	0.868	S	S	*	*				0	139.1	0	-83.1	167.6	158.3	0	0	108.9
2	K	32.7	Very low	30.9	Very low	208 Å²	208	176.9 Å²	176.9	90%	0.904	86%	0.864	S	S	*	*			trans	24.8	124.9	164.9	-64.8	-176.7	177.4	-179.5	0	121.4
3	N	31.7	Very low	30.7	Very low	161 Å²	161	182.2 Å²	182.2	86%	0.861	87%	0.872	S	S	*	*			trans	-52.3	158.6	151.4	-94.5	-19.5	0	0	0	112.6
4	W	29.4	Very low	30.6	Very low	249 Å²	249	174.3 Å²	174.3	94%	0.943	86%	0.863	S	S	*	*			trans	-146.2	131.1	143.7	-133.6	-32.7	0	0	0	112.6
5	S	33.4	Very low	30.5	Very low	93 Å²	93	167.1 Å²	167.1	65%	0.65	85%	0.85	S	S	*	*			trans	-123.1	147.9	162.6	54.9	0	0	0	0	108
6	T	35	Very low	30.6	Very low	116 Å²	116	168.6 Å²	168.6	71%	0.712	85%	0.853	S	S	*	*			trans	166.9	141	131.7	38.7	0	0	0	0	113.9
7	K	32.1	Very low	30.6	Very low	186 Å²	186	166.7 Å²	166.7	81%	0.809	85%	0.846	S	S	*	*			trans	42.3	131.7	138.4	-63.2	179.5	174.4	179.9	0	120.9
8	F	28.8	Very low	30.6	Very low	218 Å²	218	169.2 Å²	169.2	96%	0.956	84%	0.843	S	S	*	*				-129.4	142.7	121.1	-98.7	-86.2	0	0	0	110.9
9	K	29.1	Very low	30.6	Very low	199 Å²	199	165.8 Å²	165.8	87%	0.865	84%	0.837	S	S	*	*			trans	-137.7	131.7	166.2	-178.4	-169.8	-175.4	-166.3	0	101.2
10	G	27.6	Very low	30.6	Very low	66 Å²	66	162.3 Å²	162.3	68%	0.68	83%	0.829	S	S	*	*			cis	142.9	160.7	24.3	0	0	0	0	0	104.7
11	E	27.4	Very low	30.5	Very low	207 Å²	207	158.8 Å²	158.8	97%	0.967	82%	0.819	S	S	*	*			trans	-154.2	150.3	169.3	-125.3	165.6	-166.5	0	0	111
12	E	30.4	Very low	30.5	Very low	177 Å²	177	154.5 Å²	154.5	83%	0.827	80%	0.796	S	S	*	*			trans	-145.8	137.3	-159.3	-160.7	178.7	-162.6	0	0	107.9
13	Y	28.6	Very low	30.4	Very low	245 Å²	245	150.6 Å²	150.6	96%	0.961	79%	0.785	S	S	*	*			trans	178	136.8	161.1	-99.2	-68.6	0	0	0	107.6
14	G	29.4	Very low	30.3	Very low	72 Å²	72	152.8 Å²	152.8	74%	0.742	79%	0.787	S	S	*	*			cis	162.5	148.3	-8.1	0	0	0	0	0	111.3
15	G	29	Very low	30.5	Very low	66 Å²	66	147.3 Å²	147.3	68%	0.68	78%	0.781	S	S	*	*			trans	89.8	115.9	174.9	0	0	0	0	0	114.7
16	E	31.9	Very low	31.1	Very low	191 Å²	191	148.2 Å²	148.2	89%	0.893	78%	0.784	S	S	*	*				74.1	138.6	54.2	-58.4	-179.3	151.2	0	0	112.4
17	D	31.3	Very low	30.9	Very low	137 Å²	137	151 Å²	151	73%	0.733	79%	0.794	S	S	*	*			cis	-161.7	170.9	18.7	-154.8	0.4	0	0	0	115.2
18	R	29.4	Very low	31.1	Very low	211 Å²	211	147.3 Å²	147.3	80%	0.796	79%	0.791	S	S	*	*			trans	79.4	116.1	147.4	-98	179.1	166.4	-177.7	-3.2	125.9
19	S	30.8	Very low	31.8	Very low	105 Å²	105	143.1 Å²	143.1	73%	0.734	79%	0.785	S	S	*	*				51.7	154.1	121.4	-74.5	0	0	0	0	123.8
20	S	30.3	Very low	32	Very low	95 Å²	95	138.5 Å²	138.5	66%	0.664	78%	0.784	S	S	*	*			cis	-176.5	149.2	-19.2	53.3	0	0	0	0	110.8
21	S	29.8	Very low	32.5	Very low	90 Å²	90	141 Å²	141	63%	0.629	79%	0.786	S	S	*	*			trans	39.2	138.8	153.9	68.2	0	0	0	0	121.7
22	H	33.2	Very low	33.4	Very low	153 Å²	153	137.2 Å²	137.2	71%	0.708	78%	0.78	S	S	*	*				-177.8	151.9	60.6	-111.1	-58.4	0	0	0	114.4
23	N	29.2	Very low	33.3	Very low	125 Å²	125	134.2 Å²	134.2	67%	0.668	77%	0.773	S	S	*	*			trans	62.6	109.2	137.8	-64.9	-8.6	0	0	0	123.7
24	K	30.5	Very low	33.3	Very low	208 Å²	208	132.9 Å²	132.9	90%	0.904	77%	0.767	S	S	*	*				168.4	151.9	99.7	-99.2	162.6	-178.5	179.7	0	113.9
25	T	33.4	Very low	33.2	Very low	133 Å²	133	135 Å²	135	82%	0.816	77%	0.765	S	S	*	*			trans	-121	-173.4	173.1	46.2	0	0	0	0	109.5
26	P	46.6	Very low	33.3	Very low	112 Å²	112	136.6 Å²	136.6	73%	0.727	76%	0.761	S	S	*	*				-127	162.7	-56.2	36.7	-23.1	0	0	0	112.6
27	I	31.2	Very low	33.2	Very low	176 Å²	176	136.2 Å²	136.2	90%	0.903	76%	0.759	S	S	*	*			trans	-139.7	140.6	168.9	-61.5	-176.1	0	0	0	112
28	S	35.2	Very low	33.4	Very low	107 Å²	107	135.9 Å²	135.9	75%	0.748	76%	0.762	S	S	*	*			trans	-78.7	166.9	-177.1	-62.4	0	0	0	0	114.7
29	P	43.7	Very low	34	Very low	130 Å²	130	131.6 Å²	131.6	84%	0.844	76%	0.762	S	S	*	*			trans	-83.8	156.7	-173.8	34.3	-36.2	0	0	0	114.1
30	A	32.5	Very low	35	Very low	102 Å²	102	131.9 Å²	131.9	84%	0.843	76%	0.761	S	S	*	*			trans	-107.1	148.2	177	0	0	0	0	0	113
31	V	38.2	Very low	35.5	Very low	119 Å²	119	132.8 Å²	132.8	72%	0.721	77%	0.765	S	S	*	*			trans	-106.1	153.3	179	174.6	0	0	0	0	109.1	V33	V31-V33 HydrophobicContact CG1-CG2 4.04Å
32	P	46.3	Very low	35.5	Very low	128 Å²	128	135.9 Å²	135.9	83%	0.831	77%	0.774	S	S	*	*			trans	-105	147.9	154.7	35.4	-28.6	0	0	0	112
33	V	29.2	Very low	35.4	Very low	113 Å²	113	136.7 Å²	136.7	69%	0.685	78%	0.778	S	S	*	*			trans	-138.9	128.5	-152.6	113.4	0	0	0	0	110.7	V31	V31-V33 HydrophobicContact CG1-CG2 4.04Å
34	W	28.1	Very low	35.5	Very low	218 Å²	218	136 Å²	136	83%	0.826	78%	0.778	S	S	*	*			trans	69	160.5	161.1	-61.7	57.7	0	0	0	115.9
35	V	28.2	Very low	35.5	Very low	116 Å²	116	134 Å²	134	70%	0.703	77%	0.774	S	S	*	*			cis	-139.7	145.1	27.5	173.3	0	0	0	0	112.9
36	T	29.8	Very low	35.3	Very low	100 Å²	100	134.3 Å²	134.3	61%	0.613	77%	0.771	S	S	*	*			trans	-78.6	148	170.4	45.1	0	0	0	0	113.8
37	H	30.2	Very low	34.4	Very low	183 Å²	183	135.1 Å²	135.1	85%	0.847	77%	0.769	S	S	*	*			trans	-157	126.6	140.7	-83.5	-58.4	0	0	0	113.7
38	T	35.3	Very low	34.4	Very low	130 Å²	130	130.9 Å²	130.9	80%	0.798	76%	0.755	S	S	*	*			trans	-122.8	161.6	152.4	38.6	0	0	0	0	105.4
39	P	42.9	Very low	34.3	Very low	121 Å²	121	133.1 Å²	133.1	79%	0.786	76%	0.758	S	S	*	*				-152.2	-140.9	54.1	47.1	-21.9	0	0	0	114.1
40	P	51.4	Low	33.8	Very low	110 Å²	110	134.6 Å²	134.6	71%	0.714	75%	0.754	S	S	*	*			trans	-122.2	-162.6	-133.5	33	-6.8	0	0	0	113.3
41	P	39.6	Very low	33.8	Very low	114 Å²	114	136.9 Å²	136.9	74%	0.74	75%	0.752	S	S	*	*				-148.8	161.8	124.9	37.4	-22	0	0	0	117.3
42	N	30.3	Very low	33.3	Very low	156 Å²	156	134.4 Å²	134.4	83%	0.834	75%	0.75	S	S	*	*			trans	-134	171.1	144.7	-52.3	-76.9	0	0	0	105.5
43	H	30.9	Very low	32.6	Very low	170 Å²	170	137.4 Å²	137.4	79%	0.787	76%	0.756	S	S	*	*			cis	-163.3	-171.8	10	-165.9	-102	0	0	0	108.3
44	V	31.6	Very low	32.5	Very low	110 Å²	110	136.5 Å²	136.5	67%	0.667	76%	0.755	S	S	*	*			trans	86.9	108.1	157.5	-176.6	0	0	0	0	119
45	M	30.2	Very low	32.6	Very low	166 Å²	166	134.3 Å²	134.3	82%	0.818	76%	0.756	S	S	*	*			trans	50.7	147.8	141.5	-47.1	-60.3	-161.9	0	0	120.3
46	D	29.1	Very low	32.6	Very low	140 Å²	140	132.6 Å²	132.6	75%	0.749	75%	0.748	S	S	*	*			cis	-167.1	179.4	22.5	-146.9	-23.4	0	0	0	109.9
47	D	29.5	Very low	32.6	Very low	128 Å²	128	139.2 Å²	139.2	68%	0.684	76%	0.762	S	S	*	*			trans	71.9	102.8	157.5	-83.7	-49.3	0	0	0	123.2
48	S	30.3	Very low	32.5	Very low	87 Å²	87	137.8 Å²	137.8	61%	0.608	77%	0.766	S	S	*	*				82.1	146	111.9	-61.6	0	0	0	0	123.9
49	D	32.7	Very low	32.2	Very low	154 Å²	154	136.8 Å²	136.8	82%	0.824	77%	0.765	S	S	*	*			trans	66.8	147.6	166.7	-50.4	-25.2	0	0	0	118.9
50	E	32.7	Very low	31.5	Very low	161 Å²	161	136.6 Å²	136.6	75%	0.752	77%	0.767	S	S	*	*			cis	-164.9	-179	-26	-107.5	-94.3	115.6	0	0	105.3
51	D	32.8	Very low	30.7	Very low	150 Å²	150	136.9 Å²	136.9	80%	0.802	77%	0.771	S	S	*	*			trans	62.8	130.9	170.5	-60	-39.9	0	0	0	118.9
52	G	27.9	Very low	30.8	Very low	67 Å²	67	137.4 Å²	137.4	69%	0.691	78%	0.775	S	S	*	*			cis	113	76.2	4.2	0	0	0	0	0	113.8
53	M	30.9	Very low	30.8	Very low	192 Å²	192	134.7 Å²	134.7	95%	0.946	77%	0.768	S	S	*	*			trans	-158.7	138.1	142.3	-146.2	51.3	162.8	0	0	114.9
54	S	28.4	Very low	31	Very low	94 Å²	94	134.4 Å²	134.4	66%	0.657	77%	0.772	S	S	*	*			trans	-94.7	152.6	171.9	172.1	0	0	0	0	110.7
55	M	29.2	Very low	31.1	Very low	172 Å²	172	133.5 Å²	133.5	85%	0.847	78%	0.776	S	S	*	*			trans	-166.1	107.1	139	-103	-56.9	155.1	0	0	113.8
56	S	28.4	Very low	31.5	Very low	79 Å²	79	134.1 Å²	134.1	55%	0.552	78%	0.777	S	S	*	*				42.1	108.1	127.4	-53.8	0	0	0	0	123.1
57	R	29.8	Very low	31.7	Very low	240 Å²	240	134.3 Å²	134.3	91%	0.906	78%	0.778	S	S	*	*				53	124.5	113.4	-64.4	179	177.2	-150.5	0.1	121.3
58	T	28.1	Very low	32	Very low	152 Å²	152	132 Å²	132	93%	0.933	77%	0.772	S	S	*	*				-143.6	152.4	119.6	-22.5	0	0	0	0	110.9
59	S	30.2	Very low	32.4	Very low	110 Å²	110	136.1 Å²	136.1	77%	0.769	78%	0.779	S	S	*	*			trans	-118	147.1	-164.8	53.4	0	0	0	0	114.3
60	S	28.3	Very low	32.6	Very low	117 Å²	117	138.9 Å²	138.9	82%	0.818	78%	0.778	S	S	*	*			trans	-153.7	140.7	149.5	56	0	0	0	0	111.8
61	S	34	Very low	32.9	Very low	116 Å²	116	134.7 Å²	134.7	81%	0.811	77%	0.766	S	S	*	*			trans	-140.4	158.2	170.9	-49.9	0	0	0	0	106.9
62	P	41.2	Very low	33.2	Very low	125 Å²	125	133.7 Å²	133.7	81%	0.812	76%	0.758	S	S	*	*				-144.2	166.2	79.3	31.1	-10	0	0	0	116.8
63	S	31.8	Very low	34.1	Very low	98 Å²	98	138.5 Å²	138.5	69%	0.685	76%	0.76	S	S	*	*			trans	-52.2	144.4	165.3	48.2	0	0	0	0	115.9
64	D	33.6	Very low	34.5	Very low	164 Å²	164	133.1 Å²	133.1	88%	0.877	74%	0.741	S	S	*	*				178.5	104.1	126.1	-94.6	-24.9	0	0	0	112.4
65	A	34.8	Very low	35.3	Very low	91 Å²	91	136.1 Å²	136.1	75%	0.752	74%	0.742	S	S	*	*			trans	-156.9	-19.3	175.1	0	0	0	0	0	117.4
66	E	37.3	Very low	36.2	Very low	179 Å²	179	134.1 Å²	134.1	84%	0.836	74%	0.735	S	S	*	*	S	Bend	trans	-86.7	-22.3	-168.9	-92.1	-160.2	119.1	0	0	116.2	S68	E66-S68 VanDerWaalsContact C-N 3.33Å; E66-S68 PolarHBondContact O-N 2.95Å
67	N	33.8	Very low	36.7	Very low	145 Å²	145	141.2 Å²	141.2	78%	0.775	75%	0.749	S	S	*	*	S	Bend	trans	-75.3	-19.9	-168.9	-141.2	-1.5	0	0	0	113.9
68	S	36.2	Very low	37.4	Very low	79 Å²	79	134.3 Å²	134.3	55%	0.552	74%	0.738	S	S	*	*	H	α-helix	trans	-69.5	-39.5	-179.4	-178.4	0	0	0	0	113.3	E66 R70 S71	E66-S68 VanDerWaalsContact C-N 3.33Å; E66-S68 PolarHBondContact O-N 2.95Å; S68-R70 VanDerWaalsContact C-N 3.33Å; S68-R70 PolarHBondContact O-N 3.24Å; S68-S71 PolarHBondContact O-N 2.95Å
69	K	37.8	Very low	38.2	Very low	174 Å²	174	134 Å²	134	76%	0.757	73%	0.729	S	S	*	*	H	α-helix	trans	-71.2	-20	-173.6	-75.8	179.8	178.6	172.3	0	114.5
70	R	37.7	Very low	38.8	Very low	212 Å²	212	135.4 Å²	135.4	80%	0.8	73%	0.727	S	S	*	*	H	α-helix	trans	-81.2	-28.9	175.7	-79.8	-176.4	173.9	173	0.5	113.2	S68	S68-R70 VanDerWaalsContact C-N 3.33Å; S68-R70 PolarHBondContact O-N 3.24Å
71	S	38.6	Very low	39.3	Very low	73 Å²	73	134.8 Å²	134.8	51%	0.51	72%	0.72	S	S	.	*	H	α-helix	trans	-72	-35	-175.5	-170.9	0	0	0	0	114.1	S68 S74	S68-S71 PolarHBondContact O-N 2.95Å; S71-S74 PolarHBondContact O-OG 2.86Å
72	M	40.4	Very low	39.3	Very low	129 Å²	129	139.3 Å²	139.3	64%	0.635	73%	0.725	S	S	*	*	H	α-helix	trans	-74.5	-30.1	178.5	-94.7	177	-96.5	0	0	114	L76	M72-L76 PolarHBondContact O-N 3.05Å
73	K	46.6	Very low	39.3	Very low	167 Å²	167	138.3 Å²	138.3	73%	0.726	72%	0.721	S	S	*	*	H	α-helix	trans	-73.6	-25.5	-178.9	-72.4	-174.2	176.2	-177.5	0	113.5
74	S	39.6	Very low	39.8	Very low	79 Å²	79	141.4 Å²	141.4	55%	0.552	73%	0.729	S	S	*	*	H	α-helix	trans	-76.8	-37.1	175.4	55.5	0	0	0	0	112.5	S71 L76 R77	S71-S74 PolarHBondContact O-OG 2.86Å; S74-L76 VanDerWaalsContact C-N 3.31Å; S74-L76 PolarHBondContact O-N 3.23Å; S74-R77 PolarHBondContact O-N 3.18Å
75	K	44.4	Very low	39.9	Very low	157 Å²	157	139.7 Å²	139.7	68%	0.683	73%	0.73	S	S	*	*	H	α-helix	trans	-68	-23.4	175.8	-80.7	-174.9	172.2	-179	0	114.7	S78	K75-S78 PolarHBondContact O-OG 2.95Å; K75-S78 VanDerWaalsContact O-OG 3.11Å
76	L	47	Very low	40.2	Very low	131 Å²	131	138 Å²	138	69%	0.686	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-80.5	-10.3	177	-90.9	158.1	0	0	0	114.3	M72 S74	M72-L76 PolarHBondContact O-N 3.05Å; S74-L76 VanDerWaalsContact C-N 3.31Å; S74-L76 PolarHBondContact O-N 3.23Å
77	R	40.7	Very low	40.3	Very low	228 Å²	228	137.6 Å²	137.6	86%	0.86	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-87	-4.3	176	-81.3	-169.8	174	-168.3	-1.1	114.7	S74	S74-R77 PolarHBondContact O-N 3.18Å
78	S	43.1	Very low	40.4	Very low	94 Å²	94	138.3 Å²	138.3	66%	0.657	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-101.1	9.1	-175.9	59.5	0	0	0	0	115.3	K75	K75-S78 PolarHBondContact O-OG 2.95Å; K75-S78 VanDerWaalsContact O-OG 3.11Å
79	L	45.7	Very low	40	Very low	145 Å²	145	142.4 Å²	142.4	76%	0.759	74%	0.741	S	S	*	*	S	Bend	trans	-119.6	23.9	-173.6	-68.1	175.3	0	0	0	114.6
80	I	43.4	Very low	39.6	Very low	140 Å²	140	142.6 Å²	142.6	72%	0.718	74%	0.742	S	S	*	*	S	Bend	trans	-119.5	124.5	175.3	-55.4	177.7	0	0	0	109.2
81	P	36.8	Very low	39.2	Very low	104 Å²	104	140.6 Å²	140.6	68%	0.675	74%	0.742	S	S	*	*			trans	-67.8	139.5	179.2	26.9	-33.4	0	0	0	111.9	S83	P81-S83 PolarHBondContact O-N 3.47Å
82	K	35.6	Very low	38.6	Very low	212 Å²	212	142 Å²	142	92%	0.922	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	20.1	-168.9	-66.9	-177	175.5	178.2	0	115.9
83	S	41.5	Very low	38	Very low	103 Å²	103	139.3 Å²	139.3	72%	0.72	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	4.9	-171.8	57.3	0	0	0	0	115.7	P81	P81-S83 PolarHBondContact O-N 3.47Å
84	L	41.8	Very low	37	Very low	164 Å²	164	140.6 Å²	140.6	86%	0.859	77%	0.771	S	S	*	*			trans	-124.9	30.8	-177.7	-134.1	93.3	0	0	0	114.4
85	S	36.1	Very low	36.5	Very low	128 Å²	128	141.4 Å²	141.4	90%	0.895	78%	0.777	S	S	*	*			trans	-107.2	72.4	173.3	-167.3	0	0	0	0	110.8
86	G	40.7	Very low	35.6	Very low	56 Å²	56	141.2 Å²	141.2	58%	0.577	78%	0.783	S	S	*	*	S	Bend	trans	-173.9	137.9	175.3	0	0	0	0	0	108.7
87	I	40	Very low	34.8	Very low	170 Å²	170	140 Å²	140	87%	0.872	79%	0.786	S	S	*	*	S	Bend	trans	70.8	79.6	-173.1	-42.2	160.5	0	0	0	113.1
88	I	34.2	Very low	34.1	Very low	159 Å²	159	137.4 Å²	137.4	82%	0.815	78%	0.784	S	S	*	*			trans	175.6	105.6	134.2	-85.1	148.1	0	0	0	105.9
89	N	29.5	Very low	33.4	Very low	166 Å²	166	138.5 Å²	138.5	89%	0.888	79%	0.787	S	S	*	*			trans	-175	86.3	166.1	-102.5	-16.9	0	0	0	110.1
90	K	29.1	Very low	32.4	Very low	177 Å²	177	137.8 Å²	137.8	77%	0.77	79%	0.788	S	S	*	*			trans	-172.9	102	147.1	-132.7	176.5	174	-178.1	0	113
91	H	27.6	Very low	31.9	Very low	171 Å²	171	141.9 Å²	141.9	79%	0.792	80%	0.795	S	S	*	*				168.4	135.5	110.5	-87.1	94.8	0	0	0	110.3
92	A	27.2	Very low	31.5	Very low	103 Å²	103	143.4 Å²	143.4	85%	0.851	80%	0.802	S	S	*	*			trans	-148.8	153.3	171.9	0	0	0	0	0	108.2
93	G	27.9	Very low	31	Very low	71 Å²	71	143.6 Å²	143.6	73%	0.732	80%	0.797	S	S	*	*			trans	88.5	137.9	-175.7	0	0	0	0	0	113.1
94	E	25	Very low	30.8	Very low	194 Å²	194	145.8 Å²	145.8	91%	0.907	80%	0.799	S	S	*	*			cis	-155.9	172.4	-0.8	-155.1	142.3	127.5	0	0	111.5
95	S	28.4	Very low	30.2	Very low	97 Å²	97	146.4 Å²	146.4	68%	0.678	80%	0.798	S	S	*	*			trans	-89	160.8	-169.8	-52.2	0	0	0	0	114.3
96	D	27.6	Very low	30.3	Very low	152 Å²	152	147.2 Å²	147.2	81%	0.813	79%	0.791	S	S	*	*				162.6	156.4	103.2	-92.6	-24.7	0	0	0	116.9
97	S	28.9	Very low	29.8	Very low	107 Å²	107	152.5 Å²	152.5	75%	0.748	81%	0.805	S	S	*	*			trans	66.2	107.1	153	53.4	0	0	0	0	122.9
98	E	27.1	Very low	29.7	Very low	173 Å²	173	149.7 Å²	149.7	81%	0.808	80%	0.797	S	S	*	*				47.2	124.3	121.2	-76.3	-160.3	134.9	0	0	125.6
99	T	26.8	Very low	29.6	Very low	117 Å²	117	150 Å²	150	72%	0.718	80%	0.801	S	S	*	*			trans	85.7	145	133.2	67.6	0	0	0	0	123.4
100	T	25.3	Very low	30.1	Very low	130 Å²	130	145.3 Å²	145.3	80%	0.798	79%	0.792	S	S	*	*			trans	92.7	118.4	150.6	-51.1	0	0	0	0	119.2
101	R	33	Very low	30.1	Very low	226 Å²	226	143.2 Å²	143.2	85%	0.853	79%	0.794	S	S	*	*			trans	-55	140.7	166.7	-63.3	162.1	160.8	152.8	-7.7	110.9
102	T	29.2	Very low	30.2	Very low	136 Å²	136	146.8 Å²	146.8	83%	0.834	80%	0.801	S	S	*	*				177.7	153.1	111	27.7	0	0	0	0	115
103	R	24	Very low	30.5	Very low	215 Å²	215	148 Å²	148	81%	0.811	80%	0.798	S	S	*	*			trans	67.9	105.6	141.5	-162.1	174.9	-147.5	169.4	3.8	119.2
104	I	37.7	Very low	30.8	Very low	150 Å²	150	149.7 Å²	149.7	77%	0.769	80%	0.798	S	S	*	*			trans	-47.1	132.3	156.1	-61.3	158.4	0	0	0	110.5	I106	I104-I106 HydrophobicContact CG2-CD1 4.44Å; I104-I106 HydrophobicContact CG2-CG1 4.1Å
105	Q	28.2	Very low	31.1	Very low	176 Å²	176	145.8 Å²	145.8	82%	0.822	79%	0.789	S	S	*	*			trans	-126.5	133.3	155.8	-67.2	-169.1	24.8	0	0	109.1
106	I	37.9	Very low	31.3	Very low	146 Å²	146	147.6 Å²	147.6	75%	0.749	80%	0.799	S	S	*	*			trans	-115	128.1	171.1	-62.5	169.1	0	0	0	105.9	I104	I104-I106 HydrophobicContact CG2-CD1 4.44Å; I104-I106 HydrophobicContact CG2-CG1 4.1Å
107	L	31.9	Very low	31.5	Very low	166 Å²	166	146.8 Å²	146.8	87%	0.869	80%	0.799	S	S	*	*			trans	-150.8	169.8	160.8	-126.1	77.6	0	0	0	107.2
108	P	37.3	Very low	31.3	Very low	111 Å²	111	146.9 Å²	146.9	72%	0.721	80%	0.8	S	S	*	*				-122.9	-178.6	-120.9	29.2	-6.8	0	0	0	114
109	N	31.1	Very low	31.8	Very low	165 Å²	165	144 Å²	144	88%	0.882	80%	0.796	S	S	*	*			trans	72.8	89.8	160.9	-123.8	4.6	0	0	0	118.1
110	G	39.9	Very low	31.8	Very low	69 Å²	69	148.6 Å²	148.6	71%	0.711	81%	0.806	S	S	*	*				62.6	83.4	117.4	0	0	0	0	0	119.6
111	T	29.8	Very low	32	Very low	132 Å²	132	150.8 Å²	150.8	81%	0.81	81%	0.812	S	S	*	*			trans	-154.1	114	130.1	-65.9	0	0	0	0	108.4	V113	T111-V113 HydrophobicContact CG2-CG2 4.2Å
112	R	29.3	Very low	31.8	Very low	247 Å²	247	149.2 Å²	149.2	93%	0.932	82%	0.815	S	S	*	*			trans	-102.4	105	169.7	-90.5	-172.7	171.4	167.8	0	109.4
113	V	33.3	Very low	31.6	Very low	129 Å²	129	153.4 Å²	153.4	78%	0.782	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-78.7	126.7	162.9	-178.1	0	0	0	0	108	T111	T111-V113 HydrophobicContact CG2-CG2 4.2Å
114	S	34.3	Very low	31.8	Very low	105 Å²	105	153.4 Å²	153.4	73%	0.734	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-78.3	132.9	179.7	-52.9	0	0	0	0	111.7
115	P	32.8	Very low	31.3	Very low	113 Å²	113	152 Å²	152	73%	0.734	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-68.6	157.6	159.9	-15.7	31.3	0	0	0	111.1
116	P	31.4	Very low	31.2	Very low	134 Å²	134	154.4 Å²	154.4	87%	0.87	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-76.4	146.4	-160.7	29.4	-36.2	0	0	0	114.8
117	V	31.4	Very low	30.7	Very low	136 Å²	136	154.1 Å²	154.1	82%	0.824	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-100.6	131	168.1	172.4	0	0	0	0	109.3
118	S	25.9	Very low	30.5	Very low	109 Å²	109	155.4 Å²	155.4	76%	0.762	81%	0.812	S	S	*	*			trans	168.9	159.2	142.2	-83.3	0	0	0	0	111.6
119	P	37.6	Very low	29.9	Very low	111 Å²	111	155.2 Å²	155.2	72%	0.721	81%	0.814	S	S	*	*			cis	-128.5	150.1	-19.7	33	-16.2	0	0	0	113.5
120	F	26.4	Very low	29.7	Very low	215 Å²	215	153.1 Å²	153.1	94%	0.943	81%	0.812	S	S	*	*			trans	-101.5	124.2	151.5	-92.1	-86.9	0	0	0	108.3
121	L	29.7	Very low	29.1	Very low	175 Å²	175	153.6 Å²	153.6	92%	0.916	82%	0.817	S	S	*	*			trans	-83.5	116.1	166.8	-88	166.3	0	0	0	108.6
122	E	28.6	Very low	29	Very low	194 Å²	194	155.6 Å²	155.6	91%	0.907	82%	0.823	S	S	*	*			trans	-125.5	115.9	161.2	-163.5	165.4	-154.3	0	0	109.5
123	R	25.9	Very low	28.9	Very low	223 Å²	223	148.6 Å²	148.6	84%	0.842	81%	0.812	S	S	*	*			trans	-83.4	112.4	-177.9	173.3	-174.6	-75.6	-113	0.6	108.8
124	R	27.8	Very low	28.7	Very low	215 Å²	215	147.8 Å²	147.8	81%	0.811	81%	0.807	S	S	*	*			trans	-86.7	120.7	167.8	179	178.3	-73.8	177.2	-4	109.2
125	N	25.9	Very low	28.6	Very low	121 Å²	121	151.9 Å²	151.9	65%	0.647	81%	0.812	S	S	*	*			trans	-79	144.9	163.7	-75.3	3.3	0	0	0	109.8
126	W	27	Very low	28.3	Very low	227 Å²	227	153.1 Å²	153.1	86%	0.86	81%	0.812	S	S	*	*			trans	-144.5	135.2	152.3	-92	105.9	0	0	0	106.9
127	D	28.3	Very low	28.3	Very low	139 Å²	139	151.2 Å²	151.2	74%	0.743	80%	0.802	S	S	*	*			trans	-89.4	149.2	175.9	-72.5	-53.3	0	0	0	111.6
128	E	26.2	Very low	28.3	Very low	193 Å²	193	151.5 Å²	151.5	90%	0.902	79%	0.794	S	S	*	*			trans	67.6	150	153.2	-73.5	-172.7	124.9	0	0	123.7
129	S	26	Very low	28.5	Very low	108 Å²	108	154.5 Å²	154.5	76%	0.755	79%	0.794	S	S	*	*			trans	81.3	91	163.6	-155.2	0	0	0	0	119.7
130	S	26	Very low	27.7	Very low	120 Å²	120	153.3 Å²	153.3	84%	0.839	79%	0.788	S	S	*	*				48.4	115.1	119.3	-53.5	0	0	0	0	120.4
131	G	27.9	Very low	27.7	Very low	80 Å²	80	150 Å²	150	83%	0.825	78%	0.779	S	S	*	*			trans	176	89.6	163.4	0	0	0	0	0	115.3
132	N	27.6	Very low	27.6	Very low	173 Å²	173	148.5 Å²	148.5	93%	0.925	77%	0.771	S	S	*	*			trans	-71.3	131.8	165.2	-73.5	-25	0	0	0	110.4
133	S	26.3	Very low	27.5	Very low	100 Å²	100	149.1 Å²	149.1	70%	0.699	77%	0.765	S	S	*	*				170.1	116.1	125.2	178.9	0	0	0	0	113.5
134	T	29.6	Very low	27.5	Very low	112 Å²	112	146.3 Å²	146.3	69%	0.687	76%	0.762	S	S	*	*				13.5	140.9	128.5	16.5	0	0	0	0	122.3
135	K	32.5	Very low	27.3	Very low	191 Å²	191	142.2 Å²	142.2	83%	0.83	76%	0.761	S	S	*	*			trans	76.1	156	148.9	-67	170.6	-176.5	-178.5	0	117.5
136	D	26	Very low	27.9	Very low	139 Å²	139	141.4 Å²	141.4	74%	0.743	76%	0.762	S	S	*	*			cis	-177.1	163.5	-26.2	-171.6	6.4	0	0	0	106.1
137	S	31.8	Very low	27.9	Very low	94 Å²	94	138.4 Å²	138.4	66%	0.657	76%	0.758	S	S	*	*			trans	67.6	161.4	163.4	87.2	0	0	0	0	116.8
138	Q	31	Very low	27.7	Very low	142 Å²	142	140 Å²	140	66%	0.664	76%	0.761	S	S	*	*			cis	-167.5	146.6	-20	-116.7	-177.7	44.4	0	0	108.1
139	K	29.7	Very low	27.5	Very low	173 Å²	173	137.3 Å²	137.3	75%	0.752	76%	0.762	S	S	*	*			trans	55.5	171	145.4	-69.6	176.3	-175.8	160.2	0	119.4
140	S	22.4	Very low	27.4	Very low	85 Å²	85	141.3 Å²	141.3	59%	0.594	77%	0.766	S	S	*	*			cis	-169.8	151.3	-41.4	61.7	0	0	0	0	109.6
141	L	26.6	Very low	27.5	Very low	147 Å²	147	140.4 Å²	140.4	77%	0.77	76%	0.759	S	S	*	*			trans	68.5	110.6	146.1	-70.2	163.1	0	0	0	121.3
142	L	27	Very low	27.5	Very low	142 Å²	142	145.9 Å²	145.9	74%	0.743	76%	0.762	S	S	*	*				69.5	119.4	115.1	-118	166.7	0	0	0	121
143	R	25.7	Very low	27.5	Very low	208 Å²	208	143.3 Å²	143.3	79%	0.785	76%	0.758	S	S	*	*				122	144.1	121.5	-143.6	176.2	-170.2	-170.5	0.9	118
144	Q	27.2	Very low	28	Very low	163 Å²	163	146.4 Å²	146.4	76%	0.762	77%	0.766	S	S	*	*			trans	84.3	107.1	156.2	-93.9	153.4	-14.2	0	0	120.9
145	T	23.3	Very low	28.2	Very low	129 Å²	129	149.4 Å²	149.4	79%	0.791	77%	0.772	S	S	*	*			trans	-79.7	177.9	150.7	50.3	0	0	0	0	111
146	P	38.7	Very low	28.2	Very low	105 Å²	105	149.5 Å²	149.5	68%	0.682	78%	0.776	S	S	*	*			cis	-132.8	-175.2	-1.3	37.2	-17.9	0	0	0	115.9
147	Q	25.2	Very low	28.5	Very low	163 Å²	163	151.7 Å²	151.7	76%	0.762	78%	0.781	S	S	*	*			trans	109.8	126.8	142	-144.5	107.5	-8	0	0	119
148	E	24.2	Very low	28.8	Very low	174 Å²	174	151.9 Å²	151.9	81%	0.813	78%	0.783	S	S	*	*			trans	72.3	91.7	161.4	-41.2	-157.8	164.7	0	0	121.4
149	C	22.9	Very low	29.1	Very low	135 Å²	135	152.5 Å²	152.5	91%	0.912	79%	0.79	S	S	*	*				-158	151.3	110.6	-150.8	0	0	0	0	112.7
150	F	23.6	Very low	29.8	Very low	192 Å²	192	152.3 Å²	152.3	84%	0.842	80%	0.796	S	S	*	*			trans	-58.6	148.4	-168	-99.5	-124.4	0	0	0	118.4
151	C	27.2	Very low	31.1	Very low	102 Å²	102	154 Å²	154	69%	0.689	80%	0.803	S	S	*	*			trans	52.5	95.2	145.4	-68	0	0	0	0	121
152	Q	28.4	Very low	32.1	Very low	194 Å²	194	151.5 Å²	151.5	91%	0.907	80%	0.798	S	S	*	*				-167.8	104	112.6	-111.5	162.5	-23.8	0	0	112.4
153	S	28.7	Very low	33.3	Very low	120 Å²	120	150 Å²	150	84%	0.839	79%	0.789	S	S	*	*			trans	-138.9	57.7	178	65.3	0	0	0	0	111.8
154	L	36.6	Very low	34.9	Very low	164 Å²	164	145.7 Å²	145.7	86%	0.859	78%	0.778	S	S	*	*	S	Bend	trans	-162.1	42.8	175.6	-132.7	163.9	0	0	0	115.8
155	Q	33.2	Very low	36.9	Very low	175 Å²	175	141.9 Å²	141.9	82%	0.818	77%	0.768	S	S	*	*	S	Bend	trans	-148.1	10.1	178.1	-151.1	119	23.6	0	0	119.5
156	E	32.3	Very low	39.2	Very low	194 Å²	194	138.4 Å²	138.4	91%	0.907	75%	0.752	S	S	*	*	S	Bend	trans	-127.9	-4.1	-179.1	-97	178.6	163.6	0	0	117.9
157	E	33.2	Very low	40.8	Very low	184 Å²	184	138.8 Å²	138.8	86%	0.86	75%	0.745	S	S	*	*	S	Bend	trans	-98.2	3.2	171.1	-67.6	-160.5	141.2	0	0	114.2	T161	E157-T161 PolarHBondContact O-OG1 3.46Å
158	S	37.2	Very low	43.3	Very low	99 Å²	99	137.4 Å²	137.4	69%	0.692	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	17.1	-172.2	-150.5	0	0	0	0	115.2
159	L	38.6	Very low	45.8	Very low	155 Å²	155	136.2 Å²	136.2	81%	0.812	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	10.2	178.9	-74.7	177.5	0	0	0	114.8
160	L	44.2	Very low	48.6	Very low	169 Å²	169	131.9 Å²	131.9	89%	0.885	70%	0.696	S	S	*	*	S	Bend	trans	-125.3	9.1	174.3	-75.1	174.9	0	0	0	114.5
161	T	48.2	Very low	51.4	Low	119 Å²	119	125.2 Å²	125.2	73%	0.73	68%	0.676	S	S	*	*	S	Bend	trans	-119.5	10.4	-169.5	-16.6	0	0	0	0	114.4	E157	E157-T161 PolarHBondContact O-OG1 3.46Å
162	S	48.8	Very low	54	Low	95 Å²	95	124.9 Å²	124.9	66%	0.664	66%	0.663	S	S	*	*			trans	-116.5	7.7	-175.9	60	0	0	0	0	115.5	H164	S162-H164 PolarHBondContact O-N 3.26Å
163	I	51.6	Low	56.5	Low	111 Å²	111	119.3 Å²	119.3	57%	0.569	64%	0.643	S	S	*	*	S	Bend	trans	-67.1	108.3	163.4	-58.7	178.5	0	0	0	106.6	E167	I163-E167 HydrophobicContact CG2-CB 3.9Å
164	H	59.7	Low	58.8	Low	117 Å²	117	119 Å²	119	54%	0.542	63%	0.627	S	S	.	*			trans	-57.8	141	-178.8	-177.9	-101	0	0	0	108.8	S162 A166 E167 Y168	S162-H164 PolarHBondContact O-N 3.26Å; H164-A166 WeakPolarHBondContact ND1-CB 3.19Å; H164-A166 PolarHBondContact ND1-N 2.82Å; H164-A166 PolarHBondContact O-N 3.01Å; H164-E167 HydrophobicContact CB-CB 4.47Å; H164-E167 HydrophobicContact CB-CG 4.07Å; H164-E167 PolarHBondContact N-OE2 3.35Å; H164-E167 WeakPolarHBondContact O-CA 3.35Å; H164-E167 WeakPolarHBondContact O-CB 3.29Å; H164-E167 PolarHBondContact O-N 3.44Å; H164-Y168 PolarHBondContact O-N 3.26Å; H164-Y168 VanDerWaalsContact O-N 3.11Å
165	P	70	Confident	60.7	Low	84 Å²	84	115.6 Å²	115.6	55%	0.545	61%	0.613	S	S	.	*	H	α-helix	trans	-53.1	-36.7	-175	-29.3	35.5	0	0	0	112.9	E167 Y168 Y169	P165-E167 PolarHBondContact O-N 3.11Å; P165-Y168 PolarHBondContact O-N 3.15Å; P165-Y169 WeakPolarHBondContact O-CD2 3.47Å; P165-Y169 PolarHBondContact O-N 2.84Å
166	A	70	Confident	62.5	Low	56 Å²	56	113.1 Å²	113.1	46%	0.463	60%	0.598	S	S	.	*	H	α-helix	trans	-65.8	-31.1	175.2	0	0	0	0	0	114	H164 A170	H164-A166 WeakPolarHBondContact ND1-CB 3.19Å; H164-A166 PolarHBondContact ND1-N 2.82Å; H164-A166 PolarHBondContact O-N 3.01Å; A166-A170 WeakPolarHBondContact O-CB 3.09Å; A166-A170 PolarHBondContact O-N 3.46Å
167	E	74	Confident	64.3	Low	113 Å²	113	110.3 Å²	110.3	53%	0.528	58%	0.584	S	S	.	*	H	α-helix	trans	-73.7	-38.6	174.7	-66.3	174.3	160	0	0	111.3	I163 H164 P165 A170 A171	I163-E167 HydrophobicContact CG2-CB 3.9Å; H164-E167 HydrophobicContact CB-CB 4.47Å; H164-E167 HydrophobicContact CB-CG 4.07Å; H164-E167 PolarHBondContact N-OE2 3.35Å; H164-E167 WeakPolarHBondContact O-CA 3.35Å; H164-E167 WeakPolarHBondContact O-CB 3.29Å; H164-E167 PolarHBondContact O-N 3.44Å; P165-E167 PolarHBondContact O-N 3.11Å; E167-A170 PolarHBondContact O-N 3.04Å; E167-A171 WeakPolarHBondContact O-CB 3.5Å; E167-A171 PolarHBondContact O-N 2.79Å
168	Y	76.3	Confident	66.1	Low	133 Å²	133	108.3 Å²	108.3	52%	0.522	58%	0.575	S	S	.	*	H	α-helix	trans	-64.1	-42	171.6	177.4	-106.3	0	0	0	111.5	H164 P165 K172	H164-Y168 PolarHBondContact O-N 3.26Å; H164-Y168 VanDerWaalsContact O-N 3.11Å; P165-Y168 PolarHBondContact O-N 3.15Å; Y168-K172 VanDerWaalsContact O-CB 3.29Å; Y168-K172 WeakPolarHBondContact O-CB 3.29Å; Y168-K172 PolarHBondContact O-N 3.04Å
169	Y	77.6	Confident	67.7	Low	150 Å²	150	110 Å²	110	59%	0.588	57%	0.57	S	S	*	*	H	α-helix	trans	-65.3	-39.8	171.9	-74.7	-61.5	0	0	0	112.1	P165 K172 V173	P165-Y169 WeakPolarHBondContact O-CD2 3.47Å; P165-Y169 PolarHBondContact O-N 2.84Å; Y169-K172 PolarHBondContact O-N 3.44Å; Y169-V173 WeakPolarHBondContact O-CB 3.46Å; Y169-V173 VanDerWaalsContact O-CG2 3.25Å; Y169-V173 WeakPolarHBondContact O-CG2 3.4Å; Y169-V173 PolarHBondContact O-N 3.08Å
170	A	82.1	Confident	68.7	Low	44 Å²	44	108.7 Å²	108.7	36%	0.364	56%	0.555	S	S	.	*	H	α-helix	trans	-63.3	-51.5	176.6	0	0	0	0	0	111.4	A166 E167 K172 V173 E174	A166-A170 WeakPolarHBondContact O-CB 3.09Å; A166-A170 PolarHBondContact O-N 3.46Å; E167-A170 PolarHBondContact O-N 3.04Å; A170-K172 VanDerWaalsContact C-N 3.26Å; A170-K172 PolarHBondContact O-N 3.15Å; A170-V173 CarbonylContact O-C 3.59Å; A170-V173 WeakPolarHBondContact O-CA 3.32Å; A170-V173 WeakPolarHBondContact O-CB 3.36Å; A170-V173 PolarHBondContact O-N 3.25Å; A170-E174 WeakPolarHBondContact O-CG 3.42Å; A170-E174 PolarHBondContact O-N 3.42Å
171	A	81.1	Confident	69.8	Low	51 Å²	51	104 Å²	104	42%	0.421	54%	0.536	S	S	.	.	H	α-helix	trans	-57.7	-39.4	175.6	0	0	0	0	0	111.8	E167 E174 V175	E167-A171 WeakPolarHBondContact O-CB 3.5Å; E167-A171 PolarHBondContact O-N 2.79Å; A171-E174 PolarHBondContact O-N 2.91Å; A171-V175 WeakPolarHBondContact O-CG2 3.2Å; A171-V175 PolarHBondContact O-N 2.96Å
172	K	83.2	Confident	70.2	Confident	95 Å²	95	103.1 Å²	103.1	41%	0.413	52%	0.52	S	S	.	.	H	α-helix	trans	-68	-39.9	174.9	-159.3	175.2	-172.5	176.2	0	112	Y168 Y169 A170 E174 V175 Y176	Y168-K172 VanDerWaalsContact O-CB 3.29Å; Y168-K172 WeakPolarHBondContact O-CB 3.29Å; Y168-K172 PolarHBondContact O-N 3.04Å; Y169-K172 PolarHBondContact O-N 3.44Å; A170-K172 VanDerWaalsContact C-N 3.26Å; A170-K172 PolarHBondContact O-N 3.15Å; K172-E174 VanDerWaalsContact C-N 3.35Å; K172-V175 PolarHBondContact O-N 2.78Å; K172-Y176 HydrophobicContact CD-CE2 4.38Å; K172-Y176 HydrophobicContact CG-CD2 4.14Å; K172-Y176 HydrophobicContact CG-CE2 3.89Å; K172-Y176 WeakPolarHBondContact O-CD2 3.2Å; K172-Y176 PolarHBondContact O-N 3.39Å
173	V	79.8	Confident	70.8	Confident	78 Å²	78	101.5 Å²	101.5	47%	0.473	50%	0.504	S	S	.	.	H	α-helix	trans	-66.1	-34.8	173.5	166.8	0	0	0	0	111.6	Y169 A170 Y176 Q177	Y169-V173 WeakPolarHBondContact O-CB 3.46Å; Y169-V173 VanDerWaalsContact O-CG2 3.25Å; Y169-V173 WeakPolarHBondContact O-CG2 3.4Å; Y169-V173 PolarHBondContact O-N 3.08Å; A170-V173 CarbonylContact O-C 3.59Å; A170-V173 WeakPolarHBondContact O-CA 3.32Å; A170-V173 WeakPolarHBondContact O-CB 3.36Å; A170-V173 PolarHBondContact O-N 3.25Å; V173-Y176 CarbonylContact O-C 3.55Å; V173-Y176 PolarHBondContact O-N 2.88Å; V173-Q177 HydrophobicContact CG1-CG 4.44Å; V173-Q177 WeakPolarHBondContact O-CB 3.43Å; V173-Q177 WeakPolarHBondContact O-CG 3.4Å; V173-Q177 PolarHBondContact O-N 3.1Å
174	E	77.6	Confident	71.7	Confident	112 Å²	112	105.5 Å²	105.5	52%	0.523	52%	0.517	S	S	.	.	H	α-helix	trans	-68.9	-42.9	173.8	-75	179.2	-171.5	0	0	111.6	A170 A171 K172 Y176 Q177 Q178	A170-E174 WeakPolarHBondContact O-CG 3.42Å; A170-E174 PolarHBondContact O-N 3.42Å; A171-E174 PolarHBondContact O-N 2.91Å; K172-E174 VanDerWaalsContact C-N 3.35Å; E174-Y176 VanDerWaalsContact C-N 3.32Å; E174-Y176 PolarHBondContact O-N 3.34Å; E174-Q177 CarbonylContact O-C 3.59Å; E174-Q177 PolarHBondContact O-N 2.96Å; E174-Q177 VanDerWaalsContact O-N 3.14Å; E174-Q178 WeakPolarHBondContact O-CB 3.35Å; E174-Q178 WeakPolarHBondContact O-CG 3.36Å; E174-Q178 PolarHBondContact O-N 3.27Å
175	V	75.9	Confident	72.8	Confident	93 Å²	93	101.9 Å²	101.9	56%	0.564	51%	0.505	S	S	*	.	H	α-helix	trans	-61.1	-41.3	171.3	169.9	0	0	0	0	110.8	A171 K172 K179	A171-V175 WeakPolarHBondContact O-CG2 3.2Å; A171-V175 PolarHBondContact O-N 2.96Å; K172-V175 PolarHBondContact O-N 2.78Å; V175-K179 WeakPolarHBondContact O-CB 3.41Å; V175-K179 PolarHBondContact O-N 3.46Å
176	Y	70.5	Confident	73.4	Confident	124 Å²	124	101.8 Å²	101.8	49%	0.486	49%	0.494	S	S	.	.	H	α-helix	trans	-64.5	-43.1	170.6	-80.6	-64.5	0	0	0	111.9	K172 V173 E174 Q178 K179 Y180	K172-Y176 HydrophobicContact CD-CE2 4.38Å; K172-Y176 HydrophobicContact CG-CD2 4.14Å; K172-Y176 HydrophobicContact CG-CE2 3.89Å; K172-Y176 WeakPolarHBondContact O-CD2 3.2Å; K172-Y176 PolarHBondContact O-N 3.39Å; V173-Y176 CarbonylContact O-C 3.55Å; V173-Y176 PolarHBondContact O-N 2.88Å; E174-Y176 VanDerWaalsContact C-N 3.32Å; E174-Y176 PolarHBondContact O-N 3.34Å; Y176-Q178 PolarHBondContact O-N 3.22Å; Y176-K179 CarbonylContact O-C 3.47Å; Y176-K179 PolarHBondContact O-N 3.33Å; Y176-Y180 HydrophobicContact CD1-CD2 4.27Å; Y176-Y180 AromaticContact CD1-CE2 3.9Å; Y176-Y180 HydrophobicContact CD1-CE2 3.9Å; Y176-Y180 HydrophobicContact CE1-CE2 4.49Å; Y176-Y180 WeakPolarHBondContact O-CB 3.45Å; Y176-Y180 VanDerWaalsContact O-CD2 3.25Å; Y176-Y180 WeakPolarHBondContact O-CD2 3.49Å; Y176-Y180 PolarHBondContact O-N 3.37Å
177	Q	71.1	Confident	73.9	Confident	134 Å²	134	100.5 Å²	100.5	63%	0.626	48%	0.481	S	S	*	.	H	α-helix	trans	-64.1	-41.4	178.4	-84.2	-172.2	-13.8	0	0	111.8	V173 E174 Y180 S181	V173-Q177 HydrophobicContact CG1-CG 4.44Å; V173-Q177 WeakPolarHBondContact O-CB 3.43Å; V173-Q177 WeakPolarHBondContact O-CG 3.4Å; V173-Q177 PolarHBondContact O-N 3.1Å; E174-Q177 CarbonylContact O-C 3.59Å; E174-Q177 PolarHBondContact O-N 2.96Å; E174-Q177 VanDerWaalsContact O-N 3.14Å; Q177-Y180 CarbonylContact O-C 3.6Å; Q177-Y180 PolarHBondContact O-N 2.95Å; Q177-S181 WeakPolarHBondContact O-CA 3.4Å; Q177-S181 VanDerWaalsContact O-CB 3.22Å; Q177-S181 WeakPolarHBondContact O-CB 3.42Å; Q177-S181 PolarHBondContact O-N 2.72Å
178	Q	69.9	Low	74.2	Confident	143 Å²	143	95.6 Å²	95.6	67%	0.668	46%	0.461	S	S	*	.	H	α-helix	trans	-63.1	-45.8	172.6	-70.1	-179.4	7.6	0	0	110.4	E174 Y176 Y180 S181	E174-Q178 WeakPolarHBondContact O-CB 3.35Å; E174-Q178 WeakPolarHBondContact O-CG 3.36Å; E174-Q178 PolarHBondContact O-N 3.27Å; Y176-Q178 PolarHBondContact O-N 3.22Å; Q178-Y180 VanDerWaalsContact C-N 3.27Å; Q178-Y180 PolarHBondContact O-N 3.34Å; Q178-S181 PolarHBondContact O-N 3.49Å; Q178-S181 PolarHBondContact O-OG 2.75Å
179	K	70.7	Confident	74.7	Confident	134 Å²	134	92.7 Å²	92.7	58%	0.583	45%	0.454	S	S	*	.	H	α-helix	trans	-70.8	-11.1	177.4	-169	170.5	-178.9	179.2	0	114.7	V175 Y176 Y182	V175-K179 WeakPolarHBondContact O-CB 3.41Å; V175-K179 PolarHBondContact O-N 3.46Å; Y176-K179 CarbonylContact O-C 3.47Å; Y176-K179 PolarHBondContact O-N 3.33Å; K179-Y182 WeakPolarHBondContact O-CD1 3.44Å; K179-Y182 WeakPolarHBondContact O-CE1 3.42Å; K179-Y182 PolarHBondContact O-OH 2.67Å
180	Y	61.1	Low	75.2	Confident	128 Å²	128	85.9 Å²	85.9	50%	0.502	43%	0.427	S	S	.	.	H	α-helix	trans	-120.1	-1.1	175.2	-75.3	-104.3	0	0	0	112.8	Y176 Q177 Q178 Y182 L183 K184	Y176-Y180 HydrophobicContact CD1-CD2 4.27Å; Y176-Y180 AromaticContact CD1-CE2 3.9Å; Y176-Y180 HydrophobicContact CD1-CE2 3.9Å; Y176-Y180 HydrophobicContact CE1-CE2 4.49Å; Y176-Y180 WeakPolarHBondContact O-CB 3.45Å; Y176-Y180 VanDerWaalsContact O-CD2 3.25Å; Y176-Y180 WeakPolarHBondContact O-CD2 3.49Å; Y176-Y180 PolarHBondContact O-N 3.37Å; Q177-Y180 CarbonylContact O-C 3.6Å; Q177-Y180 PolarHBondContact O-N 2.95Å; Q178-Y180 VanDerWaalsContact C-N 3.27Å; Q178-Y180 PolarHBondContact O-N 3.34Å; Y180-Y182 PolarHBondContact O-N 3.44Å; Y180-L183 HydrophobicContact CD1-CD1 3.43Å; Y180-L183 VanDerWaalsContact CD1-CD1 3.43Å; Y180-L183 HydrophobicContact CE1-CD1 3.9Å; Y180-L183 HydrophobicContact CG-CD1 4.27Å; Y180-L183 WeakPolarHBondContact O-CB 3.37Å; Y180-L183 PolarHBondContact O-N 2.81Å; Y180-K184 PolarHBondContact O-N 3.03Å
181	S	66.7	Low	75.6	Confident	69 Å²	69	86.1 Å²	86.1	48%	0.483	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-33.3	175.7	64.3	0	0	0	0	112.4	Q177 Q178 K184 S185	Q177-S181 WeakPolarHBondContact O-CA 3.4Å; Q177-S181 VanDerWaalsContact O-CB 3.22Å; Q177-S181 WeakPolarHBondContact O-CB 3.42Å; Q177-S181 PolarHBondContact O-N 2.72Å; Q178-S181 PolarHBondContact O-N 3.49Å; Q178-S181 PolarHBondContact O-OG 2.75Å; S181-K184 PolarHBondContact O-N 3.13Å; S181-S185 PolarHBondContact O-N 3.46Å
182	Y	57.3	Low	76	Confident	101 Å²	101	88.3 Å²	88.3	40%	0.396	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-32.2	176.2	66.9	-104.8	0	0	0	112.7	K179 Y180 K184 S185 G188	K179-Y182 WeakPolarHBondContact O-CD1 3.44Å; K179-Y182 WeakPolarHBondContact O-CE1 3.42Å; K179-Y182 PolarHBondContact O-OH 2.67Å; Y180-Y182 PolarHBondContact O-N 3.44Å; Y182-K184 VanDerWaalsContact C-N 3.28Å; Y182-K184 PolarHBondContact O-N 2.79Å; Y182-S185 WeakPolarHBondContact O-CB 3.44Å; Y182-S185 PolarHBondContact O-N 3.26Å; Y182-S185 VanDerWaalsContact O-N 3.13Å; Y182-S185 PolarHBondContact O-OG 3.38Å; Y182-G188 WeakPolarHBondContact O-CA 3.45Å
183	L	60.9	Low	76.4	Confident	62 Å²	62	85.2 Å²	85.2	33%	0.325	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-27.1	174.3	-79.4	148.1	0	0	0	111.9	Y180 S185 L192	Y180-L183 HydrophobicContact CD1-CD1 3.43Å; Y180-L183 VanDerWaalsContact CD1-CD1 3.43Å; Y180-L183 HydrophobicContact CE1-CD1 3.9Å; Y180-L183 HydrophobicContact CG-CD1 4.27Å; Y180-L183 WeakPolarHBondContact O-CB 3.37Å; Y180-L183 PolarHBondContact O-N 2.81Å; L183-S185 VanDerWaalsContact C-N 3.28Å; L183-L192 HydrophobicContact CD2-CD1 4.03Å
184	K	70.4	Confident	77	Confident	195 Å²	195	82 Å²	82	85%	0.848	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-7.4	171.7	-159.9	169.9	-177.4	176.1	0	113.2	Y180 S181 Y182	Y180-K184 PolarHBondContact O-N 3.03Å; S181-K184 PolarHBondContact O-N 3.13Å; Y182-K184 VanDerWaalsContact C-N 3.28Å; Y182-K184 PolarHBondContact O-N 2.79Å
185	S	81.8	Confident	77.8	Confident	41 Å²	41	78.2 Å²	78.2	29%	0.287	38%	0.384	S	S	.	.	S	Bend	trans	-87.1	146	176.7	80.7	0	0	0	0	111.7	S181 Y182 L183 G188 L189	S181-S185 PolarHBondContact O-N 3.46Å; Y182-S185 WeakPolarHBondContact O-CB 3.44Å; Y182-S185 PolarHBondContact O-N 3.26Å; Y182-S185 VanDerWaalsContact O-N 3.13Å; Y182-S185 PolarHBondContact O-OG 3.38Å; L183-S185 VanDerWaalsContact C-N 3.28Å; S185-G188 PolarHBondContact O-N 3.33Å; S185-G188 PolarHBondContact OG-N 2.73Å; S185-L189 PolarHBondContact O-N 3.24Å
186	W	82.8	Confident	78.7	Confident	82 Å²	82	76.7 Å²	76.7	31%	0.311	37%	0.372	S	S	.	.	H	α-helix	trans	-52.2	-43.7	178.5	-61.3	100.3	0	0	0	113.8	G188 L189 L190 A353 K356 M357	W186-G188 VanDerWaalsContact C-N 3.33Å; W186-G188 PolarHBondContact O-N 2.93Å; W186-L189 HydrophobicContact CE3-CD2 4.11Å; W186-L189 HydrophobicContact CZ3-CD2 3.98Å; W186-L189 PolarHBondContact O-N 3.35Å; W186-L190 WeakPolarHBondContact O-CG 3.45Å; W186-L190 PolarHBondContact O-N 2.94Å; W186-L190 VanDerWaalsContact O-N 3.11Å; W186-A353 HydrophobicContact CE3-CB 4.28Å; W186-K356 HydrophobicContact CE3-CB 4.48Å; W186-K356 HydrophobicContact CH2-CD 3.45Å; W186-K356 VanDerWaalsContact CH2-CD 3.45Å; W186-K356 VanDerWaalsContact CH2-CE 3.48Å; W186-K356 HydrophobicContact CH2-CG 4.11Å; W186-K356 HydrophobicContact CZ2-CD 3.68Å; W186-K356 HydrophobicContact CZ2-CG 4.02Å; W186-K356 HydrophobicContact CZ3-CB 4.46Å; W186-K356 HydrophobicContact CZ3-CD 3.9Å; W186-K356 HydrophobicContact CZ3-CG 4.32Å; W186-M357 HydrophobicContact CB-CB 3.96Å; W186-M357 HydrophobicContact CB-CG 4.27Å; W186-M357 HydrophobicContact CG-CB 4.47Å
187	P	80.6	Confident	79.9	Confident	28 Å²	28	70.9 Å²	70.9	18%	0.182	35%	0.349	C	S	.	.	H	α-helix	trans	-66.6	-30.2	176.3	-21	33.8	0	0	0	113.8	R191 L276 M357	P187-R191 WeakPolarHBondContact O-CG 3.48Å; P187-L276 HydrophobicContact CB-CD1 4.49Å; P187-L276 HydrophobicContact CB-CD2 4.38Å; P187-L276 HydrophobicContact CG-CD2 3.84Å; P187-M357 HydrophobicContact CG-CE 4.06Å; P187-M357 HydrophobicContact CG-SD 3.96Å
188	G	81.8	Confident	81	Confident	11 Å²	11	65.5 Å²	65.5	11%	0.113	33%	0.325	C	S	.	.	H	α-helix	trans	-75.6	-38.4	176.2	0	0	0	0	0	112.7	Y182 S185 W186 L190 R191 L192	Y182-G188 WeakPolarHBondContact O-CA 3.45Å; S185-G188 PolarHBondContact O-N 3.33Å; S185-G188 PolarHBondContact OG-N 2.73Å; W186-G188 VanDerWaalsContact C-N 3.33Å; W186-G188 PolarHBondContact O-N 2.93Å; G188-L190 VanDerWaalsContact C-N 3.32Å; G188-L190 PolarHBondContact O-N 3.34Å; G188-R191 PolarHBondContact O-N 3.07Å; G188-L192 PolarHBondContact O-N 3.39Å
189	L	86.9	Confident	82.3	Confident	71 Å²	71	63.5 Å²	63.5	37%	0.372	32%	0.318	S	S	.	.	H	α-helix	trans	-58.5	-44	172.7	179	63.8	0	0	0	111.4	S185 W186 R191 L192 L193	S185-L189 PolarHBondContact O-N 3.24Å; W186-L189 HydrophobicContact CE3-CD2 4.11Å; W186-L189 HydrophobicContact CZ3-CD2 3.98Å; W186-L189 PolarHBondContact O-N 3.35Å; L189-R191 PolarHBondContact O-N 3.01Å; L189-L192 PolarHBondContact O-N 2.94Å; L189-L193 WeakPolarHBondContact O-CB 3.23Å; L189-L193 PolarHBondContact O-N 3.16Å
190	L	87.6	Confident	83.4	Confident	7 Å²	7	59.3 Å²	59.3	4%	0.037	30%	0.3	C	S	.	.	H	α-helix	trans	-57.8	-34.4	176.5	-75	167.6	0	0	0	112.8	W186 G188 A194 A353 C354 M357	W186-L190 WeakPolarHBondContact O-CG 3.45Å; W186-L190 PolarHBondContact O-N 2.94Å; W186-L190 VanDerWaalsContact O-N 3.11Å; G188-L190 VanDerWaalsContact C-N 3.32Å; G188-L190 PolarHBondContact O-N 3.34Å; L190-A194 WeakPolarHBondContact O-CB 3.32Å; L190-A194 PolarHBondContact O-N 3.17Å; L190-A353 HydrophobicContact CD2-CB 3.73Å; L190-A353 HydrophobicContact CG-CB 4.24Å; L190-C354 VanDerWaalsContact CD2-SG 3.6Å; L190-M357 HydrophobicContact CD1-SD 4.13Å
191	R	90.1	Very high	85	Confident	49 Å²	49	53.2 Å²	53.2	19%	0.185	28%	0.276	C	S	.	.	H	α-helix	trans	-78	-36.5	178.6	-58.1	-164	-167	173.7	-1.6	113.8	P187 G188 L189 L193 A194 G195 L263 G266	P187-R191 WeakPolarHBondContact O-CG 3.48Å; G188-R191 PolarHBondContact O-N 3.07Å; L189-R191 PolarHBondContact O-N 3.01Å; R191-L193 VanDerWaalsContact C-N 3.27Å; R191-A194 PolarHBondContact O-N 3.47Å; R191-G195 PolarHBondContact O-N 2.98Å; R191-L263 HydrophobicContact CB-CD1 4.09Å; R191-G266 PolarHBondContact NH1-O 3.41Å; R191-G266 PolarHBondContact NH2-O 3.36Å
192	L	90.2	Very high	86.3	Confident	98 Å²	98	51.3 Å²	51.3	51%	0.513	27%	0.267	S	S	.	.	H	α-helix	trans	-60.4	-45.8	170.7	-167.8	165.3	0	0	0	109	L183 G188 L189 G195 L196	L183-L192 HydrophobicContact CD2-CD1 4.03Å; G188-L192 PolarHBondContact O-N 3.39Å; L189-L192 PolarHBondContact O-N 2.94Å; L192-G195 PolarHBondContact O-N 3.32Å; L192-L196 WeakPolarHBondContact O-CB 3.06Å; L192-L196 PolarHBondContact O-N 3.33Å
193	L	91.5	Very high	88	Confident	30 Å²	30	50.8 Å²	50.8	16%	0.157	27%	0.27	C	S	.	.	H	α-helix	trans	-65.7	-39.2	179.1	-159.7	57.6	0	0	0	112.4	L189 R191 L196 Q197 M346 S350	L189-L193 WeakPolarHBondContact O-CB 3.23Å; L189-L193 PolarHBondContact O-N 3.16Å; R191-L193 VanDerWaalsContact C-N 3.27Å; L193-L196 HydrophobicContact CD1-CD2 4.43Å; L193-L196 WeakPolarHBondContact O-CB 3.4Å; L193-L196 PolarHBondContact O-N 3.48Å; L193-Q197 VanDerWaalsContact O-CG 3.25Å; L193-Q197 WeakPolarHBondContact O-CG 3.26Å; L193-Q197 PolarHBondContact O-N 3.46Å; L193-M346 HydrophobicContact CD1-CB 4.3Å; L193-M346 HydrophobicContact CD1-CG 4.14Å; L193-S350 WeakPolarHBondContact CD2-OG 3.34Å
194	A	92.4	Very high	89.5	Confident	10 Å²	10	48 Å²	48	8%	0.083	26%	0.255	C	S	.	.	H	α-helix	trans	-65.3	-39.9	172.8	0	0	0	0	0	113.1	L190 R191 L196 Q197 L198 L263	L190-A194 WeakPolarHBondContact O-CB 3.32Å; L190-A194 PolarHBondContact O-N 3.17Å; R191-A194 PolarHBondContact O-N 3.47Å; A194-L196 VanDerWaalsContact C-N 3.31Å; A194-L196 PolarHBondContact O-N 3.37Å; A194-Q197 WeakPolarHBondContact O-CB 3.41Å; A194-Q197 PolarHBondContact O-N 3.01Å; A194-L198 WeakPolarHBondContact O-CG 3.38Å; A194-L198 PolarHBondContact O-N 3.15Å; A194-L263 HydrophobicContact CB-CD1 4.36Å
195	G	93.7	Very high	90.5	Very high	33 Å²	33	39.5 Å²	39.5	34%	0.34	22%	0.221	S	C	.	.	H	α-helix	trans	-62.6	-38.8	172.3	0	0	0	0	0	112.3	R191 L192 L198 L199	R191-G195 PolarHBondContact O-N 2.98Å; L192-G195 PolarHBondContact O-N 3.32Å; G195-L198 PolarHBondContact O-N 3.23Å; G195-L199 PolarHBondContact O-N 2.91Å; G195-L199 VanDerWaalsContact O-N 3.16Å
196	L	94.3	Very high	91.1	Very high	60 Å²	60	40 Å²	40	31%	0.314	23%	0.227	S	C	.	.	H	α-helix	trans	-67.6	-38.6	174.8	-164.6	65.5	0	0	0	111.8	L192 L193 A194 L199 F200 M346	L192-L196 WeakPolarHBondContact O-CB 3.06Å; L192-L196 PolarHBondContact O-N 3.33Å; L193-L196 HydrophobicContact CD1-CD2 4.43Å; L193-L196 WeakPolarHBondContact O-CB 3.4Å; L193-L196 PolarHBondContact O-N 3.48Å; A194-L196 VanDerWaalsContact C-N 3.31Å; A194-L196 PolarHBondContact O-N 3.37Å; L196-L199 PolarHBondContact O-N 2.87Å; L196-F200 HydrophobicContact CD1-CD2 4.04Å; L196-F200 HydrophobicContact CD1-CE2 3.61Å; L196-F200 HydrophobicContact CD2-CE2 4.23Å; L196-F200 HydrophobicContact CG-CD2 3.85Å; L196-F200 HydrophobicContact CG-CE2 3.72Å; L196-F200 WeakPolarHBondContact O-CD2 3.36Å; L196-F200 PolarHBondContact O-N 3Å; L196-M346 HydrophobicContact CB-CE 3.91Å; L196-M346 HydrophobicContact CD2-CE 4.1Å; L196-M346 HydrophobicContact CD2-SD 3.87Å; L196-M346 HydrophobicContact CG-CE 3.75Å; L196-M346 HydrophobicContact CG-SD 4.02Å
197	Q	95.3	Very high	91.5	Very high	2 Å²	2	37 Å²	37	1%	0.009	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-43.5	175.2	-75.6	160.6	0.1	0	0	111.6	L193 A194 L199 G201 T259 N343 M346 Y347 S350	L193-Q197 VanDerWaalsContact O-CG 3.25Å; L193-Q197 WeakPolarHBondContact O-CG 3.26Å; L193-Q197 PolarHBondContact O-N 3.46Å; A194-Q197 WeakPolarHBondContact O-CB 3.41Å; A194-Q197 PolarHBondContact O-N 3.01Å; Q197-L199 VanDerWaalsContact C-N 3.35Å; Q197-L199 PolarHBondContact O-N 3.32Å; Q197-G201 WeakPolarHBondContact O-CA 3.31Å; Q197-G201 PolarHBondContact O-N 2.72Å; Q197-T259 HydrophobicContact CB-CG2 4.4Å; Q197-N343 WeakPolarHBondContact CA-OD1 3.48Å; Q197-N343 PolarHBondContact O-ND2 2.88Å; Q197-N343 PolarHBondContact O-OD1 2.93Å; Q197-M346 HydrophobicContact CB-CE 4.03Å; Q197-M346 HydrophobicContact CG-CB 4.02Å; Q197-M346 HydrophobicContact CG-CE 3.48Å; Q197-M346 VanDerWaalsContact CG-CE 3.48Å; Q197-M346 PolarHBondContact NE2-O 3.49Å; Q197-Y347 HydrophobicContact CB-CE1 4.41Å; Q197-Y347 HydrophobicContact CG-CD1 4.46Å; Q197-Y347 HydrophobicContact CG-CE1 4.1Å; Q197-S350 PolarHBondContact NE2-OG 3.06Å
198	L	95.9	Very high	91.9	Very high	21 Å²	21	35.9 Å²	35.9	11%	0.11	21%	0.211	C	C	.	.	H	α-helix	trans	-63.1	-39.2	175.1	-72.4	169.3	0	0	0	112.7	A194 G195 G202 W256 T259 L260 L263	A194-L198 WeakPolarHBondContact O-CG 3.38Å; A194-L198 PolarHBondContact O-N 3.15Å; G195-L198 PolarHBondContact O-N 3.23Å; L198-G202 PolarHBondContact O-N 2.97Å; L198-W256 HydrophobicContact CD2-CD2 3.89Å; L198-W256 HydrophobicContact CD2-CG 3.86Å; L198-W256 HydrophobicContact CD2-CZ2 4.37Å; L198-W256 WeakPolarHBondContact CD2-O 3.28Å; L198-W256 PolarHBondContact O-NE1 3.48Å; L198-T259 VanDerWaalsContact CD2-OG1 3.29Å; L198-T259 WeakPolarHBondContact CD2-OG1 3.4Å; L198-L260 HydrophobicContact CD1-CB 4.45Å; L198-L260 HydrophobicContact CD1-CD1 4.14Å; L198-L260 HydrophobicContact CD2-CB 3.95Å; L198-L263 HydrophobicContact CD1-CB 4.4Å; L198-L263 HydrophobicContact CD1-CD2 3.56Å
199	L	95.5	Very high	92.4	Very high	101 Å²	101	39.7 Å²	39.7	53%	0.529	23%	0.228	S	C	.	.	H	α-helix	trans	-64	-59.4	176.9	-171.9	163.8	0	0	0	110.6	G195 L196 Q197 G201 G202 M203	G195-L199 PolarHBondContact O-N 2.91Å; G195-L199 VanDerWaalsContact O-N 3.16Å; L196-L199 PolarHBondContact O-N 2.87Å; Q197-L199 VanDerWaalsContact C-N 3.35Å; Q197-L199 PolarHBondContact O-N 3.32Å; L199-G201 PolarHBondContact O-N 3.01Å; L199-G202 PolarHBondContact O-N 3.26Å; L199-M203 HydrophobicContact CD2-CG 4.19Å; L199-M203 WeakPolarHBondContact O-CG 3.41Å; L199-M203 PolarHBondContact O-N 3.38Å
200	F	94.4	Very high	92.5	Very high	47 Å²	47	39.9 Å²	39.9	21%	0.206	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-24.5	179.5	-73.2	-62.7	0	0	0	112.6	L196 A204 F339 I342 N343 M346	L196-F200 HydrophobicContact CD1-CD2 4.04Å; L196-F200 HydrophobicContact CD1-CE2 3.61Å; L196-F200 HydrophobicContact CD2-CE2 4.23Å; L196-F200 HydrophobicContact CG-CD2 3.85Å; L196-F200 HydrophobicContact CG-CE2 3.72Å; L196-F200 WeakPolarHBondContact O-CD2 3.36Å; L196-F200 PolarHBondContact O-N 3Å; F200-A204 VanDerWaalsContact O-CB 3.27Å; F200-A204 WeakPolarHBondContact O-CB 3.32Å; F200-A204 PolarHBondContact O-N 3.42Å; F200-F339 AromaticContact CD1-CD1 3.6Å; F200-F339 HydrophobicContact CD1-CD1 3.6Å; F200-F339 AromaticContact CD1-CE1 3.94Å; F200-F339 HydrophobicContact CD1-CE1 3.94Å; F200-F339 HydrophobicContact CE1-CD1 4.02Å; F200-F339 AromaticContact CE1-CE1 3.98Å; F200-F339 HydrophobicContact CE1-CE1 3.98Å; F200-I342 HydrophobicContact CD1-CG2 4.37Å; F200-I342 HydrophobicContact CD2-CG2 3.88Å; F200-I342 HydrophobicContact CE1-CG2 4.49Å; F200-I342 HydrophobicContact CE2-CG2 4Å; F200-I342 HydrophobicContact CG-CG2 4.07Å; F200-I342 HydrophobicContact CZ-CG2 4.31Å; F200-N343 PolarHBondContact O-ND2 3.31Å; F200-M346 HydrophobicContact CD2-CE 3.86Å; F200-M346 HydrophobicContact CD2-SD 3.66Å; F200-M346 HydrophobicContact CE2-SD 4.05Å
201	G	93.9	Very high	92.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-74.3	-40.6	177.9	0	0	0	0	0	111.8	Q197 L199 S205 N343	Q197-G201 WeakPolarHBondContact O-CA 3.31Å; Q197-G201 PolarHBondContact O-N 2.72Å; L199-G201 PolarHBondContact O-N 3.01Å; G201-S205 WeakPolarHBondContact O-CB 3.48Å; G201-S205 PolarHBondContact O-N 3.49Å; G201-S205 PolarHBondContact O-OG 3.08Å; G201-N343 WeakPolarHBondContact CA-ND2 3.31Å; G201-N343 PolarHBondContact N-ND2 2.96Å
202	G	94.1	Very high	92.1	Very high	29 Å²	29	43 Å²	43	30%	0.299	26%	0.255	S	S	.	.	H	α-helix	trans	-61.8	-45.3	168.9	0	0	0	0	0	111.8	L198 L199 S205 A206	L198-G202 PolarHBondContact O-N 2.97Å; L199-G202 PolarHBondContact O-N 3.26Å; G202-S205 PolarHBondContact O-N 2.96Å; G202-A206 WeakPolarHBondContact O-CB 3.38Å; G202-A206 PolarHBondContact O-N 2.97Å
203	M	92.9	Very high	91.7	Very high	90 Å²	90	45.1 Å²	45.1	44%	0.443	26%	0.263	S	S	.	.	H	α-helix	trans	-63.3	-45.7	177.1	-66.9	-53.8	-58.5	0	0	112.6	L199 S205 A206 C207 F339	L199-M203 HydrophobicContact CD2-CG 4.19Å; L199-M203 WeakPolarHBondContact O-CG 3.41Å; L199-M203 PolarHBondContact O-N 3.38Å; M203-S205 VanDerWaalsContact C-N 3.33Å; M203-S205 PolarHBondContact O-N 3.19Å; M203-A206 PolarHBondContact O-N 3.25Å; M203-C207 PolarHBondContact O-N 3.45Å; M203-C207 PolarHBondContact O-SG 2.91Å; M203-C207 VanDerWaalsContact O-SG 3.33Å; M203-F339 HydrophobicContact CB-CD2 4.06Å; M203-F339 HydrophobicContact CB-CE2 4.16Å; M203-F339 HydrophobicContact CB-CG 4.4Å
204	A	92.7	Very high	91.1	Very high	2 Å²	2	46.4 Å²	46.4	2%	0.017	27%	0.267	C	S	.	.	H	α-helix	trans	-58	-46	174.5	0	0	0	0	0	111.5	F200 C207 V208 F339 I340	F200-A204 VanDerWaalsContact O-CB 3.27Å; F200-A204 WeakPolarHBondContact O-CB 3.32Å; F200-A204 PolarHBondContact O-N 3.42Å; A204-C207 PolarHBondContact O-N 3.34Å; A204-V208 WeakPolarHBondContact O-CG2 3.42Å; A204-V208 PolarHBondContact O-N 2.96Å; A204-F339 HydrophobicContact CB-CB 3.81Å; A204-I340 HydrophobicContact CB-CG1 4.08Å
205	S	92.8	Very high	90.3	Very high	18 Å²	18	46.3 Å²	46.3	13%	0.126	27%	0.265	C	S	.	.	H	α-helix	trans	-62.3	-44.1	178	-55.9	0	0	0	0	111.8	G201 G202 M203 C207 V208 I209	G201-S205 WeakPolarHBondContact O-CB 3.48Å; G201-S205 PolarHBondContact O-N 3.49Å; G201-S205 PolarHBondContact O-OG 3.08Å; G202-S205 PolarHBondContact O-N 2.96Å; M203-S205 VanDerWaalsContact C-N 3.33Å; M203-S205 PolarHBondContact O-N 3.19Å; S205-C207 PolarHBondContact O-N 3.48Å; S205-V208 PolarHBondContact O-N 2.99Å; S205-I209 WeakPolarHBondContact O-CB 3.44Å; S205-I209 WeakPolarHBondContact O-CD1 3.42Å; S205-I209 WeakPolarHBondContact O-CG1 3.17Å; S205-I209 PolarHBondContact O-N 2.94Å
206	A	93.4	Very high	89.4	Confident	52 Å²	52	47 Å²	47	43%	0.43	26%	0.264	S	S	.	.	H	α-helix	trans	-62.6	-41.7	177	0	0	0	0	0	112.1	G202 M203 A210	G202-A206 WeakPolarHBondContact O-CB 3.38Å; G202-A206 PolarHBondContact O-N 2.97Å; M203-A206 PolarHBondContact O-N 3.25Å; A206-A210 WeakPolarHBondContact O-CB 3.41Å; A206-A210 PolarHBondContact O-N 2.98Å
207	C	91.3	Very high	88.4	Confident	19 Å²	19	48.2 Å²	48.2	13%	0.128	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-49.5	173.3	-69.1	0	0	0	0	111.6	M203 A204 S205 I209 A210 Y211	M203-C207 PolarHBondContact O-N 3.45Å; M203-C207 PolarHBondContact O-SG 2.91Å; M203-C207 VanDerWaalsContact O-SG 3.33Å; A204-C207 PolarHBondContact O-N 3.34Å; S205-C207 PolarHBondContact O-N 3.48Å; C207-I209 PolarHBondContact O-N 3.45Å; C207-A210 PolarHBondContact O-N 3.44Å; C207-Y211 WeakPolarHBondContact O-CD2 3.32Å; C207-Y211 PolarHBondContact O-N 3.33Å
208	V	90.1	Very high	86.9	Confident	3 Å²	3	49.7 Å²	49.7	2%	0.018	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-40.2	179.8	175	0	0	0	0	111.6	A204 S205 Y211 I212 V248 L249 Y303 I340	A204-V208 WeakPolarHBondContact O-CG2 3.42Å; A204-V208 PolarHBondContact O-N 2.96Å; S205-V208 PolarHBondContact O-N 2.99Å; V208-Y211 PolarHBondContact O-N 2.8Å; V208-I212 PolarHBondContact O-N 2.71Å; V208-I212 VanDerWaalsContact O-N 3.12Å; V208-V248 HydrophobicContact CG1-CG1 4.46Å; V208-V248 HydrophobicContact CG2-CG1 4.17Å; V208-L249 HydrophobicContact CG1-CB 4.5Å; V208-Y303 HydrophobicContact CG1-CE2 4.47Å; V208-Y303 HydrophobicContact CG2-CE2 4.02Å; V208-I340 HydrophobicContact CG2-CD1 4.25Å
209	I	90.6	Very high	85.4	Confident	92 Å²	92	53.4 Å²	53.4	47%	0.472	29%	0.29	S	S	.	.	H	α-helix	trans	-63.8	-42.5	175.7	-68.1	163.6	0	0	0	111.3	S205 C207 Y211 I212 L249	S205-I209 WeakPolarHBondContact O-CB 3.44Å; S205-I209 WeakPolarHBondContact O-CD1 3.42Å; S205-I209 WeakPolarHBondContact O-CG1 3.17Å; S205-I209 PolarHBondContact O-N 2.94Å; C207-I209 PolarHBondContact O-N 3.45Å; I209-Y211 PolarHBondContact O-N 3.19Å; I209-I212 WeakPolarHBondContact O-CG2 3.39Å; I209-I212 PolarHBondContact O-N 3.24Å; I209-L249 HydrophobicContact CD1-CD1 3.93Å; I209-L249 HydrophobicContact CG1-CD1 3.66Å; I209-L249 HydrophobicContact CG1-CD2 3.89Å; I209-L249 HydrophobicContact CG1-CG 4.45Å
210	A	89.6	Confident	84	Confident	74 Å²	74	53.8 Å²	53.8	61%	0.612	29%	0.292	S	S	*	.	H	α-helix	trans	-62.2	-27.9	-178.3	0	0	0	0	0	113.3	A206 C207	A206-A210 WeakPolarHBondContact O-CB 3.41Å; A206-A210 PolarHBondContact O-N 2.98Å; C207-A210 PolarHBondContact O-N 3.44Å
211	Y	85.3	Confident	82.6	Confident	54 Å²	54	54.3 Å²	54.3	21%	0.212	30%	0.3	C	S	.	.	H	α-helix	trans	-102.3	-2.9	180	-72.1	-85.8	0	0	0	114.5	C207 V208 I209 Q213 K214 D215 D330 Q333	C207-Y211 WeakPolarHBondContact O-CD2 3.32Å; C207-Y211 PolarHBondContact O-N 3.33Å; V208-Y211 PolarHBondContact O-N 2.8Å; I209-Y211 PolarHBondContact O-N 3.19Å; Y211-Q213 PolarHBondContact O-N 3.42Å; Y211-Q213 VanDerWaalsContact O-N 3.07Å; Y211-K214 HydrophobicContact CD1-CB 4.41Å; Y211-K214 HydrophobicContact CD1-CD 4.1Å; Y211-K214 HydrophobicContact CE1-CD 4.41Å; Y211-K214 CarbonylContact O-C 3.41Å; Y211-K214 WeakPolarHBondContact O-CA 3.35Å; Y211-K214 WeakPolarHBondContact O-CB 3.32Å; Y211-K214 PolarHBondContact O-N 3.23Å; Y211-D215 VanDerWaalsContact O-CG 3.28Å; Y211-D215 PolarHBondContact O-N 2.91Å; Y211-D330 HydrophobicContact CE1-CB 3.62Å; Y211-Q333 HydrophobicContact CD1-CG 3.73Å; Y211-Q333 HydrophobicContact CD2-CG 4.22Å; Y211-Q333 HydrophobicContact CE1-CG 4.29Å; Y211-Q333 HydrophobicContact CG-CG 3.69Å
212	I	85.3	Confident	81	Confident	67 Å²	67	57.3 Å²	57.3	34%	0.344	31%	0.311	S	S	.	.	H	α-helix	trans	-54.9	-35.8	-175.7	-158.1	171.1	0	0	0	113.6	V208 I209 S216	V208-I212 PolarHBondContact O-N 2.71Å; V208-I212 VanDerWaalsContact O-N 3.12Å; I209-I212 WeakPolarHBondContact O-CG2 3.39Å; I209-I212 PolarHBondContact O-N 3.24Å; I212-S216 WeakPolarHBondContact O-CB 3.48Å; I212-S216 PolarHBondContact O-N 3.36Å
213	Q	81.3	Confident	79.4	Confident	143 Å²	143	58.2 Å²	58.2	67%	0.668	32%	0.32	S	S	*	.	H	α-helix	trans	-68.1	-47.2	175.8	-177.6	174.8	-19.9	0	0	111	Y211 D215 S216 E217	Y211-Q213 PolarHBondContact O-N 3.42Å; Y211-Q213 VanDerWaalsContact O-N 3.07Å; Q213-D215 VanDerWaalsContact C-N 3.32Å; Q213-D215 PolarHBondContact O-N 2.85Å; Q213-S216 WeakPolarHBondContact O-CB 3.26Å; Q213-S216 PolarHBondContact O-N 3.13Å; Q213-S216 VanDerWaalsContact O-N 3.11Å; Q213-S216 PolarHBondContact O-OG 2.83Å; Q213-E217 PolarHBondContact O-N 3.38Å
214	K	77.3	Confident	77.6	Confident	57 Å²	57	59.8 Å²	59.8	25%	0.248	33%	0.33	C	S	.	.	H	α-helix	trans	-64.2	-37.5	177.7	-172.4	168.4	179.6	58.7	0	112	Y211 S216 E217 D330	Y211-K214 HydrophobicContact CD1-CB 4.41Å; Y211-K214 HydrophobicContact CD1-CD 4.1Å; Y211-K214 HydrophobicContact CE1-CD 4.41Å; Y211-K214 CarbonylContact O-C 3.41Å; Y211-K214 WeakPolarHBondContact O-CA 3.35Å; Y211-K214 WeakPolarHBondContact O-CB 3.32Å; Y211-K214 PolarHBondContact O-N 3.23Å; K214-S216 VanDerWaalsContact C-N 3.28Å; K214-S216 PolarHBondContact O-N 2.92Å; K214-E217 WeakPolarHBondContact O-CB 3.48Å; K214-E217 PolarHBondContact O-N 3.06Å; K214-D330 WeakPolarHBondContact CE-OD2 3.5Å
215	D	76.3	Confident	75.7	Confident	9 Å²	9	67.2 Å²	67.2	5%	0.048	36%	0.358	C	S	.	.	H	α-helix	trans	-67.7	-30.4	175.5	-60.6	-26.1	0	0	0	111.2	Y211 Q213 T245 Q333	Y211-D215 VanDerWaalsContact O-CG 3.28Å; Y211-D215 PolarHBondContact O-N 2.91Å; Q213-D215 VanDerWaalsContact C-N 3.32Å; Q213-D215 PolarHBondContact O-N 2.85Å; D215-T245 HydrophobicContact CB-CG2 3.78Å; D215-T245 WeakPolarHBondContact OD2-CG2 3.44Å; D215-Q333 PolarHBondContact OD1-NE2 3.19Å
216	S	75.2	Confident	73.8	Confident	46 Å²	46	69.3 Å²	69.3	32%	0.322	37%	0.373	S	S	.	.	H	α-helix	trans	-75	-21.9	175.6	80.1	0	0	0	0	114.9	I212 Q213 K214 W218 F219	I212-S216 WeakPolarHBondContact O-CB 3.48Å; I212-S216 PolarHBondContact O-N 3.36Å; Q213-S216 WeakPolarHBondContact O-CB 3.26Å; Q213-S216 PolarHBondContact O-N 3.13Å; Q213-S216 VanDerWaalsContact O-N 3.11Å; Q213-S216 PolarHBondContact O-OG 2.83Å; K214-S216 VanDerWaalsContact C-N 3.28Å; K214-S216 PolarHBondContact O-N 2.92Å; S216-W218 PolarHBondContact O-N 3.46Å; S216-F219 PolarHBondContact O-N 3.12Å; S216-F219 VanDerWaalsContact O-N 3.11Å
217	E	72.6	Confident	71.7	Confident	86 Å²	86	69.2 Å²	69.2	40%	0.402	38%	0.378	S	S	.	.	H	α-helix	trans	-61.8	-29.7	176.6	-70.3	167.7	178.5	0	0	111.8	Q213 K214 F219 N220 T221	Q213-E217 PolarHBondContact O-N 3.38Å; K214-E217 WeakPolarHBondContact O-CB 3.48Å; K214-E217 PolarHBondContact O-N 3.06Å; E217-F219 PolarHBondContact O-N 2.95Å; E217-N220 PolarHBondContact O-N 3.36Å; E217-T221 PolarHBondContact O-N 3.36Å; E217-T221 VanDerWaalsContact O-N 3.14Å; E217-T221 PolarHBondContact O-OG1 3.44Å
218	W	65.2	Low	69.7	Low	34 Å²	34	73.5 Å²	73.5	13%	0.129	40%	0.398	C	S	.	.	H	α-helix	trans	-61	-41.3	173	-70.5	114.3	0	0	0	113.1	S216 N220 T221 Y222 G310 L326	S216-W218 PolarHBondContact O-N 3.46Å; W218-N220 PolarHBondContact O-N 3.16Å; W218-T221 PolarHBondContact O-N 3.03Å; W218-Y222 HydrophobicContact CB-CD2 4.34Å; W218-Y222 HydrophobicContact CE3-CD2 4.39Å; W218-Y222 AromaticContact CE3-CE2 3.87Å; W218-Y222 HydrophobicContact CE3-CE2 3.87Å; W218-Y222 WeakPolarHBondContact O-CB 3.35Å; W218-Y222 VanDerWaalsContact O-CD2 3.28Å; W218-Y222 WeakPolarHBondContact O-CD2 3.2Å; W218-Y222 PolarHBondContact O-N 3.14Å; W218-G310 WeakPolarHBondContact CH2-O 3.34Å; W218-G310 WeakPolarHBondContact CZ2-O 3.09Å; W218-G310 WeakPolarHBondContact CZ3-O 3.29Å; W218-L326 HydrophobicContact CH2-CB 3.87Å; W218-L326 HydrophobicContact CZ2-CB 4.27Å; W218-L326 WeakPolarHBondContact CZ2-O 3.24Å
219	F	64.7	Low	67.7	Low	98 Å²	98	78.6 Å²	78.6	43%	0.43	43%	0.425	S	S	.	.	H	α-helix	trans	-63.4	-44.6	-179.2	-179.3	-113.8	0	0	0	111.9	S216 E217 T221 G223 G242	S216-F219 PolarHBondContact O-N 3.12Å; S216-F219 VanDerWaalsContact O-N 3.11Å; E217-F219 PolarHBondContact O-N 2.95Å; F219-T221 VanDerWaalsContact C-N 3.3Å; F219-T221 PolarHBondContact O-N 3.43Å; F219-G223 PolarHBondContact O-N 3.48Å; F219-G242 VanDerWaalsContact CD2-CA 3.4Å
220	N	65.6	Low	65.5	Low	110 Å²	110	78.9 Å²	78.9	59%	0.588	43%	0.427	S	S	*	.	H	α-helix	trans	-63.5	-38.5	177.1	-65.3	-45.6	0	0	0	111.7	E217 W218 L224	E217-N220 PolarHBondContact O-N 3.36Å; W218-N220 PolarHBondContact O-N 3.16Å; N220-L224 PolarHBondContact O-N 2.89Å
221	T	64.3	Low	63.3	Low	58 Å²	58	82.6 Å²	82.6	36%	0.356	44%	0.437	S	S	.	.	H	α-helix	trans	-69.6	-48.5	179.6	-52.2	0	0	0	0	111.7	E217 W218 F219 L224 Y225	E217-T221 PolarHBondContact O-N 3.36Å; E217-T221 VanDerWaalsContact O-N 3.14Å; E217-T221 PolarHBondContact O-OG1 3.44Å; W218-T221 PolarHBondContact O-N 3.03Å; F219-T221 VanDerWaalsContact C-N 3.3Å; F219-T221 PolarHBondContact O-N 3.43Å; T221-L224 PolarHBondContact O-N 3.45Å; T221-Y225 PolarHBondContact O-N 3.36Å
222	Y	60.3	Low	61.4	Low	63 Å²	63	83.4 Å²	83.4	25%	0.247	46%	0.462	C	S	.	.	H	α-helix	trans	-68.4	-35.9	177.7	-81.1	-65.6	0	0	0	113	W218 L224 Y225 S226 Y240 R309 L312	W218-Y222 HydrophobicContact CB-CD2 4.34Å; W218-Y222 HydrophobicContact CE3-CD2 4.39Å; W218-Y222 AromaticContact CE3-CE2 3.87Å; W218-Y222 HydrophobicContact CE3-CE2 3.87Å; W218-Y222 WeakPolarHBondContact O-CB 3.35Å; W218-Y222 VanDerWaalsContact O-CD2 3.28Å; W218-Y222 WeakPolarHBondContact O-CD2 3.2Å; W218-Y222 PolarHBondContact O-N 3.14Å; Y222-L224 VanDerWaalsContact C-N 3.3Å; Y222-L224 PolarHBondContact O-N 2.89Å; Y222-Y225 PolarHBondContact O-N 2.85Å; Y222-S226 WeakPolarHBondContact O-CB 3.25Å; Y222-S226 PolarHBondContact O-N 3.02Å; Y222-Y240 HydrophobicContact CD2-CD1 4.36Å; Y222-Y240 HydrophobicContact CD2-CE1 4.33Å; Y222-R309 WeakPolarHBondContact CE2-O 3.38Å; Y222-R309 PolarHBondContact OH-O 3.46Å; Y222-L312 HydrophobicContact CE1-CD1 4.19Å; Y222-L312 WeakPolarHBondContact OH-CD1 3.48Å
223	G	60.4	Low	59.5	Low	47 Å²	47	88.7 Å²	88.7	49%	0.485	49%	0.49	S	S	.	.	H	α-helix	trans	-59.9	-40.7	175.2	0	0	0	0	0	112.3	F219 G227	F219-G223 PolarHBondContact O-N 3.48Å; G223-G227 PolarHBondContact O-N 2.83Å
224	L	55.9	Low	57.5	Low	124 Å²	124	84.6 Å²	84.6	65%	0.649	49%	0.486	S	S	*	.	H	α-helix	trans	-71.4	-46.3	176.4	-165	69.4	0	0	0	112	N220 T221 Y222 G227 I228	N220-L224 PolarHBondContact O-N 2.89Å; T221-L224 PolarHBondContact O-N 3.45Å; Y222-L224 VanDerWaalsContact C-N 3.3Å; Y222-L224 PolarHBondContact O-N 2.89Å; L224-G227 PolarHBondContact O-N 3.19Å; L224-G227 VanDerWaalsContact O-N 3.16Å; L224-I228 HydrophobicContact CG-CD1 4.3Å; L224-I228 WeakPolarHBondContact O-CG1 3.29Å; L224-I228 PolarHBondContact O-N 3.42Å; L224-I228 VanDerWaalsContact O-N 3.12Å
225	Y	52.9	Low	55.9	Low	157 Å²	157	90.6 Å²	90.6	62%	0.616	52%	0.52	S	S	*	.	H	α-helix	trans	-68	-37.4	-177.9	-140.5	-91.5	0	0	0	112.7	T221 Y222 G227 I228 N229	T221-Y225 PolarHBondContact O-N 3.36Å; Y222-Y225 PolarHBondContact O-N 2.85Å; Y225-G227 VanDerWaalsContact C-N 3.3Å; Y225-I228 PolarHBondContact O-N 2.99Å; Y225-N229 PolarHBondContact O-N 3.32Å
226	S	52.1	Low	54.8	Low	63 Å²	63	95.2 Å²	95.2	44%	0.441	55%	0.553	S	S	.	*	H	α-helix	trans	-71.5	-24.4	173.3	-170.9	0	0	0	0	112.6	Y222 N230	Y222-S226 WeakPolarHBondContact O-CB 3.25Å; Y222-S226 PolarHBondContact O-N 3.02Å; S226-N230 VanDerWaalsContact O-CB 3.26Å; S226-N230 WeakPolarHBondContact O-CB 3.48Å; S226-N230 VanDerWaalsContact O-CG 3.31Å; S226-N230 PolarHBondContact O-N 3.08Å; S226-N230 PolarHBondContact O-ND2 2.69Å; S226-N230 VanDerWaalsContact O-ND2 3.11Å; S226-N230 PolarHBondContact OG-ND2 3.35Å
227	G	49.4	Very low	53.4	Low	50 Å²	50	96 Å²	96	52%	0.515	57%	0.568	S	S	.	*	H	α-helix	trans	-71.2	-39.7	172.1	0	0	0	0	0	112.6	G223 L224 Y225	G223-G227 PolarHBondContact O-N 2.83Å; L224-G227 PolarHBondContact O-N 3.19Å; L224-G227 VanDerWaalsContact O-N 3.16Å; Y225-G227 VanDerWaalsContact C-N 3.3Å
228	I	49.8	Very low	52.3	Low	109 Å²	109	100.3 Å²	100.3	56%	0.559	59%	0.588	S	S	*	*	H	α-helix	trans	-73.2	-39.7	-178.3	-66.6	164.5	0	0	0	111.8	L224 Y225	L224-I228 HydrophobicContact CG-CD1 4.3Å; L224-I228 WeakPolarHBondContact O-CG1 3.29Å; L224-I228 PolarHBondContact O-N 3.42Å; L224-I228 VanDerWaalsContact O-N 3.12Å; Y225-I228 PolarHBondContact O-N 2.99Å
229	N	46.7	Very low	51.8	Low	110 Å²	110	103.9 Å²	103.9	59%	0.588	62%	0.618	S	S	*	*	H	α-helix	trans	-83.6	-12.7	-177.8	-72	-8.7	0	0	0	114.2	Y225 N231	Y225-N229 PolarHBondContact O-N 3.32Å; N229-N231 VanDerWaalsContact C-N 3.25Å; N229-N231 PolarHBondContact O-N 3.35Å
230	N	45.9	Very low	51.7	Low	97 Å²	97	102.1 Å²	102.1	52%	0.519	61%	0.609	S	S	.	*			trans	-88.4	38.1	176.9	-81	-24.7	0	0	0	113.6	S226 G232	S226-N230 VanDerWaalsContact O-CB 3.26Å; S226-N230 WeakPolarHBondContact O-CB 3.48Å; S226-N230 VanDerWaalsContact O-CG 3.31Å; S226-N230 PolarHBondContact O-N 3.08Å; S226-N230 PolarHBondContact O-ND2 2.69Å; S226-N230 VanDerWaalsContact O-ND2 3.11Å; S226-N230 PolarHBondContact OG-ND2 3.35Å; N230-G232 PolarHBondContact O-N 3.22Å
231	N	43.5	Very low	51.6	Low	153 Å²	153	102.1 Å²	102.1	82%	0.818	61%	0.613	S	S	*	*	S	Bend	trans	-72.7	50.6	164.3	-90.6	6.5	0	0	0	112.2	N229 L233	N229-N231 VanDerWaalsContact C-N 3.25Å; N229-N231 PolarHBondContact O-N 3.35Å; N231-L233 PolarHBondContact O-N 2.89Å
232	G	45.3	Very low	51.7	Low	71 Å²	71	99.6 Å²	99.6	73%	0.732	60%	0.599	S	S	*	*	S	Bend	trans	83.2	4.5	157.7	0	0	0	0	0	119.3	N230	N230-G232 PolarHBondContact O-N 3.22Å
233	L	44	Very low	52.4	Low	177 Å²	177	98.1 Å²	98.1	93%	0.927	60%	0.597	S	S	*	*			trans	-136.7	30.3	-172.8	-141.5	79	0	0	0	116.5	N231	N231-L233 PolarHBondContact O-N 2.89Å
234	G	39.4	Very low	53.4	Low	58 Å²	58	99.7 Å²	99.7	60%	0.598	59%	0.592	S	S	*	*			trans	-113.9	117.6	176.8	0	0	0	0	0	113.2
235	L	45.1	Very low	54.8	Low	182 Å²	182	94 Å²	94	95%	0.953	56%	0.563	S	S	*	*	S	Bend	trans	-79.1	122.6	178.4	-156.3	77.5	0	0	0	110.8
236	S	53.3	Low	56.4	Low	107 Å²	107	89.5 Å²	89.5	75%	0.748	56%	0.558	S	S	*	*			trans	66.3	65.3	172.7	-159.9	0	0	0	0	117.1
237	G	44.8	Very low	58.2	Low	61 Å²	61	90.5 Å²	90.5	63%	0.629	56%	0.555	S	S	*	*			trans	-84.5	107.8	167.9	0	0	0	0	0	112.8	S239	G237-S239 PolarHBondContact O-N 3.13Å; G237-S239 VanDerWaalsContact O-N 3.1Å
238	H	50.3	Low	60.2	Low	178 Å²	178	88.2 Å²	88.2	82%	0.824	53%	0.531	S	S	*	.			trans	-63.6	109.1	170.2	-83.4	64	0	0	0	110.2	Y240	H238-Y240 PolarHBondContact O-N 2.85Å; H238-Y240 VanDerWaalsContact O-N 3.12Å
239	S	54.5	Low	62.3	Low	109 Å²	109	85.4 Å²	85.4	76%	0.762	52%	0.516	S	S	*	.			trans	-66.1	109.9	180	-43.2	0	0	0	0	110.8	G237 T241	G237-S239 PolarHBondContact O-N 3.13Å; G237-S239 VanDerWaalsContact O-N 3.1Å; S239-T241 PolarHBondContact O-N 3.12Å
240	Y	61.7	Low	64.5	Low	60 Å²	60	83.2 Å²	83.2	24%	0.235	51%	0.51	C	S	.	.			trans	-71.2	112.2	176.1	178.1	-113.3	0	0	0	110.2	Y222 H238 G242 P243	Y222-Y240 HydrophobicContact CD2-CD1 4.36Å; Y222-Y240 HydrophobicContact CD2-CE1 4.33Å; H238-Y240 PolarHBondContact O-N 2.85Å; H238-Y240 VanDerWaalsContact O-N 3.12Å; Y240-G242 VanDerWaalsContact CZ-C 3.42Å; Y240-G242 PolarHBondContact O-N 2.86Å; Y240-P243 WeakPolarHBondContact OH-CA 3.36Å
241	T	63.2	Low	66.8	Low	111 Å²	111	79.1 Å²	79.1	68%	0.681	49%	0.488	S	S	*	.			trans	-79.5	10.5	-176.1	46.7	0	0	0	0	114.6	S239 M244	S239-T241 PolarHBondContact O-N 3.12Å; T241-M244 WeakPolarHBondContact OG1-CE 3.38Å
242	G	68	Low	69.2	Low	5 Å²	5	72.2 Å²	72.2	5%	0.052	45%	0.453	C	S	.	.			trans	94.6	174.3	-178.4	0	0	0	0	0	114.5	F219 Y240	F219-G242 VanDerWaalsContact CD2-CA 3.4Å; Y240-G242 VanDerWaalsContact CZ-C 3.42Å; Y240-G242 PolarHBondContact O-N 2.86Å
243	P	73.3	Confident	71.6	Confident	31 Å²	31	70.4 Å²	70.4	20%	0.201	43%	0.434	C	S	.	.			trans	-66.3	134.5	-179.5	27.9	-36.3	0	0	0	110.9	Y240 T245	Y240-P243 WeakPolarHBondContact OH-CA 3.36Å; P243-T245 HydrophobicContact CB-CG2 4.21Å; P243-T245 PolarHBondContact O-N 3.21Å
244	M	82.3	Confident	74	Confident	80 Å²	80	66.7 Å²	66.7	39%	0.394	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	18	178.1	-65.8	-81.7	164	0	0	111.7	T241 A246 F247 V248 V302 D306	T241-M244 WeakPolarHBondContact OG1-CE 3.38Å; M244-A246 PolarHBondContact O-N 3Å; M244-F247 HydrophobicContact CB-CB 4.49Å; M244-F247 WeakPolarHBondContact O-CA 3.49Å; M244-F247 VanDerWaalsContact O-CB 3.29Å; M244-F247 WeakPolarHBondContact O-CB 3.38Å; M244-F247 PolarHBondContact O-N 3Å; M244-V248 PolarHBondContact O-N 3.15Å; M244-V248 VanDerWaalsContact O-N 3.08Å; M244-V302 HydrophobicContact CB-CG1 3.31Å; M244-V302 HydrophobicContact CG-CG1 4.16Å; M244-D306 VanDerWaalsContact CA-OD2 3.3Å; M244-D306 WeakPolarHBondContact CA-OD2 3.26Å; M244-D306 WeakPolarHBondContact CB-OD2 3.3Å; M244-D306 PolarHBondContact N-OD2 2.71Å
245	T	84.4	Confident	76.6	Confident	6 Å²	6	64 Å²	64	4%	0.037	39%	0.385	C	S	.	.	H	α-helix	trans	-58.4	-31.9	177.1	54.2	0	0	0	0	112.8	D215 P243 F247 V248 L249 Y303 D306	D215-T245 HydrophobicContact CB-CG2 3.78Å; D215-T245 WeakPolarHBondContact OD2-CG2 3.44Å; P243-T245 HydrophobicContact CB-CG2 4.21Å; P243-T245 PolarHBondContact O-N 3.21Å; T245-F247 VanDerWaalsContact C-N 3.33Å; T245-F247 PolarHBondContact O-N 3.3Å; T245-V248 PolarHBondContact O-N 3.07Å; T245-L249 WeakPolarHBondContact O-CB 3.49Å; T245-L249 PolarHBondContact O-N 2.94Å; T245-Y303 HydrophobicContact CG2-CE2 4.33Å; T245-D306 PolarHBondContact N-OD2 3.39Å
246	A	87.5	Confident	79	Confident	61 Å²	61	59.8 Å²	59.8	50%	0.504	36%	0.357	S	S	.	.	H	α-helix	trans	-63.9	-34.8	171.5	0	0	0	0	0	113	M244 S250	M244-A246 PolarHBondContact O-N 3Å; A246-S250 WeakPolarHBondContact O-CB 3.42Å; A246-S250 PolarHBondContact O-N 3.5Å; A246-S250 PolarHBondContact O-OG 3.06Å
247	F	90.1	Very high	81	Confident	85 Å²	85	59.6 Å²	59.6	37%	0.373	35%	0.346	S	S	.	.	H	α-helix	trans	-69.2	-45.6	172.4	166.2	-94.2	0	0	0	110.9	M244 T245 L249 S250 V251 V302	M244-F247 HydrophobicContact CB-CB 4.49Å; M244-F247 WeakPolarHBondContact O-CA 3.49Å; M244-F247 VanDerWaalsContact O-CB 3.29Å; M244-F247 WeakPolarHBondContact O-CB 3.38Å; M244-F247 PolarHBondContact O-N 3Å; T245-F247 VanDerWaalsContact C-N 3.33Å; T245-F247 PolarHBondContact O-N 3.3Å; F247-L249 VanDerWaalsContact C-N 3.31Å; F247-L249 PolarHBondContact O-N 3.49Å; F247-S250 PolarHBondContact O-N 3.04Å; F247-V251 HydrophobicContact CD2-CG2 4.35Å; F247-V251 HydrophobicContact CE1-CG2 4.08Å; F247-V251 HydrophobicContact CE2-CG2 3.91Å; F247-V251 HydrophobicContact CZ-CG2 3.77Å; F247-V251 WeakPolarHBondContact O-CG2 3.46Å; F247-V251 PolarHBondContact O-N 3.39Å; F247-V302 HydrophobicContact CD1-CB 4.4Å; F247-V302 HydrophobicContact CD1-CG1 4.11Å; F247-V302 HydrophobicContact CD1-CG2 4.36Å; F247-V302 HydrophobicContact CE1-CB 4.44Å; F247-V302 HydrophobicContact CE1-CG2 4.11Å
248	V	92	Very high	83.4	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.012	33%	0.33	C	S	.	.	H	α-helix	trans	-57.3	-45.3	175.9	178	0	0	0	0	110.8	V208 M244 T245 V251 A252 A299 V302 Y303 I340	V208-V248 HydrophobicContact CG1-CG1 4.46Å; V208-V248 HydrophobicContact CG2-CG1 4.17Å; M244-V248 PolarHBondContact O-N 3.15Å; M244-V248 VanDerWaalsContact O-N 3.08Å; T245-V248 PolarHBondContact O-N 3.07Å; V248-V251 PolarHBondContact O-N 3.42Å; V248-A252 WeakPolarHBondContact O-CB 3.34Å; V248-A252 PolarHBondContact O-N 3.4Å; V248-A299 HydrophobicContact CG1-CB 4.4Å; V248-V302 HydrophobicContact CG2-CB 4.46Å; V248-V302 HydrophobicContact CG2-CG1 4.07Å; V248-Y303 HydrophobicContact CG1-CD2 4.3Å; V248-Y303 HydrophobicContact CG1-CG 4.45Å; V248-Y303 HydrophobicContact CG2-CD2 4.28Å; V248-I340 HydrophobicContact CG1-CD1 3.91Å
249	L	92.6	Very high	85.5	Confident	49 Å²	49	51.1 Å²	51.1	26%	0.257	29%	0.291	S	S	.	.	H	α-helix	trans	-66.5	-38.7	177.6	-172.9	61.6	0	0	0	112.5	V208 I209 T245 F247 A252 G253	V208-L249 HydrophobicContact CG1-CB 4.5Å; I209-L249 HydrophobicContact CD1-CD1 3.93Å; I209-L249 HydrophobicContact CG1-CD1 3.66Å; I209-L249 HydrophobicContact CG1-CD2 3.89Å; I209-L249 HydrophobicContact CG1-CG 4.45Å; T245-L249 WeakPolarHBondContact O-CB 3.49Å; T245-L249 PolarHBondContact O-N 2.94Å; F247-L249 VanDerWaalsContact C-N 3.31Å; F247-L249 PolarHBondContact O-N 3.49Å; L249-A252 PolarHBondContact O-N 2.86Å; L249-G253 PolarHBondContact O-N 3.08Å
250	S	93.7	Very high	87.5	Confident	65 Å²	65	48.6 Å²	48.6	46%	0.455	27%	0.269	S	S	.	.	H	α-helix	trans	-63.8	-43.7	175.5	-61	0	0	0	0	111.6	A246 F247 G253 I254	A246-S250 WeakPolarHBondContact O-CB 3.42Å; A246-S250 PolarHBondContact O-N 3.5Å; A246-S250 PolarHBondContact O-OG 3.06Å; F247-S250 PolarHBondContact O-N 3.04Å; S250-G253 PolarHBondContact O-N 2.9Å; S250-I254 WeakPolarHBondContact O-CB 3.24Å; S250-I254 VanDerWaalsContact O-CG1 3.27Å; S250-I254 WeakPolarHBondContact O-CG1 3.36Å; S250-I254 PolarHBondContact O-N 3.47Å
251	V	94.4	Very high	88.9	Confident	11 Å²	11	48.8 Å²	48.8	7%	0.067	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-45.7	174.8	169.1	0	0	0	0	111.1	F247 V248 G253 S255 L295 A299	F247-V251 HydrophobicContact CD2-CG2 4.35Å; F247-V251 HydrophobicContact CE1-CG2 4.08Å; F247-V251 HydrophobicContact CE2-CG2 3.91Å; F247-V251 HydrophobicContact CZ-CG2 3.77Å; F247-V251 WeakPolarHBondContact O-CG2 3.46Å; F247-V251 PolarHBondContact O-N 3.39Å; V248-V251 PolarHBondContact O-N 3.42Å; V251-G253 PolarHBondContact O-N 3.3Å; V251-S255 VanDerWaalsContact O-CB 3.26Å; V251-S255 WeakPolarHBondContact O-CB 3.4Å; V251-S255 PolarHBondContact O-N 2.97Å; V251-S255 PolarHBondContact O-OG 3.01Å; V251-L295 HydrophobicContact CG1-CB 3.87Å; V251-A299 HydrophobicContact CB-CB 4.18Å; V251-A299 HydrophobicContact CG1-CB 3.88Å
252	A	93.6	Very high	90.1	Very high	8 Å²	8	44.9 Å²	44.9	7%	0.066	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-43.3	177.2	0	0	0	0	0	111.9	V248 L249 S255 W256	V248-A252 WeakPolarHBondContact O-CB 3.34Å; V248-A252 PolarHBondContact O-N 3.4Å; L249-A252 PolarHBondContact O-N 2.86Å; A252-S255 WeakPolarHBondContact CA-OG 3.48Å; A252-S255 PolarHBondContact O-OG 2.78Å; A252-W256 WeakPolarHBondContact O-CB 3.05Å; A252-W256 PolarHBondContact O-N 3.44Å
253	G	94.3	Very high	91.2	Very high	32 Å²	32	46.1 Å²	46.1	33%	0.33	26%	0.259	S	S	.	.	H	α-helix	trans	-65.8	-48.7	177.1	0	0	0	0	0	113.7	L249 S250 V251 S255 W256 M257	L249-G253 PolarHBondContact O-N 3.08Å; S250-G253 PolarHBondContact O-N 2.9Å; V251-G253 PolarHBondContact O-N 3.3Å; G253-S255 PolarHBondContact O-N 3.33Å; G253-W256 PolarHBondContact O-N 3.18Å; G253-M257 WeakPolarHBondContact O-CG 3.34Å; G253-M257 PolarHBondContact O-N 2.78Å
254	I	95.2	Very high	92	Very high	100 Å²	100	48.6 Å²	48.6	51%	0.513	27%	0.274	S	S	.	.	H	α-helix	trans	-61.8	-45.4	179.4	-69.8	166.4	0	0	0	110.7	S250 M257 I258	S250-I254 WeakPolarHBondContact O-CB 3.24Å; S250-I254 VanDerWaalsContact O-CG1 3.27Å; S250-I254 WeakPolarHBondContact O-CG1 3.36Å; S250-I254 PolarHBondContact O-N 3.47Å; I254-M257 PolarHBondContact O-N 3.49Å; I254-I258 HydrophobicContact CG2-CD1 3.73Å; I254-I258 HydrophobicContact CG2-CG1 4.48Å; I254-I258 VanDerWaalsContact O-CG1 3.3Å; I254-I258 WeakPolarHBondContact O-CG1 3.3Å; I254-I258 PolarHBondContact O-N 3.37Å
255	S	94.5	Very high	92.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.4	-36.6	178.4	58.6	0	0	0	0	113.3	V251 A252 G253 I258 T259 Y296	V251-S255 VanDerWaalsContact O-CB 3.26Å; V251-S255 WeakPolarHBondContact O-CB 3.4Å; V251-S255 PolarHBondContact O-N 2.97Å; V251-S255 PolarHBondContact O-OG 3.01Å; A252-S255 WeakPolarHBondContact CA-OG 3.48Å; A252-S255 PolarHBondContact O-OG 2.78Å; G253-S255 PolarHBondContact O-N 3.33Å; S255-I258 PolarHBondContact O-N 2.91Å; S255-T259 PolarHBondContact O-N 3.3Å; S255-T259 PolarHBondContact O-OG1 3.48Å; S255-Y296 VanDerWaalsContact CB-CE2 3.49Å; S255-Y296 WeakPolarHBondContact OG-CE2 3.26Å; S255-Y296 PolarHBondContact OG-OH 2.89Å
256	W	95.4	Very high	92	Very high	94 Å²	94	47 Å²	47	36%	0.356	27%	0.269	S	S	.	.	H	α-helix	trans	-64.3	-41.6	173.1	-166.5	90.6	0	0	0	111.6	L198 A252 G253 T259 L260	L198-W256 HydrophobicContact CD2-CD2 3.89Å; L198-W256 HydrophobicContact CD2-CG 3.86Å; L198-W256 HydrophobicContact CD2-CZ2 4.37Å; L198-W256 WeakPolarHBondContact CD2-O 3.28Å; L198-W256 PolarHBondContact O-NE1 3.48Å; A252-W256 WeakPolarHBondContact O-CB 3.05Å; A252-W256 PolarHBondContact O-N 3.44Å; G253-W256 PolarHBondContact O-N 3.18Å; W256-T259 WeakPolarHBondContact CA-OG1 3.5Å; W256-T259 PolarHBondContact O-OG1 2.98Å; W256-L260 HydrophobicContact CH2-CD2 4.14Å; W256-L260 HydrophobicContact CZ3-CD2 3.82Å; W256-L260 VanDerWaalsContact O-CB 3.3Å; W256-L260 WeakPolarHBondContact O-CB 3.3Å; W256-L260 PolarHBondContact O-N 2.96Å
257	M	95.8	Very high	91.7	Very high	104 Å²	104	50.3 Å²	50.3	51%	0.512	28%	0.275	S	S	.	.	H	α-helix	trans	-66.8	-39.6	174.7	-70.1	-59.1	-65.6	0	0	112.8	G253 I254 S261	G253-M257 WeakPolarHBondContact O-CG 3.34Å; G253-M257 PolarHBondContact O-N 2.78Å; I254-M257 PolarHBondContact O-N 3.49Å; M257-S261 WeakPolarHBondContact O-CB 3.37Å; M257-S261 PolarHBondContact O-N 3.01Å; M257-S261 PolarHBondContact O-OG 2.9Å
258	I	95.3	Very high	91.4	Very high	59 Å²	59	49.1 Å²	49.1	30%	0.303	28%	0.275	S	S	.	.	H	α-helix	trans	-66.2	-44.7	176.1	-68.2	167.1	0	0	0	111	I254 S255 S261 L262 I288 L292	I254-I258 HydrophobicContact CG2-CD1 3.73Å; I254-I258 HydrophobicContact CG2-CG1 4.48Å; I254-I258 VanDerWaalsContact O-CG1 3.3Å; I254-I258 WeakPolarHBondContact O-CG1 3.3Å; I254-I258 PolarHBondContact O-N 3.37Å; S255-I258 PolarHBondContact O-N 2.91Å; I258-S261 WeakPolarHBondContact O-CB 3.19Å; I258-S261 PolarHBondContact O-N 2.68Å; I258-L262 HydrophobicContact CG2-CD1 4.34Å; I258-L262 WeakPolarHBondContact O-CG 3.23Å; I258-L262 PolarHBondContact O-N 3.37Å; I258-I288 HydrophobicContact CG2-CG2 3.63Å; I258-L292 HydrophobicContact CB-CD1 4.49Å; I258-L292 HydrophobicContact CB-CD2 4.43Å; I258-L292 HydrophobicContact CD1-CD2 4.07Å; I258-L292 HydrophobicContact CG2-CD1 3.99Å; I258-L292 HydrophobicContact CG2-CD2 4.39Å
259	T	94.6	Very high	90.3	Very high	1 Å²	1	56.6 Å²	56.6	1%	0.006	31%	0.312	C	S	.	.	H	α-helix	trans	-65.5	-38.1	176.5	42.2	0	0	0	0	112.8	Q197 L198 S255 W256 S261 L262 L263 L292 Y347	Q197-T259 HydrophobicContact CB-CG2 4.4Å; L198-T259 VanDerWaalsContact CD2-OG1 3.29Å; L198-T259 WeakPolarHBondContact CD2-OG1 3.4Å; S255-T259 PolarHBondContact O-N 3.3Å; S255-T259 PolarHBondContact O-OG1 3.48Å; W256-T259 WeakPolarHBondContact CA-OG1 3.5Å; W256-T259 PolarHBondContact O-OG1 2.98Å; T259-S261 VanDerWaalsContact C-N 3.33Å; T259-S261 PolarHBondContact O-N 3.47Å; T259-L262 PolarHBondContact O-N 3.02Å; T259-L263 WeakPolarHBondContact O-CB 3.1Å; T259-L263 PolarHBondContact O-N 3.49Å; T259-L292 HydrophobicContact CG2-CD1 3.95Å; T259-Y347 HydrophobicContact CG2-CE1 3.45Å; T259-Y347 VanDerWaalsContact CG2-CE1 3.45Å; T259-Y347 WeakPolarHBondContact CG2-OH 3.32Å
260	L	94.7	Very high	89	Confident	57 Å²	57	61.1 Å²	61.1	30%	0.298	33%	0.326	S	S	.	.	H	α-helix	trans	-61.9	-43.5	173	-178.4	62.8	0	0	0	110.8	L198 W256 L263 V264	L198-L260 HydrophobicContact CD1-CB 4.45Å; L198-L260 HydrophobicContact CD1-CD1 4.14Å; L198-L260 HydrophobicContact CD2-CB 3.95Å; W256-L260 HydrophobicContact CH2-CD2 4.14Å; W256-L260 HydrophobicContact CZ3-CD2 3.82Å; W256-L260 VanDerWaalsContact O-CB 3.3Å; W256-L260 WeakPolarHBondContact O-CB 3.3Å; W256-L260 PolarHBondContact O-N 2.96Å; L260-L263 PolarHBondContact O-N 3.38Å; L260-V264 HydrophobicContact CD1-CG2 4.28Å; L260-V264 WeakPolarHBondContact O-CB 3.41Å; L260-V264 VanDerWaalsContact O-CG2 3.3Å; L260-V264 WeakPolarHBondContact O-CG2 3.47Å; L260-V264 PolarHBondContact O-N 2.74Å
261	S	91.6	Very high	87.8	Confident	64 Å²	64	58.2 Å²	58.2	45%	0.448	31%	0.306	S	S	.	.	H	α-helix	trans	-62.9	-42.7	176.8	-56.1	0	0	0	0	112.1	M257 I258 T259 T265	M257-S261 WeakPolarHBondContact O-CB 3.37Å; M257-S261 PolarHBondContact O-N 3.01Å; M257-S261 PolarHBondContact O-OG 2.9Å; I258-S261 WeakPolarHBondContact O-CB 3.19Å; I258-S261 PolarHBondContact O-N 2.68Å; T259-S261 VanDerWaalsContact C-N 3.33Å; T259-S261 PolarHBondContact O-N 3.47Å; S261-T265 VanDerWaalsContact O-CB 3.26Å; S261-T265 WeakPolarHBondContact O-CB 3.46Å; S261-T265 PolarHBondContact O-N 3.05Å; S261-T265 PolarHBondContact O-OG1 3.08Å
262	L	89.7	Confident	86.3	Confident	28 Å²	28	65.5 Å²	65.5	15%	0.147	33%	0.332	C	S	.	.	H	α-helix	trans	-64.5	-42.2	174.4	-73	175.8	0	0	0	112.1	I258 T259 G266 W281 I288	I258-L262 HydrophobicContact CG2-CD1 4.34Å; I258-L262 WeakPolarHBondContact O-CG 3.23Å; I258-L262 PolarHBondContact O-N 3.37Å; T259-L262 PolarHBondContact O-N 3.02Å; L262-G266 PolarHBondContact O-N 3.29Å; L262-W281 HydrophobicContact CD2-CZ2 4.33Å; L262-I288 HydrophobicContact CD1-CG2 3.89Å; L262-I288 HydrophobicContact CD2-CD1 4.26Å
263	L	91.3	Very high	84.7	Confident	31 Å²	31	69.3 Å²	69.3	16%	0.162	35%	0.354	C	S	.	.	H	α-helix	trans	-64.8	-46.5	177.5	-178.2	64.8	0	0	0	111.4	R191 A194 L198 T259 L260 G266 M267	R191-L263 HydrophobicContact CB-CD1 4.09Å; A194-L263 HydrophobicContact CB-CD1 4.36Å; L198-L263 HydrophobicContact CD1-CB 4.4Å; L198-L263 HydrophobicContact CD1-CD2 3.56Å; T259-L263 WeakPolarHBondContact O-CB 3.1Å; T259-L263 PolarHBondContact O-N 3.49Å; L260-L263 PolarHBondContact O-N 3.38Å; L263-G266 PolarHBondContact O-N 2.82Å; L263-M267 HydrophobicContact CD1-CE 4.35Å; L263-M267 HydrophobicContact CD1-CG 4.46Å; L263-M267 WeakPolarHBondContact O-CG 3.19Å; L263-M267 PolarHBondContact O-N 3.41Å
264	V	90.2	Very high	83.1	Confident	84 Å²	84	71.9 Å²	71.9	51%	0.509	36%	0.36	S	S	.	.	H	α-helix	trans	-62.7	-51.2	177.4	169.7	0	0	0	0	110.5	L260 G266 M267 T268	L260-V264 HydrophobicContact CD1-CG2 4.28Å; L260-V264 WeakPolarHBondContact O-CB 3.41Å; L260-V264 VanDerWaalsContact O-CG2 3.3Å; L260-V264 WeakPolarHBondContact O-CG2 3.47Å; L260-V264 PolarHBondContact O-N 2.74Å; V264-G266 PolarHBondContact O-N 3.36Å; V264-M267 PolarHBondContact O-N 3.43Å; V264-T268 WeakPolarHBondContact O-CG2 3.28Å; V264-T268 PolarHBondContact O-N 3.47Å; V264-T268 VanDerWaalsContact O-N 3.16Å
265	T	85.9	Confident	81.5	Confident	52 Å²	52	68.8 Å²	68.8	32%	0.319	34%	0.344	S	S	.	.	H	α-helix	trans	-55.4	-46.6	177.3	-53.9	0	0	0	0	109.7	S261 T268 Y271 L275	S261-T265 VanDerWaalsContact O-CB 3.26Å; S261-T265 WeakPolarHBondContact O-CB 3.46Å; S261-T265 PolarHBondContact O-N 3.05Å; S261-T265 PolarHBondContact O-OG1 3.08Å; T265-T268 PolarHBondContact O-N 3.13Å; T265-T268 PolarHBondContact O-OG1 3.05Å; T265-Y271 HydrophobicContact CG2-CD2 4.16Å; T265-Y271 WeakPolarHBondContact O-CB 3.15Å; T265-L275 HydrophobicContact CG2-CD1 4.42Å
266	G	80.3	Confident	80.1	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.01	35%	0.352	C	S	.	.	H	α-helix	trans	-49.2	-60.6	170.1	0	0	0	0	0	112.6	R191 L262 L263 V264 T268	R191-G266 PolarHBondContact NH1-O 3.41Å; R191-G266 PolarHBondContact NH2-O 3.36Å; L262-G266 PolarHBondContact O-N 3.29Å; L263-G266 PolarHBondContact O-N 2.82Å; V264-G266 PolarHBondContact O-N 3.36Å; G266-T268 PolarHBondContact O-N 3.34Å; G266-T268 VanDerWaalsContact O-O 3.09Å
267	M	81.6	Confident	78.7	Confident	129 Å²	129	71.4 Å²	71.4	64%	0.635	37%	0.365	S	S	*	.	H	α-helix	trans	-58.2	-23	-174.8	-70.7	-54.5	-154.1	0	0	114	L263 V264	L263-M267 HydrophobicContact CD1-CE 4.35Å; L263-M267 HydrophobicContact CD1-CG 4.46Å; L263-M267 WeakPolarHBondContact O-CG 3.19Å; L263-M267 PolarHBondContact O-N 3.41Å; V264-M267 PolarHBondContact O-N 3.43Å
268	T	83.4	Confident	77.9	Confident	60 Å²	60	69.1 Å²	69.1	37%	0.368	36%	0.359	S	S	.	.	S	Bend	trans	-62.6	144.7	172.4	73.3	0	0	0	0	112.9	V264 T265 G266 Y270 Y271	V264-T268 WeakPolarHBondContact O-CG2 3.28Å; V264-T268 PolarHBondContact O-N 3.47Å; V264-T268 VanDerWaalsContact O-N 3.16Å; T265-T268 PolarHBondContact O-N 3.13Å; T265-T268 PolarHBondContact O-OG1 3.05Å; G266-T268 PolarHBondContact O-N 3.34Å; G266-T268 VanDerWaalsContact O-O 3.09Å; T268-Y270 PolarHBondContact O-N 3.31Å; T268-Y271 PolarHBondContact O-N 2.69Å; T268-Y271 PolarHBondContact OG1-N 3.28Å
269	M	67.6	Low	76.9	Confident	159 Å²	159	69.9 Å²	69.9	78%	0.783	37%	0.369	S	S	*	.	H	α-helix	trans	-63.5	-29.3	174.8	-161	176.1	-171.7	0	0	112.1	Y271 R272 T273	M269-Y271 PolarHBondContact O-N 3.06Å; M269-R272 WeakPolarHBondContact O-CB 3.25Å; M269-R272 PolarHBondContact O-N 3.35Å; M269-T273 PolarHBondContact O-N 3.19Å; M269-T273 PolarHBondContact O-OG1 3Å
270	Y	66.6	Low	76.2	Confident	144 Å²	144	78.2 Å²	78.2	57%	0.565	40%	0.401	S	S	*	.	H	α-helix	trans	-57.5	-41.5	177.1	-174.1	-93.4	0	0	0	113.1	T268 R272 T273 I274 L275	T268-Y270 PolarHBondContact O-N 3.31Å; Y270-R272 PolarHBondContact O-N 3.16Å; Y270-T273 PolarHBondContact O-N 2.86Å; Y270-T273 PolarHBondContact O-OG1 2.72Å; Y270-I274 HydrophobicContact CD2-CD1 3.63Å; Y270-I274 HydrophobicContact CE1-CG2 4.49Å; Y270-I274 HydrophobicContact CE2-CD1 3.34Å; Y270-I274 HydrophobicContact CG-CD1 4.39Å; Y270-I274 PolarHBondContact O-N 3.16Å; Y270-I274 VanDerWaalsContact O-N 3.08Å; Y270-L275 HydrophobicContact CD1-CD1 3.87Å; Y270-L275 HydrophobicContact CE1-CD1 3.97Å
271	Y	67.9	Low	75.8	Confident	5 Å²	5	77.8 Å²	77.8	2%	0.02	40%	0.395	C	S	.	.	I	π-helix	trans	-61.1	-35.9	174.6	176.2	-74.7	0	0	0	112.4	T265 T268 M269 L275 L276 W281 E285	T265-Y271 HydrophobicContact CG2-CD2 4.16Å; T265-Y271 WeakPolarHBondContact O-CB 3.15Å; T268-Y271 PolarHBondContact O-N 2.69Å; T268-Y271 PolarHBondContact OG1-N 3.28Å; M269-Y271 PolarHBondContact O-N 3.06Å; Y271-L275 HydrophobicContact CD2-CB 4.34Å; Y271-L275 HydrophobicContact CD2-CD1 4.3Å; Y271-L275 HydrophobicContact CG-CB 4.46Å; Y271-L275 PolarHBondContact O-N 3.44Å; Y271-L276 HydrophobicContact CD1-CD1 3.73Å; Y271-L276 HydrophobicContact CD1-CG 4.34Å; Y271-L276 HydrophobicContact CE1-CD1 3.52Å; Y271-L276 HydrophobicContact CE1-CG 3.94Å; Y271-L276 PolarHBondContact O-N 3.04Å; Y271-L276 VanDerWaalsContact O-N 3.13Å; Y271-W281 HydrophobicContact CD2-CZ2 4.33Å; Y271-W281 AromaticContact CE2-CE2 3.74Å; Y271-W281 AromaticContact CE2-CZ2 3.88Å; Y271-W281 HydrophobicContact CE2-CZ2 3.88Å; Y271-W281 AromaticContact CE2-NE1 3.24Å; Y271-W281 AromaticContact CZ-NE1 3.67Å; Y271-E285 PolarHBondContact OH-OE2 3.11Å
272	R	63.7	Low	75.6	Confident	163 Å²	163	74.9 Å²	74.9	62%	0.615	38%	0.375	S	S	*	.	I	π-helix	trans	-73.8	-26.7	-176.2	-129.8	-173.4	-170.8	-156.9	3.5	113.9	M269 Y270 L276	M269-R272 WeakPolarHBondContact O-CB 3.25Å; M269-R272 PolarHBondContact O-N 3.35Å; Y270-R272 PolarHBondContact O-N 3.16Å; R272-L276 HydrophobicContact CG-CD1 4.06Å
273	T	59.6	Low	75.5	Confident	88 Å²	88	75.8 Å²	75.8	54%	0.54	38%	0.38	S	S	.	.	I	π-helix	trans	-103.1	-30.7	-174.9	52.4	0	0	0	0	113.8	M269 Y270	M269-T273 PolarHBondContact O-N 3.19Å; M269-T273 PolarHBondContact O-OG1 3Å; Y270-T273 PolarHBondContact O-N 2.86Å; Y270-T273 PolarHBondContact O-OG1 2.72Å
274	I	59.6	Low	75.4	Confident	87 Å²	87	75.6 Å²	75.6	45%	0.446	38%	0.38	S	S	.	.	I	π-helix	trans	-115.2	-45.6	-170.4	-68.8	160.8	0	0	0	112.2	Y270	Y270-I274 HydrophobicContact CD2-CD1 3.63Å; Y270-I274 HydrophobicContact CE1-CG2 4.49Å; Y270-I274 HydrophobicContact CE2-CD1 3.34Å; Y270-I274 HydrophobicContact CG-CD1 4.39Å; Y270-I274 PolarHBondContact O-N 3.16Å; Y270-I274 VanDerWaalsContact O-N 3.08Å
275	L	62	Low	75.4	Confident	34 Å²	34	72.4 Å²	72.4	18%	0.178	36%	0.359	C	S	.	.	I	π-helix	trans	-77.6	-38.3	-176.4	-74.3	140.5	0	0	0	112.2	T265 Y270 Y271 D277 S278 W281	T265-L275 HydrophobicContact CG2-CD1 4.42Å; Y270-L275 HydrophobicContact CD1-CD1 3.87Å; Y270-L275 HydrophobicContact CE1-CD1 3.97Å; Y271-L275 HydrophobicContact CD2-CB 4.34Å; Y271-L275 HydrophobicContact CD2-CD1 4.3Å; Y271-L275 HydrophobicContact CG-CB 4.46Å; Y271-L275 PolarHBondContact O-N 3.44Å; L275-D277 VanDerWaalsContact C-N 3.31Å; L275-D277 PolarHBondContact O-N 2.93Å; L275-S278 PolarHBondContact O-N 3.05Å; L275-W281 HydrophobicContact CB-CB 4.5Å; L275-W281 HydrophobicContact CB-CD2 4.26Å; L275-W281 HydrophobicContact CB-CG 4.02Å; L275-W281 HydrophobicContact CD2-CB 4.37Å; L275-W281 HydrophobicContact CD2-CD2 3.49Å; L275-W281 VanDerWaalsContact CD2-CD2 3.49Å; L275-W281 HydrophobicContact CD2-CE3 3.32Å; L275-W281 HydrophobicContact CD2-CG 3.94Å; L275-W281 HydrophobicContact CD2-CH2 4.39Å; L275-W281 HydrophobicContact CD2-CZ3 3.8Å; L275-W281 HydrophobicContact CG-CD2 4.46Å; L275-W281 WeakPolarHBondContact O-CB 3.41Å
276	L	65.8	Low	75.8	Confident	33 Å²	33	70 Å²	70	17%	0.173	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-20.1	177.8	-101.9	154.1	0	0	0	115.2	P187 Y271 R272 M357	P187-L276 HydrophobicContact CB-CD1 4.49Å; P187-L276 HydrophobicContact CB-CD2 4.38Å; P187-L276 HydrophobicContact CG-CD2 3.84Å; Y271-L276 HydrophobicContact CD1-CD1 3.73Å; Y271-L276 HydrophobicContact CD1-CG 4.34Å; Y271-L276 HydrophobicContact CE1-CD1 3.52Å; Y271-L276 HydrophobicContact CE1-CG 3.94Å; Y271-L276 PolarHBondContact O-N 3.04Å; Y271-L276 VanDerWaalsContact O-N 3.13Å; R272-L276 HydrophobicContact CG-CD1 4.06Å; L276-M357 HydrophobicContact CD2-CE 3.33Å; L276-M357 HydrophobicContact CG-CE 4.45Å
277	D	66.7	Low	76.4	Confident	117 Å²	117	76 Å²	76	63%	0.626	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-26	176.1	-163.9	32.3	0	0	0	112	L275 S279 K365	L275-D277 VanDerWaalsContact C-N 3.31Å; L275-D277 PolarHBondContact O-N 2.93Å; D277-S279 PolarHBondContact O-N 3.4Å; D277-K365 PolarHBondContact O-NZ 3.01Å
278	S	78.1	Confident	77	Confident	55 Å²	55	72.5 Å²	72.5	39%	0.385	35%	0.354	S	S	.	.	S	Bend	trans	-68.8	126.9	176.5	-177.3	0	0	0	0	112.1	L275 W280 P282	L275-S278 PolarHBondContact O-N 3.05Å; S278-W280 PolarHBondContact O-N 3.42Å; S278-P282 VanDerWaalsContact O-CD 3.28Å; S278-P282 WeakPolarHBondContact O-CD 3.11Å
279	S	73.8	Confident	77.6	Confident	75 Å²	75	69.9 Å²	69.9	52%	0.524	34%	0.338	S	S	.	.	S	Bend	trans	-68.4	-13.1	178.7	49.1	0	0	0	0	114.6	D277	D277-S279 PolarHBondContact O-N 3.4Å
280	W	80.9	Confident	78.9	Confident	176 Å²	176	64.7 Å²	64.7	67%	0.667	31%	0.313	S	S	*	.	S	Bend	trans	-95.1	-26.6	-176.2	-155.4	63	0	0	0	113.1	S278 L283 T284	S278-W280 PolarHBondContact O-N 3.42Å; W280-L283 WeakPolarHBondContact O-CB 3.33Å; W280-L283 PolarHBondContact O-N 3.31Å; W280-T284 HydrophobicContact CD2-CG2 3.93Å; W280-T284 HydrophobicContact CE3-CG2 3.61Å; W280-T284 HydrophobicContact CH2-CG2 3.94Å; W280-T284 HydrophobicContact CZ2-CG2 4.22Å; W280-T284 HydrophobicContact CZ3-CG2 3.62Å; W280-T284 PolarHBondContact O-N 3.39Å
281	W	85.7	Confident	80.4	Confident	49 Å²	49	60.1 Å²	60.1	19%	0.186	31%	0.306	C	S	.	.	H	α-helix	trans	-64.2	-44.9	-177.1	177.9	-94.5	0	0	0	114.5	L262 Y271 L275 L283 T284 E285	L262-W281 HydrophobicContact CD2-CZ2 4.33Å; Y271-W281 HydrophobicContact CD2-CZ2 4.33Å; Y271-W281 AromaticContact CE2-CE2 3.74Å; Y271-W281 AromaticContact CE2-CZ2 3.88Å; Y271-W281 HydrophobicContact CE2-CZ2 3.88Å; Y271-W281 AromaticContact CE2-NE1 3.24Å; Y271-W281 AromaticContact CZ-NE1 3.67Å; L275-W281 HydrophobicContact CB-CB 4.5Å; L275-W281 HydrophobicContact CB-CD2 4.26Å; L275-W281 HydrophobicContact CB-CG 4.02Å; L275-W281 HydrophobicContact CD2-CB 4.37Å; L275-W281 HydrophobicContact CD2-CD2 3.49Å; L275-W281 VanDerWaalsContact CD2-CD2 3.49Å; L275-W281 HydrophobicContact CD2-CE3 3.32Å; L275-W281 HydrophobicContact CD2-CG 3.94Å; L275-W281 HydrophobicContact CD2-CH2 4.39Å; L275-W281 HydrophobicContact CD2-CZ3 3.8Å; L275-W281 HydrophobicContact CG-CD2 4.46Å; L275-W281 WeakPolarHBondContact O-CB 3.41Å; W281-L283 PolarHBondContact O-N 2.94Å; W281-L283 VanDerWaalsContact O-N 3.14Å; W281-T284 WeakPolarHBondContact CA-OG1 3.46Å; W281-T284 PolarHBondContact O-N 2.93Å; W281-T284 VanDerWaalsContact O-N 3.12Å; W281-T284 PolarHBondContact O-OG1 3.5Å; W281-E285 PolarHBondContact NE1-OE2 2.99Å; W281-E285 PolarHBondContact O-N 3.5Å
282	P	86.5	Confident	81.7	Confident	2 Å²	2	60 Å²	60	1%	0.013	31%	0.305	C	S	.	.	H	α-helix	trans	-61.8	-25.5	176.6	-23	34.8	0	0	0	112.8	S278 A286 M357 W358	S278-P282 VanDerWaalsContact O-CD 3.28Å; S278-P282 WeakPolarHBondContact O-CD 3.11Å; P282-A286 WeakPolarHBondContact O-CB 3.48Å; P282-A286 PolarHBondContact O-N 3.34Å; P282-A286 VanDerWaalsContact O-N 3.13Å; P282-M357 HydrophobicContact CB-CE 4.22Å; P282-M357 HydrophobicContact CG-CE 3.83Å; P282-W358 HydrophobicContact CB-CB 4.37Å
283	L	88.1	Confident	83.3	Confident	48 Å²	48	54 Å²	54	25%	0.251	28%	0.284	S	S	.	.	H	α-helix	trans	-77	-42.8	175.4	-173.9	69.8	0	0	0	111.3	W280 W281 E285 A286 F287	W280-L283 WeakPolarHBondContact O-CB 3.33Å; W280-L283 PolarHBondContact O-N 3.31Å; W281-L283 PolarHBondContact O-N 2.94Å; W281-L283 VanDerWaalsContact O-N 3.14Å; L283-E285 VanDerWaalsContact C-N 3.34Å; L283-A286 WeakPolarHBondContact O-CB 3.35Å; L283-A286 PolarHBondContact O-N 3.2Å; L283-F287 HydrophobicContact CD1-CD2 4.34Å; L283-F287 HydrophobicContact CD1-CE2 3.85Å; L283-F287 HydrophobicContact CD2-CE2 4.09Å; L283-F287 HydrophobicContact CG-CD2 3.95Å; L283-F287 HydrophobicContact CG-CE2 3.66Å; L283-F287 WeakPolarHBondContact O-CD2 3.45Å; L283-F287 PolarHBondContact O-N 3.21Å
284	T	89.5	Confident	85	Confident	27 Å²	27	54 Å²	54	17%	0.166	28%	0.28	C	S	.	.	H	α-helix	trans	-64.3	-39.5	174.1	51.3	0	0	0	0	111.8	W280 W281 A286 F287 I288	W280-T284 HydrophobicContact CD2-CG2 3.93Å; W280-T284 HydrophobicContact CE3-CG2 3.61Å; W280-T284 HydrophobicContact CH2-CG2 3.94Å; W280-T284 HydrophobicContact CZ2-CG2 4.22Å; W280-T284 HydrophobicContact CZ3-CG2 3.62Å; W280-T284 PolarHBondContact O-N 3.39Å; W281-T284 WeakPolarHBondContact CA-OG1 3.46Å; W281-T284 PolarHBondContact O-N 2.93Å; W281-T284 VanDerWaalsContact O-N 3.12Å; W281-T284 PolarHBondContact O-OG1 3.5Å; T284-A286 VanDerWaalsContact C-N 3.34Å; T284-A286 PolarHBondContact O-N 2.96Å; T284-F287 PolarHBondContact O-N 3.49Å; T284-I288 VanDerWaalsContact O-CG1 3.3Å; T284-I288 WeakPolarHBondContact O-CG1 3.48Å; T284-I288 PolarHBondContact O-N 3.17Å
285	E	90.9	Very high	86.7	Confident	16 Å²	16	53.1 Å²	53.1	8%	0.075	28%	0.276	C	S	.	.	H	α-helix	trans	-64.8	-37.7	175.1	-165.1	174.1	144.5	0	0	111.8	Y271 W281 L283 I288 N289	Y271-E285 PolarHBondContact OH-OE2 3.11Å; W281-E285 PolarHBondContact NE1-OE2 2.99Å; W281-E285 PolarHBondContact O-N 3.5Å; L283-E285 VanDerWaalsContact C-N 3.34Å; E285-I288 PolarHBondContact O-N 3.17Å; E285-N289 PolarHBondContact O-N 2.82Å; E285-N289 PolarHBondContact O-ND2 3.2Å
286	A	92.7	Very high	88.3	Confident	3 Å²	3	51.7 Å²	51.7	3%	0.025	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-47.9	170.5	0	0	0	0	0	111.8	P282 L283 T284 I288 N289 L290 F351 C354	P282-A286 WeakPolarHBondContact O-CB 3.48Å; P282-A286 PolarHBondContact O-N 3.34Å; P282-A286 VanDerWaalsContact O-N 3.13Å; L283-A286 WeakPolarHBondContact O-CB 3.35Å; L283-A286 PolarHBondContact O-N 3.2Å; T284-A286 VanDerWaalsContact C-N 3.34Å; T284-A286 PolarHBondContact O-N 2.96Å; A286-I288 VanDerWaalsContact C-N 3.34Å; A286-I288 PolarHBondContact O-N 3.19Å; A286-N289 PolarHBondContact O-N 2.81Å; A286-L290 WeakPolarHBondContact O-CB 3.39Å; A286-L290 PolarHBondContact O-N 3.25Å; A286-F351 HydrophobicContact CB-CD2 3.95Å; A286-F351 HydrophobicContact CB-CE2 4.18Å; A286-F351 WeakPolarHBondContact O-CD2 3.49Å; A286-C354 HydrophobicContact CB-CB 3.64Å
287	F	94.2	Very high	89.7	Confident	126 Å²	126	53.3 Å²	53.3	55%	0.553	28%	0.275	S	S	*	.	H	α-helix	trans	-61.9	-38.9	178.7	-81.9	-63	0	0	0	112.9	L283 T284 L290 A291	L283-F287 HydrophobicContact CD1-CD2 4.34Å; L283-F287 HydrophobicContact CD1-CE2 3.85Å; L283-F287 HydrophobicContact CD2-CE2 4.09Å; L283-F287 HydrophobicContact CG-CD2 3.95Å; L283-F287 HydrophobicContact CG-CE2 3.66Å; L283-F287 WeakPolarHBondContact O-CD2 3.45Å; L283-F287 PolarHBondContact O-N 3.21Å; T284-F287 PolarHBondContact O-N 3.49Å; F287-L290 PolarHBondContact O-N 3Å; F287-A291 WeakPolarHBondContact O-CB 3.4Å; F287-A291 PolarHBondContact O-N 2.68Å
288	I	94.4	Very high	91	Very high	56 Å²	56	49.4 Å²	49.4	29%	0.287	26%	0.259	S	S	.	.	H	α-helix	trans	-63.9	-48.2	175.3	-64.6	161.3	0	0	0	110.1	I258 L262 T284 E285 A286 L290 A291 L292	I258-I288 HydrophobicContact CG2-CG2 3.63Å; L262-I288 HydrophobicContact CD1-CG2 3.89Å; L262-I288 HydrophobicContact CD2-CD1 4.26Å; T284-I288 VanDerWaalsContact O-CG1 3.3Å; T284-I288 WeakPolarHBondContact O-CG1 3.48Å; T284-I288 PolarHBondContact O-N 3.17Å; E285-I288 PolarHBondContact O-N 3.17Å; A286-I288 VanDerWaalsContact C-N 3.34Å; A286-I288 PolarHBondContact O-N 3.19Å; I288-L290 VanDerWaalsContact C-N 3.29Å; I288-L290 PolarHBondContact O-N 2.82Å; I288-A291 PolarHBondContact O-N 2.66Å; I288-A291 VanDerWaalsContact O-N 3.17Å; I288-L292 HydrophobicContact CG2-CD1 4.19Å; I288-L292 HydrophobicContact CG2-CG 4.32Å; I288-L292 WeakPolarHBondContact O-CG 3.5Å; I288-L292 PolarHBondContact O-N 3.21Å
289	N	95.2	Very high	91.7	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-35.7	177.3	-79.1	-79.2	0	0	0	112.8	E285 A286 F293 S350 F351	E285-N289 PolarHBondContact O-N 2.82Å; E285-N289 PolarHBondContact O-ND2 3.2Å; A286-N289 PolarHBondContact O-N 2.81Å; N289-F293 WeakPolarHBondContact O-CB 3.38Å; N289-F293 PolarHBondContact O-N 3.38Å; N289-S350 VanDerWaalsContact CG-CB 3.45Å; N289-S350 WeakPolarHBondContact OD1-CB 3.43Å; N289-F351 HydrophobicContact CB-CB 4.17Å
290	L	96.1	Very high	92.6	Very high	50 Å²	50	43.3 Å²	43.3	26%	0.262	22%	0.217	S	C	.	.	H	α-helix	trans	-66.4	-42.6	173.7	-179.2	62.5	0	0	0	112	A286 F287 I288 F293 L294 F351	A286-L290 WeakPolarHBondContact O-CB 3.39Å; A286-L290 PolarHBondContact O-N 3.25Å; F287-L290 PolarHBondContact O-N 3Å; I288-L290 VanDerWaalsContact C-N 3.29Å; I288-L290 PolarHBondContact O-N 2.82Å; L290-F293 HydrophobicContact CD1-CD1 4.19Å; L290-F293 WeakPolarHBondContact O-CB 3.31Å; L290-F293 PolarHBondContact O-N 3.33Å; L290-L294 WeakPolarHBondContact O-CG 3.26Å; L290-L294 PolarHBondContact O-N 3.47Å; L290-F351 HydrophobicContact CB-CD2 3.91Å; L290-F351 HydrophobicContact CB-CE2 4.06Å; L290-F351 HydrophobicContact CB-CG 4.44Å; L290-F351 HydrophobicContact CD1-CE1 4.49Å; L290-F351 HydrophobicContact CD1-CZ 4.44Å; L290-F351 HydrophobicContact CD2-CE2 4.16Å; L290-F351 HydrophobicContact CD2-CZ 4.29Å
291	A	96.8	Very high	93.1	Very high	49 Å²	49	39.8 Å²	39.8	41%	0.405	21%	0.21	S	C	.	.	H	α-helix	trans	-63.5	-43.7	175.6	0	0	0	0	0	111.6	F287 I288 L294 L295	F287-A291 WeakPolarHBondContact O-CB 3.4Å; F287-A291 PolarHBondContact O-N 2.68Å; I288-A291 PolarHBondContact O-N 2.66Å; I288-A291 VanDerWaalsContact O-N 3.17Å; A291-L294 PolarHBondContact O-N 3.35Å; A291-L295 WeakPolarHBondContact O-CB 3.26Å; A291-L295 WeakPolarHBondContact O-CG 3.2Å; A291-L295 PolarHBondContact O-N 2.72Å
292	L	95.6	Very high	93.2	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-63	-40.6	175	-65.7	-176.6	0	0	0	112.1	I258 T259 I288 L295 Y296 Y347	I258-L292 HydrophobicContact CB-CD1 4.49Å; I258-L292 HydrophobicContact CB-CD2 4.43Å; I258-L292 HydrophobicContact CD1-CD2 4.07Å; I258-L292 HydrophobicContact CG2-CD1 3.99Å; I258-L292 HydrophobicContact CG2-CD2 4.39Å; T259-L292 HydrophobicContact CG2-CD1 3.95Å; I288-L292 HydrophobicContact CG2-CD1 4.19Å; I288-L292 HydrophobicContact CG2-CG 4.32Å; I288-L292 WeakPolarHBondContact O-CG 3.5Å; I288-L292 PolarHBondContact O-N 3.21Å; L292-L295 HydrophobicContact CD2-CD1 4.49Å; L292-L295 PolarHBondContact O-N 3.23Å; L292-Y296 WeakPolarHBondContact O-CD2 3.18Å; L292-Y296 PolarHBondContact O-N 2.71Å; L292-Y347 HydrophobicContact CB-CD1 3.69Å; L292-Y347 HydrophobicContact CB-CE1 3.86Å; L292-Y347 HydrophobicContact CB-CG 4.07Å; L292-Y347 HydrophobicContact CD1-CD1 3.98Å; L292-Y347 HydrophobicContact CD1-CE1 3.51Å; L292-Y347 HydrophobicContact CG-CE1 4.33Å
293	F	96.6	Very high	93.3	Very high	36 Å²	36	39.1 Å²	39.1	16%	0.158	21%	0.211	C	C	.	.	H	α-helix	trans	-57.4	-48.9	172.4	163.2	-102	0	0	0	112	N289 L290 L295 Y296 M297 M344 L348	N289-F293 WeakPolarHBondContact O-CB 3.38Å; N289-F293 PolarHBondContact O-N 3.38Å; L290-F293 HydrophobicContact CD1-CD1 4.19Å; L290-F293 WeakPolarHBondContact O-CB 3.31Å; L290-F293 PolarHBondContact O-N 3.33Å; F293-L295 VanDerWaalsContact C-N 3.34Å; F293-L295 PolarHBondContact O-N 3.42Å; F293-Y296 PolarHBondContact O-N 2.7Å; F293-M297 WeakPolarHBondContact O-CB 3.29Å; F293-M297 PolarHBondContact O-N 2.73Å; F293-M344 HydrophobicContact CD2-CG 3.63Å; F293-M344 WeakPolarHBondContact CD2-O 3.36Å; F293-M344 HydrophobicContact CE2-CE 4.39Å; F293-M344 HydrophobicContact CE2-CG 3.59Å; F293-M344 HydrophobicContact CE2-SD 4.05Å; F293-L348 HydrophobicContact CD2-CB 3.81Å; F293-L348 HydrophobicContact CE2-CB 4.03Å; F293-L348 HydrophobicContact CE2-CD1 4.42Å; F293-L348 HydrophobicContact CE2-CD2 4.19Å; F293-L348 HydrophobicContact CE2-CG 4.45Å; F293-L348 HydrophobicContact CG-CB 4.45Å; F293-L348 HydrophobicContact CZ-CD1 4.47Å
294	L	96.3	Very high	93.3	Very high	87 Å²	87	39.8 Å²	39.8	46%	0.455	21%	0.214	S	C	.	.	H	α-helix	trans	-64.9	-38.2	179.8	-68.5	173.8	0	0	0	112.1	L290 A291 M297 A298	L290-L294 WeakPolarHBondContact O-CG 3.26Å; L290-L294 PolarHBondContact O-N 3.47Å; A291-L294 PolarHBondContact O-N 3.35Å; L294-M297 HydrophobicContact CD2-CE 4.26Å; L294-M297 PolarHBondContact O-N 3.25Å; L294-A298 WeakPolarHBondContact O-CB 3.4Å; L294-A298 PolarHBondContact O-N 2.67Å
295	L	95.1	Very high	92.9	Very high	70 Å²	70	41 Å²	41	37%	0.366	22%	0.22	S	C	.	.	H	α-helix	trans	-64.8	-45.3	174.2	-72.9	172.4	0	0	0	112	V251 A291 L292 F293 M297 A298 A299	V251-L295 HydrophobicContact CG1-CB 3.87Å; A291-L295 WeakPolarHBondContact O-CB 3.26Å; A291-L295 WeakPolarHBondContact O-CG 3.2Å; A291-L295 PolarHBondContact O-N 2.72Å; L292-L295 HydrophobicContact CD2-CD1 4.49Å; L292-L295 PolarHBondContact O-N 3.23Å; F293-L295 VanDerWaalsContact C-N 3.34Å; F293-L295 PolarHBondContact O-N 3.42Å; L295-M297 VanDerWaalsContact C-N 3.33Å; L295-M297 PolarHBondContact O-N 2.93Å; L295-A298 PolarHBondContact O-N 2.82Å; L295-A299 WeakPolarHBondContact O-CB 3.31Å; L295-A299 PolarHBondContact O-N 3.5Å
296	Y	94.8	Very high	92.4	Very high	3 Å²	3	40.9 Å²	40.9	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-34.7	174.9	-96.9	-87.3	0	0	0	113	S255 L292 F293 A299 G300 I340 N343 Y347	S255-Y296 VanDerWaalsContact CB-CE2 3.49Å; S255-Y296 WeakPolarHBondContact OG-CE2 3.26Å; S255-Y296 PolarHBondContact OG-OH 2.89Å; L292-Y296 WeakPolarHBondContact O-CD2 3.18Å; L292-Y296 PolarHBondContact O-N 2.71Å; F293-Y296 PolarHBondContact O-N 2.7Å; Y296-A299 PolarHBondContact O-N 2.9Å; Y296-G300 PolarHBondContact O-N 2.86Å; Y296-I340 HydrophobicContact CD1-CG2 4.06Å; Y296-N343 HydrophobicContact CD1-CB 3.94Å; Y296-N343 HydrophobicContact CE1-CB 3.73Å; Y296-Y347 AromaticContact CD2-CD2 3.64Å; Y296-Y347 HydrophobicContact CD2-CD2 3.64Å; Y296-Y347 AromaticContact CD2-CE2 3.3Å; Y296-Y347 HydrophobicContact CD2-CE2 3.3Å; Y296-Y347 HydrophobicContact CE2-CD2 4.03Å; Y296-Y347 AromaticContact CE2-CE2 3.19Å; Y296-Y347 HydrophobicContact CE2-CE2 3.19Å; Y296-Y347 AromaticContact CE2-CZ 3.77Å; Y296-Y347 HydrophobicContact CG-CD2 4.15Å; Y296-Y347 HydrophobicContact CG-CE2 4.07Å; Y296-Y347 AromaticContact CZ-CE2 3.94Å
297	M	95.8	Very high	91.6	Very high	67 Å²	67	41.9 Å²	41.9	33%	0.33	23%	0.225	S	C	.	.	H	α-helix	trans	-64.9	-46.3	174.6	-175.3	-82.9	-71.6	0	0	110.6	F293 L294 L295 G300 I301 M344	F293-M297 WeakPolarHBondContact O-CB 3.29Å; F293-M297 PolarHBondContact O-N 2.73Å; L294-M297 HydrophobicContact CD2-CE 4.26Å; L294-M297 PolarHBondContact O-N 3.25Å; L295-M297 VanDerWaalsContact C-N 3.33Å; L295-M297 PolarHBondContact O-N 2.93Å; M297-G300 PolarHBondContact O-N 2.96Å; M297-I301 WeakPolarHBondContact O-CG1 3.34Å; M297-I301 PolarHBondContact O-N 3.5Å; M297-I301 HydrophobicContact SD-CD1 3.4Å; M297-I301 WeakPolarHBondContact SD-CD1 3.28Å; M297-I301 HydrophobicContact SD-CG1 4.21Å; M297-M344 HydrophobicContact CB-CG 4.24Å; M297-M344 HydrophobicContact CB-SD 3.93Å; M297-M344 HydrophobicContact CG-SD 4.09Å
298	A	94.4	Very high	90.7	Very high	35 Å²	35	41 Å²	41	29%	0.289	23%	0.226	S	C	.	.	H	α-helix	trans	-61.1	-45.8	173.5	0	0	0	0	0	112.1	L294 L295 G300 I301 V302	L294-A298 WeakPolarHBondContact O-CB 3.4Å; L294-A298 PolarHBondContact O-N 2.67Å; L295-A298 PolarHBondContact O-N 2.82Å; A298-G300 VanDerWaalsContact C-N 3.35Å; A298-G300 PolarHBondContact O-N 3.36Å; A298-I301 PolarHBondContact O-N 2.89Å; A298-V302 WeakPolarHBondContact O-CB 3.46Å; A298-V302 VanDerWaalsContact O-CG2 3.25Å; A298-V302 WeakPolarHBondContact O-CG2 3.49Å; A298-V302 PolarHBondContact O-N 2.89Å
299	A	93.2	Very high	89.2	Confident	2 Å²	2	44.8 Å²	44.8	2%	0.017	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-38.7	176.6	0	0	0	0	0	112.5	V248 V251 L295 Y296 V302 Y303	V248-A299 HydrophobicContact CG1-CB 4.4Å; V251-A299 HydrophobicContact CB-CB 4.18Å; V251-A299 HydrophobicContact CG1-CB 3.88Å; L295-A299 WeakPolarHBondContact O-CB 3.31Å; L295-A299 PolarHBondContact O-N 3.5Å; Y296-A299 PolarHBondContact O-N 2.9Å; A299-V302 PolarHBondContact O-N 3.3Å; A299-Y303 VanDerWaalsContact O-CB 3.24Å; A299-Y303 WeakPolarHBondContact O-CB 3.24Å; A299-Y303 PolarHBondContact O-N 2.81Å
300	G	92.2	Very high	87.3	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-66.7	-42.4	175.6	0	0	0	0	0	113.3	Y296 M297 A298 I304	Y296-G300 PolarHBondContact O-N 2.86Å; M297-G300 PolarHBondContact O-N 2.96Å; A298-G300 VanDerWaalsContact C-N 3.35Å; A298-G300 PolarHBondContact O-N 3.36Å; G300-I304 WeakPolarHBondContact O-CB 3.45Å; G300-I304 WeakPolarHBondContact O-CG1 3.48Å; G300-I304 PolarHBondContact O-N 2.83Å
301	I	90.4	Very high	85.1	Confident	102 Å²	102	43.2 Å²	43.2	52%	0.523	23%	0.233	S	C	.	.	H	α-helix	trans	-62.6	-47.1	173.1	-69.9	177.8	0	0	0	110.5	M297 A298 N305	M297-I301 WeakPolarHBondContact O-CG1 3.34Å; M297-I301 PolarHBondContact O-N 3.5Å; M297-I301 HydrophobicContact SD-CD1 3.4Å; M297-I301 WeakPolarHBondContact SD-CD1 3.28Å; M297-I301 HydrophobicContact SD-CG1 4.21Å; A298-I301 PolarHBondContact O-N 2.89Å; I301-N305 WeakPolarHBondContact O-CB 3.47Å; I301-N305 PolarHBondContact O-N 3.37Å
302	V	89.3	Confident	82.9	Confident	35 Å²	35	44.9 Å²	44.9	21%	0.212	24%	0.235	C	C	.	.	H	α-helix	trans	-62.5	-44.8	179.7	169.4	0	0	0	0	111	M244 F247 V248 A298 A299 N305 D306	M244-V302 HydrophobicContact CB-CG1 3.31Å; M244-V302 HydrophobicContact CG-CG1 4.16Å; F247-V302 HydrophobicContact CD1-CB 4.4Å; F247-V302 HydrophobicContact CD1-CG1 4.11Å; F247-V302 HydrophobicContact CD1-CG2 4.36Å; F247-V302 HydrophobicContact CE1-CB 4.44Å; F247-V302 HydrophobicContact CE1-CG2 4.11Å; V248-V302 HydrophobicContact CG2-CB 4.46Å; V248-V302 HydrophobicContact CG2-CG1 4.07Å; A298-V302 WeakPolarHBondContact O-CB 3.46Å; A298-V302 VanDerWaalsContact O-CG2 3.25Å; A298-V302 WeakPolarHBondContact O-CG2 3.49Å; A298-V302 PolarHBondContact O-N 2.89Å; A299-V302 PolarHBondContact O-N 3.3Å; V302-N305 CarbonylContact O-C 3.39Å; V302-N305 PolarHBondContact O-N 2.86Å; V302-D306 PolarHBondContact O-N 2.68Å
303	Y	88.6	Confident	80.9	Confident	1 Å²	1	47.2 Å²	47.2	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-66.1	-45	179.3	-165.8	-118.9	0	0	0	112.4	V208 T245 V248 A299 N305 D306 L307 T337 I340	V208-Y303 HydrophobicContact CG1-CE2 4.47Å; V208-Y303 HydrophobicContact CG2-CE2 4.02Å; T245-Y303 HydrophobicContact CG2-CE2 4.33Å; V248-Y303 HydrophobicContact CG1-CD2 4.3Å; V248-Y303 HydrophobicContact CG1-CG 4.45Å; V248-Y303 HydrophobicContact CG2-CD2 4.28Å; A299-Y303 VanDerWaalsContact O-CB 3.24Å; A299-Y303 WeakPolarHBondContact O-CB 3.24Å; A299-Y303 PolarHBondContact O-N 2.81Å; Y303-N305 VanDerWaalsContact C-N 3.3Å; Y303-N305 PolarHBondContact O-N 2.84Å; Y303-D306 PolarHBondContact O-N 3.01Å; Y303-L307 HydrophobicContact CD1-CD1 4.17Å; Y303-L307 HydrophobicContact CE1-CD1 3.98Å; Y303-L307 WeakPolarHBondContact O-CG 3.44Å; Y303-L307 PolarHBondContact O-N 3.3Å; Y303-T337 WeakPolarHBondContact CD1-OG1 3.39Å; Y303-T337 WeakPolarHBondContact CE1-OG1 3.06Å; Y303-I340 HydrophobicContact CD1-CD1 3.76Å; Y303-I340 HydrophobicContact CE1-CD1 4.29Å; Y303-I340 HydrophobicContact CG-CD1 4.06Å
304	I	87.3	Confident	78.5	Confident	62 Å²	62	53.5 Å²	53.5	32%	0.318	28%	0.28	S	S	.	.	H	α-helix	trans	-59.5	-42.9	171.6	-76.1	-177	0	0	0	110.8	G300 D306 L307 N308 T337 F341	G300-I304 WeakPolarHBondContact O-CB 3.45Å; G300-I304 WeakPolarHBondContact O-CG1 3.48Å; G300-I304 PolarHBondContact O-N 2.83Å; I304-D306 VanDerWaalsContact C-N 3.32Å; I304-D306 PolarHBondContact O-N 3.41Å; I304-L307 PolarHBondContact O-N 2.92Å; I304-N308 WeakPolarHBondContact CG2-ND2 3.5Å; I304-N308 VanDerWaalsContact O-CB 3.28Å; I304-N308 WeakPolarHBondContact O-CB 3.35Å; I304-N308 PolarHBondContact O-N 3.21Å; I304-N308 PolarHBondContact O-ND2 2.78Å; I304-T337 HydrophobicContact CD1-CG2 4.06Å; I304-T337 HydrophobicContact CG1-CG2 3.75Å; I304-F341 HydrophobicContact CD1-CE2 3.41Å; I304-F341 VanDerWaalsContact CD1-CE2 3.41Å; I304-F341 HydrophobicContact CD1-CZ 3.61Å; I304-F341 HydrophobicContact CG1-CE2 4.04Å; I304-F341 HydrophobicContact CG1-CZ 4.45Å
305	N	81.9	Confident	76.2	Confident	53 Å²	53	56.9 Å²	56.9	28%	0.283	30%	0.296	S	S	.	.	H	α-helix	trans	-66.5	-32.7	178.5	169.6	86	0	0	0	112.1	I301 V302 Y303 N308 R309	I301-N305 WeakPolarHBondContact O-CB 3.47Å; I301-N305 PolarHBondContact O-N 3.37Å; V302-N305 CarbonylContact O-C 3.39Å; V302-N305 PolarHBondContact O-N 2.86Å; Y303-N305 VanDerWaalsContact C-N 3.3Å; Y303-N305 PolarHBondContact O-N 2.84Å; N305-N308 PolarHBondContact O-N 2.81Å; N305-R309 WeakPolarHBondContact ND2-CD 3.4Å; N305-R309 PolarHBondContact ND2-NE 2.89Å; N305-R309 WeakPolarHBondContact O-CB 3.17Å; N305-R309 WeakPolarHBondContact O-CG 3.49Å; N305-R309 PolarHBondContact O-N 3.47Å; N305-R309 PolarHBondContact OD1-NE 3.43Å
306	D	79.4	Confident	74	Confident	13 Å²	13	56.6 Å²	56.6	7%	0.07	30%	0.297	C	S	.	.	H	α-helix	trans	-69.9	-43	173.1	-78.2	-14.5	0	0	0	111.6	M244 T245 V302 Y303 I304 N308 R309 G310	M244-D306 VanDerWaalsContact CA-OD2 3.3Å; M244-D306 WeakPolarHBondContact CA-OD2 3.26Å; M244-D306 WeakPolarHBondContact CB-OD2 3.3Å; M244-D306 PolarHBondContact N-OD2 2.71Å; T245-D306 PolarHBondContact N-OD2 3.39Å; V302-D306 PolarHBondContact O-N 2.68Å; Y303-D306 PolarHBondContact O-N 3.01Å; I304-D306 VanDerWaalsContact C-N 3.32Å; I304-D306 PolarHBondContact O-N 3.41Å; D306-N308 VanDerWaalsContact C-N 3.31Å; D306-N308 PolarHBondContact O-N 3.47Å; D306-R309 PolarHBondContact O-N 3.14Å; D306-G310 PolarHBondContact O-N 3.45Å
307	L	77.1	Confident	71.7	Confident	24 Å²	24	64.2 Å²	64.2	13%	0.126	34%	0.336	C	S	.	.	H	α-helix	trans	-60.8	-40.7	172.4	-64.1	175.7	0	0	0	111.5	Y303 I304 G311 Q333 T337	Y303-L307 HydrophobicContact CD1-CD1 4.17Å; Y303-L307 HydrophobicContact CE1-CD1 3.98Å; Y303-L307 WeakPolarHBondContact O-CG 3.44Å; Y303-L307 PolarHBondContact O-N 3.3Å; I304-L307 PolarHBondContact O-N 2.92Å; L307-G311 PolarHBondContact O-N 3.38Å; L307-Q333 HydrophobicContact CD1-CB 4.4Å; L307-Q333 HydrophobicContact CD2-CB 3.85Å; L307-Q333 HydrophobicContact CD2-CG 3.95Å; L307-T337 WeakPolarHBondContact CD1-OG1 3.41Å
308	N	74.6	Confident	69.5	Low	108 Å²	108	64.6 Å²	64.6	58%	0.578	36%	0.358	S	S	*	.	H	α-helix	trans	-74.9	-29.5	177.6	-70.5	-13.6	0	0	0	113.5	I304 N305 D306 G311	I304-N308 WeakPolarHBondContact CG2-ND2 3.5Å; I304-N308 VanDerWaalsContact O-CB 3.28Å; I304-N308 WeakPolarHBondContact O-CB 3.35Å; I304-N308 PolarHBondContact O-N 3.21Å; I304-N308 PolarHBondContact O-ND2 2.78Å; N305-N308 PolarHBondContact O-N 2.81Å; D306-N308 VanDerWaalsContact C-N 3.31Å; D306-N308 PolarHBondContact O-N 3.47Å; N308-G311 CarbonylContact O-C 3.59Å; N308-G311 VanDerWaalsContact O-CA 3.29Å; N308-G311 WeakPolarHBondContact O-CA 2.8Å; N308-G311 PolarHBondContact O-N 3.01Å; N308-G311 VanDerWaalsContact O-N 3.14Å
309	R	62.8	Low	67.6	Low	135 Å²	135	68.6 Å²	68.6	51%	0.509	38%	0.378	S	S	.	.	H	α-helix	trans	-84.3	-28.5	176.9	-77.1	-178.6	-172.5	-164.8	-2.8	113.1	Y222 N305 D306 G311	Y222-R309 WeakPolarHBondContact CE2-O 3.38Å; Y222-R309 PolarHBondContact OH-O 3.46Å; N305-R309 WeakPolarHBondContact ND2-CD 3.4Å; N305-R309 PolarHBondContact ND2-NE 2.89Å; N305-R309 WeakPolarHBondContact O-CB 3.17Å; N305-R309 WeakPolarHBondContact O-CG 3.49Å; N305-R309 PolarHBondContact O-N 3.47Å; N305-R309 PolarHBondContact OD1-NE 3.43Å; D306-R309 PolarHBondContact O-N 3.14Å; R309-G311 PolarHBondContact O-N 3.39Å
310	G	55.2	Low	66	Low	1 Å²	1	73.3 Å²	73.3	1%	0.01	40%	0.403	C	S	.	.	H	α-helix	trans	-54.4	-38.7	156	0	0	0	0	0	109.8	W218 D306 L312	W218-G310 WeakPolarHBondContact CH2-O 3.34Å; W218-G310 WeakPolarHBondContact CZ2-O 3.09Å; W218-G310 WeakPolarHBondContact CZ3-O 3.29Å; D306-G310 PolarHBondContact O-N 3.45Å; G310-L312 PolarHBondContact O-N 2.93Å; G310-L312 VanDerWaalsContact O-N 3.08Å
311	G	49.7	Very low	64.6	Low	20 Å²	20	77.9 Å²	77.9	21%	0.206	43%	0.433	C	S	.	.			trans	-74	92.3	178.4	0	0	0	0	0	117.6	L307 N308 R309 C313	L307-G311 PolarHBondContact O-N 3.38Å; N308-G311 CarbonylContact O-C 3.59Å; N308-G311 VanDerWaalsContact O-CA 3.29Å; N308-G311 WeakPolarHBondContact O-CA 2.8Å; N308-G311 PolarHBondContact O-N 3.01Å; N308-G311 VanDerWaalsContact O-N 3.14Å; R309-G311 PolarHBondContact O-N 3.39Å; G311-C313 WeakPolarHBondContact CA-SG 3.34Å; G311-C313 PolarHBondContact O-N 3.27Å; G311-C313 VanDerWaalsContact O-N 3.12Å
312	L	51.4	Low	63.2	Low	84 Å²	84	79 Å²	79	44%	0.44	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-65	0.5	147.3	-123.8	86.3	0	0	0	112.8	Y222 G310 H314 M315 T316	Y222-L312 HydrophobicContact CE1-CD1 4.19Å; Y222-L312 WeakPolarHBondContact OH-CD1 3.48Å; G310-L312 PolarHBondContact O-N 2.93Å; G310-L312 VanDerWaalsContact O-N 3.08Å; L312-H314 PolarHBondContact O-N 3.37Å; L312-M315 PolarHBondContact O-N 2.81Å; L312-T316 PolarHBondContact O-N 3.11Å
313	C	53.8	Low	61.7	Low	53 Å²	53	80.6 Å²	80.6	36%	0.358	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-64.8	-10.1	-170.3	-37.1	0	0	0	0	114.8	G311 C327	G311-C313 WeakPolarHBondContact CA-SG 3.34Å; G311-C313 PolarHBondContact O-N 3.27Å; G311-C313 VanDerWaalsContact O-N 3.12Å; C313-C327 WeakPolarHBondContact CA-SG 3.39Å; C313-C327 HydrophobicContact CB-CB 3.94Å; C313-C327 WeakPolarHBondContact CB-SG 3.35Å; C313-C327 PolarHBondContact N-SG 3.37Å; C313-C327 WeakPolarHBondContact SG-CA 3.4Å; C313-C327 WeakPolarHBondContact SG-CB 3.34Å; C313-C327 CovalentContact SG-SG 2.03Å; C313-C327 PolarHBondContact SG-SG 2.93Å
314	H	45.9	Very low	60.3	Low	167 Å²	167	83.4 Å²	83.4	77%	0.773	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-73.8	-15.8	169.4	-158.7	-60.1	0	0	0	112.5	L312	L312-H314 PolarHBondContact O-N 3.37Å
315	M	48.3	Very low	59	Low	159 Å²	159	85.9 Å²	85.9	78%	0.783	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.1	-14.6	-172.5	-66.2	-58.4	-160.4	0	0	115.7	L312	L312-M315 PolarHBondContact O-N 2.81Å
316	T	47.5	Very low	57.9	Low	63 Å²	63	85.9 Å²	85.9	39%	0.387	48%	0.481	S	S	.	.			trans	-112.2	62.8	-179.5	48.5	0	0	0	0	113.5	L312 G318	L312-T316 PolarHBondContact O-N 3.11Å; T316-G318 PolarHBondContact O-N 3.2Å
317	I	46.1	Very low	57	Low	163 Å²	163	86.5 Å²	86.5	84%	0.836	49%	0.487	S	S	*	.	S	Bend	trans	-73.7	102.7	159.4	-65.3	172.9	0	0	0	107.7
318	G	50.2	Low	56.6	Low	76 Å²	76	92.1 Å²	92.1	78%	0.784	51%	0.506	S	S	*	.	S	Bend	trans	108.6	10	149.2	0	0	0	0	0	121	T316	T316-G318 PolarHBondContact O-N 3.2Å
319	V	55.3	Low	56.5	Low	118 Å²	118	89.8 Å²	89.8	72%	0.715	50%	0.496	S	S	*	.	S	Bend	trans	-114.7	-24	-173.6	-160	0	0	0	0	116.2
320	N	60	Low	57.3	Low	102 Å²	102	84.9 Å²	84.9	55%	0.545	48%	0.48	S	S	.	.			trans	-141	120.6	-178.8	-89.5	-59.3	0	0	0	113.4	I322 M323 A324	N320-I322 VanDerWaalsContact C-N 3.31Å; N320-I322 PolarHBondContact O-N 3.04Å; N320-M323 HydrophobicContact CB-CB 4.12Å; N320-M323 HydrophobicContact CB-CG 3.99Å; N320-M323 PolarHBondContact O-N 3.49Å; N320-A324 PolarHBondContact O-N 2.91Å
321	P	62.4	Low	58.5	Low	97 Å²	97	87.5 Å²	87.5	63%	0.63	51%	0.507	S	S	*	.	H	α-helix	trans	-68.5	-28.5	-177.8	27.4	-34.5	0	0	0	113.1	A324 N325	P321-A324 PolarHBondContact O-N 3.38Å; P321-N325 PolarHBondContact O-N 3.33Å; P321-N325 VanDerWaalsContact O-N 3.11Å
322	I	59.9	Low	60	Low	124 Å²	124	87.4 Å²	87.4	64%	0.636	51%	0.505	S	S	*	.	H	α-helix	trans	-64.7	-51	175.1	-61.6	171.6	0	0	0	109.7	N320 A324 N325 L326	N320-I322 VanDerWaalsContact C-N 3.31Å; N320-I322 PolarHBondContact O-N 3.04Å; I322-A324 VanDerWaalsContact C-N 3.31Å; I322-A324 PolarHBondContact O-N 2.94Å; I322-N325 PolarHBondContact O-N 2.89Å; I322-L326 HydrophobicContact CG2-CD1 4.07Å; I322-L326 WeakPolarHBondContact O-CD1 3.48Å; I322-L326 PolarHBondContact O-N 2.98Å; I322-L326 VanDerWaalsContact O-N 3.13Å
323	M	58.8	Low	61.6	Low	70 Å²	70	83.8 Å²	83.8	35%	0.345	49%	0.486	S	S	.	.	H	α-helix	trans	-63.4	-36.3	178	-63.3	-60.5	-75.2	0	0	112	N320 N325 L326 C327	N320-M323 HydrophobicContact CB-CB 4.12Å; N320-M323 HydrophobicContact CB-CG 3.99Å; N320-M323 PolarHBondContact O-N 3.49Å; M323-N325 PolarHBondContact O-N 3.36Å; M323-L326 PolarHBondContact O-N 3.31Å; M323-C327 VanDerWaalsContact O-CB 3.28Å; M323-C327 WeakPolarHBondContact O-CB 3.5Å; M323-C327 PolarHBondContact O-N 2.98Å
324	A	58.3	Low	63.1	Low	59 Å²	59	86.4 Å²	86.4	49%	0.488	49%	0.494	S	S	.	.	H	α-helix	trans	-62.6	-39.5	175.3	0	0	0	0	0	112.9	N320 P321 I322 C327 R328	N320-A324 PolarHBondContact O-N 2.91Å; P321-A324 PolarHBondContact O-N 3.38Å; I322-A324 VanDerWaalsContact C-N 3.31Å; I322-A324 PolarHBondContact O-N 2.94Å; A324-C327 PolarHBondContact O-N 2.8Å; A324-R328 PolarHBondContact O-N 3.1Å
325	N	61.1	Low	65.2	Low	114 Å²	114	80 Å²	80	61%	0.61	47%	0.471	S	S	*	.	H	α-helix	trans	-72.2	-31.3	176.4	-83.7	-24.2	0	0	0	113.5	P321 I322 M323	P321-N325 PolarHBondContact O-N 3.33Å; P321-N325 VanDerWaalsContact O-N 3.11Å; I322-N325 PolarHBondContact O-N 2.89Å; M323-N325 PolarHBondContact O-N 3.36Å
326	L	58.9	Low	67.2	Low	53 Å²	53	72.5 Å²	72.5	28%	0.277	43%	0.433	S	S	.	.	H	α-helix	trans	-70.7	-35.8	169.3	-83.5	82	0	0	0	111.4	W218 I322 M323 R328	W218-L326 HydrophobicContact CH2-CB 3.87Å; W218-L326 HydrophobicContact CZ2-CB 4.27Å; W218-L326 WeakPolarHBondContact CZ2-O 3.24Å; I322-L326 HydrophobicContact CG2-CD1 4.07Å; I322-L326 WeakPolarHBondContact O-CD1 3.48Å; I322-L326 PolarHBondContact O-N 2.98Å; I322-L326 VanDerWaalsContact O-N 3.13Å; M323-L326 PolarHBondContact O-N 3.31Å; L326-R328 PolarHBondContact O-N 3.42Å
327	C	60.1	Low	69.2	Low	27 Å²	27	70.1 Å²	70.1	18%	0.182	42%	0.419	C	S	.	.	S	Bend	trans	-69.3	-13.1	177.9	-103	0	0	0	0	115.5	C313 M323 A324 V329	C313-C327 WeakPolarHBondContact CA-SG 3.39Å; C313-C327 HydrophobicContact CB-CB 3.94Å; C313-C327 WeakPolarHBondContact CB-SG 3.35Å; C313-C327 PolarHBondContact N-SG 3.37Å; C313-C327 WeakPolarHBondContact SG-CA 3.4Å; C313-C327 WeakPolarHBondContact SG-CB 3.34Å; C313-C327 CovalentContact SG-SG 2.03Å; C313-C327 PolarHBondContact SG-SG 2.93Å; M323-C327 VanDerWaalsContact O-CB 3.28Å; M323-C327 WeakPolarHBondContact O-CB 3.5Å; M323-C327 PolarHBondContact O-N 2.98Å; A324-C327 PolarHBondContact O-N 2.8Å; C327-V329 PolarHBondContact O-N 2.8Å
328	R	68.1	Low	71.5	Confident	141 Å²	141	64.7 Å²	64.7	53%	0.532	40%	0.398	S	S	.	.			trans	-81.1	103.3	-177.6	-164	-179	67.9	67.1	7.1	110.1	A324 L326 D330	A324-R328 PolarHBondContact O-N 3.1Å; L326-R328 PolarHBondContact O-N 3.42Å; R328-D330 IonicContact CZ-OD1 3.31Å; R328-D330 VanDerWaalsContact CZ-OD1 3.31Å; R328-D330 IonicContact NH1-OD1 3.18Å; R328-D330 PolarHBondContact NH1-OD1 3.27Å; R328-D330 IonicContact NH2-OD1 2.7Å; R328-D330 PolarHBondContact NH2-OD1 3.27Å; R328-D330 PolarHBondContact O-N 3.21Å
329	V	72.4	Confident	73.6	Confident	60 Å²	60	63.3 Å²	63.3	36%	0.364	37%	0.371	S	S	.	.			trans	-57.9	126.2	171.2	-172.4	0	0	0	0	109.1	C327 Q333 M334	C327-V329 PolarHBondContact O-N 2.8Å; V329-Q333 HydrophobicContact CG1-CB 3.79Å; V329-M334 HydrophobicContact CG1-CG 3.78Å; V329-M334 HydrophobicContact CG1-SD 3.83Å
330	D	79.8	Confident	75.5	Confident	32 Å²	32	57.9 Å²	57.9	17%	0.171	34%	0.338	C	S	.	.			trans	-79	150.7	180	-87.8	-44.3	0	0	0	111.7	Y211 K214 R328 G332 Q333 M334	Y211-D330 HydrophobicContact CE1-CB 3.62Å; K214-D330 WeakPolarHBondContact CE-OD2 3.5Å; R328-D330 IonicContact CZ-OD1 3.31Å; R328-D330 VanDerWaalsContact CZ-OD1 3.31Å; R328-D330 IonicContact NH1-OD1 3.18Å; R328-D330 PolarHBondContact NH1-OD1 3.27Å; R328-D330 IonicContact NH2-OD1 2.7Å; R328-D330 PolarHBondContact NH2-OD1 3.27Å; R328-D330 PolarHBondContact O-N 3.21Å; D330-G332 PolarHBondContact O-N 2.82Å; D330-Q333 WeakPolarHBondContact O-CB 3.43Å; D330-Q333 PolarHBondContact O-N 3.39Å; D330-M334 PolarHBondContact O-N 3.03Å; D330-M334 VanDerWaalsContact O-N 3.15Å
331	G	80.2	Confident	77.1	Confident	56 Å²	56	56 Å²	56	58%	0.577	33%	0.325	S	S	*	.	H	α-helix	trans	-55.7	-29.4	-178.7	0	0	0	0	0	113.5	A335	G331-A335 VanDerWaalsContact O-CB 3.3Å; G331-A335 WeakPolarHBondContact O-CB 3.36Å; G331-A335 PolarHBondContact O-N 2.93Å
332	G	81.3	Confident	78.7	Confident	17 Å²	17	54.5 Å²	54.5	18%	0.175	31%	0.311	C	S	.	.	H	α-helix	trans	-74.2	-30.6	175.4	0	0	0	0	0	115.1	D330 G336	D330-G332 PolarHBondContact O-N 2.82Å; G332-G336 PolarHBondContact O-N 2.86Å
333	Q	84.9	Confident	80.3	Confident	8 Å²	8	48.6 Å²	48.6	4%	0.037	28%	0.28	C	S	.	.	H	α-helix	trans	-70.4	-40.5	170.7	-72.7	169.4	-44.6	0	0	110.6	Y211 D215 L307 V329 D330 G336 T337	Y211-Q333 HydrophobicContact CD1-CG 3.73Å; Y211-Q333 HydrophobicContact CD2-CG 4.22Å; Y211-Q333 HydrophobicContact CE1-CG 4.29Å; Y211-Q333 HydrophobicContact CG-CG 3.69Å; D215-Q333 PolarHBondContact OD1-NE2 3.19Å; L307-Q333 HydrophobicContact CD1-CB 4.4Å; L307-Q333 HydrophobicContact CD2-CB 3.85Å; L307-Q333 HydrophobicContact CD2-CG 3.95Å; V329-Q333 HydrophobicContact CG1-CB 3.79Å; D330-Q333 WeakPolarHBondContact O-CB 3.43Å; D330-Q333 PolarHBondContact O-N 3.39Å; Q333-G336 PolarHBondContact O-N 3.01Å; Q333-T337 WeakPolarHBondContact O-CB 3.49Å; Q333-T337 PolarHBondContact O-N 3.12Å; Q333-T337 PolarHBondContact O-OG1 3.48Å
334	M	85.8	Confident	82.1	Confident	109 Å²	109	46.6 Å²	46.6	54%	0.537	27%	0.27	S	S	.	.	H	α-helix	trans	-64.2	-41.2	172.4	-69.4	-56.8	-63.8	0	0	112.2	V329 D330 T337 A338	V329-M334 HydrophobicContact CG1-CG 3.78Å; V329-M334 HydrophobicContact CG1-SD 3.83Å; D330-M334 PolarHBondContact O-N 3.03Å; D330-M334 VanDerWaalsContact O-N 3.15Å; M334-T337 WeakPolarHBondContact O-CB 3.29Å; M334-T337 PolarHBondContact O-N 2.85Å; M334-A338 PolarHBondContact O-N 3.14Å
335	A	89.6	Confident	83.9	Confident	33 Å²	33	48.9 Å²	48.9	27%	0.273	27%	0.274	S	S	.	.	H	α-helix	trans	-64.6	-44.2	174.9	0	0	0	0	0	112	G331 T337 A338 F339	G331-A335 VanDerWaalsContact O-CB 3.3Å; G331-A335 WeakPolarHBondContact O-CB 3.36Å; G331-A335 PolarHBondContact O-N 2.93Å; A335-T337 VanDerWaalsContact C-N 3.32Å; A335-T337 PolarHBondContact O-N 2.93Å; A335-A338 PolarHBondContact O-N 3.13Å; A335-F339 HydrophobicContact CB-CE2 4.12Å; A335-F339 WeakPolarHBondContact O-CD2 3.47Å; A335-F339 WeakPolarHBondContact O-CG 3.49Å; A335-F339 PolarHBondContact O-N 2.87Å
336	G	90.6	Very high	85.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-56.7	-45.5	173.2	0	0	0	0	0	112	G332 Q333 F339 I340	G332-G336 PolarHBondContact O-N 2.86Å; Q333-G336 PolarHBondContact O-N 3.01Å; G336-F339 PolarHBondContact O-N 2.92Å; G336-I340 VanDerWaalsContact O-CG1 3.3Å; G336-I340 WeakPolarHBondContact O-CG1 3.47Å; G336-I340 PolarHBondContact O-N 2.84Å
337	T	90.4	Very high	87.3	Confident	14 Å²	14	41.9 Å²	41.9	9%	0.086	24%	0.236	C	C	.	.	H	α-helix	trans	-57.6	-52	173.6	-55.1	0	0	0	0	110.9	Y303 I304 L307 Q333 M334 A335 F339 I340 F341	Y303-T337 WeakPolarHBondContact CD1-OG1 3.39Å; Y303-T337 WeakPolarHBondContact CE1-OG1 3.06Å; I304-T337 HydrophobicContact CD1-CG2 4.06Å; I304-T337 HydrophobicContact CG1-CG2 3.75Å; L307-T337 WeakPolarHBondContact CD1-OG1 3.41Å; Q333-T337 WeakPolarHBondContact O-CB 3.49Å; Q333-T337 PolarHBondContact O-N 3.12Å; Q333-T337 PolarHBondContact O-OG1 3.48Å; M334-T337 WeakPolarHBondContact O-CB 3.29Å; M334-T337 PolarHBondContact O-N 2.85Å; A335-T337 VanDerWaalsContact C-N 3.32Å; A335-T337 PolarHBondContact O-N 2.93Å; T337-F339 VanDerWaalsContact C-N 3.34Å; T337-F339 PolarHBondContact O-N 3.23Å; T337-I340 WeakPolarHBondContact O-CB 3.43Å; T337-I340 PolarHBondContact O-N 3.23Å; T337-I340 VanDerWaalsContact O-N 3.16Å; T337-F341 HydrophobicContact CG2-CD2 3.9Å; T337-F341 HydrophobicContact CG2-CE2 3.82Å; T337-F341 VanDerWaalsContact O-CD2 3.29Å; T337-F341 WeakPolarHBondContact O-CD2 3.44Å; T337-F341 PolarHBondContact O-N 2.86Å; T337-F341 VanDerWaalsContact O-N 3.1Å
338	A	93.1	Very high	89	Confident	48 Å²	48	43.6 Å²	43.6	40%	0.397	24%	0.243	S	C	.	.	H	α-helix	trans	-57.6	-43.4	178.9	0	0	0	0	0	112.4	M334 A335 I340 F341 I342	M334-A338 PolarHBondContact O-N 3.14Å; A335-A338 PolarHBondContact O-N 3.13Å; A338-I340 PolarHBondContact O-N 3.49Å; A338-F341 PolarHBondContact O-N 3.35Å; A338-I342 WeakPolarHBondContact O-CB 3.3Å; A338-I342 WeakPolarHBondContact O-CD1 3.44Å; A338-I342 VanDerWaalsContact O-CG1 3.23Å; A338-I342 WeakPolarHBondContact O-CG1 3.3Å; A338-I342 PolarHBondContact O-N 2.87Å
339	F	94.9	Very high	90.2	Very high	47 Å²	47	38.2 Å²	38.2	21%	0.206	23%	0.231	C	C	.	.	H	α-helix	trans	-66.3	-34.9	177.8	-63.4	-44.6	0	0	0	113.2	F200 M203 A204 A335 G336 T337 I342 N343	F200-F339 AromaticContact CD1-CD1 3.6Å; F200-F339 HydrophobicContact CD1-CD1 3.6Å; F200-F339 AromaticContact CD1-CE1 3.94Å; F200-F339 HydrophobicContact CD1-CE1 3.94Å; F200-F339 HydrophobicContact CE1-CD1 4.02Å; F200-F339 AromaticContact CE1-CE1 3.98Å; F200-F339 HydrophobicContact CE1-CE1 3.98Å; M203-F339 HydrophobicContact CB-CD2 4.06Å; M203-F339 HydrophobicContact CB-CE2 4.16Å; M203-F339 HydrophobicContact CB-CG 4.4Å; A204-F339 HydrophobicContact CB-CB 3.81Å; A335-F339 HydrophobicContact CB-CE2 4.12Å; A335-F339 WeakPolarHBondContact O-CD2 3.47Å; A335-F339 WeakPolarHBondContact O-CG 3.49Å; A335-F339 PolarHBondContact O-N 2.87Å; G336-F339 PolarHBondContact O-N 2.92Å; T337-F339 VanDerWaalsContact C-N 3.34Å; T337-F339 PolarHBondContact O-N 3.23Å; F339-I342 HydrophobicContact CD1-CD1 4.33Å; F339-N343 WeakPolarHBondContact O-CB 3.4Å; F339-N343 PolarHBondContact O-N 3.21Å
340	I	94.2	Very high	91.2	Very high	5 Å²	5	35.4 Å²	35.4	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-62.1	-46.3	172.8	-69.5	166.2	0	0	0	110.5	A204 V208 V248 Y296 Y303 G336 T337 A338 N343 M344	A204-I340 HydrophobicContact CB-CG1 4.08Å; V208-I340 HydrophobicContact CG2-CD1 4.25Å; V248-I340 HydrophobicContact CG1-CD1 3.91Å; Y296-I340 HydrophobicContact CD1-CG2 4.06Å; Y303-I340 HydrophobicContact CD1-CD1 3.76Å; Y303-I340 HydrophobicContact CE1-CD1 4.29Å; Y303-I340 HydrophobicContact CG-CD1 4.06Å; G336-I340 VanDerWaalsContact O-CG1 3.3Å; G336-I340 WeakPolarHBondContact O-CG1 3.47Å; G336-I340 PolarHBondContact O-N 2.84Å; T337-I340 WeakPolarHBondContact O-CB 3.43Å; T337-I340 PolarHBondContact O-N 3.23Å; T337-I340 VanDerWaalsContact O-N 3.16Å; A338-I340 PolarHBondContact O-N 3.49Å; I340-N343 PolarHBondContact O-N 3.49Å; I340-M344 WeakPolarHBondContact O-CB 3.43Å; I340-M344 PolarHBondContact O-N 2.94Å
341	F	94.7	Very high	91.9	Very high	63 Å²	63	35.8 Å²	35.8	28%	0.276	22%	0.215	S	C	.	.	H	α-helix	trans	-70.8	-36.7	178.3	-78.6	-78.3	0	0	0	113.7	I304 T337 A338 N343 M344 I345	I304-F341 HydrophobicContact CD1-CE2 3.41Å; I304-F341 VanDerWaalsContact CD1-CE2 3.41Å; I304-F341 HydrophobicContact CD1-CZ 3.61Å; I304-F341 HydrophobicContact CG1-CE2 4.04Å; I304-F341 HydrophobicContact CG1-CZ 4.45Å; T337-F341 HydrophobicContact CG2-CD2 3.9Å; T337-F341 HydrophobicContact CG2-CE2 3.82Å; T337-F341 VanDerWaalsContact O-CD2 3.29Å; T337-F341 WeakPolarHBondContact O-CD2 3.44Å; T337-F341 PolarHBondContact O-N 2.86Å; T337-F341 VanDerWaalsContact O-N 3.1Å; A338-F341 PolarHBondContact O-N 3.35Å; F341-N343 VanDerWaalsContact C-N 3.33Å; F341-N343 PolarHBondContact O-N 3.03Å; F341-M344 HydrophobicContact CD1-CE 3.91Å; F341-M344 HydrophobicContact CD1-SD 4.06Å; F341-M344 HydrophobicContact CE1-SD 4.25Å; F341-M344 WeakPolarHBondContact O-CB 3.21Å; F341-M344 PolarHBondContact O-N 3.32Å; F341-I345 WeakPolarHBondContact O-CG1 3.25Å; F341-I345 PolarHBondContact O-N 2.9Å
342	I	95.4	Very high	92.5	Very high	64 Å²	64	37.9 Å²	37.9	33%	0.328	21%	0.212	S	C	.	.	H	α-helix	trans	-59.9	-45.9	172.6	-72.7	163.9	0	0	0	109.8	F200 A338 F339 I345 M346	F200-I342 HydrophobicContact CD1-CG2 4.37Å; F200-I342 HydrophobicContact CD2-CG2 3.88Å; F200-I342 HydrophobicContact CE1-CG2 4.49Å; F200-I342 HydrophobicContact CE2-CG2 4Å; F200-I342 HydrophobicContact CG-CG2 4.07Å; F200-I342 HydrophobicContact CZ-CG2 4.31Å; A338-I342 WeakPolarHBondContact O-CB 3.3Å; A338-I342 WeakPolarHBondContact O-CD1 3.44Å; A338-I342 VanDerWaalsContact O-CG1 3.23Å; A338-I342 WeakPolarHBondContact O-CG1 3.3Å; A338-I342 PolarHBondContact O-N 2.87Å; F339-I342 HydrophobicContact CD1-CD1 4.33Å; I342-I345 PolarHBondContact O-N 3.42Å; I342-M346 HydrophobicContact CG2-SD 3.66Å; I342-M346 VanDerWaalsContact O-CG 3.31Å; I342-M346 WeakPolarHBondContact O-CG 3.34Å; I342-M346 PolarHBondContact O-N 2.9Å
343	N	94.7	Very high	93	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.1	-46.5	175	-112.8	-46.8	0	0	0	112.5	Q197 F200 G201 Y296 F339 I340 F341 I345 M346 Y347	Q197-N343 WeakPolarHBondContact CA-OD1 3.48Å; Q197-N343 PolarHBondContact O-ND2 2.88Å; Q197-N343 PolarHBondContact O-OD1 2.93Å; F200-N343 PolarHBondContact O-ND2 3.31Å; G201-N343 WeakPolarHBondContact CA-ND2 3.31Å; G201-N343 PolarHBondContact N-ND2 2.96Å; Y296-N343 HydrophobicContact CD1-CB 3.94Å; Y296-N343 HydrophobicContact CE1-CB 3.73Å; F339-N343 WeakPolarHBondContact O-CB 3.4Å; F339-N343 PolarHBondContact O-N 3.21Å; I340-N343 PolarHBondContact O-N 3.49Å; F341-N343 VanDerWaalsContact C-N 3.33Å; F341-N343 PolarHBondContact O-N 3.03Å; N343-I345 VanDerWaalsContact C-N 3.31Å; N343-I345 PolarHBondContact O-N 3.35Å; N343-M346 CarbonylContact O-C 3.55Å; N343-M346 WeakPolarHBondContact O-CA 3.3Å; N343-M346 WeakPolarHBondContact O-CB 3.29Å; N343-M346 PolarHBondContact O-N 2.96Å; N343-Y347 HydrophobicContact CB-CD2 4.4Å; N343-Y347 HydrophobicContact CB-CE2 4.04Å; N343-Y347 WeakPolarHBondContact O-CD2 3.45Å; N343-Y347 PolarHBondContact O-N 2.93Å; N343-Y347 WeakPolarHBondContact OD1-CE2 3.37Å
344	M	95.4	Very high	93.2	Very high	28 Å²	28	37.1 Å²	37.1	14%	0.138	21%	0.205	C	C	.	.	H	α-helix	trans	-51.5	-50.3	175.5	-175	-156.5	69.7	0	0	111.1	F293 M297 I340 F341 M346 Y347 L348	F293-M344 HydrophobicContact CD2-CG 3.63Å; F293-M344 WeakPolarHBondContact CD2-O 3.36Å; F293-M344 HydrophobicContact CE2-CE 4.39Å; F293-M344 HydrophobicContact CE2-CG 3.59Å; F293-M344 HydrophobicContact CE2-SD 4.05Å; M297-M344 HydrophobicContact CB-CG 4.24Å; M297-M344 HydrophobicContact CB-SD 3.93Å; M297-M344 HydrophobicContact CG-SD 4.09Å; I340-M344 WeakPolarHBondContact O-CB 3.43Å; I340-M344 PolarHBondContact O-N 2.94Å; F341-M344 HydrophobicContact CD1-CE 3.91Å; F341-M344 HydrophobicContact CD1-SD 4.06Å; F341-M344 HydrophobicContact CE1-SD 4.25Å; F341-M344 WeakPolarHBondContact O-CB 3.21Å; F341-M344 PolarHBondContact O-N 3.32Å; M344-M346 VanDerWaalsContact C-N 3.3Å; M344-M346 PolarHBondContact O-N 3.47Å; M344-Y347 PolarHBondContact O-N 3.01Å; M344-L348 PolarHBondContact O-N 3.28Å; M344-L348 VanDerWaalsContact O-N 3.12Å
345	I	95.9	Very high	93.3	Very high	108 Å²	108	34.5 Å²	34.5	55%	0.554	19%	0.193	S	C	*	.	H	α-helix	trans	-62.7	-37.9	177.5	-66.2	168.2	0	0	0	111.3	F341 I342 N343 L348 G349	F341-I345 WeakPolarHBondContact O-CG1 3.25Å; F341-I345 PolarHBondContact O-N 2.9Å; I342-I345 PolarHBondContact O-N 3.42Å; N343-I345 VanDerWaalsContact C-N 3.31Å; N343-I345 PolarHBondContact O-N 3.35Å; I345-L348 WeakPolarHBondContact O-CB 3.46Å; I345-L348 PolarHBondContact O-N 3.17Å; I345-G349 PolarHBondContact O-N 3.3Å
346	M	95.4	Very high	93.3	Very high	19 Å²	19	38.6 Å²	38.6	9%	0.094	21%	0.205	C	C	.	.	H	α-helix	trans	-68.3	-35.8	177.2	-74.7	165.3	30.7	0	0	113.4	L193 L196 Q197 F200 I342 N343 M344 G349 S350	L193-M346 HydrophobicContact CD1-CB 4.3Å; L193-M346 HydrophobicContact CD1-CG 4.14Å; L196-M346 HydrophobicContact CB-CE 3.91Å; L196-M346 HydrophobicContact CD2-CE 4.1Å; L196-M346 HydrophobicContact CD2-SD 3.87Å; L196-M346 HydrophobicContact CG-CE 3.75Å; L196-M346 HydrophobicContact CG-SD 4.02Å; Q197-M346 HydrophobicContact CB-CE 4.03Å; Q197-M346 HydrophobicContact CG-CB 4.02Å; Q197-M346 HydrophobicContact CG-CE 3.48Å; Q197-M346 VanDerWaalsContact CG-CE 3.48Å; Q197-M346 PolarHBondContact NE2-O 3.49Å; F200-M346 HydrophobicContact CD2-CE 3.86Å; F200-M346 HydrophobicContact CD2-SD 3.66Å; F200-M346 HydrophobicContact CE2-SD 4.05Å; I342-M346 HydrophobicContact CG2-SD 3.66Å; I342-M346 VanDerWaalsContact O-CG 3.31Å; I342-M346 WeakPolarHBondContact O-CG 3.34Å; I342-M346 PolarHBondContact O-N 2.9Å; N343-M346 CarbonylContact O-C 3.55Å; N343-M346 WeakPolarHBondContact O-CA 3.3Å; N343-M346 WeakPolarHBondContact O-CB 3.29Å; N343-M346 PolarHBondContact O-N 2.96Å; M344-M346 VanDerWaalsContact C-N 3.3Å; M344-M346 PolarHBondContact O-N 3.47Å; M346-G349 PolarHBondContact O-N 3.28Å; M346-S350 PolarHBondContact O-N 2.99Å
347	Y	95.9	Very high	93.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.6	-40.1	172.2	-73.5	-65.9	0	0	0	111.9	Q197 T259 L292 Y296 N343 M344 G349 S350 F351	Q197-Y347 HydrophobicContact CB-CE1 4.41Å; Q197-Y347 HydrophobicContact CG-CD1 4.46Å; Q197-Y347 HydrophobicContact CG-CE1 4.1Å; T259-Y347 HydrophobicContact CG2-CE1 3.45Å; T259-Y347 VanDerWaalsContact CG2-CE1 3.45Å; T259-Y347 WeakPolarHBondContact CG2-OH 3.32Å; L292-Y347 HydrophobicContact CB-CD1 3.69Å; L292-Y347 HydrophobicContact CB-CE1 3.86Å; L292-Y347 HydrophobicContact CB-CG 4.07Å; L292-Y347 HydrophobicContact CD1-CD1 3.98Å; L292-Y347 HydrophobicContact CD1-CE1 3.51Å; L292-Y347 HydrophobicContact CG-CE1 4.33Å; Y296-Y347 AromaticContact CD2-CD2 3.64Å; Y296-Y347 HydrophobicContact CD2-CD2 3.64Å; Y296-Y347 AromaticContact CD2-CE2 3.3Å; Y296-Y347 HydrophobicContact CD2-CE2 3.3Å; Y296-Y347 HydrophobicContact CE2-CD2 4.03Å; Y296-Y347 AromaticContact CE2-CE2 3.19Å; Y296-Y347 HydrophobicContact CE2-CE2 3.19Å; Y296-Y347 AromaticContact CE2-CZ 3.77Å; Y296-Y347 HydrophobicContact CG-CD2 4.15Å; Y296-Y347 HydrophobicContact CG-CE2 4.07Å; Y296-Y347 AromaticContact CZ-CE2 3.94Å; N343-Y347 HydrophobicContact CB-CD2 4.4Å; N343-Y347 HydrophobicContact CB-CE2 4.04Å; N343-Y347 WeakPolarHBondContact O-CD2 3.45Å; N343-Y347 PolarHBondContact O-N 2.93Å; N343-Y347 WeakPolarHBondContact OD1-CE2 3.37Å; M344-Y347 PolarHBondContact O-N 3.01Å; Y347-G349 VanDerWaalsContact C-N 3.3Å; Y347-G349 PolarHBondContact O-N 3.17Å; Y347-S350 PolarHBondContact O-N 2.63Å; Y347-F351 PolarHBondContact O-N 3.24Å
348	L	95.5	Very high	92.8	Very high	63 Å²	63	42.5 Å²	42.5	33%	0.33	22%	0.219	S	C	.	.	H	α-helix	trans	-62.3	-39.8	171.5	-174.1	63.2	0	0	0	111.4	F293 M344 I345 F351 L352	F293-L348 HydrophobicContact CD2-CB 3.81Å; F293-L348 HydrophobicContact CE2-CB 4.03Å; F293-L348 HydrophobicContact CE2-CD1 4.42Å; F293-L348 HydrophobicContact CE2-CD2 4.19Å; F293-L348 HydrophobicContact CE2-CG 4.45Å; F293-L348 HydrophobicContact CG-CB 4.45Å; F293-L348 HydrophobicContact CZ-CD1 4.47Å; M344-L348 PolarHBondContact O-N 3.28Å; M344-L348 VanDerWaalsContact O-N 3.12Å; I345-L348 WeakPolarHBondContact O-CB 3.46Å; I345-L348 PolarHBondContact O-N 3.17Å; L348-F351 HydrophobicContact CD1-CD1 4.25Å; L348-F351 PolarHBondContact O-N 2.97Å; L348-L352 HydrophobicContact CG-CD1 4.5Å; L348-L352 WeakPolarHBondContact O-CG 3.4Å; L348-L352 PolarHBondContact O-N 3.32Å
349	G	94.1	Very high	92.5	Very high	28 Å²	28	48.8 Å²	48.8	29%	0.289	23%	0.232	S	C	.	.	H	α-helix	trans	-59.6	-45.9	172.4	0	0	0	0	0	113.1	I345 M346 Y347 L352 A353	I345-G349 PolarHBondContact O-N 3.3Å; M346-G349 PolarHBondContact O-N 3.28Å; Y347-G349 VanDerWaalsContact C-N 3.3Å; Y347-G349 PolarHBondContact O-N 3.17Å; G349-L352 PolarHBondContact O-N 2.91Å; G349-A353 WeakPolarHBondContact O-CB 3.37Å; G349-A353 PolarHBondContact O-N 3.4Å
350	S	93.4	Very high	91.9	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.014	24%	0.242	C	C	.	.	H	α-helix	trans	-60.3	-47.9	173.6	-80.4	0	0	0	0	111.5	L193 Q197 N289 M346 Y347 L352 A353 C354	L193-S350 WeakPolarHBondContact CD2-OG 3.34Å; Q197-S350 PolarHBondContact NE2-OG 3.06Å; N289-S350 VanDerWaalsContact CG-CB 3.45Å; N289-S350 WeakPolarHBondContact OD1-CB 3.43Å; M346-S350 PolarHBondContact O-N 2.99Å; Y347-S350 PolarHBondContact O-N 2.63Å; S350-L352 VanDerWaalsContact C-N 3.33Å; S350-L352 PolarHBondContact O-N 2.95Å; S350-A353 CarbonylContact O-C 3.55Å; S350-A353 WeakPolarHBondContact O-CB 3.45Å; S350-A353 PolarHBondContact O-N 3.13Å; S350-A353 VanDerWaalsContact O-N 3.08Å; S350-C354 PolarHBondContact O-N 3.25Å; S350-C354 PolarHBondContact O-SG 3.48Å
351	F	94.7	Very high	91.2	Very high	39 Å²	39	52 Å²	52	17%	0.171	25%	0.247	C	C	.	.	H	α-helix	trans	-55	-46.7	177.1	170	-111.7	0	0	0	112.3	A286 N289 L290 Y347 L348 A353 C354 L355	A286-F351 HydrophobicContact CB-CD2 3.95Å; A286-F351 HydrophobicContact CB-CE2 4.18Å; A286-F351 WeakPolarHBondContact O-CD2 3.49Å; N289-F351 HydrophobicContact CB-CB 4.17Å; L290-F351 HydrophobicContact CB-CD2 3.91Å; L290-F351 HydrophobicContact CB-CE2 4.06Å; L290-F351 HydrophobicContact CB-CG 4.44Å; L290-F351 HydrophobicContact CD1-CE1 4.49Å; L290-F351 HydrophobicContact CD1-CZ 4.44Å; L290-F351 HydrophobicContact CD2-CE2 4.16Å; L290-F351 HydrophobicContact CD2-CZ 4.29Å; Y347-F351 PolarHBondContact O-N 3.24Å; L348-F351 HydrophobicContact CD1-CD1 4.25Å; L348-F351 PolarHBondContact O-N 2.97Å; F351-A353 VanDerWaalsContact C-N 3.35Å; F351-A353 PolarHBondContact O-N 3.19Å; F351-C354 PolarHBondContact O-N 2.79Å; F351-L355 HydrophobicContact CD1-CD1 4.23Å; F351-L355 HydrophobicContact CD2-CG 4.42Å; F351-L355 HydrophobicContact CE1-CD1 3.61Å; F351-L355 HydrophobicContact CE1-CG 4.43Å; F351-L355 HydrophobicContact CE2-CD1 4Å; F351-L355 HydrophobicContact CE2-CD2 4.34Å; F351-L355 HydrophobicContact CE2-CG 4.04Å; F351-L355 HydrophobicContact CZ-CD1 3.5Å; F351-L355 VanDerWaalsContact CZ-CD1 3.5Å; F351-L355 HydrophobicContact CZ-CD2 4.48Å; F351-L355 HydrophobicContact CZ-CG 4.07Å; F351-L355 WeakPolarHBondContact O-CG 3.25Å; F351-L355 PolarHBondContact O-N 2.81Å
352	L	92.7	Very high	90.4	Very high	101 Å²	101	51.4 Å²	51.4	53%	0.529	25%	0.249	S	C	.	.	H	α-helix	trans	-65.1	-36.3	176.8	-68	173.3	0	0	0	112.4	L348 G349 S350 K356	L348-L352 HydrophobicContact CG-CD1 4.5Å; L348-L352 WeakPolarHBondContact O-CG 3.4Å; L348-L352 PolarHBondContact O-N 3.32Å; G349-L352 PolarHBondContact O-N 2.91Å; S350-L352 VanDerWaalsContact C-N 3.33Å; S350-L352 PolarHBondContact O-N 2.95Å; L352-K356 VanDerWaalsContact O-CB 3.32Å; L352-K356 WeakPolarHBondContact O-CB 3.22Å; L352-K356 PolarHBondContact O-N 3.36Å
353	A	90.9	Very high	89.6	Confident	7 Å²	7	51.9 Å²	51.9	6%	0.058	26%	0.255	C	S	.	.	H	α-helix	trans	-66.9	-42.1	174.2	0	0	0	0	0	112.1	W186 L190 G349 S350 F351 K356 M357	W186-A353 HydrophobicContact CE3-CB 4.28Å; L190-A353 HydrophobicContact CD2-CB 3.73Å; L190-A353 HydrophobicContact CG-CB 4.24Å; G349-A353 WeakPolarHBondContact O-CB 3.37Å; G349-A353 PolarHBondContact O-N 3.4Å; S350-A353 CarbonylContact O-C 3.55Å; S350-A353 WeakPolarHBondContact O-CB 3.45Å; S350-A353 PolarHBondContact O-N 3.13Å; S350-A353 VanDerWaalsContact O-N 3.08Å; F351-A353 VanDerWaalsContact C-N 3.35Å; F351-A353 PolarHBondContact O-N 3.19Å; A353-K356 PolarHBondContact O-N 2.73Å; A353-M357 WeakPolarHBondContact O-CB 3.25Å; A353-M357 PolarHBondContact O-N 3.34Å
354	C	89.8	Confident	88.7	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.007	28%	0.28	C	S	.	.	H	α-helix	trans	-61.5	-45.7	172.8	-60.7	0	0	0	0	111.5	L190 A286 S350 F351 K356 M357 W358	L190-C354 VanDerWaalsContact CD2-SG 3.6Å; A286-C354 HydrophobicContact CB-CB 3.64Å; S350-C354 PolarHBondContact O-N 3.25Å; S350-C354 PolarHBondContact O-SG 3.48Å; F351-C354 PolarHBondContact O-N 2.79Å; C354-K356 VanDerWaalsContact C-N 3.32Å; C354-K356 PolarHBondContact O-N 2.7Å; C354-M357 WeakPolarHBondContact O-CB 3.38Å; C354-M357 PolarHBondContact O-N 2.75Å; C354-W358 WeakPolarHBondContact O-CB 3.44Å; C354-W358 PolarHBondContact O-N 3.03Å
355	L	88.8	Confident	87.7	Confident	55 Å²	55	60.3 Å²	60.3	29%	0.288	29%	0.287	S	S	.	.	H	α-helix	trans	-61.1	-39.2	175.3	-75.5	-176.9	0	0	0	112.6	F351 W358 R359	F351-L355 HydrophobicContact CD1-CD1 4.23Å; F351-L355 HydrophobicContact CD2-CG 4.42Å; F351-L355 HydrophobicContact CE1-CD1 3.61Å; F351-L355 HydrophobicContact CE1-CG 4.43Å; F351-L355 HydrophobicContact CE2-CD1 4Å; F351-L355 HydrophobicContact CE2-CD2 4.34Å; F351-L355 HydrophobicContact CE2-CG 4.04Å; F351-L355 HydrophobicContact CZ-CD1 3.5Å; F351-L355 VanDerWaalsContact CZ-CD1 3.5Å; F351-L355 HydrophobicContact CZ-CD2 4.48Å; F351-L355 HydrophobicContact CZ-CG 4.07Å; F351-L355 WeakPolarHBondContact O-CG 3.25Å; F351-L355 PolarHBondContact O-N 2.81Å; L355-W358 PolarHBondContact O-N 3.28Å; L355-R359 WeakPolarHBondContact O-CB 3.4Å; L355-R359 WeakPolarHBondContact O-CG 3.38Å; L355-R359 PolarHBondContact O-N 3.02Å
356	K	88.8	Confident	86.8	Confident	119 Å²	119	59.9 Å²	59.9	52%	0.517	29%	0.289	S	S	.	.	H	α-helix	trans	-72.2	-37	179	-170	160.6	176.4	-178	0	112.1	W186 L352 A353 C354 H360	W186-K356 HydrophobicContact CE3-CB 4.48Å; W186-K356 HydrophobicContact CH2-CD 3.45Å; W186-K356 VanDerWaalsContact CH2-CD 3.45Å; W186-K356 VanDerWaalsContact CH2-CE 3.48Å; W186-K356 HydrophobicContact CH2-CG 4.11Å; W186-K356 HydrophobicContact CZ2-CD 3.68Å; W186-K356 HydrophobicContact CZ2-CG 4.02Å; W186-K356 HydrophobicContact CZ3-CB 4.46Å; W186-K356 HydrophobicContact CZ3-CD 3.9Å; W186-K356 HydrophobicContact CZ3-CG 4.32Å; L352-K356 VanDerWaalsContact O-CB 3.32Å; L352-K356 WeakPolarHBondContact O-CB 3.22Å; L352-K356 PolarHBondContact O-N 3.36Å; A353-K356 PolarHBondContact O-N 2.73Å; C354-K356 VanDerWaalsContact C-N 3.32Å; C354-K356 PolarHBondContact O-N 2.7Å; K356-H360 WeakPolarHBondContact O-CB 3.49Å; K356-H360 PolarHBondContact O-N 2.92Å
357	M	85.6	Confident	85.8	Confident	6 Å²	6	67 Å²	67	3%	0.03	32%	0.315	C	S	.	.	H	α-helix	trans	-59.2	-51.5	169.2	178.3	179.2	159.7	0	0	110.9	W186 P187 L190 L276 P282 A353 C354 R359 H360 E361	W186-M357 HydrophobicContact CB-CB 3.96Å; W186-M357 HydrophobicContact CB-CG 4.27Å; W186-M357 HydrophobicContact CG-CB 4.47Å; P187-M357 HydrophobicContact CG-CE 4.06Å; P187-M357 HydrophobicContact CG-SD 3.96Å; L190-M357 HydrophobicContact CD1-SD 4.13Å; L276-M357 HydrophobicContact CD2-CE 3.33Å; L276-M357 HydrophobicContact CG-CE 4.45Å; P282-M357 HydrophobicContact CB-CE 4.22Å; P282-M357 HydrophobicContact CG-CE 3.83Å; A353-M357 WeakPolarHBondContact O-CB 3.25Å; A353-M357 PolarHBondContact O-N 3.34Å; C354-M357 WeakPolarHBondContact O-CB 3.38Å; C354-M357 PolarHBondContact O-N 2.75Å; M357-R359 PolarHBondContact O-N 3.41Å; M357-H360 WeakPolarHBondContact O-CB 3.36Å; M357-H360 PolarHBondContact O-N 2.78Å; M357-H360 VanDerWaalsContact O-N 3.08Å; M357-E361 WeakPolarHBondContact CE-OE1 3Å; M357-E361 PolarHBondContact O-N 3.23Å
358	W	85.4	Confident	84.6	Confident	90 Å²	90	72.4 Å²	72.4	34%	0.341	34%	0.34	S	S	.	.	H	α-helix	trans	-61.3	-42.1	178	178.7	78.6	0	0	0	113	P282 C354 L355 H360 E361 T362	P282-W358 HydrophobicContact CB-CB 4.37Å; C354-W358 WeakPolarHBondContact O-CB 3.44Å; C354-W358 PolarHBondContact O-N 3.03Å; L355-W358 PolarHBondContact O-N 3.28Å; W358-H360 VanDerWaalsContact C-N 3.3Å; W358-H360 PolarHBondContact O-N 3.47Å; W358-E361 PolarHBondContact O-N 2.78Å; W358-T362 HydrophobicContact CD2-CG2 4.13Å; W358-T362 HydrophobicContact CG-CG2 4.48Å; W358-T362 HydrophobicContact CZ2-CG2 3.93Å; W358-T362 WeakPolarHBondContact O-CB 3.36Å; W358-T362 WeakPolarHBondContact O-CG2 3.49Å; W358-T362 PolarHBondContact O-N 2.97Å; W358-T362 PolarHBondContact O-OG1 3.35Å
359	R	86.5	Confident	83.3	Confident	180 Å²	180	73.8 Å²	73.8	68%	0.679	35%	0.348	S	S	*	.	H	α-helix	trans	-60.5	-38.4	172.1	-81.2	-168.6	177.1	-152.3	1.9	112.5	L355 M357 T362 V363	L355-R359 WeakPolarHBondContact O-CB 3.4Å; L355-R359 WeakPolarHBondContact O-CG 3.38Å; L355-R359 PolarHBondContact O-N 3.02Å; M357-R359 PolarHBondContact O-N 3.41Å; R359-T362 WeakPolarHBondContact CA-OG1 3.32Å; R359-T362 PolarHBondContact O-OG1 2.87Å; R359-V363 VanDerWaalsContact O-CG2 3.28Å; R359-V363 WeakPolarHBondContact O-CG2 3.44Å; R359-V363 PolarHBondContact O-N 3.03Å
360	H	81.4	Confident	82.1	Confident	88 Å²	88	75 Å²	75	41%	0.407	36%	0.355	S	S	.	.	H	α-helix	trans	-71.4	-37.6	178.6	-167.7	-109.3	0	0	0	112.2	K356 M357 W358 R364	K356-H360 WeakPolarHBondContact O-CB 3.49Å; K356-H360 PolarHBondContact O-N 2.92Å; M357-H360 WeakPolarHBondContact O-CB 3.36Å; M357-H360 PolarHBondContact O-N 2.78Å; M357-H360 VanDerWaalsContact O-N 3.08Å; W358-H360 VanDerWaalsContact C-N 3.3Å; W358-H360 PolarHBondContact O-N 3.47Å; H360-R364 VanDerWaalsContact CE1-CZ 3.5Å; H360-R364 PolarHBondContact CE1-NE 3.42Å; H360-R364 VanDerWaalsContact CE1-NE 3.35Å; H360-R364 WeakPolarHBondContact O-CG 3.28Å; H360-R364 PolarHBondContact O-N 2.92Å
361	E	80.4	Confident	80.7	Confident	30 Å²	30	79.8 Å²	79.8	14%	0.14	38%	0.38	C	S	.	.	H	α-helix	trans	-73.3	-39.2	176.9	-74.7	178.2	-174.3	0	0	113.4	M357 W358 R364 K365	M357-E361 WeakPolarHBondContact CE-OE1 3Å; M357-E361 PolarHBondContact O-N 3.23Å; W358-E361 PolarHBondContact O-N 2.78Å; E361-R364 WeakPolarHBondContact O-CB 3.19Å; E361-R364 PolarHBondContact O-N 3.49Å; E361-K365 WeakPolarHBondContact O-CB 3.43Å; E361-K365 WeakPolarHBondContact O-CG 3.34Å; E361-K365 PolarHBondContact O-N 3.31Å
362	T	77.6	Confident	79	Confident	51 Å²	51	84 Å²	84	31%	0.313	40%	0.401	S	S	.	.	H	α-helix	trans	-61.6	-43.2	172.8	46.2	0	0	0	0	111.3	W358 R359 R364 K365 V366	W358-T362 HydrophobicContact CD2-CG2 4.13Å; W358-T362 HydrophobicContact CG-CG2 4.48Å; W358-T362 HydrophobicContact CZ2-CG2 3.93Å; W358-T362 WeakPolarHBondContact O-CB 3.36Å; W358-T362 WeakPolarHBondContact O-CG2 3.49Å; W358-T362 PolarHBondContact O-N 2.97Å; W358-T362 PolarHBondContact O-OG1 3.35Å; R359-T362 WeakPolarHBondContact CA-OG1 3.32Å; R359-T362 PolarHBondContact O-OG1 2.87Å; T362-R364 PolarHBondContact O-N 2.95Å; T362-K365 PolarHBondContact O-N 2.84Å; T362-V366 WeakPolarHBondContact O-CB 3.47Å; T362-V366 VanDerWaalsContact O-CG2 3.29Å; T362-V366 WeakPolarHBondContact O-CG2 3.31Å; T362-V366 PolarHBondContact O-N 3.22Å
363	V	79.6	Confident	77.1	Confident	74 Å²	74	86.3 Å²	86.3	45%	0.448	41%	0.407	S	S	.	.	H	α-helix	trans	-62.8	-40.6	173.4	171.2	0	0	0	0	112	R359 V366 R367	R359-V363 VanDerWaalsContact O-CG2 3.28Å; R359-V363 WeakPolarHBondContact O-CG2 3.44Å; R359-V363 PolarHBondContact O-N 3.03Å; V363-V366 PolarHBondContact O-N 3.1Å; V363-R367 WeakPolarHBondContact O-CG 3.49Å; V363-R367 PolarHBondContact O-N 3.33Å
364	R	75.8	Confident	75.3	Confident	141 Å²	141	87.3 Å²	87.3	53%	0.532	42%	0.417	S	S	.	.	H	α-helix	trans	-61.2	-47.8	173.7	-79.1	173	167.3	-179.8	-6.3	112.3	H360 E361 T362 R367 Q368	H360-R364 VanDerWaalsContact CE1-CZ 3.5Å; H360-R364 PolarHBondContact CE1-NE 3.42Å; H360-R364 VanDerWaalsContact CE1-NE 3.35Å; H360-R364 WeakPolarHBondContact O-CG 3.28Å; H360-R364 PolarHBondContact O-N 2.92Å; E361-R364 WeakPolarHBondContact O-CB 3.19Å; E361-R364 PolarHBondContact O-N 3.49Å; T362-R364 PolarHBondContact O-N 2.95Å; R364-R367 PolarHBondContact O-N 3.46Å; R364-Q368 WeakPolarHBondContact O-CG 3.49Å; R364-Q368 PolarHBondContact O-N 3.38Å
365	K	73.3	Confident	73.4	Confident	65 Å²	65	94.1 Å²	94.1	28%	0.283	45%	0.449	S	S	.	.	H	α-helix	trans	-67.1	-35.2	179.8	-72.2	179.2	174.3	178.7	0	111.7	D277 E361 T362 N369	D277-K365 PolarHBondContact O-NZ 3.01Å; E361-K365 WeakPolarHBondContact O-CB 3.43Å; E361-K365 WeakPolarHBondContact O-CG 3.34Å; E361-K365 PolarHBondContact O-N 3.31Å; T362-K365 PolarHBondContact O-N 2.84Å; K365-N369 VanDerWaalsContact O-CB 3.31Å; K365-N369 WeakPolarHBondContact O-CB 3.32Å; K365-N369 PolarHBondContact O-N 3.02Å; K365-N369 PolarHBondContact O-ND2 3.02Å
366	V	77.3	Confident	71.3	Confident	99 Å²	99	95.2 Å²	95.2	60%	0.6	45%	0.452	S	S	*	.	H	α-helix	trans	-64.8	-42.1	170.9	169.7	0	0	0	0	111.6	T362 V363 N369 A370	T362-V366 WeakPolarHBondContact O-CB 3.47Å; T362-V366 VanDerWaalsContact O-CG2 3.29Å; T362-V366 WeakPolarHBondContact O-CG2 3.31Å; T362-V366 PolarHBondContact O-N 3.22Å; V363-V366 PolarHBondContact O-N 3.1Å; V366-N369 PolarHBondContact O-N 3.44Å; V366-A370 VanDerWaalsContact O-CB 3.25Å; V366-A370 WeakPolarHBondContact O-CB 3.19Å; V366-A370 PolarHBondContact O-N 3.1Å
367	R	73.6	Confident	69.3	Low	167 Å²	167	94.1 Å²	94.1	63%	0.63	45%	0.452	S	S	*	.	H	α-helix	trans	-63.3	-50.8	173.9	-74.5	-179.5	-175.6	-177.8	-0	111.7	V363 R364 N369 A370 D371	V363-R367 WeakPolarHBondContact O-CG 3.49Å; V363-R367 PolarHBondContact O-N 3.33Å; R364-R367 PolarHBondContact O-N 3.46Å; R367-N369 VanDerWaalsContact C-N 3.27Å; R367-N369 PolarHBondContact O-N 2.76Å; R367-A370 CarbonylContact O-C 3.46Å; R367-A370 WeakPolarHBondContact O-CA 3.48Å; R367-A370 WeakPolarHBondContact O-CB 3.43Å; R367-A370 PolarHBondContact O-N 2.93Å; R367-D371 WeakPolarHBondContact O-CB 3.39Å; R367-D371 PolarHBondContact O-N 3.38Å; R367-D371 VanDerWaalsContact O-OD2 3.13Å
368	Q	71.1	Confident	67.2	Low	115 Å²	115	99.6 Å²	99.6	54%	0.537	48%	0.477	S	S	.	.	H	α-helix	trans	-56.4	-39.4	175.7	-72.9	173.7	-29.2	0	0	112.8	R364 D371 Q372	R364-Q368 WeakPolarHBondContact O-CG 3.49Å; R364-Q368 PolarHBondContact O-N 3.38Å; Q368-D371 PolarHBondContact O-N 3.36Å; Q368-Q372 VanDerWaalsContact O-CB 3.31Å; Q368-Q372 WeakPolarHBondContact O-CB 3.27Å; Q368-Q372 VanDerWaalsContact O-CG 3.28Å; Q368-Q372 WeakPolarHBondContact O-CG 3.43Å; Q368-Q372 PolarHBondContact O-N 2.65Å
369	N	68.1	Low	65.2	Low	91 Å²	91	98 Å²	98	49%	0.487	48%	0.48	S	S	.	.	H	α-helix	trans	-70.3	-32.1	174.4	-72.1	-20.8	0	0	0	113	K365 V366 R367 K373	K365-N369 VanDerWaalsContact O-CB 3.31Å; K365-N369 WeakPolarHBondContact O-CB 3.32Å; K365-N369 PolarHBondContact O-N 3.02Å; K365-N369 PolarHBondContact O-ND2 3.02Å; V366-N369 PolarHBondContact O-N 3.44Å; R367-N369 VanDerWaalsContact C-N 3.27Å; R367-N369 PolarHBondContact O-N 2.76Å; N369-K373 VanDerWaalsContact O-CB 3.26Å; N369-K373 WeakPolarHBondContact O-CB 3.35Å; N369-K373 VanDerWaalsContact O-CG 3.26Å; N369-K373 WeakPolarHBondContact O-CG 3.41Å; N369-K373 PolarHBondContact O-N 3.4Å
370	A	68.8	Low	63.4	Low	53 Å²	53	92.3 Å²	92.3	44%	0.438	46%	0.462	S	S	.	.	H	α-helix	trans	-77.3	-30.8	175.4	0	0	0	0	0	112.3	V366 R367 K373 G374	V366-A370 VanDerWaalsContact O-CB 3.25Å; V366-A370 WeakPolarHBondContact O-CB 3.19Å; V366-A370 PolarHBondContact O-N 3.1Å; R367-A370 CarbonylContact O-C 3.46Å; R367-A370 WeakPolarHBondContact O-CA 3.48Å; R367-A370 WeakPolarHBondContact O-CB 3.43Å; R367-A370 PolarHBondContact O-N 2.93Å; A370-K373 CarbonylContact O-C 3.55Å; A370-G374 VanDerWaalsContact O-CA 3.24Å; A370-G374 WeakPolarHBondContact O-CA 3.34Å; A370-G374 PolarHBondContact O-N 2.9Å
371	D	65.1	Low	61.3	Low	103 Å²	103	91.8 Å²	91.8	55%	0.551	47%	0.468	S	S	*	.	H	α-helix	trans	-78.1	-40.2	175.1	-62.9	-31.8	0	0	0	109.7	R367 Q368 G374 E375	R367-D371 WeakPolarHBondContact O-CB 3.39Å; R367-D371 PolarHBondContact O-N 3.38Å; R367-D371 VanDerWaalsContact O-OD2 3.13Å; Q368-D371 PolarHBondContact O-N 3.36Å; D371-G374 CarbonylContact O-C 3.53Å; D371-G374 PolarHBondContact O-N 3.4Å; D371-G374 VanDerWaalsContact O-N 3.17Å; D371-E375 WeakPolarHBondContact O-CB 3.47Å; D371-E375 PolarHBondContact O-N 2.71Å
372	Q	57.6	Low	59.4	Low	128 Å²	128	96.5 Å²	96.5	60%	0.598	49%	0.494	S	S	*	.	H	α-helix	trans	-63.7	-42.5	169.1	-76.4	179.6	7.6	0	0	111.8	Q368 G374 F376	Q368-Q372 VanDerWaalsContact O-CB 3.31Å; Q368-Q372 WeakPolarHBondContact O-CB 3.27Å; Q368-Q372 VanDerWaalsContact O-CG 3.28Å; Q368-Q372 WeakPolarHBondContact O-CG 3.43Å; Q368-Q372 PolarHBondContact O-N 2.65Å; Q372-G374 VanDerWaalsContact C-N 3.31Å; Q372-F376 WeakPolarHBondContact O-CB 3.43Å; Q372-F376 PolarHBondContact O-N 2.95Å
373	K	53.8	Low	57.7	Low	150 Å²	150	98.6 Å²	98.6	65%	0.652	50%	0.503	S	S	*	.	H	α-helix	trans	-68	-31.4	171	-78.3	177.3	177.1	178.8	0	112.3	N369 A370 N377	N369-K373 VanDerWaalsContact O-CB 3.26Å; N369-K373 WeakPolarHBondContact O-CB 3.35Å; N369-K373 VanDerWaalsContact O-CG 3.26Å; N369-K373 WeakPolarHBondContact O-CG 3.41Å; N369-K373 PolarHBondContact O-N 3.4Å; A370-K373 CarbonylContact O-C 3.55Å; K373-N377 WeakPolarHBondContact O-CB 3.35Å; K373-N377 PolarHBondContact O-N 2.94Å; K373-N377 PolarHBondContact O-ND2 3.29Å; K373-N377 PolarHBondContact O-OD1 2.9Å
374	G	52.4	Low	55.9	Low	28 Å²	28	100.2 Å²	100.2	29%	0.289	51%	0.513	S	S	.	.	H	α-helix	trans	-71.6	-46.7	-180	0	0	0	0	0	111.2	A370 D371 Q372 N377 Q378	A370-G374 VanDerWaalsContact O-CA 3.24Å; A370-G374 WeakPolarHBondContact O-CA 3.34Å; A370-G374 PolarHBondContact O-N 2.9Å; D371-G374 CarbonylContact O-C 3.53Å; D371-G374 PolarHBondContact O-N 3.4Å; D371-G374 VanDerWaalsContact O-N 3.17Å; Q372-G374 VanDerWaalsContact C-N 3.31Å; G374-N377 CarbonylContact O-C 3.53Å; G374-N377 PolarHBondContact O-N 3.06Å; G374-Q378 WeakPolarHBondContact O-CA 3.34Å; G374-Q378 WeakPolarHBondContact O-CB 3.47Å; G374-Q378 PolarHBondContact O-N 3.17Å
375	E	50.3	Low	54.2	Low	143 Å²	143	102 Å²	102	67%	0.668	53%	0.528	S	S	*	.	H	α-helix	trans	-69.9	-33.8	174.1	-167.3	174.9	-147.3	0	0	111.2	D371 S379	D371-E375 WeakPolarHBondContact O-CB 3.47Å; D371-E375 PolarHBondContact O-N 2.71Å; E375-S379 WeakPolarHBondContact O-CB 3.35Å; E375-S379 PolarHBondContact O-N 3.34Å; E375-S379 PolarHBondContact O-OG 3.42Å
376	F	45.2	Very low	53	Low	79 Å²	79	109.3 Å²	109.3	35%	0.346	55%	0.553	S	S	.	*	H	α-helix	trans	-61.4	-49.4	165.4	-173.9	-85.3	0	0	0	111	Q372 Q378 S379 I380 K530	Q372-F376 WeakPolarHBondContact O-CB 3.43Å; Q372-F376 PolarHBondContact O-N 2.95Å; F376-Q378 PolarHBondContact O-N 3.44Å; F376-S379 PolarHBondContact O-OG 3.49Å; F376-I380 HydrophobicContact CD1-CD1 3.54Å; F376-I380 HydrophobicContact CE1-CD1 3.41Å; F376-I380 VanDerWaalsContact CE1-CD1 3.41Å; F376-I380 HydrophobicContact CG-CD1 4.45Å; F376-I380 HydrophobicContact CZ-CD1 4.26Å; F376-I380 WeakPolarHBondContact O-CB 3.48Å; F376-I380 WeakPolarHBondContact O-CD1 3.37Å; F376-I380 WeakPolarHBondContact O-CG1 3.28Å; F376-I380 PolarHBondContact O-N 3.28Å; F376-K530 VanDerWaalsContact CD2-NZ 3.26Å
377	N	45.4	Very low	50.9	Low	96 Å²	96	109.9 Å²	109.9	51%	0.513	56%	0.558	S	S	.	*	H	α-helix	trans	-71.5	-26.8	178.9	-70.2	-18	0	0	0	113.5	K373 G374 I380 S381	K373-N377 WeakPolarHBondContact O-CB 3.35Å; K373-N377 PolarHBondContact O-N 2.94Å; K373-N377 PolarHBondContact O-ND2 3.29Å; K373-N377 PolarHBondContact O-OD1 2.9Å; G374-N377 CarbonylContact O-C 3.53Å; G374-N377 PolarHBondContact O-N 3.06Å; N377-I380 WeakPolarHBondContact O-CB 3.46Å; N377-S381 VanDerWaalsContact O-CB 3.29Å; N377-S381 WeakPolarHBondContact O-CB 3.46Å; N377-S381 PolarHBondContact O-N 2.81Å
378	Q	43.1	Very low	49.3	Very low	121 Å²	121	109.8 Å²	109.8	57%	0.565	56%	0.562	S	S	*	*	H	α-helix	trans	-87.8	-31	-179.3	-170.1	167	12.6	0	0	111	G374 F376 I380 S381 L382	G374-Q378 WeakPolarHBondContact O-CA 3.34Å; G374-Q378 WeakPolarHBondContact O-CB 3.47Å; G374-Q378 PolarHBondContact O-N 3.17Å; F376-Q378 PolarHBondContact O-N 3.44Å; Q378-I380 VanDerWaalsContact C-N 3.27Å; Q378-S381 PolarHBondContact O-N 2.94Å; Q378-L382 HydrophobicContact CG-CD1 3.84Å; Q378-L382 HydrophobicContact CG-CG 4.22Å; Q378-L382 VanDerWaalsContact O-CB 3.25Å; Q378-L382 WeakPolarHBondContact O-CB 3.03Å; Q378-L382 WeakPolarHBondContact O-CG 3.19Å; Q378-L382 PolarHBondContact O-N 2.89Å
379	S	42	Very low	47.4	Very low	56 Å²	56	113 Å²	113	39%	0.392	58%	0.577	S	S	.	*	H	α-helix	trans	-69.5	-24.7	163.5	59.4	0	0	0	0	112.7	E375 F376 N383	E375-S379 WeakPolarHBondContact O-CB 3.35Å; E375-S379 PolarHBondContact O-N 3.34Å; E375-S379 PolarHBondContact O-OG 3.42Å; F376-S379 PolarHBondContact O-OG 3.49Å; S379-N383 PolarHBondContact O-ND2 3.49Å
380	I	49.3	Very low	46	Very low	60 Å²	60	114.6 Å²	114.6	31%	0.308	58%	0.584	S	S	.	*	H	α-helix	trans	-73.1	-46.7	165.7	-71.8	165.1	0	0	0	111.2	F376 N377 Q378 T384	F376-I380 HydrophobicContact CD1-CD1 3.54Å; F376-I380 HydrophobicContact CE1-CD1 3.41Å; F376-I380 VanDerWaalsContact CE1-CD1 3.41Å; F376-I380 HydrophobicContact CG-CD1 4.45Å; F376-I380 HydrophobicContact CZ-CD1 4.26Å; F376-I380 WeakPolarHBondContact O-CB 3.48Å; F376-I380 WeakPolarHBondContact O-CD1 3.37Å; F376-I380 WeakPolarHBondContact O-CG1 3.28Å; F376-I380 PolarHBondContact O-N 3.28Å; N377-I380 WeakPolarHBondContact O-CB 3.46Å; Q378-I380 VanDerWaalsContact C-N 3.27Å; I380-T384 PolarHBondContact O-N 2.9Å; I380-T384 PolarHBondContact O-OG1 2.81Å
381	S	37.3	Very low	44.2	Very low	78 Å²	78	117 Å²	117	55%	0.545	60%	0.597	S	S	.	*	H	α-helix	trans	-73.7	-43.4	-174.8	-167.1	0	0	0	0	113.6	N377 Q378 N383 T384	N377-S381 VanDerWaalsContact O-CB 3.29Å; N377-S381 WeakPolarHBondContact O-CB 3.46Å; N377-S381 PolarHBondContact O-N 2.81Å; Q378-S381 PolarHBondContact O-N 2.94Å; S381-N383 VanDerWaalsContact C-N 3.26Å; S381-N383 PolarHBondContact O-N 3.45Å; S381-T384 PolarHBondContact O-N 3.03Å
382	L	39.8	Very low	43	Very low	128 Å²	128	117.2 Å²	117.2	67%	0.67	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-20.9	178.2	-76.6	168.2	0	0	0	113.7	Q378	Q378-L382 HydrophobicContact CG-CD1 3.84Å; Q378-L382 HydrophobicContact CG-CG 4.22Å; Q378-L382 VanDerWaalsContact O-CB 3.25Å; Q378-L382 WeakPolarHBondContact O-CB 3.03Å; Q378-L382 WeakPolarHBondContact O-CG 3.19Å; Q378-L382 PolarHBondContact O-N 2.89Å
383	N	43.5	Very low	42.1	Very low	96 Å²	96	122.1 Å²	122.1	51%	0.513	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.1	-4.8	171.3	-75.9	-63.6	0	0	0	113.4	S379 S381	S379-N383 PolarHBondContact O-ND2 3.49Å; S381-N383 VanDerWaalsContact C-N 3.26Å; S381-N383 PolarHBondContact O-N 3.45Å
384	T	40.3	Very low	41.3	Very low	108 Å²	108	122.7 Å²	122.7	66%	0.663	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-18.3	179.5	-59.8	0	0	0	0	112.3	I380 S381 R386	I380-T384 PolarHBondContact O-N 2.9Å; I380-T384 PolarHBondContact O-OG1 2.81Å; S381-T384 PolarHBondContact O-N 3.03Å; T384-R386 PolarHBondContact O-N 3.19Å
385	Q	41.8	Very low	40.5	Very low	178 Å²	178	130.2 Å²	130.2	83%	0.832	64%	0.644	S	S	*	*	S	Bend	trans	-93.7	99.7	169.2	-74.1	-164.9	-8.7	0	0	112.7
386	R	47.4	Very low	40	Very low	218 Å²	218	128.9 Å²	128.9	82%	0.823	65%	0.648	S	S	*	*			trans	72.8	48.9	150	-148.4	-172.9	-144.6	173.9	7.4	118.2	T384 K388	T384-R386 PolarHBondContact O-N 3.19Å; R386-K388 VanDerWaalsContact C-N 3.28Å; R386-K388 PolarHBondContact O-N 3.34Å
387	T	33.8	Very low	39.4	Very low	112 Å²	112	132.6 Å²	132.6	69%	0.687	67%	0.672	S	S	*	*			trans	-73.6	88.5	146.5	25.6	0	0	0	0	109.7	Q389	T387-Q389 PolarHBondContact O-N 3.41Å
388	K	39.1	Very low	38.8	Very low	165 Å²	165	138 Å²	138	72%	0.717	69%	0.69	S	S	*	*			trans	-52.2	138.3	151.3	-75	-176.3	174.8	-175.1	0	107.4	R386 I390	R386-K388 VanDerWaalsContact C-N 3.28Å; R386-K388 PolarHBondContact O-N 3.34Å; K388-I390 PolarHBondContact O-N 3.4Å
389	Q	31	Very low	38.9	Very low	182 Å²	182	137.9 Å²	137.9	85%	0.85	70%	0.7	S	S	*	*			trans	-39.2	122	167.2	-178.7	-178.6	14.3	0	0	109.9	T387 S391	T387-Q389 PolarHBondContact O-N 3.41Å; Q389-S391 PolarHBondContact O-N 2.98Å
390	I	38	Very low	38.4	Very low	125 Å²	125	142.9 Å²	142.9	64%	0.641	72%	0.722	S	S	*	*			trans	-75.7	83.1	179.1	-49.4	174.8	0	0	0	107.6	K388 F392	K388-I390 PolarHBondContact O-N 3.4Å; I390-F392 HydrophobicContact CB-CE2 4.04Å; I390-F392 HydrophobicContact CG2-CD2 3.85Å; I390-F392 HydrophobicContact CG2-CE2 3.29Å; I390-F392 HydrophobicContact CG2-CZ 3.69Å; I390-F392 WeakPolarHBondContact O-CD2 3.26Å; I390-F392 PolarHBondContact O-N 2.86Å
391	S	31.8	Very low	37.5	Very low	102 Å²	102	146.7 Å²	146.7	71%	0.713	74%	0.743	S	S	*	*			trans	-67.4	115.2	166.3	-177	0	0	0	0	108.1	Q389	Q389-S391 PolarHBondContact O-N 2.98Å
392	F	40	Very low	37.3	Very low	109 Å²	109	151.2 Å²	151.2	48%	0.478	75%	0.752	S	S	.	*			trans	-89.8	133.6	166.8	-72	-94.4	0	0	0	107.1	I390 D394	I390-F392 HydrophobicContact CB-CE2 4.04Å; I390-F392 HydrophobicContact CG2-CD2 3.85Å; I390-F392 HydrophobicContact CG2-CE2 3.29Å; I390-F392 HydrophobicContact CG2-CZ 3.69Å; I390-F392 WeakPolarHBondContact O-CD2 3.26Å; I390-F392 PolarHBondContact O-N 2.86Å; F392-D394 PolarHBondContact O-N 2.91Å
393	R	37.8	Very low	36.8	Very low	231 Å²	231	151.8 Å²	151.8	87%	0.872	76%	0.756	S	S	*	*			trans	-94.6	97	-166	-172.2	-168.8	-160.3	-132.6	3.3	110.6
394	D	38.3	Very low	36	Very low	161 Å²	161	150.8 Å²	150.8	86%	0.861	77%	0.769	S	S	*	*			trans	-152.8	64.2	170.7	-79.5	-47.9	0	0	0	111.7	F392	F392-D394 PolarHBondContact O-N 2.91Å
395	E	34.3	Very low	35.3	Very low	187 Å²	187	153.1 Å²	153.1	87%	0.874	78%	0.777	S	S	*	*	S	Bend	trans	-161.1	143.1	160.9	-153.8	165.4	155	0	0	110.3
396	P	40	Very low	34.5	Very low	115 Å²	115	150 Å²	150	75%	0.747	77%	0.774	S	S	*	*			trans	-90.5	139.3	-169.9	33.3	-35.2	0	0	0	116.6
397	D	33.8	Very low	33.4	Very low	157 Å²	157	148 Å²	148	84%	0.84	77%	0.774	S	S	*	*			trans	25.6	115.7	153.8	-57.7	-24	0	0	0	122.8
398	K	31.9	Very low	33.8	Very low	209 Å²	209	147.6 Å²	147.6	91%	0.909	77%	0.773	S	S	*	*				-152.5	142.8	129.6	-145.1	164.6	-174.1	-179.6	0	111.6
399	P	45.4	Very low	33	Very low	119 Å²	119	148.9 Å²	148.9	77%	0.773	78%	0.782	S	S	*	*			trans	-105.4	153.1	-164.5	38	-33.5	0	0	0	115.2
400	L	32.3	Very low	32.7	Very low	161 Å²	161	147.7 Å²	147.7	84%	0.843	78%	0.78	S	S	*	*			trans	-155	120.1	149.4	-158.2	64.9	0	0	0	113.2
401	N	29.2	Very low	33	Very low	139 Å²	139	147 Å²	147	74%	0.743	78%	0.784	S	S	*	*			trans	-0.7	139.7	146	-76.7	-37	0	0	0	117.8
402	K	34.5	Very low	33.3	Very low	173 Å²	173	147.5 Å²	147.5	75%	0.752	79%	0.785	S	S	*	*			cis	-173.6	150.2	47.6	-134.1	-174.3	177.2	-174.2	0	113.9
403	D	27.3	Very low	32.6	Very low	140 Å²	140	151.6 Å²	151.6	75%	0.749	80%	0.803	S	S	*	*			trans	31.1	141	148.8	-48.2	-20.9	0	0	0	123.2
404	G	28.4	Very low	32.2	Very low	76 Å²	76	146 Å²	146	78%	0.784	79%	0.794	S	S	*	*			trans	-178.6	-16	171	0	0	0	0	0	122
405	N	25.9	Very low	31.5	Very low	156 Å²	156	150.5 Å²	150.5	83%	0.834	80%	0.799	S	S	*	*			trans	62.8	143.3	162.4	-152.8	27.7	0	0	0	123.5
406	C	24.4	Very low	31.4	Very low	112 Å²	112	150.8 Å²	150.8	76%	0.757	80%	0.797	S	S	*	*			trans	78	130.9	157.8	-82.4	0	0	0	0	124.8
407	Q	23	Very low	30.7	Very low	177 Å²	177	150.6 Å²	150.6	83%	0.827	80%	0.798	S	S	*	*			trans	-111.5	-161.5	-179.7	-78.9	-94.4	6.7	0	0	109
408	P	42.7	Very low	30.2	Very low	104 Å²	104	148.1 Å²	148.1	68%	0.675	79%	0.794	S	S	*	*			cis	-129.2	173.6	-31.9	22.5	-0.5	0	0	0	113.5
409	E	23.4	Very low	30	Very low	191 Å²	191	145 Å²	145	89%	0.893	79%	0.792	S	S	*	*				-177.1	158.8	119.6	-103.4	-170.8	136.5	0	0	114.3
410	L	25.1	Very low	29.1	Very low	158 Å²	158	144.2 Å²	144.2	83%	0.827	79%	0.789	S	S	*	*			trans	-109	-172.3	-174.8	-112.5	73.5	0	0	0	110
411	P	43	Very low	29.8	Very low	111 Å²	111	141.2 Å²	141.2	72%	0.721	78%	0.779	S	S	*	*			cis	-127.1	-146.9	-29.1	36.7	-14.7	0	0	0	108.9
412	P	38	Very low	29.7	Very low	112 Å²	112	142 Å²	142	73%	0.727	78%	0.783	S	S	*	*			cis	-135.6	139.7	-8.8	37.8	-17.3	0	0	0	118.9
413	K	25.4	Very low	29.4	Very low	195 Å²	195	145.6 Å²	145.6	85%	0.848	79%	0.792	S	S	*	*				38.7	99.7	118.7	-147.8	168.3	-172	176.9	0	121.4
414	V	29.8	Very low	29.5	Very low	114 Å²	114	143.3 Å²	143.3	69%	0.691	79%	0.793	S	S	*	*				48.7	127.5	124.3	-177.4	0	0	0	0	120.9	K416	V414-K416 HydrophobicContact CG1-CG 4.42Å
415	R	24.5	Very low	29.5	Very low	254 Å²	254	145.3 Å²	145.3	96%	0.958	80%	0.795	S	S	*	*			trans	-144.2	149.2	133.1	-108.6	174.3	-174.3	-173.1	0.6	112
416	K	30.3	Very low	29.7	Very low	194 Å²	194	144.3 Å²	144.3	84%	0.843	79%	0.794	S	S	*	*			trans	-114.4	152.6	-173.1	-57.7	172.8	177.4	178.1	0	111.4	V414	V414-K416 HydrophobicContact CG1-CG 4.42Å
417	S	25.4	Very low	30.1	Very low	110 Å²	110	143 Å²	143	77%	0.769	79%	0.786	S	S	*	*			trans	-175.5	121.5	151	55.6	0	0	0	0	106.7
418	S	24.5	Very low	30.5	Very low	106 Å²	106	142.4 Å²	142.4	74%	0.741	79%	0.789	S	S	*	*			cis	117.1	110.3	43.6	60.1	0	0	0	0	109.8
419	V	26.9	Very low	30	Very low	144 Å²	144	141.2 Å²	141.2	87%	0.873	78%	0.776	S	S	*	*			trans	5.5	137.7	132.4	178.4	0	0	0	0	115.3
420	S	26.7	Very low	30.6	Very low	102 Å²	102	137.7 Å²	137.7	71%	0.713	77%	0.768	S	S	*	*			cis	-167.5	-145.3	-2.3	-173.2	0	0	0	0	109.1
421	P	46.8	Very low	31	Very low	98 Å²	98	136 Å²	136	64%	0.636	77%	0.766	S	S	*	*				-116.9	-171.7	-99.3	38	-23	0	0	0	117.1
422	N	27.7	Very low	30.6	Very low	154 Å²	154	137 Å²	137	82%	0.824	76%	0.759	S	S	*	*			trans	95.3	116.3	157.1	-57.2	-25.7	0	0	0	119.3
423	R	27.3	Very low	30.4	Very low	249 Å²	249	137.9 Å²	137.9	94%	0.94	76%	0.762	S	S	*	*				-168.5	132.5	104.3	-161.8	166.2	-173.2	163.9	0.1	111.1
424	A	29.6	Very low	31.1	Very low	93 Å²	93	135 Å²	135	77%	0.769	75%	0.752	S	S	*	*			trans	-85.5	153	174.8	0	0	0	0	0	111.9
425	S	29.6	Very low	32.2	Very low	118 Å²	118	136.2 Å²	136.2	83%	0.825	76%	0.759	S	S	*	*			trans	-123.9	119.3	159.4	63.8	0	0	0	0	109
426	V	30.5	Very low	34.1	Very low	134 Å²	134	128.8 Å²	128.8	81%	0.812	74%	0.738	S	S	*	*			trans	-73.8	126.7	-179.6	176.6	0	0	0	0	110.2
427	S	31.5	Very low	36.4	Very low	84 Å²	84	120.9 Å²	120.9	59%	0.587	71%	0.708	S	S	*	*			trans	-92.4	128.8	165.7	55.2	0	0	0	0	110.3	D429	S427-D429 VanDerWaalsContact C-N 3.25Å; S427-D429 VanDerWaalsContact CB-OD2 3.31Å; S427-D429 WeakPolarHBondContact CB-OD2 3.33Å; S427-D429 PolarHBondContact O-N 2.69Å; S427-D429 VanDerWaalsContact O-N 3.07Å; S427-D429 PolarHBondContact OG-OD2 3.19Å
428	N	32.3	Very low	39.3	Very low	166 Å²	166	119.5 Å²	119.5	89%	0.888	69%	0.692	S	S	*	*			trans	-78.9	79.8	164	-72.5	-26.3	0	0	0	108.2
429	D	32.6	Very low	42.3	Very low	78 Å²	78	116.3 Å²	116.3	42%	0.417	66%	0.664	S	S	.	*			trans	-78.2	118.9	172.3	-85.6	-80.7	0	0	0	110	S427 K432	S427-D429 VanDerWaalsContact C-N 3.25Å; S427-D429 VanDerWaalsContact CB-OD2 3.31Å; S427-D429 WeakPolarHBondContact CB-OD2 3.33Å; S427-D429 PolarHBondContact O-N 2.69Å; S427-D429 VanDerWaalsContact O-N 3.07Å; S427-D429 PolarHBondContact OG-OD2 3.19Å; D429-K432 IonicContact OD1-NZ 3.03Å; D429-K432 PolarHBondContact OD1-NZ 2.79Å
430	T	34.1	Very low	45.2	Very low	118 Å²	118	112.9 Å²	112.9	72%	0.724	64%	0.64	S	S	*	*			trans	-55.6	140	148.3	46	0	0	0	0	107.7	K432	T430-K432 VanDerWaalsContact C-N 3.35Å; T430-K432 PolarHBondContact O-N 3.49Å
431	P	34.3	Very low	48.2	Very low	121 Å²	121	113.8 Å²	113.8	79%	0.786	64%	0.636	S	S	*	*			trans	-68.5	92.3	-166.6	27	-35.1	0	0	0	111.2	V433	P431-V433 PolarHBondContact O-N 3.01Å; P431-V433 VanDerWaalsContact O-N 3.13Å
432	K	33.9	Very low	50.2	Low	132 Å²	132	115.6 Å²	115.6	57%	0.574	63%	0.634	S	S	*	*			trans	-54.4	118	151.1	-70.5	175.7	-169.5	119.2	0	105.3	D429 T430 H434	D429-K432 IonicContact OD1-NZ 3.03Å; D429-K432 PolarHBondContact OD1-NZ 2.79Å; T430-K432 VanDerWaalsContact C-N 3.35Å; T430-K432 PolarHBondContact O-N 3.49Å; K432-H434 PolarHBondContact O-N 3.35Å
433	V	34.8	Very low	53.3	Low	131 Å²	131	109.2 Å²	109.2	79%	0.794	60%	0.598	S	S	*	*			trans	-64.4	90.1	166.3	179.3	0	0	0	0	106	P431 V435	P431-V433 PolarHBondContact O-N 3.01Å; P431-V433 VanDerWaalsContact O-N 3.13Å; V433-V435 PolarHBondContact O-N 3.08Å
434	H	39.6	Very low	56.4	Low	136 Å²	136	100.3 Å²	100.3	63%	0.63	57%	0.573	S	S	*	*			trans	-64.6	104.7	172	-78	-60.5	0	0	0	106.5	K432 I436	K432-H434 PolarHBondContact O-N 3.35Å; H434-I436 HydrophobicContact CB-CG1 4.13Å; H434-I436 PolarHBondContact O-N 3.24Å
435	V	52.6	Low	59.3	Low	139 Å²	139	100.3 Å²	100.3	84%	0.842	56%	0.557	S	S	*	*			trans	-67.8	80.8	163.6	-176.4	0	0	0	0	106.3	V433 A437	V433-V435 PolarHBondContact O-N 3.08Å; V435-A437 PolarHBondContact O-N 2.84Å
436	I	64.3	Low	62.4	Low	98 Å²	98	95 Å²	95	50%	0.503	52%	0.519	S	S	.	.			trans	-63.4	121.5	174.5	-62.3	171.8	0	0	0	105.9	H434 D438 I440 I441	H434-I436 HydrophobicContact CB-CG1 4.13Å; H434-I436 PolarHBondContact O-N 3.24Å; I436-D438 PolarHBondContact O-N 3.33Å; I436-I440 HydrophobicContact CG2-CB 4.02Å; I436-I440 HydrophobicContact CG2-CD1 4.32Å; I436-I440 HydrophobicContact CG2-CG2 4.21Å; I436-I441 HydrophobicContact CB-CD1 4.38Å; I436-I441 HydrophobicContact CG2-CD1 4.09Å; I436-I441 HydrophobicContact CG2-CG1 3.83Å
437	A	79.7	Confident	65.1	Low	27 Å²	27	98.4 Å²	98.4	22%	0.223	52%	0.517	C	S	.	.			trans	-60.1	136	-179.1	0	0	0	0	0	110.6	V435 Y439 I440	V435-A437 PolarHBondContact O-N 2.84Å; A437-Y439 HydrophobicContact CB-CD1 3.83Å; A437-Y439 HydrophobicContact CB-CE1 3.36Å; A437-Y439 HydrophobicContact CB-CE2 4.22Å; A437-Y439 HydrophobicContact CB-CG 4.43Å; A437-Y439 PolarHBondContact O-N 3.4Å; A437-Y439 VanDerWaalsContact O-N 3.1Å; A437-I440 HydrophobicContact CB-CD1 4.17Å; A437-I440 HydrophobicContact CB-CG1 4.28Å; A437-I440 WeakPolarHBondContact O-CB 3.03Å; A437-I440 PolarHBondContact O-N 2.88Å
438	D	86.7	Confident	67.9	Low	81 Å²	81	96.4 Å²	96.4	43%	0.433	50%	0.503	S	S	.	.	H	α-helix	trans	-49.8	-38.6	-176.4	70.3	-36.6	0	0	0	113.3	I436 I440 I441 K442 Y528	I436-D438 PolarHBondContact O-N 3.33Å; D438-I440 VanDerWaalsContact C-N 3.27Å; D438-I440 PolarHBondContact O-N 2.87Å; D438-I441 PolarHBondContact O-N 3.08Å; D438-K442 VanDerWaalsContact O-CB 3.29Å; D438-K442 WeakPolarHBondContact O-CB 3.46Å; D438-K442 PolarHBondContact O-N 3.01Å; D438-Y528 VanDerWaalsContact CG-OH 3.24Å; D438-Y528 WeakPolarHBondContact OD1-CE2 3.47Å; D438-Y528 PolarHBondContact OD1-OH 2.95Å; D438-Y528 PolarHBondContact OD2-OH 3.05Å
439	Y	88.1	Confident	70.6	Confident	39 Å²	39	92.1 Å²	92.1	15%	0.153	48%	0.478	C	S	.	.	H	α-helix	trans	-67.6	-22.8	179	63.4	-103.4	0	0	0	113.7	A437 Y443 Y528 A531 K532 H535	A437-Y439 HydrophobicContact CB-CD1 3.83Å; A437-Y439 HydrophobicContact CB-CE1 3.36Å; A437-Y439 HydrophobicContact CB-CE2 4.22Å; A437-Y439 HydrophobicContact CB-CG 4.43Å; A437-Y439 PolarHBondContact O-N 3.4Å; A437-Y439 VanDerWaalsContact O-N 3.1Å; Y439-Y443 WeakPolarHBondContact O-CB 3.46Å; Y439-Y443 WeakPolarHBondContact O-CD2 3.35Å; Y439-Y443 PolarHBondContact O-N 2.73Å; Y439-Y528 HydrophobicContact CD1-CD2 4.49Å; Y439-Y528 AromaticContact CD1-CE2 3.87Å; Y439-Y528 HydrophobicContact CD1-CE2 3.87Å; Y439-Y528 HydrophobicContact CE1-CE2 4.32Å; Y439-A531 HydrophobicContact CE1-CB 4.18Å; Y439-K532 HydrophobicContact CD1-CB 3.97Å; Y439-K532 HydrophobicContact CG-CB 4Å; Y439-K532 HydrophobicContact CG-CG 4.29Å; Y439-H535 HydrophobicContact CD2-CB 3.76Å; Y439-H535 AromaticContact CD2-CD2 3.89Å; Y439-H535 AromaticContact CD2-CG 3.8Å; Y439-H535 HydrophobicContact CE2-CB 3.83Å; Y439-H535 PolarHBondContact O-CD2 3.33Å; Y439-H535 PolarHBondContact O-NE2 3.3Å
440	I	87.7	Confident	73.4	Confident	72 Å²	72	95.9 Å²	95.9	37%	0.369	49%	0.493	S	S	.	.	H	α-helix	trans	-71.3	-39.6	175.2	-58	176	0	0	0	109.6	I436 A437 D438	I436-I440 HydrophobicContact CG2-CB 4.02Å; I436-I440 HydrophobicContact CG2-CD1 4.32Å; I436-I440 HydrophobicContact CG2-CG2 4.21Å; A437-I440 HydrophobicContact CB-CD1 4.17Å; A437-I440 HydrophobicContact CB-CG1 4.28Å; A437-I440 WeakPolarHBondContact O-CB 3.03Å; A437-I440 PolarHBondContact O-N 2.88Å; D438-I440 VanDerWaalsContact C-N 3.27Å; D438-I440 PolarHBondContact O-N 2.87Å
441	I	88.9	Confident	76.1	Confident	121 Å²	121	93.7 Å²	93.7	62%	0.621	47%	0.474	S	S	*	.	H	α-helix	trans	-75.4	-41	178.5	-54	172.8	0	0	0	110.4	I436 D438	I436-I441 HydrophobicContact CB-CD1 4.38Å; I436-I441 HydrophobicContact CG2-CD1 4.09Å; I436-I441 HydrophobicContact CG2-CG1 3.83Å; D438-I441 PolarHBondContact O-N 3.08Å
442	K	89.7	Confident	78.9	Confident	137 Å²	137	89.6 Å²	89.6	60%	0.596	44%	0.443	S	S	*	.	H	α-helix	trans	-75.8	-24.1	-177.3	-171.9	169.7	-178.6	168.7	0	114.3	D438 P444	D438-K442 VanDerWaalsContact O-CB 3.29Å; D438-K442 WeakPolarHBondContact O-CB 3.46Å; D438-K442 PolarHBondContact O-N 3.01Å; K442-P444 VanDerWaalsContact C-CD 3.44Å; K442-P444 WeakPolarHBondContact O-CD 3.38Å
443	Y	91.9	Very high	81.7	Confident	20 Å²	20	89.7 Å²	89.7	8%	0.078	44%	0.444	C	S	.	.	S	Bend	trans	-124.8	73.7	177.8	-57.2	-81.3	0	0	0	110.1	Y439 Y455 V458 H535 I536	Y439-Y443 WeakPolarHBondContact O-CB 3.46Å; Y439-Y443 WeakPolarHBondContact O-CD2 3.35Å; Y439-Y443 PolarHBondContact O-N 2.73Å; Y443-Y455 WeakPolarHBondContact CA-OH 3.46Å; Y443-Y455 HydrophobicContact CD1-CD1 4.19Å; Y443-Y455 HydrophobicContact CD1-CD2 4.13Å; Y443-Y455 HydrophobicContact CD1-CE1 4.07Å; Y443-Y455 AromaticContact CD1-CE2 3.99Å; Y443-Y455 HydrophobicContact CD1-CE2 3.99Å; Y443-Y455 HydrophobicContact CD1-CG 4.25Å; Y443-Y455 AromaticContact CD1-CZ 3.99Å; Y443-Y455 HydrophobicContact CG-CE2 4.36Å; Y443-V458 HydrophobicContact CE1-CB 4.46Å; Y443-V458 HydrophobicContact CE1-CG1 3.99Å; Y443-V458 HydrophobicContact CE1-CG2 4.39Å; Y443-V458 WeakPolarHBondContact OH-CG1 3.21Å; Y443-H535 PolarHBondContact O-NE2 3.43Å; Y443-I536 HydrophobicContact CD1-CD1 4.14Å; Y443-I536 HydrophobicContact CD1-CG1 4.05Å; Y443-I536 HydrophobicContact CD2-CD1 3.98Å; Y443-I536 HydrophobicContact CD2-CG1 4Å; Y443-I536 HydrophobicContact CE1-CD1 4.09Å; Y443-I536 HydrophobicContact CE2-CD1 3.94Å; Y443-I536 HydrophobicContact CE2-CG1 4.47Å; Y443-I536 HydrophobicContact CG-CD1 4.11Å; Y443-I536 HydrophobicContact CG-CG1 3.8Å
444	P	91.9	Very high	84.4	Confident	62 Å²	62	90.5 Å²	90.5	40%	0.403	44%	0.436	S	S	.	.			trans	-65.5	-168.9	173.7	30.7	-38.3	0	0	0	112.3	K442 Y455 R539	K442-P444 VanDerWaalsContact C-CD 3.44Å; K442-P444 WeakPolarHBondContact O-CD 3.38Å; P444-Y455 WeakPolarHBondContact CD-OH 3.48Å; P444-Y455 PolarHBondContact O-OH 2.88Å; P444-Y455 VanDerWaalsContact O-OH 3.11Å; P444-R539 WeakPolarHBondContact O-CD 3.18Å; P444-R539 PolarHBondContact O-NE 3.5Å
445	E	91.6	Very high	87	Confident	92 Å²	92	84.7 Å²	84.7	43%	0.43	41%	0.409	S	S	.	.			trans	-63.2	136.1	171.8	-166.6	152	-94.2	0	0	111.6	R539	E445-R539 IonicContact OE1-NH1 3.19Å; E445-R539 PolarHBondContact OE1-NH1 3.08Å
446	I	93.1	Very high	88.9	Confident	6 Å²	6	81.6 Å²	81.6	3%	0.031	38%	0.384	C	S	.	.			trans	-82.1	132.1	-178.9	-60.9	170.3	0	0	0	108	S448 E451 R452 Y455 R539 I540 Y543	I446-S448 VanDerWaalsContact CG2-O 3.32Å; I446-S448 WeakPolarHBondContact CG2-O 3.18Å; I446-E451 HydrophobicContact CG2-CB 3.99Å; I446-R452 HydrophobicContact CG2-CB 3.93Å; I446-Y455 HydrophobicContact CD1-CD2 3.64Å; I446-Y455 HydrophobicContact CD1-CE2 4.04Å; I446-Y455 HydrophobicContact CD1-CG 4.09Å; I446-Y455 HydrophobicContact CG1-CD2 3.74Å; I446-Y455 HydrophobicContact CG1-CE2 3.61Å; I446-Y455 HydrophobicContact CG1-CG 4.27Å; I446-R539 HydrophobicContact CD1-CB 4.08Å; I446-R539 HydrophobicContact CG1-CB 4.34Å; I446-I540 HydrophobicContact CD1-CB 4.46Å; I446-I540 HydrophobicContact CD1-CG1 3.96Å; I446-Y543 HydrophobicContact CB-CD2 3.96Å; I446-Y543 HydrophobicContact CB-CG 4.13Å; I446-Y543 HydrophobicContact CG2-CD1 4.32Å; I446-Y543 HydrophobicContact CG2-CD2 3.57Å; I446-Y543 HydrophobicContact CG2-CE2 3.94Å; I446-Y543 HydrophobicContact CG2-CG 3.77Å; I446-Y543 WeakPolarHBondContact O-CD2 3.37Å
447	R	87.9	Confident	90.3	Very high	207 Å²	207	79.8 Å²	79.8	78%	0.781	38%	0.384	S	S	*	.			trans	-118.4	-4.6	177.8	-64.7	-179.5	177.4	175.2	-1.6	113.4	E451	R447-E451 PolarHBondContact N-OE2 3.48Å
448	S	90	Very high	91	Very high	41 Å²	41	80.1 Å²	80.1	29%	0.287	38%	0.383	S	S	.	.	S	Bend	trans	-142.9	152.7	-175.7	63	0	0	0	0	113.4	I446 E450 E451 R452	I446-S448 VanDerWaalsContact CG2-O 3.32Å; I446-S448 WeakPolarHBondContact CG2-O 3.18Å; S448-E450 PolarHBondContact O-N 3.03Å; S448-E451 PolarHBondContact N-OE2 3.07Å; S448-E451 PolarHBondContact O-N 3.42Å; S448-E451 WeakPolarHBondContact OG-CB 3.36Å; S448-E451 WeakPolarHBondContact OG-CG 3.49Å; S448-E451 PolarHBondContact OG-N 3Å; S448-E451 PolarHBondContact OG-OE2 2.93Å; S448-R452 PolarHBondContact O-N 3.29Å
449	E	89.4	Confident	91.3	Very high	76 Å²	76	78.3 Å²	78.3	36%	0.355	37%	0.371	S	S	.	.	H	α-helix	trans	-60.8	-28.7	174.6	-166.5	66.2	-134.5	0	0	112	R452 K453 Y543	E449-R452 WeakPolarHBondContact O-CB 3.38Å; E449-R452 WeakPolarHBondContact OE1-CD 3.25Å; E449-R452 IonicContact OE1-CZ 2.98Å; E449-R452 IonicContact OE1-NE 3.55Å; E449-R452 IonicContact OE1-NH1 2.8Å; E449-R452 PolarHBondContact OE1-NH1 3.49Å; E449-K453 VanDerWaalsContact O-CG 3.29Å; E449-K453 WeakPolarHBondContact O-CG 3.47Å; E449-K453 PolarHBondContact O-N 2.86Å; E449-Y543 PolarHBondContact N-OH 2.98Å; E449-Y543 VanDerWaalsContact N-OH 3.15Å
450	E	90.6	Very high	91.6	Very high	158 Å²	158	80.7 Å²	80.7	74%	0.738	39%	0.387	S	S	*	.	H	α-helix	trans	-72.9	-46.7	178.8	-62.5	-178.3	-174.6	0	0	112	S448 R452 K453 K454	S448-E450 PolarHBondContact O-N 3.03Å; E450-R452 VanDerWaalsContact C-N 3.29Å; E450-R452 PolarHBondContact O-N 3.38Å; E450-K453 PolarHBondContact O-N 3.29Å; E450-K454 WeakPolarHBondContact O-CB 3.4Å; E450-K454 PolarHBondContact O-N 3.47Å
451	E	91.5	Very high	91.8	Very high	71 Å²	71	82 Å²	82	33%	0.332	40%	0.395	S	S	.	.	H	α-helix	trans	-59.6	-42	171.5	-74.8	170.8	141.1	0	0	111.1	I446 R447 S448 K453 K454 Y455	I446-E451 HydrophobicContact CG2-CB 3.99Å; R447-E451 PolarHBondContact N-OE2 3.48Å; S448-E451 PolarHBondContact N-OE2 3.07Å; S448-E451 PolarHBondContact O-N 3.42Å; S448-E451 WeakPolarHBondContact OG-CB 3.36Å; S448-E451 WeakPolarHBondContact OG-CG 3.49Å; S448-E451 PolarHBondContact OG-N 3Å; S448-E451 PolarHBondContact OG-OE2 2.93Å; E451-K453 PolarHBondContact O-N 3.11Å; E451-K454 WeakPolarHBondContact O-CB 3.4Å; E451-K454 PolarHBondContact O-N 3.39Å; E451-Y455 HydrophobicContact CB-CE1 4.48Å; E451-Y455 WeakPolarHBondContact O-CD1 3.4Å; E451-Y455 PolarHBondContact O-N 2.78Å
452	R	92.9	Very high	92	Very high	36 Å²	36	77.6 Å²	77.6	14%	0.136	37%	0.371	C	S	.	.	H	α-helix	trans	-57	-48.2	174.8	-171.1	-152.3	175.5	-142.7	2	112	I446 S448 E449 E450 K454 Y455 K456 I540 Y543 D544	I446-R452 HydrophobicContact CG2-CB 3.93Å; S448-R452 PolarHBondContact O-N 3.29Å; E449-R452 WeakPolarHBondContact O-CB 3.38Å; E449-R452 WeakPolarHBondContact OE1-CD 3.25Å; E449-R452 IonicContact OE1-CZ 2.98Å; E449-R452 IonicContact OE1-NE 3.55Å; E449-R452 IonicContact OE1-NH1 2.8Å; E449-R452 PolarHBondContact OE1-NH1 3.49Å; E450-R452 VanDerWaalsContact C-N 3.29Å; E450-R452 PolarHBondContact O-N 3.38Å; R452-K454 VanDerWaalsContact C-N 3.34Å; R452-K454 PolarHBondContact O-N 3.41Å; R452-Y455 PolarHBondContact O-N 3.32Å; R452-K456 WeakPolarHBondContact O-CB 3.48Å; R452-K456 PolarHBondContact O-N 3.3Å; R452-I540 HydrophobicContact CG-CG2 4.29Å; R452-Y543 HydrophobicContact CB-CD1 4.2Å; R452-Y543 HydrophobicContact CB-CE1 4.17Å; R452-Y543 HydrophobicContact CG-CD1 3.91Å; R452-Y543 HydrophobicContact CG-CE1 4.19Å; R452-D544 IonicContact CZ-OD1 3.82Å; R452-D544 IonicContact CZ-OD2 3.97Å; R452-D544 IonicContact NE-OD1 2.84Å; R452-D544 PolarHBondContact NE-OD1 3.48Å; R452-D544 IonicContact NE-OD2 3.78Å; R452-D544 VanDerWaalsContact NH2-CG 3.27Å; R452-D544 IonicContact NH2-OD1 3.75Å; R452-D544 PolarHBondContact NH2-OD1 3.44Å; R452-D544 IonicContact NH2-OD2 2.67Å; R452-D544 PolarHBondContact NH2-OD2 2.86Å
453	K	92	Very high	92.1	Very high	134 Å²	134	76.2 Å²	76.2	58%	0.583	36%	0.363	S	S	*	.	H	α-helix	trans	-60.2	-42.4	175.5	-74.6	167.5	-178	173.3	0	111.4	E449 E450 E451 K456 A457	E449-K453 VanDerWaalsContact O-CG 3.29Å; E449-K453 WeakPolarHBondContact O-CG 3.47Å; E449-K453 PolarHBondContact O-N 2.86Å; E450-K453 PolarHBondContact O-N 3.29Å; E451-K453 PolarHBondContact O-N 3.11Å; K453-K456 PolarHBondContact O-N 2.94Å; K453-A457 PolarHBondContact O-N 3Å
454	K	93.4	Very high	92.1	Very high	147 Å²	147	80.3 Å²	80.3	64%	0.639	39%	0.386	S	S	*	.	H	α-helix	trans	-62.9	-43.7	175.8	-173.2	176.8	-178	176.4	0	112.5	E450 E451 R452 A457 V458	E450-K454 WeakPolarHBondContact O-CB 3.4Å; E450-K454 PolarHBondContact O-N 3.47Å; E451-K454 WeakPolarHBondContact O-CB 3.4Å; E451-K454 PolarHBondContact O-N 3.39Å; R452-K454 VanDerWaalsContact C-N 3.34Å; R452-K454 PolarHBondContact O-N 3.41Å; K454-A457 PolarHBondContact O-N 3.28Å; K454-V458 WeakPolarHBondContact O-CG2 3.37Å; K454-V458 PolarHBondContact O-N 3.3Å
455	Y	93.4	Very high	92.1	Very high	14 Å²	14	80.9 Å²	80.9	6%	0.055	38%	0.383	C	S	.	.	H	α-helix	trans	-65.7	-39.7	177.6	-81	42.9	0	0	0	111	Y443 P444 I446 E451 R452 V458 F459 I536 R539	Y443-Y455 WeakPolarHBondContact CA-OH 3.46Å; Y443-Y455 HydrophobicContact CD1-CD1 4.19Å; Y443-Y455 HydrophobicContact CD1-CD2 4.13Å; Y443-Y455 HydrophobicContact CD1-CE1 4.07Å; Y443-Y455 AromaticContact CD1-CE2 3.99Å; Y443-Y455 HydrophobicContact CD1-CE2 3.99Å; Y443-Y455 HydrophobicContact CD1-CG 4.25Å; Y443-Y455 AromaticContact CD1-CZ 3.99Å; Y443-Y455 HydrophobicContact CG-CE2 4.36Å; P444-Y455 WeakPolarHBondContact CD-OH 3.48Å; P444-Y455 PolarHBondContact O-OH 2.88Å; P444-Y455 VanDerWaalsContact O-OH 3.11Å; I446-Y455 HydrophobicContact CD1-CD2 3.64Å; I446-Y455 HydrophobicContact CD1-CE2 4.04Å; I446-Y455 HydrophobicContact CD1-CG 4.09Å; I446-Y455 HydrophobicContact CG1-CD2 3.74Å; I446-Y455 HydrophobicContact CG1-CE2 3.61Å; I446-Y455 HydrophobicContact CG1-CG 4.27Å; E451-Y455 HydrophobicContact CB-CE1 4.48Å; E451-Y455 WeakPolarHBondContact O-CD1 3.4Å; E451-Y455 PolarHBondContact O-N 2.78Å; R452-Y455 PolarHBondContact O-N 3.32Å; Y455-V458 PolarHBondContact O-N 2.94Å; Y455-F459 WeakPolarHBondContact O-CB 3.45Å; Y455-F459 PolarHBondContact O-N 2.79Å; Y455-I536 HydrophobicContact CD2-CG2 4.27Å; Y455-I536 WeakPolarHBondContact O-CG2 3.4Å; Y455-R539 HydrophobicContact CD2-CB 4.22Å; Y455-R539 HydrophobicContact CE2-CB 4.18Å; Y455-R539 HydrophobicContact CE2-CG 4.5Å
456	K	93.1	Very high	92.2	Very high	74 Å²	74	78 Å²	78	32%	0.322	37%	0.368	S	S	.	.	H	α-helix	trans	-63.4	-41.2	174.4	-175.8	179.7	177.5	-176.6	0	112.2	R452 K453 F459 N460 I540	R452-K456 WeakPolarHBondContact O-CB 3.48Å; R452-K456 PolarHBondContact O-N 3.3Å; K453-K456 PolarHBondContact O-N 2.94Å; K456-F459 PolarHBondContact O-N 2.98Å; K456-N460 VanDerWaalsContact O-CG 3.3Å; K456-N460 PolarHBondContact O-N 3.46Å; K456-I540 HydrophobicContact CB-CD1 4.24Å
457	A	93.4	Very high	92.2	Very high	60 Å²	60	83.2 Å²	83.2	50%	0.496	39%	0.391	S	S	.	.	H	α-helix	trans	-62.2	-48.5	175.2	0	0	0	0	0	111.6	K453 K454 F459 N460 D461	K453-A457 PolarHBondContact O-N 3Å; K454-A457 PolarHBondContact O-N 3.28Å; A457-F459 VanDerWaalsContact C-N 3.33Å; A457-F459 PolarHBondContact O-N 3.16Å; A457-N460 PolarHBondContact O-N 2.99Å; A457-D461 PolarHBondContact O-N 2.95Å; A457-D461 VanDerWaalsContact O-N 3.08Å
458	V	93.9	Very high	92.4	Very high	35 Å²	35	77.8 Å²	77.8	21%	0.212	38%	0.377	C	S	.	.	H	α-helix	trans	-59.4	-41.8	174.8	171	0	0	0	0	111.9	Y443 K454 Y455 Q462 I536	Y443-V458 HydrophobicContact CE1-CB 4.46Å; Y443-V458 HydrophobicContact CE1-CG1 3.99Å; Y443-V458 HydrophobicContact CE1-CG2 4.39Å; Y443-V458 WeakPolarHBondContact OH-CG1 3.21Å; K454-V458 WeakPolarHBondContact O-CG2 3.37Å; K454-V458 PolarHBondContact O-N 3.3Å; Y455-V458 PolarHBondContact O-N 2.94Å; V458-Q462 HydrophobicContact CG1-CG 4.16Å; V458-Q462 VanDerWaalsContact O-CB 3.32Å; V458-Q462 WeakPolarHBondContact O-CB 3.43Å; V458-Q462 VanDerWaalsContact O-CG 3.23Å; V458-Q462 WeakPolarHBondContact O-CG 3.32Å; V458-Q462 PolarHBondContact O-N 3.28Å; V458-I536 HydrophobicContact CG1-CD1 3.9Å
459	F	93.9	Very high	92.6	Very high	42 Å²	42	77 Å²	77	18%	0.184	37%	0.37	C	S	.	.	H	α-helix	trans	-60.7	-47.2	177.3	-179.5	-86.3	0	0	0	111.1	Y455 K456 A457 Y463 L533 I536 K537	Y455-F459 WeakPolarHBondContact O-CB 3.45Å; Y455-F459 PolarHBondContact O-N 2.79Å; K456-F459 PolarHBondContact O-N 2.98Å; A457-F459 VanDerWaalsContact C-N 3.33Å; A457-F459 PolarHBondContact O-N 3.16Å; F459-Y463 HydrophobicContact CE1-CD2 4.36Å; F459-Y463 HydrophobicContact CE1-CG 4.33Å; F459-Y463 HydrophobicContact CZ-CD2 4.19Å; F459-Y463 WeakPolarHBondContact O-CB 3.16Å; F459-Y463 PolarHBondContact O-N 3.46Å; F459-L533 HydrophobicContact CD2-CB 4.28Å; F459-L533 HydrophobicContact CD2-CD2 3.58Å; F459-L533 HydrophobicContact CE2-CB 3.92Å; F459-L533 HydrophobicContact CE2-CD2 3.84Å; F459-L533 HydrophobicContact CE2-CG 4.47Å; F459-L533 WeakPolarHBondContact CE2-O 3.44Å; F459-L533 HydrophobicContact CG-CD2 4.12Å; F459-I536 HydrophobicContact CB-CG2 4.04Å; F459-I536 HydrophobicContact CD2-CG2 4.43Å; F459-K537 HydrophobicContact CD2-CB 4.27Å; F459-K537 HydrophobicContact CE2-CB 3.84Å
460	N	92.4	Very high	92.6	Very high	89 Å²	89	75 Å²	75	48%	0.476	36%	0.361	S	S	.	.	H	α-helix	trans	-63.7	-44.4	-178.2	-72.9	-13	0	0	0	112.6	K456 A457	K456-N460 VanDerWaalsContact O-CG 3.3Å; K456-N460 PolarHBondContact O-N 3.46Å; A457-N460 PolarHBondContact O-N 2.99Å
461	D	93	Very high	92.7	Very high	101 Å²	101	75.8 Å²	75.8	54%	0.54	36%	0.357	S	S	.	.	H	α-helix	trans	-58.6	-58.6	175.4	170.7	82.6	0	0	0	111.5	A457 Y463 L464	A457-D461 PolarHBondContact O-N 2.95Å; A457-D461 VanDerWaalsContact O-N 3.08Å; D461-Y463 PolarHBondContact O-N 3.31Å; D461-L464 PolarHBondContact O-N 3.1Å; D461-L464 VanDerWaalsContact O-N 3.15Å
462	Q	92.1	Very high	92.7	Very high	27 Å²	27	76.5 Å²	76.5	13%	0.126	36%	0.363	C	S	.	.	H	α-helix	trans	-69.8	-20.8	-174.8	-62.7	-75.3	-86.2	0	0	112.9	V458 E465 Y466 L533	V458-Q462 HydrophobicContact CG1-CG 4.16Å; V458-Q462 VanDerWaalsContact O-CB 3.32Å; V458-Q462 WeakPolarHBondContact O-CB 3.43Å; V458-Q462 VanDerWaalsContact O-CG 3.23Å; V458-Q462 WeakPolarHBondContact O-CG 3.32Å; V458-Q462 PolarHBondContact O-N 3.28Å; Q462-E465 PolarHBondContact NE2-OE2 3.41Å; Q462-Y466 WeakPolarHBondContact O-CB 3.29Å; Q462-Y466 PolarHBondContact O-N 2.9Å; Q462-L533 HydrophobicContact CB-CD2 3.91Å
463	Y	92.3	Very high	92.7	Very high	109 Å²	109	75.5 Å²	75.5	43%	0.427	36%	0.36	S	S	.	.	H	α-helix	trans	-71	-29.4	175.1	-178.6	-102.4	0	0	0	112.7	F459 D461 Y466 K467 L533	F459-Y463 HydrophobicContact CE1-CD2 4.36Å; F459-Y463 HydrophobicContact CE1-CG 4.33Å; F459-Y463 HydrophobicContact CZ-CD2 4.19Å; F459-Y463 WeakPolarHBondContact O-CB 3.16Å; F459-Y463 PolarHBondContact O-N 3.46Å; D461-Y463 PolarHBondContact O-N 3.31Å; Y463-Y466 HydrophobicContact CD2-CD1 4.26Å; Y463-Y466 HydrophobicContact CE2-CD1 4.28Å; Y463-K467 VanDerWaalsContact O-CB 3.26Å; Y463-K467 WeakPolarHBondContact O-CB 3.43Å; Y463-K467 PolarHBondContact O-N 2.89Å; Y463-L533 HydrophobicContact CD2-CD1 4.32Å
464	L	92.3	Very high	92.5	Very high	106 Å²	106	72.3 Å²	72.3	56%	0.555	35%	0.349	S	S	*	.	H	α-helix	trans	-67.2	-49.4	173.5	-64.8	174.4	0	0	0	110.5	D461 Y466 K467 D468	D461-L464 PolarHBondContact O-N 3.1Å; D461-L464 VanDerWaalsContact O-N 3.15Å; L464-Y466 VanDerWaalsContact C-N 3.33Å; L464-Y466 PolarHBondContact O-N 3.48Å; L464-K467 PolarHBondContact O-N 3.01Å; L464-K467 VanDerWaalsContact O-N 3.12Å; L464-D468 PolarHBondContact O-N 3.24Å; L464-D468 VanDerWaalsContact O-N 3.14Å
465	E	91.9	Very high	92.4	Very high	73 Å²	73	68.1 Å²	68.1	34%	0.341	34%	0.335	S	S	.	.	H	α-helix	trans	-54.3	-48.6	174.2	-170.1	-166.5	159	0	0	111.2	Q462 K467 L469 R525 L529	Q462-E465 PolarHBondContact NE2-OE2 3.41Å; E465-K467 PolarHBondContact O-N 3.22Å; E465-L469 VanDerWaalsContact O-CB 3.24Å; E465-L469 WeakPolarHBondContact O-CB 3.39Å; E465-L469 PolarHBondContact O-N 3.39Å; E465-R525 IonicContact OE1-CZ 3.61Å; E465-R525 IonicContact OE1-NE 2.98Å; E465-R525 PolarHBondContact OE1-NE 3.22Å; E465-R525 IonicContact OE1-NH2 2.79Å; E465-R525 PolarHBondContact OE1-NH2 3.09Å; E465-R525 IonicContact OE2-NH2 2.81Å; E465-R525 PolarHBondContact OE2-NH2 2.83Å; E465-L529 HydrophobicContact CB-CD1 4.4Å; E465-L529 HydrophobicContact CG-CD1 3.96Å
466	Y	93.4	Very high	92.2	Very high	31 Å²	31	69.6 Å²	69.6	12%	0.122	35%	0.346	C	S	.	.	H	α-helix	trans	-59.2	-44.4	176.7	170.6	-101.6	0	0	0	112.7	Q462 Y463 L464 H470 L529 K530 L533	Q462-Y466 WeakPolarHBondContact O-CB 3.29Å; Q462-Y466 PolarHBondContact O-N 2.9Å; Y463-Y466 HydrophobicContact CD2-CD1 4.26Å; Y463-Y466 HydrophobicContact CE2-CD1 4.28Å; L464-Y466 VanDerWaalsContact C-N 3.33Å; L464-Y466 PolarHBondContact O-N 3.48Å; Y466-H470 HydrophobicContact CE1-CB 4.49Å; Y466-H470 HydrophobicContact CE2-CB 4.32Å; Y466-H470 AromaticContact CZ-CD2 3.91Å; Y466-H470 WeakPolarHBondContact O-CB 3.5Å; Y466-H470 PolarHBondContact O-N 3.48Å; Y466-H470 PolarHBondContact OH-CD2 2.9Å; Y466-L529 HydrophobicContact CD2-CB 4.01Å; Y466-K530 HydrophobicContact CD2-CB 4.34Å; Y466-K530 HydrophobicContact CE2-CB 3.68Å; Y466-K530 HydrophobicContact CE2-CD 4.45Å; Y466-K530 HydrophobicContact CE2-CG 4.14Å; Y466-L533 VanDerWaalsContact CB-CD1 3.49Å; Y466-L533 HydrophobicContact CD1-CD1 4.16Å; Y466-L533 HydrophobicContact CD2-CD1 4.45Å; Y466-L533 HydrophobicContact CG-CD1 3.77Å
467	K	92.9	Very high	91.9	Very high	117 Å²	117	70.1 Å²	70.1	51%	0.509	35%	0.352	S	S	.	.	H	α-helix	trans	-63.2	-44.9	-175.9	-179.6	-172.4	173.7	-165.5	0	111.8	Y463 L464 E465 R471	Y463-K467 VanDerWaalsContact O-CB 3.26Å; Y463-K467 WeakPolarHBondContact O-CB 3.43Å; Y463-K467 PolarHBondContact O-N 2.89Å; L464-K467 PolarHBondContact O-N 3.01Å; L464-K467 VanDerWaalsContact O-N 3.12Å; E465-K467 PolarHBondContact O-N 3.22Å; K467-R471 PolarHBondContact O-N 2.98Å; K467-R471 VanDerWaalsContact O-N 3.08Å
468	D	92.9	Very high	91.7	Very high	92 Å²	92	70.5 Å²	70.5	49%	0.492	35%	0.346	S	S	.	.	H	α-helix	trans	-73.6	-42.7	-178.7	-68.4	-24.2	0	0	0	111	L464 H470 R471 D472	L464-D468 PolarHBondContact O-N 3.24Å; L464-D468 VanDerWaalsContact O-N 3.14Å; D468-H470 VanDerWaalsContact C-N 3.34Å; D468-H470 PolarHBondContact O-N 3.22Å; D468-R471 WeakPolarHBondContact O-CB 3.42Å; D468-R471 PolarHBondContact O-N 3.08Å; D468-R471 VanDerWaalsContact O-N 3.15Å; D468-D472 PolarHBondContact O-N 3.31Å
469	L	93.1	Very high	91.4	Very high	26 Å²	26	74.6 Å²	74.6	14%	0.136	36%	0.361	C	S	.	.	H	α-helix	trans	-61.5	-41.1	174.8	-173	63.5	0	0	0	112.3	E465 R471 D472 I473 K522 R525 C526 L529	E465-L469 VanDerWaalsContact O-CB 3.24Å; E465-L469 WeakPolarHBondContact O-CB 3.39Å; E465-L469 PolarHBondContact O-N 3.39Å; L469-R471 VanDerWaalsContact C-N 3.35Å; L469-R471 PolarHBondContact O-N 3.18Å; L469-D472 PolarHBondContact O-N 2.87Å; L469-I473 HydrophobicContact CD1-CD1 4.46Å; L469-I473 HydrophobicContact CG-CD1 4.03Å; L469-I473 WeakPolarHBondContact O-CD1 3.33Å; L469-I473 WeakPolarHBondContact O-CG1 3.47Å; L469-I473 PolarHBondContact O-N 3.35Å; L469-K522 HydrophobicContact CD1-CB 4.03Å; L469-K522 HydrophobicContact CD1-CD 4.49Å; L469-K522 HydrophobicContact CD1-CG 4.1Å; L469-R525 HydrophobicContact CD2-CB 4.02Å; L469-R525 HydrophobicContact CD2-CG 3.63Å; L469-C526 HydrophobicContact CD2-CB 3.8Å; L469-C526 HydrophobicContact CG-CB 4.04Å; L469-L529 HydrophobicContact CD2-CD1 4.14Å
470	H	90.3	Very high	91.1	Very high	33 Å²	33	74 Å²	74	15%	0.153	36%	0.358	C	S	.	.	H	α-helix	trans	-65.7	-35.1	175.8	-177.9	-100.8	0	0	0	112.3	Y466 D468 I473 I474	Y466-H470 HydrophobicContact CE1-CB 4.49Å; Y466-H470 HydrophobicContact CE2-CB 4.32Å; Y466-H470 AromaticContact CZ-CD2 3.91Å; Y466-H470 WeakPolarHBondContact O-CB 3.5Å; Y466-H470 PolarHBondContact O-N 3.48Å; Y466-H470 PolarHBondContact OH-CD2 2.9Å; D468-H470 VanDerWaalsContact C-N 3.34Å; D468-H470 PolarHBondContact O-N 3.22Å; H470-I473 PolarHBondContact O-N 3.47Å; H470-I474 WeakPolarHBondContact CE1-CD1 3.49Å; H470-I474 WeakPolarHBondContact O-CG1 3.38Å; H470-I474 PolarHBondContact O-N 2.91Å
471	R	93.3	Very high	90.8	Very high	174 Å²	174	77.4 Å²	77.4	66%	0.657	36%	0.364	S	S	*	.	H	α-helix	trans	-63.5	-42.5	172.9	-179.7	-173.4	179.8	-174.9	-1.4	111.7	K467 D468 L469 T475	K467-R471 PolarHBondContact O-N 2.98Å; K467-R471 VanDerWaalsContact O-N 3.08Å; D468-R471 WeakPolarHBondContact O-CB 3.42Å; D468-R471 PolarHBondContact O-N 3.08Å; D468-R471 VanDerWaalsContact O-N 3.15Å; L469-R471 VanDerWaalsContact C-N 3.35Å; L469-R471 PolarHBondContact O-N 3.18Å; R471-T475 WeakPolarHBondContact O-CB 3.49Å; R471-T475 PolarHBondContact O-N 3.33Å; R471-T475 PolarHBondContact O-OG1 2.87Å
472	D	91.3	Very high	90.5	Very high	87 Å²	87	77.9 Å²	77.9	47%	0.465	36%	0.363	S	S	.	.	H	α-helix	trans	-67	-40.9	177.8	-79.7	1	0	0	0	111.9	D468 L469 T475 T476	D468-D472 PolarHBondContact O-N 3.31Å; L469-D472 PolarHBondContact O-N 2.87Å; D472-T475 PolarHBondContact O-N 3.38Å; D472-T476 PolarHBondContact O-N 2.96Å; D472-T476 PolarHBondContact O-OG1 3.12Å
473	I	91.6	Very high	90.1	Very high	15 Å²	15	80 Å²	80	8%	0.077	38%	0.375	C	S	.	.	H	α-helix	trans	-65	-43.1	176.1	-69.9	159.5	0	0	0	111.5	L469 H470 T475 T476 L477 C526	L469-I473 HydrophobicContact CD1-CD1 4.46Å; L469-I473 HydrophobicContact CG-CD1 4.03Å; L469-I473 WeakPolarHBondContact O-CD1 3.33Å; L469-I473 WeakPolarHBondContact O-CG1 3.47Å; L469-I473 PolarHBondContact O-N 3.35Å; H470-I473 PolarHBondContact O-N 3.47Å; I473-T475 VanDerWaalsContact C-N 3.33Å; I473-T475 PolarHBondContact O-N 3.29Å; I473-T476 WeakPolarHBondContact CA-OG1 3.03Å; I473-T476 PolarHBondContact O-N 3.02Å; I473-T476 PolarHBondContact O-OG1 3.36Å; I473-L477 HydrophobicContact CG2-CD1 3.76Å; I473-L477 HydrophobicContact CG2-CG 4.27Å; I473-L477 VanDerWaalsContact O-CB 3.3Å; I473-L477 WeakPolarHBondContact O-CB 3.47Å; I473-L477 VanDerWaalsContact O-CG 3.23Å; I473-L477 WeakPolarHBondContact O-CG 3.37Å; I473-L477 PolarHBondContact O-N 3.37Å; I473-C526 HydrophobicContact CD1-CB 3.17Å
474	I	89.3	Confident	89.8	Confident	66 Å²	66	77.2 Å²	77.2	34%	0.338	37%	0.367	S	S	.	.	H	α-helix	trans	-63.1	-42.1	174.4	-73.6	175.7	0	0	0	110.9	H470 T476 L477 N478	H470-I474 WeakPolarHBondContact CE1-CD1 3.49Å; H470-I474 WeakPolarHBondContact O-CG1 3.38Å; H470-I474 PolarHBondContact O-N 2.91Å; I474-T476 PolarHBondContact O-N 2.91Å; I474-L477 PolarHBondContact O-N 3.29Å; I474-N478 WeakPolarHBondContact CG2-ND2 3.46Å; I474-N478 WeakPolarHBondContact O-CB 3.36Å; I474-N478 PolarHBondContact O-N 3.36Å; I474-N478 PolarHBondContact O-ND2 3.29Å
475	T	91.4	Very high	89.5	Confident	59 Å²	59	75.5 Å²	75.5	36%	0.362	36%	0.361	S	S	.	.	H	α-helix	trans	-61.3	-44.6	178.3	-59.8	0	0	0	0	112.1	R471 D472 I473 K479	R471-T475 WeakPolarHBondContact O-CB 3.49Å; R471-T475 PolarHBondContact O-N 3.33Å; R471-T475 PolarHBondContact O-OG1 2.87Å; D472-T475 PolarHBondContact O-N 3.38Å; I473-T475 VanDerWaalsContact C-N 3.33Å; I473-T475 PolarHBondContact O-N 3.29Å; T475-K479 WeakPolarHBondContact O-CG 3.32Å; T475-K479 PolarHBondContact O-N 2.89Å
476	T	87.8	Confident	89.1	Confident	45 Å²	45	76.5 Å²	76.5	28%	0.276	37%	0.367	S	S	.	.	H	α-helix	trans	-70.4	-42.8	178.1	43.7	0	0	0	0	112.2	D472 I473 I474 N478 K479 F480 F519	D472-T476 PolarHBondContact O-N 2.96Å; D472-T476 PolarHBondContact O-OG1 3.12Å; I473-T476 WeakPolarHBondContact CA-OG1 3.03Å; I473-T476 PolarHBondContact O-N 3.02Å; I473-T476 PolarHBondContact O-OG1 3.36Å; I474-T476 PolarHBondContact O-N 2.91Å; T476-N478 VanDerWaalsContact C-N 3.32Å; T476-N478 PolarHBondContact O-N 2.93Å; T476-K479 WeakPolarHBondContact O-CB 3.33Å; T476-K479 PolarHBondContact O-N 2.96Å; T476-F480 WeakPolarHBondContact O-CD2 3.22Å; T476-F480 PolarHBondContact O-N 2.86Å; T476-F519 VanDerWaalsContact OG1-CE2 3.28Å; T476-F519 WeakPolarHBondContact OG1-CE2 3.33Å
477	L	88.3	Confident	88.5	Confident	86 Å²	86	76.4 Å²	76.4	45%	0.45	37%	0.37	S	S	.	.	H	α-helix	trans	-60.2	-38	173.2	-73.2	173.5	0	0	0	113	I473 I474 F480 R481 F519	I473-L477 HydrophobicContact CG2-CD1 3.76Å; I473-L477 HydrophobicContact CG2-CG 4.27Å; I473-L477 VanDerWaalsContact O-CB 3.3Å; I473-L477 WeakPolarHBondContact O-CB 3.47Å; I473-L477 VanDerWaalsContact O-CG 3.23Å; I473-L477 WeakPolarHBondContact O-CG 3.37Å; I473-L477 PolarHBondContact O-N 3.37Å; I474-L477 PolarHBondContact O-N 3.29Å; L477-F480 PolarHBondContact O-N 3.26Å; L477-R481 PolarHBondContact O-N 2.86Å; L477-F519 HydrophobicContact CD2-CZ 3.9Å; L477-F519 HydrophobicContact CG-CZ 4.18Å
478	N	88	Confident	87.9	Confident	67 Å²	67	77.2 Å²	77.2	36%	0.358	38%	0.38	S	S	.	.	H	α-helix	trans	-65	-41.4	175.3	-79.8	-36.4	0	0	0	112	I474 T476 R481 E482	I474-N478 WeakPolarHBondContact CG2-ND2 3.46Å; I474-N478 WeakPolarHBondContact O-CB 3.36Å; I474-N478 PolarHBondContact O-N 3.36Å; I474-N478 PolarHBondContact O-ND2 3.29Å; T476-N478 VanDerWaalsContact C-N 3.32Å; T476-N478 PolarHBondContact O-N 2.93Å; N478-R481 WeakPolarHBondContact O-CB 3.43Å; N478-R481 PolarHBondContact O-N 3Å; N478-R481 PolarHBondContact OD1-NH2 3.48Å; N478-E482 PolarHBondContact O-N 2.96Å
479	K	88.8	Confident	87.3	Confident	122 Å²	122	80.2 Å²	80.2	53%	0.53	39%	0.391	S	S	.	.	H	α-helix	trans	-61.9	-42.6	172.7	-69	172.2	-179	-178.8	0	111.6	T475 T476 R481 E482 L483	T475-K479 WeakPolarHBondContact O-CG 3.32Å; T475-K479 PolarHBondContact O-N 2.89Å; T476-K479 WeakPolarHBondContact O-CB 3.33Å; T476-K479 PolarHBondContact O-N 2.96Å; K479-R481 VanDerWaalsContact C-N 3.31Å; K479-R481 PolarHBondContact O-N 3.39Å; K479-E482 PolarHBondContact O-N 3.48Å; K479-L483 WeakPolarHBondContact O-CB 3.38Å; K479-L483 WeakPolarHBondContact O-CG 3.27Å; K479-L483 PolarHBondContact O-N 2.88Å
480	F	87.6	Confident	86.5	Confident	28 Å²	28	82 Å²	82	12%	0.123	40%	0.4	C	S	.	.	H	α-helix	trans	-63.4	-36.1	175.7	-69.9	-52.2	0	0	0	112.8	T476 L477 D484 Y510 K513 K514 F519	T476-F480 WeakPolarHBondContact O-CD2 3.22Å; T476-F480 PolarHBondContact O-N 2.86Å; L477-F480 PolarHBondContact O-N 3.26Å; F480-D484 WeakPolarHBondContact O-CB 3.44Å; F480-D484 PolarHBondContact O-N 3.12Å; F480-Y510 HydrophobicContact CD1-CE2 4.25Å; F480-Y510 PolarHBondContact O-OH 3.5Å; F480-K513 HydrophobicContact CE1-CB 4.38Å; F480-K513 WeakPolarHBondContact CE1-O 3.33Å; F480-K513 VanDerWaalsContact CZ-O 3.26Å; F480-K513 WeakPolarHBondContact CZ-O 3.3Å; F480-K514 HydrophobicContact CE1-CB 4.49Å; F480-F519 HydrophobicContact CD2-CE1 4.47Å; F480-F519 HydrophobicContact CD2-CZ 4.44Å; F480-F519 HydrophobicContact CE2-CD1 4.04Å; F480-F519 HydrophobicContact CE2-CD2 4.45Å; F480-F519 AromaticContact CE2-CE1 3.86Å; F480-F519 HydrophobicContact CE2-CE1 3.86Å; F480-F519 HydrophobicContact CE2-CE2 4.3Å; F480-F519 HydrophobicContact CE2-CG 4.33Å; F480-F519 HydrophobicContact CE2-CZ 4Å
481	R	85.5	Confident	85.6	Confident	161 Å²	161	84.4 Å²	84.4	61%	0.608	42%	0.419	S	S	*	.	H	α-helix	trans	-66.3	-41.9	175.1	-175.8	-175.8	67.8	-166.4	-2.9	112.1	L477 N478 K479 D484 T485	L477-R481 PolarHBondContact O-N 2.86Å; N478-R481 WeakPolarHBondContact O-CB 3.43Å; N478-R481 PolarHBondContact O-N 3Å; N478-R481 PolarHBondContact OD1-NH2 3.48Å; K479-R481 VanDerWaalsContact C-N 3.31Å; K479-R481 PolarHBondContact O-N 3.39Å; R481-D484 PolarHBondContact O-N 3.33Å; R481-T485 PolarHBondContact O-N 3.5Å; R481-T485 VanDerWaalsContact O-N 3.1Å
482	E	87.3	Confident	84.2	Confident	112 Å²	112	88.4 Å²	88.4	52%	0.523	43%	0.434	S	S	.	.	H	α-helix	trans	-61.6	-48.3	174.8	-173.6	-179.9	172.6	0	0	110.9	N478 K479 D484 T485 M486	N478-E482 PolarHBondContact O-N 2.96Å; K479-E482 PolarHBondContact O-N 3.48Å; E482-D484 PolarHBondContact O-N 3.23Å; E482-T485 PolarHBondContact O-N 3.27Å; E482-T485 PolarHBondContact O-OG1 3.43Å; E482-M486 HydrophobicContact CG-CE 4.08Å; E482-M486 PolarHBondContact O-N 3.45Å; E482-M486 VanDerWaalsContact O-N 3.1Å
483	L	83.6	Confident	82.6	Confident	70 Å²	70	92.4 Å²	92.4	37%	0.366	45%	0.447	S	S	.	.	H	α-helix	trans	-62.2	-38.9	175.1	-69.7	170.6	0	0	0	112.7	K479 T485 M486 V487 Y510	K479-L483 WeakPolarHBondContact O-CB 3.38Å; K479-L483 WeakPolarHBondContact O-CG 3.27Å; K479-L483 PolarHBondContact O-N 2.88Å; L483-T485 VanDerWaalsContact C-N 3.26Å; L483-T485 PolarHBondContact O-N 3.41Å; L483-M486 HydrophobicContact CD2-SD 4.37Å; L483-M486 PolarHBondContact O-N 3.33Å; L483-V487 WeakPolarHBondContact O-CB 3.44Å; L483-V487 WeakPolarHBondContact O-CG2 3.45Å; L483-V487 PolarHBondContact O-N 2.91Å; L483-Y510 HydrophobicContact CB-CD2 3.85Å; L483-Y510 HydrophobicContact CB-CE2 3.45Å; L483-Y510 VanDerWaalsContact CB-CE2 3.45Å; L483-Y510 HydrophobicContact CD1-CD2 4.19Å; L483-Y510 HydrophobicContact CD1-CE2 4.12Å; L483-Y510 HydrophobicContact CG-CE2 4.43Å
484	D	85.4	Confident	81	Confident	51 Å²	51	92.5 Å²	92.5	27%	0.273	45%	0.452	S	S	.	.	H	α-helix	trans	-57.6	-38.9	171.6	-87.9	-44.8	0	0	0	110.4	F480 R481 E482 N488 Y510 K514	F480-D484 WeakPolarHBondContact O-CB 3.44Å; F480-D484 PolarHBondContact O-N 3.12Å; R481-D484 PolarHBondContact O-N 3.33Å; E482-D484 PolarHBondContact O-N 3.23Å; D484-N488 WeakPolarHBondContact O-CB 3.31Å; D484-N488 VanDerWaalsContact O-CG 3.27Å; D484-N488 PolarHBondContact O-N 3.01Å; D484-N488 PolarHBondContact O-ND2 3.25Å; D484-Y510 PolarHBondContact OD1-OH 2.95Å; D484-Y510 PolarHBondContact OD2-OH 3.41Å; D484-Y510 VanDerWaalsContact OD2-OH 3.1Å; D484-K514 VanDerWaalsContact CG-NZ 3.29Å; D484-K514 IonicContact OD1-NZ 3.26Å; D484-K514 PolarHBondContact OD1-NZ 3.23Å; D484-K514 IonicContact OD2-NZ 2.72Å; D484-K514 PolarHBondContact OD2-NZ 3.21Å
485	T	86.6	Confident	80	Confident	70 Å²	70	99.7 Å²	99.7	43%	0.429	48%	0.481	S	S	.	.	H	α-helix	trans	-68.4	-40	176.3	63.1	0	0	0	0	113.1	R481 E482 L483 N488 Q489	R481-T485 PolarHBondContact O-N 3.5Å; R481-T485 VanDerWaalsContact O-N 3.1Å; E482-T485 PolarHBondContact O-N 3.27Å; E482-T485 PolarHBondContact O-OG1 3.43Å; L483-T485 VanDerWaalsContact C-N 3.26Å; L483-T485 PolarHBondContact O-N 3.41Å; T485-N488 PolarHBondContact O-N 2.97Å; T485-Q489 WeakPolarHBondContact O-CG 3.33Å; T485-Q489 PolarHBondContact O-N 2.94Å
486	M	82.3	Confident	79.4	Confident	95 Å²	95	99.6 Å²	99.6	47%	0.468	48%	0.482	S	S	.	.	H	α-helix	trans	-65.3	-43.9	175.5	-63.5	178.7	177.8	0	0	111.4	E482 L483 N488 Q489 L490	E482-M486 HydrophobicContact CG-CE 4.08Å; E482-M486 PolarHBondContact O-N 3.45Å; E482-M486 VanDerWaalsContact O-N 3.1Å; L483-M486 HydrophobicContact CD2-SD 4.37Å; L483-M486 PolarHBondContact O-N 3.33Å; M486-N488 VanDerWaalsContact C-N 3.32Å; M486-N488 PolarHBondContact O-N 3.33Å; M486-Q489 PolarHBondContact O-N 3.31Å; M486-Q489 VanDerWaalsContact O-N 3.09Å; M486-L490 PolarHBondContact O-N 3.33Å
487	V	81.9	Confident	78.9	Confident	29 Å²	29	103.8 Å²	103.8	18%	0.176	50%	0.503	C	S	.	.	H	α-helix	trans	-58.8	-40.8	175.4	163.3	0	0	0	0	111.9	L483 Q489 L490 L507 Y510	L483-V487 WeakPolarHBondContact O-CB 3.44Å; L483-V487 WeakPolarHBondContact O-CG2 3.45Å; L483-V487 PolarHBondContact O-N 2.91Å; V487-Q489 VanDerWaalsContact C-N 3.28Å; V487-Q489 PolarHBondContact O-N 3.44Å; V487-L490 PolarHBondContact O-N 3.25Å; V487-L507 HydrophobicContact CG1-CD2 3.49Å; V487-L507 VanDerWaalsContact CG1-CD2 3.49Å; V487-L507 HydrophobicContact CG2-CD2 4.41Å; V487-Y510 HydrophobicContact CG2-CD1 4.35Å; V487-Y510 HydrophobicContact CG2-CD2 4.49Å; V487-Y510 HydrophobicContact CG2-CG 4.19Å
488	N	79.5	Confident	78.5	Confident	133 Å²	133	104.9 Å²	104.9	71%	0.711	51%	0.505	S	S	*	.	H	α-helix	trans	-73.2	-17.3	177.5	-73.7	-50.8	0	0	0	113.9	D484 T485 M486	D484-N488 WeakPolarHBondContact O-CB 3.31Å; D484-N488 VanDerWaalsContact O-CG 3.27Å; D484-N488 PolarHBondContact O-N 3.01Å; D484-N488 PolarHBondContact O-ND2 3.25Å; T485-N488 PolarHBondContact O-N 2.97Å; M486-N488 VanDerWaalsContact C-N 3.32Å; M486-N488 PolarHBondContact O-N 3.33Å
489	Q	80.2	Confident	78	Confident	155 Å²	155	104.4 Å²	104.4	72%	0.724	50%	0.503	S	S	*	.	H	α-helix	trans	-89	-15.3	174.9	-70.2	172.1	21.8	0	0	113.1	T485 M486 V487	T485-Q489 WeakPolarHBondContact O-CG 3.33Å; T485-Q489 PolarHBondContact O-N 2.94Å; M486-Q489 PolarHBondContact O-N 3.31Å; M486-Q489 VanDerWaalsContact O-N 3.09Å; V487-Q489 VanDerWaalsContact C-N 3.28Å; V487-Q489 PolarHBondContact O-N 3.44Å
490	L	77	Confident	77.5	Confident	63 Å²	63	102.4 Å²	102.4	33%	0.33	50%	0.495	S	S	.	.	S	Bend	trans	-67.6	134.1	177.4	-88.2	143.4	0	0	0	111.4	M486 V487 R492 I503 I506	M486-L490 PolarHBondContact O-N 3.33Å; V487-L490 PolarHBondContact O-N 3.25Å; L490-R492 PolarHBondContact O-N 2.86Å; L490-I503 HydrophobicContact CD2-CG1 4.12Å; L490-I506 HydrophobicContact CD1-CG2 4.46Å
491	P	71.9	Confident	77.2	Confident	84 Å²	84	106.8 Å²	106.8	55%	0.545	52%	0.516	S	S	.	.			trans	-59.6	123.7	178.7	-24.7	34.2	0	0	0	112.1	K493	P491-K493 PolarHBondContact O-N 3.44Å
492	R	63.3	Low	77	Confident	258 Å²	258	105.5 Å²	105.5	97%	0.974	51%	0.511	S	S	*	.	S	Bend	trans	-64.6	-10.4	-178.3	-158.7	175.3	-173.1	-176.8	2.9	114.4	L490	L490-R492 PolarHBondContact O-N 2.86Å
493	K	56.5	Low	76.8	Confident	171 Å²	171	101.5 Å²	101.5	74%	0.743	49%	0.494	S	S	*	.	S	Bend	trans	-139.1	114	175.5	-161.6	174.1	-174.7	-179	0	108	P491	P491-K493 PolarHBondContact O-N 3.44Å
494	G	59.8	Low	76.8	Confident	18 Å²	18	103.4 Å²	103.4	19%	0.186	50%	0.5	C	S	.	.			trans	-64.7	153.9	173.5	0	0	0	0	0	111	S496	G494-S496 VanDerWaalsContact C-N 3.34Å
495	K	67.9	Low	76.8	Confident	216 Å²	216	106 Å²	106	94%	0.939	51%	0.514	S	S	*	.	S	Bend	trans	-77.6	-24.2	174.6	-65.8	-178.2	-178.6	178.4	0	112
496	S	78.2	Confident	76.7	Confident	57 Å²	57	106.7 Å²	106.7	40%	0.399	51%	0.514	S	S	.	.	S	Bend	trans	-122.5	157.6	175.3	-179.5	0	0	0	0	111.5	G494 E498 D499 Q500	G494-S496 VanDerWaalsContact C-N 3.34Å; S496-E498 VanDerWaalsContact C-N 3.3Å; S496-E498 PolarHBondContact O-N 2.91Å; S496-D499 PolarHBondContact O-N 2.77Å; S496-Q500 PolarHBondContact O-N 3.33Å; S496-Q500 VanDerWaalsContact O-N 3.1Å
497	L	78.1	Confident	76.8	Confident	134 Å²	134	105 Å²	105	70%	0.702	51%	0.507	S	S	*	.	H	α-helix	trans	-59.4	-39.4	173.2	-81.5	166.8	0	0	0	112	Q500 Q501	L497-Q500 PolarHBondContact O-N 3.47Å; L497-Q501 WeakPolarHBondContact O-CG 3.3Å; L497-Q501 PolarHBondContact O-N 3.32Å
498	E	79.2	Confident	77	Confident	108 Å²	108	109.6 Å²	109.6	51%	0.505	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-42.8	176.3	-66.5	-176.7	-165	0	0	112	S496 Q500 Q501 R502	S496-E498 VanDerWaalsContact C-N 3.3Å; S496-E498 PolarHBondContact O-N 2.91Å; E498-Q500 VanDerWaalsContact C-N 3.31Å; E498-Q500 PolarHBondContact O-N 3.45Å; E498-Q501 PolarHBondContact O-N 3.43Å; E498-R502 WeakPolarHBondContact O-CG 3.39Å; E498-R502 PolarHBondContact O-N 3.27Å; E498-R502 IonicContact OE2-CZ 3.22Å; E498-R502 IonicContact OE2-NH1 2.93Å; E498-R502 IonicContact OE2-NH2 2.88Å; E498-R502 PolarHBondContact OE2-NH2 3.32Å
499	D	77.2	Confident	77.2	Confident	57 Å²	57	106.6 Å²	106.6	31%	0.305	51%	0.511	S	S	.	.	H	α-helix	trans	-65.7	-38	178.6	-62.7	-30.6	0	0	0	110.9	S496 R502 I503	S496-D499 PolarHBondContact O-N 2.77Å; D499-R502 PolarHBondContact O-N 3.07Å; D499-R502 IonicContact OD1-NH1 2.8Å; D499-R502 PolarHBondContact OD1-NH1 2.84Å; D499-I503 WeakPolarHBondContact O-CB 3.44Å; D499-I503 WeakPolarHBondContact O-CD1 3.36Å; D499-I503 WeakPolarHBondContact O-CG1 3.38Å; D499-I503 PolarHBondContact O-N 3.38Å
500	Q	77.9	Confident	77.4	Confident	80 Å²	80	100.2 Å²	100.2	37%	0.374	48%	0.481	S	S	.	.	H	α-helix	trans	-62.6	-42.2	174.4	-170.1	178.1	-66.4	0	0	111.6	S496 L497 E498 I503 Q504	S496-Q500 PolarHBondContact O-N 3.33Å; S496-Q500 VanDerWaalsContact O-N 3.1Å; L497-Q500 PolarHBondContact O-N 3.47Å; E498-Q500 VanDerWaalsContact C-N 3.31Å; E498-Q500 PolarHBondContact O-N 3.45Å; Q500-I503 PolarHBondContact O-N 2.96Å; Q500-Q504 WeakPolarHBondContact O-CB 3.32Å; Q500-Q504 WeakPolarHBondContact O-CG 3.48Å; Q500-Q504 PolarHBondContact O-N 2.97Å
501	Q	82.6	Confident	77.7	Confident	121 Å²	121	102.7 Å²	102.7	57%	0.565	49%	0.491	S	S	*	.	H	α-helix	trans	-64.9	-42.7	174.8	-71.9	177.8	-10.6	0	0	112.1	L497 E498 Q504 N505	L497-Q501 WeakPolarHBondContact O-CG 3.3Å; L497-Q501 PolarHBondContact O-N 3.32Å; E498-Q501 PolarHBondContact O-N 3.43Å; Q501-Q504 PolarHBondContact O-N 2.86Å; Q501-N505 WeakPolarHBondContact O-CB 3.44Å; Q501-N505 PolarHBondContact O-N 2.66Å
502	R	81.4	Confident	78.4	Confident	133 Å²	133	103 Å²	103	50%	0.502	49%	0.488	S	S	.	.	H	α-helix	trans	-58.7	-48	174.3	-71.3	171.3	-173.5	133.8	9.5	111.3	E498 D499 Q504 N505 I506	E498-R502 WeakPolarHBondContact O-CG 3.39Å; E498-R502 PolarHBondContact O-N 3.27Å; E498-R502 IonicContact OE2-CZ 3.22Å; E498-R502 IonicContact OE2-NH1 2.93Å; E498-R502 IonicContact OE2-NH2 2.88Å; E498-R502 PolarHBondContact OE2-NH2 3.32Å; D499-R502 PolarHBondContact O-N 3.07Å; D499-R502 IonicContact OD1-NH1 2.8Å; D499-R502 PolarHBondContact OD1-NH1 2.84Å; R502-Q504 PolarHBondContact O-N 3.44Å; R502-N505 PolarHBondContact O-N 3.11Å; R502-I506 WeakPolarHBondContact O-CD1 3.25Å; R502-I506 VanDerWaalsContact O-CG1 3.28Å; R502-I506 WeakPolarHBondContact O-CG1 3.39Å; R502-I506 PolarHBondContact O-N 2.82Å
503	I	82.1	Confident	79.4	Confident	29 Å²	29	97 Å²	97	15%	0.149	47%	0.468	C	S	.	.	H	α-helix	trans	-62	-43.9	178	-66.6	162.2	0	0	0	110.8	L490 D499 Q500 I506 L507	L490-I503 HydrophobicContact CD2-CG1 4.12Å; D499-I503 WeakPolarHBondContact O-CB 3.44Å; D499-I503 WeakPolarHBondContact O-CD1 3.36Å; D499-I503 WeakPolarHBondContact O-CG1 3.38Å; D499-I503 PolarHBondContact O-N 3.38Å; Q500-I503 PolarHBondContact O-N 2.96Å; I503-I506 PolarHBondContact O-N 3.36Å; I503-L507 HydrophobicContact CG2-CD1 4.03Å; I503-L507 HydrophobicContact CG2-CG 4.44Å; I503-L507 WeakPolarHBondContact O-CB 3.48Å; I503-L507 VanDerWaalsContact O-CG 3.31Å; I503-L507 WeakPolarHBondContact O-CG 3.43Å; I503-L507 PolarHBondContact O-N 3.34Å
504	Q	83.4	Confident	80.7	Confident	109 Å²	109	92.2 Å²	92.2	51%	0.509	45%	0.448	S	S	.	.	H	α-helix	trans	-62.7	-41.9	176.5	-75.9	-179	-4.5	0	0	112.6	Q500 Q501 R502 L507 K508	Q500-Q504 WeakPolarHBondContact O-CB 3.32Å; Q500-Q504 WeakPolarHBondContact O-CG 3.48Å; Q500-Q504 PolarHBondContact O-N 2.97Å; Q501-Q504 PolarHBondContact O-N 2.86Å; R502-Q504 PolarHBondContact O-N 3.44Å; Q504-L507 PolarHBondContact O-N 2.93Å; Q504-K508 WeakPolarHBondContact O-CB 3.24Å; Q504-K508 PolarHBondContact O-N 2.98Å
505	N	85.1	Confident	81.9	Confident	105 Å²	105	96.4 Å²	96.4	56%	0.561	47%	0.466	S	S	*	.	H	α-helix	trans	-65	-38.8	176.1	-76	-13.3	0	0	0	112.3	Q501 R502 T509	Q501-N505 WeakPolarHBondContact O-CB 3.44Å; Q501-N505 PolarHBondContact O-N 2.66Å; R502-N505 PolarHBondContact O-N 3.11Å; N505-T509 WeakPolarHBondContact O-CB 3.44Å; N505-T509 PolarHBondContact O-N 3.07Å; N505-T509 PolarHBondContact O-OG1 3.16Å
506	I	84.9	Confident	83	Confident	85 Å²	85	89 Å²	89	44%	0.436	44%	0.437	S	S	.	.	H	α-helix	trans	-63.3	-47.2	174.3	-69	163.1	0	0	0	110.5	L490 R502 I503 K508 T509 Y510	L490-I506 HydrophobicContact CD1-CG2 4.46Å; R502-I506 WeakPolarHBondContact O-CD1 3.25Å; R502-I506 VanDerWaalsContact O-CG1 3.28Å; R502-I506 WeakPolarHBondContact O-CG1 3.39Å; R502-I506 PolarHBondContact O-N 2.82Å; I503-I506 PolarHBondContact O-N 3.36Å; I506-K508 PolarHBondContact O-N 3.4Å; I506-T509 PolarHBondContact O-N 3.34Å; I506-Y510 WeakPolarHBondContact O-CB 3.41Å; I506-Y510 PolarHBondContact O-N 3.48Å
507	L	84.3	Confident	83.6	Confident	60 Å²	60	90.1 Å²	90.1	31%	0.314	44%	0.442	S	S	.	.	H	α-helix	trans	-60.8	-43.8	177.5	-73.2	172.2	0	0	0	112.3	V487 I503 Q504 Y510 Q511	V487-L507 HydrophobicContact CG1-CD2 3.49Å; V487-L507 VanDerWaalsContact CG1-CD2 3.49Å; V487-L507 HydrophobicContact CG2-CD2 4.41Å; I503-L507 HydrophobicContact CG2-CD1 4.03Å; I503-L507 HydrophobicContact CG2-CG 4.44Å; I503-L507 WeakPolarHBondContact O-CB 3.48Å; I503-L507 VanDerWaalsContact O-CG 3.31Å; I503-L507 WeakPolarHBondContact O-CG 3.43Å; I503-L507 PolarHBondContact O-N 3.34Å; Q504-L507 PolarHBondContact O-N 2.93Å; L507-Y510 WeakPolarHBondContact O-CB 3.43Å; L507-Y510 PolarHBondContact O-N 3.34Å; L507-Q511 WeakPolarHBondContact O-CG 3.49Å; L507-Q511 PolarHBondContact O-N 2.99Å
508	K	86.8	Confident	84.1	Confident	125 Å²	125	87.3 Å²	87.3	54%	0.543	43%	0.431	S	S	.	.	H	α-helix	trans	-62.9	-52.2	176.8	-175.4	-179.5	175.4	-175.8	0	111	Q504 I506 Y510 Q511 D512	Q504-K508 WeakPolarHBondContact O-CB 3.24Å; Q504-K508 PolarHBondContact O-N 2.98Å; I506-K508 PolarHBondContact O-N 3.4Å; K508-Y510 PolarHBondContact O-N 3.46Å; K508-Q511 PolarHBondContact O-N 2.83Å; K508-D512 VanDerWaalsContact O-CG 3.25Å; K508-D512 PolarHBondContact O-N 2.92Å
509	T	84.2	Confident	84.6	Confident	70 Å²	70	83.3 Å²	83.3	43%	0.429	41%	0.412	S	S	.	.	H	α-helix	trans	-58.7	-33.6	178.1	-51.8	0	0	0	0	112.1	N505 I506 K513	N505-T509 WeakPolarHBondContact O-CB 3.44Å; N505-T509 PolarHBondContact O-N 3.07Å; N505-T509 PolarHBondContact O-OG1 3.16Å; I506-T509 PolarHBondContact O-N 3.34Å; T509-K513 WeakPolarHBondContact O-CB 3.49Å; T509-K513 WeakPolarHBondContact O-CG 3.38Å; T509-K513 PolarHBondContact O-N 3.02Å; T509-K513 VanDerWaalsContact O-N 3.16Å
510	Y	84.5	Confident	85.2	Confident	21 Å²	21	84.3 Å²	84.3	8%	0.082	42%	0.417	C	S	.	.	H	α-helix	trans	-67.3	-45.7	173.1	174.6	-99.5	0	0	0	112.5	F480 L483 D484 V487 I506 L507 K508 K513 K514	F480-Y510 HydrophobicContact CD1-CE2 4.25Å; F480-Y510 PolarHBondContact O-OH 3.5Å; L483-Y510 HydrophobicContact CB-CD2 3.85Å; L483-Y510 HydrophobicContact CB-CE2 3.45Å; L483-Y510 VanDerWaalsContact CB-CE2 3.45Å; L483-Y510 HydrophobicContact CD1-CD2 4.19Å; L483-Y510 HydrophobicContact CD1-CE2 4.12Å; L483-Y510 HydrophobicContact CG-CE2 4.43Å; D484-Y510 PolarHBondContact OD1-OH 2.95Å; D484-Y510 PolarHBondContact OD2-OH 3.41Å; D484-Y510 VanDerWaalsContact OD2-OH 3.1Å; V487-Y510 HydrophobicContact CG2-CD1 4.35Å; V487-Y510 HydrophobicContact CG2-CD2 4.49Å; V487-Y510 HydrophobicContact CG2-CG 4.19Å; I506-Y510 WeakPolarHBondContact O-CB 3.41Å; I506-Y510 PolarHBondContact O-N 3.48Å; L507-Y510 WeakPolarHBondContact O-CB 3.43Å; L507-Y510 PolarHBondContact O-N 3.34Å; K508-Y510 PolarHBondContact O-N 3.46Å; Y510-K513 PolarHBondContact O-N 3.1Å; Y510-K514 HydrophobicContact CE1-CD 3.87Å; Y510-K514 WeakPolarHBondContact O-CB 3.49Å; Y510-K514 PolarHBondContact O-N 2.87Å; Y510-K514 WeakPolarHBondContact OH-CE 3.5Å; Y510-K514 PolarHBondContact OH-NZ 3.28Å
511	Q	83.3	Confident	85.8	Confident	116 Å²	116	86.6 Å²	86.6	54%	0.542	43%	0.428	S	S	.	.	H	α-helix	trans	-63.5	-44.2	176.4	-72.3	176.8	5.6	0	0	111.8	L507 K508 K513 K514 N515	L507-Q511 WeakPolarHBondContact O-CG 3.49Å; L507-Q511 PolarHBondContact O-N 2.99Å; K508-Q511 PolarHBondContact O-N 2.83Å; Q511-K513 VanDerWaalsContact C-N 3.32Å; Q511-K513 PolarHBondContact O-N 2.97Å; Q511-K514 WeakPolarHBondContact O-CB 3.46Å; Q511-K514 PolarHBondContact O-N 2.88Å; Q511-N515 WeakPolarHBondContact O-CB 3.38Å; Q511-N515 PolarHBondContact O-N 2.87Å; Q511-N515 PolarHBondContact O-ND2 2.86Å
512	D	86.4	Confident	86.3	Confident	90 Å²	90	86.1 Å²	86.1	48%	0.481	42%	0.424	S	S	.	.	H	α-helix	trans	-59	-43.3	177.8	-63.6	-21.9	0	0	0	110.7	K508 K514 N515 D516	K508-D512 VanDerWaalsContact O-CG 3.25Å; K508-D512 PolarHBondContact O-N 2.92Å; D512-K514 PolarHBondContact O-N 3.3Å; D512-N515 CarbonylContact O-C 3.44Å; D512-N515 PolarHBondContact O-N 3.43Å; D512-D516 PolarHBondContact O-N 3.27Å
513	K	84.1	Confident	86.7	Confident	131 Å²	131	84.3 Å²	84.3	57%	0.57	42%	0.419	S	S	*	.	H	α-helix	trans	-67.9	-29.3	174	-74.5	178.1	178.6	-178.2	0	114.2	F480 T509 Y510 Q511 N515	F480-K513 HydrophobicContact CE1-CB 4.38Å; F480-K513 WeakPolarHBondContact CE1-O 3.33Å; F480-K513 VanDerWaalsContact CZ-O 3.26Å; F480-K513 WeakPolarHBondContact CZ-O 3.3Å; T509-K513 WeakPolarHBondContact O-CB 3.49Å; T509-K513 WeakPolarHBondContact O-CG 3.38Å; T509-K513 PolarHBondContact O-N 3.02Å; T509-K513 VanDerWaalsContact O-N 3.16Å; Y510-K513 PolarHBondContact O-N 3.1Å; Q511-K513 VanDerWaalsContact C-N 3.32Å; Q511-K513 PolarHBondContact O-N 2.97Å; K513-N515 VanDerWaalsContact C-N 3.35Å
514	K	83.6	Confident	87.2	Confident	72 Å²	72	89.6 Å²	89.6	31%	0.313	44%	0.443	S	S	.	.	H	α-helix	trans	-76	-27.2	177.6	-162.1	171.9	-160.7	156.1	0	112	F480 D484 Y510 Q511 D512	F480-K514 HydrophobicContact CE1-CB 4.49Å; D484-K514 VanDerWaalsContact CG-NZ 3.29Å; D484-K514 IonicContact OD1-NZ 3.26Å; D484-K514 PolarHBondContact OD1-NZ 3.23Å; D484-K514 IonicContact OD2-NZ 2.72Å; D484-K514 PolarHBondContact OD2-NZ 3.21Å; Y510-K514 HydrophobicContact CE1-CD 3.87Å; Y510-K514 WeakPolarHBondContact O-CB 3.49Å; Y510-K514 PolarHBondContact O-N 2.87Å; Y510-K514 WeakPolarHBondContact OH-CE 3.5Å; Y510-K514 PolarHBondContact OH-NZ 3.28Å; Q511-K514 WeakPolarHBondContact O-CB 3.46Å; Q511-K514 PolarHBondContact O-N 2.88Å; D512-K514 PolarHBondContact O-N 3.3Å
515	N	85.5	Confident	87.6	Confident	106 Å²	106	88.7 Å²	88.7	57%	0.567	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	14.6	179.2	-61.6	-28.2	0	0	0	113	Q511 D512 K513	Q511-N515 WeakPolarHBondContact O-CB 3.38Å; Q511-N515 PolarHBondContact O-N 2.87Å; Q511-N515 PolarHBondContact O-ND2 2.86Å; D512-N515 CarbonylContact O-C 3.44Å; D512-N515 PolarHBondContact O-N 3.43Å; K513-N515 VanDerWaalsContact C-N 3.35Å
516	D	91.1	Very high	87.9	Confident	60 Å²	60	83.9 Å²	83.9	32%	0.321	41%	0.41	S	S	.	.			trans	-56.9	119.5	178.7	-178.5	-21.6	0	0	0	110.2	D512 T518 F519 L520	D512-D516 PolarHBondContact O-N 3.27Å; D516-T518 VanDerWaalsContact CG-OG1 3.28Å; D516-T518 PolarHBondContact O-N 3.48Å; D516-T518 WeakPolarHBondContact OD1-CB 3.42Å; D516-T518 PolarHBondContact OD1-N 3.11Å; D516-T518 PolarHBondContact OD1-OG1 2.8Å; D516-T518 PolarHBondContact OD2-OG1 3.47Å; D516-F519 HydrophobicContact CB-CB 4.27Å; D516-F519 PolarHBondContact O-N 3.21Å; D516-F519 VanDerWaalsContact O-N 3.08Å; D516-L520 PolarHBondContact O-N 3.14Å; D516-L520 VanDerWaalsContact O-N 3.12Å
517	P	89.6	Confident	88.2	Confident	80 Å²	80	83.7 Å²	83.7	52%	0.519	41%	0.41	S	S	.	.	H	α-helix	trans	-59.3	-34	-177.3	24.2	-33.9	0	0	0	111.9	F519 L520 E521	P517-F519 VanDerWaalsContact C-N 3.26Å; P517-F519 PolarHBondContact O-N 3.24Å; P517-L520 PolarHBondContact O-N 3.49Å; P517-L520 VanDerWaalsContact O-N 3.13Å; P517-E521 WeakPolarHBondContact O-CB 3.47Å; P517-E521 WeakPolarHBondContact O-CG 3.23Å; P517-E521 PolarHBondContact O-N 3.48Å
518	T	89.3	Confident	88.6	Confident	75 Å²	75	83.8 Å²	83.8	46%	0.46	41%	0.407	S	S	.	.	H	α-helix	trans	-67.5	-28.4	-179.7	71.9	0	0	0	0	112.5	D516 K522	D516-T518 VanDerWaalsContact CG-OG1 3.28Å; D516-T518 PolarHBondContact O-N 3.48Å; D516-T518 WeakPolarHBondContact OD1-CB 3.42Å; D516-T518 PolarHBondContact OD1-N 3.11Å; D516-T518 PolarHBondContact OD1-OG1 2.8Å; D516-T518 PolarHBondContact OD2-OG1 3.47Å; T518-K522 WeakPolarHBondContact O-CB 3.37Å; T518-K522 VanDerWaalsContact O-CG 3.25Å; T518-K522 WeakPolarHBondContact O-CG 3.3Å; T518-K522 PolarHBondContact O-N 2.88Å
519	F	90.1	Very high	88.9	Confident	24 Å²	24	77.9 Å²	77.9	11%	0.105	38%	0.381	C	S	.	.	H	α-helix	trans	-77.3	-39.7	172.2	171.4	-110.6	0	0	0	111.4	T476 L477 F480 D516 P517 K522 K523	T476-F519 VanDerWaalsContact OG1-CE2 3.28Å; T476-F519 WeakPolarHBondContact OG1-CE2 3.33Å; L477-F519 HydrophobicContact CD2-CZ 3.9Å; L477-F519 HydrophobicContact CG-CZ 4.18Å; F480-F519 HydrophobicContact CD2-CE1 4.47Å; F480-F519 HydrophobicContact CD2-CZ 4.44Å; F480-F519 HydrophobicContact CE2-CD1 4.04Å; F480-F519 HydrophobicContact CE2-CD2 4.45Å; F480-F519 AromaticContact CE2-CE1 3.86Å; F480-F519 HydrophobicContact CE2-CE1 3.86Å; F480-F519 HydrophobicContact CE2-CE2 4.3Å; F480-F519 HydrophobicContact CE2-CG 4.33Å; F480-F519 HydrophobicContact CE2-CZ 4Å; D516-F519 HydrophobicContact CB-CB 4.27Å; D516-F519 PolarHBondContact O-N 3.21Å; D516-F519 VanDerWaalsContact O-N 3.08Å; P517-F519 VanDerWaalsContact C-N 3.26Å; P517-F519 PolarHBondContact O-N 3.24Å; F519-K522 PolarHBondContact O-N 3.36Å; F519-K523 WeakPolarHBondContact O-CB 3.11Å; F519-K523 PolarHBondContact O-N 3.42Å
520	L	88.2	Confident	89.2	Confident	79 Å²	79	77.8 Å²	77.8	41%	0.414	38%	0.375	S	S	.	.	H	α-helix	trans	-64.9	-44.7	177.9	-65.2	175.3	0	0	0	111.8	D516 P517 K523 E524	D516-L520 PolarHBondContact O-N 3.14Å; D516-L520 VanDerWaalsContact O-N 3.12Å; P517-L520 PolarHBondContact O-N 3.49Å; P517-L520 VanDerWaalsContact O-N 3.13Å; L520-K523 WeakPolarHBondContact O-CB 3.48Å; L520-K523 PolarHBondContact O-N 2.86Å; L520-E524 WeakPolarHBondContact O-CB 3.28Å; L520-E524 PolarHBondContact O-N 3.47Å
521	E	92.1	Very high	89.6	Confident	128 Å²	128	78.5 Å²	78.5	60%	0.598	38%	0.384	S	S	*	.	H	α-helix	trans	-59.8	-45.7	174.1	-73.3	171.8	-174.3	0	0	111.9	P517 K523 E524 R525	P517-E521 WeakPolarHBondContact O-CB 3.47Å; P517-E521 WeakPolarHBondContact O-CG 3.23Å; P517-E521 PolarHBondContact O-N 3.48Å; E521-K523 VanDerWaalsContact C-N 3.31Å; E521-K523 PolarHBondContact O-N 2.82Å; E521-E524 PolarHBondContact O-N 3.23Å; E521-R525 VanDerWaalsContact O-CB 3.32Å; E521-R525 WeakPolarHBondContact O-CB 3.39Å; E521-R525 PolarHBondContact O-N 3.33Å
522	K	91.4	Very high	90.1	Very high	110 Å²	110	73.8 Å²	73.8	48%	0.478	36%	0.362	S	S	.	.	H	α-helix	trans	-60.5	-41.4	175.2	-79	178.1	-178.9	-174.2	0	111.9	L469 T518 F519 R525 C526	L469-K522 HydrophobicContact CD1-CB 4.03Å; L469-K522 HydrophobicContact CD1-CD 4.49Å; L469-K522 HydrophobicContact CD1-CG 4.1Å; T518-K522 WeakPolarHBondContact O-CB 3.37Å; T518-K522 VanDerWaalsContact O-CG 3.25Å; T518-K522 WeakPolarHBondContact O-CG 3.3Å; T518-K522 PolarHBondContact O-N 2.88Å; F519-K522 PolarHBondContact O-N 3.36Å; K522-R525 PolarHBondContact O-N 2.97Å; K522-C526 WeakPolarHBondContact O-CB 3.16Å; K522-C526 PolarHBondContact O-N 2.85Å
523	K	90.6	Very high	90.4	Very high	95 Å²	95	69.9 Å²	69.9	41%	0.413	34%	0.341	S	S	.	.	H	α-helix	trans	-63.9	-48.4	176.4	-175.5	-165.7	167.1	-158	0	111.3	F519 L520 E521 R525 C526 D527	F519-K523 WeakPolarHBondContact O-CB 3.11Å; F519-K523 PolarHBondContact O-N 3.42Å; L520-K523 WeakPolarHBondContact O-CB 3.48Å; L520-K523 PolarHBondContact O-N 2.86Å; E521-K523 VanDerWaalsContact C-N 3.31Å; E521-K523 PolarHBondContact O-N 2.82Å; K523-R525 VanDerWaalsContact C-N 3.35Å; K523-R525 PolarHBondContact O-N 2.97Å; K523-C526 WeakPolarHBondContact O-CB 3.44Å; K523-C526 PolarHBondContact O-N 3.43Å; K523-C526 VanDerWaalsContact O-N 3.13Å; K523-D527 PolarHBondContact O-N 3.19Å
524	E	91.9	Very high	90.8	Very high	140 Å²	140	72.3 Å²	72.3	65%	0.654	35%	0.347	S	S	*	.	H	α-helix	trans	-59.3	-44.6	176.5	-176.8	175.4	-175	0	0	111.5	L520 E521 C526 D527 Y528	L520-E524 WeakPolarHBondContact O-CB 3.28Å; L520-E524 PolarHBondContact O-N 3.47Å; E521-E524 PolarHBondContact O-N 3.23Å; E524-C526 VanDerWaalsContact C-N 3.3Å; E524-C526 PolarHBondContact O-N 2.94Å; E524-D527 PolarHBondContact O-N 3.35Å; E524-Y528 WeakPolarHBondContact O-CB 3.4Å; E524-Y528 PolarHBondContact O-N 3.43Å
525	R	92.4	Very high	91.2	Very high	91 Å²	91	70.4 Å²	70.4	34%	0.343	34%	0.339	S	S	.	.	H	α-helix	trans	-57.8	-40.4	173.9	177.4	62.2	-175.8	166.7	0.5	112.2	E465 L469 E521 K522 K523 L529	E465-R525 IonicContact OE1-CZ 3.61Å; E465-R525 IonicContact OE1-NE 2.98Å; E465-R525 PolarHBondContact OE1-NE 3.22Å; E465-R525 IonicContact OE1-NH2 2.79Å; E465-R525 PolarHBondContact OE1-NH2 3.09Å; E465-R525 IonicContact OE2-NH2 2.81Å; E465-R525 PolarHBondContact OE2-NH2 2.83Å; L469-R525 HydrophobicContact CD2-CB 4.02Å; L469-R525 HydrophobicContact CD2-CG 3.63Å; E521-R525 VanDerWaalsContact O-CB 3.32Å; E521-R525 WeakPolarHBondContact O-CB 3.39Å; E521-R525 PolarHBondContact O-N 3.33Å; K522-R525 PolarHBondContact O-N 2.97Å; K523-R525 VanDerWaalsContact C-N 3.35Å; K523-R525 PolarHBondContact O-N 2.97Å; R525-L529 HydrophobicContact CG-CD1 4.32Å; R525-L529 WeakPolarHBondContact O-CB 3.37Å; R525-L529 VanDerWaalsContact O-CG 3.32Å; R525-L529 WeakPolarHBondContact O-CG 3.47Å; R525-L529 PolarHBondContact O-N 2.78Å
526	C	91.6	Very high	91.5	Very high	4 Å²	4	65.4 Å²	65.4	3%	0.027	31%	0.312	C	S	.	.	H	α-helix	trans	-68.4	-43.4	176.2	-179.4	0	0	0	0	112.5	L469 I473 K522 K523 E524 L529 K530	L469-C526 HydrophobicContact CD2-CB 3.8Å; L469-C526 HydrophobicContact CG-CB 4.04Å; I473-C526 HydrophobicContact CD1-CB 3.17Å; K522-C526 WeakPolarHBondContact O-CB 3.16Å; K522-C526 PolarHBondContact O-N 2.85Å; K523-C526 WeakPolarHBondContact O-CB 3.44Å; K523-C526 PolarHBondContact O-N 3.43Å; K523-C526 VanDerWaalsContact O-N 3.13Å; E524-C526 VanDerWaalsContact C-N 3.3Å; E524-C526 PolarHBondContact O-N 2.94Å; C526-L529 PolarHBondContact O-N 2.86Å; C526-K530 WeakPolarHBondContact O-CB 3.48Å; C526-K530 PolarHBondContact O-N 2.9Å
527	D	90.8	Very high	91.6	Very high	81 Å²	81	67.5 Å²	67.5	43%	0.433	32%	0.319	S	S	.	.	H	α-helix	trans	-65	-40.1	177.2	-74.5	-32.4	0	0	0	111	K523 E524 K530 A531	K523-D527 PolarHBondContact O-N 3.19Å; E524-D527 PolarHBondContact O-N 3.35Å; D527-K530 WeakPolarHBondContact O-CB 3.5Å; D527-K530 PolarHBondContact O-N 3.37Å; D527-A531 PolarHBondContact O-N 3.42Å
528	Y	93	Very high	91.8	Very high	62 Å²	62	67.5 Å²	67.5	24%	0.243	31%	0.314	C	S	.	.	H	α-helix	trans	-59.3	-51.9	170.3	171.8	-87.5	0	0	0	112.1	D438 Y439 E524 K530 A531 K532	D438-Y528 VanDerWaalsContact CG-OH 3.24Å; D438-Y528 WeakPolarHBondContact OD1-CE2 3.47Å; D438-Y528 PolarHBondContact OD1-OH 2.95Å; D438-Y528 PolarHBondContact OD2-OH 3.05Å; Y439-Y528 HydrophobicContact CD1-CD2 4.49Å; Y439-Y528 AromaticContact CD1-CE2 3.87Å; Y439-Y528 HydrophobicContact CD1-CE2 3.87Å; Y439-Y528 HydrophobicContact CE1-CE2 4.32Å; E524-Y528 WeakPolarHBondContact O-CB 3.4Å; E524-Y528 PolarHBondContact O-N 3.43Å; Y528-K530 VanDerWaalsContact C-N 3.29Å; Y528-K530 PolarHBondContact O-N 3.18Å; Y528-A531 PolarHBondContact O-N 2.7Å; Y528-A531 VanDerWaalsContact O-N 3.16Å; Y528-K532 HydrophobicContact CE1-CB 4.39Å; Y528-K532 HydrophobicContact CE1-CD 3.78Å; Y528-K532 WeakPolarHBondContact O-CB 3.49Å; Y528-K532 PolarHBondContact O-N 3.15Å
529	L	92.9	Very high	91.9	Very high	0 Å²	0	67 Å²	67	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-40.9	178.9	-80	172	0	0	0	111.3	E465 Y466 L469 R525 C526 A531 K532 L533	E465-L529 HydrophobicContact CB-CD1 4.4Å; E465-L529 HydrophobicContact CG-CD1 3.96Å; Y466-L529 HydrophobicContact CD2-CB 4.01Å; L469-L529 HydrophobicContact CD2-CD1 4.14Å; R525-L529 HydrophobicContact CG-CD1 4.32Å; R525-L529 WeakPolarHBondContact O-CB 3.37Å; R525-L529 VanDerWaalsContact O-CG 3.32Å; R525-L529 WeakPolarHBondContact O-CG 3.47Å; R525-L529 PolarHBondContact O-N 2.78Å; C526-L529 PolarHBondContact O-N 2.86Å; L529-A531 PolarHBondContact O-N 3.34Å; L529-K532 PolarHBondContact O-N 3.11Å; L529-L533 VanDerWaalsContact O-CB 3.24Å; L529-L533 WeakPolarHBondContact O-CB 3.29Å; L529-L533 WeakPolarHBondContact O-CD1 3.33Å; L529-L533 WeakPolarHBondContact O-CG 3.26Å; L529-L533 PolarHBondContact O-N 3.1Å
530	K	91.6	Very high	91.9	Very high	69 Å²	69	67 Å²	67	30%	0.3	31%	0.305	S	S	.	.	H	α-helix	trans	-59.2	-45.7	175.3	-169.6	174.8	-179.7	174.7	0	111.9	F376 Y466 C526 D527 Y528 R534	F376-K530 VanDerWaalsContact CD2-NZ 3.26Å; Y466-K530 HydrophobicContact CD2-CB 4.34Å; Y466-K530 HydrophobicContact CE2-CB 3.68Å; Y466-K530 HydrophobicContact CE2-CD 4.45Å; Y466-K530 HydrophobicContact CE2-CG 4.14Å; C526-K530 WeakPolarHBondContact O-CB 3.48Å; C526-K530 PolarHBondContact O-N 2.9Å; D527-K530 WeakPolarHBondContact O-CB 3.5Å; D527-K530 PolarHBondContact O-N 3.37Å; Y528-K530 VanDerWaalsContact C-N 3.29Å; Y528-K530 PolarHBondContact O-N 3.18Å; K530-R534 VanDerWaalsContact O-CB 3.29Å; K530-R534 WeakPolarHBondContact O-CB 3.44Å; K530-R534 PolarHBondContact O-N 3.44Å
531	A	92.2	Very high	92.2	Very high	35 Å²	35	67 Å²	67	29%	0.289	30%	0.304	S	S	.	.	H	α-helix	trans	-66.3	-47.3	178.9	0	0	0	0	0	112	Y439 D527 Y528 L529 R534 H535	Y439-A531 HydrophobicContact CE1-CB 4.18Å; D527-A531 PolarHBondContact O-N 3.42Å; Y528-A531 PolarHBondContact O-N 2.7Å; Y528-A531 VanDerWaalsContact O-N 3.16Å; L529-A531 PolarHBondContact O-N 3.34Å; A531-R534 PolarHBondContact O-N 3.12Å; A531-H535 PolarHBondContact O-N 3.16Å
532	K	93.4	Very high	92.1	Very high	18 Å²	18	63.4 Å²	63.4	8%	0.078	29%	0.291	C	S	.	.	H	α-helix	trans	-58.2	-49.1	175.5	174.9	179.9	174.6	-172.8	0	112.3	Y439 Y528 L529 H535 I536	Y439-K532 HydrophobicContact CD1-CB 3.97Å; Y439-K532 HydrophobicContact CG-CB 4Å; Y439-K532 HydrophobicContact CG-CG 4.29Å; Y528-K532 HydrophobicContact CE1-CB 4.39Å; Y528-K532 HydrophobicContact CE1-CD 3.78Å; Y528-K532 WeakPolarHBondContact O-CB 3.49Å; Y528-K532 PolarHBondContact O-N 3.15Å; L529-K532 PolarHBondContact O-N 3.11Å; K532-H535 WeakPolarHBondContact O-CB 3.21Å; K532-H535 PolarHBondContact O-N 3.18Å; K532-I536 HydrophobicContact CG-CD1 3.95Å; K532-I536 WeakPolarHBondContact O-CG1 3.43Å; K532-I536 PolarHBondContact O-N 2.87Å
533	L	93.3	Very high	92.2	Very high	8 Å²	8	59.6 Å²	59.6	4%	0.042	27%	0.274	C	S	.	.	H	α-helix	trans	-65	-39.8	179.2	-73	168	0	0	0	111.8	F459 Q462 Y463 Y466 L529 H535 I536 K537	F459-L533 HydrophobicContact CD2-CB 4.28Å; F459-L533 HydrophobicContact CD2-CD2 3.58Å; F459-L533 HydrophobicContact CE2-CB 3.92Å; F459-L533 HydrophobicContact CE2-CD2 3.84Å; F459-L533 HydrophobicContact CE2-CG 4.47Å; F459-L533 WeakPolarHBondContact CE2-O 3.44Å; F459-L533 HydrophobicContact CG-CD2 4.12Å; Q462-L533 HydrophobicContact CB-CD2 3.91Å; Y463-L533 HydrophobicContact CD2-CD1 4.32Å; Y466-L533 VanDerWaalsContact CB-CD1 3.49Å; Y466-L533 HydrophobicContact CD1-CD1 4.16Å; Y466-L533 HydrophobicContact CD2-CD1 4.45Å; Y466-L533 HydrophobicContact CG-CD1 3.77Å; L529-L533 VanDerWaalsContact O-CB 3.24Å; L529-L533 WeakPolarHBondContact O-CB 3.29Å; L529-L533 WeakPolarHBondContact O-CD1 3.33Å; L529-L533 WeakPolarHBondContact O-CG 3.26Å; L529-L533 PolarHBondContact O-N 3.1Å; L533-H535 VanDerWaalsContact C-N 3.35Å; L533-I536 PolarHBondContact O-N 3.09Å; L533-K537 VanDerWaalsContact O-CB 3.26Å; L533-K537 WeakPolarHBondContact O-CB 3.35Å; L533-K537 PolarHBondContact O-N 3.12Å
534	R	92.7	Very high	92.2	Very high	182 Å²	182	57.6 Å²	57.6	69%	0.687	27%	0.268	S	S	*	.	H	α-helix	trans	-60.7	-43.7	173.3	-176.7	-176.5	-179.4	-161.9	1.6	111.5	K530 A531 N538	K530-R534 VanDerWaalsContact O-CB 3.29Å; K530-R534 WeakPolarHBondContact O-CB 3.44Å; K530-R534 PolarHBondContact O-N 3.44Å; A531-R534 PolarHBondContact O-N 3.12Å; R534-N538 WeakPolarHBondContact O-CB 3.19Å; R534-N538 VanDerWaalsContact O-CG 3.28Å; R534-N538 PolarHBondContact O-N 2.77Å; R534-N538 PolarHBondContact O-OD1 2.77Å
535	H	91.6	Very high	92.2	Very high	32 Å²	32	56.8 Å²	56.8	15%	0.148	26%	0.264	C	S	.	.	H	α-helix	trans	-61.6	-51.4	177.1	179.8	75.8	0	0	0	111.9	Y439 Y443 A531 K532 L533 K537 N538 R539	Y439-H535 HydrophobicContact CD2-CB 3.76Å; Y439-H535 AromaticContact CD2-CD2 3.89Å; Y439-H535 AromaticContact CD2-CG 3.8Å; Y439-H535 HydrophobicContact CE2-CB 3.83Å; Y439-H535 PolarHBondContact O-CD2 3.33Å; Y439-H535 PolarHBondContact O-NE2 3.3Å; Y443-H535 PolarHBondContact O-NE2 3.43Å; A531-H535 PolarHBondContact O-N 3.16Å; K532-H535 WeakPolarHBondContact O-CB 3.21Å; K532-H535 PolarHBondContact O-N 3.18Å; L533-H535 VanDerWaalsContact C-N 3.35Å; H535-K537 PolarHBondContact O-N 3.07Å; H535-N538 PolarHBondContact O-N 2.85Å; H535-R539 PolarHBondContact O-N 3.41Å
536	I	92.2	Very high	92	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.1	-43.4	178.7	-64.2	168.3	0	0	0	111	Y443 Y455 V458 F459 K532 L533 N538 R539 I540	Y443-I536 HydrophobicContact CD1-CD1 4.14Å; Y443-I536 HydrophobicContact CD1-CG1 4.05Å; Y443-I536 HydrophobicContact CD2-CD1 3.98Å; Y443-I536 HydrophobicContact CD2-CG1 4Å; Y443-I536 HydrophobicContact CE1-CD1 4.09Å; Y443-I536 HydrophobicContact CE2-CD1 3.94Å; Y443-I536 HydrophobicContact CE2-CG1 4.47Å; Y443-I536 HydrophobicContact CG-CD1 4.11Å; Y443-I536 HydrophobicContact CG-CG1 3.8Å; Y455-I536 HydrophobicContact CD2-CG2 4.27Å; Y455-I536 WeakPolarHBondContact O-CG2 3.4Å; V458-I536 HydrophobicContact CG1-CD1 3.9Å; F459-I536 HydrophobicContact CB-CG2 4.04Å; F459-I536 HydrophobicContact CD2-CG2 4.43Å; K532-I536 HydrophobicContact CG-CD1 3.95Å; K532-I536 WeakPolarHBondContact O-CG1 3.43Å; K532-I536 PolarHBondContact O-N 2.87Å; L533-I536 PolarHBondContact O-N 3.09Å; I536-N538 VanDerWaalsContact C-N 3.35Å; I536-N538 PolarHBondContact O-N 3.4Å; I536-R539 PolarHBondContact O-N 3.31Å; I536-I540 HydrophobicContact CG2-CD1 4.08Å; I536-I540 WeakPolarHBondContact O-CG1 3.05Å; I536-I540 PolarHBondContact O-N 3.14Å; I536-I540 VanDerWaalsContact O-N 3.08Å
537	K	93.1	Very high	91.7	Very high	105 Å²	105	58.1 Å²	58.1	46%	0.457	28%	0.276	S	S	.	.	H	α-helix	trans	-60.2	-43.1	175.9	-176.2	177.1	179.6	179.6	0	112	F459 L533 H535 I540 L541	F459-K537 HydrophobicContact CD2-CB 4.27Å; F459-K537 HydrophobicContact CE2-CB 3.84Å; L533-K537 VanDerWaalsContact O-CB 3.26Å; L533-K537 WeakPolarHBondContact O-CB 3.35Å; L533-K537 PolarHBondContact O-N 3.12Å; H535-K537 PolarHBondContact O-N 3.07Å; K537-I540 PolarHBondContact O-N 3.22Å; K537-L541 VanDerWaalsContact O-CB 3.31Å; K537-L541 WeakPolarHBondContact O-CB 3.41Å; K537-L541 PolarHBondContact O-N 3.41Å
538	N	92.9	Very high	91.4	Very high	80 Å²	80	56.4 Å²	56.4	43%	0.428	27%	0.273	S	S	.	.	H	α-helix	trans	-64.4	-41.4	176.9	-76.8	3.8	0	0	0	111.6	R534 H535 I536 L541 V542	R534-N538 WeakPolarHBondContact O-CB 3.19Å; R534-N538 VanDerWaalsContact O-CG 3.28Å; R534-N538 PolarHBondContact O-N 2.77Å; R534-N538 PolarHBondContact O-OD1 2.77Å; H535-N538 PolarHBondContact O-N 2.85Å; I536-N538 VanDerWaalsContact C-N 3.35Å; I536-N538 PolarHBondContact O-N 3.4Å; N538-L541 PolarHBondContact O-N 2.83Å; N538-V542 WeakPolarHBondContact O-CG2 3.29Å; N538-V542 PolarHBondContact O-N 3.13Å
539	R	91	Very high	90.7	Very high	65 Å²	65	55.9 Å²	55.9	25%	0.245	28%	0.282	C	S	.	.	H	α-helix	trans	-60.2	-45.4	176.4	-72.7	-61.1	-170	-171.6	0.6	112.6	P444 E445 I446 Y455 H535 I536 Y543	P444-R539 WeakPolarHBondContact O-CD 3.18Å; P444-R539 PolarHBondContact O-NE 3.5Å; E445-R539 IonicContact OE1-NH1 3.19Å; E445-R539 PolarHBondContact OE1-NH1 3.08Å; I446-R539 HydrophobicContact CD1-CB 4.08Å; I446-R539 HydrophobicContact CG1-CB 4.34Å; Y455-R539 HydrophobicContact CD2-CB 4.22Å; Y455-R539 HydrophobicContact CE2-CB 4.18Å; Y455-R539 HydrophobicContact CE2-CG 4.5Å; H535-R539 PolarHBondContact O-N 3.41Å; I536-R539 PolarHBondContact O-N 3.31Å; R539-Y543 PolarHBondContact O-N 3.44Å
540	I	92.1	Very high	89.9	Confident	23 Å²	23	61.3 Å²	61.3	12%	0.118	31%	0.311	C	S	.	.	H	α-helix	trans	-62.4	-44.3	174.9	-61.5	164.5	0	0	0	110.6	I446 R452 K456 I536 K537 V542 Y543 D544	I446-I540 HydrophobicContact CD1-CB 4.46Å; I446-I540 HydrophobicContact CD1-CG1 3.96Å; R452-I540 HydrophobicContact CG-CG2 4.29Å; K456-I540 HydrophobicContact CB-CD1 4.24Å; I536-I540 HydrophobicContact CG2-CD1 4.08Å; I536-I540 WeakPolarHBondContact O-CG1 3.05Å; I536-I540 PolarHBondContact O-N 3.14Å; I536-I540 VanDerWaalsContact O-N 3.08Å; K537-I540 PolarHBondContact O-N 3.22Å; I540-V542 PolarHBondContact O-N 3.35Å; I540-Y543 PolarHBondContact O-N 2.83Å; I540-D544 WeakPolarHBondContact O-CB 3.41Å; I540-D544 VanDerWaalsContact O-CG 3.27Å; I540-D544 PolarHBondContact O-N 3.49Å
541	L	92.5	Very high	88.8	Confident	78 Å²	78	66 Å²	66	41%	0.408	33%	0.334	S	S	.	.	H	α-helix	trans	-65.8	-35.1	-178	178.7	148.1	0	0	0	113.5	K537 N538 Q545	K537-L541 VanDerWaalsContact O-CB 3.31Å; K537-L541 WeakPolarHBondContact O-CB 3.41Å; K537-L541 PolarHBondContact O-N 3.41Å; N538-L541 PolarHBondContact O-N 2.83Å; L541-Q545 VanDerWaalsContact CD2-NE2 3.35Å; L541-Q545 WeakPolarHBondContact O-CG 3.44Å; L541-Q545 PolarHBondContact O-N 3.46Å
542	V	91.6	Very high	87.2	Confident	53 Å²	53	74.8 Å²	74.8	32%	0.321	36%	0.359	S	S	.	.	H	α-helix	trans	-66.9	-49.5	174.5	169.6	0	0	0	0	110.4	N538 I540 D544 Q545 E546	N538-V542 WeakPolarHBondContact O-CG2 3.29Å; N538-V542 PolarHBondContact O-N 3.13Å; I540-V542 PolarHBondContact O-N 3.35Å; V542-D544 VanDerWaalsContact C-N 3.32Å; V542-D544 PolarHBondContact O-N 3.38Å; V542-Q545 WeakPolarHBondContact O-CB 3Å; V542-Q545 PolarHBondContact O-N 3.31Å; V542-E546 HydrophobicContact CG1-CG 4.48Å; V542-E546 WeakPolarHBondContact CG1-OE1 3.34Å; V542-E546 PolarHBondContact O-N 3.29Å
543	Y	92.8	Very high	84.9	Confident	30 Å²	30	82.1 Å²	82.1	12%	0.118	41%	0.405	C	S	.	.	H	α-helix	trans	-58.7	-41.6	176.6	-179.5	-91.5	0	0	0	112.5	I446 E449 R452 R539 I540 Q545 E546 T547	I446-Y543 HydrophobicContact CB-CD2 3.96Å; I446-Y543 HydrophobicContact CB-CG 4.13Å; I446-Y543 HydrophobicContact CG2-CD1 4.32Å; I446-Y543 HydrophobicContact CG2-CD2 3.57Å; I446-Y543 HydrophobicContact CG2-CE2 3.94Å; I446-Y543 HydrophobicContact CG2-CG 3.77Å; I446-Y543 WeakPolarHBondContact O-CD2 3.37Å; E449-Y543 PolarHBondContact N-OH 2.98Å; E449-Y543 VanDerWaalsContact N-OH 3.15Å; R452-Y543 HydrophobicContact CB-CD1 4.2Å; R452-Y543 HydrophobicContact CB-CE1 4.17Å; R452-Y543 HydrophobicContact CG-CD1 3.91Å; R452-Y543 HydrophobicContact CG-CE1 4.19Å; R539-Y543 PolarHBondContact O-N 3.44Å; I540-Y543 PolarHBondContact O-N 2.83Å; Y543-Q545 PolarHBondContact O-N 3.25Å; Y543-E546 PolarHBondContact O-N 3.41Å; Y543-T547 HydrophobicContact CD1-CG2 4.02Å; Y543-T547 HydrophobicContact CD2-CG2 4.41Å; Y543-T547 HydrophobicContact CE1-CG2 3.53Å; Y543-T547 HydrophobicContact CE2-CG2 3.99Å; Y543-T547 HydrophobicContact CG-CG2 4.44Å; Y543-T547 WeakPolarHBondContact O-CB 3.41Å; Y543-T547 WeakPolarHBondContact O-CG2 3.28Å; Y543-T547 PolarHBondContact O-N 3.19Å; Y543-T547 PolarHBondContact O-OG1 3.12Å
544	D	91.1	Very high	84.5	Confident	53 Å²	53	85.8 Å²	85.8	28%	0.283	42%	0.424	S	S	.	.	H	α-helix	trans	-64.4	-27.5	176.3	-74.7	13.5	0	0	0	112.6	R452 I540 V542 T547 A548	R452-D544 IonicContact CZ-OD1 3.82Å; R452-D544 IonicContact CZ-OD2 3.97Å; R452-D544 IonicContact NE-OD1 2.84Å; R452-D544 PolarHBondContact NE-OD1 3.48Å; R452-D544 IonicContact NE-OD2 3.78Å; R452-D544 VanDerWaalsContact NH2-CG 3.27Å; R452-D544 IonicContact NH2-OD1 3.75Å; R452-D544 PolarHBondContact NH2-OD1 3.44Å; R452-D544 IonicContact NH2-OD2 2.67Å; R452-D544 PolarHBondContact NH2-OD2 2.86Å; I540-D544 WeakPolarHBondContact O-CB 3.41Å; I540-D544 VanDerWaalsContact O-CG 3.27Å; I540-D544 PolarHBondContact O-N 3.49Å; V542-D544 VanDerWaalsContact C-N 3.32Å; V542-D544 PolarHBondContact O-N 3.38Å; D544-T547 WeakPolarHBondContact CA-OG1 3.14Å; D544-T547 PolarHBondContact O-OG1 3.49Å; D544-A548 WeakPolarHBondContact O-CB 3.39Å; D544-A548 PolarHBondContact O-N 3.22Å
545	Q	90.4	Very high	84.1	Confident	123 Å²	123	80.7 Å²	80.7	58%	0.575	41%	0.41	S	S	*	.	H	α-helix	trans	-79.8	-41.5	174.6	-74.2	177	10.9	0	0	112.3	L541 V542 Y543 A548 A549	L541-Q545 VanDerWaalsContact CD2-NE2 3.35Å; L541-Q545 WeakPolarHBondContact O-CG 3.44Å; L541-Q545 PolarHBondContact O-N 3.46Å; V542-Q545 WeakPolarHBondContact O-CB 3Å; V542-Q545 PolarHBondContact O-N 3.31Å; Y543-Q545 PolarHBondContact O-N 3.25Å; Q545-A548 PolarHBondContact O-N 3.11Å; Q545-A549 WeakPolarHBondContact O-CB 3.05Å; Q545-A549 PolarHBondContact O-N 3.05Å
546	E	88.7	Confident	83.6	Confident	90 Å²	90	83.4 Å²	83.4	42%	0.421	42%	0.424	S	S	.	.	H	α-helix	trans	-67.3	-46.5	179.5	-70.7	171.6	176.9	0	0	111.4	V542 Y543 A548 A549 N550	V542-E546 HydrophobicContact CG1-CG 4.48Å; V542-E546 WeakPolarHBondContact CG1-OE1 3.34Å; V542-E546 PolarHBondContact O-N 3.29Å; Y543-E546 PolarHBondContact O-N 3.41Å; E546-A548 PolarHBondContact O-N 3.49Å; E546-A549 WeakPolarHBondContact O-CB 3.28Å; E546-A549 PolarHBondContact O-N 3.32Å; E546-A549 VanDerWaalsContact O-N 3.16Å; E546-N550 VanDerWaalsContact O-CG 3.25Å; E546-N550 PolarHBondContact O-N 3.21Å; E546-N550 PolarHBondContact O-ND2 3.26Å
547	T	86.4	Confident	83.1	Confident	34 Å²	34	88.4 Å²	88.4	21%	0.209	45%	0.449	C	S	.	.	H	α-helix	trans	-60.3	-43.9	173.4	49.5	0	0	0	0	112.1	Y543 D544 A549 N550 H551	Y543-T547 HydrophobicContact CD1-CG2 4.02Å; Y543-T547 HydrophobicContact CD2-CG2 4.41Å; Y543-T547 HydrophobicContact CE1-CG2 3.53Å; Y543-T547 HydrophobicContact CE2-CG2 3.99Å; Y543-T547 HydrophobicContact CG-CG2 4.44Å; Y543-T547 WeakPolarHBondContact O-CB 3.41Å; Y543-T547 WeakPolarHBondContact O-CG2 3.28Å; Y543-T547 PolarHBondContact O-N 3.19Å; Y543-T547 PolarHBondContact O-OG1 3.12Å; D544-T547 WeakPolarHBondContact CA-OG1 3.14Å; D544-T547 PolarHBondContact O-OG1 3.49Å; T547-A549 VanDerWaalsContact C-N 3.26Å; T547-A549 PolarHBondContact O-N 2.03Å; T547-N550 PolarHBondContact O-N 2.9Å; T547-H551 PolarHBondContact O-CD2 3.37Å; T547-H551 PolarHBondContact O-N 3.32Å
548	A	83.4	Confident	82.5	Confident	44 Å²	44	87.3 Å²	87.3	36%	0.364	45%	0.449	S	S	.	.	H	α-helix	trans	-68.6	-20.3	176.7	0	0	0	0	0	114.2	D544 Q545 E546 R552	D544-A548 WeakPolarHBondContact O-CB 3.39Å; D544-A548 PolarHBondContact O-N 3.22Å; Q545-A548 PolarHBondContact O-N 3.11Å; E546-A548 PolarHBondContact O-N 3.49Å; A548-R552 WeakPolarHBondContact O-CD 3.37Å; A548-R552 WeakPolarHBondContact O-CG 2.91Å
549	A	79	Confident	81.8	Confident	52 Å²	52	87.8 Å²	87.8	43%	0.43	45%	0.45	S	S	.	.	H	α-helix	trans	-79	-47.7	170.6	0	0	0	0	0	111	Q545 E546 T547 H551 R552	Q545-A549 WeakPolarHBondContact O-CB 3.05Å; Q545-A549 PolarHBondContact O-N 3.05Å; E546-A549 WeakPolarHBondContact O-CB 3.28Å; E546-A549 PolarHBondContact O-N 3.32Å; E546-A549 VanDerWaalsContact O-N 3.16Å; T547-A549 VanDerWaalsContact C-N 3.26Å; T547-A549 PolarHBondContact O-N 2.03Å; A549-H551 VanDerWaalsContact C-N 3.27Å; A549-H551 PolarHBondContact O-N 3.03Å; A549-R552 PolarHBondContact O-N 3.24Å
550	N	75.4	Confident	81.2	Confident	114 Å²	114	89.4 Å²	89.4	61%	0.61	47%	0.465	S	S	*	.	H	α-helix	trans	-64.6	-27.7	-179.8	-65.6	-13.9	0	0	0	113.1	E546 T547 R552 T553	E546-N550 VanDerWaalsContact O-CG 3.25Å; E546-N550 PolarHBondContact O-N 3.21Å; E546-N550 PolarHBondContact O-ND2 3.26Å; T547-N550 PolarHBondContact O-N 2.9Å; N550-R552 VanDerWaalsContact C-N 3.28Å; N550-R552 PolarHBondContact O-N 3.47Å; N550-T553 PolarHBondContact O-OG1 2.92Å
551	H	68.7	Low	80.3	Confident	168 Å²	168	94.5 Å²	94.5	78%	0.778	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	3.2	172.7	-75.8	-60.2	0	0	0	114.7	T547 A549	T547-H551 PolarHBondContact O-CD2 3.37Å; T547-H551 PolarHBondContact O-N 3.32Å; A549-H551 VanDerWaalsContact C-N 3.27Å; A549-H551 PolarHBondContact O-N 3.03Å
552	R	58.3	Low	79.3	Confident	219 Å²	219	95.9 Å²	95.9	83%	0.826	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.9	-2	178.4	-74	179.5	176.1	167.5	2.7	114	A548 A549 N550	A548-R552 WeakPolarHBondContact O-CD 3.37Å; A548-R552 WeakPolarHBondContact O-CG 2.91Å; A549-R552 PolarHBondContact O-N 3.24Å; N550-R552 VanDerWaalsContact C-N 3.28Å; N550-R552 PolarHBondContact O-N 3.47Å
553	T	45.9	Very low	78.2	Confident	171 Å²	171	99.8 Å²	99.8	100%	1.049	52%	0.515	S	S	*	.			trans	-104.2	0	170.1	49.6	0	0	0	0	109.2	N550	N550-T553 PolarHBondContact O-OG1 2.92Å

Retrieved 553 of 553 residues in 922.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).