A0A096NHH0_PAPAN Loading...

Vacuolar protein sorting-associated protein 52 homolog

AlphaFold DB , UniProt , Accession A0A096NHH0, Species PAPAN (Papio anubis, Olive baboon), Gene VPS52, Length 723 aa.

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(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	38.3	Very low	37.7	Very low	234 Å²	234	109.5 Å²	109.5	100%	1.153	76%	0.762	S	S	*	*				0	75	0	-65.8	-153.8	-73.3	0	0	108.6
2	A	38.6	Very low	37.7	Very low	95 Å²	95	119.3 Å²	119.3	79%	0.785	77%	0.77	S	S	*	*			cis	70.4	11.4	41.1	0	0	0	0	0	116.2
3	A	34.5	Very low	37.7	Very low	86 Å²	86	123.5 Å²	123.5	71%	0.711	77%	0.773	S	S	*	*	S	Bend	trans	-142.6	12.2	175.2	0	0	0	0	0	115.4
4	A	36.7	Very low	37.3	Very low	95 Å²	95	126.6 Å²	126.6	79%	0.785	78%	0.781	S	S	*	*	S	Bend	trans	-113.8	-10	170.7	0	0	0	0	0	113.2
5	A	39.2	Very low	37	Very low	84 Å²	84	127.9 Å²	127.9	69%	0.694	79%	0.788	S	S	*	*	S	Bend	trans	-90.9	-5.4	179.5	0	0	0	0	0	113.6
6	T	42.8	Very low	36.7	Very low	106 Å²	106	129.8 Å²	129.8	65%	0.65	79%	0.79	S	S	*	*	S	Bend	trans	-103.2	-1.1	-172.5	-4.2	0	0	0	0	114.8
7	M	35.5	Very low	36.2	Very low	170 Å²	170	136.4 Å²	136.4	84%	0.837	80%	0.797	S	S	*	*	S	Bend	trans	-110.1	-5.8	171.9	-77.5	-156.6	-68.3	0	0	114.2
8	A	39.1	Very low	35.8	Very low	77 Å²	77	134.8 Å²	134.8	64%	0.636	80%	0.803	S	S	*	*	S	Bend	trans	-89.4	-4.3	174.9	0	0	0	0	0	113.7
9	A	38.7	Very low	35.3	Very low	76 Å²	76	131.9 Å²	131.9	63%	0.628	80%	0.804	S	S	*	*	S	Bend	trans	-103.2	-9.4	-176.7	0	0	0	0	0	114.6
10	A	36.9	Very low	35.1	Very low	92 Å²	92	132.5 Å²	132.5	76%	0.76	81%	0.807	S	S	*	*	S	Bend	trans	-103.6	-5.9	-175.4	0	0	0	0	0	115.1
11	A	33.9	Very low	34.9	Very low	90 Å²	90	131.1 Å²	131.1	74%	0.744	80%	0.804	S	S	*	*	S	Bend	trans	-111.1	7.7	-179	0	0	0	0	0	113.9
12	R	38.1	Very low	34.5	Very low	226 Å²	226	127.8 Å²	127.8	85%	0.853	79%	0.791	S	S	*	*	S	Bend	trans	-111.2	15.3	-175.7	-105.2	-177.6	179.8	-176.2	0.4	114.8
13	E	37.2	Very low	34.1	Very low	174 Å²	174	131.4 Å²	131.4	81%	0.813	79%	0.793	S	S	*	*	S	Bend	trans	-128.2	25.8	-177.7	-147.8	177.1	-176.3	0	0	114.1
14	L	32.7	Very low	33.8	Very low	168 Å²	168	135.5 Å²	135.5	88%	0.88	80%	0.798	S	S	*	*	S	Bend	trans	-140.3	17.4	177.6	-100.8	164.7	0	0	0	115.6
15	V	32.8	Very low	33.5	Very low	146 Å²	146	139.4 Å²	139.4	89%	0.885	80%	0.8	S	S	*	*	S	Bend	trans	-131.5	29.1	171.1	-167.8	0	0	0	0	111.1
16	L	31.9	Very low	32.9	Very low	158 Å²	158	143.9 Å²	143.9	83%	0.827	81%	0.806	S	S	*	*			trans	-117.4	73.4	171.8	-128.4	152.8	0	0	0	107.7
17	R	29.3	Very low	32.2	Very low	241 Å²	241	148 Å²	148	91%	0.909	82%	0.818	S	S	*	*	S	Bend	trans	-160	112.2	153.6	-112	169.2	-173.4	-173.1	1.6	111.6
18	A	28.5	Very low	31.8	Very low	109 Å²	109	143.3 Å²	143.3	90%	0.901	81%	0.814	S	S	*	*			trans	73.8	105.2	149	0	0	0	0	0	118.2
19	G	26.7	Very low	32	Very low	80 Å²	80	145.2 Å²	145.2	83%	0.825	82%	0.819	S	S	*	*			trans	-166.1	76.3	159.3	0	0	0	0	0	109.8
20	T	31.4	Very low	31.5	Very low	142 Å²	142	149.2 Å²	149.2	87%	0.871	83%	0.829	S	S	*	*			trans	-125.5	123.9	159.1	46.7	0	0	0	0	107.4
21	S	30.4	Very low	31.1	Very low	104 Å²	104	149.7 Å²	149.7	73%	0.727	83%	0.833	S	S	*	*			trans	-64.5	153.4	171.7	51.3	0	0	0	0	112.1
22	D	29.9	Very low	30.8	Very low	165 Å²	165	149.2 Å²	149.2	88%	0.882	84%	0.837	S	S	*	*			trans	-159.5	141.5	132.7	-89.5	-25.1	0	0	0	110.3
23	M	29.9	Very low	30.3	Very low	171 Å²	171	142.6 Å²	142.6	84%	0.842	84%	0.839	S	S	*	*			trans	-76.7	153	167	-60	-169.3	-67.7	0	0	108.3
24	E	27.7	Very low	30	Very low	171 Å²	171	139.1 Å²	139.1	80%	0.799	84%	0.84	S	S	*	*				-172.1	173.8	60.1	-80.2	-178.1	148.2	0	0	110
25	E	29.8	Very low	29.8	Very low	177 Å²	177	134.3 Å²	134.3	83%	0.827	83%	0.831	S	S	*	*			trans	98.3	104.6	159.5	-67.8	-173.8	170	0	0	120.8
26	E	26.8	Very low	29.9	Very low	179 Å²	179	136.3 Å²	136.3	84%	0.836	84%	0.836	S	S	*	*			trans	28.2	116.4	131.9	-68.2	-170.8	144.8	0	0	120.9
27	E	29.1	Very low	30.2	Very low	192 Å²	192	137.2 Å²	137.2	90%	0.897	84%	0.836	S	S	*	*				174	132.4	101.7	-92.7	-166.9	155.4	0	0	108.9
28	G	27.4	Very low	30.4	Very low	72 Å²	72	134.7 Å²	134.7	74%	0.742	84%	0.835	S	S	*	*			trans	-81.3	-156.6	172.1	0	0	0	0	0	112.3
29	P	42.8	Very low	30.5	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	82%	0.824	S	S	*	*			cis	-131.5	175	-15.6	28.6	-6.4	0	0	0	112.8
30	L	28.8	Very low	30.9	Very low	161 Å²	161	139.2 Å²	139.2	84%	0.843	83%	0.831	S	S	*	*				153	116.9	124	-78.1	162.7	0	0	0	114.8
31	A	27	Very low	31	Very low	102 Å²	102	141.6 Å²	141.6	84%	0.843	83%	0.832	S	S	*	*				87.8	123.8	129.5	0	0	0	0	0	122.8
32	G	29	Very low	31.5	Very low	80 Å²	80	145.3 Å²	145.3	83%	0.825	84%	0.843	S	S	*	*			trans	104.6	96.5	151.2	0	0	0	0	0	114.5
33	G	27.1	Very low	31.8	Very low	87 Å²	87	141.2 Å²	141.2	90%	0.897	84%	0.84	S	S	*	*				77.6	128	73.4	0	0	0	0	0	109.9
34	A	30.2	Very low	32.1	Very low	100 Å²	100	142.4 Å²	142.4	83%	0.826	84%	0.844	S	S	*	*			cis	-153.8	147.1	10.9	0	0	0	0	0	106.1
35	G	30	Very low	32.8	Very low	68 Å²	68	142 Å²	142	70%	0.701	85%	0.846	S	S	*	*				67.6	109.6	85.1	0	0	0	0	0	113
36	L	34.6	Very low	32.9	Very low	187 Å²	187	138.7 Å²	138.7	98%	0.979	85%	0.849	S	S	*	*			trans	176.6	153.9	131.3	-91.8	159.3	0	0	0	113.3
37	Q	36.9	Very low	33.6	Very low	178 Å²	178	137.2 Å²	137.2	83%	0.832	85%	0.845	S	S	*	*			trans	-139.5	131.5	-155.8	172.6	-178.3	8.7	0	0	106.1
38	E	34.1	Very low	33.8	Very low	188 Å²	188	134.5 Å²	134.5	88%	0.879	84%	0.842	S	S	*	*			trans	-145.9	107.7	168.6	-80.5	-177.6	163.6	0	0	106.8
39	S	31.5	Very low	34.4	Very low	97 Å²	97	136.3 Å²	136.3	68%	0.678	84%	0.843	S	S	*	*				76	101	62	77.2	0	0	0	0	114.5
40	L	34.8	Very low	34.6	Very low	187 Å²	187	138.9 Å²	138.9	98%	0.979	85%	0.851	S	S	*	*			trans	-72.7	132.1	164.5	-83.8	134.7	0	0	0	110.3
41	Q	33.6	Very low	35.2	Very low	191 Å²	191	139.9 Å²	139.9	89%	0.893	85%	0.851	S	S	*	*			trans	-108.4	121.4	175.9	-104.2	166	-9.4	0	0	111
42	L	39.5	Very low	36.4	Very low	182 Å²	182	145.2 Å²	145.2	95%	0.953	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-102.7	126.4	163.8	-88.2	149.2	0	0	0	107.6
43	G	36.3	Very low	37.3	Very low	79 Å²	79	148.1 Å²	148.1	81%	0.814	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-102.1	153.6	176.5	0	0	0	0	0	113.2
44	E	36.9	Very low	38.5	Very low	197 Å²	197	151.1 Å²	151.1	92%	0.921	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-80.8	163.5	-155.8	-66.4	169.8	141.3	0	0	118.1
45	L	42.1	Very low	39.5	Very low	163 Å²	163	153.1 Å²	153.1	85%	0.853	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-67.8	152.8	171.4	-80.4	94.5	0	0	0	113.9
46	A	31.6	Very low	40.8	Very low	107 Å²	107	156.9 Å²	156.9	88%	0.884	84%	0.842	S	S	*	*			trans	-139.3	131.2	156.5	0	0	0	0	0	112.6
47	I	42.4	Very low	41.8	Very low	148 Å²	148	152.6 Å²	152.6	76%	0.759	82%	0.823	S	S	*	*			trans	-107	134.1	-179.3	-65.3	159.6	0	0	0	107.9
48	T	32.7	Very low	42.6	Very low	135 Å²	135	150 Å²	150	83%	0.828	82%	0.815	S	S	*	*			trans	175.7	140.1	156.6	45.2	0	0	0	0	108.3
49	S	40.5	Very low	43.7	Very low	109 Å²	109	145.9 Å²	145.9	76%	0.762	80%	0.802	S	S	*	*			cis	-180	132.3	8.3	40	0	0	0	0	108.4
50	D	47.4	Very low	44.9	Very low	171 Å²	171	147 Å²	147	91%	0.914	80%	0.797	S	S	*	*			trans	-86.8	130.7	161.1	-94.8	-28.1	0	0	0	108.9
51	E	41.6	Very low	46.1	Very low	182 Å²	182	143 Å²	143	85%	0.85	78%	0.775	S	S	*	*			trans	-155.6	129.2	160.9	-123.8	174.6	-166.6	0	0	112.8
52	F	50.8	Low	47.3	Very low	214 Å²	214	140.8 Å²	140.8	94%	0.939	77%	0.765	S	S	*	*			trans	-77	133.7	172.2	-104.6	-102.4	0	0	0	110.3
53	I	47.7	Very low	48.2	Very low	140 Å²	140	134.8 Å²	134.8	72%	0.718	74%	0.741	S	S	*	*			trans	-125.8	130.2	174.4	-55.2	179.1	0	0	0	110	D55	I53-D55 HydrophobicContact CG2-CB 4.16Å
54	L	53.3	Low	49.2	Very low	150 Å²	150	136.8 Å²	136.8	79%	0.785	73%	0.733	S	S	*	*			trans	-114.3	35.4	-168	-117.5	166.9	0	0	0	112.5
55	D	52.1	Low	50	Low	142 Å²	142	133.1 Å²	133.1	76%	0.759	72%	0.719	S	S	*	*			trans	-110.2	10.1	-167.5	-77.2	-17.5	0	0	0	116.1	I53	I53-D55 HydrophobicContact CG2-CB 4.16Å
56	E	56.3	Low	50.8	Low	148 Å²	148	132.2 Å²	132.2	69%	0.692	71%	0.711	S	S	*	*			trans	-102.9	10.8	-176	-73.2	-171.5	162.2	0	0	116.1	H60	E56-H60 PolarHBondContact O-CD2 3.39Å
57	V	54.8	Low	52.2	Low	96 Å²	96	130.9 Å²	130.9	58%	0.582	69%	0.689	S	S	*	*	H	α-helix	trans	-72.4	-33.4	-176.9	178.9	0	0	0	0	112.9
58	D	53.6	Low	53	Low	125 Å²	125	130.5 Å²	130.5	67%	0.668	68%	0.684	S	S	*	*	H	α-helix	trans	-77.7	-24.9	-175.3	-73.1	-24.8	0	0	0	113.4
59	V	58.4	Low	54.3	Low	101 Å²	101	128.4 Å²	128.4	61%	0.612	67%	0.667	S	S	*	*	H	α-helix	trans	-70.3	-33.9	178.6	-179.6	0	0	0	0	111.5	A63	V59-A63 PolarHBondContact O-N 3.33Å
60	H	57.2	Low	55.3	Low	121 Å²	121	125.8 Å²	125.8	56%	0.56	65%	0.646	S	S	*	*	H	α-helix	trans	-74.9	-25.7	-179.7	-72.5	-61.9	0	0	0	114.1	E56	E56-H60 PolarHBondContact O-CD2 3.39Å
61	I	59.1	Low	55.9	Low	102 Å²	102	122.1 Å²	122.1	52%	0.523	62%	0.622	S	S	.	*	H	α-helix	trans	-73	-34.7	176.8	-63.1	176.1	0	0	0	110.4
62	Q	58.6	Low	57	Low	145 Å²	145	120 Å²	120	68%	0.678	61%	0.612	S	S	*	*	H	α-helix	trans	-77.4	-34.2	-177	-146.8	153.9	-3.3	0	0	112.5	L65	Q62-L65 PolarHBondContact O-N 3.2Å
63	A	58.8	Low	57.3	Low	56 Å²	56	110.8 Å²	110.8	46%	0.463	58%	0.576	S	S	.	*	H	α-helix	trans	-67.3	-34.8	175.3	0	0	0	0	0	113.4	V59 L65 E66	V59-A63 PolarHBondContact O-N 3.33Å; A63-L65 VanDerWaalsContact C-N 3.26Å; A63-L65 PolarHBondContact O-N 3.43Å; A63-E66 PolarHBondContact O-N 3.07Å
64	N	56.5	Low	57.9	Low	121 Å²	121	109.9 Å²	109.9	65%	0.647	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-14.5	178.6	-81	-9.3	0	0	0	114
65	L	54.6	Low	58.1	Low	120 Å²	120	111.8 Å²	111.8	63%	0.628	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-7.8	175.9	-88.9	150.5	0	0	0	113.3	Q62 A63	Q62-L65 PolarHBondContact O-N 3.2Å; A63-L65 VanDerWaalsContact C-N 3.26Å; A63-L65 PolarHBondContact O-N 3.43Å
66	E	58.2	Low	58.5	Low	143 Å²	143	109.7 Å²	109.7	67%	0.668	57%	0.566	S	S	*	*	S	Bend	trans	-99.3	-11.9	-178.3	-67.8	-171.2	162.3	0	0	114.4	A63 E68	A63-E66 PolarHBondContact O-N 3.07Å; E66-E68 PolarHBondContact O-N 3.37Å
67	D	61.7	Low	58.5	Low	79 Å²	79	106.2 Å²	106.2	42%	0.422	57%	0.57	S	S	.	*			trans	-67	119.7	-179.6	-164.2	-36.7	0	0	0	112	L69 V70 K71	D67-L69 PolarHBondContact O-N 3.36Å; D67-L69 WeakPolarHBondContact OD1-CB 3.49Å; D67-L69 PolarHBondContact OD1-N 3.34Å; D67-V70 HydrophobicContact CB-CB 4.24Å; D67-V70 HydrophobicContact CB-CG2 3.9Å; D67-V70 PolarHBondContact O-N 3.14Å; D67-V70 VanDerWaalsContact O-N 3.09Å; D67-K71 PolarHBondContact O-N 3.31Å; D67-K71 VanDerWaalsContact O-N 3.07Å
68	E	59.9	Low	58.8	Low	140 Å²	140	106.5 Å²	106.5	65%	0.654	57%	0.572	S	S	*	*	H	α-helix	trans	-59.3	-31.7	-178.2	-83.6	-68.5	143.6	0	0	112.7	E66 K71 E72	E66-E68 PolarHBondContact O-N 3.37Å; E68-K71 PolarHBondContact O-N 3.06Å; E68-E72 PolarHBondContact O-N 3.33Å; E68-E72 VanDerWaalsContact O-N 3.08Å
69	L	59.2	Low	58.8	Low	92 Å²	92	106.2 Å²	106.2	48%	0.482	57%	0.57	S	S	.	*	H	α-helix	trans	-70.7	-34.5	176	-90.4	151.6	0	0	0	112.3	D67 A73 Y83	D67-L69 PolarHBondContact O-N 3.36Å; D67-L69 WeakPolarHBondContact OD1-CB 3.49Å; D67-L69 PolarHBondContact OD1-N 3.34Å; L69-A73 WeakPolarHBondContact O-CB 3.49Å; L69-A73 PolarHBondContact O-N 3.28Å; L69-Y83 HydrophobicContact CD2-CE1 4.22Å; L69-Y83 WeakPolarHBondContact CD2-OH 3.34Å
70	V	61.1	Low	59	Low	54 Å²	54	105.6 Å²	105.6	33%	0.327	56%	0.563	S	S	.	*	H	α-helix	trans	-74.6	-32.4	177.1	-178.4	0	0	0	0	110.6	D67 L74	D67-V70 HydrophobicContact CB-CB 4.24Å; D67-V70 HydrophobicContact CB-CG2 3.9Å; D67-V70 PolarHBondContact O-N 3.14Å; D67-V70 VanDerWaalsContact O-N 3.09Å; V70-L74 HydrophobicContact CG1-CD1 4.2Å; V70-L74 PolarHBondContact O-N 3.41Å; V70-L74 VanDerWaalsContact O-N 3.14Å
71	K	61.1	Low	59.3	Low	93 Å²	93	110.1 Å²	110.1	40%	0.404	58%	0.575	S	S	.	*	H	α-helix	trans	-67.7	-36.8	171.7	-83	173.8	-179.5	158.3	0	113.6	D67 E68 K75	D67-K71 PolarHBondContact O-N 3.31Å; D67-K71 VanDerWaalsContact O-N 3.07Å; E68-K71 PolarHBondContact O-N 3.06Å; K71-K75 PolarHBondContact O-N 3.04Å
72	E	63.1	Low	59.4	Low	137 Å²	137	112.6 Å²	112.6	64%	0.64	58%	0.584	S	S	*	*	H	α-helix	trans	-72.5	-34.8	177.7	-150	174.7	-165.7	0	0	111.8	E68 T76	E68-E72 PolarHBondContact O-N 3.33Å; E68-E72 VanDerWaalsContact O-N 3.08Å; E72-T76 PolarHBondContact O-OG1 3.34Å
73	A	58.1	Low	59.4	Low	22 Å²	22	111.6 Å²	111.6	18%	0.182	58%	0.575	C	S	.	*	H	α-helix	trans	-69.5	-37	175	0	0	0	0	0	113.8	L69 L80	L69-A73 WeakPolarHBondContact O-CB 3.49Å; L69-A73 PolarHBondContact O-N 3.28Å; A73-L80 HydrophobicContact CB-CD2 3.93Å
74	L	59.7	Low	59.5	Low	121 Å²	121	112.4 Å²	112.4	63%	0.634	58%	0.578	S	S	*	*	H	α-helix	trans	-76.9	-21.1	177.3	-82.1	161.1	0	0	0	113.8	V70	V70-L74 HydrophobicContact CG1-CD1 4.2Å; V70-L74 PolarHBondContact O-N 3.41Å; V70-L74 VanDerWaalsContact O-N 3.14Å
75	K	58.9	Low	60.1	Low	189 Å²	189	113.8 Å²	113.8	82%	0.822	58%	0.578	S	S	*	*	H	α-helix	trans	-82.2	-22.1	176.9	-89.1	178.6	176.9	171.9	0	114.6	K71	K71-K75 PolarHBondContact O-N 3.04Å
76	T	60.7	Low	60.7	Low	99 Å²	99	113.8 Å²	113.8	61%	0.607	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-1.8	-178.1	43.4	0	0	0	0	114.1	E72 V78	E72-T76 PolarHBondContact O-OG1 3.34Å; T76-V78 VanDerWaalsContact C-N 3.27Å; T76-V78 PolarHBondContact O-N 3.08Å
77	G	54.7	Low	61.1	Low	75 Å²	75	110.1 Å²	110.1	77%	0.773	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	65.8	24.9	173.3	0	0	0	0	0	114.7
78	V	62	Low	61.5	Low	101 Å²	101	112.4 Å²	112.4	61%	0.612	57%	0.57	S	S	*	*			trans	-102	139.4	-179.8	-169.7	0	0	0	0	110.4	T76 L80	T76-V78 VanDerWaalsContact C-N 3.27Å; T76-V78 PolarHBondContact O-N 3.08Å; V78-L80 PolarHBondContact O-N 3.03Å
79	D	54.3	Low	62.1	Low	119 Å²	119	110.9 Å²	110.9	64%	0.636	57%	0.566	S	S	*	*			trans	-67.5	119.7	-176.2	-168	-8.7	0	0	0	112.8	R81 H82	D79-R81 PolarHBondContact O-N 3.09Å; D79-H82 PolarHBondContact O-N 3.2Å
80	L	61.3	Low	62.5	Low	88 Å²	88	112.2 Å²	112.2	46%	0.461	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.4	-17.5	-171.6	-80.8	145.6	0	0	0	115.4	A73 V78 H82	A73-L80 HydrophobicContact CB-CD2 3.93Å; V78-L80 PolarHBondContact O-N 3.03Å; L80-H82 VanDerWaalsContact C-N 3.32Å; L80-H82 PolarHBondContact O-N 3.25Å
81	R	63.3	Low	63	Low	216 Å²	216	115.1 Å²	115.1	82%	0.815	58%	0.583	S	S	*	*	H	α-helix	trans	-71.1	-24.8	-179.8	-70.3	179.1	172.3	-175.8	-1.6	113.8	D79	D79-R81 PolarHBondContact O-N 3.09Å
82	H	61.7	Low	63.6	Low	155 Å²	155	117.1 Å²	117.1	72%	0.718	59%	0.593	S	S	*	*	H	α-helix	trans	-82.6	-28.4	-177.9	-135	-80	0	0	0	112.5	D79 L80	D79-H82 PolarHBondContact O-N 3.2Å; L80-H82 VanDerWaalsContact C-N 3.32Å; L80-H82 PolarHBondContact O-N 3.25Å
83	Y	57.8	Low	64	Low	123 Å²	123	116.7 Å²	116.7	48%	0.482	59%	0.591	S	S	.	*	H	α-helix	trans	-75.7	-40.9	-178.7	-166.9	-103.3	0	0	0	112.7	L69 K85 Q86 V87	L69-Y83 HydrophobicContact CD2-CE1 4.22Å; L69-Y83 WeakPolarHBondContact CD2-OH 3.34Å; Y83-K85 VanDerWaalsContact C-N 3.25Å; Y83-K85 PolarHBondContact O-N 3.44Å; Y83-Q86 PolarHBondContact O-N 3.44Å; Y83-V87 HydrophobicContact CD1-CG2 4.24Å; Y83-V87 HydrophobicContact CE1-CG2 3.95Å; Y83-V87 PolarHBondContact O-N 3.16Å
84	S	61.7	Low	64.6	Low	74 Å²	74	121.1 Å²	121.1	52%	0.517	61%	0.611	S	S	.	*	H	α-helix	trans	-55.6	-39.5	175.9	157.9	0	0	0	0	112.6	Q86 V87 E88	S84-Q86 VanDerWaalsContact C-N 3.27Å; S84-Q86 PolarHBondContact O-N 3.3Å; S84-V87 PolarHBondContact O-N 3.29Å; S84-E88 PolarHBondContact O-N 3.36Å; S84-E88 VanDerWaalsContact O-N 3.16Å
85	K	68.4	Low	65.2	Low	150 Å²	150	121.3 Å²	121.3	65%	0.652	61%	0.609	S	S	*	*	H	α-helix	trans	-65.8	-27.1	178.3	-108.6	-178.9	178.1	179.5	0	114.1	Y83	Y83-K85 VanDerWaalsContact C-N 3.25Å; Y83-K85 PolarHBondContact O-N 3.44Å
86	Q	67.4	Low	65.9	Low	119 Å²	119	118.4 Å²	118.4	56%	0.556	60%	0.598	S	S	*	*	H	α-helix	trans	-80.3	-40.6	-179.5	-165.8	171.1	-10.6	0	0	111.1	Y83 S84 L89 E90	Y83-Q86 PolarHBondContact O-N 3.44Å; S84-Q86 VanDerWaalsContact C-N 3.27Å; S84-Q86 PolarHBondContact O-N 3.3Å; Q86-L89 PolarHBondContact O-N 3.04Å; Q86-E90 PolarHBondContact O-N 3.33Å
87	V	66.5	Low	66.5	Low	66 Å²	66	121.1 Å²	121.1	40%	0.4	60%	0.601	S	S	.	*	H	α-helix	trans	-65.6	-39.8	177	178.5	0	0	0	0	111.9	Y83 S84 L89 E90 L91	Y83-V87 HydrophobicContact CD1-CG2 4.24Å; Y83-V87 HydrophobicContact CE1-CG2 3.95Å; Y83-V87 PolarHBondContact O-N 3.16Å; S84-V87 PolarHBondContact O-N 3.29Å; V87-L89 PolarHBondContact O-N 3.32Å; V87-E90 PolarHBondContact O-N 3.48Å; V87-L91 PolarHBondContact O-N 3.06Å
88	E	70.4	Confident	67.1	Low	127 Å²	127	120.6 Å²	120.6	59%	0.593	59%	0.586	S	S	*	*	H	α-helix	trans	-58.9	-33.8	177	-124.1	177	177.4	0	0	112.5	S84 Q92	S84-E88 PolarHBondContact O-N 3.36Å; S84-E88 VanDerWaalsContact O-N 3.16Å; E88-Q92 PolarHBondContact O-N 3.2Å
89	L	72.1	Confident	67.8	Low	109 Å²	109	120.5 Å²	120.5	57%	0.571	58%	0.581	S	S	*	*	H	α-helix	trans	-77.9	-35.6	-177.4	-138.8	150.1	0	0	0	111.9	Q86 V87	Q86-L89 PolarHBondContact O-N 3.04Å; V87-L89 PolarHBondContact O-N 3.32Å
90	E	69.3	Low	68.7	Low	119 Å²	119	122.6 Å²	122.6	56%	0.556	58%	0.58	S	S	*	*	H	α-helix	trans	-70.1	-38.1	173.9	-72	-176.4	178.4	0	0	112	Q86 V87 Q92 Q93 I94	Q86-E90 PolarHBondContact O-N 3.33Å; V87-E90 PolarHBondContact O-N 3.48Å; E90-Q92 PolarHBondContact O-N 3.22Å; E90-Q93 PolarHBondContact O-N 3.25Å; E90-I94 PolarHBondContact O-N 3.41Å
91	L	70.5	Confident	69.2	Low	116 Å²	116	123.5 Å²	123.5	61%	0.607	59%	0.585	S	S	*	*	H	α-helix	trans	-63.2	-43.9	179.6	-142.3	96.7	0	0	0	111.9	V87 Q93 I94 E95	V87-L91 PolarHBondContact O-N 3.06Å; L91-Q93 PolarHBondContact O-N 3.29Å; L91-I94 PolarHBondContact O-N 3.24Å; L91-E95 PolarHBondContact O-N 3.18Å
92	Q	73.1	Confident	69.6	Low	134 Å²	134	122.3 Å²	122.3	63%	0.626	58%	0.582	S	S	*	*	H	α-helix	trans	-61.3	-30.3	178.1	-79.2	-174.5	-9.3	0	0	113.2	E88 E90 Q96	E88-Q92 PolarHBondContact O-N 3.2Å; E90-Q92 PolarHBondContact O-N 3.22Å; Q92-Q96 PolarHBondContact O-N 3.47Å
93	Q	72.3	Confident	70.2	Confident	128 Å²	128	120.4 Å²	120.4	60%	0.598	58%	0.576	S	S	*	*	H	α-helix	trans	-73.5	-35.5	178.4	-75.4	-173.4	-1.5	0	0	113	E90 L91	E90-Q93 PolarHBondContact O-N 3.25Å; L91-Q93 PolarHBondContact O-N 3.29Å
94	I	71.1	Confident	71.1	Confident	116 Å²	116	121.8 Å²	121.8	60%	0.595	59%	0.587	S	S	*	*	H	α-helix	trans	-73.2	-42.4	-179.7	-65.5	175	0	0	0	110.3	E90 L91 Q96 K97 S98	E90-I94 PolarHBondContact O-N 3.41Å; L91-I94 PolarHBondContact O-N 3.24Å; I94-Q96 VanDerWaalsContact C-N 3.29Å; I94-Q96 PolarHBondContact O-N 3.25Å; I94-K97 WeakPolarHBondContact O-CB 3.42Å; I94-K97 PolarHBondContact O-N 3.46Å; I94-S98 PolarHBondContact O-N 3.38Å
95	E	72.8	Confident	71.8	Confident	125 Å²	125	123.1 Å²	123.1	58%	0.584	59%	0.585	S	S	*	*	H	α-helix	trans	-58.7	-41.7	179.9	-137.5	176.8	-170.9	0	0	111.8	L91 K97 S98 I99	L91-E95 PolarHBondContact O-N 3.18Å; E95-K97 VanDerWaalsContact C-N 3.28Å; E95-K97 PolarHBondContact O-N 2.97Å; E95-S98 PolarHBondContact O-N 3.42Å; E95-I99 WeakPolarHBondContact O-CG1 3.5Å; E95-I99 PolarHBondContact O-N 3.07Å
96	Q	73	Confident	72.1	Confident	128 Å²	128	119 Å²	119	60%	0.598	58%	0.575	S	S	*	*	H	α-helix	trans	-64.4	-27.5	174.7	-90.6	-171.6	-2.6	0	0	114.3	Q92 I94	Q92-Q96 PolarHBondContact O-N 3.47Å; I94-Q96 VanDerWaalsContact C-N 3.29Å; I94-Q96 PolarHBondContact O-N 3.25Å
97	K	72	Confident	72.5	Confident	155 Å²	155	121 Å²	121	67%	0.674	58%	0.584	S	S	*	*	H	α-helix	trans	-74.5	-48.8	177	-100.2	-179.9	176.2	176	0	111.4	I94 E95 I99 R100 D101	I94-K97 WeakPolarHBondContact O-CB 3.42Å; I94-K97 PolarHBondContact O-N 3.46Å; E95-K97 VanDerWaalsContact C-N 3.28Å; E95-K97 PolarHBondContact O-N 2.97Å; K97-I99 VanDerWaalsContact C-N 3.31Å; K97-I99 PolarHBondContact O-N 3.32Å; K97-R100 WeakPolarHBondContact O-CB 3.35Å; K97-R100 PolarHBondContact O-N 3.33Å; K97-R100 VanDerWaalsContact O-N 3.07Å; K97-D101 PolarHBondContact O-N 3.2Å
98	S	68.8	Low	73.1	Confident	64 Å²	64	122.7 Å²	122.7	45%	0.448	59%	0.591	S	S	.	*	H	α-helix	trans	-65.4	-33.1	-178.1	-66	0	0	0	0	113.4	I94 E95 R100 D101 Y102	I94-S98 PolarHBondContact O-N 3.38Å; E95-S98 PolarHBondContact O-N 3.42Å; S98-R100 VanDerWaalsContact C-N 3.28Å; S98-R100 PolarHBondContact O-N 3.36Å; S98-D101 PolarHBondContact O-N 3.24Å; S98-Y102 PolarHBondContact O-N 3.32Å
99	I	75.3	Confident	73.4	Confident	99 Å²	99	122.2 Å²	122.2	51%	0.508	59%	0.591	S	S	.	*	H	α-helix	trans	-63.3	-35.9	174	-68	168.6	0	0	0	111	E95 K97 I103	E95-I99 WeakPolarHBondContact O-CG1 3.5Å; E95-I99 PolarHBondContact O-N 3.07Å; K97-I99 VanDerWaalsContact C-N 3.31Å; K97-I99 PolarHBondContact O-N 3.32Å; I99-I103 HydrophobicContact CG2-CD1 3.65Å; I99-I103 HydrophobicContact CG2-CG1 4.39Å; I99-I103 WeakPolarHBondContact O-CB 3.45Å; I99-I103 WeakPolarHBondContact O-CD1 3.36Å; I99-I103 WeakPolarHBondContact O-CG1 3.38Å; I99-I103 PolarHBondContact O-N 3.1Å; I99-I103 VanDerWaalsContact O-N 3.07Å
100	R	73.5	Confident	73.7	Confident	164 Å²	164	119.4 Å²	119.4	62%	0.619	58%	0.584	S	S	*	*	H	α-helix	trans	-66.9	-42.9	177.3	-74.5	-176.9	-158.4	172.5	7	112.4	K97 S98 Y102 I103 Q104	K97-R100 WeakPolarHBondContact O-CB 3.35Å; K97-R100 PolarHBondContact O-N 3.33Å; K97-R100 VanDerWaalsContact O-N 3.07Å; S98-R100 VanDerWaalsContact C-N 3.28Å; S98-R100 PolarHBondContact O-N 3.36Å; R100-Y102 VanDerWaalsContact C-N 3.34Å; R100-Y102 PolarHBondContact O-N 3.02Å; R100-I103 PolarHBondContact O-N 3.33Å; R100-Q104 WeakPolarHBondContact O-CB 3.47Å; R100-Q104 PolarHBondContact O-N 3.34Å
101	D	72.6	Confident	74.4	Confident	106 Å²	106	116.6 Å²	116.6	57%	0.567	58%	0.577	S	S	*	*	H	α-helix	trans	-64.2	-41.2	-179.4	-67.8	-9	0	0	0	111.1	K97 S98 Q104 E105	K97-D101 PolarHBondContact O-N 3.2Å; S98-D101 PolarHBondContact O-N 3.24Å; D101-Q104 PolarHBondContact O-N 2.9Å; D101-E105 PolarHBondContact O-N 3.3Å
102	Y	72.1	Confident	74.8	Confident	191 Å²	191	116.2 Å²	116.2	75%	0.749	58%	0.575	S	S	*	*	H	α-helix	trans	-66.5	-37.4	175.4	-98.3	-77.2	0	0	0	113.6	S98 R100 Q104 S106	S98-Y102 PolarHBondContact O-N 3.32Å; R100-Y102 VanDerWaalsContact C-N 3.34Å; R100-Y102 PolarHBondContact O-N 3.02Å; Y102-Q104 VanDerWaalsContact C-N 3.27Å; Y102-Q104 PolarHBondContact O-N 3.02Å; Y102-S106 PolarHBondContact O-N 3.19Å
103	I	74.8	Confident	75.3	Confident	116 Å²	116	115.8 Å²	115.8	60%	0.595	57%	0.573	S	S	*	*	H	α-helix	trans	-64.1	-39.2	175.2	-72.5	168	0	0	0	110	I99 R100 S106	I99-I103 HydrophobicContact CG2-CD1 3.65Å; I99-I103 HydrophobicContact CG2-CG1 4.39Å; I99-I103 WeakPolarHBondContact O-CB 3.45Å; I99-I103 WeakPolarHBondContact O-CD1 3.36Å; I99-I103 WeakPolarHBondContact O-CG1 3.38Å; I99-I103 PolarHBondContact O-N 3.1Å; I99-I103 VanDerWaalsContact O-N 3.07Å; R100-I103 PolarHBondContact O-N 3.33Å; I103-S106 PolarHBondContact O-OG 3.39Å
104	Q	76.3	Confident	75.9	Confident	151 Å²	151	114.8 Å²	114.8	71%	0.706	57%	0.572	S	S	*	*	H	α-helix	trans	-67	-36.7	-176.6	-159.1	169.8	4.4	0	0	113.1	R100 D101 Y102	R100-Q104 WeakPolarHBondContact O-CB 3.47Å; R100-Q104 PolarHBondContact O-N 3.34Å; D101-Q104 PolarHBondContact O-N 2.9Å; Y102-Q104 VanDerWaalsContact C-N 3.27Å; Y102-Q104 PolarHBondContact O-N 3.02Å
105	E	75.6	Confident	76.4	Confident	103 Å²	103	115.1 Å²	115.1	48%	0.481	57%	0.571	S	S	.	*	H	α-helix	trans	-93.5	-2.8	-176	-148.9	57.1	-143.4	0	0	114.4	D101 E107 N108	D101-E105 PolarHBondContact O-N 3.3Å; E105-E107 VanDerWaalsContact C-N 3.35Å; E105-E107 PolarHBondContact O-N 2.66Å; E105-N108 PolarHBondContact O-N 3.41Å; E105-N108 PolarHBondContact OE1-ND2 2.97Å
106	S	73.9	Confident	76.9	Confident	63 Å²	63	113.6 Å²	113.6	44%	0.441	57%	0.566	S	S	.	*	H	α-helix	trans	-62.4	-33.9	-174.8	69.6	0	0	0	0	114.5	Y102 I103 A110	Y102-S106 PolarHBondContact O-N 3.19Å; I103-S106 PolarHBondContact O-OG 3.39Å; S106-A110 WeakPolarHBondContact O-CB 3.41Å; S106-A110 PolarHBondContact O-N 3.28Å
107	E	77.5	Confident	77.4	Confident	161 Å²	161	110.8 Å²	110.8	75%	0.752	56%	0.558	S	S	*	*	H	α-helix	trans	-68.7	-37.8	-179	-77	-171.3	153.6	0	0	112.7	E105 A110 S111	E105-E107 VanDerWaalsContact C-N 3.35Å; E105-E107 PolarHBondContact O-N 2.66Å; E107-A110 PolarHBondContact O-N 3.49Å; E107-S111 PolarHBondContact O-N 3.02Å
108	N	78.2	Confident	78.1	Confident	102 Å²	102	106 Å²	106	55%	0.545	55%	0.546	S	S	.	.	H	α-helix	trans	-68.8	-41.3	-178.8	-74.3	-21.1	0	0	0	111.7	E105 S111 L112	E105-N108 PolarHBondContact O-N 3.41Å; E105-N108 PolarHBondContact OE1-ND2 2.97Å; N108-S111 PolarHBondContact O-N 3.42Å; N108-L112 PolarHBondContact O-N 3.27Å
109	I	76.4	Confident	78.7	Confident	116 Å²	116	106.8 Å²	106.8	60%	0.595	55%	0.551	S	S	*	*	H	α-helix	trans	-67.3	-41.1	177.9	-62.7	174.2	0	0	0	110.7	S111 L112 H113	I109-S111 VanDerWaalsContact C-N 3.32Å; I109-S111 PolarHBondContact O-N 3.44Å; I109-L112 PolarHBondContact O-N 3.41Å; I109-H113 PolarHBondContact O-N 3.39Å; I109-H113 VanDerWaalsContact O-N 3.17Å
110	A	79.9	Confident	79.2	Confident	50 Å²	50	106.7 Å²	106.7	41%	0.413	55%	0.552	S	S	.	*	H	α-helix	trans	-62.1	-39.9	175.9	0	0	0	0	0	112	S106 E107 N114	S106-A110 WeakPolarHBondContact O-CB 3.41Å; S106-A110 PolarHBondContact O-N 3.28Å; E107-A110 PolarHBondContact O-N 3.49Å; A110-N114 PolarHBondContact O-N 3.48Å; A110-N114 PolarHBondContact O-ND2 3.26Å; A110-N114 VanDerWaalsContact O-ND2 3.12Å
111	S	82.4	Confident	79.7	Confident	61 Å²	61	101.3 Å²	101.3	43%	0.427	54%	0.543	S	S	.	.	H	α-helix	trans	-61.9	-47.1	178.1	-177.6	0	0	0	0	113	E107 N108 I109 N114 Q115	E107-S111 PolarHBondContact O-N 3.02Å; N108-S111 PolarHBondContact O-N 3.42Å; I109-S111 VanDerWaalsContact C-N 3.32Å; I109-S111 PolarHBondContact O-N 3.44Å; S111-N114 PolarHBondContact O-N 3.18Å; S111-Q115 PolarHBondContact O-N 3.46Å
112	L	80	Confident	80.3	Confident	107 Å²	107	100.5 Å²	100.5	56%	0.56	54%	0.541	S	S	*	.	H	α-helix	trans	-66.2	-41.6	-179.9	-171.4	72.2	0	0	0	111.9	N108 I109 N114 Q115 I116	N108-L112 PolarHBondContact O-N 3.27Å; I109-L112 PolarHBondContact O-N 3.41Å; L112-N114 VanDerWaalsContact C-N 3.29Å; L112-N114 PolarHBondContact O-N 3Å; L112-Q115 PolarHBondContact O-N 3.29Å; L112-I116 HydrophobicContact CG-CD1 4.33Å; L112-I116 PolarHBondContact O-N 3.07Å; L112-I116 VanDerWaalsContact O-N 3.12Å
113	H	82.1	Confident	80.9	Confident	125 Å²	125	96.8 Å²	96.8	58%	0.579	53%	0.534	S	S	*	.	H	α-helix	trans	-60.3	-41.3	175.8	-172.3	66.2	0	0	0	111.3	I109 Q115 I116 T117	I109-H113 PolarHBondContact O-N 3.39Å; I109-H113 VanDerWaalsContact O-N 3.17Å; H113-Q115 VanDerWaalsContact C-N 3.32Å; H113-Q115 PolarHBondContact O-N 3.49Å; H113-I116 PolarHBondContact O-N 3.28Å; H113-T117 WeakPolarHBondContact O-CB 3.46Å; H113-T117 PolarHBondContact O-N 3.27Å; H113-T117 PolarHBondContact O-OG1 2.85Å
114	N	85.1	Confident	81.5	Confident	107 Å²	107	96.6 Å²	96.6	57%	0.572	53%	0.53	S	S	*	.	H	α-helix	trans	-62.2	-36.1	176.2	-71.1	-26.5	0	0	0	113	A110 S111 L112 A118	A110-N114 PolarHBondContact O-N 3.48Å; A110-N114 PolarHBondContact O-ND2 3.26Å; A110-N114 VanDerWaalsContact O-ND2 3.12Å; S111-N114 PolarHBondContact O-N 3.18Å; L112-N114 VanDerWaalsContact C-N 3.29Å; L112-N114 PolarHBondContact O-N 3Å; N114-A118 WeakPolarHBondContact O-CB 3.19Å; N114-A118 PolarHBondContact O-N 3.24Å; N114-A118 VanDerWaalsContact O-N 3.08Å
115	Q	83.1	Confident	82	Confident	123 Å²	123	98.4 Å²	98.4	58%	0.575	53%	0.531	S	S	*	.	H	α-helix	trans	-72.7	-40	179.2	-71.3	-178	-1.1	0	0	113.3	S111 L112 H113 A118 C119	S111-Q115 PolarHBondContact O-N 3.46Å; L112-Q115 PolarHBondContact O-N 3.29Å; H113-Q115 VanDerWaalsContact C-N 3.32Å; H113-Q115 PolarHBondContact O-N 3.49Å; Q115-A118 WeakPolarHBondContact O-CB 3.47Å; Q115-A118 PolarHBondContact O-N 3.07Å; Q115-C119 PolarHBondContact O-N 3.36Å; Q115-C119 VanDerWaalsContact O-N 3.14Å
116	I	81.8	Confident	82.5	Confident	93 Å²	93	98.8 Å²	98.8	48%	0.477	53%	0.534	S	S	.	.	H	α-helix	trans	-66.8	-46.9	177.1	-67.1	173.7	0	0	0	109.7	L112 H113 A118 C119 D120	L112-I116 HydrophobicContact CG-CD1 4.33Å; L112-I116 PolarHBondContact O-N 3.07Å; L112-I116 VanDerWaalsContact O-N 3.12Å; H113-I116 PolarHBondContact O-N 3.28Å; I116-A118 PolarHBondContact O-N 3.19Å; I116-C119 PolarHBondContact O-N 2.93Å; I116-D120 PolarHBondContact O-N 3.41Å
117	T	85.2	Confident	83	Confident	70 Å²	70	102.9 Å²	102.9	43%	0.429	55%	0.546	S	S	.	.	H	α-helix	trans	-58.2	-33.7	175.4	-55.9	0	0	0	0	111.8	H113 A121	H113-T117 WeakPolarHBondContact O-CB 3.46Å; H113-T117 PolarHBondContact O-N 3.27Å; H113-T117 PolarHBondContact O-OG1 2.85Å; T117-A121 VanDerWaalsContact O-CB 3.3Å; T117-A121 WeakPolarHBondContact O-CB 3.37Å; T117-A121 PolarHBondContact O-N 2.75Å; T117-A121 VanDerWaalsContact O-N 3.08Å
118	A	84.8	Confident	83.4	Confident	53 Å²	53	101 Å²	101	44%	0.438	54%	0.537	S	S	.	.	H	α-helix	trans	-69.4	-36.8	174.8	0	0	0	0	0	113.4	N114 Q115 I116 V122	N114-A118 WeakPolarHBondContact O-CB 3.19Å; N114-A118 PolarHBondContact O-N 3.24Å; N114-A118 VanDerWaalsContact O-N 3.08Å; Q115-A118 WeakPolarHBondContact O-CB 3.47Å; Q115-A118 PolarHBondContact O-N 3.07Å; I116-A118 PolarHBondContact O-N 3.19Å; A118-V122 WeakPolarHBondContact O-CG2 3.2Å; A118-V122 PolarHBondContact O-N 3.24Å
119	C	82.9	Confident	83.9	Confident	81 Å²	81	102.1 Å²	102.1	55%	0.547	54%	0.541	S	S	.	.	H	α-helix	trans	-71.3	-42.2	177.1	-71	0	0	0	0	112.1	Q115 I116 A121 V122 L123	Q115-C119 PolarHBondContact O-N 3.36Å; Q115-C119 VanDerWaalsContact O-N 3.14Å; I116-C119 PolarHBondContact O-N 2.93Å; C119-A121 VanDerWaalsContact C-N 3.29Å; C119-A121 PolarHBondContact O-N 3.41Å; C119-V122 PolarHBondContact O-N 3.12Å; C119-V122 VanDerWaalsContact O-N 3.07Å; C119-L123 PolarHBondContact O-N 3.03Å
120	D	85.5	Confident	84.3	Confident	97 Å²	97	102.2 Å²	102.2	52%	0.519	54%	0.542	S	S	.	.	H	α-helix	trans	-60.8	-41.8	175.2	-74.7	-17.7	0	0	0	110.7	I116 V122 L123 E124	I116-D120 PolarHBondContact O-N 3.41Å; D120-V122 PolarHBondContact O-N 3.07Å; D120-L123 PolarHBondContact O-N 3.06Å; D120-E124 VanDerWaalsContact O-CB 3.31Å; D120-E124 WeakPolarHBondContact O-CB 3.48Å; D120-E124 PolarHBondContact O-N 3.37Å
121	A	84.8	Confident	84.6	Confident	52 Å²	52	101.7 Å²	101.7	43%	0.43	54%	0.541	S	S	.	.	H	α-helix	trans	-61.3	-29.7	174.9	0	0	0	0	0	113.5	T117 C119 R125	T117-A121 VanDerWaalsContact O-CB 3.3Å; T117-A121 WeakPolarHBondContact O-CB 3.37Å; T117-A121 PolarHBondContact O-N 2.75Å; T117-A121 VanDerWaalsContact O-N 3.08Å; C119-A121 VanDerWaalsContact C-N 3.29Å; C119-A121 PolarHBondContact O-N 3.41Å; A121-R125 WeakPolarHBondContact O-CB 3.32Å; A121-R125 PolarHBondContact O-N 3.33Å
122	V	85	Confident	84.7	Confident	89 Å²	89	101 Å²	101	54%	0.539	54%	0.54	S	S	.	.	H	α-helix	trans	-77.4	-42.4	176.6	172.1	0	0	0	0	111.4	A118 C119 D120 R125 M126	A118-V122 WeakPolarHBondContact O-CG2 3.2Å; A118-V122 PolarHBondContact O-N 3.24Å; C119-V122 PolarHBondContact O-N 3.12Å; C119-V122 VanDerWaalsContact O-N 3.07Å; D120-V122 PolarHBondContact O-N 3.07Å; V122-R125 WeakPolarHBondContact O-CB 3.49Å; V122-R125 PolarHBondContact O-N 2.89Å; V122-M126 PolarHBondContact O-N 3.25Å; V122-M126 VanDerWaalsContact O-N 3.12Å
123	L	83.3	Confident	85.1	Confident	112 Å²	112	102.6 Å²	102.6	59%	0.586	54%	0.542	S	S	*	.	H	α-helix	trans	-66.9	-43.2	178.8	-74	171	0	0	0	111.7	C119 D120 R125 M126 E127	C119-L123 PolarHBondContact O-N 3.03Å; D120-L123 PolarHBondContact O-N 3.06Å; L123-R125 PolarHBondContact O-N 3.13Å; L123-M126 PolarHBondContact O-N 2.92Å; L123-M126 VanDerWaalsContact O-N 3.11Å; L123-E127 PolarHBondContact O-N 3.23Å
124	E	87.6	Confident	85.3	Confident	113 Å²	113	103.2 Å²	103.2	53%	0.528	55%	0.545	S	S	.	.	H	α-helix	trans	-56.9	-38.2	173.5	-171.3	-179.5	-176.9	0	0	111	D120 E127 Q128	D120-E124 VanDerWaalsContact O-CB 3.31Å; D120-E124 WeakPolarHBondContact O-CB 3.48Å; D120-E124 PolarHBondContact O-N 3.37Å; E124-E127 PolarHBondContact O-N 3.32Å; E124-Q128 WeakPolarHBondContact O-CB 3.45Å; E124-Q128 VanDerWaalsContact O-CG 3.29Å; E124-Q128 WeakPolarHBondContact O-CG 3.33Å; E124-Q128 PolarHBondContact O-N 3.02Å
125	R	86.9	Confident	85.5	Confident	188 Å²	188	101.6 Å²	101.6	71%	0.709	54%	0.542	S	S	*	.	H	α-helix	trans	-68.9	-35.6	178.1	-152.9	174.6	-171.9	171	2.8	113.2	A121 V122 L123 M129	A121-R125 WeakPolarHBondContact O-CB 3.32Å; A121-R125 PolarHBondContact O-N 3.33Å; V122-R125 WeakPolarHBondContact O-CB 3.49Å; V122-R125 PolarHBondContact O-N 2.89Å; L123-R125 PolarHBondContact O-N 3.13Å; R125-M129 WeakPolarHBondContact O-CB 3.34Å; R125-M129 PolarHBondContact O-N 3.17Å; R125-M129 VanDerWaalsContact O-N 3.12Å
126	M	86.4	Confident	85.7	Confident	112 Å²	112	100 Å²	100	55%	0.552	54%	0.538	S	S	*	.	H	α-helix	trans	-72.9	-40.2	175	-80.2	-174.3	70.6	0	0	112	V122 L123 M129 L130	V122-M126 PolarHBondContact O-N 3.25Å; V122-M126 VanDerWaalsContact O-N 3.12Å; L123-M126 PolarHBondContact O-N 2.92Å; L123-M126 VanDerWaalsContact O-N 3.11Å; M126-M129 PolarHBondContact O-N 3.48Å; M126-L130 PolarHBondContact O-N 3.47Å
127	E	85.2	Confident	86	Confident	149 Å²	149	100.8 Å²	100.8	70%	0.696	54%	0.542	S	S	*	.	H	α-helix	trans	-62.8	-46.2	175.3	-174	179.2	178.5	0	0	111	L123 E124 M129 L130 G131	L123-E127 PolarHBondContact O-N 3.23Å; E124-E127 PolarHBondContact O-N 3.32Å; E127-M129 VanDerWaalsContact C-N 3.3Å; E127-M129 PolarHBondContact O-N 3.4Å; E127-L130 PolarHBondContact O-N 2.95Å; E127-G131 PolarHBondContact O-N 3.4Å
128	Q	85.5	Confident	85.9	Confident	122 Å²	122	100.8 Å²	100.8	57%	0.57	55%	0.545	S	S	*	.	H	α-helix	trans	-58.7	-41.2	174	-77.8	177.7	4.9	0	0	112.1	E124 A132	E124-Q128 WeakPolarHBondContact O-CB 3.45Å; E124-Q128 VanDerWaalsContact O-CG 3.29Å; E124-Q128 WeakPolarHBondContact O-CG 3.33Å; E124-Q128 PolarHBondContact O-N 3.02Å; Q128-A132 WeakPolarHBondContact O-CB 3.49Å; Q128-A132 PolarHBondContact O-N 2.79Å
129	M	87.5	Confident	86.1	Confident	124 Å²	124	100.7 Å²	100.7	61%	0.611	54%	0.541	S	S	*	.	H	α-helix	trans	-66.6	-42.9	179.5	-168.8	-170.2	-60.7	0	0	112.3	R125 M126 E127 F133	R125-M129 WeakPolarHBondContact O-CB 3.34Å; R125-M129 PolarHBondContact O-N 3.17Å; R125-M129 VanDerWaalsContact O-N 3.12Å; M126-M129 PolarHBondContact O-N 3.48Å; E127-M129 VanDerWaalsContact C-N 3.3Å; E127-M129 PolarHBondContact O-N 3.4Å; M129-F133 PolarHBondContact O-N 3.17Å
130	L	84.5	Confident	86.5	Confident	119 Å²	119	101.1 Å²	101.1	62%	0.623	54%	0.537	S	S	*	.	H	α-helix	trans	-72.9	-39.2	179.5	-73.9	169.9	0	0	0	112.2	M126 E127 A132 F133 Q134	M126-L130 PolarHBondContact O-N 3.47Å; E127-L130 PolarHBondContact O-N 2.95Å; L130-A132 VanDerWaalsContact C-N 3.33Å; L130-F133 PolarHBondContact O-N 3.45Å; L130-Q134 PolarHBondContact O-N 3.34Å
131	G	86.9	Confident	86.6	Confident	38 Å²	38	99.4 Å²	99.4	39%	0.392	53%	0.533	S	S	.	.	H	α-helix	trans	-61.8	-41.6	172.6	0	0	0	0	0	111.9	E127 Q134 S135	E127-G131 PolarHBondContact O-N 3.4Å; G131-Q134 PolarHBondContact O-N 2.91Å; G131-S135 WeakPolarHBondContact O-CB 3.36Å; G131-S135 PolarHBondContact O-N 2.85Å
132	A	85.6	Confident	86.7	Confident	48 Å²	48	100.1 Å²	100.1	40%	0.397	53%	0.534	S	S	.	.	H	α-helix	trans	-61.4	-47.5	172.5	0	0	0	0	0	111.4	Q128 L130 Q134 S135 D136	Q128-A132 WeakPolarHBondContact O-CB 3.49Å; Q128-A132 PolarHBondContact O-N 2.79Å; L130-A132 VanDerWaalsContact C-N 3.33Å; A132-Q134 VanDerWaalsContact C-N 3.34Å; A132-Q134 PolarHBondContact O-N 3.43Å; A132-S135 WeakPolarHBondContact O-CB 3.24Å; A132-S135 PolarHBondContact O-N 3.03Å; A132-D136 WeakPolarHBondContact O-CB 3.48Å; A132-D136 PolarHBondContact O-N 3.13Å
133	F	87.1	Confident	86.9	Confident	140 Å²	140	100.6 Å²	100.6	61%	0.614	53%	0.531	S	S	*	.	H	α-helix	trans	-60.7	-40.8	178.9	-123.8	-82.7	0	0	0	113	M129 L130 D136 L137	M129-F133 PolarHBondContact O-N 3.17Å; L130-F133 PolarHBondContact O-N 3.45Å; F133-D136 PolarHBondContact O-N 3.38Å; F133-L137 WeakPolarHBondContact O-CB 3.49Å; F133-L137 PolarHBondContact O-N 3.49Å
134	Q	87.3	Confident	87.1	Confident	138 Å²	138	99.9 Å²	99.9	65%	0.645	53%	0.527	S	S	*	.	H	α-helix	trans	-67.1	-42	176.6	-176.6	-171.5	-4.1	0	0	111.8	L130 G131 A132 D136 L137 S138	L130-Q134 PolarHBondContact O-N 3.34Å; G131-Q134 PolarHBondContact O-N 2.91Å; A132-Q134 VanDerWaalsContact C-N 3.34Å; A132-Q134 PolarHBondContact O-N 3.43Å; Q134-D136 VanDerWaalsContact C-N 3.34Å; Q134-L137 PolarHBondContact O-N 3.37Å; Q134-S138 WeakPolarHBondContact O-CB 3.34Å; Q134-S138 PolarHBondContact O-N 3.31Å; Q134-S138 PolarHBondContact O-OG 2.66Å
135	S	87.7	Confident	87.1	Confident	73 Å²	73	102.8 Å²	102.8	51%	0.51	53%	0.533	S	S	.	.	H	α-helix	trans	-59.9	-46.6	174.8	178.2	0	0	0	0	110.6	G131 A132 L137 S138 S139	G131-S135 WeakPolarHBondContact O-CB 3.36Å; G131-S135 PolarHBondContact O-N 2.85Å; A132-S135 WeakPolarHBondContact O-CB 3.24Å; A132-S135 PolarHBondContact O-N 3.03Å; S135-L137 PolarHBondContact O-N 3.12Å; S135-S138 PolarHBondContact O-N 3.38Å; S135-S139 WeakPolarHBondContact O-CB 3.45Å; S135-S139 PolarHBondContact O-N 3.06Å
136	D	89.1	Confident	87.2	Confident	90 Å²	90	96.9 Å²	96.9	48%	0.481	52%	0.518	S	S	.	.	H	α-helix	trans	-63.1	-44.1	-179.9	-69.1	-13.2	0	0	0	111.6	A132 F133 Q134 S138 S139 I140	A132-D136 WeakPolarHBondContact O-CB 3.48Å; A132-D136 PolarHBondContact O-N 3.13Å; F133-D136 PolarHBondContact O-N 3.38Å; Q134-D136 VanDerWaalsContact C-N 3.34Å; D136-S138 VanDerWaalsContact C-N 3.33Å; D136-S138 PolarHBondContact O-N 2.88Å; D136-S139 PolarHBondContact O-N 3.35Å; D136-I140 WeakPolarHBondContact O-CB 3.36Å; D136-I140 WeakPolarHBondContact O-CG1 3.29Å; D136-I140 PolarHBondContact O-N 3.14Å
137	L	87	Confident	87.3	Confident	108 Å²	108	96.7 Å²	96.7	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-66.3	-35.7	178.7	-128.9	156.8	0	0	0	112.3	F133 Q134 S135 S141	F133-L137 WeakPolarHBondContact O-CB 3.49Å; F133-L137 PolarHBondContact O-N 3.49Å; Q134-L137 PolarHBondContact O-N 3.37Å; S135-L137 PolarHBondContact O-N 3.12Å; L137-S141 VanDerWaalsContact O-CB 3.28Å; L137-S141 WeakPolarHBondContact O-CB 3.44Å; L137-S141 PolarHBondContact O-N 3Å; L137-S141 PolarHBondContact O-OG 3.25Å
138	S	83.2	Confident	87.4	Confident	71 Å²	71	96.5 Å²	96.5	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-69.9	-41.9	174.8	-58.9	0	0	0	0	111.2	Q134 S135 D136 S141 S142	Q134-S138 WeakPolarHBondContact O-CB 3.34Å; Q134-S138 PolarHBondContact O-N 3.31Å; Q134-S138 PolarHBondContact O-OG 2.66Å; S135-S138 PolarHBondContact O-N 3.38Å; D136-S138 VanDerWaalsContact C-N 3.33Å; D136-S138 PolarHBondContact O-N 2.88Å; S138-S141 PolarHBondContact O-N 3.44Å; S138-S142 WeakPolarHBondContact O-CB 3.46Å; S138-S142 PolarHBondContact O-N 3.24Å
139	S	89.1	Confident	87.6	Confident	51 Å²	51	96.6 Å²	96.6	36%	0.357	52%	0.518	S	S	.	.	H	α-helix	trans	-60.3	-52.8	174.4	-165.4	0	0	0	0	110.7	S135 D136 S141 S142 E143	S135-S139 WeakPolarHBondContact O-CB 3.45Å; S135-S139 PolarHBondContact O-N 3.06Å; D136-S139 PolarHBondContact O-N 3.35Å; S139-S141 VanDerWaalsContact C-N 3.34Å; S139-S141 PolarHBondContact O-N 2.99Å; S139-S142 CarbonylContact O-C 3.54Å; S139-S142 WeakPolarHBondContact O-CB 3.4Å; S139-S142 PolarHBondContact O-N 3.47Å; S139-S142 VanDerWaalsContact O-N 3.11Å; S139-S142 PolarHBondContact O-OG 3.31Å; S139-S142 VanDerWaalsContact O-OG 3.13Å; S139-E143 WeakPolarHBondContact O-CG 3.33Å; S139-E143 PolarHBondContact O-N 2.81Å; S139-E143 PolarHBondContact OG-OE1 3.35Å; S139-E143 VanDerWaalsContact OG-OE1 3.11Å
140	I	90.3	Very high	87.7	Confident	89 Å²	89	96.7 Å²	96.7	46%	0.456	52%	0.517	S	S	.	.	H	α-helix	trans	-60	-42.7	179.9	-68.6	166	0	0	0	111.1	D136 S142 E143 I144	D136-I140 WeakPolarHBondContact O-CB 3.36Å; D136-I140 WeakPolarHBondContact O-CG1 3.29Å; D136-I140 PolarHBondContact O-N 3.14Å; I140-S142 VanDerWaalsContact C-N 3.32Å; I140-S142 PolarHBondContact O-N 3.5Å; I140-E143 PolarHBondContact O-N 3.11Å; I140-I144 HydrophobicContact CG2-CD1 3.75Å; I140-I144 HydrophobicContact CG2-CG1 4.32Å; I140-I144 WeakPolarHBondContact O-CB 3.33Å; I140-I144 VanDerWaalsContact O-CG1 3.27Å; I140-I144 WeakPolarHBondContact O-CG1 3.28Å; I140-I144 PolarHBondContact O-N 2.89Å
141	S	88	Confident	87.9	Confident	62 Å²	62	94.8 Å²	94.8	43%	0.434	51%	0.513	S	S	.	.	H	α-helix	trans	-66.4	-36.2	178.2	-62	0	0	0	0	112.1	L137 S138 S139 R145	L137-S141 VanDerWaalsContact O-CB 3.28Å; L137-S141 WeakPolarHBondContact O-CB 3.44Å; L137-S141 PolarHBondContact O-N 3Å; L137-S141 PolarHBondContact O-OG 3.25Å; S138-S141 PolarHBondContact O-N 3.44Å; S139-S141 VanDerWaalsContact C-N 3.34Å; S139-S141 PolarHBondContact O-N 2.99Å; S141-R145 WeakPolarHBondContact O-CB 3.23Å; S141-R145 PolarHBondContact O-N 3.2Å
142	S	87.5	Confident	88.1	Confident	66 Å²	66	94.6 Å²	94.6	46%	0.462	51%	0.511	S	S	.	.	H	α-helix	trans	-67.3	-40.8	172.8	106.7	0	0	0	0	111.2	S138 S139 I140 R145 T146	S138-S142 WeakPolarHBondContact O-CB 3.46Å; S138-S142 PolarHBondContact O-N 3.24Å; S139-S142 CarbonylContact O-C 3.54Å; S139-S142 WeakPolarHBondContact O-CB 3.4Å; S139-S142 PolarHBondContact O-N 3.47Å; S139-S142 VanDerWaalsContact O-N 3.11Å; S139-S142 PolarHBondContact O-OG 3.31Å; S139-S142 VanDerWaalsContact O-OG 3.13Å; I140-S142 VanDerWaalsContact C-N 3.32Å; I140-S142 PolarHBondContact O-N 3.5Å; S142-R145 PolarHBondContact O-N 3.3Å; S142-T146 WeakPolarHBondContact O-CB 3.22Å; S142-T146 VanDerWaalsContact O-CG2 3.25Å; S142-T146 WeakPolarHBondContact O-CG2 3.41Å; S142-T146 PolarHBondContact O-N 3.36Å; S142-T146 PolarHBondContact O-OG1 3.1Å
143	E	89.3	Confident	88.5	Confident	100 Å²	100	94.3 Å²	94.3	47%	0.467	51%	0.509	S	S	.	.	H	α-helix	trans	-64.2	-42.2	176.2	-76.1	173.2	-147	0	0	111.6	S139 I140 T146 L147	S139-E143 WeakPolarHBondContact O-CG 3.33Å; S139-E143 PolarHBondContact O-N 2.81Å; S139-E143 PolarHBondContact OG-OE1 3.35Å; S139-E143 VanDerWaalsContact OG-OE1 3.11Å; I140-E143 PolarHBondContact O-N 3.11Å; E143-T146 VanDerWaalsContact CA-OG1 3.31Å; E143-T146 WeakPolarHBondContact CA-OG1 3.43Å; E143-T146 PolarHBondContact O-N 2.93Å; E143-T146 PolarHBondContact O-OG1 3.47Å; E143-L147 VanDerWaalsContact O-CB 3.29Å; E143-L147 WeakPolarHBondContact O-CB 3.34Å; E143-L147 WeakPolarHBondContact O-CG 3.48Å; E143-L147 PolarHBondContact O-N 2.9Å
144	I	87.8	Confident	88.6	Confident	96 Å²	96	94.3 Å²	94.3	49%	0.492	51%	0.513	S	S	.	.	H	α-helix	trans	-64.5	-43.9	175.5	-69.6	168.2	0	0	0	110.5	I140 L147 Q148	I140-I144 HydrophobicContact CG2-CD1 3.75Å; I140-I144 HydrophobicContact CG2-CG1 4.32Å; I140-I144 WeakPolarHBondContact O-CB 3.33Å; I140-I144 VanDerWaalsContact O-CG1 3.27Å; I140-I144 WeakPolarHBondContact O-CG1 3.28Å; I140-I144 PolarHBondContact O-N 2.89Å; I144-L147 PolarHBondContact O-N 3.34Å; I144-Q148 VanDerWaalsContact O-CB 3.3Å; I144-Q148 WeakPolarHBondContact O-CB 3.31Å; I144-Q148 PolarHBondContact O-N 2.9Å
145	R	86.9	Confident	88.9	Confident	175 Å²	175	92.7 Å²	92.7	66%	0.66	51%	0.508	S	S	*	.	H	α-helix	trans	-63.3	-45.8	177.9	-175.9	176.6	-73.5	-176.1	-2.4	111.2	S141 S142 Q148 E149	S141-R145 WeakPolarHBondContact O-CB 3.23Å; S141-R145 PolarHBondContact O-N 3.2Å; S142-R145 PolarHBondContact O-N 3.3Å; R145-Q148 PolarHBondContact O-N 2.88Å; R145-E149 WeakPolarHBondContact O-CG 3.34Å; R145-E149 PolarHBondContact O-N 3.07Å
146	T	88.5	Confident	89.1	Confident	64 Å²	64	94.3 Å²	94.3	39%	0.393	51%	0.51	S	S	.	.	H	α-helix	trans	-63.7	-41.9	177.3	54.6	0	0	0	0	111.6	S142 E143 Q148 E149 Q150	S142-T146 WeakPolarHBondContact O-CB 3.22Å; S142-T146 VanDerWaalsContact O-CG2 3.25Å; S142-T146 WeakPolarHBondContact O-CG2 3.41Å; S142-T146 PolarHBondContact O-N 3.36Å; S142-T146 PolarHBondContact O-OG1 3.1Å; E143-T146 VanDerWaalsContact CA-OG1 3.31Å; E143-T146 WeakPolarHBondContact CA-OG1 3.43Å; E143-T146 PolarHBondContact O-N 2.93Å; E143-T146 PolarHBondContact O-OG1 3.47Å; T146-Q148 VanDerWaalsContact C-N 3.34Å; T146-Q148 PolarHBondContact O-N 3.41Å; T146-E149 PolarHBondContact O-N 3.3Å; T146-Q150 VanDerWaalsContact O-CB 3.31Å; T146-Q150 WeakPolarHBondContact O-CB 3.36Å; T146-Q150 WeakPolarHBondContact O-CG 3.35Å; T146-Q150 PolarHBondContact O-N 3.28Å
147	L	89.4	Confident	89.3	Confident	108 Å²	108	98 Å²	98	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-61.6	-40	173.1	-85.7	164.2	0	0	0	112.4	E143 I144 Q150 S151	E143-L147 VanDerWaalsContact O-CB 3.29Å; E143-L147 WeakPolarHBondContact O-CB 3.34Å; E143-L147 WeakPolarHBondContact O-CG 3.48Å; E143-L147 PolarHBondContact O-N 2.9Å; I144-L147 PolarHBondContact O-N 3.34Å; L147-Q150 PolarHBondContact O-N 2.96Å; L147-S151 VanDerWaalsContact O-CB 3.26Å; L147-S151 WeakPolarHBondContact O-CB 3.44Å; L147-S151 PolarHBondContact O-N 3.27Å
148	Q	87.4	Confident	89.6	Confident	144 Å²	144	97.2 Å²	97.2	67%	0.673	51%	0.513	S	S	*	.	H	α-helix	trans	-69.1	-41.8	179.6	-166.8	173.3	-0.9	0	0	111.7	I144 R145 T146 S151 G152	I144-Q148 VanDerWaalsContact O-CB 3.3Å; I144-Q148 WeakPolarHBondContact O-CB 3.31Å; I144-Q148 PolarHBondContact O-N 2.9Å; R145-Q148 PolarHBondContact O-N 2.88Å; T146-Q148 VanDerWaalsContact C-N 3.34Å; T146-Q148 PolarHBondContact O-N 3.41Å; Q148-S151 PolarHBondContact O-N 3.42Å; Q148-G152 PolarHBondContact O-N 3.43Å
149	E	89.1	Confident	90	Very high	124 Å²	124	102.7 Å²	102.7	58%	0.579	52%	0.523	S	S	*	.	H	α-helix	trans	-63.3	-43.5	172.6	-74.2	174.1	-172	0	0	111.5	R145 T146 G152 A153	R145-E149 WeakPolarHBondContact O-CG 3.34Å; R145-E149 PolarHBondContact O-N 3.07Å; T146-E149 PolarHBondContact O-N 3.3Å; E149-G152 PolarHBondContact O-N 2.81Å; E149-A153 WeakPolarHBondContact O-CB 3.47Å; E149-A153 PolarHBondContact O-N 3.36Å
150	Q	89.8	Confident	90.2	Very high	127 Å²	127	104.8 Å²	104.8	59%	0.593	53%	0.531	S	S	*	.	H	α-helix	trans	-63.4	-42.8	176	-75.5	177.3	9.1	0	0	112.2	T146 L147 A153 M154	T146-Q150 VanDerWaalsContact O-CB 3.31Å; T146-Q150 WeakPolarHBondContact O-CB 3.36Å; T146-Q150 WeakPolarHBondContact O-CG 3.35Å; T146-Q150 PolarHBondContact O-N 3.28Å; L147-Q150 PolarHBondContact O-N 2.96Å; Q150-A153 PolarHBondContact O-N 2.81Å; Q150-M154 VanDerWaalsContact O-CB 3.24Å; Q150-M154 WeakPolarHBondContact O-CB 3.26Å; Q150-M154 PolarHBondContact O-N 3.41Å
151	S	89.8	Confident	90.3	Very high	78 Å²	78	109.5 Å²	109.5	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-62.6	-44.8	176.1	-178.4	0	0	0	0	111.5	L147 Q148 M154 N155	L147-S151 VanDerWaalsContact O-CB 3.26Å; L147-S151 WeakPolarHBondContact O-CB 3.44Å; L147-S151 PolarHBondContact O-N 3.27Å; Q148-S151 PolarHBondContact O-N 3.42Å; S151-M154 PolarHBondContact O-N 3.24Å; S151-N155 WeakPolarHBondContact O-CB 3.45Å; S151-N155 PolarHBondContact O-N 3.3Å
152	G	90.7	Very high	90.5	Very high	34 Å²	34	112.3 Å²	112.3	35%	0.351	55%	0.549	S	S	.	.	H	α-helix	trans	-60.4	-48.3	174.5	0	0	0	0	0	112.5	Q148 E149 M154 N155 I156	Q148-G152 PolarHBondContact O-N 3.43Å; E149-G152 PolarHBondContact O-N 2.81Å; G152-M154 VanDerWaalsContact C-N 3.35Å; G152-M154 PolarHBondContact O-N 3.46Å; G152-N155 PolarHBondContact O-N 2.87Å; G152-I156 WeakPolarHBondContact O-CG1 3.46Å; G152-I156 PolarHBondContact O-N 3.22Å
153	A	92.4	Very high	90.7	Very high	43 Å²	43	112 Å²	112	36%	0.355	55%	0.55	S	S	.	*	H	α-helix	trans	-61.7	-41.4	176.7	0	0	0	0	0	112.2	E149 Q150 I156 R157	E149-A153 WeakPolarHBondContact O-CB 3.47Å; E149-A153 PolarHBondContact O-N 3.36Å; Q150-A153 PolarHBondContact O-N 2.81Å; A153-I156 PolarHBondContact O-N 2.99Å; A153-R157 WeakPolarHBondContact O-CG 3.26Å; A153-R157 PolarHBondContact O-N 3.05Å
154	M	90.6	Very high	90.9	Very high	140 Å²	140	111.1 Å²	111.1	69%	0.69	55%	0.552	S	S	*	*	H	α-helix	trans	-65	-40.2	177.5	-174.3	170.7	178.8	0	0	111.7	Q150 S151 G152 R157 L158	Q150-M154 VanDerWaalsContact O-CB 3.24Å; Q150-M154 WeakPolarHBondContact O-CB 3.26Å; Q150-M154 PolarHBondContact O-N 3.41Å; S151-M154 PolarHBondContact O-N 3.24Å; G152-M154 VanDerWaalsContact C-N 3.35Å; G152-M154 PolarHBondContact O-N 3.46Å; M154-R157 PolarHBondContact O-N 3.37Å; M154-L158 WeakPolarHBondContact O-CB 3.47Å; M154-L158 PolarHBondContact O-N 2.85Å
155	N	92.7	Very high	91.1	Very high	103 Å²	103	116.2 Å²	116.2	55%	0.551	57%	0.565	S	S	*	*	H	α-helix	trans	-66.6	-41.4	178.2	-160.6	-7.3	0	0	0	111.8	S151 G152 R157 L158 R159	S151-N155 WeakPolarHBondContact O-CB 3.45Å; S151-N155 PolarHBondContact O-N 3.3Å; G152-N155 PolarHBondContact O-N 2.87Å; N155-R157 VanDerWaalsContact C-N 3.35Å; N155-R157 PolarHBondContact O-N 2.99Å; N155-L158 PolarHBondContact O-N 3.31Å; N155-R159 WeakPolarHBondContact O-CB 3.28Å; N155-R159 PolarHBondContact O-N 3.34Å
156	I	91.9	Very high	91.3	Very high	107 Å²	107	109.7 Å²	109.7	55%	0.549	55%	0.552	S	S	.	*	H	α-helix	trans	-60	-46.1	173	-66.1	166.4	0	0	0	110.5	G152 A153 L158 R159 N160	G152-I156 WeakPolarHBondContact O-CG1 3.46Å; G152-I156 PolarHBondContact O-N 3.22Å; A153-I156 PolarHBondContact O-N 2.99Å; I156-L158 VanDerWaalsContact C-N 3.34Å; I156-L158 PolarHBondContact O-N 3.31Å; I156-R159 PolarHBondContact O-N 3.36Å; I156-N160 WeakPolarHBondContact O-CB 3.24Å; I156-N160 VanDerWaalsContact O-CG 3.29Å; I156-N160 PolarHBondContact O-N 3.43Å
157	R	93.4	Very high	91.2	Very high	167 Å²	167	114.3 Å²	114.3	63%	0.63	57%	0.566	S	S	*	*	H	α-helix	trans	-60.5	-42.3	176.3	-72.7	174.3	-177	171.2	2	112	A153 M154 N155 R161	A153-R157 WeakPolarHBondContact O-CG 3.26Å; A153-R157 PolarHBondContact O-N 3.05Å; M154-R157 PolarHBondContact O-N 3.37Å; N155-R157 VanDerWaalsContact C-N 3.35Å; N155-R157 PolarHBondContact O-N 2.99Å; R157-R161 WeakPolarHBondContact O-CB 3.39Å; R157-R161 VanDerWaalsContact O-CG 3.28Å; R157-R161 WeakPolarHBondContact O-CG 3.46Å; R157-R161 PolarHBondContact O-N 2.65Å
158	L	93.1	Very high	91.2	Very high	92 Å²	92	113.8 Å²	113.8	48%	0.482	56%	0.564	S	S	.	*	H	α-helix	trans	-62.2	-48.5	177.8	-179.4	65.4	0	0	0	111.2	M154 N155 I156 N160 R161 Q162	M154-L158 WeakPolarHBondContact O-CB 3.47Å; M154-L158 PolarHBondContact O-N 2.85Å; N155-L158 PolarHBondContact O-N 3.31Å; I156-L158 VanDerWaalsContact C-N 3.34Å; I156-L158 PolarHBondContact O-N 3.31Å; L158-N160 PolarHBondContact O-N 3.4Å; L158-R161 PolarHBondContact O-N 3.37Å; L158-Q162 WeakPolarHBondContact O-CG 3.34Å; L158-Q162 PolarHBondContact O-N 3.18Å
159	R	93.1	Very high	91.3	Very high	186 Å²	186	108.3 Å²	108.3	70%	0.702	55%	0.545	S	S	*	.	H	α-helix	trans	-62	-43.6	179.4	-174.3	176.8	168	155.1	-0.9	112	N155 I156 R161 Q162 A163	N155-R159 WeakPolarHBondContact O-CB 3.28Å; N155-R159 PolarHBondContact O-N 3.34Å; I156-R159 PolarHBondContact O-N 3.36Å; R159-R161 PolarHBondContact O-N 3.12Å; R159-Q162 PolarHBondContact O-N 3.42Å; R159-A163 PolarHBondContact O-N 3.25Å
160	N	93	Very high	91.1	Very high	96 Å²	96	109.5 Å²	109.5	51%	0.513	55%	0.551	S	S	.	*	H	α-helix	trans	-62.1	-43.7	175.7	-71.3	-8.7	0	0	0	111.3	I156 L158 Q162 A163 V164	I156-N160 WeakPolarHBondContact O-CB 3.24Å; I156-N160 VanDerWaalsContact O-CG 3.29Å; I156-N160 PolarHBondContact O-N 3.43Å; L158-N160 PolarHBondContact O-N 3.4Å; N160-Q162 PolarHBondContact O-N 3.42Å; N160-A163 PolarHBondContact O-N 3.09Å; N160-V164 WeakPolarHBondContact O-CG2 3.49Å; N160-V164 PolarHBondContact O-N 2.78Å
161	R	92.4	Very high	91	Very high	188 Å²	188	105.8 Å²	105.8	71%	0.709	54%	0.535	S	S	*	.	H	α-helix	trans	-63.3	-40	176.1	-75.1	175.2	179.4	178.4	-0.6	112.6	R157 L158 R159 R165	R157-R161 WeakPolarHBondContact O-CB 3.39Å; R157-R161 VanDerWaalsContact O-CG 3.28Å; R157-R161 WeakPolarHBondContact O-CG 3.46Å; R157-R161 PolarHBondContact O-N 2.65Å; L158-R161 PolarHBondContact O-N 3.37Å; R159-R161 PolarHBondContact O-N 3.12Å; R161-R165 VanDerWaalsContact O-CB 3.25Å; R161-R165 WeakPolarHBondContact O-CB 3.28Å; R161-R165 PolarHBondContact O-N 3.07Å
162	Q	92.1	Very high	90.9	Very high	120 Å²	120	105.8 Å²	105.8	56%	0.561	53%	0.531	S	S	*	.	H	α-helix	trans	-64.8	-43.8	176.3	-75.3	177.1	-12.4	0	0	111.9	L158 R159 N160 R165 G166	L158-Q162 WeakPolarHBondContact O-CG 3.34Å; L158-Q162 PolarHBondContact O-N 3.18Å; R159-Q162 PolarHBondContact O-N 3.42Å; N160-Q162 PolarHBondContact O-N 3.42Å; Q162-R165 PolarHBondContact O-N 3.44Å; Q162-G166 PolarHBondContact O-N 3.02Å
163	A	92	Very high	90.7	Very high	60 Å²	60	109.6 Å²	109.6	50%	0.496	54%	0.544	S	S	.	.	H	α-helix	trans	-62.8	-43.2	177.3	0	0	0	0	0	112.1	R159 N160 G166 K167	R159-A163 PolarHBondContact O-N 3.25Å; N160-A163 PolarHBondContact O-N 3.09Å; A163-G166 PolarHBondContact O-N 3Å; A163-K167 PolarHBondContact O-N 3.14Å
164	V	92.6	Very high	90.3	Very high	82 Å²	82	108.5 Å²	108.5	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-66.8	-41.5	176	171.7	0	0	0	0	111.2	N160 G166 K167 L168	N160-V164 WeakPolarHBondContact O-CG2 3.49Å; N160-V164 PolarHBondContact O-N 2.78Å; V164-G166 VanDerWaalsContact C-N 3.3Å; V164-G166 PolarHBondContact O-N 3.37Å; V164-K167 PolarHBondContact O-N 3.05Å; V164-L168 HydrophobicContact CG1-CD1 3.56Å; V164-L168 HydrophobicContact CG1-CG 4.13Å; V164-L168 WeakPolarHBondContact O-CB 3.47Å; V164-L168 WeakPolarHBondContact O-CG 3.32Å; V164-L168 PolarHBondContact O-N 3.07Å
165	R	92.7	Very high	90.1	Very high	203 Å²	203	102.6 Å²	102.6	77%	0.766	51%	0.508	S	S	*	.	H	α-helix	trans	-58.3	-41	175.6	179.6	-178.8	173.9	-178.5	-1.1	112	R161 Q162 G169	R161-R165 VanDerWaalsContact O-CB 3.25Å; R161-R165 WeakPolarHBondContact O-CB 3.28Å; R161-R165 PolarHBondContact O-N 3.07Å; Q162-R165 PolarHBondContact O-N 3.44Å; R165-G169 PolarHBondContact O-N 3.19Å
166	G	90.4	Very high	90	Very high	37 Å²	37	101.2 Å²	101.2	38%	0.381	50%	0.503	S	S	.	.	H	α-helix	trans	-59.4	-53.5	176.3	0	0	0	0	0	111.8	Q162 A163 V164 L168 G169 E170	Q162-G166 PolarHBondContact O-N 3.02Å; A163-G166 PolarHBondContact O-N 3Å; V164-G166 VanDerWaalsContact C-N 3.3Å; V164-G166 PolarHBondContact O-N 3.37Å; G166-L168 PolarHBondContact O-N 3.2Å; G166-G169 PolarHBondContact O-N 3.08Å; G166-E170 WeakPolarHBondContact O-CG 3.31Å; G166-E170 PolarHBondContact O-N 3.29Å
167	K	87.3	Confident	89.9	Confident	162 Å²	162	97.8 Å²	97.8	70%	0.704	49%	0.487	S	S	*	.	H	α-helix	trans	-63.1	-40.5	179.7	-66.9	-172.4	177	-172.5	0	113.4	A163 V164 L171	A163-K167 PolarHBondContact O-N 3.14Å; V164-K167 PolarHBondContact O-N 3.05Å; K167-L171 PolarHBondContact O-N 2.95Å; K167-L171 VanDerWaalsContact O-N 3.14Å
168	L	87.6	Confident	89.8	Confident	97 Å²	97	91.7 Å²	91.7	51%	0.508	47%	0.469	S	S	.	.	H	α-helix	trans	-68	-38.3	175.8	-76.5	171.7	0	0	0	111.5	V164 G166 L171 V172	V164-L168 HydrophobicContact CG1-CD1 3.56Å; V164-L168 HydrophobicContact CG1-CG 4.13Å; V164-L168 WeakPolarHBondContact O-CB 3.47Å; V164-L168 WeakPolarHBondContact O-CG 3.32Å; V164-L168 PolarHBondContact O-N 3.07Å; G166-L168 PolarHBondContact O-N 3.2Å; L168-L171 PolarHBondContact O-N 3.47Å; L168-V172 WeakPolarHBondContact O-CB 3.49Å; L168-V172 VanDerWaalsContact O-CG2 3.22Å; L168-V172 WeakPolarHBondContact O-CG2 3.37Å; L168-V172 PolarHBondContact O-N 3.31Å
169	G	89.9	Confident	89.6	Confident	28 Å²	28	91.6 Å²	91.6	29%	0.289	48%	0.476	S	S	.	.	H	α-helix	trans	-59.3	-50.3	174.9	0	0	0	0	0	111.5	R165 G166 L171 V172 D173	R165-G169 PolarHBondContact O-N 3.19Å; G166-G169 PolarHBondContact O-N 3.08Å; G169-L171 VanDerWaalsContact C-N 3.31Å; G169-L171 PolarHBondContact O-N 3.11Å; G169-V172 PolarHBondContact O-N 3.25Å; G169-D173 WeakPolarHBondContact O-CB 3.39Å; G169-D173 VanDerWaalsContact O-CG 3.31Å; G169-D173 PolarHBondContact O-N 3.08Å
170	E	86.6	Confident	89.5	Confident	149 Å²	149	85.2 Å²	85.2	70%	0.696	46%	0.463	S	S	*	.	H	α-helix	trans	-57.5	-42.1	176.3	-71.2	171.3	-173.9	0	0	112.5	G166 G174	G166-E170 WeakPolarHBondContact O-CG 3.31Å; G166-E170 PolarHBondContact O-N 3.29Å; E170-G174 PolarHBondContact O-N 2.96Å; E170-G174 VanDerWaalsContact O-N 3.11Å
171	L	86.1	Confident	89.4	Confident	50 Å²	50	80.7 Å²	80.7	26%	0.262	44%	0.439	S	S	.	.	H	α-helix	trans	-65.4	-46.1	176.8	-177.9	66	0	0	0	111.8	K167 L168 G169 G174 L175 Q212	K167-L171 PolarHBondContact O-N 2.95Å; K167-L171 VanDerWaalsContact O-N 3.14Å; L168-L171 PolarHBondContact O-N 3.47Å; G169-L171 VanDerWaalsContact C-N 3.31Å; G169-L171 PolarHBondContact O-N 3.11Å; L171-G174 PolarHBondContact O-N 3.27Å; L171-L175 HydrophobicContact CD1-CD1 3.98Å; L171-L175 HydrophobicContact CD1-CG 4.38Å; L171-L175 HydrophobicContact CG-CD1 4.04Å; L171-L175 VanDerWaalsContact O-CG 3.31Å; L171-L175 WeakPolarHBondContact O-CG 3.19Å; L171-L175 PolarHBondContact O-N 2.91Å; L171-L175 VanDerWaalsContact O-N 3.1Å; L171-Q212 HydrophobicContact CD1-CG 3.88Å
172	V	87.9	Confident	89.4	Confident	77 Å²	77	73.7 Å²	73.7	47%	0.467	42%	0.417	S	S	.	.	H	α-helix	trans	-65.1	-45.5	-179.7	170.9	0	0	0	0	110.5	L168 G169 G174 L175 V176	L168-V172 WeakPolarHBondContact O-CB 3.49Å; L168-V172 VanDerWaalsContact O-CG2 3.22Å; L168-V172 WeakPolarHBondContact O-CG2 3.37Å; L168-V172 PolarHBondContact O-N 3.31Å; G169-V172 PolarHBondContact O-N 3.25Å; V172-G174 PolarHBondContact O-N 3.25Å; V172-L175 PolarHBondContact O-N 3.26Å; V172-L175 VanDerWaalsContact O-N 3.11Å; V172-V176 HydrophobicContact CG1-CG2 3.63Å; V172-V176 WeakPolarHBondContact O-CB 3.37Å; V172-V176 VanDerWaalsContact O-CG2 3.23Å; V172-V176 WeakPolarHBondContact O-CG2 3.3Å; V172-V176 PolarHBondContact O-N 3.36Å
173	D	86.8	Confident	89.4	Confident	114 Å²	114	70.2 Å²	70.2	61%	0.61	40%	0.404	S	S	*	.	H	α-helix	trans	-62.1	-34.2	178.6	-71.5	-19.2	0	0	0	111.9	G169 K205	G169-D173 WeakPolarHBondContact O-CB 3.39Å; G169-D173 VanDerWaalsContact O-CG 3.31Å; G169-D173 PolarHBondContact O-N 3.08Å; D173-K205 PolarHBondContact O-NZ 3.45Å
174	G	84.1	Confident	89.5	Confident	20 Å²	20	67.4 Å²	67.4	21%	0.206	38%	0.381	C	S	.	.	H	α-helix	trans	-69.2	-34.3	174	0	0	0	0	0	114.2	E170 L171 V172	E170-G174 PolarHBondContact O-N 2.96Å; E170-G174 VanDerWaalsContact O-N 3.11Å; L171-G174 PolarHBondContact O-N 3.27Å; V172-G174 PolarHBondContact O-N 3.25Å
175	L	87.1	Confident	89.5	Confident	17 Å²	17	63.5 Å²	63.5	9%	0.089	36%	0.357	C	S	.	.	H	α-helix	trans	-93.8	-29.3	-175.9	-65.6	178.5	0	0	0	113.8	L171 V172 V177 V209 Q212 T217 A219 V223	L171-L175 HydrophobicContact CD1-CD1 3.98Å; L171-L175 HydrophobicContact CD1-CG 4.38Å; L171-L175 HydrophobicContact CG-CD1 4.04Å; L171-L175 VanDerWaalsContact O-CG 3.31Å; L171-L175 WeakPolarHBondContact O-CG 3.19Å; L171-L175 PolarHBondContact O-N 2.91Å; L171-L175 VanDerWaalsContact O-N 3.1Å; V172-L175 PolarHBondContact O-N 3.26Å; V172-L175 VanDerWaalsContact O-N 3.11Å; L175-V177 PolarHBondContact O-N 3.46Å; L175-V209 HydrophobicContact CD2-CG2 3.77Å; L175-Q212 HydrophobicContact CD2-CB 4.5Å; L175-T217 HydrophobicContact CD1-CG2 4.44Å; L175-A219 HydrophobicContact CD1-CB 4Å; L175-V223 WeakPolarHBondContact O-CG1 3.34Å; L175-V223 WeakPolarHBondContact O-CG2 3.47Å
176	V	89.5	Confident	89.5	Confident	74 Å²	74	57.7 Å²	57.7	45%	0.448	34%	0.341	S	S	.	.			trans	-67.2	131.4	-178.2	165.8	0	0	0	0	109.9	V172 P178 K205	V172-V176 HydrophobicContact CG1-CG2 3.63Å; V172-V176 WeakPolarHBondContact O-CB 3.37Å; V172-V176 VanDerWaalsContact O-CG2 3.23Å; V172-V176 WeakPolarHBondContact O-CG2 3.3Å; V172-V176 PolarHBondContact O-N 3.36Å; V176-P178 WeakPolarHBondContact O-CD 3.35Å; V176-K205 WeakPolarHBondContact O-CD 3.43Å; V176-K205 WeakPolarHBondContact O-CE 3.42Å; V176-K205 PolarHBondContact O-NZ 2.88Å
177	V	90.3	Very high	89.6	Confident	34 Å²	34	63.1 Å²	63.1	21%	0.206	36%	0.356	C	S	.	.			trans	-102.2	108.4	172.7	172.2	0	0	0	0	108.8	L175 L181 V182 V223 V226 L227 L230	L175-V177 PolarHBondContact O-N 3.46Å; V177-L181 HydrophobicContact CG1-CD2 4.19Å; V177-V182 HydrophobicContact CG1-CG2 3.76Å; V177-V223 HydrophobicContact CG2-CG1 3.49Å; V177-V223 VanDerWaalsContact CG2-CG1 3.49Å; V177-V226 HydrophobicContact CG1-CG1 4.43Å; V177-L227 HydrophobicContact CG2-CD2 3.69Å; V177-L227 HydrophobicContact CG2-CG 4.03Å; V177-L230 HydrophobicContact CG1-CD1 4.03Å
178	P	91.1	Very high	89.7	Confident	40 Å²	40	55.8 Å²	55.8	26%	0.26	33%	0.326	S	S	.	.			trans	-63.5	143.8	-179	-23.8	35.2	0	0	0	112.1	V176 A180 L181 V182 E201	V176-P178 WeakPolarHBondContact O-CD 3.35Å; P178-A180 PolarHBondContact O-N 2.85Å; P178-L181 HydrophobicContact CB-CB 4.4Å; P178-L181 VanDerWaalsContact O-CB 3.3Å; P178-L181 WeakPolarHBondContact O-CB 3.45Å; P178-L181 PolarHBondContact O-N 3.32Å; P178-L181 VanDerWaalsContact O-N 3.08Å; P178-V182 PolarHBondContact O-N 2.91Å; P178-E201 WeakPolarHBondContact CG-OE1 3.39Å
179	S	89.1	Confident	89.9	Confident	90 Å²	90	53.8 Å²	53.8	63%	0.629	32%	0.319	S	S	*	.	H	α-helix	trans	-60.6	-31.2	174.4	-173	0	0	0	0	112.1	L181 V182 T183	S179-L181 VanDerWaalsContact C-N 3.28Å; S179-L181 PolarHBondContact O-N 3.37Å; S179-V182 PolarHBondContact O-N 2.87Å; S179-T183 PolarHBondContact O-N 2.94Å; S179-T183 PolarHBondContact O-OG1 3.28Å
180	A	90.7	Very high	90	Very high	52 Å²	52	53.5 Å²	53.5	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-61.1	-37.2	176.4	0	0	0	0	0	112.5	P178 A184	P178-A180 PolarHBondContact O-N 2.85Å; A180-A184 WeakPolarHBondContact O-CB 3.44Å; A180-A184 PolarHBondContact O-N 2.91Å
181	L	91.8	Very high	90.1	Very high	0 Å²	0	50 Å²	50	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.9	-48	175.5	178.1	61.2	0	0	0	111	V177 P178 S179 A184 I185 Q198 E201 L202 K205	V177-L181 HydrophobicContact CG1-CD2 4.19Å; P178-L181 HydrophobicContact CB-CB 4.4Å; P178-L181 VanDerWaalsContact O-CB 3.3Å; P178-L181 WeakPolarHBondContact O-CB 3.45Å; P178-L181 PolarHBondContact O-N 3.32Å; P178-L181 VanDerWaalsContact O-N 3.08Å; S179-L181 VanDerWaalsContact C-N 3.28Å; S179-L181 PolarHBondContact O-N 3.37Å; L181-A184 PolarHBondContact O-N 3.12Å; L181-I185 HydrophobicContact CD1-CG1 4.15Å; L181-I185 WeakPolarHBondContact O-CG1 3.48Å; L181-I185 PolarHBondContact O-N 3.28Å; L181-Q198 HydrophobicContact CD1-CB 3.79Å; L181-Q198 WeakPolarHBondContact CD1-O 3.46Å; L181-E201 HydrophobicContact CD1-CB 4.37Å; L181-L202 HydrophobicContact CD1-CB 4.11Å; L181-L202 HydrophobicContact CD2-CD1 4.37Å; L181-K205 HydrophobicContact CD2-CD 4Å
182	V	91.8	Very high	90.4	Very high	41 Å²	41	51.8 Å²	51.8	25%	0.248	31%	0.308	C	S	.	.	H	α-helix	trans	-59	-52.4	178.2	177.1	0	0	0	0	110.7	V177 P178 S179 A184 I185 L186 L230	V177-V182 HydrophobicContact CG1-CG2 3.76Å; P178-V182 PolarHBondContact O-N 2.91Å; S179-V182 PolarHBondContact O-N 2.87Å; V182-A184 PolarHBondContact O-N 3.43Å; V182-I185 PolarHBondContact O-N 3.49Å; V182-L186 HydrophobicContact CG1-CD1 3.65Å; V182-L186 WeakPolarHBondContact O-CB 3.39Å; V182-L186 WeakPolarHBondContact O-CD1 3.4Å; V182-L186 VanDerWaalsContact O-CG 3.28Å; V182-L186 WeakPolarHBondContact O-CG 3.21Å; V182-L186 PolarHBondContact O-N 3.47Å; V182-L186 VanDerWaalsContact O-N 3.08Å; V182-L230 HydrophobicContact CB-CD2 4.4Å; V182-L230 HydrophobicContact CG1-CD2 4.24Å; V182-L230 HydrophobicContact CG2-CD1 4.07Å; V182-L230 HydrophobicContact CG2-CD2 4.39Å
183	T	92.7	Very high	90.4	Very high	47 Å²	47	52.5 Å²	52.5	29%	0.288	31%	0.314	S	S	.	.	H	α-helix	trans	-62.6	-43.3	-179.5	-54.2	0	0	0	0	111.5	S179 L186 E187	S179-T183 PolarHBondContact O-N 2.94Å; S179-T183 PolarHBondContact O-OG1 3.28Å; T183-L186 PolarHBondContact O-N 3.48Å; T183-E187 HydrophobicContact CG2-CG 4.44Å; T183-E187 VanDerWaalsContact CG2-OE2 3.3Å; T183-E187 WeakPolarHBondContact CG2-OE2 3.25Å; T183-E187 WeakPolarHBondContact O-CB 3.42Å; T183-E187 PolarHBondContact O-N 3.03Å
184	A	92.6	Very high	90.7	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-63.3	-46	179.8	0	0	0	0	0	112.3	A180 L181 V182 L186 A188 R194 Q198	A180-A184 WeakPolarHBondContact O-CB 3.44Å; A180-A184 PolarHBondContact O-N 2.91Å; L181-A184 PolarHBondContact O-N 3.12Å; V182-A184 PolarHBondContact O-N 3.43Å; A184-L186 PolarHBondContact O-N 2.83Å; A184-A188 WeakPolarHBondContact O-CB 3.45Å; A184-A188 PolarHBondContact O-N 3.29Å; A184-R194 HydrophobicContact CB-CG 4.45Å; A184-Q198 HydrophobicContact CB-CB 3.88Å; A184-Q198 HydrophobicContact CB-CG 3.7Å
185	I	94.4	Very high	91.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-66	-39.4	-179.9	-65.5	-63.6	0	0	0	111.4	L181 V182 F195 L199 L202 L230 A234 K237	L181-I185 HydrophobicContact CD1-CG1 4.15Å; L181-I185 WeakPolarHBondContact O-CG1 3.48Å; L181-I185 PolarHBondContact O-N 3.28Å; V182-I185 PolarHBondContact O-N 3.49Å; I185-F195 HydrophobicContact CD1-CD2 4.37Å; I185-F195 HydrophobicContact CD1-CE2 3.95Å; I185-F195 HydrophobicContact CD1-CZ 4.31Å; I185-L199 HydrophobicContact CD1-CB 4.41Å; I185-L199 HydrophobicContact CD1-CD1 4.21Å; I185-L202 HydrophobicContact CD1-CD2 4.31Å; I185-L202 HydrophobicContact CG1-CD2 4.37Å; I185-L230 HydrophobicContact CB-CD2 4.29Å; I185-L230 HydrophobicContact CG2-CD2 4.24Å; I185-A234 HydrophobicContact CG2-CB 4.02Å; I185-K237 WeakPolarHBondContact O-CD 3.27Å; I185-K237 PolarHBondContact O-NZ 2.85Å
186	L	91.9	Very high	91.5	Very high	82 Å²	82	53.2 Å²	53.2	43%	0.429	30%	0.304	S	S	.	.	H	α-helix	trans	-70.6	-52.6	179.4	-70.3	168.4	0	0	0	111.9	V182 T183 A184 K233 K237	V182-L186 HydrophobicContact CG1-CD1 3.65Å; V182-L186 WeakPolarHBondContact O-CB 3.39Å; V182-L186 WeakPolarHBondContact O-CD1 3.4Å; V182-L186 VanDerWaalsContact O-CG 3.28Å; V182-L186 WeakPolarHBondContact O-CG 3.21Å; V182-L186 PolarHBondContact O-N 3.47Å; V182-L186 VanDerWaalsContact O-N 3.08Å; T183-L186 PolarHBondContact O-N 3.48Å; A184-L186 PolarHBondContact O-N 2.83Å; L186-K233 HydrophobicContact CD2-CG 4.08Å; L186-K237 PolarHBondContact O-NZ 3.4Å
187	E	91.6	Very high	91.6	Very high	150 Å²	150	55.2 Å²	55.2	70%	0.701	31%	0.308	S	S	*	.	H	α-helix	trans	-103.8	-36.8	-162.9	-59.8	178.6	179.3	0	0	113.6	T183	T183-E187 HydrophobicContact CG2-CG 4.44Å; T183-E187 VanDerWaalsContact CG2-OE2 3.3Å; T183-E187 WeakPolarHBondContact CG2-OE2 3.25Å; T183-E187 WeakPolarHBondContact O-CB 3.42Å; T183-E187 PolarHBondContact O-N 3.03Å
188	A	91.3	Very high	91.8	Very high	9 Å²	9	55 Å²	55	7%	0.074	31%	0.305	C	S	.	.	S	Bend	trans	-68.5	137.2	-174.2	0	0	0	0	0	111.2	A184 F195 K237	A184-A188 WeakPolarHBondContact O-CB 3.45Å; A184-A188 PolarHBondContact O-N 3.29Å; A188-F195 HydrophobicContact CB-CB 4.5Å; A188-K237 WeakPolarHBondContact O-CE 3.22Å; A188-K237 PolarHBondContact O-NZ 2.98Å
189	P	91.4	Very high	92	Very high	55 Å²	55	53 Å²	53	36%	0.357	29%	0.292	S	S	.	.			trans	-66.7	143.7	174.9	28.5	-34.3	0	0	0	110.7	T191 E192	P189-T191 PolarHBondContact O-N 3.21Å; P189-E192 VanDerWaalsContact CD-CD 3.45Å; P189-E192 WeakPolarHBondContact CD-OE1 3.31Å; P189-E192 HydrophobicContact CG-CB 4.34Å; P189-E192 HydrophobicContact CG-CG 3.71Å; P189-E192 WeakPolarHBondContact CG-OE1 3.43Å; P189-E192 PolarHBondContact O-N 3.36Å
190	V	91.4	Very high	92.2	Very high	21 Å²	21	53.3 Å²	53.3	13%	0.127	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-18.8	178.6	-82.5	0	0	0	0	114.7	F195 K237 F241 F269	V190-F195 HydrophobicContact CB-CD1 4.38Å; V190-F195 HydrophobicContact CB-CE1 4.43Å; V190-F195 HydrophobicContact CG1-CD1 4.05Å; V190-F195 HydrophobicContact CG1-CE1 3.66Å; V190-F195 HydrophobicContact CG1-CE2 4.28Å; V190-F195 HydrophobicContact CG1-CZ 3.79Å; V190-K237 HydrophobicContact CG1-CB 3.83Å; V190-F241 HydrophobicContact CB-CB 4.41Å; V190-F241 HydrophobicContact CB-CD2 4.46Å; V190-F241 HydrophobicContact CB-CG 4.32Å; V190-F241 HydrophobicContact CG2-CB 3.87Å; V190-F241 HydrophobicContact CG2-CD2 3.63Å; V190-F241 HydrophobicContact CG2-CE2 4.38Å; V190-F241 HydrophobicContact CG2-CG 3.83Å; V190-F269 HydrophobicContact CB-CE2 4.39Å; V190-F269 WeakPolarHBondContact O-CZ 3.2Å
191	T	89.4	Confident	92.3	Very high	77 Å²	77	53.7 Å²	53.7	47%	0.472	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-15.5	178.8	48.1	0	0	0	0	113.3	P189 F241	P189-T191 PolarHBondContact O-N 3.21Å; T191-F241 HydrophobicContact CG2-CD2 4.43Å; T191-F241 HydrophobicContact CG2-CE2 3.63Å; T191-F241 HydrophobicContact CG2-CZ 4.25Å
192	E	91.1	Very high	92.3	Very high	87 Å²	87	53.8 Å²	53.8	41%	0.407	28%	0.277	S	S	.	.	S	Bend	trans	-81.1	141.1	-179.1	-81	173.6	-158.7	0	0	112	P189 R194 F195	P189-E192 VanDerWaalsContact CD-CD 3.45Å; P189-E192 WeakPolarHBondContact CD-OE1 3.31Å; P189-E192 HydrophobicContact CG-CB 4.34Å; P189-E192 HydrophobicContact CG-CG 3.71Å; P189-E192 WeakPolarHBondContact CG-OE1 3.43Å; P189-E192 PolarHBondContact O-N 3.36Å; E192-R194 PolarHBondContact O-N 3.01Å; E192-F195 WeakPolarHBondContact O-CB 3.3Å; E192-F195 PolarHBondContact O-N 3.25Å
193	P	89.2	Confident	92.4	Very high	92 Å²	92	53.8 Å²	53.8	60%	0.597	28%	0.276	S	S	*	.	H	α-helix	trans	-56.4	-37.5	177.2	-24	32.8	0	0	0	113	F195 L196 E197	P193-F195 PolarHBondContact O-N 3.32Å; P193-L196 WeakPolarHBondContact O-CB 3.31Å; P193-L196 PolarHBondContact O-N 2.81Å; P193-E197 PolarHBondContact O-N 2.99Å
194	R	92.4	Very high	92.3	Very high	118 Å²	118	54.4 Å²	54.4	45%	0.445	29%	0.286	S	S	.	.	H	α-helix	trans	-56.1	-36.4	177.2	-177.4	-179.4	172.8	-168.9	-3.3	112.5	A184 E192 Q198	A184-R194 HydrophobicContact CB-CG 4.45Å; E192-R194 PolarHBondContact O-N 3.01Å; R194-Q198 HydrophobicContact CG-CG 4.41Å; R194-Q198 WeakPolarHBondContact O-CB 3.43Å; R194-Q198 WeakPolarHBondContact O-CG 3.19Å; R194-Q198 PolarHBondContact O-N 3.46Å; R194-Q198 VanDerWaalsContact O-N 3.14Å
195	F	94.6	Very high	92.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-66.5	-41.9	177	-179.2	-90	0	0	0	111.1	I185 A188 V190 E192 P193 L199 K237 I238 F269	I185-F195 HydrophobicContact CD1-CD2 4.37Å; I185-F195 HydrophobicContact CD1-CE2 3.95Å; I185-F195 HydrophobicContact CD1-CZ 4.31Å; A188-F195 HydrophobicContact CB-CB 4.5Å; V190-F195 HydrophobicContact CB-CD1 4.38Å; V190-F195 HydrophobicContact CB-CE1 4.43Å; V190-F195 HydrophobicContact CG1-CD1 4.05Å; V190-F195 HydrophobicContact CG1-CE1 3.66Å; V190-F195 HydrophobicContact CG1-CE2 4.28Å; V190-F195 HydrophobicContact CG1-CZ 3.79Å; E192-F195 WeakPolarHBondContact O-CB 3.3Å; E192-F195 PolarHBondContact O-N 3.25Å; P193-F195 PolarHBondContact O-N 3.32Å; F195-L199 HydrophobicContact CE1-CD2 4.25Å; F195-L199 VanDerWaalsContact O-CB 3.24Å; F195-L199 WeakPolarHBondContact O-CB 3.29Å; F195-L199 PolarHBondContact O-N 2.99Å; F195-K237 HydrophobicContact CE2-CD 4.43Å; F195-I238 HydrophobicContact CE1-CD1 4.42Å; F195-I238 HydrophobicContact CE1-CG1 4.08Å; F195-I238 HydrophobicContact CZ-CG1 4.31Å; F195-F269 HydrophobicContact CD1-CE1 4.13Å; F195-F269 HydrophobicContact CD1-CZ 4Å; F195-F269 HydrophobicContact CE1-CE1 4.18Å; F195-F269 HydrophobicContact CE1-CZ 4.2Å
196	L	92.6	Very high	92	Very high	47 Å²	47	56.1 Å²	56.1	25%	0.246	30%	0.295	C	S	.	.	H	α-helix	trans	-65.4	-46.1	179.1	176.2	63.6	0	0	0	112.1	P193 Q198 L199 Q200 F268 F269	P193-L196 WeakPolarHBondContact O-CB 3.31Å; P193-L196 PolarHBondContact O-N 2.81Å; L196-Q198 VanDerWaalsContact C-N 3.33Å; L196-Q198 PolarHBondContact O-N 3.11Å; L196-L199 WeakPolarHBondContact O-CB 3.37Å; L196-L199 PolarHBondContact O-N 3.37Å; L196-Q200 WeakPolarHBondContact O-CG 3.26Å; L196-Q200 PolarHBondContact O-N 2.82Å; L196-F268 HydrophobicContact CD1-CB 3.84Å; L196-F268 HydrophobicContact CD1-CD1 3.51Å; L196-F268 HydrophobicContact CD1-CE1 4.47Å; L196-F268 HydrophobicContact CD1-CG 4Å; L196-F269 HydrophobicContact CB-CE1 4.4Å; L196-F269 HydrophobicContact CD1-CD1 4.16Å; L196-F269 HydrophobicContact CD1-CE1 3.75Å
197	E	92.4	Very high	91.8	Very high	117 Å²	117	54.4 Å²	54.4	55%	0.547	29%	0.293	S	S	.	.	H	α-helix	trans	-58.6	-46.7	177.4	-70.2	170	-176.2	0	0	111.1	P193 L199 Q200 E201	P193-E197 PolarHBondContact O-N 2.99Å; E197-L199 VanDerWaalsContact C-N 3.34Å; E197-L199 PolarHBondContact O-N 2.84Å; E197-Q200 WeakPolarHBondContact O-CB 3.24Å; E197-Q200 PolarHBondContact O-N 2.85Å; E197-E201 PolarHBondContact O-N 3.11Å; E197-E201 VanDerWaalsContact O-N 3.08Å
198	Q	94	Very high	91.7	Very high	28 Å²	28	48.5 Å²	48.5	13%	0.131	27%	0.27	C	S	.	.	H	α-helix	trans	-71.8	-29.6	179.6	-65.3	-63.2	-66	0	0	111.8	L181 A184 R194 L196 E201 L202	L181-Q198 HydrophobicContact CD1-CB 3.79Å; L181-Q198 WeakPolarHBondContact CD1-O 3.46Å; A184-Q198 HydrophobicContact CB-CB 3.88Å; A184-Q198 HydrophobicContact CB-CG 3.7Å; R194-Q198 HydrophobicContact CG-CG 4.41Å; R194-Q198 WeakPolarHBondContact O-CB 3.43Å; R194-Q198 WeakPolarHBondContact O-CG 3.19Å; R194-Q198 PolarHBondContact O-N 3.46Å; R194-Q198 VanDerWaalsContact O-N 3.14Å; L196-Q198 VanDerWaalsContact C-N 3.33Å; L196-Q198 PolarHBondContact O-N 3.11Å; Q198-E201 PolarHBondContact NE2-OE2 2.95Å; Q198-E201 PolarHBondContact O-N 3.29Å; Q198-E201 PolarHBondContact OE1-OE2 3.43Å; Q198-L202 WeakPolarHBondContact O-CB 3.46Å; Q198-L202 PolarHBondContact O-N 3.44Å
199	L	94.7	Very high	91.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-65.6	-38.5	171.7	-172.6	71.5	0	0	0	112.1	I185 F195 L196 E197 L202 D203 A234 I238 F268 F269 F272	I185-L199 HydrophobicContact CD1-CB 4.41Å; I185-L199 HydrophobicContact CD1-CD1 4.21Å; F195-L199 HydrophobicContact CE1-CD2 4.25Å; F195-L199 VanDerWaalsContact O-CB 3.24Å; F195-L199 WeakPolarHBondContact O-CB 3.29Å; F195-L199 PolarHBondContact O-N 2.99Å; L196-L199 WeakPolarHBondContact O-CB 3.37Å; L196-L199 PolarHBondContact O-N 3.37Å; E197-L199 VanDerWaalsContact C-N 3.34Å; E197-L199 PolarHBondContact O-N 2.84Å; L199-L202 HydrophobicContact CD1-CD2 4.44Å; L199-L202 WeakPolarHBondContact O-CB 3.38Å; L199-L202 PolarHBondContact O-N 3.48Å; L199-D203 PolarHBondContact O-N 2.92Å; L199-A234 HydrophobicContact CD1-CB 3.76Å; L199-I238 HydrophobicContact CD1-CD1 3.91Å; L199-I238 HydrophobicContact CD2-CD1 3.53Å; L199-I238 HydrophobicContact CG-CD1 4.38Å; L199-F268 HydrophobicContact CB-CE1 4.36Å; L199-F268 HydrophobicContact CD2-CD1 3.94Å; L199-F268 HydrophobicContact CD2-CE1 3.88Å; L199-F268 HydrophobicContact CG-CD1 4.48Å; L199-F268 HydrophobicContact CG-CE1 3.94Å; L199-F269 HydrophobicContact CD2-CD1 3.65Å; L199-F269 HydrophobicContact CD2-CE1 3.9Å; L199-F272 HydrophobicContact CD1-CD1 3.97Å; L199-F272 HydrophobicContact CD1-CD2 3.9Å; L199-F272 HydrophobicContact CD1-CE1 3.79Å; L199-F272 HydrophobicContact CD1-CE2 3.72Å; L199-F272 HydrophobicContact CD1-CG 4.02Å; L199-F272 HydrophobicContact CD1-CZ 3.66Å; L199-F272 HydrophobicContact CD2-CB 4.23Å; L199-F272 HydrophobicContact CD2-CD1 4.39Å; L199-F272 HydrophobicContact CD2-CD2 4.43Å; L199-F272 HydrophobicContact CD2-CG 4.09Å; L199-F272 HydrophobicContact CG-CD1 4.47Å; L199-F272 HydrophobicContact CG-CD2 3.96Å; L199-F272 HydrophobicContact CG-CE2 4.21Å; L199-F272 HydrophobicContact CG-CG 4.09Å
200	Q	93.8	Very high	91.4	Very high	95 Å²	95	51.3 Å²	51.3	44%	0.444	27%	0.272	S	S	.	.	H	α-helix	trans	-64.6	-41.9	173.8	-71.6	174.3	-18.4	0	0	111.3	L196 E197 L202 D203 A204 F268	L196-Q200 WeakPolarHBondContact O-CG 3.26Å; L196-Q200 PolarHBondContact O-N 2.82Å; E197-Q200 WeakPolarHBondContact O-CB 3.24Å; E197-Q200 PolarHBondContact O-N 2.85Å; Q200-L202 VanDerWaalsContact C-N 3.35Å; Q200-D203 PolarHBondContact O-N 3.46Å; Q200-A204 WeakPolarHBondContact O-CB 3.45Å; Q200-A204 PolarHBondContact O-N 2.88Å; Q200-F268 HydrophobicContact CB-CE1 4.29Å; Q200-F268 HydrophobicContact CB-CZ 4.21Å; Q200-F268 HydrophobicContact CG-CD1 3.89Å; Q200-F268 HydrophobicContact CG-CD2 4.37Å; Q200-F268 HydrophobicContact CG-CE1 3.43Å; Q200-F268 VanDerWaalsContact CG-CE1 3.43Å; Q200-F268 HydrophobicContact CG-CE2 3.96Å; Q200-F268 HydrophobicContact CG-CG 4.35Å; Q200-F268 HydrophobicContact CG-CZ 3.48Å; Q200-F268 VanDerWaalsContact CG-CZ 3.48Å
201	E	92.4	Very high	91.2	Very high	60 Å²	60	55 Å²	55	28%	0.28	29%	0.288	S	S	.	.	H	α-helix	trans	-63	-40.4	174.4	-170.3	177.9	169.4	0	0	111.9	P178 L181 E197 Q198 D203 A204 K205	P178-E201 WeakPolarHBondContact CG-OE1 3.39Å; L181-E201 HydrophobicContact CD1-CB 4.37Å; E197-E201 PolarHBondContact O-N 3.11Å; E197-E201 VanDerWaalsContact O-N 3.08Å; Q198-E201 PolarHBondContact NE2-OE2 2.95Å; Q198-E201 PolarHBondContact O-N 3.29Å; Q198-E201 PolarHBondContact OE1-OE2 3.43Å; E201-D203 PolarHBondContact O-N 3.23Å; E201-A204 PolarHBondContact O-N 3.41Å; E201-K205 HydrophobicContact CG-CD 4.24Å; E201-K205 WeakPolarHBondContact O-CB 3.45Å; E201-K205 WeakPolarHBondContact O-CG 3.42Å; E201-K205 PolarHBondContact O-N 2.85Å; E201-K205 WeakPolarHBondContact OE1-CE 3.25Å; E201-K205 IonicContact OE1-NZ 3.23Å
202	L	93.3	Very high	91.1	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-59.9	-45.5	174.7	-177.5	63.6	0	0	0	111.6	L181 I185 Q198 L199 Q200 K205 A206 L227 L230 A234 F272	L181-L202 HydrophobicContact CD1-CB 4.11Å; L181-L202 HydrophobicContact CD2-CD1 4.37Å; I185-L202 HydrophobicContact CD1-CD2 4.31Å; I185-L202 HydrophobicContact CG1-CD2 4.37Å; Q198-L202 WeakPolarHBondContact O-CB 3.46Å; Q198-L202 PolarHBondContact O-N 3.44Å; L199-L202 HydrophobicContact CD1-CD2 4.44Å; L199-L202 WeakPolarHBondContact O-CB 3.38Å; L199-L202 PolarHBondContact O-N 3.48Å; Q200-L202 VanDerWaalsContact C-N 3.35Å; L202-K205 PolarHBondContact O-N 2.88Å; L202-A206 VanDerWaalsContact O-CB 3.26Å; L202-A206 WeakPolarHBondContact O-CB 3.49Å; L202-A206 PolarHBondContact O-N 3.04Å; L202-L227 HydrophobicContact CD1-CD2 3.62Å; L202-L230 HydrophobicContact CD1-CB 3.88Å; L202-L230 HydrophobicContact CD1-CD1 4.07Å; L202-L230 HydrophobicContact CD2-CB 4.17Å; L202-A234 HydrophobicContact CD2-CB 4.17Å; L202-F272 HydrophobicContact CD2-CE2 4.48Å; L202-F272 HydrophobicContact CD2-CZ 4.18Å
203	D	92.4	Very high	90.9	Very high	42 Å²	42	52.7 Å²	52.7	23%	0.225	27%	0.272	C	S	.	.	H	α-helix	trans	-65.9	-41.8	-179.9	-162.6	48	0	0	0	111.7	L199 Q200 E201 A206 A207 F268 F272 N276	L199-D203 PolarHBondContact O-N 2.92Å; Q200-D203 PolarHBondContact O-N 3.46Å; E201-D203 PolarHBondContact O-N 3.23Å; D203-A206 PolarHBondContact O-N 3.29Å; D203-A207 WeakPolarHBondContact O-CB 3.4Å; D203-A207 PolarHBondContact O-N 3.45Å; D203-F268 HydrophobicContact CB-CZ 4.41Å; D203-F272 HydrophobicContact CB-CD2 3.94Å; D203-F272 HydrophobicContact CB-CE2 4.06Å; D203-N276 PolarHBondContact OD1-ND2 3.14Å
204	A	91.5	Very high	90.8	Very high	60 Å²	60	52.7 Å²	52.7	50%	0.496	28%	0.279	S	S	.	.	H	α-helix	trans	-63	-46.3	175.3	0	0	0	0	0	112.2	Q200 E201 A207 A208	Q200-A204 WeakPolarHBondContact O-CB 3.45Å; Q200-A204 PolarHBondContact O-N 2.88Å; E201-A204 PolarHBondContact O-N 3.41Å; A204-A207 PolarHBondContact O-N 3.41Å; A204-A208 WeakPolarHBondContact O-CB 3.46Å; A204-A208 PolarHBondContact O-N 3.34Å
205	K	90.7	Very high	90.4	Very high	22 Å²	22	54.8 Å²	54.8	10%	0.096	29%	0.287	C	S	.	.	H	α-helix	trans	-65.8	-39.1	176.5	-73.1	-178.9	-176.2	-76.6	0	112	D173 V176 L181 E201 L202 A207 A208 V209 L227	D173-K205 PolarHBondContact O-NZ 3.45Å; V176-K205 WeakPolarHBondContact O-CD 3.43Å; V176-K205 WeakPolarHBondContact O-CE 3.42Å; V176-K205 PolarHBondContact O-NZ 2.88Å; L181-K205 HydrophobicContact CD2-CD 4Å; E201-K205 HydrophobicContact CG-CD 4.24Å; E201-K205 WeakPolarHBondContact O-CB 3.45Å; E201-K205 WeakPolarHBondContact O-CG 3.42Å; E201-K205 PolarHBondContact O-N 2.85Å; E201-K205 WeakPolarHBondContact OE1-CE 3.25Å; E201-K205 IonicContact OE1-NZ 3.23Å; L202-K205 PolarHBondContact O-N 2.88Å; K205-A207 VanDerWaalsContact C-N 3.34Å; K205-A207 PolarHBondContact O-N 2.88Å; K205-A208 PolarHBondContact O-N 2.83Å; K205-V209 WeakPolarHBondContact O-CB 3.44Å; K205-V209 WeakPolarHBondContact O-CG2 3.47Å; K205-V209 PolarHBondContact O-N 3.44Å; K205-L227 HydrophobicContact CB-CD2 4.48Å
206	A	89.4	Confident	90	Very high	14 Å²	14	57.9 Å²	57.9	12%	0.116	32%	0.319	C	S	.	.	H	α-helix	trans	-63	-39.3	174	0	0	0	0	0	112.1	L202 D203 R210	L202-A206 VanDerWaalsContact O-CB 3.26Å; L202-A206 WeakPolarHBondContact O-CB 3.49Å; L202-A206 PolarHBondContact O-N 3.04Å; D203-A206 PolarHBondContact O-N 3.29Å; A206-R210 VanDerWaalsContact O-CG 3.32Å; A206-R210 WeakPolarHBondContact O-CG 3.32Å; A206-R210 PolarHBondContact O-N 3.02Å; A206-R210 VanDerWaalsContact O-N 3.12Å; A206-R210 PolarHBondContact O-NE 3.3Å
207	A	89.1	Confident	89.7	Confident	46 Å²	46	57.5 Å²	57.5	38%	0.38	32%	0.319	S	S	.	.	H	α-helix	trans	-65.7	-46	173.5	0	0	0	0	0	112.2	D203 A204 K205 V209 R210 E211	D203-A207 WeakPolarHBondContact O-CB 3.4Å; D203-A207 PolarHBondContact O-N 3.45Å; A204-A207 PolarHBondContact O-N 3.41Å; K205-A207 VanDerWaalsContact C-N 3.34Å; K205-A207 PolarHBondContact O-N 2.88Å; A207-V209 PolarHBondContact O-N 3.38Å; A207-R210 PolarHBondContact O-N 2.92Å; A207-E211 PolarHBondContact O-N 3.36Å
208	A	88.1	Confident	89.3	Confident	27 Å²	27	56 Å²	56	22%	0.223	33%	0.326	C	S	.	.	H	α-helix	trans	-60.6	-44.1	178	0	0	0	0	0	112	A204 K205 R210 E211 Q212	A204-A208 WeakPolarHBondContact O-CB 3.46Å; A204-A208 PolarHBondContact O-N 3.34Å; K205-A208 PolarHBondContact O-N 2.83Å; A208-R210 PolarHBondContact O-N 2.83Å; A208-E211 PolarHBondContact O-N 3.44Å; A208-Q212 WeakPolarHBondContact O-CG 3.41Å; A208-Q212 PolarHBondContact O-N 3.25Å
209	V	89.3	Confident	88.8	Confident	5 Å²	5	56.7 Å²	56.7	3%	0.03	34%	0.337	C	S	.	.	H	α-helix	trans	-63.1	-42.3	176.2	170.7	0	0	0	0	111.4	L175 K205 A207 E211 Q212 E213 C220 L227	L175-V209 HydrophobicContact CD2-CG2 3.77Å; K205-V209 WeakPolarHBondContact O-CB 3.44Å; K205-V209 WeakPolarHBondContact O-CG2 3.47Å; K205-V209 PolarHBondContact O-N 3.44Å; A207-V209 PolarHBondContact O-N 3.38Å; V209-E211 VanDerWaalsContact C-N 3.3Å; V209-E211 PolarHBondContact O-N 3.46Å; V209-Q212 PolarHBondContact O-N 2.86Å; V209-E213 WeakPolarHBondContact O-CB 3.47Å; V209-E213 PolarHBondContact O-N 2.99Å; V209-C220 HydrophobicContact CG1-CB 4.1Å; V209-L227 HydrophobicContact CB-CD1 4.06Å; V209-L227 HydrophobicContact CG1-CD1 4.39Å; V209-L227 HydrophobicContact CG2-CD1 3.59Å
210	R	86.9	Confident	88.4	Confident	117 Å²	117	56.8 Å²	56.8	44%	0.442	34%	0.338	S	S	.	.	H	α-helix	trans	-60.4	-39.6	175.1	-76.9	-178.1	-69.4	-129.5	0.5	112.2	A206 A207 A208 A214 N276	A206-R210 VanDerWaalsContact O-CG 3.32Å; A206-R210 WeakPolarHBondContact O-CG 3.32Å; A206-R210 PolarHBondContact O-N 3.02Å; A206-R210 VanDerWaalsContact O-N 3.12Å; A206-R210 PolarHBondContact O-NE 3.3Å; A207-R210 PolarHBondContact O-N 2.92Å; A208-R210 PolarHBondContact O-N 2.83Å; R210-A214 PolarHBondContact O-N 2.98Å; R210-N276 PolarHBondContact NH1-OD1 3.42Å
211	E	87.6	Confident	88	Confident	98 Å²	98	55.4 Å²	55.4	46%	0.458	34%	0.342	S	S	.	.	H	α-helix	trans	-67.9	-46.1	176.8	-173	-177.3	175.7	0	0	112.2	A207 A208 V209 E213 A214 R215	A207-E211 PolarHBondContact O-N 3.36Å; A208-E211 PolarHBondContact O-N 3.44Å; V209-E211 VanDerWaalsContact C-N 3.3Å; V209-E211 PolarHBondContact O-N 3.46Å; E211-E213 VanDerWaalsContact C-N 3.3Å; E211-E213 PolarHBondContact O-N 2.96Å; E211-A214 WeakPolarHBondContact O-CB 3.42Å; E211-A214 PolarHBondContact O-N 3.45Å; E211-R215 PolarHBondContact O-N 3.47Å; E211-R215 IonicContact OE1-CZ 2.9Å; E211-R215 IonicContact OE1-NE 3.43Å; E211-R215 IonicContact OE1-NH2 3.9Å; E211-R215 PolarHBondContact OE1-NH2 2.92Å
212	Q	87.4	Confident	87.7	Confident	38 Å²	38	58.9 Å²	58.9	18%	0.178	36%	0.363	C	S	.	.	H	α-helix	trans	-70.3	-28.6	179.8	-64.3	-59	-17.7	0	0	112.8	L171 L175 A208 V209 R215 G216 T217	L171-Q212 HydrophobicContact CD1-CG 3.88Å; L175-Q212 HydrophobicContact CD2-CB 4.5Å; A208-Q212 WeakPolarHBondContact O-CG 3.41Å; A208-Q212 PolarHBondContact O-N 3.25Å; V209-Q212 PolarHBondContact O-N 2.86Å; Q212-R215 PolarHBondContact O-N 3.31Å; Q212-G216 PolarHBondContact O-N 3.01Å; Q212-T217 WeakPolarHBondContact O-CB 3.06Å; Q212-T217 PolarHBondContact O-N 3.01Å; Q212-T217 VanDerWaalsContact O-N 3.1Å; Q212-T217 PolarHBondContact O-OG1 3.11Å; Q212-T217 VanDerWaalsContact O-OG1 3.07Å
213	E	86.4	Confident	87.4	Confident	79 Å²	79	60 Å²	60	37%	0.369	37%	0.37	S	S	.	.	H	α-helix	trans	-63.5	-44.8	170.1	174.8	175.1	-171.6	0	0	111.1	V209 E211 R215 G216 C220 R224	V209-E213 WeakPolarHBondContact O-CB 3.47Å; V209-E213 PolarHBondContact O-N 2.99Å; E211-E213 VanDerWaalsContact C-N 3.3Å; E211-E213 PolarHBondContact O-N 2.96Å; E213-R215 PolarHBondContact O-N 3.43Å; E213-G216 PolarHBondContact O-N 3.33Å; E213-C220 HydrophobicContact CB-CB 4.32Å; E213-R224 IonicContact OE1-CZ 2.79Å; E213-R224 IonicContact OE1-NE 3.94Å; E213-R224 IonicContact OE1-NH1 3.37Å; E213-R224 PolarHBondContact OE1-NH1 3.33Å; E213-R224 IonicContact OE1-NH2 3.1Å; E213-R224 PolarHBondContact OE1-NH2 2.89Å; E213-R224 IonicContact OE2-CZ 3.14Å; E213-R224 VanDerWaalsContact OE2-CZ 3.23Å; E213-R224 IonicContact OE2-NE 3.76Å; E213-R224 PolarHBondContact OE2-NE 3.5Å; E213-R224 IonicContact OE2-NH1 3.53Å; E213-R224 IonicContact OE2-NH2 2.73Å; E213-R224 PolarHBondContact OE2-NH2 3.23Å
214	A	86.9	Confident	87.1	Confident	91 Å²	91	62.3 Å²	62.3	75%	0.752	38%	0.376	S	S	*	.	H	α-helix	trans	-61.3	-25.2	175.6	0	0	0	0	0	112.6	R210 E211 G216	R210-A214 PolarHBondContact O-N 2.98Å; E211-A214 WeakPolarHBondContact O-CB 3.42Å; E211-A214 PolarHBondContact O-N 3.45Å; A214-G216 VanDerWaalsContact C-N 3.34Å
215	R	85.7	Confident	87	Confident	163 Å²	163	61.2 Å²	61.2	62%	0.615	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	0.1	173.8	-62.3	176.4	-175.4	-171.2	2.3	113.9	E211 Q212 E213	E211-R215 PolarHBondContact O-N 3.47Å; E211-R215 IonicContact OE1-CZ 2.9Å; E211-R215 IonicContact OE1-NE 3.43Å; E211-R215 IonicContact OE1-NH2 3.9Å; E211-R215 PolarHBondContact OE1-NH2 2.92Å; Q212-R215 PolarHBondContact O-N 3.31Å; E213-R215 PolarHBondContact O-N 3.43Å
216	G	85.4	Confident	87	Confident	65 Å²	65	63.3 Å²	63.3	67%	0.67	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	21.4	176.1	0	0	0	0	0	115.5	Q212 E213 A214 A218	Q212-G216 PolarHBondContact O-N 3.01Å; E213-G216 PolarHBondContact O-N 3.33Å; A214-G216 VanDerWaalsContact C-N 3.34Å; G216-A218 PolarHBondContact O-N 2.85Å
217	T	85.4	Confident	87	Confident	39 Å²	39	63.1 Å²	63.1	24%	0.239	38%	0.381	C	S	.	.			trans	-75.2	115.1	-177.3	-52.8	0	0	0	0	111.9	L175 Q212 A219 C220	L175-T217 HydrophobicContact CD1-CG2 4.44Å; Q212-T217 WeakPolarHBondContact O-CB 3.06Å; Q212-T217 PolarHBondContact O-N 3.01Å; Q212-T217 VanDerWaalsContact O-N 3.1Å; Q212-T217 PolarHBondContact O-OG1 3.11Å; Q212-T217 VanDerWaalsContact O-OG1 3.07Å; T217-A219 VanDerWaalsContact C-N 3.34Å; T217-A219 HydrophobicContact CG2-CB 4.34Å; T217-A219 PolarHBondContact O-N 3.42Å; T217-C220 WeakPolarHBondContact O-CB 3.35Å; T217-C220 PolarHBondContact O-N 3.2Å; T217-C220 PolarHBondContact O-SG 2.84Å; T217-C220 VanDerWaalsContact O-SG 3.41Å
218	A	84.3	Confident	87.1	Confident	85 Å²	85	63.9 Å²	63.9	70%	0.702	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-37.3	-176.9	0	0	0	0	0	114.4	G216 C220 A221	G216-A218 PolarHBondContact O-N 2.85Å; A218-C220 PolarHBondContact O-N 2.83Å; A218-A221 WeakPolarHBondContact O-CB 3.43Å; A218-A221 PolarHBondContact O-N 2.99Å
219	A	83.5	Confident	87.3	Confident	43 Å²	43	72.2 Å²	72.2	36%	0.355	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-15	-179.8	0	0	0	0	0	114	L175 T217 A221 D222	L175-A219 HydrophobicContact CD1-CB 4Å; T217-A219 VanDerWaalsContact C-N 3.34Å; T217-A219 HydrophobicContact CG2-CB 4.34Å; T217-A219 PolarHBondContact O-N 3.42Å; A219-A221 PolarHBondContact O-N 2.7Å; A219-D222 PolarHBondContact O-N 3.37Å
220	C	87.1	Confident	87.5	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.007	41%	0.405	C	S	.	.	H	α-helix	trans	-65.6	-29.3	173.6	-62.4	0	0	0	0	112.2	V209 E213 T217 A218 D222 V223 R224	V209-C220 HydrophobicContact CG1-CB 4.1Å; E213-C220 HydrophobicContact CB-CB 4.32Å; T217-C220 WeakPolarHBondContact O-CB 3.35Å; T217-C220 PolarHBondContact O-N 3.2Å; T217-C220 PolarHBondContact O-SG 2.84Å; T217-C220 VanDerWaalsContact O-SG 3.41Å; A218-C220 PolarHBondContact O-N 2.83Å; C220-D222 VanDerWaalsContact C-N 3.29Å; C220-D222 PolarHBondContact O-N 3.4Å; C220-V223 PolarHBondContact O-N 3.48Å; C220-R224 WeakPolarHBondContact O-CB 3.49Å; C220-R224 PolarHBondContact O-N 2.91Å
221	A	84.9	Confident	87.8	Confident	66 Å²	66	70 Å²	70	55%	0.545	40%	0.396	S	S	.	.	H	α-helix	trans	-63.3	-36.9	179.8	0	0	0	0	0	112	A218 A219 V223	A218-A221 WeakPolarHBondContact O-CB 3.43Å; A218-A221 PolarHBondContact O-N 2.99Å; A219-A221 PolarHBondContact O-N 2.7Å; A221-V223 PolarHBondContact O-N 2.8Å
222	D	85.2	Confident	88.1	Confident	133 Å²	133	69.2 Å²	69.2	71%	0.711	40%	0.398	S	S	*	.	H	α-helix	trans	-69.5	-34.5	-177.8	-60.5	-25.1	0	0	0	112.2	A219 C220	A219-D222 PolarHBondContact O-N 3.37Å; C220-D222 VanDerWaalsContact C-N 3.29Å; C220-D222 PolarHBondContact O-N 3.4Å
223	V	88.6	Confident	88.4	Confident	26 Å²	26	71.4 Å²	71.4	16%	0.158	41%	0.407	C	S	.	.	H	α-helix	trans	-92.2	-28.1	-174.2	-176.9	0	0	0	0	112.2	L175 V177 C220 A221 G225 V226 L227	L175-V223 WeakPolarHBondContact O-CG1 3.34Å; L175-V223 WeakPolarHBondContact O-CG2 3.47Å; V177-V223 HydrophobicContact CG2-CG1 3.49Å; V177-V223 VanDerWaalsContact CG2-CG1 3.49Å; C220-V223 PolarHBondContact O-N 3.48Å; A221-V223 PolarHBondContact O-N 2.8Å; V223-G225 VanDerWaalsContact C-N 3.35Å; V223-G225 PolarHBondContact O-N 3.49Å; V223-V226 PolarHBondContact O-N 3.12Å; V223-L227 HydrophobicContact CG1-CD1 3.75Å; V223-L227 HydrophobicContact CG1-CG 3.88Å; V223-L227 PolarHBondContact O-N 3.03Å
224	R	86.4	Confident	88.8	Confident	91 Å²	91	67.7 Å²	67.7	34%	0.343	39%	0.389	S	S	.	.	H	α-helix	trans	-52.2	-49.6	-175.6	-176	-180	-54	167	14.3	112.9	E213 C220 V226 L227 D228	E213-R224 IonicContact OE1-CZ 2.79Å; E213-R224 IonicContact OE1-NE 3.94Å; E213-R224 IonicContact OE1-NH1 3.37Å; E213-R224 PolarHBondContact OE1-NH1 3.33Å; E213-R224 IonicContact OE1-NH2 3.1Å; E213-R224 PolarHBondContact OE1-NH2 2.89Å; E213-R224 IonicContact OE2-CZ 3.14Å; E213-R224 VanDerWaalsContact OE2-CZ 3.23Å; E213-R224 IonicContact OE2-NE 3.76Å; E213-R224 PolarHBondContact OE2-NE 3.5Å; E213-R224 IonicContact OE2-NH1 3.53Å; E213-R224 IonicContact OE2-NH2 2.73Å; E213-R224 PolarHBondContact OE2-NH2 3.23Å; C220-R224 WeakPolarHBondContact O-CB 3.49Å; C220-R224 PolarHBondContact O-N 2.91Å; R224-V226 PolarHBondContact O-N 3Å; R224-L227 PolarHBondContact O-N 3.33Å; R224-D228 WeakPolarHBondContact CG-OD2 3.38Å; R224-D228 WeakPolarHBondContact O-CB 3.49Å; R224-D228 PolarHBondContact O-N 2.88Å
225	G	88.4	Confident	89.2	Confident	36 Å²	36	64 Å²	64	37%	0.371	36%	0.357	S	S	.	.	H	α-helix	trans	-60.9	-33.2	-178.1	0	0	0	0	0	113.4	V223 R229	V223-G225 VanDerWaalsContact C-N 3.35Å; V223-G225 PolarHBondContact O-N 3.49Å; G225-R229 WeakPolarHBondContact O-CD 3.34Å; G225-R229 VanDerWaalsContact O-CG 3.24Å; G225-R229 WeakPolarHBondContact O-CG 3.32Å; G225-R229 PolarHBondContact O-N 3.23Å
226	V	90.3	Very high	89.7	Confident	67 Å²	67	61.6 Å²	61.6	41%	0.406	36%	0.355	S	S	.	.	H	α-helix	trans	-73.5	-48.6	177.1	-179.8	0	0	0	0	110.3	V177 V223 R224 D228 R229 L230	V177-V226 HydrophobicContact CG1-CG1 4.43Å; V223-V226 PolarHBondContact O-N 3.12Å; R224-V226 PolarHBondContact O-N 3Å; V226-D228 VanDerWaalsContact C-N 3.31Å; V226-D228 PolarHBondContact O-N 3.5Å; V226-R229 PolarHBondContact O-N 3.43Å; V226-L230 HydrophobicContact CG1-CD1 4.11Å; V226-L230 HydrophobicContact CG1-CG 4.42Å; V226-L230 WeakPolarHBondContact O-CG 3.32Å; V226-L230 PolarHBondContact O-N 3.27Å
227	L	90.4	Very high	90.1	Very high	10 Å²	10	60.1 Å²	60.1	5%	0.052	33%	0.33	C	S	.	.	H	α-helix	trans	-60.9	-39.7	178.7	-72.9	175.9	0	0	0	112.3	V177 L202 K205 V209 V223 R224 L230 R231	V177-L227 HydrophobicContact CG2-CD2 3.69Å; V177-L227 HydrophobicContact CG2-CG 4.03Å; L202-L227 HydrophobicContact CD1-CD2 3.62Å; K205-L227 HydrophobicContact CB-CD2 4.48Å; V209-L227 HydrophobicContact CB-CD1 4.06Å; V209-L227 HydrophobicContact CG1-CD1 4.39Å; V209-L227 HydrophobicContact CG2-CD1 3.59Å; V223-L227 HydrophobicContact CG1-CD1 3.75Å; V223-L227 HydrophobicContact CG1-CG 3.88Å; V223-L227 PolarHBondContact O-N 3.03Å; R224-L227 PolarHBondContact O-N 3.33Å; L227-L230 PolarHBondContact O-N 3.47Å; L227-R231 VanDerWaalsContact O-CB 3.26Å; L227-R231 WeakPolarHBondContact O-CB 3.28Å; L227-R231 PolarHBondContact O-N 3.32Å
228	D	90.4	Very high	90.6	Very high	61 Å²	61	58.3 Å²	58.3	33%	0.326	32%	0.318	S	S	.	.	H	α-helix	trans	-63.4	-42.4	176.5	-82.3	-35.1	0	0	0	112.2	R224 V226 R231 V232	R224-D228 WeakPolarHBondContact CG-OD2 3.38Å; R224-D228 WeakPolarHBondContact O-CB 3.49Å; R224-D228 PolarHBondContact O-N 2.88Å; V226-D228 VanDerWaalsContact C-N 3.31Å; V226-D228 PolarHBondContact O-N 3.5Å; D228-R231 WeakPolarHBondContact O-CB 2.96Å; D228-R231 PolarHBondContact O-N 3.36Å; D228-R231 IonicContact OD1-CZ 3.56Å; D228-R231 IonicContact OD1-NE 3.84Å; D228-R231 PolarHBondContact OD1-NE 3.28Å; D228-R231 IonicContact OD1-NH2 2.93Å; D228-R231 PolarHBondContact OD1-NH2 2.92Å; D228-V232 WeakPolarHBondContact O-CG2 3.3Å; D228-V232 PolarHBondContact O-N 2.86Å
229	R	92.6	Very high	91.1	Very high	203 Å²	203	58.5 Å²	58.5	77%	0.766	30%	0.301	S	S	*	.	H	α-helix	trans	-66	-41.3	176	-70.1	172.6	-170	-170.5	4.5	111.8	G225 V226 V232 K233	G225-R229 WeakPolarHBondContact O-CD 3.34Å; G225-R229 VanDerWaalsContact O-CG 3.24Å; G225-R229 WeakPolarHBondContact O-CG 3.32Å; G225-R229 PolarHBondContact O-N 3.23Å; V226-R229 PolarHBondContact O-N 3.43Å; R229-V232 PolarHBondContact O-N 3.22Å; R229-K233 PolarHBondContact O-N 3.09Å
230	L	93.4	Very high	91.7	Very high	8 Å²	8	61.9 Å²	61.9	4%	0.042	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-43.4	174.8	-69.2	174.7	0	0	0	111.3	V177 V182 I185 L202 V226 L227 K233 A234	V177-L230 HydrophobicContact CG1-CD1 4.03Å; V182-L230 HydrophobicContact CB-CD2 4.4Å; V182-L230 HydrophobicContact CG1-CD2 4.24Å; V182-L230 HydrophobicContact CG2-CD1 4.07Å; V182-L230 HydrophobicContact CG2-CD2 4.39Å; I185-L230 HydrophobicContact CB-CD2 4.29Å; I185-L230 HydrophobicContact CG2-CD2 4.24Å; L202-L230 HydrophobicContact CD1-CB 3.88Å; L202-L230 HydrophobicContact CD1-CD1 4.07Å; L202-L230 HydrophobicContact CD2-CB 4.17Å; V226-L230 HydrophobicContact CG1-CD1 4.11Å; V226-L230 HydrophobicContact CG1-CG 4.42Å; V226-L230 WeakPolarHBondContact O-CG 3.32Å; V226-L230 PolarHBondContact O-N 3.27Å; L227-L230 PolarHBondContact O-N 3.47Å; L230-K233 PolarHBondContact O-N 2.82Å; L230-A234 WeakPolarHBondContact O-CB 3.43Å; L230-A234 PolarHBondContact O-N 3.29Å
231	R	93.7	Very high	92	Very high	68 Å²	68	62.5 Å²	62.5	26%	0.257	31%	0.312	S	S	.	.	H	α-helix	trans	-57.9	-52.3	175	176.5	179.7	62.9	128.6	-5.9	111	L227 D228 K233 A234 V235 N276	L227-R231 VanDerWaalsContact O-CB 3.26Å; L227-R231 WeakPolarHBondContact O-CB 3.28Å; L227-R231 PolarHBondContact O-N 3.32Å; D228-R231 WeakPolarHBondContact O-CB 2.96Å; D228-R231 PolarHBondContact O-N 3.36Å; D228-R231 IonicContact OD1-CZ 3.56Å; D228-R231 IonicContact OD1-NE 3.84Å; D228-R231 PolarHBondContact OD1-NE 3.28Å; D228-R231 IonicContact OD1-NH2 2.93Å; D228-R231 PolarHBondContact OD1-NH2 2.92Å; R231-K233 VanDerWaalsContact C-N 3.3Å; R231-K233 PolarHBondContact O-N 3.02Å; R231-A234 PolarHBondContact O-N 3.42Å; R231-V235 HydrophobicContact CG-CG2 4.39Å; R231-V235 WeakPolarHBondContact O-CB 3.44Å; R231-V235 VanDerWaalsContact O-CG2 3.24Å; R231-V235 WeakPolarHBondContact O-CG2 3.18Å; R231-V235 PolarHBondContact O-N 3.4Å; R231-N276 HydrophobicContact CG-CB 4.16Å; R231-N276 PolarHBondContact NH1-O 3.08Å; R231-N276 VanDerWaalsContact NH1-O 3.13Å
232	V	93.9	Very high	92.5	Very high	81 Å²	81	59.3 Å²	59.3	49%	0.491	29%	0.286	S	S	.	.	H	α-helix	trans	-57.2	-45.3	178.2	170.4	0	0	0	0	110.8	D228 R229 V235 M236	D228-V232 WeakPolarHBondContact O-CG2 3.3Å; D228-V232 PolarHBondContact O-N 2.86Å; R229-V232 PolarHBondContact O-N 3.22Å; V232-V235 PolarHBondContact O-N 3.3Å; V232-M236 HydrophobicContact CG1-SD 4.27Å; V232-M236 WeakPolarHBondContact O-CG 3.44Å; V232-M236 PolarHBondContact O-N 3.29Å
233	K	93.9	Very high	92.9	Very high	84 Å²	84	53.4 Å²	53.4	37%	0.365	25%	0.254	S	S	.	.	H	α-helix	trans	-64.1	-43.8	178.4	-172.8	68.6	172.6	179.8	0	112.5	L186 R229 L230 R231 M236 K237	L186-K233 HydrophobicContact CD2-CG 4.08Å; R229-K233 PolarHBondContact O-N 3.09Å; L230-K233 PolarHBondContact O-N 2.82Å; R231-K233 VanDerWaalsContact C-N 3.3Å; R231-K233 PolarHBondContact O-N 3.02Å; K233-M236 PolarHBondContact O-N 3.22Å; K233-K237 HydrophobicContact CG-CD 4.32Å; K233-K237 WeakPolarHBondContact O-CG 3.38Å; K233-K237 PolarHBondContact O-N 3.02Å; K233-K237 VanDerWaalsContact O-N 3.09Å
234	A	94.9	Very high	93.1	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.1	-47.4	177	0	0	0	0	0	111	I185 L199 L202 L230 R231 M236 K237 I238 F272	I185-A234 HydrophobicContact CG2-CB 4.02Å; L199-A234 HydrophobicContact CD1-CB 3.76Å; L202-A234 HydrophobicContact CD2-CB 4.17Å; L230-A234 WeakPolarHBondContact O-CB 3.43Å; L230-A234 PolarHBondContact O-N 3.29Å; R231-A234 PolarHBondContact O-N 3.42Å; A234-M236 VanDerWaalsContact C-N 3.34Å; A234-M236 PolarHBondContact O-N 3.17Å; A234-K237 PolarHBondContact O-N 2.96Å; A234-I238 WeakPolarHBondContact O-CB 3.39Å; A234-I238 WeakPolarHBondContact O-CD1 3.15Å; A234-I238 VanDerWaalsContact O-CG1 3.22Å; A234-I238 WeakPolarHBondContact O-CG1 3.42Å; A234-I238 PolarHBondContact O-N 3.42Å; A234-F272 HydrophobicContact CB-CE1 4.04Å; A234-F272 HydrophobicContact CB-CZ 4.19Å
235	V	95.8	Very high	93.3	Very high	13 Å²	13	56.5 Å²	56.5	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-55.7	-47.5	175.7	168.8	0	0	0	0	110.9	R231 V232 K237 I238 R239 F272 L273 E277 T280	R231-V235 HydrophobicContact CG-CG2 4.39Å; R231-V235 WeakPolarHBondContact O-CB 3.44Å; R231-V235 VanDerWaalsContact O-CG2 3.24Å; R231-V235 WeakPolarHBondContact O-CG2 3.18Å; R231-V235 PolarHBondContact O-N 3.4Å; V232-V235 PolarHBondContact O-N 3.3Å; V235-K237 PolarHBondContact O-N 2.86Å; V235-I238 PolarHBondContact O-N 2.96Å; V235-R239 WeakPolarHBondContact O-CB 3.38Å; V235-R239 PolarHBondContact O-N 3.47Å; V235-F272 HydrophobicContact CG2-CE1 4.05Å; V235-L273 HydrophobicContact CB-CD2 4.1Å; V235-L273 HydrophobicContact CG1-CD2 3.8Å; V235-L273 HydrophobicContact CG2-CD2 3.92Å; V235-E277 HydrophobicContact CG1-CB 4.11Å; V235-E277 HydrophobicContact CG1-CG 4.17Å; V235-E277 HydrophobicContact CG2-CB 4.05Å; V235-T280 HydrophobicContact CG1-CG2 4.2Å
236	M	94.3	Very high	93.5	Very high	114 Å²	114	54.8 Å²	54.8	56%	0.562	25%	0.252	S	S	*	.	H	α-helix	trans	-59.5	-48.4	178.5	-72.4	176.9	76.4	0	0	112.5	V232 K233 A234 R239 E240	V232-M236 HydrophobicContact CG1-SD 4.27Å; V232-M236 WeakPolarHBondContact O-CG 3.44Å; V232-M236 PolarHBondContact O-N 3.29Å; K233-M236 PolarHBondContact O-N 3.22Å; A234-M236 VanDerWaalsContact C-N 3.34Å; A234-M236 PolarHBondContact O-N 3.17Å; M236-R239 PolarHBondContact O-N 3.49Å; M236-E240 WeakPolarHBondContact O-CB 3.36Å; M236-E240 PolarHBondContact O-N 3.27Å
237	K	95	Very high	93.5	Very high	34 Å²	34	56.2 Å²	56.2	15%	0.148	25%	0.251	C	S	.	.	H	α-helix	trans	-65.2	-43.5	-178.9	-70.4	176.2	72.5	168.6	0	111.7	I185 L186 A188 V190 F195 K233 A234 V235 F241	I185-K237 WeakPolarHBondContact O-CD 3.27Å; I185-K237 PolarHBondContact O-NZ 2.85Å; L186-K237 PolarHBondContact O-NZ 3.4Å; A188-K237 WeakPolarHBondContact O-CE 3.22Å; A188-K237 PolarHBondContact O-NZ 2.98Å; V190-K237 HydrophobicContact CG1-CB 3.83Å; F195-K237 HydrophobicContact CE2-CD 4.43Å; K233-K237 HydrophobicContact CG-CD 4.32Å; K233-K237 WeakPolarHBondContact O-CG 3.38Å; K233-K237 PolarHBondContact O-N 3.02Å; K233-K237 VanDerWaalsContact O-N 3.09Å; A234-K237 PolarHBondContact O-N 2.96Å; V235-K237 PolarHBondContact O-N 2.86Å; K237-F241 WeakPolarHBondContact O-CB 3.46Å; K237-F241 PolarHBondContact O-N 3.43Å; K237-F241 VanDerWaalsContact O-N 3.09Å
238	I	95.8	Very high	93.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-46.1	177.6	-69.6	166.3	0	0	0	110.8	F195 L199 A234 V235 E240 F241 I242 F269 F272 L273	F195-I238 HydrophobicContact CE1-CD1 4.42Å; F195-I238 HydrophobicContact CE1-CG1 4.08Å; F195-I238 HydrophobicContact CZ-CG1 4.31Å; L199-I238 HydrophobicContact CD1-CD1 3.91Å; L199-I238 HydrophobicContact CD2-CD1 3.53Å; L199-I238 HydrophobicContact CG-CD1 4.38Å; A234-I238 WeakPolarHBondContact O-CB 3.39Å; A234-I238 WeakPolarHBondContact O-CD1 3.15Å; A234-I238 VanDerWaalsContact O-CG1 3.22Å; A234-I238 WeakPolarHBondContact O-CG1 3.42Å; A234-I238 PolarHBondContact O-N 3.42Å; V235-I238 PolarHBondContact O-N 2.96Å; I238-E240 PolarHBondContact O-N 2.85Å; I238-F241 PolarHBondContact O-N 3.08Å; I238-I242 HydrophobicContact CG2-CD1 3.64Å; I238-I242 HydrophobicContact CG2-CG1 4.25Å; I238-I242 WeakPolarHBondContact O-CG1 3.31Å; I238-I242 PolarHBondContact O-N 2.87Å; I238-F269 HydrophobicContact CD1-CD1 4.48Å; I238-F269 HydrophobicContact CG1-CD1 4.49Å; I238-F269 HydrophobicContact CG1-CD2 4.44Å; I238-F269 HydrophobicContact CG1-CG 4.25Å; I238-F269 HydrophobicContact CG2-CB 3.62Å; I238-F269 HydrophobicContact CG2-CD2 4.28Å; I238-F269 HydrophobicContact CG2-CG 4.12Å; I238-F272 HydrophobicContact CD1-CD1 3.65Å; I238-F272 HydrophobicContact CD1-CE1 4.1Å; I238-F272 HydrophobicContact CD1-CG 4.44Å; I238-L273 HydrophobicContact CG2-CD1 3.77Å; I238-L273 HydrophobicContact CG2-CD2 4.26Å; I238-L273 HydrophobicContact CG2-CG 3.96Å
239	R	95.6	Very high	93.2	Very high	90 Å²	90	54.7 Å²	54.7	34%	0.34	25%	0.245	S	C	.	.	H	α-helix	trans	-56.7	-51.8	178.1	178.5	-175.3	170	-88.7	-0.2	111	V235 M236 F241 I242 L243 T280 E283	V235-R239 WeakPolarHBondContact O-CB 3.38Å; V235-R239 PolarHBondContact O-N 3.47Å; M236-R239 PolarHBondContact O-N 3.49Å; R239-F241 VanDerWaalsContact C-N 3.3Å; R239-F241 PolarHBondContact O-N 3.46Å; R239-I242 PolarHBondContact O-N 3.47Å; R239-L243 HydrophobicContact CG-CD1 3.8Å; R239-L243 HydrophobicContact CG-CG 4.4Å; R239-L243 WeakPolarHBondContact O-CB 3.36Å; R239-L243 VanDerWaalsContact O-CG 3.31Å; R239-L243 WeakPolarHBondContact O-CG 3.5Å; R239-L243 PolarHBondContact O-N 2.92Å; R239-T280 HydrophobicContact CB-CG2 3.74Å; R239-T280 HydrophobicContact CG-CG2 3.69Å; R239-E283 IonicContact CZ-OE1 2.73Å; R239-E283 IonicContact CZ-OE2 3.22Å; R239-E283 IonicContact NE-OE1 3.04Å; R239-E283 PolarHBondContact NE-OE1 3.47Å; R239-E283 IonicContact NE-OE2 3.24Å; R239-E283 PolarHBondContact NE-OE2 3.36Å; R239-E283 IonicContact NH2-OE1 3.32Å; R239-E283 PolarHBondContact NH2-OE1 3.01Å; R239-E283 IonicContact NH2-OE2 2.75Å
240	E	95.1	Very high	92.9	Very high	114 Å²	114	51.2 Å²	51.2	53%	0.533	23%	0.232	S	C	.	.	H	α-helix	trans	-56.6	-46.7	179	-176.5	178.3	178.6	0	0	111.1	M236 I238 Q244	M236-E240 WeakPolarHBondContact O-CB 3.36Å; M236-E240 PolarHBondContact O-N 3.27Å; I238-E240 PolarHBondContact O-N 2.85Å; E240-Q244 WeakPolarHBondContact O-CB 3.3Å; E240-Q244 WeakPolarHBondContact O-CG 3.44Å; E240-Q244 PolarHBondContact O-N 3.46Å; E240-Q244 PolarHBondContact OE1-NE2 3.06Å
241	F	94.6	Very high	92.4	Very high	13 Å²	13	57.5 Å²	57.5	6%	0.057	26%	0.259	C	S	.	.	H	α-helix	trans	-61.7	-50.9	179.4	177.5	-104.1	0	0	0	113.7	V190 T191 K237 I238 R239 Q244 K245 Y266 F269	V190-F241 HydrophobicContact CB-CB 4.41Å; V190-F241 HydrophobicContact CB-CD2 4.46Å; V190-F241 HydrophobicContact CB-CG 4.32Å; V190-F241 HydrophobicContact CG2-CB 3.87Å; V190-F241 HydrophobicContact CG2-CD2 3.63Å; V190-F241 HydrophobicContact CG2-CE2 4.38Å; V190-F241 HydrophobicContact CG2-CG 3.83Å; T191-F241 HydrophobicContact CG2-CD2 4.43Å; T191-F241 HydrophobicContact CG2-CE2 3.63Å; T191-F241 HydrophobicContact CG2-CZ 4.25Å; K237-F241 WeakPolarHBondContact O-CB 3.46Å; K237-F241 PolarHBondContact O-N 3.43Å; K237-F241 VanDerWaalsContact O-N 3.09Å; I238-F241 PolarHBondContact O-N 3.08Å; R239-F241 VanDerWaalsContact C-N 3.3Å; R239-F241 PolarHBondContact O-N 3.46Å; F241-Q244 PolarHBondContact O-N 3Å; F241-K245 HydrophobicContact CE1-CG 4.31Å; F241-K245 HydrophobicContact CE2-CG 4.35Å; F241-K245 HydrophobicContact CZ-CG 4.16Å; F241-K245 WeakPolarHBondContact O-CG 3.27Å; F241-K245 PolarHBondContact O-N 3.47Å; F241-Y266 HydrophobicContact CE1-CD1 4.13Å; F241-Y266 AromaticContact CE1-CD2 3.72Å; F241-Y266 HydrophobicContact CE1-CD2 3.72Å; F241-Y266 HydrophobicContact CE1-CE1 4.37Å; F241-Y266 HydrophobicContact CE1-CE2 4.02Å; F241-Y266 AromaticContact CE1-CG 3.79Å; F241-Y266 HydrophobicContact CE1-CG 3.79Å; F241-Y266 HydrophobicContact CZ-CD1 4.42Å; F241-Y266 AromaticContact CZ-CD2 3.85Å; F241-Y266 HydrophobicContact CZ-CD2 3.85Å; F241-Y266 HydrophobicContact CZ-CE1 4.21Å; F241-Y266 AromaticContact CZ-CE2 3.64Å; F241-Y266 HydrophobicContact CZ-CE2 3.64Å; F241-Y266 HydrophobicContact CZ-CG 4.24Å; F241-Y266 AromaticContact CZ-CZ 3.82Å; F241-F269 HydrophobicContact CD1-CD2 4.05Å; F241-F269 AromaticContact CD1-CE2 3.99Å; F241-F269 HydrophobicContact CD1-CE2 3.99Å; F241-F269 HydrophobicContact CE1-CD2 4.24Å; F241-F269 HydrophobicContact CE1-CE2 4.02Å
242	I	94.3	Very high	91.3	Very high	0 Å²	0	60 Å²	60	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-43.3	-177.6	-63.7	173.5	0	0	0	109.9	I238 R239 Q244 K245 I246 L263 F269 L273 I284 F403	I238-I242 HydrophobicContact CG2-CD1 3.64Å; I238-I242 HydrophobicContact CG2-CG1 4.25Å; I238-I242 WeakPolarHBondContact O-CG1 3.31Å; I238-I242 PolarHBondContact O-N 2.87Å; R239-I242 PolarHBondContact O-N 3.47Å; I242-Q244 PolarHBondContact O-N 2.86Å; I242-K245 WeakPolarHBondContact O-CB 3.36Å; I242-K245 PolarHBondContact O-N 2.98Å; I242-K245 VanDerWaalsContact O-N 3.13Å; I242-I246 HydrophobicContact CG2-CD1 3.88Å; I242-I246 HydrophobicContact CG2-CG1 4.34Å; I242-I246 WeakPolarHBondContact O-CG1 2.87Å; I242-I246 PolarHBondContact O-N 3.44Å; I242-L263 HydrophobicContact CG2-CD2 4.31Å; I242-F269 HydrophobicContact CD1-CB 3.94Å; I242-L273 HydrophobicContact CD1-CD1 4.27Å; I242-I284 HydrophobicContact CB-CD1 4.1Å; I242-I284 HydrophobicContact CB-CG2 4.47Å; I242-I284 HydrophobicContact CD1-CD1 4.04Å; I242-I284 HydrophobicContact CG2-CD1 4.23Å; I242-I284 HydrophobicContact CG2-CG1 4.47Å; I242-I284 HydrophobicContact CG2-CG2 3.49Å; I242-I284 VanDerWaalsContact CG2-CG2 3.49Å; I242-F403 HydrophobicContact CD1-CZ 4.46Å; I242-F403 HydrophobicContact CG2-CZ 4.31Å
243	L	94.1	Very high	90	Very high	8 Å²	8	65.5 Å²	65.5	4%	0.042	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-43.2	176.9	-71.2	177.6	0	0	0	111.7	R239 K245 I246 Y247 I284 E287	R239-L243 HydrophobicContact CG-CD1 3.8Å; R239-L243 HydrophobicContact CG-CG 4.4Å; R239-L243 WeakPolarHBondContact O-CB 3.36Å; R239-L243 VanDerWaalsContact O-CG 3.31Å; R239-L243 WeakPolarHBondContact O-CG 3.5Å; R239-L243 PolarHBondContact O-N 2.92Å; L243-K245 VanDerWaalsContact C-N 3.27Å; L243-K245 PolarHBondContact O-N 2.91Å; L243-I246 PolarHBondContact O-N 3.4Å; L243-I246 VanDerWaalsContact O-N 3.13Å; L243-Y247 HydrophobicContact CB-CD2 4.44Å; L243-Y247 HydrophobicContact CB-CE2 3.97Å; L243-Y247 WeakPolarHBondContact O-CD2 3.33Å; L243-Y247 VanDerWaalsContact O-CG 3.29Å; L243-Y247 PolarHBondContact O-N 3.09Å; L243-I284 HydrophobicContact CD2-CG1 4.18Å; L243-I284 HydrophobicContact CG-CG1 4.32Å; L243-E287 HydrophobicContact CD2-CB 4.07Å; L243-E287 HydrophobicContact CD2-CG 3.97Å
244	Q	92.6	Very high	88.9	Confident	108 Å²	108	63.8 Å²	63.8	51%	0.505	30%	0.303	S	S	.	.	H	α-helix	trans	-58.1	-39.9	173.8	-77.1	176.4	4.8	0	0	112	E240 F241 I242 Y247 S248	E240-Q244 WeakPolarHBondContact O-CB 3.3Å; E240-Q244 WeakPolarHBondContact O-CG 3.44Å; E240-Q244 PolarHBondContact O-N 3.46Å; E240-Q244 PolarHBondContact OE1-NE2 3.06Å; F241-Q244 PolarHBondContact O-N 3Å; I242-Q244 PolarHBondContact O-N 2.86Å; Q244-Y247 PolarHBondContact O-N 3.49Å; Q244-S248 PolarHBondContact O-N 2.84Å; Q244-S248 VanDerWaalsContact O-N 3.12Å
245	K	90.8	Very high	88.1	Confident	74 Å²	74	67 Å²	67	32%	0.322	32%	0.32	S	S	.	.	H	α-helix	trans	-66.4	-41.7	174.4	-68.4	-67.4	178.4	-175.8	0	111.8	F241 I242 L243 Y247 S248 F249 L263	F241-K245 HydrophobicContact CE1-CG 4.31Å; F241-K245 HydrophobicContact CE2-CG 4.35Å; F241-K245 HydrophobicContact CZ-CG 4.16Å; F241-K245 WeakPolarHBondContact O-CG 3.27Å; F241-K245 PolarHBondContact O-N 3.47Å; I242-K245 WeakPolarHBondContact O-CB 3.36Å; I242-K245 PolarHBondContact O-N 2.98Å; I242-K245 VanDerWaalsContact O-N 3.13Å; L243-K245 VanDerWaalsContact C-N 3.27Å; L243-K245 PolarHBondContact O-N 2.91Å; K245-Y247 PolarHBondContact O-N 3.03Å; K245-S248 WeakPolarHBondContact O-CB 3.05Å; K245-S248 PolarHBondContact O-N 2.99Å; K245-S248 VanDerWaalsContact O-N 3.17Å; K245-S248 PolarHBondContact O-OG 3.44Å; K245-F249 VanDerWaalsContact O-CD2 3.24Å; K245-F249 WeakPolarHBondContact O-CD2 3.21Å; K245-L263 HydrophobicContact CB-CD2 3.72Å; K245-L263 HydrophobicContact CB-CG 4.24Å; K245-L263 HydrophobicContact CG-CD2 4.21Å
246	I	92.2	Very high	87.3	Confident	0 Å²	0	68 Å²	68	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-62.2	-42	174.8	-67	169.4	0	0	0	111.1	I242 L243 S248 F249 I284 E287 Y288 T291	I242-I246 HydrophobicContact CG2-CD1 3.88Å; I242-I246 HydrophobicContact CG2-CG1 4.34Å; I242-I246 WeakPolarHBondContact O-CG1 2.87Å; I242-I246 PolarHBondContact O-N 3.44Å; L243-I246 PolarHBondContact O-N 3.4Å; L243-I246 VanDerWaalsContact O-N 3.13Å; I246-S248 PolarHBondContact O-N 3.39Å; I246-F249 WeakPolarHBondContact O-CB 3.41Å; I246-F249 VanDerWaalsContact O-CD2 3.26Å; I246-F249 WeakPolarHBondContact O-CD2 3.48Å; I246-F249 PolarHBondContact O-N 3.28Å; I246-I284 HydrophobicContact CD1-CG2 3.91Å; I246-E287 HydrophobicContact CG2-CG 4.24Å; I246-Y288 HydrophobicContact CD1-CD2 4.45Å; I246-Y288 HydrophobicContact CG1-CD2 4.23Å; I246-T291 HydrophobicContact CG2-CG2 4.39Å
247	Y	90.3	Very high	86.6	Confident	97 Å²	97	65.1 Å²	65.1	38%	0.38	31%	0.308	S	S	.	.	H	α-helix	trans	-65.9	-26	176.7	-64.6	-43.4	0	0	0	113.2	L243 Q244 K245 F249 R250 E287	L243-Y247 HydrophobicContact CB-CD2 4.44Å; L243-Y247 HydrophobicContact CB-CE2 3.97Å; L243-Y247 WeakPolarHBondContact O-CD2 3.33Å; L243-Y247 VanDerWaalsContact O-CG 3.29Å; L243-Y247 PolarHBondContact O-N 3.09Å; Q244-Y247 PolarHBondContact O-N 3.49Å; K245-Y247 PolarHBondContact O-N 3.03Å; Y247-F249 PolarHBondContact O-N 2.93Å; Y247-R250 WeakPolarHBondContact O-CB 3.43Å; Y247-R250 PolarHBondContact O-N 3.43Å; Y247-R250 VanDerWaalsContact O-N 3.08Å; Y247-E287 HydrophobicContact CE1-CG 4.11Å; Y247-E287 WeakPolarHBondContact CE1-OE1 3.35Å
248	S	88.2	Confident	86	Confident	31 Å²	31	69.2 Å²	69.2	22%	0.217	33%	0.33	C	S	.	.	H	α-helix	trans	-63	-24.9	176	81.9	0	0	0	0	113.4	Q244 K245 I246 R250 K251	Q244-S248 PolarHBondContact O-N 2.84Å; Q244-S248 VanDerWaalsContact O-N 3.12Å; K245-S248 WeakPolarHBondContact O-CB 3.05Å; K245-S248 PolarHBondContact O-N 2.99Å; K245-S248 VanDerWaalsContact O-N 3.17Å; K245-S248 PolarHBondContact O-OG 3.44Å; I246-S248 PolarHBondContact O-N 3.39Å; S248-R250 PolarHBondContact O-N 2.71Å; S248-K251 WeakPolarHBondContact O-CB 3.28Å; S248-K251 PolarHBondContact O-N 2.58Å
249	F	85.9	Confident	85.3	Confident	8 Å²	8	69.9 Å²	69.9	4%	0.035	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.2	174.7	-70.9	-99.3	0	0	0	113	K245 I246 Y247 K251 Y256 P259 Q260 L263 Y288 T291 L292 I295	K245-F249 VanDerWaalsContact O-CD2 3.24Å; K245-F249 WeakPolarHBondContact O-CD2 3.21Å; I246-F249 WeakPolarHBondContact O-CB 3.41Å; I246-F249 VanDerWaalsContact O-CD2 3.26Å; I246-F249 WeakPolarHBondContact O-CD2 3.48Å; I246-F249 PolarHBondContact O-N 3.28Å; Y247-F249 PolarHBondContact O-N 2.93Å; F249-K251 PolarHBondContact O-N 2.95Å; F249-Y256 WeakPolarHBondContact CE1-O 3.35Å; F249-P259 HydrophobicContact CD1-CB 4.26Å; F249-P259 HydrophobicContact CD1-CG 4.46Å; F249-P259 HydrophobicContact CD2-CB 4.09Å; F249-P259 HydrophobicContact CE1-CB 3.8Å; F249-P259 HydrophobicContact CE1-CG 4.33Å; F249-P259 HydrophobicContact CE2-CB 3.62Å; F249-P259 HydrophobicContact CG-CB 4.42Å; F249-P259 HydrophobicContact CZ-CB 3.48Å; F249-P259 VanDerWaalsContact CZ-CB 3.48Å; F249-P259 HydrophobicContact CZ-CG 4.47Å; F249-Q260 HydrophobicContact CE1-CG 3.84Å; F249-Q260 HydrophobicContact CZ-CG 3.84Å; F249-L263 HydrophobicContact CE2-CD1 3.85Å; F249-L263 HydrophobicContact CZ-CD1 4.07Å; F249-Y288 HydrophobicContact CZ-CE2 4.47Å; F249-T291 HydrophobicContact CB-CG2 4.24Å; F249-L292 HydrophobicContact CD1-CD1 4.1Å; F249-L292 HydrophobicContact CD1-CD2 4.12Å; F249-L292 HydrophobicContact CE1-CD1 4.29Å; F249-L292 HydrophobicContact CE1-CD2 4.36Å; F249-L292 HydrophobicContact CG-CD2 4.21Å; F249-I295 HydrophobicContact CB-CD1 3.77Å; F249-I295 VanDerWaalsContact O-CD1 3.32Å; F249-I295 WeakPolarHBondContact O-CD1 3.36Å
250	R	86.1	Confident	85	Confident	130 Å²	130	66 Å²	66	49%	0.491	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-11.7	-180	-60.2	179.5	177.5	178.5	-2.6	113	Y247 S248 E287 T291	Y247-R250 WeakPolarHBondContact O-CB 3.43Å; Y247-R250 PolarHBondContact O-N 3.43Å; Y247-R250 VanDerWaalsContact O-N 3.08Å; S248-R250 PolarHBondContact O-N 2.71Å; R250-E287 IonicContact CZ-OE1 2.74Å; R250-E287 IonicContact NH2-OE1 3.99Å; R250-E287 PolarHBondContact NH2-OE1 2.63Å; R250-T291 HydrophobicContact CG-CG2 3.86Å; R250-T291 PolarHBondContact NH2-OG1 2.97Å
251	K	82.7	Confident	84.6	Confident	140 Å²	140	64.7 Å²	64.7	61%	0.609	32%	0.321	S	S	*	.	S	Bend	trans	-66.6	130.8	179	-69.9	-177.4	-179.4	-175.5	0	109.8	S248 F249 T254	S248-K251 WeakPolarHBondContact O-CB 3.28Å; S248-K251 PolarHBondContact O-N 2.58Å; F249-K251 PolarHBondContact O-N 2.95Å; K251-T254 VanDerWaalsContact CB-OG1 3.28Å; K251-T254 WeakPolarHBondContact CB-OG1 3.48Å; K251-T254 WeakPolarHBondContact O-CB 3.41Å; K251-T254 PolarHBondContact O-N 3.18Å; K251-T254 PolarHBondContact O-OG1 3.12Å
252	P	70.9	Confident	84.3	Confident	121 Å²	121	65.6 Å²	65.6	79%	0.786	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	145.9	178.2	-22.6	31.4	0	0	0	111.9	T254	P252-T254 PolarHBondContact O-N 2.93Å; P252-T254 VanDerWaalsContact O-N 3.11Å
253	M	66.9	Low	84.1	Confident	196 Å²	196	65.6 Å²	65.6	97%	0.966	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	13.6	178.5	-55.7	-61.9	-172	0	0	115.6	N255	M253-N255 PolarHBondContact O-N 2.99Å
254	T	70.7	Confident	84	Confident	49 Å²	49	67.5 Å²	67.5	30%	0.301	34%	0.34	S	S	.	.			trans	-69.2	124.8	174.2	-55.3	0	0	0	0	109.8	K251 P252 Y256 P259	K251-T254 VanDerWaalsContact CB-OG1 3.28Å; K251-T254 WeakPolarHBondContact CB-OG1 3.48Å; K251-T254 WeakPolarHBondContact O-CB 3.41Å; K251-T254 PolarHBondContact O-N 3.18Å; K251-T254 PolarHBondContact O-OG1 3.12Å; P252-T254 PolarHBondContact O-N 2.93Å; P252-T254 VanDerWaalsContact O-N 3.11Å; T254-Y256 PolarHBondContact O-N 3.26Å; T254-Y256 VanDerWaalsContact O-N 3.11Å; T254-P259 HydrophobicContact CG2-CG 3.82Å
255	N	77.8	Confident	83.8	Confident	66 Å²	66	70.2 Å²	70.2	35%	0.353	35%	0.35	S	S	.	.			trans	-69.6	105.5	164.3	-177.8	-7.5	0	0	0	108	M253 Q257 I258 P259	M253-N255 PolarHBondContact O-N 2.99Å; N255-Q257 PolarHBondContact ND2-OE1 3.03Å; N255-Q257 PolarHBondContact O-N 2.8Å; N255-Q257 WeakPolarHBondContact OD1-CB 3.35Å; N255-Q257 WeakPolarHBondContact OD1-CG 3.47Å; N255-Q257 PolarHBondContact OD1-N 2.97Å; N255-Q257 VanDerWaalsContact OD1-N 3.07Å; N255-Q257 PolarHBondContact OD1-OE1 3.08Å; N255-I258 HydrophobicContact CB-CD1 4.08Å; N255-I258 HydrophobicContact CB-CG1 4.25Å; N255-I258 PolarHBondContact O-N 3.3Å; N255-P259 WeakPolarHBondContact O-CD 3.48Å
256	Y	79	Confident	83.9	Confident	34 Å²	34	69 Å²	69	13%	0.133	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-22.3	-178.3	49.3	-89.2	0	0	0	113.2	F249 T254 I258 P259 Q260 Y296 N392	F249-Y256 WeakPolarHBondContact CE1-O 3.35Å; T254-Y256 PolarHBondContact O-N 3.26Å; T254-Y256 VanDerWaalsContact O-N 3.11Å; Y256-I258 VanDerWaalsContact C-N 3.32Å; Y256-I258 PolarHBondContact O-N 2.98Å; Y256-P259 WeakPolarHBondContact O-CD 3.42Å; Y256-Q260 WeakPolarHBondContact O-CB 3.39Å; Y256-Q260 WeakPolarHBondContact O-CG 3.48Å; Y256-Q260 PolarHBondContact O-N 3.34Å; Y256-Y296 HydrophobicContact CD2-CE1 4.31Å; Y256-Y296 HydrophobicContact CE1-CE1 4.49Å; Y256-Y296 HydrophobicContact CE2-CE1 4.14Å; Y256-N392 PolarHBondContact OH-ND2 3.47Å; Y256-N392 PolarHBondContact OH-OD1 2.85Å
257	Q	79.2	Confident	83.9	Confident	54 Å²	54	75 Å²	75	25%	0.252	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-35.7	175.6	-59.7	170.2	-12.9	0	0	112.5	N255 Q260 T261 R395	N255-Q257 PolarHBondContact ND2-OE1 3.03Å; N255-Q257 PolarHBondContact O-N 2.8Å; N255-Q257 WeakPolarHBondContact OD1-CB 3.35Å; N255-Q257 WeakPolarHBondContact OD1-CG 3.47Å; N255-Q257 PolarHBondContact OD1-N 2.97Å; N255-Q257 VanDerWaalsContact OD1-N 3.07Å; N255-Q257 PolarHBondContact OD1-OE1 3.08Å; Q257-Q260 PolarHBondContact O-N 3.17Å; Q257-T261 WeakPolarHBondContact O-CB 3.38Å; Q257-T261 PolarHBondContact O-N 2.92Å; Q257-T261 PolarHBondContact O-OG1 3.37Å; Q257-R395 VanDerWaalsContact NE2-CZ 3.3Å; Q257-R395 VanDerWaalsContact NE2-NH1 3.13Å
258	I	82.9	Confident	84.1	Confident	120 Å²	120	71.9 Å²	71.9	62%	0.615	36%	0.355	S	S	*	.	H	α-helix	trans	-68.1	-51.2	-175.9	-60	171.8	0	0	0	110.2	N255 Y256 Q260 T261 A262	N255-I258 HydrophobicContact CB-CD1 4.08Å; N255-I258 HydrophobicContact CB-CG1 4.25Å; N255-I258 PolarHBondContact O-N 3.3Å; Y256-I258 VanDerWaalsContact C-N 3.32Å; Y256-I258 PolarHBondContact O-N 2.98Å; I258-Q260 PolarHBondContact O-N 3.11Å; I258-T261 PolarHBondContact O-N 2.79Å; I258-A262 PolarHBondContact O-N 3.39Å
259	P	82.4	Confident	84.4	Confident	15 Å²	15	70.4 Å²	70.4	10%	0.097	35%	0.345	C	S	.	.	H	α-helix	trans	-65.6	-32.8	175.2	-22.1	34.7	0	0	0	114	F249 T254 N255 Y256 A262 L263	F249-P259 HydrophobicContact CD1-CB 4.26Å; F249-P259 HydrophobicContact CD1-CG 4.46Å; F249-P259 HydrophobicContact CD2-CB 4.09Å; F249-P259 HydrophobicContact CE1-CB 3.8Å; F249-P259 HydrophobicContact CE1-CG 4.33Å; F249-P259 HydrophobicContact CE2-CB 3.62Å; F249-P259 HydrophobicContact CG-CB 4.42Å; F249-P259 HydrophobicContact CZ-CB 3.48Å; F249-P259 VanDerWaalsContact CZ-CB 3.48Å; F249-P259 HydrophobicContact CZ-CG 4.47Å; T254-P259 HydrophobicContact CG2-CG 3.82Å; N255-P259 WeakPolarHBondContact O-CD 3.48Å; Y256-P259 WeakPolarHBondContact O-CD 3.42Å; P259-A262 PolarHBondContact O-N 3.24Å; P259-L263 WeakPolarHBondContact O-CG 3.24Å; P259-L263 PolarHBondContact O-N 3.02Å
260	Q	87.4	Confident	84.8	Confident	8 Å²	8	70.5 Å²	70.5	4%	0.037	35%	0.345	C	S	.	.	H	α-helix	trans	-62.1	-50.2	173.8	-83.9	171.4	-16.8	0	0	111.8	F249 Y256 Q257 I258 A262 L263 L264 Y288 E396 F399	F249-Q260 HydrophobicContact CE1-CG 3.84Å; F249-Q260 HydrophobicContact CZ-CG 3.84Å; Y256-Q260 WeakPolarHBondContact O-CB 3.39Å; Y256-Q260 WeakPolarHBondContact O-CG 3.48Å; Y256-Q260 PolarHBondContact O-N 3.34Å; Q257-Q260 PolarHBondContact O-N 3.17Å; I258-Q260 PolarHBondContact O-N 3.11Å; Q260-A262 PolarHBondContact O-N 3.28Å; Q260-L263 WeakPolarHBondContact O-CB 3.47Å; Q260-L263 PolarHBondContact O-N 3.28Å; Q260-L264 PolarHBondContact O-N 3.49Å; Q260-Y288 PolarHBondContact NE2-OH 3.18Å; Q260-E396 PolarHBondContact NE2-OE2 2.97Å; Q260-F399 HydrophobicContact CB-CD2 3.76Å; Q260-F399 HydrophobicContact CB-CE2 3.95Å; Q260-F399 HydrophobicContact CB-CG 4.4Å; Q260-F399 HydrophobicContact CG-CD1 4.42Å; Q260-F399 HydrophobicContact CG-CD2 3.86Å; Q260-F399 HydrophobicContact CG-CE2 3.97Å; Q260-F399 HydrophobicContact CG-CG 4.09Å; Q260-F399 HydrophobicContact CG-CZ 4.33Å; Q260-F399 WeakPolarHBondContact O-CE2 3.33Å
261	T	87.8	Confident	85.2	Confident	87 Å²	87	68.3 Å²	68.3	53%	0.534	34%	0.34	S	S	.	.	H	α-helix	trans	-60.4	-35.1	176.1	-57.8	0	0	0	0	111.7	Q257 I258	Q257-T261 WeakPolarHBondContact O-CB 3.38Å; Q257-T261 PolarHBondContact O-N 2.92Å; Q257-T261 PolarHBondContact O-OG1 3.37Å; I258-T261 PolarHBondContact O-N 2.79Å
262	A	87.5	Confident	85.8	Confident	31 Å²	31	61.7 Å²	61.7	26%	0.256	31%	0.311	S	S	.	.	H	α-helix	trans	-67.1	-39.4	174.3	0	0	0	0	0	112.5	I258 P259 Q260 K265 Y266	I258-A262 PolarHBondContact O-N 3.39Å; P259-A262 PolarHBondContact O-N 3.24Å; Q260-A262 PolarHBondContact O-N 3.28Å; A262-K265 PolarHBondContact O-N 2.99Å; A262-Y266 WeakPolarHBondContact O-CD2 3.17Å
263	L	90.8	Very high	86.9	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-66.3	-36.1	176.8	-81.6	172.6	0	0	0	112.6	I242 K245 F249 P259 Q260 K265 Y266 F399 F403	I242-L263 HydrophobicContact CG2-CD2 4.31Å; K245-L263 HydrophobicContact CB-CD2 3.72Å; K245-L263 HydrophobicContact CB-CG 4.24Å; K245-L263 HydrophobicContact CG-CD2 4.21Å; F249-L263 HydrophobicContact CE2-CD1 3.85Å; F249-L263 HydrophobicContact CZ-CD1 4.07Å; P259-L263 WeakPolarHBondContact O-CG 3.24Å; P259-L263 PolarHBondContact O-N 3.02Å; Q260-L263 WeakPolarHBondContact O-CB 3.47Å; Q260-L263 PolarHBondContact O-N 3.28Å; L263-K265 PolarHBondContact O-N 3.08Å; L263-Y266 CarbonylContact O-C 3.56Å; L263-Y266 WeakPolarHBondContact O-CA 3.47Å; L263-Y266 PolarHBondContact O-N 3.35Å; L263-F399 HydrophobicContact CB-CE2 4.03Å; L263-F399 HydrophobicContact CB-CZ 4.22Å; L263-F399 HydrophobicContact CD1-CZ 4.17Å; L263-F403 HydrophobicContact CB-CD2 4.23Å; L263-F403 HydrophobicContact CB-CE2 3.98Å; L263-F403 HydrophobicContact CD2-CE2 4.28Å; L263-F403 HydrophobicContact CD2-CZ 4.21Å; L263-F403 WeakPolarHBondContact O-CE2 3.41Å
264	L	91	Very high	88.1	Confident	48 Å²	48	50.1 Å²	50.1	25%	0.251	25%	0.247	S	C	.	.	H	α-helix	trans	-58.4	-33.5	178	-72.6	173.7	0	0	0	113	Q260 Y266 R267 F399 E402 F403	Q260-L264 PolarHBondContact O-N 3.49Å; L264-Y266 PolarHBondContact O-N 3.36Å; L264-Y266 VanDerWaalsContact O-N 3.12Å; L264-R267 PolarHBondContact O-N 3.29Å; L264-R267 VanDerWaalsContact O-N 3.14Å; L264-F399 HydrophobicContact CD1-CD2 4.23Å; L264-F399 HydrophobicContact CD2-CD2 3.8Å; L264-F399 HydrophobicContact CD2-CE2 4.06Å; L264-F399 HydrophobicContact CG-CD2 3.82Å; L264-F399 HydrophobicContact CG-CE2 4.02Å; L264-E402 HydrophobicContact CD2-CB 3.75Å; L264-F403 HydrophobicContact CD2-CB 4.07Å
265	K	90.1	Very high	89.1	Confident	165 Å²	165	50.5 Å²	50.5	72%	0.717	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.2	174.2	-62.7	-177.5	178.8	-175.8	0	113.1	A262 L263	A262-K265 PolarHBondContact O-N 2.99Å; L263-K265 PolarHBondContact O-N 3.08Å
266	Y	91.6	Very high	89.6	Confident	49 Å²	49	47.9 Å²	47.9	19%	0.192	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.8	24.6	-178.1	-57.3	-77.6	0	0	0	112.1	F241 A262 L263 L264 F268 F269	F241-Y266 HydrophobicContact CE1-CD1 4.13Å; F241-Y266 AromaticContact CE1-CD2 3.72Å; F241-Y266 HydrophobicContact CE1-CD2 3.72Å; F241-Y266 HydrophobicContact CE1-CE1 4.37Å; F241-Y266 HydrophobicContact CE1-CE2 4.02Å; F241-Y266 AromaticContact CE1-CG 3.79Å; F241-Y266 HydrophobicContact CE1-CG 3.79Å; F241-Y266 HydrophobicContact CZ-CD1 4.42Å; F241-Y266 AromaticContact CZ-CD2 3.85Å; F241-Y266 HydrophobicContact CZ-CD2 3.85Å; F241-Y266 HydrophobicContact CZ-CE1 4.21Å; F241-Y266 AromaticContact CZ-CE2 3.64Å; F241-Y266 HydrophobicContact CZ-CE2 3.64Å; F241-Y266 HydrophobicContact CZ-CG 4.24Å; F241-Y266 AromaticContact CZ-CZ 3.82Å; A262-Y266 WeakPolarHBondContact O-CD2 3.17Å; L263-Y266 CarbonylContact O-C 3.56Å; L263-Y266 WeakPolarHBondContact O-CA 3.47Å; L263-Y266 PolarHBondContact O-N 3.35Å; L264-Y266 PolarHBondContact O-N 3.36Å; L264-Y266 VanDerWaalsContact O-N 3.12Å; Y266-F268 PolarHBondContact O-N 3.36Å; Y266-F268 VanDerWaalsContact O-N 3.11Å; Y266-F269 HydrophobicContact CD1-CD2 4.01Å; Y266-F269 HydrophobicContact CD1-CE1 4.46Å; Y266-F269 AromaticContact CD1-CE2 3.32Å; Y266-F269 HydrophobicContact CD1-CE2 3.32Å; Y266-F269 AromaticContact CD1-CZ 3.59Å; Y266-F269 HydrophobicContact CD1-CZ 3.59Å; Y266-F269 HydrophobicContact CE1-CE2 4.11Å; Y266-F269 HydrophobicContact CE1-CZ 4.26Å; Y266-F269 HydrophobicContact CG-CD2 4.15Å; Y266-F269 AromaticContact CG-CE2 3.89Å; Y266-F269 HydrophobicContact CG-CE2 3.89Å; Y266-F269 VanDerWaalsContact O-CB 3.23Å; Y266-F269 WeakPolarHBondContact O-CB 3.33Å; Y266-F269 PolarHBondContact O-N 2.91Å
267	R	92.6	Very high	90.3	Very high	126 Å²	126	49.9 Å²	49.9	48%	0.475	26%	0.257	S	S	.	.	H	α-helix	trans	-53.6	-36.3	-178	89.9	177.3	-167.4	140.5	2.7	113.3	L264 F269 Y270 Q271	L264-R267 PolarHBondContact O-N 3.29Å; L264-R267 VanDerWaalsContact O-N 3.14Å; R267-F269 PolarHBondContact O-N 3.35Å; R267-F269 VanDerWaalsContact O-N 3.16Å; R267-Y270 PolarHBondContact O-N 2.83Å; R267-Q271 PolarHBondContact O-N 3.3Å
268	F	94	Very high	90.9	Very high	30 Å²	30	56.7 Å²	56.7	13%	0.132	28%	0.28	C	S	.	.	H	α-helix	trans	-61	-27.4	-178.6	-177.5	-100.5	0	0	0	111.9	L196 L199 Q200 D203 Y266 Y270 Q271 F272	L196-F268 HydrophobicContact CD1-CB 3.84Å; L196-F268 HydrophobicContact CD1-CD1 3.51Å; L196-F268 HydrophobicContact CD1-CE1 4.47Å; L196-F268 HydrophobicContact CD1-CG 4Å; L199-F268 HydrophobicContact CB-CE1 4.36Å; L199-F268 HydrophobicContact CD2-CD1 3.94Å; L199-F268 HydrophobicContact CD2-CE1 3.88Å; L199-F268 HydrophobicContact CG-CD1 4.48Å; L199-F268 HydrophobicContact CG-CE1 3.94Å; Q200-F268 HydrophobicContact CB-CE1 4.29Å; Q200-F268 HydrophobicContact CB-CZ 4.21Å; Q200-F268 HydrophobicContact CG-CD1 3.89Å; Q200-F268 HydrophobicContact CG-CD2 4.37Å; Q200-F268 HydrophobicContact CG-CE1 3.43Å; Q200-F268 VanDerWaalsContact CG-CE1 3.43Å; Q200-F268 HydrophobicContact CG-CE2 3.96Å; Q200-F268 HydrophobicContact CG-CG 4.35Å; Q200-F268 HydrophobicContact CG-CZ 3.48Å; Q200-F268 VanDerWaalsContact CG-CZ 3.48Å; D203-F268 HydrophobicContact CB-CZ 4.41Å; Y266-F268 PolarHBondContact O-N 3.36Å; Y266-F268 VanDerWaalsContact O-N 3.11Å; F268-Y270 PolarHBondContact O-N 3.47Å; F268-Q271 PolarHBondContact O-N 3.06Å; F268-F272 HydrophobicContact CE1-CB 4.3Å; F268-F272 WeakPolarHBondContact O-CB 3.5Å; F268-F272 PolarHBondContact O-N 2.97Å
269	F	94.9	Very high	91.5	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.8	-42.5	175.8	-68.8	-2.1	0	0	0	111.9	V190 F195 L196 L199 I238 F241 I242 Y266 R267 F272 L273	V190-F269 HydrophobicContact CB-CE2 4.39Å; V190-F269 WeakPolarHBondContact O-CZ 3.2Å; F195-F269 HydrophobicContact CD1-CE1 4.13Å; F195-F269 HydrophobicContact CD1-CZ 4Å; F195-F269 HydrophobicContact CE1-CE1 4.18Å; F195-F269 HydrophobicContact CE1-CZ 4.2Å; L196-F269 HydrophobicContact CB-CE1 4.4Å; L196-F269 HydrophobicContact CD1-CD1 4.16Å; L196-F269 HydrophobicContact CD1-CE1 3.75Å; L199-F269 HydrophobicContact CD2-CD1 3.65Å; L199-F269 HydrophobicContact CD2-CE1 3.9Å; I238-F269 HydrophobicContact CD1-CD1 4.48Å; I238-F269 HydrophobicContact CG1-CD1 4.49Å; I238-F269 HydrophobicContact CG1-CD2 4.44Å; I238-F269 HydrophobicContact CG1-CG 4.25Å; I238-F269 HydrophobicContact CG2-CB 3.62Å; I238-F269 HydrophobicContact CG2-CD2 4.28Å; I238-F269 HydrophobicContact CG2-CG 4.12Å; F241-F269 HydrophobicContact CD1-CD2 4.05Å; F241-F269 AromaticContact CD1-CE2 3.99Å; F241-F269 HydrophobicContact CD1-CE2 3.99Å; F241-F269 HydrophobicContact CE1-CD2 4.24Å; F241-F269 HydrophobicContact CE1-CE2 4.02Å; I242-F269 HydrophobicContact CD1-CB 3.94Å; Y266-F269 HydrophobicContact CD1-CD2 4.01Å; Y266-F269 HydrophobicContact CD1-CE1 4.46Å; Y266-F269 AromaticContact CD1-CE2 3.32Å; Y266-F269 HydrophobicContact CD1-CE2 3.32Å; Y266-F269 AromaticContact CD1-CZ 3.59Å; Y266-F269 HydrophobicContact CD1-CZ 3.59Å; Y266-F269 HydrophobicContact CE1-CE2 4.11Å; Y266-F269 HydrophobicContact CE1-CZ 4.26Å; Y266-F269 HydrophobicContact CG-CD2 4.15Å; Y266-F269 AromaticContact CG-CE2 3.89Å; Y266-F269 HydrophobicContact CG-CE2 3.89Å; Y266-F269 VanDerWaalsContact O-CB 3.23Å; Y266-F269 WeakPolarHBondContact O-CB 3.33Å; Y266-F269 PolarHBondContact O-N 2.91Å; R267-F269 PolarHBondContact O-N 3.35Å; R267-F269 VanDerWaalsContact O-N 3.16Å; F269-F272 PolarHBondContact O-N 3.23Å; F269-L273 VanDerWaalsContact O-CG 3.32Å; F269-L273 WeakPolarHBondContact O-CG 3.45Å; F269-L273 PolarHBondContact O-N 2.85Å; F269-L273 VanDerWaalsContact O-N 3.09Å
270	Y	94.4	Very high	92.2	Very high	10 Å²	10	54.3 Å²	54.3	4%	0.039	28%	0.278	C	S	.	.	H	α-helix	trans	-67.4	-41.6	175.6	-170.7	-96.5	0	0	0	111.5	R267 F268 F272 L273 L274 A281 I284 F403 F404	R267-Y270 PolarHBondContact O-N 2.83Å; F268-Y270 PolarHBondContact O-N 3.47Å; Y270-F272 VanDerWaalsContact C-N 3.34Å; Y270-F272 PolarHBondContact O-N 2.89Å; Y270-L273 PolarHBondContact O-N 3.13Å; Y270-L274 PolarHBondContact O-N 3.14Å; Y270-A281 HydrophobicContact CE2-CB 4.12Å; Y270-A281 WeakPolarHBondContact CE2-O 3.15Å; Y270-A281 PolarHBondContact OH-O 3.23Å; Y270-I284 HydrophobicContact CD2-CG2 4.26Å; Y270-I284 HydrophobicContact CE2-CG2 4.3Å; Y270-F403 WeakPolarHBondContact CD1-O 3.29Å; Y270-F403 HydrophobicContact CD2-CE1 4.23Å; Y270-F403 HydrophobicContact CG-CE1 4.32Å; Y270-F404 HydrophobicContact CD1-CD1 4.19Å; Y270-F404 HydrophobicContact CD2-CD1 4.14Å; Y270-F404 HydrophobicContact CD2-CE1 4.27Å; Y270-F404 HydrophobicContact CE1-CB 4.2Å; Y270-F404 AromaticContact CE1-CD1 3.73Å; Y270-F404 HydrophobicContact CE1-CD1 3.73Å; Y270-F404 HydrophobicContact CE1-CG 4.46Å; Y270-F404 AromaticContact CE2-CD1 3.67Å; Y270-F404 HydrophobicContact CE2-CD1 3.67Å; Y270-F404 AromaticContact CE2-CE1 3.84Å; Y270-F404 HydrophobicContact CE2-CE1 3.84Å; Y270-F404 HydrophobicContact CG-CD1 4.39Å; Y270-F404 AromaticContact CZ-CD1 3.46Å; Y270-F404 VanDerWaalsContact CZ-CD1 3.46Å
271	Q	94.2	Very high	92.5	Very high	84 Å²	84	54 Å²	54	39%	0.393	28%	0.276	S	S	.	.	H	α-helix	trans	-58.5	-44.6	175.2	-175.4	179.4	-4.3	0	0	112	R267 F268 L273 L274 G275	R267-Q271 PolarHBondContact O-N 3.3Å; F268-Q271 PolarHBondContact O-N 3.06Å; Q271-L273 PolarHBondContact O-N 3.16Å; Q271-L274 PolarHBondContact O-N 3.48Å; Q271-G275 PolarHBondContact O-N 2.94Å; Q271-G275 VanDerWaalsContact O-N 3.12Å
272	F	94.7	Very high	92.9	Very high	1 Å²	1	55.4 Å²	55.4	0%	0.004	28%	0.275	C	S	.	.	H	α-helix	trans	-59.9	-45.2	176.1	177.2	-95.2	0	0	0	111.7	L199 L202 D203 A234 V235 I238 F268 F269 Y270 G275 N276	L199-F272 HydrophobicContact CD1-CD1 3.97Å; L199-F272 HydrophobicContact CD1-CD2 3.9Å; L199-F272 HydrophobicContact CD1-CE1 3.79Å; L199-F272 HydrophobicContact CD1-CE2 3.72Å; L199-F272 HydrophobicContact CD1-CG 4.02Å; L199-F272 HydrophobicContact CD1-CZ 3.66Å; L199-F272 HydrophobicContact CD2-CB 4.23Å; L199-F272 HydrophobicContact CD2-CD1 4.39Å; L199-F272 HydrophobicContact CD2-CD2 4.43Å; L199-F272 HydrophobicContact CD2-CG 4.09Å; L199-F272 HydrophobicContact CG-CD1 4.47Å; L199-F272 HydrophobicContact CG-CD2 3.96Å; L199-F272 HydrophobicContact CG-CE2 4.21Å; L199-F272 HydrophobicContact CG-CG 4.09Å; L202-F272 HydrophobicContact CD2-CE2 4.48Å; L202-F272 HydrophobicContact CD2-CZ 4.18Å; D203-F272 HydrophobicContact CB-CD2 3.94Å; D203-F272 HydrophobicContact CB-CE2 4.06Å; A234-F272 HydrophobicContact CB-CE1 4.04Å; A234-F272 HydrophobicContact CB-CZ 4.19Å; V235-F272 HydrophobicContact CG2-CE1 4.05Å; I238-F272 HydrophobicContact CD1-CD1 3.65Å; I238-F272 HydrophobicContact CD1-CE1 4.1Å; I238-F272 HydrophobicContact CD1-CG 4.44Å; F268-F272 HydrophobicContact CE1-CB 4.3Å; F268-F272 WeakPolarHBondContact O-CB 3.5Å; F268-F272 PolarHBondContact O-N 2.97Å; F269-F272 PolarHBondContact O-N 3.23Å; Y270-F272 VanDerWaalsContact C-N 3.34Å; Y270-F272 PolarHBondContact O-N 2.89Å; F272-G275 PolarHBondContact O-N 2.76Å; F272-N276 WeakPolarHBondContact CD2-ND2 3.34Å; F272-N276 WeakPolarHBondContact CE2-ND2 3.46Å; F272-N276 HydrophobicContact CZ-CB 4.48Å; F272-N276 WeakPolarHBondContact O-CB 3.42Å; F272-N276 PolarHBondContact O-N 3.45Å; F272-N276 PolarHBondContact O-ND2 3.24Å
273	L	95.1	Very high	93.3	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.3	-41.6	176.3	-69	178.3	0	0	0	112.1	V235 I238 I242 F269 Y270 Q271 G275 N276 E277 T280 A281 I284	V235-L273 HydrophobicContact CB-CD2 4.1Å; V235-L273 HydrophobicContact CG1-CD2 3.8Å; V235-L273 HydrophobicContact CG2-CD2 3.92Å; I238-L273 HydrophobicContact CG2-CD1 3.77Å; I238-L273 HydrophobicContact CG2-CD2 4.26Å; I238-L273 HydrophobicContact CG2-CG 3.96Å; I242-L273 HydrophobicContact CD1-CD1 4.27Å; F269-L273 VanDerWaalsContact O-CG 3.32Å; F269-L273 WeakPolarHBondContact O-CG 3.45Å; F269-L273 PolarHBondContact O-N 2.85Å; F269-L273 VanDerWaalsContact O-N 3.09Å; Y270-L273 PolarHBondContact O-N 3.13Å; Q271-L273 PolarHBondContact O-N 3.16Å; L273-G275 VanDerWaalsContact C-N 3.29Å; L273-G275 PolarHBondContact O-N 2.82Å; L273-N276 PolarHBondContact O-N 3.15Å; L273-E277 CarbonylContact O-C 3.48Å; L273-E277 WeakPolarHBondContact O-CA 3.32Å; L273-E277 PolarHBondContact O-N 3.46Å; L273-E277 VanDerWaalsContact O-O 3.08Å; L273-T280 HydrophobicContact CD1-CG2 4.16Å; L273-T280 HydrophobicContact CD2-CG2 4.12Å; L273-A281 HydrophobicContact CB-CB 4.05Å; L273-I284 HydrophobicContact CD1-CD1 3.28Å
274	L	92.8	Very high	93.6	Very high	75 Å²	75	57.3 Å²	57.3	39%	0.393	28%	0.279	S	S	.	.	H	α-helix	trans	-62.6	-36.8	179.9	-170.7	66.7	0	0	0	112.3	Y270 Q271 R278 A281	Y270-L274 PolarHBondContact O-N 3.14Å; Q271-L274 PolarHBondContact O-N 3.48Å; L274-R278 WeakPolarHBondContact O-CG 3.09Å; L274-A281 HydrophobicContact CD1-CB 4.36Å
275	G	89.9	Confident	93.8	Very high	57 Å²	57	59 Å²	59	59%	0.588	28%	0.282	S	S	*	.	H	α-helix	trans	-76.1	-31.3	177.1	0	0	0	0	0	114.4	Q271 F272 L273	Q271-G275 PolarHBondContact O-N 2.94Å; Q271-G275 VanDerWaalsContact O-N 3.12Å; F272-G275 PolarHBondContact O-N 2.76Å; L273-G275 VanDerWaalsContact C-N 3.29Å; L273-G275 PolarHBondContact O-N 2.82Å
276	N	89.3	Confident	94.1	Very high	11 Å²	11	54.4 Å²	54.4	6%	0.059	27%	0.265	C	S	.	.	H	α-helix	trans	-112.5	-31.4	-168	-72.2	-71.3	0	0	0	115.5	D203 R210 R231 F272 L273	D203-N276 PolarHBondContact OD1-ND2 3.14Å; R210-N276 PolarHBondContact NH1-OD1 3.42Å; R231-N276 HydrophobicContact CG-CB 4.16Å; R231-N276 PolarHBondContact NH1-O 3.08Å; R231-N276 VanDerWaalsContact NH1-O 3.13Å; F272-N276 WeakPolarHBondContact CD2-ND2 3.34Å; F272-N276 WeakPolarHBondContact CE2-ND2 3.46Å; F272-N276 HydrophobicContact CZ-CB 4.48Å; F272-N276 WeakPolarHBondContact O-CB 3.42Å; F272-N276 PolarHBondContact O-N 3.45Å; F272-N276 PolarHBondContact O-ND2 3.24Å; L273-N276 PolarHBondContact O-N 3.15Å
277	E	92.8	Very high	94.4	Very high	76 Å²	76	54.4 Å²	54.4	36%	0.355	27%	0.267	S	S	.	.			trans	-150.7	85.4	-178.4	-170.3	56.5	-123.5	0	0	111.7	V235 L273 A279 T280 A281	V235-E277 HydrophobicContact CG1-CB 4.11Å; V235-E277 HydrophobicContact CG1-CG 4.17Å; V235-E277 HydrophobicContact CG2-CB 4.05Å; L273-E277 CarbonylContact O-C 3.48Å; L273-E277 WeakPolarHBondContact O-CA 3.32Å; L273-E277 PolarHBondContact O-N 3.46Å; L273-E277 VanDerWaalsContact O-O 3.08Å; E277-A279 VanDerWaalsContact C-N 3.28Å; E277-A279 PolarHBondContact O-N 2.88Å; E277-T280 WeakPolarHBondContact CG-OG1 3.28Å; E277-T280 PolarHBondContact O-N 2.93Å; E277-A281 PolarHBondContact O-N 3.49Å
278	R	93.6	Very high	94.5	Very high	197 Å²	197	48.4 Å²	48.4	74%	0.743	24%	0.244	S	C	*	.	H	α-helix	trans	-63.6	-29.9	-173.9	-67.7	-177.9	-179.8	171.6	1.1	113.8	L274 A281 K282	L274-R278 WeakPolarHBondContact O-CG 3.09Å; R278-A281 PolarHBondContact O-N 3.19Å; R278-K282 WeakPolarHBondContact O-CB 3.32Å; R278-K282 PolarHBondContact O-N 2.97Å
279	A	95.4	Very high	94.7	Very high	67 Å²	67	47.9 Å²	47.9	55%	0.554	24%	0.244	S	C	*	.	H	α-helix	trans	-63.8	-44.6	179.3	0	0	0	0	0	111.3	E277 K282 E283	E277-A279 VanDerWaalsContact C-N 3.28Å; E277-A279 PolarHBondContact O-N 2.88Å; A279-K282 PolarHBondContact O-N 2.89Å; A279-E283 PolarHBondContact O-N 2.86Å
280	T	95.3	Very high	94.7	Very high	17 Å²	17	51.1 Å²	51.1	10%	0.104	26%	0.258	C	S	.	.	H	α-helix	trans	-67.6	-39.5	175.9	-58.9	0	0	0	0	112.4	V235 R239 L273 E277 K282 E283 I284	V235-T280 HydrophobicContact CG1-CG2 4.2Å; R239-T280 HydrophobicContact CB-CG2 3.74Å; R239-T280 HydrophobicContact CG-CG2 3.69Å; L273-T280 HydrophobicContact CD1-CG2 4.16Å; L273-T280 HydrophobicContact CD2-CG2 4.12Å; E277-T280 WeakPolarHBondContact CG-OG1 3.28Å; E277-T280 PolarHBondContact O-N 2.93Å; T280-K282 VanDerWaalsContact C-N 3.3Å; T280-K282 PolarHBondContact O-N 3.26Å; T280-E283 PolarHBondContact O-N 3.13Å; T280-I284 HydrophobicContact CG2-CD1 4.22Å; T280-I284 WeakPolarHBondContact O-CG1 3.37Å; T280-I284 PolarHBondContact O-N 3.4Å
281	A	94.9	Very high	94.7	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.008	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-39.5	174.8	0	0	0	0	0	112.1	Y270 L273 L274 E277 R278 R285	Y270-A281 HydrophobicContact CE2-CB 4.12Å; Y270-A281 WeakPolarHBondContact CE2-O 3.15Å; Y270-A281 PolarHBondContact OH-O 3.23Å; L273-A281 HydrophobicContact CB-CB 4.05Å; L274-A281 HydrophobicContact CD1-CB 4.36Å; E277-A281 PolarHBondContact O-N 3.49Å; R278-A281 PolarHBondContact O-N 3.19Å; A281-R285 WeakPolarHBondContact O-CB 3.38Å; A281-R285 PolarHBondContact O-N 3.37Å; A281-R285 VanDerWaalsContact O-N 3.17Å
282	K	95.6	Very high	94.7	Very high	118 Å²	118	46.8 Å²	46.8	51%	0.513	24%	0.239	S	C	.	.	H	α-helix	trans	-64.9	-46.8	174.4	-178.6	-179.8	176.2	-172.6	0	111.5	R278 A279 T280 I284 R285 D286	R278-K282 WeakPolarHBondContact O-CB 3.32Å; R278-K282 PolarHBondContact O-N 2.97Å; A279-K282 PolarHBondContact O-N 2.89Å; T280-K282 VanDerWaalsContact C-N 3.3Å; T280-K282 PolarHBondContact O-N 3.26Å; K282-I284 PolarHBondContact O-N 3.04Å; K282-R285 PolarHBondContact O-N 3.45Å; K282-D286 VanDerWaalsContact CE-OD2 3.28Å; K282-D286 WeakPolarHBondContact CE-OD2 3.26Å; K282-D286 WeakPolarHBondContact CG-OD2 3.29Å; K282-D286 WeakPolarHBondContact O-CB 3.26Å; K282-D286 PolarHBondContact O-N 2.83Å
283	E	96.8	Very high	94.8	Very high	71 Å²	71	46.8 Å²	46.8	33%	0.332	24%	0.239	S	C	.	.	H	α-helix	trans	-54.5	-50.5	177.3	-177.4	-168.9	179.8	0	0	111.9	R239 A279 T280 R285 D286 E287	R239-E283 IonicContact CZ-OE1 2.73Å; R239-E283 IonicContact CZ-OE2 3.22Å; R239-E283 IonicContact NE-OE1 3.04Å; R239-E283 PolarHBondContact NE-OE1 3.47Å; R239-E283 IonicContact NE-OE2 3.24Å; R239-E283 PolarHBondContact NE-OE2 3.36Å; R239-E283 IonicContact NH2-OE1 3.32Å; R239-E283 PolarHBondContact NH2-OE1 3.01Å; R239-E283 IonicContact NH2-OE2 2.75Å; A279-E283 PolarHBondContact O-N 2.86Å; T280-E283 PolarHBondContact O-N 3.13Å; E283-R285 VanDerWaalsContact C-N 3.32Å; E283-R285 PolarHBondContact O-N 3.05Å; E283-D286 PolarHBondContact O-N 3.19Å; E283-E287 WeakPolarHBondContact O-CB 3.38Å; E283-E287 PolarHBondContact O-N 3.13Å
284	I	95.9	Very high	94.8	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.6	-43.8	179.2	-73.5	172.5	0	0	0	111.5	I242 L243 I246 Y270 L273 T280 K282 Y288	I242-I284 HydrophobicContact CB-CD1 4.1Å; I242-I284 HydrophobicContact CB-CG2 4.47Å; I242-I284 HydrophobicContact CD1-CD1 4.04Å; I242-I284 HydrophobicContact CG2-CD1 4.23Å; I242-I284 HydrophobicContact CG2-CG1 4.47Å; I242-I284 HydrophobicContact CG2-CG2 3.49Å; I242-I284 VanDerWaalsContact CG2-CG2 3.49Å; L243-I284 HydrophobicContact CD2-CG1 4.18Å; L243-I284 HydrophobicContact CG-CG1 4.32Å; I246-I284 HydrophobicContact CD1-CG2 3.91Å; Y270-I284 HydrophobicContact CD2-CG2 4.26Å; Y270-I284 HydrophobicContact CE2-CG2 4.3Å; L273-I284 HydrophobicContact CD1-CD1 3.28Å; T280-I284 HydrophobicContact CG2-CD1 4.22Å; T280-I284 WeakPolarHBondContact O-CG1 3.37Å; T280-I284 PolarHBondContact O-N 3.4Å; K282-I284 PolarHBondContact O-N 3.04Å; I284-Y288 WeakPolarHBondContact O-CB 3.45Å; I284-Y288 PolarHBondContact O-N 3.02Å
285	R	95.9	Very high	94.8	Very high	85 Å²	85	50.8 Å²	50.8	32%	0.321	26%	0.255	S	S	.	.	H	α-helix	trans	-63.9	-47.9	178.6	-177.8	-162.8	67.4	-178.9	3.8	110.9	A281 K282 E283 E287 Y288 V289 F404 L414	A281-R285 WeakPolarHBondContact O-CB 3.38Å; A281-R285 PolarHBondContact O-N 3.37Å; A281-R285 VanDerWaalsContact O-N 3.17Å; K282-R285 PolarHBondContact O-N 3.45Å; E283-R285 VanDerWaalsContact C-N 3.32Å; E283-R285 PolarHBondContact O-N 3.05Å; R285-E287 VanDerWaalsContact C-N 3.33Å; R285-E287 PolarHBondContact O-N 3.13Å; R285-Y288 WeakPolarHBondContact O-CB 3.34Å; R285-Y288 PolarHBondContact O-N 3.49Å; R285-V289 VanDerWaalsContact O-CG2 3.28Å; R285-V289 WeakPolarHBondContact O-CG2 3.38Å; R285-V289 PolarHBondContact O-N 3.45Å; R285-F404 HydrophobicContact CB-CD1 4.27Å; R285-F404 HydrophobicContact CB-CE1 3.85Å; R285-F404 HydrophobicContact CG-CD1 4.13Å; R285-F404 HydrophobicContact CG-CE1 3.94Å; R285-F404 HydrophobicContact CG-CZ 4.41Å; R285-L414 HydrophobicContact CG-CD1 3.89Å; R285-L414 HydrophobicContact CG-CD2 4.2Å
286	D	96.8	Very high	94.9	Very high	68 Å²	68	48.1 Å²	48.1	36%	0.364	23%	0.227	S	C	.	.	H	α-helix	trans	-65.9	-38.2	-177.5	-64.3	-5.8	0	0	0	110.6	K282 E283 V289 E290	K282-D286 VanDerWaalsContact CE-OD2 3.28Å; K282-D286 WeakPolarHBondContact CE-OD2 3.26Å; K282-D286 WeakPolarHBondContact CG-OD2 3.29Å; K282-D286 WeakPolarHBondContact O-CB 3.26Å; K282-D286 PolarHBondContact O-N 2.83Å; E283-D286 PolarHBondContact O-N 3.19Å; D286-V289 PolarHBondContact O-N 3.28Å; D286-E290 WeakPolarHBondContact O-CB 3.25Å; D286-E290 PolarHBondContact O-N 3.24Å
287	E	96.4	Very high	95.2	Very high	48 Å²	48	49.7 Å²	49.7	22%	0.224	24%	0.235	C	C	.	.	H	α-helix	trans	-67.2	-38.3	175	-169	61.7	-151.2	0	0	112.8	L243 I246 Y247 R250 E283 R285 T291	L243-E287 HydrophobicContact CD2-CB 4.07Å; L243-E287 HydrophobicContact CD2-CG 3.97Å; I246-E287 HydrophobicContact CG2-CG 4.24Å; Y247-E287 HydrophobicContact CE1-CG 4.11Å; Y247-E287 WeakPolarHBondContact CE1-OE1 3.35Å; R250-E287 IonicContact CZ-OE1 2.74Å; R250-E287 IonicContact NH2-OE1 3.99Å; R250-E287 PolarHBondContact NH2-OE1 2.63Å; E283-E287 WeakPolarHBondContact O-CB 3.38Å; E283-E287 PolarHBondContact O-N 3.13Å; R285-E287 VanDerWaalsContact C-N 3.33Å; R285-E287 PolarHBondContact O-N 3.13Å; E287-T291 VanDerWaalsContact O-CB 3.27Å; E287-T291 WeakPolarHBondContact O-CB 3.34Å; E287-T291 PolarHBondContact O-N 3.34Å; E287-T291 PolarHBondContact O-OG1 3.12Å
288	Y	96.1	Very high	95.3	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.4	-51.9	172.4	178.6	-89.7	0	0	0	110.7	I246 F249 Q260 I284 R285 E290 T291 L292 E396 F399 F404 V418	I246-Y288 HydrophobicContact CD1-CD2 4.45Å; I246-Y288 HydrophobicContact CG1-CD2 4.23Å; F249-Y288 HydrophobicContact CZ-CE2 4.47Å; Q260-Y288 PolarHBondContact NE2-OH 3.18Å; I284-Y288 WeakPolarHBondContact O-CB 3.45Å; I284-Y288 PolarHBondContact O-N 3.02Å; R285-Y288 WeakPolarHBondContact O-CB 3.34Å; R285-Y288 PolarHBondContact O-N 3.49Å; Y288-E290 PolarHBondContact O-N 2.97Å; Y288-T291 PolarHBondContact O-N 3.08Å; Y288-L292 HydrophobicContact CD2-CD2 3.89Å; Y288-L292 HydrophobicContact CE1-CB 4.4Å; Y288-L292 HydrophobicContact CE1-CD2 4.38Å; Y288-L292 HydrophobicContact CE1-CG 4.03Å; Y288-L292 HydrophobicContact CE2-CD2 3.71Å; Y288-L292 HydrophobicContact CE2-CG 4.04Å; Y288-L292 HydrophobicContact CG-CD2 4.32Å; Y288-L292 PolarHBondContact O-N 3.47Å; Y288-E396 WeakPolarHBondContact CE1-OE1 3.46Å; Y288-E396 PolarHBondContact OH-OE1 2.93Å; Y288-F399 HydrophobicContact CD2-CE1 4.41Å; Y288-F399 HydrophobicContact CE1-CD1 4.39Å; Y288-F399 HydrophobicContact CE1-CE1 4.04Å; Y288-F399 HydrophobicContact CE2-CD1 4.34Å; Y288-F399 AromaticContact CE2-CE1 3.49Å; Y288-F399 HydrophobicContact CE2-CE1 3.49Å; Y288-F399 VanDerWaalsContact CE2-CE1 3.49Å; Y288-F399 AromaticContact CE2-CZ 3.94Å; Y288-F399 HydrophobicContact CE2-CZ 3.94Å; Y288-F399 AromaticContact CZ-CD1 3.72Å; Y288-F399 AromaticContact CZ-CE1 3.27Å; Y288-F399 WeakPolarHBondContact OH-CD1 3.38Å; Y288-F399 WeakPolarHBondContact OH-CE1 3.25Å; Y288-F404 AromaticContact CD1-CE2 3.7Å; Y288-F404 HydrophobicContact CD1-CE2 3.7Å; Y288-F404 AromaticContact CD1-CZ 3.75Å; Y288-F404 HydrophobicContact CD1-CZ 3.75Å; Y288-F404 HydrophobicContact CD2-CZ 4.31Å; Y288-F404 AromaticContact CE1-CE2 3.92Å; Y288-F404 HydrophobicContact CE1-CE2 3.92Å; Y288-F404 HydrophobicContact CE1-CZ 4.38Å; Y288-F404 HydrophobicContact CG-CE2 4.11Å; Y288-F404 AromaticContact CG-CZ 3.72Å; Y288-F404 HydrophobicContact CG-CZ 3.72Å; Y288-V418 HydrophobicContact CE1-CG2 4.35Å
289	V	97	Very high	95.2	Very high	20 Å²	20	44.6 Å²	44.6	12%	0.121	23%	0.226	C	C	.	.	H	α-helix	trans	-57.9	-49.9	-178.9	169.4	0	0	0	0	110.9	R285 D286 T291 S293 L414 A417 V418	R285-V289 VanDerWaalsContact O-CG2 3.28Å; R285-V289 WeakPolarHBondContact O-CG2 3.38Å; R285-V289 PolarHBondContact O-N 3.45Å; D286-V289 PolarHBondContact O-N 3.28Å; V289-T291 VanDerWaalsContact C-N 3.32Å; V289-T291 PolarHBondContact O-N 2.96Å; V289-S293 WeakPolarHBondContact O-CB 3.3Å; V289-S293 PolarHBondContact O-N 2.84Å; V289-L414 HydrophobicContact CG2-CD1 3.36Å; V289-A417 HydrophobicContact CG1-CB 3.7Å; V289-V418 HydrophobicContact CB-CG2 4.38Å; V289-V418 HydrophobicContact CG1-CG2 4.38Å; V289-V418 HydrophobicContact CG2-CG2 3.96Å
290	E	96.4	Very high	95.1	Very high	67 Å²	67	41.5 Å²	41.5	31%	0.313	20%	0.2	S	C	.	.	H	α-helix	trans	-64.3	-38.4	-178.4	-177.6	63.9	-174.9	0	0	111.9	D286 Y288 K294 R421	D286-E290 WeakPolarHBondContact O-CB 3.25Å; D286-E290 PolarHBondContact O-N 3.24Å; Y288-E290 PolarHBondContact O-N 2.97Å; E290-K294 WeakPolarHBondContact O-CG 3.45Å; E290-K294 PolarHBondContact O-N 3.34Å; E290-K294 WeakPolarHBondContact OE1-CE 3.42Å; E290-K294 IonicContact OE1-NZ 2.97Å; E290-K294 PolarHBondContact OE1-NZ 3.11Å; E290-R421 IonicContact OE2-NH1 3.93Å
291	T	94.4	Very high	95.1	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.018	23%	0.226	C	C	.	.	H	α-helix	trans	-68.9	-52	178.7	-61.8	0	0	0	0	111.4	I246 F249 R250 E287 Y288 V289 K294 I295	I246-T291 HydrophobicContact CG2-CG2 4.39Å; F249-T291 HydrophobicContact CB-CG2 4.24Å; R250-T291 HydrophobicContact CG-CG2 3.86Å; R250-T291 PolarHBondContact NH2-OG1 2.97Å; E287-T291 VanDerWaalsContact O-CB 3.27Å; E287-T291 WeakPolarHBondContact O-CB 3.34Å; E287-T291 PolarHBondContact O-N 3.34Å; E287-T291 PolarHBondContact O-OG1 3.12Å; Y288-T291 PolarHBondContact O-N 3.08Å; V289-T291 VanDerWaalsContact C-N 3.32Å; V289-T291 PolarHBondContact O-N 2.96Å; T291-K294 PolarHBondContact O-N 2.96Å; T291-I295 HydrophobicContact CG2-CD1 3.79Å; T291-I295 VanDerWaalsContact O-CG1 3.29Å; T291-I295 WeakPolarHBondContact O-CG1 3.4Å; T291-I295 PolarHBondContact O-N 3.27Å; T291-I295 VanDerWaalsContact O-N 3.13Å
292	L	94.6	Very high	95.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-69.5	-38.6	-177.1	-86.7	-66.3	0	0	0	111.7	F249 Y288 K294 I295 Y296 V418	F249-L292 HydrophobicContact CD1-CD1 4.1Å; F249-L292 HydrophobicContact CD1-CD2 4.12Å; F249-L292 HydrophobicContact CE1-CD1 4.29Å; F249-L292 HydrophobicContact CE1-CD2 4.36Å; F249-L292 HydrophobicContact CG-CD2 4.21Å; Y288-L292 HydrophobicContact CD2-CD2 3.89Å; Y288-L292 HydrophobicContact CE1-CB 4.4Å; Y288-L292 HydrophobicContact CE1-CD2 4.38Å; Y288-L292 HydrophobicContact CE1-CG 4.03Å; Y288-L292 HydrophobicContact CE2-CD2 3.71Å; Y288-L292 HydrophobicContact CE2-CG 4.04Å; Y288-L292 HydrophobicContact CG-CD2 4.32Å; Y288-L292 PolarHBondContact O-N 3.47Å; L292-K294 VanDerWaalsContact C-N 3.32Å; L292-K294 PolarHBondContact O-N 3.26Å; L292-I295 PolarHBondContact O-N 2.86Å; L292-Y296 HydrophobicContact CB-CD2 4.28Å; L292-Y296 HydrophobicContact CB-CE2 4.2Å; L292-Y296 HydrophobicContact CD1-CD2 4.44Å; L292-Y296 HydrophobicContact CD1-CE2 3.87Å; L292-Y296 HydrophobicContact CG-CE2 4.47Å; L292-Y296 WeakPolarHBondContact O-CD2 2.99Å; L292-Y296 PolarHBondContact O-N 3.41Å; L292-V418 HydrophobicContact CB-CG1 3.85Å
293	S	96.2	Very high	95	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.007	22%	0.221	C	C	.	.	H	α-helix	trans	-58.5	-43.3	176.8	-169.1	0	0	0	0	112	V289 L297 V418	V289-S293 WeakPolarHBondContact O-CB 3.3Å; V289-S293 PolarHBondContact O-N 2.84Å; S293-L297 VanDerWaalsContact O-CB 3.26Å; S293-L297 WeakPolarHBondContact O-CB 3.23Å; S293-L297 PolarHBondContact O-N 3.48Å; S293-V418 WeakPolarHBondContact CA-O 3.22Å; S293-V418 VanDerWaalsContact CB-O 3.28Å; S293-V418 WeakPolarHBondContact CB-O 3.22Å; S293-V418 PolarHBondContact OG-O 3.29Å
294	K	94.6	Very high	94.9	Very high	114 Å²	114	43.3 Å²	43.3	50%	0.496	21%	0.207	S	C	.	.	H	α-helix	trans	-65.1	-43.3	175.2	-77.4	174.3	176.7	155.5	0	112.6	E290 T291 L292 S298	E290-K294 WeakPolarHBondContact O-CG 3.45Å; E290-K294 PolarHBondContact O-N 3.34Å; E290-K294 WeakPolarHBondContact OE1-CE 3.42Å; E290-K294 IonicContact OE1-NZ 2.97Å; E290-K294 PolarHBondContact OE1-NZ 3.11Å; T291-K294 PolarHBondContact O-N 2.96Å; L292-K294 VanDerWaalsContact C-N 3.32Å; L292-K294 PolarHBondContact O-N 3.26Å; K294-S298 VanDerWaalsContact O-CB 3.28Å; K294-S298 WeakPolarHBondContact O-CB 3.45Å; K294-S298 PolarHBondContact O-N 2.67Å
295	I	92.1	Very high	94.8	Very high	45 Å²	45	45.1 Å²	45.1	23%	0.231	23%	0.225	C	C	.	.	H	α-helix	trans	-63.9	-51.2	-178.9	-70.4	167.3	0	0	0	110.3	F249 T291 L292 L297 S298 Y299	F249-I295 HydrophobicContact CB-CD1 3.77Å; F249-I295 VanDerWaalsContact O-CD1 3.32Å; F249-I295 WeakPolarHBondContact O-CD1 3.36Å; T291-I295 HydrophobicContact CG2-CD1 3.79Å; T291-I295 VanDerWaalsContact O-CG1 3.29Å; T291-I295 WeakPolarHBondContact O-CG1 3.4Å; T291-I295 PolarHBondContact O-N 3.27Å; T291-I295 VanDerWaalsContact O-N 3.13Å; L292-I295 PolarHBondContact O-N 2.86Å; I295-L297 PolarHBondContact O-N 3.23Å; I295-S298 PolarHBondContact O-N 2.74Å; I295-Y299 VanDerWaalsContact O-CB 3.32Å; I295-Y299 WeakPolarHBondContact O-CB 3.5Å; I295-Y299 PolarHBondContact O-N 3.14Å
296	Y	93.8	Very high	94.7	Very high	1 Å²	1	47.3 Å²	47.3	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-48.4	178.4	-75.2	-57.2	0	0	0	111.2	Y256 L292 S298 Y299 Y300 N392 E396 V418 M419	Y256-Y296 HydrophobicContact CD2-CE1 4.31Å; Y256-Y296 HydrophobicContact CE1-CE1 4.49Å; Y256-Y296 HydrophobicContact CE2-CE1 4.14Å; L292-Y296 HydrophobicContact CB-CD2 4.28Å; L292-Y296 HydrophobicContact CB-CE2 4.2Å; L292-Y296 HydrophobicContact CD1-CD2 4.44Å; L292-Y296 HydrophobicContact CD1-CE2 3.87Å; L292-Y296 HydrophobicContact CG-CE2 4.47Å; L292-Y296 WeakPolarHBondContact O-CD2 2.99Å; L292-Y296 PolarHBondContact O-N 3.41Å; Y296-S298 VanDerWaalsContact C-N 3.33Å; Y296-S298 PolarHBondContact O-N 3Å; Y296-Y299 PolarHBondContact O-N 3.03Å; Y296-Y300 HydrophobicContact CD1-CE2 4.03Å; Y296-Y300 VanDerWaalsContact O-CD2 3.26Å; Y296-Y300 WeakPolarHBondContact O-CD2 3.34Å; Y296-Y300 PolarHBondContact O-N 3.01Å; Y296-N392 HydrophobicContact CE1-CB 4.25Å; Y296-E396 HydrophobicContact CE2-CG 4.23Å; Y296-E396 WeakPolarHBondContact CE2-OE2 3.46Å; Y296-E396 PolarHBondContact OH-OE2 3.43Å; Y296-V418 HydrophobicContact CD2-CG1 3.84Å; Y296-V418 HydrophobicContact CE2-CG1 3.88Å; Y296-M419 HydrophobicContact CD1-SD 4.17Å; Y296-M419 HydrophobicContact CD2-SD 3.46Å; Y296-M419 WeakPolarHBondContact CD2-SD 3.46Å; Y296-M419 HydrophobicContact CE1-SD 4.45Å; Y296-M419 HydrophobicContact CE2-SD 3.77Å; Y296-M419 HydrophobicContact CG-SD 3.68Å
297	L	95.3	Very high	94.6	Very high	45 Å²	45	44.1 Å²	44.1	24%	0.236	22%	0.217	C	C	.	.	H	α-helix	trans	-58.1	-45.7	179.8	179.9	63.2	0	0	0	111.9	S293 I295 R301 R421 T422 M425	S293-L297 VanDerWaalsContact O-CB 3.26Å; S293-L297 WeakPolarHBondContact O-CB 3.23Å; S293-L297 PolarHBondContact O-N 3.48Å; I295-L297 PolarHBondContact O-N 3.23Å; L297-R301 WeakPolarHBondContact O-CB 3Å; L297-R301 PolarHBondContact O-N 2.8Å; L297-R421 HydrophobicContact CD2-CB 4.41Å; L297-T422 PolarHBondContact N-OG1 2.95Å; L297-M425 HydrophobicContact CD1-CB 3.98Å; L297-M425 HydrophobicContact CD1-CG 4.16Å
298	S	93.7	Very high	94.4	Very high	82 Å²	82	44 Å²	44	57%	0.573	22%	0.217	S	C	*	.	H	α-helix	trans	-63.5	-46.1	178.2	-176.1	0	0	0	0	111.9	K294 I295 Y296 S302	K294-S298 VanDerWaalsContact O-CB 3.28Å; K294-S298 WeakPolarHBondContact O-CB 3.45Å; K294-S298 PolarHBondContact O-N 2.67Å; I295-S298 PolarHBondContact O-N 2.74Å; Y296-S298 VanDerWaalsContact C-N 3.33Å; Y296-S298 PolarHBondContact O-N 3Å; S298-S302 WeakPolarHBondContact O-CB 3.45Å; S298-S302 PolarHBondContact O-N 2.92Å
299	Y	92	Very high	94.2	Very high	83 Å²	83	50.7 Å²	50.7	33%	0.325	25%	0.246	S	C	.	.	H	α-helix	trans	-58.9	-55.8	178.3	170.8	-97.7	0	0	0	111.4	I295 Y296 R301 S302 Y303	I295-Y299 VanDerWaalsContact O-CB 3.32Å; I295-Y299 WeakPolarHBondContact O-CB 3.5Å; I295-Y299 PolarHBondContact O-N 3.14Å; Y296-Y299 PolarHBondContact O-N 3.03Å; Y299-R301 PolarHBondContact O-N 3.15Å; Y299-S302 PolarHBondContact O-N 3.35Å; Y299-Y303 VanDerWaalsContact O-CB 3.23Å; Y299-Y303 WeakPolarHBondContact O-CB 3.38Å; Y299-Y303 PolarHBondContact O-N 3.22Å
300	Y	94.4	Very high	94	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-66.6	-37.7	-177.1	-79.9	-80.1	0	0	0	112.2	Y296 S302 Y303 L304 A388 L389 N392 T422	Y296-Y300 HydrophobicContact CD1-CE2 4.03Å; Y296-Y300 VanDerWaalsContact O-CD2 3.26Å; Y296-Y300 WeakPolarHBondContact O-CD2 3.34Å; Y296-Y300 PolarHBondContact O-N 3.01Å; Y300-S302 PolarHBondContact O-N 3.24Å; Y300-Y303 PolarHBondContact O-N 2.91Å; Y300-L304 WeakPolarHBondContact O-CB 3.35Å; Y300-L304 PolarHBondContact O-N 3.05Å; Y300-A388 HydrophobicContact CE1-CB 4.11Å; Y300-A388 PolarHBondContact OH-O 3.24Å; Y300-L389 HydrophobicContact CE1-CB 4.05Å; Y300-L389 HydrophobicContact CE1-CD1 4.07Å; Y300-L389 HydrophobicContact CE2-CD1 4.21Å; Y300-L389 VanDerWaalsContact OH-CA 3.23Å; Y300-L389 WeakPolarHBondContact OH-CA 3.45Å; Y300-L389 PolarHBondContact OH-N 3.05Å; Y300-N392 WeakPolarHBondContact OH-CB 3.47Å; Y300-N392 PolarHBondContact OH-ND2 3.47Å; Y300-T422 HydrophobicContact CD2-CG2 3.31Å; Y300-T422 HydrophobicContact CE2-CG2 4.03Å; Y300-T422 HydrophobicContact CG-CG2 3.64Å
301	R	95.1	Very high	93.7	Very high	171 Å²	171	47.9 Å²	47.9	65%	0.645	23%	0.231	S	C	*	.	H	α-helix	trans	-61.2	-46.3	175.4	-172.5	177.4	-163.7	161.7	4.7	111.7	L297 Y299 G305	L297-R301 WeakPolarHBondContact O-CB 3Å; L297-R301 PolarHBondContact O-N 2.8Å; Y299-R301 PolarHBondContact O-N 3.15Å; R301-G305 PolarHBondContact O-N 3.43Å
302	S	93.5	Very high	93.4	Very high	51 Å²	51	53.7 Å²	53.7	36%	0.357	25%	0.254	S	S	.	.	H	α-helix	trans	-67.6	-42.3	176.5	174.7	0	0	0	0	111.7	S298 Y299 Y300 G305 R306	S298-S302 WeakPolarHBondContact O-CB 3.45Å; S298-S302 PolarHBondContact O-N 2.92Å; Y299-S302 PolarHBondContact O-N 3.35Å; Y300-S302 PolarHBondContact O-N 3.24Å; S302-G305 PolarHBondContact O-N 3.34Å; S302-R306 VanDerWaalsContact O-CG 3.29Å; S302-R306 WeakPolarHBondContact O-CG 3.21Å; S302-R306 PolarHBondContact O-N 2.9Å; S302-R306 VanDerWaalsContact O-N 3.09Å; S302-R306 PolarHBondContact OG-NE 2.93Å; S302-R306 PolarHBondContact OG-NH2 3.31Å
303	Y	94.3	Very high	92.6	Very high	17 Å²	17	61.1 Å²	61.1	7%	0.067	29%	0.289	C	S	.	.	H	α-helix	trans	-62.7	-50.8	-179	-178.1	-121.7	0	0	0	111.1	Y299 Y300 G305 R306 L307 L364 P366 S384 A388	Y299-Y303 VanDerWaalsContact O-CB 3.23Å; Y299-Y303 WeakPolarHBondContact O-CB 3.38Å; Y299-Y303 PolarHBondContact O-N 3.22Å; Y300-Y303 PolarHBondContact O-N 2.91Å; Y303-G305 PolarHBondContact O-N 2.99Å; Y303-R306 PolarHBondContact O-N 2.93Å; Y303-R306 VanDerWaalsContact O-N 3.14Å; Y303-L307 HydrophobicContact CD1-CD1 3.79Å; Y303-L307 HydrophobicContact CD1-CG 4.44Å; Y303-L307 HydrophobicContact CD2-CG 4.46Å; Y303-L307 HydrophobicContact CE1-CD1 3.35Å; Y303-L307 HydrophobicContact CE1-CG 4.11Å; Y303-L307 HydrophobicContact CE2-CD1 4.26Å; Y303-L307 HydrophobicContact CE2-CD2 4.27Å; Y303-L307 HydrophobicContact CE2-CG 4.11Å; Y303-L307 HydrophobicContact CG-CD1 4.4Å; Y303-L307 PolarHBondContact O-N 2.96Å; Y303-L364 WeakPolarHBondContact CE2-O 3.5Å; Y303-L364 PolarHBondContact OH-O 2.98Å; Y303-P366 HydrophobicContact CD2-CG 4.14Å; Y303-P366 HydrophobicContact CE2-CG 3.89Å; Y303-S384 PolarHBondContact OH-OG 2.91Å; Y303-A388 HydrophobicContact CE1-CB 4.48Å
304	L	94.5	Very high	91.6	Very high	6 Å²	6	66 Å²	66	3%	0.031	31%	0.311	C	S	.	.	H	α-helix	trans	-58.5	-48.6	175.7	178.7	57.9	0	0	0	112.1	Y300 R306 L307 M308 Q385 M425 H429	Y300-L304 WeakPolarHBondContact O-CB 3.35Å; Y300-L304 PolarHBondContact O-N 3.05Å; L304-R306 PolarHBondContact O-N 2.94Å; L304-R306 VanDerWaalsContact O-N 3.15Å; L304-L307 PolarHBondContact O-N 2.89Å; L304-L307 VanDerWaalsContact O-N 3.09Å; L304-M308 HydrophobicContact CD1-CG 4.09Å; L304-M308 HydrophobicContact CD1-SD 4.26Å; L304-M308 WeakPolarHBondContact O-CG 3.31Å; L304-M308 PolarHBondContact O-N 3.08Å; L304-Q385 VanDerWaalsContact CD1-OE1 3.23Å; L304-M425 HydrophobicContact CD2-CE 3.34Å; L304-M425 HydrophobicContact CD2-SD 4.23Å; L304-H429 HydrophobicContact CD2-CB 3.88Å
305	G	94.4	Very high	91	Very high	38 Å²	38	63.3 Å²	63.3	39%	0.392	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-26.1	178.2	0	0	0	0	0	113.6	R301 S302 Y303 K309	R301-G305 PolarHBondContact O-N 3.43Å; S302-G305 PolarHBondContact O-N 3.34Å; Y303-G305 PolarHBondContact O-N 2.99Å; G305-K309 WeakPolarHBondContact O-CG 3.46Å
306	R	93.9	Very high	90.6	Very high	131 Å²	131	61.6 Å²	61.6	49%	0.494	30%	0.297	S	S	.	.	H	α-helix	trans	-85.3	-36.1	173.1	-66.7	174.8	-165.3	-173.9	2.7	112.6	S302 Y303 L304 K309 P366	S302-R306 VanDerWaalsContact O-CG 3.29Å; S302-R306 WeakPolarHBondContact O-CG 3.21Å; S302-R306 PolarHBondContact O-N 2.9Å; S302-R306 VanDerWaalsContact O-N 3.09Å; S302-R306 PolarHBondContact OG-NE 2.93Å; S302-R306 PolarHBondContact OG-NH2 3.31Å; Y303-R306 PolarHBondContact O-N 2.93Å; Y303-R306 VanDerWaalsContact O-N 3.14Å; L304-R306 PolarHBondContact O-N 2.94Å; L304-R306 VanDerWaalsContact O-N 3.15Å; R306-K309 WeakPolarHBondContact O-CB 3.46Å; R306-K309 PolarHBondContact O-N 3.36Å; R306-P366 HydrophobicContact CB-CB 3.6Å; R306-P366 HydrophobicContact CB-CG 3.85Å
307	L	93.6	Very high	90.3	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-60	-45.7	174.8	-79.3	176.2	0	0	0	111.3	Y303 L304 K309 V310 L364 P366 L381 Q385	Y303-L307 HydrophobicContact CD1-CD1 3.79Å; Y303-L307 HydrophobicContact CD1-CG 4.44Å; Y303-L307 HydrophobicContact CD2-CG 4.46Å; Y303-L307 HydrophobicContact CE1-CD1 3.35Å; Y303-L307 HydrophobicContact CE1-CG 4.11Å; Y303-L307 HydrophobicContact CE2-CD1 4.26Å; Y303-L307 HydrophobicContact CE2-CD2 4.27Å; Y303-L307 HydrophobicContact CE2-CG 4.11Å; Y303-L307 HydrophobicContact CG-CD1 4.4Å; Y303-L307 PolarHBondContact O-N 2.96Å; L304-L307 PolarHBondContact O-N 2.89Å; L304-L307 VanDerWaalsContact O-N 3.09Å; L307-K309 PolarHBondContact O-N 3.18Å; L307-K309 VanDerWaalsContact O-N 3.12Å; L307-V310 WeakPolarHBondContact O-CG2 3.5Å; L307-V310 PolarHBondContact O-N 3.36Å; L307-L364 HydrophobicContact CD2-CB 3.99Å; L307-L364 HydrophobicContact CD2-CD1 4.4Å; L307-P366 HydrophobicContact CD2-CG 3.91Å; L307-P366 HydrophobicContact CG-CG 4.12Å; L307-L381 HydrophobicContact CB-CD2 4.38Å; L307-L381 HydrophobicContact CD2-CD2 3.98Å; L307-L381 WeakPolarHBondContact O-CD1 3.27Å; L307-Q385 HydrophobicContact CD1-CB 4.06Å
308	M	93	Very high	89.9	Confident	47 Å²	47	70.9 Å²	70.9	23%	0.232	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-62.8	-23.6	180	-62.2	-49.9	-68.8	0	0	113	L304 V310 Q311 F378 L381 Y433	L304-M308 HydrophobicContact CD1-CG 4.09Å; L304-M308 HydrophobicContact CD1-SD 4.26Å; L304-M308 WeakPolarHBondContact O-CG 3.31Å; L304-M308 PolarHBondContact O-N 3.08Å; M308-V310 VanDerWaalsContact C-N 3.27Å; M308-V310 PolarHBondContact O-N 3.06Å; M308-Q311 WeakPolarHBondContact O-CB 3.35Å; M308-Q311 PolarHBondContact O-N 3.34Å; M308-F378 HydrophobicContact CE-CD2 4.3Å; M308-F378 HydrophobicContact CE-CE2 4.25Å; M308-F378 HydrophobicContact SD-CE2 4.41Å; M308-L381 HydrophobicContact SD-CD1 4.36Å; M308-Y433 HydrophobicContact CE-CD2 3.9Å; M308-Y433 HydrophobicContact CE-CE2 4.02Å
309	K	92.4	Very high	89.5	Confident	139 Å²	139	71.6 Å²	71.6	60%	0.604	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-73.7	-15.7	175	-67.6	179.2	-178.4	-169.4	0	114	G305 R306 L307 R375	G305-K309 WeakPolarHBondContact O-CG 3.46Å; R306-K309 WeakPolarHBondContact O-CB 3.46Å; R306-K309 PolarHBondContact O-N 3.36Å; L307-K309 PolarHBondContact O-N 3.18Å; L307-K309 VanDerWaalsContact O-N 3.12Å; K309-R375 PolarHBondContact O-NH1 3.37Å
310	V	92.2	Very high	89.2	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.012	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-105.6	10	176.8	-61.6	0	0	0	0	112.3	L307 M308 A369 Q370 R375 Y376 L381	L307-V310 WeakPolarHBondContact O-CG2 3.5Å; L307-V310 PolarHBondContact O-N 3.36Å; M308-V310 VanDerWaalsContact C-N 3.27Å; M308-V310 PolarHBondContact O-N 3.06Å; V310-A369 HydrophobicContact CB-CB 4.5Å; V310-A369 HydrophobicContact CG1-CB 4.07Å; V310-Q370 HydrophobicContact CG1-CG 3.44Å; V310-Q370 VanDerWaalsContact CG1-CG 3.44Å; V310-R375 CarbonylContact O-C 3.13Å; V310-R375 VanDerWaalsContact O-CA 3.24Å; V310-R375 WeakPolarHBondContact O-CA 3.22Å; V310-Y376 HydrophobicContact CB-CD2 4.47Å; V310-Y376 HydrophobicContact CG2-CD2 4.23Å; V310-Y376 PolarHBondContact O-N 2.98Å; V310-L381 HydrophobicContact CG2-CD2 3.92Å
311	Q	90.6	Very high	88.9	Confident	26 Å²	26	70 Å²	70	12%	0.121	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-64.4	150.8	168.3	-164.9	-177.9	-19.9	0	0	110.1	M308 R375 Y376 L381 Y433	M308-Q311 WeakPolarHBondContact O-CB 3.35Å; M308-Q311 PolarHBondContact O-N 3.34Å; Q311-R375 PolarHBondContact O-NH1 2.91Å; Q311-R375 VanDerWaalsContact O-NH1 3.14Å; Q311-Y376 WeakPolarHBondContact CA-O 3.35Å; Q311-L381 HydrophobicContact CB-CD1 3.69Å; Q311-L381 HydrophobicContact CG-CD1 4.04Å; Q311-Y433 PolarHBondContact NE2-OH 3.43Å
312	Y	87.3	Confident	88.6	Confident	125 Å²	125	61.8 Å²	61.8	49%	0.49	30%	0.301	S	S	.	.			trans	-54	142.4	163.7	-70.9	-56.3	0	0	0	111.3	R375 Y376 P377	Y312-R375 HydrophobicContact CD1-CB 3.38Å; Y312-R375 HydrophobicContact CD1-CG 4.37Å; Y312-R375 HydrophobicContact CE1-CB 3.49Å; Y312-R375 VanDerWaalsContact CE1-CB 3.49Å; Y312-R375 HydrophobicContact CG-CB 4.22Å; Y312-R375 PolarHBondContact OH-O 3.06Å; Y312-Y376 VanDerWaalsContact CD2-C 3.41Å; Y312-Y376 WeakPolarHBondContact CD2-O 3.48Å; Y312-Y376 PolarHBondContact N-O 3Å; Y312-P377 HydrophobicContact CD2-CB 4.05Å; Y312-P377 HydrophobicContact CE2-CB 4.01Å; Y312-P377 HydrophobicContact CE2-CG 4.32Å; Y312-P377 VanDerWaalsContact CE2-N 3.33Å
313	E	78.3	Confident	88.1	Confident	156 Å²	156	59.9 Å²	59.9	73%	0.729	29%	0.289	S	S	*	.	S	Bend	trans	-79.7	-36.5	-178	-66.7	177.6	-178.9	0	0	112.2	R375	E313-R375 IonicContact OE1-CZ 2.58Å; E313-R375 IonicContact OE1-NH1 3.62Å; E313-R375 IonicContact OE1-NH2 3.53Å; E313-R375 PolarHBondContact OE1-NH2 3.49Å
314	E	75.1	Confident	87.7	Confident	103 Å²	103	61.6 Å²	61.6	48%	0.481	30%	0.301	S	S	.	.			trans	-84.6	120	173.1	-65.8	-178.9	153.5	0	0	109.1	S337 S340	E314-S337 VanDerWaalsContact OE1-CB 3.3Å; E314-S337 WeakPolarHBondContact OE1-CB 3.08Å; E314-S337 PolarHBondContact OE1-OG 3.29Å; E314-S340 WeakPolarHBondContact OE2-CB 3.12Å; E314-S340 PolarHBondContact OE2-OG 2.96Å
315	V	81.5	Confident	86.6	Confident	59 Å²	59	64.7 Å²	64.7	36%	0.358	32%	0.315	S	S	.	.			trans	-127.1	150.6	179.4	-175	0	0	0	0	108	E317	V315-E317 PolarHBondContact O-N 2.9Å
316	A	84.1	Confident	85.2	Confident	8 Å²	8	65.9 Å²	65.9	7%	0.066	31%	0.313	C	S	.	.			trans	-57.5	127.5	177.2	0	0	0	0	0	111.5	I344 D439	A316-I344 HydrophobicContact CB-CD1 4.03Å; A316-I344 HydrophobicContact CB-CG1 4.2Å; A316-I344 HydrophobicContact CB-CG2 4.03Å; A316-D439 HydrophobicContact CB-CB 4.05Å
317	E	86.8	Confident	83.3	Confident	117 Å²	117	64 Å²	64	55%	0.547	32%	0.316	S	S	.	.			trans	-96.2	169.4	177.7	-63.7	-176.7	176.7	0	0	111.4	V315 D319 D320	V315-E317 PolarHBondContact O-N 2.9Å; E317-D319 PolarHBondContact O-N 2.89Å; E317-D319 VanDerWaalsContact O-N 3.13Å; E317-D320 PolarHBondContact N-OD2 3.24Å; E317-D320 WeakPolarHBondContact O-CB 3.38Å; E317-D320 PolarHBondContact O-N 3.24Å
318	K	87.1	Confident	81.1	Confident	124 Å²	124	65.6 Å²	65.6	54%	0.539	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30	178.9	-172.1	177.6	176.6	-178.1	0	113.7	Y438 M486	K318-Y438 HydrophobicContact CB-CD1 4.24Å; K318-Y438 HydrophobicContact CB-CD2 4.41Å; K318-Y438 HydrophobicContact CB-CE1 3.77Å; K318-Y438 HydrophobicContact CB-CE2 3.96Å; K318-Y438 HydrophobicContact CD-CE1 4.48Å; K318-Y438 HydrophobicContact CG-CD1 4.41Å; K318-Y438 HydrophobicContact CG-CE1 3.77Å; K318-M486 HydrophobicContact CG-CE 3.98Å
319	D	84.6	Confident	78.8	Confident	98 Å²	98	71.6 Å²	71.6	52%	0.524	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-1.5	-177.5	-62.3	-30.5	0	0	0	113	E317 L321	E317-D319 PolarHBondContact O-N 2.89Å; E317-D319 VanDerWaalsContact O-N 3.13Å; D319-L321 PolarHBondContact O-N 3.29Å
320	D	85.8	Confident	76.4	Confident	23 Å²	23	75 Å²	75	12%	0.123	37%	0.369	C	S	.	.			trans	-82.6	54.7	175.7	-68.3	-39.8	0	0	0	112	E317 R341 I344 F345	E317-D320 PolarHBondContact N-OD2 3.24Å; E317-D320 WeakPolarHBondContact O-CB 3.38Å; E317-D320 PolarHBondContact O-N 3.24Å; D320-R341 IonicContact OD1-CZ 2.7Å; D320-R341 VanDerWaalsContact OD1-CZ 3.32Å; D320-R341 IonicContact OD1-NE 2.68Å; D320-R341 PolarHBondContact OD1-NE 3.16Å; D320-R341 IonicContact OD1-NH2 3.64Å; D320-R341 PolarHBondContact OD1-NH2 3.39Å; D320-I344 HydrophobicContact CB-CD1 3.59Å; D320-F345 WeakPolarHBondContact O-CZ 3.28Å
321	L	88.6	Confident	74.1	Confident	27 Å²	27	76.8 Å²	76.8	14%	0.141	39%	0.388	C	S	.	.			trans	-97	154.3	178.1	-59.6	174	0	0	0	111.6	D319 G323 V324 M486	D319-L321 PolarHBondContact O-N 3.29Å; L321-G323 VanDerWaalsContact C-N 3.31Å; L321-G323 PolarHBondContact O-N 3Å; L321-V324 HydrophobicContact CB-CG2 3.97Å; L321-V324 PolarHBondContact O-N 3.25Å; L321-M486 HydrophobicContact CD1-CB 4.45Å; L321-M486 HydrophobicContact CD1-CE 4.33Å; L321-M486 HydrophobicContact CD2-CB 3.85Å; L321-M486 HydrophobicContact CD2-CE 4.27Å
322	M	89.1	Confident	71.9	Confident	0 Å²	0	85.3 Å²	85.3	0%	0	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-44.1	-175.2	-166.6	174.7	-67.9	0	0	112.7	V324 F345 N487 V491 I509 R512 F516 L539 V543	M322-V324 VanDerWaalsContact C-N 3.35Å; M322-V324 PolarHBondContact O-N 2.61Å; M322-F345 HydrophobicContact CB-CE1 4.29Å; M322-F345 HydrophobicContact CB-CZ 4.36Å; M322-F345 HydrophobicContact CE-CD1 4.21Å; M322-F345 HydrophobicContact CE-CE1 4.3Å; M322-N487 WeakPolarHBondContact CB-OD1 3.14Å; M322-N487 PolarHBondContact N-OD1 3.28Å; M322-V491 HydrophobicContact CB-CG2 3.91Å; M322-V491 HydrophobicContact CG-CG2 3.96Å; M322-V491 HydrophobicContact SD-CG2 3.98Å; M322-I509 HydrophobicContact CG-CG2 4.19Å; M322-R512 HydrophobicContact CG-CB 3.92Å; M322-R512 PolarHBondContact O-NH1 3.17Å; M322-F516 HydrophobicContact CE-CB 4.03Å; M322-F516 HydrophobicContact CE-CD1 3.97Å; M322-F516 HydrophobicContact CE-CG 4.15Å; M322-L539 HydrophobicContact CE-CD2 4.04Å; M322-L539 HydrophobicContact SD-CD1 4.22Å; M322-V543 HydrophobicContact SD-CG2 4.47Å
323	G	83.8	Confident	70.1	Confident	11 Å²	11	89.3 Å²	89.3	11%	0.113	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	1.4	-177.9	0	0	0	0	0	116.4	L321 S490 T494	L321-G323 VanDerWaalsContact C-N 3.31Å; L321-G323 PolarHBondContact O-N 3Å; G323-S490 PolarHBondContact N-OG 2.71Å; G323-T494 WeakPolarHBondContact CA-OG1 3.23Å; G323-T494 PolarHBondContact O-OG1 2.86Å
324	V	83.9	Confident	68.2	Low	53 Å²	53	85 Å²	85	32%	0.321	43%	0.433	S	S	.	.	S	Bend	trans	-85.3	139.4	179.2	175.5	0	0	0	0	110.5	L321 M322 Y508 R512	L321-V324 HydrophobicContact CB-CG2 3.97Å; L321-V324 PolarHBondContact O-N 3.25Å; M322-V324 VanDerWaalsContact C-N 3.35Å; M322-V324 PolarHBondContact O-N 2.61Å; V324-Y508 WeakPolarHBondContact O-CE2 3.5Å; V324-Y508 PolarHBondContact O-OH 2.72Å; V324-R512 PolarHBondContact O-NH1 3.26Å
325	E	71.8	Confident	66.3	Low	70 Å²	70	89.6 Å²	89.6	33%	0.327	45%	0.451	S	S	.	.			trans	-54.7	135.9	-179.4	-77.9	175.9	-154.3	0	0	113	T327 L499 Y508	E325-T327 HydrophobicContact CB-CG2 4.34Å; E325-T327 PolarHBondContact O-N 3.2Å; E325-T327 VanDerWaalsContact O-N 3.11Å; E325-L499 HydrophobicContact CG-CD2 4.12Å; E325-Y508 WeakPolarHBondContact CA-OH 3.5Å
326	D	64.9	Low	64.2	Low	63 Å²	63	91.2 Å²	91.2	34%	0.337	46%	0.463	S	S	.	.			trans	-81.3	28.6	173.2	-155	27.3	0	0	0	112.3	A328 R341 Y508 R512	D326-A328 VanDerWaalsContact C-N 3.26Å; D326-A328 PolarHBondContact O-N 3.33Å; D326-R341 IonicContact OD1-NH1 2.94Å; D326-Y508 HydrophobicContact CB-CD2 4.28Å; D326-Y508 HydrophobicContact CB-CE2 4.38Å; D326-Y508 HydrophobicContact CB-CG 4.37Å; D326-R512 VanDerWaalsContact CG-NH2 3.34Å; D326-R512 IonicContact OD1-NH2 3.24Å; D326-R512 PolarHBondContact OD1-NH2 3.5Å; D326-R512 VanDerWaalsContact OD1-NH2 3.13Å; D326-R512 IonicContact OD2-NH2 3.7Å
327	T	55.4	Low	62	Low	91 Å²	91	94.4 Å²	94.4	56%	0.558	48%	0.484	S	S	*	.			trans	-72.1	92.4	165.3	57.5	0	0	0	0	106.7	E325 K329	E325-T327 HydrophobicContact CB-CG2 4.34Å; E325-T327 PolarHBondContact O-N 3.2Å; E325-T327 VanDerWaalsContact O-N 3.11Å; T327-K329 PolarHBondContact O-N 2.98Å
328	A	47.7	Very low	59.8	Low	36 Å²	36	93.6 Å²	93.6	30%	0.298	48%	0.484	S	S	.	.			trans	-42.4	115.1	155.6	0	0	0	0	0	106.2	D326 K330 P336 L338	D326-A328 VanDerWaalsContact C-N 3.26Å; D326-A328 PolarHBondContact O-N 3.33Å; A328-K330 PolarHBondContact O-N 3.26Å; A328-P336 HydrophobicContact CB-CB 4.48Å; A328-L338 HydrophobicContact CB-CD2 4.35Å; A328-L338 HydrophobicContact CB-CG 4.48Å
329	K	44.2	Very low	57.7	Low	173 Å²	173	99.2 Å²	99.2	75%	0.752	50%	0.501	S	S	*	.			trans	-44.1	107.1	-177.1	-73.5	175.2	178.8	167.7	0	107.4	T327 G331	T327-K329 PolarHBondContact O-N 2.98Å; K329-G331 PolarHBondContact O-N 3.03Å
330	K	42.3	Very low	56	Low	210 Å²	210	96.1 Å²	96.1	91%	0.913	49%	0.487	S	S	*	.			trans	-73.1	60	172	-80.9	-175.7	176.8	175.1	0	108	A328	A328-K330 PolarHBondContact O-N 3.26Å
331	G	42.5	Very low	54.3	Low	40 Å²	40	98 Å²	98	41%	0.412	49%	0.493	S	S	.	.			trans	-76.9	128.5	166.9	0	0	0	0	0	108.2	K329 F333 S334	K329-G331 PolarHBondContact O-N 3.03Å; G331-F333 PolarHBondContact O-N 2.98Å; G331-S334 PolarHBondContact O-N 3.5Å
332	F	45.9	Very low	52.4	Low	205 Å²	205	101.3 Å²	101.3	90%	0.899	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	2.5	-177.4	-106.1	-96.1	0	0	0	115.3
333	F	48.8	Very low	51.3	Low	208 Å²	208	104.8 Å²	104.8	91%	0.912	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.5	6.8	-178.8	-71	-79.2	0	0	0	115.7	G331	G331-F333 PolarHBondContact O-N 2.98Å
334	S	38.7	Very low	51.3	Low	67 Å²	67	105 Å²	105	47%	0.469	53%	0.53	S	S	.	.			trans	-110.2	118.2	177.1	59.8	0	0	0	0	111.4	G331	G331-S334 PolarHBondContact O-N 3.5Å
335	K	34.2	Very low	51.5	Low	199 Å²	199	102.9 Å²	102.9	87%	0.865	52%	0.517	S	S	*	.			trans	-55	130.3	167.1	-81	-178.8	-178.3	176.7	0	108.6	S337	K335-S337 PolarHBondContact O-N 3.49Å; K335-S337 VanDerWaalsContact O-N 3.1Å
336	P	37.2	Very low	52.2	Low	92 Å²	92	100.9 Å²	100.9	60%	0.597	51%	0.509	S	S	*	.			trans	-70.3	108.1	178.1	26.4	-30.7	0	0	0	109.5	A328 L338	A328-P336 HydrophobicContact CB-CB 4.48Å; P336-L338 HydrophobicContact CB-CD1 4Å; P336-L338 HydrophobicContact CB-CG 4.19Å; P336-L338 HydrophobicContact CG-CD1 4.48Å; P336-L338 PolarHBondContact O-N 2.86Å
337	S	39.2	Very low	53.3	Low	75 Å²	75	98.5 Å²	98.5	52%	0.524	50%	0.496	S	S	.	.			trans	-78.6	67.8	166.5	68.2	0	0	0	0	109.8	E314 K335 R339	E314-S337 VanDerWaalsContact OE1-CB 3.3Å; E314-S337 WeakPolarHBondContact OE1-CB 3.08Å; E314-S337 PolarHBondContact OE1-OG 3.29Å; K335-S337 PolarHBondContact O-N 3.49Å; K335-S337 VanDerWaalsContact O-N 3.1Å; S337-R339 PolarHBondContact O-N 3.37Å
338	L	40.2	Very low	54.7	Low	101 Å²	101	96.7 Å²	96.7	53%	0.529	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	3.8	176.8	-86.9	158.1	0	0	0	114	A328 P336	A328-L338 HydrophobicContact CB-CD2 4.35Å; A328-L338 HydrophobicContact CB-CG 4.48Å; P336-L338 HydrophobicContact CB-CD1 4Å; P336-L338 HydrophobicContact CB-CG 4.19Å; P336-L338 HydrophobicContact CG-CD1 4.48Å; P336-L338 PolarHBondContact O-N 2.86Å
339	R	43.1	Very low	56.5	Low	242 Å²	242	100.9 Å²	100.9	91%	0.913	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-17.1	-168.1	-75.6	-170.5	178.9	-176.9	0.1	116.2	S337	S337-R339 PolarHBondContact O-N 3.37Å
340	S	48.4	Very low	58.7	Low	33 Å²	33	94 Å²	94	23%	0.231	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-18.1	178.7	69.2	0	0	0	0	115.2	E314 N342 T343	E314-S340 WeakPolarHBondContact OE2-CB 3.12Å; E314-S340 PolarHBondContact OE2-OG 2.96Å; S340-N342 PolarHBondContact O-N 2.93Å; S340-T343 PolarHBondContact O-N 2.91Å; S340-T343 PolarHBondContact O-OG1 3.37Å
341	R	50.1	Low	60.9	Low	61 Å²	61	84.8 Å²	84.8	23%	0.23	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-64.8	-28.5	-179.2	-145.5	175.8	-179.7	-156.5	-3.2	113.1	D320 D326 T343 I344	D320-R341 IonicContact OD1-CZ 2.7Å; D320-R341 VanDerWaalsContact OD1-CZ 3.32Å; D320-R341 IonicContact OD1-NE 2.68Å; D320-R341 PolarHBondContact OD1-NE 3.16Å; D320-R341 IonicContact OD1-NH2 3.64Å; D320-R341 PolarHBondContact OD1-NH2 3.39Å; D326-R341 IonicContact OD1-NH1 2.94Å; R341-T343 PolarHBondContact O-N 3.35Å; R341-I344 HydrophobicContact CG-CD1 4.03Å; R341-I344 WeakPolarHBondContact O-CG1 3.32Å; R341-I344 PolarHBondContact O-N 2.96Å
342	N	48.8	Very low	63.2	Low	97 Å²	97	85 Å²	85	52%	0.519	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-70.9	-13.1	174	-72.7	-9.6	0	0	0	113.7	S340 T346	S340-N342 PolarHBondContact O-N 2.93Å; N342-T346 WeakPolarHBondContact O-CG2 3.32Å; N342-T346 PolarHBondContact O-OG1 2.95Å
343	T	67.1	Low	65.4	Low	73 Å²	73	75.5 Å²	75.5	45%	0.448	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-86.4	-8	178.7	62.4	0	0	0	0	114.1	S340 R341 T346 R350	S340-T343 PolarHBondContact O-N 2.91Å; S340-T343 PolarHBondContact O-OG1 3.37Å; R341-T343 PolarHBondContact O-N 3.35Å; T343-T346 WeakPolarHBondContact CA-OG1 3.24Å; T343-R350 PolarHBondContact O-NH1 2.88Å
344	I	82.5	Confident	67.5	Low	15 Å²	15	66.6 Å²	66.6	8%	0.077	37%	0.368	C	S	.	.	S	Bend	trans	-72	-39.2	-177.3	-57.7	175.6	0	0	0	111.1	A316 D320 R341 I441	A316-I344 HydrophobicContact CB-CD1 4.03Å; A316-I344 HydrophobicContact CB-CG1 4.2Å; A316-I344 HydrophobicContact CB-CG2 4.03Å; D320-I344 HydrophobicContact CB-CD1 3.59Å; R341-I344 HydrophobicContact CG-CD1 4.03Å; R341-I344 WeakPolarHBondContact O-CG1 3.32Å; R341-I344 PolarHBondContact O-N 2.96Å; I344-I441 WeakPolarHBondContact O-CD1 3.26Å
345	F	88.6	Confident	70.1	Confident	9 Å²	9	64.8 Å²	64.8	4%	0.039	36%	0.355	C	S	.	.	S	Bend	trans	-100.4	0.7	-178.2	-59.5	-68.5	0	0	0	113.3	D320 M322 R512 E515 F516	D320-F345 WeakPolarHBondContact O-CZ 3.28Å; M322-F345 HydrophobicContact CB-CE1 4.29Å; M322-F345 HydrophobicContact CB-CZ 4.36Å; M322-F345 HydrophobicContact CE-CD1 4.21Å; M322-F345 HydrophobicContact CE-CE1 4.3Å; F345-R512 HydrophobicContact CB-CB 4.41Å; F345-R512 HydrophobicContact CD2-CB 4.05Å; F345-R512 HydrophobicContact CD2-CG 3.73Å; F345-R512 HydrophobicContact CE2-CG 4.19Å; F345-R512 HydrophobicContact CG-CB 4.11Å; F345-R512 HydrophobicContact CG-CG 4.27Å; F345-E515 CarbonylContact O-C 3.09Å; F345-F516 HydrophobicContact CB-CB 4.13Å; F345-F516 HydrophobicContact CD1-CB 4.16Å; F345-F516 AromaticContact CD1-CD2 3.88Å; F345-F516 HydrophobicContact CD1-CD2 3.88Å; F345-F516 HydrophobicContact CD1-CG 4.15Å; F345-F516 WeakPolarHBondContact O-CA 3.31Å; F345-F516 PolarHBondContact O-N 3.18Å; F345-F516 VanDerWaalsContact O-N 3.1Å
346	T	86.9	Confident	72.6	Confident	28 Å²	28	60.9 Å²	60.9	17%	0.172	35%	0.35	C	S	.	.			trans	-115.4	139.7	-176.5	56.1	0	0	0	0	111.7	N342 T343 E515	N342-T346 WeakPolarHBondContact O-CG2 3.32Å; N342-T346 PolarHBondContact O-OG1 2.95Å; T343-T346 WeakPolarHBondContact CA-OG1 3.24Å; T346-E515 HydrophobicContact CG2-CB 3.84Å; T346-E515 HydrophobicContact CG2-CG 4Å; T346-E515 WeakPolarHBondContact CG2-OE2 3.44Å
347	L	86.9	Confident	75.1	Confident	13 Å²	13	62 Å²	62	7%	0.068	36%	0.356	C	S	.	.			trans	-71.9	-46.6	175.9	-170.4	56.3	0	0	0	112.4	T349 R350 I441 L445 A519 I523	L347-T349 PolarHBondContact O-N 3.09Å; L347-R350 WeakPolarHBondContact O-CB 3.4Å; L347-R350 VanDerWaalsContact O-CG 3.3Å; L347-R350 WeakPolarHBondContact O-CG 3.34Å; L347-R350 PolarHBondContact O-N 3.47Å; L347-I441 HydrophobicContact CD1-CG2 3.94Å; L347-L445 HydrophobicContact CD1-CD1 4.23Å; L347-L445 HydrophobicContact CD1-CD2 4.47Å; L347-A519 HydrophobicContact CB-CB 3.7Å; L347-I523 HydrophobicContact CD1-CD1 3.77Å; L347-I523 HydrophobicContact CD1-CG1 4.17Å; L347-I523 HydrophobicContact CD2-CG1 4.34Å
348	G	85.2	Confident	77.6	Confident	54 Å²	54	62.2 Å²	62.2	56%	0.557	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	49.6	-135.9	-176.8	0	0	0	0	0	112.7	R350	G348-R350 VanDerWaalsContact C-N 3.28Å; G348-R350 PolarHBondContact O-N 3.48Å
349	T	85.7	Confident	80.2	Confident	123 Å²	123	58 Å²	58	76%	0.755	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-76.8	-10.9	175.2	53.1	0	0	0	0	113.4	L347 G351 S352	L347-T349 PolarHBondContact O-N 3.09Å; T349-G351 PolarHBondContact O-N 3.13Å; T349-S352 WeakPolarHBondContact O-CB 3.45Å; T349-S352 PolarHBondContact O-N 3.3Å; T349-S352 PolarHBondContact O-OG 2.65Å
350	R	89.3	Confident	82.6	Confident	29 Å²	29	50.7 Å²	50.7	11%	0.109	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-61.7	-31.1	-175.5	-54	171.6	64.1	-177.2	4.9	112.5	T343 L347 G348 S352 V353 E379 D439 A442 L445	T343-R350 PolarHBondContact O-NH1 2.88Å; L347-R350 WeakPolarHBondContact O-CB 3.4Å; L347-R350 VanDerWaalsContact O-CG 3.3Å; L347-R350 WeakPolarHBondContact O-CG 3.34Å; L347-R350 PolarHBondContact O-N 3.47Å; G348-R350 VanDerWaalsContact C-N 3.28Å; G348-R350 PolarHBondContact O-N 3.48Å; R350-S352 PolarHBondContact O-N 2.89Å; R350-V353 VanDerWaalsContact O-CG1 3.25Å; R350-V353 WeakPolarHBondContact O-CG1 3.3Å; R350-V353 PolarHBondContact O-N 3.4Å; R350-E379 WeakPolarHBondContact CB-OE1 3.43Å; R350-E379 IonicContact CZ-OE1 3.8Å; R350-E379 IonicContact CZ-OE2 2.77Å; R350-E379 IonicContact NE-OE1 2.55Å; R350-E379 PolarHBondContact NE-OE1 3.11Å; R350-E379 IonicContact NE-OE2 3.21Å; R350-E379 VanDerWaalsContact NH2-CD 3.35Å; R350-E379 IonicContact NH2-OE1 2.88Å; R350-E379 PolarHBondContact NH2-OE1 3.05Å; R350-E379 IonicContact NH2-OE2 3.01Å; R350-E379 PolarHBondContact NH2-OE2 3.49Å; R350-D439 IonicContact CZ-OD1 3.31Å; R350-D439 IonicContact CZ-OD2 2.91Å; R350-D439 VanDerWaalsContact CZ-OD2 3.24Å; R350-D439 IonicContact NH1-OD1 2.63Å; R350-D439 PolarHBondContact NH1-OD1 2.96Å; R350-D439 IonicContact NH1-OD2 3.58Å; R350-D439 PolarHBondContact NH1-OD2 3.12Å; R350-D439 IonicContact NH2-OD1 3.87Å; R350-D439 IonicContact NH2-OD2 2.97Å; R350-D439 PolarHBondContact NH2-OD2 3.22Å; R350-A442 VanDerWaalsContact NH2-CB 3.32Å; R350-L445 HydrophobicContact CB-CD1 3.99Å
351	G	88.5	Confident	84.7	Confident	17 Å²	17	50.5 Å²	50.5	18%	0.175	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-63	-18	176.6	0	0	0	0	0	114.2	T349 V353 I354	T349-G351 PolarHBondContact O-N 3.13Å; G351-V353 PolarHBondContact O-N 3.07Å; G351-I354 WeakPolarHBondContact O-CG1 3.46Å; G351-I354 PolarHBondContact O-N 2.89Å
352	S	91.1	Very high	86.8	Confident	43 Å²	43	53.2 Å²	53.2	30%	0.301	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-63.6	-25.2	177.9	69.7	0	0	0	0	112.2	T349 R350 I354 S355 E358	T349-S352 WeakPolarHBondContact O-CB 3.45Å; T349-S352 PolarHBondContact O-N 3.3Å; T349-S352 PolarHBondContact O-OG 2.65Å; R350-S352 PolarHBondContact O-N 2.89Å; S352-I354 PolarHBondContact O-N 3.35Å; S352-I354 VanDerWaalsContact O-N 3.08Å; S352-S355 WeakPolarHBondContact O-CB 3.11Å; S352-S355 PolarHBondContact O-N 2.88Å; S352-S355 PolarHBondContact O-OG 2.93Å; S352-E358 VanDerWaalsContact CB-OE1 3.31Å; S352-E358 WeakPolarHBondContact CB-OE1 3.28Å; S352-E358 WeakPolarHBondContact CB-OE2 3.38Å; S352-E358 WeakPolarHBondContact O-CB 3.45Å; S352-E358 PolarHBondContact OG-OE1 3.46Å; S352-E358 VanDerWaalsContact OG-OE1 3.12Å; S352-E358 PolarHBondContact OG-OE2 2.91Å
353	V	92.8	Very high	88.9	Confident	7 Å²	7	51.2 Å²	51.2	4%	0.042	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-59.6	-25.7	-176.8	78.2	0	0	0	0	114	R350 G351 E358 E379 R383 L445 I449	R350-V353 VanDerWaalsContact O-CG1 3.25Å; R350-V353 WeakPolarHBondContact O-CG1 3.3Å; R350-V353 PolarHBondContact O-N 3.4Å; G351-V353 PolarHBondContact O-N 3.07Å; V353-E358 PolarHBondContact N-OE2 3.31Å; V353-E379 HydrophobicContact CG1-CG 4.08Å; V353-R383 HydrophobicContact CG2-CB 3.7Å; V353-R383 HydrophobicContact CG2-CG 3.85Å; V353-L445 HydrophobicContact CG1-CB 4.31Å; V353-L445 HydrophobicContact CG1-CD1 4.31Å; V353-L445 HydrophobicContact CG1-CD2 4.1Å; V353-L445 HydrophobicContact CG1-CG 4.49Å; V353-I449 HydrophobicContact CG1-CD1 4.05Å; V353-I449 HydrophobicContact CG2-CD1 4.04Å
354	I	93.4	Very high	90.2	Very high	20 Å²	20	49.4 Å²	49.4	10%	0.103	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-97.8	-0.7	177.6	58	163.5	0	0	0	113.4	G351 S352 L445 H448 I449 R452 I523	G351-I354 WeakPolarHBondContact O-CG1 3.46Å; G351-I354 PolarHBondContact O-N 2.89Å; S352-I354 PolarHBondContact O-N 3.35Å; S352-I354 VanDerWaalsContact O-N 3.08Å; I354-L445 HydrophobicContact CD1-CD2 4.14Å; I354-L445 HydrophobicContact CG1-CD2 4.18Å; I354-L445 HydrophobicContact CG2-CD2 3.99Å; I354-H448 HydrophobicContact CG2-CB 4.07Å; I354-I449 HydrophobicContact CG2-CG1 3.85Å; I354-R452 PolarHBondContact O-NE 3.35Å; I354-I523 HydrophobicContact CD1-CB 4.4Å; I354-I523 HydrophobicContact CD1-CG1 4.25Å; I354-I523 HydrophobicContact CD1-CG2 4.02Å
355	S	92.1	Very high	90.6	Very high	30 Å²	30	52.5 Å²	52.5	21%	0.21	32%	0.324	C	S	.	.	S	Bend	trans	-64.7	147.2	173.9	72	0	0	0	0	110.2	S352 T357 E358 L359	S352-S355 WeakPolarHBondContact O-CB 3.11Å; S352-S355 PolarHBondContact O-N 2.88Å; S352-S355 PolarHBondContact O-OG 2.93Å; S355-T357 PolarHBondContact O-N 3.02Å; S355-T357 VanDerWaalsContact O-N 3.15Å; S355-T357 PolarHBondContact OG-OG1 3.47Å; S355-T357 VanDerWaalsContact OG-OG1 3.13Å; S355-E358 PolarHBondContact O-N 3.05Å; S355-E358 WeakPolarHBondContact OG-CB 3.27Å; S355-E358 PolarHBondContact OG-N 2.97Å; S355-L359 WeakPolarHBondContact O-CB 3.32Å; S355-L359 PolarHBondContact O-N 3.28Å
356	P	87.8	Confident	90.6	Very high	117 Å²	117	52.6 Å²	52.6	76%	0.76	33%	0.325	S	S	*	.	H	α-helix	trans	-55.3	-35	179.5	-26.5	34.9	0	0	0	113.4
357	T	89.5	Confident	90.6	Very high	115 Å²	115	55.6 Å²	55.6	71%	0.706	34%	0.337	S	S	*	.	H	α-helix	trans	-69.7	-44.1	179.7	44.5	0	0	0	0	112.6	S355	S355-T357 PolarHBondContact O-N 3.02Å; S355-T357 VanDerWaalsContact O-N 3.15Å; S355-T357 PolarHBondContact OG-OG1 3.47Å; S355-T357 VanDerWaalsContact OG-OG1 3.13Å
358	E	92.6	Very high	90.6	Very high	80 Å²	80	59.1 Å²	59.1	37%	0.374	36%	0.359	S	S	.	.	H	α-helix	trans	-87.1	-22.1	-177.8	-64.1	-169.4	-176.9	0	0	113.1	S352 V353 S355 E360 A361 R383	S352-E358 VanDerWaalsContact CB-OE1 3.31Å; S352-E358 WeakPolarHBondContact CB-OE1 3.28Å; S352-E358 WeakPolarHBondContact CB-OE2 3.38Å; S352-E358 WeakPolarHBondContact O-CB 3.45Å; S352-E358 PolarHBondContact OG-OE1 3.46Å; S352-E358 VanDerWaalsContact OG-OE1 3.12Å; S352-E358 PolarHBondContact OG-OE2 2.91Å; V353-E358 PolarHBondContact N-OE2 3.31Å; S355-E358 PolarHBondContact O-N 3.05Å; S355-E358 WeakPolarHBondContact OG-CB 3.27Å; S355-E358 PolarHBondContact OG-N 2.97Å; E358-E360 VanDerWaalsContact C-N 3.33Å; E358-E360 PolarHBondContact O-N 2.93Å; E358-A361 WeakPolarHBondContact O-CB 3.33Å; E358-A361 PolarHBondContact O-N 3.34Å; E358-R383 WeakPolarHBondContact O-CD 3.38Å; E358-R383 VanDerWaalsContact O-CZ 3.3Å; E358-R383 PolarHBondContact O-NH1 3.11Å
359	L	93.4	Very high	90.6	Very high	11 Å²	11	56.7 Å²	56.7	6%	0.058	33%	0.334	C	S	.	.	H	α-helix	trans	-67.8	-28.3	-179.3	-174.8	80.4	0	0	0	113.4	S355 R383 I449 R452 F453 I456	S355-L359 WeakPolarHBondContact O-CB 3.32Å; S355-L359 PolarHBondContact O-N 3.28Å; L359-R383 PolarHBondContact O-NH1 3.47Å; L359-I449 HydrophobicContact CD1-CG1 4.42Å; L359-I449 HydrophobicContact CD1-CG2 4.41Å; L359-R452 HydrophobicContact CD1-CB 4.26Å; L359-R452 HydrophobicContact CD2-CB 3.59Å; L359-R452 HydrophobicContact CD2-CG 4.22Å; L359-F453 HydrophobicContact CD1-CD1 4.29Å; L359-F453 HydrophobicContact CD1-CE1 3.78Å; L359-F453 HydrophobicContact CD1-CZ 4.29Å; L359-F453 HydrophobicContact CG-CD1 4.4Å; L359-F453 HydrophobicContact CG-CE1 3.87Å; L359-I456 HydrophobicContact CD2-CD1 4.01Å
360	E	93.4	Very high	90.5	Very high	90 Å²	90	54.7 Å²	54.7	42%	0.421	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	10.1	175.1	-66.1	-170.1	-118.2	0	0	112.9	E358 Y387 I456 R460	E358-E360 VanDerWaalsContact C-N 3.33Å; E358-E360 PolarHBondContact O-N 2.93Å; E360-Y387 HydrophobicContact CB-CE2 4.1Å; E360-Y387 HydrophobicContact CG-CE2 3.98Å; E360-Y387 WeakPolarHBondContact O-CE1 3.49Å; E360-Y387 PolarHBondContact O-OH 3.1Å; E360-Y387 VanDerWaalsContact O-OH 3.1Å; E360-I456 HydrophobicContact CG-CD1 3.77Å; E360-R460 IonicContact OE2-NH2 3.98Å
361	A	92.8	Very high	90.2	Very high	29 Å²	29	62.5 Å²	62.5	24%	0.24	35%	0.346	C	S	.	.	S	Bend	trans	-57.2	159.5	176.4	0	0	0	0	0	112.4	E358 R383 Y387	E358-A361 WeakPolarHBondContact O-CB 3.33Å; E358-A361 PolarHBondContact O-N 3.34Å; A361-R383 PolarHBondContact O-NH1 3.41Å; A361-R383 PolarHBondContact O-NH2 3.33Å; A361-Y387 WeakPolarHBondContact O-CE1 3.49Å
362	P	93.6	Very high	90	Very high	117 Å²	117	64.5 Å²	64.5	76%	0.76	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-52.7	147.3	175	-26.9	35.5	0	0	0	112.8	R383	P362-R383 PolarHBondContact O-NH2 2.7Å
363	I	94.4	Very high	89.7	Confident	55 Å²	55	70.6 Å²	70.6	28%	0.282	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-65.1	145.1	177.7	66.1	169.9	0	0	0	110.2	V365 S384 Y387 A388	I363-V365 PolarHBondContact O-N 3.15Å; I363-S384 WeakPolarHBondContact CA-OG 3.44Å; I363-Y387 HydrophobicContact CG2-CD1 3.9Å; I363-A388 HydrophobicContact CD1-CB 4.45Å; I363-A388 HydrophobicContact CG2-CB 3.93Å
364	L	93.2	Very high	89.4	Confident	36 Å²	36	75.3 Å²	75.3	19%	0.188	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-60.5	136.9	174.5	-63.6	177	0	0	0	109.8	Y303 L307 P366 Y376 L381 S384	Y303-L364 WeakPolarHBondContact CE2-O 3.5Å; Y303-L364 PolarHBondContact OH-O 2.98Å; L307-L364 HydrophobicContact CD2-CB 3.99Å; L307-L364 HydrophobicContact CD2-CD1 4.4Å; L364-P366 WeakPolarHBondContact O-CD 3.43Å; L364-Y376 HydrophobicContact CD1-CD1 4.16Å; L364-Y376 HydrophobicContact CD1-CD2 4.33Å; L364-Y376 HydrophobicContact CD1-CE1 4.36Å; L364-Y376 HydrophobicContact CD1-CG 4.14Å; L364-Y376 HydrophobicContact CD2-CD1 4.38Å; L364-Y376 HydrophobicContact CD2-CE1 3.79Å; L364-Y376 HydrophobicContact CD2-CE2 4.46Å; L364-L381 HydrophobicContact CD1-CD2 3.87Å; L364-S384 PolarHBondContact N-OG 3.48Å
365	V	92.4	Very high	89.1	Confident	80 Å²	80	78.6 Å²	78.6	49%	0.485	42%	0.422	S	S	.	.			trans	-102.8	101.1	175.9	-179.4	0	0	0	0	108	I363 H367 T368 A369	I363-V365 PolarHBondContact O-N 3.15Å; V365-H367 PolarHBondContact O-N 3.33Å; V365-H367 VanDerWaalsContact O-N 3.11Å; V365-T368 HydrophobicContact CB-CG2 4.41Å; V365-T368 WeakPolarHBondContact CB-OG1 3.41Å; V365-T368 HydrophobicContact CG1-CG2 3.94Å; V365-T368 PolarHBondContact O-N 3.44Å; V365-T368 VanDerWaalsContact O-N 3.16Å; V365-T368 PolarHBondContact O-OG1 3.17Å; V365-A369 PolarHBondContact O-N 3.03Å
366	P	88.5	Confident	89.1	Confident	10 Å²	10	79 Å²	79	7%	0.065	42%	0.42	C	S	.	.	H	α-helix	trans	-60.1	-32.8	-168.7	-27.3	35	0	0	0	113.9	Y303 R306 L307 L364 A369 Q370	Y303-P366 HydrophobicContact CD2-CG 4.14Å; Y303-P366 HydrophobicContact CE2-CG 3.89Å; R306-P366 HydrophobicContact CB-CB 3.6Å; R306-P366 HydrophobicContact CB-CG 3.85Å; L307-P366 HydrophobicContact CD2-CG 3.91Å; L307-P366 HydrophobicContact CG-CG 4.12Å; L364-P366 WeakPolarHBondContact O-CD 3.43Å; P366-A369 PolarHBondContact O-N 3.4Å; P366-Q370 WeakPolarHBondContact O-CB 3.32Å; P366-Q370 VanDerWaalsContact O-CG 3.23Å; P366-Q370 WeakPolarHBondContact O-CG 3.31Å; P366-Q370 PolarHBondContact O-N 2.87Å
367	H	85.6	Confident	89.3	Confident	92 Å²	92	74.7 Å²	74.7	43%	0.426	39%	0.392	S	S	.	.	H	α-helix	trans	-72.8	-32.9	-178	176.4	-96.5	0	0	0	113.1	V365 R371	V365-H367 PolarHBondContact O-N 3.33Å; V365-H367 VanDerWaalsContact O-N 3.11Å; H367-R371 PolarHBondContact CE1-NE 3.44Å; H367-R371 PolarHBondContact CE1-NH2 3.47Å; H367-R371 PolarHBondContact NE2-NE 3Å; H367-R371 PolarHBondContact NE2-NH2 3.05Å; H367-R371 WeakPolarHBondContact O-CG 3.33Å; H367-R371 PolarHBondContact O-N 3.25Å
368	T	87.3	Confident	89.4	Confident	87 Å²	87	69.8 Å²	69.8	53%	0.534	36%	0.36	S	S	.	.	H	α-helix	trans	-72.7	-41.1	173.7	54.7	0	0	0	0	110.3	V365 Q370 R371 G372	V365-T368 HydrophobicContact CB-CG2 4.41Å; V365-T368 WeakPolarHBondContact CB-OG1 3.41Å; V365-T368 HydrophobicContact CG1-CG2 3.94Å; V365-T368 PolarHBondContact O-N 3.44Å; V365-T368 VanDerWaalsContact O-N 3.16Å; V365-T368 PolarHBondContact O-OG1 3.17Å; T368-Q370 PolarHBondContact O-N 3.18Å; T368-R371 PolarHBondContact O-N 3.28Å; T368-G372 PolarHBondContact O-N 3.33Å
369	A	84.8	Confident	89.5	Confident	3 Å²	3	66 Å²	66	3%	0.025	34%	0.343	C	S	.	.	H	α-helix	trans	-59	-45.1	174.3	0	0	0	0	0	112.3	V310 V365 P366 R371 G372 E373 Q374 Y376	V310-A369 HydrophobicContact CB-CB 4.5Å; V310-A369 HydrophobicContact CG1-CB 4.07Å; V365-A369 PolarHBondContact O-N 3.03Å; P366-A369 PolarHBondContact O-N 3.4Å; A369-R371 PolarHBondContact O-N 2.81Å; A369-G372 CarbonylContact O-C 3.59Å; A369-G372 PolarHBondContact O-N 2.8Å; A369-E373 PolarHBondContact O-N 3.49Å; A369-E373 VanDerWaalsContact O-N 3.08Å; A369-Q374 PolarHBondContact O-N 3.43Å; A369-Y376 HydrophobicContact CB-CE2 3.8Å
370	Q	83.9	Confident	89.6	Confident	81 Å²	81	66.4 Å²	66.4	38%	0.379	35%	0.348	S	S	.	.	H	α-helix	trans	-61.5	-41.8	176.5	-77.4	173.8	-13.5	0	0	112.7	V310 P366 T368 G372 E373	V310-Q370 HydrophobicContact CG1-CG 3.44Å; V310-Q370 VanDerWaalsContact CG1-CG 3.44Å; P366-Q370 WeakPolarHBondContact O-CB 3.32Å; P366-Q370 VanDerWaalsContact O-CG 3.23Å; P366-Q370 WeakPolarHBondContact O-CG 3.31Å; P366-Q370 PolarHBondContact O-N 2.87Å; T368-Q370 PolarHBondContact O-N 3.18Å; Q370-G372 VanDerWaalsContact C-N 3.32Å; Q370-E373 PolarHBondContact O-N 3.07Å
371	R	83.8	Confident	89.7	Confident	193 Å²	193	62.2 Å²	62.2	73%	0.728	33%	0.328	S	S	*	.	H	α-helix	trans	-67.4	-33.4	177.3	-75.9	-177.5	178.3	-166.5	-2	113	H367 T368 A369 E373	H367-R371 PolarHBondContact CE1-NE 3.44Å; H367-R371 PolarHBondContact CE1-NH2 3.47Å; H367-R371 PolarHBondContact NE2-NE 3Å; H367-R371 PolarHBondContact NE2-NH2 3.05Å; H367-R371 WeakPolarHBondContact O-CG 3.33Å; H367-R371 PolarHBondContact O-N 3.25Å; T368-R371 PolarHBondContact O-N 3.28Å; A369-R371 PolarHBondContact O-N 2.81Å; R371-E373 VanDerWaalsContact C-N 3.31Å
372	G	83.9	Confident	89.9	Confident	59 Å²	59	61 Å²	61	61%	0.608	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	7.1	176.5	0	0	0	0	0	114.3	T368 A369 Q370 Q374	T368-G372 PolarHBondContact O-N 3.33Å; A369-G372 CarbonylContact O-C 3.59Å; A369-G372 PolarHBondContact O-N 2.8Å; Q370-G372 VanDerWaalsContact C-N 3.32Å; G372-Q374 PolarHBondContact O-N 3.33Å
373	E	84.1	Confident	90.1	Very high	170 Å²	170	56 Å²	56	79%	0.794	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	24.1	-173.9	-62.4	-176.9	173.6	0	0	114.3	A369 Q370 R371	A369-E373 PolarHBondContact O-N 3.49Å; A369-E373 VanDerWaalsContact O-N 3.08Å; Q370-E373 PolarHBondContact O-N 3.07Å; R371-E373 VanDerWaalsContact C-N 3.31Å
374	Q	87.1	Confident	90.2	Very high	106 Å²	106	53.4 Å²	53.4	50%	0.495	27%	0.27	S	S	.	.			trans	-81.7	125.8	-177.4	-165.5	171.2	6.8	0	0	110.2	A369 G372 Y376	A369-Q374 PolarHBondContact O-N 3.43Å; G372-Q374 PolarHBondContact O-N 3.33Å; Q374-Y376 HydrophobicContact CB-CE2 4.27Å; Q374-Y376 HydrophobicContact CG-CE1 4.45Å; Q374-Y376 HydrophobicContact CG-CE2 3.91Å; Q374-Y376 PolarHBondContact NE2-OH 3.31Å; Q374-Y376 PolarHBondContact OE1-OH 3.45Å; Q374-Y376 VanDerWaalsContact OE1-OH 3.05Å
375	R	87.8	Confident	90.3	Very high	89 Å²	89	52 Å²	52	34%	0.336	26%	0.263	S	S	.	.			trans	-110.6	152.2	177.3	-58.5	-61.5	-172	128.9	8.5	110.8	K309 V310 Q311 Y312 E313	K309-R375 PolarHBondContact O-NH1 3.37Å; V310-R375 CarbonylContact O-C 3.13Å; V310-R375 VanDerWaalsContact O-CA 3.24Å; V310-R375 WeakPolarHBondContact O-CA 3.22Å; Q311-R375 PolarHBondContact O-NH1 2.91Å; Q311-R375 VanDerWaalsContact O-NH1 3.14Å; Y312-R375 HydrophobicContact CD1-CB 3.38Å; Y312-R375 HydrophobicContact CD1-CG 4.37Å; Y312-R375 HydrophobicContact CE1-CB 3.49Å; Y312-R375 VanDerWaalsContact CE1-CB 3.49Å; Y312-R375 HydrophobicContact CG-CB 4.22Å; Y312-R375 PolarHBondContact OH-O 3.06Å; E313-R375 IonicContact OE1-CZ 2.58Å; E313-R375 IonicContact OE1-NH1 3.62Å; E313-R375 IonicContact OE1-NH2 3.53Å; E313-R375 PolarHBondContact OE1-NH2 3.49Å
376	Y	90.8	Very high	90.5	Very high	40 Å²	40	48.3 Å²	48.3	16%	0.157	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-130.6	150.8	-174.7	-63.7	-89.5	0	0	0	111.6	V310 Q311 Y312 L364 A369 Q374 A380 L381	V310-Y376 HydrophobicContact CB-CD2 4.47Å; V310-Y376 HydrophobicContact CG2-CD2 4.23Å; V310-Y376 PolarHBondContact O-N 2.98Å; Q311-Y376 WeakPolarHBondContact CA-O 3.35Å; Y312-Y376 VanDerWaalsContact CD2-C 3.41Å; Y312-Y376 WeakPolarHBondContact CD2-O 3.48Å; Y312-Y376 PolarHBondContact N-O 3Å; L364-Y376 HydrophobicContact CD1-CD1 4.16Å; L364-Y376 HydrophobicContact CD1-CD2 4.33Å; L364-Y376 HydrophobicContact CD1-CE1 4.36Å; L364-Y376 HydrophobicContact CD1-CG 4.14Å; L364-Y376 HydrophobicContact CD2-CD1 4.38Å; L364-Y376 HydrophobicContact CD2-CE1 3.79Å; L364-Y376 HydrophobicContact CD2-CE2 4.46Å; A369-Y376 HydrophobicContact CB-CE2 3.8Å; Q374-Y376 HydrophobicContact CB-CE2 4.27Å; Q374-Y376 HydrophobicContact CG-CE1 4.45Å; Q374-Y376 HydrophobicContact CG-CE2 3.91Å; Q374-Y376 PolarHBondContact NE2-OH 3.31Å; Q374-Y376 PolarHBondContact OE1-OH 3.45Å; Q374-Y376 VanDerWaalsContact OE1-OH 3.05Å; Y376-A380 HydrophobicContact CD1-CB 4.45Å; Y376-L381 HydrophobicContact CG-CD2 4.44Å
377	P	91.7	Very high	90.9	Very high	25 Å²	25	49.2 Å²	49.2	16%	0.162	24%	0.242	C	C	.	.			trans	-73.9	159.9	170.4	35.7	-35.9	0	0	0	110.2	Y312 E379 A380 L381	Y312-P377 HydrophobicContact CD2-CB 4.05Å; Y312-P377 HydrophobicContact CE2-CB 4.01Å; Y312-P377 HydrophobicContact CE2-CG 4.32Å; Y312-P377 VanDerWaalsContact CE2-N 3.33Å; P377-E379 VanDerWaalsContact C-N 3.33Å; P377-E379 VanDerWaalsContact CB-OE1 3.23Å; P377-E379 WeakPolarHBondContact CB-OE1 3.35Å; P377-E379 VanDerWaalsContact CG-OE1 3.25Å; P377-E379 WeakPolarHBondContact CG-OE1 3.36Å; P377-E379 PolarHBondContact O-N 3.5Å; P377-A380 HydrophobicContact CG-CB 4.13Å; P377-A380 WeakPolarHBondContact O-CB 3.13Å; P377-A380 PolarHBondContact O-N 3.49Å; P377-A380 VanDerWaalsContact O-N 3.15Å; P377-L381 PolarHBondContact O-N 2.79Å
378	F	93.1	Very high	91.4	Very high	12 Å²	12	45 Å²	45	5%	0.053	22%	0.224	C	C	.	.	H	α-helix	trans	-60.3	-41.2	-171.8	176	-103	0	0	0	112.9	M308 A380 L381 F382 L430 Y433	M308-F378 HydrophobicContact CE-CD2 4.3Å; M308-F378 HydrophobicContact CE-CE2 4.25Å; M308-F378 HydrophobicContact SD-CE2 4.41Å; F378-A380 PolarHBondContact O-N 3.35Å; F378-L381 WeakPolarHBondContact O-CB 3.26Å; F378-L381 PolarHBondContact O-N 3.09Å; F378-F382 HydrophobicContact CD1-CB 4.44Å; F378-F382 HydrophobicContact CE1-CB 4.11Å; F378-F382 HydrophobicContact CE1-CD2 4.04Å; F378-F382 HydrophobicContact CE1-CG 4.42Å; F378-F382 HydrophobicContact CZ-CB 4.36Å; F378-F382 HydrophobicContact CZ-CD2 4.12Å; F378-F382 WeakPolarHBondContact O-CB 3.15Å; F378-F382 PolarHBondContact O-N 3.31Å; F378-L430 HydrophobicContact CZ-CD1 4.32Å; F378-Y433 HydrophobicContact CB-CE1 4.39Å; F378-Y433 WeakPolarHBondContact CB-OH 3.28Å; F378-Y433 HydrophobicContact CD1-CD1 4.17Å; F378-Y433 AromaticContact CD1-CE1 3.43Å; F378-Y433 HydrophobicContact CD1-CE1 3.43Å; F378-Y433 VanDerWaalsContact CD1-CE1 3.43Å; F378-Y433 AromaticContact CD1-CZ 3.77Å; F378-Y433 HydrophobicContact CD2-CD1 4.14Å; F378-Y433 HydrophobicContact CD2-CD2 4.02Å; F378-Y433 AromaticContact CD2-CE1 3.61Å; F378-Y433 HydrophobicContact CD2-CE1 3.61Å; F378-Y433 AromaticContact CD2-CE2 3.46Å; F378-Y433 HydrophobicContact CD2-CE2 3.46Å; F378-Y433 VanDerWaalsContact CD2-CE2 3.46Å; F378-Y433 HydrophobicContact CD2-CG 4.33Å; F378-Y433 AromaticContact CD2-CZ 3.24Å; F378-Y433 AromaticContact CE1-CD1 3.66Å; F378-Y433 HydrophobicContact CE1-CD1 3.66Å; F378-Y433 AromaticContact CE1-CE1 3.41Å; F378-Y433 HydrophobicContact CE1-CE1 3.41Å; F378-Y433 VanDerWaalsContact CE1-CE1 3.41Å; F378-Y433 AromaticContact CE2-CD1 3.63Å; F378-Y433 HydrophobicContact CE2-CD1 3.63Å; F378-Y433 AromaticContact CE2-CD2 3.7Å; F378-Y433 HydrophobicContact CE2-CD2 3.7Å; F378-Y433 AromaticContact CE2-CE1 3.59Å; F378-Y433 HydrophobicContact CE2-CE1 3.59Å; F378-Y433 AromaticContact CE2-CE2 3.65Å; F378-Y433 HydrophobicContact CE2-CE2 3.65Å; F378-Y433 AromaticContact CE2-CG 3.69Å; F378-Y433 HydrophobicContact CE2-CG 3.69Å; F378-Y433 AromaticContact CE2-CZ 3.61Å; F378-Y433 HydrophobicContact CG-CD1 4.38Å; F378-Y433 AromaticContact CG-CE1 3.52Å; F378-Y433 HydrophobicContact CG-CE1 3.52Å; F378-Y433 HydrophobicContact CG-CE2 4.04Å; F378-Y433 AromaticContact CG-CZ 3.32Å; F378-Y433 WeakPolarHBondContact CG-OH 3.35Å; F378-Y433 AromaticContact CZ-CD1 3.35Å; F378-Y433 HydrophobicContact CZ-CD1 3.35Å; F378-Y433 HydrophobicContact CZ-CD2 4.28Å; F378-Y433 AromaticContact CZ-CE1 3.48Å; F378-Y433 HydrophobicContact CZ-CE1 3.48Å; F378-Y433 VanDerWaalsContact CZ-CE1 3.48Å; F378-Y433 HydrophobicContact CZ-CE2 4.37Å; F378-Y433 AromaticContact CZ-CG 3.8Å; F378-Y433 HydrophobicContact CZ-CG 3.8Å
379	E	94.5	Very high	91.8	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-60	-30	-180	64.5	-82.2	-174.7	0	0	113.1	R350 V353 P377 R383 A442 L445 I449	R350-E379 WeakPolarHBondContact CB-OE1 3.43Å; R350-E379 IonicContact CZ-OE1 3.8Å; R350-E379 IonicContact CZ-OE2 2.77Å; R350-E379 IonicContact NE-OE1 2.55Å; R350-E379 PolarHBondContact NE-OE1 3.11Å; R350-E379 IonicContact NE-OE2 3.21Å; R350-E379 VanDerWaalsContact NH2-CD 3.35Å; R350-E379 IonicContact NH2-OE1 2.88Å; R350-E379 PolarHBondContact NH2-OE1 3.05Å; R350-E379 IonicContact NH2-OE2 3.01Å; R350-E379 PolarHBondContact NH2-OE2 3.49Å; V353-E379 HydrophobicContact CG1-CG 4.08Å; P377-E379 VanDerWaalsContact C-N 3.33Å; P377-E379 VanDerWaalsContact CB-OE1 3.23Å; P377-E379 WeakPolarHBondContact CB-OE1 3.35Å; P377-E379 VanDerWaalsContact CG-OE1 3.25Å; P377-E379 WeakPolarHBondContact CG-OE1 3.36Å; P377-E379 PolarHBondContact O-N 3.5Å; E379-R383 VanDerWaalsContact O-CB 3.25Å; E379-R383 WeakPolarHBondContact O-CB 3.5Å; E379-R383 PolarHBondContact O-N 2.85Å; E379-A442 WeakPolarHBondContact OE2-CB 3.46Å; E379-L445 HydrophobicContact CB-CB 3.97Å; E379-L445 HydrophobicContact CG-CB 4.16Å; E379-L445 HydrophobicContact CG-CD1 3.8Å; E379-I449 HydrophobicContact CB-CD1 4.41Å
380	A	94.9	Very high	92.3	Very high	20 Å²	20	40.8 Å²	40.8	17%	0.165	20%	0.197	C	C	.	.	H	α-helix	trans	-72.9	-38.8	175.4	0	0	0	0	0	111.8	Y376 P377 F378 S384	Y376-A380 HydrophobicContact CD1-CB 4.45Å; P377-A380 HydrophobicContact CG-CB 4.13Å; P377-A380 WeakPolarHBondContact O-CB 3.13Å; P377-A380 PolarHBondContact O-N 3.49Å; P377-A380 VanDerWaalsContact O-N 3.15Å; F378-A380 PolarHBondContact O-N 3.35Å; A380-S384 WeakPolarHBondContact O-CB 3.32Å; A380-S384 PolarHBondContact O-N 2.94Å
381	L	95.4	Very high	92.8	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-65.3	-46.2	172.9	-55.5	-177.3	0	0	0	110.7	L307 M308 V310 Q311 L364 Y376 P377 F378 R383 S384 Q385	L307-L381 HydrophobicContact CB-CD2 4.38Å; L307-L381 HydrophobicContact CD2-CD2 3.98Å; L307-L381 WeakPolarHBondContact O-CD1 3.27Å; M308-L381 HydrophobicContact SD-CD1 4.36Å; V310-L381 HydrophobicContact CG2-CD2 3.92Å; Q311-L381 HydrophobicContact CB-CD1 3.69Å; Q311-L381 HydrophobicContact CG-CD1 4.04Å; L364-L381 HydrophobicContact CD1-CD2 3.87Å; Y376-L381 HydrophobicContact CG-CD2 4.44Å; P377-L381 PolarHBondContact O-N 2.79Å; F378-L381 WeakPolarHBondContact O-CB 3.26Å; F378-L381 PolarHBondContact O-N 3.09Å; L381-R383 PolarHBondContact O-N 2.69Å; L381-S384 PolarHBondContact O-N 2.68Å; L381-Q385 WeakPolarHBondContact O-CB 3.46Å; L381-Q385 PolarHBondContact O-N 3.39Å
382	F	97.1	Very high	93.2	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.009	15%	0.154	C	C	.	.	H	α-helix	trans	-57.9	-48.4	176.6	-179.6	-84.9	0	0	0	111	F378 S384 Q385 H386 L430 C446 I449 V450 V472 L476	F378-F382 HydrophobicContact CD1-CB 4.44Å; F378-F382 HydrophobicContact CE1-CB 4.11Å; F378-F382 HydrophobicContact CE1-CD2 4.04Å; F378-F382 HydrophobicContact CE1-CG 4.42Å; F378-F382 HydrophobicContact CZ-CB 4.36Å; F378-F382 HydrophobicContact CZ-CD2 4.12Å; F378-F382 WeakPolarHBondContact O-CB 3.15Å; F378-F382 PolarHBondContact O-N 3.31Å; F382-S384 PolarHBondContact O-N 3.24Å; F382-Q385 PolarHBondContact O-N 3.24Å; F382-H386 AromaticContact CD1-ND1 3.78Å; F382-H386 AromaticContact CD2-CE1 3.5Å; F382-H386 VanDerWaalsContact CD2-CE1 3.5Å; F382-H386 WeakPolarHBondContact CD2-CE1 3.32Å; F382-H386 AromaticContact CD2-ND1 3.57Å; F382-H386 AromaticContact CE1-ND1 3.69Å; F382-H386 AromaticContact CE2-CE1 3.14Å; F382-H386 WeakPolarHBondContact CE2-CE1 3.4Å; F382-H386 AromaticContact CE2-ND1 3.49Å; F382-H386 WeakPolarHBondContact CE2-ND1 3.32Å; F382-H386 AromaticContact CE2-NE2 3.92Å; F382-H386 AromaticContact CG-ND1 3.71Å; F382-H386 AromaticContact CZ-CE1 3.48Å; F382-H386 VanDerWaalsContact CZ-CE1 3.48Å; F382-H386 WeakPolarHBondContact CZ-CE1 3.27Å; F382-H386 AromaticContact CZ-ND1 3.54Å; F382-H386 AromaticContact CZ-NE2 3.97Å; F382-H386 WeakPolarHBondContact O-CB 3.41Å; F382-H386 PolarHBondContact O-N 3.12Å; F382-H386 PolarHBondContact O-ND1 3.21Å; F382-L430 HydrophobicContact CD2-CD1 4.18Å; F382-L430 HydrophobicContact CE2-CD1 3.82Å; F382-L430 HydrophobicContact CE2-CD2 4.1Å; F382-C446 HydrophobicContact CD1-CB 3.89Å; F382-C446 HydrophobicContact CD2-CB 4.43Å; F382-C446 HydrophobicContact CE1-CB 3.85Å; F382-C446 HydrophobicContact CE2-CB 4.37Å; F382-C446 HydrophobicContact CG-CB 4.2Å; F382-C446 VanDerWaalsContact CG-SG 3.57Å; F382-C446 HydrophobicContact CZ-CB 4.09Å; F382-I449 HydrophobicContact CD1-CD1 4.27Å; F382-I449 HydrophobicContact CD1-CG2 4.28Å; F382-I449 HydrophobicContact CE1-CB 4.44Å; F382-I449 HydrophobicContact CE1-CG2 4.17Å; F382-V450 HydrophobicContact CE1-CG2 3.77Å; F382-V450 HydrophobicContact CZ-CG2 3.7Å; F382-V472 HydrophobicContact CZ-CG1 3.98Å; F382-L476 HydrophobicContact CZ-CD1 4.3Å
383	R	97.2	Very high	93.8	Very high	14 Å²	14	26.6 Å²	26.6	5%	0.053	13%	0.125	C	C	.	.	H	α-helix	trans	-55.1	-51.1	174.2	-173.1	-132.2	85.1	96.2	5	111	V353 E358 L359 A361 P362 E379 L381 Q385 H386 Y387 I449 F453	V353-R383 HydrophobicContact CG2-CB 3.7Å; V353-R383 HydrophobicContact CG2-CG 3.85Å; E358-R383 WeakPolarHBondContact O-CD 3.38Å; E358-R383 VanDerWaalsContact O-CZ 3.3Å; E358-R383 PolarHBondContact O-NH1 3.11Å; L359-R383 PolarHBondContact O-NH1 3.47Å; A361-R383 PolarHBondContact O-NH1 3.41Å; A361-R383 PolarHBondContact O-NH2 3.33Å; P362-R383 PolarHBondContact O-NH2 2.7Å; E379-R383 VanDerWaalsContact O-CB 3.25Å; E379-R383 WeakPolarHBondContact O-CB 3.5Å; E379-R383 PolarHBondContact O-N 2.85Å; L381-R383 PolarHBondContact O-N 2.69Å; R383-Q385 PolarHBondContact O-N 3.39Å; R383-H386 PolarHBondContact O-N 3.06Å; R383-Y387 WeakPolarHBondContact O-CB 3.23Å; R383-Y387 PolarHBondContact O-N 3.33Å; R383-I449 HydrophobicContact CB-CD1 3.86Å; R383-I449 HydrophobicContact CG-CD1 4.37Å; R383-I449 HydrophobicContact CG-CG2 4.45Å; R383-F453 HydrophobicContact CG-CZ 4.18Å
384	S	96.6	Very high	94.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-61.3	-45.9	-177.8	-169.1	0	0	0	0	112.7	Y303 I363 L364 A380 L381 F382 A388	Y303-S384 PolarHBondContact OH-OG 2.91Å; I363-S384 WeakPolarHBondContact CA-OG 3.44Å; L364-S384 PolarHBondContact N-OG 3.48Å; A380-S384 WeakPolarHBondContact O-CB 3.32Å; A380-S384 PolarHBondContact O-N 2.94Å; L381-S384 PolarHBondContact O-N 2.68Å; F382-S384 PolarHBondContact O-N 3.24Å; S384-A388 WeakPolarHBondContact O-CB 3.13Å; S384-A388 PolarHBondContact O-N 3.2Å; S384-A388 VanDerWaalsContact O-N 3.1Å
385	Q	96	Very high	94.5	Very high	6 Å²	6	17.8 Å²	17.8	3%	0.028	8%	0.08	C	C	.	.	H	α-helix	trans	-62.4	-49.4	177.3	179.5	-176.8	6	0	0	111.9	L304 L307 L381 F382 R383 A388 L389 T426	L304-Q385 VanDerWaalsContact CD1-OE1 3.23Å; L307-Q385 HydrophobicContact CD1-CB 4.06Å; L381-Q385 WeakPolarHBondContact O-CB 3.46Å; L381-Q385 PolarHBondContact O-N 3.39Å; F382-Q385 PolarHBondContact O-N 3.24Å; R383-Q385 PolarHBondContact O-N 3.39Å; Q385-A388 WeakPolarHBondContact O-CB 3.02Å; Q385-A388 PolarHBondContact O-N 3.26Å; Q385-L389 WeakPolarHBondContact O-CB 3.29Å; Q385-L389 PolarHBondContact O-N 2.97Å; Q385-T426 VanDerWaalsContact NE2-CG2 3.31Å
386	H	97.1	Very high	94.9	Very high	2 Å²	2	13.6 Å²	13.6	1%	0.009	6%	0.064	C	C	.	.	H	α-helix	trans	-74.3	-28.5	-175.8	-74.8	88.3	0	0	0	112.5	F382 R383 L389 L390 F453 Y468 W469	F382-H386 AromaticContact CD1-ND1 3.78Å; F382-H386 AromaticContact CD2-CE1 3.5Å; F382-H386 VanDerWaalsContact CD2-CE1 3.5Å; F382-H386 WeakPolarHBondContact CD2-CE1 3.32Å; F382-H386 AromaticContact CD2-ND1 3.57Å; F382-H386 AromaticContact CE1-ND1 3.69Å; F382-H386 AromaticContact CE2-CE1 3.14Å; F382-H386 WeakPolarHBondContact CE2-CE1 3.4Å; F382-H386 AromaticContact CE2-ND1 3.49Å; F382-H386 WeakPolarHBondContact CE2-ND1 3.32Å; F382-H386 AromaticContact CE2-NE2 3.92Å; F382-H386 AromaticContact CG-ND1 3.71Å; F382-H386 AromaticContact CZ-CE1 3.48Å; F382-H386 VanDerWaalsContact CZ-CE1 3.48Å; F382-H386 WeakPolarHBondContact CZ-CE1 3.27Å; F382-H386 AromaticContact CZ-ND1 3.54Å; F382-H386 AromaticContact CZ-NE2 3.97Å; F382-H386 WeakPolarHBondContact O-CB 3.41Å; F382-H386 PolarHBondContact O-N 3.12Å; F382-H386 PolarHBondContact O-ND1 3.21Å; R383-H386 PolarHBondContact O-N 3.06Å; H386-L389 PolarHBondContact O-N 3.29Å; H386-L390 VanDerWaalsContact O-CB 3.29Å; H386-L390 WeakPolarHBondContact O-CB 3.23Å; H386-L390 PolarHBondContact O-N 3.17Å; H386-F453 HydrophobicContact CB-CD2 3.92Å; H386-F453 HydrophobicContact CB-CE2 3.61Å; H386-Y468 AromaticContact CD2-CE1 3.96Å; H386-Y468 PolarHBondContact CD2-OH 3.29Å; H386-Y468 VanDerWaalsContact CD2-OH 3.3Å; H386-Y468 AromaticContact NE2-CZ 3.94Å; H386-Y468 PolarHBondContact NE2-OH 2.96Å; H386-W469 HydrophobicContact CB-CH2 4.33Å; H386-W469 HydrophobicContact CB-CZ3 4.35Å; H386-W469 AromaticContact CD2-CZ3 3.7Å
387	Y	96.9	Very high	95.1	Very high	29 Å²	29	12.5 Å²	12.5	11%	0.114	6%	0.06	C	C	.	.	H	α-helix	trans	-66.1	-45.9	170.4	-174	-120.8	0	0	0	111.1	E360 A361 I363 R383 L389 L390 D391 F453	E360-Y387 HydrophobicContact CB-CE2 4.1Å; E360-Y387 HydrophobicContact CG-CE2 3.98Å; E360-Y387 WeakPolarHBondContact O-CE1 3.49Å; E360-Y387 PolarHBondContact O-OH 3.1Å; E360-Y387 VanDerWaalsContact O-OH 3.1Å; A361-Y387 WeakPolarHBondContact O-CE1 3.49Å; I363-Y387 HydrophobicContact CG2-CD1 3.9Å; R383-Y387 WeakPolarHBondContact O-CB 3.23Å; R383-Y387 PolarHBondContact O-N 3.33Å; Y387-L389 VanDerWaalsContact C-N 3.25Å; Y387-L389 PolarHBondContact O-N 2.97Å; Y387-L390 HydrophobicContact CD2-CD2 4.49Å; Y387-L390 PolarHBondContact O-N 3.25Å; Y387-D391 VanDerWaalsContact O-CB 3.29Å; Y387-D391 WeakPolarHBondContact O-CB 3.35Å; Y387-D391 PolarHBondContact O-N 3.22Å; Y387-F453 AromaticContact CD2-CE1 3.93Å; Y387-F453 HydrophobicContact CD2-CE1 3.93Å; Y387-F453 HydrophobicContact CD2-CZ 4.16Å; Y387-F453 HydrophobicContact CG-CZ 4.38Å
388	A	94.8	Very high	95.2	Very high	5 Å²	5	15 Å²	15	4%	0.041	7%	0.072	C	C	.	.	H	α-helix	trans	-57.2	-42.8	173.1	0	0	0	0	0	111	Y300 Y303 I363 S384 Q385 N392	Y300-A388 HydrophobicContact CE1-CB 4.11Å; Y300-A388 PolarHBondContact OH-O 3.24Å; Y303-A388 HydrophobicContact CE1-CB 4.48Å; I363-A388 HydrophobicContact CD1-CB 4.45Å; I363-A388 HydrophobicContact CG2-CB 3.93Å; S384-A388 WeakPolarHBondContact O-CB 3.13Å; S384-A388 PolarHBondContact O-N 3.2Å; S384-A388 VanDerWaalsContact O-N 3.1Å; Q385-A388 WeakPolarHBondContact O-CB 3.02Å; Q385-A388 PolarHBondContact O-N 3.26Å; A388-N392 VanDerWaalsContact O-CB 3.32Å; A388-N392 WeakPolarHBondContact O-CB 3.42Å; A388-N392 PolarHBondContact O-N 3.1Å; A388-N392 VanDerWaalsContact O-N 3.11Å; A388-N392 PolarHBondContact O-ND2 3.18Å
389	L	95.4	Very high	95.3	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.3	-48.2	178.6	-172	65.4	0	0	0	112.6	Y300 Q385 H386 Y387 S393 M419 T422 L423 Y468	Y300-L389 HydrophobicContact CE1-CB 4.05Å; Y300-L389 HydrophobicContact CE1-CD1 4.07Å; Y300-L389 HydrophobicContact CE2-CD1 4.21Å; Y300-L389 VanDerWaalsContact OH-CA 3.23Å; Y300-L389 WeakPolarHBondContact OH-CA 3.45Å; Y300-L389 PolarHBondContact OH-N 3.05Å; Q385-L389 WeakPolarHBondContact O-CB 3.29Å; Q385-L389 PolarHBondContact O-N 2.97Å; H386-L389 PolarHBondContact O-N 3.29Å; Y387-L389 VanDerWaalsContact C-N 3.25Å; Y387-L389 PolarHBondContact O-N 2.97Å; L389-S393 WeakPolarHBondContact O-CB 3.46Å; L389-S393 PolarHBondContact O-N 2.95Å; L389-S393 PolarHBondContact O-OG 3.34Å; L389-M419 HydrophobicContact CD1-CE 3.79Å; L389-T422 HydrophobicContact CD1-CG2 4.2Å; L389-L423 HydrophobicContact CD1-CD2 3.9Å; L389-L423 HydrophobicContact CD2-CD2 3.76Å; L389-L423 HydrophobicContact CG-CD2 4.08Å; L389-Y468 HydrophobicContact CD2-CE1 3.67Å; L389-Y468 HydrophobicContact CD2-CE2 4.26Å; L389-Y468 WeakPolarHBondContact CD2-OH 3.05Å
390	L	96.1	Very high	95.3	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-56.1	-53.9	175.9	171.7	65.5	0	0	0	110.5	H386 Y387 N392 S393 C394 F453 I456 A457 L465 W469	H386-L390 VanDerWaalsContact O-CB 3.29Å; H386-L390 WeakPolarHBondContact O-CB 3.23Å; H386-L390 PolarHBondContact O-N 3.17Å; Y387-L390 HydrophobicContact CD2-CD2 4.49Å; Y387-L390 PolarHBondContact O-N 3.25Å; L390-N392 VanDerWaalsContact C-N 3.33Å; L390-N392 PolarHBondContact O-N 3.31Å; L390-S393 PolarHBondContact O-N 3.29Å; L390-C394 WeakPolarHBondContact O-CB 3.28Å; L390-C394 PolarHBondContact O-N 3.35Å; L390-C394 PolarHBondContact O-SG 3.11Å; L390-F453 HydrophobicContact CD2-CB 4.03Å; L390-F453 HydrophobicContact CD2-CD1 3.82Å; L390-F453 HydrophobicContact CD2-CE1 4.46Å; L390-F453 HydrophobicContact CD2-CG 3.96Å; L390-I456 HydrophobicContact CD2-CB 4.09Å; L390-I456 HydrophobicContact CD2-CG2 3.88Å; L390-A457 HydrophobicContact CD1-CB 3.75Å; L390-L465 HydrophobicContact CD1-CD1 4.06Å; L390-W469 HydrophobicContact CB-CH2 4.42Å; L390-W469 HydrophobicContact CB-CZ2 4.13Å; L390-W469 HydrophobicContact CD1-CZ2 4.03Å
391	D	93.7	Very high	95.4	Very high	30 Å²	30	15.3 Å²	15.3	16%	0.16	7%	0.073	C	C	.	.	H	α-helix	trans	-65.8	-36.7	-172.5	-163.2	40.2	0	0	0	112.4	Y387 R395 R460	Y387-D391 VanDerWaalsContact O-CB 3.29Å; Y387-D391 WeakPolarHBondContact O-CB 3.35Å; Y387-D391 PolarHBondContact O-N 3.22Å; D391-R395 VanDerWaalsContact CG-CZ 3.45Å; D391-R395 VanDerWaalsContact CG-NH2 3.26Å; D391-R395 WeakPolarHBondContact O-CG 3.29Å; D391-R395 PolarHBondContact O-N 2.9Å; D391-R395 PolarHBondContact O-NH1 3.42Å; D391-R395 IonicContact OD1-CZ 3.45Å; D391-R395 IonicContact OD1-NH1 3.13Å; D391-R395 PolarHBondContact OD1-NH1 3.43Å; D391-R395 IonicContact OD1-NH2 2.84Å; D391-R395 PolarHBondContact OD1-NH2 3.41Å; D391-R395 VanDerWaalsContact OD1-NH2 3.14Å; D391-R395 IonicContact OD2-CZ 2.66Å; D391-R395 IonicContact OD2-NH1 3.81Å; D391-R395 PolarHBondContact OD2-NH1 3.22Å; D391-R395 IonicContact OD2-NH2 2.63Å; D391-R395 PolarHBondContact OD2-NH2 3.38Å; D391-R460 IonicContact OD1-CZ 2.65Å; D391-R460 IonicContact OD1-NH1 3.78Å; D391-R460 PolarHBondContact OD1-NH1 3Å; D391-R460 IonicContact OD1-NH2 3.37Å
392	N	93.4	Very high	95.3	Very high	5 Å²	5	20.1 Å²	20.1	3%	0.027	10%	0.095	C	C	.	.	H	α-helix	trans	-75.5	-41.2	175.7	-68.8	-17.4	0	0	0	112.7	Y256 Y296 Y300 A388 L390 C394 R395 E396	Y256-N392 PolarHBondContact OH-ND2 3.47Å; Y256-N392 PolarHBondContact OH-OD1 2.85Å; Y296-N392 HydrophobicContact CE1-CB 4.25Å; Y300-N392 WeakPolarHBondContact OH-CB 3.47Å; Y300-N392 PolarHBondContact OH-ND2 3.47Å; A388-N392 VanDerWaalsContact O-CB 3.32Å; A388-N392 WeakPolarHBondContact O-CB 3.42Å; A388-N392 PolarHBondContact O-N 3.1Å; A388-N392 VanDerWaalsContact O-N 3.11Å; A388-N392 PolarHBondContact O-ND2 3.18Å; L390-N392 VanDerWaalsContact C-N 3.33Å; L390-N392 PolarHBondContact O-N 3.31Å; N392-C394 VanDerWaalsContact C-N 3.33Å; N392-C394 PolarHBondContact O-N 3.37Å; N392-R395 PolarHBondContact O-N 3.43Å; N392-E396 VanDerWaalsContact O-CB 3.27Å; N392-E396 WeakPolarHBondContact O-CB 3.49Å; N392-E396 PolarHBondContact O-N 3Å
393	S	95.3	Very high	95.2	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63	-40.5	177.5	-61.3	0	0	0	0	111.8	L389 L390 E396 Y397 F415 M419	L389-S393 WeakPolarHBondContact O-CB 3.46Å; L389-S393 PolarHBondContact O-N 2.95Å; L389-S393 PolarHBondContact O-OG 3.34Å; L390-S393 PolarHBondContact O-N 3.29Å; S393-E396 PolarHBondContact O-N 2.82Å; S393-Y397 WeakPolarHBondContact O-CB 3.48Å; S393-Y397 PolarHBondContact O-N 2.72Å; S393-F415 WeakPolarHBondContact O-CE2 3.48Å; S393-M419 VanDerWaalsContact OG-CE 3.26Å; S393-M419 WeakPolarHBondContact OG-CE 3.35Å
394	C	94.3	Very high	95.2	Very high	3 Å²	3	19.5 Å²	19.5	2%	0.02	9%	0.093	C	C	.	.	H	α-helix	trans	-62.5	-46.1	177.1	-69.6	0	0	0	0	111.7	L390 N392 Y397 L398 V462	L390-C394 WeakPolarHBondContact O-CB 3.28Å; L390-C394 PolarHBondContact O-N 3.35Å; L390-C394 PolarHBondContact O-SG 3.11Å; N392-C394 VanDerWaalsContact C-N 3.33Å; N392-C394 PolarHBondContact O-N 3.37Å; C394-Y397 PolarHBondContact O-N 2.75Å; C394-L398 VanDerWaalsContact O-CG 3.31Å; C394-L398 WeakPolarHBondContact O-CG 3.21Å; C394-L398 PolarHBondContact O-N 2.97Å; C394-L398 VanDerWaalsContact O-N 3.09Å; C394-V462 HydrophobicContact CB-CG2 3.93Å
395	R	92.7	Very high	95	Very high	89 Å²	89	23 Å²	23	34%	0.336	11%	0.114	S	C	.	.	H	α-helix	trans	-64.7	-42.4	176.8	-68.7	-172.9	-167.6	97.9	0.2	112.3	Q257 D391 N392 L398 F399	Q257-R395 VanDerWaalsContact NE2-CZ 3.3Å; Q257-R395 VanDerWaalsContact NE2-NH1 3.13Å; D391-R395 VanDerWaalsContact CG-CZ 3.45Å; D391-R395 VanDerWaalsContact CG-NH2 3.26Å; D391-R395 WeakPolarHBondContact O-CG 3.29Å; D391-R395 PolarHBondContact O-N 2.9Å; D391-R395 PolarHBondContact O-NH1 3.42Å; D391-R395 IonicContact OD1-CZ 3.45Å; D391-R395 IonicContact OD1-NH1 3.13Å; D391-R395 PolarHBondContact OD1-NH1 3.43Å; D391-R395 IonicContact OD1-NH2 2.84Å; D391-R395 PolarHBondContact OD1-NH2 3.41Å; D391-R395 VanDerWaalsContact OD1-NH2 3.14Å; D391-R395 IonicContact OD2-CZ 2.66Å; D391-R395 IonicContact OD2-NH1 3.81Å; D391-R395 PolarHBondContact OD2-NH1 3.22Å; D391-R395 IonicContact OD2-NH2 2.63Å; D391-R395 PolarHBondContact OD2-NH2 3.38Å; N392-R395 PolarHBondContact O-N 3.43Å; R395-L398 PolarHBondContact O-N 3.41Å; R395-F399 WeakPolarHBondContact O-CB 3.44Å; R395-F399 PolarHBondContact O-N 2.94Å
396	E	95	Very high	94.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.3	-46.4	178	-172.8	63.2	-152.3	0	0	111.4	Q260 Y288 Y296 N392 S393 F399 I400 F415 V418 M419	Q260-E396 PolarHBondContact NE2-OE2 2.97Å; Y288-E396 WeakPolarHBondContact CE1-OE1 3.46Å; Y288-E396 PolarHBondContact OH-OE1 2.93Å; Y296-E396 HydrophobicContact CE2-CG 4.23Å; Y296-E396 WeakPolarHBondContact CE2-OE2 3.46Å; Y296-E396 PolarHBondContact OH-OE2 3.43Å; N392-E396 VanDerWaalsContact O-CB 3.27Å; N392-E396 WeakPolarHBondContact O-CB 3.49Å; N392-E396 PolarHBondContact O-N 3Å; S393-E396 PolarHBondContact O-N 2.82Å; E396-F399 PolarHBondContact O-N 3.34Å; E396-I400 HydrophobicContact CG-CD1 3.96Å; E396-I400 WeakPolarHBondContact O-CB 3.46Å; E396-I400 VanDerWaalsContact O-CG1 3.25Å; E396-I400 WeakPolarHBondContact O-CG1 3.26Å; E396-I400 PolarHBondContact O-N 2.97Å; E396-F415 HydrophobicContact CG-CD2 4.47Å; E396-V418 HydrophobicContact CG-CG1 4.1Å; E396-M419 HydrophobicContact CG-CG 4.3Å
397	Y	95.8	Very high	94.8	Very high	18 Å²	18	28.9 Å²	28.9	7%	0.071	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-46	179	-178.6	-101.2	0	0	0	112.1	S393 C394 I400 C401 A411 F415 V462 P463 A464	S393-Y397 WeakPolarHBondContact O-CB 3.48Å; S393-Y397 PolarHBondContact O-N 2.72Å; C394-Y397 PolarHBondContact O-N 2.75Å; Y397-I400 PolarHBondContact O-N 3.37Å; Y397-C401 PolarHBondContact O-N 2.55Å; Y397-C401 PolarHBondContact O-SG 2.63Å; Y397-A411 HydrophobicContact CE2-CB 3.92Å; Y397-F415 HydrophobicContact CD2-CB 4.1Å; Y397-F415 HydrophobicContact CD2-CD2 4.27Å; Y397-F415 HydrophobicContact CD2-CG 4.25Å; Y397-V462 HydrophobicContact CD1-CB 4.3Å; Y397-V462 HydrophobicContact CD1-CG1 3.79Å; Y397-V462 HydrophobicContact CD1-CG2 4.11Å; Y397-V462 HydrophobicContact CG-CG1 3.91Å; Y397-P463 HydrophobicContact CE1-CG 4.5Å; Y397-A464 HydrophobicContact CD2-CB 3.41Å; Y397-A464 VanDerWaalsContact CD2-CB 3.41Å; Y397-A464 HydrophobicContact CE2-CB 3.69Å; Y397-A464 HydrophobicContact CG-CB 4.03Å
398	L	93.9	Very high	94.6	Very high	78 Å²	78	29.1 Å²	29.1	41%	0.408	17%	0.166	S	C	.	.	H	α-helix	trans	-63.4	-44.1	177.1	-68.3	173.8	0	0	0	111.4	C394 R395 I400 C401 E402 V462	C394-L398 VanDerWaalsContact O-CG 3.31Å; C394-L398 WeakPolarHBondContact O-CG 3.21Å; C394-L398 PolarHBondContact O-N 2.97Å; C394-L398 VanDerWaalsContact O-N 3.09Å; R395-L398 PolarHBondContact O-N 3.41Å; L398-I400 VanDerWaalsContact C-N 3.31Å; L398-I400 PolarHBondContact O-N 3.1Å; L398-C401 PolarHBondContact O-N 3.25Å; L398-E402 WeakPolarHBondContact O-CB 3.44Å; L398-E402 WeakPolarHBondContact O-CG 3.31Å; L398-E402 PolarHBondContact O-N 3.44Å; L398-V462 HydrophobicContact CG-CG2 4.42Å
399	F	95.2	Very high	94.5	Very high	6 Å²	6	33.9 Å²	33.9	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-58	-44.9	174.1	173.6	-89.4	0	0	0	111.5	Q260 L263 L264 Y288 R395 E396 C401 E402 F403 F404	Q260-F399 HydrophobicContact CB-CD2 3.76Å; Q260-F399 HydrophobicContact CB-CE2 3.95Å; Q260-F399 HydrophobicContact CB-CG 4.4Å; Q260-F399 HydrophobicContact CG-CD1 4.42Å; Q260-F399 HydrophobicContact CG-CD2 3.86Å; Q260-F399 HydrophobicContact CG-CE2 3.97Å; Q260-F399 HydrophobicContact CG-CG 4.09Å; Q260-F399 HydrophobicContact CG-CZ 4.33Å; Q260-F399 WeakPolarHBondContact O-CE2 3.33Å; L263-F399 HydrophobicContact CB-CE2 4.03Å; L263-F399 HydrophobicContact CB-CZ 4.22Å; L263-F399 HydrophobicContact CD1-CZ 4.17Å; L264-F399 HydrophobicContact CD1-CD2 4.23Å; L264-F399 HydrophobicContact CD2-CD2 3.8Å; L264-F399 HydrophobicContact CD2-CE2 4.06Å; L264-F399 HydrophobicContact CG-CD2 3.82Å; L264-F399 HydrophobicContact CG-CE2 4.02Å; Y288-F399 HydrophobicContact CD2-CE1 4.41Å; Y288-F399 HydrophobicContact CE1-CD1 4.39Å; Y288-F399 HydrophobicContact CE1-CE1 4.04Å; Y288-F399 HydrophobicContact CE2-CD1 4.34Å; Y288-F399 AromaticContact CE2-CE1 3.49Å; Y288-F399 HydrophobicContact CE2-CE1 3.49Å; Y288-F399 VanDerWaalsContact CE2-CE1 3.49Å; Y288-F399 AromaticContact CE2-CZ 3.94Å; Y288-F399 HydrophobicContact CE2-CZ 3.94Å; Y288-F399 AromaticContact CZ-CD1 3.72Å; Y288-F399 AromaticContact CZ-CE1 3.27Å; Y288-F399 WeakPolarHBondContact OH-CD1 3.38Å; Y288-F399 WeakPolarHBondContact OH-CE1 3.25Å; R395-F399 WeakPolarHBondContact O-CB 3.44Å; R395-F399 PolarHBondContact O-N 2.94Å; E396-F399 PolarHBondContact O-N 3.34Å; F399-C401 VanDerWaalsContact C-N 3.34Å; F399-C401 PolarHBondContact O-N 2.9Å; F399-E402 PolarHBondContact O-N 3.21Å; F399-F403 HydrophobicContact CD1-CB 4.42Å; F399-F403 HydrophobicContact CD2-CB 4.33Å; F399-F403 HydrophobicContact CE1-CB 3.93Å; F399-F403 HydrophobicContact CE1-CD1 4.15Å; F399-F403 HydrophobicContact CE1-CG 4.18Å; F399-F403 HydrophobicContact CE2-CB 3.86Å; F399-F403 HydrophobicContact CE2-CD2 4.39Å; F399-F403 HydrophobicContact CE2-CG 4.08Å; F399-F403 HydrophobicContact CZ-CB 3.63Å; F399-F403 AromaticContact CZ-CD1 3.82Å; F399-F403 HydrophobicContact CZ-CD1 3.82Å; F399-F403 HydrophobicContact CZ-CD2 4.2Å; F399-F403 AromaticContact CZ-CG 3.61Å; F399-F403 HydrophobicContact CZ-CG 3.61Å; F399-F403 VanDerWaalsContact O-CB 3.3Å; F399-F403 WeakPolarHBondContact O-CB 3.48Å; F399-F403 PolarHBondContact O-N 3.08Å; F399-F404 HydrophobicContact CE1-CE2 4.02Å
400	I	95.6	Very high	94.5	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.8	-47.2	179	-77.3	169.1	0	0	0	110.5	E396 Y397 L398 E402 F404 V406 L414 F415 V418	E396-I400 HydrophobicContact CG-CD1 3.96Å; E396-I400 WeakPolarHBondContact O-CB 3.46Å; E396-I400 VanDerWaalsContact O-CG1 3.25Å; E396-I400 WeakPolarHBondContact O-CG1 3.26Å; E396-I400 PolarHBondContact O-N 2.97Å; Y397-I400 PolarHBondContact O-N 3.37Å; L398-I400 VanDerWaalsContact C-N 3.31Å; L398-I400 PolarHBondContact O-N 3.1Å; I400-E402 PolarHBondContact O-N 3.01Å; I400-F404 HydrophobicContact CG1-CD2 4.38Å; I400-F404 WeakPolarHBondContact O-CB 3.29Å; I400-F404 PolarHBondContact O-N 3.4Å; I400-F404 VanDerWaalsContact O-N 3.13Å; I400-V406 HydrophobicContact CG2-CG2 3.7Å; I400-L414 HydrophobicContact CD1-CG 4.43Å; I400-L414 HydrophobicContact CG2-CB 4.04Å; I400-L414 HydrophobicContact CG2-CD2 3.75Å; I400-L414 HydrophobicContact CG2-CG 3.91Å; I400-F415 HydrophobicContact CD1-CB 4.14Å; I400-V418 HydrophobicContact CD1-CG2 4.13Å
401	C	94.9	Very high	94.4	Very high	32 Å²	32	36.3 Å²	36.3	22%	0.216	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-45.6	179	-64.9	0	0	0	0	111.6	Y397 L398 F399 V405 V406	Y397-C401 PolarHBondContact O-N 2.55Å; Y397-C401 PolarHBondContact O-SG 2.63Å; L398-C401 PolarHBondContact O-N 3.25Å; F399-C401 VanDerWaalsContact C-N 3.34Å; F399-C401 PolarHBondContact O-N 2.9Å; C401-V405 WeakPolarHBondContact O-CA 3.45Å; C401-V405 PolarHBondContact O-N 3.35Å; C401-V406 WeakPolarHBondContact CA-O 3.31Å; C401-V406 PolarHBondContact O-N 3.42Å
402	E	94.5	Very high	94.4	Very high	104 Å²	104	37.2 Å²	37.2	49%	0.486	22%	0.22	S	C	.	.	H	α-helix	trans	-75.1	-47.4	-175.4	-72.9	-173.9	-176.7	0	0	113.9	L264 L398 F399 I400	L264-E402 HydrophobicContact CD2-CB 3.75Å; L398-E402 WeakPolarHBondContact O-CB 3.44Å; L398-E402 WeakPolarHBondContact O-CG 3.31Å; L398-E402 PolarHBondContact O-N 3.44Å; F399-E402 PolarHBondContact O-N 3.21Å; I400-E402 PolarHBondContact O-N 3.01Å
403	F	95.7	Very high	94.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-79	-44.2	-173.7	-175	-100.7	0	0	0	112.3	I242 L263 L264 Y270 F399 V405	I242-F403 HydrophobicContact CD1-CZ 4.46Å; I242-F403 HydrophobicContact CG2-CZ 4.31Å; L263-F403 HydrophobicContact CB-CD2 4.23Å; L263-F403 HydrophobicContact CB-CE2 3.98Å; L263-F403 HydrophobicContact CD2-CE2 4.28Å; L263-F403 HydrophobicContact CD2-CZ 4.21Å; L263-F403 WeakPolarHBondContact O-CE2 3.41Å; L264-F403 HydrophobicContact CD2-CB 4.07Å; Y270-F403 WeakPolarHBondContact CD1-O 3.29Å; Y270-F403 HydrophobicContact CD2-CE1 4.23Å; Y270-F403 HydrophobicContact CG-CE1 4.32Å; F399-F403 HydrophobicContact CD1-CB 4.42Å; F399-F403 HydrophobicContact CD2-CB 4.33Å; F399-F403 HydrophobicContact CE1-CB 3.93Å; F399-F403 HydrophobicContact CE1-CD1 4.15Å; F399-F403 HydrophobicContact CE1-CG 4.18Å; F399-F403 HydrophobicContact CE2-CB 3.86Å; F399-F403 HydrophobicContact CE2-CD2 4.39Å; F399-F403 HydrophobicContact CE2-CG 4.08Å; F399-F403 HydrophobicContact CZ-CB 3.63Å; F399-F403 AromaticContact CZ-CD1 3.82Å; F399-F403 HydrophobicContact CZ-CD1 3.82Å; F399-F403 HydrophobicContact CZ-CD2 4.2Å; F399-F403 AromaticContact CZ-CG 3.61Å; F399-F403 HydrophobicContact CZ-CG 3.61Å; F399-F403 VanDerWaalsContact O-CB 3.3Å; F399-F403 WeakPolarHBondContact O-CB 3.48Å; F399-F403 PolarHBondContact O-N 3.08Å; F403-V405 VanDerWaalsContact C-N 3.31Å
404	F	95.4	Very high	94.6	Very high	3 Å²	3	43.1 Å²	43.1	1%	0.013	25%	0.251	C	S	.	.	H	α-helix	trans	-86.8	-3.4	-179.9	-64.1	-70.3	0	0	0	113.1	Y270 R285 Y288 F399 I400 V406 L414	Y270-F404 HydrophobicContact CD1-CD1 4.19Å; Y270-F404 HydrophobicContact CD2-CD1 4.14Å; Y270-F404 HydrophobicContact CD2-CE1 4.27Å; Y270-F404 HydrophobicContact CE1-CB 4.2Å; Y270-F404 AromaticContact CE1-CD1 3.73Å; Y270-F404 HydrophobicContact CE1-CD1 3.73Å; Y270-F404 HydrophobicContact CE1-CG 4.46Å; Y270-F404 AromaticContact CE2-CD1 3.67Å; Y270-F404 HydrophobicContact CE2-CD1 3.67Å; Y270-F404 AromaticContact CE2-CE1 3.84Å; Y270-F404 HydrophobicContact CE2-CE1 3.84Å; Y270-F404 HydrophobicContact CG-CD1 4.39Å; Y270-F404 AromaticContact CZ-CD1 3.46Å; Y270-F404 VanDerWaalsContact CZ-CD1 3.46Å; R285-F404 HydrophobicContact CB-CD1 4.27Å; R285-F404 HydrophobicContact CB-CE1 3.85Å; R285-F404 HydrophobicContact CG-CD1 4.13Å; R285-F404 HydrophobicContact CG-CE1 3.94Å; R285-F404 HydrophobicContact CG-CZ 4.41Å; Y288-F404 AromaticContact CD1-CE2 3.7Å; Y288-F404 HydrophobicContact CD1-CE2 3.7Å; Y288-F404 AromaticContact CD1-CZ 3.75Å; Y288-F404 HydrophobicContact CD1-CZ 3.75Å; Y288-F404 HydrophobicContact CD2-CZ 4.31Å; Y288-F404 AromaticContact CE1-CE2 3.92Å; Y288-F404 HydrophobicContact CE1-CE2 3.92Å; Y288-F404 HydrophobicContact CE1-CZ 4.38Å; Y288-F404 HydrophobicContact CG-CE2 4.11Å; Y288-F404 AromaticContact CG-CZ 3.72Å; Y288-F404 HydrophobicContact CG-CZ 3.72Å; F399-F404 HydrophobicContact CE1-CE2 4.02Å; I400-F404 HydrophobicContact CG1-CD2 4.38Å; I400-F404 WeakPolarHBondContact O-CB 3.29Å; I400-F404 PolarHBondContact O-N 3.4Å; I400-F404 VanDerWaalsContact O-N 3.13Å; F404-V406 VanDerWaalsContact C-N 3.28Å; F404-V406 HydrophobicContact CB-CG1 4.36Å; F404-V406 HydrophobicContact CB-CG2 4.19Å; F404-V406 PolarHBondContact O-N 3.42Å; F404-L414 HydrophobicContact CB-CD2 3.97Å; F404-L414 HydrophobicContact CD2-CD2 3.71Å; F404-L414 HydrophobicContact CE2-CD2 4.36Å; F404-L414 HydrophobicContact CG-CD2 3.84Å
405	V	94	Very high	94.8	Very high	72 Å²	72	43 Å²	43	44%	0.436	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	46.7	177.7	-162.4	0	0	0	0	110.9	C401 F403	C401-V405 WeakPolarHBondContact O-CA 3.45Å; C401-V405 PolarHBondContact O-N 3.35Å; F403-V405 VanDerWaalsContact C-N 3.31Å
406	V	94.2	Very high	95	Very high	36 Å²	36	42.1 Å²	42.1	22%	0.218	25%	0.25	C	S	.	.			trans	-116.6	149.2	179.1	-67	0	0	0	0	110.4	I400 C401 F404 A410 A411 L414	I400-V406 HydrophobicContact CG2-CG2 3.7Å; C401-V406 WeakPolarHBondContact CA-O 3.31Å; C401-V406 PolarHBondContact O-N 3.42Å; F404-V406 VanDerWaalsContact C-N 3.28Å; F404-V406 HydrophobicContact CB-CG1 4.36Å; F404-V406 HydrophobicContact CB-CG2 4.19Å; F404-V406 PolarHBondContact O-N 3.42Å; V406-A410 HydrophobicContact CB-CB 4.32Å; V406-A410 HydrophobicContact CG1-CB 4.45Å; V406-A411 HydrophobicContact CB-CB 4.46Å; V406-A411 HydrophobicContact CG2-CB 3.96Å; V406-L414 HydrophobicContact CG2-CD2 4.33Å
407	S	93.6	Very high	95.1	Very high	96 Å²	96	44.4 Å²	44.4	67%	0.671	27%	0.269	S	S	*	.			trans	-144.6	165	177	63.5	0	0	0	0	110.9
408	G	92.3	Very high	95.1	Very high	35 Å²	35	43.6 Å²	43.6	36%	0.361	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	-137	177.6	0	0	0	0	0	112.6	A410 A411 H412	G408-A410 VanDerWaalsContact C-N 3.32Å; G408-A410 PolarHBondContact O-N 2.87Å; G408-A411 PolarHBondContact O-N 3.14Å; G408-H412 PolarHBondContact O-N 2.95Å; G408-H412 PolarHBondContact O-ND1 2.98Å
409	P	93.7	Very high	95.3	Very high	104 Å²	104	39.9 Å²	39.9	68%	0.675	25%	0.246	S	C	*	.	H	α-helix	trans	-57.3	-38.7	-175.7	-26	34.8	0	0	0	114.2	A411 H412 D413	P409-A411 VanDerWaalsContact C-N 3.3Å; P409-A411 PolarHBondContact O-N 3.25Å; P409-H412 WeakPolarHBondContact O-CB 3.49Å; P409-H412 PolarHBondContact O-N 3.17Å; P409-H412 VanDerWaalsContact O-N 3.08Å; P409-D413 PolarHBondContact O-N 3.09Å
410	A	94.5	Very high	95.4	Very high	51 Å²	51	40.2 Å²	40.2	42%	0.421	25%	0.251	S	S	.	.	H	α-helix	trans	-64.2	-35.2	-179.6	0	0	0	0	0	112.7	V406 G408 L414	V406-A410 HydrophobicContact CB-CB 4.32Å; V406-A410 HydrophobicContact CG1-CB 4.45Å; G408-A410 VanDerWaalsContact C-N 3.32Å; G408-A410 PolarHBondContact O-N 2.87Å; A410-L414 WeakPolarHBondContact O-CB 3.14Å; A410-L414 PolarHBondContact O-N 3.15Å; A410-L414 VanDerWaalsContact O-N 3.11Å
411	A	95.3	Very high	95.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-67.7	-37.9	173.9	0	0	0	0	0	111.6	Y397 V406 G408 P409 F415	Y397-A411 HydrophobicContact CE2-CB 3.92Å; V406-A411 HydrophobicContact CB-CB 4.46Å; V406-A411 HydrophobicContact CG2-CB 3.96Å; G408-A411 PolarHBondContact O-N 3.14Å; P409-A411 VanDerWaalsContact C-N 3.3Å; P409-A411 PolarHBondContact O-N 3.25Å; A411-F415 VanDerWaalsContact O-CB 3.25Å; A411-F415 WeakPolarHBondContact O-CB 3.36Å; A411-F415 PolarHBondContact O-N 3.27Å
412	H	94.3	Very high	95.6	Very high	49 Å²	49	44.9 Å²	44.9	23%	0.227	27%	0.265	C	S	.	.	H	α-helix	trans	-66	-44.8	176.3	-70.2	71.7	0	0	0	111.7	G408 P409 L414 F415 H416	G408-H412 PolarHBondContact O-N 2.95Å; G408-H412 PolarHBondContact O-ND1 2.98Å; P409-H412 WeakPolarHBondContact O-CB 3.49Å; P409-H412 PolarHBondContact O-N 3.17Å; P409-H412 VanDerWaalsContact O-N 3.08Å; H412-L414 VanDerWaalsContact C-N 3.34Å; H412-L414 PolarHBondContact O-N 3.05Å; H412-F415 PolarHBondContact O-N 3.27Å; H412-H416 WeakPolarHBondContact O-CB 3.48Å; H412-H416 PolarHBondContact O-CD2 2.97Å; H412-H416 VanDerWaalsContact O-CD2 3.29Å; H412-H416 PolarHBondContact O-N 3.48Å
413	D	96	Very high	95.7	Very high	112 Å²	112	40.3 Å²	40.3	60%	0.599	24%	0.243	S	C	*	.	H	α-helix	trans	-61.6	-44.4	178.3	-69.1	-23.5	0	0	0	111.3	P409 H416 A417	P409-D413 PolarHBondContact O-N 3.09Å; D413-H416 PolarHBondContact O-N 3Å; D413-A417 WeakPolarHBondContact O-CB 3.5Å; D413-A417 PolarHBondContact O-N 3.49Å
414	L	96.5	Very high	95.8	Very high	18 Å²	18	43.2 Å²	43.2	9%	0.094	26%	0.264	C	S	.	.	H	α-helix	trans	-67.9	-40.9	178.7	-171.7	53.3	0	0	0	111.7	R285 V289 I400 F404 V406 A410 H412 A417 V418	R285-L414 HydrophobicContact CG-CD1 3.89Å; R285-L414 HydrophobicContact CG-CD2 4.2Å; V289-L414 HydrophobicContact CG2-CD1 3.36Å; I400-L414 HydrophobicContact CD1-CG 4.43Å; I400-L414 HydrophobicContact CG2-CB 4.04Å; I400-L414 HydrophobicContact CG2-CD2 3.75Å; I400-L414 HydrophobicContact CG2-CG 3.91Å; F404-L414 HydrophobicContact CB-CD2 3.97Å; F404-L414 HydrophobicContact CD2-CD2 3.71Å; F404-L414 HydrophobicContact CE2-CD2 4.36Å; F404-L414 HydrophobicContact CG-CD2 3.84Å; V406-L414 HydrophobicContact CG2-CD2 4.33Å; A410-L414 WeakPolarHBondContact O-CB 3.14Å; A410-L414 PolarHBondContact O-N 3.15Å; A410-L414 VanDerWaalsContact O-N 3.11Å; H412-L414 VanDerWaalsContact C-N 3.34Å; H412-L414 PolarHBondContact O-N 3.05Å; L414-A417 WeakPolarHBondContact O-CB 3.49Å; L414-A417 PolarHBondContact O-N 3.48Å; L414-V418 WeakPolarHBondContact O-CG2 3.2Å; L414-V418 PolarHBondContact O-N 3.39Å; L414-V418 VanDerWaalsContact O-N 3.15Å
415	F	97.4	Very high	95.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.7	-45.7	172.1	172.6	-93.2	0	0	0	111.9	S393 E396 Y397 I400 A411 H412 A417 V418 M419 L423 A464 L465	S393-F415 WeakPolarHBondContact O-CE2 3.48Å; E396-F415 HydrophobicContact CG-CD2 4.47Å; Y397-F415 HydrophobicContact CD2-CB 4.1Å; Y397-F415 HydrophobicContact CD2-CD2 4.27Å; Y397-F415 HydrophobicContact CD2-CG 4.25Å; I400-F415 HydrophobicContact CD1-CB 4.14Å; A411-F415 VanDerWaalsContact O-CB 3.25Å; A411-F415 WeakPolarHBondContact O-CB 3.36Å; A411-F415 PolarHBondContact O-N 3.27Å; H412-F415 PolarHBondContact O-N 3.27Å; F415-A417 VanDerWaalsContact C-N 3.3Å; F415-A417 PolarHBondContact O-N 3.47Å; F415-V418 PolarHBondContact O-N 3.09Å; F415-V418 VanDerWaalsContact O-N 3.14Å; F415-M419 HydrophobicContact CD2-CG 4.16Å; F415-M419 HydrophobicContact CE1-CB 4.07Å; F415-M419 HydrophobicContact CE2-CB 4.07Å; F415-M419 HydrophobicContact CE2-CG 3.61Å; F415-M419 HydrophobicContact CZ-CB 3.79Å; F415-M419 HydrophobicContact CZ-CG 3.81Å; F415-M419 PolarHBondContact O-N 3.02Å; F415-L423 HydrophobicContact CE1-CD1 4.1Å; F415-A464 HydrophobicContact CB-CB 4.48Å; F415-A464 HydrophobicContact CD1-CB 3.59Å; F415-A464 HydrophobicContact CD2-CB 4.3Å; F415-A464 HydrophobicContact CE1-CB 3.8Å; F415-A464 HydrophobicContact CE2-CB 4.48Å; F415-A464 HydrophobicContact CG-CB 3.86Å; F415-A464 HydrophobicContact CZ-CB 4.25Å; F415-L465 HydrophobicContact CE1-CD2 4.24Å; F415-L465 HydrophobicContact CZ-CD2 3.93Å; F415-L465 HydrophobicContact CZ-CG 4.36Å
416	H	96.5	Very high	96.1	Very high	71 Å²	71	41.9 Å²	41.9	33%	0.329	25%	0.253	S	S	.	.	H	α-helix	trans	-65.2	-33.1	177	-86	-60.3	0	0	0	112.4	H412 D413 V418 G420	H412-H416 WeakPolarHBondContact O-CB 3.48Å; H412-H416 PolarHBondContact O-CD2 2.97Å; H412-H416 VanDerWaalsContact O-CD2 3.29Å; H412-H416 PolarHBondContact O-N 3.48Å; D413-H416 PolarHBondContact O-N 3Å; H416-V418 VanDerWaalsContact C-N 3.29Å; H416-V418 PolarHBondContact O-N 3.44Å; H416-G420 WeakPolarHBondContact O-CA 3.47Å; H416-G420 PolarHBondContact O-N 3.12Å
417	A	97.3	Very high	96.3	Very high	48 Å²	48	41 Å²	41	40%	0.397	25%	0.248	S	C	.	.	H	α-helix	trans	-63.3	-36.5	173.2	0	0	0	0	0	111.8	V289 D413 L414 F415	V289-A417 HydrophobicContact CG1-CB 3.7Å; D413-A417 WeakPolarHBondContact O-CB 3.5Å; D413-A417 PolarHBondContact O-N 3.49Å; L414-A417 WeakPolarHBondContact O-CB 3.49Å; L414-A417 PolarHBondContact O-N 3.48Å; F415-A417 VanDerWaalsContact C-N 3.3Å; F415-A417 PolarHBondContact O-N 3.47Å
418	V	96.9	Very high	96.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-76.6	-60.7	175.8	179.8	0	0	0	0	111.4	Y288 V289 L292 S293 Y296 E396 I400 L414 F415 H416	Y288-V418 HydrophobicContact CE1-CG2 4.35Å; V289-V418 HydrophobicContact CB-CG2 4.38Å; V289-V418 HydrophobicContact CG1-CG2 4.38Å; V289-V418 HydrophobicContact CG2-CG2 3.96Å; L292-V418 HydrophobicContact CB-CG1 3.85Å; S293-V418 WeakPolarHBondContact CA-O 3.22Å; S293-V418 VanDerWaalsContact CB-O 3.28Å; S293-V418 WeakPolarHBondContact CB-O 3.22Å; S293-V418 PolarHBondContact OG-O 3.29Å; Y296-V418 HydrophobicContact CD2-CG1 3.84Å; Y296-V418 HydrophobicContact CE2-CG1 3.88Å; E396-V418 HydrophobicContact CG-CG1 4.1Å; I400-V418 HydrophobicContact CD1-CG2 4.13Å; L414-V418 WeakPolarHBondContact O-CG2 3.2Å; L414-V418 PolarHBondContact O-N 3.39Å; L414-V418 VanDerWaalsContact O-N 3.15Å; F415-V418 PolarHBondContact O-N 3.09Å; F415-V418 VanDerWaalsContact O-N 3.14Å; H416-V418 VanDerWaalsContact C-N 3.29Å; H416-V418 PolarHBondContact O-N 3.44Å
419	M	96.9	Very high	96.6	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-90.6	-17.8	-167.5	-69.4	-62.6	-81.6	0	0	114.2	Y296 L389 S393 E396 F415 R421 T422 L423	Y296-M419 HydrophobicContact CD1-SD 4.17Å; Y296-M419 HydrophobicContact CD2-SD 3.46Å; Y296-M419 WeakPolarHBondContact CD2-SD 3.46Å; Y296-M419 HydrophobicContact CE1-SD 4.45Å; Y296-M419 HydrophobicContact CE2-SD 3.77Å; Y296-M419 HydrophobicContact CG-SD 3.68Å; L389-M419 HydrophobicContact CD1-CE 3.79Å; S393-M419 VanDerWaalsContact OG-CE 3.26Å; S393-M419 WeakPolarHBondContact OG-CE 3.35Å; E396-M419 HydrophobicContact CG-CG 4.3Å; F415-M419 HydrophobicContact CD2-CG 4.16Å; F415-M419 HydrophobicContact CE1-CB 4.07Å; F415-M419 HydrophobicContact CE2-CB 4.07Å; F415-M419 HydrophobicContact CE2-CG 3.61Å; F415-M419 HydrophobicContact CZ-CB 3.79Å; F415-M419 HydrophobicContact CZ-CG 3.81Å; F415-M419 PolarHBondContact O-N 3.02Å; M419-R421 VanDerWaalsContact C-N 3.32Å; M419-R421 PolarHBondContact O-N 2.67Å; M419-T422 WeakPolarHBondContact O-CA 3.47Å; M419-T422 VanDerWaalsContact O-CB 3.31Å; M419-T422 WeakPolarHBondContact O-CB 3.33Å; M419-T422 PolarHBondContact O-N 3.06Å; M419-L423 HydrophobicContact CB-CD1 4.33Å; M419-L423 HydrophobicContact CB-CG 4.33Å; M419-L423 WeakPolarHBondContact O-CG 3.45Å; M419-L423 PolarHBondContact O-N 3.49Å
420	G	97.1	Very high	96.8	Very high	13 Å²	13	39.3 Å²	39.3	13%	0.134	21%	0.208	C	C	.	.	H	α-helix	trans	-58	-38.1	-169.1	0	0	0	0	0	114.6	H416 L423 S424	H416-G420 WeakPolarHBondContact O-CA 3.47Å; H416-G420 PolarHBondContact O-N 3.12Å; G420-L423 PolarHBondContact O-N 3.25Å; G420-S424 WeakPolarHBondContact O-CB 3.47Å; G420-S424 PolarHBondContact O-N 2.96Å; G420-S424 PolarHBondContact O-OG 3.14Å
421	R	97.8	Very high	96.9	Very high	131 Å²	131	42.3 Å²	42.3	49%	0.494	21%	0.214	S	C	.	.	H	α-helix	trans	-63.7	-41.1	175.3	-66.2	-177.8	-178.4	162.2	2.7	111.9	E290 L297 M419 M425	E290-R421 IonicContact OE2-NH1 3.93Å; L297-R421 HydrophobicContact CD2-CB 4.41Å; M419-R421 VanDerWaalsContact C-N 3.32Å; M419-R421 PolarHBondContact O-N 2.67Å; R421-M425 WeakPolarHBondContact O-CB 3.42Å; R421-M425 PolarHBondContact O-N 3.2Å
422	T	97.4	Very high	97	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.3	-45.7	177.8	-55.9	0	0	0	0	111.7	L297 Y300 L389 M419 M425 T426	L297-T422 PolarHBondContact N-OG1 2.95Å; Y300-T422 HydrophobicContact CD2-CG2 3.31Å; Y300-T422 HydrophobicContact CE2-CG2 4.03Å; Y300-T422 HydrophobicContact CG-CG2 3.64Å; L389-T422 HydrophobicContact CD1-CG2 4.2Å; M419-T422 WeakPolarHBondContact O-CA 3.47Å; M419-T422 VanDerWaalsContact O-CB 3.31Å; M419-T422 WeakPolarHBondContact O-CB 3.33Å; M419-T422 PolarHBondContact O-N 3.06Å; T422-M425 PolarHBondContact O-N 3.04Å; T422-T426 PolarHBondContact O-N 3.41Å; T422-T426 PolarHBondContact O-OG1 3.05Å
423	L	97.8	Very high	97	Very high	7 Å²	7	45.8 Å²	45.8	4%	0.037	24%	0.238	C	C	.	.	H	α-helix	trans	-60.1	-47.1	176.2	-63	179.3	0	0	0	110.7	L389 F415 M419 G420 M425 T426 L427 L465 Y468	L389-L423 HydrophobicContact CD1-CD2 3.9Å; L389-L423 HydrophobicContact CD2-CD2 3.76Å; L389-L423 HydrophobicContact CG-CD2 4.08Å; F415-L423 HydrophobicContact CE1-CD1 4.1Å; M419-L423 HydrophobicContact CB-CD1 4.33Å; M419-L423 HydrophobicContact CB-CG 4.33Å; M419-L423 WeakPolarHBondContact O-CG 3.45Å; M419-L423 PolarHBondContact O-N 3.49Å; G420-L423 PolarHBondContact O-N 3.25Å; L423-M425 PolarHBondContact O-N 3.15Å; L423-T426 PolarHBondContact O-N 3.42Å; L423-L427 WeakPolarHBondContact O-CG 3.44Å; L423-L427 PolarHBondContact O-N 3.17Å; L423-L465 HydrophobicContact CD1-CD2 4.24Å; L423-L465 HydrophobicContact CD2-CD2 3.94Å; L423-Y468 HydrophobicContact CB-CD2 3.8Å; L423-Y468 HydrophobicContact CB-CE2 4.03Å; L423-Y468 HydrophobicContact CD1-CD2 4.42Å; L423-Y468 HydrophobicContact CD2-CD1 4.4Å; L423-Y468 HydrophobicContact CD2-CD2 3.72Å; L423-Y468 HydrophobicContact CD2-CE2 3.84Å; L423-Y468 HydrophobicContact CD2-CG 4Å; L423-Y468 HydrophobicContact CG-CD2 4.17Å
424	S	97.9	Very high	96.9	Very high	62 Å²	62	40.9 Å²	40.9	43%	0.434	21%	0.212	S	C	.	.	H	α-helix	trans	-62.9	-39.9	178.3	-57.5	0	0	0	0	112.7	G420 T426 K428	G420-S424 WeakPolarHBondContact O-CB 3.47Å; G420-S424 PolarHBondContact O-N 2.96Å; G420-S424 PolarHBondContact O-OG 3.14Å; S424-T426 VanDerWaalsContact C-N 3.35Å; S424-K428 WeakPolarHBondContact O-CG 3.35Å; S424-K428 PolarHBondContact O-N 2.88Å
425	M	97.5	Very high	96.8	Very high	45 Å²	45	43.1 Å²	43.1	22%	0.222	23%	0.233	C	C	.	.	H	α-helix	trans	-64.2	-41.8	176.1	-176.2	-90.7	116.4	0	0	111.3	L297 L304 R421 T422 L423 K428 H429	L297-M425 HydrophobicContact CD1-CB 3.98Å; L297-M425 HydrophobicContact CD1-CG 4.16Å; L304-M425 HydrophobicContact CD2-CE 3.34Å; L304-M425 HydrophobicContact CD2-SD 4.23Å; R421-M425 WeakPolarHBondContact O-CB 3.42Å; R421-M425 PolarHBondContact O-N 3.2Å; T422-M425 PolarHBondContact O-N 3.04Å; L423-M425 PolarHBondContact O-N 3.15Å; M425-K428 PolarHBondContact O-N 3.41Å; M425-H429 HydrophobicContact CE-CB 3.7Å; M425-H429 PolarHBondContact O-N 2.92Å
426	T	97.2	Very high	96.5	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-44.3	177.6	-55.9	0	0	0	0	111.7	Q385 T422 L423 S424 H429 L430 Y468	Q385-T426 VanDerWaalsContact NE2-CG2 3.31Å; T422-T426 PolarHBondContact O-N 3.41Å; T422-T426 PolarHBondContact O-OG1 3.05Å; L423-T426 PolarHBondContact O-N 3.42Å; S424-T426 VanDerWaalsContact C-N 3.35Å; T426-H429 PolarHBondContact O-N 2.9Å; T426-L430 PolarHBondContact O-N 3.41Å; T426-Y468 WeakPolarHBondContact CG2-OH 3.35Å
427	L	97.8	Very high	96.3	Very high	19 Å²	19	45.4 Å²	45.4	10%	0.099	25%	0.248	C	C	.	.	H	α-helix	trans	-59.1	-47.7	175.3	-73.8	170.8	0	0	0	112.1	L423 H429 L430 E431 Y468 Q471 V472 L475	L423-L427 WeakPolarHBondContact O-CG 3.44Å; L423-L427 PolarHBondContact O-N 3.17Å; L427-H429 VanDerWaalsContact C-N 3.28Å; L427-H429 PolarHBondContact O-N 2.88Å; L427-L430 WeakPolarHBondContact O-CB 3.4Å; L427-L430 PolarHBondContact O-N 3.28Å; L427-L430 VanDerWaalsContact O-N 3.15Å; L427-E431 WeakPolarHBondContact O-CB 3.47Å; L427-E431 PolarHBondContact O-N 3.2Å; L427-Y468 HydrophobicContact CD1-CD2 4.08Å; L427-Y468 HydrophobicContact CD1-CE2 4.26Å; L427-Y468 HydrophobicContact CD2-CD2 4.24Å; L427-Y468 HydrophobicContact CD2-CE2 3.94Å; L427-Y468 HydrophobicContact CG-CD2 4.05Å; L427-Y468 HydrophobicContact CG-CE2 3.73Å; L427-Q471 HydrophobicContact CD1-CB 4.16Å; L427-Q471 HydrophobicContact CD2-CB 3.98Å; L427-V472 HydrophobicContact CD2-CG2 3.61Å; L427-L475 HydrophobicContact CD2-CD1 4.15Å
428	K	97.6	Very high	96.1	Very high	150 Å²	150	45 Å²	45	65%	0.652	24%	0.236	S	C	*	.	H	α-helix	trans	-61.2	-36.9	178	-75.1	179.7	178.5	-173.6	0	112.9	S424 M425 S432	S424-K428 WeakPolarHBondContact O-CG 3.35Å; S424-K428 PolarHBondContact O-N 2.88Å; M425-K428 PolarHBondContact O-N 3.41Å; K428-S432 WeakPolarHBondContact O-CB 3.24Å; K428-S432 PolarHBondContact O-N 3.38Å; K428-S432 VanDerWaalsContact O-N 3.08Å
429	H	96.2	Very high	95.9	Very high	43 Å²	43	45.9 Å²	45.9	20%	0.199	24%	0.241	C	C	.	.	H	α-helix	trans	-66.6	-44.4	174.9	173.2	71.5	0	0	0	111.7	L304 M425 T426 L427 S432 Y433	L304-H429 HydrophobicContact CD2-CB 3.88Å; M425-H429 HydrophobicContact CE-CB 3.7Å; M425-H429 PolarHBondContact O-N 2.92Å; T426-H429 PolarHBondContact O-N 2.9Å; L427-H429 VanDerWaalsContact C-N 3.28Å; L427-H429 PolarHBondContact O-N 2.88Å; H429-S432 PolarHBondContact O-N 3.39Å; H429-Y433 WeakPolarHBondContact O-CB 3.41Å; H429-Y433 PolarHBondContact O-N 2.99Å
430	L	97.3	Very high	95.7	Very high	5 Å²	5	46 Å²	46	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-60.8	-45.9	177.4	179.8	62.4	0	0	0	111.4	F378 F382 T426 L427 S432 Y433 L434 V472 L475 L476	F378-L430 HydrophobicContact CZ-CD1 4.32Å; F382-L430 HydrophobicContact CD2-CD1 4.18Å; F382-L430 HydrophobicContact CE2-CD1 3.82Å; F382-L430 HydrophobicContact CE2-CD2 4.1Å; T426-L430 PolarHBondContact O-N 3.41Å; L427-L430 WeakPolarHBondContact O-CB 3.4Å; L427-L430 PolarHBondContact O-N 3.28Å; L427-L430 VanDerWaalsContact O-N 3.15Å; L430-S432 VanDerWaalsContact C-N 3.34Å; L430-S432 PolarHBondContact O-N 3.17Å; L430-Y433 PolarHBondContact O-N 2.87Å; L430-L434 HydrophobicContact CD1-CD1 3.86Å; L430-L434 HydrophobicContact CD1-CD2 4.46Å; L430-L434 HydrophobicContact CD1-CG 3.92Å; L430-L434 HydrophobicContact CD2-CD1 4.39Å; L430-L434 HydrophobicContact CG-CD1 3.75Å; L430-L434 HydrophobicContact CG-CG 4.23Å; L430-L434 WeakPolarHBondContact O-CB 3.49Å; L430-L434 VanDerWaalsContact O-CG 3.27Å; L430-L434 WeakPolarHBondContact O-CG 3.46Å; L430-L434 PolarHBondContact O-N 2.86Å; L430-V472 HydrophobicContact CD2-CB 4.41Å; L430-V472 HydrophobicContact CD2-CG1 3.75Å; L430-V472 HydrophobicContact CD2-CG2 4.42Å; L430-L475 HydrophobicContact CD2-CD1 4.23Å; L430-L475 HydrophobicContact CG-CD1 4.48Å; L430-L476 HydrophobicContact CD1-CD2 4.37Å
431	E	97.2	Very high	95.6	Very high	115 Å²	115	45.4 Å²	45.4	54%	0.537	24%	0.236	S	C	.	.	H	α-helix	trans	-56.5	-47	175.6	-176.6	-179.9	-164.3	0	0	111.7	L427 L434 A435 L475	L427-E431 WeakPolarHBondContact O-CB 3.47Å; L427-E431 PolarHBondContact O-N 3.2Å; E431-L434 PolarHBondContact O-N 3.49Å; E431-A435 PolarHBondContact O-N 3.1Å; E431-A435 VanDerWaalsContact O-N 3.15Å; E431-L475 HydrophobicContact CB-CD1 4.33Å; E431-L475 HydrophobicContact CB-CD2 4.35Å; E431-L475 HydrophobicContact CG-CD2 4.31Å
432	S	95.9	Very high	95.4	Very high	87 Å²	87	39.2 Å²	39.2	61%	0.608	21%	0.213	S	C	*	.	H	α-helix	trans	-62	-43	176.7	179.2	0	0	0	0	112.7	K428 H429 L430 A435	K428-S432 WeakPolarHBondContact O-CB 3.24Å; K428-S432 PolarHBondContact O-N 3.38Å; K428-S432 VanDerWaalsContact O-N 3.08Å; H429-S432 PolarHBondContact O-N 3.39Å; L430-S432 VanDerWaalsContact C-N 3.34Å; L430-S432 PolarHBondContact O-N 3.17Å; S432-A435 WeakPolarHBondContact O-CB 3.41Å
433	Y	94.2	Very high	95.3	Very high	35 Å²	35	39.4 Å²	39.4	14%	0.137	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-44.5	177	179.9	-90	0	0	0	112.1	M308 Q311 F378 H429 L430 A435 D436 C437	M308-Y433 HydrophobicContact CE-CD2 3.9Å; M308-Y433 HydrophobicContact CE-CE2 4.02Å; Q311-Y433 PolarHBondContact NE2-OH 3.43Å; F378-Y433 HydrophobicContact CB-CE1 4.39Å; F378-Y433 WeakPolarHBondContact CB-OH 3.28Å; F378-Y433 HydrophobicContact CD1-CD1 4.17Å; F378-Y433 AromaticContact CD1-CE1 3.43Å; F378-Y433 HydrophobicContact CD1-CE1 3.43Å; F378-Y433 VanDerWaalsContact CD1-CE1 3.43Å; F378-Y433 AromaticContact CD1-CZ 3.77Å; F378-Y433 HydrophobicContact CD2-CD1 4.14Å; F378-Y433 HydrophobicContact CD2-CD2 4.02Å; F378-Y433 AromaticContact CD2-CE1 3.61Å; F378-Y433 HydrophobicContact CD2-CE1 3.61Å; F378-Y433 AromaticContact CD2-CE2 3.46Å; F378-Y433 HydrophobicContact CD2-CE2 3.46Å; F378-Y433 VanDerWaalsContact CD2-CE2 3.46Å; F378-Y433 HydrophobicContact CD2-CG 4.33Å; F378-Y433 AromaticContact CD2-CZ 3.24Å; F378-Y433 AromaticContact CE1-CD1 3.66Å; F378-Y433 HydrophobicContact CE1-CD1 3.66Å; F378-Y433 AromaticContact CE1-CE1 3.41Å; F378-Y433 HydrophobicContact CE1-CE1 3.41Å; F378-Y433 VanDerWaalsContact CE1-CE1 3.41Å; F378-Y433 AromaticContact CE2-CD1 3.63Å; F378-Y433 HydrophobicContact CE2-CD1 3.63Å; F378-Y433 AromaticContact CE2-CD2 3.7Å; F378-Y433 HydrophobicContact CE2-CD2 3.7Å; F378-Y433 AromaticContact CE2-CE1 3.59Å; F378-Y433 HydrophobicContact CE2-CE1 3.59Å; F378-Y433 AromaticContact CE2-CE2 3.65Å; F378-Y433 HydrophobicContact CE2-CE2 3.65Å; F378-Y433 AromaticContact CE2-CG 3.69Å; F378-Y433 HydrophobicContact CE2-CG 3.69Å; F378-Y433 AromaticContact CE2-CZ 3.61Å; F378-Y433 HydrophobicContact CG-CD1 4.38Å; F378-Y433 AromaticContact CG-CE1 3.52Å; F378-Y433 HydrophobicContact CG-CE1 3.52Å; F378-Y433 HydrophobicContact CG-CE2 4.04Å; F378-Y433 AromaticContact CG-CZ 3.32Å; F378-Y433 WeakPolarHBondContact CG-OH 3.35Å; F378-Y433 AromaticContact CZ-CD1 3.35Å; F378-Y433 HydrophobicContact CZ-CD1 3.35Å; F378-Y433 HydrophobicContact CZ-CD2 4.28Å; F378-Y433 AromaticContact CZ-CE1 3.48Å; F378-Y433 HydrophobicContact CZ-CE1 3.48Å; F378-Y433 VanDerWaalsContact CZ-CE1 3.48Å; F378-Y433 HydrophobicContact CZ-CE2 4.37Å; F378-Y433 AromaticContact CZ-CG 3.8Å; F378-Y433 HydrophobicContact CZ-CG 3.8Å; H429-Y433 WeakPolarHBondContact O-CB 3.41Å; H429-Y433 PolarHBondContact O-N 2.99Å; L430-Y433 PolarHBondContact O-N 2.87Å; Y433-A435 VanDerWaalsContact C-N 3.26Å; Y433-A435 PolarHBondContact O-N 3.06Å; Y433-D436 PolarHBondContact O-N 3.44Å; Y433-C437 HydrophobicContact CD1-CB 4.16Å; Y433-C437 HydrophobicContact CE1-CB 3.79Å; Y433-C437 PolarHBondContact O-N 3.42Å
434	L	95.6	Very high	95.2	Very high	8 Å²	8	39 Å²	39	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-68.2	-23.8	-177.6	-71.2	174.1	0	0	0	113.1	L430 E431 D436 C437 V443 L475 L476 R479	L430-L434 HydrophobicContact CD1-CD1 3.86Å; L430-L434 HydrophobicContact CD1-CD2 4.46Å; L430-L434 HydrophobicContact CD1-CG 3.92Å; L430-L434 HydrophobicContact CD2-CD1 4.39Å; L430-L434 HydrophobicContact CG-CD1 3.75Å; L430-L434 HydrophobicContact CG-CG 4.23Å; L430-L434 WeakPolarHBondContact O-CB 3.49Å; L430-L434 VanDerWaalsContact O-CG 3.27Å; L430-L434 WeakPolarHBondContact O-CG 3.46Å; L430-L434 PolarHBondContact O-N 2.86Å; E431-L434 PolarHBondContact O-N 3.49Å; L434-D436 PolarHBondContact O-N 3.33Å; L434-C437 HydrophobicContact CD2-CB 4.49Å; L434-C437 PolarHBondContact O-N 2.92Å; L434-V443 HydrophobicContact CD2-CG2 3.98Å; L434-L475 HydrophobicContact CD1-CB 3.94Å; L434-L476 HydrophobicContact CD1-CD2 3.89Å; L434-L476 HydrophobicContact CD1-CG 4.39Å; L434-L476 HydrophobicContact CD2-CD2 3.96Å; L434-R479 HydrophobicContact CB-CG 4.29Å; L434-R479 HydrophobicContact CD2-CB 4.44Å; L434-R479 HydrophobicContact CD2-CG 4.17Å; L434-R479 VanDerWaalsContact O-CD 3.32Å; L434-R479 WeakPolarHBondContact O-CD 3.36Å; L434-R479 PolarHBondContact O-NE 3.42Å; L434-R479 PolarHBondContact O-NH1 2.96Å
435	A	93.8	Very high	95.1	Very high	66 Å²	66	36.1 Å²	36.1	55%	0.545	19%	0.191	S	C	.	.	H	α-helix	trans	-54.5	-34.8	176.8	0	0	0	0	0	112.4	E431 S432 Y433 R479	E431-A435 PolarHBondContact O-N 3.1Å; E431-A435 VanDerWaalsContact O-N 3.15Å; S432-A435 WeakPolarHBondContact O-CB 3.41Å; Y433-A435 VanDerWaalsContact C-N 3.26Å; Y433-A435 PolarHBondContact O-N 3.06Å; A435-R479 PolarHBondContact O-NH1 3.01Å; A435-R479 PolarHBondContact O-NH2 3.11Å
436	D	90.9	Very high	95.1	Very high	117 Å²	117	34 Å²	34	63%	0.626	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.6	24.1	-176	-154.9	36.9	0	0	0	113.8	Y433 L434 Y438	Y433-D436 PolarHBondContact O-N 3.44Å; L434-D436 PolarHBondContact O-N 3.33Å; D436-Y438 WeakPolarHBondContact O-CE2 3.36Å; D436-Y438 WeakPolarHBondContact OD1-CE2 3.28Å; D436-Y438 PolarHBondContact OD1-OH 3.03Å; D436-Y438 VanDerWaalsContact OD1-OH 3.08Å
437	C	91.7	Very high	95.1	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.014	18%	0.181	C	C	.	.			trans	-96.8	119.6	177.7	-179.6	0	0	0	0	111.4	Y433 L434 R479 I483	Y433-C437 HydrophobicContact CD1-CB 4.16Å; Y433-C437 HydrophobicContact CE1-CB 3.79Å; Y433-C437 PolarHBondContact O-N 3.42Å; L434-C437 HydrophobicContact CD2-CB 4.49Å; L434-C437 PolarHBondContact O-N 2.92Å; C437-R479 VanDerWaalsContact C-NH2 3.31Å; C437-R479 PolarHBondContact O-NE 3.27Å; C437-R479 PolarHBondContact O-NH2 3.41Å; C437-I483 VanDerWaalsContact O-CD1 3.31Å; C437-I483 WeakPolarHBondContact O-CD1 3.41Å
438	Y	92.7	Very high	95.1	Very high	38 Å²	38	33 Å²	33	15%	0.149	18%	0.176	C	C	.	.			trans	-110.5	9.7	179.6	-55.8	-87.7	0	0	0	113.8	K318 D436 A440 R479 I483 M486	K318-Y438 HydrophobicContact CB-CD1 4.24Å; K318-Y438 HydrophobicContact CB-CD2 4.41Å; K318-Y438 HydrophobicContact CB-CE1 3.77Å; K318-Y438 HydrophobicContact CB-CE2 3.96Å; K318-Y438 HydrophobicContact CD-CE1 4.48Å; K318-Y438 HydrophobicContact CG-CD1 4.41Å; K318-Y438 HydrophobicContact CG-CE1 3.77Å; D436-Y438 WeakPolarHBondContact O-CE2 3.36Å; D436-Y438 WeakPolarHBondContact OD1-CE2 3.28Å; D436-Y438 PolarHBondContact OD1-OH 3.03Å; D436-Y438 VanDerWaalsContact OD1-OH 3.08Å; Y438-A440 PolarHBondContact O-N 2.88Å; Y438-R479 VanDerWaalsContact CE1-NH2 3.27Å; Y438-I483 WeakPolarHBondContact O-CG2 3.42Å; Y438-M486 HydrophobicContact CD1-CE 4.21Å; Y438-M486 HydrophobicContact CE1-CE 4.19Å
439	D	92.8	Very high	95.1	Very high	20 Å²	20	25.9 Å²	25.9	11%	0.107	15%	0.145	C	C	.	.			trans	-88.7	97	177	-173.9	-21.6	0	0	0	110.8	A316 R350 I441 A442 V443	A316-D439 HydrophobicContact CB-CB 4.05Å; R350-D439 IonicContact CZ-OD1 3.31Å; R350-D439 IonicContact CZ-OD2 2.91Å; R350-D439 VanDerWaalsContact CZ-OD2 3.24Å; R350-D439 IonicContact NH1-OD1 2.63Å; R350-D439 PolarHBondContact NH1-OD1 2.96Å; R350-D439 IonicContact NH1-OD2 3.58Å; R350-D439 PolarHBondContact NH1-OD2 3.12Å; R350-D439 IonicContact NH2-OD1 3.87Å; R350-D439 IonicContact NH2-OD2 2.97Å; R350-D439 PolarHBondContact NH2-OD2 3.22Å; D439-I441 VanDerWaalsContact C-N 3.32Å; D439-I441 PolarHBondContact O-N 3.5Å; D439-I441 PolarHBondContact OD1-N 3.19Å; D439-A442 HydrophobicContact CB-CB 3.83Å; D439-A442 VanDerWaalsContact CG-CB 3.48Å; D439-A442 PolarHBondContact O-N 2.95Å; D439-A442 PolarHBondContact OD1-N 3.33Å; D439-V443 WeakPolarHBondContact O-CG2 3.44Å; D439-V443 PolarHBondContact O-N 3.25Å
440	A	94	Very high	95.1	Very high	3 Å²	3	23.9 Å²	23.9	3%	0.025	14%	0.136	C	C	.	.	H	α-helix	trans	-63	-34.8	179.4	0	0	0	0	0	113.3	Y438 V443 F444 F480 I483 F516	Y438-A440 PolarHBondContact O-N 2.88Å; A440-V443 PolarHBondContact O-N 3.42Å; A440-F444 VanDerWaalsContact O-CB 3.31Å; A440-F444 WeakPolarHBondContact O-CB 3.27Å; A440-F444 PolarHBondContact O-N 3.48Å; A440-F480 HydrophobicContact CB-CD2 4.31Å; A440-F480 HydrophobicContact CB-CE2 4.32Å; A440-I483 HydrophobicContact CB-CB 4.23Å; A440-I483 HydrophobicContact CB-CG2 3.69Å; A440-F516 HydrophobicContact CB-CE2 3.79Å; A440-F516 HydrophobicContact CB-CZ 3.75Å
441	I	93.8	Very high	95.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-68.7	-42.4	179.3	-62.6	179.5	0	0	0	109.8	I344 L347 D439 V443 F444 L445 F516 A519 I523	I344-I441 WeakPolarHBondContact O-CD1 3.26Å; L347-I441 HydrophobicContact CD1-CG2 3.94Å; D439-I441 VanDerWaalsContact C-N 3.32Å; D439-I441 PolarHBondContact O-N 3.5Å; D439-I441 PolarHBondContact OD1-N 3.19Å; I441-V443 PolarHBondContact O-N 2.93Å; I441-F444 PolarHBondContact O-N 3.48Å; I441-L445 HydrophobicContact CG2-CD1 3.9Å; I441-L445 HydrophobicContact CG2-CG 4.32Å; I441-L445 WeakPolarHBondContact O-CB 3.33Å; I441-L445 VanDerWaalsContact O-CG 3.32Å; I441-L445 WeakPolarHBondContact O-CG 3.35Å; I441-L445 PolarHBondContact O-N 3.4Å; I441-F516 HydrophobicContact CD1-CD2 4.08Å; I441-F516 HydrophobicContact CD1-CE2 4.47Å; I441-F516 HydrophobicContact CG1-CD2 4Å; I441-F516 HydrophobicContact CG1-CE2 3.89Å; I441-A519 HydrophobicContact CD1-CB 3.81Å; I441-A519 HydrophobicContact CG1-CB 4.48Å; I441-I523 HydrophobicContact CG2-CD1 4.29Å
442	A	93.8	Very high	95	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.008	12%	0.124	C	C	.	.	H	α-helix	trans	-57.3	-50	175.3	0	0	0	0	0	111.5	R350 E379 D439 F444 L445 C446	R350-A442 VanDerWaalsContact NH2-CB 3.32Å; E379-A442 WeakPolarHBondContact OE2-CB 3.46Å; D439-A442 HydrophobicContact CB-CB 3.83Å; D439-A442 VanDerWaalsContact CG-CB 3.48Å; D439-A442 PolarHBondContact O-N 2.95Å; D439-A442 PolarHBondContact OD1-N 3.33Å; A442-F444 VanDerWaalsContact C-N 3.33Å; A442-F444 PolarHBondContact O-N 3.04Å; A442-L445 PolarHBondContact O-N 2.85Å; A442-C446 PolarHBondContact O-N 2.85Å; A442-C446 PolarHBondContact O-SG 2.73Å
443	V	96.2	Very high	95	Very high	3 Å²	3	17.3 Å²	17.3	2%	0.018	10%	0.095	C	C	.	.	H	α-helix	trans	-63	-43	-179.2	179.5	0	0	0	0	110.1	L434 D439 A440 I441 C446 I447 L476 F480 I483	L434-V443 HydrophobicContact CD2-CG2 3.98Å; D439-V443 WeakPolarHBondContact O-CG2 3.44Å; D439-V443 PolarHBondContact O-N 3.25Å; A440-V443 PolarHBondContact O-N 3.42Å; I441-V443 PolarHBondContact O-N 2.93Å; V443-C446 WeakPolarHBondContact O-CB 3.44Å; V443-C446 PolarHBondContact O-N 3.38Å; V443-I447 HydrophobicContact CG1-CD1 4.4Å; V443-I447 WeakPolarHBondContact O-CG1 3.31Å; V443-I447 PolarHBondContact O-N 3.02Å; V443-L476 HydrophobicContact CG1-CB 4.28Å; V443-L476 HydrophobicContact CG1-CD2 3.93Å; V443-L476 WeakPolarHBondContact CG1-O 3.42Å; V443-F480 HydrophobicContact CG1-CB 3.79Å; V443-I483 HydrophobicContact CG2-CD1 4.25Å
444	F	95.8	Very high	95.1	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-66.4	-39.2	178.7	-162.4	-123.1	0	0	0	112.6	A440 I441 A442 C446 I447 H448 W477 F480 L520 I523 N524 T532	A440-F444 VanDerWaalsContact O-CB 3.31Å; A440-F444 WeakPolarHBondContact O-CB 3.27Å; A440-F444 PolarHBondContact O-N 3.48Å; I441-F444 PolarHBondContact O-N 3.48Å; A442-F444 VanDerWaalsContact C-N 3.33Å; A442-F444 PolarHBondContact O-N 3.04Å; F444-C446 VanDerWaalsContact C-N 3.34Å; F444-C446 PolarHBondContact O-N 3.14Å; F444-I447 HydrophobicContact CD2-CD1 4.27Å; F444-I447 WeakPolarHBondContact O-CB 3.49Å; F444-I447 PolarHBondContact O-N 3.37Å; F444-H448 AromaticContact CE1-CD2 3.88Å; F444-H448 AromaticContact CE1-NE2 3.56Å; F444-H448 AromaticContact CE2-CD2 3.9Å; F444-H448 AromaticContact CE2-NE2 3.6Å; F444-H448 AromaticContact CZ-CD2 3.74Å; F444-H448 AromaticContact CZ-NE2 3.15Å; F444-H448 WeakPolarHBondContact CZ-NE2 3.47Å; F444-H448 PolarHBondContact O-CD2 3.42Å; F444-H448 PolarHBondContact O-N 3.14Å; F444-W477 HydrophobicContact CE2-CH2 4.15Å; F444-W477 HydrophobicContact CE2-CZ3 4.24Å; F444-F480 HydrophobicContact CB-CD2 3.97Å; F444-F480 HydrophobicContact CB-CE2 3.78Å; F444-F480 HydrophobicContact CB-CZ 4.5Å; F444-F480 HydrophobicContact CD2-CD1 4.36Å; F444-F480 HydrophobicContact CD2-CD2 4.2Å; F444-F480 HydrophobicContact CD2-CE1 4.03Å; F444-F480 AromaticContact CD2-CE2 3.86Å; F444-F480 HydrophobicContact CD2-CE2 3.86Å; F444-F480 HydrophobicContact CD2-CG 4.44Å; F444-F480 AromaticContact CD2-CZ 3.76Å; F444-F480 HydrophobicContact CD2-CZ 3.76Å; F444-F480 HydrophobicContact CE2-CE1 4.29Å; F444-F480 HydrophobicContact CE2-CZ 4.22Å; F444-F480 HydrophobicContact CG-CD2 4.42Å; F444-F480 AromaticContact CG-CE2 3.94Å; F444-F480 HydrophobicContact CG-CE2 3.94Å; F444-F480 HydrophobicContact CG-CZ 4.17Å; F444-L520 HydrophobicContact CB-CD2 3.93Å; F444-L520 HydrophobicContact CD1-CD2 3.42Å; F444-L520 VanDerWaalsContact CD1-CD2 3.42Å; F444-L520 HydrophobicContact CE1-CD2 4.11Å; F444-L520 HydrophobicContact CG-CD2 3.81Å; F444-I523 HydrophobicContact CD1-CB 3.87Å; F444-I523 HydrophobicContact CD1-CD1 3.97Å; F444-I523 HydrophobicContact CD1-CG2 3.53Å; F444-I523 HydrophobicContact CE1-CB 3.76Å; F444-I523 HydrophobicContact CE1-CG2 3.49Å; F444-I523 VanDerWaalsContact CE1-CG2 3.49Å; F444-I523 HydrophobicContact CZ-CG2 4.46Å; F444-N524 HydrophobicContact CE1-CB 4.18Å; F444-N524 HydrophobicContact CZ-CB 4.09Å; F444-T532 HydrophobicContact CE2-CG2 4.09Å; F444-T532 HydrophobicContact CZ-CG2 3.95Å
445	L	95.9	Very high	95	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.4	-42.3	170.9	-73.5	170.2	0	0	0	111.4	L347 R350 V353 I354 E379 I441 A442 I447 H448 I449 I523	L347-L445 HydrophobicContact CD1-CD1 4.23Å; L347-L445 HydrophobicContact CD1-CD2 4.47Å; R350-L445 HydrophobicContact CB-CD1 3.99Å; V353-L445 HydrophobicContact CG1-CB 4.31Å; V353-L445 HydrophobicContact CG1-CD1 4.31Å; V353-L445 HydrophobicContact CG1-CD2 4.1Å; V353-L445 HydrophobicContact CG1-CG 4.49Å; I354-L445 HydrophobicContact CD1-CD2 4.14Å; I354-L445 HydrophobicContact CG1-CD2 4.18Å; I354-L445 HydrophobicContact CG2-CD2 3.99Å; E379-L445 HydrophobicContact CB-CB 3.97Å; E379-L445 HydrophobicContact CG-CB 4.16Å; E379-L445 HydrophobicContact CG-CD1 3.8Å; I441-L445 HydrophobicContact CG2-CD1 3.9Å; I441-L445 HydrophobicContact CG2-CG 4.32Å; I441-L445 WeakPolarHBondContact O-CB 3.33Å; I441-L445 VanDerWaalsContact O-CG 3.32Å; I441-L445 WeakPolarHBondContact O-CG 3.35Å; I441-L445 PolarHBondContact O-N 3.4Å; A442-L445 PolarHBondContact O-N 2.85Å; L445-I447 VanDerWaalsContact C-N 3.32Å; L445-I447 PolarHBondContact O-N 3.37Å; L445-H448 PolarHBondContact O-N 2.85Å; L445-I449 WeakPolarHBondContact O-CD1 3.38Å; L445-I449 VanDerWaalsContact O-CG1 3.23Å; L445-I449 WeakPolarHBondContact O-CG1 3.34Å; L445-I449 PolarHBondContact O-N 3.23Å; L445-I523 HydrophobicContact CD2-CD1 3.52Å; L445-I523 HydrophobicContact CD2-CG1 3.78Å; L445-I523 HydrophobicContact CD2-CG2 4.41Å; L445-I523 HydrophobicContact CG-CD1 3.78Å
446	C	97.4	Very high	95	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.2	-40.7	175.1	-66	0	0	0	0	112.2	F382 A442 V443 F444 I449 V450 L476	F382-C446 HydrophobicContact CD1-CB 3.89Å; F382-C446 HydrophobicContact CD2-CB 4.43Å; F382-C446 HydrophobicContact CE1-CB 3.85Å; F382-C446 HydrophobicContact CE2-CB 4.37Å; F382-C446 HydrophobicContact CG-CB 4.2Å; F382-C446 VanDerWaalsContact CG-SG 3.57Å; F382-C446 HydrophobicContact CZ-CB 4.09Å; A442-C446 PolarHBondContact O-N 2.85Å; A442-C446 PolarHBondContact O-SG 2.73Å; V443-C446 WeakPolarHBondContact O-CB 3.44Å; V443-C446 PolarHBondContact O-N 3.38Å; F444-C446 VanDerWaalsContact C-N 3.34Å; F444-C446 PolarHBondContact O-N 3.14Å; C446-I449 PolarHBondContact O-N 3.02Å; C446-V450 VanDerWaalsContact O-CG2 3.31Å; C446-V450 WeakPolarHBondContact O-CG2 3.39Å; C446-V450 PolarHBondContact O-N 2.81Å; C446-L476 HydrophobicContact CB-CD1 4.07Å; C446-L476 HydrophobicContact CB-CD2 3.94Å
447	I	97.6	Very high	95.2	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-58	-51.4	173.4	-70.2	167.7	0	0	0	110.1	V443 F444 L445 I449 V450 L451 L473 L476 W477 F480	V443-I447 HydrophobicContact CG1-CD1 4.4Å; V443-I447 WeakPolarHBondContact O-CG1 3.31Å; V443-I447 PolarHBondContact O-N 3.02Å; F444-I447 HydrophobicContact CD2-CD1 4.27Å; F444-I447 WeakPolarHBondContact O-CB 3.49Å; F444-I447 PolarHBondContact O-N 3.37Å; L445-I447 VanDerWaalsContact C-N 3.32Å; L445-I447 PolarHBondContact O-N 3.37Å; I447-I449 VanDerWaalsContact C-N 3.33Å; I447-I449 PolarHBondContact O-N 3.41Å; I447-V450 PolarHBondContact O-N 3.19Å; I447-V450 VanDerWaalsContact O-N 3.15Å; I447-L451 HydrophobicContact CG2-CD1 3.9Å; I447-L451 HydrophobicContact CG2-CG 4.4Å; I447-L451 WeakPolarHBondContact O-CG 3.48Å; I447-L451 PolarHBondContact O-N 3.5Å; I447-L473 HydrophobicContact CG2-CD2 4.05Å; I447-L476 HydrophobicContact CD1-CB 4.06Å; I447-L476 HydrophobicContact CG1-CB 3.54Å; I447-L476 HydrophobicContact CG1-CD1 3.99Å; I447-L476 HydrophobicContact CG1-CG 4.32Å; I447-W477 HydrophobicContact CD1-CD2 3.82Å; I447-W477 HydrophobicContact CD1-CE3 3.78Å; I447-W477 HydrophobicContact CD1-CG 4.34Å; I447-W477 HydrophobicContact CD1-CH2 4.35Å; I447-W477 HydrophobicContact CD1-CZ2 4.42Å; I447-W477 HydrophobicContact CD1-CZ3 4.05Å; I447-W477 HydrophobicContact CG2-CH2 3.84Å; I447-W477 HydrophobicContact CG2-CZ2 3.37Å; I447-F480 HydrophobicContact CD1-CB 4.08Å; I447-F480 HydrophobicContact CD1-CG 4.39Å
448	H	96.4	Very high	95.2	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-66.7	-32.7	-178.3	-82.9	-101.3	0	0	0	113.2	I354 F444 L445 R452 I523 I527	I354-H448 HydrophobicContact CG2-CB 4.07Å; F444-H448 AromaticContact CE1-CD2 3.88Å; F444-H448 AromaticContact CE1-NE2 3.56Å; F444-H448 AromaticContact CE2-CD2 3.9Å; F444-H448 AromaticContact CE2-NE2 3.6Å; F444-H448 AromaticContact CZ-CD2 3.74Å; F444-H448 AromaticContact CZ-NE2 3.15Å; F444-H448 WeakPolarHBondContact CZ-NE2 3.47Å; F444-H448 PolarHBondContact O-CD2 3.42Å; F444-H448 PolarHBondContact O-N 3.14Å; L445-H448 PolarHBondContact O-N 2.85Å; H448-R452 VanDerWaalsContact O-CD 3.28Å; H448-R452 WeakPolarHBondContact O-CD 3.48Å; H448-R452 VanDerWaalsContact O-CG 3.27Å; H448-R452 WeakPolarHBondContact O-CG 3.39Å; H448-R452 PolarHBondContact O-N 3.48Å; H448-R452 VanDerWaalsContact O-N 3.14Å; H448-I523 HydrophobicContact CB-CG2 4.07Å; H448-I523 VanDerWaalsContact CD2-CG2 3.42Å; H448-I523 WeakPolarHBondContact CD2-CG2 3.21Å; H448-I523 PolarHBondContact CE1-O 3.47Å; H448-I523 VanDerWaalsContact CG-CG2 3.47Å; H448-I523 PolarHBondContact ND1-O 2.91Å; H448-I527 PolarHBondContact CE1-O 3.15Å
449	I	97.4	Very high	95.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-59.3	-50.4	170	-71.2	160.9	0	0	0	109.8	V353 I354 L359 E379 F382 R383 L445 C446 I447 L451 R452 F453	V353-I449 HydrophobicContact CG1-CD1 4.05Å; V353-I449 HydrophobicContact CG2-CD1 4.04Å; I354-I449 HydrophobicContact CG2-CG1 3.85Å; L359-I449 HydrophobicContact CD1-CG1 4.42Å; L359-I449 HydrophobicContact CD1-CG2 4.41Å; E379-I449 HydrophobicContact CB-CD1 4.41Å; F382-I449 HydrophobicContact CD1-CD1 4.27Å; F382-I449 HydrophobicContact CD1-CG2 4.28Å; F382-I449 HydrophobicContact CE1-CB 4.44Å; F382-I449 HydrophobicContact CE1-CG2 4.17Å; R383-I449 HydrophobicContact CB-CD1 3.86Å; R383-I449 HydrophobicContact CG-CD1 4.37Å; R383-I449 HydrophobicContact CG-CG2 4.45Å; L445-I449 WeakPolarHBondContact O-CD1 3.38Å; L445-I449 VanDerWaalsContact O-CG1 3.23Å; L445-I449 WeakPolarHBondContact O-CG1 3.34Å; L445-I449 PolarHBondContact O-N 3.23Å; C446-I449 PolarHBondContact O-N 3.02Å; I447-I449 VanDerWaalsContact C-N 3.33Å; I447-I449 PolarHBondContact O-N 3.41Å; I449-L451 PolarHBondContact O-N 3.04Å; I449-R452 PolarHBondContact O-N 2.97Å; I449-F453 HydrophobicContact CG2-CD2 3.65Å; I449-F453 HydrophobicContact CG2-CE1 4.4Å; I449-F453 HydrophobicContact CG2-CE2 3.27Å; I449-F453 HydrophobicContact CG2-CG 4.35Å; I449-F453 HydrophobicContact CG2-CZ 3.7Å; I449-F453 WeakPolarHBondContact O-CG 3.23Å; I449-F453 PolarHBondContact O-N 2.81Å
450	V	97.6	Very high	95.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63.1	-44.5	-178.8	173.7	0	0	0	0	111.5	F382 C446 I447 R452 F453 R454 W469 V472 L473 L476	F382-V450 HydrophobicContact CE1-CG2 3.77Å; F382-V450 HydrophobicContact CZ-CG2 3.7Å; C446-V450 VanDerWaalsContact O-CG2 3.31Å; C446-V450 WeakPolarHBondContact O-CG2 3.39Å; C446-V450 PolarHBondContact O-N 2.81Å; I447-V450 PolarHBondContact O-N 3.19Å; I447-V450 VanDerWaalsContact O-N 3.15Å; V450-R452 PolarHBondContact O-N 3.13Å; V450-F453 PolarHBondContact O-N 3.03Å; V450-R454 WeakPolarHBondContact O-CG 3.25Å; V450-R454 PolarHBondContact O-N 3.43Å; V450-W469 HydrophobicContact CG1-CB 4.08Å; V450-W469 HydrophobicContact CG1-CD2 4.32Å; V450-W469 HydrophobicContact CG1-CE3 3.76Å; V450-W469 HydrophobicContact CG1-CG 4.49Å; V450-W469 HydrophobicContact CG2-CE3 4.42Å; V450-V472 HydrophobicContact CG1-CG1 4.43Å; V450-V472 HydrophobicContact CG2-CG1 3.57Å; V450-L473 HydrophobicContact CB-CD2 4.03Å; V450-L473 HydrophobicContact CB-CG 4.44Å; V450-L473 HydrophobicContact CG1-CD1 4.16Å; V450-L473 HydrophobicContact CG1-CD2 3.86Å; V450-L473 HydrophobicContact CG1-CG 3.72Å; V450-L476 HydrophobicContact CG2-CD1 4.28Å
451	L	95.9	Very high	95.1	Very high	35 Å²	35	33 Å²	33	18%	0.183	16%	0.163	C	C	.	.	H	α-helix	trans	-57.7	-38.1	176.8	-68.6	171.5	0	0	0	111.8	I447 I449 N455 L473 I527	I447-L451 HydrophobicContact CG2-CD1 3.9Å; I447-L451 HydrophobicContact CG2-CG 4.4Å; I447-L451 WeakPolarHBondContact O-CG 3.48Å; I447-L451 PolarHBondContact O-N 3.5Å; I449-L451 PolarHBondContact O-N 3.04Å; L451-N455 PolarHBondContact O-N 2.77Å; L451-L473 HydrophobicContact CD2-CD1 3.95Å; L451-L473 HydrophobicContact CD2-CD2 4.34Å; L451-L473 HydrophobicContact CG-CD2 4.35Å; L451-I527 HydrophobicContact CB-CD1 3.82Å; L451-I527 HydrophobicContact CD1-CG2 4.07Å
452	R	95.6	Very high	95	Very high	34 Å²	34	33.1 Å²	33.1	13%	0.128	16%	0.163	C	C	.	.	H	α-helix	trans	-74.9	-39.1	176.1	-66.9	158.7	163.8	49.6	0.1	112.7	I354 L359 H448 I449 V450 R454 N455 I456 T526 I527	I354-R452 PolarHBondContact O-NE 3.35Å; L359-R452 HydrophobicContact CD1-CB 4.26Å; L359-R452 HydrophobicContact CD2-CB 3.59Å; L359-R452 HydrophobicContact CD2-CG 4.22Å; H448-R452 VanDerWaalsContact O-CD 3.28Å; H448-R452 WeakPolarHBondContact O-CD 3.48Å; H448-R452 VanDerWaalsContact O-CG 3.27Å; H448-R452 WeakPolarHBondContact O-CG 3.39Å; H448-R452 PolarHBondContact O-N 3.48Å; H448-R452 VanDerWaalsContact O-N 3.14Å; I449-R452 PolarHBondContact O-N 2.97Å; V450-R452 PolarHBondContact O-N 3.13Å; R452-R454 VanDerWaalsContact C-N 3.29Å; R452-R454 PolarHBondContact O-N 3.32Å; R452-N455 WeakPolarHBondContact O-CB 3.19Å; R452-N455 PolarHBondContact O-N 2.76Å; R452-N455 VanDerWaalsContact O-N 3.09Å; R452-I456 WeakPolarHBondContact O-CG1 3.39Å; R452-I456 PolarHBondContact O-N 3.33Å; R452-T526 PolarHBondContact NH1-OG1 2.63Å; R452-T526 VanDerWaalsContact NH2-CB 3.34Å; R452-T526 PolarHBondContact NH2-OG1 3.13Å; R452-I527 HydrophobicContact CG-CD1 4.35Å; R452-I527 VanDerWaalsContact NH1-CD1 3.26Å
453	F	96.3	Very high	95	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.8	-34.6	174.8	-73.5	-14.9	0	0	0	112.7	L359 R383 H386 Y387 L390 I449 V450 N455 I456 A457 W469	L359-F453 HydrophobicContact CD1-CD1 4.29Å; L359-F453 HydrophobicContact CD1-CE1 3.78Å; L359-F453 HydrophobicContact CD1-CZ 4.29Å; L359-F453 HydrophobicContact CG-CD1 4.4Å; L359-F453 HydrophobicContact CG-CE1 3.87Å; R383-F453 HydrophobicContact CG-CZ 4.18Å; H386-F453 HydrophobicContact CB-CD2 3.92Å; H386-F453 HydrophobicContact CB-CE2 3.61Å; Y387-F453 AromaticContact CD2-CE1 3.93Å; Y387-F453 HydrophobicContact CD2-CE1 3.93Å; Y387-F453 HydrophobicContact CD2-CZ 4.16Å; Y387-F453 HydrophobicContact CG-CZ 4.38Å; L390-F453 HydrophobicContact CD2-CB 4.03Å; L390-F453 HydrophobicContact CD2-CD1 3.82Å; L390-F453 HydrophobicContact CD2-CE1 4.46Å; L390-F453 HydrophobicContact CD2-CG 3.96Å; I449-F453 HydrophobicContact CG2-CD2 3.65Å; I449-F453 HydrophobicContact CG2-CE1 4.4Å; I449-F453 HydrophobicContact CG2-CE2 3.27Å; I449-F453 HydrophobicContact CG2-CG 4.35Å; I449-F453 HydrophobicContact CG2-CZ 3.7Å; I449-F453 WeakPolarHBondContact O-CG 3.23Å; I449-F453 PolarHBondContact O-N 2.81Å; V450-F453 PolarHBondContact O-N 3.03Å; F453-N455 VanDerWaalsContact C-N 3.35Å; F453-I456 HydrophobicContact CD1-CD1 4.09Å; F453-I456 PolarHBondContact O-N 2.87Å; F453-A457 WeakPolarHBondContact O-CB 3.45Å; F453-A457 PolarHBondContact O-N 2.97Å; F453-W469 HydrophobicContact CB-CH2 4.15Å; F453-W469 HydrophobicContact CB-CZ2 4.14Å; F453-W469 HydrophobicContact CD2-CH2 4.09Å; F453-W469 HydrophobicContact CD2-CZ3 4.4Å
454	R	95.5	Very high	94.8	Very high	72 Å²	72	35.5 Å²	35.5	27%	0.272	18%	0.179	S	C	.	.	H	α-helix	trans	-57.7	-47.2	168.5	-72.3	-176.7	74.1	170.4	8.3	111.6	V450 R452 I456 A457 A458 W469 E470	V450-R454 WeakPolarHBondContact O-CG 3.25Å; V450-R454 PolarHBondContact O-N 3.43Å; R452-R454 VanDerWaalsContact C-N 3.29Å; R452-R454 PolarHBondContact O-N 3.32Å; R454-I456 VanDerWaalsContact C-N 3.3Å; R454-I456 PolarHBondContact O-N 3.18Å; R454-A457 PolarHBondContact O-N 2.8Å; R454-A458 WeakPolarHBondContact O-CB 3.2Å; R454-A458 PolarHBondContact O-N 3.22Å; R454-W469 HydrophobicContact CG-CB 3.48Å; R454-W469 VanDerWaalsContact CG-CB 3.48Å; R454-W469 HydrophobicContact CG-CD2 4.42Å; R454-W469 HydrophobicContact CG-CG 3.56Å; R454-E470 IonicContact NH2-OE1 3.95Å
455	N	93.9	Very high	94.7	Very high	89 Å²	89	35.5 Å²	35.5	48%	0.476	18%	0.179	S	C	.	.	H	α-helix	trans	-63.1	-36.4	177.6	-67.6	-20.7	0	0	0	112.3	L451 R452 F453 K459	L451-N455 PolarHBondContact O-N 2.77Å; R452-N455 WeakPolarHBondContact O-CB 3.19Å; R452-N455 PolarHBondContact O-N 2.76Å; R452-N455 VanDerWaalsContact O-N 3.09Å; F453-N455 VanDerWaalsContact C-N 3.35Å; N455-K459 WeakPolarHBondContact O-CB 3.47Å; N455-K459 VanDerWaalsContact O-CG 3.28Å; N455-K459 WeakPolarHBondContact O-CG 3.19Å; N455-K459 PolarHBondContact O-N 3.11Å
456	I	94.5	Very high	94.6	Very high	15 Å²	15	38.2 Å²	38.2	8%	0.077	19%	0.193	C	C	.	.	H	α-helix	trans	-68.1	-44.1	175	-63.8	174.7	0	0	0	111	L359 E360 L390 R452 F453 R454 A458 K459 R460	L359-I456 HydrophobicContact CD2-CD1 4.01Å; E360-I456 HydrophobicContact CG-CD1 3.77Å; L390-I456 HydrophobicContact CD2-CB 4.09Å; L390-I456 HydrophobicContact CD2-CG2 3.88Å; R452-I456 WeakPolarHBondContact O-CG1 3.39Å; R452-I456 PolarHBondContact O-N 3.33Å; F453-I456 HydrophobicContact CD1-CD1 4.09Å; F453-I456 PolarHBondContact O-N 2.87Å; R454-I456 VanDerWaalsContact C-N 3.3Å; R454-I456 PolarHBondContact O-N 3.18Å; I456-A458 VanDerWaalsContact C-N 3.33Å; I456-A458 PolarHBondContact O-N 2.85Å; I456-K459 PolarHBondContact O-N 3.14Å; I456-R460 WeakPolarHBondContact O-CG 3.35Å; I456-R460 PolarHBondContact O-N 2.92Å; I456-R460 VanDerWaalsContact O-N 3.12Å
457	A	93.8	Very high	94.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.4	-43.7	176.7	0	0	0	0	0	111.7	L390 F453 R454 R460 D461 V462	L390-A457 HydrophobicContact CD1-CB 3.75Å; F453-A457 WeakPolarHBondContact O-CB 3.45Å; F453-A457 PolarHBondContact O-N 2.97Å; R454-A457 PolarHBondContact O-N 2.8Å; A457-R460 CarbonylContact O-C 3.32Å; A457-R460 PolarHBondContact O-N 3.12Å; A457-R460 VanDerWaalsContact O-N 3.1Å; A457-D461 PolarHBondContact O-N 3.22Å; A457-V462 PolarHBondContact O-N 2.9Å; A457-V462 VanDerWaalsContact O-N 3.12Å
458	A	93.3	Very high	94.5	Very high	58 Å²	58	46.5 Å²	46.5	48%	0.479	23%	0.225	S	C	.	.	H	α-helix	trans	-61.6	-43.8	175.4	0	0	0	0	0	112	R454 I456 R460 D461	R454-A458 WeakPolarHBondContact O-CB 3.2Å; R454-A458 PolarHBondContact O-N 3.22Å; I456-A458 VanDerWaalsContact C-N 3.33Å; I456-A458 PolarHBondContact O-N 2.85Å; A458-R460 PolarHBondContact O-N 3.16Å; A458-D461 PolarHBondContact O-N 3.49Å
459	K	93.5	Very high	94.5	Very high	178 Å²	178	46.5 Å²	46.5	77%	0.774	22%	0.224	S	C	*	.	H	α-helix	trans	-62.7	-22	174.3	-75.8	175.6	-178.1	-177.3	0	113.9	N455 I456	N455-K459 WeakPolarHBondContact O-CB 3.47Å; N455-K459 VanDerWaalsContact O-CG 3.28Å; N455-K459 WeakPolarHBondContact O-CG 3.19Å; N455-K459 PolarHBondContact O-N 3.11Å; I456-K459 PolarHBondContact O-N 3.14Å
460	R	93.7	Very high	94.5	Very high	73 Å²	73	51.3 Å²	51.3	28%	0.275	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	4.4	177.3	-66.1	176.8	-173.4	-164.4	3.6	112.5	E360 D391 I456 A457 A458 V462	E360-R460 IonicContact OE2-NH2 3.98Å; D391-R460 IonicContact OD1-CZ 2.65Å; D391-R460 IonicContact OD1-NH1 3.78Å; D391-R460 PolarHBondContact OD1-NH1 3Å; D391-R460 IonicContact OD1-NH2 3.37Å; I456-R460 WeakPolarHBondContact O-CG 3.35Å; I456-R460 PolarHBondContact O-N 2.92Å; I456-R460 VanDerWaalsContact O-N 3.12Å; A457-R460 CarbonylContact O-C 3.32Å; A457-R460 PolarHBondContact O-N 3.12Å; A457-R460 VanDerWaalsContact O-N 3.1Å; A458-R460 PolarHBondContact O-N 3.16Å; R460-V462 VanDerWaalsContact C-N 3.3Å; R460-V462 HydrophobicContact CB-CG2 4.25Å; R460-V462 WeakPolarHBondContact O-CG2 3.42Å; R460-V462 PolarHBondContact O-N 2.79Å
461	D	89.6	Confident	94.5	Very high	135 Å²	135	55.1 Å²	55.1	72%	0.722	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	38.8	-175.6	-65.3	-40.2	0	0	0	113.9	A457 A458 P463	A457-D461 PolarHBondContact O-N 3.22Å; A458-D461 PolarHBondContact O-N 3.49Å; D461-P463 VanDerWaalsContact O-CD 3.3Å; D461-P463 WeakPolarHBondContact O-CD 3.41Å
462	V	92.1	Very high	94.6	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.012	26%	0.256	C	S	.	.			trans	-113.5	94.5	179.3	-177.7	0	0	0	0	111.1	C394 Y397 L398 A457 R460 A464	C394-V462 HydrophobicContact CB-CG2 3.93Å; Y397-V462 HydrophobicContact CD1-CB 4.3Å; Y397-V462 HydrophobicContact CD1-CG1 3.79Å; Y397-V462 HydrophobicContact CD1-CG2 4.11Å; Y397-V462 HydrophobicContact CG-CG1 3.91Å; L398-V462 HydrophobicContact CG-CG2 4.42Å; A457-V462 PolarHBondContact O-N 2.9Å; A457-V462 VanDerWaalsContact O-N 3.12Å; R460-V462 VanDerWaalsContact C-N 3.3Å; R460-V462 HydrophobicContact CB-CG2 4.25Å; R460-V462 WeakPolarHBondContact O-CG2 3.42Å; R460-V462 PolarHBondContact O-N 2.79Å; V462-A464 VanDerWaalsContact C-N 3.33Å; V462-A464 HydrophobicContact CG1-CB 4.34Å; V462-A464 PolarHBondContact O-N 3.15Å
463	P	92	Very high	94.8	Very high	50 Å²	50	52.4 Å²	52.4	33%	0.325	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-78.3	-13.7	178.8	30.3	-35.6	0	0	0	114	Y397 D461 L465 D466	Y397-P463 HydrophobicContact CE1-CG 4.5Å; D461-P463 VanDerWaalsContact O-CD 3.3Å; D461-P463 WeakPolarHBondContact O-CD 3.41Å; P463-L465 PolarHBondContact O-N 3.38Å; P463-D466 WeakPolarHBondContact O-CB 3.45Å; P463-D466 PolarHBondContact O-N 3.35Å
464	A	92.1	Very high	94.8	Very high	3 Å²	3	55.6 Å²	55.6	3%	0.025	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-63.7	-15.5	-169.1	0	0	0	0	0	115.6	Y397 F415 V462	Y397-A464 HydrophobicContact CD2-CB 3.41Å; Y397-A464 VanDerWaalsContact CD2-CB 3.41Å; Y397-A464 HydrophobicContact CE2-CB 3.69Å; Y397-A464 HydrophobicContact CG-CB 4.03Å; F415-A464 HydrophobicContact CB-CB 4.48Å; F415-A464 HydrophobicContact CD1-CB 3.59Å; F415-A464 HydrophobicContact CD2-CB 4.3Å; F415-A464 HydrophobicContact CE1-CB 3.8Å; F415-A464 HydrophobicContact CE2-CB 4.48Å; F415-A464 HydrophobicContact CG-CB 3.86Å; F415-A464 HydrophobicContact CZ-CB 4.25Å; V462-A464 VanDerWaalsContact C-N 3.33Å; V462-A464 HydrophobicContact CG1-CB 4.34Å; V462-A464 PolarHBondContact O-N 3.15Å
465	L	94.8	Very high	95	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-99.6	-3.7	177.9	-71.7	177.9	0	0	0	114.1	L390 F415 L423 P463 R467 Y468 W469	L390-L465 HydrophobicContact CD1-CD1 4.06Å; F415-L465 HydrophobicContact CE1-CD2 4.24Å; F415-L465 HydrophobicContact CZ-CD2 3.93Å; F415-L465 HydrophobicContact CZ-CG 4.36Å; L423-L465 HydrophobicContact CD1-CD2 4.24Å; L423-L465 HydrophobicContact CD2-CD2 3.94Å; P463-L465 PolarHBondContact O-N 3.38Å; L465-R467 PolarHBondContact O-N 3.29Å; L465-Y468 HydrophobicContact CD2-CD1 4.36Å; L465-Y468 HydrophobicContact CD2-CG 4.48Å; L465-Y468 WeakPolarHBondContact O-CA 3.41Å; L465-Y468 WeakPolarHBondContact O-CB 3.39Å; L465-Y468 PolarHBondContact O-N 3.12Å; L465-W469 VanDerWaalsContact CB-NE1 3.31Å; L465-W469 HydrophobicContact CD1-CZ2 3.79Å; L465-W469 PolarHBondContact O-N 3.41Å
466	D	94	Very high	95.1	Very high	57 Å²	57	50.3 Å²	50.3	31%	0.305	26%	0.256	S	S	.	.	H	α-helix	trans	-57.4	-48.9	-173.2	-72.7	-23	0	0	0	112.2	P463 Y468 W469 E470	P463-D466 WeakPolarHBondContact O-CB 3.45Å; P463-D466 PolarHBondContact O-N 3.35Å; D466-Y468 PolarHBondContact O-N 3.03Å; D466-W469 PolarHBondContact O-N 3Å; D466-E470 WeakPolarHBondContact O-CG 3.23Å; D466-E470 PolarHBondContact O-N 3.42Å
467	R	95	Very high	95.3	Very high	170 Å²	170	51.6 Å²	51.6	64%	0.642	26%	0.26	S	S	*	.	H	α-helix	trans	-62.4	-30.3	176.2	-168.1	-172.8	167.5	168.1	1.1	112.8	L465 Q471	L465-R467 PolarHBondContact O-N 3.29Å; R467-Q471 WeakPolarHBondContact O-CG 3.41Å; R467-Q471 PolarHBondContact O-N 3.42Å; R467-Q471 PolarHBondContact O-NE2 3.45Å
468	Y	97	Very high	95.4	Very high	5 Å²	5	55 Å²	55	2%	0.02	28%	0.282	C	S	.	.	H	α-helix	trans	-70.8	-47.6	176.2	170.6	-96.5	0	0	0	110.5	H386 L389 L423 T426 L427 L465 D466 E470 Q471 V472	H386-Y468 AromaticContact CD2-CE1 3.96Å; H386-Y468 PolarHBondContact CD2-OH 3.29Å; H386-Y468 VanDerWaalsContact CD2-OH 3.3Å; H386-Y468 AromaticContact NE2-CZ 3.94Å; H386-Y468 PolarHBondContact NE2-OH 2.96Å; L389-Y468 HydrophobicContact CD2-CE1 3.67Å; L389-Y468 HydrophobicContact CD2-CE2 4.26Å; L389-Y468 WeakPolarHBondContact CD2-OH 3.05Å; L423-Y468 HydrophobicContact CB-CD2 3.8Å; L423-Y468 HydrophobicContact CB-CE2 4.03Å; L423-Y468 HydrophobicContact CD1-CD2 4.42Å; L423-Y468 HydrophobicContact CD2-CD1 4.4Å; L423-Y468 HydrophobicContact CD2-CD2 3.72Å; L423-Y468 HydrophobicContact CD2-CE2 3.84Å; L423-Y468 HydrophobicContact CD2-CG 4Å; L423-Y468 HydrophobicContact CG-CD2 4.17Å; T426-Y468 WeakPolarHBondContact CG2-OH 3.35Å; L427-Y468 HydrophobicContact CD1-CD2 4.08Å; L427-Y468 HydrophobicContact CD1-CE2 4.26Å; L427-Y468 HydrophobicContact CD2-CD2 4.24Å; L427-Y468 HydrophobicContact CD2-CE2 3.94Å; L427-Y468 HydrophobicContact CG-CD2 4.05Å; L427-Y468 HydrophobicContact CG-CE2 3.73Å; L465-Y468 HydrophobicContact CD2-CD1 4.36Å; L465-Y468 HydrophobicContact CD2-CG 4.48Å; L465-Y468 WeakPolarHBondContact O-CA 3.41Å; L465-Y468 WeakPolarHBondContact O-CB 3.39Å; L465-Y468 PolarHBondContact O-N 3.12Å; D466-Y468 PolarHBondContact O-N 3.03Å; Y468-E470 VanDerWaalsContact C-N 3.29Å; Y468-E470 PolarHBondContact O-N 3.26Å; Y468-Q471 PolarHBondContact O-N 2.93Å; Y468-Q471 VanDerWaalsContact O-N 3.16Å; Y468-V472 HydrophobicContact CD1-CG2 4.2Å; Y468-V472 HydrophobicContact CE1-CG2 3.7Å; Y468-V472 HydrophobicContact CE2-CG2 4.13Å; Y468-V472 WeakPolarHBondContact O-CG2 3.24Å; Y468-V472 PolarHBondContact O-N 2.97Å
469	W	97.3	Very high	95.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.2	-37.8	178.2	-60.5	129.4	0	0	0	112.5	H386 L390 V450 F453 R454 L465 D466 V472 L473	H386-W469 HydrophobicContact CB-CH2 4.33Å; H386-W469 HydrophobicContact CB-CZ3 4.35Å; H386-W469 AromaticContact CD2-CZ3 3.7Å; L390-W469 HydrophobicContact CB-CH2 4.42Å; L390-W469 HydrophobicContact CB-CZ2 4.13Å; L390-W469 HydrophobicContact CD1-CZ2 4.03Å; V450-W469 HydrophobicContact CG1-CB 4.08Å; V450-W469 HydrophobicContact CG1-CD2 4.32Å; V450-W469 HydrophobicContact CG1-CE3 3.76Å; V450-W469 HydrophobicContact CG1-CG 4.49Å; V450-W469 HydrophobicContact CG2-CE3 4.42Å; F453-W469 HydrophobicContact CB-CH2 4.15Å; F453-W469 HydrophobicContact CB-CZ2 4.14Å; F453-W469 HydrophobicContact CD2-CH2 4.09Å; F453-W469 HydrophobicContact CD2-CZ3 4.4Å; R454-W469 HydrophobicContact CG-CB 3.48Å; R454-W469 VanDerWaalsContact CG-CB 3.48Å; R454-W469 HydrophobicContact CG-CD2 4.42Å; R454-W469 HydrophobicContact CG-CG 3.56Å; L465-W469 VanDerWaalsContact CB-NE1 3.31Å; L465-W469 HydrophobicContact CD1-CZ2 3.79Å; L465-W469 PolarHBondContact O-N 3.41Å; D466-W469 PolarHBondContact O-N 3Å; W469-V472 PolarHBondContact O-N 3.12Å; W469-L473 WeakPolarHBondContact O-CG 3.43Å; W469-L473 PolarHBondContact O-N 3.3Å
470	E	97.3	Very high	95.7	Very high	101 Å²	101	45.1 Å²	45.1	47%	0.472	23%	0.228	S	C	.	.	H	α-helix	trans	-61	-43.8	173.3	-73.7	170.9	-179.1	0	0	112.3	R454 D466 Y468 L473 A474	R454-E470 IonicContact NH2-OE1 3.95Å; D466-E470 WeakPolarHBondContact O-CG 3.23Å; D466-E470 PolarHBondContact O-N 3.42Å; Y468-E470 VanDerWaalsContact C-N 3.29Å; Y468-E470 PolarHBondContact O-N 3.26Å; E470-L473 PolarHBondContact O-N 3.21Å; E470-A474 WeakPolarHBondContact O-CB 3.48Å; E470-A474 PolarHBondContact O-N 3.3Å
471	Q	98.1	Very high	95.8	Very high	80 Å²	80	42.6 Å²	42.6	37%	0.374	22%	0.219	S	C	.	.	H	α-helix	trans	-65.2	-40.4	175.7	-76.4	170.2	74.2	0	0	112.4	L427 R467 Y468 A474 L475	L427-Q471 HydrophobicContact CD1-CB 4.16Å; L427-Q471 HydrophobicContact CD2-CB 3.98Å; R467-Q471 WeakPolarHBondContact O-CG 3.41Å; R467-Q471 PolarHBondContact O-N 3.42Å; R467-Q471 PolarHBondContact O-NE2 3.45Å; Y468-Q471 PolarHBondContact O-N 2.93Å; Y468-Q471 VanDerWaalsContact O-N 3.16Å; Q471-A474 PolarHBondContact O-N 3.34Å; Q471-L475 WeakPolarHBondContact O-CG 3.39Å; Q471-L475 PolarHBondContact O-N 3.18Å; Q471-L475 VanDerWaalsContact O-N 3.13Å
472	V	98.4	Very high	96.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.9	-46.4	175.2	173.2	0	0	0	0	110.6	F382 L427 L430 V450 Y468 W469 A474 L475 L476	F382-V472 HydrophobicContact CZ-CG1 3.98Å; L427-V472 HydrophobicContact CD2-CG2 3.61Å; L430-V472 HydrophobicContact CD2-CB 4.41Å; L430-V472 HydrophobicContact CD2-CG1 3.75Å; L430-V472 HydrophobicContact CD2-CG2 4.42Å; V450-V472 HydrophobicContact CG1-CG1 4.43Å; V450-V472 HydrophobicContact CG2-CG1 3.57Å; Y468-V472 HydrophobicContact CD1-CG2 4.2Å; Y468-V472 HydrophobicContact CE1-CG2 3.7Å; Y468-V472 HydrophobicContact CE2-CG2 4.13Å; Y468-V472 WeakPolarHBondContact O-CG2 3.24Å; Y468-V472 PolarHBondContact O-N 2.97Å; W469-V472 PolarHBondContact O-N 3.12Å; V472-A474 VanDerWaalsContact C-N 3.34Å; V472-A474 PolarHBondContact O-N 3.48Å; V472-L475 PolarHBondContact O-N 2.99Å; V472-L476 HydrophobicContact CG1-CD1 3.73Å; V472-L476 HydrophobicContact CG1-CG 4.42Å; V472-L476 WeakPolarHBondContact O-CG 3.41Å; V472-L476 PolarHBondContact O-N 3.37Å; V472-L476 VanDerWaalsContact O-N 3.07Å
473	L	97.9	Very high	96.3	Very high	13 Å²	13	39.6 Å²	39.6	7%	0.068	20%	0.202	C	C	.	.	H	α-helix	trans	-63.6	-40	176.6	-70.2	170.8	0	0	0	111.8	I447 V450 L451 W469 E470 L475 L476 W477	I447-L473 HydrophobicContact CG2-CD2 4.05Å; V450-L473 HydrophobicContact CB-CD2 4.03Å; V450-L473 HydrophobicContact CB-CG 4.44Å; V450-L473 HydrophobicContact CG1-CD1 4.16Å; V450-L473 HydrophobicContact CG1-CD2 3.86Å; V450-L473 HydrophobicContact CG1-CG 3.72Å; L451-L473 HydrophobicContact CD2-CD1 3.95Å; L451-L473 HydrophobicContact CD2-CD2 4.34Å; L451-L473 HydrophobicContact CG-CD2 4.35Å; W469-L473 WeakPolarHBondContact O-CG 3.43Å; W469-L473 PolarHBondContact O-N 3.3Å; E470-L473 PolarHBondContact O-N 3.21Å; L473-L475 PolarHBondContact O-N 3.12Å; L473-L476 PolarHBondContact O-N 3.38Å; L473-W477 PolarHBondContact O-N 2.85Å
474	A	97.9	Very high	96.4	Very high	66 Å²	66	37.2 Å²	37.2	55%	0.545	19%	0.187	S	C	.	.	H	α-helix	trans	-63.4	-23	177.1	0	0	0	0	0	113.4	E470 Q471 V472 P478	E470-A474 WeakPolarHBondContact O-CB 3.48Å; E470-A474 PolarHBondContact O-N 3.3Å; Q471-A474 PolarHBondContact O-N 3.34Å; V472-A474 VanDerWaalsContact C-N 3.34Å; V472-A474 PolarHBondContact O-N 3.48Å; A474-P478 WeakPolarHBondContact O-CD 3.24Å; A474-P478 VanDerWaalsContact O-CG 3.27Å; A474-P478 WeakPolarHBondContact O-CG 3.48Å
475	L	98.1	Very high	96.5	Very high	50 Å²	50	41.6 Å²	41.6	26%	0.262	21%	0.207	S	C	.	.	H	α-helix	trans	-84.1	-40.6	171.4	-67.1	171.8	0	0	0	112.3	L427 L430 E431 L434 Q471 V472 L473	L427-L475 HydrophobicContact CD2-CD1 4.15Å; L430-L475 HydrophobicContact CD2-CD1 4.23Å; L430-L475 HydrophobicContact CG-CD1 4.48Å; E431-L475 HydrophobicContact CB-CD1 4.33Å; E431-L475 HydrophobicContact CB-CD2 4.35Å; E431-L475 HydrophobicContact CG-CD2 4.31Å; L434-L475 HydrophobicContact CD1-CB 3.94Å; Q471-L475 WeakPolarHBondContact O-CG 3.39Å; Q471-L475 PolarHBondContact O-N 3.18Å; Q471-L475 VanDerWaalsContact O-N 3.13Å; V472-L475 PolarHBondContact O-N 2.99Å; L473-L475 PolarHBondContact O-N 3.12Å
476	L	97.9	Very high	96.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-73.4	-44.4	-174.4	-70.1	167.3	0	0	0	113.2	F382 L430 L434 V443 C446 I447 V450 V472 L473 R479 F480	F382-L476 HydrophobicContact CZ-CD1 4.3Å; L430-L476 HydrophobicContact CD1-CD2 4.37Å; L434-L476 HydrophobicContact CD1-CD2 3.89Å; L434-L476 HydrophobicContact CD1-CG 4.39Å; L434-L476 HydrophobicContact CD2-CD2 3.96Å; V443-L476 HydrophobicContact CG1-CB 4.28Å; V443-L476 HydrophobicContact CG1-CD2 3.93Å; V443-L476 WeakPolarHBondContact CG1-O 3.42Å; C446-L476 HydrophobicContact CB-CD1 4.07Å; C446-L476 HydrophobicContact CB-CD2 3.94Å; I447-L476 HydrophobicContact CD1-CB 4.06Å; I447-L476 HydrophobicContact CG1-CB 3.54Å; I447-L476 HydrophobicContact CG1-CD1 3.99Å; I447-L476 HydrophobicContact CG1-CG 4.32Å; V450-L476 HydrophobicContact CG2-CD1 4.28Å; V472-L476 HydrophobicContact CG1-CD1 3.73Å; V472-L476 HydrophobicContact CG1-CG 4.42Å; V472-L476 WeakPolarHBondContact O-CG 3.41Å; V472-L476 PolarHBondContact O-N 3.37Å; V472-L476 VanDerWaalsContact O-N 3.07Å; L473-L476 PolarHBondContact O-N 3.38Å; L476-R479 PolarHBondContact O-N 3.24Å; L476-F480 PolarHBondContact O-N 3.01Å
477	W	96.9	Very high	96.6	Very high	42 Å²	42	41 Å²	41	16%	0.159	20%	0.203	C	C	.	.	H	α-helix	trans	-59.8	-51.2	-175.5	-78.1	115.5	0	0	0	113.3	F444 I447 L473 R479 F480 E481 N529	F444-W477 HydrophobicContact CE2-CH2 4.15Å; F444-W477 HydrophobicContact CE2-CZ3 4.24Å; I447-W477 HydrophobicContact CD1-CD2 3.82Å; I447-W477 HydrophobicContact CD1-CE3 3.78Å; I447-W477 HydrophobicContact CD1-CG 4.34Å; I447-W477 HydrophobicContact CD1-CH2 4.35Å; I447-W477 HydrophobicContact CD1-CZ2 4.42Å; I447-W477 HydrophobicContact CD1-CZ3 4.05Å; I447-W477 HydrophobicContact CG2-CH2 3.84Å; I447-W477 HydrophobicContact CG2-CZ2 3.37Å; L473-W477 PolarHBondContact O-N 2.85Å; W477-R479 PolarHBondContact O-N 3.36Å; W477-F480 HydrophobicContact CE3-CD1 4.19Å; W477-F480 HydrophobicContact CZ3-CD1 4.17Å; W477-F480 HydrophobicContact CZ3-CE1 4.43Å; W477-F480 PolarHBondContact O-N 3.43Å; W477-E481 VanDerWaalsContact O-CG 3.28Å; W477-E481 WeakPolarHBondContact O-CG 3.26Å; W477-E481 PolarHBondContact O-N 3.33Å; W477-N529 HydrophobicContact CH2-CB 3.86Å; W477-N529 VanDerWaalsContact CH2-CG 3.49Å; W477-N529 WeakPolarHBondContact CH2-ND2 3.33Å; W477-N529 WeakPolarHBondContact CZ2-ND2 3.45Å
478	P	96.6	Very high	96.5	Very high	71 Å²	71	33.3 Å²	33.3	46%	0.461	18%	0.175	S	C	.	.	H	α-helix	trans	-61.2	-34.7	179.4	-23.3	35	0	0	0	112.6	A474 L482	A474-P478 WeakPolarHBondContact O-CD 3.24Å; A474-P478 VanDerWaalsContact O-CG 3.27Å; A474-P478 WeakPolarHBondContact O-CG 3.48Å; P478-L482 WeakPolarHBondContact O-CB 3.24Å; P478-L482 PolarHBondContact O-N 3.37Å
479	R	96.9	Very high	96.4	Very high	30 Å²	30	37.8 Å²	37.8	11%	0.113	20%	0.196	C	C	.	.	H	α-helix	trans	-70.1	-42.8	177.6	-174.8	57.3	-179.7	-154	0.5	111.8	L434 A435 C437 Y438 L476 W477 L482 I483	L434-R479 HydrophobicContact CB-CG 4.29Å; L434-R479 HydrophobicContact CD2-CB 4.44Å; L434-R479 HydrophobicContact CD2-CG 4.17Å; L434-R479 VanDerWaalsContact O-CD 3.32Å; L434-R479 WeakPolarHBondContact O-CD 3.36Å; L434-R479 PolarHBondContact O-NE 3.42Å; L434-R479 PolarHBondContact O-NH1 2.96Å; A435-R479 PolarHBondContact O-NH1 3.01Å; A435-R479 PolarHBondContact O-NH2 3.11Å; C437-R479 VanDerWaalsContact C-NH2 3.31Å; C437-R479 PolarHBondContact O-NE 3.27Å; C437-R479 PolarHBondContact O-NH2 3.41Å; Y438-R479 VanDerWaalsContact CE1-NH2 3.27Å; L476-R479 PolarHBondContact O-N 3.24Å; W477-R479 PolarHBondContact O-N 3.36Å; R479-L482 PolarHBondContact O-N 3.13Å; R479-I483 HydrophobicContact CG-CD1 4.04Å; R479-I483 WeakPolarHBondContact O-CD1 3.42Å; R479-I483 VanDerWaalsContact O-CG1 3.26Å; R479-I483 WeakPolarHBondContact O-CG1 3.41Å; R479-I483 PolarHBondContact O-N 2.85Å; R479-I483 VanDerWaalsContact O-N 3.1Å
480	F	96.6	Very high	96.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.6	-48.4	174.9	171.4	-108.1	0	0	0	111.5	A440 V443 F444 I447 L476 W477 L482 I483 L484 L520 T532	A440-F480 HydrophobicContact CB-CD2 4.31Å; A440-F480 HydrophobicContact CB-CE2 4.32Å; V443-F480 HydrophobicContact CG1-CB 3.79Å; F444-F480 HydrophobicContact CB-CD2 3.97Å; F444-F480 HydrophobicContact CB-CE2 3.78Å; F444-F480 HydrophobicContact CB-CZ 4.5Å; F444-F480 HydrophobicContact CD2-CD1 4.36Å; F444-F480 HydrophobicContact CD2-CD2 4.2Å; F444-F480 HydrophobicContact CD2-CE1 4.03Å; F444-F480 AromaticContact CD2-CE2 3.86Å; F444-F480 HydrophobicContact CD2-CE2 3.86Å; F444-F480 HydrophobicContact CD2-CG 4.44Å; F444-F480 AromaticContact CD2-CZ 3.76Å; F444-F480 HydrophobicContact CD2-CZ 3.76Å; F444-F480 HydrophobicContact CE2-CE1 4.29Å; F444-F480 HydrophobicContact CE2-CZ 4.22Å; F444-F480 HydrophobicContact CG-CD2 4.42Å; F444-F480 AromaticContact CG-CE2 3.94Å; F444-F480 HydrophobicContact CG-CE2 3.94Å; F444-F480 HydrophobicContact CG-CZ 4.17Å; I447-F480 HydrophobicContact CD1-CB 4.08Å; I447-F480 HydrophobicContact CD1-CG 4.39Å; L476-F480 PolarHBondContact O-N 3.01Å; W477-F480 HydrophobicContact CE3-CD1 4.19Å; W477-F480 HydrophobicContact CZ3-CD1 4.17Å; W477-F480 HydrophobicContact CZ3-CE1 4.43Å; W477-F480 PolarHBondContact O-N 3.43Å; F480-L482 PolarHBondContact O-N 2.67Å; F480-I483 PolarHBondContact O-N 3.42Å; F480-L484 HydrophobicContact CE1-CD2 4.16Å; F480-L484 HydrophobicContact CZ-CD2 3.93Å; F480-L484 WeakPolarHBondContact O-CB 3.48Å; F480-L484 PolarHBondContact O-N 3.1Å; F480-L520 HydrophobicContact CE2-CD1 4.23Å; F480-L520 HydrophobicContact CE2-CD2 4.03Å; F480-L520 HydrophobicContact CZ-CD1 4.09Å; F480-L520 HydrophobicContact CZ-CD2 4.33Å; F480-T532 HydrophobicContact CE1-CG2 4.03Å; F480-T532 HydrophobicContact CZ-CG2 3.99Å
481	E	95.8	Very high	96.1	Very high	20 Å²	20	33.4 Å²	33.4	9%	0.093	18%	0.177	C	C	.	.	H	α-helix	trans	-59.3	-47.1	178.7	-69.1	169.2	-172.8	0	0	111.4	W477 I483 L484 E485 R531 L535	W477-E481 VanDerWaalsContact O-CG 3.28Å; W477-E481 WeakPolarHBondContact O-CG 3.26Å; W477-E481 PolarHBondContact O-N 3.33Å; E481-I483 PolarHBondContact O-N 2.66Å; E481-L484 PolarHBondContact O-N 3.44Å; E481-E485 WeakPolarHBondContact O-CB 3.5Å; E481-E485 WeakPolarHBondContact O-CG 3.32Å; E481-E485 PolarHBondContact O-N 3.29Å; E481-R531 VanDerWaalsContact OE1-CD 3.29Å; E481-R531 WeakPolarHBondContact OE1-CD 3.13Å; E481-R531 IonicContact OE1-CZ 2.94Å; E481-R531 IonicContact OE1-NE 3.33Å; E481-R531 PolarHBondContact OE1-NE 3.48Å; E481-R531 IonicContact OE1-NH1 3.4Å; E481-R531 PolarHBondContact OE1-NH1 3.42Å; E481-R531 IonicContact OE1-NH2 3.02Å; E481-R531 IonicContact OE2-CZ 3.39Å; E481-R531 IonicContact OE2-NE 2.75Å; E481-R531 IonicContact OE2-NH1 3.82Å; E481-R531 PolarHBondContact OE2-NH1 3.3Å; E481-R531 IonicContact OE2-NH2 2.66Å; E481-R531 PolarHBondContact OE2-NH2 3.34Å; E481-L535 HydrophobicContact CB-CD1 4.33Å; E481-L535 HydrophobicContact CG-CD1 3.94Å
482	L	95.8	Very high	95.9	Very high	73 Å²	73	35.5 Å²	35.5	38%	0.382	18%	0.181	S	C	.	.	H	α-helix	trans	-56.9	-47.6	177.2	177.4	65.7	0	0	0	112.2	P478 R479 F480 L484 E485 M486	P478-L482 WeakPolarHBondContact O-CB 3.24Å; P478-L482 PolarHBondContact O-N 3.37Å; R479-L482 PolarHBondContact O-N 3.13Å; F480-L482 PolarHBondContact O-N 2.67Å; L482-L484 VanDerWaalsContact C-N 3.29Å; L482-L484 PolarHBondContact O-N 2.86Å; L482-E485 PolarHBondContact O-N 3.35Å; L482-M486 HydrophobicContact CD1-CG 4.48Å; L482-M486 HydrophobicContact CD1-SD 4.48Å; L482-M486 HydrophobicContact CG-SD 4.19Å; L482-M486 WeakPolarHBondContact O-CB 3.47Å; L482-M486 WeakPolarHBondContact O-CG 3.15Å; L482-M486 PolarHBondContact O-N 3.48Å
483	I	95.3	Very high	95.6	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-64.6	-38.5	-179.7	-60.3	160.6	0	0	0	110.5	C437 Y438 A440 V443 R479 F480 E481 M486 N487	C437-I483 VanDerWaalsContact O-CD1 3.31Å; C437-I483 WeakPolarHBondContact O-CD1 3.41Å; Y438-I483 WeakPolarHBondContact O-CG2 3.42Å; A440-I483 HydrophobicContact CB-CB 4.23Å; A440-I483 HydrophobicContact CB-CG2 3.69Å; V443-I483 HydrophobicContact CG2-CD1 4.25Å; R479-I483 HydrophobicContact CG-CD1 4.04Å; R479-I483 WeakPolarHBondContact O-CD1 3.42Å; R479-I483 VanDerWaalsContact O-CG1 3.26Å; R479-I483 WeakPolarHBondContact O-CG1 3.41Å; R479-I483 PolarHBondContact O-N 2.85Å; R479-I483 VanDerWaalsContact O-N 3.1Å; F480-I483 PolarHBondContact O-N 3.42Å; E481-I483 PolarHBondContact O-N 2.66Å; I483-M486 PolarHBondContact O-N 3.18Å; I483-N487 PolarHBondContact O-N 2.91Å; I483-N487 PolarHBondContact O-ND2 3.1Å
484	L	94.6	Very high	95.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-68.2	-44	179.1	-168.8	52.2	0	0	0	111.3	F480 E481 L482 M486 N487 V488 F516 L535 L539	F480-L484 HydrophobicContact CE1-CD2 4.16Å; F480-L484 HydrophobicContact CZ-CD2 3.93Å; F480-L484 WeakPolarHBondContact O-CB 3.48Å; F480-L484 PolarHBondContact O-N 3.1Å; E481-L484 PolarHBondContact O-N 3.44Å; L482-L484 VanDerWaalsContact C-N 3.29Å; L482-L484 PolarHBondContact O-N 2.86Å; L484-M486 VanDerWaalsContact C-N 3.33Å; L484-M486 PolarHBondContact O-N 3.37Å; L484-N487 WeakPolarHBondContact O-CB 3.5Å; L484-N487 PolarHBondContact O-N 3.28Å; L484-N487 VanDerWaalsContact O-N 3.1Å; L484-V488 WeakPolarHBondContact O-CG2 3.49Å; L484-V488 PolarHBondContact O-N 2.92Å; L484-F516 HydrophobicContact CD1-CE1 3.49Å; L484-F516 VanDerWaalsContact CD1-CE1 3.49Å; L484-F516 HydrophobicContact CD1-CZ 3.95Å; L484-L535 HydrophobicContact CD2-CB 3.36Å; L484-L535 HydrophobicContact CD2-CD1 3.94Å; L484-L535 HydrophobicContact CD2-CG 4.26Å; L484-L535 HydrophobicContact CG-CB 4.04Å; L484-L539 HydrophobicContact CD1-CD2 4.17Å
485	E	95.2	Very high	94.6	Very high	94 Å²	94	38.8 Å²	38.8	44%	0.439	20%	0.196	S	C	.	.	H	α-helix	trans	-60.4	-40.3	173	-73.6	175.8	179.2	0	0	112.1	E481 L482 N487 V488 Q489 L535	E481-E485 WeakPolarHBondContact O-CB 3.5Å; E481-E485 WeakPolarHBondContact O-CG 3.32Å; E481-E485 PolarHBondContact O-N 3.29Å; L482-E485 PolarHBondContact O-N 3.35Å; E485-N487 VanDerWaalsContact C-N 3.3Å; E485-N487 PolarHBondContact O-N 3.16Å; E485-V488 PolarHBondContact O-N 2.88Å; E485-Q489 WeakPolarHBondContact O-CB 3.48Å; E485-Q489 PolarHBondContact O-N 3.05Å; E485-L535 HydrophobicContact CG-CD2 4.31Å
486	M	94.8	Very high	93.9	Very high	40 Å²	40	36.9 Å²	36.9	20%	0.197	19%	0.187	C	C	.	.	H	α-helix	trans	-60.1	-40.3	173.2	-73.1	173.2	67.9	0	0	111.7	K318 L321 Y438 L482 I483 L484 S490	K318-M486 HydrophobicContact CG-CE 3.98Å; L321-M486 HydrophobicContact CD1-CB 4.45Å; L321-M486 HydrophobicContact CD1-CE 4.33Å; L321-M486 HydrophobicContact CD2-CB 3.85Å; L321-M486 HydrophobicContact CD2-CE 4.27Å; Y438-M486 HydrophobicContact CD1-CE 4.21Å; Y438-M486 HydrophobicContact CE1-CE 4.19Å; L482-M486 HydrophobicContact CD1-CG 4.48Å; L482-M486 HydrophobicContact CD1-SD 4.48Å; L482-M486 HydrophobicContact CG-SD 4.19Å; L482-M486 WeakPolarHBondContact O-CB 3.47Å; L482-M486 WeakPolarHBondContact O-CG 3.15Å; L482-M486 PolarHBondContact O-N 3.48Å; I483-M486 PolarHBondContact O-N 3.18Å; L484-M486 VanDerWaalsContact C-N 3.33Å; L484-M486 PolarHBondContact O-N 3.37Å; M486-S490 WeakPolarHBondContact O-CB 3.42Å; M486-S490 PolarHBondContact O-N 3.22Å
487	N	94.4	Very high	93.1	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-67.1	-45.6	175.8	-82.2	-73.4	0	0	0	112	M322 I483 L484 E485 Q489 S490 V491	M322-N487 WeakPolarHBondContact CB-OD1 3.14Å; M322-N487 PolarHBondContact N-OD1 3.28Å; I483-N487 PolarHBondContact O-N 2.91Å; I483-N487 PolarHBondContact O-ND2 3.1Å; L484-N487 WeakPolarHBondContact O-CB 3.5Å; L484-N487 PolarHBondContact O-N 3.28Å; L484-N487 VanDerWaalsContact O-N 3.1Å; E485-N487 VanDerWaalsContact C-N 3.3Å; E485-N487 PolarHBondContact O-N 3.16Å; N487-Q489 VanDerWaalsContact C-N 3.33Å; N487-Q489 PolarHBondContact O-N 3.37Å; N487-S490 WeakPolarHBondContact O-CB 3.43Å; N487-S490 PolarHBondContact O-N 2.75Å; N487-S490 VanDerWaalsContact O-N 3.17Å; N487-S490 PolarHBondContact O-OG 3.02Å; N487-V491 PolarHBondContact O-N 3.5Å; N487-V491 VanDerWaalsContact O-N 3.13Å
488	V	94.9	Very high	92.2	Very high	9 Å²	9	50.5 Å²	50.5	6%	0.055	24%	0.244	C	C	.	.	H	α-helix	trans	-54.8	-50.4	174.1	173.9	0	0	0	0	110.3	L484 E485 S490 V491 R492 L539 E542	L484-V488 WeakPolarHBondContact O-CG2 3.49Å; L484-V488 PolarHBondContact O-N 2.92Å; E485-V488 PolarHBondContact O-N 2.88Å; V488-S490 VanDerWaalsContact C-N 3.32Å; V488-S490 PolarHBondContact O-N 2.73Å; V488-V491 PolarHBondContact O-N 3.39Å; V488-R492 WeakPolarHBondContact O-CB 3.38Å; V488-R492 PolarHBondContact O-N 3.18Å; V488-L539 HydrophobicContact CG2-CB 3.82Å; V488-L539 HydrophobicContact CG2-CD1 3.93Å; V488-L539 HydrophobicContact CG2-CG 4.45Å; V488-E542 HydrophobicContact CG1-CG 3.76Å
489	Q	94.9	Very high	91.1	Very high	99 Å²	99	48.3 Å²	48.3	46%	0.463	23%	0.229	S	C	.	.	H	α-helix	trans	-64.6	-37	179.5	-174.9	58.9	26.3	0	0	112	E485 N487 V491 R492 S493	E485-Q489 WeakPolarHBondContact O-CB 3.48Å; E485-Q489 PolarHBondContact O-N 3.05Å; N487-Q489 VanDerWaalsContact C-N 3.33Å; N487-Q489 PolarHBondContact O-N 3.37Å; Q489-V491 PolarHBondContact O-N 3.43Å; Q489-R492 PolarHBondContact O-N 2.93Å; Q489-S493 WeakPolarHBondContact O-CB 3.44Å; Q489-S493 PolarHBondContact O-N 3.03Å; Q489-S493 PolarHBondContact O-OG 2.9Å
490	S	94.3	Very high	89.6	Confident	10 Å²	10	49.3 Å²	49.3	7%	0.07	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-48.2	177.6	78.2	0	0	0	0	111.4	G323 M486 N487 V488 S493 T494	G323-S490 PolarHBondContact N-OG 2.71Å; M486-S490 WeakPolarHBondContact O-CB 3.42Å; M486-S490 PolarHBondContact O-N 3.22Å; N487-S490 WeakPolarHBondContact O-CB 3.43Å; N487-S490 PolarHBondContact O-N 2.75Å; N487-S490 VanDerWaalsContact O-N 3.17Å; N487-S490 PolarHBondContact O-OG 3.02Å; V488-S490 VanDerWaalsContact C-N 3.32Å; V488-S490 PolarHBondContact O-N 2.73Å; S490-S493 PolarHBondContact O-N 3.38Å; S490-S493 PolarHBondContact O-OG 3.31Å; S490-T494 PolarHBondContact O-N 2.92Å; S490-T494 VanDerWaalsContact O-N 3.16Å; S490-T494 PolarHBondContact O-OG1 2.93Å
491	V	93.9	Very high	88.3	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.3	-41.9	179.3	176.8	0	0	0	0	111.2	M322 N487 V488 Q489 S493 T494 I509 L539 E542 V543 F546 R549	M322-V491 HydrophobicContact CB-CG2 3.91Å; M322-V491 HydrophobicContact CG-CG2 3.96Å; M322-V491 HydrophobicContact SD-CG2 3.98Å; N487-V491 PolarHBondContact O-N 3.5Å; N487-V491 VanDerWaalsContact O-N 3.13Å; V488-V491 PolarHBondContact O-N 3.39Å; Q489-V491 PolarHBondContact O-N 3.43Å; V491-S493 VanDerWaalsContact C-N 3.32Å; V491-S493 PolarHBondContact O-N 3.05Å; V491-T494 WeakPolarHBondContact O-CB 3.49Å; V491-T494 PolarHBondContact O-N 2.63Å; V491-T494 PolarHBondContact O-OG1 3.36Å; V491-I509 HydrophobicContact CG1-CG2 4.5Å; V491-I509 HydrophobicContact CG2-CG2 4.19Å; V491-L539 HydrophobicContact CG2-CD1 4.45Å; V491-E542 HydrophobicContact CG1-CB 4.3Å; V491-V543 HydrophobicContact CG1-CG2 3.99Å; V491-V543 HydrophobicContact CG2-CG2 4.5Å; V491-F546 HydrophobicContact CG1-CB 3.78Å; V491-F546 HydrophobicContact CG1-CG 4.19Å; V491-R549 PolarHBondContact O-NH2 3.43Å; V491-R549 VanDerWaalsContact O-NH2 3.11Å
492	R	93.8	Very high	87.7	Confident	124 Å²	124	55.1 Å²	55.1	47%	0.468	30%	0.3	S	S	.	.	H	α-helix	trans	-57.2	-47.5	175.8	-178.8	176.8	-81.6	174	-5.5	111.3	V488 Q489 T494 E542 R549	V488-R492 WeakPolarHBondContact O-CB 3.38Å; V488-R492 PolarHBondContact O-N 3.18Å; Q489-R492 PolarHBondContact O-N 2.93Å; R492-T494 VanDerWaalsContact C-N 3.3Å; R492-T494 PolarHBondContact O-N 3.15Å; R492-E542 HydrophobicContact CB-CG 4.35Å; R492-E542 VanDerWaalsContact CB-OE2 3.24Å; R492-E542 WeakPolarHBondContact CB-OE2 3.42Å; R492-E542 VanDerWaalsContact CG-OE2 3.26Å; R492-E542 WeakPolarHBondContact CG-OE2 3.42Å; R492-E542 IonicContact CZ-OE1 3.56Å; R492-E542 VanDerWaalsContact CZ-OE1 3.25Å; R492-E542 IonicContact NE-OE1 3.39Å; R492-E542 PolarHBondContact NE-OE1 3.48Å; R492-E542 IonicContact NE-OE2 2.78Å; R492-E542 PolarHBondContact NE-OE2 3.04Å; R492-E542 IonicContact NH2-OE1 3.5Å; R492-E542 PolarHBondContact NH2-OE1 2.74Å; R492-R549 PolarHBondContact O-NH1 3.39Å; R492-R549 PolarHBondContact O-NH2 2.98Å
493	S	91.1	Very high	87.2	Confident	80 Å²	80	55.4 Å²	55.4	56%	0.559	30%	0.302	S	S	*	.	H	α-helix	trans	-77.7	-8.3	-176.7	69.4	0	0	0	0	115.1	Q489 S490 V491 D495	Q489-S493 WeakPolarHBondContact O-CB 3.44Å; Q489-S493 PolarHBondContact O-N 3.03Å; Q489-S493 PolarHBondContact O-OG 2.9Å; S490-S493 PolarHBondContact O-N 3.38Å; S490-S493 PolarHBondContact O-OG 3.31Å; V491-S493 VanDerWaalsContact C-N 3.32Å; V491-S493 PolarHBondContact O-N 3.05Å; S493-D495 PolarHBondContact O-N 3.01Å
494	T	90.4	Very high	86.9	Confident	10 Å²	10	56.6 Å²	56.6	6%	0.061	31%	0.309	C	S	.	.			trans	-62.4	128.9	178.8	-55.8	0	0	0	0	111.1	G323 S490 V491 R492 L499 I509 F546 R549	G323-T494 WeakPolarHBondContact CA-OG1 3.23Å; G323-T494 PolarHBondContact O-OG1 2.86Å; S490-T494 PolarHBondContact O-N 2.92Å; S490-T494 VanDerWaalsContact O-N 3.16Å; S490-T494 PolarHBondContact O-OG1 2.93Å; V491-T494 WeakPolarHBondContact O-CB 3.49Å; V491-T494 PolarHBondContact O-N 2.63Å; V491-T494 PolarHBondContact O-OG1 3.36Å; R492-T494 VanDerWaalsContact C-N 3.3Å; R492-T494 PolarHBondContact O-N 3.15Å; T494-L499 HydrophobicContact CG2-CD1 3.9Å; T494-L499 HydrophobicContact CG2-CD2 3.79Å; T494-L499 HydrophobicContact CG2-CG 4.12Å; T494-I509 HydrophobicContact CG2-CD1 4.13Å; T494-F546 HydrophobicContact CG2-CD2 4.21Å; T494-F546 HydrophobicContact CG2-CE2 3.66Å; T494-R549 PolarHBondContact O-NH1 2.88Å
495	D	85.3	Confident	86.6	Confident	58 Å²	58	64.3 Å²	64.3	31%	0.31	34%	0.338	S	S	.	.			trans	-97.5	113.9	175.4	179.5	1.3	0	0	0	109.5	S493 Q497 R498	S493-D495 PolarHBondContact O-N 3.01Å; D495-Q497 PolarHBondContact O-N 3.46Å; D495-Q497 VanDerWaalsContact O-N 3.11Å; D495-Q497 PolarHBondContact OD1-N 3.08Å; D495-R498 HydrophobicContact CB-CB 4.44Å; D495-R498 HydrophobicContact CB-CG 3.99Å; D495-R498 PolarHBondContact O-N 3.48Å; D495-R498 VanDerWaalsContact O-N 3.08Å; D495-R498 WeakPolarHBondContact OD2-CG 3.25Å; D495-R498 IonicContact OD2-NE 3.3Å; D495-R498 PolarHBondContact OD2-NE 3.26Å; D495-R498 VanDerWaalsContact OD2-NE 3.1Å
496	P	83	Confident	86.3	Confident	10 Å²	10	61.8 Å²	61.8	7%	0.065	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-52.7	-31.9	-179.8	-28.4	35.9	0	0	0	114.5	R498 L499 R549 V550 E553	P496-R498 VanDerWaalsContact C-N 3.26Å; P496-R498 PolarHBondContact O-N 3.28Å; P496-L499 PolarHBondContact O-N 2.79Å; P496-R549 HydrophobicContact CG-CB 3.89Å; P496-V550 HydrophobicContact CB-CG2 4.07Å; P496-V550 HydrophobicContact CG-CG2 4.14Å; P496-E553 HydrophobicContact CB-CG 3.74Å
497	Q	79.8	Confident	86.1	Confident	142 Å²	142	61 Å²	61	66%	0.664	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-73.6	-19.3	-176.6	-62.7	-171.6	-12.2	0	0	113.3	D495 E553	D495-Q497 PolarHBondContact O-N 3.46Å; D495-Q497 VanDerWaalsContact O-N 3.11Å; D495-Q497 PolarHBondContact OD1-N 3.08Å; Q497-E553 PolarHBondContact NE2-OE2 3Å
498	R	78.3	Confident	85.7	Confident	185 Å²	185	63.4 Å²	63.4	70%	0.698	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-85.2	-20.6	179.7	-62.9	-176.2	-172.2	-154.3	-6.1	112.8	D495 P496 G500	D495-R498 HydrophobicContact CB-CB 4.44Å; D495-R498 HydrophobicContact CB-CG 3.99Å; D495-R498 PolarHBondContact O-N 3.48Å; D495-R498 VanDerWaalsContact O-N 3.08Å; D495-R498 WeakPolarHBondContact OD2-CG 3.25Å; D495-R498 IonicContact OD2-NE 3.3Å; D495-R498 PolarHBondContact OD2-NE 3.26Å; D495-R498 VanDerWaalsContact OD2-NE 3.1Å; P496-R498 VanDerWaalsContact C-N 3.26Å; P496-R498 PolarHBondContact O-N 3.28Å; R498-G500 PolarHBondContact O-N 3.3Å
499	L	73.4	Confident	85.6	Confident	26 Å²	26	63 Å²	63	14%	0.136	33%	0.332	C	S	.	.	S	Bend	trans	-69.7	5.6	-171.9	-62.8	172.6	0	0	0	115.7	E325 T494 P496 L502 Y508 F546 V550	E325-L499 HydrophobicContact CG-CD2 4.12Å; T494-L499 HydrophobicContact CG2-CD1 3.9Å; T494-L499 HydrophobicContact CG2-CD2 3.79Å; T494-L499 HydrophobicContact CG2-CG 4.12Å; P496-L499 PolarHBondContact O-N 2.79Å; L499-L502 HydrophobicContact CB-CD2 4.2Å; L499-Y508 WeakPolarHBondContact CD2-OH 3.25Å; L499-F546 HydrophobicContact CD1-CE2 3.74Å; L499-F546 HydrophobicContact CD1-CZ 3.78Å; L499-V550 HydrophobicContact CD1-CG2 4.29Å
500	G	66.8	Low	85.4	Confident	50 Å²	50	58.3 Å²	58.3	52%	0.515	31%	0.31	S	S	.	.			trans	74.8	-162.3	-179.3	0	0	0	0	0	113.2	R498 L502	R498-G500 PolarHBondContact O-N 3.3Å; G500-L502 PolarHBondContact O-N 2.81Å
501	G	69.7	Low	85.2	Confident	87 Å²	87	64.6 Å²	64.6	90%	0.897	33%	0.333	S	S	*	.	S	Bend	trans	-61.6	97.5	-174.2	0	0	0	0	0	113.1
502	L	82	Confident	85	Confident	55 Å²	55	65.4 Å²	65.4	29%	0.288	34%	0.336	S	S	.	.			trans	-65.6	134.6	176.4	-60.9	175.1	0	0	0	110.3	L499 G500 V550 E553 F554	L499-L502 HydrophobicContact CB-CD2 4.2Å; G500-L502 PolarHBondContact O-N 2.81Å; L502-V550 HydrophobicContact CD1-CG1 4.19Å; L502-V550 HydrophobicContact CD2-CG1 3.92Å; L502-E553 HydrophobicContact CD1-CB 3.77Å; L502-E553 HydrophobicContact CD1-CG 4.14Å; L502-F554 HydrophobicContact CB-CE1 4.36Å; L502-F554 HydrophobicContact CB-CZ 4.04Å
503	D	85.8	Confident	85	Confident	79 Å²	79	59.5 Å²	59.5	42%	0.422	31%	0.314	S	S	.	.			trans	-129.3	163.2	173.2	-174.7	14.8	0	0	0	108.3	R505 F554 F563	D503-R505 PolarHBondContact O-N 3.3Å; D503-R505 VanDerWaalsContact O-N 3.11Å; D503-R505 VanDerWaalsContact OD2-CD 3.32Å; D503-R505 WeakPolarHBondContact OD2-CD 3.39Å; D503-R505 WeakPolarHBondContact OD2-CG 3.36Å; D503-R505 IonicContact OD2-CZ 2.67Å; D503-R505 IonicContact OD2-NE 3.06Å; D503-R505 PolarHBondContact OD2-NE 3.06Å; D503-F554 WeakPolarHBondContact O-CZ 3.1Å; D503-F563 WeakPolarHBondContact O-CD2 3.26Å
504	T	88.9	Confident	85	Confident	27 Å²	27	55.7 Å²	55.7	17%	0.166	29%	0.287	C	S	.	.	S	Bend	trans	-74.2	3.3	-178.4	63.2	0	0	0	0	113.7	F554 E559 V562 N566	T504-F554 HydrophobicContact CG2-CD1 4.47Å; T504-F554 HydrophobicContact CG2-CE1 4.08Å; T504-E559 HydrophobicContact CG2-CB 4.17Å; T504-E559 HydrophobicContact CG2-CG 4.47Å; T504-V562 HydrophobicContact CG2-CB 4.47Å; T504-V562 HydrophobicContact CG2-CG1 4.34Å; T504-N566 PolarHBondContact O-ND2 3.34Å
505	R	88.6	Confident	85	Confident	162 Å²	162	56.7 Å²	56.7	61%	0.611	29%	0.291	S	S	*	.	S	Bend	trans	-74.3	160.7	177.6	-65.4	178.2	-162.2	-154.6	-5.8	111.6	D503 H507	D503-R505 PolarHBondContact O-N 3.3Å; D503-R505 VanDerWaalsContact O-N 3.11Å; D503-R505 VanDerWaalsContact OD2-CD 3.32Å; D503-R505 WeakPolarHBondContact OD2-CD 3.39Å; D503-R505 WeakPolarHBondContact OD2-CG 3.36Å; D503-R505 IonicContact OD2-CZ 2.67Å; D503-R505 IonicContact OD2-NE 3.06Å; D503-R505 PolarHBondContact OD2-NE 3.06Å; R505-H507 PolarHBondContact O-N 3.38Å
506	P	89.5	Confident	85.4	Confident	41 Å²	41	54.1 Å²	54.1	27%	0.266	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-56.2	129.8	173.8	-22.4	32.5	0	0	0	111.5	N566 N567 M570	P506-N566 HydrophobicContact CG-CB 4.22Å; P506-N567 WeakPolarHBondContact CA-OD1 3.3Å; P506-M570 HydrophobicContact CB-CB 3.96Å; P506-M570 HydrophobicContact CB-CE 3.85Å; P506-M570 HydrophobicContact CB-CG 3.96Å; P506-M570 HydrophobicContact CG-CB 3.91Å; P506-M570 HydrophobicContact CG-CG 4.22Å
507	H	89.4	Confident	85.8	Confident	22 Å²	22	53.6 Å²	53.6	10%	0.102	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-73.9	149.9	179.9	-162.7	-95	0	0	0	110.7	R505 I509 T510 R511 F546 F563 N567	R505-H507 PolarHBondContact O-N 3.38Å; H507-I509 VanDerWaalsContact C-N 3.26Å; H507-I509 WeakPolarHBondContact ND1-CB 3.45Å; H507-I509 WeakPolarHBondContact ND1-CG1 3.3Å; H507-I509 PolarHBondContact ND1-N 3.34Å; H507-I509 PolarHBondContact O-N 3.38Å; H507-T510 PolarHBondContact O-N 2.97Å; H507-T510 PolarHBondContact O-OG1 3.48Å; H507-R511 PolarHBondContact O-N 3.08Å; H507-F546 AromaticContact CE1-CZ 3.78Å; H507-F546 AromaticContact ND1-CE1 3.78Å; H507-F546 AromaticContact ND1-CZ 3.71Å; H507-F563 HydrophobicContact CB-CE2 4.41Å; H507-F563 HydrophobicContact CB-CZ 4.32Å; H507-N567 PolarHBondContact N-OD1 2.87Å
508	Y	87	Confident	86.2	Confident	56 Å²	56	46.9 Å²	46.9	22%	0.22	24%	0.242	C	C	.	.	H	α-helix	trans	-66.1	-30.2	-179.1	68.2	-92	0	0	0	112.3	V324 E325 D326 L499 R511 R512	V324-Y508 WeakPolarHBondContact O-CE2 3.5Å; V324-Y508 PolarHBondContact O-OH 2.72Å; E325-Y508 WeakPolarHBondContact CA-OH 3.5Å; D326-Y508 HydrophobicContact CB-CD2 4.28Å; D326-Y508 HydrophobicContact CB-CE2 4.38Å; D326-Y508 HydrophobicContact CB-CG 4.37Å; L499-Y508 WeakPolarHBondContact CD2-OH 3.25Å; Y508-R511 PolarHBondContact O-N 2.86Å; Y508-R512 WeakPolarHBondContact O-CG 3.27Å; Y508-R512 PolarHBondContact O-N 3.41Å
509	I	91	Very high	86.8	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.1	-45.7	177.5	-65.2	179.2	0	0	0	111.2	M322 V491 T494 H507 R511 R512 Y513 F546	M322-I509 HydrophobicContact CG-CG2 4.19Å; V491-I509 HydrophobicContact CG1-CG2 4.5Å; V491-I509 HydrophobicContact CG2-CG2 4.19Å; T494-I509 HydrophobicContact CG2-CD1 4.13Å; H507-I509 VanDerWaalsContact C-N 3.26Å; H507-I509 WeakPolarHBondContact ND1-CB 3.45Å; H507-I509 WeakPolarHBondContact ND1-CG1 3.3Å; H507-I509 PolarHBondContact ND1-N 3.34Å; H507-I509 PolarHBondContact O-N 3.38Å; I509-R511 VanDerWaalsContact C-N 3.27Å; I509-R511 PolarHBondContact O-N 3.47Å; I509-R512 PolarHBondContact O-N 3Å; I509-Y513 WeakPolarHBondContact O-CB 3.44Å; I509-Y513 PolarHBondContact O-N 2.87Å; I509-F546 HydrophobicContact CB-CD1 4.44Å; I509-F546 HydrophobicContact CB-CE1 3.86Å; I509-F546 HydrophobicContact CB-CZ 4.28Å; I509-F546 HydrophobicContact CD1-CE1 4.02Å; I509-F546 HydrophobicContact CD1-CE2 3.88Å; I509-F546 HydrophobicContact CD1-CZ 3.54Å; I509-F546 HydrophobicContact CG1-CE1 4.43Å; I509-F546 HydrophobicContact CG1-CZ 4.35Å; I509-F546 HydrophobicContact CG2-CD1 4.05Å; I509-F546 HydrophobicContact CG2-CE1 3.97Å
510	T	91.8	Very high	87.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.4	-35	178.9	51.6	0	0	0	0	111	H507 Y513 A514 V543 V547 N567 M570 M571	H507-T510 PolarHBondContact O-N 2.97Å; H507-T510 PolarHBondContact O-OG1 3.48Å; T510-Y513 WeakPolarHBondContact O-CB 3.33Å; T510-Y513 PolarHBondContact O-N 3.16Å; T510-A514 PolarHBondContact O-N 3.12Å; T510-V543 HydrophobicContact CG2-CG1 4.28Å; T510-V547 HydrophobicContact CG2-CG2 3.29Å; T510-N567 HydrophobicContact CG2-CB 4.28Å; T510-N567 WeakPolarHBondContact CG2-OD1 3.39Å; T510-N567 PolarHBondContact OG1-OD1 3.36Å; T510-M570 WeakPolarHBondContact OG1-CE 3.39Å; T510-M571 HydrophobicContact CG2-CE 4.3Å; T510-M571 HydrophobicContact CG2-SD 3.91Å
511	R	89.6	Confident	88.6	Confident	143 Å²	143	35.3 Å²	35.3	54%	0.54	18%	0.183	S	C	.	.	H	α-helix	trans	-66.9	-47.7	174.6	-176.1	175.6	177.3	160.2	5.1	112.1	H507 Y508 I509 Y513 A514 E515 M570	H507-R511 PolarHBondContact O-N 3.08Å; Y508-R511 PolarHBondContact O-N 2.86Å; I509-R511 VanDerWaalsContact C-N 3.27Å; I509-R511 PolarHBondContact O-N 3.47Å; R511-Y513 VanDerWaalsContact C-N 3.27Å; R511-Y513 PolarHBondContact O-N 2.96Å; R511-A514 PolarHBondContact O-N 3.46Å; R511-E515 HydrophobicContact CG-CG 4.39Å; R511-E515 IonicContact CZ-OE1 3.28Å; R511-E515 IonicContact NE-OE1 2.75Å; R511-E515 PolarHBondContact NE-OE1 2.93Å; R511-E515 IonicContact NH2-OE1 2.89Å; R511-E515 PolarHBondContact NH2-OE1 3.31Å; R511-E515 WeakPolarHBondContact O-CB 3.33Å; R511-E515 WeakPolarHBondContact O-CG 3.44Å; R511-E515 PolarHBondContact O-N 3.43Å; R511-M570 HydrophobicContact CB-CE 3.83Å; R511-M570 HydrophobicContact CB-SD 3.85Å; R511-M570 HydrophobicContact CG-SD 4.13Å; R511-M570 VanDerWaalsContact N-CE 3.28Å
512	R	90.8	Very high	89.5	Confident	17 Å²	17	33 Å²	33	6%	0.064	15%	0.153	C	C	.	.	H	α-helix	trans	-56.8	-43.4	174.7	-73	177.1	-178	171.7	2.6	110.9	M322 V324 D326 F345 Y508 I509 F516	M322-R512 HydrophobicContact CG-CB 3.92Å; M322-R512 PolarHBondContact O-NH1 3.17Å; V324-R512 PolarHBondContact O-NH1 3.26Å; D326-R512 VanDerWaalsContact CG-NH2 3.34Å; D326-R512 IonicContact OD1-NH2 3.24Å; D326-R512 PolarHBondContact OD1-NH2 3.5Å; D326-R512 VanDerWaalsContact OD1-NH2 3.13Å; D326-R512 IonicContact OD2-NH2 3.7Å; F345-R512 HydrophobicContact CB-CB 4.41Å; F345-R512 HydrophobicContact CD2-CB 4.05Å; F345-R512 HydrophobicContact CD2-CG 3.73Å; F345-R512 HydrophobicContact CE2-CG 4.19Å; F345-R512 HydrophobicContact CG-CB 4.11Å; F345-R512 HydrophobicContact CG-CG 4.27Å; Y508-R512 WeakPolarHBondContact O-CG 3.27Å; Y508-R512 PolarHBondContact O-N 3.41Å; I509-R512 PolarHBondContact O-N 3Å; R512-F516 WeakPolarHBondContact O-CB 3.44Å; R512-F516 PolarHBondContact O-N 3.29Å
513	Y	93.3	Very high	89.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-58	-52.9	174.2	166.1	-102.8	0	0	0	112.2	I509 T510 R511 E515 F516 S517 L539 Q540 V543 M571 F589	I509-Y513 WeakPolarHBondContact O-CB 3.44Å; I509-Y513 PolarHBondContact O-N 2.87Å; T510-Y513 WeakPolarHBondContact O-CB 3.33Å; T510-Y513 PolarHBondContact O-N 3.16Å; R511-Y513 VanDerWaalsContact C-N 3.27Å; R511-Y513 PolarHBondContact O-N 2.96Å; Y513-E515 PolarHBondContact O-N 3.48Å; Y513-F516 PolarHBondContact O-N 3.1Å; Y513-S517 WeakPolarHBondContact O-CB 3.41Å; Y513-S517 PolarHBondContact O-N 3.21Å; Y513-L539 HydrophobicContact CD2-CD2 3.94Å; Y513-L539 HydrophobicContact CD2-CG 3.84Å; Y513-L539 HydrophobicContact CE2-CD2 4.22Å; Y513-L539 HydrophobicContact CE2-CG 4Å; Y513-Q540 HydrophobicContact CE2-CB 4.4Å; Y513-Q540 VanDerWaalsContact OH-CB 3.29Å; Y513-Q540 WeakPolarHBondContact OH-CB 3.05Å; Y513-Q540 WeakPolarHBondContact OH-CG 3.3Å; Y513-V543 HydrophobicContact CD1-CB 4.49Å; Y513-V543 HydrophobicContact CD1-CG1 3.95Å; Y513-V543 HydrophobicContact CD2-CB 4.31Å; Y513-V543 HydrophobicContact CD2-CG2 3.68Å; Y513-V543 HydrophobicContact CE2-CG2 4.35Å; Y513-V543 HydrophobicContact CG-CB 4.21Å; Y513-V543 HydrophobicContact CG-CG1 3.96Å; Y513-V543 HydrophobicContact CG-CG2 3.76Å; Y513-M571 HydrophobicContact CD1-CG 4.49Å; Y513-M571 HydrophobicContact CD1-SD 3.69Å; Y513-M571 HydrophobicContact CE1-SD 4.14Å; Y513-F589 AromaticContact CE1-CE2 3.74Å; Y513-F589 HydrophobicContact CE1-CE2 3.74Å; Y513-F589 AromaticContact CE1-CZ 3.75Å; Y513-F589 HydrophobicContact CE1-CZ 3.75Å
514	A	91.6	Very high	90	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.2	-41.6	-176.1	0	0	0	0	0	112.1	T510 R511 F516 S518 M571 V574	T510-A514 PolarHBondContact O-N 3.12Å; R511-A514 PolarHBondContact O-N 3.46Å; A514-F516 VanDerWaalsContact C-N 3.32Å; A514-F516 PolarHBondContact O-N 3.37Å; A514-S518 WeakPolarHBondContact O-CB 3.29Å; A514-S518 PolarHBondContact O-N 3.39Å; A514-S518 PolarHBondContact O-OG 2.99Å; A514-M571 HydrophobicContact CB-CB 4.1Å; A514-M571 HydrophobicContact CB-CG 4.08Å; A514-V574 HydrophobicContact CB-CB 3.82Å; A514-V574 HydrophobicContact CB-CG1 3.86Å; A514-V574 HydrophobicContact CB-CG2 4.48Å
515	E	90.4	Very high	89.7	Confident	31 Å²	31	31.1 Å²	31.1	15%	0.145	14%	0.139	C	C	.	.	H	α-helix	trans	-63.2	-38.6	175.1	-73.6	175.7	175.8	0	0	111.8	F345 T346 R511 Y513 S518 A519 V574	F345-E515 CarbonylContact O-C 3.09Å; T346-E515 HydrophobicContact CG2-CB 3.84Å; T346-E515 HydrophobicContact CG2-CG 4Å; T346-E515 WeakPolarHBondContact CG2-OE2 3.44Å; R511-E515 HydrophobicContact CG-CG 4.39Å; R511-E515 IonicContact CZ-OE1 3.28Å; R511-E515 IonicContact NE-OE1 2.75Å; R511-E515 PolarHBondContact NE-OE1 2.93Å; R511-E515 IonicContact NH2-OE1 2.89Å; R511-E515 PolarHBondContact NH2-OE1 3.31Å; R511-E515 WeakPolarHBondContact O-CB 3.33Å; R511-E515 WeakPolarHBondContact O-CG 3.44Å; R511-E515 PolarHBondContact O-N 3.43Å; Y513-E515 PolarHBondContact O-N 3.48Å; E515-S518 PolarHBondContact O-OG 2.86Å; E515-A519 WeakPolarHBondContact O-CB 3.5Å; E515-A519 PolarHBondContact O-N 2.9Å; E515-V574 HydrophobicContact CG-CG1 4.08Å
516	F	92.4	Very high	89.2	Confident	3 Å²	3	27.4 Å²	27.4	1%	0.013	13%	0.134	C	C	.	.	H	α-helix	trans	-76	-47.6	-179.3	-177.8	-103.9	0	0	0	113.1	M322 F345 A440 I441 L484 R512 Y513 A514 S518 A519 L520 L539	M322-F516 HydrophobicContact CE-CB 4.03Å; M322-F516 HydrophobicContact CE-CD1 3.97Å; M322-F516 HydrophobicContact CE-CG 4.15Å; F345-F516 HydrophobicContact CB-CB 4.13Å; F345-F516 HydrophobicContact CD1-CB 4.16Å; F345-F516 AromaticContact CD1-CD2 3.88Å; F345-F516 HydrophobicContact CD1-CD2 3.88Å; F345-F516 HydrophobicContact CD1-CG 4.15Å; F345-F516 WeakPolarHBondContact O-CA 3.31Å; F345-F516 PolarHBondContact O-N 3.18Å; F345-F516 VanDerWaalsContact O-N 3.1Å; A440-F516 HydrophobicContact CB-CE2 3.79Å; A440-F516 HydrophobicContact CB-CZ 3.75Å; I441-F516 HydrophobicContact CD1-CD2 4.08Å; I441-F516 HydrophobicContact CD1-CE2 4.47Å; I441-F516 HydrophobicContact CG1-CD2 4Å; I441-F516 HydrophobicContact CG1-CE2 3.89Å; L484-F516 HydrophobicContact CD1-CE1 3.49Å; L484-F516 VanDerWaalsContact CD1-CE1 3.49Å; L484-F516 HydrophobicContact CD1-CZ 3.95Å; R512-F516 WeakPolarHBondContact O-CB 3.44Å; R512-F516 PolarHBondContact O-N 3.29Å; Y513-F516 PolarHBondContact O-N 3.1Å; A514-F516 VanDerWaalsContact C-N 3.32Å; A514-F516 PolarHBondContact O-N 3.37Å; F516-S518 PolarHBondContact O-N 3.11Å; F516-A519 WeakPolarHBondContact O-CB 3.46Å; F516-A519 PolarHBondContact O-N 2.97Å; F516-L520 HydrophobicContact CD1-CD1 4.07Å; F516-L520 HydrophobicContact CE1-CD1 3.37Å; F516-L520 HydrophobicContact CE1-CG 4.26Å; F516-L520 HydrophobicContact CE2-CD1 4.19Å; F516-L520 HydrophobicContact CE2-CG 4.43Å; F516-L520 HydrophobicContact CZ-CD1 3.46Å; F516-L520 VanDerWaalsContact CZ-CD1 3.46Å; F516-L520 HydrophobicContact CZ-CG 4.16Å; F516-L520 PolarHBondContact O-N 3.17Å; F516-L539 HydrophobicContact CD1-CD2 4.01Å; F516-L539 HydrophobicContact CE1-CD2 4.15Å
517	S	91.8	Very high	89.1	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62	-45.9	177.6	-164	0	0	0	0	110.3	Y513 A519 L520 V521 E585	Y513-S517 WeakPolarHBondContact O-CB 3.41Å; Y513-S517 PolarHBondContact O-N 3.21Å; S517-A519 VanDerWaalsContact C-N 3.28Å; S517-A519 PolarHBondContact O-N 2.91Å; S517-L520 PolarHBondContact O-N 3.47Å; S517-V521 WeakPolarHBondContact O-CB 3.39Å; S517-V521 VanDerWaalsContact O-CG2 3.31Å; S517-V521 WeakPolarHBondContact O-CG2 3.07Å; S517-V521 PolarHBondContact O-N 3.04Å; S517-E585 PolarHBondContact OG-OE2 3.42Å; S517-E585 VanDerWaalsContact OG-OE2 3.12Å
518	S	88.6	Confident	89	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.6	-37.5	176.5	64.3	0	0	0	0	112.9	A514 E515 F516 S522	A514-S518 WeakPolarHBondContact O-CB 3.29Å; A514-S518 PolarHBondContact O-N 3.39Å; A514-S518 PolarHBondContact O-OG 2.99Å; E515-S518 PolarHBondContact O-OG 2.86Å; F516-S518 PolarHBondContact O-N 3.11Å; S518-S522 WeakPolarHBondContact O-CB 3.34Å; S518-S522 PolarHBondContact O-N 3.23Å
519	A	90	Very high	89	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.4	-50.1	174.5	0	0	0	0	0	112.1	L347 I441 E515 F516 S517 S522 I523	L347-A519 HydrophobicContact CB-CB 3.7Å; I441-A519 HydrophobicContact CD1-CB 3.81Å; I441-A519 HydrophobicContact CG1-CB 4.48Å; E515-A519 WeakPolarHBondContact O-CB 3.5Å; E515-A519 PolarHBondContact O-N 2.9Å; F516-A519 WeakPolarHBondContact O-CB 3.46Å; F516-A519 PolarHBondContact O-N 2.97Å; S517-A519 VanDerWaalsContact C-N 3.28Å; S517-A519 PolarHBondContact O-N 2.91Å; A519-S522 PolarHBondContact O-N 3.22Å; A519-I523 WeakPolarHBondContact O-CD1 3.34Å; A519-I523 WeakPolarHBondContact O-CG1 3.48Å; A519-I523 PolarHBondContact O-N 2.95Å; A519-I523 VanDerWaalsContact O-N 3.11Å
520	L	91.1	Very high	88.8	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.8	-44	-178.9	-67.2	-175.9	0	0	0	111.8	F444 F480 F516 S517 S522 I523 N524 L536	F444-L520 HydrophobicContact CB-CD2 3.93Å; F444-L520 HydrophobicContact CD1-CD2 3.42Å; F444-L520 VanDerWaalsContact CD1-CD2 3.42Å; F444-L520 HydrophobicContact CE1-CD2 4.11Å; F444-L520 HydrophobicContact CG-CD2 3.81Å; F480-L520 HydrophobicContact CE2-CD1 4.23Å; F480-L520 HydrophobicContact CE2-CD2 4.03Å; F480-L520 HydrophobicContact CZ-CD1 4.09Å; F480-L520 HydrophobicContact CZ-CD2 4.33Å; F516-L520 HydrophobicContact CD1-CD1 4.07Å; F516-L520 HydrophobicContact CE1-CD1 3.37Å; F516-L520 HydrophobicContact CE1-CG 4.26Å; F516-L520 HydrophobicContact CE2-CD1 4.19Å; F516-L520 HydrophobicContact CE2-CG 4.43Å; F516-L520 HydrophobicContact CZ-CD1 3.46Å; F516-L520 VanDerWaalsContact CZ-CD1 3.46Å; F516-L520 HydrophobicContact CZ-CG 4.16Å; F516-L520 PolarHBondContact O-N 3.17Å; S517-L520 PolarHBondContact O-N 3.47Å; L520-S522 VanDerWaalsContact C-N 3.35Å; L520-S522 PolarHBondContact O-N 3.47Å; L520-I523 PolarHBondContact O-N 2.79Å; L520-N524 VanDerWaalsContact O-CB 3.24Å; L520-N524 WeakPolarHBondContact O-CB 3.37Å; L520-N524 PolarHBondContact O-N 3.5Å; L520-L536 HydrophobicContact CB-CD1 4.17Å; L520-L536 HydrophobicContact CB-CD2 4.33Å; L520-L536 HydrophobicContact CD1-CD2 3.72Å; L520-L536 HydrophobicContact CD1-CG 4.49Å
521	V	88.3	Confident	88.7	Confident	19 Å²	19	44.8 Å²	44.8	12%	0.115	22%	0.22	C	C	.	.	H	α-helix	trans	-59.2	-47.1	175.7	172	0	0	0	0	110.3	S517 I523 N524 Q525 L536 A579	S517-V521 WeakPolarHBondContact O-CB 3.39Å; S517-V521 VanDerWaalsContact O-CG2 3.31Å; S517-V521 WeakPolarHBondContact O-CG2 3.07Å; S517-V521 PolarHBondContact O-N 3.04Å; V521-I523 VanDerWaalsContact C-N 3.34Å; V521-I523 PolarHBondContact O-N 3.1Å; V521-N524 PolarHBondContact O-N 3.47Å; V521-N524 VanDerWaalsContact O-N 3.1Å; V521-Q525 WeakPolarHBondContact O-CG 3.14Å; V521-Q525 PolarHBondContact O-N 3.08Å; V521-L536 HydrophobicContact CG2-CD1 4.04Å; V521-A579 HydrophobicContact CG1-CB 4.41Å
522	S	87.3	Confident	88.7	Confident	38 Å²	38	38 Å²	38	27%	0.266	20%	0.195	S	C	.	.	H	α-helix	trans	-57.8	-43	178.6	-179.6	0	0	0	0	112.7	S518 A519 L520	S518-S522 WeakPolarHBondContact O-CB 3.34Å; S518-S522 PolarHBondContact O-N 3.23Å; A519-S522 PolarHBondContact O-N 3.22Å; L520-S522 VanDerWaalsContact C-N 3.35Å; L520-S522 PolarHBondContact O-N 3.47Å
523	I	90	Very high	88.5	Confident	2 Å²	2	41 Å²	41	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-66	-41.8	175.7	-66.5	162.8	0	0	0	111.1	L347 I354 I441 F444 L445 H448 A519 L520 V521 Q525 T526	L347-I523 HydrophobicContact CD1-CD1 3.77Å; L347-I523 HydrophobicContact CD1-CG1 4.17Å; L347-I523 HydrophobicContact CD2-CG1 4.34Å; I354-I523 HydrophobicContact CD1-CB 4.4Å; I354-I523 HydrophobicContact CD1-CG1 4.25Å; I354-I523 HydrophobicContact CD1-CG2 4.02Å; I441-I523 HydrophobicContact CG2-CD1 4.29Å; F444-I523 HydrophobicContact CD1-CB 3.87Å; F444-I523 HydrophobicContact CD1-CD1 3.97Å; F444-I523 HydrophobicContact CD1-CG2 3.53Å; F444-I523 HydrophobicContact CE1-CB 3.76Å; F444-I523 HydrophobicContact CE1-CG2 3.49Å; F444-I523 VanDerWaalsContact CE1-CG2 3.49Å; F444-I523 HydrophobicContact CZ-CG2 4.46Å; L445-I523 HydrophobicContact CD2-CD1 3.52Å; L445-I523 HydrophobicContact CD2-CG1 3.78Å; L445-I523 HydrophobicContact CD2-CG2 4.41Å; L445-I523 HydrophobicContact CG-CD1 3.78Å; H448-I523 HydrophobicContact CB-CG2 4.07Å; H448-I523 VanDerWaalsContact CD2-CG2 3.42Å; H448-I523 WeakPolarHBondContact CD2-CG2 3.21Å; H448-I523 PolarHBondContact CE1-O 3.47Å; H448-I523 VanDerWaalsContact CG-CG2 3.47Å; H448-I523 PolarHBondContact ND1-O 2.91Å; A519-I523 WeakPolarHBondContact O-CD1 3.34Å; A519-I523 WeakPolarHBondContact O-CG1 3.48Å; A519-I523 PolarHBondContact O-N 2.95Å; A519-I523 VanDerWaalsContact O-N 3.11Å; L520-I523 PolarHBondContact O-N 2.79Å; V521-I523 VanDerWaalsContact C-N 3.34Å; V521-I523 PolarHBondContact O-N 3.1Å; I523-Q525 VanDerWaalsContact C-N 3.31Å; I523-Q525 PolarHBondContact O-N 3.22Å; I523-T526 PolarHBondContact O-OG1 3.21Å
524	N	88.1	Confident	88.4	Confident	6 Å²	6	46.7 Å²	46.7	3%	0.032	24%	0.237	C	C	.	.	H	α-helix	trans	-72.9	-17.3	-174.1	-156.8	35.8	0	0	0	113.6	F444 L520 V521 T526 I527 P528 N529 M533	F444-N524 HydrophobicContact CE1-CB 4.18Å; F444-N524 HydrophobicContact CZ-CB 4.09Å; L520-N524 VanDerWaalsContact O-CB 3.24Å; L520-N524 WeakPolarHBondContact O-CB 3.37Å; L520-N524 PolarHBondContact O-N 3.5Å; V521-N524 PolarHBondContact O-N 3.47Å; V521-N524 VanDerWaalsContact O-N 3.1Å; N524-T526 PolarHBondContact O-N 3.18Å; N524-T526 VanDerWaalsContact O-N 3.08Å; N524-I527 CarbonylContact O-C 3.51Å; N524-I527 VanDerWaalsContact O-C 3.32Å; N524-I527 PolarHBondContact O-N 3.2Å; N524-I527 PolarHBondContact OD1-O 2.86Å; N524-I527 VanDerWaalsContact OD1-O 3.12Å; N524-P528 WeakPolarHBondContact O-CA 3.46Å; N524-P528 WeakPolarHBondContact OD1-CA 3.11Å; N524-N529 PolarHBondContact OD1-N 3.47Å; N524-M533 PolarHBondContact ND2-SD 3.46Å; N524-M533 VanDerWaalsContact ND2-SD 3.45Å
525	Q	82.7	Confident	88.4	Confident	114 Å²	114	47.1 Å²	47.1	53%	0.533	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-36.3	-178.8	-78.6	173	4.7	0	0	113.8	V521 I523 R578	V521-Q525 WeakPolarHBondContact O-CG 3.14Å; V521-Q525 PolarHBondContact O-N 3.08Å; I523-Q525 VanDerWaalsContact C-N 3.31Å; I523-Q525 PolarHBondContact O-N 3.22Å; Q525-R578 PolarHBondContact NE2-O 2.98Å
526	T	78.8	Confident	88.4	Confident	84 Å²	84	45.7 Å²	45.7	52%	0.515	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-31.3	-172.9	54.6	0	0	0	0	114.4	R452 I523 N524	R452-T526 PolarHBondContact NH1-OG1 2.63Å; R452-T526 VanDerWaalsContact NH2-CB 3.34Å; R452-T526 PolarHBondContact NH2-OG1 3.13Å; I523-T526 PolarHBondContact O-OG1 3.21Å; N524-T526 PolarHBondContact O-N 3.18Å; N524-T526 VanDerWaalsContact O-N 3.08Å
527	I	87.4	Confident	88.4	Confident	49 Å²	49	46.8 Å²	46.8	25%	0.251	24%	0.244	S	C	.	.	S	Bend	trans	-143.8	86.6	-179.1	-53.7	-179.9	0	0	0	106.3	H448 L451 R452 N524	H448-I527 PolarHBondContact CE1-O 3.15Å; L451-I527 HydrophobicContact CB-CD1 3.82Å; L451-I527 HydrophobicContact CD1-CG2 4.07Å; R452-I527 HydrophobicContact CG-CD1 4.35Å; R452-I527 VanDerWaalsContact NH1-CD1 3.26Å; N524-I527 CarbonylContact O-C 3.51Å; N524-I527 VanDerWaalsContact O-C 3.32Å; N524-I527 PolarHBondContact O-N 3.2Å; N524-I527 PolarHBondContact OD1-O 2.86Å; N524-I527 VanDerWaalsContact OD1-O 3.12Å
528	P	85.9	Confident	88.4	Confident	106 Å²	106	51.5 Å²	51.5	69%	0.688	27%	0.267	S	S	*	.			trans	-69.9	138	-171.7	27.1	-33.9	0	0	0	111.5	N524	N524-P528 WeakPolarHBondContact O-CA 3.46Å; N524-P528 WeakPolarHBondContact OD1-CA 3.11Å
529	N	88.3	Confident	88.7	Confident	43 Å²	43	51.5 Å²	51.5	23%	0.23	27%	0.267	C	S	.	.			trans	-117.5	121.2	170.3	-173.9	-73.7	0	0	0	111.2	W477 N524 R531 T532 M533	W477-N529 HydrophobicContact CH2-CB 3.86Å; W477-N529 VanDerWaalsContact CH2-CG 3.49Å; W477-N529 WeakPolarHBondContact CH2-ND2 3.33Å; W477-N529 WeakPolarHBondContact CZ2-ND2 3.45Å; N524-N529 PolarHBondContact OD1-N 3.47Å; N529-R531 PolarHBondContact O-N 3.33Å; N529-R531 WeakPolarHBondContact OD1-CA 3.45Å; N529-R531 WeakPolarHBondContact OD1-CB 3.38Å; N529-R531 PolarHBondContact OD1-N 3.41Å; N529-T532 PolarHBondContact O-N 2.82Å; N529-T532 PolarHBondContact OD1-N 2.58Å; N529-T532 PolarHBondContact OD1-OG1 3.11Å; N529-M533 WeakPolarHBondContact O-CG 3.33Å; N529-M533 PolarHBondContact O-N 3.19Å
530	E	87.2	Confident	88.9	Confident	159 Å²	159	52.5 Å²	52.5	74%	0.743	27%	0.271	S	S	*	.	H	α-helix	trans	-64.1	-39.1	-178.1	-67.8	-175.8	173.2	0	0	113.1	T532 M533 Q534	E530-T532 PolarHBondContact O-N 3.08Å; E530-M533 PolarHBondContact O-N 3.44Å; E530-Q534 WeakPolarHBondContact O-CG 3.16Å; E530-Q534 PolarHBondContact O-N 3.27Å
531	R	88.3	Confident	89	Confident	127 Å²	127	56 Å²	56	48%	0.479	29%	0.292	S	S	.	.	H	α-helix	trans	-66.2	-39.4	-179	-168.9	171.9	-174	-165.8	-2.4	111.4	E481 N529 M533 Q534 L535	E481-R531 VanDerWaalsContact OE1-CD 3.29Å; E481-R531 WeakPolarHBondContact OE1-CD 3.13Å; E481-R531 IonicContact OE1-CZ 2.94Å; E481-R531 IonicContact OE1-NE 3.33Å; E481-R531 PolarHBondContact OE1-NE 3.48Å; E481-R531 IonicContact OE1-NH1 3.4Å; E481-R531 PolarHBondContact OE1-NH1 3.42Å; E481-R531 IonicContact OE1-NH2 3.02Å; E481-R531 IonicContact OE2-CZ 3.39Å; E481-R531 IonicContact OE2-NE 2.75Å; E481-R531 IonicContact OE2-NH1 3.82Å; E481-R531 PolarHBondContact OE2-NH1 3.3Å; E481-R531 IonicContact OE2-NH2 2.66Å; E481-R531 PolarHBondContact OE2-NH2 3.34Å; N529-R531 PolarHBondContact O-N 3.33Å; N529-R531 WeakPolarHBondContact OD1-CA 3.45Å; N529-R531 WeakPolarHBondContact OD1-CB 3.38Å; N529-R531 PolarHBondContact OD1-N 3.41Å; R531-M533 VanDerWaalsContact C-N 3.34Å; R531-M533 PolarHBondContact O-N 3.19Å; R531-Q534 PolarHBondContact O-N 2.97Å; R531-L535 PolarHBondContact O-N 2.93Å
532	T	89.6	Confident	89.3	Confident	1 Å²	1	56 Å²	56	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-45.7	171.4	-59	0	0	0	0	111.3	F444 F480 N529 E530 Q534 L535 L536	F444-T532 HydrophobicContact CE2-CG2 4.09Å; F444-T532 HydrophobicContact CZ-CG2 3.95Å; F480-T532 HydrophobicContact CE1-CG2 4.03Å; F480-T532 HydrophobicContact CZ-CG2 3.99Å; N529-T532 PolarHBondContact O-N 2.82Å; N529-T532 PolarHBondContact OD1-N 2.58Å; N529-T532 PolarHBondContact OD1-OG1 3.11Å; E530-T532 PolarHBondContact O-N 3.08Å; T532-Q534 VanDerWaalsContact C-N 3.31Å; T532-Q534 PolarHBondContact O-N 3.03Å; T532-L535 PolarHBondContact O-N 3.42Å; T532-L536 HydrophobicContact CG2-CD1 4.25Å; T532-L536 HydrophobicContact CG2-CG 4.49Å; T532-L536 WeakPolarHBondContact O-CG 3.3Å; T532-L536 PolarHBondContact O-N 3.12Å
533	M	88.4	Confident	89.7	Confident	78 Å²	78	54.1 Å²	54.1	38%	0.384	28%	0.278	S	S	.	.	H	α-helix	trans	-64	-35.7	178.5	-64.3	-56.4	-60.5	0	0	112.4	N524 N529 E530 R531 L536 G537	N524-M533 PolarHBondContact ND2-SD 3.46Å; N524-M533 VanDerWaalsContact ND2-SD 3.45Å; N529-M533 WeakPolarHBondContact O-CG 3.33Å; N529-M533 PolarHBondContact O-N 3.19Å; E530-M533 PolarHBondContact O-N 3.44Å; R531-M533 VanDerWaalsContact C-N 3.34Å; R531-M533 PolarHBondContact O-N 3.19Å; M533-L536 HydrophobicContact SD-CD1 4.25Å; M533-G537 PolarHBondContact O-N 3.42Å
534	Q	90.3	Very high	89.8	Confident	121 Å²	121	55.9 Å²	55.9	57%	0.565	29%	0.286	S	S	*	.	H	α-helix	trans	-64.5	-44.6	174.5	-70.7	172.4	5.3	0	0	112	E530 R531 T532 G537 Q538	E530-Q534 WeakPolarHBondContact O-CG 3.16Å; E530-Q534 PolarHBondContact O-N 3.27Å; R531-Q534 PolarHBondContact O-N 2.97Å; T532-Q534 VanDerWaalsContact C-N 3.31Å; T532-Q534 PolarHBondContact O-N 3.03Å; Q534-G537 PolarHBondContact O-N 3.03Å; Q534-Q538 WeakPolarHBondContact O-CG 3.36Å; Q534-Q538 PolarHBondContact O-N 3.49Å
535	L	90.6	Very high	90.1	Very high	9 Å²	9	59 Å²	59	5%	0.047	30%	0.303	C	S	.	.	H	α-helix	trans	-67.3	-37.3	177.9	-69.1	170.2	0	0	0	112.1	E481 L484 E485 R531 T532 Q538 L539	E481-L535 HydrophobicContact CB-CD1 4.33Å; E481-L535 HydrophobicContact CG-CD1 3.94Å; L484-L535 HydrophobicContact CD2-CB 3.36Å; L484-L535 HydrophobicContact CD2-CD1 3.94Å; L484-L535 HydrophobicContact CD2-CG 4.26Å; L484-L535 HydrophobicContact CG-CB 4.04Å; E485-L535 HydrophobicContact CG-CD2 4.31Å; R531-L535 PolarHBondContact O-N 2.93Å; T532-L535 PolarHBondContact O-N 3.42Å; L535-Q538 PolarHBondContact O-N 3.34Å; L535-L539 PolarHBondContact O-N 2.92Å
536	L	91.4	Very high	90.6	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-43.3	171.4	-75.7	177.2	0	0	0	111.7	L520 V521 T532 M533 Q538 L539 Q540	L520-L536 HydrophobicContact CB-CD1 4.17Å; L520-L536 HydrophobicContact CB-CD2 4.33Å; L520-L536 HydrophobicContact CD1-CD2 3.72Å; L520-L536 HydrophobicContact CD1-CG 4.49Å; V521-L536 HydrophobicContact CG2-CD1 4.04Å; T532-L536 HydrophobicContact CG2-CD1 4.25Å; T532-L536 HydrophobicContact CG2-CG 4.49Å; T532-L536 WeakPolarHBondContact O-CG 3.3Å; T532-L536 PolarHBondContact O-N 3.12Å; M533-L536 HydrophobicContact SD-CD1 4.25Å; L536-Q538 VanDerWaalsContact C-N 3.33Å; L536-Q538 PolarHBondContact O-N 2.75Å; L536-L539 WeakPolarHBondContact O-CB 3.47Å; L536-L539 PolarHBondContact O-N 3.22Å; L536-Q540 PolarHBondContact O-N 3.37Å
537	G	91.4	Very high	91.3	Very high	26 Å²	26	49.5 Å²	49.5	27%	0.268	25%	0.253	S	S	.	.	H	α-helix	trans	-61.4	-37.8	174.1	0	0	0	0	0	113.2	M533 Q534 Q540 V541	M533-G537 PolarHBondContact O-N 3.42Å; Q534-G537 PolarHBondContact O-N 3.03Å; G537-Q540 WeakPolarHBondContact O-CB 3.31Å; G537-Q540 PolarHBondContact O-N 3.13Å; G537-V541 WeakPolarHBondContact O-CG2 3.5Å; G537-V541 PolarHBondContact O-N 2.78Å; G537-V541 VanDerWaalsContact O-N 3.12Å
538	Q	93.3	Very high	91.6	Very high	99 Å²	99	50.7 Å²	50.7	46%	0.463	26%	0.259	S	S	.	.	H	α-helix	trans	-64.3	-43.9	173.1	-69.3	176.1	19.9	0	0	111.7	Q534 L535 L536 Q540 V541 E542	Q534-Q538 WeakPolarHBondContact O-CG 3.36Å; Q534-Q538 PolarHBondContact O-N 3.49Å; L535-Q538 PolarHBondContact O-N 3.34Å; L536-Q538 VanDerWaalsContact C-N 3.33Å; L536-Q538 PolarHBondContact O-N 2.75Å; Q538-Q540 VanDerWaalsContact C-N 3.33Å; Q538-Q540 PolarHBondContact O-N 2.98Å; Q538-V541 PolarHBondContact O-N 3.11Å; Q538-E542 PolarHBondContact O-N 2.98Å; Q538-E542 VanDerWaalsContact O-N 3.12Å
539	L	94.3	Very high	92	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-42.2	176.3	-177	61.6	0	0	0	111.6	M322 L484 V488 V491 Y513 F516 L535 L536 V541 E542 V543	M322-L539 HydrophobicContact CE-CD2 4.04Å; M322-L539 HydrophobicContact SD-CD1 4.22Å; L484-L539 HydrophobicContact CD1-CD2 4.17Å; V488-L539 HydrophobicContact CG2-CB 3.82Å; V488-L539 HydrophobicContact CG2-CD1 3.93Å; V488-L539 HydrophobicContact CG2-CG 4.45Å; V491-L539 HydrophobicContact CG2-CD1 4.45Å; Y513-L539 HydrophobicContact CD2-CD2 3.94Å; Y513-L539 HydrophobicContact CD2-CG 3.84Å; Y513-L539 HydrophobicContact CE2-CD2 4.22Å; Y513-L539 HydrophobicContact CE2-CG 4Å; F516-L539 HydrophobicContact CD1-CD2 4.01Å; F516-L539 HydrophobicContact CE1-CD2 4.15Å; L535-L539 PolarHBondContact O-N 2.92Å; L536-L539 WeakPolarHBondContact O-CB 3.47Å; L536-L539 PolarHBondContact O-N 3.22Å; L539-V541 PolarHBondContact O-N 2.54Å; L539-E542 PolarHBondContact O-N 3.1Å; L539-V543 HydrophobicContact CD1-CG2 4.36Å; L539-V543 WeakPolarHBondContact O-CG2 3.36Å; L539-V543 PolarHBondContact O-N 3.12Å
540	Q	93.3	Very high	92.2	Very high	22 Å²	22	47.8 Å²	47.8	10%	0.103	23%	0.231	C	C	.	.	H	α-helix	trans	-55.3	-51.5	175.2	-178.5	-175	-9.5	0	0	111.2	Y513 L536 G537 Q538 E542 V543 E544 S588 F589	Y513-Q540 HydrophobicContact CE2-CB 4.4Å; Y513-Q540 VanDerWaalsContact OH-CB 3.29Å; Y513-Q540 WeakPolarHBondContact OH-CB 3.05Å; Y513-Q540 WeakPolarHBondContact OH-CG 3.3Å; L536-Q540 PolarHBondContact O-N 3.37Å; G537-Q540 WeakPolarHBondContact O-CB 3.31Å; G537-Q540 PolarHBondContact O-N 3.13Å; Q538-Q540 VanDerWaalsContact C-N 3.33Å; Q538-Q540 PolarHBondContact O-N 2.98Å; Q540-E542 VanDerWaalsContact C-N 3.32Å; Q540-E542 PolarHBondContact O-N 3Å; Q540-V543 PolarHBondContact O-N 3Å; Q540-V543 VanDerWaalsContact O-N 3.16Å; Q540-E544 WeakPolarHBondContact CG-OE1 3.13Å; Q540-E544 PolarHBondContact NE2-OE1 3.46Å; Q540-E544 WeakPolarHBondContact O-CG 3.37Å; Q540-E544 PolarHBondContact O-N 2.82Å; Q540-S588 PolarHBondContact NE2-OG 2.87Å; Q540-F589 HydrophobicContact CG-CE2 4.1Å; Q540-F589 HydrophobicContact CG-CZ 3.96Å
541	V	93.8	Very high	92.5	Very high	73 Å²	73	40.4 Å²	40.4	44%	0.442	20%	0.198	S	C	.	.	H	α-helix	trans	-59.7	-42.6	-179.6	171.1	0	0	0	0	111.4	G537 Q538 L539 V543 E544 N545	G537-V541 WeakPolarHBondContact O-CG2 3.5Å; G537-V541 PolarHBondContact O-N 2.78Å; G537-V541 VanDerWaalsContact O-N 3.12Å; Q538-V541 PolarHBondContact O-N 3.11Å; L539-V541 PolarHBondContact O-N 2.54Å; V541-V543 PolarHBondContact O-N 2.78Å; V541-E544 PolarHBondContact O-N 3.05Å; V541-N545 WeakPolarHBondContact O-CB 3.19Å; V541-N545 VanDerWaalsContact O-CG 3.27Å; V541-N545 PolarHBondContact O-N 3.06Å; V541-N545 PolarHBondContact O-ND2 3.25Å
542	E	95.1	Very high	92.7	Very high	18 Å²	18	37.6 Å²	37.6	8%	0.084	20%	0.202	C	C	.	.	H	α-helix	trans	-67	-35.4	177.6	-66.7	-53.1	139.9	0	0	112.8	V488 V491 R492 Q538 L539 Q540 F546	V488-E542 HydrophobicContact CG1-CG 3.76Å; V491-E542 HydrophobicContact CG1-CB 4.3Å; R492-E542 HydrophobicContact CB-CG 4.35Å; R492-E542 VanDerWaalsContact CB-OE2 3.24Å; R492-E542 WeakPolarHBondContact CB-OE2 3.42Å; R492-E542 VanDerWaalsContact CG-OE2 3.26Å; R492-E542 WeakPolarHBondContact CG-OE2 3.42Å; R492-E542 IonicContact CZ-OE1 3.56Å; R492-E542 VanDerWaalsContact CZ-OE1 3.25Å; R492-E542 IonicContact NE-OE1 3.39Å; R492-E542 PolarHBondContact NE-OE1 3.48Å; R492-E542 IonicContact NE-OE2 2.78Å; R492-E542 PolarHBondContact NE-OE2 3.04Å; R492-E542 IonicContact NH2-OE1 3.5Å; R492-E542 PolarHBondContact NH2-OE1 2.74Å; Q538-E542 PolarHBondContact O-N 2.98Å; Q538-E542 VanDerWaalsContact O-N 3.12Å; L539-E542 PolarHBondContact O-N 3.1Å; Q540-E542 VanDerWaalsContact C-N 3.32Å; Q540-E542 PolarHBondContact O-N 3Å; E542-F546 VanDerWaalsContact O-CB 3.27Å; E542-F546 WeakPolarHBondContact O-CB 3.4Å; E542-F546 PolarHBondContact O-N 3.04Å
543	V	94.6	Very high	92.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-69	-42.4	174.9	171.7	0	0	0	0	111	M322 V491 T510 Y513 L539 Q540 V541 N545 F546 V547 M571	M322-V543 HydrophobicContact SD-CG2 4.47Å; V491-V543 HydrophobicContact CG1-CG2 3.99Å; V491-V543 HydrophobicContact CG2-CG2 4.5Å; T510-V543 HydrophobicContact CG2-CG1 4.28Å; Y513-V543 HydrophobicContact CD1-CB 4.49Å; Y513-V543 HydrophobicContact CD1-CG1 3.95Å; Y513-V543 HydrophobicContact CD2-CB 4.31Å; Y513-V543 HydrophobicContact CD2-CG2 3.68Å; Y513-V543 HydrophobicContact CE2-CG2 4.35Å; Y513-V543 HydrophobicContact CG-CB 4.21Å; Y513-V543 HydrophobicContact CG-CG1 3.96Å; Y513-V543 HydrophobicContact CG-CG2 3.76Å; L539-V543 HydrophobicContact CD1-CG2 4.36Å; L539-V543 WeakPolarHBondContact O-CG2 3.36Å; L539-V543 PolarHBondContact O-N 3.12Å; Q540-V543 PolarHBondContact O-N 3Å; Q540-V543 VanDerWaalsContact O-N 3.16Å; V541-V543 PolarHBondContact O-N 2.78Å; V543-N545 PolarHBondContact O-N 3.37Å; V543-F546 WeakPolarHBondContact O-CB 3.5Å; V543-F546 PolarHBondContact O-N 3.26Å; V543-V547 HydrophobicContact CG1-CG2 4.49Å; V543-V547 WeakPolarHBondContact O-CG2 3.24Å; V543-V547 PolarHBondContact O-N 3.41Å; V543-M571 HydrophobicContact CG1-SD 4.05Å
544	E	93.1	Very high	92.9	Very high	38 Å²	38	39.1 Å²	39.1	18%	0.178	21%	0.207	C	C	.	.	H	α-helix	trans	-59	-47	173.9	-73	178.6	-160.3	0	0	111.3	Q540 V541 F546 V547 L548 F589 L592	Q540-E544 WeakPolarHBondContact CG-OE1 3.13Å; Q540-E544 PolarHBondContact NE2-OE1 3.46Å; Q540-E544 WeakPolarHBondContact O-CG 3.37Å; Q540-E544 PolarHBondContact O-N 2.82Å; V541-E544 PolarHBondContact O-N 3.05Å; E544-F546 VanDerWaalsContact C-N 3.32Å; E544-F546 PolarHBondContact O-N 3.12Å; E544-V547 PolarHBondContact O-N 3.39Å; E544-L548 WeakPolarHBondContact O-CG 3.32Å; E544-L548 PolarHBondContact O-N 3.07Å; E544-F589 HydrophobicContact CG-CE1 3.89Å; E544-F589 HydrophobicContact CG-CZ 4.21Å; E544-L592 HydrophobicContact CG-CD1 4.35Å
545	N	93.8	Very high	92.9	Very high	71 Å²	71	38.9 Å²	38.9	38%	0.38	22%	0.22	S	C	.	.	H	α-helix	trans	-61.8	-39.6	175.2	-73.2	-30.1	0	0	0	112.2	V541 V543 L548 R549	V541-N545 WeakPolarHBondContact O-CB 3.19Å; V541-N545 VanDerWaalsContact O-CG 3.27Å; V541-N545 PolarHBondContact O-N 3.06Å; V541-N545 PolarHBondContact O-ND2 3.25Å; V543-N545 PolarHBondContact O-N 3.37Å; N545-L548 PolarHBondContact O-N 3.29Å; N545-R549 WeakPolarHBondContact O-CG 3.17Å; N545-R549 PolarHBondContact O-N 3.42Å
546	F	94.2	Very high	93	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-49.1	175	167.7	-98.6	0	0	0	111.7	V491 T494 L499 H507 I509 E542 V543 E544 L548 R549 V550	V491-F546 HydrophobicContact CG1-CB 3.78Å; V491-F546 HydrophobicContact CG1-CG 4.19Å; T494-F546 HydrophobicContact CG2-CD2 4.21Å; T494-F546 HydrophobicContact CG2-CE2 3.66Å; L499-F546 HydrophobicContact CD1-CE2 3.74Å; L499-F546 HydrophobicContact CD1-CZ 3.78Å; H507-F546 AromaticContact CE1-CZ 3.78Å; H507-F546 AromaticContact ND1-CE1 3.78Å; H507-F546 AromaticContact ND1-CZ 3.71Å; I509-F546 HydrophobicContact CB-CD1 4.44Å; I509-F546 HydrophobicContact CB-CE1 3.86Å; I509-F546 HydrophobicContact CB-CZ 4.28Å; I509-F546 HydrophobicContact CD1-CE1 4.02Å; I509-F546 HydrophobicContact CD1-CE2 3.88Å; I509-F546 HydrophobicContact CD1-CZ 3.54Å; I509-F546 HydrophobicContact CG1-CE1 4.43Å; I509-F546 HydrophobicContact CG1-CZ 4.35Å; I509-F546 HydrophobicContact CG2-CD1 4.05Å; I509-F546 HydrophobicContact CG2-CE1 3.97Å; E542-F546 VanDerWaalsContact O-CB 3.27Å; E542-F546 WeakPolarHBondContact O-CB 3.4Å; E542-F546 PolarHBondContact O-N 3.04Å; V543-F546 WeakPolarHBondContact O-CB 3.5Å; V543-F546 PolarHBondContact O-N 3.26Å; E544-F546 VanDerWaalsContact C-N 3.32Å; E544-F546 PolarHBondContact O-N 3.12Å; F546-L548 VanDerWaalsContact C-N 3.3Å; F546-L548 PolarHBondContact O-N 3.28Å; F546-R549 PolarHBondContact O-N 3.14Å; F546-R549 VanDerWaalsContact O-N 3.17Å; F546-V550 HydrophobicContact CD2-CG2 4.16Å; F546-V550 HydrophobicContact CE1-CG2 4.01Å; F546-V550 HydrophobicContact CE2-CG2 3.54Å; F546-V550 HydrophobicContact CZ-CG2 3.44Å; F546-V550 VanDerWaalsContact CZ-CG2 3.44Å; F546-V550 WeakPolarHBondContact O-CG2 3.33Å; F546-V550 PolarHBondContact O-N 3.28Å
547	V	93.6	Very high	93.1	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.9	-41.1	179.5	178.5	0	0	0	0	110.9	T510 V543 E544 V550 A551 F563 L564 N567 Y568	T510-V547 HydrophobicContact CG2-CG2 3.29Å; V543-V547 HydrophobicContact CG1-CG2 4.49Å; V543-V547 WeakPolarHBondContact O-CG2 3.24Å; V543-V547 PolarHBondContact O-N 3.41Å; E544-V547 PolarHBondContact O-N 3.39Å; V547-V550 PolarHBondContact O-N 3.22Å; V547-A551 WeakPolarHBondContact O-CB 3.36Å; V547-A551 PolarHBondContact O-N 3.04Å; V547-F563 HydrophobicContact CG1-CD1 4.38Å; V547-F563 HydrophobicContact CG1-CE1 3.85Å; V547-L564 HydrophobicContact CG1-CD2 3.63Å; V547-N567 HydrophobicContact CG1-CB 4.21Å; V547-Y568 HydrophobicContact CG1-CE1 4.49Å
548	L	94.3	Very high	93	Very high	74 Å²	74	46.5 Å²	46.5	39%	0.387	25%	0.248	S	C	.	.	H	α-helix	trans	-64.5	-40.5	176.1	-69	174	0	0	0	112.7	E544 N545 F546 A551 A552 L564	E544-L548 WeakPolarHBondContact O-CG 3.32Å; E544-L548 PolarHBondContact O-N 3.07Å; N545-L548 PolarHBondContact O-N 3.29Å; F546-L548 VanDerWaalsContact C-N 3.3Å; F546-L548 PolarHBondContact O-N 3.28Å; L548-A551 PolarHBondContact O-N 2.94Å; L548-A552 PolarHBondContact O-N 2.77Å; L548-A552 VanDerWaalsContact O-N 3.07Å; L548-L564 HydrophobicContact CD2-CD2 3.9Å
549	R	93.5	Very high	93	Very high	87 Å²	87	45.6 Å²	45.6	33%	0.328	24%	0.244	S	C	.	.	H	α-helix	trans	-62.8	-44.3	175.5	-75.4	-174.6	-66.4	167.9	-0.5	111.9	V491 R492 T494 P496 N545 F546 A552	V491-R549 PolarHBondContact O-NH2 3.43Å; V491-R549 VanDerWaalsContact O-NH2 3.11Å; R492-R549 PolarHBondContact O-NH1 3.39Å; R492-R549 PolarHBondContact O-NH2 2.98Å; T494-R549 PolarHBondContact O-NH1 2.88Å; P496-R549 HydrophobicContact CG-CB 3.89Å; N545-R549 WeakPolarHBondContact O-CG 3.17Å; N545-R549 PolarHBondContact O-N 3.42Å; F546-R549 PolarHBondContact O-N 3.14Å; F546-R549 VanDerWaalsContact O-N 3.17Å; R549-A552 WeakPolarHBondContact O-CB 3.17Å; R549-A552 PolarHBondContact O-N 2.75Å
550	V	92.1	Very high	93	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67	-40.1	176.5	178.8	0	0	0	0	111.3	P496 L499 L502 F546 V547 A552 E553 F554 F563	P496-V550 HydrophobicContact CB-CG2 4.07Å; P496-V550 HydrophobicContact CG-CG2 4.14Å; L499-V550 HydrophobicContact CD1-CG2 4.29Å; L502-V550 HydrophobicContact CD1-CG1 4.19Å; L502-V550 HydrophobicContact CD2-CG1 3.92Å; F546-V550 HydrophobicContact CD2-CG2 4.16Å; F546-V550 HydrophobicContact CE1-CG2 4.01Å; F546-V550 HydrophobicContact CE2-CG2 3.54Å; F546-V550 HydrophobicContact CZ-CG2 3.44Å; F546-V550 VanDerWaalsContact CZ-CG2 3.44Å; F546-V550 WeakPolarHBondContact O-CG2 3.33Å; F546-V550 PolarHBondContact O-N 3.28Å; V547-V550 PolarHBondContact O-N 3.22Å; V550-A552 PolarHBondContact O-N 3.36Å; V550-E553 WeakPolarHBondContact O-CB 3.5Å; V550-E553 PolarHBondContact O-N 3.27Å; V550-E553 VanDerWaalsContact O-N 3.14Å; V550-F554 HydrophobicContact CG1-CE2 4.34Å; V550-F563 HydrophobicContact CB-CE1 3.81Å; V550-F563 HydrophobicContact CB-CZ 3.85Å; V550-F563 HydrophobicContact CG1-CE1 3.69Å; V550-F563 HydrophobicContact CG1-CE2 3.99Å; V550-F563 HydrophobicContact CG1-CZ 3.36Å
551	A	93.3	Very high	93.1	Very high	5 Å²	5	46.3 Å²	46.3	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-36.7	175.4	0	0	0	0	0	111.5	V547 L548 E553 F554 Q560 F563 L564	V547-A551 WeakPolarHBondContact O-CB 3.36Å; V547-A551 PolarHBondContact O-N 3.04Å; L548-A551 PolarHBondContact O-N 2.94Å; A551-E553 PolarHBondContact O-N 3.3Å; A551-F554 PolarHBondContact O-N 2.94Å; A551-Q560 VanDerWaalsContact O-CG 3.23Å; A551-Q560 WeakPolarHBondContact O-CG 3.33Å; A551-F563 HydrophobicContact CB-CD1 3.97Å; A551-F563 HydrophobicContact CB-CE1 4.48Å; A551-L564 HydrophobicContact CB-CD1 4.21Å; A551-L564 HydrophobicContact CB-CD2 4.06Å; A551-L564 HydrophobicContact CB-CG 3.91Å
552	A	92.8	Very high	93.1	Very high	68 Å²	68	43 Å²	43	56%	0.562	23%	0.227	S	C	*	.	H	α-helix	trans	-67	-18.3	-179.9	0	0	0	0	0	114.5	L548 R549 V550 F554	L548-A552 PolarHBondContact O-N 2.77Å; L548-A552 VanDerWaalsContact O-N 3.07Å; R549-A552 WeakPolarHBondContact O-CB 3.17Å; R549-A552 PolarHBondContact O-N 2.75Å; V550-A552 PolarHBondContact O-N 3.36Å; A552-F554 VanDerWaalsContact C-N 3.3Å
553	E	91.6	Very high	93	Very high	89 Å²	89	42.2 Å²	42.2	42%	0.416	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-17.4	176.7	-61.9	-64	138.6	0	0	112.7	P496 Q497 L502 V550 A551	P496-E553 HydrophobicContact CB-CG 3.74Å; Q497-E553 PolarHBondContact NE2-OE2 3Å; L502-E553 HydrophobicContact CD1-CB 3.77Å; L502-E553 HydrophobicContact CD1-CG 4.14Å; V550-E553 WeakPolarHBondContact O-CB 3.5Å; V550-E553 PolarHBondContact O-N 3.27Å; V550-E553 VanDerWaalsContact O-N 3.14Å; A551-E553 PolarHBondContact O-N 3.3Å
554	F	91.6	Very high	93	Very high	21 Å²	21	42.4 Å²	42.4	9%	0.092	23%	0.225	C	C	.	.	S	Bend	trans	-78.1	135.1	176.1	-63.8	-87.1	0	0	0	111.5	L502 D503 T504 V550 A551 A552 E559 Q560 F563	L502-F554 HydrophobicContact CB-CE1 4.36Å; L502-F554 HydrophobicContact CB-CZ 4.04Å; D503-F554 WeakPolarHBondContact O-CZ 3.1Å; T504-F554 HydrophobicContact CG2-CD1 4.47Å; T504-F554 HydrophobicContact CG2-CE1 4.08Å; V550-F554 HydrophobicContact CG1-CE2 4.34Å; A551-F554 PolarHBondContact O-N 2.94Å; A552-F554 VanDerWaalsContact C-N 3.3Å; F554-E559 HydrophobicContact CB-CB 3.94Å; F554-E559 HydrophobicContact CD1-CB 4.08Å; F554-E559 HydrophobicContact CG-CB 4.21Å; F554-Q560 HydrophobicContact CB-CG 3.96Å; F554-Q560 PolarHBondContact O-NE2 3.31Å; F554-F563 HydrophobicContact CD2-CB 4.36Å; F554-F563 HydrophobicContact CD2-CG 4.47Å; F554-F563 HydrophobicContact CE2-CB 3.85Å; F554-F563 HydrophobicContact CE2-CD1 4.12Å; F554-F563 AromaticContact CE2-CD2 3.81Å; F554-F563 HydrophobicContact CE2-CD2 3.81Å; F554-F563 HydrophobicContact CE2-CE2 4.4Å; F554-F563 AromaticContact CE2-CG 3.65Å; F554-F563 HydrophobicContact CE2-CG 3.65Å; F554-F563 HydrophobicContact CZ-CB 4.31Å; F554-F563 AromaticContact CZ-CD2 3.95Å; F554-F563 HydrophobicContact CZ-CD2 3.95Å; F554-F563 HydrophobicContact CZ-CG 4.19Å
555	S	90.1	Very high	93.1	Very high	117 Å²	117	40.6 Å²	40.6	82%	0.818	22%	0.216	S	C	*	.	S	Bend	trans	-70.6	-33.1	-174.5	67	0	0	0	0	114.1
556	S	92.2	Very high	93.1	Very high	46 Å²	46	37.3 Å²	37.3	32%	0.322	20%	0.199	S	C	.	.	S	Bend	trans	-104.7	132.2	-175.8	174.7	0	0	0	0	111.6	K558 E559 Q560	S556-K558 PolarHBondContact O-N 2.88Å; S556-K558 VanDerWaalsContact O-N 3.1Å; S556-K558 PolarHBondContact OG-N 3.41Å; S556-E559 WeakPolarHBondContact O-CB 3.44Å; S556-E559 PolarHBondContact O-N 3Å; S556-Q560 WeakPolarHBondContact O-CG 3.36Å; S556-Q560 PolarHBondContact O-N 3.34Å
557	R	92.9	Very high	93.1	Very high	92 Å²	92	37.3 Å²	37.3	35%	0.347	20%	0.199	S	C	.	.	H	α-helix	trans	-53	-36.2	176.3	-175.8	55.6	174.2	-179.6	0.5	112.2	Q560 L561 E599	R557-Q560 WeakPolarHBondContact O-CB 3.35Å; R557-Q560 PolarHBondContact O-N 2.91Å; R557-L561 HydrophobicContact CG-CD1 4.11Å; R557-L561 WeakPolarHBondContact O-CG 3.41Å; R557-L561 PolarHBondContact O-N 3.3Å; R557-E599 IonicContact CZ-OE1 3.36Å; R557-E599 IonicContact NE-OE1 2.74Å; R557-E599 PolarHBondContact NE-OE1 3.49Å; R557-E599 VanDerWaalsContact NH2-CD 3.35Å; R557-E599 IonicContact NH2-OE1 3.41Å; R557-E599 PolarHBondContact NH2-OE1 2.84Å; R557-E599 IonicContact NH2-OE2 3.08Å; R557-E599 PolarHBondContact NH2-OE2 3.3Å
558	K	90.9	Very high	93.1	Very high	56 Å²	56	37.5 Å²	37.5	24%	0.243	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-48	175	-173.3	-173.1	163.9	-162.8	0	111.8	S556 L561 V562 F600 D659	S556-K558 PolarHBondContact O-N 2.88Å; S556-K558 VanDerWaalsContact O-N 3.1Å; S556-K558 PolarHBondContact OG-N 3.41Å; K558-L561 PolarHBondContact O-N 2.77Å; K558-V562 VanDerWaalsContact O-CG2 3.29Å; K558-V562 WeakPolarHBondContact O-CG2 3.44Å; K558-V562 PolarHBondContact O-N 3.43Å; K558-F600 HydrophobicContact CG-CD2 4.5Å; K558-F600 HydrophobicContact CG-CE2 3.75Å; K558-D659 WeakPolarHBondContact CE-OD2 3.06Å; K558-D659 IonicContact NZ-OD1 3.84Å; K558-D659 PolarHBondContact NZ-OD1 3.35Å; K558-D659 IonicContact NZ-OD2 3.05Å; K558-D659 PolarHBondContact NZ-OD2 3.36Å
559	E	91.9	Very high	93	Very high	81 Å²	81	35.1 Å²	35.1	38%	0.379	19%	0.187	S	C	.	.	H	α-helix	trans	-64.9	-40	178.4	-67.7	173	167.3	0	0	111.7	T504 F554 S556 L561 V562 F563	T504-E559 HydrophobicContact CG2-CB 4.17Å; T504-E559 HydrophobicContact CG2-CG 4.47Å; F554-E559 HydrophobicContact CB-CB 3.94Å; F554-E559 HydrophobicContact CD1-CB 4.08Å; F554-E559 HydrophobicContact CG-CB 4.21Å; S556-E559 WeakPolarHBondContact O-CB 3.44Å; S556-E559 PolarHBondContact O-N 3Å; E559-L561 VanDerWaalsContact C-N 3.32Å; E559-L561 PolarHBondContact O-N 3.02Å; E559-V562 PolarHBondContact O-N 2.85Å; E559-F563 WeakPolarHBondContact O-CB 3.48Å; E559-F563 PolarHBondContact O-N 3.04Å
560	Q	94.5	Very high	92.9	Very high	36 Å²	36	32.6 Å²	32.6	17%	0.168	18%	0.179	C	C	.	.	H	α-helix	trans	-56.5	-46.7	174.5	-54.6	-178.3	-8.9	0	0	111.2	A551 F554 S556 R557 F563 L564	A551-Q560 VanDerWaalsContact O-CG 3.23Å; A551-Q560 WeakPolarHBondContact O-CG 3.33Å; F554-Q560 HydrophobicContact CB-CG 3.96Å; F554-Q560 PolarHBondContact O-NE2 3.31Å; S556-Q560 WeakPolarHBondContact O-CG 3.36Å; S556-Q560 PolarHBondContact O-N 3.34Å; R557-Q560 WeakPolarHBondContact O-CB 3.35Å; R557-Q560 PolarHBondContact O-N 2.91Å; Q560-F563 PolarHBondContact O-N 3Å; Q560-L564 WeakPolarHBondContact O-CD1 3.16Å; Q560-L564 VanDerWaalsContact O-CG 3.26Å; Q560-L564 WeakPolarHBondContact O-CG 3.14Å; Q560-L564 PolarHBondContact O-N 2.63Å
561	L	94.5	Very high	92.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.9	-40.5	-179.5	-70.2	170.8	0	0	0	112.4	R557 K558 E559 F563 L564 I565 R596 E599 F600 E603	R557-L561 HydrophobicContact CG-CD1 4.11Å; R557-L561 WeakPolarHBondContact O-CG 3.41Å; R557-L561 PolarHBondContact O-N 3.3Å; K558-L561 PolarHBondContact O-N 2.77Å; E559-L561 VanDerWaalsContact C-N 3.32Å; E559-L561 PolarHBondContact O-N 3.02Å; L561-F563 VanDerWaalsContact C-N 3.34Å; L561-F563 PolarHBondContact O-N 3.03Å; L561-L564 HydrophobicContact CD2-CD1 4.47Å; L561-L564 PolarHBondContact O-N 3.27Å; L561-I565 WeakPolarHBondContact O-CB 3.43Å; L561-I565 WeakPolarHBondContact O-CD1 3.37Å; L561-I565 VanDerWaalsContact O-CG1 3.23Å; L561-I565 WeakPolarHBondContact O-CG1 3.28Å; L561-I565 PolarHBondContact O-N 3.41Å; L561-R596 HydrophobicContact CD2-CB 4.4Å; L561-E599 HydrophobicContact CD1-CB 4.39Å; L561-E599 HydrophobicContact CD1-CG 4Å; L561-E599 HydrophobicContact CD2-CB 4.17Å; L561-E599 HydrophobicContact CD2-CG 4.13Å; L561-F600 HydrophobicContact CB-CB 4.13Å; L561-F600 HydrophobicContact CB-CD2 3.87Å; L561-F600 HydrophobicContact CB-CG 4.46Å; L561-F600 HydrophobicContact CD1-CB 4.21Å; L561-E603 HydrophobicContact CD1-CB 4.29Å
562	V	93.7	Very high	92.8	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.024	18%	0.18	C	C	.	.	H	α-helix	trans	-59.9	-46.2	174.4	174.9	0	0	0	0	110.4	T504 K558 E559 I565 N566 F600 S663 F664	T504-V562 HydrophobicContact CG2-CB 4.47Å; T504-V562 HydrophobicContact CG2-CG1 4.34Å; K558-V562 VanDerWaalsContact O-CG2 3.29Å; K558-V562 WeakPolarHBondContact O-CG2 3.44Å; K558-V562 PolarHBondContact O-N 3.43Å; E559-V562 PolarHBondContact O-N 2.85Å; V562-I565 PolarHBondContact O-N 2.89Å; V562-N566 WeakPolarHBondContact CG1-ND2 3.26Å; V562-N566 WeakPolarHBondContact O-CB 3.38Å; V562-N566 PolarHBondContact O-N 3.5Å; V562-N566 PolarHBondContact O-ND2 3.4Å; V562-F600 HydrophobicContact CG2-CD2 4.18Å; V562-F600 HydrophobicContact CG2-CE2 3.45Å; V562-F600 VanDerWaalsContact CG2-CE2 3.45Å; V562-F600 HydrophobicContact CG2-CZ 3.97Å; V562-S663 VanDerWaalsContact CG1-O 3.28Å; V562-S663 WeakPolarHBondContact CG1-O 3.28Å; V562-F664 HydrophobicContact CG1-CE1 4.25Å; V562-F664 HydrophobicContact CG2-CE1 4.47Å; V562-F664 HydrophobicContact CG2-CZ 4.05Å
563	F	94.5	Very high	92.6	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.009	17%	0.17	C	C	.	.	H	α-helix	trans	-59.9	-47.6	176.9	177.2	-98.8	0	0	0	111.9	D503 H507 V547 V550 A551 F554 E559 Q560 L561 N566 N567	D503-F563 WeakPolarHBondContact O-CD2 3.26Å; H507-F563 HydrophobicContact CB-CE2 4.41Å; H507-F563 HydrophobicContact CB-CZ 4.32Å; V547-F563 HydrophobicContact CG1-CD1 4.38Å; V547-F563 HydrophobicContact CG1-CE1 3.85Å; V550-F563 HydrophobicContact CB-CE1 3.81Å; V550-F563 HydrophobicContact CB-CZ 3.85Å; V550-F563 HydrophobicContact CG1-CE1 3.69Å; V550-F563 HydrophobicContact CG1-CE2 3.99Å; V550-F563 HydrophobicContact CG1-CZ 3.36Å; A551-F563 HydrophobicContact CB-CD1 3.97Å; A551-F563 HydrophobicContact CB-CE1 4.48Å; F554-F563 HydrophobicContact CD2-CB 4.36Å; F554-F563 HydrophobicContact CD2-CG 4.47Å; F554-F563 HydrophobicContact CE2-CB 3.85Å; F554-F563 HydrophobicContact CE2-CD1 4.12Å; F554-F563 AromaticContact CE2-CD2 3.81Å; F554-F563 HydrophobicContact CE2-CD2 3.81Å; F554-F563 HydrophobicContact CE2-CE2 4.4Å; F554-F563 AromaticContact CE2-CG 3.65Å; F554-F563 HydrophobicContact CE2-CG 3.65Å; F554-F563 HydrophobicContact CZ-CB 4.31Å; F554-F563 AromaticContact CZ-CD2 3.95Å; F554-F563 HydrophobicContact CZ-CD2 3.95Å; F554-F563 HydrophobicContact CZ-CG 4.19Å; E559-F563 WeakPolarHBondContact O-CB 3.48Å; E559-F563 PolarHBondContact O-N 3.04Å; Q560-F563 PolarHBondContact O-N 3Å; L561-F563 VanDerWaalsContact C-N 3.34Å; L561-F563 PolarHBondContact O-N 3.03Å; F563-N566 PolarHBondContact O-N 3.38Å; F563-N567 WeakPolarHBondContact CD2-ND2 3.46Å; F563-N567 WeakPolarHBondContact CE2-ND2 3.15Å; F563-N567 VanDerWaalsContact CZ-ND2 3.3Å; F563-N567 WeakPolarHBondContact CZ-ND2 3.36Å; F563-N567 PolarHBondContact O-N 2.95Å; F563-N567 PolarHBondContact O-ND2 3.26Å
564	L	94.9	Very high	92.5	Very high	4 Å²	4	28.3 Å²	28.3	2%	0.021	16%	0.158	C	C	.	.	H	α-helix	trans	-58.8	-50.2	178.2	-74.5	165	0	0	0	111.9	V547 L548 A551 Q560 L561 N567 Y568 R596	V547-L564 HydrophobicContact CG1-CD2 3.63Å; L548-L564 HydrophobicContact CD2-CD2 3.9Å; A551-L564 HydrophobicContact CB-CD1 4.21Å; A551-L564 HydrophobicContact CB-CD2 4.06Å; A551-L564 HydrophobicContact CB-CG 3.91Å; Q560-L564 WeakPolarHBondContact O-CD1 3.16Å; Q560-L564 VanDerWaalsContact O-CG 3.26Å; Q560-L564 WeakPolarHBondContact O-CG 3.14Å; Q560-L564 PolarHBondContact O-N 2.63Å; L561-L564 HydrophobicContact CD2-CD1 4.47Å; L561-L564 PolarHBondContact O-N 3.27Å; L564-N567 PolarHBondContact O-N 3.4Å; L564-Y568 HydrophobicContact CB-CD2 4.38Å; L564-Y568 HydrophobicContact CB-CE2 4.03Å; L564-Y568 HydrophobicContact CD2-CE2 3.92Å; L564-Y568 WeakPolarHBondContact O-CD2 3.45Å; L564-Y568 VanDerWaalsContact O-CG 3.3Å; L564-Y568 PolarHBondContact O-N 2.9Å; L564-R596 HydrophobicContact CB-CG 4.37Å; L564-R596 HydrophobicContact CD1-CG 4.44Å
565	I	94.5	Very high	92.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.3	-46.6	-179.2	-69.1	164.8	0	0	0	110.8	L561 V562 N567 Y568 D569 L593 R596 F600 F664 N669 I673	L561-I565 WeakPolarHBondContact O-CB 3.43Å; L561-I565 WeakPolarHBondContact O-CD1 3.37Å; L561-I565 VanDerWaalsContact O-CG1 3.23Å; L561-I565 WeakPolarHBondContact O-CG1 3.28Å; L561-I565 PolarHBondContact O-N 3.41Å; V562-I565 PolarHBondContact O-N 2.89Å; I565-N567 VanDerWaalsContact C-N 3.31Å; I565-N567 PolarHBondContact O-N 3.49Å; I565-Y568 PolarHBondContact O-N 3.38Å; I565-D569 WeakPolarHBondContact O-CB 3.49Å; I565-D569 PolarHBondContact O-N 3.23Å; I565-L593 HydrophobicContact CB-CD1 4.36Å; I565-L593 HydrophobicContact CG2-CD1 3.83Å; I565-R596 HydrophobicContact CG1-CB 3.96Å; I565-F600 HydrophobicContact CD1-CB 3.59Å; I565-F600 HydrophobicContact CD1-CD1 4.35Å; I565-F600 HydrophobicContact CD1-CG 3.92Å; I565-F664 HydrophobicContact CB-CE1 3.78Å; I565-F664 HydrophobicContact CD1-CE1 4.07Å; I565-F664 HydrophobicContact CD1-CZ 4.12Å; I565-F664 HydrophobicContact CG2-CD1 3.85Å; I565-F664 HydrophobicContact CG2-CE1 3.41Å; I565-F664 VanDerWaalsContact CG2-CE1 3.41Å; I565-F664 HydrophobicContact CG2-CZ 4.36Å; I565-N669 VanDerWaalsContact CG2-ND2 3.32Å; I565-N669 WeakPolarHBondContact CG2-ND2 3.4Å; I565-I673 HydrophobicContact CG2-CD1 4.21Å
566	N	93.8	Very high	91.9	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.011	13%	0.134	C	C	.	.	H	α-helix	trans	-60.5	-40.9	179.3	-80.9	-26.5	0	0	0	111.8	T504 P506 V562 F563 M570 S663 F664	T504-N566 PolarHBondContact O-ND2 3.34Å; P506-N566 HydrophobicContact CG-CB 4.22Å; V562-N566 WeakPolarHBondContact CG1-ND2 3.26Å; V562-N566 WeakPolarHBondContact O-CB 3.38Å; V562-N566 PolarHBondContact O-N 3.5Å; V562-N566 PolarHBondContact O-ND2 3.4Å; F563-N566 PolarHBondContact O-N 3.38Å; N566-M570 WeakPolarHBondContact O-CB 3.33Å; N566-M570 PolarHBondContact O-N 3.49Å; N566-M570 VanDerWaalsContact O-N 3.14Å; N566-S663 PolarHBondContact ND2-O 2.93Å; N566-S663 VanDerWaalsContact ND2-O 3.08Å; N566-F664 VanDerWaalsContact OD1-CD1 3.28Å; N566-F664 WeakPolarHBondContact OD1-CD1 3.23Å
567	N	93.8	Very high	91.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-70.1	-45.3	178	-79.9	-85.2	0	0	0	112.3	P506 H507 T510 V547 F563 L564 I565 M570 M571	P506-N567 WeakPolarHBondContact CA-OD1 3.3Å; H507-N567 PolarHBondContact N-OD1 2.87Å; T510-N567 HydrophobicContact CG2-CB 4.28Å; T510-N567 WeakPolarHBondContact CG2-OD1 3.39Å; T510-N567 PolarHBondContact OG1-OD1 3.36Å; V547-N567 HydrophobicContact CG1-CB 4.21Å; F563-N567 WeakPolarHBondContact CD2-ND2 3.46Å; F563-N567 WeakPolarHBondContact CE2-ND2 3.15Å; F563-N567 VanDerWaalsContact CZ-ND2 3.3Å; F563-N567 WeakPolarHBondContact CZ-ND2 3.36Å; F563-N567 PolarHBondContact O-N 2.95Å; F563-N567 PolarHBondContact O-ND2 3.26Å; L564-N567 PolarHBondContact O-N 3.4Å; I565-N567 VanDerWaalsContact C-N 3.31Å; I565-N567 PolarHBondContact O-N 3.49Å; N567-M570 PolarHBondContact O-N 3.42Å; N567-M571 VanDerWaalsContact O-CG 3.32Å; N567-M571 WeakPolarHBondContact O-CG 3.37Å; N567-M571 PolarHBondContact O-N 2.88Å
568	Y	94.4	Very high	90.2	Very high	3 Å²	3	30.3 Å²	30.3	1%	0.012	15%	0.151	C	C	.	.	H	α-helix	trans	-65.2	-42.4	178.1	-64.1	-39	0	0	0	112.3	V547 L564 I565 M570 M571 L572 F589 L592 R596	V547-Y568 HydrophobicContact CG1-CE1 4.49Å; L564-Y568 HydrophobicContact CB-CD2 4.38Å; L564-Y568 HydrophobicContact CB-CE2 4.03Å; L564-Y568 HydrophobicContact CD2-CE2 3.92Å; L564-Y568 WeakPolarHBondContact O-CD2 3.45Å; L564-Y568 VanDerWaalsContact O-CG 3.3Å; L564-Y568 PolarHBondContact O-N 2.9Å; I565-Y568 PolarHBondContact O-N 3.38Å; Y568-M570 PolarHBondContact O-N 2.8Å; Y568-M571 HydrophobicContact CD1-CE 3.53Å; Y568-M571 HydrophobicContact CE1-CE 4.04Å; Y568-M571 PolarHBondContact O-N 3.33Å; Y568-L572 WeakPolarHBondContact O-CB 3.22Å; Y568-L572 PolarHBondContact O-N 3.03Å; Y568-F589 AromaticContact CD1-CD1 3.73Å; Y568-F589 HydrophobicContact CD1-CD1 3.73Å; Y568-F589 HydrophobicContact CD1-CE1 4.08Å; Y568-F589 HydrophobicContact CE1-CD1 4.15Å; Y568-F589 HydrophobicContact CE1-CE1 4.17Å; Y568-L592 HydrophobicContact CD2-CB 4.22Å; Y568-L592 HydrophobicContact CE1-CD1 4.24Å; Y568-L592 HydrophobicContact CE2-CB 4.08Å; Y568-R596 HydrophobicContact CD2-CG 4.45Å; Y568-R596 HydrophobicContact CE2-CG 4.05Å
569	D	92.5	Very high	89.1	Confident	25 Å²	25	28.2 Å²	28.2	13%	0.134	14%	0.144	C	C	.	.	H	α-helix	trans	-60.6	-44.3	176.2	-178.9	69.9	0	0	0	111.7	I565 G573 L593 N666	I565-D569 WeakPolarHBondContact O-CB 3.49Å; I565-D569 PolarHBondContact O-N 3.23Å; D569-G573 PolarHBondContact O-N 2.94Å; D569-L593 HydrophobicContact CB-CD1 4.26Å; D569-L593 HydrophobicContact CB-CD2 4.42Å; D569-N666 PolarHBondContact OD1-ND2 3.31Å; D569-N666 WeakPolarHBondContact OD2-CB 3.48Å; D569-N666 PolarHBondContact OD2-ND2 3.45Å
570	M	91.4	Very high	87.7	Confident	34 Å²	34	27.4 Å²	27.4	17%	0.167	15%	0.151	C	C	.	.	H	α-helix	trans	-66.2	-46.1	177.8	177.4	-77.5	-61.7	0	0	112	P506 T510 R511 N566 N567 Y568 L572 G573 V574	P506-M570 HydrophobicContact CB-CB 3.96Å; P506-M570 HydrophobicContact CB-CE 3.85Å; P506-M570 HydrophobicContact CB-CG 3.96Å; P506-M570 HydrophobicContact CG-CB 3.91Å; P506-M570 HydrophobicContact CG-CG 4.22Å; T510-M570 WeakPolarHBondContact OG1-CE 3.39Å; R511-M570 HydrophobicContact CB-CE 3.83Å; R511-M570 HydrophobicContact CB-SD 3.85Å; R511-M570 HydrophobicContact CG-SD 4.13Å; R511-M570 VanDerWaalsContact N-CE 3.28Å; N566-M570 WeakPolarHBondContact O-CB 3.33Å; N566-M570 PolarHBondContact O-N 3.49Å; N566-M570 VanDerWaalsContact O-N 3.14Å; N567-M570 PolarHBondContact O-N 3.42Å; Y568-M570 PolarHBondContact O-N 2.8Å; M570-L572 VanDerWaalsContact C-N 3.34Å; M570-L572 PolarHBondContact O-N 3.24Å; M570-G573 PolarHBondContact O-N 3.34Å; M570-V574 WeakPolarHBondContact O-CG2 3.46Å; M570-V574 PolarHBondContact O-N 3.45Å; M570-V574 VanDerWaalsContact O-N 3.11Å; M570-V574 HydrophobicContact SD-CG2 4.36Å
571	M	91.8	Very high	86.1	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62	-44.7	177.9	-71	-172.1	-66.8	0	0	111.2	T510 Y513 A514 V543 N567 Y568 V574 L575 F589	T510-M571 HydrophobicContact CG2-CE 4.3Å; T510-M571 HydrophobicContact CG2-SD 3.91Å; Y513-M571 HydrophobicContact CD1-CG 4.49Å; Y513-M571 HydrophobicContact CD1-SD 3.69Å; Y513-M571 HydrophobicContact CE1-SD 4.14Å; A514-M571 HydrophobicContact CB-CB 4.1Å; A514-M571 HydrophobicContact CB-CG 4.08Å; V543-M571 HydrophobicContact CG1-SD 4.05Å; N567-M571 VanDerWaalsContact O-CG 3.32Å; N567-M571 WeakPolarHBondContact O-CG 3.37Å; N567-M571 PolarHBondContact O-N 2.88Å; Y568-M571 HydrophobicContact CD1-CE 3.53Å; Y568-M571 HydrophobicContact CE1-CE 4.04Å; Y568-M571 PolarHBondContact O-N 3.33Å; M571-V574 PolarHBondContact O-N 2.92Å; M571-L575 WeakPolarHBondContact O-CB 3.48Å; M571-L575 VanDerWaalsContact O-CG 3.24Å; M571-L575 WeakPolarHBondContact O-CG 3.32Å; M571-L575 PolarHBondContact O-N 3.5Å; M571-F589 HydrophobicContact CE-CD1 4Å; M571-F589 HydrophobicContact CE-CE1 3.56Å; M571-F589 HydrophobicContact CE-CZ 4.14Å; M571-F589 HydrophobicContact SD-CE1 4.28Å; M571-F589 HydrophobicContact SD-CZ 4.27Å
572	L	90.3	Very high	84.6	Confident	11 Å²	11	37.4 Å²	37.4	6%	0.058	21%	0.206	C	C	.	.	H	α-helix	trans	-63.4	-43.1	178	-173.8	135.4	0	0	0	111.6	Y568 M570 V574 L575 M576 F589 Q590	Y568-L572 WeakPolarHBondContact O-CB 3.22Å; Y568-L572 PolarHBondContact O-N 3.03Å; M570-L572 VanDerWaalsContact C-N 3.34Å; M570-L572 PolarHBondContact O-N 3.24Å; L572-V574 VanDerWaalsContact C-N 3.33Å; L572-V574 PolarHBondContact O-N 2.8Å; L572-L575 PolarHBondContact O-N 3.34Å; L572-M576 HydrophobicContact CD2-CG 4.16Å; L572-M576 HydrophobicContact CD2-SD 3.33Å; L572-M576 WeakPolarHBondContact CD2-SD 3.44Å; L572-M576 HydrophobicContact CG-CG 4.28Å; L572-M576 HydrophobicContact CG-SD 4.03Å; L572-M576 WeakPolarHBondContact O-CB 3.35Å; L572-M576 VanDerWaalsContact O-CG 3.28Å; L572-M576 WeakPolarHBondContact O-CG 3.36Å; L572-M576 PolarHBondContact O-N 3.46Å; L572-F589 HydrophobicContact CD1-CB 4.27Å; L572-Q590 HydrophobicContact CD1-CB 3.71Å; L572-Q590 HydrophobicContact CD1-CG 4.38Å
573	G	89	Confident	83.7	Confident	34 Å²	34	38.5 Å²	38.5	35%	0.351	21%	0.213	S	C	.	.	H	α-helix	trans	-56.2	-45.1	175.1	0	0	0	0	0	112.8	D569 M570 E577	D569-G573 PolarHBondContact O-N 2.94Å; M570-G573 PolarHBondContact O-N 3.34Å; G573-E577 PolarHBondContact O-N 3.06Å
574	V	88.6	Confident	83	Confident	26 Å²	26	47 Å²	47	16%	0.158	25%	0.251	C	S	.	.	H	α-helix	trans	-70.9	-39.5	178	174.6	0	0	0	0	112.1	A514 E515 M570 M571 L572 E577	A514-V574 HydrophobicContact CB-CB 3.82Å; A514-V574 HydrophobicContact CB-CG1 3.86Å; A514-V574 HydrophobicContact CB-CG2 4.48Å; E515-V574 HydrophobicContact CG-CG1 4.08Å; M570-V574 WeakPolarHBondContact O-CG2 3.46Å; M570-V574 PolarHBondContact O-N 3.45Å; M570-V574 VanDerWaalsContact O-N 3.11Å; M570-V574 HydrophobicContact SD-CG2 4.36Å; M571-V574 PolarHBondContact O-N 2.92Å; L572-V574 VanDerWaalsContact C-N 3.33Å; L572-V574 PolarHBondContact O-N 2.8Å; V574-E577 PolarHBondContact O-N 3.38Å
575	L	86.6	Confident	82.3	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-65.8	-43	179	-71.6	170	0	0	0	111.4	M571 L572 E577 R578 A579 V586 F589	M571-L575 WeakPolarHBondContact O-CB 3.48Å; M571-L575 VanDerWaalsContact O-CG 3.24Å; M571-L575 WeakPolarHBondContact O-CG 3.32Å; M571-L575 PolarHBondContact O-N 3.5Å; L572-L575 PolarHBondContact O-N 3.34Å; L575-E577 VanDerWaalsContact C-N 3.27Å; L575-E577 PolarHBondContact O-N 2.86Å; L575-R578 PolarHBondContact O-N 2.71Å; L575-A579 WeakPolarHBondContact O-CB 3.23Å; L575-A579 PolarHBondContact O-N 3.39Å; L575-V586 HydrophobicContact CB-CG2 3.93Å; L575-F589 HydrophobicContact CD1-CD2 3.71Å; L575-F589 HydrophobicContact CD1-CE2 4.01Å
576	M	84.3	Confident	81.8	Confident	82 Å²	82	47.8 Å²	47.8	40%	0.404	26%	0.255	S	S	.	.	H	α-helix	trans	-65.8	-23.9	179.2	-72	-175.4	77.6	0	0	113.9	L572 R578 V586	L572-M576 HydrophobicContact CD2-CG 4.16Å; L572-M576 HydrophobicContact CD2-SD 3.33Å; L572-M576 WeakPolarHBondContact CD2-SD 3.44Å; L572-M576 HydrophobicContact CG-CG 4.28Å; L572-M576 HydrophobicContact CG-SD 4.03Å; L572-M576 WeakPolarHBondContact O-CB 3.35Å; L572-M576 VanDerWaalsContact O-CG 3.28Å; L572-M576 WeakPolarHBondContact O-CG 3.36Å; L572-M576 PolarHBondContact O-N 3.46Å; M576-R578 PolarHBondContact O-N 3.46Å; M576-V586 HydrophobicContact CG-CG1 4.06Å
577	E	79.5	Confident	81.5	Confident	154 Å²	154	52.4 Å²	52.4	72%	0.72	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-21.2	176.3	-78.1	-177.9	-177.3	0	0	113.4	G573 V574 L575	G573-E577 PolarHBondContact O-N 3.06Å; V574-E577 PolarHBondContact O-N 3.38Å; L575-E577 VanDerWaalsContact C-N 3.27Å; L575-E577 PolarHBondContact O-N 2.86Å
578	R	70	Confident	81.2	Confident	82 Å²	82	54.1 Å²	54.1	31%	0.309	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.4	-24.7	-167.5	-64.6	-174.3	-179.1	167.4	4.5	115.2	Q525 L575 M576	Q525-R578 PolarHBondContact NE2-O 2.98Å; L575-R578 PolarHBondContact O-N 2.71Å; M576-R578 PolarHBondContact O-N 3.46Å
579	A	66.3	Low	81	Confident	11 Å²	11	54 Å²	54	9%	0.091	29%	0.287	C	S	.	.	S	Bend	trans	-86	157	171.9	0	0	0	0	0	110.1	V521 L575 V586	V521-A579 HydrophobicContact CG1-CB 4.41Å; L575-A579 WeakPolarHBondContact O-CB 3.23Å; L575-A579 PolarHBondContact O-N 3.39Å; A579-V586 HydrophobicContact CB-CG2 4.28Å
580	A	63.1	Low	81	Confident	64 Å²	64	55.8 Å²	55.8	53%	0.529	30%	0.295	S	S	.	.			trans	-67.1	142.1	167.5	0	0	0	0	0	109.3	D582 S583	A580-D582 PolarHBondContact O-N 3.11Å; A580-S583 PolarHBondContact O-N 3.3Å; A580-S583 PolarHBondContact O-OG 3.42Å
581	D	61.6	Low	81	Confident	109 Å²	109	60.7 Å²	60.7	58%	0.583	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-27.2	-177.2	-70.4	-32.1	0	0	0	113
582	D	62.3	Low	81.1	Confident	138 Å²	138	62.6 Å²	62.6	74%	0.738	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	17.8	-177.4	-54.5	-34.8	0	0	0	114.4	A580	A580-D582 PolarHBondContact O-N 3.11Å
583	S	75.8	Confident	81.2	Confident	26 Å²	26	62.5 Å²	62.5	18%	0.182	33%	0.327	C	S	.	.			trans	-72.2	139.6	177.5	72.3	0	0	0	0	111.6	A580 E585 V586 E587	A580-S583 PolarHBondContact O-N 3.3Å; A580-S583 PolarHBondContact O-OG 3.42Å; S583-E585 PolarHBondContact O-N 3.11Å; S583-E585 VanDerWaalsContact O-N 3.12Å; S583-V586 PolarHBondContact O-N 3.32Å; S583-V586 WeakPolarHBondContact OG-CB 3.41Å; S583-V586 WeakPolarHBondContact OG-CG2 3.33Å; S583-V586 PolarHBondContact OG-N 3.09Å; S583-E587 PolarHBondContact O-N 3.01Å
584	K	79.4	Confident	81.4	Confident	182 Å²	182	65.2 Å²	65.2	79%	0.791	33%	0.333	S	S	*	.	H	α-helix	trans	-54.9	-32.9	178.4	-67.8	-175.2	178.5	-179.1	0	113.2	S588	K584-S588 WeakPolarHBondContact O-CB 3.46Å; K584-S588 PolarHBondContact O-N 2.87Å
585	E	78.9	Confident	81.7	Confident	13 Å²	13	66.7 Å²	66.7	6%	0.061	35%	0.348	C	S	.	.	H	α-helix	trans	-66.4	-47.3	177.3	-68.9	170.2	-156.7	0	0	111.1	S517 S583 S588 F589	S517-E585 PolarHBondContact OG-OE2 3.42Å; S517-E585 VanDerWaalsContact OG-OE2 3.12Å; S583-E585 PolarHBondContact O-N 3.11Å; S583-E585 VanDerWaalsContact O-N 3.12Å; E585-S588 PolarHBondContact O-N 2.98Å; E585-F589 VanDerWaalsContact O-CD2 3.3Å; E585-F589 WeakPolarHBondContact O-CD2 3.29Å; E585-F589 PolarHBondContact O-N 3.46Å; E585-F589 VanDerWaalsContact O-N 3.12Å
586	V	85.3	Confident	82.1	Confident	7 Å²	7	69.7 Å²	69.7	4%	0.042	36%	0.36	C	S	.	.	H	α-helix	trans	-62.9	-45.4	176.7	170.8	0	0	0	0	110.6	L575 M576 A579 S583 S588 F589 Q590	L575-V586 HydrophobicContact CB-CG2 3.93Å; M576-V586 HydrophobicContact CG-CG1 4.06Å; A579-V586 HydrophobicContact CB-CG2 4.28Å; S583-V586 PolarHBondContact O-N 3.32Å; S583-V586 WeakPolarHBondContact OG-CB 3.41Å; S583-V586 WeakPolarHBondContact OG-CG2 3.33Å; S583-V586 PolarHBondContact OG-N 3.09Å; V586-S588 VanDerWaalsContact C-N 3.34Å; V586-S588 PolarHBondContact O-N 2.76Å; V586-F589 PolarHBondContact O-N 3.41Å; V586-Q590 VanDerWaalsContact O-CB 3.28Å; V586-Q590 WeakPolarHBondContact O-CB 3.28Å; V586-Q590 PolarHBondContact O-N 2.91Å
587	E	87.2	Confident	82.6	Confident	98 Å²	98	66.7 Å²	66.7	46%	0.458	35%	0.346	S	S	.	.	H	α-helix	trans	-59	-43.7	176.4	-70.1	-176.2	166.4	0	0	112.3	S583 Q590 Q591	S583-E587 PolarHBondContact O-N 3.01Å; E587-Q590 PolarHBondContact O-N 2.98Å; E587-Q591 WeakPolarHBondContact O-CG 3.2Å; E587-Q591 PolarHBondContact O-N 3.02Å
588	S	87.9	Confident	83.2	Confident	36 Å²	36	63.2 Å²	63.2	25%	0.252	33%	0.329	S	S	.	.	H	α-helix	trans	-59.6	-52.7	178.3	-172.9	0	0	0	0	111.6	Q540 K584 E585 V586 Q590 Q591 L592	Q540-S588 PolarHBondContact NE2-OG 2.87Å; K584-S588 WeakPolarHBondContact O-CB 3.46Å; K584-S588 PolarHBondContact O-N 2.87Å; E585-S588 PolarHBondContact O-N 2.98Å; V586-S588 VanDerWaalsContact C-N 3.34Å; V586-S588 PolarHBondContact O-N 2.76Å; S588-Q590 VanDerWaalsContact C-N 3.31Å; S588-Q590 PolarHBondContact O-N 2.88Å; S588-Q591 PolarHBondContact O-N 3.42Å; S588-L592 WeakPolarHBondContact O-CG 3.28Å; S588-L592 PolarHBondContact O-N 3.38Å
589	F	90.2	Very high	84.4	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-66.6	-32.5	179.1	-75.1	-61.5	0	0	0	112.7	Y513 Q540 E544 Y568 M571 L572 L575 E585 V586 L592 L593	Y513-F589 AromaticContact CE1-CE2 3.74Å; Y513-F589 HydrophobicContact CE1-CE2 3.74Å; Y513-F589 AromaticContact CE1-CZ 3.75Å; Y513-F589 HydrophobicContact CE1-CZ 3.75Å; Q540-F589 HydrophobicContact CG-CE2 4.1Å; Q540-F589 HydrophobicContact CG-CZ 3.96Å; E544-F589 HydrophobicContact CG-CE1 3.89Å; E544-F589 HydrophobicContact CG-CZ 4.21Å; Y568-F589 AromaticContact CD1-CD1 3.73Å; Y568-F589 HydrophobicContact CD1-CD1 3.73Å; Y568-F589 HydrophobicContact CD1-CE1 4.08Å; Y568-F589 HydrophobicContact CE1-CD1 4.15Å; Y568-F589 HydrophobicContact CE1-CE1 4.17Å; M571-F589 HydrophobicContact CE-CD1 4Å; M571-F589 HydrophobicContact CE-CE1 3.56Å; M571-F589 HydrophobicContact CE-CZ 4.14Å; M571-F589 HydrophobicContact SD-CE1 4.28Å; M571-F589 HydrophobicContact SD-CZ 4.27Å; L572-F589 HydrophobicContact CD1-CB 4.27Å; L575-F589 HydrophobicContact CD1-CD2 3.71Å; L575-F589 HydrophobicContact CD1-CE2 4.01Å; E585-F589 VanDerWaalsContact O-CD2 3.3Å; E585-F589 WeakPolarHBondContact O-CD2 3.29Å; E585-F589 PolarHBondContact O-N 3.46Å; E585-F589 VanDerWaalsContact O-N 3.12Å; V586-F589 PolarHBondContact O-N 3.41Å; F589-L592 HydrophobicContact CD1-CD1 4.18Å; F589-L592 PolarHBondContact O-N 3.07Å; F589-L593 VanDerWaalsContact O-CB 3.26Å; F589-L593 WeakPolarHBondContact O-CB 3.47Å; F589-L593 PolarHBondContact O-N 3.4Å
590	Q	91.6	Very high	85.7	Confident	64 Å²	64	61.5 Å²	61.5	30%	0.299	32%	0.323	S	S	.	.	H	α-helix	trans	-64.1	-42.6	175	-172	61.1	71	0	0	111.7	L572 V586 E587 S588 L593 N594	L572-Q590 HydrophobicContact CD1-CB 3.71Å; L572-Q590 HydrophobicContact CD1-CG 4.38Å; V586-Q590 VanDerWaalsContact O-CB 3.28Å; V586-Q590 WeakPolarHBondContact O-CB 3.28Å; V586-Q590 PolarHBondContact O-N 2.91Å; E587-Q590 PolarHBondContact O-N 2.98Å; S588-Q590 VanDerWaalsContact C-N 3.31Å; S588-Q590 PolarHBondContact O-N 2.88Å; Q590-L593 PolarHBondContact O-N 3.31Å; Q590-N594 PolarHBondContact NE2-OD1 3.4Å; Q590-N594 WeakPolarHBondContact O-CB 3.32Å; Q590-N594 PolarHBondContact O-N 3.45Å; Q590-N594 PolarHBondContact O-ND2 3.49Å
591	Q	92.3	Very high	87.2	Confident	136 Å²	136	58.6 Å²	58.6	64%	0.636	30%	0.299	S	S	*	.	H	α-helix	trans	-64.5	-44.6	175.6	-71.1	175.8	16.3	0	0	111.5	E587 S588 N594 A595	E587-Q591 WeakPolarHBondContact O-CG 3.2Å; E587-Q591 PolarHBondContact O-N 3.02Å; S588-Q591 PolarHBondContact O-N 3.42Å; Q591-N594 PolarHBondContact O-N 3.1Å; Q591-A595 WeakPolarHBondContact O-CB 3.34Å; Q591-A595 PolarHBondContact O-N 3.04Å
592	L	92.6	Very high	88.5	Confident	41 Å²	41	57.9 Å²	57.9	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-61.1	-45.4	176.4	-70.3	172.9	0	0	0	111.8	E544 Y568 S588 F589 A595 R596	E544-L592 HydrophobicContact CG-CD1 4.35Å; Y568-L592 HydrophobicContact CD2-CB 4.22Å; Y568-L592 HydrophobicContact CE1-CD1 4.24Å; Y568-L592 HydrophobicContact CE2-CB 4.08Å; S588-L592 WeakPolarHBondContact O-CG 3.28Å; S588-L592 PolarHBondContact O-N 3.38Å; F589-L592 HydrophobicContact CD1-CD1 4.18Å; F589-L592 PolarHBondContact O-N 3.07Å; L592-A595 PolarHBondContact O-N 3.34Å; L592-R596 WeakPolarHBondContact O-CG 3.31Å; L592-R596 PolarHBondContact O-N 2.96Å
593	L	93.3	Very high	90	Very high	9 Å²	9	54.9 Å²	54.9	5%	0.047	27%	0.274	C	S	.	.	H	α-helix	trans	-60.5	-46.6	177	178.1	60.8	0	0	0	111.4	I565 D569 F589 Q590 R596 T597	I565-L593 HydrophobicContact CB-CD1 4.36Å; I565-L593 HydrophobicContact CG2-CD1 3.83Å; D569-L593 HydrophobicContact CB-CD1 4.26Å; D569-L593 HydrophobicContact CB-CD2 4.42Å; F589-L593 VanDerWaalsContact O-CB 3.26Å; F589-L593 WeakPolarHBondContact O-CB 3.47Å; F589-L593 PolarHBondContact O-N 3.4Å; Q590-L593 PolarHBondContact O-N 3.31Å; L593-R596 PolarHBondContact O-N 2.81Å; L593-T597 VanDerWaalsContact O-CB 3.22Å; L593-T597 WeakPolarHBondContact O-CB 3.2Å; L593-T597 PolarHBondContact O-N 2.88Å; L593-T597 PolarHBondContact O-OG1 2.94Å
594	N	93.6	Very high	90.6	Very high	90 Å²	90	54.4 Å²	54.4	48%	0.481	27%	0.269	S	S	.	.	H	α-helix	trans	-63.8	-44.2	179.7	-71.6	-14	0	0	0	111.6	Q590 Q591 T597 Q598	Q590-N594 PolarHBondContact NE2-OD1 3.4Å; Q590-N594 WeakPolarHBondContact O-CB 3.32Å; Q590-N594 PolarHBondContact O-N 3.45Å; Q590-N594 PolarHBondContact O-ND2 3.49Å; Q591-N594 PolarHBondContact O-N 3.1Å; N594-T597 PolarHBondContact O-N 3.24Å; N594-Q598 PolarHBondContact O-N 2.93Å
595	A	94.7	Very high	91.1	Very high	57 Å²	57	46.1 Å²	46.1	47%	0.471	23%	0.233	S	C	.	.	H	α-helix	trans	-62.2	-45.8	178.5	0	0	0	0	0	112	Q591 L592 Q598 E599	Q591-A595 WeakPolarHBondContact O-CB 3.34Å; Q591-A595 PolarHBondContact O-N 3.04Å; L592-A595 PolarHBondContact O-N 3.34Å; A595-Q598 PolarHBondContact O-N 2.94Å; A595-E599 PolarHBondContact O-N 3.14Å; A595-E599 VanDerWaalsContact O-N 3.09Å
596	R	94.8	Very high	91.7	Very high	65 Å²	65	48.5 Å²	48.5	25%	0.245	25%	0.251	C	S	.	.	H	α-helix	trans	-71.3	-33.9	178.5	-61.8	-54.2	171.1	-167.4	-4.5	112.9	L561 L564 I565 Y568 L592 L593 E599 F600	L561-R596 HydrophobicContact CD2-CB 4.4Å; L564-R596 HydrophobicContact CB-CG 4.37Å; L564-R596 HydrophobicContact CD1-CG 4.44Å; I565-R596 HydrophobicContact CG1-CB 3.96Å; Y568-R596 HydrophobicContact CD2-CG 4.45Å; Y568-R596 HydrophobicContact CE2-CG 4.05Å; L592-R596 WeakPolarHBondContact O-CG 3.31Å; L592-R596 PolarHBondContact O-N 2.96Å; L593-R596 PolarHBondContact O-N 2.81Å; R596-E599 IonicContact CZ-OE2 2.63Å; R596-E599 IonicContact NH1-OE2 3.25Å; R596-E599 PolarHBondContact NH1-OE2 3.08Å; R596-E599 PolarHBondContact O-N 3.42Å; R596-F600 WeakPolarHBondContact O-CB 3.38Å; R596-F600 PolarHBondContact O-N 2.82Å
597	T	93.9	Very high	91.8	Very high	18 Å²	18	53.4 Å²	53.4	11%	0.11	28%	0.283	C	S	.	.	H	α-helix	trans	-61	-46.2	172.6	-65.1	0	0	0	0	111.2	L593 N594 E599 F600 I601 I673	L593-T597 VanDerWaalsContact O-CB 3.22Å; L593-T597 WeakPolarHBondContact O-CB 3.2Å; L593-T597 PolarHBondContact O-N 2.88Å; L593-T597 PolarHBondContact O-OG1 2.94Å; N594-T597 PolarHBondContact O-N 3.24Å; T597-E599 PolarHBondContact O-N 3.39Å; T597-F600 PolarHBondContact O-N 3.33Å; T597-I601 HydrophobicContact CG2-CD1 3.99Å; T597-I601 VanDerWaalsContact O-CG1 3.31Å; T597-I601 WeakPolarHBondContact O-CG1 3.09Å; T597-I601 PolarHBondContact O-N 3.03Å; T597-I673 HydrophobicContact CG2-CG1 3.86Å
598	Q	93.8	Very high	91.8	Very high	81 Å²	81	51 Å²	51	38%	0.379	28%	0.276	S	S	.	.	H	α-helix	trans	-62.9	-43.3	177.6	-176.8	55.3	36.3	0	0	111.7	N594 A595 F600 I601 E602	N594-Q598 PolarHBondContact O-N 2.93Å; A595-Q598 PolarHBondContact O-N 2.94Å; Q598-F600 VanDerWaalsContact C-N 3.33Å; Q598-F600 PolarHBondContact O-N 3.29Å; Q598-I601 PolarHBondContact O-N 3.16Å; Q598-E602 PolarHBondContact NE2-OE1 3.27Å; Q598-E602 PolarHBondContact O-N 3.28Å; Q598-E602 VanDerWaalsContact O-N 3.16Å
599	E	94.1	Very high	91.9	Very high	57 Å²	57	49.6 Å²	49.6	27%	0.266	27%	0.265	S	S	.	.	H	α-helix	trans	-61.5	-41.4	175.7	-166.8	-177.3	169	0	0	112.1	R557 L561 A595 R596 T597 E602 E603	R557-E599 IonicContact CZ-OE1 3.36Å; R557-E599 IonicContact NE-OE1 2.74Å; R557-E599 PolarHBondContact NE-OE1 3.49Å; R557-E599 VanDerWaalsContact NH2-CD 3.35Å; R557-E599 IonicContact NH2-OE1 3.41Å; R557-E599 PolarHBondContact NH2-OE1 2.84Å; R557-E599 IonicContact NH2-OE2 3.08Å; R557-E599 PolarHBondContact NH2-OE2 3.3Å; L561-E599 HydrophobicContact CD1-CB 4.39Å; L561-E599 HydrophobicContact CD1-CG 4Å; L561-E599 HydrophobicContact CD2-CB 4.17Å; L561-E599 HydrophobicContact CD2-CG 4.13Å; A595-E599 PolarHBondContact O-N 3.14Å; A595-E599 VanDerWaalsContact O-N 3.09Å; R596-E599 IonicContact CZ-OE2 2.63Å; R596-E599 IonicContact NH1-OE2 3.25Å; R596-E599 PolarHBondContact NH1-OE2 3.08Å; R596-E599 PolarHBondContact O-N 3.42Å; T597-E599 PolarHBondContact O-N 3.39Å; E599-E602 PolarHBondContact O-N 3.44Å; E599-E603 PolarHBondContact O-N 3.18Å
600	F	94.5	Very high	91.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.8	-40.4	176.7	178.7	-100.5	0	0	0	112.4	K558 L561 V562 I565 R596 T597 Q598 E602 E603 L604 V660 F664 I673	K558-F600 HydrophobicContact CG-CD2 4.5Å; K558-F600 HydrophobicContact CG-CE2 3.75Å; L561-F600 HydrophobicContact CB-CB 4.13Å; L561-F600 HydrophobicContact CB-CD2 3.87Å; L561-F600 HydrophobicContact CB-CG 4.46Å; L561-F600 HydrophobicContact CD1-CB 4.21Å; V562-F600 HydrophobicContact CG2-CD2 4.18Å; V562-F600 HydrophobicContact CG2-CE2 3.45Å; V562-F600 VanDerWaalsContact CG2-CE2 3.45Å; V562-F600 HydrophobicContact CG2-CZ 3.97Å; I565-F600 HydrophobicContact CD1-CB 3.59Å; I565-F600 HydrophobicContact CD1-CD1 4.35Å; I565-F600 HydrophobicContact CD1-CG 3.92Å; R596-F600 WeakPolarHBondContact O-CB 3.38Å; R596-F600 PolarHBondContact O-N 2.82Å; T597-F600 PolarHBondContact O-N 3.33Å; Q598-F600 VanDerWaalsContact C-N 3.33Å; Q598-F600 PolarHBondContact O-N 3.29Å; F600-E602 VanDerWaalsContact C-N 3.28Å; F600-E602 PolarHBondContact O-N 2.84Å; F600-E603 PolarHBondContact O-N 3.05Å; F600-L604 HydrophobicContact CE1-CD2 3.93Å; F600-L604 HydrophobicContact CZ-CD1 4.33Å; F600-L604 HydrophobicContact CZ-CD2 4.47Å; F600-L604 WeakPolarHBondContact O-CB 3.15Å; F600-L604 PolarHBondContact O-N 3.31Å; F600-V660 HydrophobicContact CE1-CG2 4.27Å; F600-F664 HydrophobicContact CD1-CE2 4.24Å; F600-F664 AromaticContact CD1-CZ 3.93Å; F600-F664 HydrophobicContact CD1-CZ 3.93Å; F600-F664 AromaticContact CE1-CE2 3.51Å; F600-F664 HydrophobicContact CE1-CE2 3.51Å; F600-F664 AromaticContact CE1-CZ 3.58Å; F600-F664 HydrophobicContact CE1-CZ 3.58Å; F600-F664 HydrophobicContact CE2-CZ 4.27Å; F600-F664 HydrophobicContact CG-CZ 4.42Å; F600-F664 AromaticContact CZ-CE2 3.75Å; F600-F664 HydrophobicContact CZ-CE2 3.75Å; F600-F664 AromaticContact CZ-CZ 3.77Å; F600-F664 HydrophobicContact CZ-CZ 3.77Å; F600-I673 HydrophobicContact CD1-CG2 3.83Å; F600-I673 HydrophobicContact CE1-CG2 3.87Å
601	I	92.7	Very high	91.8	Very high	4 Å²	4	49.4 Å²	49.4	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-60.4	-41.6	175.8	-70.1	164.6	0	0	0	110.6	T597 Q598 L604 L605 I673 A677 Q680	T597-I601 HydrophobicContact CG2-CD1 3.99Å; T597-I601 VanDerWaalsContact O-CG1 3.31Å; T597-I601 WeakPolarHBondContact O-CG1 3.09Å; T597-I601 PolarHBondContact O-N 3.03Å; Q598-I601 PolarHBondContact O-N 3.16Å; I601-L604 PolarHBondContact O-N 3.46Å; I601-L605 HydrophobicContact CG2-CD1 3.88Å; I601-L605 HydrophobicContact CG2-CG 4.42Å; I601-L605 WeakPolarHBondContact O-CB 3.39Å; I601-L605 VanDerWaalsContact O-CG 3.3Å; I601-L605 WeakPolarHBondContact O-CG 3.44Å; I601-L605 PolarHBondContact O-N 2.95Å; I601-I673 HydrophobicContact CG1-CG2 4.16Å; I601-A677 HydrophobicContact CG1-CB 4.39Å; I601-A677 VanDerWaalsContact CG2-CA 3.5Å; I601-A677 HydrophobicContact CG2-CB 3.86Å; I601-Q680 HydrophobicContact CG2-CB 4.36Å
602	E	90.8	Very high	91.7	Very high	93 Å²	93	43.1 Å²	43.1	44%	0.435	25%	0.252	S	S	.	.	H	α-helix	trans	-64.5	-46.1	177.2	-72.2	-179.3	-163.6	0	0	112.1	Q598 E599 F600 L604 L605 S606	Q598-E602 PolarHBondContact NE2-OE1 3.27Å; Q598-E602 PolarHBondContact O-N 3.28Å; Q598-E602 VanDerWaalsContact O-N 3.16Å; E599-E602 PolarHBondContact O-N 3.44Å; F600-E602 VanDerWaalsContact C-N 3.28Å; F600-E602 PolarHBondContact O-N 2.84Å; E602-L604 VanDerWaalsContact C-N 3.3Å; E602-L604 PolarHBondContact O-N 2.55Å; E602-L605 PolarHBondContact O-N 2.75Å; E602-S606 WeakPolarHBondContact O-CB 3.36Å; E602-S606 PolarHBondContact O-N 2.93Å
603	E	92	Very high	91.6	Very high	76 Å²	76	42.8 Å²	42.8	36%	0.355	25%	0.251	S	S	.	.	H	α-helix	trans	-62.6	-37.6	176.4	-172.8	63.2	-169.4	0	0	111.8	L561 E599 F600 S606 P607	L561-E603 HydrophobicContact CD1-CB 4.29Å; E599-E603 PolarHBondContact O-N 3.18Å; F600-E603 PolarHBondContact O-N 3.05Å; E603-S606 PolarHBondContact O-N 2.75Å; E603-P607 WeakPolarHBondContact O-CD 3.32Å
604	L	89.9	Confident	91.5	Very high	16 Å²	16	44 Å²	44	8%	0.084	26%	0.263	C	S	.	.	H	α-helix	trans	-70.2	-36.2	179.4	-173.4	68.8	0	0	0	112.7	F600 I601 E602 L656 V660	F600-L604 HydrophobicContact CE1-CD2 3.93Å; F600-L604 HydrophobicContact CZ-CD1 4.33Å; F600-L604 HydrophobicContact CZ-CD2 4.47Å; F600-L604 WeakPolarHBondContact O-CB 3.15Å; F600-L604 PolarHBondContact O-N 3.31Å; I601-L604 PolarHBondContact O-N 3.46Å; E602-L604 VanDerWaalsContact C-N 3.3Å; E602-L604 PolarHBondContact O-N 2.55Å; L604-L656 HydrophobicContact CD1-CD1 4.46Å; L604-L656 HydrophobicContact CD1-CG 4.05Å; L604-L656 HydrophobicContact CD2-CD1 3.76Å; L604-L656 HydrophobicContact CD2-CD2 3.56Å; L604-L656 HydrophobicContact CD2-CG 3.46Å; L604-L656 VanDerWaalsContact CD2-CG 3.46Å; L604-L656 HydrophobicContact CG-CD1 3.61Å; L604-L656 HydrophobicContact CG-CD2 4.26Å; L604-L656 HydrophobicContact CG-CG 3.57Å; L604-V660 HydrophobicContact CD2-CG2 3.52Å
605	L	90.1	Very high	91.4	Very high	8 Å²	8	39.9 Å²	39.9	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-81.9	-18.1	177.2	-67.2	174.2	0	0	0	112.9	I601 E602 P608 F609 G610 L656 A677 Q680 L681	I601-L605 HydrophobicContact CG2-CD1 3.88Å; I601-L605 HydrophobicContact CG2-CG 4.42Å; I601-L605 WeakPolarHBondContact O-CB 3.39Å; I601-L605 VanDerWaalsContact O-CG 3.3Å; I601-L605 WeakPolarHBondContact O-CG 3.44Å; I601-L605 PolarHBondContact O-N 2.95Å; E602-L605 PolarHBondContact O-N 2.75Å; L605-P608 WeakPolarHBondContact O-CD 3.25Å; L605-F609 HydrophobicContact CB-CD2 4.44Å; L605-F609 HydrophobicContact CD2-CD2 3.68Å; L605-F609 HydrophobicContact CD2-CE2 4.02Å; L605-F609 CarbonylContact O-C 3.57Å; L605-F609 WeakPolarHBondContact O-CA 3.47Å; L605-F609 WeakPolarHBondContact O-CB 3.2Å; L605-F609 PolarHBondContact O-N 3.13Å; L605-G610 PolarHBondContact O-N 3.03Å; L605-L656 HydrophobicContact CD2-CD1 3.78Å; L605-A677 HydrophobicContact CD2-CB 4.47Å; L605-Q680 HydrophobicContact CD1-CB 4.05Å; L605-Q680 HydrophobicContact CD1-CG 4.02Å; L605-L681 HydrophobicContact CD2-CB 4.39Å
606	S	89.9	Confident	91.3	Very high	62 Å²	62	37.2 Å²	37.2	43%	0.434	22%	0.218	S	C	.	.	H	α-helix	trans	-62.6	-48.2	-175.1	179.4	0	0	0	0	114.1	E602 E603 G610	E602-S606 WeakPolarHBondContact O-CB 3.36Å; E602-S606 PolarHBondContact O-N 2.93Å; E603-S606 PolarHBondContact O-N 2.75Å; S606-G610 WeakPolarHBondContact O-CA 3.39Å; S606-G610 PolarHBondContact O-N 3.05Å
607	P	88.1	Confident	91.1	Very high	111 Å²	111	39.9 Å²	39.9	72%	0.721	23%	0.232	S	C	*	.	H	α-helix	trans	-62.5	-48.8	179.1	-17.3	26.3	0	0	0	114.4	E603	E603-P607 WeakPolarHBondContact O-CD 3.32Å
608	P	87.3	Confident	91	Very high	48 Å²	48	43.3 Å²	43.3	31%	0.312	25%	0.246	S	C	.	.	H	α-helix	trans	-81.7	-28	-178.7	29.2	-32.9	0	0	0	114.1	L605	L605-P608 WeakPolarHBondContact O-CD 3.25Å
609	F	90.7	Very high	90.7	Very high	5 Å²	5	39.5 Å²	39.5	2%	0.022	23%	0.229	C	C	.	.	H	α-helix	trans	-128.6	2.4	-170.1	-51.5	-64.7	0	0	0	114.5	L605 G611 L612 V613 F645 W649 V653 L681	L605-F609 HydrophobicContact CB-CD2 4.44Å; L605-F609 HydrophobicContact CD2-CD2 3.68Å; L605-F609 HydrophobicContact CD2-CE2 4.02Å; L605-F609 CarbonylContact O-C 3.57Å; L605-F609 WeakPolarHBondContact O-CA 3.47Å; L605-F609 WeakPolarHBondContact O-CB 3.2Å; L605-F609 PolarHBondContact O-N 3.13Å; F609-G611 VanDerWaalsContact C-N 3.3Å; F609-G611 PolarHBondContact O-N 3.35Å; F609-L612 WeakPolarHBondContact O-CA 3.36Å; F609-L612 VanDerWaalsContact O-CB 3.3Å; F609-L612 WeakPolarHBondContact O-CB 3.32Å; F609-L612 PolarHBondContact O-N 3.08Å; F609-V613 WeakPolarHBondContact O-CG2 3.37Å; F609-V613 PolarHBondContact O-N 3.36Å; F609-F645 AromaticContact CD1-CD2 3.84Å; F609-F645 HydrophobicContact CD1-CD2 3.84Å; F609-F645 AromaticContact CD1-CE2 3.83Å; F609-F645 HydrophobicContact CD1-CE2 3.83Å; F609-F645 AromaticContact CE1-CD2 3.79Å; F609-F645 HydrophobicContact CE1-CD2 3.79Å; F609-F645 AromaticContact CE1-CE2 3.58Å; F609-F645 HydrophobicContact CE1-CE2 3.58Å; F609-W649 HydrophobicContact CE1-CB 4.13Å; F609-W649 HydrophobicContact CZ-CB 4.49Å; F609-V653 HydrophobicContact CZ-CG2 4.21Å; F609-L681 HydrophobicContact CB-CD1 4.31Å; F609-L681 HydrophobicContact CD1-CD1 3.97Å; F609-L681 HydrophobicContact CD2-CD1 3.73Å; F609-L681 HydrophobicContact CD2-CD2 4.45Å; F609-L681 HydrophobicContact CE1-CD1 4.2Å; F609-L681 HydrophobicContact CE2-CD1 3.97Å; F609-L681 HydrophobicContact CE2-CD2 3.87Å; F609-L681 HydrophobicContact CG-CD1 3.73Å; F609-L681 HydrophobicContact CZ-CD1 4.2Å; F609-L681 HydrophobicContact CZ-CD2 3.91Å
610	G	89.2	Confident	90.6	Very high	19 Å²	19	38.9 Å²	38.9	20%	0.196	23%	0.226	C	C	.	.	H	α-helix	trans	-58.8	-37.3	-176.1	0	0	0	0	0	113.7	L605 S606 L612 V613 A614	L605-G610 PolarHBondContact O-N 3.03Å; S606-G610 WeakPolarHBondContact O-CA 3.39Å; S606-G610 PolarHBondContact O-N 3.05Å; G610-L612 VanDerWaalsContact C-N 3.3Å; G610-L612 PolarHBondContact O-N 3.35Å; G610-V613 PolarHBondContact O-N 2.96Å; G610-A614 WeakPolarHBondContact O-CB 3.3Å; G610-A614 PolarHBondContact O-N 3.41Å
611	G	88.8	Confident	90.4	Very high	41 Å²	41	40.3 Å²	40.3	42%	0.423	24%	0.238	S	C	.	.	H	α-helix	trans	-62	-36.3	174.3	0	0	0	0	0	113.4	F609 F615	F609-G611 VanDerWaalsContact C-N 3.3Å; F609-G611 PolarHBondContact O-N 3.35Å; G611-F615 WeakPolarHBondContact O-CB 3.4Å; G611-F615 PolarHBondContact O-N 3.03Å; G611-F615 VanDerWaalsContact O-N 3.15Å
612	L	90.1	Very high	90.2	Very high	5 Å²	5	41.9 Å²	41.9	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-69.7	-46.5	175.1	-175.5	73.2	0	0	0	110.6	F609 G610 F615 V616 F645 V684 Y685 F688	F609-L612 WeakPolarHBondContact O-CA 3.36Å; F609-L612 VanDerWaalsContact O-CB 3.3Å; F609-L612 WeakPolarHBondContact O-CB 3.32Å; F609-L612 PolarHBondContact O-N 3.08Å; G610-L612 VanDerWaalsContact C-N 3.3Å; G610-L612 PolarHBondContact O-N 3.35Å; L612-F615 PolarHBondContact O-N 2.89Å; L612-V616 VanDerWaalsContact O-CG2 3.3Å; L612-V616 WeakPolarHBondContact O-CG2 3.45Å; L612-V616 PolarHBondContact O-N 2.74Å; L612-F645 HydrophobicContact CD2-CD2 4.15Å; L612-F645 HydrophobicContact CD2-CE2 4.32Å; L612-V684 HydrophobicContact CD2-CG1 4.02Å; L612-V684 HydrophobicContact CG-CG1 4.15Å; L612-Y685 HydrophobicContact CD2-CD2 4.39Å; L612-F688 HydrophobicContact CD1-CB 4.22Å; L612-F688 HydrophobicContact CD1-CD1 3.7Å; L612-F688 HydrophobicContact CD1-CD2 3.59Å; L612-F688 HydrophobicContact CD1-CE1 3.8Å; L612-F688 HydrophobicContact CD1-CE2 3.71Å; L612-F688 HydrophobicContact CD1-CG 3.58Å; L612-F688 HydrophobicContact CD1-CZ 3.8Å
613	V	90.6	Very high	89.9	Confident	33 Å²	33	39.7 Å²	39.7	20%	0.2	24%	0.237	C	C	.	.	H	α-helix	trans	-61.3	-46.2	179.1	178.6	0	0	0	0	111.1	F609 G610 V616 K617 V684	F609-V613 WeakPolarHBondContact O-CG2 3.37Å; F609-V613 PolarHBondContact O-N 3.36Å; G610-V613 PolarHBondContact O-N 2.96Å; V613-V616 PolarHBondContact O-N 2.89Å; V613-K617 HydrophobicContact CG1-CD 4.3Å; V613-K617 WeakPolarHBondContact O-CG 3.32Å; V613-K617 PolarHBondContact O-N 3.41Å; V613-V684 HydrophobicContact CG2-CG1 3.93Å; V613-V684 HydrophobicContact CG2-CG2 4.15Å
614	A	91.4	Very high	89.8	Confident	36 Å²	36	44 Å²	44	30%	0.298	26%	0.257	S	S	.	.	H	α-helix	trans	-61.7	-47.6	178.8	0	0	0	0	0	111.4	G610 V616 K617 E618	G610-A614 WeakPolarHBondContact O-CB 3.3Å; G610-A614 PolarHBondContact O-N 3.41Å; A614-V616 PolarHBondContact O-N 3.31Å; A614-K617 PolarHBondContact O-N 3.42Å; A614-E618 WeakPolarHBondContact O-CB 3.46Å; A614-E618 VanDerWaalsContact O-CG 3.3Å; A614-E618 WeakPolarHBondContact O-CG 3.38Å; A614-E618 PolarHBondContact O-N 3.44Å
615	F	92.4	Very high	89.9	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.009	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-44.9	177.1	173.4	-95.7	0	0	0	112.3	G611 L612 K617 E618 A619 E634 V638 L641 F688 V691 L697	G611-F615 WeakPolarHBondContact O-CB 3.4Å; G611-F615 PolarHBondContact O-N 3.03Å; G611-F615 VanDerWaalsContact O-N 3.15Å; L612-F615 PolarHBondContact O-N 2.89Å; F615-K617 PolarHBondContact O-N 3.29Å; F615-E618 PolarHBondContact O-N 3.36Å; F615-A619 HydrophobicContact CE1-CB 4.29Å; F615-A619 HydrophobicContact CE2-CB 4.46Å; F615-A619 HydrophobicContact CZ-CB 4.15Å; F615-A619 WeakPolarHBondContact O-CB 3.47Å; F615-A619 PolarHBondContact O-N 3.35Å; F615-E634 HydrophobicContact CE2-CB 4.02Å; F615-E634 HydrophobicContact CE2-CG 4.46Å; F615-V638 HydrophobicContact CD2-CG2 4.33Å; F615-V638 HydrophobicContact CE1-CG2 3.91Å; F615-V638 HydrophobicContact CE2-CG2 3.49Å; F615-V638 VanDerWaalsContact CE2-CG2 3.49Å; F615-V638 HydrophobicContact CZ-CG2 3.24Å; F615-L641 HydrophobicContact CB-CD1 3.59Å; F615-L641 HydrophobicContact CD1-CD1 4.22Å; F615-L641 HydrophobicContact CD2-CD1 4.44Å; F615-L641 HydrophobicContact CG-CD1 3.81Å; F615-F688 AromaticContact CD1-CD2 3.72Å; F615-F688 HydrophobicContact CD1-CD2 3.72Å; F615-F688 AromaticContact CD1-CE2 3.48Å; F615-F688 HydrophobicContact CD1-CE2 3.48Å; F615-F688 VanDerWaalsContact CD1-CE2 3.48Å; F615-F688 AromaticContact CE1-CD2 3.85Å; F615-F688 HydrophobicContact CE1-CD2 3.85Å; F615-F688 AromaticContact CE1-CE2 3.53Å; F615-F688 HydrophobicContact CE1-CE2 3.53Å; F615-V691 HydrophobicContact CE1-CG1 3.9Å; F615-V691 HydrophobicContact CZ-CG1 4.18Å; F615-L697 HydrophobicContact CZ-CD1 4.16Å
616	V	91.5	Very high	89.6	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.006	32%	0.319	C	S	.	.	H	α-helix	trans	-59.9	-47.3	177.6	171.5	0	0	0	0	110.8	L612 V613 A614 A619 E620 V684 R687 F688	L612-V616 VanDerWaalsContact O-CG2 3.3Å; L612-V616 WeakPolarHBondContact O-CG2 3.45Å; L612-V616 PolarHBondContact O-N 2.74Å; V613-V616 PolarHBondContact O-N 2.89Å; A614-V616 PolarHBondContact O-N 3.31Å; V616-A619 PolarHBondContact O-N 3.42Å; V616-E620 HydrophobicContact CG1-CG 4.31Å; V616-E620 WeakPolarHBondContact O-CB 3.42Å; V616-E620 VanDerWaalsContact O-CG 3.26Å; V616-E620 WeakPolarHBondContact O-CG 3.43Å; V616-E620 PolarHBondContact O-N 3.01Å; V616-V684 HydrophobicContact CG2-CG1 4.41Å; V616-R687 HydrophobicContact CG1-CB 3.64Å; V616-F688 HydrophobicContact CG2-CB 3.61Å; V616-F688 HydrophobicContact CG2-CD2 3.81Å; V616-F688 HydrophobicContact CG2-CG 4.18Å
617	K	91.3	Very high	89.4	Confident	121 Å²	121	55.7 Å²	55.7	53%	0.526	31%	0.314	S	S	.	.	H	α-helix	trans	-61.9	-46	178.4	-73.8	-178.4	178.1	-178.5	0	112.2	V613 A614 F615 A621	V613-K617 HydrophobicContact CG1-CD 4.3Å; V613-K617 WeakPolarHBondContact O-CG 3.32Å; V613-K617 PolarHBondContact O-N 3.41Å; A614-K617 PolarHBondContact O-N 3.42Å; F615-K617 PolarHBondContact O-N 3.29Å; K617-A621 WeakPolarHBondContact O-CB 3.31Å; K617-A621 PolarHBondContact O-N 3.41Å
618	E	90.9	Very high	89.1	Confident	90 Å²	90	51.2 Å²	51.2	42%	0.421	29%	0.287	S	S	.	.	H	α-helix	trans	-62.9	-44.6	178	-74.2	165.9	-155.5	0	0	111.6	A614 F615 A621 L622 R637	A614-E618 WeakPolarHBondContact O-CB 3.46Å; A614-E618 VanDerWaalsContact O-CG 3.3Å; A614-E618 WeakPolarHBondContact O-CG 3.38Å; A614-E618 PolarHBondContact O-N 3.44Å; F615-E618 PolarHBondContact O-N 3.36Å; E618-A621 PolarHBondContact O-N 3.39Å; E618-L622 VanDerWaalsContact O-CG 3.32Å; E618-L622 WeakPolarHBondContact O-CG 3.09Å; E618-L622 PolarHBondContact O-N 3.31Å; E618-R637 IonicContact OE1-NH2 3.79Å; E618-R637 PolarHBondContact OE1-NH2 2.86Å; E618-R637 IonicContact OE2-CZ 3.39Å; E618-R637 VanDerWaalsContact OE2-CZ 3.28Å; E618-R637 IonicContact OE2-NH1 2.88Å; E618-R637 PolarHBondContact OE2-NH1 3.4Å; E618-R637 IonicContact OE2-NH2 3.73Å; E618-R637 PolarHBondContact OE2-NH2 3Å
619	A	88.3	Confident	88.7	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-68.7	-42.2	-179.4	0	0	0	0	0	112.2	F615 V616 L622 I623 L631 V691	F615-A619 HydrophobicContact CE1-CB 4.29Å; F615-A619 HydrophobicContact CE2-CB 4.46Å; F615-A619 HydrophobicContact CZ-CB 4.15Å; F615-A619 WeakPolarHBondContact O-CB 3.47Å; F615-A619 PolarHBondContact O-N 3.35Å; V616-A619 PolarHBondContact O-N 3.42Å; A619-L622 PolarHBondContact O-N 2.86Å; A619-I623 WeakPolarHBondContact O-CB 3.45Å; A619-I623 VanDerWaalsContact O-CD1 3.31Å; A619-I623 WeakPolarHBondContact O-CD1 3.3Å; A619-I623 WeakPolarHBondContact O-CG1 3.26Å; A619-I623 PolarHBondContact O-N 3.47Å; A619-L631 HydrophobicContact CB-CD2 3.68Å; A619-V691 HydrophobicContact CB-CB 4.48Å; A619-V691 HydrophobicContact CB-CG1 3.45Å; A619-V691 VanDerWaalsContact CB-CG1 3.45Å; A619-V691 HydrophobicContact CB-CG2 4.19Å
620	E	91.1	Very high	88.3	Confident	45 Å²	45	61.2 Å²	61.2	21%	0.21	32%	0.322	C	S	.	.	H	α-helix	trans	-59.4	-45.8	173.5	-73.8	-179.6	150.3	0	0	110.8	V616 L622 I623 E624 R687 V691	V616-E620 HydrophobicContact CG1-CG 4.31Å; V616-E620 WeakPolarHBondContact O-CB 3.42Å; V616-E620 VanDerWaalsContact O-CG 3.26Å; V616-E620 WeakPolarHBondContact O-CG 3.43Å; V616-E620 PolarHBondContact O-N 3.01Å; E620-L622 PolarHBondContact O-N 3.21Å; E620-I623 PolarHBondContact O-N 3.42Å; E620-E624 WeakPolarHBondContact O-CG 3.32Å; E620-E624 PolarHBondContact O-N 3.26Å; E620-R687 VanDerWaalsContact OE1-CD 3.29Å; E620-R687 WeakPolarHBondContact OE1-CD 3.29Å; E620-R687 WeakPolarHBondContact OE1-CG 3.37Å; E620-R687 IonicContact OE2-NH1 3.95Å; E620-R687 PolarHBondContact OE2-NH1 3.5Å; E620-V691 HydrophobicContact CG-CG2 3.94Å
621	A	91.3	Very high	88	Confident	30 Å²	30	60.3 Å²	60.3	25%	0.248	31%	0.313	C	S	.	.	H	α-helix	trans	-63.3	-37.8	177	0	0	0	0	0	113.2	K617 E618 R625	K617-A621 WeakPolarHBondContact O-CB 3.31Å; K617-A621 PolarHBondContact O-N 3.41Å; E618-A621 PolarHBondContact O-N 3.39Å; A621-R625 WeakPolarHBondContact O-CB 3.21Å; A621-R625 WeakPolarHBondContact O-CD 3.44Å; A621-R625 WeakPolarHBondContact O-CG 3.32Å; A621-R625 PolarHBondContact O-N 2.9Å; A621-R625 VanDerWaalsContact O-N 3.08Å
622	L	87.9	Confident	87.5	Confident	36 Å²	36	65.4 Å²	65.4	19%	0.188	32%	0.32	C	S	.	.	H	α-helix	trans	-67	-38.5	174.7	-74.6	172.4	0	0	0	112	E618 A619 E620 G626 Q627 R630 L631	E618-L622 VanDerWaalsContact O-CG 3.32Å; E618-L622 WeakPolarHBondContact O-CG 3.09Å; E618-L622 PolarHBondContact O-N 3.31Å; A619-L622 PolarHBondContact O-N 2.86Å; E620-L622 PolarHBondContact O-N 3.21Å; L622-G626 PolarHBondContact O-N 3.46Å; L622-Q627 HydrophobicContact CD2-CB 4.11Å; L622-Q627 CarbonylContact O-C 3.49Å; L622-Q627 WeakPolarHBondContact O-CA 3.15Å; L622-Q627 PolarHBondContact O-N 2.89Å; L622-R630 HydrophobicContact CD1-CB 4.35Å; L622-L631 HydrophobicContact CD1-CD2 4.14Å
623	I	85.9	Confident	87.1	Confident	48 Å²	48	68.3 Å²	68.3	25%	0.246	35%	0.351	C	S	.	.	H	α-helix	trans	-66	-46.9	176.4	-67.5	160.3	0	0	0	110.2	A619 E620 R625 G626 A628 L631 V691 Q694	A619-I623 WeakPolarHBondContact O-CB 3.45Å; A619-I623 VanDerWaalsContact O-CD1 3.31Å; A619-I623 WeakPolarHBondContact O-CD1 3.3Å; A619-I623 WeakPolarHBondContact O-CG1 3.26Å; A619-I623 PolarHBondContact O-N 3.47Å; E620-I623 PolarHBondContact O-N 3.42Å; I623-R625 VanDerWaalsContact C-N 3.29Å; I623-R625 PolarHBondContact O-N 2.96Å; I623-G626 PolarHBondContact O-N 3.5Å; I623-A628 HydrophobicContact CG1-CB 4.37Å; I623-L631 HydrophobicContact CD1-CD1 4.18Å; I623-L631 HydrophobicContact CG1-CD1 3.99Å; I623-V691 HydrophobicContact CD1-CG2 4.31Å; I623-Q694 HydrophobicContact CD1-CG 3.78Å; I623-Q694 HydrophobicContact CG1-CG 4.41Å
624	E	90	Very high	86.8	Confident	167 Å²	167	69.7 Å²	69.7	78%	0.78	36%	0.356	S	S	*	.	H	α-helix	trans	-61.9	-35.4	178.5	-74	176.4	176.9	0	0	112.6	E620 G626	E620-E624 WeakPolarHBondContact O-CG 3.32Å; E620-E624 PolarHBondContact O-N 3.26Å; E624-G626 PolarHBondContact O-N 2.82Å
625	R	90.1	Very high	86.3	Confident	188 Å²	188	72.3 Å²	72.3	71%	0.709	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	2.6	175.8	-67.6	172.1	-174.7	-177.6	2.2	113.9	A621 I623 Q627	A621-R625 WeakPolarHBondContact O-CB 3.21Å; A621-R625 WeakPolarHBondContact O-CD 3.44Å; A621-R625 WeakPolarHBondContact O-CG 3.32Å; A621-R625 PolarHBondContact O-N 2.9Å; A621-R625 VanDerWaalsContact O-N 3.08Å; I623-R625 VanDerWaalsContact C-N 3.29Å; I623-R625 PolarHBondContact O-N 2.96Å; R625-Q627 HydrophobicContact CB-CG 4.42Å; R625-Q627 PolarHBondContact O-N 3.35Å
626	G	84	Confident	86	Confident	69 Å²	69	76 Å²	76	71%	0.711	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	15.3	-177.8	0	0	0	0	0	114.6	L622 I623 E624	L622-G626 PolarHBondContact O-N 3.46Å; I623-G626 PolarHBondContact O-N 3.5Å; E624-G626 PolarHBondContact O-N 2.82Å
627	Q	85.8	Confident	85.8	Confident	73 Å²	73	79.3 Å²	79.3	34%	0.341	41%	0.405	S	S	.	.			trans	-102.2	31.2	-177.2	-62.8	-177.4	2.6	0	0	112.6	L622 R625 E629 R630	L622-Q627 HydrophobicContact CD2-CB 4.11Å; L622-Q627 CarbonylContact O-C 3.49Å; L622-Q627 WeakPolarHBondContact O-CA 3.15Å; L622-Q627 PolarHBondContact O-N 2.89Å; R625-Q627 HydrophobicContact CB-CG 4.42Å; R625-Q627 PolarHBondContact O-N 3.35Å; Q627-E629 PolarHBondContact O-N 3.4Å; Q627-R630 PolarHBondContact O-N 3.2Å; Q627-R630 VanDerWaalsContact O-N 3.09Å
628	A	81.7	Confident	85.6	Confident	17 Å²	17	73.6 Å²	73.6	14%	0.14	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-58.6	-22.5	-176.5	0	0	0	0	0	113.8	I623 R630 L631 Q696	I623-A628 HydrophobicContact CG1-CB 4.37Å; A628-R630 PolarHBondContact O-N 2.97Å; A628-L631 HydrophobicContact CB-CD1 4.47Å; A628-L631 VanDerWaalsContact O-CB 3.24Å; A628-L631 WeakPolarHBondContact O-CB 3.5Å; A628-L631 WeakPolarHBondContact O-CG 3.34Å; A628-L631 PolarHBondContact O-N 3.05Å; A628-Q696 WeakPolarHBondContact O-CG 3.34Å
629	E	80.4	Confident	85.4	Confident	100 Å²	100	70.7 Å²	70.7	47%	0.467	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-59.9	-28	175.5	-70.4	-56	131	0	0	113.8	Q627 L631 R632 Q696	Q627-E629 PolarHBondContact O-N 3.4Å; E629-L631 PolarHBondContact O-N 2.93Å; E629-R632 PolarHBondContact O-N 2.89Å; E629-R632 IonicContact OE1-NH2 2.81Å; E629-R632 IonicContact OE2-CZ 3.02Å; E629-R632 IonicContact OE2-NE 3.81Å; E629-R632 PolarHBondContact OE2-NE 3.33Å; E629-R632 IonicContact OE2-NH1 3.75Å; E629-R632 IonicContact OE2-NH2 3.58Å; E629-R632 PolarHBondContact OE2-NH2 3.48Å; E629-Q696 PolarHBondContact OE1-NE2 3.27Å
630	R	81.8	Confident	85.4	Confident	163 Å²	163	77.7 Å²	77.7	62%	0.615	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-65.5	-18.8	176.4	-67.5	-176.1	175.5	-173.7	-2.1	112.9	L622 Q627 A628 R632 G633	L622-R630 HydrophobicContact CD1-CB 4.35Å; Q627-R630 PolarHBondContact O-N 3.2Å; Q627-R630 VanDerWaalsContact O-N 3.09Å; A628-R630 PolarHBondContact O-N 2.97Å; R630-R632 PolarHBondContact O-N 2.73Å; R630-G633 PolarHBondContact O-N 3.21Å
631	L	82.3	Confident	85.4	Confident	1 Å²	1	77 Å²	77	1%	0.005	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-66	-23	178.3	-64.4	173.6	0	0	0	113.2	A619 L622 I623 A628 E629 G633 E634 Q696 L697	A619-L631 HydrophobicContact CB-CD2 3.68Å; L622-L631 HydrophobicContact CD1-CD2 4.14Å; I623-L631 HydrophobicContact CD1-CD1 4.18Å; I623-L631 HydrophobicContact CG1-CD1 3.99Å; A628-L631 HydrophobicContact CB-CD1 4.47Å; A628-L631 VanDerWaalsContact O-CB 3.24Å; A628-L631 WeakPolarHBondContact O-CB 3.5Å; A628-L631 WeakPolarHBondContact O-CG 3.34Å; A628-L631 PolarHBondContact O-N 3.05Å; E629-L631 PolarHBondContact O-N 2.93Å; L631-G633 PolarHBondContact O-N 3.29Å; L631-E634 PolarHBondContact O-N 2.89Å; L631-E634 VanDerWaalsContact O-N 3.1Å; L631-Q696 HydrophobicContact CB-CB 4.31Å; L631-L697 HydrophobicContact CB-CD1 4.15Å; L631-L697 HydrophobicContact CB-CD2 4.37Å; L631-L697 HydrophobicContact CB-CG 4.13Å; L631-L697 HydrophobicContact CD1-CD1 4.31Å; L631-L697 WeakPolarHBondContact O-CD2 3.31Å
632	R	79.7	Confident	85.3	Confident	147 Å²	147	75.8 Å²	75.8	56%	0.555	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-61.7	-25.7	175.4	-64.8	-171.5	-159	177.6	5.2	112.9	E629 R630 E634 E635 Q696	E629-R632 PolarHBondContact O-N 2.89Å; E629-R632 IonicContact OE1-NH2 2.81Å; E629-R632 IonicContact OE2-CZ 3.02Å; E629-R632 IonicContact OE2-NE 3.81Å; E629-R632 PolarHBondContact OE2-NE 3.33Å; E629-R632 IonicContact OE2-NH1 3.75Å; E629-R632 IonicContact OE2-NH2 3.58Å; E629-R632 PolarHBondContact OE2-NH2 3.48Å; R630-R632 PolarHBondContact O-N 2.73Å; R632-E634 VanDerWaalsContact C-N 3.3Å; R632-E634 PolarHBondContact O-N 2.96Å; R632-E635 WeakPolarHBondContact O-CG 3.17Å; R632-Q696 HydrophobicContact CG-CB 3.88Å; R632-Q696 HydrophobicContact CG-CG 4.2Å
633	G	80.6	Confident	85.3	Confident	67 Å²	67	80.6 Å²	80.6	69%	0.691	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-76.4	-14.3	177.3	0	0	0	0	0	114.3	R630 L631	R630-G633 PolarHBondContact O-N 3.21Å; L631-G633 PolarHBondContact O-N 3.29Å
634	E	83.8	Confident	85.4	Confident	62 Å²	62	79.7 Å²	79.7	29%	0.29	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-96.9	6.7	-173.1	-62.7	-69.8	137.6	0	0	113	F615 L631 R632 A636 R637 V638	F615-E634 HydrophobicContact CE2-CB 4.02Å; F615-E634 HydrophobicContact CE2-CG 4.46Å; L631-E634 PolarHBondContact O-N 2.89Å; L631-E634 VanDerWaalsContact O-N 3.1Å; R632-E634 VanDerWaalsContact C-N 3.3Å; R632-E634 PolarHBondContact O-N 2.96Å; E634-A636 VanDerWaalsContact C-N 3.3Å; E634-A636 PolarHBondContact O-N 3.08Å; E634-R637 PolarHBondContact O-N 3.46Å; E634-R637 VanDerWaalsContact O-N 3.08Å; E634-R637 WeakPolarHBondContact OE2-CD 3.5Å; E634-R637 IonicContact OE2-CZ 3Å; E634-R637 IonicContact OE2-NE 3.95Å; E634-R637 IonicContact OE2-NH1 2.69Å; E634-R637 PolarHBondContact OE2-NH1 3.03Å; E634-V638 WeakPolarHBondContact O-CG2 3.29Å; E634-V638 PolarHBondContact O-N 3.38Å
635	E	82	Confident	85.4	Confident	90 Å²	90	72.4 Å²	72.4	42%	0.421	37%	0.372	S	S	.	.	H	α-helix	trans	-53.9	-40.8	-175.6	-75.3	-177.7	-176.7	0	0	113.9	R632 T639 L697 L700	R632-E635 WeakPolarHBondContact O-CG 3.17Å; E635-T639 WeakPolarHBondContact O-CB 2.93Å; E635-T639 PolarHBondContact O-N 3.09Å; E635-T639 PolarHBondContact O-OG1 3.48Å; E635-L697 HydrophobicContact CG-CD2 4.48Å; E635-L700 HydrophobicContact CB-CD1 4.48Å; E635-L700 HydrophobicContact CB-CD2 3.94Å; E635-L700 HydrophobicContact CB-CG 4.45Å; E635-L700 HydrophobicContact CG-CD1 4Å; E635-L700 HydrophobicContact CG-CD2 4.09Å; E635-L700 HydrophobicContact CG-CG 4.05Å
636	A	85.1	Confident	85.2	Confident	80 Å²	80	65.1 Å²	65.1	66%	0.661	36%	0.355	S	S	*	.	H	α-helix	trans	-66.6	-44.4	177.6	0	0	0	0	0	111.9	E634 T639 Q640	E634-A636 VanDerWaalsContact C-N 3.3Å; E634-A636 PolarHBondContact O-N 3.08Å; A636-T639 PolarHBondContact O-N 3.06Å; A636-Q640 PolarHBondContact O-N 2.82Å
637	R	87.3	Confident	85.4	Confident	71 Å²	71	66.5 Å²	66.5	27%	0.268	35%	0.354	S	S	.	.	H	α-helix	trans	-65.1	-42.8	177.4	-174.6	-170.3	175.8	-172.7	-3.2	111	E618 E634 T639 Q640 L641	E618-R637 IonicContact OE1-NH2 3.79Å; E618-R637 PolarHBondContact OE1-NH2 2.86Å; E618-R637 IonicContact OE2-CZ 3.39Å; E618-R637 VanDerWaalsContact OE2-CZ 3.28Å; E618-R637 IonicContact OE2-NH1 2.88Å; E618-R637 PolarHBondContact OE2-NH1 3.4Å; E618-R637 IonicContact OE2-NH2 3.73Å; E618-R637 PolarHBondContact OE2-NH2 3Å; E634-R637 PolarHBondContact O-N 3.46Å; E634-R637 VanDerWaalsContact O-N 3.08Å; E634-R637 WeakPolarHBondContact OE2-CD 3.5Å; E634-R637 IonicContact OE2-CZ 3Å; E634-R637 IonicContact OE2-NE 3.95Å; E634-R637 IonicContact OE2-NH1 2.69Å; E634-R637 PolarHBondContact OE2-NH1 3.03Å; R637-T639 PolarHBondContact O-N 2.89Å; R637-Q640 PolarHBondContact O-N 3.19Å; R637-L641 HydrophobicContact CG-CD1 4.38Å; R637-L641 WeakPolarHBondContact O-CG 3.49Å; R637-L641 PolarHBondContact O-N 2.95Å
638	V	87.8	Confident	85.6	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-60.5	-45.5	174.9	169.8	0	0	0	0	111.3	F615 E634 Q640 L641 I642 L692 L697 L700	F615-V638 HydrophobicContact CD2-CG2 4.33Å; F615-V638 HydrophobicContact CE1-CG2 3.91Å; F615-V638 HydrophobicContact CE2-CG2 3.49Å; F615-V638 VanDerWaalsContact CE2-CG2 3.49Å; F615-V638 HydrophobicContact CZ-CG2 3.24Å; E634-V638 WeakPolarHBondContact O-CG2 3.29Å; E634-V638 PolarHBondContact O-N 3.38Å; V638-Q640 VanDerWaalsContact C-N 3.31Å; V638-Q640 PolarHBondContact O-N 2.89Å; V638-L641 PolarHBondContact O-N 2.88Å; V638-I642 HydrophobicContact CG1-CD1 3.85Å; V638-I642 HydrophobicContact CG1-CG1 4.4Å; V638-I642 WeakPolarHBondContact O-CG1 3.26Å; V638-I642 PolarHBondContact O-N 3.42Å; V638-L692 HydrophobicContact CG1-CD2 3.45Å; V638-L692 VanDerWaalsContact CG1-CD2 3.45Å; V638-L692 HydrophobicContact CG2-CD2 4.43Å; V638-L697 HydrophobicContact CG2-CD2 4.38Å; V638-L700 HydrophobicContact CB-CD1 4.43Å; V638-L700 HydrophobicContact CG1-CD1 4.03Å
639	T	87.2	Confident	86	Confident	30 Å²	30	64.4 Å²	64.4	18%	0.184	35%	0.346	C	S	.	.	H	α-helix	trans	-61.1	-41.6	177.9	-60.9	0	0	0	0	111.5	E635 A636 R637 I642 R643 A702	E635-T639 WeakPolarHBondContact O-CB 2.93Å; E635-T639 PolarHBondContact O-N 3.09Å; E635-T639 PolarHBondContact O-OG1 3.48Å; A636-T639 PolarHBondContact O-N 3.06Å; R637-T639 PolarHBondContact O-N 2.89Å; T639-I642 PolarHBondContact O-N 2.84Å; T639-R643 PolarHBondContact O-N 3.4Å; T639-R643 VanDerWaalsContact O-N 3.15Å; T639-A702 HydrophobicContact CG2-CB 3.74Å
640	Q	88.5	Confident	86.3	Confident	147 Å²	147	64.5 Å²	64.5	69%	0.687	34%	0.344	S	S	*	.	H	α-helix	trans	-64.7	-40.5	175.1	-172.2	179.2	-0.2	0	0	112.2	A636 R637 V638 G644	A636-Q640 PolarHBondContact O-N 2.82Å; R637-Q640 PolarHBondContact O-N 3.19Å; V638-Q640 VanDerWaalsContact C-N 3.31Å; V638-Q640 PolarHBondContact O-N 2.89Å; Q640-G644 WeakPolarHBondContact O-CA 3.3Å; Q640-G644 PolarHBondContact O-N 3.03Å
641	L	90	Very high	86.7	Confident	31 Å²	31	60.1 Å²	60.1	16%	0.162	34%	0.338	C	S	.	.	H	α-helix	trans	-66.2	-41	177.3	-71.8	172.6	0	0	0	112.4	F615 R637 V638 F645 F688	F615-L641 HydrophobicContact CB-CD1 3.59Å; F615-L641 HydrophobicContact CD1-CD1 4.22Å; F615-L641 HydrophobicContact CD2-CD1 4.44Å; F615-L641 HydrophobicContact CG-CD1 3.81Å; R637-L641 HydrophobicContact CG-CD1 4.38Å; R637-L641 WeakPolarHBondContact O-CG 3.49Å; R637-L641 PolarHBondContact O-N 2.95Å; V638-L641 PolarHBondContact O-N 2.88Å; L641-F645 WeakPolarHBondContact O-CB 3.41Å; L641-F645 PolarHBondContact O-N 3Å; L641-F688 HydrophobicContact CB-CZ 4.35Å
642	I	88.8	Confident	87	Confident	4 Å²	4	61.2 Å²	61.2	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-63.8	-51.1	178.2	-66.4	170.3	0	0	0	110.7	V638 T639 G646 F688 L692 A702 E705 L706	V638-I642 HydrophobicContact CG1-CD1 3.85Å; V638-I642 HydrophobicContact CG1-CG1 4.4Å; V638-I642 WeakPolarHBondContact O-CG1 3.26Å; V638-I642 PolarHBondContact O-N 3.42Å; T639-I642 PolarHBondContact O-N 2.84Å; I642-G646 PolarHBondContact O-N 2.97Å; I642-F688 HydrophobicContact CG1-CE1 3.94Å; I642-F688 HydrophobicContact CG1-CZ 3.94Å; I642-L692 HydrophobicContact CD1-CD1 4Å; I642-L692 HydrophobicContact CG1-CD1 4.4Å; I642-A702 HydrophobicContact CD1-CB 4.13Å; I642-A702 WeakPolarHBondContact CG2-O 3.35Å; I642-E705 HydrophobicContact CG2-CB 4.12Å; I642-L706 HydrophobicContact CB-CD2 4.49Å; I642-L706 HydrophobicContact CD1-CD2 4Å; I642-L706 HydrophobicContact CD1-CG 4.22Å; I642-L706 HydrophobicContact CG1-CD2 3.77Å; I642-L706 HydrophobicContact CG1-CG 4.44Å; I642-L706 HydrophobicContact CG2-CD2 4.03Å; I642-L706 HydrophobicContact CG2-CG 4.26Å
643	R	88.7	Confident	87.4	Confident	137 Å²	137	54.3 Å²	54.3	52%	0.517	32%	0.321	S	S	.	.	H	α-helix	trans	-66.8	-43.9	-179.9	-75.7	175.9	177.5	171.6	1.9	112.4	T639 G646 S647 E705	T639-R643 PolarHBondContact O-N 3.4Å; T639-R643 VanDerWaalsContact O-N 3.15Å; R643-G646 PolarHBondContact O-N 3.45Å; R643-S647 PolarHBondContact O-N 3.15Å; R643-S647 PolarHBondContact O-OG 2.88Å; R643-E705 WeakPolarHBondContact CD-OE2 3.49Å; R643-E705 WeakPolarHBondContact CG-OE2 3.31Å; R643-E705 IonicContact CZ-OE1 3.66Å; R643-E705 IonicContact CZ-OE2 3.49Å; R643-E705 IonicContact NE-OE1 2.72Å; R643-E705 PolarHBondContact NE-OE1 3.33Å; R643-E705 IonicContact NE-OE2 3.31Å; R643-E705 PolarHBondContact NE-OE2 3.06Å; R643-E705 IonicContact NH2-OE1 2.89Å; R643-E705 PolarHBondContact NH2-OE1 3.24Å; R643-E705 IonicContact NH2-OE2 2.8Å
644	G	88.1	Confident	87.8	Confident	30 Å²	30	55.9 Å²	55.9	31%	0.309	31%	0.31	S	S	.	.	H	α-helix	trans	-58.2	-55.3	176.6	0	0	0	0	0	110.8	Q640 G646 S647 S648	Q640-G644 WeakPolarHBondContact O-CA 3.3Å; Q640-G644 PolarHBondContact O-N 3.03Å; G644-G646 VanDerWaalsContact C-N 3.33Å; G644-G646 PolarHBondContact O-N 3.43Å; G644-S647 PolarHBondContact O-N 3.02Å; G644-S647 PolarHBondContact O-OG 3.36Å; G644-S648 PolarHBondContact O-N 3.29Å; G644-S648 PolarHBondContact O-OG 2.94Å; G644-S648 VanDerWaalsContact O-OG 3.04Å
645	F	90.1	Very high	88	Confident	14 Å²	14	56.5 Å²	56.5	6%	0.061	32%	0.321	C	S	.	.	H	α-helix	trans	-54.8	-50.2	175.6	-175.8	-95.7	0	0	0	110.8	F609 L612 L641 S647 S648 W649 L681 Y685 I707 L712	F609-F645 AromaticContact CD1-CD2 3.84Å; F609-F645 HydrophobicContact CD1-CD2 3.84Å; F609-F645 AromaticContact CD1-CE2 3.83Å; F609-F645 HydrophobicContact CD1-CE2 3.83Å; F609-F645 AromaticContact CE1-CD2 3.79Å; F609-F645 HydrophobicContact CE1-CD2 3.79Å; F609-F645 AromaticContact CE1-CE2 3.58Å; F609-F645 HydrophobicContact CE1-CE2 3.58Å; L612-F645 HydrophobicContact CD2-CD2 4.15Å; L612-F645 HydrophobicContact CD2-CE2 4.32Å; L641-F645 WeakPolarHBondContact O-CB 3.41Å; L641-F645 PolarHBondContact O-N 3Å; F645-S647 VanDerWaalsContact C-N 3.25Å; F645-S647 PolarHBondContact O-N 3.29Å; F645-S648 PolarHBondContact O-N 3.47Å; F645-W649 HydrophobicContact CD1-CB 4.32Å; F645-W649 HydrophobicContact CD1-CG 4.43Å; F645-W649 HydrophobicContact CD2-CB 4.07Å; F645-W649 HydrophobicContact CE1-CB 4.07Å; F645-W649 HydrophobicContact CE1-CG 4.05Å; F645-W649 HydrophobicContact CE2-CB 3.82Å; F645-W649 HydrophobicContact CG-CB 4.32Å; F645-W649 HydrophobicContact CZ-CB 3.81Å; F645-W649 HydrophobicContact CZ-CG 4.17Å; F645-W649 VanDerWaalsContact O-CB 3.28Å; F645-W649 WeakPolarHBondContact O-CB 3.48Å; F645-W649 PolarHBondContact O-N 2.86Å; F645-L681 HydrophobicContact CE2-CD1 4.26Å; F645-Y685 HydrophobicContact CD1-CD2 4.2Å; F645-Y685 AromaticContact CD1-CE2 3.63Å; F645-Y685 HydrophobicContact CD1-CE2 3.63Å; F645-Y685 AromaticContact CE1-CD2 3.73Å; F645-Y685 HydrophobicContact CE1-CD2 3.73Å; F645-Y685 AromaticContact CE1-CE2 3.4Å; F645-Y685 HydrophobicContact CE1-CE2 3.4Å; F645-Y685 AromaticContact CE1-CZ 3.94Å; F645-Y685 HydrophobicContact CE2-CD2 4.32Å; F645-Y685 HydrophobicContact CG-CE2 4.38Å; F645-Y685 AromaticContact CZ-CD2 3.8Å; F645-Y685 HydrophobicContact CZ-CD2 3.8Å; F645-Y685 AromaticContact CZ-CE2 3.98Å; F645-Y685 HydrophobicContact CZ-CE2 3.98Å; F645-Y685 HydrophobicContact CZ-CG 4.41Å; F645-I707 HydrophobicContact CD1-CD1 3.95Å; F645-I707 HydrophobicContact CE1-CD1 3.93Å; F645-L712 HydrophobicContact CE1-CD1 4.4Å; F645-L712 HydrophobicContact CZ-CD1 4.13Å; F645-L712 HydrophobicContact CZ-CD2 4.19Å
646	G	86.7	Confident	88.4	Confident	34 Å²	34	52.7 Å²	52.7	35%	0.351	30%	0.303	S	S	.	.	H	α-helix	trans	-55	-36.1	-178.6	0	0	0	0	0	114.9	I642 R643 G644	I642-G646 PolarHBondContact O-N 2.97Å; R643-G646 PolarHBondContact O-N 3.45Å; G644-G646 VanDerWaalsContact C-N 3.33Å; G644-G646 PolarHBondContact O-N 3.43Å
647	S	88.2	Confident	88.5	Confident	99 Å²	99	49.8 Å²	49.8	69%	0.692	28%	0.278	S	S	*	.	H	α-helix	trans	-83.6	-30.4	-177.2	69.4	0	0	0	0	114.9	R643 G644 F645	R643-S647 PolarHBondContact O-N 3.15Å; R643-S647 PolarHBondContact O-OG 2.88Å; G644-S647 PolarHBondContact O-N 3.02Å; G644-S647 PolarHBondContact O-OG 3.36Å; F645-S647 VanDerWaalsContact C-N 3.25Å; F645-S647 PolarHBondContact O-N 3.29Å
648	S	89.9	Confident	88.5	Confident	39 Å²	39	51 Å²	51	27%	0.273	29%	0.287	S	S	.	.	H	α-helix	trans	-121.3	-10.3	-166.2	68	0	0	0	0	115.5	G644 F645 K650 S651 S652	G644-S648 PolarHBondContact O-N 3.29Å; G644-S648 PolarHBondContact O-OG 2.94Å; G644-S648 VanDerWaalsContact O-OG 3.04Å; F645-S648 PolarHBondContact O-N 3.47Å; S648-K650 VanDerWaalsContact C-N 3.34Å; S648-K650 PolarHBondContact O-N 3.48Å; S648-S651 PolarHBondContact O-N 2.98Å; S648-S651 PolarHBondContact O-OG 2.76Å; S648-S652 VanDerWaalsContact O-CB 3.29Å; S648-S652 WeakPolarHBondContact O-CB 3.27Å; S648-S652 PolarHBondContact O-N 3.43Å; S648-S652 PolarHBondContact O-OG 3.44Å
649	W	88.4	Confident	88.5	Confident	7 Å²	7	53.4 Å²	53.4	3%	0.027	30%	0.3	C	S	.	.	H	α-helix	trans	-60.9	-38	-173.2	72.1	-81	0	0	0	113.6	F609 F645 S652 V653 I707 L712 E715 L716	F609-W649 HydrophobicContact CE1-CB 4.13Å; F609-W649 HydrophobicContact CZ-CB 4.49Å; F645-W649 HydrophobicContact CD1-CB 4.32Å; F645-W649 HydrophobicContact CD1-CG 4.43Å; F645-W649 HydrophobicContact CD2-CB 4.07Å; F645-W649 HydrophobicContact CE1-CB 4.07Å; F645-W649 HydrophobicContact CE1-CG 4.05Å; F645-W649 HydrophobicContact CE2-CB 3.82Å; F645-W649 HydrophobicContact CG-CB 4.32Å; F645-W649 HydrophobicContact CZ-CB 3.81Å; F645-W649 HydrophobicContact CZ-CG 4.17Å; F645-W649 VanDerWaalsContact O-CB 3.28Å; F645-W649 WeakPolarHBondContact O-CB 3.48Å; F645-W649 PolarHBondContact O-N 2.86Å; W649-S652 PolarHBondContact O-N 3.43Å; W649-V653 WeakPolarHBondContact O-CB 3.29Å; W649-V653 WeakPolarHBondContact O-CG2 3.47Å; W649-V653 PolarHBondContact O-N 3.28Å; W649-I707 VanDerWaalsContact CD1-CD1 3.44Å; W649-I707 HydrophobicContact CD2-CD1 4.5Å; W649-I707 HydrophobicContact CG-CD1 4.27Å; W649-I707 HydrophobicContact CZ2-CD1 4.39Å; W649-L712 HydrophobicContact CD2-CD1 3.95Å; W649-L712 HydrophobicContact CE3-CD1 3.51Å; W649-L712 HydrophobicContact CH2-CD1 3.81Å; W649-L712 HydrophobicContact CZ2-CD1 4.24Å; W649-L712 HydrophobicContact CZ3-CD1 3.46Å; W649-L712 VanDerWaalsContact CZ3-CD1 3.46Å; W649-E715 HydrophobicContact CH2-CB 3.59Å; W649-E715 HydrophobicContact CH2-CG 4.03Å; W649-E715 HydrophobicContact CZ3-CB 4.15Å; W649-L716 HydrophobicContact CE3-CD2 4.2Å; W649-L716 HydrophobicContact CZ3-CD2 3.88Å; W649-L716 HydrophobicContact CZ3-CG 4.38Å
650	K	88.2	Confident	88.5	Confident	102 Å²	102	52 Å²	52	44%	0.443	29%	0.291	S	S	.	.	H	α-helix	trans	-64.5	-51.9	-179.8	-68.4	-172	178.6	-178.3	0	111.7	S648 S652 V653 E654	S648-K650 VanDerWaalsContact C-N 3.34Å; S648-K650 PolarHBondContact O-N 3.48Å; K650-S652 VanDerWaalsContact C-N 3.3Å; K650-S652 PolarHBondContact O-N 2.9Å; K650-V653 PolarHBondContact O-N 3.48Å; K650-E654 PolarHBondContact O-N 2.93Å
651	S	89.4	Confident	88.4	Confident	70 Å²	70	47.5 Å²	47.5	49%	0.49	27%	0.271	S	S	.	.	H	α-helix	trans	-65.7	-35.6	178.6	56.6	0	0	0	0	111.7	S648 E654 S655	S648-S651 PolarHBondContact O-N 2.98Å; S648-S651 PolarHBondContact O-OG 2.76Å; S651-E654 PolarHBondContact O-N 3.25Å; S651-S655 WeakPolarHBondContact O-CB 3.32Å; S651-S655 PolarHBondContact O-N 2.68Å
652	S	88.9	Confident	88.3	Confident	24 Å²	24	55.9 Å²	55.9	17%	0.168	30%	0.3	C	S	.	.	H	α-helix	trans	-65.5	-41.8	176.3	-57.7	0	0	0	0	112.1	S648 W649 K650 L656	S648-S652 VanDerWaalsContact O-CB 3.29Å; S648-S652 WeakPolarHBondContact O-CB 3.27Å; S648-S652 PolarHBondContact O-N 3.43Å; S648-S652 PolarHBondContact O-OG 3.44Å; W649-S652 PolarHBondContact O-N 3.43Å; K650-S652 VanDerWaalsContact C-N 3.3Å; K650-S652 PolarHBondContact O-N 2.9Å; S652-L656 VanDerWaalsContact O-CB 3.22Å; S652-L656 WeakPolarHBondContact O-CB 3.37Å; S652-L656 PolarHBondContact O-N 3.31Å
653	V	88.4	Confident	88.2	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.018	31%	0.306	C	S	.	.	H	α-helix	trans	-68.2	-40.1	175.9	168	0	0	0	0	111.7	F609 W649 K650 L656 S657 L678 L681 L716 H719	F609-V653 HydrophobicContact CZ-CG2 4.21Å; W649-V653 WeakPolarHBondContact O-CB 3.29Å; W649-V653 WeakPolarHBondContact O-CG2 3.47Å; W649-V653 PolarHBondContact O-N 3.28Å; K650-V653 PolarHBondContact O-N 3.48Å; V653-L656 PolarHBondContact O-N 3.29Å; V653-S657 WeakPolarHBondContact O-CB 3.3Å; V653-S657 PolarHBondContact O-N 3.46Å; V653-L678 HydrophobicContact CG1-CD2 3.74Å; V653-L681 HydrophobicContact CG2-CD2 3.9Å; V653-L716 HydrophobicContact CB-CD2 4.27Å; V653-L716 HydrophobicContact CG1-CD2 3.82Å; V653-L716 HydrophobicContact CG2-CD2 3.68Å; V653-H719 HydrophobicContact CG1-CB 4.22Å
654	E	88	Confident	88.2	Confident	100 Å²	100	50.3 Å²	50.3	47%	0.467	28%	0.282	S	S	.	.	H	α-helix	trans	-64	-46.3	175.9	-173.9	173.7	-170.8	0	0	111.5	K650 S651 L656 S657 Q658	K650-E654 PolarHBondContact O-N 2.93Å; S651-E654 PolarHBondContact O-N 3.25Å; E654-L656 VanDerWaalsContact C-N 3.34Å; E654-L656 PolarHBondContact O-N 3.49Å; E654-S657 PolarHBondContact O-N 2.9Å; E654-Q658 WeakPolarHBondContact O-CG 3.23Å; E654-Q658 PolarHBondContact O-N 2.89Å
655	S	89.3	Confident	87.6	Confident	74 Å²	74	53.1 Å²	53.1	52%	0.517	29%	0.293	S	S	.	.	H	α-helix	trans	-60.1	-43.3	174.9	-174	0	0	0	0	111.7	S651 Q658 D659	S651-S655 WeakPolarHBondContact O-CB 3.32Å; S651-S655 PolarHBondContact O-N 2.68Å; S655-Q658 PolarHBondContact O-N 2.96Å; S655-D659 WeakPolarHBondContact O-CB 3.42Å; S655-D659 PolarHBondContact O-N 3.39Å
656	L	89.4	Confident	87.2	Confident	10 Å²	10	55 Å²	55	5%	0.052	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-47.2	177	-176.9	156.2	0	0	0	111.3	L604 L605 S652 V653 E654 Q658 D659 V660 A677	L604-L656 HydrophobicContact CD1-CD1 4.46Å; L604-L656 HydrophobicContact CD1-CG 4.05Å; L604-L656 HydrophobicContact CD2-CD1 3.76Å; L604-L656 HydrophobicContact CD2-CD2 3.56Å; L604-L656 HydrophobicContact CD2-CG 3.46Å; L604-L656 VanDerWaalsContact CD2-CG 3.46Å; L604-L656 HydrophobicContact CG-CD1 3.61Å; L604-L656 HydrophobicContact CG-CD2 4.26Å; L604-L656 HydrophobicContact CG-CG 3.57Å; L605-L656 HydrophobicContact CD2-CD1 3.78Å; S652-L656 VanDerWaalsContact O-CB 3.22Å; S652-L656 WeakPolarHBondContact O-CB 3.37Å; S652-L656 PolarHBondContact O-N 3.31Å; V653-L656 PolarHBondContact O-N 3.29Å; E654-L656 VanDerWaalsContact C-N 3.34Å; E654-L656 PolarHBondContact O-N 3.49Å; L656-Q658 PolarHBondContact O-N 3.41Å; L656-D659 PolarHBondContact O-N 2.93Å; L656-V660 HydrophobicContact CD2-CG2 4.13Å; L656-V660 VanDerWaalsContact O-CG2 3.31Å; L656-V660 WeakPolarHBondContact O-CG2 3.22Å; L656-V660 PolarHBondContact O-N 3.03Å; L656-A677 HydrophobicContact CD2-CB 4.25Å
657	S	86.6	Confident	87.1	Confident	20 Å²	20	58.4 Å²	58.4	14%	0.14	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-44.9	178.5	-175.5	0	0	0	0	111.8	V653 E654 D659 V660 M661	V653-S657 WeakPolarHBondContact O-CB 3.3Å; V653-S657 PolarHBondContact O-N 3.46Å; E654-S657 PolarHBondContact O-N 2.9Å; S657-D659 VanDerWaalsContact C-N 3.33Å; S657-D659 PolarHBondContact O-N 3.04Å; S657-V660 PolarHBondContact O-N 3.24Å; S657-M661 WeakPolarHBondContact O-CB 3.35Å; S657-M661 VanDerWaalsContact O-CG 3.25Å; S657-M661 WeakPolarHBondContact O-CG 3.34Å; S657-M661 PolarHBondContact O-N 3.43Å
658	Q	87.3	Confident	86.9	Confident	97 Å²	97	62.8 Å²	62.8	45%	0.453	31%	0.311	S	S	.	.	H	α-helix	trans	-62.3	-40	176.7	-70.6	-179.4	9.8	0	0	112.5	E654 S655 L656 M661 R662	E654-Q658 WeakPolarHBondContact O-CG 3.23Å; E654-Q658 PolarHBondContact O-N 2.89Å; S655-Q658 PolarHBondContact O-N 2.96Å; L656-Q658 PolarHBondContact O-N 3.41Å; Q658-M661 PolarHBondContact O-N 2.69Å; Q658-R662 VanDerWaalsContact O-CG 3.32Å; Q658-R662 WeakPolarHBondContact O-CG 3.43Å; Q658-R662 PolarHBondContact O-N 3.02Å; Q658-R662 VanDerWaalsContact O-N 3.08Å
659	D	87.4	Confident	86.6	Confident	50 Å²	50	61.6 Å²	61.6	27%	0.267	30%	0.301	S	S	.	.	H	α-helix	trans	-68.3	-43	-179.2	-171.8	20.1	0	0	0	112.1	K558 S655 L656 S657 R662 S663	K558-D659 WeakPolarHBondContact CE-OD2 3.06Å; K558-D659 IonicContact NZ-OD1 3.84Å; K558-D659 PolarHBondContact NZ-OD1 3.35Å; K558-D659 IonicContact NZ-OD2 3.05Å; K558-D659 PolarHBondContact NZ-OD2 3.36Å; S655-D659 WeakPolarHBondContact O-CB 3.42Å; S655-D659 PolarHBondContact O-N 3.39Å; L656-D659 PolarHBondContact O-N 2.93Å; S657-D659 VanDerWaalsContact C-N 3.33Å; S657-D659 PolarHBondContact O-N 3.04Å; D659-R662 PolarHBondContact O-N 2.91Å; D659-S663 WeakPolarHBondContact O-CB 3.49Å; D659-S663 PolarHBondContact O-N 3.2Å; D659-S663 PolarHBondContact O-OG 3.22Å
660	V	89.1	Confident	86.6	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-60.8	-47.6	172.5	176.5	0	0	0	0	110.4	F600 L604 L656 S657 R662 S663 F664 G670 I673 I674	F600-V660 HydrophobicContact CE1-CG2 4.27Å; L604-V660 HydrophobicContact CD2-CG2 3.52Å; L656-V660 HydrophobicContact CD2-CG2 4.13Å; L656-V660 VanDerWaalsContact O-CG2 3.31Å; L656-V660 WeakPolarHBondContact O-CG2 3.22Å; L656-V660 PolarHBondContact O-N 3.03Å; S657-V660 PolarHBondContact O-N 3.24Å; V660-R662 PolarHBondContact O-N 3.3Å; V660-S663 PolarHBondContact O-N 3.07Å; V660-F664 HydrophobicContact CB-CD2 4.44Å; V660-F664 HydrophobicContact CG1-CD2 3.57Å; V660-F664 HydrophobicContact CG1-CE2 3.83Å; V660-F664 VanDerWaalsContact O-CD2 3.25Å; V660-F664 WeakPolarHBondContact O-CD2 3.49Å; V660-F664 PolarHBondContact O-N 3.23Å; V660-F664 VanDerWaalsContact O-N 3.13Å; V660-G670 WeakPolarHBondContact CG1-O 3.16Å; V660-I673 HydrophobicContact CG1-CB 4.18Å; V660-I673 HydrophobicContact CG1-CG2 4.06Å; V660-I673 HydrophobicContact CG2-CG2 4.29Å; V660-I674 HydrophobicContact CB-CD1 4.25Å; V660-I674 HydrophobicContact CB-CG1 3.96Å; V660-I674 HydrophobicContact CG1-CD1 4.14Å; V660-I674 HydrophobicContact CG1-CG1 3.81Å; V660-I674 HydrophobicContact CG2-CG1 4.29Å
661	M	85.7	Confident	86.6	Confident	52 Å²	52	56.9 Å²	56.9	26%	0.256	28%	0.282	S	S	.	.	H	α-helix	trans	-65.7	-22.5	-179.1	-68.1	-63.6	-71.6	0	0	113.7	S657 Q658 F667 I674 P721 F723	S657-M661 WeakPolarHBondContact O-CB 3.35Å; S657-M661 VanDerWaalsContact O-CG 3.25Å; S657-M661 WeakPolarHBondContact O-CG 3.34Å; S657-M661 PolarHBondContact O-N 3.43Å; Q658-M661 PolarHBondContact O-N 2.69Å; M661-F667 HydrophobicContact CE-CD1 3.37Å; M661-F667 HydrophobicContact CE-CE1 3.84Å; M661-F667 HydrophobicContact CE-CG 4.34Å; M661-F667 HydrophobicContact SD-CD1 4.33Å; M661-I674 HydrophobicContact CG-CD1 4.03Å; M661-I674 HydrophobicContact SD-CD1 4.09Å; M661-P721 HydrophobicContact SD-CG 4.48Å; M661-F723 HydrophobicContact CE-CE2 4.34Å
662	R	86.8	Confident	86.5	Confident	207 Å²	207	56.9 Å²	56.9	78%	0.781	28%	0.282	S	S	*	.	H	α-helix	trans	-82.7	-28.8	171.8	-73.3	175.2	-176.4	-178.3	4.3	113	Q658 D659 V660	Q658-R662 VanDerWaalsContact O-CG 3.32Å; Q658-R662 WeakPolarHBondContact O-CG 3.43Å; Q658-R662 PolarHBondContact O-N 3.02Å; Q658-R662 VanDerWaalsContact O-N 3.08Å; D659-R662 PolarHBondContact O-N 2.91Å; V660-R662 PolarHBondContact O-N 3.3Å
663	S	87.1	Confident	86.6	Confident	20 Å²	20	55.7 Å²	55.7	14%	0.14	27%	0.274	C	S	.	.	H	α-helix	trans	-85.4	-30.5	-172.3	-60.4	0	0	0	0	113.7	V562 N566 D659 V660	V562-S663 VanDerWaalsContact CG1-O 3.28Å; V562-S663 WeakPolarHBondContact CG1-O 3.28Å; N566-S663 PolarHBondContact ND2-O 2.93Å; N566-S663 VanDerWaalsContact ND2-O 3.08Å; D659-S663 WeakPolarHBondContact O-CB 3.49Å; D659-S663 PolarHBondContact O-N 3.2Å; D659-S663 PolarHBondContact O-OG 3.22Å; V660-S663 PolarHBondContact O-N 3.07Å
664	F	88.3	Confident	86.6	Confident	5 Å²	5	55.6 Å²	55.6	2%	0.022	27%	0.273	C	S	.	.			trans	-111	125.5	-176.1	-58.7	-76.8	0	0	0	111.7	V562 I565 N566 F600 V660 N666 I673	V562-F664 HydrophobicContact CG1-CE1 4.25Å; V562-F664 HydrophobicContact CG2-CE1 4.47Å; V562-F664 HydrophobicContact CG2-CZ 4.05Å; I565-F664 HydrophobicContact CB-CE1 3.78Å; I565-F664 HydrophobicContact CD1-CE1 4.07Å; I565-F664 HydrophobicContact CD1-CZ 4.12Å; I565-F664 HydrophobicContact CG2-CD1 3.85Å; I565-F664 HydrophobicContact CG2-CE1 3.41Å; I565-F664 VanDerWaalsContact CG2-CE1 3.41Å; I565-F664 HydrophobicContact CG2-CZ 4.36Å; N566-F664 VanDerWaalsContact OD1-CD1 3.28Å; N566-F664 WeakPolarHBondContact OD1-CD1 3.23Å; F600-F664 HydrophobicContact CD1-CE2 4.24Å; F600-F664 AromaticContact CD1-CZ 3.93Å; F600-F664 HydrophobicContact CD1-CZ 3.93Å; F600-F664 AromaticContact CE1-CE2 3.51Å; F600-F664 HydrophobicContact CE1-CE2 3.51Å; F600-F664 AromaticContact CE1-CZ 3.58Å; F600-F664 HydrophobicContact CE1-CZ 3.58Å; F600-F664 HydrophobicContact CE2-CZ 4.27Å; F600-F664 HydrophobicContact CG-CZ 4.42Å; F600-F664 AromaticContact CZ-CE2 3.75Å; F600-F664 HydrophobicContact CZ-CE2 3.75Å; F600-F664 AromaticContact CZ-CZ 3.77Å; F600-F664 HydrophobicContact CZ-CZ 3.77Å; V660-F664 HydrophobicContact CB-CD2 4.44Å; V660-F664 HydrophobicContact CG1-CD2 3.57Å; V660-F664 HydrophobicContact CG1-CE2 3.83Å; V660-F664 VanDerWaalsContact O-CD2 3.25Å; V660-F664 WeakPolarHBondContact O-CD2 3.49Å; V660-F664 PolarHBondContact O-N 3.23Å; V660-F664 VanDerWaalsContact O-N 3.13Å; F664-N666 VanDerWaalsContact C-N 3.33Å; F664-I673 HydrophobicContact CD1-CD1 3.96Å; F664-I673 HydrophobicContact CD2-CD1 3.8Å; F664-I673 HydrophobicContact CE1-CD1 3.71Å; F664-I673 HydrophobicContact CE2-CD1 3.52Å; F664-I673 HydrophobicContact CE2-CG2 4.48Å; F664-I673 HydrophobicContact CG-CD1 4.03Å; F664-I673 HydrophobicContact CZ-CD1 3.48Å; F664-I673 VanDerWaalsContact CZ-CD1 3.48Å
665	T	75.6	Confident	86.7	Confident	88 Å²	88	54.4 Å²	54.4	54%	0.54	27%	0.268	S	S	.	.	S	Bend	trans	-74.7	-24	179.3	50.7	0	0	0	0	113
666	N	83.5	Confident	86.7	Confident	54 Å²	54	52.1 Å²	52.1	29%	0.289	26%	0.256	S	S	.	.			trans	-94.2	108	175.4	-177.9	-9.1	0	0	0	110.2	D569 F664 R668 N669 G670	D569-N666 PolarHBondContact OD1-ND2 3.31Å; D569-N666 WeakPolarHBondContact OD2-CB 3.48Å; D569-N666 PolarHBondContact OD2-ND2 3.45Å; F664-N666 VanDerWaalsContact C-N 3.33Å; N666-R668 PolarHBondContact O-N 3.3Å; N666-R668 WeakPolarHBondContact OD1-CB 3.25Å; N666-R668 PolarHBondContact OD1-N 3.17Å; N666-N669 HydrophobicContact CB-CB 4.05Å; N666-N669 PolarHBondContact O-N 3.1Å; N666-G670 PolarHBondContact O-N 3.12Å
667	F	82.6	Confident	86.7	Confident	106 Å²	106	51.7 Å²	51.7	47%	0.465	25%	0.254	S	S	.	.	H	α-helix	trans	-63.9	-27	-177.9	-61.8	-59	0	0	0	113.9	M661 T671	M661-F667 HydrophobicContact CE-CD1 3.37Å; M661-F667 HydrophobicContact CE-CE1 3.84Å; M661-F667 HydrophobicContact CE-CG 4.34Å; M661-F667 HydrophobicContact SD-CD1 4.33Å; F667-T671 VanDerWaalsContact O-CB 3.26Å; F667-T671 WeakPolarHBondContact O-CB 3.41Å; F667-T671 PolarHBondContact O-N 3.22Å; F667-T671 PolarHBondContact O-OG1 3.19Å
668	R	83.9	Confident	86.9	Confident	190 Å²	190	51 Å²	51	72%	0.717	25%	0.248	S	C	*	.	H	α-helix	trans	-68.5	-45.5	174.7	-68.6	-176.7	175.5	176.6	0.5	110.8	N666 T671 S672	N666-R668 PolarHBondContact O-N 3.3Å; N666-R668 WeakPolarHBondContact OD1-CB 3.25Å; N666-R668 PolarHBondContact OD1-N 3.17Å; R668-T671 PolarHBondContact O-N 2.92Å; R668-S672 PolarHBondContact O-N 2.88Å
669	N	85.5	Confident	87.1	Confident	14 Å²	14	49.4 Å²	49.4	8%	0.075	25%	0.245	C	C	.	.	H	α-helix	trans	-63.1	-48.2	175.4	-171.4	15.6	0	0	0	110.7	I565 N666 T671 S672 I673	I565-N669 VanDerWaalsContact CG2-ND2 3.32Å; I565-N669 WeakPolarHBondContact CG2-ND2 3.4Å; N666-N669 HydrophobicContact CB-CB 4.05Å; N666-N669 PolarHBondContact O-N 3.1Å; N669-T671 VanDerWaalsContact C-N 3.29Å; N669-T671 PolarHBondContact O-N 3.15Å; N669-S672 WeakPolarHBondContact O-CB 3.36Å; N669-S672 PolarHBondContact O-N 3.33Å; N669-I673 VanDerWaalsContact O-CG1 3.32Å; N669-I673 WeakPolarHBondContact O-CG1 3.24Å; N669-I673 PolarHBondContact O-N 3.05Å
670	G	87.6	Confident	87.2	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-55.8	-41.3	174.7	0	0	0	0	0	113.3	V660 N666 I673 I674	V660-G670 WeakPolarHBondContact CG1-O 3.16Å; N666-G670 PolarHBondContact O-N 3.12Å; G670-I673 PolarHBondContact O-N 3.47Å; G670-I674 WeakPolarHBondContact O-CG1 3.28Å; G670-I674 PolarHBondContact O-N 2.91Å
671	T	87.1	Confident	87.3	Confident	9 Å²	9	48.6 Å²	48.6	6%	0.055	24%	0.24	C	C	.	.	H	α-helix	trans	-64.2	-43.7	174.9	-62	0	0	0	0	111.7	F667 R668 N669 I673 I674 Q675 P721	F667-T671 VanDerWaalsContact O-CB 3.26Å; F667-T671 WeakPolarHBondContact O-CB 3.41Å; F667-T671 PolarHBondContact O-N 3.22Å; F667-T671 PolarHBondContact O-OG1 3.19Å; R668-T671 PolarHBondContact O-N 2.92Å; N669-T671 VanDerWaalsContact C-N 3.29Å; N669-T671 PolarHBondContact O-N 3.15Å; T671-I673 PolarHBondContact O-N 2.98Å; T671-I674 PolarHBondContact O-N 3.37Å; T671-Q675 VanDerWaalsContact O-CG 3.29Å; T671-Q675 WeakPolarHBondContact O-CG 3.48Å; T671-Q675 PolarHBondContact O-N 3.08Å; T671-P721 HydrophobicContact CG2-CB 4.31Å; T671-P721 HydrophobicContact CG2-CG 4.32Å
672	S	88.5	Confident	87.5	Confident	70 Å²	70	48 Å²	48	49%	0.49	24%	0.237	S	C	.	.	H	α-helix	trans	-60	-44.6	175.7	-171.4	0	0	0	0	111.7	R668 N669 Q675 G676	R668-S672 PolarHBondContact O-N 2.88Å; N669-S672 WeakPolarHBondContact O-CB 3.36Å; N669-S672 PolarHBondContact O-N 3.33Å; S672-Q675 PolarHBondContact O-N 3.12Å; S672-G676 PolarHBondContact O-N 3.5Å
673	I	90.9	Very high	87.7	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-45.8	176.9	-65.2	169.9	0	0	0	110.9	I565 T597 F600 I601 V660 F664 N669 G670 T671 Q675 G676 A677	I565-I673 HydrophobicContact CG2-CD1 4.21Å; T597-I673 HydrophobicContact CG2-CG1 3.86Å; F600-I673 HydrophobicContact CD1-CG2 3.83Å; F600-I673 HydrophobicContact CE1-CG2 3.87Å; I601-I673 HydrophobicContact CG1-CG2 4.16Å; V660-I673 HydrophobicContact CG1-CB 4.18Å; V660-I673 HydrophobicContact CG1-CG2 4.06Å; V660-I673 HydrophobicContact CG2-CG2 4.29Å; F664-I673 HydrophobicContact CD1-CD1 3.96Å; F664-I673 HydrophobicContact CD2-CD1 3.8Å; F664-I673 HydrophobicContact CE1-CD1 3.71Å; F664-I673 HydrophobicContact CE2-CD1 3.52Å; F664-I673 HydrophobicContact CE2-CG2 4.48Å; F664-I673 HydrophobicContact CG-CD1 4.03Å; F664-I673 HydrophobicContact CZ-CD1 3.48Å; F664-I673 VanDerWaalsContact CZ-CD1 3.48Å; N669-I673 VanDerWaalsContact O-CG1 3.32Å; N669-I673 WeakPolarHBondContact O-CG1 3.24Å; N669-I673 PolarHBondContact O-N 3.05Å; G670-I673 PolarHBondContact O-N 3.47Å; T671-I673 PolarHBondContact O-N 2.98Å; I673-Q675 VanDerWaalsContact C-N 3.33Å; I673-Q675 PolarHBondContact O-N 3.29Å; I673-G676 PolarHBondContact O-N 3.3Å; I673-A677 WeakPolarHBondContact O-CB 3.38Å; I673-A677 PolarHBondContact O-N 3.32Å
674	I	89.4	Confident	87.9	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-58.9	-47.2	174.7	-70.2	162.8	0	0	0	109.8	V660 M661 G670 T671 G676 A677 L678 P721	V660-I674 HydrophobicContact CB-CD1 4.25Å; V660-I674 HydrophobicContact CB-CG1 3.96Å; V660-I674 HydrophobicContact CG1-CD1 4.14Å; V660-I674 HydrophobicContact CG1-CG1 3.81Å; V660-I674 HydrophobicContact CG2-CG1 4.29Å; M661-I674 HydrophobicContact CG-CD1 4.03Å; M661-I674 HydrophobicContact SD-CD1 4.09Å; G670-I674 WeakPolarHBondContact O-CG1 3.28Å; G670-I674 PolarHBondContact O-N 2.91Å; T671-I674 PolarHBondContact O-N 3.37Å; I674-G676 VanDerWaalsContact C-N 3.33Å; I674-G676 PolarHBondContact O-N 3.5Å; I674-A677 PolarHBondContact O-N 2.89Å; I674-L678 HydrophobicContact CG2-CD1 3.65Å; I674-L678 HydrophobicContact CG2-CG 4.11Å; I674-L678 WeakPolarHBondContact O-CB 3.22Å; I674-L678 WeakPolarHBondContact O-CG 3.39Å; I674-L678 PolarHBondContact O-N 2.83Å; I674-P721 HydrophobicContact CD1-CG 3.8Å
675	Q	88.6	Confident	88	Confident	75 Å²	75	42.4 Å²	42.4	35%	0.35	22%	0.218	S	C	.	.	H	α-helix	trans	-61.5	-41.1	178.5	-71.5	-175.4	21.7	0	0	112.3	T671 S672 I673 T679 K720	T671-Q675 VanDerWaalsContact O-CG 3.29Å; T671-Q675 WeakPolarHBondContact O-CG 3.48Å; T671-Q675 PolarHBondContact O-N 3.08Å; S672-Q675 PolarHBondContact O-N 3.12Å; I673-Q675 VanDerWaalsContact C-N 3.33Å; I673-Q675 PolarHBondContact O-N 3.29Å; Q675-T679 VanDerWaalsContact O-CB 3.27Å; Q675-T679 WeakPolarHBondContact O-CB 3.37Å; Q675-T679 PolarHBondContact O-N 2.97Å; Q675-T679 PolarHBondContact O-OG1 2.84Å; Q675-K720 HydrophobicContact CG-CD 4.13Å; Q675-K720 HydrophobicContact CG-CG 4.3Å
676	G	90	Very high	88.7	Confident	25 Å²	25	43.4 Å²	43.4	26%	0.258	22%	0.217	S	C	.	.	H	α-helix	trans	-60.5	-49.8	174.2	0	0	0	0	0	111.9	S672 I673 I674 L678 T679 Q680	S672-G676 PolarHBondContact O-N 3.5Å; I673-G676 PolarHBondContact O-N 3.3Å; I674-G676 VanDerWaalsContact C-N 3.33Å; I674-G676 PolarHBondContact O-N 3.5Å; G676-L678 PolarHBondContact O-N 3.3Å; G676-T679 PolarHBondContact O-N 2.93Å; G676-Q680 WeakPolarHBondContact O-CB 3.39Å; G676-Q680 PolarHBondContact O-N 3.04Å
677	A	90.2	Very high	89.1	Confident	2 Å²	2	44.6 Å²	44.6	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-61	-45	178.2	0	0	0	0	0	112.9	I601 L605 L656 I673 I674 T679 Q680 L681	I601-A677 HydrophobicContact CG1-CB 4.39Å; I601-A677 VanDerWaalsContact CG2-CA 3.5Å; I601-A677 HydrophobicContact CG2-CB 3.86Å; L605-A677 HydrophobicContact CD2-CB 4.47Å; L656-A677 HydrophobicContact CD2-CB 4.25Å; I673-A677 WeakPolarHBondContact O-CB 3.38Å; I673-A677 PolarHBondContact O-N 3.32Å; I674-A677 PolarHBondContact O-N 2.89Å; A677-T679 VanDerWaalsContact C-N 3.33Å; A677-T679 PolarHBondContact O-N 3.49Å; A677-Q680 PolarHBondContact O-N 3.48Å; A677-L681 WeakPolarHBondContact O-CB 3.31Å; A677-L681 PolarHBondContact O-N 2.94Å
678	L	89.9	Confident	89.6	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.026	20%	0.195	C	C	.	.	H	α-helix	trans	-64.1	-40.1	176.3	-65.1	173.8	0	0	0	111.5	V653 I674 G676 L681 I682 L716 K720	V653-L678 HydrophobicContact CG1-CD2 3.74Å; I674-L678 HydrophobicContact CG2-CD1 3.65Å; I674-L678 HydrophobicContact CG2-CG 4.11Å; I674-L678 WeakPolarHBondContact O-CB 3.22Å; I674-L678 WeakPolarHBondContact O-CG 3.39Å; I674-L678 PolarHBondContact O-N 2.83Å; G676-L678 PolarHBondContact O-N 3.3Å; L678-L681 PolarHBondContact O-N 3.05Å; L678-I682 WeakPolarHBondContact O-CD1 3.46Å; L678-I682 VanDerWaalsContact O-CG1 3.23Å; L678-I682 WeakPolarHBondContact O-CG1 3.3Å; L678-I682 PolarHBondContact O-N 3.25Å; L678-L716 HydrophobicContact CD2-CB 4.15Å; L678-L716 HydrophobicContact CD2-CD1 4.47Å; L678-L716 HydrophobicContact CD2-CD2 3.71Å; L678-L716 HydrophobicContact CD2-CG 4.29Å; L678-K720 HydrophobicContact CD1-CG 4.08Å
679	T	90.4	Very high	89.8	Confident	63 Å²	63	32.3 Å²	32.3	39%	0.387	17%	0.169	S	C	.	.	H	α-helix	trans	-65.5	-45.7	178.1	-58.8	0	0	0	0	110.9	Q675 G676 A677 L681 I682 Q683	Q675-T679 VanDerWaalsContact O-CB 3.27Å; Q675-T679 WeakPolarHBondContact O-CB 3.37Å; Q675-T679 PolarHBondContact O-N 2.97Å; Q675-T679 PolarHBondContact O-OG1 2.84Å; G676-T679 PolarHBondContact O-N 2.93Å; A677-T679 VanDerWaalsContact C-N 3.33Å; A677-T679 PolarHBondContact O-N 3.49Å; T679-L681 VanDerWaalsContact C-N 3.34Å; T679-L681 PolarHBondContact O-N 2.82Å; T679-I682 PolarHBondContact O-N 2.89Å; T679-Q683 VanDerWaalsContact O-CG 3.32Å; T679-Q683 WeakPolarHBondContact O-CG 3.32Å; T679-Q683 PolarHBondContact O-N 3.39Å
680	Q	91.2	Very high	90	Very high	31 Å²	31	40 Å²	40	15%	0.145	20%	0.197	C	C	.	.	H	α-helix	trans	-63.7	-39.8	176.8	-174.7	165.4	-5.8	0	0	111.8	I601 L605 G676 A677 Q683 V684	I601-Q680 HydrophobicContact CG2-CB 4.36Å; L605-Q680 HydrophobicContact CD1-CB 4.05Å; L605-Q680 HydrophobicContact CD1-CG 4.02Å; G676-Q680 WeakPolarHBondContact O-CB 3.39Å; G676-Q680 PolarHBondContact O-N 3.04Å; A677-Q680 PolarHBondContact O-N 3.48Å; Q680-Q683 PolarHBondContact O-N 3.28Å; Q680-V684 VanDerWaalsContact O-CG2 3.29Å; Q680-V684 WeakPolarHBondContact O-CG2 3.32Å; Q680-V684 PolarHBondContact O-N 3.45Å
681	L	90.8	Very high	90	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.016	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-45.6	174	-177.8	61.7	0	0	0	111.9	L605 F609 F645 V653 A677 L678 T679 Q683 V684 Y685 L716	L605-L681 HydrophobicContact CD2-CB 4.39Å; F609-L681 HydrophobicContact CB-CD1 4.31Å; F609-L681 HydrophobicContact CD1-CD1 3.97Å; F609-L681 HydrophobicContact CD2-CD1 3.73Å; F609-L681 HydrophobicContact CD2-CD2 4.45Å; F609-L681 HydrophobicContact CE1-CD1 4.2Å; F609-L681 HydrophobicContact CE2-CD1 3.97Å; F609-L681 HydrophobicContact CE2-CD2 3.87Å; F609-L681 HydrophobicContact CG-CD1 3.73Å; F609-L681 HydrophobicContact CZ-CD1 4.2Å; F609-L681 HydrophobicContact CZ-CD2 3.91Å; F645-L681 HydrophobicContact CE2-CD1 4.26Å; V653-L681 HydrophobicContact CG2-CD2 3.9Å; A677-L681 WeakPolarHBondContact O-CB 3.31Å; A677-L681 PolarHBondContact O-N 2.94Å; L678-L681 PolarHBondContact O-N 3.05Å; T679-L681 VanDerWaalsContact C-N 3.34Å; T679-L681 PolarHBondContact O-N 2.82Å; L681-Q683 VanDerWaalsContact C-N 3.33Å; L681-Q683 PolarHBondContact O-N 3.42Å; L681-V684 PolarHBondContact O-N 3.04Å; L681-Y685 WeakPolarHBondContact O-CB 3.43Å; L681-Y685 PolarHBondContact O-N 3.43Å; L681-L716 HydrophobicContact CD2-CD1 4.35Å; L681-L716 HydrophobicContact CD2-CD2 4.46Å
682	I	89.8	Confident	89.9	Confident	38 Å²	38	39.7 Å²	39.7	20%	0.195	20%	0.195	C	C	.	.	H	α-helix	trans	-60.6	-44.3	176	-69	161.7	0	0	0	110.5	L678 T679 Y685 H686 M713 L716	L678-I682 WeakPolarHBondContact O-CD1 3.46Å; L678-I682 VanDerWaalsContact O-CG1 3.23Å; L678-I682 WeakPolarHBondContact O-CG1 3.3Å; L678-I682 PolarHBondContact O-N 3.25Å; T679-I682 PolarHBondContact O-N 2.89Å; I682-Y685 PolarHBondContact O-N 2.99Å; I682-H686 VanDerWaalsContact O-CB 3.32Å; I682-H686 WeakPolarHBondContact O-CB 3.12Å; I682-H686 PolarHBondContact O-N 3.38Å; I682-M713 HydrophobicContact CD1-CG 4.11Å; I682-M713 HydrophobicContact CG1-CG 4.35Å; I682-M713 HydrophobicContact CG2-CG 4.12Å; I682-M713 HydrophobicContact CG2-SD 4.49Å; I682-L716 HydrophobicContact CD1-CD1 3.91Å; I682-L716 HydrophobicContact CG1-CD1 3.53Å
683	Q	90.9	Very high	89.8	Confident	109 Å²	109	39.4 Å²	39.4	51%	0.509	19%	0.193	S	C	.	.	H	α-helix	trans	-63.2	-43.9	178.4	-72.3	174.6	3.3	0	0	112	T679 Q680 L681 H686 R687	T679-Q683 VanDerWaalsContact O-CG 3.32Å; T679-Q683 WeakPolarHBondContact O-CG 3.32Å; T679-Q683 PolarHBondContact O-N 3.39Å; Q680-Q683 PolarHBondContact O-N 3.28Å; L681-Q683 VanDerWaalsContact C-N 3.33Å; L681-Q683 PolarHBondContact O-N 3.42Å; Q683-H686 PolarHBondContact O-N 2.74Å; Q683-R687 WeakPolarHBondContact O-CB 3.19Å; Q683-R687 WeakPolarHBondContact O-CG 3.38Å; Q683-R687 PolarHBondContact O-N 2.95Å
684	V	90.6	Very high	89.6	Confident	4 Å²	4	42 Å²	42	2%	0.024	21%	0.205	C	C	.	.	H	α-helix	trans	-61.8	-44.9	175.1	171	0	0	0	0	110.4	L612 V613 V616 Q680 L681 H686 R687 F688	L612-V684 HydrophobicContact CD2-CG1 4.02Å; L612-V684 HydrophobicContact CG-CG1 4.15Å; V613-V684 HydrophobicContact CG2-CG1 3.93Å; V613-V684 HydrophobicContact CG2-CG2 4.15Å; V616-V684 HydrophobicContact CG2-CG1 4.41Å; Q680-V684 VanDerWaalsContact O-CG2 3.29Å; Q680-V684 WeakPolarHBondContact O-CG2 3.32Å; Q680-V684 PolarHBondContact O-N 3.45Å; L681-V684 PolarHBondContact O-N 3.04Å; V684-H686 PolarHBondContact O-N 3.44Å; V684-R687 PolarHBondContact O-N 3.39Å; V684-F688 WeakPolarHBondContact O-CB 3.22Å; V684-F688 PolarHBondContact O-N 2.99Å
685	Y	91.4	Very high	89.1	Confident	3 Å²	3	46.3 Å²	46.3	1%	0.012	23%	0.233	C	C	.	.	H	α-helix	trans	-67.8	-35.6	180	-167.8	-106.2	0	0	0	112.8	L612 F645 L681 I682 F688 H689 I707 I709 L712	L612-Y685 HydrophobicContact CD2-CD2 4.39Å; F645-Y685 HydrophobicContact CD1-CD2 4.2Å; F645-Y685 AromaticContact CD1-CE2 3.63Å; F645-Y685 HydrophobicContact CD1-CE2 3.63Å; F645-Y685 AromaticContact CE1-CD2 3.73Å; F645-Y685 HydrophobicContact CE1-CD2 3.73Å; F645-Y685 AromaticContact CE1-CE2 3.4Å; F645-Y685 HydrophobicContact CE1-CE2 3.4Å; F645-Y685 AromaticContact CE1-CZ 3.94Å; F645-Y685 HydrophobicContact CE2-CD2 4.32Å; F645-Y685 HydrophobicContact CG-CE2 4.38Å; F645-Y685 AromaticContact CZ-CD2 3.8Å; F645-Y685 HydrophobicContact CZ-CD2 3.8Å; F645-Y685 AromaticContact CZ-CE2 3.98Å; F645-Y685 HydrophobicContact CZ-CE2 3.98Å; F645-Y685 HydrophobicContact CZ-CG 4.41Å; L681-Y685 WeakPolarHBondContact O-CB 3.43Å; L681-Y685 PolarHBondContact O-N 3.43Å; I682-Y685 PolarHBondContact O-N 2.99Å; Y685-F688 HydrophobicContact CD2-CD1 4.37Å; Y685-F688 HydrophobicContact CE2-CD1 4.29Å; Y685-F688 WeakPolarHBondContact O-CB 3.41Å; Y685-F688 PolarHBondContact O-N 3.26Å; Y685-H689 AromaticContact CD1-CD2 3.87Å; Y685-H689 AromaticContact CE1-CD2 3.46Å; Y685-H689 VanDerWaalsContact CE1-CD2 3.46Å; Y685-H689 WeakPolarHBondContact CE1-CD2 3.45Å; Y685-H689 AromaticContact CE1-NE2 3.37Å; Y685-H689 WeakPolarHBondContact CE1-NE2 3.29Å; Y685-H689 AromaticContact CZ-CD2 3.76Å; Y685-H689 AromaticContact CZ-NE2 3.52Å; Y685-H689 PolarHBondContact O-N 3.14Å; Y685-H689 PolarHBondContact OH-NE2 2.82Å; Y685-I707 WeakPolarHBondContact CE1-O 3.44Å; Y685-I707 WeakPolarHBondContact OH-CA 3.37Å; Y685-I707 WeakPolarHBondContact OH-CB 3.4Å; Y685-I707 PolarHBondContact OH-N 3.34Å; Y685-I707 PolarHBondContact OH-O 3.09Å; Y685-I709 HydrophobicContact CD1-CG1 4.04Å; Y685-I709 HydrophobicContact CE1-CG1 3.98Å; Y685-L712 HydrophobicContact CD1-CD2 3.35Å; Y685-L712 HydrophobicContact CD2-CD2 4.45Å; Y685-L712 HydrophobicContact CE1-CD2 3.88Å; Y685-L712 HydrophobicContact CG-CD2 3.67Å
686	H	90.8	Very high	88.8	Confident	109 Å²	109	44.2 Å²	44.2	51%	0.505	22%	0.223	S	C	.	.	H	α-helix	trans	-65.2	-44	172.9	-173.7	-82.3	0	0	0	111.5	I682 Q683 V684 F688 H689 R690	I682-H686 VanDerWaalsContact O-CB 3.32Å; I682-H686 WeakPolarHBondContact O-CB 3.12Å; I682-H686 PolarHBondContact O-N 3.38Å; Q683-H686 PolarHBondContact O-N 2.74Å; V684-H686 PolarHBondContact O-N 3.44Å; H686-F688 VanDerWaalsContact C-N 3.33Å; H686-F688 PolarHBondContact O-N 3.29Å; H686-H689 PolarHBondContact O-N 3.26Å; H686-R690 PolarHBondContact O-N 2.82Å
687	R	92	Very high	88.3	Confident	78 Å²	78	43 Å²	43	29%	0.294	21%	0.211	S	C	.	.	H	α-helix	trans	-62	-40.4	173.3	-73.9	-173.7	-68.6	166.1	-9.2	111.9	V616 E620 Q683 V684 H689 R690 V691	V616-R687 HydrophobicContact CG1-CB 3.64Å; E620-R687 VanDerWaalsContact OE1-CD 3.29Å; E620-R687 WeakPolarHBondContact OE1-CD 3.29Å; E620-R687 WeakPolarHBondContact OE1-CG 3.37Å; E620-R687 IonicContact OE2-NH1 3.95Å; E620-R687 PolarHBondContact OE2-NH1 3.5Å; Q683-R687 WeakPolarHBondContact O-CB 3.19Å; Q683-R687 WeakPolarHBondContact O-CG 3.38Å; Q683-R687 PolarHBondContact O-N 2.95Å; V684-R687 PolarHBondContact O-N 3.39Å; R687-H689 PolarHBondContact O-N 3.24Å; R687-R690 WeakPolarHBondContact O-CB 3.33Å; R687-R690 PolarHBondContact O-N 3.02Å; R687-R690 VanDerWaalsContact O-N 3.12Å; R687-V691 WeakPolarHBondContact O-CG2 3.46Å; R687-V691 PolarHBondContact O-N 3.43Å
688	F	91.8	Very high	87.8	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.9	-47.5	173	-175.8	-119.5	0	0	0	112.1	L612 F615 V616 L641 I642 V684 Y685 H686 R690 V691 L692 L706	L612-F688 HydrophobicContact CD1-CB 4.22Å; L612-F688 HydrophobicContact CD1-CD1 3.7Å; L612-F688 HydrophobicContact CD1-CD2 3.59Å; L612-F688 HydrophobicContact CD1-CE1 3.8Å; L612-F688 HydrophobicContact CD1-CE2 3.71Å; L612-F688 HydrophobicContact CD1-CG 3.58Å; L612-F688 HydrophobicContact CD1-CZ 3.8Å; F615-F688 AromaticContact CD1-CD2 3.72Å; F615-F688 HydrophobicContact CD1-CD2 3.72Å; F615-F688 AromaticContact CD1-CE2 3.48Å; F615-F688 HydrophobicContact CD1-CE2 3.48Å; F615-F688 VanDerWaalsContact CD1-CE2 3.48Å; F615-F688 AromaticContact CE1-CD2 3.85Å; F615-F688 HydrophobicContact CE1-CD2 3.85Å; F615-F688 AromaticContact CE1-CE2 3.53Å; F615-F688 HydrophobicContact CE1-CE2 3.53Å; V616-F688 HydrophobicContact CG2-CB 3.61Å; V616-F688 HydrophobicContact CG2-CD2 3.81Å; V616-F688 HydrophobicContact CG2-CG 4.18Å; L641-F688 HydrophobicContact CB-CZ 4.35Å; I642-F688 HydrophobicContact CG1-CE1 3.94Å; I642-F688 HydrophobicContact CG1-CZ 3.94Å; V684-F688 WeakPolarHBondContact O-CB 3.22Å; V684-F688 PolarHBondContact O-N 2.99Å; Y685-F688 HydrophobicContact CD2-CD1 4.37Å; Y685-F688 HydrophobicContact CE2-CD1 4.29Å; Y685-F688 WeakPolarHBondContact O-CB 3.41Å; Y685-F688 PolarHBondContact O-N 3.26Å; H686-F688 VanDerWaalsContact C-N 3.33Å; H686-F688 PolarHBondContact O-N 3.29Å; F688-R690 VanDerWaalsContact C-N 3.28Å; F688-R690 PolarHBondContact O-N 3.35Å; F688-V691 PolarHBondContact O-N 3.2Å; F688-L692 HydrophobicContact CD1-CD1 3.89Å; F688-L692 HydrophobicContact CD2-CG 4.42Å; F688-L692 HydrophobicContact CE1-CD1 3.51Å; F688-L692 HydrophobicContact CE1-CG 4.33Å; F688-L692 HydrophobicContact CE2-CD1 4.22Å; F688-L692 HydrophobicContact CE2-CD2 4.23Å; F688-L692 HydrophobicContact CE2-CG 4.23Å; F688-L692 HydrophobicContact CG-CD1 4.42Å; F688-L692 HydrophobicContact CZ-CD1 3.7Å; F688-L692 HydrophobicContact CZ-CD2 4.27Å; F688-L692 HydrophobicContact CZ-CG 4.19Å; F688-L692 VanDerWaalsContact O-CG 3.31Å; F688-L692 WeakPolarHBondContact O-CG 3.28Å; F688-L692 PolarHBondContact O-N 3.07Å; F688-L706 HydrophobicContact CE1-CD2 4.04Å
689	H	88.9	Confident	87.1	Confident	39 Å²	39	55.8 Å²	55.8	18%	0.181	28%	0.279	C	S	.	.	H	α-helix	trans	-57.7	-39.2	173.7	-97.5	-94.4	0	0	0	113.1	Y685 H686 R687 L692 S693 I707 I709	Y685-H689 AromaticContact CD1-CD2 3.87Å; Y685-H689 AromaticContact CE1-CD2 3.46Å; Y685-H689 VanDerWaalsContact CE1-CD2 3.46Å; Y685-H689 WeakPolarHBondContact CE1-CD2 3.45Å; Y685-H689 AromaticContact CE1-NE2 3.37Å; Y685-H689 WeakPolarHBondContact CE1-NE2 3.29Å; Y685-H689 AromaticContact CZ-CD2 3.76Å; Y685-H689 AromaticContact CZ-NE2 3.52Å; Y685-H689 PolarHBondContact O-N 3.14Å; Y685-H689 PolarHBondContact OH-NE2 2.82Å; H686-H689 PolarHBondContact O-N 3.26Å; R687-H689 PolarHBondContact O-N 3.24Å; H689-L692 PolarHBondContact O-N 3.4Å; H689-S693 PolarHBondContact O-N 2.87Å; H689-S693 VanDerWaalsContact O-N 3.14Å; H689-S693 PolarHBondContact O-OG 3.33Å; H689-I707 PolarHBondContact NE2-O 3.41Å; H689-I709 HydrophobicContact CB-CD1 3.94Å
690	R	88.3	Confident	86.7	Confident	176 Å²	176	53.4 Å²	53.4	66%	0.664	26%	0.264	S	S	*	.	H	α-helix	trans	-64.5	-45.1	176	-171.5	-177.7	-178.9	-174.4	0.4	111.7	H686 R687 F688 S693	H686-R690 PolarHBondContact O-N 2.82Å; R687-R690 WeakPolarHBondContact O-CB 3.33Å; R687-R690 PolarHBondContact O-N 3.02Å; R687-R690 VanDerWaalsContact O-N 3.12Å; F688-R690 VanDerWaalsContact C-N 3.28Å; F688-R690 PolarHBondContact O-N 3.35Å; R690-S693 WeakPolarHBondContact O-CB 3.38Å; R690-S693 PolarHBondContact O-N 2.97Å; R690-S693 VanDerWaalsContact O-N 3.15Å
691	V	88.4	Confident	86.2	Confident	3 Å²	3	57 Å²	57	2%	0.018	29%	0.29	C	S	.	.	H	α-helix	trans	-61	-43.7	175.2	170	0	0	0	0	111	F615 A619 E620 I623 R687 F688 S693 Q694 L697	F615-V691 HydrophobicContact CE1-CG1 3.9Å; F615-V691 HydrophobicContact CZ-CG1 4.18Å; A619-V691 HydrophobicContact CB-CB 4.48Å; A619-V691 HydrophobicContact CB-CG1 3.45Å; A619-V691 VanDerWaalsContact CB-CG1 3.45Å; A619-V691 HydrophobicContact CB-CG2 4.19Å; E620-V691 HydrophobicContact CG-CG2 3.94Å; I623-V691 HydrophobicContact CD1-CG2 4.31Å; R687-V691 WeakPolarHBondContact O-CG2 3.46Å; R687-V691 PolarHBondContact O-N 3.43Å; F688-V691 PolarHBondContact O-N 3.2Å; V691-S693 PolarHBondContact O-N 2.95Å; V691-S693 VanDerWaalsContact O-N 3.17Å; V691-Q694 VanDerWaalsContact O-CB 3.3Å; V691-Q694 WeakPolarHBondContact O-CB 3.36Å; V691-Q694 VanDerWaalsContact O-CG 3.22Å; V691-Q694 WeakPolarHBondContact O-CG 3.4Å; V691-Q694 PolarHBondContact O-N 3.39Å; V691-Q694 VanDerWaalsContact O-N 3.12Å; V691-L697 HydrophobicContact CG1-CD1 4.18Å
692	L	85.9	Confident	85.7	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-68.1	-12.6	177.7	-65.7	-175.9	0	0	0	114.1	V638 I642 F688 H689 Q694 L697 R703 L706	V638-L692 HydrophobicContact CG1-CD2 3.45Å; V638-L692 VanDerWaalsContact CG1-CD2 3.45Å; V638-L692 HydrophobicContact CG2-CD2 4.43Å; I642-L692 HydrophobicContact CD1-CD1 4Å; I642-L692 HydrophobicContact CG1-CD1 4.4Å; F688-L692 HydrophobicContact CD1-CD1 3.89Å; F688-L692 HydrophobicContact CD2-CG 4.42Å; F688-L692 HydrophobicContact CE1-CD1 3.51Å; F688-L692 HydrophobicContact CE1-CG 4.33Å; F688-L692 HydrophobicContact CE2-CD1 4.22Å; F688-L692 HydrophobicContact CE2-CD2 4.23Å; F688-L692 HydrophobicContact CE2-CG 4.23Å; F688-L692 HydrophobicContact CG-CD1 4.42Å; F688-L692 HydrophobicContact CZ-CD1 3.7Å; F688-L692 HydrophobicContact CZ-CD2 4.27Å; F688-L692 HydrophobicContact CZ-CG 4.19Å; F688-L692 VanDerWaalsContact O-CG 3.31Å; F688-L692 WeakPolarHBondContact O-CG 3.28Å; F688-L692 PolarHBondContact O-N 3.07Å; H689-L692 PolarHBondContact O-N 3.4Å; L692-Q694 VanDerWaalsContact C-N 3.29Å; L692-L697 HydrophobicContact CD2-CB 4.5Å; L692-L697 HydrophobicContact CD2-CD1 4.14Å; L692-R703 PolarHBondContact O-NE 2.72Å; L692-R703 PolarHBondContact O-NH2 3.06Å; L692-L706 HydrophobicContact CD1-CD1 3.75Å; L692-L706 HydrophobicContact CD1-CD2 3.77Å; L692-L706 HydrophobicContact CD1-CG 4.32Å
693	S	85.4	Confident	85.3	Confident	64 Å²	64	58.1 Å²	58.1	45%	0.448	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-6.7	175.4	-59.6	0	0	0	0	113	H689 R690 V691	H689-S693 PolarHBondContact O-N 2.87Å; H689-S693 VanDerWaalsContact O-N 3.14Å; H689-S693 PolarHBondContact O-OG 3.33Å; R690-S693 WeakPolarHBondContact O-CB 3.38Å; R690-S693 PolarHBondContact O-N 2.97Å; R690-S693 VanDerWaalsContact O-N 3.15Å; V691-S693 PolarHBondContact O-N 2.95Å; V691-S693 VanDerWaalsContact O-N 3.17Å
694	Q	86.3	Confident	84.8	Confident	54 Å²	54	57.6 Å²	57.6	25%	0.252	31%	0.306	S	S	.	.	S	Bend	trans	-65.3	145.1	175.9	-66.7	-64.5	-15.5	0	0	111.7	I623 V691 L692 Q696 L697 R698	I623-Q694 HydrophobicContact CD1-CG 3.78Å; I623-Q694 HydrophobicContact CG1-CG 4.41Å; V691-Q694 VanDerWaalsContact O-CB 3.3Å; V691-Q694 WeakPolarHBondContact O-CB 3.36Å; V691-Q694 VanDerWaalsContact O-CG 3.22Å; V691-Q694 WeakPolarHBondContact O-CG 3.4Å; V691-Q694 PolarHBondContact O-N 3.39Å; V691-Q694 VanDerWaalsContact O-N 3.12Å; L692-Q694 VanDerWaalsContact C-N 3.29Å; Q694-Q696 PolarHBondContact O-N 2.91Å; Q694-Q696 VanDerWaalsContact O-N 3.09Å; Q694-L697 PolarHBondContact O-N 3.38Å; Q694-R698 WeakPolarHBondContact O-CB 3.41Å; Q694-R698 PolarHBondContact O-N 3.35Å
695	P	80.3	Confident	84.5	Confident	92 Å²	92	61.7 Å²	61.7	60%	0.597	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-37.5	-176	-27	33.9	0	0	0	114.3	L697 R698	P695-L697 VanDerWaalsContact C-N 3.31Å; P695-L697 PolarHBondContact O-N 3.15Å; P695-R698 PolarHBondContact O-N 3.49Å
696	Q	81.7	Confident	84.2	Confident	30 Å²	30	63 Å²	63	14%	0.14	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-27.4	-176.1	-63.1	80.5	6.4	0	0	113.3	A628 E629 L631 R632 Q694	A628-Q696 WeakPolarHBondContact O-CG 3.34Å; E629-Q696 PolarHBondContact OE1-NE2 3.27Å; L631-Q696 HydrophobicContact CB-CB 4.31Å; R632-Q696 HydrophobicContact CG-CB 3.88Å; R632-Q696 HydrophobicContact CG-CG 4.2Å; Q694-Q696 PolarHBondContact O-N 2.91Å; Q694-Q696 VanDerWaalsContact O-N 3.09Å
697	L	80.4	Confident	84	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-3.9	179.9	-63.9	172.7	0	0	0	112	F615 L631 E635 V638 V691 L692 Q694 P695 A699 L700 R703	F615-L697 HydrophobicContact CZ-CD1 4.16Å; L631-L697 HydrophobicContact CB-CD1 4.15Å; L631-L697 HydrophobicContact CB-CD2 4.37Å; L631-L697 HydrophobicContact CB-CG 4.13Å; L631-L697 HydrophobicContact CD1-CD1 4.31Å; L631-L697 WeakPolarHBondContact O-CD2 3.31Å; E635-L697 HydrophobicContact CG-CD2 4.48Å; V638-L697 HydrophobicContact CG2-CD2 4.38Å; V691-L697 HydrophobicContact CG1-CD1 4.18Å; L692-L697 HydrophobicContact CD2-CB 4.5Å; L692-L697 HydrophobicContact CD2-CD1 4.14Å; Q694-L697 PolarHBondContact O-N 3.38Å; P695-L697 VanDerWaalsContact C-N 3.31Å; P695-L697 PolarHBondContact O-N 3.15Å; L697-A699 VanDerWaalsContact C-N 3.27Å; L697-A699 PolarHBondContact O-N 3.33Å; L697-L700 HydrophobicContact CB-CD1 3.97Å; L697-L700 HydrophobicContact CD2-CD1 3.52Å; L697-L700 HydrophobicContact CG-CD1 4.35Å; L697-L700 WeakPolarHBondContact O-CB 3.48Å; L697-L700 PolarHBondContact O-N 3.4Å; L697-R703 WeakPolarHBondContact O-CD 3.37Å
698	R	77.9	Confident	83.8	Confident	178 Å²	178	59.9 Å²	59.9	67%	0.672	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-31.5	-170.9	-169.2	173.3	179.1	162	-0.9	112.9	Q694 P695 R703	Q694-R698 WeakPolarHBondContact O-CB 3.41Å; Q694-R698 PolarHBondContact O-N 3.35Å; P695-R698 PolarHBondContact O-N 3.49Å; R698-R703 PolarHBondContact O-NH1 2.97Å
699	A	76.9	Confident	83.4	Confident	97 Å²	97	61.4 Å²	61.4	80%	0.802	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	1.3	-176.2	0	0	0	0	0	114.6	L697	L697-A699 VanDerWaalsContact C-N 3.27Å; L697-A699 PolarHBondContact O-N 3.33Å
700	L	81.1	Confident	83.1	Confident	13 Å²	13	66.4 Å²	66.4	7%	0.068	36%	0.355	C	S	.	.			trans	-64.3	123.6	179.5	-96.6	148	0	0	0	111.9	E635 V638 L697 A702 R703	E635-L700 HydrophobicContact CB-CD1 4.48Å; E635-L700 HydrophobicContact CB-CD2 3.94Å; E635-L700 HydrophobicContact CB-CG 4.45Å; E635-L700 HydrophobicContact CG-CD1 4Å; E635-L700 HydrophobicContact CG-CD2 4.09Å; E635-L700 HydrophobicContact CG-CG 4.05Å; V638-L700 HydrophobicContact CB-CD1 4.43Å; V638-L700 HydrophobicContact CG1-CD1 4.03Å; L697-L700 HydrophobicContact CB-CD1 3.97Å; L697-L700 HydrophobicContact CD2-CD1 3.52Å; L697-L700 HydrophobicContact CG-CD1 4.35Å; L697-L700 WeakPolarHBondContact O-CB 3.48Å; L697-L700 PolarHBondContact O-N 3.4Å; L700-A702 VanDerWaalsContact C-N 3.26Å; L700-A702 PolarHBondContact O-N 3.06Å; L700-R703 HydrophobicContact CB-CG 4.02Å; L700-R703 WeakPolarHBondContact O-CB 3.46Å; L700-R703 WeakPolarHBondContact O-CG 3.49Å; L700-R703 PolarHBondContact O-N 3.49Å
701	P	79.9	Confident	82.9	Confident	108 Å²	108	62 Å²	62	70%	0.701	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-64.6	-30.5	179.3	23.7	-32.2	0	0	0	112.7	R703 A704	P701-R703 PolarHBondContact O-N 3.37Å; P701-A704 PolarHBondContact O-N 2.87Å
702	A	80.9	Confident	82.7	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.008	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-60.6	-16.8	177.5	0	0	0	0	0	113.7	T639 I642 L700 A704 E705	T639-A702 HydrophobicContact CG2-CB 3.74Å; I642-A702 HydrophobicContact CD1-CB 4.13Å; I642-A702 WeakPolarHBondContact CG2-O 3.35Å; L700-A702 VanDerWaalsContact C-N 3.26Å; L700-A702 PolarHBondContact O-N 3.06Å; A702-A704 PolarHBondContact O-N 3.34Å; A702-E705 WeakPolarHBondContact O-CB 3.48Å; A702-E705 PolarHBondContact O-N 3.24Å
703	R	81.8	Confident	82.6	Confident	63 Å²	63	65.3 Å²	65.3	24%	0.238	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-64.1	-25.2	176.4	-67.2	-176.4	70.2	-155.1	8.8	113.3	L692 L697 R698 L700 P701 E705 L706	L692-R703 PolarHBondContact O-NE 2.72Å; L692-R703 PolarHBondContact O-NH2 3.06Å; L697-R703 WeakPolarHBondContact O-CD 3.37Å; R698-R703 PolarHBondContact O-NH1 2.97Å; L700-R703 HydrophobicContact CB-CG 4.02Å; L700-R703 WeakPolarHBondContact O-CB 3.46Å; L700-R703 WeakPolarHBondContact O-CG 3.49Å; L700-R703 PolarHBondContact O-N 3.49Å; P701-R703 PolarHBondContact O-N 3.37Å; R703-E705 PolarHBondContact O-N 3.31Å; R703-L706 HydrophobicContact CB-CD1 4.01Å; R703-L706 HydrophobicContact CG-CD1 4.22Å; R703-L706 VanDerWaalsContact O-CB 3.3Å; R703-L706 WeakPolarHBondContact O-CB 3.36Å; R703-L706 WeakPolarHBondContact O-CD1 3.3Å; R703-L706 WeakPolarHBondContact O-CG 3.47Å; R703-L706 PolarHBondContact O-N 3.19Å; R703-L706 VanDerWaalsContact O-N 3.16Å
704	A	80.1	Confident	82.5	Confident	97 Å²	97	66.3 Å²	66.3	80%	0.802	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-64.6	-21.1	174.6	0	0	0	0	0	112.5	P701 A702	P701-A704 PolarHBondContact O-N 2.87Å; A702-A704 PolarHBondContact O-N 3.34Å
705	E	83.9	Confident	82.2	Confident	90 Å²	90	65.4 Å²	65.4	42%	0.421	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-91	2.6	179.1	-55.7	172.4	-154.4	0	0	112.3	I642 R643 A702 R703 I707	I642-E705 HydrophobicContact CG2-CB 4.12Å; R643-E705 WeakPolarHBondContact CD-OE2 3.49Å; R643-E705 WeakPolarHBondContact CG-OE2 3.31Å; R643-E705 IonicContact CZ-OE1 3.66Å; R643-E705 IonicContact CZ-OE2 3.49Å; R643-E705 IonicContact NE-OE1 2.72Å; R643-E705 PolarHBondContact NE-OE1 3.33Å; R643-E705 IonicContact NE-OE2 3.31Å; R643-E705 PolarHBondContact NE-OE2 3.06Å; R643-E705 IonicContact NH2-OE1 2.89Å; R643-E705 PolarHBondContact NH2-OE1 3.24Å; R643-E705 IonicContact NH2-OE2 2.8Å; A702-E705 WeakPolarHBondContact O-CB 3.48Å; A702-E705 PolarHBondContact O-N 3.24Å; R703-E705 PolarHBondContact O-N 3.31Å; E705-I707 PolarHBondContact O-N 2.9Å
706	L	86.1	Confident	82.2	Confident	31 Å²	31	61.1 Å²	61.1	16%	0.162	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-66.5	131.8	177.1	-76.2	166.9	0	0	0	111.3	I642 F688 L692 R703 N708	I642-L706 HydrophobicContact CB-CD2 4.49Å; I642-L706 HydrophobicContact CD1-CD2 4Å; I642-L706 HydrophobicContact CD1-CG 4.22Å; I642-L706 HydrophobicContact CG1-CD2 3.77Å; I642-L706 HydrophobicContact CG1-CG 4.44Å; I642-L706 HydrophobicContact CG2-CD2 4.03Å; I642-L706 HydrophobicContact CG2-CG 4.26Å; F688-L706 HydrophobicContact CE1-CD2 4.04Å; L692-L706 HydrophobicContact CD1-CD1 3.75Å; L692-L706 HydrophobicContact CD1-CD2 3.77Å; L692-L706 HydrophobicContact CD1-CG 4.32Å; R703-L706 HydrophobicContact CB-CD1 4.01Å; R703-L706 HydrophobicContact CG-CD1 4.22Å; R703-L706 VanDerWaalsContact O-CB 3.3Å; R703-L706 WeakPolarHBondContact O-CB 3.36Å; R703-L706 WeakPolarHBondContact O-CD1 3.3Å; R703-L706 WeakPolarHBondContact O-CG 3.47Å; R703-L706 PolarHBondContact O-N 3.19Å; R703-L706 VanDerWaalsContact O-N 3.16Å; L706-N708 PolarHBondContact O-N 3.29Å
707	I	86.6	Confident	82	Confident	26 Å²	26	66.1 Å²	66.1	13%	0.133	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-68.7	134.2	171.6	-64.1	159.9	0	0	0	109.2	F645 W649 Y685 H689 E705 I709 L712	F645-I707 HydrophobicContact CD1-CD1 3.95Å; F645-I707 HydrophobicContact CE1-CD1 3.93Å; W649-I707 VanDerWaalsContact CD1-CD1 3.44Å; W649-I707 HydrophobicContact CD2-CD1 4.5Å; W649-I707 HydrophobicContact CG-CD1 4.27Å; W649-I707 HydrophobicContact CZ2-CD1 4.39Å; Y685-I707 WeakPolarHBondContact CE1-O 3.44Å; Y685-I707 WeakPolarHBondContact OH-CA 3.37Å; Y685-I707 WeakPolarHBondContact OH-CB 3.4Å; Y685-I707 PolarHBondContact OH-N 3.34Å; Y685-I707 PolarHBondContact OH-O 3.09Å; H689-I707 PolarHBondContact NE2-O 3.41Å; E705-I707 PolarHBondContact O-N 2.9Å; I707-I709 PolarHBondContact O-N 3.26Å; I707-L712 HydrophobicContact CG2-CB 4.27Å
708	N	86.3	Confident	81.9	Confident	96 Å²	96	72.6 Å²	72.6	51%	0.513	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-62.5	129.4	174.5	-172.9	-57.1	0	0	0	110.5	L706 H710 H711 L712	L706-N708 PolarHBondContact O-N 3.29Å; N708-H710 VanDerWaalsContact C-N 3.27Å; N708-H710 PolarHBondContact O-N 3.46Å; N708-H710 WeakPolarHBondContact OD1-CB 3.5Å; N708-H710 PolarHBondContact OD1-N 2.97Å; N708-H711 HydrophobicContact CB-CB 4.09Å; N708-H711 WeakPolarHBondContact O-CB 3.34Å; N708-H711 PolarHBondContact O-N 3.4Å; N708-L712 PolarHBondContact O-N 2.99Å
709	I	84.2	Confident	81.5	Confident	31 Å²	31	66.6 Å²	66.6	16%	0.159	36%	0.358	C	S	.	.	H	α-helix	trans	-57.3	-38.8	-178.9	-58.5	175.4	0	0	0	111.7	Y685 H689 I707 L712 M713	Y685-I709 HydrophobicContact CD1-CG1 4.04Å; Y685-I709 HydrophobicContact CE1-CG1 3.98Å; H689-I709 HydrophobicContact CB-CD1 3.94Å; I707-I709 PolarHBondContact O-N 3.26Å; I709-L712 WeakPolarHBondContact O-CB 3.44Å; I709-L712 PolarHBondContact O-N 3.19Å; I709-M713 HydrophobicContact CG2-CG 4.41Å; I709-M713 HydrophobicContact CG2-SD 4.21Å; I709-M713 VanDerWaalsContact O-CG 3.31Å; I709-M713 WeakPolarHBondContact O-CG 3.42Å; I709-M713 PolarHBondContact O-N 3.31Å
710	H	82.2	Confident	81.1	Confident	144 Å²	144	65.4 Å²	65.4	67%	0.667	34%	0.335	S	S	*	.	H	α-helix	trans	-66.6	-39.6	177.5	-70.1	71.2	0	0	0	111.4	N708 M713 V714	N708-H710 VanDerWaalsContact C-N 3.27Å; N708-H710 PolarHBondContact O-N 3.46Å; N708-H710 WeakPolarHBondContact OD1-CB 3.5Å; N708-H710 PolarHBondContact OD1-N 2.97Å; H710-M713 PolarHBondContact O-N 3.06Å; H710-V714 VanDerWaalsContact O-CG2 3.3Å; H710-V714 WeakPolarHBondContact O-CG2 3.41Å; H710-V714 PolarHBondContact O-N 3.41Å
711	H	83.9	Confident	80.2	Confident	83 Å²	83	66 Å²	66	38%	0.384	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-44	174.7	-176.9	58.7	0	0	0	111.1	N708 M713 V714 E715	N708-H711 HydrophobicContact CB-CB 4.09Å; N708-H711 WeakPolarHBondContact O-CB 3.34Å; N708-H711 PolarHBondContact O-N 3.4Å; H711-M713 PolarHBondContact O-N 3.28Å; H711-V714 PolarHBondContact O-N 3.46Å; H711-E715 IonicContact CE1-OE1 3.68Å; H711-E715 WeakPolarHBondContact O-CG 3.47Å; H711-E715 PolarHBondContact O-N 3.05Å
712	L	85.2	Confident	78.9	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-57.8	-49.1	173.8	-177.3	67.4	0	0	0	110.9	F645 W649 Y685 I707 N708 I709 V714 E715 L716	F645-L712 HydrophobicContact CE1-CD1 4.4Å; F645-L712 HydrophobicContact CZ-CD1 4.13Å; F645-L712 HydrophobicContact CZ-CD2 4.19Å; W649-L712 HydrophobicContact CD2-CD1 3.95Å; W649-L712 HydrophobicContact CE3-CD1 3.51Å; W649-L712 HydrophobicContact CH2-CD1 3.81Å; W649-L712 HydrophobicContact CZ2-CD1 4.24Å; W649-L712 HydrophobicContact CZ3-CD1 3.46Å; W649-L712 VanDerWaalsContact CZ3-CD1 3.46Å; Y685-L712 HydrophobicContact CD1-CD2 3.35Å; Y685-L712 HydrophobicContact CD2-CD2 4.45Å; Y685-L712 HydrophobicContact CE1-CD2 3.88Å; Y685-L712 HydrophobicContact CG-CD2 3.67Å; I707-L712 HydrophobicContact CG2-CB 4.27Å; N708-L712 PolarHBondContact O-N 2.99Å; I709-L712 WeakPolarHBondContact O-CB 3.44Å; I709-L712 PolarHBondContact O-N 3.19Å; L712-V714 PolarHBondContact O-N 2.83Å; L712-E715 PolarHBondContact O-N 3.16Å; L712-L716 HydrophobicContact CD1-CD1 3.9Å; L712-L716 HydrophobicContact CD1-CD2 4.32Å; L712-L716 HydrophobicContact CD1-CG 4.01Å; L712-L716 HydrophobicContact CD2-CD1 4.36Å; L712-L716 HydrophobicContact CG-CD1 3.73Å; L712-L716 HydrophobicContact CG-CG 4.19Å; L712-L716 WeakPolarHBondContact O-CB 3.01Å; L712-L716 WeakPolarHBondContact O-CG 3.44Å; L712-L716 PolarHBondContact O-N 3.27Å
713	M	82.7	Confident	77.5	Confident	73 Å²	73	77 Å²	77	36%	0.36	38%	0.384	S	S	.	.	H	α-helix	trans	-60.6	-41.5	178.9	-73.3	178	69.5	0	0	113.2	I682 I709 H710 H711 K717	I682-M713 HydrophobicContact CD1-CG 4.11Å; I682-M713 HydrophobicContact CG1-CG 4.35Å; I682-M713 HydrophobicContact CG2-CG 4.12Å; I682-M713 HydrophobicContact CG2-SD 4.49Å; I709-M713 HydrophobicContact CG2-CG 4.41Å; I709-M713 HydrophobicContact CG2-SD 4.21Å; I709-M713 VanDerWaalsContact O-CG 3.31Å; I709-M713 WeakPolarHBondContact O-CG 3.42Å; I709-M713 PolarHBondContact O-N 3.31Å; H710-M713 PolarHBondContact O-N 3.06Å; H711-M713 PolarHBondContact O-N 3.28Å; M713-K717 WeakPolarHBondContact O-CB 3.38Å; M713-K717 VanDerWaalsContact O-CG 3.3Å; M713-K717 WeakPolarHBondContact O-CG 3.3Å; M713-K717 PolarHBondContact O-N 3.18Å
714	V	83.6	Confident	77.2	Confident	85 Å²	85	77.7 Å²	77.7	52%	0.515	39%	0.392	S	S	.	.	H	α-helix	trans	-66.7	-42.7	178.9	169.6	0	0	0	0	111.2	H710 H711 L712 K717	H710-V714 VanDerWaalsContact O-CG2 3.3Å; H710-V714 WeakPolarHBondContact O-CG2 3.41Å; H710-V714 PolarHBondContact O-N 3.41Å; H711-V714 PolarHBondContact O-N 3.46Å; L712-V714 PolarHBondContact O-N 2.83Å; V714-K717 WeakPolarHBondContact O-CB 3.34Å; V714-K717 PolarHBondContact O-N 2.8Å
715	E	80.9	Confident	77.1	Confident	34 Å²	34	76.7 Å²	76.7	16%	0.159	37%	0.37	C	S	.	.	H	α-helix	trans	-69.5	-43.9	177.6	-71.7	-61.4	153.9	0	0	112.1	W649 H711 L712 K717 K718 H719	W649-E715 HydrophobicContact CH2-CB 3.59Å; W649-E715 HydrophobicContact CH2-CG 4.03Å; W649-E715 HydrophobicContact CZ3-CB 4.15Å; H711-E715 IonicContact CE1-OE1 3.68Å; H711-E715 WeakPolarHBondContact O-CG 3.47Å; H711-E715 PolarHBondContact O-N 3.05Å; L712-E715 PolarHBondContact O-N 3.16Å; E715-K717 PolarHBondContact O-N 3.31Å; E715-K718 WeakPolarHBondContact O-CB 3.42Å; E715-K718 PolarHBondContact O-N 2.94Å; E715-K718 IonicContact OE1-NZ 3.38Å; E715-K718 PolarHBondContact OE1-NZ 3.02Å; E715-K718 WeakPolarHBondContact OE2-CD 3.49Å; E715-K718 IonicContact OE2-NZ 2.85Å; E715-K718 PolarHBondContact OE2-NZ 2.89Å; E715-H719 PolarHBondContact O-CD2 3.05Å
716	L	80.8	Confident	76.7	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.01	37%	0.367	C	S	.	.	H	α-helix	trans	-63.1	-29.5	176.6	-65.4	179	0	0	0	112.1	W649 V653 L678 L681 I682 L712 K718 H719	W649-L716 HydrophobicContact CE3-CD2 4.2Å; W649-L716 HydrophobicContact CZ3-CD2 3.88Å; W649-L716 HydrophobicContact CZ3-CG 4.38Å; V653-L716 HydrophobicContact CB-CD2 4.27Å; V653-L716 HydrophobicContact CG1-CD2 3.82Å; V653-L716 HydrophobicContact CG2-CD2 3.68Å; L678-L716 HydrophobicContact CD2-CB 4.15Å; L678-L716 HydrophobicContact CD2-CD1 4.47Å; L678-L716 HydrophobicContact CD2-CD2 3.71Å; L678-L716 HydrophobicContact CD2-CG 4.29Å; L681-L716 HydrophobicContact CD2-CD1 4.35Å; L681-L716 HydrophobicContact CD2-CD2 4.46Å; I682-L716 HydrophobicContact CD1-CD1 3.91Å; I682-L716 HydrophobicContact CG1-CD1 3.53Å; L712-L716 HydrophobicContact CD1-CD1 3.9Å; L712-L716 HydrophobicContact CD1-CD2 4.32Å; L712-L716 HydrophobicContact CD1-CG 4.01Å; L712-L716 HydrophobicContact CD2-CD1 4.36Å; L712-L716 HydrophobicContact CG-CD1 3.73Å; L712-L716 HydrophobicContact CG-CG 4.19Å; L712-L716 WeakPolarHBondContact O-CB 3.01Å; L712-L716 WeakPolarHBondContact O-CG 3.44Å; L712-L716 PolarHBondContact O-N 3.27Å; L716-K718 VanDerWaalsContact C-N 3.27Å; L716-K718 PolarHBondContact O-N 3.27Å; L716-H719 PolarHBondContact O-N 2.81Å
717	K	77.5	Confident	76.2	Confident	135 Å²	135	78.6 Å²	78.6	59%	0.587	38%	0.379	S	S	*	.	H	α-helix	trans	-62.6	-30.3	171.9	-83.6	-179.9	-179	-174.3	0	113.1	M713 V714 E715 H719 K720	M713-K717 WeakPolarHBondContact O-CB 3.38Å; M713-K717 VanDerWaalsContact O-CG 3.3Å; M713-K717 WeakPolarHBondContact O-CG 3.3Å; M713-K717 PolarHBondContact O-N 3.18Å; V714-K717 WeakPolarHBondContact O-CB 3.34Å; V714-K717 PolarHBondContact O-N 2.8Å; E715-K717 PolarHBondContact O-N 3.31Å; K717-H719 PolarHBondContact O-N 3.46Å; K717-K720 WeakPolarHBondContact O-CB 3.3Å; K717-K720 PolarHBondContact O-N 2.72Å
718	K	77.8	Confident	75.5	Confident	136 Å²	136	81.9 Å²	81.9	59%	0.591	40%	0.395	S	S	*	.	H	α-helix	trans	-69.5	-24.5	177.9	-60.6	178.3	-171.4	165.4	0	112.8	E715 L716 K720	E715-K718 WeakPolarHBondContact O-CB 3.42Å; E715-K718 PolarHBondContact O-N 2.94Å; E715-K718 IonicContact OE1-NZ 3.38Å; E715-K718 PolarHBondContact OE1-NZ 3.02Å; E715-K718 WeakPolarHBondContact OE2-CD 3.49Å; E715-K718 IonicContact OE2-NZ 2.85Å; E715-K718 PolarHBondContact OE2-NZ 2.89Å; L716-K718 VanDerWaalsContact C-N 3.27Å; L716-K718 PolarHBondContact O-N 3.27Å; K718-K720 VanDerWaalsContact C-N 3.32Å
719	H	70.1	Confident	74.8	Confident	52 Å²	52	80.9 Å²	80.9	24%	0.241	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	3.3	177.7	-67.1	-79.4	0	0	0	113.3	V653 E715 L716 K717 P721	V653-H719 HydrophobicContact CG1-CB 4.22Å; E715-H719 PolarHBondContact O-CD2 3.05Å; L716-H719 PolarHBondContact O-N 2.81Å; K717-H719 PolarHBondContact O-N 3.46Å; H719-P721 VanDerWaalsContact O-CD 3.28Å; H719-P721 WeakPolarHBondContact O-CD 3.46Å
720	K	66.8	Low	74.1	Confident	73 Å²	73	84.5 Å²	84.5	32%	0.317	40%	0.403	S	S	.	.	S	Bend	trans	-75.3	117.6	169.5	-69.6	-169.1	174.3	-160.5	0	108.8	Q675 L678 K717 K718	Q675-K720 HydrophobicContact CG-CD 4.13Å; Q675-K720 HydrophobicContact CG-CG 4.3Å; L678-K720 HydrophobicContact CD1-CG 4.08Å; K717-K720 WeakPolarHBondContact O-CB 3.3Å; K717-K720 PolarHBondContact O-N 2.72Å; K718-K720 VanDerWaalsContact C-N 3.32Å
721	P	62.3	Low	73.5	Confident	24 Å²	24	79.9 Å²	79.9	16%	0.156	38%	0.383	C	S	.	.			trans	-61.7	137.4	169.8	-13.1	25.8	0	0	0	109.8	M661 T671 I674 H719 F723	M661-P721 HydrophobicContact SD-CG 4.48Å; T671-P721 HydrophobicContact CG2-CB 4.31Å; T671-P721 HydrophobicContact CG2-CG 4.32Å; I674-P721 HydrophobicContact CD1-CG 3.8Å; H719-P721 VanDerWaalsContact O-CD 3.28Å; H719-P721 WeakPolarHBondContact O-CD 3.46Å; P721-F723 HydrophobicContact CB-CD2 3.74Å; P721-F723 HydrophobicContact CB-CE2 4.26Å
722	N	54.4	Low	72.6	Confident	162 Å²	162	79.7 Å²	79.7	87%	0.866	38%	0.383	S	S	*	.			trans	-96.3	91.3	168.9	-72.7	-19.3	0	0	0	107.7
723	F	49.5	Very low	71.5	Confident	179 Å²	179	86.8 Å²	86.8	79%	0.785	42%	0.417	S	S	*	.			trans	-131.4	0	176.5	-81.9	-74.7	0	0	0	111.8	M661 P721	M661-F723 HydrophobicContact CE-CE2 4.34Å; P721-F723 HydrophobicContact CB-CD2 3.74Å; P721-F723 HydrophobicContact CB-CE2 4.26Å

Retrieved 723 of 723 residues in 1776.1 ms (Link to these results)

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