X5D8W6_HUMAN Loading...

Ca++-dependent secretion activator 2 isoform C

AlphaFold DB , UniProt , Accession X5D8W6, Species HUMAN (Homo sapiens, Human), Gene CADPS2, Length 1,256 aa.

						>X5D8W6_HUMAN|X5D8W6|CADPS2
MLDPSSSEEESDEGLEEESRDVLVAAGSSQRAPPAPTREGRRDAPGRAGGGGAARSVSPSPSVLSEGRDEPQRQLDDEQERRIRLQLYVFVVRCIAYPFNAKQPTDMARRQQKLNKQQLQLLKERFQAFLNGETQIIADEAFCNAVRSYYEVFLKSDRVARMVQSGGCSANDFREVFKKNIEKRVRSLPEIDGLSKETVLSSWIAKYDAIYRGEEDLCKQPNRMALSAVSELILSKEQLYEMFQQILGIKKLEHQLLYNACQLDNADEQAAQIRRELDGRLQLADKMAKERKFPKFIAKDMENMYIEELRSSVNLLMANLESLPVSKGGPEFKLQKLKRSQNSAFLDIGDENEIQLSKSDVVLSFTLEIVIMEVQGLKSVAPNRIVYCTMEVEGEKLQTDQAEASRPQWGTQGDFTTTHPRPVVKVKLFTESTGVLALEDKELGRVILYPTSNSSKSAELHRMVVPKNSQDSDLKIKLAVRMDKPAHMKHSGYLYALGQKVWKRWKKRYFVLVQVSQYTFAMCSYREKKSEPQELMQLEGYTVDYTDPHPGLQGGCMFFNAVKEGDTVIFASDDEQDRILWVQAMYRATGQSYKPVPAIQTQKLNPKGGTLHADAQLSGKDADRFQKHGMDEFISANPCKLDHAFLFRILQRQTLDHRLNDSYSCLGWFSPGQVFVLDEYCARYGVRGCHRHLCYLAELMEHSENGAVIDPTLLHYSFAFCASHVHGNRPDGIGTVSVEEKERFEEIKERLSSLLENQISHFRYCFPFGRPEGALKATLSLLERVLMKDIATPIPAEEVKKVVRKCLEKAALINYTRLTEYAKIEETMNQASPARKLEEILHLAELCIEVLQQNEEHHAEGREAFAWWPDLLAEHAEKFWALFTVDMDTALEAQPQDSWDSFPLFQLLNNFLRNDTLLCNGKFHKHLQEIFVPLVVRYVDLMESSIAQSIHRGFEQETWQPVNNGSATSEDLFWKLDALQMFVFDLHWPEQEFAHHLEQRLKLMASDMLEACVKRTRTAFELKLQKASKTTDLRIPASVCTMFNVLVDAKKQSTKLCALDGGQEQQYHSKIDDLIDNSVKEIISLLVSKFVSVLEGVLSKLSRYDEGTFFSSILSFTVKAAAKYVDVPKPGMDLADTYIMFVRQNQDILREKVNEEMYIEKLFDQWYSSSMKVICVWLTDRLDLQLHIYQLKTLIKIVKKTYRDFRLQGVLEGTLNSKTYDTVHRRLTVEEATASVSEGGGLQGITMKDSDEEEEG
					

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Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.5	Very low	27.3	Very low	237 Å²	237	152.1 Å²	152.1	100%	1.167	85%	0.846	S	S	*	*				0	109	0	-107.3	177.3	148.4	0	0	107.3
2	L	27.4	Very low	26.8	Very low	167 Å²	167	151.8 Å²	151.8	87%	0.874	84%	0.841	S	S	*	*			trans	71.6	99.8	155.8	-56.9	171.9	0	0	0	119.8
3	D	25.8	Very low	26.6	Very low	148 Å²	148	155.2 Å²	155.2	79%	0.791	85%	0.847	S	S	*	*			trans	-40.1	161.6	130.4	-98.8	-31	0	0	0	114.1
4	P	42.2	Very low	26.5	Very low	122 Å²	122	149.1 Å²	149.1	79%	0.792	84%	0.838	S	S	*	*				-152.1	152.7	58.1	37.7	-15.2	0	0	0	121.1
5	S	24.8	Very low	26.5	Very low	116 Å²	116	150.9 Å²	150.9	81%	0.811	84%	0.844	S	S	*	*			trans	37.7	126.9	135.1	-154.2	0	0	0	0	124.3
6	S	26	Very low	26.2	Very low	103 Å²	103	152.8 Å²	152.8	72%	0.72	84%	0.844	S	S	*	*				161.3	143.3	114.1	-176	0	0	0	0	115.7
7	S	24.4	Very low	26.1	Very low	97 Å²	97	153 Å²	153	68%	0.678	84%	0.837	S	S	*	*			trans	72.7	116.7	156.3	44.9	0	0	0	0	120.3
8	E	24.9	Very low	25.9	Very low	180 Å²	180	153.2 Å²	153.2	84%	0.841	83%	0.831	S	S	*	*				66.6	131.9	69.7	-75.6	-176.5	172.1	0	0	111.5
9	E	24.9	Very low	25.7	Very low	178 Å²	178	150.1 Å²	150.1	83%	0.832	82%	0.822	S	S	*	*			cis	-167.7	158.6	24.8	-104.5	166.3	175.1	0	0	107.2
10	E	23.3	Very low	25.5	Very low	206 Å²	206	154.1 Å²	154.1	96%	0.963	82%	0.824	S	S	*	*			trans	-131.5	132.4	155.9	-124	-179.4	-159.6	0	0	109.2
11	S	25.6	Very low	25.3	Very low	119 Å²	119	153.3 Å²	153.3	83%	0.832	82%	0.82	S	S	*	*			trans	-93.3	141.7	-153.2	48.3	0	0	0	0	115.3
12	D	21.9	Very low	25	Very low	148 Å²	148	147.4 Å²	147.4	79%	0.791	80%	0.797	S	S	*	*			trans	-80.3	151	156.6	-172.2	14.8	0	0	0	110.5
13	E	24.3	Very low	24.8	Very low	197 Å²	197	146.5 Å²	146.5	92%	0.921	79%	0.793	S	S	*	*			trans	-164.1	92.6	151.9	-109.5	-172.7	-158.4	0	0	110.2
14	G	24.5	Very low	24.6	Very low	70 Å²	70	145.3 Å²	145.3	72%	0.722	79%	0.79	S	S	*	*				71.8	105.7	102.9	0	0	0	0	0	119.4
15	L	26.4	Very low	23.7	Very low	175 Å²	175	144 Å²	144	92%	0.916	79%	0.789	S	S	*	*			trans	-96.2	139.6	159.9	-77.9	161.8	0	0	0	110.6
16	E	22.3	Very low	23.5	Very low	182 Å²	182	143.2 Å²	143.2	85%	0.85	79%	0.79	S	S	*	*			trans	-153.5	147	151.6	-74.6	-170	166.5	0	0	106.2
17	E	24.1	Very low	23.3	Very low	156 Å²	156	141.4 Å²	141.4	73%	0.729	79%	0.788	S	S	*	*			cis	-167	155.6	2.5	-121.9	-171	162.6	0	0	108.4
18	E	23.5	Very low	23.2	Very low	157 Å²	157	142.2 Å²	142.2	73%	0.734	79%	0.793	S	S	*	*			trans	65	117	144.1	-71	-145.9	124.6	0	0	126.3
19	S	20.6	Very low	23.2	Very low	93 Å²	93	138.8 Å²	138.8	65%	0.65	79%	0.79	S	S	*	*				73.3	113.4	116.1	-61.2	0	0	0	0	123.1
20	R	22.2	Very low	23.1	Very low	231 Å²	231	139 Å²	139	87%	0.872	79%	0.791	S	S	*	*				156	127.2	112.1	-92	-176.6	173.4	167.5	0.8	115.8
21	D	22.6	Very low	23.1	Very low	138 Å²	138	140 Å²	140	74%	0.738	79%	0.785	S	S	*	*				43.7	121	129.9	-73.8	-29.1	0	0	0	125.1
22	V	23	Very low	22.9	Very low	113 Å²	113	138.4 Å²	138.4	69%	0.685	78%	0.78	S	S	*	*				47.9	127	129.1	-148	0	0	0	0	122.2
23	L	23.1	Very low	23.6	Very low	148 Å²	148	137 Å²	137	78%	0.775	78%	0.779	S	S	*	*				144.5	122.9	119.9	-75.6	170	0	0	0	116
24	V	21.9	Very low	24.3	Very low	123 Å²	123	132.9 Å²	132.9	75%	0.745	77%	0.769	S	S	*	*				72.4	126.5	123.8	-179.1	0	0	0	0	123.1
25	A	23.1	Very low	24.4	Very low	93 Å²	93	133.9 Å²	133.9	77%	0.769	77%	0.771	S	S	*	*			trans	66.3	157.8	146.5	0	0	0	0	0	118.8
26	A	21.8	Very low	25.1	Very low	100 Å²	100	130.6 Å²	130.6	83%	0.826	76%	0.76	S	S	*	*			cis	-170.2	163.6	-15.1	0	0	0	0	0	106.6
27	G	21.6	Very low	25.4	Very low	66 Å²	66	128 Å²	128	68%	0.68	76%	0.756	S	S	*	*			trans	100.4	97.6	140.7	0	0	0	0	0	120.4
28	S	22.5	Very low	25.5	Very low	113 Å²	113	130.7 Å²	130.7	79%	0.79	76%	0.76	S	S	*	*				72.1	117.6	123	67.5	0	0	0	0	123.2
29	S	23.5	Very low	25.6	Very low	109 Å²	109	131.1 Å²	131.1	76%	0.762	76%	0.762	S	S	*	*				86.8	118.8	117.5	-63.9	0	0	0	0	121.9
30	Q	24.1	Very low	25.9	Very low	182 Å²	182	130.3 Å²	130.3	85%	0.85	77%	0.768	S	S	*	*				140.5	115.8	121.8	-72.7	-163.5	0.8	0	0	110.4
31	R	22.5	Very low	26.2	Very low	226 Å²	226	129.5 Å²	129.5	85%	0.853	77%	0.765	S	S	*	*				103.9	92.4	56.9	-167.7	179.4	-162.4	-176.1	5.6	111.4
32	A	22.3	Very low	26.5	Very low	87 Å²	87	131.7 Å²	131.7	72%	0.719	76%	0.763	S	S	*	*				62.2	171.6	128	0	0	0	0	0	119.8
33	P	35.5	Very low	26.8	Very low	118 Å²	118	132.8 Å²	132.8	77%	0.766	77%	0.765	S	S	*	*			cis	-138.8	-139.2	-23.4	29.8	-2	0	0	0	112.6
34	P	40.2	Very low	26.8	Very low	110 Å²	110	130.4 Å²	130.4	71%	0.714	77%	0.766	S	S	*	*				-137.3	167.4	-94.6	44.6	-26.2	0	0	0	118.5
35	A	26	Very low	27.8	Very low	92 Å²	92	130.8 Å²	130.8	76%	0.76	77%	0.772	S	S	*	*			trans	50.4	176.1	141.6	0	0	0	0	0	121.4
36	P	41	Very low	27.9	Very low	106 Å²	106	130.4 Å²	130.4	69%	0.688	78%	0.777	S	S	*	*			cis	-153.7	-175.3	10.8	45.3	-23.1	0	0	0	120.8
37	T	28	Very low	28.2	Very low	127 Å²	127	137.7 Å²	137.7	78%	0.779	78%	0.783	S	S	*	*			trans	76.3	148.8	152.1	63.5	0	0	0	0	120.6
38	R	27.2	Very low	28.4	Very low	213 Å²	213	139.4 Å²	139.4	80%	0.804	79%	0.791	S	S	*	*			cis	-170.9	158	29.3	-151.3	173	168.5	169.8	-2.6	115.1
39	E	26.1	Very low	28.5	Very low	166 Å²	166	138 Å²	138	78%	0.776	79%	0.794	S	S	*	*			trans	-12.9	161.5	161	-55.8	164	130.6	0	0	122.4
40	G	25.9	Very low	28.5	Very low	75 Å²	75	137 Å²	137	77%	0.773	80%	0.801	S	S	*	*			cis	169.8	171	1.4	0	0	0	0	0	116.3
41	R	28.9	Very low	28.6	Very low	215 Å²	215	132.7 Å²	132.7	81%	0.811	81%	0.806	S	S	*	*			trans	70.5	124.3	144.6	-81.1	-175.3	173.1	-174.7	1.5	127.6
42	R	28.8	Very low	28.7	Very low	183 Å²	183	125.6 Å²	125.6	69%	0.691	80%	0.803	S	S	*	*				112.8	125.1	117	-85.8	-179	-174.1	-172.1	0.3	124.7
43	D	27.8	Very low	29	Very low	137 Å²	137	126.6 Å²	126.6	73%	0.733	81%	0.811	S	S	*	*			trans	80.8	104.1	132.7	-56.9	-25	0	0	0	127.3
44	A	24.1	Very low	28.7	Very low	97 Å²	97	126.3 Å²	126.3	80%	0.802	82%	0.818	S	S	*	*				29.5	174.1	127.2	0	0	0	0	0	125.9
45	P	43.3	Very low	28.1	Very low	132 Å²	132	132.2 Å²	132.2	86%	0.857	83%	0.826	S	S	*	*				-138.4	175.2	-50.8	39	-20.9	0	0	0	115.9
46	G	24.6	Very low	28.1	Very low	85 Å²	85	133.4 Å²	133.4	88%	0.876	83%	0.829	S	S	*	*			trans	177.8	153.7	168.6	0	0	0	0	0	117.2
47	R	27.8	Very low	27.4	Very low	252 Å²	252	135 Å²	135	95%	0.951	84%	0.836	S	S	*	*			trans	-102.7	156.3	-153.8	-99.6	176.1	168.5	176.5	-4.5	118.6
48	A	25.8	Very low	27.4	Very low	103 Å²	103	133.8 Å²	133.8	85%	0.851	83%	0.833	S	S	*	*			trans	86	124.1	136.8	0	0	0	0	0	124.5
49	G	24.5	Very low	27.8	Very low	84 Å²	84	129.9 Å²	129.9	87%	0.866	84%	0.835	S	S	*	*				110.7	124.2	125.6	0	0	0	0	0	120.8
50	G	24.6	Very low	27.8	Very low	88 Å²	88	126.8 Å²	126.8	91%	0.907	83%	0.832	S	S	*	*			trans	108.2	131.3	148.5	0	0	0	0	0	118.6
51	G	25.7	Very low	28.2	Very low	91 Å²	91	129.5 Å²	129.5	94%	0.938	84%	0.836	S	S	*	*			trans	-93	178.7	-167.2	0	0	0	0	0	118.3
52	G	25.3	Very low	28.3	Very low	77 Å²	77	124.6 Å²	124.6	79%	0.794	84%	0.835	S	S	*	*			trans	160.9	121.4	172.9	0	0	0	0	0	115
53	A	28.3	Very low	28.9	Very low	107 Å²	107	121.7 Å²	121.7	88%	0.884	84%	0.837	S	S	*	*			trans	34.6	114.8	150.7	0	0	0	0	0	120.6
54	A	28.7	Very low	29.3	Very low	112 Å²	112	123.2 Å²	123.2	93%	0.926	84%	0.844	S	S	*	*			trans	-84.3	115.7	167.8	0	0	0	0	0	111.4
55	R	27.9	Very low	29.8	Very low	235 Å²	235	124 Å²	124	89%	0.887	84%	0.844	S	S	*	*			trans	-121.1	146.5	156.2	-109.8	-177	-180	163.8	-0.2	108.9
56	S	25.9	Very low	29.5	Very low	117 Å²	117	123.6 Å²	123.6	82%	0.818	83%	0.831	S	S	*	*			trans	-47.8	135	-176.3	49.1	0	0	0	0	116.2
57	V	27	Very low	30.3	Very low	138 Å²	138	122.5 Å²	122.5	84%	0.836	82%	0.819	S	S	*	*			trans	-135.3	128.9	166.2	-176.4	0	0	0	0	110.6
58	S	27.4	Very low	31.1	Very low	103 Å²	103	121.4 Å²	121.4	72%	0.72	82%	0.815	S	S	*	*			trans	-55.2	149.7	172.2	-42.4	0	0	0	0	113.3
59	P	34.6	Very low	32.1	Very low	130 Å²	130	120.7 Å²	120.7	84%	0.844	80%	0.797	S	S	*	*			trans	-86	124.9	175.8	33.1	-28	0	0	0	110.3
60	S	26.9	Very low	33.3	Very low	101 Å²	101	121.2 Å²	121.2	71%	0.706	78%	0.777	S	S	*	*			trans	-120.8	138.9	155.1	-73.2	0	0	0	0	107.9	S62	S60-S62 PolarHBondContact O-N 2.8Å
61	P	35.4	Very low	34.9	Very low	132 Å²	132	120.5 Å²	120.5	86%	0.857	76%	0.756	S	S	*	*			trans	-78.9	113.4	-160.6	31.5	-32	0	0	0	109.8
62	S	29.4	Very low	36.3	Very low	113 Å²	113	122.3 Å²	122.3	79%	0.79	74%	0.74	S	S	*	*			trans	-119.3	100	165.9	22.4	0	0	0	0	108.7	S60	S60-S62 PolarHBondContact O-N 2.8Å
63	V	41.4	Very low	38	Very low	122 Å²	122	125.2 Å²	125.2	74%	0.739	73%	0.728	S	S	*	*			trans	-54.6	143.1	166.8	-174.7	0	0	0	0	108.3
64	L	37.3	Very low	39.7	Very low	168 Å²	168	126.1 Å²	126.1	88%	0.88	71%	0.713	S	S	*	*			trans	107	51.6	178.7	-53.8	170.9	0	0	0	115.7
65	S	34.2	Very low	41.4	Very low	113 Å²	113	126.1 Å²	126.1	79%	0.79	70%	0.697	S	S	*	*	S	Bend	trans	-151.5	31.2	150.9	-175.4	0	0	0	0	112.9
66	E	37.8	Very low	43.4	Very low	124 Å²	124	119.2 Å²	119.2	58%	0.579	68%	0.678	S	S	*	*			trans	-98.5	-18.1	-179.2	-74.8	-174.3	130.3	0	0	114.5	R68 E70	E66-R68 PolarHBondContact O-N 3.22Å; E66-R68 VanDerWaalsContact O-N 3.15Å; E66-E70 VanDerWaalsContact O-CG 3.29Å; E66-E70 WeakPolarHBondContact O-CG 3.44Å
67	G	41.3	Very low	45.8	Very low	62 Å²	62	118.4 Å²	118.4	64%	0.639	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	6.4	-168.4	0	0	0	0	0	118.4
68	R	44.2	Very low	48.2	Very low	229 Å²	229	116 Å²	116	86%	0.864	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	-24.1	176.7	-91.2	-172.7	-166.6	-171.4	4.7	115.1	E66	E66-R68 PolarHBondContact O-N 3.22Å; E66-R68 VanDerWaalsContact O-N 3.15Å
69	D	46.4	Very low	50.5	Low	89 Å²	89	117 Å²	117	48%	0.476	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99	-13.2	177.5	-66.3	-22.2	0	0	0	112.6	Q72 R73	D69-Q72 PolarHBondContact O-N 2.93Å; D69-R73 WeakPolarHBondContact O-CB 3.49Å; D69-R73 WeakPolarHBondContact O-CG 3.41Å; D69-R73 PolarHBondContact O-N 3.47Å; D69-R73 IonicContact OD2-NH2 2.76Å
70	E	50.4	Low	52.7	Low	94 Å²	94	114.6 Å²	114.6	44%	0.439	62%	0.615	S	S	.	*	H	α-helix	trans	-55.2	-47.1	176.9	-86.9	178.2	160.4	0	0	115.1	E66 Q72 Q74	E66-E70 VanDerWaalsContact O-CG 3.29Å; E66-E70 WeakPolarHBondContact O-CG 3.44Å; E70-Q72 VanDerWaalsContact C-N 3.28Å; E70-Q72 PolarHBondContact O-N 2.91Å; E70-Q74 WeakPolarHBondContact O-CB 3.48Å; E70-Q74 WeakPolarHBondContact O-CG 3.28Å; E70-Q74 PolarHBondContact O-N 2.85Å
71	P	56.6	Low	55.3	Low	73 Å²	73	114.7 Å²	114.7	47%	0.474	60%	0.6	S	S	.	*	H	α-helix	trans	-69.3	-29.3	178.9	25.5	-32.3	0	0	0	112.2	L75	P71-L75 WeakPolarHBondContact O-CB 3.46Å; P71-L75 WeakPolarHBondContact O-CD1 3.48Å; P71-L75 VanDerWaalsContact O-CG 3.22Å; P71-L75 WeakPolarHBondContact O-CG 3.46Å; P71-L75 PolarHBondContact O-N 2.88Å
72	Q	55.6	Low	57.6	Low	129 Å²	129	114.2 Å²	114.2	60%	0.603	58%	0.581	S	S	*	*	H	α-helix	trans	-76	-42.4	178.7	-164.8	135.6	-5.7	0	0	111.3	D69 E70 Q74 L75 D76	D69-Q72 PolarHBondContact O-N 2.93Å; E70-Q72 VanDerWaalsContact C-N 3.28Å; E70-Q72 PolarHBondContact O-N 2.91Å; Q72-Q74 VanDerWaalsContact C-N 3.34Å; Q72-Q74 PolarHBondContact O-N 3.2Å; Q72-L75 PolarHBondContact O-N 2.98Å; Q72-D76 WeakPolarHBondContact O-CB 2.78Å; Q72-D76 VanDerWaalsContact O-CG 3.24Å; Q72-D76 PolarHBondContact O-N 3.45Å
73	R	61.3	Low	60.3	Low	139 Å²	139	110.4 Å²	110.4	53%	0.525	55%	0.551	S	S	.	*	H	α-helix	trans	-61.4	-40.3	170.4	-69.4	179.4	-161.7	176.3	7.5	112.1	D69 D76 D77	D69-R73 WeakPolarHBondContact O-CB 3.49Å; D69-R73 WeakPolarHBondContact O-CG 3.41Å; D69-R73 PolarHBondContact O-N 3.47Å; D69-R73 IonicContact OD2-NH2 2.76Å; R73-D76 PolarHBondContact O-N 3.28Å; R73-D77 VanDerWaalsContact O-CB 3.31Å; R73-D77 WeakPolarHBondContact O-CB 3.39Å; R73-D77 PolarHBondContact O-N 3.29Å
74	Q	63.6	Low	62.5	Low	126 Å²	126	108.1 Å²	108.1	59%	0.589	53%	0.529	S	S	*	.	H	α-helix	trans	-65.7	-37.2	176.2	-75.3	171.4	22.1	0	0	113	E70 Q72 E78	E70-Q74 WeakPolarHBondContact O-CB 3.48Å; E70-Q74 WeakPolarHBondContact O-CG 3.28Å; E70-Q74 PolarHBondContact O-N 2.85Å; Q72-Q74 VanDerWaalsContact C-N 3.34Å; Q72-Q74 PolarHBondContact O-N 3.2Å; Q74-E78 WeakPolarHBondContact O-CB 3.4Å; Q74-E78 PolarHBondContact O-N 3.32Å
75	L	64.6	Low	64.8	Low	111 Å²	111	100.2 Å²	100.2	58%	0.581	49%	0.488	S	S	*	.	H	α-helix	trans	-67.5	-42.8	174.4	-77.2	162.2	0	0	0	111.5	P71 Q72 E78 Q79	P71-L75 WeakPolarHBondContact O-CB 3.46Å; P71-L75 WeakPolarHBondContact O-CD1 3.48Å; P71-L75 VanDerWaalsContact O-CG 3.22Å; P71-L75 WeakPolarHBondContact O-CG 3.46Å; P71-L75 PolarHBondContact O-N 2.88Å; Q72-L75 PolarHBondContact O-N 2.98Å; L75-E78 PolarHBondContact O-N 2.92Å; L75-Q79 WeakPolarHBondContact O-CB 3.46Å; L75-Q79 PolarHBondContact O-N 3.45Å
76	D	70.4	Confident	67.3	Low	90 Å²	90	96.6 Å²	96.6	48%	0.481	46%	0.459	S	S	.	.	H	α-helix	trans	-65.1	-43.2	177.2	-68.3	-21.3	0	0	0	111.1	Q72 R73 E78 Q79 E80	Q72-D76 WeakPolarHBondContact O-CB 2.78Å; Q72-D76 VanDerWaalsContact O-CG 3.24Å; Q72-D76 PolarHBondContact O-N 3.45Å; R73-D76 PolarHBondContact O-N 3.28Å; D76-E78 PolarHBondContact O-N 2.96Å; D76-Q79 PolarHBondContact O-N 3.36Å; D76-E80 WeakPolarHBondContact O-CB 3.46Å; D76-E80 PolarHBondContact O-N 3.39Å
77	D	75.6	Confident	69.7	Low	100 Å²	100	90.7 Å²	90.7	54%	0.535	43%	0.431	S	S	.	.	H	α-helix	trans	-63.6	-38.9	175.4	-71.8	-19.8	0	0	0	112	R73 R81	R73-D77 VanDerWaalsContact O-CB 3.31Å; R73-D77 WeakPolarHBondContact O-CB 3.39Å; R73-D77 PolarHBondContact O-N 3.29Å; D77-R81 WeakPolarHBondContact O-CB 3.13Å; D77-R81 PolarHBondContact O-N 3.26Å
78	E	77.2	Confident	72	Confident	88 Å²	88	87.8 Å²	87.8	41%	0.411	40%	0.401	S	S	.	.	H	α-helix	trans	-68.3	-41.7	176.3	-166.8	-176.2	158.5	0	0	111.1	Q74 L75 D76 R81 R82	Q74-E78 WeakPolarHBondContact O-CB 3.4Å; Q74-E78 PolarHBondContact O-N 3.32Å; L75-E78 PolarHBondContact O-N 2.92Å; D76-E78 PolarHBondContact O-N 2.96Å; E78-R81 PolarHBondContact O-N 2.98Å; E78-R82 WeakPolarHBondContact O-CG 3.38Å; E78-R82 PolarHBondContact O-N 3.17Å; E78-R82 IonicContact OE1-CZ 3.18Å; E78-R82 IonicContact OE1-NE 3.41Å; E78-R82 PolarHBondContact OE1-NE 2.81Å; E78-R82 IonicContact OE1-NH2 3.56Å; E78-R82 PolarHBondContact OE1-NH2 3.23Å
79	Q	76.8	Confident	74.1	Confident	124 Å²	124	76.9 Å²	76.9	58%	0.579	36%	0.36	S	S	*	.	H	α-helix	trans	-65.2	-42.3	176.8	-174	166.4	-18.6	0	0	111.3	L75 D76 R81 R82 I83	L75-Q79 WeakPolarHBondContact O-CB 3.46Å; L75-Q79 PolarHBondContact O-N 3.45Å; D76-Q79 PolarHBondContact O-N 3.36Å; Q79-R81 VanDerWaalsContact C-N 3.35Å; Q79-R81 PolarHBondContact O-N 3.18Å; Q79-R82 PolarHBondContact O-N 3.3Å; Q79-I83 HydrophobicContact CG-CD1 4.27Å; Q79-I83 WeakPolarHBondContact O-CG1 3.19Å; Q79-I83 PolarHBondContact O-N 3.38Å
80	E	80.6	Confident	76.1	Confident	80 Å²	80	72.6 Å²	72.6	37%	0.374	34%	0.337	S	S	.	.	H	α-helix	trans	-63.4	-41.9	175.2	-159.5	-173.5	172.9	0	0	111.3	D76 R82 I83 R84	D76-E80 WeakPolarHBondContact O-CB 3.46Å; D76-E80 PolarHBondContact O-N 3.39Å; E80-R82 PolarHBondContact O-N 2.71Å; E80-I83 PolarHBondContact O-N 3.43Å; E80-R84 WeakPolarHBondContact O-CG 3.38Å; E80-R84 PolarHBondContact O-N 2.93Å; E80-R84 IonicContact OE1-CZ 3.99Å; E80-R84 IonicContact OE1-NE 2.95Å; E80-R84 PolarHBondContact OE1-NE 3.04Å; E80-R84 IonicContact OE1-NH2 3.95Å; E80-R84 PolarHBondContact OE1-NH2 3.34Å; E80-R84 IonicContact OE2-CZ 3.94Å; E80-R84 IonicContact OE2-NH2 3.08Å; E80-R84 PolarHBondContact OE2-NH2 3.49Å
81	R	81.8	Confident	78	Confident	102 Å²	102	68.1 Å²	68.1	39%	0.385	32%	0.316	S	S	.	.	H	α-helix	trans	-60.8	-42	174.2	-180	173.1	167.8	-87.7	0.7	112.3	D77 E78 Q79 R84 L85 E253	D77-R81 WeakPolarHBondContact O-CB 3.13Å; D77-R81 PolarHBondContact O-N 3.26Å; E78-R81 PolarHBondContact O-N 2.98Å; Q79-R81 VanDerWaalsContact C-N 3.35Å; Q79-R81 PolarHBondContact O-N 3.18Å; R81-R84 PolarHBondContact O-N 3.4Å; R81-L85 HydrophobicContact CG-CD1 4.2Å; R81-L85 WeakPolarHBondContact O-CG 3.45Å; R81-L85 PolarHBondContact O-N 3.33Å; R81-E253 IonicContact CZ-OE1 3.5Å; R81-E253 IonicContact NE-OE1 3.6Å; R81-E253 PolarHBondContact NE-OE1 2.99Å; R81-E253 IonicContact NH2-OE1 3.69Å; R81-E253 PolarHBondContact NH2-OE1 3.04Å
82	R	83.6	Confident	79.5	Confident	122 Å²	122	64.7 Å²	64.7	46%	0.46	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-42.8	176.3	-72.3	-176	-171.7	-163.8	5	111.7	E78 Q79 E80 L85 Q86 F633	E78-R82 WeakPolarHBondContact O-CG 3.38Å; E78-R82 PolarHBondContact O-N 3.17Å; E78-R82 IonicContact OE1-CZ 3.18Å; E78-R82 IonicContact OE1-NE 3.41Å; E78-R82 PolarHBondContact OE1-NE 2.81Å; E78-R82 IonicContact OE1-NH2 3.56Å; E78-R82 PolarHBondContact OE1-NH2 3.23Å; Q79-R82 PolarHBondContact O-N 3.3Å; E80-R82 PolarHBondContact O-N 2.71Å; R82-L85 PolarHBondContact O-N 2.88Å; R82-Q86 WeakPolarHBondContact O-CB 3.48Å; R82-Q86 PolarHBondContact O-N 2.89Å; R82-F633 HydrophobicContact CB-CE1 4.28Å; R82-F633 HydrophobicContact CB-CZ 4.3Å; R82-F633 HydrophobicContact CG-CZ 4.14Å
83	I	85.6	Confident	81	Confident	34 Å²	34	59.1 Å²	59.1	17%	0.174	27%	0.267	C	S	.	.	H	α-helix	trans	-63	-44.7	177.2	-68.4	166.3	0	0	0	110.8	Q79 E80 Q86 L87 L646 I649	Q79-I83 HydrophobicContact CG-CD1 4.27Å; Q79-I83 WeakPolarHBondContact O-CG1 3.19Å; Q79-I83 PolarHBondContact O-N 3.38Å; E80-I83 PolarHBondContact O-N 3.43Å; I83-Q86 PolarHBondContact O-N 3.29Å; I83-L87 HydrophobicContact CG2-CD1 4.11Å; I83-L87 WeakPolarHBondContact O-CB 3.3Å; I83-L87 PolarHBondContact O-N 2.97Å; I83-L646 HydrophobicContact CG2-CD2 3.79Å; I83-I649 HydrophobicContact CG2-CD1 3.91Å
84	R	87.6	Confident	82.3	Confident	73 Å²	73	52.5 Å²	52.5	28%	0.275	24%	0.242	S	C	.	.	H	α-helix	trans	-62.4	-42.3	177.4	-69.3	175.8	-168.4	-179.8	4.8	112.4	E80 R81 L87 Y88 L247 I249	E80-R84 WeakPolarHBondContact O-CG 3.38Å; E80-R84 PolarHBondContact O-N 2.93Å; E80-R84 IonicContact OE1-CZ 3.99Å; E80-R84 IonicContact OE1-NE 2.95Å; E80-R84 PolarHBondContact OE1-NE 3.04Å; E80-R84 IonicContact OE1-NH2 3.95Å; E80-R84 PolarHBondContact OE1-NH2 3.34Å; E80-R84 IonicContact OE2-CZ 3.94Å; E80-R84 IonicContact OE2-NH2 3.08Å; E80-R84 PolarHBondContact OE2-NH2 3.49Å; R81-R84 PolarHBondContact O-N 3.4Å; R84-L87 WeakPolarHBondContact O-CB 3.49Å; R84-L87 PolarHBondContact O-N 2.82Å; R84-Y88 WeakPolarHBondContact O-CB 3.49Å; R84-Y88 PolarHBondContact O-N 3.29Å; R84-L247 WeakPolarHBondContact CD-O 3.45Å; R84-I249 HydrophobicContact CB-CD1 4.21Å
85	L	86.4	Confident	83.5	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-63.2	-44	175.5	-75.8	168.2	0	0	0	111.9	R81 R82 Y88 V89 I249 E253 L257 M630 F633	R81-L85 HydrophobicContact CG-CD1 4.2Å; R81-L85 WeakPolarHBondContact O-CG 3.45Å; R81-L85 PolarHBondContact O-N 3.33Å; R82-L85 PolarHBondContact O-N 2.88Å; L85-Y88 PolarHBondContact O-N 3.08Å; L85-V89 PolarHBondContact O-N 2.81Å; L85-V89 VanDerWaalsContact O-N 3.13Å; L85-I249 HydrophobicContact CD2-CD1 4.09Å; L85-I249 HydrophobicContact CD2-CG2 4.34Å; L85-I249 HydrophobicContact CG-CD1 4.48Å; L85-E253 HydrophobicContact CD2-CB 4.11Å; L85-E253 HydrophobicContact CD2-CG 4.46Å; L85-L257 HydrophobicContact CD2-CD1 4.22Å; L85-M630 HydrophobicContact CD1-CE 3.97Å; L85-M630 HydrophobicContact CD1-SD 4.46Å; L85-M630 HydrophobicContact CD2-CE 4.16Å; L85-F633 HydrophobicContact CD1-CE2 4.4Å
86	Q	85.8	Confident	84.3	Confident	38 Å²	38	41.3 Å²	41.3	18%	0.178	19%	0.187	C	C	.	.	H	α-helix	trans	-63.4	-43.2	177.2	-171.3	168.8	39.3	0	0	112	R82 I83 Y88 V89 F90 F633 L641	R82-Q86 WeakPolarHBondContact O-CB 3.48Å; R82-Q86 PolarHBondContact O-N 2.89Å; I83-Q86 PolarHBondContact O-N 3.29Å; Q86-Y88 VanDerWaalsContact C-N 3.32Å; Q86-Y88 PolarHBondContact O-N 2.89Å; Q86-V89 PolarHBondContact O-N 3.48Å; Q86-F90 HydrophobicContact CG-CE2 3.79Å; Q86-F90 HydrophobicContact CG-CZ 4.43Å; Q86-F90 WeakPolarHBondContact O-CD2 3.07Å; Q86-F90 PolarHBondContact O-N 3.49Å; Q86-F633 HydrophobicContact CB-CD1 3.96Å; Q86-F633 HydrophobicContact CB-CE1 4.44Å; Q86-F633 HydrophobicContact CG-CD1 4.5Å; Q86-L641 HydrophobicContact CG-CD1 4.2Å
87	L	88.1	Confident	84.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-57.4	-44.9	171.8	-91.8	167.5	0	0	0	112.1	I83 R84 V89 F90 V91 L247 L646 I649 L650 Y680	I83-L87 HydrophobicContact CG2-CD1 4.11Å; I83-L87 WeakPolarHBondContact O-CB 3.3Å; I83-L87 PolarHBondContact O-N 2.97Å; R84-L87 WeakPolarHBondContact O-CB 3.49Å; R84-L87 PolarHBondContact O-N 2.82Å; L87-V89 VanDerWaalsContact C-N 3.34Å; L87-V89 PolarHBondContact O-N 2.89Å; L87-F90 PolarHBondContact O-N 2.83Å; L87-V91 WeakPolarHBondContact O-CG2 3.49Å; L87-V91 PolarHBondContact O-N 2.91Å; L87-L247 HydrophobicContact CB-CD1 4.18Å; L87-L646 HydrophobicContact CD1-CD2 4.41Å; L87-L646 HydrophobicContact CD2-CB 3.72Å; L87-L646 WeakPolarHBondContact CD2-O 3.43Å; L87-L646 HydrophobicContact CG-CB 4.22Å; L87-L646 HydrophobicContact CG-CD2 4.12Å; L87-I649 HydrophobicContact CD1-CB 4.13Å; L87-I649 HydrophobicContact CD1-CG2 4.01Å; L87-L650 HydrophobicContact CD2-CB 4.1Å; L87-Y680 HydrophobicContact CD2-CE2 4.46Å
88	Y	89.8	Confident	85.2	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.9	-38.7	-178.4	-166.6	-119.5	0	0	0	112.6	R84 L85 Q86 F90 V91 V92 Y240 F243 Q244 L247 I249 H254 L257	R84-Y88 WeakPolarHBondContact O-CB 3.49Å; R84-Y88 PolarHBondContact O-N 3.29Å; L85-Y88 PolarHBondContact O-N 3.08Å; Q86-Y88 VanDerWaalsContact C-N 3.32Å; Q86-Y88 PolarHBondContact O-N 2.89Å; Y88-F90 VanDerWaalsContact C-N 3.3Å; Y88-F90 PolarHBondContact O-N 3.1Å; Y88-V91 PolarHBondContact O-N 2.8Å; Y88-V92 HydrophobicContact CD1-CG2 3.83Å; Y88-V92 HydrophobicContact CD2-CG2 4.24Å; Y88-V92 HydrophobicContact CE1-CG2 3.51Å; Y88-V92 HydrophobicContact CE2-CG2 3.98Å; Y88-V92 HydrophobicContact CG-CG2 4.19Å; Y88-V92 WeakPolarHBondContact O-CB 3.17Å; Y88-V92 VanDerWaalsContact O-CG2 3.23Å; Y88-V92 WeakPolarHBondContact O-CG2 3.45Å; Y88-V92 PolarHBondContact O-N 2.79Å; Y88-Y240 PolarHBondContact OH-O 2.82Å; Y88-F243 HydrophobicContact CE2-CB 4.19Å; Y88-Q244 HydrophobicContact CE2-CB 4.43Å; Y88-L247 HydrophobicContact CD2-CD1 3.76Å; Y88-L247 HydrophobicContact CG-CD1 4.25Å; Y88-I249 HydrophobicContact CD1-CG1 4.13Å; Y88-I249 HydrophobicContact CD1-CG2 4.14Å; Y88-I249 HydrophobicContact CD2-CG1 4.13Å; Y88-I249 HydrophobicContact CE1-CG2 4.32Å; Y88-I249 HydrophobicContact CG-CG1 3.83Å; Y88-H254 HydrophobicContact CE1-CB 4.2Å; Y88-H254 AromaticContact CE1-ND1 3.59Å; Y88-H254 AromaticContact CZ-ND1 3.54Å; Y88-H254 PolarHBondContact OH-CE1 3.43Å; Y88-H254 PolarHBondContact OH-ND1 3.3Å; Y88-L257 HydrophobicContact CD1-CD1 3.85Å
89	V	88.2	Confident	85.3	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-56.5	-45.9	174.5	173.4	0	0	0	0	111.3	L85 Q86 L87 V92 R93 L257 F633	L85-V89 PolarHBondContact O-N 2.81Å; L85-V89 VanDerWaalsContact O-N 3.13Å; Q86-V89 PolarHBondContact O-N 3.48Å; L87-V89 VanDerWaalsContact C-N 3.34Å; L87-V89 PolarHBondContact O-N 2.89Å; V89-V92 PolarHBondContact O-N 3.22Å; V89-R93 WeakPolarHBondContact O-CG 3.29Å; V89-R93 PolarHBondContact O-N 2.89Å; V89-R93 VanDerWaalsContact O-N 3.1Å; V89-L257 HydrophobicContact CG2-CD1 3.96Å; V89-L257 HydrophobicContact CG2-CD2 3.73Å; V89-L257 HydrophobicContact CG2-CG 4.37Å; V89-F633 HydrophobicContact CG2-CB 3.99Å
90	F	89.3	Confident	85.7	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-67.9	-38.1	180	-65	-47.9	0	0	0	112.9	Q86 L87 Y88 R93 C94 P638 L641 L646 Y680 Y684	Q86-F90 HydrophobicContact CG-CE2 3.79Å; Q86-F90 HydrophobicContact CG-CZ 4.43Å; Q86-F90 WeakPolarHBondContact O-CD2 3.07Å; Q86-F90 PolarHBondContact O-N 3.49Å; L87-F90 PolarHBondContact O-N 2.83Å; Y88-F90 VanDerWaalsContact C-N 3.3Å; Y88-F90 PolarHBondContact O-N 3.1Å; F90-R93 PolarHBondContact O-N 2.92Å; F90-C94 PolarHBondContact O-N 2.99Å; F90-C94 PolarHBondContact O-SG 3.09Å; F90-C94 VanDerWaalsContact O-SG 3.32Å; F90-P638 HydrophobicContact CE1-CB 4.03Å; F90-P638 HydrophobicContact CE1-CG 3.92Å; F90-L641 HydrophobicContact CE2-CD1 3.49Å; F90-L641 VanDerWaalsContact CE2-CD1 3.49Å; F90-L641 HydrophobicContact CZ-CD1 3.38Å; F90-L646 HydrophobicContact CE2-CD1 4.4Å; F90-Y680 HydrophobicContact CB-CD2 4.32Å; F90-Y680 HydrophobicContact CB-CE2 3.63Å; F90-Y684 WeakPolarHBondContact CA-OH 3.49Å; F90-Y684 HydrophobicContact CB-CE2 3.73Å; F90-Y684 AromaticContact CD1-CE1 3.91Å; F90-Y684 HydrophobicContact CD1-CE1 3.91Å; F90-Y684 HydrophobicContact CD1-CE2 4.43Å; F90-Y684 AromaticContact CD1-CZ 3.67Å; F90-Y684 WeakPolarHBondContact CD1-OH 3.18Å; F90-Y684 HydrophobicContact CG-CE1 4.48Å; F90-Y684 HydrophobicContact CG-CE2 4.29Å; F90-Y684 AromaticContact CG-CZ 3.98Å; F90-Y684 PolarHBondContact O-OH 3.33Å
91	V	89.6	Confident	85.7	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.9	-45.3	174.5	168.1	0	0	0	0	111.3	L87 Y88 R93 C94 I95 F243 L650 V676 Y680	L87-V91 WeakPolarHBondContact O-CG2 3.49Å; L87-V91 PolarHBondContact O-N 2.91Å; Y88-V91 PolarHBondContact O-N 2.8Å; V91-R93 VanDerWaalsContact C-N 3.28Å; V91-R93 PolarHBondContact O-N 3.02Å; V91-C94 WeakPolarHBondContact O-CB 3.46Å; V91-C94 PolarHBondContact O-N 2.58Å; V91-I95 HydrophobicContact CG1-CD1 3.88Å; V91-I95 WeakPolarHBondContact O-CG1 3.37Å; V91-I95 PolarHBondContact O-N 3.21Å; V91-F243 HydrophobicContact CG1-CB 3.82Å; V91-F243 HydrophobicContact CG1-CD1 3.8Å; V91-F243 HydrophobicContact CG1-CD2 4.24Å; V91-F243 HydrophobicContact CG1-CE1 4.46Å; V91-F243 HydrophobicContact CG1-CG 3.67Å; V91-L650 HydrophobicContact CG2-CD1 3.95Å; V91-L650 HydrophobicContact CG2-CD2 3.87Å; V91-V676 HydrophobicContact CG1-CG1 3.83Å; V91-Y680 HydrophobicContact CG2-CD2 4.36Å
92	V	88.4	Confident	85.6	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.4	-40.5	178	168.1	0	0	0	0	110.7	Y88 V89 C94 I95 A96 Y240 C261	Y88-V92 HydrophobicContact CD1-CG2 3.83Å; Y88-V92 HydrophobicContact CD2-CG2 4.24Å; Y88-V92 HydrophobicContact CE1-CG2 3.51Å; Y88-V92 HydrophobicContact CE2-CG2 3.98Å; Y88-V92 HydrophobicContact CG-CG2 4.19Å; Y88-V92 WeakPolarHBondContact O-CB 3.17Å; Y88-V92 VanDerWaalsContact O-CG2 3.23Å; Y88-V92 WeakPolarHBondContact O-CG2 3.45Å; Y88-V92 PolarHBondContact O-N 2.79Å; V89-V92 PolarHBondContact O-N 3.22Å; V92-C94 VanDerWaalsContact C-N 3.34Å; V92-C94 PolarHBondContact O-N 3.47Å; V92-I95 PolarHBondContact O-N 2.97Å; V92-A96 VanDerWaalsContact O-CB 3.26Å; V92-A96 WeakPolarHBondContact O-CB 3.35Å; V92-A96 PolarHBondContact O-N 2.93Å; V92-Y240 HydrophobicContact CB-CE1 4.22Å; V92-Y240 HydrophobicContact CG1-CE1 3.85Å; V92-Y240 HydrophobicContact CG2-CD1 4.24Å; V92-Y240 HydrophobicContact CG2-CE1 4.19Å; V92-C261 HydrophobicContact CG1-CB 3.54Å
93	R	87.6	Confident	85.3	Confident	13 Å²	13	25.1 Å²	25.1	5%	0.049	12%	0.12	C	C	.	.	H	α-helix	trans	-62.5	-38	174.5	-70.8	179.8	-172.9	175.8	8.5	113.2	V89 F90 V91 I95 Y97 E276 I634 R683	V89-R93 WeakPolarHBondContact O-CG 3.29Å; V89-R93 PolarHBondContact O-N 2.89Å; V89-R93 VanDerWaalsContact O-N 3.1Å; F90-R93 PolarHBondContact O-N 2.92Å; V91-R93 VanDerWaalsContact C-N 3.28Å; V91-R93 PolarHBondContact O-N 3.02Å; R93-I95 VanDerWaalsContact C-N 3.35Å; R93-Y97 WeakPolarHBondContact CG-OH 3.17Å; R93-Y97 PolarHBondContact O-N 3.41Å; R93-E276 IonicContact NH1-OE1 2.93Å; R93-E276 PolarHBondContact NH1-OE1 3.4Å; R93-I634 PolarHBondContact NH2-O 2.96Å; R93-R683 VanDerWaalsContact C-NH1 3.34Å; R93-R683 PolarHBondContact O-NH1 3.21Å
94	C	88.1	Confident	84.7	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.9	-35.7	175.4	-67.6	0	0	0	0	112.1	F90 V91 V92 E679	F90-C94 PolarHBondContact O-N 2.99Å; F90-C94 PolarHBondContact O-SG 3.09Å; F90-C94 VanDerWaalsContact O-SG 3.32Å; V91-C94 WeakPolarHBondContact O-CB 3.46Å; V91-C94 PolarHBondContact O-N 2.58Å; V92-C94 VanDerWaalsContact C-N 3.34Å; V92-C94 PolarHBondContact O-N 3.47Å; C94-E679 HydrophobicContact CB-CB 4.22Å; C94-E679 HydrophobicContact CB-CG 3.9Å
95	I	87.6	Confident	83.6	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-78.2	-38.4	177.8	-60.3	165.8	0	0	0	111.6	V91 V92 R93 Y97 K236 L239 Y240 F243 V676	V91-I95 HydrophobicContact CG1-CD1 3.88Å; V91-I95 WeakPolarHBondContact O-CG1 3.37Å; V91-I95 PolarHBondContact O-N 3.21Å; V92-I95 PolarHBondContact O-N 2.97Å; R93-I95 VanDerWaalsContact C-N 3.35Å; I95-Y97 PolarHBondContact O-N 2.83Å; I95-K236 HydrophobicContact CG2-CB 4.25Å; I95-K236 HydrophobicContact CG2-CG 4.4Å; I95-L239 HydrophobicContact CD1-CB 4.02Å; I95-L239 HydrophobicContact CG1-CB 4.29Å; I95-L239 HydrophobicContact CG2-CB 4.01Å; I95-L239 HydrophobicContact CG2-CD1 4.29Å; I95-Y240 HydrophobicContact CB-CD1 4.18Å; I95-Y240 HydrophobicContact CB-CE1 3.57Å; I95-Y240 HydrophobicContact CD1-CD1 3.82Å; I95-Y240 HydrophobicContact CD1-CE1 4.05Å; I95-Y240 HydrophobicContact CG1-CE1 4.41Å; I95-Y240 HydrophobicContact CG2-CD1 3.94Å; I95-Y240 HydrophobicContact CG2-CD2 4.15Å; I95-Y240 HydrophobicContact CG2-CE1 3.51Å; I95-Y240 HydrophobicContact CG2-CE2 3.74Å; I95-Y240 HydrophobicContact CG2-CG 4.24Å; I95-Y240 VanDerWaalsContact CG2-CZ 3.43Å; I95-F243 HydrophobicContact CD1-CD2 4.17Å; I95-V676 HydrophobicContact CD1-CG2 4.27Å; I95-V676 HydrophobicContact CG1-CG2 3.78Å
96	A	83.1	Confident	82.2	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-62.7	-46.4	-174.6	0	0	0	0	0	112.2	V92 K236 Y240	V92-A96 VanDerWaalsContact O-CB 3.26Å; V92-A96 WeakPolarHBondContact O-CB 3.35Å; V92-A96 PolarHBondContact O-N 2.93Å; A96-K236 PolarHBondContact O-NZ 3.46Å; A96-Y240 WeakPolarHBondContact CA-OH 3.3Å; A96-Y240 WeakPolarHBondContact CB-OH 3.42Å; A96-Y240 PolarHBondContact N-OH 3.47Å
97	Y	82.5	Confident	80.7	Confident	9 Å²	9	35.2 Å²	35.2	4%	0.035	19%	0.185	C	C	.	.	S	Bend	trans	-143.4	75.2	-176.7	46.3	-89.1	0	0	0	112	R93 I95 L263 Q269 Q272 I273 R683	R93-Y97 WeakPolarHBondContact CG-OH 3.17Å; R93-Y97 PolarHBondContact O-N 3.41Å; I95-Y97 PolarHBondContact O-N 2.83Å; Y97-L263 HydrophobicContact CE1-CD1 4.37Å; Y97-Q269 HydrophobicContact CD1-CB 4.37Å; Y97-Q269 HydrophobicContact CD1-CG 3.97Å; Y97-Q269 HydrophobicContact CD2-CB 4.22Å; Y97-Q269 HydrophobicContact CG-CB 3.89Å; Y97-Q269 HydrophobicContact CG-CG 3.9Å; Y97-Q272 HydrophobicContact CE2-CG 4.3Å; Y97-Q272 VanDerWaalsContact OH-CG 3.31Å; Y97-Q272 WeakPolarHBondContact OH-CG 3.31Å; Y97-I273 HydrophobicContact CD2-CD1 3.8Å; Y97-I273 HydrophobicContact CD2-CG1 3.74Å; Y97-I273 HydrophobicContact CE2-CD1 4.35Å; Y97-I273 HydrophobicContact CE2-CG1 3.77Å; Y97-R683 VanDerWaalsContact CE2-CZ 3.5Å; Y97-R683 PolarHBondContact OH-NH2 3.47Å
98	P	81.1	Confident	78.9	Confident	45 Å²	45	37.7 Å²	37.7	29%	0.292	21%	0.206	S	C	.	.			trans	-72.4	144.4	177	31.4	-36.3	0	0	0	111.4	F675 E679	P98-F675 HydrophobicContact CB-CE2 4.02Å; P98-F675 HydrophobicContact CB-CZ 3.56Å; P98-F675 HydrophobicContact CG-CZ 3.89Å; P98-E679 WeakPolarHBondContact CA-OE1 3.48Å
99	F	80.4	Confident	77.2	Confident	17 Å²	17	45 Å²	45	8%	0.075	23%	0.234	C	C	.	.			trans	-139.5	-11.7	-178.8	71.4	-81.9	0	0	0	114.3	I273 L316 L320 L323 E679 R683	F99-I273 HydrophobicContact CB-CD1 4.17Å; F99-I273 HydrophobicContact CD1-CD1 3.49Å; F99-I273 VanDerWaalsContact CD1-CD1 3.49Å; F99-I273 HydrophobicContact CD1-CG1 4.05Å; F99-I273 HydrophobicContact CD1-CG2 4.09Å; F99-I273 HydrophobicContact CE1-CD1 4.06Å; F99-I273 HydrophobicContact CE1-CG1 4.12Å; F99-I273 HydrophobicContact CE1-CG2 3.62Å; F99-I273 HydrophobicContact CE2-CG2 4.09Å; F99-I273 HydrophobicContact CG-CD1 3.92Å; F99-I273 HydrophobicContact CZ-CG2 3.62Å; F99-L316 HydrophobicContact CE2-CB 4Å; F99-L316 HydrophobicContact CE2-CD2 3.89Å; F99-L316 HydrophobicContact CZ-CB 4.44Å; F99-L316 HydrophobicContact CZ-CD2 4.16Å; F99-L320 HydrophobicContact CB-CD1 4.47Å; F99-L320 HydrophobicContact CD2-CB 4.13Å; F99-L323 HydrophobicContact CB-CD1 3.83Å; F99-E679 WeakPolarHBondContact CD1-OE1 3.25Å; F99-E679 PolarHBondContact N-OE1 2.74Å; F99-R683 HydrophobicContact CE1-CG 4.38Å
100	N	84.2	Confident	75.8	Confident	54 Å²	54	49.9 Å²	49.9	29%	0.289	25%	0.252	S	S	.	.	S	Bend	trans	-112.4	-54.5	-176.9	-179.1	73.4	0	0	0	113.3	L316 N319 E679 A682	N100-L316 HydrophobicContact CB-CD2 3.89Å; N100-L316 WeakPolarHBondContact OD1-CD2 3.21Å; N100-N319 PolarHBondContact OD1-ND2 3.25Å; N100-E679 WeakPolarHBondContact CB-OE2 3.44Å; N100-E679 PolarHBondContact N-OE1 2.68Å; N100-E679 PolarHBondContact N-OE2 3.12Å; N100-A682 VanDerWaalsContact ND2-CB 3.31Å; N100-A682 WeakPolarHBondContact ND2-CB 3.46Å
101	A	80.9	Confident	74.6	Confident	19 Å²	19	53.5 Å²	53.5	16%	0.157	27%	0.269	C	S	.	.			trans	-85.7	158	-175	0	0	0	0	0	112.9	F675 D678 E679	A101-F675 HydrophobicContact CB-CD2 3.78Å; A101-F675 HydrophobicContact CB-CE2 4.06Å; A101-F675 WeakPolarHBondContact O-CE2 3.33Å; A101-D678 HydrophobicContact CB-CB 4.12Å; A101-E679 HydrophobicContact CB-CB 4.23Å; A101-E679 WeakPolarHBondContact CB-OE2 3.43Å; A101-E679 PolarHBondContact N-OE2 3.18Å
102	K	80.2	Confident	73.6	Confident	186 Å²	186	59 Å²	59	81%	0.809	30%	0.295	S	S	*	.			trans	-128.4	148.9	170.4	-66	-179.7	-177.4	175.3	0	108.8	P104	K102-P104 WeakPolarHBondContact O-CD 3.41Å
103	Q	76.1	Confident	73.1	Confident	35 Å²	35	60.5 Å²	60.5	16%	0.164	30%	0.301	C	S	.	.			trans	-67.2	122.3	176.9	-69.6	-171.7	39.1	0	0	110.1	L234 F675	Q103-L234 PolarHBondContact NE2-O 2.71Å; Q103-F675 HydrophobicContact CG-CB 3.75Å; Q103-F675 HydrophobicContact CG-CD1 4.03Å; Q103-F675 HydrophobicContact CG-CD2 4.08Å; Q103-F675 HydrophobicContact CG-CG 3.67Å
104	P	73.1	Confident	72.6	Confident	38 Å²	38	60 Å²	60	25%	0.247	30%	0.3	C	S	.	.			trans	-72.2	131.9	-179.8	27.4	-32.3	0	0	0	111	K102 M107 P671 V674	K102-P104 WeakPolarHBondContact O-CD 3.41Å; P104-M107 HydrophobicContact CG-SD 4.32Å; P104-P671 HydrophobicContact CG-CB 4.13Å; P104-P671 VanDerWaalsContact O-CB 3.3Å; P104-P671 WeakPolarHBondContact O-CB 3.26Å; P104-V674 HydrophobicContact CG-CB 4.43Å; P104-V674 HydrophobicContact CG-CG1 4.34Å
105	T	65.3	Low	72.2	Confident	97 Å²	97	63.9 Å²	63.9	60%	0.595	32%	0.32	S	S	*	.	S	Bend	trans	-91.1	-5.9	-177.2	51.7	0	0	0	0	114.3	L232	T105-L232 WeakPolarHBondContact O-CD2 3.2Å
106	D	56.4	Low	71.9	Confident	154 Å²	154	71 Å²	71	82%	0.824	35%	0.351	S	S	*	.	S	Bend	trans	-98.9	-6.6	-168.1	-156.3	11.4	0	0	0	114.2	A108	D106-A108 PolarHBondContact O-N 2.8Å
107	M	55.3	Low	71.9	Confident	70 Å²	70	78.8 Å²	78.8	35%	0.345	39%	0.387	S	S	.	.			trans	-101.1	35.2	-166.5	-63.7	-171.9	72.3	0	0	115.4	P104 W668 P671	P104-M107 HydrophobicContact CG-SD 4.32Å; M107-W668 HydrophobicContact CE-CE3 3.4Å; M107-W668 VanDerWaalsContact CE-CE3 3.4Å; M107-W668 HydrophobicContact CE-CZ3 3.6Å; M107-P671 HydrophobicContact CB-CG 4.5Å
108	A	50	Low	71.8	Confident	52 Å²	52	81.5 Å²	81.5	43%	0.43	40%	0.4	S	S	.	.			trans	-102.7	80.2	-174.7	0	0	0	0	0	114.2	D106 R110 L232	D106-A108 PolarHBondContact O-N 2.8Å; A108-R110 PolarHBondContact O-N 2.86Å; A108-L232 HydrophobicContact CB-CD2 3.73Å
109	R	54.6	Low	72	Confident	155 Å²	155	79.8 Å²	79.8	59%	0.585	39%	0.388	S	S	*	.			trans	-83.9	100.4	150.4	-73.2	-172.8	-173.6	166.7	5.6	107.8	D710	R109-D710 IonicContact CZ-OD2 2.79Å; R109-D710 IonicContact NH1-OD2 2.79Å; R109-D710 PolarHBondContact NH1-OD2 3.07Å
110	R	57.3	Low	72.3	Confident	102 Å²	102	83.5 Å²	83.5	39%	0.385	41%	0.406	S	S	.	.			trans	-117.4	82.2	172.3	-66.5	-169.6	-172.8	178.1	6.3	109.1	A108 E231 Y663	A108-R110 PolarHBondContact O-N 2.86Å; R110-E231 PolarHBondContact NH1-O 3.24Å; R110-E231 PolarHBondContact NH2-O 3.28Å; R110-Y663 HydrophobicContact CB-CD1 4.39Å
111	Q	64.8	Low	72.4	Confident	76 Å²	76	84.6 Å²	84.6	36%	0.355	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.6	167.2	-61.5	-173.5	-21	0	0	108.1	K113 S169 N171 S664	Q111-K113 PolarHBondContact O-N 3.47Å; Q111-S169 VanDerWaalsContact CB-CB 3.48Å; Q111-S169 PolarHBondContact OE1-OG 3.38Å; Q111-N171 PolarHBondContact NE2-ND2 3.42Å; Q111-S664 PolarHBondContact O-N 3.21Å
112	Q	68.1	Low	72.6	Confident	116 Å²	116	84 Å²	84	54%	0.542	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	129.7	-179	-170	175.5	-0.8	0	0	109.6	S169	Q112-S169 WeakPolarHBondContact O-CA 3.35Å
113	K	77.9	Confident	73	Confident	31 Å²	31	77 Å²	77	14%	0.135	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-71.5	136.6	178	174.2	169.3	155	171.5	0	108.9	Q111 Q118 L659 S662	Q111-K113 PolarHBondContact O-N 3.47Å; K113-Q118 PolarHBondContact O-OE1 3.15Å; K113-L659 PolarHBondContact NZ-O 2.95Å; K113-L659 VanDerWaalsContact NZ-O 3.12Å; K113-S662 WeakPolarHBondContact CB-O 3.36Å; K113-S662 PolarHBondContact N-O 3.06Å
114	L	77.3	Confident	73.6	Confident	3 Å²	3	79.9 Å²	79.9	2%	0.016	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-81.1	130	172.1	-78.6	168.3	0	0	0	109.8	Q118 V163 C168 F173	L114-Q118 HydrophobicContact CD2-CB 4.02Å; L114-V163 WeakPolarHBondContact O-CG1 3.12Å; L114-C168 PolarHBondContact N-O 3.37Å; L114-F173 HydrophobicContact CD1-CD1 4.21Å; L114-F173 HydrophobicContact CD1-CD2 3.53Å; L114-F173 HydrophobicContact CD1-CE1 4.22Å; L114-F173 HydrophobicContact CD1-CE2 3.55Å; L114-F173 HydrophobicContact CD1-CG 3.89Å; L114-F173 HydrophobicContact CD1-CZ 3.9Å
115	N	79.8	Confident	74.3	Confident	80 Å²	80	80.8 Å²	80.8	43%	0.428	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-97.2	162.5	174.1	-72.2	-15.9	0	0	0	111.5	Q117 Q118 L119	N115-Q117 PolarHBondContact O-N 3.32Å; N115-Q118 WeakPolarHBondContact O-CB 3.32Å; N115-Q118 PolarHBondContact O-N 3.48Å; N115-L119 PolarHBondContact O-N 3.16Å
116	K	82.5	Confident	75.3	Confident	150 Å²	150	76.1 Å²	76.1	65%	0.652	36%	0.359	S	S	*	.	H	α-helix	trans	-53.8	-39.4	178.5	-172.8	178.9	178	-178.7	0	112.9	L119 Q120	K116-L119 PolarHBondContact O-N 3.23Å; K116-Q120 PolarHBondContact O-N 2.91Å; K116-Q120 VanDerWaalsContact O-N 3.14Å
117	Q	82.7	Confident	76.9	Confident	166 Å²	166	73 Å²	73	78%	0.776	34%	0.339	S	S	*	.	H	α-helix	trans	-66.1	-40.8	176.7	-70	174.1	-18.4	0	0	112.1	N115 Q120 L121	N115-Q117 PolarHBondContact O-N 3.32Å; Q117-Q120 PolarHBondContact O-N 3.16Å; Q117-L121 PolarHBondContact O-N 3.41Å
118	Q	80.9	Confident	78.3	Confident	66 Å²	66	70.6 Å²	70.6	31%	0.308	33%	0.331	S	S	.	.	H	α-helix	trans	-69	-36.4	178	-68.5	172.3	-34.4	0	0	111.8	K113 L114 N115 Q120 L121 L122	K113-Q118 PolarHBondContact O-OE1 3.15Å; L114-Q118 HydrophobicContact CD2-CB 4.02Å; N115-Q118 WeakPolarHBondContact O-CB 3.32Å; N115-Q118 PolarHBondContact O-N 3.48Å; Q118-Q120 VanDerWaalsContact C-N 3.32Å; Q118-L121 PolarHBondContact O-N 3.47Å; Q118-L122 WeakPolarHBondContact O-CB 3.24Å; Q118-L122 PolarHBondContact O-N 3.18Å
119	L	85	Confident	80.1	Confident	8 Å²	8	68.7 Å²	68.7	4%	0.042	31%	0.313	C	S	.	.	H	α-helix	trans	-61.7	-41.6	172.4	177.9	66.4	0	0	0	111.4	N115 K116 L122 K123 V159 A160 V163 F173	N115-L119 PolarHBondContact O-N 3.16Å; K116-L119 PolarHBondContact O-N 3.23Å; L119-L122 PolarHBondContact O-N 2.81Å; L119-K123 WeakPolarHBondContact O-CG 3.32Å; L119-K123 PolarHBondContact O-N 3.36Å; L119-V159 HydrophobicContact CD1-CG1 4.46Å; L119-A160 HydrophobicContact CD2-CB 4.45Å; L119-V163 HydrophobicContact CB-CG1 4.18Å; L119-V163 HydrophobicContact CB-CG2 4.47Å; L119-V163 HydrophobicContact CD1-CG2 4.4Å; L119-V163 HydrophobicContact CD2-CB 4.23Å; L119-V163 HydrophobicContact CD2-CG1 4.35Å; L119-V163 HydrophobicContact CD2-CG2 4.02Å; L119-F173 HydrophobicContact CD1-CE1 3.66Å; L119-F173 HydrophobicContact CD1-CZ 3.82Å
120	Q	85.8	Confident	81.6	Confident	96 Å²	96	63.4 Å²	63.4	45%	0.449	30%	0.296	S	S	.	.	H	α-helix	trans	-65.3	-46.7	178.6	-175.1	57.6	32.6	0	0	111.4	K116 Q117 Q118 L122 K123 E124	K116-Q120 PolarHBondContact O-N 2.91Å; K116-Q120 VanDerWaalsContact O-N 3.14Å; Q117-Q120 PolarHBondContact O-N 3.16Å; Q118-Q120 VanDerWaalsContact C-N 3.32Å; Q120-L122 VanDerWaalsContact C-N 3.27Å; Q120-L122 PolarHBondContact O-N 2.92Å; Q120-K123 WeakPolarHBondContact O-CB 3.27Å; Q120-K123 PolarHBondContact O-N 2.84Å; Q120-K123 VanDerWaalsContact O-N 3.13Å; Q120-E124 WeakPolarHBondContact CG-OE1 3.28Å; Q120-E124 PolarHBondContact NE2-OE1 3.4Å; Q120-E124 PolarHBondContact O-N 3.17Å
121	L	86.4	Confident	83	Confident	77 Å²	77	63.2 Å²	63.2	40%	0.403	30%	0.302	S	S	.	.	H	α-helix	trans	-58.4	-39.9	173.7	-178.5	65.5	0	0	0	112	Q117 Q118 E124 R125	Q117-L121 PolarHBondContact O-N 3.41Å; Q118-L121 PolarHBondContact O-N 3.47Å; L121-E124 PolarHBondContact O-N 3.02Å; L121-R125 WeakPolarHBondContact O-CG 3.45Å; L121-R125 PolarHBondContact O-N 2.88Å
122	L	86.1	Confident	83.7	Confident	6 Å²	6	62.5 Å²	62.5	3%	0.031	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-40.7	176.8	-171.2	66.6	0	0	0	111.8	Q118 L119 Q120 E124 R125 F126 L154 F173 Y211	Q118-L122 WeakPolarHBondContact O-CB 3.24Å; Q118-L122 PolarHBondContact O-N 3.18Å; L119-L122 PolarHBondContact O-N 2.81Å; Q120-L122 VanDerWaalsContact C-N 3.27Å; Q120-L122 PolarHBondContact O-N 2.92Å; L122-E124 VanDerWaalsContact C-N 3.33Å; L122-E124 PolarHBondContact O-N 2.92Å; L122-R125 PolarHBondContact O-N 3.01Å; L122-F126 HydrophobicContact CD1-CD2 3.8Å; L122-F126 HydrophobicContact CD1-CE2 3.53Å; L122-F126 HydrophobicContact CG-CD2 4.01Å; L122-F126 HydrophobicContact CG-CE2 4.06Å; L122-F126 VanDerWaalsContact O-CD2 3.28Å; L122-F126 WeakPolarHBondContact O-CD2 3.34Å; L122-F126 PolarHBondContact O-N 3.39Å; L122-L154 HydrophobicContact CD2-CD2 3.94Å; L122-F173 HydrophobicContact CD2-CD1 3.57Å; L122-F173 HydrophobicContact CD2-CE1 3.86Å; L122-Y211 HydrophobicContact CD1-CD2 3.47Å; L122-Y211 VanDerWaalsContact CD1-CD2 3.47Å; L122-Y211 HydrophobicContact CD1-CE2 3.84Å; L122-Y211 HydrophobicContact CD1-CG 4.23Å; L122-Y211 HydrophobicContact CD2-CD2 4.32Å; L122-Y211 HydrophobicContact CD2-CE2 4.09Å
123	K	88.1	Confident	84.2	Confident	39 Å²	39	63.2 Å²	63.2	17%	0.17	32%	0.319	C	S	.	.	H	α-helix	trans	-59.8	-44.9	174.4	-73.8	174.9	173.9	-170	0	111.2	L119 Q120 F126 Q127 Y150 L154	L119-K123 WeakPolarHBondContact O-CG 3.32Å; L119-K123 PolarHBondContact O-N 3.36Å; Q120-K123 WeakPolarHBondContact O-CB 3.27Å; Q120-K123 PolarHBondContact O-N 2.84Å; Q120-K123 VanDerWaalsContact O-N 3.13Å; K123-F126 PolarHBondContact O-N 3.38Å; K123-Q127 VanDerWaalsContact O-CB 3.3Å; K123-Q127 WeakPolarHBondContact O-CB 3.42Å; K123-Q127 PolarHBondContact O-N 3.44Å; K123-Y150 HydrophobicContact CB-CE2 4.2Å; K123-Y150 HydrophobicContact CG-CE2 4.5Å; K123-Y150 WeakPolarHBondContact O-CE2 3.41Å; K123-L154 WeakPolarHBondContact CE-O 3.27Å; K123-L154 HydrophobicContact CG-CB 4.48Å; K123-L154 PolarHBondContact NZ-O 3.2Å
124	E	88.2	Confident	84.3	Confident	95 Å²	95	63.5 Å²	63.5	44%	0.444	32%	0.323	S	S	.	.	H	α-helix	trans	-62.6	-45	178.6	-72.4	160.4	-163.3	0	0	111.5	Q120 L121 L122 F126 Q127 A128	Q120-E124 WeakPolarHBondContact CG-OE1 3.28Å; Q120-E124 PolarHBondContact NE2-OE1 3.4Å; Q120-E124 PolarHBondContact O-N 3.17Å; L121-E124 PolarHBondContact O-N 3.02Å; L122-E124 VanDerWaalsContact C-N 3.33Å; L122-E124 PolarHBondContact O-N 2.92Å; E124-F126 PolarHBondContact O-N 3.33Å; E124-Q127 PolarHBondContact O-N 3.31Å; E124-A128 WeakPolarHBondContact O-CB 3.35Å; E124-A128 PolarHBondContact O-N 3.47Å
125	R	87.4	Confident	84.1	Confident	57 Å²	57	71.3 Å²	71.3	22%	0.215	36%	0.36	C	S	.	.	H	α-helix	trans	-60.8	-43.8	176.8	-71.8	174	-179	-164.5	-8.4	113.2	L121 L122 Q127 F129 Y211 R212	L121-R125 WeakPolarHBondContact O-CG 3.45Å; L121-R125 PolarHBondContact O-N 2.88Å; L122-R125 PolarHBondContact O-N 3.01Å; R125-Q127 VanDerWaalsContact C-N 3.33Å; R125-F129 PolarHBondContact O-N 3.13Å; R125-F129 VanDerWaalsContact O-N 3.12Å; R125-Y211 PolarHBondContact NH1-O 2.96Å; R125-R212 PolarHBondContact NH1-O 3.33Å
126	F	87.7	Confident	84.1	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-68.6	-33.9	177.4	-87.9	-105.1	0	0	0	112.1	L122 K123 E124 L130 V146 Y149 Y150 L154 Y207 I210	L122-F126 HydrophobicContact CD1-CD2 3.8Å; L122-F126 HydrophobicContact CD1-CE2 3.53Å; L122-F126 HydrophobicContact CG-CD2 4.01Å; L122-F126 HydrophobicContact CG-CE2 4.06Å; L122-F126 VanDerWaalsContact O-CD2 3.28Å; L122-F126 WeakPolarHBondContact O-CD2 3.34Å; L122-F126 PolarHBondContact O-N 3.39Å; K123-F126 PolarHBondContact O-N 3.38Å; E124-F126 PolarHBondContact O-N 3.33Å; F126-L130 WeakPolarHBondContact O-CG 3.27Å; F126-L130 PolarHBondContact O-N 3.18Å; F126-L130 VanDerWaalsContact O-N 3.14Å; F126-V146 HydrophobicContact CD1-CG1 3.69Å; F126-V146 HydrophobicContact CE1-CG1 4.05Å; F126-Y149 HydrophobicContact CD1-CD1 4.16Å; F126-Y149 HydrophobicContact CD1-CE1 4.43Å; F126-Y149 AromaticContact CE1-CD1 3.77Å; F126-Y149 HydrophobicContact CE1-CD1 3.77Å; F126-Y149 AromaticContact CE1-CE1 3.86Å; F126-Y149 HydrophobicContact CE1-CE1 3.86Å; F126-Y149 HydrophobicContact CZ-CD1 4.49Å; F126-Y149 HydrophobicContact CZ-CE1 4.13Å; F126-Y150 HydrophobicContact CB-CD2 3.81Å; F126-Y150 HydrophobicContact CB-CE2 4.36Å; F126-L154 HydrophobicContact CB-CD1 3.97Å; F126-L154 HydrophobicContact CD1-CD1 3.86Å; F126-L154 HydrophobicContact CD2-CD1 4.06Å; F126-L154 HydrophobicContact CE1-CD1 4.44Å; F126-L154 HydrophobicContact CG-CD1 3.66Å; F126-Y207 HydrophobicContact CE1-CD2 4.13Å; F126-Y207 HydrophobicContact CE1-CE2 4.18Å; F126-Y207 HydrophobicContact CE2-CE2 4.37Å; F126-Y207 AromaticContact CZ-CD2 3.6Å; F126-Y207 HydrophobicContact CZ-CD2 3.6Å; F126-Y207 AromaticContact CZ-CE2 3.46Å; F126-Y207 HydrophobicContact CZ-CE2 3.46Å; F126-Y207 VanDerWaalsContact CZ-CE2 3.46Å; F126-I210 HydrophobicContact CD1-CG2 4.35Å; F126-I210 HydrophobicContact CD2-CG2 3.6Å; F126-I210 HydrophobicContact CE1-CG2 4.3Å; F126-I210 HydrophobicContact CE2-CB 4.3Å; F126-I210 HydrophobicContact CE2-CG2 3.55Å; F126-I210 HydrophobicContact CG-CG2 4.01Å; F126-I210 HydrophobicContact CZ-CB 4.35Å; F126-I210 HydrophobicContact CZ-CG2 3.9Å
127	Q	88.3	Confident	83.7	Confident	87 Å²	87	69.7 Å²	69.7	41%	0.407	36%	0.356	S	S	.	.	H	α-helix	trans	-70.5	-42.4	175.5	-171.4	169.5	-1.9	0	0	111.9	K123 E124 R125 F129 L130 N131 Y150	K123-Q127 VanDerWaalsContact O-CB 3.3Å; K123-Q127 WeakPolarHBondContact O-CB 3.42Å; K123-Q127 PolarHBondContact O-N 3.44Å; E124-Q127 PolarHBondContact O-N 3.31Å; R125-Q127 VanDerWaalsContact C-N 3.33Å; Q127-F129 VanDerWaalsContact C-N 3.29Å; Q127-F129 PolarHBondContact O-N 3.25Å; Q127-L130 PolarHBondContact O-N 3.41Å; Q127-L130 VanDerWaalsContact O-N 3.09Å; Q127-N131 VanDerWaalsContact O-CG 3.27Å; Q127-N131 PolarHBondContact O-N 2.9Å; Q127-N131 PolarHBondContact O-OD1 3.03Å; Q127-Y150 HydrophobicContact CB-CE2 4.25Å; Q127-Y150 PolarHBondContact OE1-OH 3Å
128	A	86	Confident	83.6	Confident	21 Å²	21	63.5 Å²	63.5	17%	0.174	33%	0.333	C	S	.	.	H	α-helix	trans	-58.6	-40.8	173.8	0	0	0	0	0	111.8	E124 N131 G132 E133 T134	E124-A128 WeakPolarHBondContact O-CB 3.35Å; E124-A128 PolarHBondContact O-N 3.47Å; A128-N131 PolarHBondContact O-N 2.9Å; A128-G132 PolarHBondContact O-N 3.25Å; A128-E133 HydrophobicContact CB-CB 4.23Å; A128-E133 WeakPolarHBondContact O-CB 3.47Å; A128-E133 PolarHBondContact O-N 3.14Å; A128-T134 HydrophobicContact CB-CG2 4.38Å
129	F	87.5	Confident	83.6	Confident	11 Å²	11	63.4 Å²	63.4	5%	0.048	34%	0.335	C	S	.	.	H	α-helix	trans	-61	-45.3	172.7	171.6	-93.1	0	0	0	112.2	R125 Q127 N131 G132 T134 I136 A138 F142 V146 I210	R125-F129 PolarHBondContact O-N 3.13Å; R125-F129 VanDerWaalsContact O-N 3.12Å; Q127-F129 VanDerWaalsContact C-N 3.29Å; Q127-F129 PolarHBondContact O-N 3.25Å; F129-N131 VanDerWaalsContact C-N 3.28Å; F129-N131 PolarHBondContact O-N 3.01Å; F129-G132 PolarHBondContact O-N 2.98Å; F129-G132 VanDerWaalsContact O-N 3.12Å; F129-T134 HydrophobicContact CB-CG2 4.09Å; F129-T134 VanDerWaalsContact CD2-OG1 3.28Å; F129-T134 WeakPolarHBondContact CD2-OG1 3.34Å; F129-I136 HydrophobicContact CD2-CB 4.15Å; F129-I136 HydrophobicContact CD2-CD1 4.49Å; F129-I136 HydrophobicContact CD2-CG2 4.5Å; F129-I136 HydrophobicContact CE2-CB 4Å; F129-I136 HydrophobicContact CE2-CG2 3.99Å; F129-A138 HydrophobicContact CE2-CB 3.94Å; F129-A138 HydrophobicContact CZ-CB 3.54Å; F129-F142 HydrophobicContact CE1-CD1 4.42Å; F129-F142 HydrophobicContact CE1-CE1 4.19Å; F129-F142 HydrophobicContact CE2-CE1 4.29Å; F129-F142 AromaticContact CZ-CD1 3.84Å; F129-F142 HydrophobicContact CZ-CD1 3.84Å; F129-F142 AromaticContact CZ-CE1 3.65Å; F129-F142 HydrophobicContact CZ-CE1 3.65Å; F129-V146 HydrophobicContact CD1-CB 4.37Å; F129-V146 HydrophobicContact CD1-CG1 3.76Å; F129-V146 HydrophobicContact CE1-CB 4Å; F129-V146 HydrophobicContact CE1-CG1 3.91Å; F129-V146 HydrophobicContact CE1-CG2 3.98Å; F129-I210 HydrophobicContact CB-CD1 4.34Å; F129-I210 HydrophobicContact CB-CG1 4.42Å; F129-I210 HydrophobicContact CB-CG2 4.41Å; F129-I210 HydrophobicContact CD1-CD1 3.94Å; F129-I210 HydrophobicContact CD2-CD1 3.74Å; F129-I210 HydrophobicContact CD2-CG1 3.97Å; F129-I210 HydrophobicContact CE1-CD1 4.2Å; F129-I210 HydrophobicContact CE2-CD1 4.04Å; F129-I210 HydrophobicContact CG-CD1 3.72Å; F129-I210 HydrophobicContact CG-CG1 4.15Å; F129-I210 HydrophobicContact CZ-CD1 4.25Å
130	L	86.5	Confident	83.5	Confident	44 Å²	44	70.3 Å²	70.3	23%	0.23	37%	0.367	C	S	.	.	H	α-helix	trans	-67.4	-27.8	178.9	-70.3	172.4	0	0	0	113.3	F126 Q127 G132 V146 R147 Y150	F126-L130 WeakPolarHBondContact O-CG 3.27Å; F126-L130 PolarHBondContact O-N 3.18Å; F126-L130 VanDerWaalsContact O-N 3.14Å; Q127-L130 PolarHBondContact O-N 3.41Å; Q127-L130 VanDerWaalsContact O-N 3.09Å; L130-G132 VanDerWaalsContact C-N 3.28Å; L130-V146 HydrophobicContact CD2-CB 4.41Å; L130-V146 HydrophobicContact CD2-CG1 4.11Å; L130-V146 HydrophobicContact CG-CG1 4.35Å; L130-R147 HydrophobicContact CD1-CB 4.49Å; L130-R147 HydrophobicContact CD2-CB 3.95Å; L130-Y150 HydrophobicContact CD1-CD1 4.18Å; L130-Y150 HydrophobicContact CD1-CG 4.11Å
131	N	86	Confident	83.3	Confident	98 Å²	98	67.4 Å²	67.4	52%	0.524	36%	0.359	S	S	.	.	H	α-helix	trans	-78.8	-10	174.2	-68.1	-7.4	0	0	0	113.2	Q127 A128 F129 E133	Q127-N131 VanDerWaalsContact O-CG 3.27Å; Q127-N131 PolarHBondContact O-N 2.9Å; Q127-N131 PolarHBondContact O-OD1 3.03Å; A128-N131 PolarHBondContact O-N 2.9Å; F129-N131 VanDerWaalsContact C-N 3.28Å; F129-N131 PolarHBondContact O-N 3.01Å; N131-E133 HydrophobicContact CB-CG 4.01Å; N131-E133 VanDerWaalsContact CB-OE1 3.3Å; N131-E133 WeakPolarHBondContact CB-OE1 3.22Å; N131-E133 PolarHBondContact ND2-OE1 3.12Å
132	G	80.6	Confident	83.2	Confident	61 Å²	61	63.7 Å²	63.7	63%	0.629	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	16.2	-177.4	0	0	0	0	0	114.6	A128 F129 L130 T134	A128-G132 PolarHBondContact O-N 3.25Å; F129-G132 PolarHBondContact O-N 2.98Å; F129-G132 VanDerWaalsContact O-N 3.12Å; L130-G132 VanDerWaalsContact C-N 3.28Å; G132-T134 VanDerWaalsContact C-N 3.29Å; G132-T134 PolarHBondContact O-N 3.13Å
133	E	77.8	Confident	83.2	Confident	132 Å²	132	65.1 Å²	65.1	62%	0.617	35%	0.35	S	S	*	.			trans	-80.6	-8.8	-177.6	-63.3	165.6	-153.8	0	0	113	A128 N131	A128-E133 HydrophobicContact CB-CB 4.23Å; A128-E133 WeakPolarHBondContact O-CB 3.47Å; A128-E133 PolarHBondContact O-N 3.14Å; N131-E133 HydrophobicContact CB-CG 4.01Å; N131-E133 VanDerWaalsContact CB-OE1 3.3Å; N131-E133 WeakPolarHBondContact CB-OE1 3.22Å; N131-E133 PolarHBondContact ND2-OE1 3.12Å
134	T	79.3	Confident	83	Confident	37 Å²	37	66.1 Å²	66.1	23%	0.227	36%	0.357	C	S	.	.	S	Bend	trans	-104.9	145.7	-177.4	62.2	0	0	0	0	112.6	A128 F129 G132 I136	A128-T134 HydrophobicContact CB-CG2 4.38Å; F129-T134 HydrophobicContact CB-CG2 4.09Å; F129-T134 VanDerWaalsContact CD2-OG1 3.28Å; F129-T134 WeakPolarHBondContact CD2-OG1 3.34Å; G132-T134 VanDerWaalsContact C-N 3.29Å; G132-T134 PolarHBondContact O-N 3.13Å; T134-I136 PolarHBondContact O-N 3.18Å
135	Q	74.2	Confident	82.9	Confident	167 Å²	167	61.6 Å²	61.6	78%	0.78	34%	0.336	S	S	*	.			trans	-74.7	15.7	178.1	-59.3	-174.1	18	0	0	115.4	I137 E214	Q135-I137 PolarHBondContact O-N 3.25Å; Q135-E214 PolarHBondContact N-OE1 3.1Å
136	I	79.8	Confident	82.8	Confident	43 Å²	43	58.9 Å²	58.9	22%	0.221	33%	0.326	C	S	.	.			trans	-85.5	112.3	-174	-59.8	173.7	0	0	0	110.2	F129 T134 A138 K206 A209 I210	F129-I136 HydrophobicContact CD2-CB 4.15Å; F129-I136 HydrophobicContact CD2-CD1 4.49Å; F129-I136 HydrophobicContact CD2-CG2 4.5Å; F129-I136 HydrophobicContact CE2-CB 4Å; F129-I136 HydrophobicContact CE2-CG2 3.99Å; T134-I136 PolarHBondContact O-N 3.18Å; I136-A138 PolarHBondContact O-N 3.49Å; I136-K206 HydrophobicContact CG2-CB 4.39Å; I136-K206 HydrophobicContact CG2-CG 4.38Å; I136-A209 HydrophobicContact CD1-CB 3.95Å; I136-I210 HydrophobicContact CD1-CB 4.32Å; I136-I210 HydrophobicContact CD1-CG1 3.45Å; I136-I210 VanDerWaalsContact CD1-CG1 3.45Å
137	I	74.3	Confident	82.8	Confident	153 Å²	153	64.7 Å²	64.7	79%	0.785	35%	0.347	S	S	*	.			trans	-68.5	116.1	178.5	-56.5	173.2	0	0	0	110.4	Q135 K206	Q135-I137 PolarHBondContact O-N 3.25Å; I137-K206 VanDerWaalsContact O-CE 3.28Å; I137-K206 WeakPolarHBondContact O-CE 3.46Å; I137-K206 PolarHBondContact O-NZ 3.48Å
138	A	79.5	Confident	82.5	Confident	36 Å²	36	61.8 Å²	61.8	30%	0.298	34%	0.337	S	S	.	.			trans	-129	140.6	-176.7	0	0	0	0	0	112.4	F129 I136 F142	F129-A138 HydrophobicContact CE2-CB 3.94Å; F129-A138 HydrophobicContact CZ-CB 3.54Å; I136-A138 PolarHBondContact O-N 3.49Å; A138-F142 HydrophobicContact CB-CD1 3.71Å; A138-F142 HydrophobicContact CB-CE1 4.41Å
139	D	82	Confident	82.5	Confident	64 Å²	64	60.8 Å²	60.8	34%	0.342	33%	0.329	S	S	.	.			trans	-81.2	155.6	168.7	52.1	-49.8	0	0	0	110.7	A141 F142 C143 K206	D139-A141 PolarHBondContact O-N 3.22Å; D139-F142 WeakPolarHBondContact O-CB 3.46Å; D139-F142 PolarHBondContact O-N 2.89Å; D139-F142 WeakPolarHBondContact OD1-CB 3.29Å; D139-C143 PolarHBondContact O-N 2.61Å; D139-K206 IonicContact OD1-NZ 3.26Å; D139-K206 PolarHBondContact OD1-NZ 3.01Å
140	E	81.9	Confident	82.5	Confident	153 Å²	153	61 Å²	61	72%	0.715	33%	0.329	S	S	*	.	H	α-helix	trans	-58.2	-37.5	-177.1	-170.5	-179.9	176.5	0	0	112.4	F142 C143 N144	E140-F142 PolarHBondContact O-N 3.18Å; E140-C143 PolarHBondContact O-N 3.1Å; E140-N144 WeakPolarHBondContact O-CB 2.96Å; E140-N144 VanDerWaalsContact O-CG 3.31Å; E140-N144 PolarHBondContact O-N 2.93Å; E140-N144 PolarHBondContact O-ND2 3.4Å
141	A	81.8	Confident	82.3	Confident	34 Å²	34	63.4 Å²	63.4	28%	0.281	34%	0.339	S	S	.	.	H	α-helix	trans	-62.1	-41.2	176	0	0	0	0	0	112.3	D139 A145 W203	D139-A141 PolarHBondContact O-N 3.22Å; A141-A145 PolarHBondContact O-N 3.04Å; A141-W203 HydrophobicContact CB-CH2 4Å; A141-W203 HydrophobicContact CB-CZ2 3.89Å
142	F	84.9	Confident	82	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-67.9	-43.4	174.4	-178	-106	0	0	0	111.8	F129 A138 D139 E140 N144 A145 V146 F177 W203 K206 I210	F129-F142 HydrophobicContact CE1-CD1 4.42Å; F129-F142 HydrophobicContact CE1-CE1 4.19Å; F129-F142 HydrophobicContact CE2-CE1 4.29Å; F129-F142 AromaticContact CZ-CD1 3.84Å; F129-F142 HydrophobicContact CZ-CD1 3.84Å; F129-F142 AromaticContact CZ-CE1 3.65Å; F129-F142 HydrophobicContact CZ-CE1 3.65Å; A138-F142 HydrophobicContact CB-CD1 3.71Å; A138-F142 HydrophobicContact CB-CE1 4.41Å; D139-F142 WeakPolarHBondContact O-CB 3.46Å; D139-F142 PolarHBondContact O-N 2.89Å; D139-F142 WeakPolarHBondContact OD1-CB 3.29Å; E140-F142 PolarHBondContact O-N 3.18Å; F142-N144 VanDerWaalsContact C-N 3.28Å; F142-N144 PolarHBondContact O-N 3.23Å; F142-A145 WeakPolarHBondContact O-CB 3.26Å; F142-A145 PolarHBondContact O-N 2.8Å; F142-A145 VanDerWaalsContact O-N 3.11Å; F142-V146 HydrophobicContact CD1-CG2 4.06Å; F142-V146 HydrophobicContact CD2-CG2 4.39Å; F142-V146 HydrophobicContact CE1-CG2 3.68Å; F142-V146 HydrophobicContact CE2-CG2 4.04Å; F142-V146 HydrophobicContact CG-CG2 4.42Å; F142-V146 HydrophobicContact CZ-CG2 3.66Å; F142-V146 WeakPolarHBondContact O-CG2 3.38Å; F142-V146 PolarHBondContact O-N 3.5Å; F142-F177 HydrophobicContact CE2-CE1 4.18Å; F142-F177 AromaticContact CE2-CZ 3.76Å; F142-F177 HydrophobicContact CE2-CZ 3.76Å; F142-F177 HydrophobicContact CZ-CZ 4.34Å; F142-W203 HydrophobicContact CB-CD2 4.31Å; F142-W203 HydrophobicContact CB-CZ2 4.08Å; F142-W203 HydrophobicContact CD2-CB 3.79Å; F142-W203 AromaticContact CD2-CD1 3.79Å; F142-W203 AromaticContact CD2-CD2 3.57Å; F142-W203 HydrophobicContact CD2-CD2 3.57Å; F142-W203 HydrophobicContact CD2-CE3 4.01Å; F142-W203 AromaticContact CD2-CG 3.45Å; F142-W203 HydrophobicContact CD2-CG 3.45Å; F142-W203 VanDerWaalsContact CD2-CG 3.45Å; F142-W203 HydrophobicContact CE2-CB 3.78Å; F142-W203 HydrophobicContact CE2-CD2 4.43Å; F142-W203 AromaticContact CE2-CG 3.99Å; F142-W203 HydrophobicContact CE2-CG 3.99Å; F142-W203 WeakPolarHBondContact CE2-O 3.18Å; F142-W203 HydrophobicContact CG-CD2 4.41Å; F142-W203 HydrophobicContact CG-CG 4.4Å; F142-K206 HydrophobicContact CD1-CD 4.05Å; F142-K206 HydrophobicContact CE1-CB 3.78Å; F142-K206 HydrophobicContact CE1-CD 3.92Å; F142-K206 HydrophobicContact CE2-CB 4.06Å; F142-K206 HydrophobicContact CE2-CD 4.48Å; F142-K206 HydrophobicContact CG-CD 4.37Å; F142-K206 HydrophobicContact CZ-CB 3.41Å; F142-K206 VanDerWaalsContact CZ-CB 3.41Å; F142-K206 HydrophobicContact CZ-CD 4.16Å; F142-K206 HydrophobicContact CZ-CG 4.43Å; F142-I210 HydrophobicContact CE1-CD1 4.18Å; F142-I210 HydrophobicContact CZ-CD1 4.27Å
143	C	85.1	Confident	82.2	Confident	35 Å²	35	58.8 Å²	58.8	24%	0.236	30%	0.302	C	S	.	.	H	α-helix	trans	-57.9	-41.6	175.5	-69.7	0	0	0	0	111.9	D139 E140 V146 R147	D139-C143 PolarHBondContact O-N 2.61Å; E140-C143 PolarHBondContact O-N 3.1Å; C143-V146 PolarHBondContact O-N 3.49Å; C143-R147 WeakPolarHBondContact O-CB 3.33Å; C143-R147 PolarHBondContact O-N 2.88Å
144	N	84.4	Confident	82.5	Confident	61 Å²	61	52.5 Å²	52.5	33%	0.326	27%	0.272	S	S	.	.	H	α-helix	trans	-66.8	-36.3	176.1	-72.3	-22.3	0	0	0	112.5	E140 F142 R147 S148 R184	E140-N144 WeakPolarHBondContact O-CB 2.96Å; E140-N144 VanDerWaalsContact O-CG 3.31Å; E140-N144 PolarHBondContact O-N 2.93Å; E140-N144 PolarHBondContact O-ND2 3.4Å; F142-N144 VanDerWaalsContact C-N 3.28Å; F142-N144 PolarHBondContact O-N 3.23Å; N144-R147 PolarHBondContact OD1-NH1 3.13Å; N144-S148 WeakPolarHBondContact O-CB 3.44Å; N144-S148 PolarHBondContact O-N 2.62Å; N144-R184 PolarHBondContact O-NH1 3.02Å
145	A	85.2	Confident	82.7	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-67.1	-42.3	173.9	0	0	0	0	0	112.4	A141 F142 S148 Y149 I181 W203	A141-A145 PolarHBondContact O-N 3.04Å; F142-A145 WeakPolarHBondContact O-CB 3.26Å; F142-A145 PolarHBondContact O-N 2.8Å; F142-A145 VanDerWaalsContact O-N 3.11Å; A145-S148 PolarHBondContact O-N 3.12Å; A145-Y149 WeakPolarHBondContact O-CB 3.32Å; A145-Y149 PolarHBondContact O-N 3.13Å; A145-I181 HydrophobicContact CB-CG2 4.01Å; A145-W203 HydrophobicContact CB-CZ3 3.96Å
146	V	87.1	Confident	83.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.7	-41.4	176.1	176.4	0	0	0	0	111.2	F126 F129 L130 F142 C143 Y149 Y150 F177	F126-V146 HydrophobicContact CD1-CG1 3.69Å; F126-V146 HydrophobicContact CE1-CG1 4.05Å; F129-V146 HydrophobicContact CD1-CB 4.37Å; F129-V146 HydrophobicContact CD1-CG1 3.76Å; F129-V146 HydrophobicContact CE1-CB 4Å; F129-V146 HydrophobicContact CE1-CG1 3.91Å; F129-V146 HydrophobicContact CE1-CG2 3.98Å; L130-V146 HydrophobicContact CD2-CB 4.41Å; L130-V146 HydrophobicContact CD2-CG1 4.11Å; L130-V146 HydrophobicContact CG-CG1 4.35Å; F142-V146 HydrophobicContact CD1-CG2 4.06Å; F142-V146 HydrophobicContact CD2-CG2 4.39Å; F142-V146 HydrophobicContact CE1-CG2 3.68Å; F142-V146 HydrophobicContact CE2-CG2 4.04Å; F142-V146 HydrophobicContact CG-CG2 4.42Å; F142-V146 HydrophobicContact CZ-CG2 3.66Å; F142-V146 WeakPolarHBondContact O-CG2 3.38Å; F142-V146 PolarHBondContact O-N 3.5Å; C143-V146 PolarHBondContact O-N 3.49Å; V146-Y149 PolarHBondContact O-N 3.4Å; V146-Y150 WeakPolarHBondContact O-CB 3.48Å; V146-Y150 PolarHBondContact O-N 3.19Å; V146-F177 HydrophobicContact CG2-CE2 4.15Å; V146-F177 HydrophobicContact CG2-CZ 4.15Å
147	R	86.1	Confident	83.2	Confident	121 Å²	121	51.8 Å²	51.8	46%	0.457	27%	0.271	S	S	.	.	H	α-helix	trans	-61	-45.8	175.8	-169.6	-179.5	-67.1	128.6	-1	111.5	L130 C143 N144 Y150 E151	L130-R147 HydrophobicContact CD1-CB 4.49Å; L130-R147 HydrophobicContact CD2-CB 3.95Å; C143-R147 WeakPolarHBondContact O-CB 3.33Å; C143-R147 PolarHBondContact O-N 2.88Å; N144-R147 PolarHBondContact OD1-NH1 3.13Å; R147-Y150 PolarHBondContact O-N 2.73Å; R147-E151 PolarHBondContact O-N 3.25Å
148	S	83.1	Confident	83.5	Confident	27 Å²	27	45.7 Å²	45.7	19%	0.189	24%	0.238	C	C	.	.	H	α-helix	trans	-61.7	-43.9	174.9	173.4	0	0	0	0	112.2	N144 A145 Y150 V152 R184	N144-S148 WeakPolarHBondContact O-CB 3.44Å; N144-S148 PolarHBondContact O-N 2.62Å; A145-S148 PolarHBondContact O-N 3.12Å; S148-Y150 VanDerWaalsContact C-N 3.32Å; S148-Y150 PolarHBondContact O-N 3.26Å; S148-V152 VanDerWaalsContact O-CB 3.24Å; S148-V152 WeakPolarHBondContact O-CB 3.48Å; S148-V152 WeakPolarHBondContact O-CG2 3.38Å; S148-V152 PolarHBondContact O-N 3.35Å; S148-R184 PolarHBondContact OG-NH2 3.41Å
149	Y	86.2	Confident	83.7	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.4	-39.2	175.9	177.8	-106.6	0	0	0	112.4	F126 A145 V146 F153 L154 F173 V176 F177 Y207	F126-Y149 HydrophobicContact CD1-CD1 4.16Å; F126-Y149 HydrophobicContact CD1-CE1 4.43Å; F126-Y149 AromaticContact CE1-CD1 3.77Å; F126-Y149 HydrophobicContact CE1-CD1 3.77Å; F126-Y149 AromaticContact CE1-CE1 3.86Å; F126-Y149 HydrophobicContact CE1-CE1 3.86Å; F126-Y149 HydrophobicContact CZ-CD1 4.49Å; F126-Y149 HydrophobicContact CZ-CE1 4.13Å; A145-Y149 WeakPolarHBondContact O-CB 3.32Å; A145-Y149 PolarHBondContact O-N 3.13Å; V146-Y149 PolarHBondContact O-N 3.4Å; Y149-F153 HydrophobicContact CD2-CB 3.91Å; Y149-F153 HydrophobicContact CD2-CD1 4Å; Y149-F153 HydrophobicContact CD2-CG 4.19Å; Y149-F153 HydrophobicContact CE1-CD1 4.32Å; Y149-F153 HydrophobicContact CE2-CB 4.01Å; Y149-F153 AromaticContact CE2-CD1 3.22Å; Y149-F153 HydrophobicContact CE2-CD1 3.22Å; Y149-F153 AromaticContact CE2-CE1 3.82Å; Y149-F153 HydrophobicContact CE2-CE1 3.82Å; Y149-F153 AromaticContact CE2-CG 3.76Å; Y149-F153 HydrophobicContact CE2-CG 3.76Å; Y149-F153 AromaticContact CZ-CD1 3.42Å; Y149-F153 VanDerWaalsContact CZ-CD1 3.42Å; Y149-F153 AromaticContact CZ-CE1 3.8Å; Y149-F153 WeakPolarHBondContact O-CA 3.48Å; Y149-F153 VanDerWaalsContact O-CB 3.28Å; Y149-F153 WeakPolarHBondContact O-CB 3.23Å; Y149-F153 PolarHBondContact O-N 3.05Å; Y149-F153 WeakPolarHBondContact OH-CD1 3.44Å; Y149-F153 WeakPolarHBondContact OH-CE1 3.45Å; Y149-L154 HydrophobicContact CD1-CD1 3.91Å; Y149-L154 HydrophobicContact CD1-CG 4.04Å; Y149-L154 HydrophobicContact CE1-CD1 3.68Å; Y149-L154 HydrophobicContact CE1-CD2 3.94Å; Y149-L154 HydrophobicContact CE1-CG 3.66Å; Y149-L154 PolarHBondContact O-N 3.33Å; Y149-F173 PolarHBondContact OH-O 3.43Å; Y149-V176 HydrophobicContact CE2-CG1 4.23Å; Y149-F177 AromaticContact CD1-CD2 3.86Å; Y149-F177 HydrophobicContact CD1-CD2 3.86Å; Y149-F177 HydrophobicContact CD1-CE2 4.48Å; Y149-F177 HydrophobicContact CD2-CB 4.1Å; Y149-F177 AromaticContact CD2-CD2 3.8Å; Y149-F177 HydrophobicContact CD2-CD2 3.8Å; Y149-F177 HydrophobicContact CD2-CG 4.47Å; Y149-F177 HydrophobicContact CE1-CD2 4.31Å; Y149-F177 HydrophobicContact CE2-CB 3.8Å; Y149-F177 HydrophobicContact CE2-CD2 4.28Å; Y149-F177 AromaticContact CG-CD2 3.57Å; Y149-F177 HydrophobicContact CG-CD2 3.57Å; Y149-F177 HydrophobicContact CG-CE2 4.28Å; Y149-Y207 AromaticContact CE1-CE2 3.95Å; Y149-Y207 HydrophobicContact CE1-CE2 3.95Å
150	Y	86.4	Confident	83.7	Confident	15 Å²	15	41.9 Å²	41.9	6%	0.059	22%	0.216	C	C	.	.	I	π-helix	trans	-66.4	-49.4	178.3	-179.4	-97.9	0	0	0	112.4	K123 F126 Q127 L130 V146 R147 S148 L154 K155	K123-Y150 HydrophobicContact CB-CE2 4.2Å; K123-Y150 HydrophobicContact CG-CE2 4.5Å; K123-Y150 WeakPolarHBondContact O-CE2 3.41Å; F126-Y150 HydrophobicContact CB-CD2 3.81Å; F126-Y150 HydrophobicContact CB-CE2 4.36Å; Q127-Y150 HydrophobicContact CB-CE2 4.25Å; Q127-Y150 PolarHBondContact OE1-OH 3Å; L130-Y150 HydrophobicContact CD1-CD1 4.18Å; L130-Y150 HydrophobicContact CD1-CG 4.11Å; V146-Y150 WeakPolarHBondContact O-CB 3.48Å; V146-Y150 PolarHBondContact O-N 3.19Å; R147-Y150 PolarHBondContact O-N 2.73Å; S148-Y150 VanDerWaalsContact C-N 3.32Å; S148-Y150 PolarHBondContact O-N 3.26Å; Y150-L154 HydrophobicContact CD2-CB 4.28Å; Y150-L154 HydrophobicContact CD2-CD1 3.88Å; Y150-L154 PolarHBondContact O-N 3.43Å; Y150-K155 HydrophobicContact CD1-CD 4.14Å; Y150-K155 HydrophobicContact CE1-CD 3.74Å; Y150-K155 HydrophobicContact CE1-CG 4.21Å; Y150-K155 PolarHBondContact O-N 3.14Å
151	E	82.3	Confident	83.6	Confident	95 Å²	95	40.3 Å²	40.3	44%	0.444	20%	0.203	S	C	.	.	I	π-helix	trans	-71.4	-45.8	-178.8	-66.4	-57.7	143.9	0	0	112.7	R147 K155	R147-E151 PolarHBondContact O-N 3.25Å; E151-K155 IonicContact OE1-NZ 3.61Å; E151-K155 PolarHBondContact OE1-NZ 3.46Å; E151-K155 WeakPolarHBondContact OE2-CD 3.32Å; E151-K155 IonicContact OE2-NZ 2.84Å; E151-K155 PolarHBondContact OE2-NZ 2.98Å
152	V	79.4	Confident	83.5	Confident	56 Å²	56	39.1 Å²	39.1	34%	0.339	19%	0.192	S	C	.	.	I	π-helix	trans	-82.3	-38.1	-172.9	-179.5	0	0	0	0	112.3	S148	S148-V152 VanDerWaalsContact O-CB 3.24Å; S148-V152 WeakPolarHBondContact O-CB 3.48Å; S148-V152 WeakPolarHBondContact O-CG2 3.38Å; S148-V152 PolarHBondContact O-N 3.35Å
153	F	84.7	Confident	83.3	Confident	5 Å²	5	39.3 Å²	39.3	2%	0.022	19%	0.193	C	C	.	.	I	π-helix	trans	-104	-61.8	-174.4	-179.4	-99.2	0	0	0	112.6	Y149 K155 S156 V159 F173 V176 F768	Y149-F153 HydrophobicContact CD2-CB 3.91Å; Y149-F153 HydrophobicContact CD2-CD1 4Å; Y149-F153 HydrophobicContact CD2-CG 4.19Å; Y149-F153 HydrophobicContact CE1-CD1 4.32Å; Y149-F153 HydrophobicContact CE2-CB 4.01Å; Y149-F153 AromaticContact CE2-CD1 3.22Å; Y149-F153 HydrophobicContact CE2-CD1 3.22Å; Y149-F153 AromaticContact CE2-CE1 3.82Å; Y149-F153 HydrophobicContact CE2-CE1 3.82Å; Y149-F153 AromaticContact CE2-CG 3.76Å; Y149-F153 HydrophobicContact CE2-CG 3.76Å; Y149-F153 AromaticContact CZ-CD1 3.42Å; Y149-F153 VanDerWaalsContact CZ-CD1 3.42Å; Y149-F153 AromaticContact CZ-CE1 3.8Å; Y149-F153 WeakPolarHBondContact O-CA 3.48Å; Y149-F153 VanDerWaalsContact O-CB 3.28Å; Y149-F153 WeakPolarHBondContact O-CB 3.23Å; Y149-F153 PolarHBondContact O-N 3.05Å; Y149-F153 WeakPolarHBondContact OH-CD1 3.44Å; Y149-F153 WeakPolarHBondContact OH-CE1 3.45Å; F153-K155 PolarHBondContact O-N 3.01Å; F153-S156 VanDerWaalsContact O-CB 3.3Å; F153-S156 WeakPolarHBondContact O-CB 3.44Å; F153-S156 PolarHBondContact O-N 3.43Å; F153-S156 VanDerWaalsContact O-N 3.1Å; F153-V159 HydrophobicContact CD1-CG2 4.48Å; F153-V159 HydrophobicContact CD2-CG2 3.71Å; F153-V159 HydrophobicContact CE1-CG1 4.34Å; F153-V159 HydrophobicContact CE1-CG2 4.37Å; F153-V159 HydrophobicContact CE2-CG2 3.56Å; F153-V159 HydrophobicContact CG-CG2 4.19Å; F153-V159 HydrophobicContact CZ-CG1 4.24Å; F153-V159 HydrophobicContact CZ-CG2 3.92Å; F153-V159 VanDerWaalsContact O-CG2 3.23Å; F153-V159 WeakPolarHBondContact O-CG2 3.31Å; F153-F173 HydrophobicContact CE1-CB 4.47Å; F153-F173 AromaticContact CE1-CD1 3.67Å; F153-F173 HydrophobicContact CE1-CD1 3.67Å; F153-F173 HydrophobicContact CE1-CD2 4.17Å; F153-F173 AromaticContact CE1-CE1 3.83Å; F153-F173 HydrophobicContact CE1-CE1 3.83Å; F153-F173 HydrophobicContact CE1-CE2 4.3Å; F153-F173 AromaticContact CE1-CG 3.85Å; F153-F173 HydrophobicContact CE1-CG 3.85Å; F153-F173 HydrophobicContact CE1-CZ 4.14Å; F153-F173 HydrophobicContact CZ-CD1 4.44Å; F153-F173 HydrophobicContact CZ-CD2 4.15Å; F153-F173 HydrophobicContact CZ-CE2 4.22Å; F153-F173 HydrophobicContact CZ-CG 4.26Å; F153-F173 HydrophobicContact CZ-CZ 4.41Å; F153-V176 HydrophobicContact CD1-CG1 4.5Å; F153-V176 HydrophobicContact CD2-CB 4.45Å; F153-V176 HydrophobicContact CD2-CG1 3.58Å; F153-V176 HydrophobicContact CE2-CB 4.05Å; F153-V176 HydrophobicContact CE2-CG1 3.63Å; F153-V176 HydrophobicContact CE2-CG2 3.92Å; F153-V176 HydrophobicContact CG-CG1 4.04Å; F153-V176 HydrophobicContact CZ-CB 4.11Å; F153-V176 HydrophobicContact CZ-CG1 4.12Å; F153-V176 HydrophobicContact CZ-CG2 4.1Å; F153-F768 HydrophobicContact CB-CZ 4.42Å; F153-F768 HydrophobicContact CD2-CD1 4.03Å; F153-F768 AromaticContact CD2-CD2 3.44Å; F153-F768 HydrophobicContact CD2-CD2 3.44Å; F153-F768 VanDerWaalsContact CD2-CD2 3.44Å; F153-F768 HydrophobicContact CD2-CE1 4.02Å; F153-F768 AromaticContact CD2-CE2 3.44Å; F153-F768 HydrophobicContact CD2-CE2 3.44Å; F153-F768 VanDerWaalsContact CD2-CE2 3.44Å; F153-F768 AromaticContact CD2-CG 3.76Å; F153-F768 HydrophobicContact CD2-CG 3.76Å; F153-F768 AromaticContact CD2-CZ 3.73Å; F153-F768 HydrophobicContact CD2-CZ 3.73Å; F153-F768 HydrophobicContact CE2-CB 4.34Å; F153-F768 AromaticContact CE2-CD2 3.48Å; F153-F768 HydrophobicContact CE2-CD2 3.48Å; F153-F768 VanDerWaalsContact CE2-CD2 3.48Å; F153-F768 AromaticContact CE2-CE2 3.88Å; F153-F768 HydrophobicContact CE2-CE2 3.88Å; F153-F768 AromaticContact CE2-CG 3.9Å; F153-F768 HydrophobicContact CE2-CG 3.9Å; F153-F768 HydrophobicContact CG-CE2 4.5Å
154	L	84.5	Confident	82.9	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.209	C	C	.	.	I	π-helix	trans	-64.3	-38.3	-171.9	-68.4	176	0	0	0	113	L122 K123 F126 Y149 Y150 S156 F173	L122-L154 HydrophobicContact CD2-CD2 3.94Å; K123-L154 WeakPolarHBondContact CE-O 3.27Å; K123-L154 HydrophobicContact CG-CB 4.48Å; K123-L154 PolarHBondContact NZ-O 3.2Å; F126-L154 HydrophobicContact CB-CD1 3.97Å; F126-L154 HydrophobicContact CD1-CD1 3.86Å; F126-L154 HydrophobicContact CD2-CD1 4.06Å; F126-L154 HydrophobicContact CE1-CD1 4.44Å; F126-L154 HydrophobicContact CG-CD1 3.66Å; Y149-L154 HydrophobicContact CD1-CD1 3.91Å; Y149-L154 HydrophobicContact CD1-CG 4.04Å; Y149-L154 HydrophobicContact CE1-CD1 3.68Å; Y149-L154 HydrophobicContact CE1-CD2 3.94Å; Y149-L154 HydrophobicContact CE1-CG 3.66Å; Y149-L154 PolarHBondContact O-N 3.33Å; Y150-L154 HydrophobicContact CD2-CB 4.28Å; Y150-L154 HydrophobicContact CD2-CD1 3.88Å; Y150-L154 PolarHBondContact O-N 3.43Å; L154-S156 VanDerWaalsContact C-N 3.31Å; L154-F173 HydrophobicContact CD2-CD1 3.77Å; L154-F173 HydrophobicContact CD2-CE1 3.58Å
155	K	84.6	Confident	82.2	Confident	90 Å²	90	41.9 Å²	41.9	39%	0.391	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-12.8	176.5	-86.6	173.8	162	175.7	0	114.3	Y150 E151 F153 D157	Y150-K155 HydrophobicContact CD1-CD 4.14Å; Y150-K155 HydrophobicContact CE1-CD 3.74Å; Y150-K155 HydrophobicContact CE1-CG 4.21Å; Y150-K155 PolarHBondContact O-N 3.14Å; E151-K155 IonicContact OE1-NZ 3.61Å; E151-K155 PolarHBondContact OE1-NZ 3.46Å; E151-K155 WeakPolarHBondContact OE2-CD 3.32Å; E151-K155 IonicContact OE2-NZ 2.84Å; E151-K155 PolarHBondContact OE2-NZ 2.98Å; F153-K155 PolarHBondContact O-N 3.01Å; K155-D157 PolarHBondContact O-N 3.19Å
156	S	82.4	Confident	81.4	Confident	23 Å²	23	42.3 Å²	42.3	16%	0.161	21%	0.207	C	C	.	.			trans	-66.2	132.2	-175.2	-169	0	0	0	0	113	F153 L154 R158 V159 A160	F153-S156 VanDerWaalsContact O-CB 3.3Å; F153-S156 WeakPolarHBondContact O-CB 3.44Å; F153-S156 PolarHBondContact O-N 3.43Å; F153-S156 VanDerWaalsContact O-N 3.1Å; L154-S156 VanDerWaalsContact C-N 3.31Å; S156-R158 PolarHBondContact O-N 3Å; S156-R158 VanDerWaalsContact O-N 3.15Å; S156-R158 PolarHBondContact OG-N 3.03Å; S156-V159 PolarHBondContact O-N 3.27Å; S156-A160 PolarHBondContact O-N 3.16Å
157	D	80.9	Confident	80.4	Confident	120 Å²	120	42.4 Å²	42.4	64%	0.642	21%	0.208	S	C	*	.	H	α-helix	trans	-59.8	-25	173.1	-70.9	-35.6	0	0	0	113.3	K155 A160 R161	K155-D157 PolarHBondContact O-N 3.19Å; D157-A160 PolarHBondContact O-N 2.68Å; D157-R161 PolarHBondContact O-N 3.5Å
158	R	81.5	Confident	79.7	Confident	24 Å²	24	36.6 Å²	36.6	9%	0.091	19%	0.186	C	C	.	.	H	α-helix	trans	-64	-42.8	175.4	-63.6	-174.1	-71.5	-178.6	-6.6	111.2	S156 M162 R763 Y764 P767 Q853	S156-R158 PolarHBondContact O-N 3Å; S156-R158 VanDerWaalsContact O-N 3.15Å; S156-R158 PolarHBondContact OG-N 3.03Å; R158-M162 WeakPolarHBondContact O-CB 3.43Å; R158-M162 PolarHBondContact O-N 3.5Å; R158-R763 WeakPolarHBondContact CD-O 3.43Å; R158-Y764 HydrophobicContact CG-CD1 3.78Å; R158-Y764 HydrophobicContact CG-CE1 3.66Å; R158-P767 HydrophobicContact CB-CB 3.97Å; R158-Q853 VanDerWaalsContact NH2-OE1 3.13Å
159	V	83	Confident	79.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-71.3	-39.9	177.6	179.5	0	0	0	0	110.5	L119 F153 S156 R161 M162 V163 F173 F768	L119-V159 HydrophobicContact CD1-CG1 4.46Å; F153-V159 HydrophobicContact CD1-CG2 4.48Å; F153-V159 HydrophobicContact CD2-CG2 3.71Å; F153-V159 HydrophobicContact CE1-CG1 4.34Å; F153-V159 HydrophobicContact CE1-CG2 4.37Å; F153-V159 HydrophobicContact CE2-CG2 3.56Å; F153-V159 HydrophobicContact CG-CG2 4.19Å; F153-V159 HydrophobicContact CZ-CG1 4.24Å; F153-V159 HydrophobicContact CZ-CG2 3.92Å; F153-V159 VanDerWaalsContact O-CG2 3.23Å; F153-V159 WeakPolarHBondContact O-CG2 3.31Å; S156-V159 PolarHBondContact O-N 3.27Å; V159-R161 VanDerWaalsContact C-N 3.34Å; V159-R161 PolarHBondContact O-N 3.28Å; V159-M162 HydrophobicContact CG1-CE 4.23Å; V159-M162 WeakPolarHBondContact O-CB 3.39Å; V159-M162 PolarHBondContact O-N 3.3Å; V159-V163 HydrophobicContact CG1-CG2 4.34Å; V159-V163 WeakPolarHBondContact O-CG2 3.29Å; V159-V163 PolarHBondContact O-N 3.36Å; V159-F173 HydrophobicContact CG1-CE1 4.07Å; V159-F173 HydrophobicContact CG1-CE2 4.02Å; V159-F173 HydrophobicContact CG1-CZ 3.35Å; V159-F768 HydrophobicContact CG2-CD2 4.13Å; V159-F768 HydrophobicContact CG2-CE2 3.64Å
160	A	81.9	Confident	78.9	Confident	21 Å²	21	36.8 Å²	36.8	17%	0.174	19%	0.189	C	C	.	.	H	α-helix	trans	-59.5	-43.3	175.4	0	0	0	0	0	112.2	L119 S156 D157 V163 Q164	L119-A160 HydrophobicContact CD2-CB 4.45Å; S156-A160 PolarHBondContact O-N 3.16Å; D157-A160 PolarHBondContact O-N 2.68Å; A160-V163 PolarHBondContact O-N 2.95Å; A160-Q164 VanDerWaalsContact O-CG 3.24Å; A160-Q164 WeakPolarHBondContact O-CG 3.02Å; A160-Q164 PolarHBondContact O-N 2.93Å
161	R	79.6	Confident	78.6	Confident	119 Å²	119	39.1 Å²	39.1	45%	0.449	20%	0.202	S	C	.	.	H	α-helix	trans	-66	-41.3	173.5	-81	-169.3	-82.7	-173.7	-14.3	112.6	D157 V159 V163 Q164 S165	D157-R161 PolarHBondContact O-N 3.5Å; V159-R161 VanDerWaalsContact C-N 3.34Å; V159-R161 PolarHBondContact O-N 3.28Å; R161-V163 VanDerWaalsContact C-N 3.34Å; R161-V163 PolarHBondContact O-N 2.84Å; R161-Q164 PolarHBondContact O-N 2.84Å; R161-S165 WeakPolarHBondContact O-CB 3.1Å; R161-S165 PolarHBondContact O-N 3.35Å; R161-S165 PolarHBondContact O-OG 3.5Å
162	M	79.4	Confident	78.5	Confident	9 Å²	9	35.5 Å²	35.5	4%	0.044	19%	0.186	C	C	.	.	H	α-helix	trans	-60.2	-43	175.8	-173.8	179.5	55	0	0	112.1	R158 V159 S165 G166 G167 C168 F173 P767 R770	R158-M162 WeakPolarHBondContact O-CB 3.43Å; R158-M162 PolarHBondContact O-N 3.5Å; V159-M162 HydrophobicContact CG1-CE 4.23Å; V159-M162 WeakPolarHBondContact O-CB 3.39Å; V159-M162 PolarHBondContact O-N 3.3Å; M162-S165 WeakPolarHBondContact CA-OG 3.07Å; M162-S165 PolarHBondContact O-N 2.95Å; M162-S165 PolarHBondContact O-OG 3.17Å; M162-G166 PolarHBondContact O-N 3.33Å; M162-G167 PolarHBondContact O-N 3.47Å; M162-C168 HydrophobicContact CE-CB 3.63Å; M162-C168 HydrophobicContact CG-CB 3.86Å; M162-C168 HydrophobicContact SD-CB 3.81Å; M162-F173 HydrophobicContact CE-CE2 4.26Å; M162-P767 HydrophobicContact CB-CG 3.99Å; M162-P767 HydrophobicContact CE-CG 4.32Å; M162-P767 HydrophobicContact CG-CG 4.09Å; M162-P767 HydrophobicContact SD-CG 3.5Å; M162-P767 WeakPolarHBondContact SD-CG 3.4Å; M162-R770 HydrophobicContact SD-CB 4.31Å
163	V	80.8	Confident	78.7	Confident	4 Å²	4	32.8 Å²	32.8	2%	0.024	17%	0.17	C	C	.	.	H	α-helix	trans	-64	-42.7	175.2	170.9	0	0	0	0	111.2	L114 L119 V159 A160 R161 S165 G166 C168 F173	L114-V163 WeakPolarHBondContact O-CG1 3.12Å; L119-V163 HydrophobicContact CB-CG1 4.18Å; L119-V163 HydrophobicContact CB-CG2 4.47Å; L119-V163 HydrophobicContact CD1-CG2 4.4Å; L119-V163 HydrophobicContact CD2-CB 4.23Å; L119-V163 HydrophobicContact CD2-CG1 4.35Å; L119-V163 HydrophobicContact CD2-CG2 4.02Å; V159-V163 HydrophobicContact CG1-CG2 4.34Å; V159-V163 WeakPolarHBondContact O-CG2 3.29Å; V159-V163 PolarHBondContact O-N 3.36Å; A160-V163 PolarHBondContact O-N 2.95Å; R161-V163 VanDerWaalsContact C-N 3.34Å; R161-V163 PolarHBondContact O-N 2.84Å; V163-S165 VanDerWaalsContact C-N 3.33Å; V163-S165 PolarHBondContact O-N 3.38Å; V163-G166 PolarHBondContact O-N 3.22Å; V163-G166 VanDerWaalsContact O-N 3.15Å; V163-C168 VanDerWaalsContact CA-SG 3.57Å; V163-C168 WeakPolarHBondContact CG2-SG 3.35Å; V163-F173 HydrophobicContact CG2-CE2 4.26Å; V163-F173 HydrophobicContact CG2-CZ 3.92Å
164	Q	77.1	Confident	78.7	Confident	123 Å²	123	35.8 Å²	35.8	58%	0.575	18%	0.181	S	C	*	.	H	α-helix	trans	-62.3	-39.9	176	-72.1	168.8	22.6	0	0	112.4	A160 R161 G166	A160-Q164 VanDerWaalsContact O-CG 3.24Å; A160-Q164 WeakPolarHBondContact O-CG 3.02Å; A160-Q164 PolarHBondContact O-N 2.93Å; R161-Q164 PolarHBondContact O-N 2.84Å; Q164-G166 PolarHBondContact O-N 3.22Å
165	S	70.9	Confident	78.7	Confident	28 Å²	28	37.8 Å²	37.8	20%	0.196	19%	0.19	C	C	.	.	H	α-helix	trans	-71.3	-11.7	177	69.1	0	0	0	0	114.2	R161 M162 V163 G167 G706 V708	R161-S165 WeakPolarHBondContact O-CB 3.1Å; R161-S165 PolarHBondContact O-N 3.35Å; R161-S165 PolarHBondContact O-OG 3.5Å; M162-S165 WeakPolarHBondContact CA-OG 3.07Å; M162-S165 PolarHBondContact O-N 2.95Å; M162-S165 PolarHBondContact O-OG 3.17Å; V163-S165 VanDerWaalsContact C-N 3.33Å; V163-S165 PolarHBondContact O-N 3.38Å; S165-G167 VanDerWaalsContact C-N 3.31Å; S165-G167 PolarHBondContact O-N 2.98Å; S165-G706 WeakPolarHBondContact CB-O 3.29Å; S165-V708 WeakPolarHBondContact OG-CG2 3.27Å
166	G	67.8	Low	78.6	Confident	8 Å²	8	33.9 Å²	33.9	8%	0.082	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	17.6	179.5	0	0	0	0	0	116.1	M162 V163 Q164	M162-G166 PolarHBondContact O-N 3.33Å; V163-G166 PolarHBondContact O-N 3.22Å; V163-G166 VanDerWaalsContact O-N 3.15Å; Q164-G166 PolarHBondContact O-N 3.22Å
167	G	65.9	Low	78.8	Confident	2 Å²	2	32.8 Å²	32.8	2%	0.021	17%	0.166	C	C	.	.			trans	-86	-3	-177	0	0	0	0	0	115.9	M162 S165	M162-G167 PolarHBondContact O-N 3.47Å; S165-G167 VanDerWaalsContact C-N 3.31Å; S165-G167 PolarHBondContact O-N 2.98Å
168	C	71.9	Confident	79	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.			trans	-123.5	144.3	-174.1	62.5	0	0	0	0	113.6	L114 M162 V163 F173	L114-C168 PolarHBondContact N-O 3.37Å; M162-C168 HydrophobicContact CE-CB 3.63Å; M162-C168 HydrophobicContact CG-CB 3.86Å; M162-C168 HydrophobicContact SD-CB 3.81Å; V163-C168 VanDerWaalsContact CA-SG 3.57Å; V163-C168 WeakPolarHBondContact CG2-SG 3.35Å; C168-F173 HydrophobicContact CB-CE2 4.21Å
169	S	77.1	Confident	78.9	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-109.5	167.9	174.8	82.5	0	0	0	0	112.8	Q111 Q112 N171 D172 F173	Q111-S169 VanDerWaalsContact CB-CB 3.48Å; Q111-S169 PolarHBondContact OE1-OG 3.38Å; Q112-S169 WeakPolarHBondContact O-CA 3.35Å; S169-N171 PolarHBondContact O-N 2.93Å; S169-N171 WeakPolarHBondContact OG-CB 3.46Å; S169-N171 PolarHBondContact OG-N 2.94Å; S169-N171 VanDerWaalsContact OG-N 3.12Å; S169-D172 PolarHBondContact N-OD2 3.22Å; S169-D172 WeakPolarHBondContact O-CB 3.38Å; S169-D172 PolarHBondContact O-N 2.73Å; S169-D172 VanDerWaalsContact O-N 3.15Å; S169-D172 PolarHBondContact OG-N 3.35Å; S169-D172 PolarHBondContact OG-OD2 3.27Å; S169-F173 PolarHBondContact O-N 3.41Å
170	A	75.6	Confident	78.8	Confident	30 Å²	30	33.7 Å²	33.7	25%	0.248	17%	0.167	C	C	.	.	H	α-helix	trans	-55.8	-34.3	169.3	0	0	0	0	0	112.9	F173 R174 Y211	A170-F173 PolarHBondContact O-N 3.44Å; A170-R174 PolarHBondContact O-N 3.36Å; A170-Y211 HydrophobicContact CB-CE1 4.39Å; A170-Y211 HydrophobicContact CB-CE2 4.37Å; A170-Y211 WeakPolarHBondContact CB-OH 3.41Å
171	N	78.9	Confident	79	Confident	64 Å²	64	32.7 Å²	32.7	34%	0.342	16%	0.158	S	C	.	.	H	α-helix	trans	-70.9	-35	178.8	-169.3	75.4	0	0	0	111.5	Q111 S169 F173 R174 E175	Q111-N171 PolarHBondContact NE2-ND2 3.42Å; S169-N171 PolarHBondContact O-N 2.93Å; S169-N171 WeakPolarHBondContact OG-CB 3.46Å; S169-N171 PolarHBondContact OG-N 2.94Å; S169-N171 VanDerWaalsContact OG-N 3.12Å; N171-F173 VanDerWaalsContact C-N 3.34Å; N171-F173 PolarHBondContact O-N 2.8Å; N171-R174 PolarHBondContact O-N 3.41Å; N171-E175 WeakPolarHBondContact O-CG 3.43Å; N171-E175 PolarHBondContact O-N 3.33Å
172	D	79.6	Confident	79	Confident	19 Å²	19	29.4 Å²	29.4	10%	0.102	15%	0.148	C	C	.	.	H	α-helix	trans	-62.3	-42.1	176.2	-64.1	-48	0	0	0	111.4	S169 E175 V176	S169-D172 PolarHBondContact N-OD2 3.22Å; S169-D172 WeakPolarHBondContact O-CB 3.38Å; S169-D172 PolarHBondContact O-N 2.73Å; S169-D172 VanDerWaalsContact O-N 3.15Å; S169-D172 PolarHBondContact OG-N 3.35Å; S169-D172 PolarHBondContact OG-OD2 3.27Å; D172-E175 PolarHBondContact O-N 2.69Å; D172-V176 WeakPolarHBondContact O-CG2 3.24Å; D172-V176 PolarHBondContact O-N 2.88Å
173	F	85.3	Confident	78.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62	-44.8	176.1	-84.4	-128.8	0	0	0	111.2	L114 L119 L122 Y149 F153 L154 V159 M162 V163 C168 S169 A170 N171 E175 V176 F177 Y207	L114-F173 HydrophobicContact CD1-CD1 4.21Å; L114-F173 HydrophobicContact CD1-CD2 3.53Å; L114-F173 HydrophobicContact CD1-CE1 4.22Å; L114-F173 HydrophobicContact CD1-CE2 3.55Å; L114-F173 HydrophobicContact CD1-CG 3.89Å; L114-F173 HydrophobicContact CD1-CZ 3.9Å; L119-F173 HydrophobicContact CD1-CE1 3.66Å; L119-F173 HydrophobicContact CD1-CZ 3.82Å; L122-F173 HydrophobicContact CD2-CD1 3.57Å; L122-F173 HydrophobicContact CD2-CE1 3.86Å; Y149-F173 PolarHBondContact OH-O 3.43Å; F153-F173 HydrophobicContact CE1-CB 4.47Å; F153-F173 AromaticContact CE1-CD1 3.67Å; F153-F173 HydrophobicContact CE1-CD1 3.67Å; F153-F173 HydrophobicContact CE1-CD2 4.17Å; F153-F173 AromaticContact CE1-CE1 3.83Å; F153-F173 HydrophobicContact CE1-CE1 3.83Å; F153-F173 HydrophobicContact CE1-CE2 4.3Å; F153-F173 AromaticContact CE1-CG 3.85Å; F153-F173 HydrophobicContact CE1-CG 3.85Å; F153-F173 HydrophobicContact CE1-CZ 4.14Å; F153-F173 HydrophobicContact CZ-CD1 4.44Å; F153-F173 HydrophobicContact CZ-CD2 4.15Å; F153-F173 HydrophobicContact CZ-CE2 4.22Å; F153-F173 HydrophobicContact CZ-CG 4.26Å; F153-F173 HydrophobicContact CZ-CZ 4.41Å; L154-F173 HydrophobicContact CD2-CD1 3.77Å; L154-F173 HydrophobicContact CD2-CE1 3.58Å; V159-F173 HydrophobicContact CG1-CE1 4.07Å; V159-F173 HydrophobicContact CG1-CE2 4.02Å; V159-F173 HydrophobicContact CG1-CZ 3.35Å; M162-F173 HydrophobicContact CE-CE2 4.26Å; V163-F173 HydrophobicContact CG2-CE2 4.26Å; V163-F173 HydrophobicContact CG2-CZ 3.92Å; C168-F173 HydrophobicContact CB-CE2 4.21Å; S169-F173 PolarHBondContact O-N 3.41Å; A170-F173 PolarHBondContact O-N 3.44Å; N171-F173 VanDerWaalsContact C-N 3.34Å; N171-F173 PolarHBondContact O-N 2.8Å; F173-E175 PolarHBondContact O-N 2.87Å; F173-V176 PolarHBondContact O-N 2.66Å; F173-F177 PolarHBondContact O-N 3.44Å; F173-Y207 WeakPolarHBondContact CB-OH 3.43Å
174	R	84.8	Confident	78.3	Confident	68 Å²	68	36.3 Å²	36.3	26%	0.257	18%	0.175	S	C	.	.	H	α-helix	trans	-60.6	-43.7	176.7	-174.3	179	-179.1	-84.8	10.9	112.4	A170 N171 F177 K178 Y207 D208	A170-R174 PolarHBondContact O-N 3.36Å; N171-R174 PolarHBondContact O-N 3.41Å; R174-F177 PolarHBondContact O-N 3.26Å; R174-K178 WeakPolarHBondContact O-CB 3.36Å; R174-K178 PolarHBondContact O-N 3.14Å; R174-Y207 HydrophobicContact CB-CD1 4.46Å; R174-Y207 HydrophobicContact CB-CE1 3.75Å; R174-Y207 HydrophobicContact CG-CD1 4.07Å; R174-Y207 HydrophobicContact CG-CE1 3.84Å; R174-Y207 PolarHBondContact N-OH 3.27Å; R174-D208 WeakPolarHBondContact CD-OD1 3.27Å; R174-D208 IonicContact CZ-OD2 2.73Å; R174-D208 IonicContact NE-OD1 2.73Å; R174-D208 PolarHBondContact NE-OD1 2.86Å; R174-D208 VanDerWaalsContact NE-OD1 3.12Å; R174-D208 IonicContact NE-OD2 2.64Å; R174-D208 PolarHBondContact NE-OD2 2.92Å; R174-D208 IonicContact NH2-OD2 3.09Å; R174-D208 PolarHBondContact NH2-OD2 2.9Å
175	E	82.8	Confident	78.5	Confident	41 Å²	41	30.8 Å²	30.8	19%	0.192	15%	0.15	C	C	.	.	H	α-helix	trans	-72.6	-30.6	179.7	-68.3	-61.1	130.2	0	0	112.8	N171 D172 F173 K178 K179	N171-E175 WeakPolarHBondContact O-CG 3.43Å; N171-E175 PolarHBondContact O-N 3.33Å; D172-E175 PolarHBondContact O-N 2.69Å; F173-E175 PolarHBondContact O-N 2.87Å; E175-K178 PolarHBondContact O-N 3.38Å; E175-K178 IonicContact OE2-NZ 2.69Å; E175-K179 PolarHBondContact O-N 3.21Å
176	V	83.1	Confident	78.6	Confident	8 Å²	8	37.5 Å²	37.5	5%	0.048	17%	0.171	C	C	.	.	H	α-helix	trans	-66.5	-43.4	170.5	175	0	0	0	0	110.7	Y149 F153 D172 F173 K178 K179 N180 F768 R770	Y149-V176 HydrophobicContact CE2-CG1 4.23Å; F153-V176 HydrophobicContact CD1-CG1 4.5Å; F153-V176 HydrophobicContact CD2-CB 4.45Å; F153-V176 HydrophobicContact CD2-CG1 3.58Å; F153-V176 HydrophobicContact CE2-CB 4.05Å; F153-V176 HydrophobicContact CE2-CG1 3.63Å; F153-V176 HydrophobicContact CE2-CG2 3.92Å; F153-V176 HydrophobicContact CG-CG1 4.04Å; F153-V176 HydrophobicContact CZ-CB 4.11Å; F153-V176 HydrophobicContact CZ-CG1 4.12Å; F153-V176 HydrophobicContact CZ-CG2 4.1Å; D172-V176 WeakPolarHBondContact O-CG2 3.24Å; D172-V176 PolarHBondContact O-N 2.88Å; F173-V176 PolarHBondContact O-N 2.66Å; V176-K178 VanDerWaalsContact C-N 3.31Å; V176-K178 PolarHBondContact O-N 3.03Å; V176-K179 PolarHBondContact O-N 2.88Å; V176-N180 PolarHBondContact O-N 2.7Å; V176-N180 VanDerWaalsContact O-N 3.07Å; V176-F768 HydrophobicContact CG2-CB 4.33Å; V176-R770 HydrophobicContact CG2-CG 4.1Å
177	F	86.3	Confident	78.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.8	-45.5	173.6	-177.3	-105	0	0	0	111.2	F142 V146 Y149 F173 R174 K179 N180 I181 I204 Y207	F142-F177 HydrophobicContact CE2-CE1 4.18Å; F142-F177 AromaticContact CE2-CZ 3.76Å; F142-F177 HydrophobicContact CE2-CZ 3.76Å; F142-F177 HydrophobicContact CZ-CZ 4.34Å; V146-F177 HydrophobicContact CG2-CE2 4.15Å; V146-F177 HydrophobicContact CG2-CZ 4.15Å; Y149-F177 AromaticContact CD1-CD2 3.86Å; Y149-F177 HydrophobicContact CD1-CD2 3.86Å; Y149-F177 HydrophobicContact CD1-CE2 4.48Å; Y149-F177 HydrophobicContact CD2-CB 4.1Å; Y149-F177 AromaticContact CD2-CD2 3.8Å; Y149-F177 HydrophobicContact CD2-CD2 3.8Å; Y149-F177 HydrophobicContact CD2-CG 4.47Å; Y149-F177 HydrophobicContact CE1-CD2 4.31Å; Y149-F177 HydrophobicContact CE2-CB 3.8Å; Y149-F177 HydrophobicContact CE2-CD2 4.28Å; Y149-F177 AromaticContact CG-CD2 3.57Å; Y149-F177 HydrophobicContact CG-CD2 3.57Å; Y149-F177 HydrophobicContact CG-CE2 4.28Å; F173-F177 PolarHBondContact O-N 3.44Å; R174-F177 PolarHBondContact O-N 3.26Å; F177-K179 PolarHBondContact O-N 3.24Å; F177-N180 WeakPolarHBondContact O-CB 3.36Å; F177-N180 PolarHBondContact O-N 3.44Å; F177-N180 VanDerWaalsContact O-N 3.17Å; F177-I181 HydrophobicContact CD1-CD1 4.3Å; F177-I181 HydrophobicContact CD1-CG2 4.37Å; F177-I181 HydrophobicContact CD2-CG2 4.46Å; F177-I181 HydrophobicContact CE1-CD1 3.99Å; F177-I181 HydrophobicContact CE1-CG2 3.86Å; F177-I181 HydrophobicContact CE2-CG2 3.98Å; F177-I181 HydrophobicContact CZ-CG2 3.66Å; F177-I181 WeakPolarHBondContact O-CG1 3.1Å; F177-I181 PolarHBondContact O-N 2.79Å; F177-I204 HydrophobicContact CD1-CD1 3.96Å; F177-I204 HydrophobicContact CE1-CD1 4.46Å; F177-Y207 HydrophobicContact CB-CD2 3.86Å; F177-Y207 HydrophobicContact CB-CE2 3.78Å; F177-Y207 AromaticContact CD1-CD2 3.42Å; F177-Y207 HydrophobicContact CD1-CD2 3.42Å; F177-Y207 VanDerWaalsContact CD1-CD2 3.42Å; F177-Y207 HydrophobicContact CD1-CE2 4.24Å; F177-Y207 AromaticContact CD1-CG 3.68Å; F177-Y207 HydrophobicContact CD1-CG 3.68Å; F177-Y207 AromaticContact CD2-CD2 3.95Å; F177-Y207 HydrophobicContact CD2-CD2 3.95Å; F177-Y207 HydrophobicContact CD2-CE2 4.38Å; F177-Y207 AromaticContact CE1-CD2 3.91Å; F177-Y207 HydrophobicContact CE1-CD2 3.91Å; F177-Y207 HydrophobicContact CE1-CG 4.06Å; F177-Y207 HydrophobicContact CE2-CD2 4.37Å; F177-Y207 AromaticContact CG-CD2 3.44Å; F177-Y207 HydrophobicContact CG-CD2 3.44Å; F177-Y207 VanDerWaalsContact CG-CD2 3.44Å; F177-Y207 AromaticContact CG-CE2 3.87Å; F177-Y207 HydrophobicContact CG-CE2 3.87Å; F177-Y207 HydrophobicContact CG-CG 4.17Å; F177-Y207 HydrophobicContact CZ-CD2 4.35Å
178	K	85.5	Confident	79	Confident	63 Å²	63	44.5 Å²	44.5	27%	0.274	21%	0.213	S	C	.	.	H	α-helix	trans	-54.9	-49.2	175.9	-168	-171.7	177.1	-159.9	0	112.5	R174 E175 V176 N180 I181 E182 I204	R174-K178 WeakPolarHBondContact O-CB 3.36Å; R174-K178 PolarHBondContact O-N 3.14Å; E175-K178 PolarHBondContact O-N 3.38Å; E175-K178 IonicContact OE2-NZ 2.69Å; V176-K178 VanDerWaalsContact C-N 3.31Å; V176-K178 PolarHBondContact O-N 3.03Å; K178-N180 VanDerWaalsContact C-N 3.35Å; K178-N180 PolarHBondContact O-N 2.72Å; K178-I181 WeakPolarHBondContact O-CG1 3.38Å; K178-I181 PolarHBondContact O-N 3.34Å; K178-E182 WeakPolarHBondContact CE-OE1 3.32Å; K178-E182 HydrophobicContact CG-CG 4.5Å; K178-E182 IonicContact NZ-OE1 3.69Å; K178-E182 WeakPolarHBondContact O-CG 3.33Å; K178-E182 PolarHBondContact O-N 3.08Å; K178-I204 HydrophobicContact CB-CD1 3.72Å; K178-I204 HydrophobicContact CG-CD1 3.94Å; K178-I204 HydrophobicContact CG-CG1 4.41Å
179	K	79.1	Confident	78.9	Confident	61 Å²	61	49.4 Å²	49.4	27%	0.265	25%	0.245	S	C	.	.	H	α-helix	trans	-60.5	-41.3	176.8	-78.1	-170.2	173.2	-170.4	0	112.6	E175 V176 F177 E182 E863	E175-K179 PolarHBondContact O-N 3.21Å; V176-K179 PolarHBondContact O-N 2.88Å; F177-K179 PolarHBondContact O-N 3.24Å; K179-E182 PolarHBondContact O-N 2.85Å; K179-E863 IonicContact NZ-OE1 3.49Å; K179-E863 PolarHBondContact NZ-OE1 2.91Å
180	N	81.6	Confident	78.3	Confident	39 Å²	39	57.4 Å²	57.4	21%	0.209	28%	0.283	C	S	.	.	H	α-helix	trans	-61	-45.6	177.5	-175	-24	0	0	0	111.2	V176 F177 K178 R184	V176-N180 PolarHBondContact O-N 2.7Å; V176-N180 VanDerWaalsContact O-N 3.07Å; F177-N180 WeakPolarHBondContact O-CB 3.36Å; F177-N180 PolarHBondContact O-N 3.44Å; F177-N180 VanDerWaalsContact O-N 3.17Å; K178-N180 VanDerWaalsContact C-N 3.35Å; K178-N180 PolarHBondContact O-N 2.72Å; N180-R184 PolarHBondContact OD1-NE 2.87Å; N180-R184 VanDerWaalsContact OD1-NE 3.09Å
181	I	85.4	Confident	78	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-75.2	-29.2	-179	63.3	168.9	0	0	0	113.5	A145 F177 K178 K183 R184 V185 L200 W203 I204	A145-I181 HydrophobicContact CB-CG2 4.01Å; F177-I181 HydrophobicContact CD1-CD1 4.3Å; F177-I181 HydrophobicContact CD1-CG2 4.37Å; F177-I181 HydrophobicContact CD2-CG2 4.46Å; F177-I181 HydrophobicContact CE1-CD1 3.99Å; F177-I181 HydrophobicContact CE1-CG2 3.86Å; F177-I181 HydrophobicContact CE2-CG2 3.98Å; F177-I181 HydrophobicContact CZ-CG2 3.66Å; F177-I181 WeakPolarHBondContact O-CG1 3.1Å; F177-I181 PolarHBondContact O-N 2.79Å; K178-I181 WeakPolarHBondContact O-CG1 3.38Å; K178-I181 PolarHBondContact O-N 3.34Å; I181-K183 VanDerWaalsContact C-N 3.32Å; I181-K183 PolarHBondContact O-N 2.94Å; I181-R184 PolarHBondContact O-N 3.33Å; I181-V185 WeakPolarHBondContact O-CB 3.39Å; I181-V185 VanDerWaalsContact O-CG2 3.26Å; I181-V185 WeakPolarHBondContact O-CG2 3.37Å; I181-V185 PolarHBondContact O-N 3.19Å; I181-L200 HydrophobicContact CB-CD1 4.46Å; I181-L200 HydrophobicContact CD1-CD1 3.46Å; I181-L200 VanDerWaalsContact CD1-CD1 3.46Å; I181-L200 HydrophobicContact CD1-CG 4.4Å; I181-L200 HydrophobicContact CG1-CD1 3.5Å; I181-L200 VanDerWaalsContact CG1-CD1 3.5Å; I181-W203 HydrophobicContact CB-CE3 3.69Å; I181-W203 HydrophobicContact CB-CZ3 4.05Å; I181-W203 HydrophobicContact CD1-CB 3.8Å; I181-W203 HydrophobicContact CD1-CE3 4.27Å; I181-W203 HydrophobicContact CG2-CE3 3.66Å; I181-W203 HydrophobicContact CG2-CZ3 4.03Å; I181-I204 HydrophobicContact CD1-CD1 3.8Å; I181-I204 HydrophobicContact CD1-CG1 3.92Å
182	E	80.8	Confident	76.9	Confident	51 Å²	51	66.3 Å²	66.3	24%	0.238	33%	0.325	C	S	.	.	H	α-helix	trans	-58	-42.3	179.2	-84	177.9	-169.3	0	0	112.4	K178 K179 R186 L200	K178-E182 WeakPolarHBondContact CE-OE1 3.32Å; K178-E182 HydrophobicContact CG-CG 4.5Å; K178-E182 IonicContact NZ-OE1 3.69Å; K178-E182 WeakPolarHBondContact O-CG 3.33Å; K178-E182 PolarHBondContact O-N 3.08Å; K179-E182 PolarHBondContact O-N 2.85Å; E182-R186 VanDerWaalsContact O-CG 3.27Å; E182-R186 WeakPolarHBondContact O-CG 3.41Å; E182-R186 PolarHBondContact O-N 2.9Å; E182-L200 HydrophobicContact CB-CD1 4.47Å; E182-L200 HydrophobicContact CG-CD1 3.62Å; E182-L200 HydrophobicContact CG-CD2 3.82Å; E182-L200 HydrophobicContact CG-CG 4.41Å
183	K	69	Low	76.2	Confident	76 Å²	76	69.6 Å²	69.6	33%	0.33	36%	0.363	S	S	.	.	H	α-helix	trans	-67.5	-44.9	177	-69.4	-166.7	176.3	-157.7	0	111.9	I181 V185 R186 S187 E856 E860	I181-K183 VanDerWaalsContact C-N 3.32Å; I181-K183 PolarHBondContact O-N 2.94Å; K183-V185 PolarHBondContact O-N 3.07Å; K183-R186 PolarHBondContact O-N 3.21Å; K183-S187 PolarHBondContact O-N 3.48Å; K183-S187 VanDerWaalsContact O-N 3.15Å; K183-E856 WeakPolarHBondContact CD-OE1 3.42Å; K183-E856 WeakPolarHBondContact CE-OE1 3.22Å; K183-E856 VanDerWaalsContact NZ-CD 3.32Å; K183-E856 VanDerWaalsContact NZ-CG 3.3Å; K183-E856 IonicContact NZ-OE1 3.95Å; K183-E856 PolarHBondContact NZ-OE1 2.99Å; K183-E860 WeakPolarHBondContact CE-OE2 3.48Å; K183-E860 IonicContact NZ-OE2 3.31Å; K183-E860 PolarHBondContact NZ-OE2 3.35Å
184	R	76.6	Confident	75.7	Confident	81 Å²	81	74.2 Å²	74.2	31%	0.306	39%	0.387	S	S	.	.	H	α-helix	trans	-60.7	-46.3	177.9	-67.4	175.9	179.2	-107.4	-11.7	111.4	N144 S148 N180 I181 R186 S187 L188	N144-R184 PolarHBondContact O-NH1 3.02Å; S148-R184 PolarHBondContact OG-NH2 3.41Å; N180-R184 PolarHBondContact OD1-NE 2.87Å; N180-R184 VanDerWaalsContact OD1-NE 3.09Å; I181-R184 PolarHBondContact O-N 3.33Å; R184-R186 VanDerWaalsContact C-N 3.32Å; R184-R186 PolarHBondContact O-N 2.99Å; R184-S187 PolarHBondContact O-N 3.49Å; R184-S187 VanDerWaalsContact O-N 3.15Å; R184-S187 PolarHBondContact O-OG 2.79Å; R184-L188 WeakPolarHBondContact O-CG 3.35Å; R184-L188 PolarHBondContact O-N 3.47Å
185	V	79.5	Confident	75.5	Confident	7 Å²	7	73.7 Å²	73.7	4%	0.042	39%	0.394	C	S	.	.	H	α-helix	trans	-66.8	-32.3	178.9	174.7	0	0	0	0	111.9	I181 K183 S187 L188 K196 V199 W203	I181-V185 WeakPolarHBondContact O-CB 3.39Å; I181-V185 VanDerWaalsContact O-CG2 3.26Å; I181-V185 WeakPolarHBondContact O-CG2 3.37Å; I181-V185 PolarHBondContact O-N 3.19Å; K183-V185 PolarHBondContact O-N 3.07Å; V185-S187 VanDerWaalsContact C-N 3.33Å; V185-L188 HydrophobicContact CG2-CD1 4.47Å; V185-L188 PolarHBondContact O-N 2.82Å; V185-K196 HydrophobicContact CG1-CB 3.98Å; V185-K196 HydrophobicContact CG1-CG 4.37Å; V185-V199 HydrophobicContact CG1-CB 4.35Å; V185-V199 HydrophobicContact CG1-CG1 4.31Å; V185-V199 HydrophobicContact CG2-CG1 4.14Å; V185-W203 HydrophobicContact CG2-CD2 4.44Å; V185-W203 HydrophobicContact CG2-CE3 3.94Å; V185-W203 HydrophobicContact CG2-CH2 4.17Å; V185-W203 HydrophobicContact CG2-CZ3 3.79Å
186	R	73.6	Confident	75.4	Confident	170 Å²	170	75.7 Å²	75.7	64%	0.642	40%	0.403	S	S	*	.	H	α-helix	trans	-64	-38	172.4	-77.3	176.7	-166.2	170.1	9.2	112.4	E182 K183 R184 L188 K196	E182-R186 VanDerWaalsContact O-CG 3.27Å; E182-R186 WeakPolarHBondContact O-CG 3.41Å; E182-R186 PolarHBondContact O-N 2.9Å; K183-R186 PolarHBondContact O-N 3.21Å; R184-R186 VanDerWaalsContact C-N 3.32Å; R184-R186 PolarHBondContact O-N 2.99Å; R186-L188 VanDerWaalsContact C-N 3.34Å; R186-K196 PolarHBondContact O-NZ 3.08Å
187	S	69.3	Low	75.3	Confident	96 Å²	96	82.6 Å²	82.6	67%	0.671	43%	0.434	S	S	*	.	H	α-helix	trans	-77.5	-12	178.8	65.9	0	0	0	0	115	K183 R184 V185	K183-S187 PolarHBondContact O-N 3.48Å; K183-S187 VanDerWaalsContact O-N 3.15Å; R184-S187 PolarHBondContact O-N 3.49Å; R184-S187 VanDerWaalsContact O-N 3.15Å; R184-S187 PolarHBondContact O-OG 2.79Å; V185-S187 VanDerWaalsContact C-N 3.33Å
188	L	72.3	Confident	75.2	Confident	60 Å²	60	86.1 Å²	86.1	31%	0.314	46%	0.456	S	S	.	.	S	Bend	trans	-70.7	141.5	177	-70.9	173.3	0	0	0	111	R184 V185 R186 W203	R184-L188 WeakPolarHBondContact O-CG 3.35Å; R184-L188 PolarHBondContact O-N 3.47Å; V185-L188 HydrophobicContact CG2-CD1 4.47Å; V185-L188 PolarHBondContact O-N 2.82Å; R186-L188 VanDerWaalsContact C-N 3.34Å; L188-W203 HydrophobicContact CD1-CH2 4.37Å
189	P	71.3	Confident	75.1	Confident	103 Å²	103	84.6 Å²	84.6	67%	0.669	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-59.6	146.3	172.2	23.9	-30.9	0	0	0	110.5	I191	P189-I191 PolarHBondContact O-N 2.83Å
190	E	63.6	Low	75.4	Confident	169 Å²	169	83 Å²	83	79%	0.79	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-65.9	122.6	178.9	-67.8	-173.3	166.9	0	0	110
191	I	69.3	Low	75.6	Confident	112 Å²	112	84.9 Å²	84.9	57%	0.574	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-98.2	124.7	177.8	-56.3	173.8	0	0	0	107.5	P189 G193 L194	P189-I191 PolarHBondContact O-N 2.83Å; I191-G193 PolarHBondContact O-N 2.88Å; I191-G193 VanDerWaalsContact O-N 3.17Å; I191-L194 PolarHBondContact O-N 3.37Å
192	D	55.8	Low	75.7	Confident	169 Å²	169	87.5 Å²	87.5	90%	0.904	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	119.7	-179.9	-82	-29.6	0	0	0	111.7
193	G	65.4	Low	76.1	Confident	88 Å²	88	85.4 Å²	85.4	91%	0.907	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.3	-2.2	174.3	0	0	0	0	0	116.9	I191	I191-G193 PolarHBondContact O-N 2.88Å; I191-G193 VanDerWaalsContact O-N 3.17Å
194	L	74.4	Confident	77	Confident	96 Å²	96	82.3 Å²	82.3	50%	0.503	46%	0.457	S	S	.	.			trans	-121.6	117.7	177.8	-94.2	151.5	0	0	0	111.5	I191 T198 V199	I191-L194 PolarHBondContact O-N 3.37Å; L194-T198 HydrophobicContact CD2-CG2 4.14Å; L194-V199 HydrophobicContact CD2-CG2 4.39Å
195	S	80.5	Confident	77.5	Confident	58 Å²	58	81.1 Å²	81.1	41%	0.406	47%	0.465	S	S	.	.			trans	-73.4	144.8	175.4	86.6	0	0	0	0	111.3	E197 T198 V199	S195-E197 PolarHBondContact O-N 3.32Å; S195-T198 WeakPolarHBondContact O-CB 3.49Å; S195-T198 PolarHBondContact O-N 2.78Å; S195-T198 PolarHBondContact OG-N 2.96Å; S195-T198 VanDerWaalsContact OG-N 3.12Å; S195-T198 PolarHBondContact OG-OG1 3.46Å; S195-V199 PolarHBondContact O-N 3.07Å; S195-V199 VanDerWaalsContact O-N 3.12Å
196	K	80.8	Confident	77.9	Confident	83 Å²	83	82.7 Å²	82.7	36%	0.361	47%	0.471	S	S	.	.	H	α-helix	trans	-56.3	-31.9	175.6	-66.9	-175.1	-179.5	-175.7	0	112.3	V185 R186 L200	V185-K196 HydrophobicContact CG1-CB 3.98Å; V185-K196 HydrophobicContact CG1-CG 4.37Å; R186-K196 PolarHBondContact O-NZ 3.08Å; K196-L200 WeakPolarHBondContact O-CB 3.39Å; K196-L200 PolarHBondContact O-N 3.39Å
197	E	81.4	Confident	78.6	Confident	153 Å²	153	74.7 Å²	74.7	72%	0.715	44%	0.441	S	S	*	.	H	α-helix	trans	-70.2	-35.3	175.1	-66.8	-175	171.4	0	0	113	S195 L200 S201	S195-E197 PolarHBondContact O-N 3.32Å; E197-L200 PolarHBondContact O-N 2.83Å; E197-S201 WeakPolarHBondContact O-CB 3.31Å; E197-S201 PolarHBondContact O-N 3.48Å; E197-S201 PolarHBondContact O-OG 3.41Å
198	T	83.8	Confident	79.4	Confident	74 Å²	74	71.8 Å²	71.8	45%	0.454	42%	0.417	S	S	.	.	H	α-helix	trans	-68	-41.2	175.2	-51.1	0	0	0	0	110.9	L194 S195 S201 S202	L194-T198 HydrophobicContact CD2-CG2 4.14Å; S195-T198 WeakPolarHBondContact O-CB 3.49Å; S195-T198 PolarHBondContact O-N 2.78Å; S195-T198 PolarHBondContact OG-N 2.96Å; S195-T198 VanDerWaalsContact OG-N 3.12Å; S195-T198 PolarHBondContact OG-OG1 3.46Å; T198-S201 PolarHBondContact O-N 3.47Å; T198-S202 WeakPolarHBondContact O-CB 3.36Å; T198-S202 PolarHBondContact O-N 2.98Å
199	V	83.1	Confident	80.1	Confident	31 Å²	31	70.6 Å²	70.6	19%	0.188	42%	0.417	C	S	.	.	H	α-helix	trans	-61.7	-47.6	174.2	178.3	0	0	0	0	110.4	V185 L194 S195 S201 S202 W203	V185-V199 HydrophobicContact CG1-CB 4.35Å; V185-V199 HydrophobicContact CG1-CG1 4.31Å; V185-V199 HydrophobicContact CG2-CG1 4.14Å; L194-V199 HydrophobicContact CD2-CG2 4.39Å; S195-V199 PolarHBondContact O-N 3.07Å; S195-V199 VanDerWaalsContact O-N 3.12Å; V199-S201 PolarHBondContact O-N 2.98Å; V199-S202 WeakPolarHBondContact O-CB 3.37Å; V199-S202 PolarHBondContact O-N 3.07Å; V199-W203 HydrophobicContact CG1-CD2 4.39Å; V199-W203 HydrophobicContact CG1-CZ2 4.41Å; V199-W203 PolarHBondContact O-N 2.94Å
200	L	85.5	Confident	80.7	Confident	28 Å²	28	66 Å²	66	15%	0.147	39%	0.386	C	S	.	.	H	α-helix	trans	-57.3	-47.2	176.4	-173	73.7	0	0	0	111.9	I181 E182 K196 E197 S202 W203 I204	I181-L200 HydrophobicContact CB-CD1 4.46Å; I181-L200 HydrophobicContact CD1-CD1 3.46Å; I181-L200 VanDerWaalsContact CD1-CD1 3.46Å; I181-L200 HydrophobicContact CD1-CG 4.4Å; I181-L200 HydrophobicContact CG1-CD1 3.5Å; I181-L200 VanDerWaalsContact CG1-CD1 3.5Å; E182-L200 HydrophobicContact CB-CD1 4.47Å; E182-L200 HydrophobicContact CG-CD1 3.62Å; E182-L200 HydrophobicContact CG-CD2 3.82Å; E182-L200 HydrophobicContact CG-CG 4.41Å; K196-L200 WeakPolarHBondContact O-CB 3.39Å; K196-L200 PolarHBondContact O-N 3.39Å; E197-L200 PolarHBondContact O-N 2.83Å; L200-S202 VanDerWaalsContact C-N 3.35Å; L200-S202 PolarHBondContact O-N 3.06Å; L200-W203 PolarHBondContact O-N 2.97Å; L200-I204 VanDerWaalsContact O-CG1 3.31Å; L200-I204 WeakPolarHBondContact O-CG1 3.35Å; L200-I204 PolarHBondContact O-N 2.72Å
201	S	86.1	Confident	81.6	Confident	77 Å²	77	60.8 Å²	60.8	54%	0.538	36%	0.36	S	S	.	.	H	α-helix	trans	-64.3	-38.9	179	-59.1	0	0	0	0	112.3	E197 T198 V199 I204 A205	E197-S201 WeakPolarHBondContact O-CB 3.31Å; E197-S201 PolarHBondContact O-N 3.48Å; E197-S201 PolarHBondContact O-OG 3.41Å; T198-S201 PolarHBondContact O-N 3.47Å; V199-S201 PolarHBondContact O-N 2.98Å; S201-I204 PolarHBondContact O-N 2.72Å; S201-A205 PolarHBondContact O-N 3.22Å
202	S	86.8	Confident	82.2	Confident	56 Å²	56	61.7 Å²	61.7	39%	0.392	36%	0.356	S	S	.	.	H	α-helix	trans	-62.8	-47	175.1	-177.7	0	0	0	0	111.7	T198 V199 L200 I204 A205 K206	T198-S202 WeakPolarHBondContact O-CB 3.36Å; T198-S202 PolarHBondContact O-N 2.98Å; V199-S202 WeakPolarHBondContact O-CB 3.37Å; V199-S202 PolarHBondContact O-N 3.07Å; L200-S202 VanDerWaalsContact C-N 3.35Å; L200-S202 PolarHBondContact O-N 3.06Å; S202-I204 VanDerWaalsContact C-N 3.32Å; S202-I204 PolarHBondContact O-N 3.09Å; S202-A205 WeakPolarHBondContact O-CB 3.27Å; S202-A205 PolarHBondContact O-N 3.3Å; S202-A205 VanDerWaalsContact O-N 3.16Å; S202-K206 WeakPolarHBondContact O-CG 3.15Å; S202-K206 PolarHBondContact O-N 3.26Å
203	W	89.4	Confident	82.8	Confident	6 Å²	6	54.7 Å²	54.7	2%	0.023	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-36.4	179.1	-75.2	16.1	0	0	0	112.4	A141 F142 A145 I181 V185 L188 V199 L200 K206 Y207	A141-W203 HydrophobicContact CB-CH2 4Å; A141-W203 HydrophobicContact CB-CZ2 3.89Å; F142-W203 HydrophobicContact CB-CD2 4.31Å; F142-W203 HydrophobicContact CB-CZ2 4.08Å; F142-W203 HydrophobicContact CD2-CB 3.79Å; F142-W203 AromaticContact CD2-CD1 3.79Å; F142-W203 AromaticContact CD2-CD2 3.57Å; F142-W203 HydrophobicContact CD2-CD2 3.57Å; F142-W203 HydrophobicContact CD2-CE3 4.01Å; F142-W203 AromaticContact CD2-CG 3.45Å; F142-W203 HydrophobicContact CD2-CG 3.45Å; F142-W203 VanDerWaalsContact CD2-CG 3.45Å; F142-W203 HydrophobicContact CE2-CB 3.78Å; F142-W203 HydrophobicContact CE2-CD2 4.43Å; F142-W203 AromaticContact CE2-CG 3.99Å; F142-W203 HydrophobicContact CE2-CG 3.99Å; F142-W203 WeakPolarHBondContact CE2-O 3.18Å; F142-W203 HydrophobicContact CG-CD2 4.41Å; F142-W203 HydrophobicContact CG-CG 4.4Å; A145-W203 HydrophobicContact CB-CZ3 3.96Å; I181-W203 HydrophobicContact CB-CE3 3.69Å; I181-W203 HydrophobicContact CB-CZ3 4.05Å; I181-W203 HydrophobicContact CD1-CB 3.8Å; I181-W203 HydrophobicContact CD1-CE3 4.27Å; I181-W203 HydrophobicContact CG2-CE3 3.66Å; I181-W203 HydrophobicContact CG2-CZ3 4.03Å; V185-W203 HydrophobicContact CG2-CD2 4.44Å; V185-W203 HydrophobicContact CG2-CE3 3.94Å; V185-W203 HydrophobicContact CG2-CH2 4.17Å; V185-W203 HydrophobicContact CG2-CZ3 3.79Å; L188-W203 HydrophobicContact CD1-CH2 4.37Å; V199-W203 HydrophobicContact CG1-CD2 4.39Å; V199-W203 HydrophobicContact CG1-CZ2 4.41Å; V199-W203 PolarHBondContact O-N 2.94Å; L200-W203 PolarHBondContact O-N 2.97Å; W203-K206 PolarHBondContact O-N 3.34Å; W203-Y207 PolarHBondContact O-N 2.9Å
204	I	89.2	Confident	82.3	Confident	12 Å²	12	55.9 Å²	55.9	6%	0.062	31%	0.305	C	S	.	.	H	α-helix	trans	-67.4	-39	172.8	-67.9	-65.8	0	0	0	112.1	F177 K178 I181 L200 S201 S202 K206 Y207 D208	F177-I204 HydrophobicContact CD1-CD1 3.96Å; F177-I204 HydrophobicContact CE1-CD1 4.46Å; K178-I204 HydrophobicContact CB-CD1 3.72Å; K178-I204 HydrophobicContact CG-CD1 3.94Å; K178-I204 HydrophobicContact CG-CG1 4.41Å; I181-I204 HydrophobicContact CD1-CD1 3.8Å; I181-I204 HydrophobicContact CD1-CG1 3.92Å; L200-I204 VanDerWaalsContact O-CG1 3.31Å; L200-I204 WeakPolarHBondContact O-CG1 3.35Å; L200-I204 PolarHBondContact O-N 2.72Å; S201-I204 PolarHBondContact O-N 2.72Å; S202-I204 VanDerWaalsContact C-N 3.32Å; S202-I204 PolarHBondContact O-N 3.09Å; I204-K206 VanDerWaalsContact C-N 3.32Å; I204-K206 PolarHBondContact O-N 3.28Å; I204-Y207 WeakPolarHBondContact O-CB 3.48Å; I204-Y207 PolarHBondContact O-N 3.08Å; I204-D208 PolarHBondContact O-N 3.45Å
205	A	86.4	Confident	80.9	Confident	55 Å²	55	59.3 Å²	59.3	46%	0.455	32%	0.319	S	S	.	.	H	α-helix	trans	-63.8	-38.8	175.1	0	0	0	0	0	112	S201 S202 D208 A209	S201-A205 PolarHBondContact O-N 3.22Å; S202-A205 WeakPolarHBondContact O-CB 3.27Å; S202-A205 PolarHBondContact O-N 3.3Å; S202-A205 VanDerWaalsContact O-N 3.16Å; A205-D208 PolarHBondContact O-N 2.93Å; A205-A209 PolarHBondContact O-N 3.36Å
206	K	88.1	Confident	79.2	Confident	41 Å²	41	60.8 Å²	60.8	18%	0.178	32%	0.322	C	S	.	.	H	α-helix	trans	-64.7	-42.7	172.7	-67	-177.7	-168.7	-170.5	0	111.7	I136 I137 D139 F142 S202 W203 I204 D208 A209 I210	I136-K206 HydrophobicContact CG2-CB 4.39Å; I136-K206 HydrophobicContact CG2-CG 4.38Å; I137-K206 VanDerWaalsContact O-CE 3.28Å; I137-K206 WeakPolarHBondContact O-CE 3.46Å; I137-K206 PolarHBondContact O-NZ 3.48Å; D139-K206 IonicContact OD1-NZ 3.26Å; D139-K206 PolarHBondContact OD1-NZ 3.01Å; F142-K206 HydrophobicContact CD1-CD 4.05Å; F142-K206 HydrophobicContact CE1-CB 3.78Å; F142-K206 HydrophobicContact CE1-CD 3.92Å; F142-K206 HydrophobicContact CE2-CB 4.06Å; F142-K206 HydrophobicContact CE2-CD 4.48Å; F142-K206 HydrophobicContact CG-CD 4.37Å; F142-K206 HydrophobicContact CZ-CB 3.41Å; F142-K206 VanDerWaalsContact CZ-CB 3.41Å; F142-K206 HydrophobicContact CZ-CD 4.16Å; F142-K206 HydrophobicContact CZ-CG 4.43Å; S202-K206 WeakPolarHBondContact O-CG 3.15Å; S202-K206 PolarHBondContact O-N 3.26Å; W203-K206 PolarHBondContact O-N 3.34Å; I204-K206 VanDerWaalsContact C-N 3.32Å; I204-K206 PolarHBondContact O-N 3.28Å; K206-D208 VanDerWaalsContact C-N 3.34Å; K206-D208 PolarHBondContact O-N 3.28Å; K206-A209 WeakPolarHBondContact O-CB 3.38Å; K206-A209 PolarHBondContact O-N 3.45Å; K206-I210 WeakPolarHBondContact O-CG1 3.32Å; K206-I210 PolarHBondContact O-N 3.17Å
207	Y	88.1	Confident	77.3	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.008	35%	0.345	C	S	.	.	H	α-helix	trans	-56.2	-47.8	171.8	170.6	-83.5	0	0	0	111.7	F126 Y149 F173 R174 F177 W203 I204 A209 I210 Y211	F126-Y207 HydrophobicContact CE1-CD2 4.13Å; F126-Y207 HydrophobicContact CE1-CE2 4.18Å; F126-Y207 HydrophobicContact CE2-CE2 4.37Å; F126-Y207 AromaticContact CZ-CD2 3.6Å; F126-Y207 HydrophobicContact CZ-CD2 3.6Å; F126-Y207 AromaticContact CZ-CE2 3.46Å; F126-Y207 HydrophobicContact CZ-CE2 3.46Å; F126-Y207 VanDerWaalsContact CZ-CE2 3.46Å; Y149-Y207 AromaticContact CE1-CE2 3.95Å; Y149-Y207 HydrophobicContact CE1-CE2 3.95Å; F173-Y207 WeakPolarHBondContact CB-OH 3.43Å; R174-Y207 HydrophobicContact CB-CD1 4.46Å; R174-Y207 HydrophobicContact CB-CE1 3.75Å; R174-Y207 HydrophobicContact CG-CD1 4.07Å; R174-Y207 HydrophobicContact CG-CE1 3.84Å; R174-Y207 PolarHBondContact N-OH 3.27Å; F177-Y207 HydrophobicContact CB-CD2 3.86Å; F177-Y207 HydrophobicContact CB-CE2 3.78Å; F177-Y207 AromaticContact CD1-CD2 3.42Å; F177-Y207 HydrophobicContact CD1-CD2 3.42Å; F177-Y207 VanDerWaalsContact CD1-CD2 3.42Å; F177-Y207 HydrophobicContact CD1-CE2 4.24Å; F177-Y207 AromaticContact CD1-CG 3.68Å; F177-Y207 HydrophobicContact CD1-CG 3.68Å; F177-Y207 AromaticContact CD2-CD2 3.95Å; F177-Y207 HydrophobicContact CD2-CD2 3.95Å; F177-Y207 HydrophobicContact CD2-CE2 4.38Å; F177-Y207 AromaticContact CE1-CD2 3.91Å; F177-Y207 HydrophobicContact CE1-CD2 3.91Å; F177-Y207 HydrophobicContact CE1-CG 4.06Å; F177-Y207 HydrophobicContact CE2-CD2 4.37Å; F177-Y207 AromaticContact CG-CD2 3.44Å; F177-Y207 HydrophobicContact CG-CD2 3.44Å; F177-Y207 VanDerWaalsContact CG-CD2 3.44Å; F177-Y207 AromaticContact CG-CE2 3.87Å; F177-Y207 HydrophobicContact CG-CE2 3.87Å; F177-Y207 HydrophobicContact CG-CG 4.17Å; F177-Y207 HydrophobicContact CZ-CD2 4.35Å; W203-Y207 PolarHBondContact O-N 2.9Å; I204-Y207 WeakPolarHBondContact O-CB 3.48Å; I204-Y207 PolarHBondContact O-N 3.08Å; Y207-A209 PolarHBondContact O-N 2.84Å; Y207-I210 PolarHBondContact O-N 3.25Å; Y207-Y211 HydrophobicContact CE1-CD2 4.27Å; Y207-Y211 WeakPolarHBondContact O-CB 3.43Å; Y207-Y211 PolarHBondContact O-N 2.91Å
208	D	87.1	Confident	75.2	Confident	34 Å²	34	63 Å²	63	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-63.9	-29.6	-179.7	-72.1	-26.2	0	0	0	111.5	R174 I204 A205 K206 R212	R174-D208 WeakPolarHBondContact CD-OD1 3.27Å; R174-D208 IonicContact CZ-OD2 2.73Å; R174-D208 IonicContact NE-OD1 2.73Å; R174-D208 PolarHBondContact NE-OD1 2.86Å; R174-D208 VanDerWaalsContact NE-OD1 3.12Å; R174-D208 IonicContact NE-OD2 2.64Å; R174-D208 PolarHBondContact NE-OD2 2.92Å; R174-D208 IonicContact NH2-OD2 3.09Å; R174-D208 PolarHBondContact NH2-OD2 2.9Å; I204-D208 PolarHBondContact O-N 3.45Å; A205-D208 PolarHBondContact O-N 2.93Å; K206-D208 VanDerWaalsContact C-N 3.34Å; K206-D208 PolarHBondContact O-N 3.28Å; D208-R212 WeakPolarHBondContact O-CG 3.31Å; D208-R212 VanDerWaalsContact O-CZ 3.29Å; D208-R212 PolarHBondContact O-N 2.99Å; D208-R212 VanDerWaalsContact O-N 3.15Å; D208-R212 PolarHBondContact O-NE 3.49Å
209	A	84.9	Confident	73.2	Confident	36 Å²	36	67.6 Å²	67.6	30%	0.298	36%	0.364	S	S	.	.	H	α-helix	trans	-70	-45.7	172.4	0	0	0	0	0	112.4	I136 A205 K206 Y207 Y211 R212 G213	I136-A209 HydrophobicContact CD1-CB 3.95Å; A205-A209 PolarHBondContact O-N 3.36Å; K206-A209 WeakPolarHBondContact O-CB 3.38Å; K206-A209 PolarHBondContact O-N 3.45Å; Y207-A209 PolarHBondContact O-N 2.84Å; A209-Y211 VanDerWaalsContact C-N 3.31Å; A209-Y211 PolarHBondContact O-N 3.39Å; A209-R212 PolarHBondContact O-N 2.95Å; A209-G213 PolarHBondContact O-N 3.48Å; A209-G213 VanDerWaalsContact O-N 3.07Å
210	I	85.3	Confident	70.6	Confident	5 Å²	5	74.4 Å²	74.4	3%	0.026	39%	0.394	C	S	.	.	H	α-helix	trans	-61.1	-42.8	174.2	-60.6	165.8	0	0	0	110.4	F126 F129 I136 F142 K206 Y207 R212 G213	F126-I210 HydrophobicContact CD1-CG2 4.35Å; F126-I210 HydrophobicContact CD2-CG2 3.6Å; F126-I210 HydrophobicContact CE1-CG2 4.3Å; F126-I210 HydrophobicContact CE2-CB 4.3Å; F126-I210 HydrophobicContact CE2-CG2 3.55Å; F126-I210 HydrophobicContact CG-CG2 4.01Å; F126-I210 HydrophobicContact CZ-CB 4.35Å; F126-I210 HydrophobicContact CZ-CG2 3.9Å; F129-I210 HydrophobicContact CB-CD1 4.34Å; F129-I210 HydrophobicContact CB-CG1 4.42Å; F129-I210 HydrophobicContact CB-CG2 4.41Å; F129-I210 HydrophobicContact CD1-CD1 3.94Å; F129-I210 HydrophobicContact CD2-CD1 3.74Å; F129-I210 HydrophobicContact CD2-CG1 3.97Å; F129-I210 HydrophobicContact CE1-CD1 4.2Å; F129-I210 HydrophobicContact CE2-CD1 4.04Å; F129-I210 HydrophobicContact CG-CD1 3.72Å; F129-I210 HydrophobicContact CG-CG1 4.15Å; F129-I210 HydrophobicContact CZ-CD1 4.25Å; I136-I210 HydrophobicContact CD1-CB 4.32Å; I136-I210 HydrophobicContact CD1-CG1 3.45Å; I136-I210 VanDerWaalsContact CD1-CG1 3.45Å; F142-I210 HydrophobicContact CE1-CD1 4.18Å; F142-I210 HydrophobicContact CZ-CD1 4.27Å; K206-I210 WeakPolarHBondContact O-CG1 3.32Å; K206-I210 PolarHBondContact O-N 3.17Å; Y207-I210 PolarHBondContact O-N 3.25Å; I210-R212 PolarHBondContact O-N 3.4Å; I210-G213 PolarHBondContact O-N 3.37Å
211	Y	83	Confident	68.2	Low	61 Å²	61	79.3 Å²	79.3	24%	0.239	43%	0.427	C	S	.	.	H	α-helix	trans	-62.1	-41.3	-179.5	-173.2	-83.2	0	0	0	112	L122 R125 A170 Y207 A209	L122-Y211 HydrophobicContact CD1-CD2 3.47Å; L122-Y211 VanDerWaalsContact CD1-CD2 3.47Å; L122-Y211 HydrophobicContact CD1-CE2 3.84Å; L122-Y211 HydrophobicContact CD1-CG 4.23Å; L122-Y211 HydrophobicContact CD2-CD2 4.32Å; L122-Y211 HydrophobicContact CD2-CE2 4.09Å; R125-Y211 PolarHBondContact NH1-O 2.96Å; A170-Y211 HydrophobicContact CB-CE1 4.39Å; A170-Y211 HydrophobicContact CB-CE2 4.37Å; A170-Y211 WeakPolarHBondContact CB-OH 3.41Å; Y207-Y211 HydrophobicContact CE1-CD2 4.27Å; Y207-Y211 WeakPolarHBondContact O-CB 3.43Å; Y207-Y211 PolarHBondContact O-N 2.91Å; A209-Y211 VanDerWaalsContact C-N 3.31Å; A209-Y211 PolarHBondContact O-N 3.39Å
212	R	80.9	Confident	65.6	Low	131 Å²	131	82.3 Å²	82.3	49%	0.494	44%	0.437	S	S	.	.	H	α-helix	trans	-73.8	-35	178.5	-75.7	-173.2	-69.3	-91.3	-3.3	113.5	R125 D208 A209 I210	R125-R212 PolarHBondContact NH1-O 3.33Å; D208-R212 WeakPolarHBondContact O-CG 3.31Å; D208-R212 VanDerWaalsContact O-CZ 3.29Å; D208-R212 PolarHBondContact O-N 2.99Å; D208-R212 VanDerWaalsContact O-N 3.15Å; D208-R212 PolarHBondContact O-NE 3.49Å; A209-R212 PolarHBondContact O-N 2.95Å; I210-R212 PolarHBondContact O-N 3.4Å
213	G	69.4	Low	63.2	Low	21 Å²	21	90.3 Å²	90.3	22%	0.216	46%	0.459	C	S	.	.			trans	72.7	171.3	-174	0	0	0	0	0	112.9	A209 I210 E215	A209-G213 PolarHBondContact O-N 3.48Å; A209-G213 VanDerWaalsContact O-N 3.07Å; I210-G213 PolarHBondContact O-N 3.37Å; G213-E215 VanDerWaalsContact C-N 3.32Å; G213-E215 PolarHBondContact O-N 2.94Å
214	E	54.6	Low	60.6	Low	113 Å²	113	97.9 Å²	97.9	53%	0.528	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-73.4	-17.4	-175.7	-68.3	-168.8	169.1	0	0	114.1	Q135 D216	Q135-E214 PolarHBondContact N-OE1 3.1Å; E214-D216 PolarHBondContact O-N 3.29Å
215	E	45.4	Very low	57.8	Low	168 Å²	168	101.9 Å²	101.9	79%	0.785	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-71.3	-18	-174.8	-72.1	-171.6	143.2	0	0	115.5	G213	G213-E215 VanDerWaalsContact C-N 3.32Å; G213-E215 PolarHBondContact O-N 2.94Å
216	D	44.5	Very low	55.2	Low	90 Å²	90	106.6 Å²	106.6	48%	0.481	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-102.7	3.2	-172.8	-93.6	-31.6	0	0	0	115.2	E214 C218 K219	E214-D216 PolarHBondContact O-N 3.29Å; D216-C218 PolarHBondContact O-N 3.42Å; D216-K219 PolarHBondContact O-N 3.08Å
217	L	40.8	Very low	52.6	Low	158 Å²	158	107 Å²	107	83%	0.827	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-10.3	177.8	-75.5	163	0	0	0	113.6
218	C	37.6	Very low	50.2	Low	124 Å²	124	109.7 Å²	109.7	84%	0.838	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-11.9	-179.4	-162.9	0	0	0	0	114.7	D216	D216-C218 PolarHBondContact O-N 3.42Å
219	K	40.2	Very low	47.8	Very low	171 Å²	171	113.6 Å²	113.6	74%	0.743	60%	0.604	S	S	*	*	S	Bend	trans	-107.2	106.9	178.9	-71.4	179.3	-176.8	166.2	0	111.1	D216	D216-K219 PolarHBondContact O-N 3.08Å
220	Q	28.9	Very low	45.5	Very low	174 Å²	174	116.7 Å²	116.7	81%	0.813	62%	0.623	S	S	*	*			trans	-48.4	144.6	168	-83.9	-175.6	-12.8	0	0	111	N222	Q220-N222 VanDerWaalsContact C-N 3.33Å; Q220-N222 PolarHBondContact O-N 3.18Å
221	P	35.7	Very low	43.8	Very low	130 Å²	130	121.1 Å²	121.1	84%	0.844	64%	0.644	S	S	*	*			trans	-68.2	96.4	170.1	28.7	-30.4	0	0	0	108	R223	P221-R223 PolarHBondContact O-N 3.06Å
222	N	31.4	Very low	42.6	Very low	140 Å²	140	119.9 Å²	119.9	75%	0.749	64%	0.641	S	S	*	*			trans	-62.8	136.7	173.7	-131.2	-7.2	0	0	0	108.1	Q220 M224	Q220-N222 VanDerWaalsContact C-N 3.33Å; Q220-N222 PolarHBondContact O-N 3.18Å; N222-M224 WeakPolarHBondContact O-CG 3.5Å; N222-M224 PolarHBondContact O-N 3.26Å
223	R	36.2	Very low	41.9	Very low	224 Å²	224	118.3 Å²	118.3	85%	0.845	64%	0.641	S	S	*	*			trans	-44.4	92.4	-178.2	-78.5	173.6	160.8	173.8	-5.4	112.8	P221	P221-R223 PolarHBondContact O-N 3.06Å
224	M	34.4	Very low	42.3	Very low	165 Å²	165	119.1 Å²	119.1	81%	0.813	64%	0.64	S	S	*	*			trans	-88.3	-2.2	175.7	-75.8	-171.3	110	0	0	114	N222 L226	N222-M224 WeakPolarHBondContact O-CG 3.5Å; N222-M224 PolarHBondContact O-N 3.26Å; M224-L226 PolarHBondContact O-N 3.43Å
225	A	31.6	Very low	43.6	Very low	97 Å²	97	115.9 Å²	115.9	80%	0.802	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-11.9	-173.4	0	0	0	0	0	115.2
226	L	30.9	Very low	45.4	Very low	153 Å²	153	112.5 Å²	112.5	80%	0.801	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	-7.1	-177.5	-72.9	161.8	0	0	0	114.3	M224	M224-L226 PolarHBondContact O-N 3.43Å
227	S	34.6	Very low	47.4	Very low	51 Å²	51	114.6 Å²	114.6	36%	0.357	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.4	-23.2	177.4	-164.4	0	0	0	0	113.6	V229 S230 E231	S227-V229 VanDerWaalsContact C-N 3.27Å; S227-V229 PolarHBondContact O-N 2.89Å; S227-V229 VanDerWaalsContact O-N 3.12Å; S227-S230 PolarHBondContact O-N 3.47Å; S227-E231 PolarHBondContact O-N 3.48Å; S227-E231 VanDerWaalsContact O-N 3.17Å; S227-E231 PolarHBondContact OG-OE1 3.39Å
228	A	36.2	Very low	49.5	Very low	57 Å²	57	111.5 Å²	111.5	47%	0.471	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.9	-31.8	-169.2	0	0	0	0	0	114.3	L232	A228-L232 WeakPolarHBondContact O-CD1 3.41Å
229	V	36.9	Very low	51.8	Low	116 Å²	116	105.7 Å²	105.7	70%	0.703	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-31.8	178.5	-174.5	0	0	0	0	112	S227 E231	S227-V229 VanDerWaalsContact C-N 3.27Å; S227-V229 PolarHBondContact O-N 2.89Å; S227-V229 VanDerWaalsContact O-N 3.12Å; V229-E231 VanDerWaalsContact C-N 3.33Å
230	S	37.7	Very low	54.1	Low	101 Å²	101	97.8 Å²	97.8	71%	0.706	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-15.8	179.7	-149.9	0	0	0	0	112.9	S227	S227-S230 PolarHBondContact O-N 3.47Å
231	E	48.4	Very low	56.9	Low	99 Å²	99	95 Å²	95	46%	0.463	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-5.2	174.8	-75.7	174.8	-154.1	0	0	114.3	R110 S227 V229	R110-E231 PolarHBondContact NH1-O 3.24Å; R110-E231 PolarHBondContact NH2-O 3.28Å; S227-E231 PolarHBondContact O-N 3.48Å; S227-E231 VanDerWaalsContact O-N 3.17Å; S227-E231 PolarHBondContact OG-OE1 3.39Å; V229-E231 VanDerWaalsContact C-N 3.33Å
232	L	57.3	Low	59.4	Low	34 Å²	34	90.1 Å²	90.1	18%	0.178	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-30.8	179.7	-96.8	151.6	0	0	0	112.7	T105 A108 A228	T105-L232 WeakPolarHBondContact O-CD2 3.2Å; A108-L232 HydrophobicContact CB-CD2 3.73Å; A228-L232 WeakPolarHBondContact O-CD1 3.41Å
233	I	68.1	Low	62.1	Low	98 Å²	98	83.5 Å²	83.5	50%	0.503	45%	0.445	S	S	.	.	S	Bend	trans	-105.8	111.7	178.4	-58.4	175.6	0	0	0	108.4
234	L	76.3	Confident	64.7	Low	38 Å²	38	74.1 Å²	74.1	20%	0.199	41%	0.411	C	S	.	.			trans	-73.3	135.9	178.8	-70.7	160.1	0	0	0	110.4	Q103 Q238 L239	Q103-L234 PolarHBondContact NE2-O 2.71Å; L234-Q238 HydrophobicContact CB-CB 4.36Å; L234-Q238 HydrophobicContact CD2-CB 4.01Å; L234-L239 HydrophobicContact CB-CD2 3.92Å; L234-L239 HydrophobicContact CB-CG 4.08Å; L234-L239 HydrophobicContact CD1-CD2 4Å
235	S	82.8	Confident	67.3	Low	46 Å²	46	72.2 Å²	72.2	32%	0.322	40%	0.4	S	S	.	.			trans	-66.7	161.2	172.2	83	0	0	0	0	110.7	E237 Q238 L239	S235-E237 PolarHBondContact O-N 2.67Å; S235-E237 PolarHBondContact OG-N 2.93Å; S235-Q238 PolarHBondContact O-N 3.31Å; S235-Q238 WeakPolarHBondContact OG-CG 3.42Å; S235-Q238 PolarHBondContact OG-N 3.41Å; S235-L239 WeakPolarHBondContact O-CG 3.37Å; S235-L239 PolarHBondContact O-N 3.45Å
236	K	83.6	Confident	70	Confident	96 Å²	96	68.2 Å²	68.2	42%	0.417	37%	0.365	S	S	.	.	H	α-helix	trans	-58.3	-39.9	176	-71.2	-172.3	177.3	-175.6	0	111.8	I95 A96 L239 Y240	I95-K236 HydrophobicContact CG2-CB 4.25Å; I95-K236 HydrophobicContact CG2-CG 4.4Å; A96-K236 PolarHBondContact O-NZ 3.46Å; K236-L239 PolarHBondContact O-N 3.28Å; K236-Y240 HydrophobicContact CB-CE2 4.13Å; K236-Y240 WeakPolarHBondContact O-CD2 3.26Å; K236-Y240 PolarHBondContact O-N 3.01Å
237	E	85.1	Confident	72.7	Confident	134 Å²	134	61 Å²	61	63%	0.626	33%	0.327	S	S	*	.	H	α-helix	trans	-60.6	-47	177.4	-67.4	148.3	-175.2	0	0	111.2	S235 L239 Y240 E241	S235-E237 PolarHBondContact O-N 2.67Å; S235-E237 PolarHBondContact OG-N 2.93Å; E237-L239 VanDerWaalsContact C-N 3.31Å; E237-L239 PolarHBondContact O-N 3.32Å; E237-Y240 PolarHBondContact O-N 3.3Å; E237-Y240 VanDerWaalsContact O-N 3.16Å; E237-E241 PolarHBondContact O-N 3.2Å
238	Q	84.9	Confident	75.2	Confident	94 Å²	94	61.1 Å²	61.1	44%	0.439	34%	0.337	S	S	.	.	H	α-helix	trans	-61.8	-38.3	176.4	-70	172.5	-30.2	0	0	112.2	L234 S235 M242	L234-Q238 HydrophobicContact CB-CB 4.36Å; L234-Q238 HydrophobicContact CD2-CB 4.01Å; S235-Q238 PolarHBondContact O-N 3.31Å; S235-Q238 WeakPolarHBondContact OG-CG 3.42Å; S235-Q238 PolarHBondContact OG-N 3.41Å; Q238-M242 VanDerWaalsContact O-CB 3.29Å; Q238-M242 WeakPolarHBondContact O-CB 3.44Å; Q238-M242 PolarHBondContact O-N 2.94Å
239	L	86.5	Confident	77.7	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-65.7	-40	175.1	-68	174.6	0	0	0	112.1	I95 L234 S235 K236 E237 M242 F243 F675 V676	I95-L239 HydrophobicContact CD1-CB 4.02Å; I95-L239 HydrophobicContact CG1-CB 4.29Å; I95-L239 HydrophobicContact CG2-CB 4.01Å; I95-L239 HydrophobicContact CG2-CD1 4.29Å; L234-L239 HydrophobicContact CB-CD2 3.92Å; L234-L239 HydrophobicContact CB-CG 4.08Å; L234-L239 HydrophobicContact CD1-CD2 4Å; S235-L239 WeakPolarHBondContact O-CG 3.37Å; S235-L239 PolarHBondContact O-N 3.45Å; K236-L239 PolarHBondContact O-N 3.28Å; E237-L239 VanDerWaalsContact C-N 3.31Å; E237-L239 PolarHBondContact O-N 3.32Å; L239-M242 HydrophobicContact CD2-CE 3.79Å; L239-M242 PolarHBondContact O-N 3Å; L239-F243 WeakPolarHBondContact O-CD2 3.23Å; L239-F243 PolarHBondContact O-N 3.42Å; L239-F675 HydrophobicContact CD1-CD1 3.91Å; L239-F675 HydrophobicContact CD1-CE1 3.81Å; L239-V676 HydrophobicContact CD1-CG2 4.47Å; L239-V676 HydrophobicContact CD2-CG2 4.39Å
240	Y	88.4	Confident	80	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.016	31%	0.312	C	S	.	.	H	α-helix	trans	-64.3	-45.3	176.9	-72	-56.2	0	0	0	112.3	Y88 V92 I95 A96 K236 E237 Q244 Y258 Q262	Y88-Y240 PolarHBondContact OH-O 2.82Å; V92-Y240 HydrophobicContact CB-CE1 4.22Å; V92-Y240 HydrophobicContact CG1-CE1 3.85Å; V92-Y240 HydrophobicContact CG2-CD1 4.24Å; V92-Y240 HydrophobicContact CG2-CE1 4.19Å; I95-Y240 HydrophobicContact CB-CD1 4.18Å; I95-Y240 HydrophobicContact CB-CE1 3.57Å; I95-Y240 HydrophobicContact CD1-CD1 3.82Å; I95-Y240 HydrophobicContact CD1-CE1 4.05Å; I95-Y240 HydrophobicContact CG1-CE1 4.41Å; I95-Y240 HydrophobicContact CG2-CD1 3.94Å; I95-Y240 HydrophobicContact CG2-CD2 4.15Å; I95-Y240 HydrophobicContact CG2-CE1 3.51Å; I95-Y240 HydrophobicContact CG2-CE2 3.74Å; I95-Y240 HydrophobicContact CG2-CG 4.24Å; I95-Y240 VanDerWaalsContact CG2-CZ 3.43Å; A96-Y240 WeakPolarHBondContact CA-OH 3.3Å; A96-Y240 WeakPolarHBondContact CB-OH 3.42Å; A96-Y240 PolarHBondContact N-OH 3.47Å; K236-Y240 HydrophobicContact CB-CE2 4.13Å; K236-Y240 WeakPolarHBondContact O-CD2 3.26Å; K236-Y240 PolarHBondContact O-N 3.01Å; E237-Y240 PolarHBondContact O-N 3.3Å; E237-Y240 VanDerWaalsContact O-N 3.16Å; Y240-Q244 WeakPolarHBondContact O-CB 3.46Å; Y240-Q244 PolarHBondContact O-N 3.29Å; Y240-Y258 HydrophobicContact CD1-CD2 4.39Å; Y240-Y258 HydrophobicContact CD2-CD2 4Å; Y240-Y258 AromaticContact CD2-CE2 3.58Å; Y240-Y258 HydrophobicContact CD2-CE2 3.58Å; Y240-Y258 HydrophobicContact CE1-CD2 4.32Å; Y240-Y258 AromaticContact CE2-CD2 3.94Å; Y240-Y258 HydrophobicContact CE2-CD2 3.94Å; Y240-Y258 AromaticContact CE2-CE2 3.4Å; Y240-Y258 HydrophobicContact CE2-CE2 3.4Å; Y240-Y258 VanDerWaalsContact CE2-CE2 3.4Å; Y240-Y258 HydrophobicContact CG-CD2 4.22Å; Y240-Y258 HydrophobicContact CG-CE2 4.25Å; Y240-Y258 AromaticContact CZ-CE2 3.92Å; Y240-Q262 PolarHBondContact OH-NE2 3.36Å; Y240-Q262 VanDerWaalsContact OH-NE2 3.08Å
241	E	87.1	Confident	82.2	Confident	115 Å²	115	63.1 Å²	63.1	54%	0.537	31%	0.313	S	S	.	.	H	α-helix	trans	-61.9	-44.1	176.4	-71.1	-177.2	170.2	0	0	111.4	E237 Q244 Q245	E237-E241 PolarHBondContact O-N 3.2Å; E241-Q244 WeakPolarHBondContact O-CB 3.47Å; E241-Q244 PolarHBondContact O-N 3.01Å; E241-Q245 WeakPolarHBondContact O-CG 3.48Å; E241-Q245 PolarHBondContact O-N 2.63Å
242	M	88.6	Confident	83.9	Confident	29 Å²	29	63.5 Å²	63.5	14%	0.143	32%	0.317	C	S	.	.	H	α-helix	trans	-61.1	-51.8	178.4	-176.5	-179	67.6	0	0	111.6	Q238 L239 Q244 Q245 I246 Q673	Q238-M242 VanDerWaalsContact O-CB 3.29Å; Q238-M242 WeakPolarHBondContact O-CB 3.44Å; Q238-M242 PolarHBondContact O-N 2.94Å; L239-M242 HydrophobicContact CD2-CE 3.79Å; L239-M242 PolarHBondContact O-N 3Å; M242-Q244 VanDerWaalsContact C-N 3.3Å; M242-Q244 PolarHBondContact O-N 3.24Å; M242-Q245 PolarHBondContact O-N 3.42Å; M242-Q245 VanDerWaalsContact O-N 3.17Å; M242-I246 HydrophobicContact CG-CD1 3.81Å; M242-I246 VanDerWaalsContact O-CG1 3.27Å; M242-I246 WeakPolarHBondContact O-CG1 3.35Å; M242-I246 PolarHBondContact O-N 3.06Å; M242-Q673 HydrophobicContact CE-CG 3.74Å; M242-Q673 HydrophobicContact SD-CG 3.87Å
243	F	89.4	Confident	85.1	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-72.1	-23.8	179.7	-83.4	-81.7	0	0	0	113.5	Y88 V91 I95 L239 I246 L247 L650 V676	Y88-F243 HydrophobicContact CE2-CB 4.19Å; V91-F243 HydrophobicContact CG1-CB 3.82Å; V91-F243 HydrophobicContact CG1-CD1 3.8Å; V91-F243 HydrophobicContact CG1-CD2 4.24Å; V91-F243 HydrophobicContact CG1-CE1 4.46Å; V91-F243 HydrophobicContact CG1-CG 3.67Å; I95-F243 HydrophobicContact CD1-CD2 4.17Å; L239-F243 WeakPolarHBondContact O-CD2 3.23Å; L239-F243 PolarHBondContact O-N 3.42Å; F243-I246 HydrophobicContact CD1-CD1 4Å; F243-I246 HydrophobicContact CE1-CD1 4.08Å; F243-I246 HydrophobicContact CG-CD1 4.3Å; F243-I246 HydrophobicContact CZ-CD1 4.43Å; F243-L247 PolarHBondContact O-N 3.24Å; F243-L247 VanDerWaalsContact O-N 3.16Å; F243-L650 HydrophobicContact CD1-CD1 4.24Å; F243-L650 HydrophobicContact CE1-CD1 4.08Å; F243-V676 HydrophobicContact CD2-CB 4.34Å; F243-V676 HydrophobicContact CD2-CG1 4.15Å; F243-V676 HydrophobicContact CD2-CG2 4.1Å; F243-V676 HydrophobicContact CE1-CB 4.48Å; F243-V676 HydrophobicContact CE1-CG1 4.01Å; F243-V676 HydrophobicContact CE2-CB 3.41Å; F243-V676 VanDerWaalsContact CE2-CB 3.41Å; F243-V676 HydrophobicContact CE2-CG1 3.57Å; F243-V676 HydrophobicContact CE2-CG2 3.45Å; F243-V676 VanDerWaalsContact CE2-CG2 3.45Å; F243-V676 HydrophobicContact CZ-CB 3.51Å; F243-V676 HydrophobicContact CZ-CG1 3.49Å; F243-V676 VanDerWaalsContact CZ-CG1 3.49Å; F243-V676 HydrophobicContact CZ-CG2 4.1Å
244	Q	90	Very high	86	Confident	27 Å²	27	59.5 Å²	59.5	13%	0.126	30%	0.296	C	S	.	.	H	α-helix	trans	-63.2	-45	168.5	-174.7	-164.1	-11.7	0	0	110.6	Y88 Y240 E241 M242 G248 I249 H254	Y88-Q244 HydrophobicContact CE2-CB 4.43Å; Y240-Q244 WeakPolarHBondContact O-CB 3.46Å; Y240-Q244 PolarHBondContact O-N 3.29Å; E241-Q244 WeakPolarHBondContact O-CB 3.47Å; E241-Q244 PolarHBondContact O-N 3.01Å; M242-Q244 VanDerWaalsContact C-N 3.3Å; M242-Q244 PolarHBondContact O-N 3.24Å; Q244-G248 PolarHBondContact O-N 3.16Å; Q244-G248 VanDerWaalsContact O-N 3.1Å; Q244-I249 HydrophobicContact CG-CB 4.1Å; Q244-I249 VanDerWaalsContact CG-O 3.3Å; Q244-I249 WeakPolarHBondContact CG-O 3.38Å; Q244-I249 PolarHBondContact NE2-O 2.91Å; Q244-I249 PolarHBondContact O-N 3.34Å; Q244-H254 HydrophobicContact CG-CB 4.15Å
245	Q	88.1	Confident	86.3	Confident	126 Å²	126	63.3 Å²	63.3	59%	0.589	31%	0.312	S	S	*	.	H	α-helix	trans	-68.4	-43.8	177.5	-69.4	175.5	12.5	0	0	112	E241 M242 L247 G248	E241-Q245 WeakPolarHBondContact O-CG 3.48Å; E241-Q245 PolarHBondContact O-N 2.63Å; M242-Q245 PolarHBondContact O-N 3.42Å; M242-Q245 VanDerWaalsContact O-N 3.17Å; Q245-L247 PolarHBondContact O-N 3.17Å; Q245-G248 PolarHBondContact O-N 3.44Å
246	I	88.4	Confident	86.3	Confident	13 Å²	13	62.6 Å²	62.6	7%	0.067	31%	0.305	C	S	.	.	H	α-helix	trans	-56.7	-48.2	179	-70.9	164.8	0	0	0	111.5	M242 F243 G248 Q653 T654 H657	M242-I246 HydrophobicContact CG-CD1 3.81Å; M242-I246 VanDerWaalsContact O-CG1 3.27Å; M242-I246 WeakPolarHBondContact O-CG1 3.35Å; M242-I246 PolarHBondContact O-N 3.06Å; F243-I246 HydrophobicContact CD1-CD1 4Å; F243-I246 HydrophobicContact CE1-CD1 4.08Å; F243-I246 HydrophobicContact CG-CD1 4.3Å; F243-I246 HydrophobicContact CZ-CD1 4.43Å; I246-G248 VanDerWaalsContact C-N 3.34Å; I246-Q653 HydrophobicContact CG2-CB 4Å; I246-T654 HydrophobicContact CD1-CG2 4.23Å; I246-H657 HydrophobicContact CG1-CB 3.74Å
247	L	88.6	Confident	86.3	Confident	1 Å²	1	58 Å²	58	1%	0.005	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-2.6	-178.4	-61.2	-174.2	0	0	0	113.4	R84 L87 Y88 F243 Q245 I249 L650	R84-L247 WeakPolarHBondContact CD-O 3.45Å; L87-L247 HydrophobicContact CB-CD1 4.18Å; Y88-L247 HydrophobicContact CD2-CD1 3.76Å; Y88-L247 HydrophobicContact CG-CD1 4.25Å; F243-L247 PolarHBondContact O-N 3.24Å; F243-L247 VanDerWaalsContact O-N 3.16Å; Q245-L247 PolarHBondContact O-N 3.17Å; L247-I249 HydrophobicContact CB-CD1 4.15Å; L247-I249 HydrophobicContact CB-CG1 3.85Å; L247-I249 PolarHBondContact O-N 3.34Å; L247-L650 HydrophobicContact CD2-CD1 3.82Å; L247-L650 HydrophobicContact CG-CD1 4.49Å
248	G	86.8	Confident	86.1	Confident	53 Å²	53	54.9 Å²	54.9	55%	0.546	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	36.8	-179.2	0	0	0	0	0	114.6	Q244 Q245 I246	Q244-G248 PolarHBondContact O-N 3.16Å; Q244-G248 VanDerWaalsContact O-N 3.1Å; Q245-G248 PolarHBondContact O-N 3.44Å; I246-G248 VanDerWaalsContact C-N 3.34Å
249	I	88.3	Confident	86	Confident	11 Å²	11	55 Å²	55	6%	0.056	27%	0.272	C	S	.	.			trans	-82.8	134.5	-176.4	-55.2	-58.3	0	0	0	111.2	R84 L85 Y88 Q244 L247 E253 H254	R84-I249 HydrophobicContact CB-CD1 4.21Å; L85-I249 HydrophobicContact CD2-CD1 4.09Å; L85-I249 HydrophobicContact CD2-CG2 4.34Å; L85-I249 HydrophobicContact CG-CD1 4.48Å; Y88-I249 HydrophobicContact CD1-CG1 4.13Å; Y88-I249 HydrophobicContact CD1-CG2 4.14Å; Y88-I249 HydrophobicContact CD2-CG1 4.13Å; Y88-I249 HydrophobicContact CE1-CG2 4.32Å; Y88-I249 HydrophobicContact CG-CG1 3.83Å; Q244-I249 HydrophobicContact CG-CB 4.1Å; Q244-I249 VanDerWaalsContact CG-O 3.3Å; Q244-I249 WeakPolarHBondContact CG-O 3.38Å; Q244-I249 PolarHBondContact NE2-O 2.91Å; Q244-I249 PolarHBondContact O-N 3.34Å; L247-I249 HydrophobicContact CB-CD1 4.15Å; L247-I249 HydrophobicContact CB-CG1 3.85Å; L247-I249 PolarHBondContact O-N 3.34Å; I249-E253 HydrophobicContact CG2-CB 3.83Å; I249-H254 HydrophobicContact CG2-CB 4.34Å
250	K	86.4	Confident	85.6	Confident	137 Å²	137	56.8 Å²	56.8	60%	0.596	29%	0.287	S	S	*	.			trans	-67.2	145.5	179.8	-61	-179	-177.9	174.8	0	110.5	L252 E253 H254	K250-L252 VanDerWaalsContact C-N 3.25Å; K250-L252 PolarHBondContact O-N 3.08Å; K250-L252 VanDerWaalsContact O-N 3.16Å; K250-E253 HydrophobicContact CB-CB 4.46Å; K250-E253 HydrophobicContact CB-CG 4.06Å; K250-E253 WeakPolarHBondContact CB-OE2 3.34Å; K250-E253 PolarHBondContact N-OE2 3.26Å; K250-E253 VanDerWaalsContact N-OE2 3.16Å; K250-E253 WeakPolarHBondContact O-CB 3.36Å; K250-E253 PolarHBondContact O-N 3.44Å; K250-H254 PolarHBondContact O-N 2.92Å
251	K	84.1	Confident	85.2	Confident	169 Å²	169	57 Å²	57	74%	0.735	29%	0.289	S	S	*	.	H	α-helix	trans	-52.5	-40.4	179.9	-71.3	-173.9	177.1	-173.5	0	113.4	Q255	K251-Q255 WeakPolarHBondContact O-CB 3.27Å; K251-Q255 PolarHBondContact O-N 3.19Å
252	L	82.9	Confident	84.6	Confident	106 Å²	106	53.9 Å²	53.9	56%	0.555	27%	0.274	S	S	*	.	H	α-helix	trans	-65.4	-42.5	177.9	-174.6	71.3	0	0	0	112.3	K250 Q255 L256	K250-L252 VanDerWaalsContact C-N 3.25Å; K250-L252 PolarHBondContact O-N 3.08Å; K250-L252 VanDerWaalsContact O-N 3.16Å; L252-Q255 PolarHBondContact O-N 2.94Å; L252-L256 WeakPolarHBondContact O-CG 3.48Å; L252-L256 PolarHBondContact O-N 2.8Å; L252-L256 VanDerWaalsContact O-N 3.11Å
253	E	83.8	Confident	84	Confident	17 Å²	17	54.5 Å²	54.5	8%	0.079	28%	0.278	C	S	.	.	H	α-helix	trans	-67.4	-42.8	179.3	-61.2	165.6	171.4	0	0	110.3	R81 L85 I249 K250 Q255 L256 L257 M630	R81-E253 IonicContact CZ-OE1 3.5Å; R81-E253 IonicContact NE-OE1 3.6Å; R81-E253 PolarHBondContact NE-OE1 2.99Å; R81-E253 IonicContact NH2-OE1 3.69Å; R81-E253 PolarHBondContact NH2-OE1 3.04Å; L85-E253 HydrophobicContact CD2-CB 4.11Å; L85-E253 HydrophobicContact CD2-CG 4.46Å; I249-E253 HydrophobicContact CG2-CB 3.83Å; K250-E253 HydrophobicContact CB-CB 4.46Å; K250-E253 HydrophobicContact CB-CG 4.06Å; K250-E253 WeakPolarHBondContact CB-OE2 3.34Å; K250-E253 PolarHBondContact N-OE2 3.26Å; K250-E253 VanDerWaalsContact N-OE2 3.16Å; K250-E253 WeakPolarHBondContact O-CB 3.36Å; K250-E253 PolarHBondContact O-N 3.44Å; E253-Q255 PolarHBondContact O-N 3.08Å; E253-L256 PolarHBondContact O-N 3.28Å; E253-L257 WeakPolarHBondContact O-CG 3.44Å; E253-L257 PolarHBondContact O-N 3.39Å; E253-M630 HydrophobicContact CB-CE 4.23Å; E253-M630 HydrophobicContact CG-CE 3.82Å
254	H	85.2	Confident	82.9	Confident	32 Å²	32	62 Å²	62	15%	0.148	32%	0.318	C	S	.	.	H	α-helix	trans	-55.3	-50.9	171.4	165.3	64.8	0	0	0	111.3	Y88 Q244 I249 K250 L256 L257 Y258	Y88-H254 HydrophobicContact CE1-CB 4.2Å; Y88-H254 AromaticContact CE1-ND1 3.59Å; Y88-H254 AromaticContact CZ-ND1 3.54Å; Y88-H254 PolarHBondContact OH-CE1 3.43Å; Y88-H254 PolarHBondContact OH-ND1 3.3Å; Q244-H254 HydrophobicContact CG-CB 4.15Å; I249-H254 HydrophobicContact CG2-CB 4.34Å; K250-H254 PolarHBondContact O-N 2.92Å; H254-L256 VanDerWaalsContact C-N 3.31Å; H254-L256 PolarHBondContact O-N 2.98Å; H254-L257 PolarHBondContact O-N 2.93Å; H254-Y258 AromaticContact CE1-CD2 3.87Å; H254-Y258 WeakPolarHBondContact O-CB 3.36Å; H254-Y258 PolarHBondContact O-N 3.23Å
255	Q	83.1	Confident	82.2	Confident	117 Å²	117	63.3 Å²	63.3	55%	0.547	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-38.7	-176.9	-167.6	171.8	14.9	0	0	112.5	K251 L252 E253 N259	K251-Q255 WeakPolarHBondContact O-CB 3.27Å; K251-Q255 PolarHBondContact O-N 3.19Å; L252-Q255 PolarHBondContact O-N 2.94Å; E253-Q255 PolarHBondContact O-N 3.08Å; Q255-N259 WeakPolarHBondContact O-CB 3.24Å; Q255-N259 PolarHBondContact O-N 3.06Å; Q255-N259 VanDerWaalsContact O-N 3.12Å; Q255-N259 PolarHBondContact O-ND2 2.92Å
256	L	82.8	Confident	81.3	Confident	32 Å²	32	60.2 Å²	60.2	17%	0.168	32%	0.322	C	S	.	.	H	α-helix	trans	-64.8	-47.2	175.1	-69.7	171.2	0	0	0	111.7	L252 E253 H254 A260 F625	L252-L256 WeakPolarHBondContact O-CG 3.48Å; L252-L256 PolarHBondContact O-N 2.8Å; L252-L256 VanDerWaalsContact O-N 3.11Å; E253-L256 PolarHBondContact O-N 3.28Å; H254-L256 VanDerWaalsContact C-N 3.31Å; H254-L256 PolarHBondContact O-N 2.98Å; L256-A260 WeakPolarHBondContact O-CB 3.48Å; L256-A260 PolarHBondContact O-N 3.39Å; L256-A260 VanDerWaalsContact O-N 3.16Å; L256-F625 HydrophobicContact CB-CE1 4.06Å; L256-F625 HydrophobicContact CD2-CD1 4.21Å; L256-F625 HydrophobicContact CD2-CE1 3.67Å; L256-F625 HydrophobicContact CD2-CZ 3.86Å; L256-F625 HydrophobicContact CG-CE1 4.46Å
257	L	82.9	Confident	80.5	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-71.5	-37.4	-178.8	-66.3	178.5	0	0	0	112.6	L85 Y88 V89 E253 H254 A260 C261 M630 I634	L85-L257 HydrophobicContact CD2-CD1 4.22Å; Y88-L257 HydrophobicContact CD1-CD1 3.85Å; V89-L257 HydrophobicContact CG2-CD1 3.96Å; V89-L257 HydrophobicContact CG2-CD2 3.73Å; V89-L257 HydrophobicContact CG2-CG 4.37Å; E253-L257 WeakPolarHBondContact O-CG 3.44Å; E253-L257 PolarHBondContact O-N 3.39Å; H254-L257 PolarHBondContact O-N 2.93Å; L257-A260 PolarHBondContact O-N 3.31Å; L257-C261 WeakPolarHBondContact O-CB 3.43Å; L257-C261 PolarHBondContact O-N 2.89Å; L257-C261 PolarHBondContact O-SG 3.06Å; L257-M630 HydrophobicContact CD2-SD 4.43Å; L257-I634 HydrophobicContact CD2-CD1 4Å; L257-I634 HydrophobicContact CD2-CG1 3.8Å
258	Y	82.4	Confident	79.9	Confident	68 Å²	68	63.2 Å²	63.2	27%	0.267	34%	0.336	S	S	.	.	H	α-helix	trans	-59.3	-52.9	174.9	176.5	-92.3	0	0	0	110.5	Y240 H254 A260 C261 Q262	Y240-Y258 HydrophobicContact CD1-CD2 4.39Å; Y240-Y258 HydrophobicContact CD2-CD2 4Å; Y240-Y258 AromaticContact CD2-CE2 3.58Å; Y240-Y258 HydrophobicContact CD2-CE2 3.58Å; Y240-Y258 HydrophobicContact CE1-CD2 4.32Å; Y240-Y258 AromaticContact CE2-CD2 3.94Å; Y240-Y258 HydrophobicContact CE2-CD2 3.94Å; Y240-Y258 AromaticContact CE2-CE2 3.4Å; Y240-Y258 HydrophobicContact CE2-CE2 3.4Å; Y240-Y258 VanDerWaalsContact CE2-CE2 3.4Å; Y240-Y258 HydrophobicContact CG-CD2 4.22Å; Y240-Y258 HydrophobicContact CG-CE2 4.25Å; Y240-Y258 AromaticContact CZ-CE2 3.92Å; H254-Y258 AromaticContact CE1-CD2 3.87Å; H254-Y258 WeakPolarHBondContact O-CB 3.36Å; H254-Y258 PolarHBondContact O-N 3.23Å; Y258-A260 VanDerWaalsContact C-N 3.26Å; Y258-A260 PolarHBondContact O-N 3.48Å; Y258-C261 PolarHBondContact O-N 3.5Å; Y258-Q262 HydrophobicContact CD1-CG 4.23Å; Y258-Q262 HydrophobicContact CD2-CG 4.31Å; Y258-Q262 HydrophobicContact CE1-CG 4.01Å; Y258-Q262 HydrophobicContact CE2-CG 4.12Å; Y258-Q262 HydrophobicContact CG-CG 4.36Å; Y258-Q262 VanDerWaalsContact CZ-NE2 3.25Å; Y258-Q262 WeakPolarHBondContact O-CB 3.11Å; Y258-Q262 WeakPolarHBondContact O-CG 3.41Å; Y258-Q262 PolarHBondContact O-N 3.31Å; Y258-Q262 VanDerWaalsContact O-N 3.11Å; Y258-Q262 PolarHBondContact OH-NE2 2.85Å
259	N	82.3	Confident	79.6	Confident	96 Å²	96	62.9 Å²	62.9	51%	0.513	32%	0.32	S	S	.	.	H	α-helix	trans	-62.5	-33.7	178.8	-71.3	-16.6	0	0	0	112.4	Q255	Q255-N259 WeakPolarHBondContact O-CB 3.24Å; Q255-N259 PolarHBondContact O-N 3.06Å; Q255-N259 VanDerWaalsContact O-N 3.12Å; Q255-N259 PolarHBondContact O-ND2 2.92Å
260	A	77.9	Confident	79.2	Confident	40 Å²	40	62.6 Å²	62.6	33%	0.331	32%	0.32	S	S	.	.	H	α-helix	trans	-77	-29	-179.8	0	0	0	0	0	114.1	L256 L257 Y258 I634	L256-A260 WeakPolarHBondContact O-CB 3.48Å; L256-A260 PolarHBondContact O-N 3.39Å; L256-A260 VanDerWaalsContact O-N 3.16Å; L257-A260 PolarHBondContact O-N 3.31Å; Y258-A260 VanDerWaalsContact C-N 3.26Å; Y258-A260 PolarHBondContact O-N 3.48Å; A260-I634 HydrophobicContact CB-CD1 3.46Å; A260-I634 VanDerWaalsContact CB-CD1 3.46Å; A260-I634 HydrophobicContact CB-CG1 4.16Å; A260-I634 HydrophobicContact CB-CG2 4.42Å
261	C	79.7	Confident	78.9	Confident	8 Å²	8	56.2 Å²	56.2	5%	0.054	29%	0.293	C	S	.	.	H	α-helix	trans	-97.1	-12	-176.3	-64.4	0	0	0	0	113.9	V92 L257 Y258 L263	V92-C261 HydrophobicContact CG1-CB 3.54Å; L257-C261 WeakPolarHBondContact O-CB 3.43Å; L257-C261 PolarHBondContact O-N 2.89Å; L257-C261 PolarHBondContact O-SG 3.06Å; Y258-C261 PolarHBondContact O-N 3.5Å; C261-L263 PolarHBondContact O-N 3.06Å
262	Q	75.8	Confident	78.8	Confident	49 Å²	49	49.9 Å²	49.9	23%	0.229	27%	0.266	C	S	.	.			trans	-76.4	110.2	175	-73.8	-81.7	1.6	0	0	109.7	Y240 Y258	Y240-Q262 PolarHBondContact OH-NE2 3.36Å; Y240-Q262 VanDerWaalsContact OH-NE2 3.08Å; Y258-Q262 HydrophobicContact CD1-CG 4.23Å; Y258-Q262 HydrophobicContact CD2-CG 4.31Å; Y258-Q262 HydrophobicContact CE1-CG 4.01Å; Y258-Q262 HydrophobicContact CE2-CG 4.12Å; Y258-Q262 HydrophobicContact CG-CG 4.36Å; Y258-Q262 VanDerWaalsContact CZ-NE2 3.25Å; Y258-Q262 WeakPolarHBondContact O-CB 3.11Å; Y258-Q262 WeakPolarHBondContact O-CG 3.41Å; Y258-Q262 PolarHBondContact O-N 3.31Å; Y258-Q262 VanDerWaalsContact O-N 3.11Å; Y258-Q262 PolarHBondContact OH-NE2 2.85Å
263	L	75.6	Confident	78.8	Confident	42 Å²	42	45 Å²	45	22%	0.22	24%	0.241	C	C	.	.			trans	-100.7	114.2	171.9	-64.1	173.1	0	0	0	107.6	Y97 C261 N265 E268 Q269 Q272	Y97-L263 HydrophobicContact CE1-CD1 4.37Å; C261-L263 PolarHBondContact O-N 3.06Å; L263-N265 VanDerWaalsContact C-N 3.27Å; L263-N265 PolarHBondContact O-N 2.9Å; L263-E268 HydrophobicContact CB-CB 4.31Å; L263-E268 HydrophobicContact CD1-CB 4.22Å; L263-E268 HydrophobicContact CD2-CB 4.42Å; L263-Q269 HydrophobicContact CB-CG 3.75Å; L263-Q269 HydrophobicContact CD1-CG 4.44Å; L263-Q269 PolarHBondContact O-NE2 3.15Å; L263-Q272 HydrophobicContact CD1-CB 4.07Å
264	D	65.3	Low	78.8	Confident	158 Å²	158	45 Å²	45	85%	0.845	24%	0.24	S	C	*	.	S	Bend	trans	-72	-23.7	-176.4	-65	-37.9	0	0	0	112.7
265	N	75.1	Confident	78.7	Confident	54 Å²	54	46.5 Å²	46.5	29%	0.289	24%	0.244	S	C	.	.	S	Bend	trans	-96	124	-178.4	-172.6	10.2	0	0	0	111.8	L263 D267 E268 Q269	L263-N265 VanDerWaalsContact C-N 3.27Å; L263-N265 PolarHBondContact O-N 2.9Å; N265-D267 PolarHBondContact O-N 3.2Å; N265-D267 PolarHBondContact OD1-N 3.43Å; N265-E268 HydrophobicContact CB-CB 4.26Å; N265-E268 HydrophobicContact CB-CG 3.97Å; N265-E268 WeakPolarHBondContact O-CB 3.21Å; N265-E268 PolarHBondContact O-N 2.85Å; N265-Q269 PolarHBondContact O-N 2.89Å; N265-Q269 VanDerWaalsContact O-N 3.12Å
266	A	71.1	Confident	78.8	Confident	62 Å²	62	41.5 Å²	41.5	51%	0.512	22%	0.221	S	C	.	.	H	α-helix	trans	-56.7	-32.7	177.5	0	0	0	0	0	112.8	E268 Q269 A270	A266-E268 VanDerWaalsContact C-N 3.33Å; A266-E268 PolarHBondContact O-N 3.31Å; A266-Q269 PolarHBondContact O-N 3.32Å; A266-A270 WeakPolarHBondContact O-CB 3.36Å; A266-A270 PolarHBondContact O-N 3.36Å
267	D	71.4	Confident	78.9	Confident	24 Å²	24	40.1 Å²	40.1	13%	0.128	21%	0.213	C	C	.	.	H	α-helix	trans	-68.2	-34.4	177.1	-60.6	-29.3	0	0	0	112.4	N265 A271 K489 Q514	N265-D267 PolarHBondContact O-N 3.2Å; N265-D267 PolarHBondContact OD1-N 3.43Å; D267-A271 VanDerWaalsContact O-CB 3.27Å; D267-A271 WeakPolarHBondContact O-CB 3.24Å; D267-A271 PolarHBondContact O-N 2.87Å; D267-K489 WeakPolarHBondContact OD1-CE 3.28Å; D267-K489 IonicContact OD1-NZ 3.75Å; D267-K489 PolarHBondContact OD1-NZ 3.1Å; D267-K489 WeakPolarHBondContact OD2-CD 3.49Å; D267-K489 WeakPolarHBondContact OD2-CE 3.4Å; D267-K489 IonicContact OD2-NZ 2.72Å; D267-K489 PolarHBondContact OD2-NZ 3.03Å; D267-Q514 PolarHBondContact OD1-OE1 3.49Å
268	E	76.1	Confident	79	Confident	53 Å²	53	43.5 Å²	43.5	25%	0.248	23%	0.232	C	C	.	.	H	α-helix	trans	-73.1	-38.7	177.3	-68.3	-174.2	150.1	0	0	111	L263 N265 A266 A271 Q272 R587	L263-E268 HydrophobicContact CB-CB 4.31Å; L263-E268 HydrophobicContact CD1-CB 4.22Å; L263-E268 HydrophobicContact CD2-CB 4.42Å; N265-E268 HydrophobicContact CB-CB 4.26Å; N265-E268 HydrophobicContact CB-CG 3.97Å; N265-E268 WeakPolarHBondContact O-CB 3.21Å; N265-E268 PolarHBondContact O-N 2.85Å; A266-E268 VanDerWaalsContact C-N 3.33Å; A266-E268 PolarHBondContact O-N 3.31Å; E268-A271 PolarHBondContact O-N 2.96Å; E268-Q272 WeakPolarHBondContact O-CB 3.34Å; E268-Q272 PolarHBondContact O-N 2.81Å; E268-R587 HydrophobicContact CG-CG 4.46Å; E268-R587 IonicContact OE1-CZ 3.15Å; E268-R587 IonicContact OE1-NE 3.96Å; E268-R587 PolarHBondContact OE1-NE 2.97Å; E268-R587 IonicContact OE1-NH2 2.64Å; E268-R587 PolarHBondContact OE1-NH2 3.42Å
269	Q	80.3	Confident	79	Confident	45 Å²	45	41 Å²	41	21%	0.21	23%	0.227	C	C	.	.	H	α-helix	trans	-58.3	-50.7	171.7	-64.4	174.8	6.8	0	0	110.7	Y97 L263 N265 A266 A271 Q272 I273	Y97-Q269 HydrophobicContact CD1-CB 4.37Å; Y97-Q269 HydrophobicContact CD1-CG 3.97Å; Y97-Q269 HydrophobicContact CD2-CB 4.22Å; Y97-Q269 HydrophobicContact CG-CB 3.89Å; Y97-Q269 HydrophobicContact CG-CG 3.9Å; L263-Q269 HydrophobicContact CB-CG 3.75Å; L263-Q269 HydrophobicContact CD1-CG 4.44Å; L263-Q269 PolarHBondContact O-NE2 3.15Å; N265-Q269 PolarHBondContact O-N 2.89Å; N265-Q269 VanDerWaalsContact O-N 3.12Å; A266-Q269 PolarHBondContact O-N 3.32Å; Q269-A271 PolarHBondContact O-N 3.22Å; Q269-Q272 PolarHBondContact O-N 2.89Å; Q269-I273 WeakPolarHBondContact O-CG1 3.5Å; Q269-I273 PolarHBondContact O-N 3.41Å
270	A	79.9	Confident	79.2	Confident	5 Å²	5	37.9 Å²	37.9	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-60.8	-44.6	177.2	0	0	0	0	0	111.6	A266 Q272 I273 R274 L320	A266-A270 WeakPolarHBondContact O-CB 3.36Å; A266-A270 PolarHBondContact O-N 3.36Å; A270-Q272 VanDerWaalsContact C-N 3.3Å; A270-Q272 PolarHBondContact O-N 2.83Å; A270-I273 PolarHBondContact O-N 2.71Å; A270-R274 WeakPolarHBondContact O-CG 3.18Å; A270-R274 PolarHBondContact O-N 2.95Å; A270-L320 HydrophobicContact CB-CD1 4.43Å
271	A	78.5	Confident	79.5	Confident	4 Å²	4	37.5 Å²	37.5	3%	0.033	20%	0.2	C	C	.	.	H	α-helix	trans	-63.7	-32.6	177.3	0	0	0	0	0	113.3	D267 E268 Q269 R275	D267-A271 VanDerWaalsContact O-CB 3.27Å; D267-A271 WeakPolarHBondContact O-CB 3.24Å; D267-A271 PolarHBondContact O-N 2.87Å; E268-A271 PolarHBondContact O-N 2.96Å; Q269-A271 PolarHBondContact O-N 3.22Å; A271-R275 WeakPolarHBondContact O-CG 3.33Å; A271-R275 PolarHBondContact O-N 2.93Å; A271-R275 PolarHBondContact O-NE 2.8Å
272	Q	81.9	Confident	79.8	Confident	35 Å²	35	42.4 Å²	42.4	16%	0.164	22%	0.222	C	C	.	.	H	α-helix	trans	-68.5	-44.6	172.8	-178.5	63.7	32.6	0	0	111.3	Y97 L263 E268 Q269 A270 R275 E276	Y97-Q272 HydrophobicContact CE2-CG 4.3Å; Y97-Q272 VanDerWaalsContact OH-CG 3.31Å; Y97-Q272 WeakPolarHBondContact OH-CG 3.31Å; L263-Q272 HydrophobicContact CD1-CB 4.07Å; E268-Q272 WeakPolarHBondContact O-CB 3.34Å; E268-Q272 PolarHBondContact O-N 2.81Å; Q269-Q272 PolarHBondContact O-N 2.89Å; A270-Q272 VanDerWaalsContact C-N 3.3Å; A270-Q272 PolarHBondContact O-N 2.83Å; Q272-R275 PolarHBondContact O-N 2.99Å; Q272-R275 VanDerWaalsContact OE1-CZ 3.23Å; Q272-E276 PolarHBondContact NE2-OE1 2.83Å; Q272-E276 WeakPolarHBondContact O-CG 3.32Å; Q272-E276 PolarHBondContact O-N 3.47Å
273	I	84.2	Confident	80.1	Confident	5 Å²	5	43.1 Å²	43.1	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-61.7	-45.9	175.9	-62.3	161.5	0	0	0	110.7	Y97 F99 Q269 A270 R275 E276 L277 L320	Y97-I273 HydrophobicContact CD2-CD1 3.8Å; Y97-I273 HydrophobicContact CD2-CG1 3.74Å; Y97-I273 HydrophobicContact CE2-CD1 4.35Å; Y97-I273 HydrophobicContact CE2-CG1 3.77Å; F99-I273 HydrophobicContact CB-CD1 4.17Å; F99-I273 HydrophobicContact CD1-CD1 3.49Å; F99-I273 VanDerWaalsContact CD1-CD1 3.49Å; F99-I273 HydrophobicContact CD1-CG1 4.05Å; F99-I273 HydrophobicContact CD1-CG2 4.09Å; F99-I273 HydrophobicContact CE1-CD1 4.06Å; F99-I273 HydrophobicContact CE1-CG1 4.12Å; F99-I273 HydrophobicContact CE1-CG2 3.62Å; F99-I273 HydrophobicContact CE2-CG2 4.09Å; F99-I273 HydrophobicContact CG-CD1 3.92Å; F99-I273 HydrophobicContact CZ-CG2 3.62Å; Q269-I273 WeakPolarHBondContact O-CG1 3.5Å; Q269-I273 PolarHBondContact O-N 3.41Å; A270-I273 PolarHBondContact O-N 2.71Å; I273-R275 VanDerWaalsContact C-N 3.29Å; I273-R275 PolarHBondContact O-N 3.46Å; I273-E276 PolarHBondContact O-N 3.34Å; I273-E276 VanDerWaalsContact O-N 3.09Å; I273-L277 HydrophobicContact CG2-CD1 3.76Å; I273-L277 HydrophobicContact CG2-CG 4.09Å; I273-L277 WeakPolarHBondContact O-CG 3.42Å; I273-L277 PolarHBondContact O-N 3.31Å; I273-L320 HydrophobicContact CB-CD2 4.09Å; I273-L320 HydrophobicContact CD1-CD1 4.15Å; I273-L320 HydrophobicContact CG2-CD2 3.85Å
274	R	83.7	Confident	80.6	Confident	16 Å²	16	41.2 Å²	41.2	6%	0.06	22%	0.218	C	C	.	.	H	α-helix	trans	-54.2	-44.7	177.8	-71	-161.6	-64.9	-87.1	-0	112	A270 E276 L277 D278 L320 Q517 Y518 R587	A270-R274 WeakPolarHBondContact O-CG 3.18Å; A270-R274 PolarHBondContact O-N 2.95Å; R274-E276 VanDerWaalsContact C-N 3.35Å; R274-E276 PolarHBondContact O-N 3.3Å; R274-L277 PolarHBondContact O-N 3.27Å; R274-D278 WeakPolarHBondContact O-CB 3.22Å; R274-D278 PolarHBondContact O-N 3.06Å; R274-L320 HydrophobicContact CG-CD2 4Å; R274-Q517 WeakPolarHBondContact CD-O 3.41Å; R274-Q517 PolarHBondContact NH1-O 2.95Å; R274-Y518 HydrophobicContact CB-CE1 4.21Å; R274-Y518 VanDerWaalsContact CD-CD1 3.47Å; R274-Y518 HydrophobicContact CG-CD1 3.96Å; R274-Y518 HydrophobicContact CG-CE1 3.49Å; R274-Y518 VanDerWaalsContact CG-CE1 3.49Å; R274-Y518 HydrophobicContact CG-CE2 4.39Å; R274-R587 PolarHBondContact NH2-O 3.48Å
275	R	82.4	Confident	81.5	Confident	64 Å²	64	36.4 Å²	36.4	24%	0.242	19%	0.192	C	C	.	.	H	α-helix	trans	-62.5	-39.4	177.6	-79.1	-178.2	-70.5	157.3	-3.5	113.2	A271 Q272 I273 G279 Y586 G590 Q591	A271-R275 WeakPolarHBondContact O-CG 3.33Å; A271-R275 PolarHBondContact O-N 2.93Å; A271-R275 PolarHBondContact O-NE 2.8Å; Q272-R275 PolarHBondContact O-N 2.99Å; Q272-R275 VanDerWaalsContact OE1-CZ 3.23Å; I273-R275 VanDerWaalsContact C-N 3.29Å; I273-R275 PolarHBondContact O-N 3.46Å; R275-G279 PolarHBondContact O-N 3.34Å; R275-Y586 PolarHBondContact NH1-OH 2.69Å; R275-G590 WeakPolarHBondContact CG-O 3.45Å; R275-Q591 VanDerWaalsContact CD-O 3.24Å; R275-Q591 WeakPolarHBondContact CD-O 3.47Å
276	E	85.4	Confident	82	Confident	12 Å²	12	39.3 Å²	39.3	6%	0.056	20%	0.202	C	C	.	.	H	α-helix	trans	-70.9	-39.2	178.9	-68.3	177.1	-171.8	0	0	111.7	R93 Q272 I273 R274 R280 P638 R683	R93-E276 IonicContact NH1-OE1 2.93Å; R93-E276 PolarHBondContact NH1-OE1 3.4Å; Q272-E276 PolarHBondContact NE2-OE1 2.83Å; Q272-E276 WeakPolarHBondContact O-CG 3.32Å; Q272-E276 PolarHBondContact O-N 3.47Å; I273-E276 PolarHBondContact O-N 3.34Å; I273-E276 VanDerWaalsContact O-N 3.09Å; R274-E276 VanDerWaalsContact C-N 3.35Å; R274-E276 PolarHBondContact O-N 3.3Å; E276-R280 WeakPolarHBondContact O-CG 3.27Å; E276-R280 PolarHBondContact O-N 3.43Å; E276-P638 HydrophobicContact CG-CG 4.22Å; E276-R683 IonicContact OE1-NH2 3.08Å; E276-R683 PolarHBondContact OE1-NH2 3.13Å; E276-R683 VanDerWaalsContact OE1-NH2 3.1Å; E276-R683 IonicContact OE2-CZ 2.72Å; E276-R683 IonicContact OE2-NE 3.44Å; E276-R683 PolarHBondContact OE2-NE 3.33Å; E276-R683 IonicContact OE2-NH2 2.87Å; E276-R683 PolarHBondContact OE2-NH2 3.27Å
277	L	85.9	Confident	82.6	Confident	3 Å²	3	39 Å²	39	2%	0.016	19%	0.19	C	C	.	.	H	α-helix	trans	-69.1	-42.5	176	-64.8	178.1	0	0	0	112.1	I273 R274 G279 R280 L281 V313 L316 M317 Y518	I273-L277 HydrophobicContact CG2-CD1 3.76Å; I273-L277 HydrophobicContact CG2-CG 4.09Å; I273-L277 WeakPolarHBondContact O-CG 3.42Å; I273-L277 PolarHBondContact O-N 3.31Å; R274-L277 PolarHBondContact O-N 3.27Å; L277-G279 PolarHBondContact O-N 3.14Å; L277-R280 WeakPolarHBondContact O-CB 3.37Å; L277-R280 PolarHBondContact O-N 2.89Å; L277-R280 VanDerWaalsContact O-N 3.13Å; L277-L281 PolarHBondContact O-N 2.83Å; L277-V313 HydrophobicContact CB-CG1 3.99Å; L277-V313 HydrophobicContact CD2-CG1 4.22Å; L277-L316 HydrophobicContact CD1-CB 4.07Å; L277-L316 HydrophobicContact CD2-CB 3.9Å; L277-L316 HydrophobicContact CD2-CD1 3.81Å; L277-M317 HydrophobicContact CD1-CG 4.13Å; L277-Y518 VanDerWaalsContact CD1-OH 3.24Å; L277-Y518 WeakPolarHBondContact CD1-OH 3.31Å
278	D	83.2	Confident	83.2	Confident	71 Å²	71	39.6 Å²	39.6	38%	0.38	20%	0.199	S	C	.	.	H	α-helix	trans	-62.2	-42.3	174.4	-174.8	57	0	0	0	111.5	R274 R280 L281 Q282	R274-D278 WeakPolarHBondContact O-CB 3.22Å; R274-D278 PolarHBondContact O-N 3.06Å; D278-R280 PolarHBondContact O-N 2.6Å; D278-L281 PolarHBondContact O-N 3.02Å; D278-L281 VanDerWaalsContact O-N 3.12Å; D278-Q282 WeakPolarHBondContact O-CG 3.43Å; D278-Q282 PolarHBondContact O-N 3.04Å; D278-Q282 PolarHBondContact OD2-NE2 3.06Å
279	G	83.8	Confident	83.5	Confident	16 Å²	16	45.5 Å²	45.5	17%	0.165	22%	0.223	C	C	.	.	H	α-helix	trans	-57.4	-35.7	173.2	0	0	0	0	0	113.3	R275 L277 L283	R275-G279 PolarHBondContact O-N 3.34Å; L277-G279 PolarHBondContact O-N 3.14Å; G279-L283 PolarHBondContact O-N 3.25Å; G279-L283 VanDerWaalsContact O-N 3.08Å
280	R	85.6	Confident	83.8	Confident	30 Å²	30	47.5 Å²	47.5	11%	0.113	23%	0.233	C	C	.	.	H	α-helix	trans	-72	-39.5	174.9	-73.7	-176.5	61.9	-165.7	-8.7	112.7	E276 L277 D278 L283 A284 V313 A682 R683 G685	E276-R280 WeakPolarHBondContact O-CG 3.27Å; E276-R280 PolarHBondContact O-N 3.43Å; L277-R280 WeakPolarHBondContact O-CB 3.37Å; L277-R280 PolarHBondContact O-N 2.89Å; L277-R280 VanDerWaalsContact O-N 3.13Å; D278-R280 PolarHBondContact O-N 2.6Å; R280-L283 PolarHBondContact O-N 3.46Å; R280-A284 PolarHBondContact O-N 2.81Å; R280-V313 HydrophobicContact CB-CG2 4.02Å; R280-A682 PolarHBondContact NH1-O 2.73Å; R280-R683 WeakPolarHBondContact CD-O 3.38Å; R280-R683 PolarHBondContact NH1-O 2.8Å; R280-G685 VanDerWaalsContact CZ-CA 3.43Å
281	L	85.4	Confident	83.7	Confident	32 Å²	32	57.1 Å²	57.1	17%	0.168	27%	0.268	C	S	.	.	H	α-helix	trans	-61.7	-45.3	173.5	-75.1	170.1	0	0	0	111	L277 D278 L283 A284 D285 R310 V313 M317	L277-L281 PolarHBondContact O-N 2.83Å; D278-L281 PolarHBondContact O-N 3.02Å; D278-L281 VanDerWaalsContact O-N 3.12Å; L281-L283 VanDerWaalsContact C-N 3.28Å; L281-L283 PolarHBondContact O-N 3.2Å; L281-A284 WeakPolarHBondContact O-CB 3.43Å; L281-A284 PolarHBondContact O-N 3.49Å; L281-A284 VanDerWaalsContact O-N 3.13Å; L281-D285 PolarHBondContact O-N 3.44Å; L281-R310 HydrophobicContact CD2-CG 4.33Å; L281-V313 HydrophobicContact CD1-CG1 4.03Å; L281-V313 HydrophobicContact CD2-CB 4.02Å; L281-V313 HydrophobicContact CD2-CG1 3.99Å; L281-V313 HydrophobicContact CG-CB 4.24Å; L281-V313 HydrophobicContact CG-CG1 3.69Å; L281-M317 HydrophobicContact CD1-SD 3.96Å
282	Q	84.4	Confident	83.5	Confident	110 Å²	110	63.6 Å²	63.6	51%	0.514	30%	0.296	S	S	.	.	H	α-helix	trans	-59.8	-38.2	175.6	-68.9	178.5	17.8	0	0	112.3	D278 D285 K286	D278-Q282 WeakPolarHBondContact O-CG 3.43Å; D278-Q282 PolarHBondContact O-N 3.04Å; D278-Q282 PolarHBondContact OD2-NE2 3.06Å; Q282-D285 PolarHBondContact O-N 3.38Å; Q282-K286 VanDerWaalsContact O-CB 3.3Å; Q282-K286 WeakPolarHBondContact O-CB 2.87Å; Q282-K286 PolarHBondContact O-N 3.22Å
283	L	83.3	Confident	83.2	Confident	64 Å²	64	64 Å²	64	34%	0.335	30%	0.297	S	S	.	.	H	α-helix	trans	-65.9	-43.5	175	-177.1	62.9	0	0	0	111.6	G279 R280 L281 D285 K286 M287	G279-L283 PolarHBondContact O-N 3.25Å; G279-L283 VanDerWaalsContact O-N 3.08Å; R280-L283 PolarHBondContact O-N 3.46Å; L281-L283 VanDerWaalsContact C-N 3.28Å; L281-L283 PolarHBondContact O-N 3.2Å; L283-D285 VanDerWaalsContact C-N 3.34Å; L283-D285 PolarHBondContact O-N 3Å; L283-K286 PolarHBondContact O-N 2.96Å; L283-M287 HydrophobicContact CD1-CE 4.42Å; L283-M287 HydrophobicContact CG-CE 4.33Å; L283-M287 WeakPolarHBondContact O-CG 3.41Å; L283-M287 PolarHBondContact O-N 3.4Å
284	A	85.1	Confident	83	Confident	3 Å²	3	66.4 Å²	66.4	3%	0.025	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-42.1	175.8	0	0	0	0	0	111.5	R280 L281 M287 A288 L309	R280-A284 PolarHBondContact O-N 2.81Å; L281-A284 WeakPolarHBondContact O-CB 3.43Å; L281-A284 PolarHBondContact O-N 3.49Å; L281-A284 VanDerWaalsContact O-N 3.13Å; A284-M287 PolarHBondContact O-N 3.01Å; A284-A288 WeakPolarHBondContact O-CB 3.49Å; A284-A288 PolarHBondContact O-N 3.48Å; A284-L309 HydrophobicContact CB-CB 4.32Å; A284-L309 HydrophobicContact CB-CD1 4.38Å
285	D	85.4	Confident	82.9	Confident	56 Å²	56	74 Å²	74	30%	0.299	35%	0.346	S	S	.	.	H	α-helix	trans	-67.6	-37.5	176.3	-72.5	-19.9	0	0	0	112.6	L281 Q282 L283 A288 K289 R310	L281-D285 PolarHBondContact O-N 3.44Å; Q282-D285 PolarHBondContact O-N 3.38Å; L283-D285 VanDerWaalsContact C-N 3.34Å; L283-D285 PolarHBondContact O-N 3Å; D285-A288 PolarHBondContact O-N 3.26Å; D285-K289 WeakPolarHBondContact O-CB 3.4Å; D285-K289 VanDerWaalsContact O-CG 3.28Å; D285-K289 WeakPolarHBondContact O-CG 3.36Å; D285-K289 PolarHBondContact O-N 3.3Å; D285-R310 IonicContact OD1-CZ 2.8Å; D285-R310 IonicContact OD1-NE 3.86Å; D285-R310 PolarHBondContact OD1-NE 3.26Å; D285-R310 IonicContact OD1-NH2 3.81Å; D285-R310 PolarHBondContact OD1-NH2 3.41Å
286	K	84.6	Confident	83.1	Confident	115 Å²	115	71.9 Å²	71.9	50%	0.5	34%	0.339	S	S	.	.	H	α-helix	trans	-64.1	-43.2	173.4	-174.7	179.7	178.2	-178.1	0	111.1	Q282 L283 A288 K289 E290	Q282-K286 VanDerWaalsContact O-CB 3.3Å; Q282-K286 WeakPolarHBondContact O-CB 2.87Å; Q282-K286 PolarHBondContact O-N 3.22Å; L283-K286 PolarHBondContact O-N 2.96Å; K286-A288 VanDerWaalsContact C-N 3.35Å; K286-K289 PolarHBondContact O-N 3.13Å; K286-E290 WeakPolarHBondContact CE-OE1 3.4Å; K286-E290 HydrophobicContact CG-CG 4.3Å; K286-E290 IonicContact NZ-OE1 3.3Å; K286-E290 WeakPolarHBondContact O-CB 3.41Å; K286-E290 WeakPolarHBondContact O-CG 3.44Å; K286-E290 PolarHBondContact O-N 3.49Å
287	M	83.3	Confident	82.9	Confident	55 Å²	55	75 Å²	75	27%	0.271	36%	0.355	S	S	.	.	H	α-helix	trans	-61	-43.6	174.8	-75.7	179.2	166.8	0	0	111.5	L283 A284 K289 R291 F293 I306	L283-M287 HydrophobicContact CD1-CE 4.42Å; L283-M287 HydrophobicContact CG-CE 4.33Å; L283-M287 WeakPolarHBondContact O-CG 3.41Å; L283-M287 PolarHBondContact O-N 3.4Å; A284-M287 PolarHBondContact O-N 3.01Å; M287-K289 VanDerWaalsContact C-N 3.35Å; M287-K289 PolarHBondContact O-N 2.99Å; M287-R291 WeakPolarHBondContact O-CA 3.43Å; M287-R291 PolarHBondContact O-N 2.92Å; M287-F293 WeakPolarHBondContact O-CE1 3.29Å; M287-I306 HydrophobicContact CB-CD1 4.01Å
288	A	84.1	Confident	82.7	Confident	37 Å²	37	76.6 Å²	76.6	31%	0.306	37%	0.368	S	S	.	.	H	α-helix	trans	-61.2	-40.5	175.4	0	0	0	0	0	112.6	A284 D285 K286 I306	A284-A288 WeakPolarHBondContact O-CB 3.49Å; A284-A288 PolarHBondContact O-N 3.48Å; D285-A288 PolarHBondContact O-N 3.26Å; K286-A288 VanDerWaalsContact C-N 3.35Å; A288-I306 HydrophobicContact CB-CG1 4.3Å; A288-I306 HydrophobicContact CB-CG2 4.16Å
289	K	83.9	Confident	82.4	Confident	177 Å²	177	81.6 Å²	81.6	77%	0.77	39%	0.387	S	S	*	.	H	α-helix	trans	-72.3	-43.6	178.3	-73	171.7	-176.8	174.7	0	113.1	D285 K286 M287 R291	D285-K289 WeakPolarHBondContact O-CB 3.4Å; D285-K289 VanDerWaalsContact O-CG 3.28Å; D285-K289 WeakPolarHBondContact O-CG 3.36Å; D285-K289 PolarHBondContact O-N 3.3Å; K286-K289 PolarHBondContact O-N 3.13Å; M287-K289 VanDerWaalsContact C-N 3.35Å; M287-K289 PolarHBondContact O-N 2.99Å; K289-R291 VanDerWaalsContact C-N 3.33Å
290	E	85.2	Confident	82.2	Confident	87 Å²	87	85.6 Å²	85.6	41%	0.407	41%	0.405	S	S	.	.	H	α-helix	trans	-81.7	-10.2	-177.7	-68.3	-172.2	-169.5	0	0	113.6	K286 K292	K286-E290 WeakPolarHBondContact CE-OE1 3.4Å; K286-E290 HydrophobicContact CG-CG 4.3Å; K286-E290 IonicContact NZ-OE1 3.3Å; K286-E290 WeakPolarHBondContact O-CB 3.41Å; K286-E290 WeakPolarHBondContact O-CG 3.44Å; K286-E290 PolarHBondContact O-N 3.49Å; E290-K292 HydrophobicContact CB-CD 4.36Å; E290-K292 HydrophobicContact CB-CG 4.23Å; E290-K292 PolarHBondContact O-N 3.45Å; E290-K292 WeakPolarHBondContact OE2-CD 3.45Å; E290-K292 WeakPolarHBondContact OE2-CE 3.5Å; E290-K292 IonicContact OE2-NZ 2.8Å; E290-K292 PolarHBondContact OE2-NZ 2.96Å
291	R	77.9	Confident	82	Confident	207 Å²	207	85.9 Å²	85.9	78%	0.781	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	34.8	-173.6	-62.2	-172.9	176.5	-171.4	-1.5	113.7	M287 K289 F293	M287-R291 WeakPolarHBondContact O-CA 3.43Å; M287-R291 PolarHBondContact O-N 2.92Å; K289-R291 VanDerWaalsContact C-N 3.33Å; R291-F293 VanDerWaalsContact CA-CE2 3.5Å; R291-F293 HydrophobicContact CB-CE2 3.89Å; R291-F293 HydrophobicContact CB-CZ 4.37Å; R291-F293 HydrophobicContact CG-CE2 4.25Å; R291-F293 HydrophobicContact CG-CZ 4.48Å
292	K	74.4	Confident	81.9	Confident	141 Å²	141	87.7 Å²	87.7	61%	0.613	42%	0.415	S	S	*	.			trans	-98.5	96.5	175	-72.5	-179.7	-171.6	154.9	0	108.7	E290	E290-K292 HydrophobicContact CB-CD 4.36Å; E290-K292 HydrophobicContact CB-CG 4.23Å; E290-K292 PolarHBondContact O-N 3.45Å; E290-K292 WeakPolarHBondContact OE2-CD 3.45Å; E290-K292 WeakPolarHBondContact OE2-CE 3.5Å; E290-K292 IonicContact OE2-NZ 2.8Å; E290-K292 PolarHBondContact OE2-NZ 2.96Å
293	F	76.9	Confident	81.8	Confident	43 Å²	43	87.7 Å²	87.7	19%	0.189	42%	0.419	C	S	.	.			trans	-118.2	155.8	-179.7	-46.4	-68.1	0	0	0	111.1	M287 R291 F296 E302 I306	M287-F293 WeakPolarHBondContact O-CE1 3.29Å; R291-F293 VanDerWaalsContact CA-CE2 3.5Å; R291-F293 HydrophobicContact CB-CE2 3.89Å; R291-F293 HydrophobicContact CB-CZ 4.37Å; R291-F293 HydrophobicContact CG-CE2 4.25Å; R291-F293 HydrophobicContact CG-CZ 4.48Å; F293-F296 HydrophobicContact CB-CE2 4.12Å; F293-E302 HydrophobicContact CD2-CB 4.1Å; F293-E302 HydrophobicContact CD2-CG 4.19Å; F293-E302 HydrophobicContact CE2-CB 4.34Å; F293-E302 HydrophobicContact CG-CB 4.5Å; F293-I306 HydrophobicContact CD1-CD1 4.22Å; F293-I306 HydrophobicContact CD1-CG1 4.46Å; F293-I306 HydrophobicContact CE1-CD1 3.83Å; F293-I306 HydrophobicContact CE1-CG1 3.81Å
294	P	78.4	Confident	81.7	Confident	56 Å²	56	87.5 Å²	87.5	36%	0.364	42%	0.417	S	S	.	.			trans	-55.2	153.6	159.9	-21.2	33.4	0	0	0	110.8	F296 Y305	P294-F296 HydrophobicContact CB-CE2 4.27Å; P294-F296 HydrophobicContact CB-CZ 4.1Å; P294-F296 HydrophobicContact CG-CZ 4.24Å; P294-F296 WeakPolarHBondContact O-CD2 3.22Å; P294-F296 WeakPolarHBondContact O-CE2 3.43Å; P294-F296 PolarHBondContact O-N 3.35Å; P294-Y305 HydrophobicContact CG-CE1 4.32Å
295	K	82.2	Confident	81.7	Confident	175 Å²	175	88.7 Å²	88.7	76%	0.761	42%	0.421	S	S	*	.			trans	-73.4	124.9	175.5	-68.9	-178.1	-179.5	175.8	0	109.7	S737 V738	K295-S737 CarbonylContact O-C 3.31Å; K295-S737 VanDerWaalsContact O-CA 3.32Å; K295-S737 WeakPolarHBondContact O-CA 3.09Å; K295-S737 WeakPolarHBondContact O-CB 3.46Å; K295-V738 HydrophobicContact CB-CB 4.37Å; K295-V738 HydrophobicContact CB-CG2 4.11Å; K295-V738 PolarHBondContact O-N 2.99Å
296	F	86.1	Confident	81.7	Confident	20 Å²	20	86.4 Å²	86.4	9%	0.088	41%	0.409	C	S	.	.	B	Isolated β-bridge	trans	-107.1	160.9	177.7	-63.8	-78	0	0	0	112.5	F293 P294 A298 M301 E302 Y305 V736	F293-F296 HydrophobicContact CB-CE2 4.12Å; P294-F296 HydrophobicContact CB-CE2 4.27Å; P294-F296 HydrophobicContact CB-CZ 4.1Å; P294-F296 HydrophobicContact CG-CZ 4.24Å; P294-F296 WeakPolarHBondContact O-CD2 3.22Å; P294-F296 WeakPolarHBondContact O-CE2 3.43Å; P294-F296 PolarHBondContact O-N 3.35Å; F296-A298 VanDerWaalsContact C-N 3.31Å; F296-A298 PolarHBondContact O-N 3.21Å; F296-M301 HydrophobicContact CB-CB 3.9Å; F296-M301 HydrophobicContact CD1-CB 4.37Å; F296-M301 HydrophobicContact CG-CB 4.12Å; F296-E302 HydrophobicContact CD2-CG 3.91Å; F296-Y305 HydrophobicContact CE1-CD2 4.24Å; F296-Y305 HydrophobicContact CE1-CG 4.23Å; F296-Y305 HydrophobicContact CE2-CD1 4.08Å; F296-Y305 HydrophobicContact CE2-CG 4.05Å; F296-Y305 AromaticContact CZ-CD1 3.69Å; F296-Y305 HydrophobicContact CZ-CD1 3.69Å; F296-Y305 AromaticContact CZ-CD2 3.78Å; F296-Y305 HydrophobicContact CZ-CD2 3.78Å; F296-Y305 HydrophobicContact CZ-CE1 4.27Å; F296-Y305 HydrophobicContact CZ-CE2 4.37Å; F296-Y305 AromaticContact CZ-CG 3.4Å; F296-Y305 HydrophobicContact CZ-CG 3.4Å; F296-Y305 VanDerWaalsContact CZ-CG 3.4Å; F296-V736 WeakPolarHBondContact CD1-O 3.41Å
297	I	81.4	Confident	81.7	Confident	78 Å²	78	86.1 Å²	86.1	40%	0.4	41%	0.409	S	S	.	.	S	Bend	trans	-64.3	-37.4	179.3	-63.3	175.9	0	0	0	111.5	M301 V736 K741	I297-M301 HydrophobicContact CB-SD 4.45Å; I297-V736 HydrophobicContact CD1-CB 3.78Å; I297-V736 HydrophobicContact CD1-CG1 3.53Å; I297-V736 HydrophobicContact CG1-CB 4.44Å; I297-V736 HydrophobicContact CG1-CG1 4.38Å; I297-V736 PolarHBondContact N-O 2.92Å; I297-V736 VanDerWaalsContact N-O 3.16Å; I297-K741 HydrophobicContact CD1-CB 4.25Å; I297-K741 HydrophobicContact CD1-CD 3.59Å; I297-K741 HydrophobicContact CD1-CG 4.49Å; I297-K741 HydrophobicContact CG1-CD 4.29Å
298	A	81.3	Confident	81.8	Confident	35 Å²	35	85.5 Å²	85.5	29%	0.289	41%	0.405	S	S	.	.	S	Bend	trans	-130.8	146	179.6	0	0	0	0	0	110.7	F296 D300 M301	F296-A298 VanDerWaalsContact C-N 3.31Å; F296-A298 PolarHBondContact O-N 3.21Å; A298-D300 VanDerWaalsContact C-N 3.34Å; A298-D300 WeakPolarHBondContact CB-OD1 3.48Å; A298-D300 PolarHBondContact O-N 3.23Å; A298-M301 HydrophobicContact CB-CE 4.26Å; A298-M301 HydrophobicContact CB-CG 4.2Å; A298-M301 HydrophobicContact CB-SD 4.3Å; A298-M301 VanDerWaalsContact O-CB 3.3Å; A298-M301 WeakPolarHBondContact O-CB 3.44Å; A298-M301 PolarHBondContact O-N 3.03Å
299	K	77.4	Confident	81.9	Confident	177 Å²	177	85.1 Å²	85.1	77%	0.77	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-29	-172.4	-77.7	-173.6	174.5	-179.4	0	113.8	M301 E302	K299-M301 PolarHBondContact O-N 3.37Å; K299-E302 WeakPolarHBondContact O-CB 3.42Å; K299-E302 PolarHBondContact O-N 2.92Å
300	D	79.7	Confident	82	Confident	100 Å²	100	81.4 Å²	81.4	54%	0.535	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-26.6	172.5	56.4	-25.2	0	0	0	112.6	A298 E302 M304	A298-D300 VanDerWaalsContact C-N 3.34Å; A298-D300 WeakPolarHBondContact CB-OD1 3.48Å; A298-D300 PolarHBondContact O-N 3.23Å; D300-E302 PolarHBondContact O-N 2.9Å; D300-M304 HydrophobicContact CB-CE 4.47Å
301	M	82.3	Confident	82.1	Confident	35 Å²	35	80.7 Å²	80.7	17%	0.172	38%	0.384	C	S	.	.	H	α-helix	trans	-68.4	-18.8	176.8	-59.6	-177.5	173.8	0	0	113.9	F296 I297 A298 K299 M304 Y305 T735	F296-M301 HydrophobicContact CB-CB 3.9Å; F296-M301 HydrophobicContact CD1-CB 4.37Å; F296-M301 HydrophobicContact CG-CB 4.12Å; I297-M301 HydrophobicContact CB-SD 4.45Å; A298-M301 HydrophobicContact CB-CE 4.26Å; A298-M301 HydrophobicContact CB-CG 4.2Å; A298-M301 HydrophobicContact CB-SD 4.3Å; A298-M301 VanDerWaalsContact O-CB 3.3Å; A298-M301 WeakPolarHBondContact O-CB 3.44Å; A298-M301 PolarHBondContact O-N 3.03Å; K299-M301 PolarHBondContact O-N 3.37Å; M301-M304 HydrophobicContact CB-CE 4.14Å; M301-M304 HydrophobicContact CG-CE 3.65Å; M301-M304 PolarHBondContact O-N 3.47Å; M301-Y305 WeakPolarHBondContact O-CB 3.27Å; M301-Y305 PolarHBondContact O-N 3.38Å; M301-T735 HydrophobicContact CB-CG2 4.05Å; M301-T735 VanDerWaalsContact O-CG2 3.26Å; M301-T735 WeakPolarHBondContact O-CG2 3.4Å
302	E	82.7	Confident	82.4	Confident	70 Å²	70	72.8 Å²	72.8	33%	0.327	36%	0.36	S	S	.	.	H	α-helix	trans	-63.6	-42.8	177.9	-67.7	174.3	-171.6	0	0	111.7	F293 F296 K299 D300	F293-E302 HydrophobicContact CD2-CB 4.1Å; F293-E302 HydrophobicContact CD2-CG 4.19Å; F293-E302 HydrophobicContact CE2-CB 4.34Å; F293-E302 HydrophobicContact CG-CB 4.5Å; F296-E302 HydrophobicContact CD2-CG 3.91Å; K299-E302 WeakPolarHBondContact O-CB 3.42Å; K299-E302 PolarHBondContact O-N 2.92Å; D300-E302 PolarHBondContact O-N 2.9Å
303	N	81.4	Confident	83	Confident	110 Å²	110	66.3 Å²	66.3	59%	0.588	33%	0.332	S	S	*	.	H	α-helix	trans	-74.5	-41.2	177.4	-68.4	-28.7	0	0	0	111.4	Y305 I306 E307	N303-Y305 PolarHBondContact O-N 2.74Å; N303-I306 PolarHBondContact O-N 3.48Å; N303-E307 PolarHBondContact O-N 2.97Å; N303-E307 VanDerWaalsContact O-N 3.16Å
304	M	82.9	Confident	83.5	Confident	60 Å²	60	68.3 Å²	68.3	30%	0.296	35%	0.345	S	S	.	.	H	α-helix	trans	-60.6	-28.8	175.4	-66.8	-170.3	-72	0	0	111.9	D300 M301 E307 E308 I733 T735	D300-M304 HydrophobicContact CB-CE 4.47Å; M301-M304 HydrophobicContact CB-CE 4.14Å; M301-M304 HydrophobicContact CG-CE 3.65Å; M301-M304 PolarHBondContact O-N 3.47Å; M304-E307 PolarHBondContact O-N 3.49Å; M304-E308 WeakPolarHBondContact O-CB 3.29Å; M304-E308 PolarHBondContact O-N 2.99Å; M304-I733 HydrophobicContact CB-CG2 4.43Å; M304-T735 HydrophobicContact CB-CG2 3.73Å
305	Y	84.4	Confident	83.8	Confident	29 Å²	29	70.7 Å²	70.7	11%	0.114	35%	0.354	C	S	.	.	H	α-helix	trans	-67.9	-40.1	178.2	177.4	-119.7	0	0	0	111.7	P294 F296 M301 N303 E307 E308 L309 T735	P294-Y305 HydrophobicContact CG-CE1 4.32Å; F296-Y305 HydrophobicContact CE1-CD2 4.24Å; F296-Y305 HydrophobicContact CE1-CG 4.23Å; F296-Y305 HydrophobicContact CE2-CD1 4.08Å; F296-Y305 HydrophobicContact CE2-CG 4.05Å; F296-Y305 AromaticContact CZ-CD1 3.69Å; F296-Y305 HydrophobicContact CZ-CD1 3.69Å; F296-Y305 AromaticContact CZ-CD2 3.78Å; F296-Y305 HydrophobicContact CZ-CD2 3.78Å; F296-Y305 HydrophobicContact CZ-CE1 4.27Å; F296-Y305 HydrophobicContact CZ-CE2 4.37Å; F296-Y305 AromaticContact CZ-CG 3.4Å; F296-Y305 HydrophobicContact CZ-CG 3.4Å; F296-Y305 VanDerWaalsContact CZ-CG 3.4Å; M301-Y305 WeakPolarHBondContact O-CB 3.27Å; M301-Y305 PolarHBondContact O-N 3.38Å; N303-Y305 PolarHBondContact O-N 2.74Å; Y305-E307 VanDerWaalsContact C-N 3.34Å; Y305-E308 PolarHBondContact O-N 3.48Å; Y305-L309 HydrophobicContact CD1-CD1 4.2Å; Y305-L309 HydrophobicContact CD2-CG 4.46Å; Y305-L309 HydrophobicContact CE1-CD1 3.65Å; Y305-L309 HydrophobicContact CE1-CG 4.31Å; Y305-L309 HydrophobicContact CE2-CD1 4.25Å; Y305-L309 HydrophobicContact CE2-CD2 4.2Å; Y305-L309 HydrophobicContact CE2-CG 4.04Å; Y305-L309 WeakPolarHBondContact O-CG 3.45Å; Y305-L309 PolarHBondContact O-N 2.9Å; Y305-T735 VanDerWaalsContact N-CG2 3.35Å
306	I	85.6	Confident	84.1	Confident	8 Å²	8	62.7 Å²	62.7	4%	0.041	32%	0.32	C	S	.	.	H	α-helix	trans	-67.4	-39.4	175.2	-61.7	-55.2	0	0	0	110.7	M287 A288 F293 N303 L309 R310	M287-I306 HydrophobicContact CB-CD1 4.01Å; A288-I306 HydrophobicContact CB-CG1 4.3Å; A288-I306 HydrophobicContact CB-CG2 4.16Å; F293-I306 HydrophobicContact CD1-CD1 4.22Å; F293-I306 HydrophobicContact CD1-CG1 4.46Å; F293-I306 HydrophobicContact CE1-CD1 3.83Å; F293-I306 HydrophobicContact CE1-CG1 3.81Å; N303-I306 PolarHBondContact O-N 3.48Å; I306-L309 HydrophobicContact CD1-CD1 4.37Å; I306-L309 PolarHBondContact O-N 2.69Å; I306-R310 WeakPolarHBondContact O-CB 3.46Å; I306-R310 WeakPolarHBondContact O-CG 3.18Å; I306-R310 PolarHBondContact O-N 2.86Å
307	E	84.6	Confident	84	Confident	109 Å²	109	63.9 Å²	63.9	51%	0.509	33%	0.326	S	S	.	.	H	α-helix	trans	-63.9	-40.4	173.5	-68.6	175.9	-177.3	0	0	112	N303 M304 Y305 R310 S311	N303-E307 PolarHBondContact O-N 2.97Å; N303-E307 VanDerWaalsContact O-N 3.16Å; M304-E307 PolarHBondContact O-N 3.49Å; Y305-E307 VanDerWaalsContact C-N 3.34Å; E307-R310 PolarHBondContact O-N 3.5Å; E307-S311 WeakPolarHBondContact O-CB 3.48Å; E307-S311 PolarHBondContact O-N 2.83Å
308	E	85.1	Confident	84	Confident	41 Å²	41	62.2 Å²	62.2	19%	0.192	32%	0.324	C	S	.	.	H	α-helix	trans	-61	-47	173.9	-176.4	180	170.5	0	0	111	M304 Y305 S311 S312 R729 T735	M304-E308 WeakPolarHBondContact O-CB 3.29Å; M304-E308 PolarHBondContact O-N 2.99Å; Y305-E308 PolarHBondContact O-N 3.48Å; E308-S311 PolarHBondContact O-N 3.44Å; E308-S312 WeakPolarHBondContact O-CB 3.43Å; E308-S312 PolarHBondContact O-N 3.41Å; E308-R729 IonicContact OE1-NH1 3.63Å; E308-T735 PolarHBondContact OE2-N 3.37Å; E308-T735 PolarHBondContact OE2-OG1 3.01Å
309	L	85.2	Confident	84.2	Confident	30 Å²	30	62.8 Å²	62.8	16%	0.157	32%	0.322	C	S	.	.	H	α-helix	trans	-60.9	-48	176.1	-73	178.7	0	0	0	111.6	A284 Y305 I306 S312 V313	A284-L309 HydrophobicContact CB-CB 4.32Å; A284-L309 HydrophobicContact CB-CD1 4.38Å; Y305-L309 HydrophobicContact CD1-CD1 4.2Å; Y305-L309 HydrophobicContact CD2-CG 4.46Å; Y305-L309 HydrophobicContact CE1-CD1 3.65Å; Y305-L309 HydrophobicContact CE1-CG 4.31Å; Y305-L309 HydrophobicContact CE2-CD1 4.25Å; Y305-L309 HydrophobicContact CE2-CD2 4.2Å; Y305-L309 HydrophobicContact CE2-CG 4.04Å; Y305-L309 WeakPolarHBondContact O-CG 3.45Å; Y305-L309 PolarHBondContact O-N 2.9Å; I306-L309 HydrophobicContact CD1-CD1 4.37Å; I306-L309 PolarHBondContact O-N 2.69Å; L309-S312 PolarHBondContact O-N 3.06Å; L309-S312 PolarHBondContact O-OG 3.23Å; L309-V313 WeakPolarHBondContact O-CG2 3.24Å; L309-V313 PolarHBondContact O-N 3.45Å; L309-V313 VanDerWaalsContact O-N 3.08Å
310	R	87.5	Confident	84.5	Confident	99 Å²	99	54.5 Å²	54.5	37%	0.374	29%	0.287	S	S	.	.	H	α-helix	trans	-62	-46.2	177.7	-74.5	173.8	175.5	170.5	-2.4	111.6	L281 D285 I306 E307 S312 V313 N314	L281-R310 HydrophobicContact CD2-CG 4.33Å; D285-R310 IonicContact OD1-CZ 2.8Å; D285-R310 IonicContact OD1-NE 3.86Å; D285-R310 PolarHBondContact OD1-NE 3.26Å; D285-R310 IonicContact OD1-NH2 3.81Å; D285-R310 PolarHBondContact OD1-NH2 3.41Å; I306-R310 WeakPolarHBondContact O-CB 3.46Å; I306-R310 WeakPolarHBondContact O-CG 3.18Å; I306-R310 PolarHBondContact O-N 2.86Å; E307-R310 PolarHBondContact O-N 3.5Å; R310-S312 VanDerWaalsContact C-N 3.33Å; R310-S312 PolarHBondContact O-N 3.01Å; R310-V313 PolarHBondContact O-N 3.46Å; R310-N314 WeakPolarHBondContact O-CB 3.48Å; R310-N314 PolarHBondContact O-N 3.49Å; R310-N314 PolarHBondContact O-ND2 2.94Å
311	S	85.9	Confident	84.5	Confident	72 Å²	72	54.3 Å²	54.3	50%	0.503	28%	0.282	S	S	.	.	H	α-helix	trans	-59.2	-43.6	176.7	-175.3	0	0	0	0	111.6	E307 E308 V313 N314 L315	E307-S311 WeakPolarHBondContact O-CB 3.48Å; E307-S311 PolarHBondContact O-N 2.83Å; E308-S311 PolarHBondContact O-N 3.44Å; S311-V313 PolarHBondContact O-N 3.27Å; S311-N314 PolarHBondContact O-N 3.23Å; S311-L315 PolarHBondContact O-N 3.32Å
312	S	85.8	Confident	84.2	Confident	41 Å²	41	57 Å²	57	29%	0.287	30%	0.304	S	S	.	.	H	α-helix	trans	-61.9	-40.7	177.1	78.8	0	0	0	0	112.7	E308 L309 R310 L316	E308-S312 WeakPolarHBondContact O-CB 3.43Å; E308-S312 PolarHBondContact O-N 3.41Å; L309-S312 PolarHBondContact O-N 3.06Å; L309-S312 PolarHBondContact O-OG 3.23Å; R310-S312 VanDerWaalsContact C-N 3.33Å; R310-S312 PolarHBondContact O-N 3.01Å; S312-L316 WeakPolarHBondContact O-CG 3.43Å; S312-L316 PolarHBondContact O-N 2.92Å
313	V	86.9	Confident	83.9	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.024	31%	0.305	C	S	.	.	H	α-helix	trans	-71.7	-41.5	177.3	178.6	0	0	0	0	110.6	L277 R280 L281 L309 R310 S311 L315 L316 M317	L277-V313 HydrophobicContact CB-CG1 3.99Å; L277-V313 HydrophobicContact CD2-CG1 4.22Å; R280-V313 HydrophobicContact CB-CG2 4.02Å; L281-V313 HydrophobicContact CD1-CG1 4.03Å; L281-V313 HydrophobicContact CD2-CB 4.02Å; L281-V313 HydrophobicContact CD2-CG1 3.99Å; L281-V313 HydrophobicContact CG-CB 4.24Å; L281-V313 HydrophobicContact CG-CG1 3.69Å; L309-V313 WeakPolarHBondContact O-CG2 3.24Å; L309-V313 PolarHBondContact O-N 3.45Å; L309-V313 VanDerWaalsContact O-N 3.08Å; R310-V313 PolarHBondContact O-N 3.46Å; S311-V313 PolarHBondContact O-N 3.27Å; V313-L315 VanDerWaalsContact C-N 3.3Å; V313-L315 PolarHBondContact O-N 3.12Å; V313-L316 CarbonylContact O-C 3.53Å; V313-L316 WeakPolarHBondContact O-CA 3.45Å; V313-L316 WeakPolarHBondContact O-CB 3.48Å; V313-L316 PolarHBondContact O-N 3.24Å; V313-M317 HydrophobicContact CG1-CG 4.31Å; V313-M317 HydrophobicContact CG1-SD 4.31Å; V313-M317 WeakPolarHBondContact O-CG 3.34Å; V313-M317 PolarHBondContact O-N 2.95Å
314	N	86.3	Confident	83.1	Confident	86 Å²	86	55.9 Å²	55.9	46%	0.46	31%	0.305	S	S	.	.	H	α-helix	trans	-61	-37.5	177	-70.9	-20.9	0	0	0	112.3	R310 S311 L316 M317 A318	R310-N314 WeakPolarHBondContact O-CB 3.48Å; R310-N314 PolarHBondContact O-N 3.49Å; R310-N314 PolarHBondContact O-ND2 2.94Å; S311-N314 PolarHBondContact O-N 3.23Å; N314-L316 VanDerWaalsContact C-N 3.34Å; N314-M317 WeakPolarHBondContact O-CB 2.93Å; N314-M317 PolarHBondContact O-N 3.44Å; N314-A318 WeakPolarHBondContact O-CB 3.33Å; N314-A318 PolarHBondContact O-N 3.23Å
315	L	86.5	Confident	82.1	Confident	105 Å²	105	54 Å²	54	55%	0.55	30%	0.298	S	S	.	.	H	α-helix	trans	-61.9	-42.5	173	-180	63.1	0	0	0	111.5	S311 V313 A318 N319	S311-L315 PolarHBondContact O-N 3.32Å; V313-L315 VanDerWaalsContact C-N 3.3Å; V313-L315 PolarHBondContact O-N 3.12Å; L315-A318 PolarHBondContact O-N 3.04Å; L315-N319 VanDerWaalsContact O-CG 3.3Å; L315-N319 PolarHBondContact O-N 2.63Å
316	L	86.6	Confident	80.7	Confident	7 Å²	7	54.5 Å²	54.5	4%	0.037	31%	0.305	C	S	.	.	H	α-helix	trans	-67	-36.7	176.1	-67.6	171.3	0	0	0	112.3	F99 N100 L277 S312 V313 N314 N319 L320 A682	F99-L316 HydrophobicContact CE2-CB 4Å; F99-L316 HydrophobicContact CE2-CD2 3.89Å; F99-L316 HydrophobicContact CZ-CB 4.44Å; F99-L316 HydrophobicContact CZ-CD2 4.16Å; N100-L316 HydrophobicContact CB-CD2 3.89Å; N100-L316 WeakPolarHBondContact OD1-CD2 3.21Å; L277-L316 HydrophobicContact CD1-CB 4.07Å; L277-L316 HydrophobicContact CD2-CB 3.9Å; L277-L316 HydrophobicContact CD2-CD1 3.81Å; S312-L316 WeakPolarHBondContact O-CG 3.43Å; S312-L316 PolarHBondContact O-N 2.92Å; V313-L316 CarbonylContact O-C 3.53Å; V313-L316 WeakPolarHBondContact O-CA 3.45Å; V313-L316 WeakPolarHBondContact O-CB 3.48Å; V313-L316 PolarHBondContact O-N 3.24Å; N314-L316 VanDerWaalsContact C-N 3.34Å; L316-N319 PolarHBondContact O-N 3.38Å; L316-L320 PolarHBondContact O-N 3Å; L316-A682 WeakPolarHBondContact CD1-O 3.25Å; L316-A682 HydrophobicContact CD2-CB 4.13Å
317	M	84.2	Confident	78.8	Confident	45 Å²	45	64.2 Å²	64.2	22%	0.222	35%	0.347	C	S	.	.	H	α-helix	trans	-61.1	-48.3	172	-66.4	177.5	68.7	0	0	110.5	L277 L281 V313 N314 N319 L320 E321 Y518	L277-M317 HydrophobicContact CD1-CG 4.13Å; L281-M317 HydrophobicContact CD1-SD 3.96Å; V313-M317 HydrophobicContact CG1-CG 4.31Å; V313-M317 HydrophobicContact CG1-SD 4.31Å; V313-M317 WeakPolarHBondContact O-CG 3.34Å; V313-M317 PolarHBondContact O-N 2.95Å; N314-M317 WeakPolarHBondContact O-CB 2.93Å; N314-M317 PolarHBondContact O-N 3.44Å; M317-N319 VanDerWaalsContact C-N 3.35Å; M317-N319 PolarHBondContact O-N 3.44Å; M317-L320 PolarHBondContact O-N 2.96Å; M317-E321 WeakPolarHBondContact O-CG 3.4Å; M317-E321 PolarHBondContact O-N 2.92Å; M317-Y518 HydrophobicContact CB-CE2 4.12Å; M317-Y518 HydrophobicContact CE-CD1 3.91Å; M317-Y518 HydrophobicContact CE-CE1 3.58Å; M317-Y518 HydrophobicContact CG-CE1 4.19Å; M317-Y518 WeakPolarHBondContact CG-OH 3.12Å; M317-Y518 WeakPolarHBondContact O-CE2 3.42Å
318	A	82.7	Confident	76.7	Confident	44 Å²	44	63 Å²	63	36%	0.364	36%	0.364	S	S	.	.	H	α-helix	trans	-61.8	-39.4	177	0	0	0	0	0	112.8	N314 L315 E321 S322	N314-A318 WeakPolarHBondContact O-CB 3.33Å; N314-A318 PolarHBondContact O-N 3.23Å; L315-A318 PolarHBondContact O-N 3.04Å; A318-E321 WeakPolarHBondContact O-CB 3.49Å; A318-E321 PolarHBondContact O-N 3.18Å; A318-S322 PolarHBondContact O-N 3.41Å
319	N	85.3	Confident	74.5	Confident	46 Å²	46	63.3 Å²	63.3	25%	0.246	38%	0.378	C	S	.	.	H	α-helix	trans	-63.8	-42.6	175.3	-74	-12.4	0	0	0	111.3	N100 L315 L316 M317 S322	N100-N319 PolarHBondContact OD1-ND2 3.25Å; L315-N319 VanDerWaalsContact O-CG 3.3Å; L315-N319 PolarHBondContact O-N 2.63Å; L316-N319 PolarHBondContact O-N 3.38Å; M317-N319 VanDerWaalsContact C-N 3.35Å; M317-N319 PolarHBondContact O-N 3.44Å; N319-S322 PolarHBondContact O-N 3.1Å; N319-S322 PolarHBondContact O-OG 3.34Å
320	L	83.8	Confident	72	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.021	41%	0.411	C	S	.	.	H	α-helix	trans	-63.8	-41.5	173.2	-179.5	61.5	0	0	0	111.2	F99 A270 I273 R274 L316 M317 S322 L323 Q517 Y518	F99-L320 HydrophobicContact CB-CD1 4.47Å; F99-L320 HydrophobicContact CD2-CB 4.13Å; A270-L320 HydrophobicContact CB-CD1 4.43Å; I273-L320 HydrophobicContact CB-CD2 4.09Å; I273-L320 HydrophobicContact CD1-CD1 4.15Å; I273-L320 HydrophobicContact CG2-CD2 3.85Å; R274-L320 HydrophobicContact CG-CD2 4Å; L316-L320 PolarHBondContact O-N 3Å; M317-L320 PolarHBondContact O-N 2.96Å; L320-S322 VanDerWaalsContact C-N 3.26Å; L320-S322 PolarHBondContact O-N 3.43Å; L320-L323 HydrophobicContact CD1-CD1 4.08Å; L320-L323 WeakPolarHBondContact O-CB 3.28Å; L320-L323 PolarHBondContact O-N 3.13Å; L320-L323 VanDerWaalsContact O-N 3.15Å; L320-Q517 HydrophobicContact CG-CB 4.21Å; L320-Q517 VanDerWaalsContact O-CG 3.28Å; L320-Q517 WeakPolarHBondContact O-CG 3.47Å; L320-Y518 HydrophobicContact CB-CE2 3.97Å; L320-Y518 HydrophobicContact CD2-CE2 3.66Å; L320-Y518 WeakPolarHBondContact CD2-OH 3.47Å; L320-Y518 HydrophobicContact CG-CE2 3.94Å
321	E	79.3	Confident	69.4	Low	95 Å²	95	71.8 Å²	71.8	44%	0.444	43%	0.432	S	S	.	.	H	α-helix	trans	-60.2	-33.2	175.3	-75.7	-176.4	166	0	0	113.9	M317 A318 L323 Y518	M317-E321 WeakPolarHBondContact O-CG 3.4Å; M317-E321 PolarHBondContact O-N 2.92Å; A318-E321 WeakPolarHBondContact O-CB 3.49Å; A318-E321 PolarHBondContact O-N 3.18Å; E321-L323 PolarHBondContact O-N 3.37Å; E321-Y518 HydrophobicContact CG-CD2 3.45Å; E321-Y518 VanDerWaalsContact CG-CD2 3.45Å; E321-Y518 HydrophobicContact CG-CE2 4.01Å; E321-Y518 HydrophobicContact CG-CG 4.4Å
322	S	76.6	Confident	67.2	Low	91 Å²	91	75.5 Å²	75.5	64%	0.636	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-15.6	178.6	79.4	0	0	0	0	113.7	A318 N319 L320	A318-S322 PolarHBondContact O-N 3.41Å; N319-S322 PolarHBondContact O-N 3.1Å; N319-S322 PolarHBondContact O-OG 3.34Å; L320-S322 VanDerWaalsContact C-N 3.26Å; L320-S322 PolarHBondContact O-N 3.43Å
323	L	74.7	Confident	64.6	Low	67 Å²	67	82.1 Å²	82.1	35%	0.351	46%	0.463	S	S	.	.	S	Bend	trans	-76.3	133.2	179.1	-65.5	-179.7	0	0	0	111.4	F99 L320 E321 V325 Q517	F99-L323 HydrophobicContact CB-CD1 3.83Å; L320-L323 HydrophobicContact CD1-CD1 4.08Å; L320-L323 WeakPolarHBondContact O-CB 3.28Å; L320-L323 PolarHBondContact O-N 3.13Å; L320-L323 VanDerWaalsContact O-N 3.15Å; E321-L323 PolarHBondContact O-N 3.37Å; L323-V325 PolarHBondContact O-N 2.83Å; L323-Q517 WeakPolarHBondContact O-CG 3.43Å; L323-Q517 PolarHBondContact O-NE2 3.28Å
324	P	65.6	Low	62.2	Low	90 Å²	90	88.1 Å²	88.1	58%	0.584	49%	0.494	S	S	*	.			trans	-61.3	137.9	-178.6	26.1	-34.1	0	0	0	111.2	S326 Q517	P324-S326 PolarHBondContact O-N 3.35Å; P324-Q517 PolarHBondContact O-NE2 3.13Å
325	V	61.8	Low	59.7	Low	22 Å²	22	92.7 Å²	92.7	13%	0.133	51%	0.513	C	S	.	.	S	Bend	trans	-63.6	-20.6	-179.2	171.5	0	0	0	0	112.7	L323 Q514	L323-V325 PolarHBondContact O-N 2.83Å; V325-Q514 HydrophobicContact CG1-CB 4.14Å; V325-Q514 HydrophobicContact CG1-CG 3.75Å; V325-Q514 VanDerWaalsContact CG1-OE1 3.26Å; V325-Q514 HydrophobicContact CG2-CG 4.41Å
326	S	55	Low	57	Low	38 Å²	38	96.7 Å²	96.7	27%	0.266	53%	0.526	S	S	.	.			trans	-148.2	141.5	173.3	63.8	0	0	0	0	112.6	P324	P324-S326 PolarHBondContact O-N 3.35Å
327	K	45.8	Very low	54.4	Low	212 Å²	212	103.9 Å²	103.9	92%	0.922	56%	0.564	S	S	*	*	S	Bend	trans	-89.1	106.3	168.3	-70.9	-172.5	177.7	-177.8	0	108.3
328	G	40.3	Very low	51.8	Low	84 Å²	84	111 Å²	111	87%	0.866	59%	0.594	S	S	*	*	S	Bend	trans	123.3	12.7	164.6	0	0	0	0	0	118.7
329	G	38.6	Very low	49.5	Very low	48 Å²	48	119.5 Å²	119.5	50%	0.495	62%	0.616	S	S	.	*	S	Bend	trans	-95.9	149.7	169	0	0	0	0	0	112.3	E331	G329-E331 PolarHBondContact O-N 3.3Å
330	P	33.9	Very low	46.6	Very low	131 Å²	131	122 Å²	122	85%	0.851	64%	0.638	S	S	*	*			trans	-55.2	131.6	169.6	23.3	-30.7	0	0	0	109	F332	P330-F332 PolarHBondContact O-N 3Å
331	E	32	Very low	44.1	Very low	175 Å²	175	130.5 Å²	130.5	82%	0.818	68%	0.677	S	S	*	*			trans	-48.8	102.7	-175	-68.1	-176.6	157.2	0	0	111.4	G329 K333	G329-E331 PolarHBondContact O-N 3.3Å; E331-K333 VanDerWaalsContact C-N 3.32Å; E331-K333 PolarHBondContact O-N 2.75Å
332	F	38.9	Very low	41.5	Very low	150 Å²	150	133.3 Å²	133.3	66%	0.658	70%	0.695	S	S	*	*			trans	-67.9	99.5	161.2	-132.9	-95.7	0	0	0	105.7	P330 L334	P330-F332 PolarHBondContact O-N 3Å; F332-L334 PolarHBondContact O-N 3.35Å
333	K	31.7	Very low	39.3	Very low	181 Å²	181	134.8 Å²	134.8	79%	0.787	71%	0.705	S	S	*	*			trans	-63.7	83.5	170.4	-77.4	-178.9	178.9	173.1	0	108.1	E331 Q335	E331-K333 VanDerWaalsContact C-N 3.32Å; E331-K333 PolarHBondContact O-N 2.75Å; K333-Q335 VanDerWaalsContact C-N 3.33Å; K333-Q335 PolarHBondContact O-N 3.2Å
334	L	37.7	Very low	37	Very low	129 Å²	129	136 Å²	136	68%	0.675	73%	0.726	S	S	*	*			trans	-56.8	106.7	157.1	-125	140.9	0	0	0	104.9	F332 K336	F332-L334 PolarHBondContact O-N 3.35Å; L334-K336 PolarHBondContact O-N 3.03Å
335	Q	32.1	Very low	35.2	Very low	182 Å²	182	140.7 Å²	140.7	85%	0.85	74%	0.737	S	S	*	*			trans	-49.2	110.9	178.6	-124.5	174.9	1.5	0	0	106.5	K333 L337	K333-Q335 VanDerWaalsContact C-N 3.33Å; K333-Q335 PolarHBondContact O-N 3.2Å; Q335-L337 PolarHBondContact O-N 3.16Å
336	K	31.3	Very low	34.2	Very low	189 Å²	189	145.8 Å²	145.8	82%	0.822	76%	0.763	S	S	*	*			trans	-32.2	109.9	-179.6	-81.4	178.4	172	178.6	0	109.7	L334 K338	L334-K336 PolarHBondContact O-N 3.03Å; K336-K338 PolarHBondContact O-N 3.3Å
337	L	31.6	Very low	32.7	Very low	159 Å²	159	151.3 Å²	151.3	83%	0.832	79%	0.789	S	S	*	*			trans	-59.9	95.9	153.4	-133.8	100.2	0	0	0	104.3	Q335 R339	Q335-L337 PolarHBondContact O-N 3.16Å; L337-R339 PolarHBondContact O-N 3.5Å
338	K	28.6	Very low	32.4	Very low	194 Å²	194	149.2 Å²	149.2	84%	0.843	79%	0.787	S	S	*	*			trans	-66.2	83.6	170.5	-85.2	-173.8	173.7	-178.3	0	106.7	K336 S340	K336-K338 PolarHBondContact O-N 3.3Å; K338-S340 PolarHBondContact O-N 3.16Å
339	R	34.7	Very low	32	Very low	222 Å²	222	148.1 Å²	148.1	84%	0.838	78%	0.775	S	S	*	*			trans	-75.5	99.6	151.8	-114.5	178.9	171.8	172.7	-2.6	105.7	L337 Q341	L337-R339 PolarHBondContact O-N 3.5Å; R339-Q341 PolarHBondContact O-N 2.92Å
340	S	24.8	Very low	31.5	Very low	100 Å²	100	152.7 Å²	152.7	70%	0.699	79%	0.788	S	S	*	*			trans	-54.3	119.2	170.4	-170.2	0	0	0	0	108.1	K338 N342	K338-S340 PolarHBondContact O-N 3.16Å; S340-N342 PolarHBondContact O-N 3.48Å
341	Q	31.4	Very low	31.4	Very low	182 Å²	182	155.8 Å²	155.8	85%	0.85	79%	0.791	S	S	*	*			trans	-59.5	114.6	156.2	-74.5	178.6	-28	0	0	106.7	R339	R339-Q341 PolarHBondContact O-N 2.92Å
342	N	25.4	Very low	31.3	Very low	153 Å²	153	153.9 Å²	153.9	82%	0.818	79%	0.787	S	S	*	*			trans	-159.6	119.4	145	-92.3	-16.6	0	0	0	107.7	S340 A344	S340-N342 PolarHBondContact O-N 3.48Å; N342-A344 PolarHBondContact O-N 3.38Å
343	S	29.5	Very low	31.4	Very low	122 Å²	122	153.4 Å²	153.4	85%	0.853	79%	0.787	S	S	*	*			trans	-64.2	116.4	171.7	48.1	0	0	0	0	111.2
344	A	25.8	Very low	32.2	Very low	94 Å²	94	151.9 Å²	151.9	78%	0.777	79%	0.786	S	S	*	*			trans	-163.9	103.6	149.9	0	0	0	0	0	109.8	N342	N342-A344 PolarHBondContact O-N 3.38Å
345	F	29.3	Very low	33.2	Very low	187 Å²	187	153.1 Å²	153.1	82%	0.82	79%	0.788	S	S	*	*			trans	12.6	126.5	135.9	-159.3	-115.8	0	0	0	118.6
346	L	39.6	Very low	34.8	Very low	130 Å²	130	145.8 Å²	145.8	68%	0.681	76%	0.755	S	S	*	*			trans	67.1	97.2	164.7	-62	173.8	0	0	0	118.3
347	D	24.4	Very low	36.6	Very low	154 Å²	154	139 Å²	139	82%	0.824	73%	0.73	S	S	*	*				-149.4	114.7	126.5	-153.4	3.7	0	0	0	110.4
348	I	38.9	Very low	38.5	Very low	168 Å²	168	136 Å²	136	86%	0.862	71%	0.711	S	S	*	*			trans	-90	97.8	170	-67.3	171.9	0	0	0	104.5
349	G	30.9	Very low	40.5	Very low	61 Å²	61	130.4 Å²	130.4	63%	0.629	70%	0.696	S	S	*	*			trans	-171.4	114.7	179.9	0	0	0	0	0	112.6
350	D	29.4	Very low	42.2	Very low	143 Å²	143	123.2 Å²	123.2	77%	0.765	67%	0.674	S	S	*	*			trans	71.4	87.9	173.2	-78.3	-6.4	0	0	0	118.6	N352	D350-N352 PolarHBondContact O-N 3.01Å
351	E	32.2	Very low	44.5	Very low	196 Å²	196	118.5 Å²	118.5	92%	0.916	64%	0.641	S	S	*	*			trans	-55.5	88.6	142.9	-66.3	-161.6	165.6	0	0	110.3
352	N	30.3	Very low	46.8	Very low	135 Å²	135	112.2 Å²	112.2	72%	0.722	62%	0.615	S	S	*	*			trans	-100.5	105.8	150.8	-84.5	-49.2	0	0	0	106.8	D350 I354	D350-N352 PolarHBondContact O-N 3.01Å; N352-I354 PolarHBondContact O-N 3.11Å
353	E	40.4	Very low	49.5	Very low	141 Å²	141	105.2 Å²	105.2	66%	0.659	58%	0.578	S	S	*	*			trans	-36.4	124.2	169.1	-72.9	-179.6	149	0	0	109.5	Q355	E353-Q355 PolarHBondContact O-N 3.34Å
354	I	48.1	Very low	52.1	Low	149 Å²	149	102.1 Å²	102.1	76%	0.764	56%	0.556	S	S	*	*			trans	-64.4	87.7	170.6	-60.4	168.7	0	0	0	106.6	N352 L356	N352-I354 PolarHBondContact O-N 3.11Å; I354-L356 PolarHBondContact O-N 3.35Å
355	Q	57.7	Low	55	Low	154 Å²	154	97.7 Å²	97.7	72%	0.72	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-69.3	119.6	176.8	-77.5	-176.8	-1.1	0	0	108.4	E353 S357	E353-Q355 PolarHBondContact O-N 3.34Å; Q355-S357 PolarHBondContact O-N 3.49Å
356	L	66.4	Low	57.7	Low	29 Å²	29	91.9 Å²	91.9	15%	0.152	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-55.3	129.1	175.5	-83	163.9	0	0	0	109.8	I354 D360 V515 T519 A521 Q537	I354-L356 PolarHBondContact O-N 3.35Å; L356-D360 HydrophobicContact CD2-CB 4.04Å; L356-V515 HydrophobicContact CD1-CG2 4.34Å; L356-V515 HydrophobicContact CD2-CB 4.34Å; L356-V515 HydrophobicContact CD2-CG1 3.8Å; L356-V515 HydrophobicContact CD2-CG2 4.26Å; L356-T519 HydrophobicContact CD1-CG2 3.38Å; L356-T519 HydrophobicContact CD2-CG2 4.29Å; L356-T519 HydrophobicContact CG-CG2 4.13Å; L356-A521 HydrophobicContact CD1-CB 4.31Å; L356-Q537 VanDerWaalsContact CB-NE2 3.31Å; L356-Q537 HydrophobicContact CD1-CG 3.57Å; L356-Q537 VanDerWaalsContact CD1-NE2 3.31Å; L356-Q537 HydrophobicContact CG-CG 4.36Å
357	S	69.8	Low	60	Low	45 Å²	45	85.8 Å²	85.8	32%	0.315	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-78.4	154.5	175.3	76.7	0	0	0	0	110.1	Q355 S359 D360	Q355-S357 PolarHBondContact O-N 3.49Å; S357-S359 PolarHBondContact O-N 2.7Å; S357-S359 PolarHBondContact OG-OG 3.5Å; S357-D360 WeakPolarHBondContact CB-OD2 3.37Å; S357-D360 PolarHBondContact N-OD2 2.89Å; S357-D360 PolarHBondContact O-N 3Å; S357-D360 VanDerWaalsContact O-N 3.08Å; S357-D360 PolarHBondContact OG-N 3.31Å; S357-D360 PolarHBondContact OG-OD1 3.47Å; S357-D360 PolarHBondContact OG-OD2 2.78Å
358	K	71.9	Confident	63.1	Low	96 Å²	96	80.4 Å²	80.4	42%	0.417	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-62.7	-23.9	177.4	-66.7	-174.4	177.7	-168.9	0	112.9	Q533 L535	K358-Q533 PolarHBondContact NZ-O 2.89Å; K358-L535 HydrophobicContact CG-CD2 4.01Å
359	S	69.6	Low	65.5	Low	77 Å²	77	72.4 Å²	72.4	54%	0.538	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-71.5	-26	175	34.4	0	0	0	0	113.7	S357 V361 V362	S357-S359 PolarHBondContact O-N 2.7Å; S357-S359 PolarHBondContact OG-OG 3.5Å; S359-V361 PolarHBondContact O-N 2.63Å; S359-V362 PolarHBondContact O-N 3.28Å
360	D	70.1	Confident	68.2	Low	71 Å²	71	70.9 Å²	70.9	38%	0.38	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-73	-8	-178.7	-58.2	-38.8	0	0	0	113	L356 S357 V515	L356-D360 HydrophobicContact CD2-CB 4.04Å; S357-D360 WeakPolarHBondContact CB-OD2 3.37Å; S357-D360 PolarHBondContact N-OD2 2.89Å; S357-D360 PolarHBondContact O-N 3Å; S357-D360 VanDerWaalsContact O-N 3.08Å; S357-D360 PolarHBondContact OG-N 3.31Å; S357-D360 PolarHBondContact OG-OD1 3.47Å; S357-D360 PolarHBondContact OG-OD2 2.78Å; D360-V515 HydrophobicContact CB-CG1 4.35Å
361	V	74.4	Confident	71.1	Confident	1 Å²	1	64 Å²	64	1%	0.006	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-118.8	19.8	-175	-156.7	0	0	0	0	112	S359 V513 V515 C523 Y525 P532	S359-V361 PolarHBondContact O-N 2.63Å; V361-V513 HydrophobicContact CG1-CB 3.58Å; V361-V513 HydrophobicContact CG1-CG1 3.64Å; V361-V513 HydrophobicContact CG1-CG2 3.62Å; V361-V515 HydrophobicContact CG2-CG2 4.45Å; V361-C523 HydrophobicContact CG1-CB 4.35Å; V361-C523 VanDerWaalsContact CG1-SG 3.51Å; V361-Y525 WeakPolarHBondContact CG1-OH 3.22Å; V361-Y525 PolarHBondContact O-OH 3.47Å; V361-P532 HydrophobicContact CB-CG 4.5Å
362	V	79.6	Confident	73.8	Confident	50 Å²	50	58.4 Å²	58.4	30%	0.303	31%	0.313	S	S	.	.			trans	-77	125.7	174	178.7	0	0	0	0	109.1	S359 T418	S359-V362 PolarHBondContact O-N 3.28Å; V362-T418 HydrophobicContact CG1-CG2 4.28Å
363	L	81.9	Confident	76.7	Confident	6 Å²	6	53.8 Å²	53.8	3%	0.031	29%	0.287	C	S	.	.			trans	-101.8	150.2	179.3	-64.6	172.5	0	0	0	109.8	F365 T418 P485 H487 M488 V511 V513	L363-F365 HydrophobicContact CB-CD2 4.3Å; L363-F365 HydrophobicContact CB-CE2 3.46Å; L363-F365 VanDerWaalsContact CB-CE2 3.46Å; L363-F365 HydrophobicContact CB-CZ 3.68Å; L363-F365 HydrophobicContact CD1-CE2 4.29Å; L363-F365 HydrophobicContact CD1-CZ 3.71Å; L363-F365 HydrophobicContact CG-CZ 4.37Å; L363-T418 CarbonylContact O-C 3.5Å; L363-T418 WeakPolarHBondContact O-CA 3.41Å; L363-P485 HydrophobicContact CB-CG 4.47Å; L363-H487 HydrophobicContact CD2-CB 3.94Å; L363-M488 HydrophobicContact CD1-CB 4.07Å; L363-M488 HydrophobicContact CD1-CG 4.43Å; L363-M488 HydrophobicContact CD1-SD 3.98Å; L363-M488 HydrophobicContact CD2-CB 4.37Å; L363-V511 HydrophobicContact CD1-CG1 3.88Å; L363-V513 HydrophobicContact CD1-CG2 3.95Å; L363-V513 HydrophobicContact CD2-CG1 3.98Å; L363-V513 HydrophobicContact CD2-CG2 4.31Å; L363-V513 HydrophobicContact CG-CG2 4.36Å
364	S	83.1	Confident	79	Confident	57 Å²	57	47.4 Å²	47.4	40%	0.399	26%	0.258	S	S	.	.			trans	-118.5	126.1	173.5	-175.5	0	0	0	0	109.4	P485	S364-P485 WeakPolarHBondContact O-CG 3.44Å
365	F	86.4	Confident	80.8	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.009	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	141.7	-176.2	-56.3	-95.8	0	0	0	110.2	L363 T416 T417 P420 M482 P485 M488	L363-F365 HydrophobicContact CB-CD2 4.3Å; L363-F365 HydrophobicContact CB-CE2 3.46Å; L363-F365 VanDerWaalsContact CB-CE2 3.46Å; L363-F365 HydrophobicContact CB-CZ 3.68Å; L363-F365 HydrophobicContact CD1-CE2 4.29Å; L363-F365 HydrophobicContact CD1-CZ 3.71Å; L363-F365 HydrophobicContact CG-CZ 4.37Å; F365-T416 WeakPolarHBondContact O-CA 3.33Å; F365-T417 HydrophobicContact CB-CG2 3.82Å; F365-T417 HydrophobicContact CD2-CG2 4.27Å; F365-T417 HydrophobicContact CG-CG2 4.43Å; F365-T417 PolarHBondContact N-O 3.19Å; F365-T417 PolarHBondContact O-N 2.95Å; F365-P420 VanDerWaalsContact CE2-CA 3.48Å; F365-P420 HydrophobicContact CE2-CB 4.02Å; F365-P420 HydrophobicContact CE2-CG 3.85Å; F365-P420 HydrophobicContact CZ-CB 3.83Å; F365-P420 HydrophobicContact CZ-CG 4Å; F365-M482 HydrophobicContact CB-CE 3.74Å; F365-M482 HydrophobicContact CB-CG 4.4Å; F365-M482 HydrophobicContact CD1-CE 3.19Å; F365-M482 HydrophobicContact CD1-CG 4.34Å; F365-M482 HydrophobicContact CD2-CE 3.88Å; F365-M482 HydrophobicContact CE1-CE 3.64Å; F365-M482 HydrophobicContact CE2-CE 4.28Å; F365-M482 HydrophobicContact CG-CE 3.34Å; F365-M482 HydrophobicContact CZ-CE 4.17Å; F365-P485 HydrophobicContact CD1-CG 3.3Å; F365-P485 HydrophobicContact CD2-CG 4.42Å; F365-P485 HydrophobicContact CE1-CG 3.38Å; F365-P485 HydrophobicContact CE2-CG 4.46Å; F365-P485 HydrophobicContact CG-CG 3.86Å; F365-P485 HydrophobicContact CZ-CG 3.98Å; F365-M488 HydrophobicContact CE1-SD 3.7Å; F365-M488 HydrophobicContact CZ-SD 3.95Å
366	T	86.5	Confident	81.8	Confident	65 Å²	65	38.8 Å²	38.8	40%	0.399	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.5	167.1	45.2	0	0	0	0	109	T416 M482 D483	T366-T416 HydrophobicContact CG2-CG2 4.3Å; T366-M482 WeakPolarHBondContact O-CA 3.33Å; T366-D483 PolarHBondContact O-N 3.42Å; T366-D483 WeakPolarHBondContact OG1-CB 3.09Å; T366-D483 PolarHBondContact OG1-OD2 2.77Å
367	L	88.3	Confident	82.6	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	124.8	176.8	-76.6	130.8	0	0	0	109.5	V392 D414 F415 T417 P422 V424 P450 V480 R481 M482	L367-V392 HydrophobicContact CD1-CG1 4.26Å; L367-D414 CarbonylContact O-C 3.58Å; L367-D414 WeakPolarHBondContact O-CA 3.49Å; L367-F415 HydrophobicContact CB-CB 4.22Å; L367-F415 PolarHBondContact N-O 3.49Å; L367-F415 PolarHBondContact O-N 2.81Å; L367-T417 HydrophobicContact CD1-CG2 3.27Å; L367-P422 HydrophobicContact CD1-CB 4.31Å; L367-P422 HydrophobicContact CD1-CG 3.94Å; L367-P422 HydrophobicContact CD2-CG 4.1Å; L367-V424 HydrophobicContact CD2-CG2 4.4Å; L367-P450 HydrophobicContact CD2-CB 4.22Å; L367-P450 HydrophobicContact CD2-CG 3.58Å; L367-V480 HydrophobicContact CD2-CG1 4.07Å; L367-R481 CarbonylContact C-O 3.56Å; L367-R481 VanDerWaalsContact CA-O 3.3Å; L367-R481 WeakPolarHBondContact CA-O 3.42Å; L367-M482 HydrophobicContact CD2-CB 3.95Å; L367-M482 HydrophobicContact CD2-CG 4.07Å; L367-M482 HydrophobicContact CD2-SD 4.29Å; L367-M482 HydrophobicContact CG-CB 4.38Å; L367-M482 HydrophobicContact CG-CG 4.2Å
368	E	88.3	Confident	82.9	Confident	40 Å²	40	44.4 Å²	44.4	19%	0.187	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	119.9	172	176.2	-165	173.8	0	0	107.8	V370 Q412 V480 R481	E368-V370 HydrophobicContact CG-CG2 4.12Å; E368-Q412 HydrophobicContact CG-CG 3.72Å; E368-Q412 PolarHBondContact OE1-OE1 3.18Å; E368-V480 WeakPolarHBondContact O-CA 2.79Å; E368-R481 HydrophobicContact CB-CB 4.2Å; E368-R481 PolarHBondContact N-O 3.36Å; E368-R481 PolarHBondContact O-N 3.42Å; E368-R481 IonicContact OE1-NH1 3.05Å; E368-R481 PolarHBondContact OE1-NH1 3.33Å; E368-R481 VanDerWaalsContact OE1-NH1 3.15Å; E368-R481 WeakPolarHBondContact OE2-CD 3.42Å; E368-R481 IonicContact OE2-CZ 4Å; E368-R481 IonicContact OE2-NE 3.88Å; E368-R481 IonicContact OE2-NH1 3.82Å; E368-R481 PolarHBondContact OE2-NH1 3.37Å; E368-R481 VanDerWaalsContact OE2-NH1 3.08Å
369	I	89.8	Confident	82.9	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	119.4	177	-60.1	163.9	0	0	0	108.4	I371 M390 V392 Q412 G413 F415 V424 A479 V480	I369-I371 HydrophobicContact CG2-CG1 4.44Å; I369-M390 HydrophobicContact CB-SD 4.03Å; I369-M390 HydrophobicContact CG2-CG 4.08Å; I369-M390 HydrophobicContact CG2-SD 3.76Å; I369-V392 HydrophobicContact CD1-CG2 3.62Å; I369-Q412 CarbonylContact O-C 3.59Å; I369-Q412 WeakPolarHBondContact O-CA 3.27Å; I369-G413 PolarHBondContact N-O 3.32Å; I369-G413 PolarHBondContact O-N 3.25Å; I369-F415 HydrophobicContact CD1-CD2 3.8Å; I369-F415 HydrophobicContact CD1-CE2 3.7Å; I369-F415 HydrophobicContact CG1-CD2 4.46Å; I369-V424 HydrophobicContact CD1-CB 4.33Å; I369-V424 HydrophobicContact CD1-CG1 3.37Å; I369-V424 HydrophobicContact CD1-CG2 3.99Å; I369-V424 HydrophobicContact CG1-CG1 4.27Å; I369-A479 WeakPolarHBondContact CA-O 3.33Å; I369-V480 HydrophobicContact CG1-CG1 4.07Å; I369-V480 HydrophobicContact CG1-CG2 4.33Å
370	V	89.3	Confident	83.3	Confident	29 Å²	29	39.3 Å²	39.3	18%	0.176	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	115.1	177.8	-175.6	0	0	0	0	109	E368 Q412 L478 A479	E368-V370 HydrophobicContact CG-CG2 4.12Å; V370-Q412 HydrophobicContact CG2-CB 4.18Å; V370-Q412 HydrophobicContact CG2-CG 4.05Å; V370-L478 CarbonylContact O-C 3.56Å; V370-L478 WeakPolarHBondContact O-CA 3.43Å; V370-L478 WeakPolarHBondContact O-CB 3.45Å; V370-A479 HydrophobicContact CB-CB 4.45Å; V370-A479 PolarHBondContact N-O 3.01Å; V370-A479 PolarHBondContact O-N 3.25Å
371	I	89.8	Confident	83.5	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	124.6	175.2	-62.4	177.7	0	0	0	108.3	I369 C388 M390 T399 W409 T411 V426 I476 L478	I369-I371 HydrophobicContact CG2-CG1 4.44Å; I371-C388 HydrophobicContact CD1-CB 3.63Å; I371-M390 HydrophobicContact CD1-CG 3.47Å; I371-M390 VanDerWaalsContact CD1-CG 3.47Å; I371-M390 HydrophobicContact CD1-SD 3.85Å; I371-M390 HydrophobicContact CG1-CG 4.24Å; I371-M390 HydrophobicContact CG1-SD 4.12Å; I371-T399 HydrophobicContact CB-CG2 4.3Å; I371-T399 HydrophobicContact CD1-CG2 3.78Å; I371-W409 HydrophobicContact CG2-CB 4.47Å; I371-W409 HydrophobicContact CG2-CD2 4.41Å; I371-W409 HydrophobicContact CG2-CE3 3.83Å; I371-W409 CarbonylContact O-C 3.6Å; I371-T411 PolarHBondContact N-O 3.18Å; I371-V426 HydrophobicContact CD1-CG1 3.54Å; I371-V426 HydrophobicContact CD1-CG2 4.47Å; I371-V426 HydrophobicContact CG1-CG1 4.42Å; I371-I476 HydrophobicContact CG2-CD1 4.07Å; I371-I476 HydrophobicContact CG2-CG1 4.45Å; I371-L478 HydrophobicContact CG1-CB 4.35Å
372	M	88.8	Confident	83.5	Confident	78 Å²	78	42.3 Å²	42.3	38%	0.384	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-55.9	-176.3	-59	-168.9	81.7	0	0	112.9	Q408 W409 A458 K477	M372-Q408 CarbonylContact O-C 3.54Å; M372-Q408 WeakPolarHBondContact O-CA 3.33Å; M372-W409 CarbonylContact C-O 3.34Å; M372-W409 WeakPolarHBondContact CA-O 3.35Å; M372-W409 PolarHBondContact O-N 3.4Å; M372-A458 HydrophobicContact CG-CB 4.36Å; M372-A458 HydrophobicContact SD-CB 3.26Å; M372-A458 WeakPolarHBondContact SD-CB 3.28Å; M372-K477 HydrophobicContact CB-CB 4.32Å; M372-K477 HydrophobicContact CB-CD 4.32Å; M372-K477 HydrophobicContact CB-CG 4.22Å; M372-K477 WeakPolarHBondContact CB-O 3.13Å; M372-K477 PolarHBondContact N-O 2.9Å; M372-K477 HydrophobicContact SD-CD 4.07Å; M372-K477 HydrophobicContact SD-CG 4.2Å
373	E	89.7	Confident	83.6	Confident	37 Å²	37	46.6 Å²	46.6	17%	0.173	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	158.9	-176.3	61.1	177.6	-168.4	0	0	112.4	Q375 P407 Q408 I476 K477	E373-Q375 PolarHBondContact OE1-NE2 3.27Å; E373-P407 CarbonylContact C-O 3.54Å; E373-P407 VanDerWaalsContact CA-O 3.3Å; E373-P407 WeakPolarHBondContact CA-O 3.31Å; E373-Q408 HydrophobicContact CB-CB 4.41Å; E373-Q408 HydrophobicContact CB-CG 3.86Å; E373-Q408 PolarHBondContact OE2-NE2 3.44Å; E373-I476 CarbonylContact O-C 3.54Å; E373-K477 HydrophobicContact CG-CB 3.76Å; E373-K477 HydrophobicContact CG-CD 4.1Å; E373-K477 PolarHBondContact N-O 3.17Å; E373-K477 PolarHBondContact O-N 3.16Å
374	V	88.9	Confident	83.7	Confident	8 Å²	8	50.7 Å²	50.7	5%	0.048	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	135.1	169.8	167.2	0	0	0	0	109.6	P407 W409 L428 L474 K475 I476	V374-P407 HydrophobicContact CB-CB 4.27Å; V374-P407 HydrophobicContact CB-CG 4.16Å; V374-P407 PolarHBondContact N-O 3.23Å; V374-P407 VanDerWaalsContact O-CG 3.3Å; V374-P407 WeakPolarHBondContact O-CG 3.38Å; V374-W409 HydrophobicContact CB-CH2 4.43Å; V374-W409 HydrophobicContact CB-CZ3 4.02Å; V374-W409 HydrophobicContact CG2-CH2 4.1Å; V374-W409 HydrophobicContact CG2-CZ3 3.62Å; V374-L428 HydrophobicContact CG1-CD2 3.99Å; V374-L428 HydrophobicContact CG2-CD1 4.38Å; V374-L428 HydrophobicContact CG2-CD2 4.36Å; V374-L474 HydrophobicContact CG1-CD1 3.57Å; V374-L474 HydrophobicContact CG1-CG 4.24Å; V374-K475 CarbonylContact C-O 3.52Å; V374-K475 WeakPolarHBondContact CA-O 3.28Å; V374-I476 HydrophobicContact CG2-CB 3.98Å; V374-I476 HydrophobicContact CG2-CD1 3.93Å; V374-I476 HydrophobicContact CG2-CG1 3.73Å
375	Q	85.8	Confident	83.8	Confident	80 Å²	80	50.5 Å²	50.5	37%	0.374	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	141.6	179	-61.8	-176.9	1.7	0	0	110.1	E373 L460 K475	E373-Q375 PolarHBondContact OE1-NE2 3.27Å; Q375-L460 HydrophobicContact CG-CD2 4.49Å; Q375-K475 PolarHBondContact N-O 3.11Å; Q375-K475 PolarHBondContact O-N 3.26Å
376	G	80	Confident	83.9	Confident	41 Å²	41	50.4 Å²	50.4	42%	0.423	28%	0.277	S	S	.	.			trans	87.3	18	174	0	0	0	0	0	116	K378	G376-K378 PolarHBondContact O-N 3.43Å
377	L	82.1	Confident	84	Confident	28 Å²	28	48.3 Å²	48.3	15%	0.147	26%	0.262	C	S	.	.			trans	-76.5	115.2	174.3	-174.4	69.3	0	0	0	110.9	V380 V386 A404 L428 L443 L474	L377-V380 HydrophobicContact CD1-CG2 4.37Å; L377-V386 HydrophobicContact CD2-CG1 4.08Å; L377-A404 HydrophobicContact CD2-CB 4.01Å; L377-L428 HydrophobicContact CD1-CD2 4.28Å; L377-L443 HydrophobicContact CD1-CD1 3.91Å; L377-L474 HydrophobicContact CB-CD1 3.97Å; L377-L474 HydrophobicContact CD1-CD1 4.1Å
378	K	76.4	Confident	84.2	Confident	165 Å²	165	48.2 Å²	48.2	72%	0.717	26%	0.261	S	S	*	.			trans	-129.3	-17.1	179.9	-60.1	179.6	-179.1	177.9	0	113.5	G376 V380 D471	G376-K378 PolarHBondContact O-N 3.43Å; K378-V380 PolarHBondContact O-N 3Å; K378-D471 VanDerWaalsContact CA-OD1 3.28Å; K378-D471 WeakPolarHBondContact CA-OD1 3.31Å; K378-D471 WeakPolarHBondContact CB-OD1 3.34Å; K378-D471 PolarHBondContact N-OD1 2.95Å
379	S	71.8	Confident	84.2	Confident	39 Å²	39	47.3 Å²	47.3	27%	0.273	26%	0.258	S	S	.	.	S	Bend	trans	-74.2	-4.8	-176.8	66.4	0	0	0	0	115.2	D471	S379-D471 WeakPolarHBondContact CB-OD2 3.36Å; S379-D471 PolarHBondContact N-OD1 3.28Å; S379-D471 PolarHBondContact N-OD2 3.36Å; S379-D471 PolarHBondContact OG-OD2 2.95Å
380	V	77.8	Confident	84.3	Confident	27 Å²	27	47.3 Å²	47.3	16%	0.164	26%	0.259	C	S	.	.	S	Bend	trans	-125.1	140.6	-174.1	-177.8	0	0	0	0	110	L377 K378 R384 A404 T430 L443	L377-V380 HydrophobicContact CD1-CG2 4.37Å; K378-V380 PolarHBondContact O-N 3Å; V380-R384 HydrophobicContact CG1-CB 3.41Å; V380-R384 VanDerWaalsContact CG1-CB 3.41Å; V380-R384 HydrophobicContact CG1-CG 3.77Å; V380-A404 HydrophobicContact CB-CB 4.41Å; V380-A404 HydrophobicContact CG1-CB 4.03Å; V380-T430 HydrophobicContact CG2-CG2 4.38Å; V380-L443 HydrophobicContact CG2-CD1 3.83Å; V380-L443 HydrophobicContact CG2-CD2 3.67Å; V380-L443 HydrophobicContact CG2-CG 4.41Å
381	A	75.3	Confident	84.3	Confident	56 Å²	56	47.1 Å²	47.1	46%	0.463	26%	0.255	S	S	.	.			trans	-63.2	144.8	177.7	0	0	0	0	0	111.4	N383 R384	A381-N383 PolarHBondContact O-N 3.49Å; A381-R384 HydrophobicContact CB-CG 4.19Å; A381-R384 WeakPolarHBondContact O-CB 3.46Å; A381-R384 PolarHBondContact O-N 2.87Å; A381-R384 VanDerWaalsContact O-N 3.09Å
382	P	74.9	Confident	84.2	Confident	79 Å²	79	47.3 Å²	47.3	51%	0.513	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-28.9	-171.6	-24.7	32.9	0	0	0	115.1	S405	P382-S405 WeakPolarHBondContact O-CB 3.41Å; P382-S405 PolarHBondContact O-N 3.39Å; P382-S405 VanDerWaalsContact O-N 3.12Å
383	N	80.3	Confident	83.6	Confident	139 Å²	139	47.6 Å²	47.6	74%	0.743	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-0.8	-172.4	-28.7	1.1	0	0	0	113	A381	A381-N383 PolarHBondContact O-N 3.49Å
384	R	83.9	Confident	83	Confident	93 Å²	93	48.5 Å²	48.5	35%	0.351	28%	0.276	S	S	.	.	S	Bend	trans	-83.1	149.9	-178.6	-75.3	-98.7	179.4	176.2	-9.5	110.5	V380 A381 A404 E431 T433	V380-R384 HydrophobicContact CG1-CB 3.41Å; V380-R384 VanDerWaalsContact CG1-CB 3.41Å; V380-R384 HydrophobicContact CG1-CG 3.77Å; A381-R384 HydrophobicContact CB-CG 4.19Å; A381-R384 WeakPolarHBondContact O-CB 3.46Å; A381-R384 PolarHBondContact O-N 2.87Å; A381-R384 VanDerWaalsContact O-N 3.09Å; R384-A404 WeakPolarHBondContact O-CB 3.23Å; R384-A404 PolarHBondContact O-N 3.03Å; R384-E431 PolarHBondContact NH1-O 3.32Å; R384-E431 VanDerWaalsContact NH1-O 3.17Å; R384-T433 PolarHBondContact NH1-OG1 2.98Å; R384-T433 VanDerWaalsContact NH1-OG1 3.13Å; R384-T433 PolarHBondContact NH2-OG1 3.05Å
385	I	85.3	Confident	82.7	Confident	52 Å²	52	52.9 Å²	52.9	27%	0.267	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	135.2	175.3	-61.5	179.1	0	0	0	110.1	Q401 A402 T430 E431	I385-Q401 HydrophobicContact CG2-CB 3.49Å; I385-Q401 VanDerWaalsContact CG2-CB 3.49Å; I385-Q401 HydrophobicContact CG2-CG 3.62Å; I385-A402 WeakPolarHBondContact CA-O 3.4Å; I385-T430 WeakPolarHBondContact O-CA 3.42Å; I385-T430 PolarHBondContact O-OG1 2.88Å; I385-T430 VanDerWaalsContact O-OG1 3.05Å; I385-E431 HydrophobicContact CB-CB 4.39Å; I385-E431 PolarHBondContact O-N 3.18Å; I385-E431 VanDerWaalsContact O-N 3.16Å
386	V	88.9	Confident	82.7	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	148.9	172.8	-65.9	0	0	0	0	110.3	L377 A402 A404 P407 W409 L428 F429 L443	L377-V386 HydrophobicContact CD2-CG1 4.08Å; V386-A402 WeakPolarHBondContact CG2-O 3.43Å; V386-A402 PolarHBondContact N-O 3.2Å; V386-A402 PolarHBondContact O-N 3.4Å; V386-A404 HydrophobicContact CG1-CB 4.16Å; V386-P407 HydrophobicContact CG2-CB 3.94Å; V386-W409 HydrophobicContact CG2-CH2 4.25Å; V386-W409 HydrophobicContact CG2-CZ2 4.02Å; V386-L428 HydrophobicContact CB-CD1 4.28Å; V386-F429 VanDerWaalsContact CA-O 3.26Å; V386-F429 WeakPolarHBondContact CA-O 3.46Å; V386-F429 WeakPolarHBondContact CB-O 3.33Å; V386-L443 HydrophobicContact CG1-CD1 4.08Å
387	Y	89.9	Confident	83	Confident	22 Å²	22	56.7 Å²	56.7	9%	0.086	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	158.7	175.3	64.4	-93.7	0	0	0	110	T389 Q398 F429 D440	Y387-T389 HydrophobicContact CD2-CG2 4.16Å; Y387-T389 HydrophobicContact CE2-CG2 3.87Å; Y387-Q398 HydrophobicContact CD2-CG 3.59Å; Y387-Q398 HydrophobicContact CE2-CG 4.04Å; Y387-Q398 VanDerWaalsContact CE2-NE2 3.27Å; Y387-Q398 HydrophobicContact CG-CG 4.33Å; Y387-F429 HydrophobicContact CD1-CB 4.42Å; Y387-F429 HydrophobicContact CD2-CB 4.21Å; Y387-F429 HydrophobicContact CE1-CB 3.94Å; Y387-F429 HydrophobicContact CE2-CB 3.72Å; Y387-F429 AromaticContact CE2-CD2 3.99Å; Y387-F429 HydrophobicContact CE2-CD2 3.99Å; Y387-F429 HydrophobicContact CE2-CG 4.11Å; Y387-F429 PolarHBondContact N-O 2.81Å; Y387-F429 VanDerWaalsContact N-O 3.08Å; Y387-F429 PolarHBondContact O-N 3Å; Y387-D440 VanDerWaalsContact CE1-OD2 3.31Å; Y387-D440 WeakPolarHBondContact CE1-OD2 3.47Å; Y387-D440 WeakPolarHBondContact OH-CB 3.31Å; Y387-D440 PolarHBondContact OH-OD2 3.12Å
388	C	90.5	Very high	83.2	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	151.3	175.1	-66.1	0	0	0	0	110.9	I371 Q398 T399 V426 K427 L428	I371-C388 HydrophobicContact CD1-CB 3.63Å; C388-Q398 WeakPolarHBondContact O-CA 3.49Å; C388-T399 HydrophobicContact CB-CG2 3.8Å; C388-T399 PolarHBondContact N-OG1 3.25Å; C388-T399 PolarHBondContact O-N 2.96Å; C388-T399 PolarHBondContact O-OG1 3.33Å; C388-V426 HydrophobicContact CB-CG1 4.33Å; C388-K427 CarbonylContact C-O 3.13Å; C388-K427 VanDerWaalsContact CA-O 3.29Å; C388-K427 WeakPolarHBondContact CA-O 3.38Å; C388-L428 VanDerWaalsContact SG-CD1 3.54Å
389	T	89.6	Confident	83.7	Confident	20 Å²	20	52.7 Å²	52.7	12%	0.123	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	138.1	167.9	58.7	0	0	0	0	109.4	Y387 L397 Q398 V426 K427 F429	Y387-T389 HydrophobicContact CD2-CG2 4.16Å; Y387-T389 HydrophobicContact CE2-CG2 3.87Å; T389-L397 CarbonylContact C-O 3.6Å; T389-L397 VanDerWaalsContact CA-O 3.32Å; T389-L397 WeakPolarHBondContact CA-O 3.45Å; T389-Q398 HydrophobicContact CG2-CB 4.35Å; T389-Q398 HydrophobicContact CG2-CG 4.19Å; T389-V426 CarbonylContact O-C 3.5Å; T389-V426 VanDerWaalsContact O-CA 3.24Å; T389-V426 WeakPolarHBondContact O-CA 3.38Å; T389-K427 PolarHBondContact N-O 2.94Å; T389-K427 PolarHBondContact O-N 3.47Å; T389-K427 PolarHBondContact OG1-O 2.84Å; T389-F429 HydrophobicContact CG2-CD2 4.1Å; T389-F429 HydrophobicContact CG2-CE2 4.12Å; T389-F429 WeakPolarHBondContact OG1-CE2 3.46Å
390	M	91.2	Very high	84.4	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	116.4	175.5	-61.9	165.9	-75.1	0	0	107.4	I369 I371 K396 L397 T399 F415 V426	I369-M390 HydrophobicContact CB-SD 4.03Å; I369-M390 HydrophobicContact CG2-CG 4.08Å; I369-M390 HydrophobicContact CG2-SD 3.76Å; I371-M390 HydrophobicContact CD1-CG 3.47Å; I371-M390 VanDerWaalsContact CD1-CG 3.47Å; I371-M390 HydrophobicContact CD1-SD 3.85Å; I371-M390 HydrophobicContact CG1-CG 4.24Å; I371-M390 HydrophobicContact CG1-SD 4.12Å; M390-K396 CarbonylContact O-C 3.59Å; M390-K396 VanDerWaalsContact O-CA 3.31Å; M390-K396 WeakPolarHBondContact O-CA 3.43Å; M390-L397 HydrophobicContact CE-CB 3.87Å; M390-L397 PolarHBondContact N-O 3.3Å; M390-L397 PolarHBondContact O-N 2.68Å; M390-T399 HydrophobicContact CE-CG2 4.22Å; M390-F415 HydrophobicContact CB-CE2 3.99Å; M390-F415 HydrophobicContact CB-CZ 3.77Å; M390-V426 HydrophobicContact CG-CG2 4.31Å
391	E	89.6	Confident	84.8	Confident	24 Å²	24	60.5 Å²	60.5	11%	0.112	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.1	178.6	-177.5	-169.9	129.4	0	0	109.5	E395 K396 K425 K427	E391-E395 CarbonylContact C-O 3.49Å; E391-E395 VanDerWaalsContact CA-O 3.28Å; E391-E395 WeakPolarHBondContact CA-O 3.22Å; E391-K396 HydrophobicContact CB-CG 4.03Å; E391-K396 HydrophobicContact CG-CG 3.88Å; E391-K396 VanDerWaalsContact OE2-CE 3.24Å; E391-K396 WeakPolarHBondContact OE2-CE 3.35Å; E391-K396 IonicContact OE2-NZ 2.89Å; E391-K425 HydrophobicContact CB-CB 4.29Å; E391-K425 PolarHBondContact N-O 3.07Å; E391-K425 PolarHBondContact O-N 2.73Å; E391-K425 IonicContact OE1-NZ 3.42Å; E391-K425 PolarHBondContact OE1-NZ 2.64Å; E391-K427 IonicContact OE2-NZ 2.69Å
392	V	87.4	Confident	85.3	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.024	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	114.3	175.3	-174.6	0	0	0	0	108.4	L367 I369 G394 E395 F415 V424	L367-V392 HydrophobicContact CD1-CG1 4.26Å; I369-V392 HydrophobicContact CD1-CG2 3.62Å; V392-G394 PolarHBondContact O-N 3.38Å; V392-E395 PolarHBondContact N-O 3.41Å; V392-E395 PolarHBondContact O-N 2.82Å; V392-F415 HydrophobicContact CB-CB 4.19Å; V392-F415 HydrophobicContact CB-CD1 3.68Å; V392-F415 HydrophobicContact CB-CD2 4.45Å; V392-F415 HydrophobicContact CB-CE1 4.09Å; V392-F415 HydrophobicContact CB-CG 3.86Å; V392-F415 HydrophobicContact CG1-CB 4.31Å; V392-F415 HydrophobicContact CG1-CG 4.5Å; V392-F415 HydrophobicContact CG2-CB 4.17Å; V392-F415 HydrophobicContact CG2-CD1 3.74Å; V392-F415 HydrophobicContact CG2-CD2 3.67Å; V392-F415 HydrophobicContact CG2-CE1 3.93Å; V392-F415 HydrophobicContact CG2-CE2 3.88Å; V392-F415 HydrophobicContact CG2-CG 3.59Å; V392-F415 HydrophobicContact CG2-CZ 3.97Å; V392-V424 HydrophobicContact CG2-CG1 4.43Å; V392-V424 HydrophobicContact CG2-CG2 4.07Å
393	E	77.4	Confident	85.8	Confident	84 Å²	84	60.3 Å²	60.3	39%	0.393	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	22.4	176.4	-55.8	-61.5	148.5	0	0	115.8	H419 P422 V423	E393-H419 IonicContact OE1-ND1 3.99Å; E393-H419 PolarHBondContact OE1-ND1 3.45Å; E393-H419 IonicContact OE2-CE1 3.31Å; E393-H419 PolarHBondContact OE2-CE1 2.94Å; E393-H419 IonicContact OE2-ND1 3.2Å; E393-H419 PolarHBondContact OE2-ND1 3.2Å; E393-P422 WeakPolarHBondContact OE1-CA 3.41Å; E393-V423 PolarHBondContact OE1-N 2.88Å
394	G	75.7	Confident	85.9	Confident	56 Å²	56	54.3 Å²	54.3	58%	0.577	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.7	-19.6	179.5	0	0	0	0	0	114.5	V392	V392-G394 PolarHBondContact O-N 3.38Å
395	E	82.2	Confident	85.6	Confident	100 Å²	100	53 Å²	53	47%	0.467	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	132	171.7	-168.8	174.7	-169.1	0	0	109.7	E391 V392 F415	E391-E395 CarbonylContact C-O 3.49Å; E391-E395 VanDerWaalsContact CA-O 3.28Å; E391-E395 WeakPolarHBondContact CA-O 3.22Å; V392-E395 PolarHBondContact N-O 3.41Å; V392-E395 PolarHBondContact O-N 2.82Å; E395-F415 HydrophobicContact CB-CD1 4.14Å; E395-F415 HydrophobicContact CB-CE1 4.21Å; E395-F415 HydrophobicContact CG-CD1 4.06Å; E395-F415 HydrophobicContact CG-CE1 4.05Å
396	K	86	Confident	85.5	Confident	139 Å²	139	59.7 Å²	59.7	60%	0.604	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.2	-174.9	-69.5	-178.9	-179.2	176.3	0	110.9	M390 E391	M390-K396 CarbonylContact O-C 3.59Å; M390-K396 VanDerWaalsContact O-CA 3.31Å; M390-K396 WeakPolarHBondContact O-CA 3.43Å; E391-K396 HydrophobicContact CB-CG 4.03Å; E391-K396 HydrophobicContact CG-CG 3.88Å; E391-K396 VanDerWaalsContact OE2-CE 3.24Å; E391-K396 WeakPolarHBondContact OE2-CE 3.35Å; E391-K396 IonicContact OE2-NZ 2.89Å
397	L	86.9	Confident	85.2	Confident	62 Å²	62	60.4 Å²	60.4	33%	0.325	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.7	169.7	-66	176.6	0	0	0	109.7	T389 M390 F415	T389-L397 CarbonylContact C-O 3.6Å; T389-L397 VanDerWaalsContact CA-O 3.32Å; T389-L397 WeakPolarHBondContact CA-O 3.45Å; M390-L397 HydrophobicContact CE-CB 3.87Å; M390-L397 PolarHBondContact N-O 3.3Å; M390-L397 PolarHBondContact O-N 2.68Å; L397-F415 HydrophobicContact CB-CE1 4.42Å; L397-F415 HydrophobicContact CB-CZ 3.83Å; L397-F415 HydrophobicContact CD1-CE1 3.9Å; L397-F415 HydrophobicContact CD1-CE2 3.87Å; L397-F415 HydrophobicContact CD1-CZ 3.55Å; L397-F415 HydrophobicContact CG-CE1 3.88Å; L397-F415 HydrophobicContact CG-CE2 4.48Å; L397-F415 HydrophobicContact CG-CZ 3.68Å
398	Q	86.4	Confident	84.9	Confident	105 Å²	105	64.9 Å²	64.9	49%	0.491	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	144.5	-178.1	-175.1	179.1	-16.1	0	0	109.9	Y387 C388 T389	Y387-Q398 HydrophobicContact CD2-CG 3.59Å; Y387-Q398 HydrophobicContact CE2-CG 4.04Å; Y387-Q398 VanDerWaalsContact CE2-NE2 3.27Å; Y387-Q398 HydrophobicContact CG-CG 4.33Å; C388-Q398 WeakPolarHBondContact O-CA 3.49Å; T389-Q398 HydrophobicContact CG2-CB 4.35Å; T389-Q398 HydrophobicContact CG2-CG 4.19Å
399	T	87.6	Confident	84.7	Confident	5 Å²	5	66 Å²	66	3%	0.031	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-81.5	165.8	172.4	67.8	0	0	0	0	111.6	I371 C388 M390 W409	I371-T399 HydrophobicContact CB-CG2 4.3Å; I371-T399 HydrophobicContact CD1-CG2 3.78Å; C388-T399 HydrophobicContact CB-CG2 3.8Å; C388-T399 PolarHBondContact N-OG1 3.25Å; C388-T399 PolarHBondContact O-N 2.96Å; C388-T399 PolarHBondContact O-OG1 3.33Å; M390-T399 HydrophobicContact CE-CG2 4.22Å; T399-W409 HydrophobicContact CG2-CG 4.49Å; T399-W409 PolarHBondContact OG1-NE1 3.27Å
400	D	85.9	Confident	84.3	Confident	117 Å²	117	68.4 Å²	68.4	63%	0.626	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-59.2	157.7	169.9	-59.3	-53.9	0	0	0	111.8	W409 T411	D400-W409 PolarHBondContact O-NE1 3.1Å; D400-T411 PolarHBondContact OD2-OG1 3.3Å
401	Q	86.1	Confident	84	Confident	112 Å²	112	69.6 Å²	69.6	52%	0.523	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-73.9	128.7	175.4	-74.8	-174.3	-5.7	0	0	110.2	I385	I385-Q401 HydrophobicContact CG2-CB 3.49Å; I385-Q401 VanDerWaalsContact CG2-CB 3.49Å; I385-Q401 HydrophobicContact CG2-CG 3.62Å
402	A	86.2	Confident	83.8	Confident	14 Å²	14	73.1 Å²	73.1	12%	0.116	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	151.5	177.3	0	0	0	0	0	111.1	I385 V386 W409	I385-A402 WeakPolarHBondContact CA-O 3.4Å; V386-A402 WeakPolarHBondContact CG2-O 3.43Å; V386-A402 PolarHBondContact N-O 3.2Å; V386-A402 PolarHBondContact O-N 3.4Å; A402-W409 HydrophobicContact CB-CZ2 3.98Å
403	E	85.3	Confident	83.8	Confident	118 Å²	118	73 Å²	73	55%	0.551	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	141.1	173.5	-67.7	-175.6	-177.7	0	0	111.1	S405 R406	E403-S405 PolarHBondContact O-N 3.15Å; E403-S405 VanDerWaalsContact O-N 3.09Å; E403-S405 PolarHBondContact OE2-OG 2.94Å; E403-R406 CarbonylContact O-C 3.6Å; E403-R406 PolarHBondContact O-N 3.43Å
404	A	81.6	Confident	84.3	Confident	12 Å²	12	73.8 Å²	73.8	10%	0.099	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-21.1	176.5	0	0	0	0	0	113.3	L377 V380 R384 V386 R406	L377-A404 HydrophobicContact CD2-CB 4.01Å; V380-A404 HydrophobicContact CB-CB 4.41Å; V380-A404 HydrophobicContact CG1-CB 4.03Å; R384-A404 WeakPolarHBondContact O-CB 3.23Å; R384-A404 PolarHBondContact O-N 3.03Å; V386-A404 HydrophobicContact CG1-CB 4.16Å; A404-R406 VanDerWaalsContact C-N 3.35Å
405	S	78.4	Confident	84.9	Confident	65 Å²	65	71.2 Å²	71.2	46%	0.455	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-30	174.3	72.5	0	0	0	0	113.6	P382 E403	P382-S405 WeakPolarHBondContact O-CB 3.41Å; P382-S405 PolarHBondContact O-N 3.39Å; P382-S405 VanDerWaalsContact O-N 3.12Å; E403-S405 PolarHBondContact O-N 3.15Å; E403-S405 VanDerWaalsContact O-N 3.09Å; E403-S405 PolarHBondContact OE2-OG 2.94Å
406	R	82.9	Confident	85.1	Confident	194 Å²	194	71.3 Å²	71.3	73%	0.732	37%	0.371	S	S	*	.	S	Bend	trans	-146.2	76.1	178.1	-82.7	-176	169.8	165.1	-3.5	110.2	E403 A404 Q408	E403-R406 CarbonylContact O-C 3.6Å; E403-R406 PolarHBondContact O-N 3.43Å; A404-R406 VanDerWaalsContact C-N 3.35Å; R406-Q408 VanDerWaalsContact C-N 3.25Å; R406-Q408 PolarHBondContact O-N 2.84Å
407	P	81.8	Confident	85.1	Confident	14 Å²	14	65.1 Å²	65.1	9%	0.091	35%	0.345	C	S	.	.			trans	-78.8	75.5	-178.5	33.9	-36.2	0	0	0	110.5	E373 V374 V386 W409	E373-P407 CarbonylContact C-O 3.54Å; E373-P407 VanDerWaalsContact CA-O 3.3Å; E373-P407 WeakPolarHBondContact CA-O 3.31Å; V374-P407 HydrophobicContact CB-CB 4.27Å; V374-P407 HydrophobicContact CB-CG 4.16Å; V374-P407 PolarHBondContact N-O 3.23Å; V374-P407 VanDerWaalsContact O-CG 3.3Å; V374-P407 WeakPolarHBondContact O-CG 3.38Å; V386-P407 HydrophobicContact CG2-CB 3.94Å; P407-W409 HydrophobicContact CB-CH2 3.65Å; P407-W409 HydrophobicContact CB-CZ2 4.34Å; P407-W409 HydrophobicContact CB-CZ3 4Å; P407-W409 VanDerWaalsContact O-CZ3 3.26Å; P407-W409 WeakPolarHBondContact O-CZ3 3.44Å
408	Q	84.4	Confident	85	Confident	116 Å²	116	64.9 Å²	64.9	54%	0.542	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-119.7	137.6	178.4	-60	-171.1	-47.8	0	0	110.2	M372 E373 R406	M372-Q408 CarbonylContact O-C 3.54Å; M372-Q408 WeakPolarHBondContact O-CA 3.33Å; E373-Q408 HydrophobicContact CB-CB 4.41Å; E373-Q408 HydrophobicContact CB-CG 3.86Å; E373-Q408 PolarHBondContact OE2-NE2 3.44Å; R406-Q408 VanDerWaalsContact C-N 3.25Å; R406-Q408 PolarHBondContact O-N 2.84Å
409	W	87.1	Confident	84.9	Confident	24 Å²	24	61.2 Å²	61.2	9%	0.091	33%	0.33	C	S	.	.			trans	-133.1	156.8	-179	-59.5	-82.9	0	0	0	110.2	I371 M372 V374 V386 T399 D400 A402 P407 L428	I371-W409 HydrophobicContact CG2-CB 4.47Å; I371-W409 HydrophobicContact CG2-CD2 4.41Å; I371-W409 HydrophobicContact CG2-CE3 3.83Å; I371-W409 CarbonylContact O-C 3.6Å; M372-W409 CarbonylContact C-O 3.34Å; M372-W409 WeakPolarHBondContact CA-O 3.35Å; M372-W409 PolarHBondContact O-N 3.4Å; V374-W409 HydrophobicContact CB-CH2 4.43Å; V374-W409 HydrophobicContact CB-CZ3 4.02Å; V374-W409 HydrophobicContact CG2-CH2 4.1Å; V374-W409 HydrophobicContact CG2-CZ3 3.62Å; V386-W409 HydrophobicContact CG2-CH2 4.25Å; V386-W409 HydrophobicContact CG2-CZ2 4.02Å; T399-W409 HydrophobicContact CG2-CG 4.49Å; T399-W409 PolarHBondContact OG1-NE1 3.27Å; D400-W409 PolarHBondContact O-NE1 3.1Å; A402-W409 HydrophobicContact CB-CZ2 3.98Å; P407-W409 HydrophobicContact CB-CH2 3.65Å; P407-W409 HydrophobicContact CB-CZ2 4.34Å; P407-W409 HydrophobicContact CB-CZ3 4Å; P407-W409 VanDerWaalsContact O-CZ3 3.26Å; P407-W409 WeakPolarHBondContact O-CZ3 3.44Å; W409-L428 HydrophobicContact CH2-CD1 3.79Å; W409-L428 HydrophobicContact CZ2-CD1 4.38Å
410	G	80.8	Confident	84.6	Confident	70 Å²	70	61.1 Å²	61.1	72%	0.722	33%	0.329	S	S	*	.			trans	-122	16.4	167.8	0	0	0	0	0	111.9	Q412	G410-Q412 PolarHBondContact O-N 3.3Å
411	T	84.4	Confident	84.6	Confident	27 Å²	27	56.9 Å²	56.9	17%	0.166	30%	0.304	C	S	.	.			trans	-75.5	125	-170.8	-43.1	0	0	0	0	110.4	I371 D400	I371-T411 PolarHBondContact N-O 3.18Å; D400-T411 PolarHBondContact OD2-OG1 3.3Å
412	Q	85.5	Confident	84.6	Confident	98 Å²	98	51.5 Å²	51.5	46%	0.458	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.4	172.3	179.5	179.6	-27.4	0	0	109.3	E368 I369 V370 G410 D414	E368-Q412 HydrophobicContact CG-CG 3.72Å; E368-Q412 PolarHBondContact OE1-OE1 3.18Å; I369-Q412 CarbonylContact O-C 3.59Å; I369-Q412 WeakPolarHBondContact O-CA 3.27Å; V370-Q412 HydrophobicContact CG2-CB 4.18Å; V370-Q412 HydrophobicContact CG2-CG 4.05Å; G410-Q412 PolarHBondContact O-N 3.3Å; Q412-D414 PolarHBondContact NE2-OD1 2.69Å; Q412-D414 PolarHBondContact NE2-OD2 2.73Å
413	G	87	Confident	84.6	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118.8	170.7	0	0	0	0	0	110.4	I369	I369-G413 PolarHBondContact N-O 3.32Å; I369-G413 PolarHBondContact O-N 3.25Å
414	D	88.3	Confident	84.8	Confident	100 Å²	100	45.6 Å²	45.6	54%	0.535	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	127.3	176	-62.5	-30.9	0	0	0	109.7	L367 Q412	L367-D414 CarbonylContact O-C 3.58Å; L367-D414 WeakPolarHBondContact O-CA 3.49Å; Q412-D414 PolarHBondContact NE2-OD1 2.69Å; Q412-D414 PolarHBondContact NE2-OD2 2.73Å
415	F	88.6	Confident	85.2	Confident	3 Å²	3	48.1 Å²	48.1	1%	0.013	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	153	-179.1	-61.7	-92.2	0	0	0	110.4	L367 I369 M390 V392 E395 L397	L367-F415 HydrophobicContact CB-CB 4.22Å; L367-F415 PolarHBondContact N-O 3.49Å; L367-F415 PolarHBondContact O-N 2.81Å; I369-F415 HydrophobicContact CD1-CD2 3.8Å; I369-F415 HydrophobicContact CD1-CE2 3.7Å; I369-F415 HydrophobicContact CG1-CD2 4.46Å; M390-F415 HydrophobicContact CB-CE2 3.99Å; M390-F415 HydrophobicContact CB-CZ 3.77Å; V392-F415 HydrophobicContact CB-CB 4.19Å; V392-F415 HydrophobicContact CB-CD1 3.68Å; V392-F415 HydrophobicContact CB-CD2 4.45Å; V392-F415 HydrophobicContact CB-CE1 4.09Å; V392-F415 HydrophobicContact CB-CG 3.86Å; V392-F415 HydrophobicContact CG1-CB 4.31Å; V392-F415 HydrophobicContact CG1-CG 4.5Å; V392-F415 HydrophobicContact CG2-CB 4.17Å; V392-F415 HydrophobicContact CG2-CD1 3.74Å; V392-F415 HydrophobicContact CG2-CD2 3.67Å; V392-F415 HydrophobicContact CG2-CE1 3.93Å; V392-F415 HydrophobicContact CG2-CE2 3.88Å; V392-F415 HydrophobicContact CG2-CG 3.59Å; V392-F415 HydrophobicContact CG2-CZ 3.97Å; E395-F415 HydrophobicContact CB-CD1 4.14Å; E395-F415 HydrophobicContact CB-CE1 4.21Å; E395-F415 HydrophobicContact CG-CD1 4.06Å; E395-F415 HydrophobicContact CG-CE1 4.05Å; L397-F415 HydrophobicContact CB-CE1 4.42Å; L397-F415 HydrophobicContact CB-CZ 3.83Å; L397-F415 HydrophobicContact CD1-CE1 3.9Å; L397-F415 HydrophobicContact CD1-CE2 3.87Å; L397-F415 HydrophobicContact CD1-CZ 3.55Å; L397-F415 HydrophobicContact CG-CE1 3.88Å; L397-F415 HydrophobicContact CG-CE2 4.48Å; L397-F415 HydrophobicContact CG-CZ 3.68Å
416	T	85.4	Confident	85.7	Confident	101 Å²	101	45 Å²	45	62%	0.62	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	133	170	59.3	0	0	0	0	109.9	F365 T366	F365-T416 WeakPolarHBondContact O-CA 3.33Å; T366-T416 HydrophobicContact CG2-CG2 4.3Å
417	T	85.8	Confident	86.1	Confident	9 Å²	9	37.8 Å²	37.8	6%	0.055	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150	178.2	-167.8	0	0	0	0	111.3	F365 L367 H419 P422	F365-T417 HydrophobicContact CB-CG2 3.82Å; F365-T417 HydrophobicContact CD2-CG2 4.27Å; F365-T417 HydrophobicContact CG-CG2 4.43Å; F365-T417 PolarHBondContact N-O 3.19Å; F365-T417 PolarHBondContact O-N 2.95Å; L367-T417 HydrophobicContact CD1-CG2 3.27Å; T417-H419 PolarHBondContact OG1-N 2.81Å; T417-P422 HydrophobicContact CG2-CB 3.96Å; T417-P422 HydrophobicContact CG2-CG 4.09Å
418	T	84.9	Confident	86.5	Confident	58 Å²	58	37.1 Å²	37.1	36%	0.356	21%	0.206	S	C	.	.	S	Bend	trans	-98	-0.1	169.9	56.7	0	0	0	0	113	V362 L363 P420	V362-T418 HydrophobicContact CG1-CG2 4.28Å; L363-T418 CarbonylContact O-C 3.5Å; L363-T418 WeakPolarHBondContact O-CA 3.41Å; T418-P420 WeakPolarHBondContact O-CD 3.4Å
419	H	84.4	Confident	86.7	Confident	28 Å²	28	33.2 Å²	33.2	13%	0.13	19%	0.187	C	C	.	.			trans	-90.3	122.1	-178.5	-64.8	177.5	0	0	0	109.9	E393 T417 R421 P422 S530	E393-H419 IonicContact OE1-ND1 3.99Å; E393-H419 PolarHBondContact OE1-ND1 3.45Å; E393-H419 IonicContact OE2-CE1 3.31Å; E393-H419 PolarHBondContact OE2-CE1 2.94Å; E393-H419 IonicContact OE2-ND1 3.2Å; E393-H419 PolarHBondContact OE2-ND1 3.2Å; T417-H419 PolarHBondContact OG1-N 2.81Å; H419-R421 PolarHBondContact O-N 3.43Å; H419-R421 VanDerWaalsContact O-N 3.15Å; H419-P422 HydrophobicContact CB-CB 4.33Å; H419-P422 WeakPolarHBondContact O-CD 3.47Å; H419-S530 PolarHBondContact CD2-N 3.2Å
420	P	82.4	Confident	86.7	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.013	19%	0.186	C	C	.	.	S	Bend	trans	-63.9	-18.3	173.4	-24.5	36.1	0	0	0	113.9	F365 T418 V511 Y525	F365-P420 VanDerWaalsContact CE2-CA 3.48Å; F365-P420 HydrophobicContact CE2-CB 4.02Å; F365-P420 HydrophobicContact CE2-CG 3.85Å; F365-P420 HydrophobicContact CZ-CB 3.83Å; F365-P420 HydrophobicContact CZ-CG 4Å; T418-P420 WeakPolarHBondContact O-CD 3.4Å; P420-V511 HydrophobicContact CB-CG2 4.41Å; P420-Y525 HydrophobicContact CB-CG 4.34Å; P420-Y525 HydrophobicContact CG-CD1 3.59Å; P420-Y525 HydrophobicContact CG-CD2 4.2Å; P420-Y525 HydrophobicContact CG-CE1 3.74Å; P420-Y525 HydrophobicContact CG-CE2 4.35Å; P420-Y525 HydrophobicContact CG-CG 3.82Å
421	R	85	Confident	86.7	Confident	28 Å²	28	32.9 Å²	32.9	11%	0.106	17%	0.169	C	C	.	.	S	Bend	trans	-131.4	77.3	173.7	-67.9	-171.9	63.9	-149.1	-8.6	109.3	H419 Y493 Y509 E527	H419-R421 PolarHBondContact O-N 3.43Å; H419-R421 VanDerWaalsContact O-N 3.15Å; R421-Y493 PolarHBondContact NE-OH 3.32Å; R421-Y493 PolarHBondContact NH1-OH 3.35Å; R421-Y493 PolarHBondContact NH2-OH 2.89Å; R421-Y509 HydrophobicContact CG-CD1 3.97Å; R421-Y509 HydrophobicContact CG-CE1 4.09Å; R421-Y509 HydrophobicContact CG-CG 4.39Å; R421-E527 IonicContact CZ-OE1 3.43Å; R421-E527 VanDerWaalsContact CZ-OE1 3.23Å; R421-E527 IonicContact NH1-OE1 3.93Å; R421-E527 PolarHBondContact NH1-OE1 2.97Å; R421-E527 IonicContact NH2-OE1 2.87Å; R421-E527 PolarHBondContact NH2-OE1 2.87Å
422	P	86.1	Confident	86.1	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.174	C	C	.	.			trans	-74.6	161	179.4	34.3	-34.9	0	0	0	110.3	L367 E393 T417 H419 P450 M482	L367-P422 HydrophobicContact CD1-CB 4.31Å; L367-P422 HydrophobicContact CD1-CG 3.94Å; L367-P422 HydrophobicContact CD2-CG 4.1Å; E393-P422 WeakPolarHBondContact OE1-CA 3.41Å; T417-P422 HydrophobicContact CG2-CB 3.96Å; T417-P422 HydrophobicContact CG2-CG 4.09Å; H419-P422 HydrophobicContact CB-CB 4.33Å; H419-P422 WeakPolarHBondContact O-CD 3.47Å; P422-P450 HydrophobicContact CG-CG 3.88Å; P422-M482 HydrophobicContact CG-CE 4.26Å; P422-M482 HydrophobicContact CG-SD 4.23Å
423	V	86.6	Confident	84.9	Confident	8 Å²	8	33.6 Å²	33.6	5%	0.048	18%	0.182	C	C	.	.			trans	-109.1	111.8	174.6	-175	0	0	0	0	109.6	E393 K425 I447 Y449 K528	E393-V423 PolarHBondContact OE1-N 2.88Å; V423-K425 HydrophobicContact CG1-CG 4.17Å; V423-I447 HydrophobicContact CG1-CG2 3.56Å; V423-Y449 HydrophobicContact CB-CE1 4.4Å; V423-Y449 HydrophobicContact CG1-CE1 4.16Å; V423-Y449 HydrophobicContact CG2-CD1 3.9Å; V423-Y449 HydrophobicContact CG2-CE1 3.55Å; V423-K528 HydrophobicContact CG2-CD 4.33Å; V423-K528 HydrophobicContact CG2-CG 3.76Å
424	V	88.5	Confident	83.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120	175.2	177.6	0	0	0	0	108.3	L367 I369 V392 V426 I447 L448 P450 V480	L367-V424 HydrophobicContact CD2-CG2 4.4Å; I369-V424 HydrophobicContact CD1-CB 4.33Å; I369-V424 HydrophobicContact CD1-CG1 3.37Å; I369-V424 HydrophobicContact CD1-CG2 3.99Å; I369-V424 HydrophobicContact CG1-CG1 4.27Å; V392-V424 HydrophobicContact CG2-CG1 4.43Å; V392-V424 HydrophobicContact CG2-CG2 4.07Å; V424-V426 HydrophobicContact CG1-CG2 4.18Å; V424-I447 CarbonylContact O-C 3.55Å; V424-I447 WeakPolarHBondContact O-CA 3.47Å; V424-L448 HydrophobicContact CB-CB 4.33Å; V424-L448 PolarHBondContact N-O 3.45Å; V424-L448 PolarHBondContact O-N 2.97Å; V424-P450 HydrophobicContact CG2-CG 3.77Å; V424-V480 HydrophobicContact CG2-CG1 4.43Å
425	K	90.2	Very high	81.9	Confident	64 Å²	64	38.3 Å²	38.3	28%	0.278	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.4	173.6	-50.6	-179.6	-160.1	141.8	0	109	E391 V423 V446 I447	E391-K425 HydrophobicContact CB-CB 4.29Å; E391-K425 PolarHBondContact N-O 3.07Å; E391-K425 PolarHBondContact O-N 2.73Å; E391-K425 IonicContact OE1-NZ 3.42Å; E391-K425 PolarHBondContact OE1-NZ 2.64Å; V423-K425 HydrophobicContact CG1-CG 4.17Å; K425-V446 WeakPolarHBondContact CA-O 3.48Å; K425-I447 HydrophobicContact CG-CG1 4.23Å; K425-I447 HydrophobicContact CG-CG2 4.46Å
426	V	90.5	Very high	80.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124.2	172.4	-179.4	0	0	0	0	108.8	I371 C388 T389 M390 V424 R445 V446 I476 L478	I371-V426 HydrophobicContact CD1-CG1 3.54Å; I371-V426 HydrophobicContact CD1-CG2 4.47Å; I371-V426 HydrophobicContact CG1-CG1 4.42Å; C388-V426 HydrophobicContact CB-CG1 4.33Å; T389-V426 CarbonylContact O-C 3.5Å; T389-V426 VanDerWaalsContact O-CA 3.24Å; T389-V426 WeakPolarHBondContact O-CA 3.38Å; M390-V426 HydrophobicContact CG-CG2 4.31Å; V424-V426 HydrophobicContact CG1-CG2 4.18Å; V426-R445 CarbonylContact O-C 3.59Å; V426-R445 VanDerWaalsContact O-CA 3.27Å; V426-R445 WeakPolarHBondContact O-CA 3.18Å; V426-V446 HydrophobicContact CB-CG1 3.68Å; V426-V446 HydrophobicContact CG2-CG1 4.45Å; V426-V446 PolarHBondContact N-O 2.9Å; V426-V446 PolarHBondContact O-N 3.46Å; V426-I476 HydrophobicContact CG1-CD1 3.74Å; V426-L478 HydrophobicContact CB-CD2 4.42Å; V426-L478 HydrophobicContact CG2-CD2 4.2Å
427	K	91.3	Very high	79.2	Confident	42 Å²	42	43.8 Å²	43.8	18%	0.183	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134.1	-178.7	-63.4	177.1	177.5	175.5	0	110.2	C388 T389 E391 F429 G444 R445	C388-K427 CarbonylContact C-O 3.13Å; C388-K427 VanDerWaalsContact CA-O 3.29Å; C388-K427 WeakPolarHBondContact CA-O 3.38Å; T389-K427 PolarHBondContact N-O 2.94Å; T389-K427 PolarHBondContact O-N 3.47Å; T389-K427 PolarHBondContact OG1-O 2.84Å; E391-K427 IonicContact OE2-NZ 2.69Å; K427-F429 HydrophobicContact CB-CD2 4.19Å; K427-F429 HydrophobicContact CB-CE2 3.49Å; K427-F429 VanDerWaalsContact CB-CE2 3.49Å; K427-F429 HydrophobicContact CB-CZ 4.1Å; K427-F429 HydrophobicContact CD-CE2 4.09Å; K427-F429 HydrophobicContact CD-CZ 4.01Å; K427-F429 HydrophobicContact CG-CE2 4.48Å; K427-G444 WeakPolarHBondContact CA-O 3.4Å; K427-R445 HydrophobicContact CG-CB 3.87Å
428	L	89.3	Confident	77.8	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	129.5	175.3	178.5	69.6	0	0	0	109.6	V374 L377 V386 C388 W409 L443 G444 M463 L474	V374-L428 HydrophobicContact CG1-CD2 3.99Å; V374-L428 HydrophobicContact CG2-CD1 4.38Å; V374-L428 HydrophobicContact CG2-CD2 4.36Å; L377-L428 HydrophobicContact CD1-CD2 4.28Å; V386-L428 HydrophobicContact CB-CD1 4.28Å; C388-L428 VanDerWaalsContact SG-CD1 3.54Å; W409-L428 HydrophobicContact CH2-CD1 3.79Å; W409-L428 HydrophobicContact CZ2-CD1 4.38Å; L428-L443 HydrophobicContact CB-CB 4.46Å; L428-L443 HydrophobicContact CD2-CB 4.01Å; L428-L443 HydrophobicContact CD2-CD1 4.03Å; L428-L443 HydrophobicContact CG-CB 4.13Å; L428-L443 HydrophobicContact CG-CD1 4.04Å; L428-L443 PolarHBondContact O-N 2.92Å; L428-G444 PolarHBondContact N-O 3.4Å; L428-M463 HydrophobicContact CB-CE 3.73Å; L428-M463 HydrophobicContact CB-SD 4.46Å; L428-L474 HydrophobicContact CD2-CD2 4.03Å
429	F	88.4	Confident	77.1	Confident	35 Å²	35	57.3 Å²	57.3	15%	0.154	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	156.8	179.6	-70.9	-85.8	0	0	0	111.4	V386 Y387 T389 K427 D440 K441 E442	V386-F429 VanDerWaalsContact CA-O 3.26Å; V386-F429 WeakPolarHBondContact CA-O 3.46Å; V386-F429 WeakPolarHBondContact CB-O 3.33Å; Y387-F429 HydrophobicContact CD1-CB 4.42Å; Y387-F429 HydrophobicContact CD2-CB 4.21Å; Y387-F429 HydrophobicContact CE1-CB 3.94Å; Y387-F429 HydrophobicContact CE2-CB 3.72Å; Y387-F429 AromaticContact CE2-CD2 3.99Å; Y387-F429 HydrophobicContact CE2-CD2 3.99Å; Y387-F429 HydrophobicContact CE2-CG 4.11Å; Y387-F429 PolarHBondContact N-O 2.81Å; Y387-F429 VanDerWaalsContact N-O 3.08Å; Y387-F429 PolarHBondContact O-N 3Å; T389-F429 HydrophobicContact CG2-CD2 4.1Å; T389-F429 HydrophobicContact CG2-CE2 4.12Å; T389-F429 WeakPolarHBondContact OG1-CE2 3.46Å; K427-F429 HydrophobicContact CB-CD2 4.19Å; K427-F429 HydrophobicContact CB-CE2 3.49Å; K427-F429 VanDerWaalsContact CB-CE2 3.49Å; K427-F429 HydrophobicContact CB-CZ 4.1Å; K427-F429 HydrophobicContact CD-CE2 4.09Å; K427-F429 HydrophobicContact CD-CZ 4.01Å; K427-F429 HydrophobicContact CG-CE2 4.48Å; F429-D440 HydrophobicContact CB-CB 4.41Å; F429-D440 HydrophobicContact CD1-CB 4.18Å; F429-K441 WeakPolarHBondContact CA-O 3.36Å; F429-E442 HydrophobicContact CD1-CB 4.14Å; F429-E442 HydrophobicContact CE1-CB 3.72Å; F429-E442 HydrophobicContact CE1-CG 4.3Å; F429-E442 HydrophobicContact CZ-CB 4.31Å; F429-E442 HydrophobicContact CZ-CG 4.43Å
430	T	87.1	Confident	77	Confident	11 Å²	11	58.2 Å²	58.2	7%	0.067	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	141.8	165.3	-174.8	0	0	0	0	110.5	V380 I385 K441 L443	V380-T430 HydrophobicContact CG2-CG2 4.38Å; I385-T430 WeakPolarHBondContact O-CA 3.42Å; I385-T430 PolarHBondContact O-OG1 2.88Å; I385-T430 VanDerWaalsContact O-OG1 3.05Å; T430-K441 HydrophobicContact CG2-CB 3.99Å; T430-K441 PolarHBondContact N-O 2.91Å; T430-K441 VanDerWaalsContact N-O 3.08Å; T430-K441 PolarHBondContact O-N 3.43Å; T430-L443 HydrophobicContact CG2-CD1 4.11Å; T430-L443 HydrophobicContact CG2-CD2 3.89Å; T430-L443 HydrophobicContact CG2-CG 4.06Å
431	E	80.6	Confident	77	Confident	76 Å²	76	65 Å²	65	36%	0.355	35%	0.352	S	S	.	.			trans	-67.6	131.7	-177.1	-168.6	179.5	-152.6	0	0	112	R384 I385 T433 D440	R384-E431 PolarHBondContact NH1-O 3.32Å; R384-E431 VanDerWaalsContact NH1-O 3.17Å; I385-E431 HydrophobicContact CB-CB 4.39Å; I385-E431 PolarHBondContact O-N 3.18Å; I385-E431 VanDerWaalsContact O-N 3.16Å; E431-T433 PolarHBondContact O-N 3.42Å; E431-D440 WeakPolarHBondContact CA-OD1 3.42Å
432	S	73.1	Confident	77	Confident	39 Å²	39	66.3 Å²	66.3	27%	0.273	36%	0.359	S	S	.	.			trans	-88.7	101.8	-179.3	53.6	0	0	0	0	111.7	G434 D440	S432-G434 PolarHBondContact O-N 2.61Å; S432-D440 PolarHBondContact N-OD1 3.06Å; S432-D440 PolarHBondContact OG-OD1 2.84Å
433	T	58.8	Low	77	Confident	101 Å²	101	66.5 Å²	66.5	62%	0.62	36%	0.361	S	S	*	.			trans	-74.6	15.8	-179.2	60.4	0	0	0	0	115	R384 E431	R384-T433 PolarHBondContact NH1-OG1 2.98Å; R384-T433 VanDerWaalsContact NH1-OG1 3.13Å; R384-T433 PolarHBondContact NH2-OG1 3.05Å; E431-T433 PolarHBondContact O-N 3.42Å
434	G	59.6	Low	77	Confident	42 Å²	42	66.1 Å²	66.1	43%	0.433	36%	0.358	S	S	.	.			trans	-103.8	128.4	-173.9	0	0	0	0	0	111.9	S432 L436 A437	S432-G434 PolarHBondContact O-N 2.61Å; G434-L436 PolarHBondContact O-N 3.02Å; G434-A437 PolarHBondContact O-N 3.02Å
435	V	54.4	Low	77	Confident	157 Å²	157	71.6 Å²	71.6	95%	0.952	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-9.5	-178.1	-175.9	0	0	0	0	114.1
436	L	57.6	Low	77.1	Confident	168 Å²	168	69 Å²	69	88%	0.88	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.8	5.9	179.6	-67.7	168.4	0	0	0	114	G434 L438	G434-L436 PolarHBondContact O-N 3.02Å; L436-L438 PolarHBondContact O-N 3.49Å
437	A	57.7	Low	77	Confident	52 Å²	52	72.3 Å²	72.3	43%	0.43	39%	0.385	S	S	.	.			trans	-83.8	115.2	178.2	0	0	0	0	0	110.1	G434	G434-A437 PolarHBondContact O-N 3.02Å
438	L	58	Low	76.8	Confident	177 Å²	177	71.4 Å²	71.4	93%	0.927	38%	0.382	S	S	*	.			trans	-82	-18.9	179.8	-79.2	150.3	0	0	0	113.1	L436	L436-L438 PolarHBondContact O-N 3.49Å
439	E	69.9	Low	76.6	Confident	174 Å²	174	76.5 Å²	76.5	81%	0.813	40%	0.402	S	S	*	.	S	Bend	trans	-146.5	145.2	-178.5	-65.2	-175.3	173.4	0	0	111.7
440	D	81.4	Confident	76.4	Confident	46 Å²	46	75.2 Å²	75.2	25%	0.246	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-69.8	151.2	175.4	-77.2	-25.3	0	0	0	112.7	Y387 F429 E431 S432 E442	Y387-D440 VanDerWaalsContact CE1-OD2 3.31Å; Y387-D440 WeakPolarHBondContact CE1-OD2 3.47Å; Y387-D440 WeakPolarHBondContact OH-CB 3.31Å; Y387-D440 PolarHBondContact OH-OD2 3.12Å; F429-D440 HydrophobicContact CB-CB 4.41Å; F429-D440 HydrophobicContact CD1-CB 4.18Å; E431-D440 WeakPolarHBondContact CA-OD1 3.42Å; S432-D440 PolarHBondContact N-OD1 3.06Å; S432-D440 PolarHBondContact OG-OD1 2.84Å; D440-E442 PolarHBondContact O-N 2.98Å
441	K	83.3	Confident	76.2	Confident	146 Å²	146	75.9 Å²	75.9	64%	0.635	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	118.8	-173.2	-174.2	-178.6	178.5	-173.8	0	111.3	F429 T430 L443	F429-K441 WeakPolarHBondContact CA-O 3.36Å; T430-K441 HydrophobicContact CG2-CB 3.99Å; T430-K441 PolarHBondContact N-O 2.91Å; T430-K441 VanDerWaalsContact N-O 3.08Å; T430-K441 PolarHBondContact O-N 3.43Å; K441-L443 PolarHBondContact O-N 3.42Å
442	E	85.8	Confident	76	Confident	54 Å²	54	73 Å²	73	25%	0.252	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	122.3	172.1	-171.6	-178.2	137.4	0	0	110.5	F429 D440 R445	F429-E442 HydrophobicContact CD1-CB 4.14Å; F429-E442 HydrophobicContact CE1-CB 3.72Å; F429-E442 HydrophobicContact CE1-CG 4.3Å; F429-E442 HydrophobicContact CZ-CB 4.31Å; F429-E442 HydrophobicContact CZ-CG 4.43Å; D440-E442 PolarHBondContact O-N 2.98Å; E442-R445 WeakPolarHBondContact OE1-CD 3.41Å
443	L	84.7	Confident	76.1	Confident	5 Å²	5	75.8 Å²	75.8	3%	0.026	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-31.9	179.4	-63.6	173.9	0	0	0	112.3	L377 V380 V386 L428 T430 K441 P466	L377-L443 HydrophobicContact CD1-CD1 3.91Å; V380-L443 HydrophobicContact CG2-CD1 3.83Å; V380-L443 HydrophobicContact CG2-CD2 3.67Å; V380-L443 HydrophobicContact CG2-CG 4.41Å; V386-L443 HydrophobicContact CG1-CD1 4.08Å; L428-L443 HydrophobicContact CB-CB 4.46Å; L428-L443 HydrophobicContact CD2-CB 4.01Å; L428-L443 HydrophobicContact CD2-CD1 4.03Å; L428-L443 HydrophobicContact CG-CB 4.13Å; L428-L443 HydrophobicContact CG-CD1 4.04Å; L428-L443 PolarHBondContact O-N 2.92Å; T430-L443 HydrophobicContact CG2-CD1 4.11Å; T430-L443 HydrophobicContact CG2-CD2 3.89Å; T430-L443 HydrophobicContact CG2-CG 4.06Å; K441-L443 PolarHBondContact O-N 3.42Å; L443-P466 VanDerWaalsContact O-CD 3.25Å; L443-P466 WeakPolarHBondContact O-CD 3.49Å
444	G	86.3	Confident	76.8	Confident	0 Å²	0	73 Å²	73	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	162	177.2	0	0	0	0	0	112	K427 L428 M463 V464	K427-G444 WeakPolarHBondContact CA-O 3.4Å; L428-G444 PolarHBondContact N-O 3.4Å; G444-M463 VanDerWaalsContact C-CE 3.48Å; G444-M463 VanDerWaalsContact O-CE 3.29Å; G444-M463 WeakPolarHBondContact O-CE 3.46Å; G444-V464 WeakPolarHBondContact CA-O 3.31Å
445	R	89.9	Confident	77.4	Confident	114 Å²	114	73.7 Å²	73.7	43%	0.43	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	148.8	178.7	68.5	-176.8	-172.3	-165.3	2.3	112.5	V426 K427 E442 V464	V426-R445 CarbonylContact O-C 3.59Å; V426-R445 VanDerWaalsContact O-CA 3.27Å; V426-R445 WeakPolarHBondContact O-CA 3.18Å; K427-R445 HydrophobicContact CG-CB 3.87Å; E442-R445 WeakPolarHBondContact OE1-CD 3.41Å; R445-V464 HydrophobicContact CG-CB 4.24Å; R445-V464 PolarHBondContact N-O 3.28Å; R445-V464 PolarHBondContact O-N 2.99Å
446	V	90.7	Very high	78.3	Confident	9 Å²	9	72.2 Å²	72.2	6%	0.055	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	141.7	169.5	63.9	0	0	0	0	109.1	K425 V426 L448 H461 I476 L478	K425-V446 WeakPolarHBondContact CA-O 3.48Å; V426-V446 HydrophobicContact CB-CG1 3.68Å; V426-V446 HydrophobicContact CG2-CG1 4.45Å; V426-V446 PolarHBondContact N-O 2.9Å; V426-V446 PolarHBondContact O-N 3.46Å; V446-L448 HydrophobicContact CG2-CD2 3.75Å; V446-L448 HydrophobicContact CG2-CG 4.1Å; V446-H461 HydrophobicContact CG2-CB 3.9Å; V446-I476 HydrophobicContact CB-CG2 4.32Å; V446-I476 HydrophobicContact CG1-CG2 3.81Å; V446-L478 HydrophobicContact CG1-CD2 4.04Å
447	I	89	Confident	79.4	Confident	71 Å²	71	67.5 Å²	67.5	36%	0.364	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.6	176.8	-55.7	179.1	0	0	0	107.3	V423 V424 K425 Y449	V423-I447 HydrophobicContact CG1-CG2 3.56Å; V424-I447 CarbonylContact O-C 3.55Å; V424-I447 WeakPolarHBondContact O-CA 3.47Å; K425-I447 HydrophobicContact CG-CG1 4.23Å; K425-I447 HydrophobicContact CG-CG2 4.46Å; I447-Y449 HydrophobicContact CG2-CE2 4.15Å
448	L	87.3	Confident	80.6	Confident	23 Å²	23	66.7 Å²	66.7	12%	0.12	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	146.7	-177.6	-55.5	175.6	0	0	0	110.1	V424 V446 P450 H461 L478 V480	V424-L448 HydrophobicContact CB-CB 4.33Å; V424-L448 PolarHBondContact N-O 3.45Å; V424-L448 PolarHBondContact O-N 2.97Å; V446-L448 HydrophobicContact CG2-CD2 3.75Å; V446-L448 HydrophobicContact CG2-CG 4.1Å; L448-P450 WeakPolarHBondContact O-CD 3.36Å; L448-H461 WeakPolarHBondContact CD2-CD2 3.06Å; L448-L478 HydrophobicContact CD1-CD1 3.36Å; L448-L478 HydrophobicContact CD1-CD2 4.12Å; L448-L478 HydrophobicContact CD1-CG 4.26Å; L448-V480 HydrophobicContact CD1-CG2 3.74Å
449	Y	85	Confident	81.9	Confident	107 Å²	107	62.4 Å²	62.4	42%	0.42	32%	0.315	S	S	.	.			trans	-120.2	76	177.5	-60.2	-83.8	0	0	0	108.8	V423 I447	V423-Y449 HydrophobicContact CB-CE1 4.4Å; V423-Y449 HydrophobicContact CG1-CE1 4.16Å; V423-Y449 HydrophobicContact CG2-CD1 3.9Å; V423-Y449 HydrophobicContact CG2-CE1 3.55Å; I447-Y449 HydrophobicContact CG2-CE2 4.15Å
450	P	84.6	Confident	82.7	Confident	7 Å²	7	58.5 Å²	58.5	5%	0.045	30%	0.299	C	S	.	.			trans	-65.9	151.2	-179.4	31.5	-36.9	0	0	0	110.7	L367 P422 V424 L448 V480 M482	L367-P450 HydrophobicContact CD2-CB 4.22Å; L367-P450 HydrophobicContact CD2-CG 3.58Å; P422-P450 HydrophobicContact CG-CG 3.88Å; V424-P450 HydrophobicContact CG2-CG 3.77Å; L448-P450 WeakPolarHBondContact O-CD 3.36Å; P450-V480 HydrophobicContact CB-CB 4.4Å; P450-V480 HydrophobicContact CB-CG1 3.6Å; P450-V480 HydrophobicContact CG-CG1 3.8Å; P450-M482 HydrophobicContact CB-SD 4.47Å
451	T	82.1	Confident	83	Confident	26 Å²	26	58.5 Å²	58.5	16%	0.16	30%	0.298	C	S	.	.			trans	-132.4	161.4	172.2	66	0	0	0	0	109.3	N453 S454 Y509	T451-N453 PolarHBondContact O-N 3.06Å; T451-S454 WeakPolarHBondContact CA-OG 3.29Å; T451-S454 PolarHBondContact N-OG 3.06Å; T451-S454 VanDerWaalsContact O-CB 3.29Å; T451-S454 WeakPolarHBondContact O-CB 3.47Å; T451-S454 PolarHBondContact O-N 3.45Å; T451-S454 PolarHBondContact O-OG 3.24Å; T451-S454 PolarHBondContact OG1-OG 3.5Å; T451-Y509 HydrophobicContact CG2-CE2 4.26Å
452	S	77.8	Confident	83.2	Confident	15 Å²	15	59.4 Å²	59.4	11%	0.105	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-14.8	178.8	-55.1	0	0	0	0	114.9	M488	S452-M488 WeakPolarHBondContact OG-CE 3.45Å
453	N	74.8	Confident	83.3	Confident	97 Å²	97	57.2 Å²	57.2	52%	0.519	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	8	176.3	-61.7	-11.8	0	0	0	112.8	T451 S491	T451-N453 PolarHBondContact O-N 3.06Å; N453-S491 PolarHBondContact ND2-O 2.98Å
454	S	74.1	Confident	83.4	Confident	43 Å²	43	61.4 Å²	61.4	30%	0.301	31%	0.313	S	S	.	.	S	Bend	trans	-71.9	153.6	-177.7	-44.4	0	0	0	0	111.6	T451 K456	T451-S454 WeakPolarHBondContact CA-OG 3.29Å; T451-S454 PolarHBondContact N-OG 3.06Å; T451-S454 VanDerWaalsContact O-CB 3.29Å; T451-S454 WeakPolarHBondContact O-CB 3.47Å; T451-S454 PolarHBondContact O-N 3.45Å; T451-S454 PolarHBondContact O-OG 3.24Å; T451-S454 PolarHBondContact OG1-OG 3.5Å; S454-K456 PolarHBondContact O-N 3.46Å
455	S	70.3	Confident	83.2	Confident	57 Å²	57	63.1 Å²	63.1	40%	0.399	32%	0.323	S	S	.	.			trans	-54.8	126.8	173.4	176	0	0	0	0	110.7	S457 E459	S455-S457 PolarHBondContact OG-N 2.85Å; S455-S457 PolarHBondContact OG-OG 2.74Å; S455-E459 WeakPolarHBondContact CB-OE1 3.39Å; S455-E459 PolarHBondContact OG-OE1 3.27Å
456	K	74.6	Confident	82.7	Confident	125 Å²	125	60.5 Å²	60.5	54%	0.543	32%	0.321	S	S	.	.			trans	-83.8	-0.3	176.5	-62	-168.8	179.3	-164.5	0	112.9	S454 R481	S454-K456 PolarHBondContact O-N 3.46Å; K456-R481 HydrophobicContact CB-CG 4.09Å; K456-R481 HydrophobicContact CG-CG 4.3Å; K456-R481 PolarHBondContact O-NE 2.88Å
457	S	80.4	Confident	81.7	Confident	69 Å²	69	70.2 Å²	70.2	48%	0.483	36%	0.362	S	S	.	.	S	Bend	trans	-87.3	156.5	-179.9	74.7	0	0	0	0	111.4	S455 E459	S455-S457 PolarHBondContact OG-N 2.85Å; S455-S457 PolarHBondContact OG-OG 2.74Å; S457-E459 PolarHBondContact O-N 2.73Å
458	A	82.5	Confident	80.5	Confident	36 Å²	36	74.9 Å²	74.9	30%	0.298	39%	0.388	S	S	.	.			trans	-76.6	118.8	177.6	0	0	0	0	0	110.7	M372 K477 A479	M372-A458 HydrophobicContact CG-CB 4.36Å; M372-A458 HydrophobicContact SD-CB 3.26Å; M372-A458 WeakPolarHBondContact SD-CB 3.28Å; A458-K477 HydrophobicContact CB-CG 4.28Å; A458-A479 HydrophobicContact CB-CB 4.1Å
459	E	85.7	Confident	79.4	Confident	87 Å²	87	75.8 Å²	75.8	41%	0.407	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	147.7	-176	-70.5	179.2	-169.2	0	0	111.5	S455 S457 H461 K477 L478	S455-E459 WeakPolarHBondContact CB-OE1 3.39Å; S455-E459 PolarHBondContact OG-OE1 3.27Å; S457-E459 PolarHBondContact O-N 2.73Å; E459-H461 PolarHBondContact O-ND1 3.44Å; E459-K477 WeakPolarHBondContact O-CA 3.35Å; E459-L478 PolarHBondContact N-O 3.4Å; E459-L478 PolarHBondContact O-N 3.25Å; E459-L478 VanDerWaalsContact O-N 3.16Å
460	L	86.6	Confident	78.5	Confident	91 Å²	91	78.6 Å²	78.6	48%	0.476	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	113.1	176.9	-87.4	156.5	0	0	0	110	Q375 K475 K477	Q375-L460 HydrophobicContact CG-CD2 4.49Å; L460-K475 HydrophobicContact CD2-CB 4.12Å; L460-K477 HydrophobicContact CD2-CB 3.95Å; L460-K477 HydrophobicContact CG-CB 4.23Å; L460-K477 HydrophobicContact CG-CG 4.37Å
461	H	87.1	Confident	78	Confident	46 Å²	46	78.5 Å²	78.5	21%	0.213	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	135.5	-179.9	-61.7	84.2	0	0	0	111.1	V446 L448 E459 K475 I476	V446-H461 HydrophobicContact CG2-CB 3.9Å; L448-H461 WeakPolarHBondContact CD2-CD2 3.06Å; E459-H461 PolarHBondContact O-ND1 3.44Å; H461-K475 CarbonylContact O-C 3.54Å; H461-K475 VanDerWaalsContact O-CA 3.28Å; H461-K475 WeakPolarHBondContact O-CA 3.48Å; H461-I476 HydrophobicContact CB-CG2 4.18Å; H461-I476 PolarHBondContact N-O 3.01Å; H461-I476 PolarHBondContact O-N 3.32Å
462	R	88.1	Confident	77.2	Confident	165 Å²	165	82.3 Å²	82.3	62%	0.623	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	128.3	175.7	-164.6	177.9	-164.1	-151.9	-4	110.4	S472 D473	R462-S472 PolarHBondContact NH2-O 3.03Å; R462-D473 IonicContact NE-OD1 3.1Å; R462-D473 PolarHBondContact NE-OD1 3.08Å; R462-D473 IonicContact NH2-OD1 3.33Å
463	M	87.4	Confident	77.2	Confident	9 Å²	9	85.1 Å²	85.1	4%	0.044	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-85.8	143.1	178.4	-59	-172.6	84	0	0	111	L428 G444 L474 I476	L428-M463 HydrophobicContact CB-CE 3.73Å; L428-M463 HydrophobicContact CB-SD 4.46Å; G444-M463 VanDerWaalsContact C-CE 3.48Å; G444-M463 VanDerWaalsContact O-CE 3.29Å; G444-M463 WeakPolarHBondContact O-CE 3.46Å; M463-L474 HydrophobicContact CB-CB 4.32Å; M463-L474 HydrophobicContact CB-CD2 4.09Å; M463-L474 HydrophobicContact CB-CG 4.25Å; M463-L474 HydrophobicContact CG-CD2 4.41Å; M463-L474 HydrophobicContact CG-CG 4.38Å; M463-L474 PolarHBondContact N-O 3.08Å; M463-L474 HydrophobicContact SD-CD2 3.63Å; M463-L474 HydrophobicContact SD-CG 3.84Å; M463-I476 HydrophobicContact CE-CD1 4.42Å; M463-I476 HydrophobicContact CE-CG2 4.45Å; M463-I476 HydrophobicContact CG-CB 3.99Å; M463-I476 HydrophobicContact CG-CG2 3.6Å; M463-I476 HydrophobicContact SD-CB 3.81Å; M463-I476 HydrophobicContact SD-CG2 3.99Å
464	V	86.4	Confident	77.7	Confident	93 Å²	93	80.6 Å²	80.6	56%	0.564	43%	0.43	S	S	*	.	B	Isolated β-bridge	trans	-81.6	117.1	169.3	-178.1	0	0	0	0	107.9	G444 R445	G444-V464 WeakPolarHBondContact CA-O 3.31Å; R445-V464 HydrophobicContact CG-CB 4.24Å; R445-V464 PolarHBondContact N-O 3.28Å; R445-V464 PolarHBondContact O-N 2.99Å
465	V	83.9	Confident	78.4	Confident	35 Å²	35	81.7 Å²	81.7	21%	0.212	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-101.4	144.5	-175.6	-176.5	0	0	0	0	110.5	D471 L474	V465-D471 HydrophobicContact CG1-CB 4.45Å; V465-D471 WeakPolarHBondContact CG1-O 3.22Å; V465-D471 WeakPolarHBondContact CG2-O 3.28Å; V465-L474 HydrophobicContact CG2-CB 3.79Å; V465-L474 HydrophobicContact CG2-CD2 4.11Å
466	P	77.9	Confident	79.3	Confident	60 Å²	60	79 Å²	79	39%	0.39	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-59.8	147.4	175.2	-24	34.3	0	0	0	113.4	L443 N468 S469	L443-P466 VanDerWaalsContact O-CD 3.25Å; L443-P466 WeakPolarHBondContact O-CD 3.49Å; P466-N468 PolarHBondContact O-N 2.86Å; P466-S469 PolarHBondContact O-N 3.3Å
467	K	70.8	Confident	80.1	Confident	213 Å²	213	76 Å²	76	93%	0.926	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-13.4	-172.3	-67.2	-175.4	178.5	-179	0	116
468	N	62.5	Low	80.6	Confident	168 Å²	168	72.8 Å²	72.8	90%	0.898	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	19.2	-175.8	-64.8	-2.8	0	0	0	113.6	P466	P466-N468 PolarHBondContact O-N 2.86Å
469	S	65.6	Low	80.9	Confident	43 Å²	43	71.3 Å²	71.3	30%	0.301	36%	0.362	S	S	.	.			trans	-98.2	152.4	-178.2	-170	0	0	0	0	113.3	P466 D471	P466-S469 PolarHBondContact O-N 3.3Å; S469-D471 VanDerWaalsContact C-N 3.3Å; S469-D471 PolarHBondContact OG-N 3.04Å
470	Q	64.6	Low	81	Confident	165 Å²	165	67.9 Å²	67.9	77%	0.771	35%	0.347	S	S	*	.	S	Bend	trans	-80.2	-8.7	171.5	-67.4	-171.4	-7.8	0	0	113.3	S472	Q470-S472 PolarHBondContact O-N 2.67Å
471	D	73.9	Confident	81	Confident	6 Å²	6	68 Å²	68	3%	0.032	34%	0.341	C	S	.	.			trans	-91.9	99.7	-176.8	-61.7	-29.5	0	0	0	111.3	K378 S379 V465 S469 L474	K378-D471 VanDerWaalsContact CA-OD1 3.28Å; K378-D471 WeakPolarHBondContact CA-OD1 3.31Å; K378-D471 WeakPolarHBondContact CB-OD1 3.34Å; K378-D471 PolarHBondContact N-OD1 2.95Å; S379-D471 WeakPolarHBondContact CB-OD2 3.36Å; S379-D471 PolarHBondContact N-OD1 3.28Å; S379-D471 PolarHBondContact N-OD2 3.36Å; S379-D471 PolarHBondContact OG-OD2 2.95Å; V465-D471 HydrophobicContact CG1-CB 4.45Å; V465-D471 WeakPolarHBondContact CG1-O 3.22Å; V465-D471 WeakPolarHBondContact CG2-O 3.28Å; S469-D471 VanDerWaalsContact C-N 3.3Å; S469-D471 PolarHBondContact OG-N 3.04Å; D471-L474 HydrophobicContact CB-CB 4.46Å
472	S	65.4	Low	81	Confident	105 Å²	105	66.1 Å²	66.1	73%	0.734	33%	0.333	S	S	*	.	S	Bend	trans	-95.1	-11.8	-178.7	57.3	0	0	0	0	115	R462 Q470	R462-S472 PolarHBondContact NH2-O 3.03Å; Q470-S472 PolarHBondContact O-N 2.67Å
473	D	78.6	Confident	80.8	Confident	75 Å²	75	61.8 Å²	61.8	40%	0.401	32%	0.322	S	S	.	.	S	Bend	trans	-134.8	41.7	179.9	-161.4	35.3	0	0	0	113.4	R462 K475	R462-D473 IonicContact NE-OD1 3.1Å; R462-D473 PolarHBondContact NE-OD1 3.08Å; R462-D473 IonicContact NH2-OD1 3.33Å; D473-K475 PolarHBondContact O-N 3.08Å; D473-K475 WeakPolarHBondContact OD1-CE 3.41Å; D473-K475 IonicContact OD1-NZ 3.42Å; D473-K475 PolarHBondContact OD1-NZ 3.02Å; D473-K475 IonicContact OD2-NZ 2.63Å; D473-K475 PolarHBondContact OD2-NZ 3.43Å
474	L	86.2	Confident	80.7	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	34%	0.341	C	S	.	.			trans	-66.9	125.5	176.1	-168.2	70.2	0	0	0	110.6	V374 L377 L428 M463 V465 D471	V374-L474 HydrophobicContact CG1-CD1 3.57Å; V374-L474 HydrophobicContact CG1-CG 4.24Å; L377-L474 HydrophobicContact CB-CD1 3.97Å; L377-L474 HydrophobicContact CD1-CD1 4.1Å; L428-L474 HydrophobicContact CD2-CD2 4.03Å; M463-L474 HydrophobicContact CB-CB 4.32Å; M463-L474 HydrophobicContact CB-CD2 4.09Å; M463-L474 HydrophobicContact CB-CG 4.25Å; M463-L474 HydrophobicContact CG-CD2 4.41Å; M463-L474 HydrophobicContact CG-CG 4.38Å; M463-L474 PolarHBondContact N-O 3.08Å; M463-L474 HydrophobicContact SD-CD2 3.63Å; M463-L474 HydrophobicContact SD-CG 3.84Å; V465-L474 HydrophobicContact CG2-CB 3.79Å; V465-L474 HydrophobicContact CG2-CD2 4.11Å; D471-L474 HydrophobicContact CB-CB 4.46Å
475	K	88.3	Confident	80.5	Confident	67 Å²	67	62.8 Å²	62.8	29%	0.291	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	145.4	179.2	-69.2	170.9	-176.5	145.6	0	110.4	V374 Q375 L460 H461 D473	V374-K475 CarbonylContact C-O 3.52Å; V374-K475 WeakPolarHBondContact CA-O 3.28Å; Q375-K475 PolarHBondContact N-O 3.11Å; Q375-K475 PolarHBondContact O-N 3.26Å; L460-K475 HydrophobicContact CD2-CB 4.12Å; H461-K475 CarbonylContact O-C 3.54Å; H461-K475 VanDerWaalsContact O-CA 3.28Å; H461-K475 WeakPolarHBondContact O-CA 3.48Å; D473-K475 PolarHBondContact O-N 3.08Å; D473-K475 WeakPolarHBondContact OD1-CE 3.41Å; D473-K475 IonicContact OD1-NZ 3.42Å; D473-K475 PolarHBondContact OD1-NZ 3.02Å; D473-K475 IonicContact OD2-NZ 2.63Å; D473-K475 PolarHBondContact OD2-NZ 3.43Å
476	I	89.4	Confident	80	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.2	176.1	-173.8	167.4	0	0	0	109.6	I371 E373 V374 V426 V446 H461 M463 L478	I371-I476 HydrophobicContact CG2-CD1 4.07Å; I371-I476 HydrophobicContact CG2-CG1 4.45Å; E373-I476 CarbonylContact O-C 3.54Å; V374-I476 HydrophobicContact CG2-CB 3.98Å; V374-I476 HydrophobicContact CG2-CD1 3.93Å; V374-I476 HydrophobicContact CG2-CG1 3.73Å; V426-I476 HydrophobicContact CG1-CD1 3.74Å; V446-I476 HydrophobicContact CB-CG2 4.32Å; V446-I476 HydrophobicContact CG1-CG2 3.81Å; H461-I476 HydrophobicContact CB-CG2 4.18Å; H461-I476 PolarHBondContact N-O 3.01Å; H461-I476 PolarHBondContact O-N 3.32Å; M463-I476 HydrophobicContact CE-CD1 4.42Å; M463-I476 HydrophobicContact CE-CG2 4.45Å; M463-I476 HydrophobicContact CG-CB 3.99Å; M463-I476 HydrophobicContact CG-CG2 3.6Å; M463-I476 HydrophobicContact SD-CB 3.81Å; M463-I476 HydrophobicContact SD-CG2 3.99Å; I476-L478 HydrophobicContact CD1-CD2 4.12Å; I476-L478 HydrophobicContact CG1-CD2 4.1Å; I476-L478 HydrophobicContact CG2-CD2 3.85Å
477	K	90.7	Very high	80.1	Confident	63 Å²	63	64.1 Å²	64.1	27%	0.274	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	116.9	173.3	-170.8	179	-177.8	-179	0	108.6	M372 E373 A458 E459 L460	M372-K477 HydrophobicContact CB-CB 4.32Å; M372-K477 HydrophobicContact CB-CD 4.32Å; M372-K477 HydrophobicContact CB-CG 4.22Å; M372-K477 WeakPolarHBondContact CB-O 3.13Å; M372-K477 PolarHBondContact N-O 2.9Å; M372-K477 HydrophobicContact SD-CD 4.07Å; M372-K477 HydrophobicContact SD-CG 4.2Å; E373-K477 HydrophobicContact CG-CB 3.76Å; E373-K477 HydrophobicContact CG-CD 4.1Å; E373-K477 PolarHBondContact N-O 3.17Å; E373-K477 PolarHBondContact O-N 3.16Å; A458-K477 HydrophobicContact CB-CG 4.28Å; E459-K477 WeakPolarHBondContact O-CA 3.35Å; L460-K477 HydrophobicContact CD2-CB 3.95Å; L460-K477 HydrophobicContact CG-CB 4.23Å; L460-K477 HydrophobicContact CG-CG 4.37Å
478	L	90.6	Very high	80.8	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	152.4	179.1	66.3	89.9	0	0	0	110.2	V370 I371 V426 V446 L448 E459 I476 V480	V370-L478 CarbonylContact O-C 3.56Å; V370-L478 WeakPolarHBondContact O-CA 3.43Å; V370-L478 WeakPolarHBondContact O-CB 3.45Å; I371-L478 HydrophobicContact CG1-CB 4.35Å; V426-L478 HydrophobicContact CB-CD2 4.42Å; V426-L478 HydrophobicContact CG2-CD2 4.2Å; V446-L478 HydrophobicContact CG1-CD2 4.04Å; L448-L478 HydrophobicContact CD1-CD1 3.36Å; L448-L478 HydrophobicContact CD1-CD2 4.12Å; L448-L478 HydrophobicContact CD1-CG 4.26Å; E459-L478 PolarHBondContact N-O 3.4Å; E459-L478 PolarHBondContact O-N 3.25Å; E459-L478 VanDerWaalsContact O-N 3.16Å; I476-L478 HydrophobicContact CD1-CD2 4.12Å; I476-L478 HydrophobicContact CG1-CD2 4.1Å; I476-L478 HydrophobicContact CG2-CD2 3.85Å; L478-V480 HydrophobicContact CD1-CG2 3.37Å
479	A	88.6	Confident	81.9	Confident	5 Å²	5	47.7 Å²	47.7	4%	0.041	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	134	170.1	0	0	0	0	0	109.1	I369 V370 A458	I369-A479 WeakPolarHBondContact CA-O 3.33Å; V370-A479 HydrophobicContact CB-CB 4.45Å; V370-A479 PolarHBondContact N-O 3.01Å; V370-A479 PolarHBondContact O-N 3.25Å; A458-A479 HydrophobicContact CB-CB 4.1Å
480	V	88.1	Confident	82.9	Confident	15 Å²	15	46.6 Å²	46.6	9%	0.091	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	113.9	169.9	-173.5	0	0	0	0	108.1	L367 E368 I369 V424 L448 P450 L478	L367-V480 HydrophobicContact CD2-CG1 4.07Å; E368-V480 WeakPolarHBondContact O-CA 2.79Å; I369-V480 HydrophobicContact CG1-CG1 4.07Å; I369-V480 HydrophobicContact CG1-CG2 4.33Å; V424-V480 HydrophobicContact CG2-CG1 4.43Å; L448-V480 HydrophobicContact CD1-CG2 3.74Å; P450-V480 HydrophobicContact CB-CB 4.4Å; P450-V480 HydrophobicContact CB-CG1 3.6Å; P450-V480 HydrophobicContact CG-CG1 3.8Å; L478-V480 HydrophobicContact CD1-CG2 3.37Å
481	R	86.6	Confident	84.1	Confident	93 Å²	93	38.8 Å²	38.8	35%	0.351	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.5	178	-65.3	166.7	176.8	172.8	3.7	108.2	L367 E368 K456	L367-R481 CarbonylContact C-O 3.56Å; L367-R481 VanDerWaalsContact CA-O 3.3Å; L367-R481 WeakPolarHBondContact CA-O 3.42Å; E368-R481 HydrophobicContact CB-CB 4.2Å; E368-R481 PolarHBondContact N-O 3.36Å; E368-R481 PolarHBondContact O-N 3.42Å; E368-R481 IonicContact OE1-NH1 3.05Å; E368-R481 PolarHBondContact OE1-NH1 3.33Å; E368-R481 VanDerWaalsContact OE1-NH1 3.15Å; E368-R481 WeakPolarHBondContact OE2-CD 3.42Å; E368-R481 IonicContact OE2-CZ 4Å; E368-R481 IonicContact OE2-NE 3.88Å; E368-R481 IonicContact OE2-NH1 3.82Å; E368-R481 PolarHBondContact OE2-NH1 3.37Å; E368-R481 VanDerWaalsContact OE2-NH1 3.08Å; K456-R481 HydrophobicContact CB-CG 4.09Å; K456-R481 HydrophobicContact CG-CG 4.3Å; K456-R481 PolarHBondContact O-NE 2.88Å
482	M	87.3	Confident	84.8	Confident	7 Å²	7	38.9 Å²	38.9	3%	0.034	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	115.2	176.7	-177.8	175.1	179.7	0	0	107.6	F365 T366 L367 P422 P450	F365-M482 HydrophobicContact CB-CE 3.74Å; F365-M482 HydrophobicContact CB-CG 4.4Å; F365-M482 HydrophobicContact CD1-CE 3.19Å; F365-M482 HydrophobicContact CD1-CG 4.34Å; F365-M482 HydrophobicContact CD2-CE 3.88Å; F365-M482 HydrophobicContact CE1-CE 3.64Å; F365-M482 HydrophobicContact CE2-CE 4.28Å; F365-M482 HydrophobicContact CG-CE 3.34Å; F365-M482 HydrophobicContact CZ-CE 4.17Å; T366-M482 WeakPolarHBondContact O-CA 3.33Å; L367-M482 HydrophobicContact CD2-CB 3.95Å; L367-M482 HydrophobicContact CD2-CG 4.07Å; L367-M482 HydrophobicContact CD2-SD 4.29Å; L367-M482 HydrophobicContact CG-CB 4.38Å; L367-M482 HydrophobicContact CG-CG 4.2Å; P422-M482 HydrophobicContact CG-CE 4.26Å; P422-M482 HydrophobicContact CG-SD 4.23Å; P450-M482 HydrophobicContact CB-SD 4.47Å
483	D	84.1	Confident	85.8	Confident	74 Å²	74	38.1 Å²	38.1	40%	0.396	19%	0.186	S	C	.	.	P	Polyproline II helix	trans	-75.4	141.3	-179.9	-65.1	-41.1	0	0	0	110.7	T366 P485	T366-D483 PolarHBondContact O-N 3.42Å; T366-D483 WeakPolarHBondContact OG1-CB 3.09Å; T366-D483 PolarHBondContact OG1-OD2 2.77Å; D483-P485 WeakPolarHBondContact O-CD 3.42Å
484	K	84.3	Confident	86.4	Confident	104 Å²	104	34.6 Å²	34.6	45%	0.452	17%	0.167	S	C	.	.	P	Polyproline II helix	trans	-78.2	119.8	177	-178.4	178.5	168.7	-176.7	0	109	M488 K489	K484-M488 WeakPolarHBondContact CE-O 3.46Å; K484-M488 HydrophobicContact CG-CB 4.5Å; K484-M488 HydrophobicContact CG-CE 4.42Å; K484-M488 HydrophobicContact CG-CG 4.37Å; K484-K489 WeakPolarHBondContact CE-O 3.21Å; K484-K489 PolarHBondContact NZ-O 3.2Å
485	P	82.4	Confident	86.6	Confident	18 Å²	18	36.7 Å²	36.7	12%	0.117	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-65.5	147	177.4	-18.2	31.4	0	0	0	110.6	L363 S364 F365 D483 H487 M488	L363-P485 HydrophobicContact CB-CG 4.47Å; S364-P485 WeakPolarHBondContact O-CG 3.44Å; F365-P485 HydrophobicContact CD1-CG 3.3Å; F365-P485 HydrophobicContact CD2-CG 4.42Å; F365-P485 HydrophobicContact CE1-CG 3.38Å; F365-P485 HydrophobicContact CE2-CG 4.46Å; F365-P485 HydrophobicContact CG-CG 3.86Å; F365-P485 HydrophobicContact CZ-CG 3.98Å; D483-P485 WeakPolarHBondContact O-CD 3.42Å; P485-H487 PolarHBondContact O-N 3.3Å; P485-M488 HydrophobicContact CB-CB 4.42Å; P485-M488 WeakPolarHBondContact O-CB 3.4Å; P485-M488 PolarHBondContact O-N 3.12Å
486	A	74.1	Confident	86.6	Confident	52 Å²	52	33.5 Å²	33.5	43%	0.43	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-28.6	-176.2	0	0	0	0	0	114	M488 K489	A486-M488 VanDerWaalsContact C-N 3.28Å; A486-M488 PolarHBondContact O-N 2.68Å; A486-K489 PolarHBondContact O-NZ 2.97Å
487	H	79.4	Confident	86.6	Confident	71 Å²	71	36.1 Å²	36.1	33%	0.329	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-19.2	174.4	-62.9	-75.5	0	0	0	113.3	L363 P485 V513 Q514	L363-H487 HydrophobicContact CD2-CB 3.94Å; P485-H487 PolarHBondContact O-N 3.3Å; H487-V513 CarbonylContact O-C 3.58Å; H487-V513 WeakPolarHBondContact O-CA 3.4Å; H487-Q514 PolarHBondContact ND1-O 3.39Å; H487-Q514 PolarHBondContact O-N 2.79Å
488	M	85.4	Confident	86.4	Confident	3 Å²	3	33.5 Å²	33.5	2%	0.015	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	110.7	179.2	172.9	162.6	144.4	0	0	109.7	L363 F365 S452 K484 P485 A486 S491 V511	L363-M488 HydrophobicContact CD1-CB 4.07Å; L363-M488 HydrophobicContact CD1-CG 4.43Å; L363-M488 HydrophobicContact CD1-SD 3.98Å; L363-M488 HydrophobicContact CD2-CB 4.37Å; F365-M488 HydrophobicContact CE1-SD 3.7Å; F365-M488 HydrophobicContact CZ-SD 3.95Å; S452-M488 WeakPolarHBondContact OG-CE 3.45Å; K484-M488 WeakPolarHBondContact CE-O 3.46Å; K484-M488 HydrophobicContact CG-CB 4.5Å; K484-M488 HydrophobicContact CG-CE 4.42Å; K484-M488 HydrophobicContact CG-CG 4.37Å; P485-M488 HydrophobicContact CB-CB 4.42Å; P485-M488 WeakPolarHBondContact O-CB 3.4Å; P485-M488 PolarHBondContact O-N 3.12Å; A486-M488 VanDerWaalsContact C-N 3.28Å; A486-M488 PolarHBondContact O-N 2.68Å; M488-S491 WeakPolarHBondContact CE-OG 3.34Å; M488-V511 HydrophobicContact CB-CG1 4.34Å; M488-V511 HydrophobicContact CE-CG1 4.4Å; M488-V511 HydrophobicContact CG-CG1 3.52Å; M488-V511 HydrophobicContact SD-CG1 3.48Å; M488-V511 WeakPolarHBondContact SD-CG1 2.95Å
489	K	85.4	Confident	86.1	Confident	33 Å²	33	39.5 Å²	39.5	14%	0.143	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-40.7	-176.4	-61.7	-51.2	-178.2	-175.1	0	113.3	D267 K484 A486 L512 Q514 F520	D267-K489 WeakPolarHBondContact OD1-CE 3.28Å; D267-K489 IonicContact OD1-NZ 3.75Å; D267-K489 PolarHBondContact OD1-NZ 3.1Å; D267-K489 WeakPolarHBondContact OD2-CD 3.49Å; D267-K489 WeakPolarHBondContact OD2-CE 3.4Å; D267-K489 IonicContact OD2-NZ 2.72Å; D267-K489 PolarHBondContact OD2-NZ 3.03Å; K484-K489 WeakPolarHBondContact CE-O 3.21Å; K484-K489 PolarHBondContact NZ-O 3.2Å; A486-K489 PolarHBondContact O-NZ 2.97Å; K489-L512 HydrophobicContact CB-CB 4.42Å; K489-L512 HydrophobicContact CB-CD2 3.96Å; K489-L512 HydrophobicContact CB-CG 4.05Å; K489-L512 PolarHBondContact N-O 3.28Å; K489-Q514 HydrophobicContact CD-CB 4.5Å; K489-Q514 HydrophobicContact CG-CB 4.19Å; K489-F520 HydrophobicContact CG-CE1 4.2Å
490	H	87.3	Confident	85.8	Confident	20 Å²	20	46 Å²	46	9%	0.093	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	154.5	177.6	-164.5	72.8	0	0	0	110.5	V511 L512 D577 W581 A584	H490-V511 WeakPolarHBondContact O-CA 3.16Å; H490-L512 HydrophobicContact CB-CB 4.45Å; H490-L512 PolarHBondContact O-N 2.98Å; H490-D577 IonicContact NE2-OD1 3.87Å; H490-W581 HydrophobicContact CB-CZ3 4.38Å; H490-W581 AromaticContact CD2-CD1 3.98Å; H490-W581 AromaticContact CD2-CD2 3.29Å; H490-W581 AromaticContact CD2-CE2 3.26Å; H490-W581 AromaticContact CD2-CE3 3.58Å; H490-W581 AromaticContact CD2-CG 3.82Å; H490-W581 AromaticContact CD2-CH2 3.85Å; H490-W581 AromaticContact CD2-CZ2 3.59Å; H490-W581 AromaticContact CD2-CZ3 3.83Å; H490-W581 AromaticContact CD2-NE1 3.67Å; H490-W581 AromaticContact NE2-CD1 3.7Å; H490-W581 AromaticContact NE2-CD2 3.83Å; H490-W581 AromaticContact NE2-CE2 3.62Å; H490-W581 AromaticContact NE2-CG 3.94Å; H490-W581 AromaticContact NE2-NE1 3.49Å; H490-W581 PolarHBondContact NE2-NE1 2.76Å; H490-A584 HydrophobicContact CB-CB 3.76Å
491	S	89.3	Confident	85.6	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.007	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	149.6	177.9	62.4	0	0	0	0	111.6	N453 M488 Y509 F510	N453-S491 PolarHBondContact ND2-O 2.98Å; M488-S491 WeakPolarHBondContact CE-OG 3.34Å; S491-Y509 WeakPolarHBondContact CB-OH 3.28Å; S491-Y509 PolarHBondContact OG-OH 3.16Å; S491-F510 WeakPolarHBondContact CA-O 3.23Å
492	G	88.5	Confident	85.8	Confident	8 Å²	8	42.3 Å²	42.3	8%	0.082	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.7	175.9	-176.1	0	0	0	0	0	111.8	F510	G492-F510 PolarHBondContact N-O 3.29Å; G492-F510 PolarHBondContact O-N 2.76Å
493	Y	88.1	Confident	85.7	Confident	90 Å²	90	49.1 Å²	49.1	35%	0.353	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	124	174.8	-71.8	-85.6	0	0	0	110.2	R421 K507 R508 Y509	R421-Y493 PolarHBondContact NE-OH 3.32Å; R421-Y493 PolarHBondContact NH1-OH 3.35Å; R421-Y493 PolarHBondContact NH2-OH 2.89Å; Y493-K507 HydrophobicContact CD1-CG 4.3Å; Y493-R508 WeakPolarHBondContact CA-O 3.36Å; Y493-Y509 HydrophobicContact CD1-CD2 4.12Å; Y493-Y509 AromaticContact CD2-CD2 3.89Å; Y493-Y509 HydrophobicContact CD2-CD2 3.89Å; Y493-Y509 HydrophobicContact CD2-CE2 4.38Å; Y493-Y509 AromaticContact CE1-CD2 3.94Å; Y493-Y509 HydrophobicContact CE1-CD2 3.94Å; Y493-Y509 HydrophobicContact CE1-CG 4.37Å; Y493-Y509 AromaticContact CE2-CD2 3.7Å; Y493-Y509 HydrophobicContact CE2-CD2 3.7Å; Y493-Y509 HydrophobicContact CE2-CE2 4.16Å; Y493-Y509 HydrophobicContact CG-CD2 4.09Å; Y493-Y509 AromaticContact CZ-CD2 3.73Å
494	L	89.6	Confident	85.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	149.5	173.9	-65.5	172.4	0	0	0	110.3	K507 R508 F510 M522 F559 F570 W581	L494-K507 WeakPolarHBondContact O-CA 3.42Å; L494-R508 PolarHBondContact N-O 3.3Å; L494-R508 PolarHBondContact O-N 3.02Å; L494-F510 HydrophobicContact CB-CD2 3.67Å; L494-F510 HydrophobicContact CB-CE2 4.01Å; L494-F510 HydrophobicContact CB-CG 4.49Å; L494-F510 HydrophobicContact CD1-CB 4.42Å; L494-F510 HydrophobicContact CD1-CD2 4.44Å; L494-F510 HydrophobicContact CG-CD2 4.44Å; L494-F510 WeakPolarHBondContact O-CE2 3.38Å; L494-M522 HydrophobicContact CD1-CE 4.4Å; L494-F559 HydrophobicContact CD1-CZ 3.91Å; L494-F559 HydrophobicContact CD2-CE1 4.07Å; L494-F559 HydrophobicContact CD2-CZ 4.24Å; L494-F570 HydrophobicContact CB-CD1 4.47Å; L494-F570 HydrophobicContact CD1-CD1 4.05Å; L494-W581 HydrophobicContact CD1-CD2 3.6Å; L494-W581 VanDerWaalsContact CD1-CE2 3.46Å; L494-W581 HydrophobicContact CD1-CE3 4.04Å; L494-W581 HydrophobicContact CD1-CG 4.02Å; L494-W581 HydrophobicContact CD1-CH2 4.22Å; L494-W581 HydrophobicContact CD1-CZ2 3.77Å; L494-W581 HydrophobicContact CD1-CZ3 4.35Å; L494-W581 HydrophobicContact CD2-CG 4.23Å; L494-W581 HydrophobicContact CG-CD2 4.32Å; L494-W581 HydrophobicContact CG-CZ2 4.12Å
495	Y	90.1	Very high	86	Confident	46 Å²	46	51.2 Å²	51.2	18%	0.18	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	137.6	157.9	-67.4	-98.1	0	0	0	108.2	W505 K507 F570 A571	Y495-W505 HydrophobicContact CD1-CD2 4.41Å; Y495-W505 AromaticContact CD1-CE2 3.85Å; Y495-W505 HydrophobicContact CD1-CZ2 4.28Å; Y495-W505 AromaticContact CD1-NE1 3.58Å; Y495-W505 AromaticContact CG-CZ2 3.98Å; Y495-W505 HydrophobicContact CG-CZ2 3.98Å; Y495-K507 HydrophobicContact CD1-CB 4.06Å; Y495-K507 HydrophobicContact CD2-CB 4.41Å; Y495-K507 HydrophobicContact CD2-CG 4.37Å; Y495-K507 HydrophobicContact CE1-CB 3.72Å; Y495-K507 HydrophobicContact CE2-CB 4.08Å; Y495-K507 HydrophobicContact CE2-CD 3.78Å; Y495-K507 HydrophobicContact CE2-CG 4Å; Y495-K507 HydrophobicContact CG-CB 4.39Å; Y495-F570 CarbonylContact O-C 3.55Å; Y495-F570 WeakPolarHBondContact O-CA 3.39Å; Y495-A571 PolarHBondContact N-O 3.28Å; Y495-A571 PolarHBondContact O-N 3.34Å
496	A	90.3	Very high	86.3	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	141.7	178.5	0	0	0	0	0	111.6	W502 F510 I569 F570	A496-W502 HydrophobicContact CB-CB 4.31Å; A496-W502 HydrophobicContact CB-CG 4.4Å; A496-F510 HydrophobicContact CB-CE1 4.42Å; A496-F510 HydrophobicContact CB-CE2 3.92Å; A496-F510 HydrophobicContact CB-CZ 3.48Å; A496-F510 VanDerWaalsContact CB-CZ 3.48Å; A496-I569 CarbonylContact C-O 3.57Å; A496-I569 VanDerWaalsContact CA-O 3.27Å; A496-I569 WeakPolarHBondContact CA-O 3.35Å; A496-F570 HydrophobicContact CB-CD1 3.64Å; A496-F570 HydrophobicContact CB-CE1 3.69Å
497	L	89.2	Confident	86.9	Confident	55 Å²	55	57.5 Å²	57.5	29%	0.288	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	119.7	169.4	178	70.7	0	0	0	109.1	W502 W505 L552 V568 I569	L497-W502 WeakPolarHBondContact CA-O 3.22Å; L497-W505 HydrophobicContact CB-CE3 3.66Å; L497-W505 HydrophobicContact CB-CZ3 4.2Å; L497-L552 HydrophobicContact CD2-CD2 4.34Å; L497-V568 WeakPolarHBondContact O-CA 3.27Å; L497-I569 PolarHBondContact N-O 3.17Å; L497-I569 PolarHBondContact O-N 2.94Å
498	G	86.1	Confident	87.5	Confident	8 Å²	8	55.7 Å²	55.7	8%	0.082	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	164.7	176.5	0	0	0	0	0	112.8	V501 W502	G498-V501 CarbonylContact C-O 3.34Å; G498-V501 WeakPolarHBondContact CA-O 3.38Å; G498-V501 PolarHBondContact N-O 3.2Å; G498-W502 PolarHBondContact N-O 2.8Å
499	Q	83.3	Confident	87.6	Confident	126 Å²	126	55.9 Å²	55.9	59%	0.589	25%	0.245	S	C	*	.	S	Bend	trans	-78.5	-46.9	-179.8	-59.1	-176.7	-0.8	0	0	111.5
500	K	83.3	Confident	87.9	Confident	142 Å²	142	54.3 Å²	54.3	62%	0.617	24%	0.238	S	C	*	.	S	Bend	trans	-85.1	-48.4	178.1	-64.5	-173.5	-167.9	170.8	0	112.7	K503 D566	K500-K503 WeakPolarHBondContact O-CE 3.49Å; K500-D566 WeakPolarHBondContact CB-OD2 3.41Å; K500-D566 WeakPolarHBondContact CD-OD2 3.29Å; K500-D566 WeakPolarHBondContact CG-OD2 3.4Å
501	V	83.7	Confident	88	Confident	30 Å²	30	53.4 Å²	53.4	18%	0.182	23%	0.234	C	C	.	.	S	Bend	trans	-117.8	151.9	-176.8	-70.9	0	0	0	0	111.4	G498 K503 M536 V568	G498-V501 CarbonylContact C-O 3.34Å; G498-V501 WeakPolarHBondContact CA-O 3.38Å; G498-V501 PolarHBondContact N-O 3.2Å; V501-K503 PolarHBondContact O-N 3.26Å; V501-M536 HydrophobicContact CG2-CB 4.07Å; V501-M536 HydrophobicContact CG2-CG 4.09Å; V501-M536 HydrophobicContact CG2-SD 3.72Å; V501-V568 HydrophobicContact CG2-CG2 4.5Å
502	W	89.7	Confident	88.1	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	23%	0.233	C	C	.	.			trans	55	51.1	-178.1	-52.6	-61.7	0	0	0	114	A496 L497 G498 R504 F510 M522 S524 E534 M536 V568 F570	A496-W502 HydrophobicContact CB-CB 4.31Å; A496-W502 HydrophobicContact CB-CG 4.4Å; L497-W502 WeakPolarHBondContact CA-O 3.22Å; G498-W502 PolarHBondContact N-O 2.8Å; W502-R504 PolarHBondContact O-N 3.48Å; W502-F510 AromaticContact CD2-CE1 3.85Å; W502-F510 HydrophobicContact CD2-CE1 3.85Å; W502-F510 AromaticContact CD2-CZ 3.98Å; W502-F510 HydrophobicContact CD2-CZ 3.98Å; W502-F510 AromaticContact CE2-CE1 3.4Å; W502-F510 VanDerWaalsContact CE2-CE1 3.4Å; W502-F510 AromaticContact CE2-CZ 3.83Å; W502-F510 HydrophobicContact CE3-CE1 4.17Å; W502-F510 HydrophobicContact CE3-CZ 4.48Å; W502-F510 HydrophobicContact CG-CZ 4.29Å; W502-F510 HydrophobicContact CH2-CD1 4.44Å; W502-F510 AromaticContact CH2-CE1 3.73Å; W502-F510 HydrophobicContact CH2-CE1 3.73Å; W502-F510 HydrophobicContact CZ2-CD1 4.17Å; W502-F510 AromaticContact CZ2-CE1 3.38Å; W502-F510 HydrophobicContact CZ2-CE1 3.38Å; W502-F510 HydrophobicContact CZ2-CZ 4.27Å; W502-F510 HydrophobicContact CZ3-CE1 4.1Å; W502-F510 AromaticContact NE1-CE1 3.82Å; W502-F510 AromaticContact NE1-CZ 3.92Å; W502-M522 HydrophobicContact CH2-CB 4.17Å; W502-M522 HydrophobicContact CH2-CG 3.83Å; W502-M522 WeakPolarHBondContact CH2-O 3.34Å; W502-M522 HydrophobicContact CZ3-CG 4.41Å; W502-S524 PolarHBondContact NE1-OG 2.94Å; W502-E534 HydrophobicContact CZ2-CB 4.44Å; W502-E534 PolarHBondContact N-OE1 2.8Å; W502-M536 HydrophobicContact CH2-CB 3.53Å; W502-M536 HydrophobicContact CZ3-CB 3.75Å; W502-M536 HydrophobicContact CZ3-CE 4.08Å; W502-M536 HydrophobicContact CZ3-CG 4.42Å; W502-M536 HydrophobicContact CZ3-SD 3.8Å; W502-V568 HydrophobicContact CE3-CG1 4.07Å; W502-V568 HydrophobicContact CZ3-CG1 4.41Å; W502-F570 HydrophobicContact CZ3-CE1 4.39Å; W502-F570 HydrophobicContact CZ3-CZ 4.12Å
503	K	86.6	Confident	88	Confident	151 Å²	151	53.1 Å²	53.1	66%	0.657	23%	0.23	S	C	*	.			trans	-60.6	0.7	-178.3	-57.4	-173	176.9	-176.9	0	116.3	K500 V501	K500-K503 WeakPolarHBondContact O-CE 3.49Å; V501-K503 PolarHBondContact O-N 3.26Å
504	R	85.9	Confident	87.9	Confident	174 Å²	174	48.9 Å²	48.9	66%	0.657	21%	0.214	S	C	*	.	S	Bend	trans	-133.5	129.2	-179.1	-66.4	-176.7	179.8	177.8	-0.9	109.4	W502 K506 R508	W502-R504 PolarHBondContact O-N 3.48Å; R504-K506 HydrophobicContact CB-CG 4.35Å; R504-K506 PolarHBondContact O-N 2.96Å; R504-R508 PolarHBondContact O-NH1 3.02Å; R504-R508 PolarHBondContact O-NH2 3.38Å
505	W	88.6	Confident	87.4	Confident	47 Å²	47	50.5 Å²	50.5	18%	0.178	22%	0.223	C	C	.	.			trans	-63.4	102.6	172.6	-172.2	-111.9	0	0	0	110.1	Y495 L497 L552 Q553 G554 F558 I569 A571	Y495-W505 HydrophobicContact CD1-CD2 4.41Å; Y495-W505 AromaticContact CD1-CE2 3.85Å; Y495-W505 HydrophobicContact CD1-CZ2 4.28Å; Y495-W505 AromaticContact CD1-NE1 3.58Å; Y495-W505 AromaticContact CG-CZ2 3.98Å; Y495-W505 HydrophobicContact CG-CZ2 3.98Å; L497-W505 HydrophobicContact CB-CE3 3.66Å; L497-W505 HydrophobicContact CB-CZ3 4.2Å; W505-L552 HydrophobicContact CB-CD2 4.02Å; W505-L552 HydrophobicContact CD2-CB 4.29Å; W505-L552 HydrophobicContact CD2-CD1 4.12Å; W505-L552 HydrophobicContact CD2-CD2 3.92Å; W505-L552 HydrophobicContact CD2-CG 4.33Å; W505-L552 HydrophobicContact CE3-CD1 4.02Å; W505-L552 HydrophobicContact CE3-CD2 4.39Å; W505-L552 HydrophobicContact CG-CD2 3.79Å; W505-L552 HydrophobicContact CH2-CD1 3.97Å; W505-L552 HydrophobicContact CZ2-CB 3.99Å; W505-L552 HydrophobicContact CZ2-CD1 4.12Å; W505-L552 HydrophobicContact CZ3-CD1 3.95Å; W505-Q553 PolarHBondContact NE1-O 2.91Å; W505-G554 WeakPolarHBondContact CZ2-O 3.4Å; W505-F558 HydrophobicContact CH2-CD1 4.32Å; W505-F558 AromaticContact CH2-CE1 3.78Å; W505-F558 HydrophobicContact CH2-CE1 3.78Å; W505-F558 AromaticContact CZ2-CE1 3.93Å; W505-F558 HydrophobicContact CZ2-CE1 3.93Å; W505-F558 HydrophobicContact CZ2-CZ 4.42Å; W505-I569 HydrophobicContact CZ3-CG2 4.47Å; W505-A571 HydrophobicContact CH2-CB 3.57Å; W505-A571 HydrophobicContact CZ2-CB 3.89Å
506	K	87.4	Confident	86.8	Confident	111 Å²	111	49.6 Å²	49.6	48%	0.483	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	141.9	179.2	-65.2	-170	175	-165.3	0	109.6	R504 R508	R504-K506 HydrophobicContact CB-CG 4.35Å; R504-K506 PolarHBondContact O-N 2.96Å; K506-R508 PolarHBondContact O-N 3.08Å; K506-R508 PolarHBondContact O-NH1 2.97Å
507	K	88.6	Confident	85.9	Confident	91 Å²	91	50.2 Å²	50.2	40%	0.396	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	123.2	168.9	-164.7	169	-177.9	165.6	0	109.3	Y493 L494 Y495 D573	Y493-K507 HydrophobicContact CD1-CG 4.3Å; L494-K507 WeakPolarHBondContact O-CA 3.42Å; Y495-K507 HydrophobicContact CD1-CB 4.06Å; Y495-K507 HydrophobicContact CD2-CB 4.41Å; Y495-K507 HydrophobicContact CD2-CG 4.37Å; Y495-K507 HydrophobicContact CE1-CB 3.72Å; Y495-K507 HydrophobicContact CE2-CB 4.08Å; Y495-K507 HydrophobicContact CE2-CD 3.78Å; Y495-K507 HydrophobicContact CE2-CG 4Å; Y495-K507 HydrophobicContact CG-CB 4.39Å; K507-D573 IonicContact NZ-OD2 3.98Å; K507-D573 PolarHBondContact NZ-OD2 3.4Å
508	R	90.5	Very high	85.2	Confident	34 Å²	34	49.2 Å²	49.2	13%	0.128	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	159.2	177	-59.8	174.2	178.9	87.7	-10.8	108.9	Y493 L494 R504 K506 F510 E534	Y493-R508 WeakPolarHBondContact CA-O 3.36Å; L494-R508 PolarHBondContact N-O 3.3Å; L494-R508 PolarHBondContact O-N 3.02Å; R504-R508 PolarHBondContact O-NH1 3.02Å; R504-R508 PolarHBondContact O-NH2 3.38Å; K506-R508 PolarHBondContact O-N 3.08Å; K506-R508 PolarHBondContact O-NH1 2.97Å; R508-F510 HydrophobicContact CB-CD2 4.14Å; R508-F510 HydrophobicContact CB-CE2 3.66Å; R508-F510 HydrophobicContact CB-CZ 4.26Å; R508-F510 WeakPolarHBondContact O-CD2 3.42Å; R508-E534 IonicContact NE-OE2 2.74Å; R508-E534 IonicContact NH2-OE2 3.3Å
509	Y	88.9	Confident	84.9	Confident	7 Å²	7	50.1 Å²	50.1	3%	0.027	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	117	172.1	-169	-104.8	0	0	0	109	R421 T451 S491 Y493 V511 S524 Y525	R421-Y509 HydrophobicContact CG-CD1 3.97Å; R421-Y509 HydrophobicContact CG-CE1 4.09Å; R421-Y509 HydrophobicContact CG-CG 4.39Å; T451-Y509 HydrophobicContact CG2-CE2 4.26Å; S491-Y509 WeakPolarHBondContact CB-OH 3.28Å; S491-Y509 PolarHBondContact OG-OH 3.16Å; Y493-Y509 HydrophobicContact CD1-CD2 4.12Å; Y493-Y509 AromaticContact CD2-CD2 3.89Å; Y493-Y509 HydrophobicContact CD2-CD2 3.89Å; Y493-Y509 HydrophobicContact CD2-CE2 4.38Å; Y493-Y509 AromaticContact CE1-CD2 3.94Å; Y493-Y509 HydrophobicContact CE1-CD2 3.94Å; Y493-Y509 HydrophobicContact CE1-CG 4.37Å; Y493-Y509 AromaticContact CE2-CD2 3.7Å; Y493-Y509 HydrophobicContact CE2-CD2 3.7Å; Y493-Y509 HydrophobicContact CE2-CE2 4.16Å; Y493-Y509 HydrophobicContact CG-CD2 4.09Å; Y493-Y509 AromaticContact CZ-CD2 3.73Å; Y509-V511 HydrophobicContact CD1-CG2 4.05Å; Y509-V511 HydrophobicContact CE1-CG2 3.73Å; Y509-S524 WeakPolarHBondContact O-CA 3.11Å; Y509-Y525 PolarHBondContact O-N 3.15Å
510	F	90.8	Very high	85.1	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	144.5	-178.5	-76.5	-91.1	0	0	0	110.7	S491 G492 L494 A496 W502 R508 M522 C523 F570 W581	S491-F510 WeakPolarHBondContact CA-O 3.23Å; G492-F510 PolarHBondContact N-O 3.29Å; G492-F510 PolarHBondContact O-N 2.76Å; L494-F510 HydrophobicContact CB-CD2 3.67Å; L494-F510 HydrophobicContact CB-CE2 4.01Å; L494-F510 HydrophobicContact CB-CG 4.49Å; L494-F510 HydrophobicContact CD1-CB 4.42Å; L494-F510 HydrophobicContact CD1-CD2 4.44Å; L494-F510 HydrophobicContact CG-CD2 4.44Å; L494-F510 WeakPolarHBondContact O-CE2 3.38Å; A496-F510 HydrophobicContact CB-CE1 4.42Å; A496-F510 HydrophobicContact CB-CE2 3.92Å; A496-F510 HydrophobicContact CB-CZ 3.48Å; A496-F510 VanDerWaalsContact CB-CZ 3.48Å; W502-F510 AromaticContact CD2-CE1 3.85Å; W502-F510 HydrophobicContact CD2-CE1 3.85Å; W502-F510 AromaticContact CD2-CZ 3.98Å; W502-F510 HydrophobicContact CD2-CZ 3.98Å; W502-F510 AromaticContact CE2-CE1 3.4Å; W502-F510 VanDerWaalsContact CE2-CE1 3.4Å; W502-F510 AromaticContact CE2-CZ 3.83Å; W502-F510 HydrophobicContact CE3-CE1 4.17Å; W502-F510 HydrophobicContact CE3-CZ 4.48Å; W502-F510 HydrophobicContact CG-CZ 4.29Å; W502-F510 HydrophobicContact CH2-CD1 4.44Å; W502-F510 AromaticContact CH2-CE1 3.73Å; W502-F510 HydrophobicContact CH2-CE1 3.73Å; W502-F510 HydrophobicContact CZ2-CD1 4.17Å; W502-F510 AromaticContact CZ2-CE1 3.38Å; W502-F510 HydrophobicContact CZ2-CE1 3.38Å; W502-F510 HydrophobicContact CZ2-CZ 4.27Å; W502-F510 HydrophobicContact CZ3-CE1 4.1Å; W502-F510 AromaticContact NE1-CE1 3.82Å; W502-F510 AromaticContact NE1-CZ 3.92Å; R508-F510 HydrophobicContact CB-CD2 4.14Å; R508-F510 HydrophobicContact CB-CE2 3.66Å; R508-F510 HydrophobicContact CB-CZ 4.26Å; R508-F510 WeakPolarHBondContact O-CD2 3.42Å; F510-M522 HydrophobicContact CB-SD 4.06Å; F510-M522 HydrophobicContact CD1-CG 3.75Å; F510-M522 HydrophobicContact CD1-SD 3.85Å; F510-M522 HydrophobicContact CE1-CG 4.21Å; F510-M522 HydrophobicContact CG-SD 4.35Å; F510-C523 CarbonylContact C-O 3.49Å; F510-C523 VanDerWaalsContact CA-O 3.31Å; F510-C523 WeakPolarHBondContact CA-O 3.2Å; F510-F570 HydrophobicContact CE1-CE1 4.07Å; F510-F570 HydrophobicContact CZ-CE1 4.22Å; F510-W581 HydrophobicContact CB-CH2 3.76Å; F510-W581 HydrophobicContact CB-CZ2 4.05Å
511	V	90.2	Very high	85.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	126.1	172.5	-173	0	0	0	0	108	L363 P420 M488 H490 Y509 V513 C523 Y525	L363-V511 HydrophobicContact CD1-CG1 3.88Å; P420-V511 HydrophobicContact CB-CG2 4.41Å; M488-V511 HydrophobicContact CB-CG1 4.34Å; M488-V511 HydrophobicContact CE-CG1 4.4Å; M488-V511 HydrophobicContact CG-CG1 3.52Å; M488-V511 HydrophobicContact SD-CG1 3.48Å; M488-V511 WeakPolarHBondContact SD-CG1 2.95Å; H490-V511 WeakPolarHBondContact O-CA 3.16Å; Y509-V511 HydrophobicContact CD1-CG2 4.05Å; Y509-V511 HydrophobicContact CE1-CG2 3.73Å; V511-V513 HydrophobicContact CB-CG2 4.35Å; V511-V513 HydrophobicContact CG1-CG2 3.78Å; V511-C523 PolarHBondContact N-O 3.2Å; V511-C523 PolarHBondContact O-N 3.43Å; V511-Y525 HydrophobicContact CB-CD2 4.07Å; V511-Y525 HydrophobicContact CB-CE2 3.81Å; V511-Y525 HydrophobicContact CG2-CD2 3.71Å; V511-Y525 HydrophobicContact CG2-CE2 3.91Å
512	L	89.9	Confident	85.6	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	114.1	170.7	178.7	62.4	0	0	0	108.7	K489 H490 F520 L538 W581 A584 A588	K489-L512 HydrophobicContact CB-CB 4.42Å; K489-L512 HydrophobicContact CB-CD2 3.96Å; K489-L512 HydrophobicContact CB-CG 4.05Å; K489-L512 PolarHBondContact N-O 3.28Å; H490-L512 HydrophobicContact CB-CB 4.45Å; H490-L512 PolarHBondContact O-N 2.98Å; L512-F520 HydrophobicContact CD1-CB 4.43Å; L512-L538 HydrophobicContact CD1-CD1 3.4Å; L512-W581 HydrophobicContact CB-CZ3 4.09Å; L512-A584 HydrophobicContact CD2-CB 3.83Å; L512-A588 HydrophobicContact CD1-CB 4.19Å; L512-A588 HydrophobicContact CD2-CB 4.12Å
513	V	87.7	Confident	85.7	Confident	3 Å²	3	36.3 Å²	36.3	2%	0.018	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.1	-176	-176.8	0	0	0	0	110.2	V361 L363 H487 V511 F520 A521	V361-V513 HydrophobicContact CG1-CB 3.58Å; V361-V513 HydrophobicContact CG1-CG1 3.64Å; V361-V513 HydrophobicContact CG1-CG2 3.62Å; L363-V513 HydrophobicContact CD1-CG2 3.95Å; L363-V513 HydrophobicContact CD2-CG1 3.98Å; L363-V513 HydrophobicContact CD2-CG2 4.31Å; L363-V513 HydrophobicContact CG-CG2 4.36Å; H487-V513 CarbonylContact O-C 3.58Å; H487-V513 WeakPolarHBondContact O-CA 3.4Å; V511-V513 HydrophobicContact CB-CG2 4.35Å; V511-V513 HydrophobicContact CG1-CG2 3.78Å; V513-F520 WeakPolarHBondContact O-CA 3.26Å; V513-A521 PolarHBondContact N-O 3.38Å; V513-A521 PolarHBondContact O-N 2.84Å
514	Q	85.1	Confident	85.8	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	113.4	169.9	-173.9	179.5	7.4	0	0	109.4	D267 V325 H487 K489 S516 Q517 F520	D267-Q514 PolarHBondContact OD1-OE1 3.49Å; V325-Q514 HydrophobicContact CG1-CB 4.14Å; V325-Q514 HydrophobicContact CG1-CG 3.75Å; V325-Q514 VanDerWaalsContact CG1-OE1 3.26Å; V325-Q514 HydrophobicContact CG2-CG 4.41Å; H487-Q514 PolarHBondContact ND1-O 3.39Å; H487-Q514 PolarHBondContact O-N 2.79Å; K489-Q514 HydrophobicContact CD-CB 4.5Å; K489-Q514 HydrophobicContact CG-CB 4.19Å; Q514-S516 WeakPolarHBondContact CG-O 3.49Å; Q514-S516 PolarHBondContact NE2-O 3.27Å; Q514-Q517 VanDerWaalsContact NE2-OE1 3.17Å; Q514-F520 HydrophobicContact CB-CD1 3.84Å; Q514-F520 HydrophobicContact CB-CE1 3.58Å; Q514-F520 HydrophobicContact CB-CZ 4.31Å; Q514-F520 HydrophobicContact CG-CD1 3.99Å; Q514-F520 HydrophobicContact CG-CE1 3.48Å; Q514-F520 VanDerWaalsContact CG-CE1 3.48Å; Q514-F520 HydrophobicContact CG-CE2 4.37Å; Q514-F520 HydrophobicContact CG-CZ 3.68Å
515	V	79	Confident	85.8	Confident	34 Å²	34	21.3 Å²	21.3	21%	0.206	10%	0.099	C	C	.	.			trans	-90.5	-42.8	179	-175.4	0	0	0	0	110.6	L356 D360 V361 T519	L356-V515 HydrophobicContact CD1-CG2 4.34Å; L356-V515 HydrophobicContact CD2-CB 4.34Å; L356-V515 HydrophobicContact CD2-CG1 3.8Å; L356-V515 HydrophobicContact CD2-CG2 4.26Å; D360-V515 HydrophobicContact CB-CG1 4.35Å; V361-V515 HydrophobicContact CG2-CG2 4.45Å; V515-T519 HydrophobicContact CB-CG2 4.48Å; V515-T519 PolarHBondContact N-O 3.15Å
516	S	77.1	Confident	85.6	Confident	28 Å²	28	25.6 Å²	25.6	20%	0.196	12%	0.115	C	C	.	.	S	Bend	trans	-138.3	-177.6	175	80.6	0	0	0	0	110.5	Q514 Y518 T519	Q514-S516 WeakPolarHBondContact CG-O 3.49Å; Q514-S516 PolarHBondContact NE2-O 3.27Å; S516-Y518 PolarHBondContact O-N 3.04Å; S516-Y518 PolarHBondContact OG-N 3.44Å; S516-Y518 VanDerWaalsContact OG-N 3.15Å; S516-T519 PolarHBondContact N-O 3.33Å; S516-T519 VanDerWaalsContact OG-CB 3.22Å; S516-T519 WeakPolarHBondContact OG-CB 3.34Å; S516-T519 PolarHBondContact OG-N 3.24Å; S516-T519 PolarHBondContact OG-OG1 3.12Å
517	Q	73.2	Confident	85.2	Confident	13 Å²	13	24.7 Å²	24.7	6%	0.061	11%	0.113	C	C	.	.	S	Bend	trans	-68.9	-16.2	173.5	-63.1	-69.2	-1.8	0	0	113.5	R274 L320 L323 P324 Q514	R274-Q517 WeakPolarHBondContact CD-O 3.41Å; R274-Q517 PolarHBondContact NH1-O 2.95Å; L320-Q517 HydrophobicContact CG-CB 4.21Å; L320-Q517 VanDerWaalsContact O-CG 3.28Å; L320-Q517 WeakPolarHBondContact O-CG 3.47Å; L323-Q517 WeakPolarHBondContact O-CG 3.43Å; L323-Q517 PolarHBondContact O-NE2 3.28Å; P324-Q517 PolarHBondContact O-NE2 3.13Å; Q514-Q517 VanDerWaalsContact NE2-OE1 3.17Å
518	Y	74.2	Confident	84.6	Confident	33 Å²	33	26.3 Å²	26.3	13%	0.129	12%	0.119	C	C	.	.	S	Bend	trans	-111.8	-22.6	174.2	-80.6	-97.3	0	0	0	113.2	R274 L277 M317 L320 E321 S516	R274-Y518 HydrophobicContact CB-CE1 4.21Å; R274-Y518 VanDerWaalsContact CD-CD1 3.47Å; R274-Y518 HydrophobicContact CG-CD1 3.96Å; R274-Y518 HydrophobicContact CG-CE1 3.49Å; R274-Y518 VanDerWaalsContact CG-CE1 3.49Å; R274-Y518 HydrophobicContact CG-CE2 4.39Å; L277-Y518 VanDerWaalsContact CD1-OH 3.24Å; L277-Y518 WeakPolarHBondContact CD1-OH 3.31Å; M317-Y518 HydrophobicContact CB-CE2 4.12Å; M317-Y518 HydrophobicContact CE-CD1 3.91Å; M317-Y518 HydrophobicContact CE-CE1 3.58Å; M317-Y518 HydrophobicContact CG-CE1 4.19Å; M317-Y518 WeakPolarHBondContact CG-OH 3.12Å; M317-Y518 WeakPolarHBondContact O-CE2 3.42Å; L320-Y518 HydrophobicContact CB-CE2 3.97Å; L320-Y518 HydrophobicContact CD2-CE2 3.66Å; L320-Y518 WeakPolarHBondContact CD2-OH 3.47Å; L320-Y518 HydrophobicContact CG-CE2 3.94Å; E321-Y518 HydrophobicContact CG-CD2 3.45Å; E321-Y518 VanDerWaalsContact CG-CD2 3.45Å; E321-Y518 HydrophobicContact CG-CE2 4.01Å; E321-Y518 HydrophobicContact CG-CG 4.4Å; S516-Y518 PolarHBondContact O-N 3.04Å; S516-Y518 PolarHBondContact OG-N 3.44Å; S516-Y518 VanDerWaalsContact OG-N 3.15Å
519	T	79.9	Confident	84.1	Confident	27 Å²	27	30.4 Å²	30.4	17%	0.166	14%	0.138	C	C	.	.			trans	-103.6	113.7	-170	-44.9	0	0	0	0	111.2	L356 V515 S516	L356-T519 HydrophobicContact CD1-CG2 3.38Å; L356-T519 HydrophobicContact CD2-CG2 4.29Å; L356-T519 HydrophobicContact CG-CG2 4.13Å; V515-T519 HydrophobicContact CB-CG2 4.48Å; V515-T519 PolarHBondContact N-O 3.15Å; S516-T519 PolarHBondContact N-O 3.33Å; S516-T519 VanDerWaalsContact OG-CB 3.22Å; S516-T519 WeakPolarHBondContact OG-CB 3.34Å; S516-T519 PolarHBondContact OG-N 3.24Å; S516-T519 PolarHBondContact OG-OG1 3.12Å
520	F	87.3	Confident	83.5	Confident	8 Å²	8	31.9 Å²	31.9	4%	0.035	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	141.1	172.6	-66.8	-99.3	0	0	0	110.2	K489 L512 V513 Q514 L538 A588	K489-F520 HydrophobicContact CG-CE1 4.2Å; L512-F520 HydrophobicContact CD1-CB 4.43Å; V513-F520 WeakPolarHBondContact O-CA 3.26Å; Q514-F520 HydrophobicContact CB-CD1 3.84Å; Q514-F520 HydrophobicContact CB-CE1 3.58Å; Q514-F520 HydrophobicContact CB-CZ 4.31Å; Q514-F520 HydrophobicContact CG-CD1 3.99Å; Q514-F520 HydrophobicContact CG-CE1 3.48Å; Q514-F520 VanDerWaalsContact CG-CE1 3.48Å; Q514-F520 HydrophobicContact CG-CE2 4.37Å; Q514-F520 HydrophobicContact CG-CZ 3.68Å; F520-L538 HydrophobicContact CB-CB 4.34Å; F520-L538 HydrophobicContact CB-CD1 4.33Å; F520-L538 PolarHBondContact O-N 3.03Å; F520-A588 HydrophobicContact CB-CB 3.74Å; F520-A588 HydrophobicContact CD1-CB 3.52Å; F520-A588 HydrophobicContact CD2-CB 4.04Å; F520-A588 VanDerWaalsContact CD2-O 3.23Å; F520-A588 WeakPolarHBondContact CD2-O 3.36Å; F520-A588 HydrophobicContact CE1-CB 4.09Å; F520-A588 HydrophobicContact CG-CB 3.49Å; F520-A588 VanDerWaalsContact CG-CB 3.49Å
521	A	87.9	Confident	83	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.6	179.1	0	0	0	0	0	110.9	L356 V513 M536	L356-A521 HydrophobicContact CD1-CB 4.31Å; V513-A521 PolarHBondContact N-O 3.38Å; V513-A521 PolarHBondContact O-N 2.84Å; A521-M536 CarbonylContact C-O 3.45Å; A521-M536 VanDerWaalsContact CA-O 3.32Å; A521-M536 WeakPolarHBondContact CA-O 3.17Å
522	M	90	Very high	82.7	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	117.2	166.9	-177.5	68	103.9	0	0	108.7	L494 W502 F510 L535 M536 L538 F570 W581 M585	L494-M522 HydrophobicContact CD1-CE 4.4Å; W502-M522 HydrophobicContact CH2-CB 4.17Å; W502-M522 HydrophobicContact CH2-CG 3.83Å; W502-M522 WeakPolarHBondContact CH2-O 3.34Å; W502-M522 HydrophobicContact CZ3-CG 4.41Å; F510-M522 HydrophobicContact CB-SD 4.06Å; F510-M522 HydrophobicContact CD1-CG 3.75Å; F510-M522 HydrophobicContact CD1-SD 3.85Å; F510-M522 HydrophobicContact CE1-CG 4.21Å; F510-M522 HydrophobicContact CG-SD 4.35Å; M522-L535 CarbonylContact O-C 3.6Å; M522-L535 WeakPolarHBondContact O-CA 3.44Å; M522-M536 HydrophobicContact CB-CB 4.47Å; M522-M536 HydrophobicContact CB-CE 4.43Å; M522-M536 PolarHBondContact N-O 3.41Å; M522-M536 PolarHBondContact O-N 3.4Å; M522-L538 HydrophobicContact CB-CD2 4.18Å; M522-L538 HydrophobicContact CB-CG 4.39Å; M522-F570 HydrophobicContact CE-CE1 4.19Å; M522-F570 HydrophobicContact CE-CZ 4.16Å; M522-F570 HydrophobicContact CG-CZ 4.39Å; M522-W581 HydrophobicContact CE-CE3 3.87Å; M522-W581 HydrophobicContact CE-CH2 4.33Å; M522-W581 HydrophobicContact CE-CZ3 3.55Å; M522-W581 HydrophobicContact SD-CH2 4.16Å; M522-W581 HydrophobicContact SD-CZ3 3.74Å; M522-M585 HydrophobicContact CE-CE 3.97Å; M522-M585 HydrophobicContact CE-CG 4.15Å; M522-M585 HydrophobicContact CE-SD 3.46Å; M522-M585 WeakPolarHBondContact CE-SD 3.28Å
523	C	90.1	Very high	82.4	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.9	-169.7	-66.7	0	0	0	0	111.7	V361 F510 V511 Y525 P532	V361-C523 HydrophobicContact CG1-CB 4.35Å; V361-C523 VanDerWaalsContact CG1-SG 3.51Å; F510-C523 CarbonylContact C-O 3.49Å; F510-C523 VanDerWaalsContact CA-O 3.31Å; F510-C523 WeakPolarHBondContact CA-O 3.2Å; V511-C523 PolarHBondContact N-O 3.2Å; V511-C523 PolarHBondContact O-N 3.43Å; C523-Y525 HydrophobicContact CB-CD2 4.28Å; C523-Y525 HydrophobicContact CB-CE2 3.48Å; C523-Y525 VanDerWaalsContact CB-CE2 3.48Å; C523-P532 HydrophobicContact CB-CB 3.92Å
524	S	89.9	Confident	82.3	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.014	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.4	177.8	61.9	0	0	0	0	111.2	W502 Y509 P532 Q533 E534	W502-S524 PolarHBondContact NE1-OG 2.94Å; Y509-S524 WeakPolarHBondContact O-CA 3.11Å; S524-P532 CarbonylContact O-C 3.51Å; S524-P532 WeakPolarHBondContact O-CA 3.39Å; S524-Q533 PolarHBondContact O-N 2.96Å; S524-E534 PolarHBondContact N-O 3.14Å; S524-E534 PolarHBondContact OG-N 3.3Å; S524-E534 PolarHBondContact OG-O 3.28Å
525	Y	86.2	Confident	82.4	Confident	9 Å²	9	44.5 Å²	44.5	4%	0.035	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	148.6	-175.1	-68.7	-94	0	0	0	112.4	V361 P420 Y509 V511 C523 S530 P532	V361-Y525 WeakPolarHBondContact CG1-OH 3.22Å; V361-Y525 PolarHBondContact O-OH 3.47Å; P420-Y525 HydrophobicContact CB-CG 4.34Å; P420-Y525 HydrophobicContact CG-CD1 3.59Å; P420-Y525 HydrophobicContact CG-CD2 4.2Å; P420-Y525 HydrophobicContact CG-CE1 3.74Å; P420-Y525 HydrophobicContact CG-CE2 4.35Å; P420-Y525 HydrophobicContact CG-CG 3.82Å; Y509-Y525 PolarHBondContact O-N 3.15Å; V511-Y525 HydrophobicContact CB-CD2 4.07Å; V511-Y525 HydrophobicContact CB-CE2 3.81Å; V511-Y525 HydrophobicContact CG2-CD2 3.71Å; V511-Y525 HydrophobicContact CG2-CE2 3.91Å; C523-Y525 HydrophobicContact CB-CD2 4.28Å; C523-Y525 HydrophobicContact CB-CE2 3.48Å; C523-Y525 VanDerWaalsContact CB-CE2 3.48Å; Y525-S530 WeakPolarHBondContact CE1-O 3.46Å; Y525-P532 HydrophobicContact CD1-CB 4.32Å; Y525-P532 HydrophobicContact CE1-CB 3.94Å; Y525-P532 HydrophobicContact CE1-CG 4.38Å; Y525-P532 HydrophobicContact CE2-CB 4.25Å
526	R	83.2	Confident	82.9	Confident	137 Å²	137	43.3 Å²	43.3	52%	0.517	20%	0.202	S	C	.	.			trans	-104.7	161.2	169.8	-71.9	-164	-177.2	-174.9	7.2	110.4	K529 Q533	R526-K529 HydrophobicContact CB-CD 4.48Å; R526-Q533 VanDerWaalsContact NE-CD 3.35Å; R526-Q533 VanDerWaalsContact NH2-CD 3.34Å
527	E	79.9	Confident	83.3	Confident	92 Å²	92	44.2 Å²	44.2	43%	0.43	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	141.5	172.6	-63.5	171.1	-168.3	0	0	110.6	R421 K529	R421-E527 IonicContact CZ-OE1 3.43Å; R421-E527 VanDerWaalsContact CZ-OE1 3.23Å; R421-E527 IonicContact NH1-OE1 3.93Å; R421-E527 PolarHBondContact NH1-OE1 2.97Å; R421-E527 IonicContact NH2-OE1 2.87Å; R421-E527 PolarHBondContact NH2-OE1 2.87Å; E527-K529 PolarHBondContact O-N 2.77Å
528	K	75.2	Confident	83.9	Confident	124 Å²	124	43.7 Å²	43.7	54%	0.539	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	28.3	176	-52.8	175.8	-179.3	176.7	0	114.5	V423	V423-K528 HydrophobicContact CG2-CD 4.33Å; V423-K528 HydrophobicContact CG2-CG 3.76Å
529	K	81	Confident	84.2	Confident	121 Å²	121	47.5 Å²	47.5	53%	0.526	22%	0.22	S	C	.	.			trans	-130.5	133	174.4	-67.3	-160.3	173.6	-159.6	0	110.3	R526 E527	R526-K529 HydrophobicContact CB-CD 4.48Å; E527-K529 PolarHBondContact O-N 2.77Å
530	S	76.6	Confident	84.1	Confident	37 Å²	37	48.9 Å²	48.9	26%	0.259	24%	0.239	S	C	.	.	S	Bend	trans	-77.6	-32.7	172.6	50	0	0	0	0	112.5	H419 Y525	H419-S530 PolarHBondContact CD2-N 3.2Å; Y525-S530 WeakPolarHBondContact CE1-O 3.46Å
531	E	80.2	Confident	84	Confident	100 Å²	100	49.3 Å²	49.3	47%	0.467	24%	0.24	S	C	.	.	S	Bend	trans	-91.2	144.1	-178.3	-67.4	-177	-179.1	0	0	113.2
532	P	84.2	Confident	83.9	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.019	25%	0.253	C	S	.	.			trans	-68.4	141.5	174.6	28.9	-33.9	0	0	0	111.6	V361 C523 S524 Y525 L535	V361-P532 HydrophobicContact CB-CG 4.5Å; C523-P532 HydrophobicContact CB-CB 3.92Å; S524-P532 CarbonylContact O-C 3.51Å; S524-P532 WeakPolarHBondContact O-CA 3.39Å; Y525-P532 HydrophobicContact CD1-CB 4.32Å; Y525-P532 HydrophobicContact CE1-CB 3.94Å; Y525-P532 HydrophobicContact CE1-CG 4.38Å; Y525-P532 HydrophobicContact CE2-CB 4.25Å; P532-L535 HydrophobicContact CG-CD2 4.37Å
533	Q	83.6	Confident	83.9	Confident	74 Å²	74	51.4 Å²	51.4	35%	0.346	25%	0.253	S	S	.	.	S	Bend	trans	-69.7	-51.6	177.3	-172.8	-167.8	-24.3	0	0	110.9	K358 S524 R526	K358-Q533 PolarHBondContact NZ-O 2.89Å; S524-Q533 PolarHBondContact O-N 2.96Å; R526-Q533 VanDerWaalsContact NE-CD 3.35Å; R526-Q533 VanDerWaalsContact NH2-CD 3.34Å
534	E	85.1	Confident	83.8	Confident	54 Å²	54	53.5 Å²	53.5	25%	0.252	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	138.5	177	-62.3	172.5	111	0	0	107.1	W502 R508 S524	W502-E534 HydrophobicContact CZ2-CB 4.44Å; W502-E534 PolarHBondContact N-OE1 2.8Å; R508-E534 IonicContact NE-OE2 2.74Å; R508-E534 IonicContact NH2-OE2 3.3Å; S524-E534 PolarHBondContact N-O 3.14Å; S524-E534 PolarHBondContact OG-N 3.3Å; S524-E534 PolarHBondContact OG-O 3.28Å
535	L	87.3	Confident	83.7	Confident	38 Å²	38	55 Å²	55	20%	0.199	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	151	178.5	70	86.6	0	0	0	110.1	K358 M522 P532	K358-L535 HydrophobicContact CG-CD2 4.01Å; M522-L535 CarbonylContact O-C 3.6Å; M522-L535 WeakPolarHBondContact O-CA 3.44Å; P532-L535 HydrophobicContact CG-CD2 4.37Å
536	M	88.6	Confident	83.6	Confident	9 Å²	9	56 Å²	56	4%	0.044	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	123.4	176	-175	175.2	80.4	0	0	109.6	V501 W502 A521 M522 L538 Y541 V568 F570	V501-M536 HydrophobicContact CG2-CB 4.07Å; V501-M536 HydrophobicContact CG2-CG 4.09Å; V501-M536 HydrophobicContact CG2-SD 3.72Å; W502-M536 HydrophobicContact CH2-CB 3.53Å; W502-M536 HydrophobicContact CZ3-CB 3.75Å; W502-M536 HydrophobicContact CZ3-CE 4.08Å; W502-M536 HydrophobicContact CZ3-CG 4.42Å; W502-M536 HydrophobicContact CZ3-SD 3.8Å; A521-M536 CarbonylContact C-O 3.45Å; A521-M536 VanDerWaalsContact CA-O 3.32Å; A521-M536 WeakPolarHBondContact CA-O 3.17Å; M522-M536 HydrophobicContact CB-CB 4.47Å; M522-M536 HydrophobicContact CB-CE 4.43Å; M522-M536 PolarHBondContact N-O 3.41Å; M522-M536 PolarHBondContact O-N 3.4Å; M536-L538 HydrophobicContact CE-CD2 3.5Å; M536-Y541 HydrophobicContact CG-CE2 4.47Å; M536-Y541 HydrophobicContact SD-CE1 4.32Å; M536-V568 HydrophobicContact CE-CG2 4.34Å; M536-V568 HydrophobicContact SD-CB 4.43Å; M536-V568 HydrophobicContact SD-CG2 3.63Å; M536-F570 HydrophobicContact CE-CE2 4.47Å; M536-F570 HydrophobicContact CE-CZ 4.2Å
537	Q	86.6	Confident	83.4	Confident	47 Å²	47	55.4 Å²	55.4	22%	0.22	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	134.7	170.5	-60.2	-177.2	-14.7	0	0	109.5	L356 E539 Y541	L356-Q537 VanDerWaalsContact CB-NE2 3.31Å; L356-Q537 HydrophobicContact CD1-CG 3.57Å; L356-Q537 VanDerWaalsContact CD1-NE2 3.31Å; L356-Q537 HydrophobicContact CG-CG 4.36Å; Q537-E539 VanDerWaalsContact C-N 3.32Å; Q537-Y541 WeakPolarHBondContact O-CD2 3.3Å; Q537-Y541 VanDerWaalsContact O-CE2 3.23Å; Q537-Y541 WeakPolarHBondContact O-CE2 3.46Å
538	L	85	Confident	83.1	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	29%	0.291	C	S	.	.			trans	-89.5	5.2	-178.4	-66.2	-177.9	0	0	0	113.8	L512 F520 M522 M536 G540 Y541 M585 A588 T589	L512-L538 HydrophobicContact CD1-CD1 3.4Å; F520-L538 HydrophobicContact CB-CB 4.34Å; F520-L538 HydrophobicContact CB-CD1 4.33Å; F520-L538 PolarHBondContact O-N 3.03Å; M522-L538 HydrophobicContact CB-CD2 4.18Å; M522-L538 HydrophobicContact CB-CG 4.39Å; M536-L538 HydrophobicContact CE-CD2 3.5Å; L538-G540 PolarHBondContact O-N 3.44Å; L538-Y541 PolarHBondContact O-N 3.27Å; L538-M585 HydrophobicContact CD1-CE 4.28Å; L538-M585 HydrophobicContact CD2-CE 3.81Å; L538-A588 HydrophobicContact CD1-CB 3.96Å; L538-T589 HydrophobicContact CB-CG2 4.37Å
539	E	81	Confident	83	Confident	114 Å²	114	53.6 Å²	53.6	53%	0.533	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	122.3	180	-169.8	174.1	174.9	0	0	111.7	Q537 Y541 K563	Q537-E539 VanDerWaalsContact C-N 3.32Å; E539-Y541 VanDerWaalsContact C-N 3.32Å; E539-K563 PolarHBondContact O-NZ 2.95Å
540	G	76.4	Confident	82.1	Confident	55 Å²	55	54.1 Å²	54.1	57%	0.567	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	7.8	-177.2	0	0	0	0	0	115.3	L538 K563	L538-G540 PolarHBondContact O-N 3.44Å; G540-K563 WeakPolarHBondContact O-CG 3.48Å
541	Y	85.3	Confident	81.7	Confident	17 Å²	17	56.1 Å²	56.1	7%	0.067	33%	0.327	C	S	.	.			trans	-88	144.5	172.4	-76.8	-95.2	0	0	0	111.4	M536 Q537 L538 E539 A561 V562 K563 D566 T589	M536-Y541 HydrophobicContact CG-CE2 4.47Å; M536-Y541 HydrophobicContact SD-CE1 4.32Å; Q537-Y541 WeakPolarHBondContact O-CD2 3.3Å; Q537-Y541 VanDerWaalsContact O-CE2 3.23Å; Q537-Y541 WeakPolarHBondContact O-CE2 3.46Å; L538-Y541 PolarHBondContact O-N 3.27Å; E539-Y541 VanDerWaalsContact C-N 3.32Å; Y541-A561 HydrophobicContact CD1-CB 4.02Å; Y541-V562 CarbonylContact C-O 3.49Å; Y541-V562 VanDerWaalsContact CA-O 3.29Å; Y541-V562 WeakPolarHBondContact CA-O 3.26Å; Y541-K563 HydrophobicContact CD1-CB 3.66Å; Y541-K563 HydrophobicContact CD2-CB 4.06Å; Y541-K563 HydrophobicContact CD2-CD 3.88Å; Y541-K563 HydrophobicContact CE1-CB 3.61Å; Y541-K563 HydrophobicContact CE2-CB 4.03Å; Y541-K563 HydrophobicContact CE2-CD 3.63Å; Y541-K563 HydrophobicContact CE2-CG 4.47Å; Y541-K563 HydrophobicContact CG-CB 3.89Å; Y541-D566 PolarHBondContact OH-OD2 2.83Å; Y541-D566 VanDerWaalsContact OH-OD2 3.04Å; Y541-T589 WeakPolarHBondContact O-CB 3.43Å; Y541-T589 WeakPolarHBondContact O-CG2 3.12Å
542	T	85.6	Confident	81.6	Confident	44 Å²	44	53.5 Å²	53.5	27%	0.27	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	151.2	164.6	62.5	0	0	0	0	110.1	A561 V562 Q591	T542-A561 CarbonylContact O-C 3.56Å; T542-A561 WeakPolarHBondContact O-CA 3.45Å; T542-V562 PolarHBondContact N-O 2.76Å; T542-V562 PolarHBondContact O-N 2.9Å; T542-Q591 HydrophobicContact CG2-CB 4.09Å
543	V	89.9	Confident	80.8	Confident	0 Å²	0	62 Å²	62	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	129.8	-176.1	177.6	0	0	0	0	108.9	F559 N560 A561 V582 M585 T589 Q591 P595	V543-F559 HydrophobicContact CG1-CD2 4.25Å; V543-N560 VanDerWaalsContact CA-O 3.26Å; V543-N560 WeakPolarHBondContact CA-O 3.2Å; V543-A561 HydrophobicContact CG2-CB 4.37Å; V543-V582 HydrophobicContact CG1-CB 4.46Å; V543-V582 HydrophobicContact CG1-CG1 4.09Å; V543-V582 HydrophobicContact CG1-CG2 4.28Å; V543-M585 HydrophobicContact CB-CB 4.44Å; V543-M585 HydrophobicContact CG1-CB 4.27Å; V543-M585 HydrophobicContact CG2-CB 3.65Å; V543-M585 HydrophobicContact CG2-CE 3.84Å; V543-M585 HydrophobicContact CG2-SD 4.44Å; V543-T589 HydrophobicContact CG2-CG2 3.91Å; V543-Q591 PolarHBondContact O-NE2 2.9Å; V543-Q591 VanDerWaalsContact O-NE2 3.09Å; V543-Q591 PolarHBondContact O-OE1 2.83Å; V543-P595 VanDerWaalsContact O-CG 3.24Å; V543-P595 WeakPolarHBondContact O-CG 3.16Å
544	D	88.2	Confident	80	Confident	44 Å²	44	60 Å²	60	24%	0.235	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	154	179.1	-80.7	-54.3	0	0	0	112.7	F559 N560 Y593	D544-F559 CarbonylContact O-C 3.53Å; D544-F559 VanDerWaalsContact O-CA 3.28Å; D544-F559 WeakPolarHBondContact O-CA 3.44Å; D544-F559 WeakPolarHBondContact O-CB 3.41Å; D544-N560 PolarHBondContact N-O 3.21Å; D544-N560 VanDerWaalsContact N-O 3.1Å; D544-N560 PolarHBondContact O-N 3.19Å; D544-N560 PolarHBondContact O-OD1 2.82Å; D544-Y593 WeakPolarHBondContact OD1-CE2 3.47Å; D544-Y593 PolarHBondContact OD2-OH 3.42Å
545	Y	88.3	Confident	79.4	Confident	35 Å²	35	58 Å²	58	14%	0.137	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	135.8	169.7	-66.8	-85.1	0	0	0	109.3	R578 V582 P595 V596 P597	Y545-R578 HydrophobicContact CD1-CG 4.34Å; Y545-R578 HydrophobicContact CE1-CG 4.02Å; Y545-V582 HydrophobicContact CD1-CG2 4.26Å; Y545-V582 HydrophobicContact CD2-CG1 4.34Å; Y545-V582 HydrophobicContact CE1-CB 4.21Å; Y545-V582 HydrophobicContact CE1-CG1 4.33Å; Y545-V582 HydrophobicContact CE1-CG2 3.84Å; Y545-V582 HydrophobicContact CE2-CB 4.4Å; Y545-V582 HydrophobicContact CE2-CG1 3.67Å; Y545-P595 HydrophobicContact CD2-CB 3.92Å; Y545-P595 HydrophobicContact CE2-CB 3.83Å; Y545-V596 VanDerWaalsContact CD2-C 3.42Å; Y545-V596 WeakPolarHBondContact CD2-O 3.24Å; Y545-P597 HydrophobicContact CD2-CB 4.46Å; Y545-P597 HydrophobicContact CD2-CG 4.4Å; Y545-P597 HydrophobicContact CE1-CB 4.39Å; Y545-P597 HydrophobicContact CE1-CG 4.3Å; Y545-P597 HydrophobicContact CE2-CB 4.29Å; Y545-P597 HydrophobicContact CE2-CG 3.79Å
546	T	84	Confident	78.8	Confident	28 Å²	28	60.2 Å²	60.2	17%	0.172	37%	0.366	C	S	.	.			trans	-128.2	151.1	-179.6	55.7	0	0	0	0	111.6	F558 F559 N560	T546-F558 PolarHBondContact N-O 3.48Å; T546-F558 WeakPolarHBondContact OG1-CB 3.45Å; T546-F559 WeakPolarHBondContact OG1-CA 3.43Å; T546-F559 PolarHBondContact OG1-N 3.36Å; T546-N560 HydrophobicContact CG2-CB 3.78Å; T546-N560 WeakPolarHBondContact CG2-ND2 3.33Å; T546-N560 WeakPolarHBondContact CG2-OD1 3.41Å
547	D	78.9	Confident	78.6	Confident	126 Å²	126	62.8 Å²	62.8	67%	0.674	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-67	154.9	173.1	-69.5	-43.2	0	0	0	112.3	H549	D547-H549 PolarHBondContact O-N 2.91Å; D547-H549 PolarHBondContact O-ND1 3.45Å
548	P	75.1	Confident	78.7	Confident	89 Å²	89	60.9 Å²	60.9	58%	0.578	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-56.2	126.8	177.1	-23	32.9	0	0	0	112.1	P550 F558	P548-P550 WeakPolarHBondContact O-CD 3.24Å; P548-F558 HydrophobicContact CB-CD2 3.98Å; P548-F558 HydrophobicContact CB-CE2 3.95Å; P548-F558 HydrophobicContact CG-CD2 4.4Å
549	H	73.1	Confident	79	Confident	88 Å²	88	60.8 Å²	60.8	41%	0.407	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-82.4	121	179.8	-92.4	57.5	0	0	0	111.5	D547 G551 L552 F558	D547-H549 PolarHBondContact O-N 2.91Å; D547-H549 PolarHBondContact O-ND1 3.45Å; H549-G551 PolarHBondContact O-N 3.4Å; H549-L552 HydrophobicContact CB-CD1 4.11Å; H549-F558 HydrophobicContact CB-CE1 4.44Å
550	P	60.5	Low	79.5	Confident	133 Å²	133	56.7 Å²	56.7	86%	0.864	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	116.9	177.8	25.1	-30.2	0	0	0	110.5	P548	P548-P550 WeakPolarHBondContact O-CD 3.24Å
551	G	68.7	Low	80.2	Confident	78 Å²	78	54.1 Å²	54.1	80%	0.804	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.5	-9.1	177.1	0	0	0	0	0	115.6	H549	H549-G551 PolarHBondContact O-N 3.4Å
552	L	78.3	Confident	80.3	Confident	46 Å²	46	55.5 Å²	55.5	24%	0.241	33%	0.334	C	S	.	.			trans	-99.6	120	174.1	-62.5	177.1	0	0	0	109.9	L497 W505 H549 F558	L497-L552 HydrophobicContact CD2-CD2 4.34Å; W505-L552 HydrophobicContact CB-CD2 4.02Å; W505-L552 HydrophobicContact CD2-CB 4.29Å; W505-L552 HydrophobicContact CD2-CD1 4.12Å; W505-L552 HydrophobicContact CD2-CD2 3.92Å; W505-L552 HydrophobicContact CD2-CG 4.33Å; W505-L552 HydrophobicContact CE3-CD1 4.02Å; W505-L552 HydrophobicContact CE3-CD2 4.39Å; W505-L552 HydrophobicContact CG-CD2 3.79Å; W505-L552 HydrophobicContact CH2-CD1 3.97Å; W505-L552 HydrophobicContact CZ2-CB 3.99Å; W505-L552 HydrophobicContact CZ2-CD1 4.12Å; W505-L552 HydrophobicContact CZ3-CD1 3.95Å; H549-L552 HydrophobicContact CB-CD1 4.11Å; L552-F558 HydrophobicContact CB-CE1 4.44Å; L552-F558 HydrophobicContact CD1-CE1 4.22Å
553	Q	67.7	Low	80.3	Confident	182 Å²	182	57 Å²	57	85%	0.85	34%	0.337	S	S	*	.			trans	-94.3	129.1	175.9	-70.9	-176.4	-5.8	0	0	110.5	W505	W505-Q553 PolarHBondContact NE1-O 2.91Å
554	G	66.3	Low	79.7	Confident	32 Å²	32	66.3 Å²	66.3	33%	0.33	38%	0.381	S	S	.	.	S	Bend	trans	96.9	141.4	-176.8	0	0	0	0	0	112.9	W505	W505-G554 WeakPolarHBondContact CZ2-O 3.4Å
555	G	72.1	Confident	79.1	Confident	12 Å²	12	67.4 Å²	67.4	12%	0.124	40%	0.403	C	S	.	.			trans	77.9	123.5	-168.3	0	0	0	0	0	112.3	F558 S572 D573	G555-F558 WeakPolarHBondContact O-CE2 3.22Å; G555-S572 CarbonylContact C-O 3.57Å; G555-S572 WeakPolarHBondContact CA-O 3.36Å; G555-D573 PolarHBondContact N-OD1 3.48Å
556	C	75.8	Confident	79	Confident	83 Å²	83	65.9 Å²	65.9	56%	0.561	40%	0.397	S	S	*	.	S	Bend	trans	-95.8	-29.3	-178.7	-67.2	0	0	0	0	112.1	S572	C556-S572 PolarHBondContact N-O 3.4Å
557	M	84.6	Confident	79.1	Confident	63 Å²	63	66.8 Å²	66.8	31%	0.31	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	115.6	-170.5	-54.5	-54	-170.5	0	0	109.9	A571 S572 E575 R578	M557-A571 VanDerWaalsContact O-CA 3.27Å; M557-A571 WeakPolarHBondContact O-CA 3.41Å; M557-S572 PolarHBondContact N-O 3.4Å; M557-S572 VanDerWaalsContact N-O 3.13Å; M557-S572 PolarHBondContact O-N 3.11Å; M557-E575 HydrophobicContact CE-CB 4.14Å; M557-E575 HydrophobicContact CG-CB 4.3Å; M557-E575 VanDerWaalsContact CG-OE2 3.27Å; M557-E575 WeakPolarHBondContact CG-OE2 3.43Å; M557-R578 HydrophobicContact CB-CB 4.14Å; M557-R578 HydrophobicContact CB-CG 4.46Å
558	F	88.4	Confident	79.6	Confident	8 Å²	8	60.8 Å²	60.8	4%	0.035	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	149.7	-170.9	-67.3	-105.1	0	0	0	112.4	W505 T546 P548 H549 L552 G555 I569 F570 A571 R578	W505-F558 HydrophobicContact CH2-CD1 4.32Å; W505-F558 AromaticContact CH2-CE1 3.78Å; W505-F558 HydrophobicContact CH2-CE1 3.78Å; W505-F558 AromaticContact CZ2-CE1 3.93Å; W505-F558 HydrophobicContact CZ2-CE1 3.93Å; W505-F558 HydrophobicContact CZ2-CZ 4.42Å; T546-F558 PolarHBondContact N-O 3.48Å; T546-F558 WeakPolarHBondContact OG1-CB 3.45Å; P548-F558 HydrophobicContact CB-CD2 3.98Å; P548-F558 HydrophobicContact CB-CE2 3.95Å; P548-F558 HydrophobicContact CG-CD2 4.4Å; H549-F558 HydrophobicContact CB-CE1 4.44Å; L552-F558 HydrophobicContact CB-CE1 4.44Å; L552-F558 HydrophobicContact CD1-CE1 4.22Å; G555-F558 WeakPolarHBondContact O-CE2 3.22Å; F558-I569 HydrophobicContact CD1-CG2 4.09Å; F558-F570 WeakPolarHBondContact CA-O 3.41Å; F558-A571 HydrophobicContact CD1-CB 3.76Å; F558-A571 HydrophobicContact CD2-CB 4.39Å; F558-A571 HydrophobicContact CE1-CB 3.82Å; F558-A571 HydrophobicContact CE2-CB 4.43Å; F558-A571 HydrophobicContact CG-CB 4.06Å; F558-A571 HydrophobicContact CZ-CB 4.16Å; F558-R578 WeakPolarHBondContact O-CD 3.42Å; F558-R578 PolarHBondContact O-NH1 2.73Å
559	F	91.5	Very high	80.3	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	158.3	168.9	65	-83.2	0	0	0	109.6	L494 V543 D544 T546 F570 R578 W581 V582 M585	L494-F559 HydrophobicContact CD1-CZ 3.91Å; L494-F559 HydrophobicContact CD2-CE1 4.07Å; L494-F559 HydrophobicContact CD2-CZ 4.24Å; V543-F559 HydrophobicContact CG1-CD2 4.25Å; D544-F559 CarbonylContact O-C 3.53Å; D544-F559 VanDerWaalsContact O-CA 3.28Å; D544-F559 WeakPolarHBondContact O-CA 3.44Å; D544-F559 WeakPolarHBondContact O-CB 3.41Å; T546-F559 WeakPolarHBondContact OG1-CA 3.43Å; T546-F559 PolarHBondContact OG1-N 3.36Å; F559-F570 HydrophobicContact CD1-CB 3.98Å; F559-F570 HydrophobicContact CD2-CB 3.91Å; F559-F570 HydrophobicContact CD2-CD2 4.14Å; F559-F570 HydrophobicContact CD2-CG 4.41Å; F559-F570 HydrophobicContact CE1-CB 3.54Å; F559-F570 HydrophobicContact CE2-CB 3.45Å; F559-F570 VanDerWaalsContact CE2-CB 3.45Å; F559-F570 AromaticContact CE2-CD2 3.65Å; F559-F570 HydrophobicContact CE2-CD2 3.65Å; F559-F570 AromaticContact CE2-CG 3.72Å; F559-F570 HydrophobicContact CE2-CG 3.72Å; F559-F570 HydrophobicContact CG-CB 4.17Å; F559-F570 HydrophobicContact CZ-CB 3.26Å; F559-F570 HydrophobicContact CZ-CD2 4.25Å; F559-F570 AromaticContact CZ-CG 3.83Å; F559-F570 HydrophobicContact CZ-CG 3.83Å; F559-F570 PolarHBondContact N-O 3.23Å; F559-F570 PolarHBondContact O-N 2.69Å; F559-R578 HydrophobicContact CD1-CG 3.92Å; F559-W581 HydrophobicContact CE1-CB 4.19Å; F559-W581 HydrophobicContact CE2-CB 4.49Å; F559-W581 HydrophobicContact CZ-CB 3.81Å; F559-W581 HydrophobicContact CZ-CG 4.26Å; F559-V582 HydrophobicContact CB-CG2 3.76Å; F559-V582 HydrophobicContact CD1-CG2 4.31Å; F559-V582 HydrophobicContact CD2-CG2 4Å; F559-V582 HydrophobicContact CG-CG2 3.78Å; F559-M585 HydrophobicContact CD2-SD 4.49Å; F559-M585 HydrophobicContact CE2-SD 3.63Å; F559-M585 HydrophobicContact CZ-SD 4.45Å
560	N	91	Very high	81.2	Confident	28 Å²	28	53.5 Å²	53.5	15%	0.15	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	159.3	179.5	67.7	-5.6	0	0	0	112.4	V543 D544 T546 V562 V568	V543-N560 VanDerWaalsContact CA-O 3.26Å; V543-N560 WeakPolarHBondContact CA-O 3.2Å; D544-N560 PolarHBondContact N-O 3.21Å; D544-N560 VanDerWaalsContact N-O 3.1Å; D544-N560 PolarHBondContact O-N 3.19Å; D544-N560 PolarHBondContact O-OD1 2.82Å; T546-N560 HydrophobicContact CG2-CB 3.78Å; T546-N560 WeakPolarHBondContact CG2-ND2 3.33Å; T546-N560 WeakPolarHBondContact CG2-OD1 3.41Å; N560-V562 HydrophobicContact CB-CG2 4.5Å; N560-V562 WeakPolarHBondContact ND2-CG2 3.45Å; N560-V568 CarbonylContact C-O 3.56Å; N560-V568 VanDerWaalsContact CA-O 3.31Å; N560-V568 WeakPolarHBondContact CA-O 3.29Å
561	A	90.8	Very high	82.6	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.2	165.3	0	0	0	0	0	108.9	Y541 T542 V543 V568 F570 M585	Y541-A561 HydrophobicContact CD1-CB 4.02Å; T542-A561 CarbonylContact O-C 3.56Å; T542-A561 WeakPolarHBondContact O-CA 3.45Å; V543-A561 HydrophobicContact CG2-CB 4.37Å; A561-V568 PolarHBondContact N-O 2.9Å; A561-V568 PolarHBondContact O-N 3.49Å; A561-F570 HydrophobicContact CB-CE2 4.08Å; A561-M585 HydrophobicContact CB-CE 3.99Å
562	V	87.6	Confident	83.6	Confident	46 Å²	46	43.5 Å²	43.5	28%	0.279	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	133	-172.6	-173.7	0	0	0	0	110.7	Y541 T542 N560 T567	Y541-V562 CarbonylContact C-O 3.49Å; Y541-V562 VanDerWaalsContact CA-O 3.29Å; Y541-V562 WeakPolarHBondContact CA-O 3.26Å; T542-V562 PolarHBondContact N-O 2.76Å; T542-V562 PolarHBondContact O-N 2.9Å; N560-V562 HydrophobicContact CB-CG2 4.5Å; N560-V562 WeakPolarHBondContact ND2-CG2 3.45Å; V562-T567 HydrophobicContact CG2-CG2 4.12Å
563	K	85.2	Confident	83.9	Confident	76 Å²	76	45 Å²	45	33%	0.33	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	156.4	169.4	179.8	169.9	-178.5	171.6	0	107.9	E539 G540 Y541 G565 D566	E539-K563 PolarHBondContact O-NZ 2.95Å; G540-K563 WeakPolarHBondContact O-CG 3.48Å; Y541-K563 HydrophobicContact CD1-CB 3.66Å; Y541-K563 HydrophobicContact CD2-CB 4.06Å; Y541-K563 HydrophobicContact CD2-CD 3.88Å; Y541-K563 HydrophobicContact CE1-CB 3.61Å; Y541-K563 HydrophobicContact CE2-CB 4.03Å; Y541-K563 HydrophobicContact CE2-CD 3.63Å; Y541-K563 HydrophobicContact CE2-CG 4.47Å; Y541-K563 HydrophobicContact CG-CB 3.89Å; K563-G565 PolarHBondContact O-N 3.18Å; K563-D566 PolarHBondContact N-O 3.2Å; K563-D566 PolarHBondContact O-N 3.33Å
564	E	77.9	Confident	84.7	Confident	195 Å²	195	40.5 Å²	40.5	91%	0.911	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.5	110.5	179.1	-67.5	-172.3	167.2	0	0	111.5
565	G	75.6	Confident	85.5	Confident	68 Å²	68	41.4 Å²	41.4	70%	0.701	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.2	9.6	-178.8	0	0	0	0	0	117	K563	K563-G565 PolarHBondContact O-N 3.18Å
566	D	85.7	Confident	86	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.011	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	142.1	172.9	-160	-3.1	0	0	0	111.7	K500 Y541 K563	K500-D566 WeakPolarHBondContact CB-OD2 3.41Å; K500-D566 WeakPolarHBondContact CD-OD2 3.29Å; K500-D566 WeakPolarHBondContact CG-OD2 3.4Å; Y541-D566 PolarHBondContact OH-OD2 2.83Å; Y541-D566 VanDerWaalsContact OH-OD2 3.04Å; K563-D566 PolarHBondContact N-O 3.2Å; K563-D566 PolarHBondContact O-N 3.33Å
567	T	86.9	Confident	86.5	Confident	47 Å²	47	44.1 Å²	44.1	29%	0.288	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	129.1	178.9	-60	0	0	0	0	109.7	V562	V562-T567 HydrophobicContact CG2-CG2 4.12Å
568	V	89.8	Confident	86.6	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	121.8	177	-172.2	0	0	0	0	109.2	L497 V501 W502 M536 N560 A561 F570	L497-V568 WeakPolarHBondContact O-CA 3.27Å; V501-V568 HydrophobicContact CG2-CG2 4.5Å; W502-V568 HydrophobicContact CE3-CG1 4.07Å; W502-V568 HydrophobicContact CZ3-CG1 4.41Å; M536-V568 HydrophobicContact CE-CG2 4.34Å; M536-V568 HydrophobicContact SD-CB 4.43Å; M536-V568 HydrophobicContact SD-CG2 3.63Å; N560-V568 CarbonylContact C-O 3.56Å; N560-V568 VanDerWaalsContact CA-O 3.31Å; N560-V568 WeakPolarHBondContact CA-O 3.29Å; A561-V568 PolarHBondContact N-O 2.9Å; A561-V568 PolarHBondContact O-N 3.49Å; V568-F570 HydrophobicContact CB-CE2 4Å; V568-F570 HydrophobicContact CB-CZ 4.31Å; V568-F570 HydrophobicContact CG1-CD2 4.25Å; V568-F570 HydrophobicContact CG1-CE1 4.12Å; V568-F570 HydrophobicContact CG1-CE2 3.59Å; V568-F570 HydrophobicContact CG1-CZ 3.51Å
569	I	89.8	Confident	86.6	Confident	25 Å²	25	44.1 Å²	44.1	13%	0.128	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	130.9	177.7	-57.4	172.5	0	0	0	108.1	A496 L497 W505 F558	A496-I569 CarbonylContact C-O 3.57Å; A496-I569 VanDerWaalsContact CA-O 3.27Å; A496-I569 WeakPolarHBondContact CA-O 3.35Å; L497-I569 PolarHBondContact N-O 3.17Å; L497-I569 PolarHBondContact O-N 2.94Å; W505-I569 HydrophobicContact CZ3-CG2 4.47Å; F558-I569 HydrophobicContact CD1-CG2 4.09Å
570	F	91.2	Very high	86.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	150.7	174.2	-63	-83.6	0	0	0	111.1	L494 Y495 A496 W502 F510 M522 M536 F558 F559 A561 V568 M585	L494-F570 HydrophobicContact CB-CD1 4.47Å; L494-F570 HydrophobicContact CD1-CD1 4.05Å; Y495-F570 CarbonylContact O-C 3.55Å; Y495-F570 WeakPolarHBondContact O-CA 3.39Å; A496-F570 HydrophobicContact CB-CD1 3.64Å; A496-F570 HydrophobicContact CB-CE1 3.69Å; W502-F570 HydrophobicContact CZ3-CE1 4.39Å; W502-F570 HydrophobicContact CZ3-CZ 4.12Å; F510-F570 HydrophobicContact CE1-CE1 4.07Å; F510-F570 HydrophobicContact CZ-CE1 4.22Å; M522-F570 HydrophobicContact CE-CE1 4.19Å; M522-F570 HydrophobicContact CE-CZ 4.16Å; M522-F570 HydrophobicContact CG-CZ 4.39Å; M536-F570 HydrophobicContact CE-CE2 4.47Å; M536-F570 HydrophobicContact CE-CZ 4.2Å; F558-F570 WeakPolarHBondContact CA-O 3.41Å; F559-F570 HydrophobicContact CD1-CB 3.98Å; F559-F570 HydrophobicContact CD2-CB 3.91Å; F559-F570 HydrophobicContact CD2-CD2 4.14Å; F559-F570 HydrophobicContact CD2-CG 4.41Å; F559-F570 HydrophobicContact CE1-CB 3.54Å; F559-F570 HydrophobicContact CE2-CB 3.45Å; F559-F570 VanDerWaalsContact CE2-CB 3.45Å; F559-F570 AromaticContact CE2-CD2 3.65Å; F559-F570 HydrophobicContact CE2-CD2 3.65Å; F559-F570 AromaticContact CE2-CG 3.72Å; F559-F570 HydrophobicContact CE2-CG 3.72Å; F559-F570 HydrophobicContact CG-CB 4.17Å; F559-F570 HydrophobicContact CZ-CB 3.26Å; F559-F570 HydrophobicContact CZ-CD2 4.25Å; F559-F570 AromaticContact CZ-CG 3.83Å; F559-F570 HydrophobicContact CZ-CG 3.83Å; F559-F570 PolarHBondContact N-O 3.23Å; F559-F570 PolarHBondContact O-N 2.69Å; A561-F570 HydrophobicContact CB-CE2 4.08Å; V568-F570 HydrophobicContact CB-CE2 4Å; V568-F570 HydrophobicContact CB-CZ 4.31Å; V568-F570 HydrophobicContact CG1-CD2 4.25Å; V568-F570 HydrophobicContact CG1-CE1 4.12Å; V568-F570 HydrophobicContact CG1-CE2 3.59Å; V568-F570 HydrophobicContact CG1-CZ 3.51Å; F570-M585 HydrophobicContact CE2-CE 4.12Å
571	A	90.5	Very high	86.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	139.4	167.6	0	0	0	0	0	112.2	Y495 W505 M557 F558	Y495-A571 PolarHBondContact N-O 3.28Å; Y495-A571 PolarHBondContact O-N 3.34Å; W505-A571 HydrophobicContact CH2-CB 3.57Å; W505-A571 HydrophobicContact CZ2-CB 3.89Å; M557-A571 VanDerWaalsContact O-CA 3.27Å; M557-A571 WeakPolarHBondContact O-CA 3.41Å; F558-A571 HydrophobicContact CD1-CB 3.76Å; F558-A571 HydrophobicContact CD2-CB 4.39Å; F558-A571 HydrophobicContact CE1-CB 3.82Å; F558-A571 HydrophobicContact CE2-CB 4.43Å; F558-A571 HydrophobicContact CG-CB 4.06Å; F558-A571 HydrophobicContact CZ-CB 4.16Å
572	S	88.4	Confident	86.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	160.3	170.3	64.1	0	0	0	0	110.8	G555 C556 M557 D574 R578	G555-S572 CarbonylContact C-O 3.57Å; G555-S572 WeakPolarHBondContact CA-O 3.36Å; C556-S572 PolarHBondContact N-O 3.4Å; M557-S572 PolarHBondContact N-O 3.4Å; M557-S572 VanDerWaalsContact N-O 3.13Å; M557-S572 PolarHBondContact O-N 3.11Å; S572-D574 PolarHBondContact OG-O 3.29Å; S572-R578 WeakPolarHBondContact OG-CB 3.49Å
573	D	85.3	Confident	86.3	Confident	77 Å²	77	47.8 Å²	47.8	41%	0.412	25%	0.252	S	S	.	.	S	Bend	trans	-81.4	-22.3	175.2	-65.4	-35.9	0	0	0	112.1	K507 G555	K507-D573 IonicContact NZ-OD2 3.98Å; K507-D573 PolarHBondContact NZ-OD2 3.4Å; G555-D573 PolarHBondContact N-OD1 3.48Å
574	D	84.6	Confident	86.3	Confident	89 Å²	89	44.7 Å²	44.7	48%	0.476	24%	0.241	S	C	.	.	S	Bend	trans	-125.5	148.5	-177.2	-179.6	48.7	0	0	0	112.5	S572 Q576 D577 R578	S572-D574 PolarHBondContact OG-O 3.29Å; D574-Q576 VanDerWaalsContact OD2-CB 3.24Å; D574-Q576 WeakPolarHBondContact OD2-CB 3.33Å; D574-Q576 PolarHBondContact OD2-N 3.3Å; D574-D577 HydrophobicContact CB-CB 4.27Å; D574-D577 PolarHBondContact OD2-N 3.43Å; D574-R578 PolarHBondContact O-N 2.96Å; D574-R578 VanDerWaalsContact O-N 3.14Å
575	E	82.4	Confident	86.8	Confident	50 Å²	50	35.4 Å²	35.4	23%	0.234	20%	0.198	C	C	.	.	H	α-helix	trans	-71.7	-39.8	-178.9	-177.6	56.1	-149	0	0	112.1	M557 D577 R578 I579	M557-E575 HydrophobicContact CE-CB 4.14Å; M557-E575 HydrophobicContact CG-CB 4.3Å; M557-E575 VanDerWaalsContact CG-OE2 3.27Å; M557-E575 WeakPolarHBondContact CG-OE2 3.43Å; E575-D577 VanDerWaalsContact C-N 3.31Å; E575-D577 PolarHBondContact O-N 2.97Å; E575-R578 WeakPolarHBondContact O-CB 3.47Å; E575-R578 PolarHBondContact O-N 2.88Å; E575-R578 IonicContact OE1-CZ 3.12Å; E575-R578 VanDerWaalsContact OE1-CZ 3.32Å; E575-R578 IonicContact OE1-NE 3.12Å; E575-R578 PolarHBondContact OE1-NE 3.48Å; E575-R578 IonicContact OE1-NH2 2.83Å; E575-R578 PolarHBondContact OE1-NH2 3.47Å; E575-R578 IonicContact OE2-CZ 2.71Å; E575-R578 IonicContact OE2-NE 2.68Å; E575-R578 PolarHBondContact OE2-NE 3.32Å; E575-R578 VanDerWaalsContact OE2-NE 3.12Å; E575-R578 IonicContact OE2-NH2 3.32Å; E575-R578 PolarHBondContact OE2-NH2 2.97Å; E575-I579 HydrophobicContact CG-CD1 4.21Å; E575-I579 WeakPolarHBondContact O-CG1 3.41Å; E575-I579 PolarHBondContact O-N 3.34Å
576	Q	84.1	Confident	87.3	Confident	118 Å²	118	33.8 Å²	33.8	55%	0.551	17%	0.171	S	C	*	.	H	α-helix	trans	-65.8	-40	179.7	-167	67.1	6.9	0	0	110.5	D574 I579 L580	D574-Q576 VanDerWaalsContact OD2-CB 3.24Å; D574-Q576 WeakPolarHBondContact OD2-CB 3.33Å; D574-Q576 PolarHBondContact OD2-N 3.3Å; Q576-I579 PolarHBondContact O-N 3.14Å; Q576-L580 WeakPolarHBondContact O-CG 3.35Å; Q576-L580 PolarHBondContact O-N 2.99Å; Q576-L580 VanDerWaalsContact O-N 3.08Å
577	D	85.1	Confident	87.2	Confident	35 Å²	35	37.6 Å²	37.6	19%	0.187	19%	0.185	C	C	.	.	H	α-helix	trans	-62.8	-40.9	173.5	-163.7	45	0	0	0	111.6	H490 D574 E575 I579 L580 W581	H490-D577 IonicContact NE2-OD1 3.87Å; D574-D577 HydrophobicContact CB-CB 4.27Å; D574-D577 PolarHBondContact OD2-N 3.43Å; E575-D577 VanDerWaalsContact C-N 3.31Å; E575-D577 PolarHBondContact O-N 2.97Å; D577-I579 PolarHBondContact O-N 2.86Å; D577-L580 PolarHBondContact O-N 3.07Å; D577-W581 PolarHBondContact O-N 3.25Å
578	R	87.9	Confident	87	Confident	31 Å²	31	35.6 Å²	35.6	12%	0.117	17%	0.174	C	C	.	.	H	α-helix	trans	-57.3	-48.8	173.8	-177.6	174.6	65.2	166.1	3.1	111.5	Y545 M557 F558 F559 S572 D574 E575 L580 W581 V582	Y545-R578 HydrophobicContact CD1-CG 4.34Å; Y545-R578 HydrophobicContact CE1-CG 4.02Å; M557-R578 HydrophobicContact CB-CB 4.14Å; M557-R578 HydrophobicContact CB-CG 4.46Å; F558-R578 WeakPolarHBondContact O-CD 3.42Å; F558-R578 PolarHBondContact O-NH1 2.73Å; F559-R578 HydrophobicContact CD1-CG 3.92Å; S572-R578 WeakPolarHBondContact OG-CB 3.49Å; D574-R578 PolarHBondContact O-N 2.96Å; D574-R578 VanDerWaalsContact O-N 3.14Å; E575-R578 WeakPolarHBondContact O-CB 3.47Å; E575-R578 PolarHBondContact O-N 2.88Å; E575-R578 IonicContact OE1-CZ 3.12Å; E575-R578 VanDerWaalsContact OE1-CZ 3.32Å; E575-R578 IonicContact OE1-NE 3.12Å; E575-R578 PolarHBondContact OE1-NE 3.48Å; E575-R578 IonicContact OE1-NH2 2.83Å; E575-R578 PolarHBondContact OE1-NH2 3.47Å; E575-R578 IonicContact OE2-CZ 2.71Å; E575-R578 IonicContact OE2-NE 2.68Å; E575-R578 PolarHBondContact OE2-NE 3.32Å; E575-R578 VanDerWaalsContact OE2-NE 3.12Å; E575-R578 IonicContact OE2-NH2 3.32Å; E575-R578 PolarHBondContact OE2-NH2 2.97Å; R578-L580 VanDerWaalsContact C-N 3.3Å; R578-L580 PolarHBondContact O-N 2.82Å; R578-W581 PolarHBondContact O-N 2.9Å; R578-V582 HydrophobicContact CG-CG2 4.19Å; R578-V582 WeakPolarHBondContact O-CG2 3.25Å; R578-V582 PolarHBondContact O-N 3.37Å
579	I	87.2	Confident	86.7	Confident	39 Å²	39	36.8 Å²	36.8	20%	0.2	18%	0.181	C	C	.	.	H	α-helix	trans	-60.6	-43.5	-178.5	-66.7	165.9	0	0	0	110.1	E575 Q576 D577 V582 Q583	E575-I579 HydrophobicContact CG-CD1 4.21Å; E575-I579 WeakPolarHBondContact O-CG1 3.41Å; E575-I579 PolarHBondContact O-N 3.34Å; Q576-I579 PolarHBondContact O-N 3.14Å; D577-I579 PolarHBondContact O-N 2.86Å; I579-V582 PolarHBondContact O-N 2.91Å; I579-Q583 HydrophobicContact CG2-CG 4.38Å; I579-Q583 WeakPolarHBondContact O-CB 3.3Å; I579-Q583 WeakPolarHBondContact O-CG 3.36Å; I579-Q583 PolarHBondContact O-N 3.2Å
580	L	87.8	Confident	85.9	Confident	73 Å²	73	36.1 Å²	36.1	38%	0.382	18%	0.18	S	C	.	.	H	α-helix	trans	-64.3	-42.2	177.5	-68.4	173.2	0	0	0	112.3	Q576 D577 R578 A584	Q576-L580 WeakPolarHBondContact O-CG 3.35Å; Q576-L580 PolarHBondContact O-N 2.99Å; Q576-L580 VanDerWaalsContact O-N 3.08Å; D577-L580 PolarHBondContact O-N 3.07Å; R578-L580 VanDerWaalsContact C-N 3.3Å; R578-L580 PolarHBondContact O-N 2.82Å; L580-A584 VanDerWaalsContact O-CB 3.24Å; L580-A584 WeakPolarHBondContact O-CB 3.48Å; L580-A584 PolarHBondContact O-N 3.14Å
581	W	90.4	Very high	85.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63	-48.9	175.3	-86.9	108.9	0	0	0	112.6	H490 L494 F510 L512 M522 F559 D577 R578 Q583 A584 M585	H490-W581 HydrophobicContact CB-CZ3 4.38Å; H490-W581 AromaticContact CD2-CD1 3.98Å; H490-W581 AromaticContact CD2-CD2 3.29Å; H490-W581 AromaticContact CD2-CE2 3.26Å; H490-W581 AromaticContact CD2-CE3 3.58Å; H490-W581 AromaticContact CD2-CG 3.82Å; H490-W581 AromaticContact CD2-CH2 3.85Å; H490-W581 AromaticContact CD2-CZ2 3.59Å; H490-W581 AromaticContact CD2-CZ3 3.83Å; H490-W581 AromaticContact CD2-NE1 3.67Å; H490-W581 AromaticContact NE2-CD1 3.7Å; H490-W581 AromaticContact NE2-CD2 3.83Å; H490-W581 AromaticContact NE2-CE2 3.62Å; H490-W581 AromaticContact NE2-CG 3.94Å; H490-W581 AromaticContact NE2-NE1 3.49Å; H490-W581 PolarHBondContact NE2-NE1 2.76Å; L494-W581 HydrophobicContact CD1-CD2 3.6Å; L494-W581 VanDerWaalsContact CD1-CE2 3.46Å; L494-W581 HydrophobicContact CD1-CE3 4.04Å; L494-W581 HydrophobicContact CD1-CG 4.02Å; L494-W581 HydrophobicContact CD1-CH2 4.22Å; L494-W581 HydrophobicContact CD1-CZ2 3.77Å; L494-W581 HydrophobicContact CD1-CZ3 4.35Å; L494-W581 HydrophobicContact CD2-CG 4.23Å; L494-W581 HydrophobicContact CG-CD2 4.32Å; L494-W581 HydrophobicContact CG-CZ2 4.12Å; F510-W581 HydrophobicContact CB-CH2 3.76Å; F510-W581 HydrophobicContact CB-CZ2 4.05Å; L512-W581 HydrophobicContact CB-CZ3 4.09Å; M522-W581 HydrophobicContact CE-CE3 3.87Å; M522-W581 HydrophobicContact CE-CH2 4.33Å; M522-W581 HydrophobicContact CE-CZ3 3.55Å; M522-W581 HydrophobicContact SD-CH2 4.16Å; M522-W581 HydrophobicContact SD-CZ3 3.74Å; F559-W581 HydrophobicContact CE1-CB 4.19Å; F559-W581 HydrophobicContact CE2-CB 4.49Å; F559-W581 HydrophobicContact CZ-CB 3.81Å; F559-W581 HydrophobicContact CZ-CG 4.26Å; D577-W581 PolarHBondContact O-N 3.25Å; R578-W581 PolarHBondContact O-N 2.9Å; W581-Q583 VanDerWaalsContact C-N 3.34Å; W581-Q583 PolarHBondContact O-N 3.18Å; W581-A584 PolarHBondContact O-N 3.32Å; W581-M585 HydrophobicContact CE3-CG 4.48Å; W581-M585 WeakPolarHBondContact O-CB 3.38Å; W581-M585 WeakPolarHBondContact O-CG 3.26Å; W581-M585 PolarHBondContact O-N 3.48Å
582	V	89.3	Confident	84	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.018	21%	0.212	C	C	.	.	H	α-helix	trans	-62.5	-42.1	179.2	172	0	0	0	0	110.6	V543 Y545 F559 R578 I579 M585 Y586 P595	V543-V582 HydrophobicContact CG1-CB 4.46Å; V543-V582 HydrophobicContact CG1-CG1 4.09Å; V543-V582 HydrophobicContact CG1-CG2 4.28Å; Y545-V582 HydrophobicContact CD1-CG2 4.26Å; Y545-V582 HydrophobicContact CD2-CG1 4.34Å; Y545-V582 HydrophobicContact CE1-CB 4.21Å; Y545-V582 HydrophobicContact CE1-CG1 4.33Å; Y545-V582 HydrophobicContact CE1-CG2 3.84Å; Y545-V582 HydrophobicContact CE2-CB 4.4Å; Y545-V582 HydrophobicContact CE2-CG1 3.67Å; F559-V582 HydrophobicContact CB-CG2 3.76Å; F559-V582 HydrophobicContact CD1-CG2 4.31Å; F559-V582 HydrophobicContact CD2-CG2 4Å; F559-V582 HydrophobicContact CG-CG2 3.78Å; R578-V582 HydrophobicContact CG-CG2 4.19Å; R578-V582 WeakPolarHBondContact O-CG2 3.25Å; R578-V582 PolarHBondContact O-N 3.37Å; I579-V582 PolarHBondContact O-N 2.91Å; V582-M585 PolarHBondContact O-N 3.34Å; V582-Y586 WeakPolarHBondContact O-CB 3.29Å; V582-Y586 PolarHBondContact O-N 3Å; V582-P595 HydrophobicContact CG1-CB 3.79Å; V582-P595 HydrophobicContact CG1-CG 3.88Å
583	Q	86.5	Confident	83.2	Confident	75 Å²	75	45.8 Å²	45.8	35%	0.35	23%	0.231	S	C	.	.	H	α-helix	trans	-64.2	-42.6	175.3	-74	178	1.5	0	0	112.6	I579 W581 R587	I579-Q583 HydrophobicContact CG2-CG 4.38Å; I579-Q583 WeakPolarHBondContact O-CB 3.3Å; I579-Q583 WeakPolarHBondContact O-CG 3.36Å; I579-Q583 PolarHBondContact O-N 3.2Å; W581-Q583 VanDerWaalsContact C-N 3.34Å; W581-Q583 PolarHBondContact O-N 3.18Å; Q583-R587 WeakPolarHBondContact O-CG 3.43Å; Q583-R587 PolarHBondContact O-N 3.41Å; Q583-R587 VanDerWaalsContact O-N 3.08Å
584	A	86.9	Confident	82.8	Confident	12 Å²	12	49 Å²	49	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-66	-43.3	178.8	0	0	0	0	0	111.5	H490 L512 L580 W581 R587 A588	H490-A584 HydrophobicContact CB-CB 3.76Å; L512-A584 HydrophobicContact CD2-CB 3.83Å; L580-A584 VanDerWaalsContact O-CB 3.24Å; L580-A584 WeakPolarHBondContact O-CB 3.48Å; L580-A584 PolarHBondContact O-N 3.14Å; W581-A584 PolarHBondContact O-N 3.32Å; A584-R587 PolarHBondContact O-N 3.04Å; A584-A588 WeakPolarHBondContact O-CB 3.5Å; A584-A588 PolarHBondContact O-N 2.78Å; A584-A588 VanDerWaalsContact O-N 3.07Å
585	M	88.2	Confident	82.7	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-71.3	-38.3	177	-65.4	-176.3	68.8	0	0	112.1	M522 L538 V543 F559 A561 F570 W581 V582 R587 A588 T589	M522-M585 HydrophobicContact CE-CE 3.97Å; M522-M585 HydrophobicContact CE-CG 4.15Å; M522-M585 HydrophobicContact CE-SD 3.46Å; M522-M585 WeakPolarHBondContact CE-SD 3.28Å; L538-M585 HydrophobicContact CD1-CE 4.28Å; L538-M585 HydrophobicContact CD2-CE 3.81Å; V543-M585 HydrophobicContact CB-CB 4.44Å; V543-M585 HydrophobicContact CG1-CB 4.27Å; V543-M585 HydrophobicContact CG2-CB 3.65Å; V543-M585 HydrophobicContact CG2-CE 3.84Å; V543-M585 HydrophobicContact CG2-SD 4.44Å; F559-M585 HydrophobicContact CD2-SD 4.49Å; F559-M585 HydrophobicContact CE2-SD 3.63Å; F559-M585 HydrophobicContact CZ-SD 4.45Å; A561-M585 HydrophobicContact CB-CE 3.99Å; F570-M585 HydrophobicContact CE2-CE 4.12Å; W581-M585 HydrophobicContact CE3-CG 4.48Å; W581-M585 WeakPolarHBondContact O-CB 3.38Å; W581-M585 WeakPolarHBondContact O-CG 3.26Å; W581-M585 PolarHBondContact O-N 3.48Å; V582-M585 PolarHBondContact O-N 3.34Å; M585-R587 VanDerWaalsContact C-N 3.31Å; M585-R587 PolarHBondContact O-N 2.9Å; M585-A588 CarbonylContact O-C 3.4Å; M585-A588 WeakPolarHBondContact O-CB 3.46Å; M585-A588 PolarHBondContact O-N 3.16Å; M585-A588 VanDerWaalsContact O-N 3.07Å; M585-T589 WeakPolarHBondContact O-CG2 3.47Å; M585-T589 PolarHBondContact O-N 2.74Å; M585-T589 PolarHBondContact O-OG1 3.42Å; M585-T589 VanDerWaalsContact O-OG1 3.1Å
586	Y	85.8	Confident	82.5	Confident	33 Å²	33	48.1 Å²	48.1	13%	0.129	24%	0.243	C	C	.	.	H	α-helix	trans	-55.6	-44.2	172.3	167.6	-109.6	0	0	0	112.2	R275 V582 T589 G590 Q591 Y593 K594 P595	R275-Y586 PolarHBondContact NH1-OH 2.69Å; V582-Y586 WeakPolarHBondContact O-CB 3.29Å; V582-Y586 PolarHBondContact O-N 3Å; Y586-T589 PolarHBondContact O-OG1 2.89Å; Y586-G590 PolarHBondContact O-N 3.26Å; Y586-G590 VanDerWaalsContact O-N 3.08Å; Y586-Q591 HydrophobicContact CD2-CG 3.38Å; Y586-Q591 HydrophobicContact CE2-CG 3.55Å; Y586-Q591 WeakPolarHBondContact CE2-O 3.28Å; Y586-Y593 VanDerWaalsContact CE2-O 3.27Å; Y586-Y593 WeakPolarHBondContact CE2-O 3.47Å; Y586-K594 HydrophobicContact CE1-CG 4.38Å; Y586-K594 HydrophobicContact CE2-CB 4.44Å; Y586-P595 HydrophobicContact CD2-CG 4.04Å; Y586-P595 HydrophobicContact CG-CG 4.34Å
587	R	82.9	Confident	82	Confident	82 Å²	82	45 Å²	45	31%	0.309	23%	0.232	S	C	.	.	H	α-helix	trans	-64.4	-41.1	174.4	-70.7	175.3	-174.3	150.5	2.8	111.4	E268 R274 Q583 A584 M585	E268-R587 HydrophobicContact CG-CG 4.46Å; E268-R587 IonicContact OE1-CZ 3.15Å; E268-R587 IonicContact OE1-NE 3.96Å; E268-R587 PolarHBondContact OE1-NE 2.97Å; E268-R587 IonicContact OE1-NH2 2.64Å; E268-R587 PolarHBondContact OE1-NH2 3.42Å; R274-R587 PolarHBondContact NH2-O 3.48Å; Q583-R587 WeakPolarHBondContact O-CG 3.43Å; Q583-R587 PolarHBondContact O-N 3.41Å; Q583-R587 VanDerWaalsContact O-N 3.08Å; A584-R587 PolarHBondContact O-N 3.04Å; M585-R587 VanDerWaalsContact C-N 3.31Å; M585-R587 PolarHBondContact O-N 2.9Å
588	A	84.1	Confident	80.8	Confident	6 Å²	6	46.9 Å²	46.9	5%	0.05	25%	0.253	C	S	.	.	H	α-helix	trans	-68.2	-44	-179.6	0	0	0	0	0	113	L512 F520 L538 A584 M585 G590	L512-A588 HydrophobicContact CD1-CB 4.19Å; L512-A588 HydrophobicContact CD2-CB 4.12Å; F520-A588 HydrophobicContact CB-CB 3.74Å; F520-A588 HydrophobicContact CD1-CB 3.52Å; F520-A588 HydrophobicContact CD2-CB 4.04Å; F520-A588 VanDerWaalsContact CD2-O 3.23Å; F520-A588 WeakPolarHBondContact CD2-O 3.36Å; F520-A588 HydrophobicContact CE1-CB 4.09Å; F520-A588 HydrophobicContact CG-CB 3.49Å; F520-A588 VanDerWaalsContact CG-CB 3.49Å; L538-A588 HydrophobicContact CD1-CB 3.96Å; A584-A588 WeakPolarHBondContact O-CB 3.5Å; A584-A588 PolarHBondContact O-N 2.78Å; A584-A588 VanDerWaalsContact O-N 3.07Å; M585-A588 CarbonylContact O-C 3.4Å; M585-A588 WeakPolarHBondContact O-CB 3.46Å; M585-A588 PolarHBondContact O-N 3.16Å; M585-A588 VanDerWaalsContact O-N 3.07Å; A588-G590 VanDerWaalsContact C-N 3.33Å
589	T	82.8	Confident	78.8	Confident	24 Å²	24	52.5 Å²	52.5	15%	0.147	28%	0.284	C	S	.	.	H	α-helix	trans	-70.7	-31	179.3	56.8	0	0	0	0	112.2	L538 Y541 V543 M585 Y586 Q591	L538-T589 HydrophobicContact CB-CG2 4.37Å; Y541-T589 WeakPolarHBondContact O-CB 3.43Å; Y541-T589 WeakPolarHBondContact O-CG2 3.12Å; V543-T589 HydrophobicContact CG2-CG2 3.91Å; M585-T589 WeakPolarHBondContact O-CG2 3.47Å; M585-T589 PolarHBondContact O-N 2.74Å; M585-T589 PolarHBondContact O-OG1 3.42Å; M585-T589 VanDerWaalsContact O-OG1 3.1Å; Y586-T589 PolarHBondContact O-OG1 2.89Å; T589-Q591 PolarHBondContact O-N 3.28Å; T589-Q591 PolarHBondContact OG1-OE1 3.08Å
590	G	72.3	Confident	76.7	Confident	11 Å²	11	58.7 Å²	58.7	11%	0.113	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	23.7	-176	0	0	0	0	0	112.8	R275 Y586 A588	R275-G590 WeakPolarHBondContact CG-O 3.45Å; Y586-G590 PolarHBondContact O-N 3.26Å; Y586-G590 VanDerWaalsContact O-N 3.08Å; A588-G590 VanDerWaalsContact C-N 3.33Å
591	Q	76.1	Confident	74.1	Confident	13 Å²	13	61.9 Å²	61.9	6%	0.061	34%	0.335	C	S	.	.			trans	-59.1	147.4	178.4	70.4	-169.8	62.3	0	0	111.7	R275 T542 V543 Y586 T589 Y593	R275-Q591 VanDerWaalsContact CD-O 3.24Å; R275-Q591 WeakPolarHBondContact CD-O 3.47Å; T542-Q591 HydrophobicContact CG2-CB 4.09Å; V543-Q591 PolarHBondContact O-NE2 2.9Å; V543-Q591 VanDerWaalsContact O-NE2 3.09Å; V543-Q591 PolarHBondContact O-OE1 2.83Å; Y586-Q591 HydrophobicContact CD2-CG 3.38Å; Y586-Q591 HydrophobicContact CE2-CG 3.55Å; Y586-Q591 WeakPolarHBondContact CE2-O 3.28Å; T589-Q591 PolarHBondContact O-N 3.28Å; T589-Q591 PolarHBondContact OG1-OE1 3.08Å; Q591-Y593 WeakPolarHBondContact CG-O 3.19Å; Q591-Y593 PolarHBondContact NE2-O 3.04Å; Q591-Y593 PolarHBondContact O-N 2.87Å
592	S	65.3	Low	71.5	Confident	88 Å²	88	70.2 Å²	70.2	62%	0.615	37%	0.374	S	S	*	.	S	Bend	trans	-69	-31.2	-170.4	57.3	0	0	0	0	114.8
593	Y	73.1	Confident	68.9	Low	102 Å²	102	79.7 Å²	79.7	40%	0.4	42%	0.415	S	S	.	.	S	Bend	trans	-107.7	139.6	-178.8	67.1	-86.2	0	0	0	112.1	D544 Y586 Q591	D544-Y593 WeakPolarHBondContact OD1-CE2 3.47Å; D544-Y593 PolarHBondContact OD2-OH 3.42Å; Y586-Y593 VanDerWaalsContact CE2-O 3.27Å; Y586-Y593 WeakPolarHBondContact CE2-O 3.47Å; Q591-Y593 WeakPolarHBondContact CG-O 3.19Å; Q591-Y593 PolarHBondContact NE2-O 3.04Å; Q591-Y593 PolarHBondContact O-N 2.87Å
594	K	77.3	Confident	66.3	Low	146 Å²	146	84.1 Å²	84.1	64%	0.635	44%	0.44	S	S	*	.			trans	-75.1	128.1	177.9	-171.3	176.8	-179.6	178.9	0	110.2	Y586 V596	Y586-K594 HydrophobicContact CE1-CG 4.38Å; Y586-K594 HydrophobicContact CE2-CB 4.44Å; K594-V596 PolarHBondContact O-N 3.04Å
595	P	82.4	Confident	63.5	Low	10 Å²	10	90.9 Å²	90.9	7%	0.065	47%	0.474	C	S	.	.			trans	-63.4	132.5	174	-16.6	27	0	0	0	110.3	V543 Y545 V582 Y586	V543-P595 VanDerWaalsContact O-CG 3.24Å; V543-P595 WeakPolarHBondContact O-CG 3.16Å; Y545-P595 HydrophobicContact CD2-CB 3.92Å; Y545-P595 HydrophobicContact CE2-CB 3.83Å; V582-P595 HydrophobicContact CG1-CB 3.79Å; V582-P595 HydrophobicContact CG1-CG 3.88Å; Y586-P595 HydrophobicContact CD2-CG 4.04Å; Y586-P595 HydrophobicContact CG-CG 4.34Å
596	V	77	Confident	61.7	Low	110 Å²	110	95.9 Å²	95.9	67%	0.667	51%	0.507	S	S	*	.			trans	-110.7	127.8	178.2	-174.8	0	0	0	0	109	Y545 K594 A598	Y545-V596 VanDerWaalsContact CD2-C 3.42Å; Y545-V596 WeakPolarHBondContact CD2-O 3.24Å; K594-V596 PolarHBondContact O-N 3.04Å; V596-A598 PolarHBondContact O-N 3.01Å
597	P	73.2	Confident	59	Low	51 Å²	51	104.4 Å²	104.4	33%	0.331	54%	0.544	S	S	.	.			trans	-61.6	132.2	172.4	-15.7	26.7	0	0	0	109.9	Y545 I599	Y545-P597 HydrophobicContact CD2-CB 4.46Å; Y545-P597 HydrophobicContact CD2-CG 4.4Å; Y545-P597 HydrophobicContact CE1-CB 4.39Å; Y545-P597 HydrophobicContact CE1-CG 4.3Å; Y545-P597 HydrophobicContact CE2-CB 4.29Å; Y545-P597 HydrophobicContact CE2-CG 3.79Å; P597-I599 PolarHBondContact O-N 2.99Å
598	A	59.5	Low	56.5	Low	76 Å²	76	104.6 Å²	104.6	63%	0.628	57%	0.572	S	S	*	*			trans	-63.2	107.1	172	0	0	0	0	0	109.2	V596 Q600	V596-A598 PolarHBondContact O-N 3.01Å; A598-Q600 PolarHBondContact O-N 3.47Å; A598-Q600 VanDerWaalsContact O-N 3.17Å
599	I	47.3	Very low	53.7	Low	148 Å²	148	108.2 Å²	108.2	76%	0.759	61%	0.61	S	S	*	*			trans	-65.6	115.5	173.2	-60.6	171.5	0	0	0	106.9	P597 T601	P597-I599 PolarHBondContact O-N 2.99Å; I599-T601 PolarHBondContact O-N 3.16Å
600	Q	43	Very low	51.3	Low	170 Å²	170	113.2 Å²	113.2	79%	0.794	64%	0.641	S	S	*	*			trans	-62.3	102.1	168.8	-72.7	-177.3	9.7	0	0	108.8	A598 Q602	A598-Q600 PolarHBondContact O-N 3.47Å; A598-Q600 VanDerWaalsContact O-N 3.17Å; Q600-Q602 PolarHBondContact O-N 3.26Å
601	T	33.3	Very low	49.4	Very low	140 Å²	140	119.4 Å²	119.4	86%	0.859	67%	0.67	S	S	*	*			trans	-59.4	96.5	165.4	29.6	0	0	0	0	109.9	I599	I599-T601 PolarHBondContact O-N 3.16Å
602	Q	36.2	Very low	47.2	Very low	175 Å²	175	126.7 Å²	126.7	82%	0.818	70%	0.704	S	S	*	*			trans	-84.9	112.4	162.4	-85.8	-171.5	2.1	0	0	110.4	Q600	Q600-Q602 PolarHBondContact O-N 3.26Å
603	K	33.8	Very low	45.8	Very low	202 Å²	202	126.1 Å²	126.1	88%	0.878	71%	0.705	S	S	*	*			trans	11.4	123.4	151	-69.9	177.2	176.8	176.1	0	118.8	N605	K603-N605 PolarHBondContact O-N 2.82Å
604	L	31	Very low	43.6	Very low	168 Å²	168	129.3 Å²	129.3	88%	0.88	73%	0.729	S	S	*	*			trans	-44.7	125	152.3	-69.3	118.2	0	0	0	112.9
605	N	29.5	Very low	41.5	Very low	153 Å²	153	127.3 Å²	127.3	82%	0.818	74%	0.74	S	S	*	*				-175.8	155.4	107	-113.9	-2.2	0	0	0	112.8	K603	K603-N605 PolarHBondContact O-N 2.82Å
606	P	49	Very low	39.1	Very low	105 Å²	105	134.1 Å²	134.1	68%	0.682	77%	0.771	S	S	*	*			trans	-96.8	142.8	-163.8	36.8	-31.5	0	0	0	112.8
607	K	30.4	Very low	37	Very low	212 Å²	212	137.1 Å²	137.1	92%	0.922	78%	0.782	S	S	*	*			trans	176.1	116.7	139.8	-98.9	165.1	-174.2	-174.2	0	111.7
608	G	29.1	Very low	35.3	Very low	86 Å²	86	140.2 Å²	140.2	89%	0.887	81%	0.805	S	S	*	*			trans	59.9	119.6	138.8	0	0	0	0	0	120
609	G	26.9	Very low	34	Very low	83 Å²	83	138.7 Å²	138.7	86%	0.856	80%	0.797	S	S	*	*			trans	147	118.4	153.8	0	0	0	0	0	115.2
610	T	30.8	Very low	33.3	Very low	129 Å²	129	138.8 Å²	138.8	79%	0.791	79%	0.792	S	S	*	*			trans	-66.3	143.3	-173.6	21.1	0	0	0	0	118.2
611	L	33.2	Very low	33.2	Very low	140 Å²	140	136 Å²	136	73%	0.733	78%	0.782	S	S	*	*			trans	75.5	114.9	138	-64	169.3	0	0	0	122.4
612	H	29.2	Very low	33.3	Very low	166 Å²	166	132.3 Å²	132.3	77%	0.769	77%	0.766	S	S	*	*				154.5	111.1	110.4	-94.5	-73.3	0	0	0	109.6
613	A	35.9	Very low	33.4	Very low	76 Å²	76	129.2 Å²	129.2	63%	0.628	76%	0.755	S	S	*	*				76.3	97.6	92.8	0	0	0	0	0	112.3
614	D	28.6	Very low	33.8	Very low	169 Å²	169	128.7 Å²	128.7	90%	0.904	75%	0.747	S	S	*	*	S	Bend	trans	167.3	7.1	144.1	-88.4	-10.4	0	0	0	115.6
615	A	32.6	Very low	34.4	Very low	105 Å²	105	122.7 Å²	122.7	87%	0.868	71%	0.714	S	S	*	*	S	Bend	trans	-111.6	39.3	176.5	0	0	0	0	0	114.1
616	Q	31	Very low	35.1	Very low	152 Å²	152	122.2 Å²	122.2	71%	0.71	71%	0.707	S	S	*	*			trans	-127.2	25	-170	-117.7	-176.4	19.4	0	0	116.2
617	L	34.2	Very low	35.1	Very low	174 Å²	174	125.7 Å²	125.7	91%	0.911	71%	0.711	S	S	*	*	S	Bend	trans	-105.3	-9.8	176.8	-85.8	152.4	0	0	0	115.2
618	S	36.3	Very low	36.3	Very low	116 Å²	116	120.5 Å²	120.5	81%	0.811	69%	0.69	S	S	*	*	S	Bend	trans	-107.9	-7.4	179.3	-173.2	0	0	0	0	115
619	G	32.2	Very low	37.8	Very low	44 Å²	44	118.5 Å²	118.5	45%	0.454	67%	0.67	S	S	.	*	S	Bend	trans	-100.9	-13.9	-173.7	0	0	0	0	0	115.9
620	K	32.5	Very low	39.8	Very low	150 Å²	150	114.9 Å²	114.9	65%	0.652	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-23.3	-172.9	-89.3	-176.5	176.1	174.4	0	114.6
621	D	40.5	Very low	41.5	Very low	110 Å²	110	112 Å²	112	59%	0.588	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-44.3	177.5	-67.2	-40.3	0	0	0	111	D623 R624 F625	D621-D623 VanDerWaalsContact C-N 3.3Å; D621-D623 PolarHBondContact O-N 3.23Å; D621-R624 PolarHBondContact O-N 3.42Å; D621-F625 VanDerWaalsContact O-CD2 3.22Å; D621-F625 WeakPolarHBondContact O-CD2 3.45Å; D621-F625 PolarHBondContact O-N 2.98Å
622	A	36.8	Very low	43.5	Very low	63 Å²	63	112 Å²	112	52%	0.521	61%	0.606	S	S	.	*	H	α-helix	trans	-57	-38.6	178.2	0	0	0	0	0	113.5	R624 F625 Q626	A622-R624 VanDerWaalsContact C-N 3.29Å; A622-R624 PolarHBondContact O-N 3.42Å; A622-F625 PolarHBondContact O-N 3.18Å; A622-Q626 PolarHBondContact O-N 2.94Å
623	D	37.4	Very low	45.7	Very low	111 Å²	111	105.1 Å²	105.1	59%	0.594	58%	0.575	S	S	*	*	H	α-helix	trans	-70.8	-19	178.1	-96.2	-5.1	0	0	0	114	D621	D621-D623 VanDerWaalsContact C-N 3.3Å; D621-D623 PolarHBondContact O-N 3.23Å
624	R	43.6	Very low	47.6	Very low	190 Å²	190	103.3 Å²	103.3	72%	0.717	55%	0.554	S	S	*	*	H	α-helix	trans	-85.6	-31.3	175.6	-122.4	179.8	180	-172	-0.7	112.2	D621 A622 H628	D621-R624 PolarHBondContact O-N 3.42Å; A622-R624 VanDerWaalsContact C-N 3.29Å; A622-R624 PolarHBondContact O-N 3.42Å; R624-H628 PolarHBondContact O-ND1 2.94Å
625	F	43	Very low	49.6	Very low	42 Å²	42	99.8 Å²	99.8	18%	0.184	54%	0.542	C	S	.	.	H	α-helix	trans	-70.9	-39.9	177.3	-82.8	-85.3	0	0	0	112.6	L256 D621 A622 K627 H628	L256-F625 HydrophobicContact CB-CE1 4.06Å; L256-F625 HydrophobicContact CD2-CD1 4.21Å; L256-F625 HydrophobicContact CD2-CE1 3.67Å; L256-F625 HydrophobicContact CD2-CZ 3.86Å; L256-F625 HydrophobicContact CG-CE1 4.46Å; D621-F625 VanDerWaalsContact O-CD2 3.22Å; D621-F625 WeakPolarHBondContact O-CD2 3.45Å; D621-F625 PolarHBondContact O-N 2.98Å; A622-F625 PolarHBondContact O-N 3.18Å; F625-K627 VanDerWaalsContact C-N 3.26Å; F625-K627 PolarHBondContact O-N 3.02Å; F625-H628 PolarHBondContact O-N 2.9Å
626	Q	44.9	Very low	51.5	Low	143 Å²	143	95.8 Å²	95.8	67%	0.668	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-62.2	-26.9	177.8	-90.5	-176.1	-12.8	0	0	114.4	A622 H628	A622-Q626 PolarHBondContact O-N 2.94Å; Q626-H628 VanDerWaalsContact C-N 3.27Å; Q626-H628 PolarHBondContact O-N 2.78Å
627	K	48.1	Very low	53.5	Low	178 Å²	178	92.2 Å²	92.2	77%	0.774	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-74.5	-10.3	179.7	-76.4	-173.1	177.6	179.7	0	114.7	F625	F625-K627 VanDerWaalsContact C-N 3.26Å; F625-K627 PolarHBondContact O-N 3.02Å
628	H	55.2	Low	55.6	Low	103 Å²	103	84.5 Å²	84.5	48%	0.477	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-117.4	3.5	-172.5	-66	86	0	0	0	114.7	R624 F625 Q626 M630	R624-H628 PolarHBondContact O-ND1 2.94Å; F625-H628 PolarHBondContact O-N 2.9Å; Q626-H628 VanDerWaalsContact C-N 3.27Å; Q626-H628 PolarHBondContact O-N 2.78Å; H628-M630 HydrophobicContact CB-CG 4.36Å; H628-M630 PolarHBondContact O-N 3.43Å; H628-M630 VanDerWaalsContact O-N 3.17Å
629	G	62.1	Low	57.6	Low	44 Å²	44	80.5 Å²	80.5	45%	0.454	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	15.7	175.7	0	0	0	0	0	115.3
630	M	67.4	Low	59.8	Low	8 Å²	8	86.7 Å²	86.7	4%	0.039	44%	0.442	C	S	.	.			trans	-83	-19.6	-175.2	-69.2	-64.9	173.5	0	0	114.1	L85 E253 L257 H628 E632 F633 I634	L85-M630 HydrophobicContact CD1-CE 3.97Å; L85-M630 HydrophobicContact CD1-SD 4.46Å; L85-M630 HydrophobicContact CD2-CE 4.16Å; E253-M630 HydrophobicContact CB-CE 4.23Å; E253-M630 HydrophobicContact CG-CE 3.82Å; L257-M630 HydrophobicContact CD2-SD 4.43Å; H628-M630 HydrophobicContact CB-CG 4.36Å; H628-M630 PolarHBondContact O-N 3.43Å; H628-M630 VanDerWaalsContact O-N 3.17Å; M630-E632 PolarHBondContact O-N 2.76Å; M630-F633 PolarHBondContact O-N 2.96Å; M630-F633 VanDerWaalsContact O-N 3.16Å; M630-F633 HydrophobicContact SD-CD2 4Å; M630-F633 HydrophobicContact SD-CE2 4.32Å; M630-I634 PolarHBondContact O-N 2.88Å
631	D	68	Low	62.1	Low	69 Å²	69	82 Å²	82	37%	0.369	42%	0.423	S	S	.	.	H	α-helix	trans	-62.8	-29.4	-179.2	-72.2	-21	0	0	0	112.6	F633 S635	D631-F633 PolarHBondContact O-N 2.95Å; D631-S635 WeakPolarHBondContact O-CB 3.29Å; D631-S635 PolarHBondContact O-N 3.48Å; D631-S635 PolarHBondContact O-OG 2.72Å
632	E	74.4	Confident	64.2	Low	138 Å²	138	81.6 Å²	81.6	65%	0.645	42%	0.421	S	S	*	.	H	α-helix	trans	-63	-41	176.2	-172.6	179	176	0	0	111.5	M630 A636	M630-E632 PolarHBondContact O-N 2.76Å; E632-A636 PolarHBondContact O-N 2.88Å
633	F	76.1	Confident	66.7	Low	23 Å²	23	79.4 Å²	79.4	10%	0.101	40%	0.4	C	S	.	.	H	α-helix	trans	-74.9	-36.7	-179.6	-55.8	-72.1	0	0	0	112.3	R82 L85 Q86 V89 M630 D631	R82-F633 HydrophobicContact CB-CE1 4.28Å; R82-F633 HydrophobicContact CB-CZ 4.3Å; R82-F633 HydrophobicContact CG-CZ 4.14Å; L85-F633 HydrophobicContact CD1-CE2 4.4Å; Q86-F633 HydrophobicContact CB-CD1 3.96Å; Q86-F633 HydrophobicContact CB-CE1 4.44Å; Q86-F633 HydrophobicContact CG-CD1 4.5Å; V89-F633 HydrophobicContact CG2-CB 3.99Å; M630-F633 PolarHBondContact O-N 2.96Å; M630-F633 VanDerWaalsContact O-N 3.16Å; M630-F633 HydrophobicContact SD-CD2 4Å; M630-F633 HydrophobicContact SD-CE2 4.32Å; D631-F633 PolarHBondContact O-N 2.95Å
634	I	75.3	Confident	69	Low	37 Å²	37	75.7 Å²	75.7	19%	0.19	39%	0.385	C	S	.	.	H	α-helix	trans	-72.4	-37.5	179.8	-62.7	157.6	0	0	0	111	R93 L257 A260 M630	R93-I634 PolarHBondContact NH2-O 2.96Å; L257-I634 HydrophobicContact CD2-CD1 4Å; L257-I634 HydrophobicContact CD2-CG1 3.8Å; A260-I634 HydrophobicContact CB-CD1 3.46Å; A260-I634 VanDerWaalsContact CB-CD1 3.46Å; A260-I634 HydrophobicContact CB-CG1 4.16Å; A260-I634 HydrophobicContact CB-CG2 4.42Å; M630-I634 PolarHBondContact O-N 2.88Å
635	S	69.7	Low	71.1	Confident	95 Å²	95	72 Å²	72	66%	0.664	37%	0.374	S	S	*	.	H	α-helix	trans	-86	-5.2	-179.9	63.7	0	0	0	0	114.3	D631 N637	D631-S635 WeakPolarHBondContact O-CB 3.29Å; D631-S635 PolarHBondContact O-N 3.48Å; D631-S635 PolarHBondContact O-OG 2.72Å; S635-N637 PolarHBondContact O-N 2.89Å
636	A	74.1	Confident	73.4	Confident	21 Å²	21	70.4 Å²	70.4	17%	0.174	37%	0.368	C	S	.	.			trans	-56.9	130.3	179.3	0	0	0	0	0	111.7	E632 P638	E632-A636 PolarHBondContact O-N 2.88Å; A636-P638 WeakPolarHBondContact O-CD 3.3Å
637	N	72.6	Confident	75.6	Confident	77 Å²	77	63.6 Å²	63.6	41%	0.412	34%	0.336	S	S	.	.			trans	-76.3	118.3	175.2	-173.8	-32.5	0	0	0	109.2	S635 C639 K640	S635-N637 PolarHBondContact O-N 2.89Å; N637-C639 PolarHBondContact O-N 2.92Å; N637-C639 WeakPolarHBondContact OD1-CB 3.46Å; N637-C639 PolarHBondContact OD1-N 2.81Å; N637-K640 HydrophobicContact CB-CD 4.23Å; N637-K640 HydrophobicContact CB-CG 4.22Å; N637-K640 PolarHBondContact O-N 2.86Å
638	P	78.5	Confident	77.6	Confident	13 Å²	13	60.3 Å²	60.3	8%	0.084	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-56.8	-36.9	-179.8	-20.8	30.1	0	0	0	112.6	F90 E276 A636 K640 L641 H643 Y684	F90-P638 HydrophobicContact CE1-CB 4.03Å; F90-P638 HydrophobicContact CE1-CG 3.92Å; E276-P638 HydrophobicContact CG-CG 4.22Å; A636-P638 WeakPolarHBondContact O-CD 3.3Å; P638-K640 PolarHBondContact O-N 3.17Å; P638-L641 PolarHBondContact O-N 3.39Å; P638-H643 PolarHBondContact O-NE2 2.86Å; P638-Y684 HydrophobicContact CB-CD1 3.99Å; P638-Y684 HydrophobicContact CB-CE1 3.88Å; P638-Y684 HydrophobicContact CG-CE1 4.24Å
639	C	77.2	Confident	79.3	Confident	31 Å²	31	57.2 Å²	57.2	21%	0.209	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-70.1	-4.5	-174	-56.7	0	0	0	0	114.3	N637	N637-C639 PolarHBondContact O-N 2.92Å; N637-C639 WeakPolarHBondContact OD1-CB 3.46Å; N637-C639 PolarHBondContact OD1-N 2.81Å
640	K	77.8	Confident	80.7	Confident	174 Å²	174	55.1 Å²	55.1	76%	0.757	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-99.6	-6	178.6	-66.1	-173.6	180	179.9	0	113.6	N637 P638	N637-K640 HydrophobicContact CB-CD 4.23Å; N637-K640 HydrophobicContact CB-CG 4.22Å; N637-K640 PolarHBondContact O-N 2.86Å; P638-K640 PolarHBondContact O-N 3.17Å
641	L	81.8	Confident	81.9	Confident	51 Å²	51	54.8 Å²	54.8	27%	0.267	28%	0.282	S	S	.	.	S	Bend	trans	-107.9	150.4	-173	-60.9	166.8	0	0	0	111.1	Q86 F90 P638 H643 L646	Q86-L641 HydrophobicContact CG-CD1 4.2Å; F90-L641 HydrophobicContact CE2-CD1 3.49Å; F90-L641 VanDerWaalsContact CE2-CD1 3.49Å; F90-L641 HydrophobicContact CZ-CD1 3.38Å; P638-L641 PolarHBondContact O-N 3.39Å; L641-H643 PolarHBondContact O-N 2.98Å; L641-H643 VanDerWaalsContact O-N 3.12Å; L641-L646 HydrophobicContact CB-CD1 4.23Å
642	D	84.4	Confident	83	Confident	102 Å²	102	56 Å²	56	55%	0.545	28%	0.281	S	S	.	.			trans	-80.7	91.3	174.6	-176.4	-0.8	0	0	0	110.8	A644 F645 L646	D642-A644 PolarHBondContact O-N 2.97Å; D642-A644 WeakPolarHBondContact OD1-CB 3.01Å; D642-A644 PolarHBondContact OD1-N 3.35Å; D642-F645 HydrophobicContact CB-CB 4.29Å; D642-F645 PolarHBondContact O-N 2.85Å; D642-F645 PolarHBondContact OD1-N 3.4Å; D642-L646 WeakPolarHBondContact O-CG 3.44Å; D642-L646 PolarHBondContact O-N 3.13Å; D642-L646 VanDerWaalsContact O-N 3.13Å
643	H	88.4	Confident	83.8	Confident	18 Å²	18	50.6 Å²	50.6	8%	0.083	26%	0.256	C	S	.	.	H	α-helix	trans	-66.8	-20.7	177.4	-73.7	-73.6	0	0	0	113.7	P638 L641 F647 Y680 Y684 V686	P638-H643 PolarHBondContact O-NE2 2.86Å; L641-H643 PolarHBondContact O-N 2.98Å; L641-H643 VanDerWaalsContact O-N 3.12Å; H643-F647 WeakPolarHBondContact O-CB 2.95Å; H643-F647 PolarHBondContact O-N 2.85Å; H643-Y680 AromaticContact ND1-CZ 3.7Å; H643-Y680 PolarHBondContact ND1-OH 3.29Å; H643-Y684 AromaticContact CE1-CD1 3.48Å; H643-Y684 VanDerWaalsContact CE1-CD1 3.48Å; H643-Y684 WeakPolarHBondContact CE1-CD1 3.38Å; H643-Y684 AromaticContact CE1-CG 3.5Å; H643-Y684 AromaticContact ND1-CG 3.71Å; H643-Y684 AromaticContact NE2-CD1 3.61Å; H643-Y684 AromaticContact NE2-CG 3.89Å; H643-V686 HydrophobicContact CB-CG2 4.17Å
644	A	86.3	Confident	84.5	Confident	33 Å²	33	49.5 Å²	49.5	27%	0.273	25%	0.251	S	S	.	.	H	α-helix	trans	-72	-39.3	177.1	0	0	0	0	0	111.4	D642 R648 H690	D642-A644 PolarHBondContact O-N 2.97Å; D642-A644 WeakPolarHBondContact OD1-CB 3.01Å; D642-A644 PolarHBondContact OD1-N 3.35Å; A644-R648 PolarHBondContact O-N 2.93Å; A644-H690 PolarHBondContact O-NE2 3.45Å
645	F	89	Confident	85.1	Confident	111 Å²	111	47.8 Å²	47.8	49%	0.487	24%	0.242	S	C	.	.	H	α-helix	trans	-69.5	-49.3	172.7	175.5	-101.7	0	0	0	112.1	D642 F647 R648 I649	D642-F645 HydrophobicContact CB-CB 4.29Å; D642-F645 PolarHBondContact O-N 2.85Å; D642-F645 PolarHBondContact OD1-N 3.4Å; F645-F647 VanDerWaalsContact C-N 3.31Å; F645-F647 PolarHBondContact O-N 2.82Å; F645-R648 WeakPolarHBondContact O-CB 3.29Å; F645-R648 PolarHBondContact O-N 2.79Å; F645-R648 VanDerWaalsContact O-N 3.17Å; F645-I649 HydrophobicContact CD1-CD1 4.22Å; F645-I649 HydrophobicContact CE1-CD1 3.55Å; F645-I649 HydrophobicContact CE2-CD1 4.42Å; F645-I649 HydrophobicContact CZ-CD1 3.68Å; F645-I649 PolarHBondContact O-N 2.95Å
646	L	89.4	Confident	86.1	Confident	10 Å²	10	45.6 Å²	45.6	5%	0.052	22%	0.223	C	C	.	.	H	α-helix	trans	-59.2	-43	179.8	-68.4	177.7	0	0	0	111.5	I83 L87 F90 L641 D642 R648 I649 L650	I83-L646 HydrophobicContact CG2-CD2 3.79Å; L87-L646 HydrophobicContact CD1-CD2 4.41Å; L87-L646 HydrophobicContact CD2-CB 3.72Å; L87-L646 WeakPolarHBondContact CD2-O 3.43Å; L87-L646 HydrophobicContact CG-CB 4.22Å; L87-L646 HydrophobicContact CG-CD2 4.12Å; F90-L646 HydrophobicContact CE2-CD1 4.4Å; L641-L646 HydrophobicContact CB-CD1 4.23Å; D642-L646 WeakPolarHBondContact O-CG 3.44Å; D642-L646 PolarHBondContact O-N 3.13Å; D642-L646 VanDerWaalsContact O-N 3.13Å; L646-R648 VanDerWaalsContact C-N 3.32Å; L646-R648 PolarHBondContact O-N 3.25Å; L646-I649 PolarHBondContact O-N 2.94Å; L646-L650 PolarHBondContact O-N 2.82Å
647	F	92	Very high	86.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.8	-35.5	178.5	-177.7	-95.8	0	0	0	113	H643 F645 I649 L650 Q651 L677 Y680 C681 V686 R691	H643-F647 WeakPolarHBondContact O-CB 2.95Å; H643-F647 PolarHBondContact O-N 2.85Å; F645-F647 VanDerWaalsContact C-N 3.31Å; F645-F647 PolarHBondContact O-N 2.82Å; F647-I649 VanDerWaalsContact C-N 3.32Å; F647-I649 PolarHBondContact O-N 3.3Å; F647-L650 HydrophobicContact CD2-CD2 4.41Å; F647-L650 PolarHBondContact O-N 2.86Å; F647-Q651 HydrophobicContact CE1-CB 4.08Å; F647-Q651 HydrophobicContact CE1-CG 4.49Å; F647-Q651 HydrophobicContact CZ-CB 4.36Å; F647-Q651 WeakPolarHBondContact O-CB 3.27Å; F647-Q651 PolarHBondContact O-N 2.88Å; F647-L677 HydrophobicContact CE2-CB 4.19Å; F647-L677 HydrophobicContact CE2-CD2 3.67Å; F647-L677 HydrophobicContact CE2-CG 4.5Å; F647-L677 HydrophobicContact CZ-CB 4.44Å; F647-L677 HydrophobicContact CZ-CD2 4.14Å; F647-Y680 HydrophobicContact CB-CE1 4.06Å; F647-Y680 AromaticContact CD2-CD1 3.63Å; F647-Y680 HydrophobicContact CD2-CD1 3.63Å; F647-Y680 HydrophobicContact CD2-CE1 4.02Å; F647-Y680 HydrophobicContact CD2-CG 4.44Å; F647-Y680 HydrophobicContact CE2-CD1 4.41Å; F647-Y680 HydrophobicContact CG-CD1 4.5Å; F647-C681 WeakPolarHBondContact CE2-SG 3.42Å; F647-C681 WeakPolarHBondContact CZ-SG 3.29Å; F647-V686 HydrophobicContact CB-CG1 4.28Å; F647-V686 HydrophobicContact CB-CG2 3.98Å; F647-V686 HydrophobicContact CD1-CG1 3.97Å; F647-V686 HydrophobicContact CG-CG1 4.1Å; F647-V686 HydrophobicContact CG-CG2 4.24Å; F647-R691 HydrophobicContact CE1-CB 3.85Å; F647-R691 HydrophobicContact CE1-CG 3.7Å; F647-R691 HydrophobicContact CZ-CB 4.46Å; F647-R691 HydrophobicContact CZ-CG 3.97Å
648	R	90.6	Very high	87.3	Confident	109 Å²	109	44.6 Å²	44.6	41%	0.411	21%	0.212	S	C	.	.	H	α-helix	trans	-58.6	-45.5	175.5	-178.5	-178.4	175.9	-178	0.1	111.3	A644 F645 L646 Q651 R652 C694 E698	A644-R648 PolarHBondContact O-N 2.93Å; F645-R648 WeakPolarHBondContact O-CB 3.29Å; F645-R648 PolarHBondContact O-N 2.79Å; F645-R648 VanDerWaalsContact O-N 3.17Å; L646-R648 VanDerWaalsContact C-N 3.32Å; L646-R648 PolarHBondContact O-N 3.25Å; R648-Q651 PolarHBondContact O-N 3.29Å; R648-R652 WeakPolarHBondContact O-CB 3.41Å; R648-R652 PolarHBondContact O-N 3.01Å; R648-C694 HydrophobicContact CG-CB 4.35Å; R648-E698 IonicContact CZ-OE1 3.28Å; R648-E698 IonicContact NE-OE1 2.62Å; R648-E698 PolarHBondContact NE-OE1 3.32Å; R648-E698 IonicContact NH2-OE1 3.6Å; R648-E698 PolarHBondContact NH2-OE1 3.08Å
649	I	90.3	Very high	87.5	Confident	37 Å²	37	45.1 Å²	45.1	19%	0.19	21%	0.213	C	C	.	.	H	α-helix	trans	-63.5	-46.5	177.2	-61.6	172.7	0	0	0	110.4	I83 L87 F645 L646 F647 Q651 R652 Q653	I83-I649 HydrophobicContact CG2-CD1 3.91Å; L87-I649 HydrophobicContact CD1-CB 4.13Å; L87-I649 HydrophobicContact CD1-CG2 4.01Å; F645-I649 HydrophobicContact CD1-CD1 4.22Å; F645-I649 HydrophobicContact CE1-CD1 3.55Å; F645-I649 HydrophobicContact CE2-CD1 4.42Å; F645-I649 HydrophobicContact CZ-CD1 3.68Å; F645-I649 PolarHBondContact O-N 2.95Å; L646-I649 PolarHBondContact O-N 2.94Å; F647-I649 VanDerWaalsContact C-N 3.32Å; F647-I649 PolarHBondContact O-N 3.3Å; I649-Q651 PolarHBondContact O-N 3.4Å; I649-R652 PolarHBondContact O-N 2.79Å; I649-Q653 HydrophobicContact CG2-CG 4.42Å; I649-Q653 WeakPolarHBondContact O-CG 3.35Å; I649-Q653 PolarHBondContact O-N 2.81Å
650	L	91.6	Very high	87.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.8	-45.9	178.3	178.7	64.1	0	0	0	111.7	L87 V91 F243 L247 L646 F647 T654 L677 Y680	L87-L650 HydrophobicContact CD2-CB 4.1Å; V91-L650 HydrophobicContact CG2-CD1 3.95Å; V91-L650 HydrophobicContact CG2-CD2 3.87Å; F243-L650 HydrophobicContact CD1-CD1 4.24Å; F243-L650 HydrophobicContact CE1-CD1 4.08Å; L247-L650 HydrophobicContact CD2-CD1 3.82Å; L247-L650 HydrophobicContact CG-CD1 4.49Å; L646-L650 PolarHBondContact O-N 2.82Å; F647-L650 HydrophobicContact CD2-CD2 4.41Å; F647-L650 PolarHBondContact O-N 2.86Å; L650-T654 VanDerWaalsContact O-CB 3.31Å; L650-T654 WeakPolarHBondContact O-CB 3.47Å; L650-T654 PolarHBondContact O-N 3.13Å; L650-T654 PolarHBondContact O-OG1 2.89Å; L650-L677 HydrophobicContact CD2-CD2 3.86Å; L650-L677 HydrophobicContact CG-CD2 3.89Å; L650-Y680 HydrophobicContact CD2-CD2 4.1Å; L650-Y680 HydrophobicContact CD2-CE2 4.34Å; L650-Y680 HydrophobicContact CD2-CG 4.28Å
651	Q	92.2	Very high	87.8	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-64.8	-44.5	-179.8	-177	176.1	53.7	0	0	111.6	F647 R648 I649 T654 L655 F669 R691 Y695	F647-Q651 HydrophobicContact CE1-CB 4.08Å; F647-Q651 HydrophobicContact CE1-CG 4.49Å; F647-Q651 HydrophobicContact CZ-CB 4.36Å; F647-Q651 WeakPolarHBondContact O-CB 3.27Å; F647-Q651 PolarHBondContact O-N 2.88Å; R648-Q651 PolarHBondContact O-N 3.29Å; I649-Q651 PolarHBondContact O-N 3.4Å; Q651-T654 PolarHBondContact O-N 2.97Å; Q651-L655 WeakPolarHBondContact O-CB 3.24Å; Q651-L655 PolarHBondContact O-N 2.53Å; Q651-F669 HydrophobicContact CG-CE2 4.48Å; Q651-F669 HydrophobicContact CG-CZ 4.08Å; Q651-R691 PolarHBondContact NE2-O 3.25Å; Q651-R691 PolarHBondContact OE1-O 3.12Å; Q651-Y695 HydrophobicContact CG-CD2 4.4Å
652	R	91.3	Very high	87.2	Confident	94 Å²	94	44 Å²	44	36%	0.355	22%	0.219	S	C	.	.	H	α-helix	trans	-59.3	-53.2	175.9	179.5	179.6	177	137.2	-2.1	111.5	R648 I649 T654 L655 D656 E698 E701	R648-R652 WeakPolarHBondContact O-CB 3.41Å; R648-R652 PolarHBondContact O-N 3.01Å; I649-R652 PolarHBondContact O-N 2.79Å; R652-T654 VanDerWaalsContact C-N 3.26Å; R652-T654 PolarHBondContact O-N 2.81Å; R652-L655 WeakPolarHBondContact O-CB 3.4Å; R652-L655 PolarHBondContact O-N 3.28Å; R652-D656 PolarHBondContact O-N 3.38Å; R652-E698 HydrophobicContact CB-CG 4.42Å; R652-E698 VanDerWaalsContact CD-OE2 3.22Å; R652-E698 WeakPolarHBondContact CD-OE2 3.31Å; R652-E698 WeakPolarHBondContact CG-OE2 3.47Å; R652-E698 IonicContact CZ-OE2 2.7Å; R652-E698 IonicContact NE-OE2 3.28Å; R652-E698 IonicContact NH1-OE1 2.89Å; R652-E698 IonicContact NH1-OE2 3.14Å; R652-E698 PolarHBondContact NH1-OE2 3.1Å; R652-E701 IonicContact NH2-OE1 2.86Å
653	Q	90.4	Very high	86.7	Confident	25 Å²	25	43.8 Å²	43.8	12%	0.117	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-35.3	179.2	-70.4	-176.2	-12.3	0	0	112.3	I246 I649 H657	I246-Q653 HydrophobicContact CG2-CB 4Å; I649-Q653 HydrophobicContact CG2-CG 4.42Å; I649-Q653 WeakPolarHBondContact O-CG 3.35Å; I649-Q653 PolarHBondContact O-N 2.81Å; Q653-H657 WeakPolarHBondContact O-CB 3.29Å; Q653-H657 PolarHBondContact O-N 2.9Å
654	T	90.9	Very high	86	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.1	-39.3	175	-56.1	0	0	0	0	111.5	I246 L650 Q651 R652 R658 F669 Q673 L677	I246-T654 HydrophobicContact CD1-CG2 4.23Å; L650-T654 VanDerWaalsContact O-CB 3.31Å; L650-T654 WeakPolarHBondContact O-CB 3.47Å; L650-T654 PolarHBondContact O-N 3.13Å; L650-T654 PolarHBondContact O-OG1 2.89Å; Q651-T654 PolarHBondContact O-N 2.97Å; R652-T654 VanDerWaalsContact C-N 3.26Å; R652-T654 PolarHBondContact O-N 2.81Å; T654-R658 VanDerWaalsContact O-CB 3.29Å; T654-R658 WeakPolarHBondContact O-CB 3.28Å; T654-R658 PolarHBondContact O-N 2.8Å; T654-F669 HydrophobicContact CG2-CD1 3.84Å; T654-F669 HydrophobicContact CG2-CE1 3.74Å; T654-Q673 HydrophobicContact CG2-CB 3.95Å; T654-Q673 HydrophobicContact CG2-CG 3.69Å; T654-L677 HydrophobicContact CG2-CD1 4.3Å
655	L	89.6	Confident	85.3	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-70.1	-44.8	177.5	-179	60.2	0	0	0	111.5	Q651 R652 H657 R658 L659 F669 Y695 E698 L699	Q651-L655 WeakPolarHBondContact O-CB 3.24Å; Q651-L655 PolarHBondContact O-N 2.53Å; R652-L655 WeakPolarHBondContact O-CB 3.4Å; R652-L655 PolarHBondContact O-N 3.28Å; L655-H657 VanDerWaalsContact C-N 3.33Å; L655-H657 PolarHBondContact O-N 2.85Å; L655-R658 PolarHBondContact O-N 2.78Å; L655-L659 HydrophobicContact CD1-CD1 4.08Å; L655-L659 HydrophobicContact CD1-CG 4.06Å; L655-L659 HydrophobicContact CG-CD1 3.97Å; L655-L659 HydrophobicContact CG-CG 4.37Å; L655-L659 WeakPolarHBondContact O-CG 3.36Å; L655-L659 PolarHBondContact O-N 3.49Å; L655-F669 HydrophobicContact CB-CE1 3.95Å; L655-F669 HydrophobicContact CB-CZ 4.17Å; L655-F669 HydrophobicContact CD1-CE1 4.29Å; L655-Y695 HydrophobicContact CD1-CE2 4.25Å; L655-Y695 HydrophobicContact CD2-CD2 4.48Å; L655-Y695 HydrophobicContact CD2-CE2 4.23Å; L655-E698 HydrophobicContact CD2-CB 4.04Å; L655-L699 HydrophobicContact CD1-CD2 4.03Å; L655-L699 HydrophobicContact CD2-CD2 3.9Å; L655-L699 HydrophobicContact CD2-CG 4.3Å
656	D	89	Confident	84.8	Confident	50 Å²	50	37.8 Å²	37.8	27%	0.267	18%	0.181	S	C	.	.	H	α-helix	trans	-55.5	-48.4	174.6	-77.6	-37.9	0	0	0	111.2	R652 R658 N660 H702	R652-D656 PolarHBondContact O-N 3.38Å; D656-R658 VanDerWaalsContact C-N 3.29Å; D656-R658 PolarHBondContact O-N 3.17Å; D656-N660 WeakPolarHBondContact O-CB 3.44Å; D656-N660 PolarHBondContact O-N 3.46Å; D656-N660 PolarHBondContact O-ND2 3.27Å; D656-H702 IonicContact OD1-CE1 2.67Å; D656-H702 PolarHBondContact OD1-CE1 3.01Å; D656-H702 IonicContact OD1-NE2 3.38Å; D656-H702 PolarHBondContact OD1-NE2 2.9Å
657	H	87.6	Confident	84.5	Confident	55 Å²	55	37.3 Å²	37.3	26%	0.255	18%	0.179	S	C	.	.	H	α-helix	trans	-60.9	-41.2	175.5	-177.9	102.1	0	0	0	111.4	I246 Q653 L655 N660 D661	I246-H657 HydrophobicContact CG1-CB 3.74Å; Q653-H657 WeakPolarHBondContact O-CB 3.29Å; Q653-H657 PolarHBondContact O-N 2.9Å; L655-H657 VanDerWaalsContact C-N 3.33Å; L655-H657 PolarHBondContact O-N 2.85Å; H657-N660 PolarHBondContact O-N 3.35Å; H657-D661 PolarHBondContact O-N 3.26Å
658	R	84.8	Confident	84.1	Confident	21 Å²	21	40.3 Å²	40.3	8%	0.079	19%	0.19	C	C	.	.	H	α-helix	trans	-69.5	-38.3	-177.2	-172.7	54.5	174.3	163	3.6	113	T654 L655 D656 N660 D661 C665 W668	T654-R658 VanDerWaalsContact O-CB 3.29Å; T654-R658 WeakPolarHBondContact O-CB 3.28Å; T654-R658 PolarHBondContact O-N 2.8Å; L655-R658 PolarHBondContact O-N 2.78Å; D656-R658 VanDerWaalsContact C-N 3.29Å; D656-R658 PolarHBondContact O-N 3.17Å; R658-N660 VanDerWaalsContact C-N 3.3Å; R658-D661 IonicContact NH1-OD2 3.5Å; R658-D661 PolarHBondContact NH1-OD2 3.32Å; R658-D661 VanDerWaalsContact O-CB 3.29Å; R658-D661 WeakPolarHBondContact O-CB 3.41Å; R658-D661 PolarHBondContact O-N 3.42Å; R658-C665 HydrophobicContact CG-CB 3.86Å; R658-C665 PolarHBondContact O-SG 3.39Å; R658-W668 WeakPolarHBondContact CG-O 3.41Å; R658-W668 PolarHBondContact NE-O 2.83Å
659	L	82.9	Confident	83.9	Confident	24 Å²	24	35.7 Å²	35.7	13%	0.126	17%	0.173	C	C	.	.	H	α-helix	trans	-71.5	-26.8	177.4	-70.1	172.3	0	0	0	112.7	K113 L655 H702 I709	K113-L659 PolarHBondContact NZ-O 2.95Å; K113-L659 VanDerWaalsContact NZ-O 3.12Å; L655-L659 HydrophobicContact CD1-CD1 4.08Å; L655-L659 HydrophobicContact CD1-CG 4.06Å; L655-L659 HydrophobicContact CG-CD1 3.97Å; L655-L659 HydrophobicContact CG-CG 4.37Å; L655-L659 WeakPolarHBondContact O-CG 3.36Å; L655-L659 PolarHBondContact O-N 3.49Å; L659-H702 HydrophobicContact CD1-CB 4.01Å; L659-I709 HydrophobicContact CD1-CD1 4.49Å; L659-I709 HydrophobicContact CD2-CD1 3.92Å
660	N	83	Confident	83.5	Confident	129 Å²	129	34.5 Å²	34.5	69%	0.69	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-3.4	176.2	-69.6	-46.3	0	0	0	113.9	D656 H657 R658	D656-N660 WeakPolarHBondContact O-CB 3.44Å; D656-N660 PolarHBondContact O-N 3.46Å; D656-N660 PolarHBondContact O-ND2 3.27Å; H657-N660 PolarHBondContact O-N 3.35Å; R658-N660 VanDerWaalsContact C-N 3.3Å
661	D	78.4	Confident	83.1	Confident	43 Å²	43	34.7 Å²	34.7	23%	0.23	17%	0.169	C	C	.	.	S	Bend	trans	-64.8	157.7	176.4	-166.5	0.8	0	0	0	111.5	H657 R658 Y663	H657-D661 PolarHBondContact O-N 3.26Å; R658-D661 IonicContact NH1-OD2 3.5Å; R658-D661 PolarHBondContact NH1-OD2 3.32Å; R658-D661 VanDerWaalsContact O-CB 3.29Å; R658-D661 WeakPolarHBondContact O-CB 3.41Å; R658-D661 PolarHBondContact O-N 3.42Å; D661-Y663 PolarHBondContact O-N 3.5Å
662	S	69.3	Low	82.7	Confident	61 Å²	61	34.6 Å²	34.6	43%	0.427	17%	0.169	S	C	.	.	S	Bend	trans	-69.7	-7.6	177.5	61.5	0	0	0	0	114.4	K113	K113-S662 WeakPolarHBondContact CB-O 3.36Å; K113-S662 PolarHBondContact N-O 3.06Å
663	Y	73.7	Confident	82.6	Confident	97 Å²	97	30.3 Å²	30.3	38%	0.38	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	141.9	178.4	-61.5	-80.4	0	0	0	111.2	R110 D661 C665	R110-Y663 HydrophobicContact CB-CD1 4.39Å; D661-Y663 PolarHBondContact O-N 3.5Å; Y663-C665 PolarHBondContact O-N 2.87Å; Y663-C665 VanDerWaalsContact O-N 3.07Å
664	S	73.3	Confident	82.5	Confident	12 Å²	12	29.9 Å²	29.9	8%	0.084	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	105.1	173.9	-178	0	0	0	0	109.4	Q111	Q111-S664 PolarHBondContact O-N 3.21Å
665	C	72.8	Confident	82.5	Confident	8 Å²	8	30.5 Å²	30.5	5%	0.054	16%	0.155	C	C	.	.			trans	-99.1	-22.3	-178.9	63.9	0	0	0	0	113	R658 Y663 G667 W668	R658-C665 HydrophobicContact CG-CB 3.86Å; R658-C665 PolarHBondContact O-SG 3.39Å; Y663-C665 PolarHBondContact O-N 2.87Å; Y663-C665 VanDerWaalsContact O-N 3.07Å; C665-G667 PolarHBondContact O-N 3.29Å; C665-W668 WeakPolarHBondContact O-CB 3.39Å; C665-W668 VanDerWaalsContact O-CD1 3.27Å; C665-W668 PolarHBondContact O-N 3.07Å
666	L	78.3	Confident	82.5	Confident	16 Å²	16	30.4 Å²	30.4	8%	0.084	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	29.5	-175.4	-51.6	176.3	0	0	0	113.3	V708 D710 P771	L666-V708 HydrophobicContact CD2-CG1 3.95Å; L666-D710 HydrophobicContact CB-CB 3.82Å; L666-D710 HydrophobicContact CD1-CB 4.41Å; L666-D710 PolarHBondContact O-N 3.14Å; L666-P771 HydrophobicContact CD1-CB 4.13Å; L666-P771 HydrophobicContact CD1-CG 4.01Å; L666-P771 HydrophobicContact CD2-CG 4.14Å
667	G	82	Confident	82.6	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.4	-12.3	-175.2	0	0	0	0	0	115.4	C665 F669 Y695 L713	C665-G667 PolarHBondContact O-N 3.29Å; G667-F669 PolarHBondContact O-N 3.07Å; G667-Y695 PolarHBondContact O-OH 3.08Å; G667-L713 VanDerWaalsContact C-CD2 3.49Å
668	W	84.4	Confident	82.7	Confident	64 Å²	64	27.9 Å²	27.9	24%	0.242	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-69.7	124.1	179.1	-67.2	95.4	0	0	0	112.5	M107 R658 C665 D710 L713	M107-W668 HydrophobicContact CE-CE3 3.4Å; M107-W668 VanDerWaalsContact CE-CE3 3.4Å; M107-W668 HydrophobicContact CE-CZ3 3.6Å; R658-W668 WeakPolarHBondContact CG-O 3.41Å; R658-W668 PolarHBondContact NE-O 2.83Å; C665-W668 WeakPolarHBondContact O-CB 3.39Å; C665-W668 VanDerWaalsContact O-CD1 3.27Å; C665-W668 PolarHBondContact O-N 3.07Å; W668-D710 PolarHBondContact NE1-OD2 2.94Å; W668-L713 HydrophobicContact CD2-CD1 4.02Å; W668-L713 HydrophobicContact CE3-CD1 3.75Å; W668-L713 HydrophobicContact CH2-CB 4.46Å; W668-L713 HydrophobicContact CH2-CD1 3.98Å; W668-L713 HydrophobicContact CZ2-CB 3.98Å; W668-L713 HydrophobicContact CZ2-CD1 4.22Å; W668-L713 HydrophobicContact CZ3-CD1 3.73Å
669	F	86.4	Confident	83	Confident	11 Å²	11	26.9 Å²	26.9	5%	0.048	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-63.2	148.3	170.6	-67.3	-51.2	0	0	0	112.1	Q651 T654 L655 G667 Q673 V674 L677 Y695	Q651-F669 HydrophobicContact CG-CE2 4.48Å; Q651-F669 HydrophobicContact CG-CZ 4.08Å; T654-F669 HydrophobicContact CG2-CD1 3.84Å; T654-F669 HydrophobicContact CG2-CE1 3.74Å; L655-F669 HydrophobicContact CB-CE1 3.95Å; L655-F669 HydrophobicContact CB-CZ 4.17Å; L655-F669 HydrophobicContact CD1-CE1 4.29Å; G667-F669 PolarHBondContact O-N 3.07Å; F669-Q673 HydrophobicContact CB-CB 4.02Å; F669-Q673 HydrophobicContact CD1-CB 4.45Å; F669-Q673 HydrophobicContact CG-CB 4.49Å; F669-V674 HydrophobicContact CB-CG2 3.61Å; F669-L677 HydrophobicContact CD2-CD1 4.1Å; F669-L677 HydrophobicContact CE2-CD1 4.01Å; F669-L677 HydrophobicContact CG-CD1 4.41Å; F669-L677 HydrophobicContact CZ-CD1 4.25Å; F669-Y695 HydrophobicContact CD2-CE2 4.24Å; F669-Y695 AromaticContact CD2-CZ 3.91Å; F669-Y695 HydrophobicContact CE1-CE2 4.4Å; F669-Y695 AromaticContact CE2-CD2 3.97Å; F669-Y695 HydrophobicContact CE2-CD2 3.97Å; F669-Y695 HydrophobicContact CE2-CE1 4.14Å; F669-Y695 AromaticContact CE2-CE2 3.32Å; F669-Y695 HydrophobicContact CE2-CE2 3.32Å; F669-Y695 AromaticContact CE2-CZ 3.4Å; F669-Y695 VanDerWaalsContact CE2-CZ 3.4Å; F669-Y695 WeakPolarHBondContact CE2-OH 3.23Å; F669-Y695 HydrophobicContact CZ-CD2 4.06Å; F669-Y695 AromaticContact CZ-CE2 3.42Å; F669-Y695 HydrophobicContact CZ-CE2 3.42Å; F669-Y695 VanDerWaalsContact CZ-CE2 3.42Å; F669-Y695 AromaticContact CZ-CZ 3.95Å
670	S	81.8	Confident	83.4	Confident	12 Å²	12	25.7 Å²	25.7	8%	0.084	13%	0.133	C	C	.	.	P	Polyproline II helix	trans	-69.3	155.9	172.5	79.7	0	0	0	0	111.2	G672 Q673 V674	S670-G672 PolarHBondContact O-N 3.29Å; S670-G672 VanDerWaalsContact O-N 3.16Å; S670-Q673 WeakPolarHBondContact O-CB 3.45Å; S670-Q673 PolarHBondContact O-N 3.45Å; S670-Q673 VanDerWaalsContact OG-CG 3.3Å; S670-Q673 WeakPolarHBondContact OG-CG 3.41Å; S670-Q673 PolarHBondContact OG-N 2.88Å; S670-V674 WeakPolarHBondContact O-CG2 3.46Å; S670-V674 PolarHBondContact O-N 3.06Å
671	P	82.4	Confident	83.7	Confident	4 Å²	4	20.2 Å²	20.2	3%	0.026	10%	0.104	C	C	.	.	H	α-helix	trans	-49.6	-40.1	174.5	-33.3	38.2	0	0	0	114.7	P104 M107 F675	P104-P671 HydrophobicContact CG-CB 4.13Å; P104-P671 VanDerWaalsContact O-CB 3.3Å; P104-P671 WeakPolarHBondContact O-CB 3.26Å; M107-P671 HydrophobicContact CB-CG 4.5Å; P671-F675 VanDerWaalsContact O-CB 3.28Å; P671-F675 WeakPolarHBondContact O-CB 3.47Å; P671-F675 PolarHBondContact O-N 2.85Å
672	G	84.2	Confident	84.1	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-70.2	-37.3	176.7	0	0	0	0	0	113.7	S670 V676	S670-G672 PolarHBondContact O-N 3.29Å; S670-G672 VanDerWaalsContact O-N 3.16Å; G672-V676 WeakPolarHBondContact O-CG2 3.4Å; G672-V676 PolarHBondContact O-N 3.34Å; G672-V676 VanDerWaalsContact O-N 3.14Å
673	Q	88.9	Confident	85	Confident	3 Å²	3	16.7 Å²	16.7	1%	0.014	9%	0.085	C	C	.	.	H	α-helix	trans	-64.4	-48.3	174.2	-73	171.6	-27.1	0	0	110.6	M242 T654 F669 S670 F675 V676 L677	M242-Q673 HydrophobicContact CE-CG 3.74Å; M242-Q673 HydrophobicContact SD-CG 3.87Å; T654-Q673 HydrophobicContact CG2-CB 3.95Å; T654-Q673 HydrophobicContact CG2-CG 3.69Å; F669-Q673 HydrophobicContact CB-CB 4.02Å; F669-Q673 HydrophobicContact CD1-CB 4.45Å; F669-Q673 HydrophobicContact CG-CB 4.49Å; S670-Q673 WeakPolarHBondContact O-CB 3.45Å; S670-Q673 PolarHBondContact O-N 3.45Å; S670-Q673 VanDerWaalsContact OG-CG 3.3Å; S670-Q673 WeakPolarHBondContact OG-CG 3.41Å; S670-Q673 PolarHBondContact OG-N 2.88Å; Q673-F675 VanDerWaalsContact C-N 3.33Å; Q673-F675 PolarHBondContact O-N 3.25Å; Q673-V676 PolarHBondContact O-N 2.84Å; Q673-L677 WeakPolarHBondContact O-CB 3.3Å; Q673-L677 VanDerWaalsContact O-CG 3.23Å; Q673-L677 WeakPolarHBondContact O-CG 3.48Å; Q673-L677 PolarHBondContact O-N 2.9Å
674	V	88.7	Confident	85.7	Confident	17 Å²	17	12.9 Å²	12.9	10%	0.103	7%	0.069	C	C	.	.	H	α-helix	trans	-57.6	-47.4	176.7	176.2	0	0	0	0	110.5	P104 F669 S670 V676 L677 D678	P104-V674 HydrophobicContact CG-CB 4.43Å; P104-V674 HydrophobicContact CG-CG1 4.34Å; F669-V674 HydrophobicContact CB-CG2 3.61Å; S670-V674 WeakPolarHBondContact O-CG2 3.46Å; S670-V674 PolarHBondContact O-N 3.06Å; V674-V676 PolarHBondContact O-N 2.9Å; V674-L677 PolarHBondContact O-N 3.16Å; V674-D678 WeakPolarHBondContact CG1-OD2 3.24Å; V674-D678 VanDerWaalsContact O-CB 3.28Å; V674-D678 WeakPolarHBondContact O-CB 3.27Å; V674-D678 PolarHBondContact O-N 2.76Å
675	F	90	Very high	86.2	Confident	12 Å²	12	13.7 Å²	13.7	5%	0.053	8%	0.08	C	C	.	.	H	α-helix	trans	-54.9	-49.5	178.3	164.1	-106.4	0	0	0	113.3	P98 A101 Q103 L239 P671 Q673 E679	P98-F675 HydrophobicContact CB-CE2 4.02Å; P98-F675 HydrophobicContact CB-CZ 3.56Å; P98-F675 HydrophobicContact CG-CZ 3.89Å; A101-F675 HydrophobicContact CB-CD2 3.78Å; A101-F675 HydrophobicContact CB-CE2 4.06Å; A101-F675 WeakPolarHBondContact O-CE2 3.33Å; Q103-F675 HydrophobicContact CG-CB 3.75Å; Q103-F675 HydrophobicContact CG-CD1 4.03Å; Q103-F675 HydrophobicContact CG-CD2 4.08Å; Q103-F675 HydrophobicContact CG-CG 3.67Å; L239-F675 HydrophobicContact CD1-CD1 3.91Å; L239-F675 HydrophobicContact CD1-CE1 3.81Å; P671-F675 VanDerWaalsContact O-CB 3.28Å; P671-F675 WeakPolarHBondContact O-CB 3.47Å; P671-F675 PolarHBondContact O-N 2.85Å; Q673-F675 VanDerWaalsContact C-N 3.33Å; Q673-F675 PolarHBondContact O-N 3.25Å; F675-E679 WeakPolarHBondContact O-CB 3.29Å; F675-E679 PolarHBondContact O-N 2.9Å
676	V	90.3	Very high	86.8	Confident	0 Å²	0	14 Å²	14	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-70	-39.6	-179.3	173.7	0	0	0	0	111.6	V91 I95 L239 F243 G672 Q673 V674 Y680	V91-V676 HydrophobicContact CG1-CG1 3.83Å; I95-V676 HydrophobicContact CD1-CG2 4.27Å; I95-V676 HydrophobicContact CG1-CG2 3.78Å; L239-V676 HydrophobicContact CD1-CG2 4.47Å; L239-V676 HydrophobicContact CD2-CG2 4.39Å; F243-V676 HydrophobicContact CD2-CB 4.34Å; F243-V676 HydrophobicContact CD2-CG1 4.15Å; F243-V676 HydrophobicContact CD2-CG2 4.1Å; F243-V676 HydrophobicContact CE1-CB 4.48Å; F243-V676 HydrophobicContact CE1-CG1 4.01Å; F243-V676 HydrophobicContact CE2-CB 3.41Å; F243-V676 VanDerWaalsContact CE2-CB 3.41Å; F243-V676 HydrophobicContact CE2-CG1 3.57Å; F243-V676 HydrophobicContact CE2-CG2 3.45Å; F243-V676 VanDerWaalsContact CE2-CG2 3.45Å; F243-V676 HydrophobicContact CZ-CB 3.51Å; F243-V676 HydrophobicContact CZ-CG1 3.49Å; F243-V676 VanDerWaalsContact CZ-CG1 3.49Å; F243-V676 HydrophobicContact CZ-CG2 4.1Å; G672-V676 WeakPolarHBondContact O-CG2 3.4Å; G672-V676 PolarHBondContact O-N 3.34Å; G672-V676 VanDerWaalsContact O-N 3.14Å; Q673-V676 PolarHBondContact O-N 2.84Å; V674-V676 PolarHBondContact O-N 2.9Å; V676-Y680 VanDerWaalsContact O-CB 3.31Å; V676-Y680 WeakPolarHBondContact O-CB 3.34Å; V676-Y680 PolarHBondContact O-N 3.03Å
677	L	91	Very high	87.2	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-65.5	-40.4	177.1	-67.9	174.1	0	0	0	111.7	F647 L650 T654 F669 Q673 V674 Y680 C681	F647-L677 HydrophobicContact CE2-CB 4.19Å; F647-L677 HydrophobicContact CE2-CD2 3.67Å; F647-L677 HydrophobicContact CE2-CG 4.5Å; F647-L677 HydrophobicContact CZ-CB 4.44Å; F647-L677 HydrophobicContact CZ-CD2 4.14Å; L650-L677 HydrophobicContact CD2-CD2 3.86Å; L650-L677 HydrophobicContact CG-CD2 3.89Å; T654-L677 HydrophobicContact CG2-CD1 4.3Å; F669-L677 HydrophobicContact CD2-CD1 4.1Å; F669-L677 HydrophobicContact CE2-CD1 4.01Å; F669-L677 HydrophobicContact CG-CD1 4.41Å; F669-L677 HydrophobicContact CZ-CD1 4.25Å; Q673-L677 WeakPolarHBondContact O-CB 3.3Å; Q673-L677 VanDerWaalsContact O-CG 3.23Å; Q673-L677 WeakPolarHBondContact O-CG 3.48Å; Q673-L677 PolarHBondContact O-N 2.9Å; V674-L677 PolarHBondContact O-N 3.16Å; L677-Y680 PolarHBondContact O-N 2.77Å; L677-C681 WeakPolarHBondContact O-CB 3.46Å; L677-C681 PolarHBondContact O-N 3.4Å; L677-C681 PolarHBondContact O-SG 3.13Å
678	D	90.6	Very high	87.3	Confident	51 Å²	51	16.8 Å²	16.8	27%	0.273	10%	0.1	S	C	.	.	H	α-helix	trans	-65.8	-45.7	176.9	-72.9	-5	0	0	0	111.1	A101 V674 Y680 C681 A682 R691	A101-D678 HydrophobicContact CB-CB 4.12Å; V674-D678 WeakPolarHBondContact CG1-OD2 3.24Å; V674-D678 VanDerWaalsContact O-CB 3.28Å; V674-D678 WeakPolarHBondContact O-CB 3.27Å; V674-D678 PolarHBondContact O-N 2.76Å; D678-Y680 VanDerWaalsContact C-N 3.34Å; D678-Y680 PolarHBondContact O-N 2.92Å; D678-C681 PolarHBondContact O-N 3.15Å; D678-A682 WeakPolarHBondContact O-CB 3.33Å; D678-A682 PolarHBondContact O-N 3.07Å; D678-R691 IonicContact OD1-CZ 3.95Å; D678-R691 IonicContact OD1-NH1 3.48Å; D678-R691 PolarHBondContact OD1-NH1 2.99Å; D678-R691 IonicContact OD1-NH2 3.45Å; D678-R691 PolarHBondContact OD1-NH2 3.36Å
679	E	89.7	Confident	87.5	Confident	0 Å²	0	13.8 Å²	13.8	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.1	-42.3	176.2	-168	70.9	-179.9	0	0	111.1	C94 P98 F99 N100 A101 F675 R683	C94-E679 HydrophobicContact CB-CB 4.22Å; C94-E679 HydrophobicContact CB-CG 3.9Å; P98-E679 WeakPolarHBondContact CA-OE1 3.48Å; F99-E679 WeakPolarHBondContact CD1-OE1 3.25Å; F99-E679 PolarHBondContact N-OE1 2.74Å; N100-E679 WeakPolarHBondContact CB-OE2 3.44Å; N100-E679 PolarHBondContact N-OE1 2.68Å; N100-E679 PolarHBondContact N-OE2 3.12Å; A101-E679 HydrophobicContact CB-CB 4.23Å; A101-E679 WeakPolarHBondContact CB-OE2 3.43Å; A101-E679 PolarHBondContact N-OE2 3.18Å; F675-E679 WeakPolarHBondContact O-CB 3.29Å; F675-E679 PolarHBondContact O-N 2.9Å; E679-R683 WeakPolarHBondContact O-CB 3.14Å; E679-R683 PolarHBondContact O-N 3.03Å
680	Y	91.6	Very high	87.6	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.6	-49.3	175.9	-173.2	-75.3	0	0	0	111.4	L87 F90 V91 H643 F647 L650 V676 L677 D678 A682 R683 Y684 V686	L87-Y680 HydrophobicContact CD2-CE2 4.46Å; F90-Y680 HydrophobicContact CB-CD2 4.32Å; F90-Y680 HydrophobicContact CB-CE2 3.63Å; V91-Y680 HydrophobicContact CG2-CD2 4.36Å; H643-Y680 AromaticContact ND1-CZ 3.7Å; H643-Y680 PolarHBondContact ND1-OH 3.29Å; F647-Y680 HydrophobicContact CB-CE1 4.06Å; F647-Y680 AromaticContact CD2-CD1 3.63Å; F647-Y680 HydrophobicContact CD2-CD1 3.63Å; F647-Y680 HydrophobicContact CD2-CE1 4.02Å; F647-Y680 HydrophobicContact CD2-CG 4.44Å; F647-Y680 HydrophobicContact CE2-CD1 4.41Å; F647-Y680 HydrophobicContact CG-CD1 4.5Å; L650-Y680 HydrophobicContact CD2-CD2 4.1Å; L650-Y680 HydrophobicContact CD2-CE2 4.34Å; L650-Y680 HydrophobicContact CD2-CG 4.28Å; V676-Y680 VanDerWaalsContact O-CB 3.31Å; V676-Y680 WeakPolarHBondContact O-CB 3.34Å; V676-Y680 PolarHBondContact O-N 3.03Å; L677-Y680 PolarHBondContact O-N 2.77Å; D678-Y680 VanDerWaalsContact C-N 3.34Å; D678-Y680 PolarHBondContact O-N 2.92Å; Y680-A682 PolarHBondContact O-N 2.87Å; Y680-R683 PolarHBondContact O-N 3.38Å; Y680-Y684 AromaticContact CD1-CD2 3.85Å; Y680-Y684 HydrophobicContact CD1-CD2 3.85Å; Y680-Y684 AromaticContact CD2-CD2 3.63Å; Y680-Y684 HydrophobicContact CD2-CD2 3.63Å; Y680-Y684 AromaticContact CD2-CE2 3.62Å; Y680-Y684 HydrophobicContact CD2-CE2 3.62Å; Y680-Y684 AromaticContact CE1-CD2 3.85Å; Y680-Y684 HydrophobicContact CE1-CD2 3.85Å; Y680-Y684 AromaticContact CE2-CD2 3.67Å; Y680-Y684 HydrophobicContact CE2-CD2 3.67Å; Y680-Y684 AromaticContact CE2-CE2 3.72Å; Y680-Y684 HydrophobicContact CE2-CE2 3.72Å; Y680-Y684 AromaticContact CG-CD2 3.73Å; Y680-Y684 HydrophobicContact CG-CD2 3.73Å; Y680-Y684 HydrophobicContact CG-CE2 4.11Å; Y680-Y684 AromaticContact CZ-CD2 3.76Å; Y680-Y684 WeakPolarHBondContact O-CD2 3.27Å; Y680-Y684 PolarHBondContact O-N 3.23Å; Y680-V686 HydrophobicContact CD1-CG2 4.35Å; Y680-V686 HydrophobicContact CE1-CG2 4.19Å
681	C	90.3	Very high	88	Confident	13 Å²	13	16 Å²	16	9%	0.088	10%	0.096	C	C	.	.	H	α-helix	trans	-60.3	-46.2	-179.3	-70.9	0	0	0	0	111.5	F647 L677 D678 G685 V686	F647-C681 WeakPolarHBondContact CE2-SG 3.42Å; F647-C681 WeakPolarHBondContact CZ-SG 3.29Å; L677-C681 WeakPolarHBondContact O-CB 3.46Å; L677-C681 PolarHBondContact O-N 3.4Å; L677-C681 PolarHBondContact O-SG 3.13Å; D678-C681 PolarHBondContact O-N 3.15Å; C681-G685 CarbonylContact O-C 3.52Å; C681-G685 WeakPolarHBondContact O-CA 3.42Å; C681-G685 PolarHBondContact O-N 2.78Å; C681-V686 HydrophobicContact CB-CB 4.17Å; C681-V686 PolarHBondContact O-N 2.94Å
682	A	86.8	Confident	88.4	Confident	28 Å²	28	16.6 Å²	16.6	23%	0.231	10%	0.098	C	C	.	.	H	α-helix	trans	-65	-52.5	-179.9	0	0	0	0	0	110.9	N100 R280 L316 D678 Y680 Y684	N100-A682 VanDerWaalsContact ND2-CB 3.31Å; N100-A682 WeakPolarHBondContact ND2-CB 3.46Å; R280-A682 PolarHBondContact NH1-O 2.73Å; L316-A682 WeakPolarHBondContact CD1-O 3.25Å; L316-A682 HydrophobicContact CD2-CB 4.13Å; D678-A682 WeakPolarHBondContact O-CB 3.33Å; D678-A682 PolarHBondContact O-N 3.07Å; Y680-A682 PolarHBondContact O-N 2.87Å; A682-Y684 PolarHBondContact O-N 3.38Å
683	R	88.1	Confident	88.7	Confident	3 Å²	3	16.7 Å²	16.7	1%	0.011	10%	0.099	C	C	.	.	H	α-helix	trans	-62.3	-42.7	-175.9	-173	170.1	178.4	171.7	-10	113.2	R93 Y97 F99 E276 R280 E679 Y680	R93-R683 VanDerWaalsContact C-NH1 3.34Å; R93-R683 PolarHBondContact O-NH1 3.21Å; Y97-R683 VanDerWaalsContact CE2-CZ 3.5Å; Y97-R683 PolarHBondContact OH-NH2 3.47Å; F99-R683 HydrophobicContact CE1-CG 4.38Å; E276-R683 IonicContact OE1-NH2 3.08Å; E276-R683 PolarHBondContact OE1-NH2 3.13Å; E276-R683 VanDerWaalsContact OE1-NH2 3.1Å; E276-R683 IonicContact OE2-CZ 2.72Å; E276-R683 IonicContact OE2-NE 3.44Å; E276-R683 PolarHBondContact OE2-NE 3.33Å; E276-R683 IonicContact OE2-NH2 2.87Å; E276-R683 PolarHBondContact OE2-NH2 3.27Å; R280-R683 WeakPolarHBondContact CD-O 3.38Å; R280-R683 PolarHBondContact NH1-O 2.8Å; E679-R683 WeakPolarHBondContact O-CB 3.14Å; E679-R683 PolarHBondContact O-N 3.03Å; Y680-R683 PolarHBondContact O-N 3.38Å
684	Y	87.6	Confident	88.8	Confident	16 Å²	16	16.9 Å²	16.9	6%	0.063	10%	0.1	C	C	.	.	H	α-helix	trans	-100.4	-2.1	-176.7	-56	-63.4	0	0	0	114.9	F90 P638 H643 Y680 A682	F90-Y684 WeakPolarHBondContact CA-OH 3.49Å; F90-Y684 HydrophobicContact CB-CE2 3.73Å; F90-Y684 AromaticContact CD1-CE1 3.91Å; F90-Y684 HydrophobicContact CD1-CE1 3.91Å; F90-Y684 HydrophobicContact CD1-CE2 4.43Å; F90-Y684 AromaticContact CD1-CZ 3.67Å; F90-Y684 WeakPolarHBondContact CD1-OH 3.18Å; F90-Y684 HydrophobicContact CG-CE1 4.48Å; F90-Y684 HydrophobicContact CG-CE2 4.29Å; F90-Y684 AromaticContact CG-CZ 3.98Å; F90-Y684 PolarHBondContact O-OH 3.33Å; P638-Y684 HydrophobicContact CB-CD1 3.99Å; P638-Y684 HydrophobicContact CB-CE1 3.88Å; P638-Y684 HydrophobicContact CG-CE1 4.24Å; H643-Y684 AromaticContact CE1-CD1 3.48Å; H643-Y684 VanDerWaalsContact CE1-CD1 3.48Å; H643-Y684 WeakPolarHBondContact CE1-CD1 3.38Å; H643-Y684 AromaticContact CE1-CG 3.5Å; H643-Y684 AromaticContact ND1-CG 3.71Å; H643-Y684 AromaticContact NE2-CD1 3.61Å; H643-Y684 AromaticContact NE2-CG 3.89Å; Y680-Y684 AromaticContact CD1-CD2 3.85Å; Y680-Y684 HydrophobicContact CD1-CD2 3.85Å; Y680-Y684 AromaticContact CD2-CD2 3.63Å; Y680-Y684 HydrophobicContact CD2-CD2 3.63Å; Y680-Y684 AromaticContact CD2-CE2 3.62Å; Y680-Y684 HydrophobicContact CD2-CE2 3.62Å; Y680-Y684 AromaticContact CE1-CD2 3.85Å; Y680-Y684 HydrophobicContact CE1-CD2 3.85Å; Y680-Y684 AromaticContact CE2-CD2 3.67Å; Y680-Y684 HydrophobicContact CE2-CD2 3.67Å; Y680-Y684 AromaticContact CE2-CE2 3.72Å; Y680-Y684 HydrophobicContact CE2-CE2 3.72Å; Y680-Y684 AromaticContact CG-CD2 3.73Å; Y680-Y684 HydrophobicContact CG-CD2 3.73Å; Y680-Y684 HydrophobicContact CG-CE2 4.11Å; Y680-Y684 AromaticContact CZ-CD2 3.76Å; Y680-Y684 WeakPolarHBondContact O-CD2 3.27Å; Y680-Y684 PolarHBondContact O-N 3.23Å; A682-Y684 PolarHBondContact O-N 3.38Å
685	G	83.8	Confident	89	Confident	29 Å²	29	16.7 Å²	16.7	30%	0.299	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	33.1	169.6	0	0	0	0	0	115.4	R280 C681 R687	R280-G685 VanDerWaalsContact CZ-CA 3.43Å; C681-G685 CarbonylContact O-C 3.52Å; C681-G685 WeakPolarHBondContact O-CA 3.42Å; C681-G685 PolarHBondContact O-N 2.78Å; G685-R687 PolarHBondContact O-N 3.01Å
686	V	86.9	Confident	89.1	Confident	15 Å²	15	16.1 Å²	16.1	9%	0.091	10%	0.095	C	C	.	.			trans	-75.4	122.9	174.5	-176.1	0	0	0	0	109.1	H643 F647 Y680 C681	H643-V686 HydrophobicContact CB-CG2 4.17Å; F647-V686 HydrophobicContact CB-CG1 4.28Å; F647-V686 HydrophobicContact CB-CG2 3.98Å; F647-V686 HydrophobicContact CD1-CG1 3.97Å; F647-V686 HydrophobicContact CG-CG1 4.1Å; F647-V686 HydrophobicContact CG-CG2 4.24Å; Y680-V686 HydrophobicContact CD1-CG2 4.35Å; Y680-V686 HydrophobicContact CE1-CG2 4.19Å; C681-V686 HydrophobicContact CB-CB 4.17Å; C681-V686 PolarHBondContact O-N 2.94Å
687	R	85.1	Confident	89.2	Confident	45 Å²	45	17 Å²	17	17%	0.17	10%	0.103	C	C	.	.			trans	-63.3	137	180	-70.8	171.1	59.7	109.5	7.1	111	G685 C689 H690 R691 H724 T735 E740	G685-R687 PolarHBondContact O-N 3.01Å; R687-C689 VanDerWaalsContact C-N 3.31Å; R687-C689 PolarHBondContact O-N 3.45Å; R687-H690 HydrophobicContact CB-CB 4.41Å; R687-H690 PolarHBondContact O-N 3.3Å; R687-R691 PolarHBondContact O-N 3.42Å; R687-R691 VanDerWaalsContact O-N 3.14Å; R687-H724 PolarHBondContact NH2-CE1 3.34Å; R687-H724 PolarHBondContact NH2-NE2 3.36Å; R687-T735 PolarHBondContact NH1-OG1 3.47Å; R687-T735 PolarHBondContact NH2-O 2.92Å; R687-E740 IonicContact CZ-OE1 3.65Å; R687-E740 IonicContact CZ-OE2 2.96Å; R687-E740 IonicContact NE-OE1 3.68Å; R687-E740 PolarHBondContact NE-OE1 3.2Å; R687-E740 IonicContact NE-OE2 3.64Å; R687-E740 IonicContact NH2-OE1 2.61Å; R687-E740 PolarHBondContact NH2-OE1 3.33Å; R687-E740 VanDerWaalsContact NH2-OE1 3.14Å; R687-E740 IonicContact NH2-OE2 3.48Å; R687-E740 PolarHBondContact NH2-OE2 3.21Å
688	G	85.8	Confident	89.2	Confident	30 Å²	30	17.1 Å²	17.1	31%	0.309	10%	0.104	S	C	.	.	H	α-helix	trans	-59.1	-37.9	-179.8	0	0	0	0	0	113.5	R691 H692	G688-R691 WeakPolarHBondContact O-CB 3.38Å; G688-R691 PolarHBondContact O-N 2.64Å; G688-H692 PolarHBondContact O-CD2 3.33Å; G688-H692 VanDerWaalsContact O-CD2 3.27Å; G688-H692 PolarHBondContact O-N 2.88Å
689	C	87	Confident	89.2	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66	-46.3	178.7	-168.7	0	0	0	0	111.6	R687 R691 H692 L693 H724	R687-C689 VanDerWaalsContact C-N 3.31Å; R687-C689 PolarHBondContact O-N 3.45Å; C689-R691 VanDerWaalsContact C-N 3.27Å; C689-R691 PolarHBondContact O-N 3.44Å; C689-H692 PolarHBondContact O-N 3.22Å; C689-H692 VanDerWaalsContact O-N 3.13Å; C689-L693 WeakPolarHBondContact O-CB 3.11Å; C689-L693 VanDerWaalsContact O-CG 3.29Å; C689-L693 WeakPolarHBondContact O-CG 3.42Å; C689-L693 PolarHBondContact O-N 3.15Å; C689-H724 HydrophobicContact CB-CB 4.35Å; C689-H724 WeakPolarHBondContact CB-CD2 3.47Å; C689-H724 PolarHBondContact SG-CD2 3.24Å
690	H	88.1	Confident	89.3	Confident	25 Å²	25	14.7 Å²	14.7	12%	0.116	9%	0.091	C	C	.	.	H	α-helix	trans	-56.8	-41.5	175.1	178.8	74	0	0	0	112	A644 R687 L693 C694 R743	A644-H690 PolarHBondContact O-NE2 3.45Å; R687-H690 HydrophobicContact CB-CB 4.41Å; R687-H690 PolarHBondContact O-N 3.3Å; H690-L693 PolarHBondContact O-N 3.04Å; H690-C694 PolarHBondContact CE1-SG 3.19Å; H690-C694 WeakPolarHBondContact O-CB 3.33Å; H690-C694 PolarHBondContact O-N 3.31Å; H690-C694 PolarHBondContact O-SG 2.76Å; H690-R743 PolarHBondContact CE1-NH1 3.23Å; H690-R743 PolarHBondContact ND1-NH1 3.18Å
691	R	90.8	Very high	89.2	Confident	44 Å²	44	17.5 Å²	17.5	17%	0.166	10%	0.104	C	C	.	.	H	α-helix	trans	-58.7	-47.3	173.9	166.3	179.9	-179.1	-167.3	8.4	112.4	F647 Q651 D678 R687 G688 C689 Y695	F647-R691 HydrophobicContact CE1-CB 3.85Å; F647-R691 HydrophobicContact CE1-CG 3.7Å; F647-R691 HydrophobicContact CZ-CB 4.46Å; F647-R691 HydrophobicContact CZ-CG 3.97Å; Q651-R691 PolarHBondContact NE2-O 3.25Å; Q651-R691 PolarHBondContact OE1-O 3.12Å; D678-R691 IonicContact OD1-CZ 3.95Å; D678-R691 IonicContact OD1-NH1 3.48Å; D678-R691 PolarHBondContact OD1-NH1 2.99Å; D678-R691 IonicContact OD1-NH2 3.45Å; D678-R691 PolarHBondContact OD1-NH2 3.36Å; R687-R691 PolarHBondContact O-N 3.42Å; R687-R691 VanDerWaalsContact O-N 3.14Å; G688-R691 WeakPolarHBondContact O-CB 3.38Å; G688-R691 PolarHBondContact O-N 2.64Å; C689-R691 VanDerWaalsContact C-N 3.27Å; C689-R691 PolarHBondContact O-N 3.44Å; R691-Y695 VanDerWaalsContact O-CB 3.28Å; R691-Y695 WeakPolarHBondContact O-CB 3.28Å; R691-Y695 PolarHBondContact O-N 2.89Å
692	H	91.3	Very high	89.1	Confident	17 Å²	17	18.3 Å²	18.3	8%	0.079	11%	0.106	C	C	.	.	H	α-helix	trans	-73.9	-34.3	-178.8	-79.5	-75	0	0	0	112.7	G688 C689 Y695 L696 Y716 S717 F720 C721	G688-H692 PolarHBondContact O-CD2 3.33Å; G688-H692 VanDerWaalsContact O-CD2 3.27Å; G688-H692 PolarHBondContact O-N 2.88Å; C689-H692 PolarHBondContact O-N 3.22Å; C689-H692 VanDerWaalsContact O-N 3.13Å; H692-Y695 PolarHBondContact O-N 3.49Å; H692-L696 WeakPolarHBondContact O-CB 3.2Å; H692-L696 VanDerWaalsContact O-CG 3.28Å; H692-L696 WeakPolarHBondContact O-CG 3.34Å; H692-L696 PolarHBondContact O-N 3.44Å; H692-Y716 AromaticContact CE1-CE1 3.68Å; H692-S717 WeakPolarHBondContact ND1-CB 3.46Å; H692-S717 PolarHBondContact ND1-OG 3.35Å; H692-F720 HydrophobicContact CB-CD1 4.14Å; H692-F720 AromaticContact CD2-CD1 3.28Å; H692-F720 WeakPolarHBondContact CD2-CD1 3.4Å; H692-F720 AromaticContact CD2-CE1 3.62Å; H692-F720 AromaticContact CD2-CG 3.68Å; H692-F720 AromaticContact CG-CD1 3.83Å; H692-C721 WeakPolarHBondContact CB-SG 3.43Å
693	L	90.8	Very high	89.1	Confident	3 Å²	3	17.8 Å²	17.8	2%	0.016	10%	0.101	C	C	.	.	H	α-helix	trans	-64.7	-47.9	173.7	-69.8	171	0	0	0	111.4	C689 H690 Y695 L696 A697 C721 E740 R743 F744 I747	C689-L693 WeakPolarHBondContact O-CB 3.11Å; C689-L693 VanDerWaalsContact O-CG 3.29Å; C689-L693 WeakPolarHBondContact O-CG 3.42Å; C689-L693 PolarHBondContact O-N 3.15Å; H690-L693 PolarHBondContact O-N 3.04Å; L693-Y695 VanDerWaalsContact C-N 3.3Å; L693-Y695 PolarHBondContact O-N 3.46Å; L693-L696 PolarHBondContact O-N 3.23Å; L693-A697 WeakPolarHBondContact O-CB 3.33Å; L693-A697 PolarHBondContact O-N 2.96Å; L693-C721 HydrophobicContact CD2-CB 4.11Å; L693-E740 HydrophobicContact CD1-CB 4.21Å; L693-E740 HydrophobicContact CD1-CG 4.29Å; L693-R743 HydrophobicContact CD1-CB 4.45Å; L693-F744 HydrophobicContact CD2-CB 3.91Å; L693-F744 HydrophobicContact CD2-CD2 4.1Å; L693-I747 HydrophobicContact CB-CD1 4.07Å; L693-I747 HydrophobicContact CD2-CD1 3.84Å; L693-I747 WeakPolarHBondContact O-CD1 3.15Å
694	C	90.9	Very high	89	Confident	6 Å²	6	22.1 Å²	22.1	4%	0.041	12%	0.121	C	C	.	.	H	α-helix	trans	-59.6	-44.5	173.9	-66.7	0	0	0	0	110.6	R648 H690 L696 A697 E698	R648-C694 HydrophobicContact CG-CB 4.35Å; H690-C694 PolarHBondContact CE1-SG 3.19Å; H690-C694 WeakPolarHBondContact O-CB 3.33Å; H690-C694 PolarHBondContact O-N 3.31Å; H690-C694 PolarHBondContact O-SG 2.76Å; C694-L696 PolarHBondContact O-N 2.9Å; C694-A697 PolarHBondContact O-N 3.25Å; C694-E698 WeakPolarHBondContact O-CG 3.35Å; C694-E698 PolarHBondContact O-N 3.02Å
695	Y	92	Very high	88.8	Confident	13 Å²	13	27.3 Å²	27.3	5%	0.051	15%	0.15	C	C	.	.	H	α-helix	trans	-61.6	-45.3	179.8	-165.3	-149.9	0	0	0	113	Q651 L655 G667 F669 R691 H692 L693 A697 E698 L699 L713	Q651-Y695 HydrophobicContact CG-CD2 4.4Å; L655-Y695 HydrophobicContact CD1-CE2 4.25Å; L655-Y695 HydrophobicContact CD2-CD2 4.48Å; L655-Y695 HydrophobicContact CD2-CE2 4.23Å; G667-Y695 PolarHBondContact O-OH 3.08Å; F669-Y695 HydrophobicContact CD2-CE2 4.24Å; F669-Y695 AromaticContact CD2-CZ 3.91Å; F669-Y695 HydrophobicContact CE1-CE2 4.4Å; F669-Y695 AromaticContact CE2-CD2 3.97Å; F669-Y695 HydrophobicContact CE2-CD2 3.97Å; F669-Y695 HydrophobicContact CE2-CE1 4.14Å; F669-Y695 AromaticContact CE2-CE2 3.32Å; F669-Y695 HydrophobicContact CE2-CE2 3.32Å; F669-Y695 AromaticContact CE2-CZ 3.4Å; F669-Y695 VanDerWaalsContact CE2-CZ 3.4Å; F669-Y695 WeakPolarHBondContact CE2-OH 3.23Å; F669-Y695 HydrophobicContact CZ-CD2 4.06Å; F669-Y695 AromaticContact CZ-CE2 3.42Å; F669-Y695 HydrophobicContact CZ-CE2 3.42Å; F669-Y695 VanDerWaalsContact CZ-CE2 3.42Å; F669-Y695 AromaticContact CZ-CZ 3.95Å; R691-Y695 VanDerWaalsContact O-CB 3.28Å; R691-Y695 WeakPolarHBondContact O-CB 3.28Å; R691-Y695 PolarHBondContact O-N 2.89Å; H692-Y695 PolarHBondContact O-N 3.49Å; L693-Y695 VanDerWaalsContact C-N 3.3Å; L693-Y695 PolarHBondContact O-N 3.46Å; Y695-A697 VanDerWaalsContact C-N 3.34Å; Y695-A697 PolarHBondContact O-N 3.42Å; Y695-E698 PolarHBondContact O-N 2.98Å; Y695-L699 HydrophobicContact CD1-CD1 3.94Å; Y695-L699 HydrophobicContact CD2-CD1 3.98Å; Y695-L699 HydrophobicContact CD2-CD2 4.47Å; Y695-L699 HydrophobicContact CD2-CG 3.92Å; Y695-L699 HydrophobicContact CE1-CD1 3.84Å; Y695-L699 HydrophobicContact CE2-CD1 3.87Å; Y695-L699 HydrophobicContact CE2-CD2 3.9Å; Y695-L699 HydrophobicContact CE2-CG 3.82Å; Y695-L699 HydrophobicContact CG-CD1 4.02Å; Y695-L699 HydrophobicContact CG-CG 4.4Å; Y695-L699 WeakPolarHBondContact O-CB 3.34Å; Y695-L699 WeakPolarHBondContact O-CG 3.26Å; Y695-L699 PolarHBondContact O-N 3.23Å; Y695-L713 HydrophobicContact CE1-CD1 3.83Å; Y695-L713 HydrophobicContact CE1-CD2 4.29Å; Y695-L713 HydrophobicContact CE1-CG 4.15Å; Y695-L713 WeakPolarHBondContact OH-CD2 3.46Å
696	L	92.4	Very high	88.5	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60	-44.6	176	-77.5	169.1	0	0	0	111.5	H692 L693 C694 E698 L699 M700 L714 F718 I747	H692-L696 WeakPolarHBondContact O-CB 3.2Å; H692-L696 VanDerWaalsContact O-CG 3.28Å; H692-L696 WeakPolarHBondContact O-CG 3.34Å; H692-L696 PolarHBondContact O-N 3.44Å; L693-L696 PolarHBondContact O-N 3.23Å; C694-L696 PolarHBondContact O-N 2.9Å; L696-E698 PolarHBondContact O-N 3.14Å; L696-L699 PolarHBondContact O-N 3.44Å; L696-M700 WeakPolarHBondContact O-CB 3.47Å; L696-M700 VanDerWaalsContact O-CG 3.22Å; L696-M700 WeakPolarHBondContact O-CG 3.4Å; L696-M700 PolarHBondContact O-N 2.96Å; L696-L714 HydrophobicContact CD2-CD2 3.91Å; L696-F718 HydrophobicContact CD1-CB 4.33Å; L696-F718 HydrophobicContact CD2-CB 4.49Å; L696-I747 HydrophobicContact CB-CG2 4.14Å; L696-I747 HydrophobicContact CD1-CG2 4.21Å
697	A	92.1	Very high	88.2	Confident	20 Å²	20	28.5 Å²	28.5	17%	0.165	16%	0.163	C	C	.	.	H	α-helix	trans	-59.1	-47.5	178.8	0	0	0	0	0	112	L693 C694 Y695 M700 E701 I747	L693-A697 WeakPolarHBondContact O-CB 3.33Å; L693-A697 PolarHBondContact O-N 2.96Å; C694-A697 PolarHBondContact O-N 3.25Å; Y695-A697 VanDerWaalsContact C-N 3.34Å; Y695-A697 PolarHBondContact O-N 3.42Å; A697-M700 PolarHBondContact O-N 2.86Å; A697-E701 PolarHBondContact O-N 3.44Å; A697-I747 HydrophobicContact CB-CD1 4.3Å
698	E	91.6	Very high	88	Confident	2 Å²	2	27.8 Å²	27.8	1%	0.009	16%	0.164	C	C	.	.	H	α-helix	trans	-70.6	-39.4	179.8	-54.3	-67.3	150	0	0	111.3	R648 R652 L655 C694 Y695 L696 M700 E701 H702	R648-E698 IonicContact CZ-OE1 3.28Å; R648-E698 IonicContact NE-OE1 2.62Å; R648-E698 PolarHBondContact NE-OE1 3.32Å; R648-E698 IonicContact NH2-OE1 3.6Å; R648-E698 PolarHBondContact NH2-OE1 3.08Å; R652-E698 HydrophobicContact CB-CG 4.42Å; R652-E698 VanDerWaalsContact CD-OE2 3.22Å; R652-E698 WeakPolarHBondContact CD-OE2 3.31Å; R652-E698 WeakPolarHBondContact CG-OE2 3.47Å; R652-E698 IonicContact CZ-OE2 2.7Å; R652-E698 IonicContact NE-OE2 3.28Å; R652-E698 IonicContact NH1-OE1 2.89Å; R652-E698 IonicContact NH1-OE2 3.14Å; R652-E698 PolarHBondContact NH1-OE2 3.1Å; L655-E698 HydrophobicContact CD2-CB 4.04Å; C694-E698 WeakPolarHBondContact O-CG 3.35Å; C694-E698 PolarHBondContact O-N 3.02Å; Y695-E698 PolarHBondContact O-N 2.98Å; L696-E698 PolarHBondContact O-N 3.14Å; E698-M700 VanDerWaalsContact C-N 3.33Å; E698-M700 PolarHBondContact O-N 3.1Å; E698-E701 PolarHBondContact O-N 2.81Å; E698-H702 PolarHBondContact O-CD2 3.32Å; E698-H702 PolarHBondContact O-N 3.2Å
699	L	91.3	Very high	88	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.1	-40.6	174.5	-72.1	172.4	0	0	0	112.2	L655 Y695 L696 S703 I709 L713 L714	L655-L699 HydrophobicContact CD1-CD2 4.03Å; L655-L699 HydrophobicContact CD2-CD2 3.9Å; L655-L699 HydrophobicContact CD2-CG 4.3Å; Y695-L699 HydrophobicContact CD1-CD1 3.94Å; Y695-L699 HydrophobicContact CD2-CD1 3.98Å; Y695-L699 HydrophobicContact CD2-CD2 4.47Å; Y695-L699 HydrophobicContact CD2-CG 3.92Å; Y695-L699 HydrophobicContact CE1-CD1 3.84Å; Y695-L699 HydrophobicContact CE2-CD1 3.87Å; Y695-L699 HydrophobicContact CE2-CD2 3.9Å; Y695-L699 HydrophobicContact CE2-CG 3.82Å; Y695-L699 HydrophobicContact CG-CD1 4.02Å; Y695-L699 HydrophobicContact CG-CG 4.4Å; Y695-L699 WeakPolarHBondContact O-CB 3.34Å; Y695-L699 WeakPolarHBondContact O-CG 3.26Å; Y695-L699 PolarHBondContact O-N 3.23Å; L696-L699 PolarHBondContact O-N 3.44Å; L699-S703 WeakPolarHBondContact O-CB 3.43Å; L699-S703 PolarHBondContact O-N 3.34Å; L699-I709 HydrophobicContact CB-CG2 4.42Å; L699-I709 HydrophobicContact CD2-CD1 4.04Å; L699-I709 HydrophobicContact CD2-CG2 3.91Å; L699-L713 HydrophobicContact CD1-CD2 3.9Å; L699-L713 HydrophobicContact CD1-CG 3.99Å; L699-L713 HydrophobicContact CD2-CD2 4.05Å; L699-L714 HydrophobicContact CB-CD2 3.75Å; L699-L714 HydrophobicContact CD1-CD2 3.98Å
700	M	90.8	Very high	87.8	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-66.2	-43.3	175.3	-72	-174.7	-55.1	0	0	111.6	L696 A697 E698 H702 S703 E704 I747 R750 L751 L754	L696-M700 WeakPolarHBondContact O-CB 3.47Å; L696-M700 VanDerWaalsContact O-CG 3.22Å; L696-M700 WeakPolarHBondContact O-CG 3.4Å; L696-M700 PolarHBondContact O-N 2.96Å; A697-M700 PolarHBondContact O-N 2.86Å; E698-M700 VanDerWaalsContact C-N 3.33Å; E698-M700 PolarHBondContact O-N 3.1Å; M700-H702 VanDerWaalsContact C-N 3.34Å; M700-H702 PolarHBondContact O-N 2.86Å; M700-S703 PolarHBondContact O-N 2.81Å; M700-S703 VanDerWaalsContact O-N 3.12Å; M700-E704 WeakPolarHBondContact O-CB 3.37Å; M700-E704 WeakPolarHBondContact O-CG 3.49Å; M700-E704 PolarHBondContact O-N 2.85Å; M700-I747 HydrophobicContact CE-CB 4.14Å; M700-I747 HydrophobicContact CE-CG1 3.94Å; M700-I747 HydrophobicContact CE-CG2 3.71Å; M700-I747 HydrophobicContact SD-CG2 4.35Å; M700-R750 HydrophobicContact CE-CG 4.45Å; M700-R750 HydrophobicContact SD-CG 4.41Å; M700-L751 HydrophobicContact CG-CD1 4.32Å; M700-L751 HydrophobicContact SD-CB 3.73Å; M700-L751 HydrophobicContact SD-CD1 4.05Å; M700-L751 HydrophobicContact SD-CG 4.44Å; M700-L754 HydrophobicContact CB-CD2 4.18Å; M700-L754 HydrophobicContact CG-CD2 3.93Å
701	E	90.4	Very high	87.6	Confident	59 Å²	59	26 Å²	26	28%	0.276	15%	0.148	S	C	.	.	H	α-helix	trans	-59.3	-43.9	176.9	-174.5	174.9	164	0	0	111.5	R652 A697 E698 E704 N705	R652-E701 IonicContact NH2-OE1 2.86Å; A697-E701 PolarHBondContact O-N 3.44Å; E698-E701 PolarHBondContact O-N 2.81Å; E701-E704 PolarHBondContact O-N 3.16Å; E701-N705 WeakPolarHBondContact O-CB 3.47Å; E701-N705 PolarHBondContact O-N 2.92Å; E701-N705 PolarHBondContact O-ND2 3.44Å; E701-N705 VanDerWaalsContact O-ND2 3.08Å
702	H	87.3	Confident	87.4	Confident	29 Å²	29	27 Å²	27	13%	0.134	16%	0.159	C	C	.	.	H	α-helix	trans	-65.6	-38.1	173.8	-73.3	-64.1	0	0	0	112.9	D656 L659 E698 M700 N705 G706 A707	D656-H702 IonicContact OD1-CE1 2.67Å; D656-H702 PolarHBondContact OD1-CE1 3.01Å; D656-H702 IonicContact OD1-NE2 3.38Å; D656-H702 PolarHBondContact OD1-NE2 2.9Å; L659-H702 HydrophobicContact CD1-CB 4.01Å; E698-H702 PolarHBondContact O-CD2 3.32Å; E698-H702 PolarHBondContact O-N 3.2Å; M700-H702 VanDerWaalsContact C-N 3.34Å; M700-H702 PolarHBondContact O-N 2.86Å; H702-N705 CarbonylContact O-C 3.55Å; H702-N705 PolarHBondContact O-N 3.27Å; H702-G706 PolarHBondContact O-N 3.42Å; H702-A707 HydrophobicContact CB-CB 4.08Å; H702-A707 VanDerWaalsContact O-CB 3.24Å; H702-A707 WeakPolarHBondContact O-CB 3.15Å; H702-A707 PolarHBondContact O-N 3.24Å
703	S	86.4	Confident	87.2	Confident	18 Å²	18	26.3 Å²	26.3	13%	0.126	16%	0.156	C	C	.	.	H	α-helix	trans	-65.7	-40.6	176.8	-173.1	0	0	0	0	112.4	L699 M700 N705 G706 A707 Q758	L699-S703 WeakPolarHBondContact O-CB 3.43Å; L699-S703 PolarHBondContact O-N 3.34Å; M700-S703 PolarHBondContact O-N 2.81Å; M700-S703 VanDerWaalsContact O-N 3.12Å; S703-N705 VanDerWaalsContact C-N 3.31Å; S703-G706 PolarHBondContact O-N 2.84Å; S703-G706 VanDerWaalsContact O-N 3.08Å; S703-A707 WeakPolarHBondContact CA-O 3.41Å; S703-Q758 PolarHBondContact OG-NE2 3.48Å
704	E	85.8	Confident	87.1	Confident	93 Å²	93	26.2 Å²	26.2	44%	0.435	16%	0.156	S	C	.	.	H	α-helix	trans	-65.4	-35.1	174.4	-71.9	169.7	-177.4	0	0	111.9	M700 E701 G706 R750 L754	M700-E704 WeakPolarHBondContact O-CB 3.37Å; M700-E704 WeakPolarHBondContact O-CG 3.49Å; M700-E704 PolarHBondContact O-N 2.85Å; E701-E704 PolarHBondContact O-N 3.16Å; E704-G706 PolarHBondContact O-N 2.89Å; E704-R750 IonicContact OE1-CZ 3.37Å; E704-R750 IonicContact OE1-NE 3.15Å; E704-R750 PolarHBondContact OE1-NE 3.36Å; E704-R750 IonicContact OE1-NH2 3.91Å; E704-R750 PolarHBondContact OE1-NH2 3.11Å; E704-R750 IonicContact OE2-CZ 3.14Å; E704-R750 IonicContact OE2-NE 2.72Å; E704-R750 PolarHBondContact OE2-NE 3.13Å; E704-R750 IonicContact OE2-NH2 2.79Å; E704-R750 PolarHBondContact OE2-NH2 2.91Å; E704-L754 HydrophobicContact CG-CD1 3.87Å
705	N	84.2	Confident	87	Confident	125 Å²	125	27.7 Å²	27.7	67%	0.668	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75	2.2	173	-69.4	-31.4	0	0	0	113.7	E701 H702 S703	E701-N705 WeakPolarHBondContact O-CB 3.47Å; E701-N705 PolarHBondContact O-N 2.92Å; E701-N705 PolarHBondContact O-ND2 3.44Å; E701-N705 VanDerWaalsContact O-ND2 3.08Å; H702-N705 CarbonylContact O-C 3.55Å; H702-N705 PolarHBondContact O-N 3.27Å; S703-N705 VanDerWaalsContact C-N 3.31Å
706	G	76.7	Confident	86.8	Confident	46 Å²	46	33.5 Å²	33.5	47%	0.474	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.9	10	173.6	0	0	0	0	0	115.6	S165 H702 S703 E704	S165-G706 WeakPolarHBondContact CB-O 3.29Å; H702-G706 PolarHBondContact O-N 3.42Å; S703-G706 PolarHBondContact O-N 2.84Å; S703-G706 VanDerWaalsContact O-N 3.08Å; E704-G706 PolarHBondContact O-N 2.89Å
707	A	81.9	Confident	86.7	Confident	23 Å²	23	33.5 Å²	33.5	19%	0.19	19%	0.185	C	C	.	.			trans	-75.6	143	170.1	0	0	0	0	0	111	H702 S703	H702-A707 HydrophobicContact CB-CB 4.08Å; H702-A707 VanDerWaalsContact O-CB 3.24Å; H702-A707 WeakPolarHBondContact O-CB 3.15Å; H702-A707 PolarHBondContact O-N 3.24Å; S703-A707 WeakPolarHBondContact CA-O 3.41Å
708	V	80.1	Confident	86.6	Confident	30 Å²	30	32.8 Å²	32.8	18%	0.182	18%	0.178	C	C	.	.			trans	-86.7	116.9	176.8	177.2	0	0	0	0	109.5	S165 L666 P771	S165-V708 WeakPolarHBondContact OG-CG2 3.27Å; L666-V708 HydrophobicContact CD2-CG1 3.95Å; V708-P771 HydrophobicContact CG1-CG 3.93Å
709	I	85.5	Confident	86.4	Confident	11 Å²	11	34.1 Å²	34.1	6%	0.056	19%	0.189	C	C	.	.			trans	-111.1	139.5	177.8	-56.6	-58.7	0	0	0	109.2	L659 L699 P711 L714	L659-I709 HydrophobicContact CD1-CD1 4.49Å; L659-I709 HydrophobicContact CD2-CD1 3.92Å; L699-I709 HydrophobicContact CB-CG2 4.42Å; L699-I709 HydrophobicContact CD2-CD1 4.04Å; L699-I709 HydrophobicContact CD2-CG2 3.91Å; I709-P711 VanDerWaalsContact O-CD 3.25Å; I709-P711 WeakPolarHBondContact O-CD 3.42Å; I709-L714 HydrophobicContact CG2-CD1 4.47Å; I709-L714 HydrophobicContact CG2-CG 4.19Å
710	D	83.9	Confident	86.3	Confident	5 Å²	5	37 Å²	37	3%	0.027	20%	0.201	C	C	.	.			trans	-65.9	117.8	175.8	-169.6	-28.2	0	0	0	110	R109 L666 W668 T712 L713	R109-D710 IonicContact CZ-OD2 2.79Å; R109-D710 IonicContact NH1-OD2 2.79Å; R109-D710 PolarHBondContact NH1-OD2 3.07Å; L666-D710 HydrophobicContact CB-CB 3.82Å; L666-D710 HydrophobicContact CD1-CB 4.41Å; L666-D710 PolarHBondContact O-N 3.14Å; W668-D710 PolarHBondContact NE1-OD2 2.94Å; D710-T712 PolarHBondContact O-N 2.93Å; D710-T712 VanDerWaalsContact O-N 3.13Å; D710-T712 WeakPolarHBondContact OD1-CB 3.12Å; D710-T712 PolarHBondContact OD1-N 3.46Å; D710-T712 PolarHBondContact OD1-OG1 2.83Å; D710-L713 HydrophobicContact CB-CB 4.34Å; D710-L713 VanDerWaalsContact O-CB 3.3Å; D710-L713 WeakPolarHBondContact O-CB 3.38Å; D710-L713 PolarHBondContact O-N 3.08Å
711	P	84.3	Confident	86.2	Confident	2 Å²	2	37 Å²	37	1%	0.013	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-23.9	179.7	-24.2	36.3	0	0	0	113.2	I709 L713 L714 H715 F766 A774 A777 T778	I709-P711 VanDerWaalsContact O-CD 3.25Å; I709-P711 WeakPolarHBondContact O-CD 3.42Å; P711-L713 VanDerWaalsContact C-N 3.27Å; P711-L713 PolarHBondContact O-N 2.81Å; P711-L714 PolarHBondContact O-N 3.3Å; P711-H715 VanDerWaalsContact O-CB 3.29Å; P711-H715 WeakPolarHBondContact O-CB 3.24Å; P711-H715 PolarHBondContact O-N 3.27Å; P711-F766 HydrophobicContact CG-CE1 4.25Å; P711-A774 HydrophobicContact CG-CB 3.93Å; P711-A777 HydrophobicContact CB-CB 3.93Å; P711-T778 WeakPolarHBondContact CB-OG1 3.5Å; P711-T778 VanDerWaalsContact CG-OG1 3.29Å; P711-T778 WeakPolarHBondContact CG-OG1 3.37Å
712	T	85.4	Confident	86	Confident	64 Å²	64	34.5 Å²	34.5	39%	0.393	19%	0.191	S	C	.	.	H	α-helix	trans	-63.5	-34.9	175.3	-43.1	0	0	0	0	111.7	D710 H715 Y716	D710-T712 PolarHBondContact O-N 2.93Å; D710-T712 VanDerWaalsContact O-N 3.13Å; D710-T712 WeakPolarHBondContact OD1-CB 3.12Å; D710-T712 PolarHBondContact OD1-N 3.46Å; D710-T712 PolarHBondContact OD1-OG1 2.83Å; T712-H715 PolarHBondContact O-N 3.49Å; T712-Y716 PolarHBondContact O-N 3.08Å
713	L	87.6	Confident	85.9	Confident	4 Å²	4	34.2 Å²	34.2	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-70.6	-44	178.8	-179.8	63	0	0	0	111.5	G667 W668 Y695 L699 D710 P711 H715 Y716 S717	G667-L713 VanDerWaalsContact C-CD2 3.49Å; W668-L713 HydrophobicContact CD2-CD1 4.02Å; W668-L713 HydrophobicContact CE3-CD1 3.75Å; W668-L713 HydrophobicContact CH2-CB 4.46Å; W668-L713 HydrophobicContact CH2-CD1 3.98Å; W668-L713 HydrophobicContact CZ2-CB 3.98Å; W668-L713 HydrophobicContact CZ2-CD1 4.22Å; W668-L713 HydrophobicContact CZ3-CD1 3.73Å; Y695-L713 HydrophobicContact CE1-CD1 3.83Å; Y695-L713 HydrophobicContact CE1-CD2 4.29Å; Y695-L713 HydrophobicContact CE1-CG 4.15Å; Y695-L713 WeakPolarHBondContact OH-CD2 3.46Å; L699-L713 HydrophobicContact CD1-CD2 3.9Å; L699-L713 HydrophobicContact CD1-CG 3.99Å; L699-L713 HydrophobicContact CD2-CD2 4.05Å; D710-L713 HydrophobicContact CB-CB 4.34Å; D710-L713 VanDerWaalsContact O-CB 3.3Å; D710-L713 WeakPolarHBondContact O-CB 3.38Å; D710-L713 PolarHBondContact O-N 3.08Å; P711-L713 VanDerWaalsContact C-N 3.27Å; P711-L713 PolarHBondContact O-N 2.81Å; L713-H715 VanDerWaalsContact C-N 3.27Å; L713-H715 PolarHBondContact O-N 2.95Å; L713-Y716 PolarHBondContact O-N 2.85Å; L713-S717 PolarHBondContact O-N 3.38Å; L713-S717 VanDerWaalsContact O-N 3.11Å; L713-S717 PolarHBondContact O-OG 3.44Å
714	L	89.4	Confident	85.8	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-58.9	-44.2	171.7	-68.2	174.8	0	0	0	110.1	L696 L699 I709 P711 S717 F718 L751 L781	L696-L714 HydrophobicContact CD2-CD2 3.91Å; L699-L714 HydrophobicContact CB-CD2 3.75Å; L699-L714 HydrophobicContact CD1-CD2 3.98Å; I709-L714 HydrophobicContact CG2-CD1 4.47Å; I709-L714 HydrophobicContact CG2-CG 4.19Å; P711-L714 PolarHBondContact O-N 3.3Å; L714-S717 PolarHBondContact O-N 2.87Å; L714-F718 WeakPolarHBondContact O-CB 3.32Å; L714-F718 PolarHBondContact O-N 3.23Å; L714-L751 HydrophobicContact CD1-CD1 4.46Å; L714-L781 HydrophobicContact CB-CD2 3.65Å
715	H	88.2	Confident	85.7	Confident	36 Å²	36	29.8 Å²	29.8	17%	0.167	17%	0.171	C	C	.	.	H	α-helix	trans	-63.6	-44.3	179.5	178.9	-88.1	0	0	0	113.4	P711 T712 L713 A719 L781 R784	P711-H715 VanDerWaalsContact O-CB 3.29Å; P711-H715 WeakPolarHBondContact O-CB 3.24Å; P711-H715 PolarHBondContact O-N 3.27Å; T712-H715 PolarHBondContact O-N 3.49Å; L713-H715 VanDerWaalsContact C-N 3.27Å; L713-H715 PolarHBondContact O-N 2.95Å; H715-A719 VanDerWaalsContact O-CB 3.22Å; H715-A719 WeakPolarHBondContact O-CB 3.31Å; H715-A719 PolarHBondContact O-N 2.73Å; H715-L781 HydrophobicContact CB-CB 4.35Å; H715-L781 HydrophobicContact CB-CD1 3.94Å; H715-L781 HydrophobicContact CB-CD2 4.32Å; H715-L781 HydrophobicContact CB-CG 4.43Å; H715-R784 PolarHBondContact CE1-NH1 2.9Å; H715-R784 WeakPolarHBondContact NE2-CD 3.45Å; H715-R784 VanDerWaalsContact NE2-CZ 3.26Å; H715-R784 PolarHBondContact NE2-NE 3.3Å; H715-R784 PolarHBondContact NE2-NH1 3.07Å; H715-R784 VanDerWaalsContact NE2-NH1 3.12Å
716	Y	88.2	Confident	85.6	Confident	136 Å²	136	26.4 Å²	26.4	53%	0.533	15%	0.151	S	C	.	.	H	α-helix	trans	-59.8	-49.6	175.1	175	-101.8	0	0	0	111.8	H692 T712 L713 A719 F720	H692-Y716 AromaticContact CE1-CE1 3.68Å; T712-Y716 PolarHBondContact O-N 3.08Å; L713-Y716 PolarHBondContact O-N 2.85Å; Y716-A719 PolarHBondContact O-N 2.83Å; Y716-F720 PolarHBondContact O-N 3.32Å; Y716-F720 VanDerWaalsContact O-N 3.07Å
717	S	89.4	Confident	85.2	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-68.1	-39.3	-178	-61.7	0	0	0	0	112.2	H692 L713 L714 F720 C721	H692-S717 WeakPolarHBondContact ND1-CB 3.46Å; H692-S717 PolarHBondContact ND1-OG 3.35Å; L713-S717 PolarHBondContact O-N 3.38Å; L713-S717 VanDerWaalsContact O-N 3.11Å; L713-S717 PolarHBondContact O-OG 3.44Å; L714-S717 PolarHBondContact O-N 2.87Å; S717-F720 PolarHBondContact O-N 3.21Å; S717-C721 PolarHBondContact O-N 3.45Å; S717-C721 VanDerWaalsContact O-N 3.1Å; S717-C721 PolarHBondContact O-SG 3.24Å; S717-C721 VanDerWaalsContact O-SG 3.4Å
718	F	90.6	Very high	84.3	Confident	5 Å²	5	30 Å²	30	2%	0.022	17%	0.17	C	C	.	.	H	α-helix	trans	-64.9	-44.7	176	-178.1	-95	0	0	0	111.5	L696 L714 F720 C721 A722 F744 K748 L751 L781 R784 V785	L696-F718 HydrophobicContact CD1-CB 4.33Å; L696-F718 HydrophobicContact CD2-CB 4.49Å; L714-F718 WeakPolarHBondContact O-CB 3.32Å; L714-F718 PolarHBondContact O-N 3.23Å; F718-F720 VanDerWaalsContact C-N 3.29Å; F718-F720 PolarHBondContact O-N 3.18Å; F718-C721 PolarHBondContact O-N 3.32Å; F718-A722 HydrophobicContact CE1-CB 4.35Å; F718-A722 WeakPolarHBondContact O-CB 3.4Å; F718-A722 PolarHBondContact O-N 2.87Å; F718-F744 HydrophobicContact CD2-CE2 4.05Å; F718-F744 AromaticContact CE2-CE2 3.62Å; F718-F744 HydrophobicContact CE2-CE2 3.62Å; F718-F744 AromaticContact CE2-CZ 3.84Å; F718-F744 HydrophobicContact CE2-CZ 3.84Å; F718-F744 HydrophobicContact CZ-CE2 4.08Å; F718-F744 AromaticContact CZ-CZ 3.86Å; F718-F744 HydrophobicContact CZ-CZ 3.86Å; F718-K748 HydrophobicContact CE2-CB 4.26Å; F718-K748 HydrophobicContact CE2-CG 4.18Å; F718-K748 HydrophobicContact CZ-CG 4.19Å; F718-L751 HydrophobicContact CB-CD2 4.37Å; F718-L751 HydrophobicContact CD2-CD2 3.67Å; F718-L751 HydrophobicContact CE2-CD2 4.23Å; F718-L751 HydrophobicContact CG-CD2 4.11Å; F718-L781 HydrophobicContact CB-CD1 4.15Å; F718-L781 HydrophobicContact CD1-CD1 4.11Å; F718-L781 HydrophobicContact CG-CD1 4.27Å; F718-R784 HydrophobicContact CE1-CB 4.49Å; F718-V785 HydrophobicContact CD1-CG2 4.13Å; F718-V785 HydrophobicContact CD2-CG2 4.32Å; F718-V785 HydrophobicContact CE1-CB 4.42Å; F718-V785 HydrophobicContact CE1-CG2 3.79Å; F718-V785 HydrophobicContact CE2-CG2 3.99Å; F718-V785 HydrophobicContact CG-CG2 4.39Å; F718-V785 HydrophobicContact CZ-CB 4.22Å; F718-V785 HydrophobicContact CZ-CG2 3.72Å
719	A	87.8	Confident	83.6	Confident	29 Å²	29	31 Å²	31	24%	0.24	17%	0.17	C	C	.	.	H	α-helix	trans	-61.1	-38.4	177.5	0	0	0	0	0	112.1	H715 Y716 S723	H715-A719 VanDerWaalsContact O-CB 3.22Å; H715-A719 WeakPolarHBondContact O-CB 3.31Å; H715-A719 PolarHBondContact O-N 2.73Å; Y716-A719 PolarHBondContact O-N 2.83Å; A719-S723 VanDerWaalsContact O-CB 3.29Å; A719-S723 WeakPolarHBondContact O-CB 3.37Å; A719-S723 PolarHBondContact O-N 3.15Å
720	F	87.6	Confident	82	Confident	61 Å²	61	36.1 Å²	36.1	27%	0.268	20%	0.204	S	C	.	.	H	α-helix	trans	-62.6	-48.5	174.3	-174.6	-84.4	0	0	0	111.9	H692 Y716 S717 F718 S723 H724	H692-F720 HydrophobicContact CB-CD1 4.14Å; H692-F720 AromaticContact CD2-CD1 3.28Å; H692-F720 WeakPolarHBondContact CD2-CD1 3.4Å; H692-F720 AromaticContact CD2-CE1 3.62Å; H692-F720 AromaticContact CD2-CG 3.68Å; H692-F720 AromaticContact CG-CD1 3.83Å; Y716-F720 PolarHBondContact O-N 3.32Å; Y716-F720 VanDerWaalsContact O-N 3.07Å; S717-F720 PolarHBondContact O-N 3.21Å; F718-F720 VanDerWaalsContact C-N 3.29Å; F718-F720 PolarHBondContact O-N 3.18Å; F720-S723 PolarHBondContact O-N 2.78Å; F720-H724 PolarHBondContact O-N 2.94Å
721	C	88.6	Confident	80.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.5	-43.6	177.7	-67.7	0	0	0	0	112.3	H692 L693 S717 F718 S723 H724 V725 F744	H692-C721 WeakPolarHBondContact CB-SG 3.43Å; L693-C721 HydrophobicContact CD2-CB 4.11Å; S717-C721 PolarHBondContact O-N 3.45Å; S717-C721 VanDerWaalsContact O-N 3.1Å; S717-C721 PolarHBondContact O-SG 3.24Å; S717-C721 VanDerWaalsContact O-SG 3.4Å; F718-C721 PolarHBondContact O-N 3.32Å; C721-S723 PolarHBondContact O-N 3.27Å; C721-H724 WeakPolarHBondContact O-CB 3.48Å; C721-H724 PolarHBondContact O-N 2.86Å; C721-V725 WeakPolarHBondContact O-CG2 3.29Å; C721-V725 PolarHBondContact O-N 3.12Å; C721-F744 HydrophobicContact CB-CD2 3.7Å; C721-F744 HydrophobicContact CB-CE2 3.83Å
722	A	87.1	Confident	79.2	Confident	6 Å²	6	45.2 Å²	45.2	5%	0.05	27%	0.268	C	S	.	.	H	α-helix	trans	-62.1	-43.2	177.2	0	0	0	0	0	111.5	F718 H724 V725 H726 F744 I790	F718-A722 HydrophobicContact CE1-CB 4.35Å; F718-A722 WeakPolarHBondContact O-CB 3.4Å; F718-A722 PolarHBondContact O-N 2.87Å; A722-H724 VanDerWaalsContact C-N 3.26Å; A722-H724 PolarHBondContact O-N 3.17Å; A722-V725 PolarHBondContact O-N 3.29Å; A722-H726 VanDerWaalsContact O-CB 3.27Å; A722-H726 WeakPolarHBondContact O-CB 3.39Å; A722-H726 VanDerWaalsContact O-CG 3.27Å; A722-H726 PolarHBondContact O-N 2.5Å; A722-F744 HydrophobicContact CB-CE2 4.18Å; A722-F744 HydrophobicContact CB-CZ 3.8Å; A722-I790 HydrophobicContact CB-CD1 3.97Å; A722-I790 HydrophobicContact CB-CG1 4.43Å; A722-I790 WeakPolarHBondContact O-CD1 3.47Å
723	S	84.9	Confident	77.8	Confident	24 Å²	24	46.2 Å²	46.2	17%	0.168	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-37.8	176.8	167.2	0	0	0	0	111.5	A719 F720 C721 G727 N728	A719-S723 VanDerWaalsContact O-CB 3.29Å; A719-S723 WeakPolarHBondContact O-CB 3.37Å; A719-S723 PolarHBondContact O-N 3.15Å; F720-S723 PolarHBondContact O-N 2.78Å; C721-S723 PolarHBondContact O-N 3.27Å; S723-G727 PolarHBondContact O-N 2.94Å; S723-N728 PolarHBondContact O-N 3.34Å; S723-N728 VanDerWaalsContact O-N 3.08Å; S723-N728 PolarHBondContact OG-O 3.07Å
724	H	84.8	Confident	76.7	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.009	28%	0.282	C	S	.	.	H	α-helix	trans	-65.9	-54.9	174.3	-177.4	57.1	0	0	0	113	R687 C689 F720 C721 A722 H726 G727 R729 T735 V736 E740	R687-H724 PolarHBondContact NH2-CE1 3.34Å; R687-H724 PolarHBondContact NH2-NE2 3.36Å; C689-H724 HydrophobicContact CB-CB 4.35Å; C689-H724 WeakPolarHBondContact CB-CD2 3.47Å; C689-H724 PolarHBondContact SG-CD2 3.24Å; F720-H724 PolarHBondContact O-N 2.94Å; C721-H724 WeakPolarHBondContact O-CB 3.48Å; C721-H724 PolarHBondContact O-N 2.86Å; A722-H724 VanDerWaalsContact C-N 3.26Å; A722-H724 PolarHBondContact O-N 3.17Å; H724-H726 VanDerWaalsContact C-N 3.33Å; H724-H726 PolarHBondContact O-N 3.15Å; H724-G727 PolarHBondContact O-N 2.99Å; H724-R729 VanDerWaalsContact CE1-CZ 3.42Å; H724-R729 PolarHBondContact CE1-NH2 3.24Å; H724-R729 VanDerWaalsContact CE1-NH2 3.26Å; H724-R729 PolarHBondContact ND1-NE 3.36Å; H724-R729 PolarHBondContact ND1-NH1 2.84Å; H724-R729 PolarHBondContact ND1-NH2 3.26Å; H724-T735 PolarHBondContact CE1-O 3.25Å; H724-T735 PolarHBondContact NE2-O 2.93Å; H724-V736 VanDerWaalsContact O-CG2 3.27Å; H724-V736 WeakPolarHBondContact O-CG2 3.48Å; H724-E740 IonicContact NE2-OE1 3.72Å; H724-E740 IonicContact NE2-OE2 3.99Å
725	V	84.2	Confident	76.2	Confident	16 Å²	16	47.3 Å²	47.3	10%	0.097	28%	0.282	C	S	.	.	H	α-helix	trans	-68.2	-33.8	-173.5	175.2	0	0	0	0	111.8	C721 A722 V736 K741 F744	C721-V725 WeakPolarHBondContact O-CG2 3.29Å; C721-V725 PolarHBondContact O-N 3.12Å; A722-V725 PolarHBondContact O-N 3.29Å; V725-V736 HydrophobicContact CG2-CG1 4.4Å; V725-K741 HydrophobicContact CG1-CB 4.35Å; V725-K741 HydrophobicContact CG1-CD 4.4Å; V725-K741 HydrophobicContact CG1-CG 3.98Å; V725-F744 HydrophobicContact CB-CD1 4.15Å; V725-F744 HydrophobicContact CB-CE1 4.48Å; V725-F744 HydrophobicContact CG1-CD1 4.02Å; V725-F744 HydrophobicContact CG1-CE1 4.49Å; V725-F744 HydrophobicContact CG2-CB 3.97Å; V725-F744 HydrophobicContact CG2-CD1 4.05Å; V725-F744 HydrophobicContact CG2-CG 3.93Å
726	H	80.8	Confident	76.1	Confident	54 Å²	54	45.8 Å²	45.8	25%	0.25	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-2.9	179	-57.9	163	0	0	0	114	A722 H724 I790	A722-H726 VanDerWaalsContact O-CB 3.27Å; A722-H726 WeakPolarHBondContact O-CB 3.39Å; A722-H726 VanDerWaalsContact O-CG 3.27Å; A722-H726 PolarHBondContact O-N 2.5Å; H724-H726 VanDerWaalsContact C-N 3.33Å; H724-H726 PolarHBondContact O-N 3.15Å; H726-I790 HydrophobicContact CB-CD1 4.24Å
727	G	69.7	Low	75.9	Confident	59 Å²	59	39.9 Å²	39.9	61%	0.608	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.8	8.9	172.5	0	0	0	0	0	116.6	S723 H724 R729	S723-G727 PolarHBondContact O-N 2.94Å; H724-G727 PolarHBondContact O-N 2.99Å; G727-R729 PolarHBondContact O-N 3.27Å
728	N	63.2	Low	75.8	Confident	86 Å²	86	42 Å²	42	46%	0.46	27%	0.267	S	S	.	.			trans	-95.7	54.2	179.9	-76.4	-19.8	0	0	0	111.9	S723 I790	S723-N728 PolarHBondContact O-N 3.34Å; S723-N728 VanDerWaalsContact O-N 3.08Å; S723-N728 PolarHBondContact OG-O 3.07Å; N728-I790 HydrophobicContact CB-CG2 4.49Å
729	R	63.8	Low	75.5	Confident	51 Å²	51	46.9 Å²	46.9	19%	0.192	29%	0.289	C	S	.	.			trans	-84	130.9	177.7	-86.7	-173	166.6	179	-3.5	111.4	E308 H724 G727 D731	E308-R729 IonicContact OE1-NH1 3.63Å; H724-R729 VanDerWaalsContact CE1-CZ 3.42Å; H724-R729 PolarHBondContact CE1-NH2 3.24Å; H724-R729 VanDerWaalsContact CE1-NH2 3.26Å; H724-R729 PolarHBondContact ND1-NE 3.36Å; H724-R729 PolarHBondContact ND1-NH1 2.84Å; H724-R729 PolarHBondContact ND1-NH2 3.26Å; G727-R729 PolarHBondContact O-N 3.27Å; R729-D731 PolarHBondContact O-N 2.86Å
730	P	52.1	Low	75.6	Confident	117 Å²	117	46 Å²	46	76%	0.76	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-21.3	171.2	24.8	-30.7	0	0	0	113.1	G732	P730-G732 PolarHBondContact O-N 2.83Å
731	D	56.6	Low	75.5	Confident	136 Å²	136	47.3 Å²	47.3	73%	0.727	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	6.7	-174.1	-55.5	-33.9	0	0	0	114.8	R729 I733	R729-D731 PolarHBondContact O-N 2.86Å; D731-I733 PolarHBondContact O-N 3.45Å; D731-I733 VanDerWaalsContact O-N 3.16Å
732	G	53.7	Low	75.6	Confident	63 Å²	63	53.5 Å²	53.5	65%	0.649	32%	0.315	S	S	*	.	S	Bend	trans	81.5	-13.2	156.7	0	0	0	0	0	119.5	P730	P730-G732 PolarHBondContact O-N 2.83Å
733	I	55.8	Low	75.7	Confident	85 Å²	85	57.1 Å²	57.1	44%	0.436	33%	0.327	S	S	.	.			trans	-145.4	124.8	170.4	-53.6	176.2	0	0	0	108.2	M304 D731	M304-I733 HydrophobicContact CB-CG2 4.43Å; D731-I733 PolarHBondContact O-N 3.45Å; D731-I733 VanDerWaalsContact O-N 3.16Å
734	G	63.9	Low	76	Confident	28 Å²	28	56 Å²	56	29%	0.289	32%	0.319	S	S	.	.			trans	-145.3	107.8	-177.6	0	0	0	0	0	111.9
735	T	80.1	Confident	76.2	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.334	C	S	.	.			trans	-81.7	138.4	167.7	59.3	0	0	0	0	109.7	M301 M304 Y305 E308 R687 H724	M301-T735 HydrophobicContact CB-CG2 4.05Å; M301-T735 VanDerWaalsContact O-CG2 3.26Å; M301-T735 WeakPolarHBondContact O-CG2 3.4Å; M304-T735 HydrophobicContact CB-CG2 3.73Å; Y305-T735 VanDerWaalsContact N-CG2 3.35Å; E308-T735 PolarHBondContact OE2-N 3.37Å; E308-T735 PolarHBondContact OE2-OG1 3.01Å; R687-T735 PolarHBondContact NH1-OG1 3.47Å; R687-T735 PolarHBondContact NH2-O 2.92Å; H724-T735 PolarHBondContact CE1-O 3.25Å; H724-T735 PolarHBondContact NE2-O 2.93Å
736	V	84.8	Confident	76.6	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.024	36%	0.359	C	S	.	.			trans	-121.8	118.9	177.6	-175	0	0	0	0	108.9	F296 I297 H724 V725	F296-V736 WeakPolarHBondContact CD1-O 3.41Å; I297-V736 HydrophobicContact CD1-CB 3.78Å; I297-V736 HydrophobicContact CD1-CG1 3.53Å; I297-V736 HydrophobicContact CG1-CB 4.44Å; I297-V736 HydrophobicContact CG1-CG1 4.38Å; I297-V736 PolarHBondContact N-O 2.92Å; I297-V736 VanDerWaalsContact N-O 3.16Å; H724-V736 VanDerWaalsContact O-CG2 3.27Å; H724-V736 WeakPolarHBondContact O-CG2 3.48Å; V725-V736 HydrophobicContact CG2-CG1 4.4Å
737	S	85.3	Confident	77.1	Confident	11 Å²	11	62.8 Å²	62.8	8%	0.077	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-76.8	153.7	176.4	67.2	0	0	0	0	111.5	K295 E739 E740 K741	K295-S737 CarbonylContact O-C 3.31Å; K295-S737 VanDerWaalsContact O-CA 3.32Å; K295-S737 WeakPolarHBondContact O-CA 3.09Å; K295-S737 WeakPolarHBondContact O-CB 3.46Å; S737-E739 VanDerWaalsContact C-N 3.26Å; S737-E739 PolarHBondContact O-N 3Å; S737-E740 WeakPolarHBondContact CB-OE2 3.3Å; S737-E740 PolarHBondContact N-OE2 3.15Å; S737-E740 PolarHBondContact O-N 3.42Å; S737-E740 VanDerWaalsContact OG-CB 3.29Å; S737-E740 WeakPolarHBondContact OG-CB 3.11Å; S737-E740 WeakPolarHBondContact OG-CG 3.45Å; S737-E740 PolarHBondContact OG-N 3.35Å; S737-E740 VanDerWaalsContact OG-N 3.14Å; S737-E740 PolarHBondContact OG-OE2 3.35Å; S737-K741 PolarHBondContact O-N 3.06Å; S737-K741 VanDerWaalsContact O-N 3.17Å
738	V	86.3	Confident	78.1	Confident	45 Å²	45	61.6 Å²	61.6	27%	0.273	33%	0.328	S	S	.	.	H	α-helix	trans	-61.1	-40.2	175	177.4	0	0	0	0	110.3	K295 K741 E742	K295-V738 HydrophobicContact CB-CB 4.37Å; K295-V738 HydrophobicContact CB-CG2 4.11Å; K295-V738 PolarHBondContact O-N 2.99Å; V738-K741 PolarHBondContact O-N 3.47Å; V738-E742 HydrophobicContact CG1-CG 4.28Å; V738-E742 WeakPolarHBondContact O-CG 3.22Å; V738-E742 PolarHBondContact O-N 2.89Å
739	E	85.5	Confident	79.4	Confident	107 Å²	107	64.6 Å²	64.6	50%	0.5	34%	0.34	S	S	.	.	H	α-helix	trans	-64.1	-41.9	178.5	-176.6	175.1	-165.3	0	0	112.6	S737 K741 R743	S737-E739 VanDerWaalsContact C-N 3.26Å; S737-E739 PolarHBondContact O-N 3Å; E739-K741 VanDerWaalsContact C-N 3.31Å; E739-K741 PolarHBondContact O-N 2.87Å; E739-R743 WeakPolarHBondContact O-CB 3.16Å; E739-R743 VanDerWaalsContact O-CG 3.31Å; E739-R743 WeakPolarHBondContact O-CG 3.26Å; E739-R743 PolarHBondContact O-N 3.49Å; E739-R743 IonicContact OE1-CZ 3.28Å; E739-R743 VanDerWaalsContact OE1-CZ 3.28Å; E739-R743 IonicContact OE1-NE 2.78Å; E739-R743 IonicContact OE1-NH2 3.48Å; E739-R743 PolarHBondContact OE1-NH2 3.32Å
740	E	88.1	Confident	80.8	Confident	11 Å²	11	66.1 Å²	66.1	5%	0.051	35%	0.345	C	S	.	.	H	α-helix	trans	-63.2	-38.5	174.8	-76.9	163.6	142.2	0	0	111.7	R687 L693 H724 S737 F744	R687-E740 IonicContact CZ-OE1 3.65Å; R687-E740 IonicContact CZ-OE2 2.96Å; R687-E740 IonicContact NE-OE1 3.68Å; R687-E740 PolarHBondContact NE-OE1 3.2Å; R687-E740 IonicContact NE-OE2 3.64Å; R687-E740 IonicContact NH2-OE1 2.61Å; R687-E740 PolarHBondContact NH2-OE1 3.33Å; R687-E740 VanDerWaalsContact NH2-OE1 3.14Å; R687-E740 IonicContact NH2-OE2 3.48Å; R687-E740 PolarHBondContact NH2-OE2 3.21Å; L693-E740 HydrophobicContact CD1-CB 4.21Å; L693-E740 HydrophobicContact CD1-CG 4.29Å; H724-E740 IonicContact NE2-OE1 3.72Å; H724-E740 IonicContact NE2-OE2 3.99Å; S737-E740 WeakPolarHBondContact CB-OE2 3.3Å; S737-E740 PolarHBondContact N-OE2 3.15Å; S737-E740 PolarHBondContact O-N 3.42Å; S737-E740 VanDerWaalsContact OG-CB 3.29Å; S737-E740 WeakPolarHBondContact OG-CB 3.11Å; S737-E740 WeakPolarHBondContact OG-CG 3.45Å; S737-E740 PolarHBondContact OG-N 3.35Å; S737-E740 VanDerWaalsContact OG-N 3.14Å; S737-E740 PolarHBondContact OG-OE2 3.35Å; E740-F744 VanDerWaalsContact O-CB 3.26Å; E740-F744 WeakPolarHBondContact O-CB 3.2Å; E740-F744 PolarHBondContact O-N 2.96Å
741	K	86.8	Confident	82.7	Confident	89 Å²	89	60.5 Å²	60.5	39%	0.387	31%	0.309	S	S	.	.	H	α-helix	trans	-69.1	-47.4	177.7	-179.4	172.6	177.3	179.5	0	112.2	I297 V725 S737 V738 E739 R743 F744 E745	I297-K741 HydrophobicContact CD1-CB 4.25Å; I297-K741 HydrophobicContact CD1-CD 3.59Å; I297-K741 HydrophobicContact CD1-CG 4.49Å; I297-K741 HydrophobicContact CG1-CD 4.29Å; V725-K741 HydrophobicContact CG1-CB 4.35Å; V725-K741 HydrophobicContact CG1-CD 4.4Å; V725-K741 HydrophobicContact CG1-CG 3.98Å; S737-K741 PolarHBondContact O-N 3.06Å; S737-K741 VanDerWaalsContact O-N 3.17Å; V738-K741 PolarHBondContact O-N 3.47Å; E739-K741 VanDerWaalsContact C-N 3.31Å; E739-K741 PolarHBondContact O-N 2.87Å; K741-R743 PolarHBondContact O-N 3.5Å; K741-F744 PolarHBondContact O-N 3.06Å; K741-E745 PolarHBondContact O-N 3.22Å
742	E	89.9	Confident	84.4	Confident	130 Å²	130	55 Å²	55	61%	0.607	28%	0.281	S	S	*	.	H	α-helix	trans	-59.8	-46.5	178.3	-74.6	175.4	174.5	0	0	111.2	V738 F744 E745 E746	V738-E742 HydrophobicContact CG1-CG 4.28Å; V738-E742 WeakPolarHBondContact O-CG 3.22Å; V738-E742 PolarHBondContact O-N 2.89Å; E742-F744 VanDerWaalsContact C-N 3.31Å; E742-F744 PolarHBondContact O-N 3.13Å; E742-E745 PolarHBondContact O-N 3.49Å; E742-E746 PolarHBondContact O-N 3Å
743	R	89.6	Confident	86.2	Confident	82 Å²	82	55.8 Å²	55.8	31%	0.309	28%	0.277	S	S	.	.	H	α-helix	trans	-63.7	-35.5	175.4	-71.4	-178.2	-174.3	-179.2	3	112.8	H690 L693 E739 K741 I747	H690-R743 PolarHBondContact CE1-NH1 3.23Å; H690-R743 PolarHBondContact ND1-NH1 3.18Å; L693-R743 HydrophobicContact CD1-CB 4.45Å; E739-R743 WeakPolarHBondContact O-CB 3.16Å; E739-R743 VanDerWaalsContact O-CG 3.31Å; E739-R743 WeakPolarHBondContact O-CG 3.26Å; E739-R743 PolarHBondContact O-N 3.49Å; E739-R743 IonicContact OE1-CZ 3.28Å; E739-R743 VanDerWaalsContact OE1-CZ 3.28Å; E739-R743 IonicContact OE1-NE 2.78Å; E739-R743 IonicContact OE1-NH2 3.48Å; E739-R743 PolarHBondContact OE1-NH2 3.32Å; K741-R743 PolarHBondContact O-N 3.5Å; R743-I747 WeakPolarHBondContact O-CB 3.33Å; R743-I747 VanDerWaalsContact O-CG1 3.27Å; R743-I747 WeakPolarHBondContact O-CG1 3.41Å; R743-I747 PolarHBondContact O-N 2.89Å
744	F	91	Very high	87.8	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65.3	-44.2	176.4	173.7	-104.9	0	0	0	112	L693 F718 C721 A722 V725 E740 K741 E742 I747 K748	L693-F744 HydrophobicContact CD2-CB 3.91Å; L693-F744 HydrophobicContact CD2-CD2 4.1Å; F718-F744 HydrophobicContact CD2-CE2 4.05Å; F718-F744 AromaticContact CE2-CE2 3.62Å; F718-F744 HydrophobicContact CE2-CE2 3.62Å; F718-F744 AromaticContact CE2-CZ 3.84Å; F718-F744 HydrophobicContact CE2-CZ 3.84Å; F718-F744 HydrophobicContact CZ-CE2 4.08Å; F718-F744 AromaticContact CZ-CZ 3.86Å; F718-F744 HydrophobicContact CZ-CZ 3.86Å; C721-F744 HydrophobicContact CB-CD2 3.7Å; C721-F744 HydrophobicContact CB-CE2 3.83Å; A722-F744 HydrophobicContact CB-CE2 4.18Å; A722-F744 HydrophobicContact CB-CZ 3.8Å; V725-F744 HydrophobicContact CB-CD1 4.15Å; V725-F744 HydrophobicContact CB-CE1 4.48Å; V725-F744 HydrophobicContact CG1-CD1 4.02Å; V725-F744 HydrophobicContact CG1-CE1 4.49Å; V725-F744 HydrophobicContact CG2-CB 3.97Å; V725-F744 HydrophobicContact CG2-CD1 4.05Å; V725-F744 HydrophobicContact CG2-CG 3.93Å; E740-F744 VanDerWaalsContact O-CB 3.26Å; E740-F744 WeakPolarHBondContact O-CB 3.2Å; E740-F744 PolarHBondContact O-N 2.96Å; K741-F744 PolarHBondContact O-N 3.06Å; E742-F744 VanDerWaalsContact C-N 3.31Å; E742-F744 PolarHBondContact O-N 3.13Å; F744-I747 PolarHBondContact O-N 3.39Å; F744-K748 HydrophobicContact CE1-CD 4.42Å; F744-K748 VanDerWaalsContact O-CB 3.27Å; F744-K748 WeakPolarHBondContact O-CB 3.48Å; F744-K748 PolarHBondContact O-N 3.16Å
745	E	90.1	Very high	89.1	Confident	69 Å²	69	50.9 Å²	50.9	32%	0.322	25%	0.245	S	C	.	.	H	α-helix	trans	-65.1	-40.6	177.1	-65	-62.3	167	0	0	111.7	K741 E742 I747 K748 E749	K741-E745 PolarHBondContact O-N 3.22Å; E742-E745 PolarHBondContact O-N 3.49Å; E745-I747 PolarHBondContact O-N 3.47Å; E745-K748 WeakPolarHBondContact O-CB 3.1Å; E745-K748 PolarHBondContact O-N 3.18Å; E745-K748 WeakPolarHBondContact OE2-CD 3.32Å; E745-E749 PolarHBondContact O-N 2.96Å
746	E	91.3	Very high	89.6	Confident	131 Å²	131	53.4 Å²	53.4	61%	0.612	26%	0.257	S	S	*	.	H	α-helix	trans	-59.7	-46.6	173.5	-174.6	-174.6	174.2	0	0	111.7	E742 K748 E749 R750	E742-E746 PolarHBondContact O-N 3Å; E746-K748 VanDerWaalsContact C-N 3.32Å; E746-K748 PolarHBondContact O-N 3.4Å; E746-E749 PolarHBondContact O-N 2.99Å; E746-R750 WeakPolarHBondContact O-CB 3.44Å; E746-R750 PolarHBondContact O-N 2.91Å
747	I	92.3	Very high	89.9	Confident	15 Å²	15	57.3 Å²	57.3	8%	0.077	28%	0.277	C	S	.	.	H	α-helix	trans	-63.9	-38.4	176	-74.8	170	0	0	0	111.1	L693 L696 A697 M700 R743 F744 E745 R750 L751	L693-I747 HydrophobicContact CB-CD1 4.07Å; L693-I747 HydrophobicContact CD2-CD1 3.84Å; L693-I747 WeakPolarHBondContact O-CD1 3.15Å; L696-I747 HydrophobicContact CB-CG2 4.14Å; L696-I747 HydrophobicContact CD1-CG2 4.21Å; A697-I747 HydrophobicContact CB-CD1 4.3Å; M700-I747 HydrophobicContact CE-CB 4.14Å; M700-I747 HydrophobicContact CE-CG1 3.94Å; M700-I747 HydrophobicContact CE-CG2 3.71Å; M700-I747 HydrophobicContact SD-CG2 4.35Å; R743-I747 WeakPolarHBondContact O-CB 3.33Å; R743-I747 VanDerWaalsContact O-CG1 3.27Å; R743-I747 WeakPolarHBondContact O-CG1 3.41Å; R743-I747 PolarHBondContact O-N 2.89Å; F744-I747 PolarHBondContact O-N 3.39Å; E745-I747 PolarHBondContact O-N 3.47Å; I747-R750 PolarHBondContact O-N 3.45Å; I747-L751 WeakPolarHBondContact O-CB 3.27Å; I747-L751 PolarHBondContact O-N 3.19Å
748	K	90.7	Very high	90	Very high	33 Å²	33	57.6 Å²	57.6	14%	0.143	28%	0.278	C	S	.	.	H	α-helix	trans	-62.7	-47	179	-175.9	-173.8	-175.9	178	0	111.3	F718 F744 E745 E746 S752 V785 M787	F718-K748 HydrophobicContact CE2-CB 4.26Å; F718-K748 HydrophobicContact CE2-CG 4.18Å; F718-K748 HydrophobicContact CZ-CG 4.19Å; F744-K748 HydrophobicContact CE1-CD 4.42Å; F744-K748 VanDerWaalsContact O-CB 3.27Å; F744-K748 WeakPolarHBondContact O-CB 3.48Å; F744-K748 PolarHBondContact O-N 3.16Å; E745-K748 WeakPolarHBondContact O-CB 3.1Å; E745-K748 PolarHBondContact O-N 3.18Å; E745-K748 WeakPolarHBondContact OE2-CD 3.32Å; E746-K748 VanDerWaalsContact C-N 3.32Å; E746-K748 PolarHBondContact O-N 3.4Å; K748-S752 WeakPolarHBondContact O-CB 3.47Å; K748-S752 PolarHBondContact O-N 3.14Å; K748-V785 WeakPolarHBondContact CE-O 3.44Å; K748-V785 HydrophobicContact CG-CG1 4.02Å; K748-M787 PolarHBondContact NZ-O 3.5Å
749	E	90.6	Very high	90.2	Very high	149 Å²	149	55.5 Å²	55.5	70%	0.696	27%	0.265	S	S	*	.	H	α-helix	trans	-64.4	-46.6	176.9	-71.4	-171.9	168.3	0	0	111.7	E745 E746 L751 S752 S753	E745-E749 PolarHBondContact O-N 2.96Å; E746-E749 PolarHBondContact O-N 2.99Å; E749-L751 PolarHBondContact O-N 2.59Å; E749-S752 WeakPolarHBondContact O-CB 3.3Å; E749-S752 PolarHBondContact O-N 3.29Å; E749-S753 PolarHBondContact O-N 2.82Å
750	R	93.1	Very high	90.4	Very high	83 Å²	83	50.6 Å²	50.6	31%	0.313	24%	0.242	S	C	.	.	H	α-helix	trans	-61.9	-43	177.6	-172.3	174.5	169.6	-161.9	-1.4	111.8	M700 E704 E746 I747 S753 L754	M700-R750 HydrophobicContact CE-CG 4.45Å; M700-R750 HydrophobicContact SD-CG 4.41Å; E704-R750 IonicContact OE1-CZ 3.37Å; E704-R750 IonicContact OE1-NE 3.15Å; E704-R750 PolarHBondContact OE1-NE 3.36Å; E704-R750 IonicContact OE1-NH2 3.91Å; E704-R750 PolarHBondContact OE1-NH2 3.11Å; E704-R750 IonicContact OE2-CZ 3.14Å; E704-R750 IonicContact OE2-NE 2.72Å; E704-R750 PolarHBondContact OE2-NE 3.13Å; E704-R750 IonicContact OE2-NH2 2.79Å; E704-R750 PolarHBondContact OE2-NH2 2.91Å; E746-R750 WeakPolarHBondContact O-CB 3.44Å; E746-R750 PolarHBondContact O-N 2.91Å; I747-R750 PolarHBondContact O-N 3.45Å; R750-S753 PolarHBondContact O-N 3.41Å; R750-L754 WeakPolarHBondContact O-CB 3.39Å; R750-L754 PolarHBondContact O-N 3.33Å
751	L	92	Very high	90.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.7	-41.9	176.1	-176.4	58.9	0	0	0	111.3	M700 L714 F718 I747 E749 S753 L754 L755 L781 V785	M700-L751 HydrophobicContact CG-CD1 4.32Å; M700-L751 HydrophobicContact SD-CB 3.73Å; M700-L751 HydrophobicContact SD-CD1 4.05Å; M700-L751 HydrophobicContact SD-CG 4.44Å; L714-L751 HydrophobicContact CD1-CD1 4.46Å; F718-L751 HydrophobicContact CB-CD2 4.37Å; F718-L751 HydrophobicContact CD2-CD2 3.67Å; F718-L751 HydrophobicContact CE2-CD2 4.23Å; F718-L751 HydrophobicContact CG-CD2 4.11Å; I747-L751 WeakPolarHBondContact O-CB 3.27Å; I747-L751 PolarHBondContact O-N 3.19Å; E749-L751 PolarHBondContact O-N 2.59Å; L751-S753 VanDerWaalsContact C-N 3.34Å; L751-S753 PolarHBondContact O-N 3.31Å; L751-L754 HydrophobicContact CD1-CD2 4.44Å; L751-L754 PolarHBondContact O-N 2.89Å; L751-L755 HydrophobicContact CD1-CD1 4.25Å; L751-L755 HydrophobicContact CD1-CD2 4.34Å; L751-L755 HydrophobicContact CD1-CG 4.09Å; L751-L755 HydrophobicContact CG-CD1 3.97Å; L751-L755 HydrophobicContact CG-CG 4.27Å; L751-L755 WeakPolarHBondContact O-CG 3.29Å; L751-L755 PolarHBondContact O-N 3.45Å; L751-L781 HydrophobicContact CD2-CD2 4.42Å; L751-V785 HydrophobicContact CD2-CG2 3.68Å; L751-V785 HydrophobicContact CG-CG2 4.12Å
752	S	91.3	Very high	90.3	Very high	19 Å²	19	48.1 Å²	48.1	13%	0.133	23%	0.232	C	C	.	.	H	α-helix	trans	-57.5	-47.4	175.1	-166.9	0	0	0	0	111.3	K748 E749 L754 L755 E756	K748-S752 WeakPolarHBondContact O-CB 3.47Å; K748-S752 PolarHBondContact O-N 3.14Å; E749-S752 WeakPolarHBondContact O-CB 3.3Å; E749-S752 PolarHBondContact O-N 3.29Å; S752-L754 VanDerWaalsContact C-N 3.34Å; S752-L754 PolarHBondContact O-N 3.31Å; S752-L755 PolarHBondContact O-N 3.32Å; S752-E756 WeakPolarHBondContact O-CG 3.33Å; S752-E756 PolarHBondContact O-N 2.98Å
753	S	91.3	Very high	90	Very high	80 Å²	80	42.7 Å²	42.7	56%	0.559	21%	0.206	S	C	*	.	H	α-helix	trans	-62.4	-40	176.8	-175.2	0	0	0	0	112.3	E749 R750 L751 N757	E749-S753 PolarHBondContact O-N 2.82Å; R750-S753 PolarHBondContact O-N 3.41Å; L751-S753 VanDerWaalsContact C-N 3.34Å; L751-S753 PolarHBondContact O-N 3.31Å; S753-N757 WeakPolarHBondContact O-CB 3.36Å; S753-N757 PolarHBondContact O-N 3.42Å
754	L	90.4	Very high	89.7	Confident	11 Å²	11	41.8 Å²	41.8	6%	0.058	20%	0.203	C	C	.	.	H	α-helix	trans	-63.8	-45.5	177.1	-178.5	64.2	0	0	0	111.6	M700 E704 R750 L751 S752 N757 Q758	M700-L754 HydrophobicContact CB-CD2 4.18Å; M700-L754 HydrophobicContact CG-CD2 3.93Å; E704-L754 HydrophobicContact CG-CD1 3.87Å; R750-L754 WeakPolarHBondContact O-CB 3.39Å; R750-L754 PolarHBondContact O-N 3.33Å; L751-L754 HydrophobicContact CD1-CD2 4.44Å; L751-L754 PolarHBondContact O-N 2.89Å; S752-L754 VanDerWaalsContact C-N 3.34Å; S752-L754 PolarHBondContact O-N 3.31Å; L754-N757 WeakPolarHBondContact O-CB 3.42Å; L754-N757 PolarHBondContact O-N 3.21Å; L754-Q758 WeakPolarHBondContact O-CG 3.43Å; L754-Q758 PolarHBondContact O-N 2.9Å
755	L	91	Very high	89.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-66.4	-43.2	179.5	-63.9	170.8	0	0	0	111.5	L751 S752 N757 Q758 I759 T778 L781 L782 V785	L751-L755 HydrophobicContact CD1-CD1 4.25Å; L751-L755 HydrophobicContact CD1-CD2 4.34Å; L751-L755 HydrophobicContact CD1-CG 4.09Å; L751-L755 HydrophobicContact CG-CD1 3.97Å; L751-L755 HydrophobicContact CG-CG 4.27Å; L751-L755 WeakPolarHBondContact O-CG 3.29Å; L751-L755 PolarHBondContact O-N 3.45Å; S752-L755 PolarHBondContact O-N 3.32Å; L755-N757 PolarHBondContact O-N 2.86Å; L755-Q758 PolarHBondContact O-N 3.08Å; L755-I759 WeakPolarHBondContact O-CD1 3.46Å; L755-I759 VanDerWaalsContact O-CG1 3.25Å; L755-I759 WeakPolarHBondContact O-CG1 3.33Å; L755-I759 PolarHBondContact O-N 3.44Å; L755-T778 HydrophobicContact CD2-CG2 3.7Å; L755-L781 HydrophobicContact CD1-CB 4.41Å; L755-L781 HydrophobicContact CD1-CD2 4.26Å; L755-L781 HydrophobicContact CD1-CG 3.88Å; L755-L781 HydrophobicContact CD2-CD2 4.03Å; L755-L781 HydrophobicContact CD2-CG 4.39Å; L755-L782 HydrophobicContact CB-CD1 4.28Å; L755-L782 HydrophobicContact CD1-CB 4.28Å; L755-L782 HydrophobicContact CD1-CD1 4.42Å; L755-V785 HydrophobicContact CD1-CG2 4.03Å
756	E	90.7	Very high	88.9	Confident	53 Å²	53	41 Å²	41	25%	0.248	20%	0.203	C	C	.	.	H	α-helix	trans	-58.1	-39.6	173.4	-76.8	-173.7	-147	0	0	111.7	S752 S760 V802	S752-E756 WeakPolarHBondContact O-CG 3.33Å; S752-E756 PolarHBondContact O-N 2.98Å; E756-S760 WeakPolarHBondContact O-CB 3.3Å; E756-S760 PolarHBondContact O-N 3.16Å; E756-S760 PolarHBondContact O-OG 3.05Å; E756-V802 HydrophobicContact CG-CG1 4.08Å
757	N	90.3	Very high	88.4	Confident	85 Å²	85	34.9 Å²	34.9	46%	0.455	18%	0.175	S	C	.	.	H	α-helix	trans	-67.9	-43.5	176.9	-169.7	26.2	0	0	0	112	S753 L754 L755 I759 S760 H761	S753-N757 WeakPolarHBondContact O-CB 3.36Å; S753-N757 PolarHBondContact O-N 3.42Å; L754-N757 WeakPolarHBondContact O-CB 3.42Å; L754-N757 PolarHBondContact O-N 3.21Å; L755-N757 PolarHBondContact O-N 2.86Å; N757-I759 PolarHBondContact O-N 3.22Å; N757-S760 PolarHBondContact O-N 3.15Å; N757-H761 WeakPolarHBondContact O-CB 3.49Å; N757-H761 PolarHBondContact O-N 3.13Å; N757-H761 PolarHBondContact O-ND1 3.3Å; N757-H761 VanDerWaalsContact O-ND1 3.07Å; N757-H761 PolarHBondContact OD1-CE1 3.42Å; N757-H761 PolarHBondContact OD1-ND1 2.87Å
758	Q	88.4	Confident	87.6	Confident	18 Å²	18	34.4 Å²	34.4	8%	0.084	17%	0.173	C	C	.	.	H	α-helix	trans	-62.7	-39.6	176.6	-73.7	178.6	-0.8	0	0	112.3	S703 L754 L755 H761 F762 C765 F766 T778	S703-Q758 PolarHBondContact OG-NE2 3.48Å; L754-Q758 WeakPolarHBondContact O-CG 3.43Å; L754-Q758 PolarHBondContact O-N 2.9Å; L755-Q758 PolarHBondContact O-N 3.08Å; Q758-H761 CarbonylContact O-C 3.33Å; Q758-H761 VanDerWaalsContact O-C 3.31Å; Q758-H761 PolarHBondContact O-N 2.9Å; Q758-F762 VanDerWaalsContact O-CA 3.31Å; Q758-F762 WeakPolarHBondContact O-CA 3.41Å; Q758-F762 PolarHBondContact O-N 3.33Å; Q758-F762 VanDerWaalsContact O-N 3.07Å; Q758-C765 HydrophobicContact CB-CB 4.41Å; Q758-C765 HydrophobicContact CG-CB 4.49Å; Q758-F766 HydrophobicContact CB-CE2 4.24Å; Q758-F766 HydrophobicContact CB-CZ 4.46Å; Q758-T778 HydrophobicContact CB-CG2 4.47Å
759	I	88.9	Confident	86.8	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-71.2	-41.1	176.6	-63.2	161.4	0	0	0	110.5	L755 N757 H761 F762 T778 L779 L782 C806	L755-I759 WeakPolarHBondContact O-CD1 3.46Å; L755-I759 VanDerWaalsContact O-CG1 3.25Å; L755-I759 WeakPolarHBondContact O-CG1 3.33Å; L755-I759 PolarHBondContact O-N 3.44Å; N757-I759 PolarHBondContact O-N 3.22Å; I759-H761 PolarHBondContact O-N 3.01Å; I759-F762 WeakPolarHBondContact O-CB 3.35Å; I759-F762 WeakPolarHBondContact O-CD1 3.48Å; I759-F762 PolarHBondContact O-N 2.64Å; I759-T778 HydrophobicContact CD1-CG2 4.4Å; I759-T778 HydrophobicContact CG1-CG2 4.03Å; I759-L779 HydrophobicContact CD1-CD2 3.79Å; I759-L779 HydrophobicContact CG1-CD2 4.17Å; I759-L782 HydrophobicContact CD1-CD2 3.58Å; I759-C806 HydrophobicContact CB-CB 4.12Å; I759-C806 HydrophobicContact CG2-CB 3.62Å
760	S	89.6	Confident	86.2	Confident	5 Å²	5	26.6 Å²	26.6	4%	0.035	14%	0.139	C	C	.	.	H	α-helix	trans	-64.4	-27.2	176.6	-54	0	0	0	0	112.4	E756 N757 A810	E756-S760 WeakPolarHBondContact O-CB 3.3Å; E756-S760 PolarHBondContact O-N 3.16Å; E756-S760 PolarHBondContact O-OG 3.05Å; N757-S760 PolarHBondContact O-N 3.15Å; S760-A810 WeakPolarHBondContact O-CA 3.36Å; S760-A810 WeakPolarHBondContact O-CB 3.4Å
761	H	88	Confident	85.2	Confident	46 Å²	46	23.3 Å²	23.3	21%	0.213	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	31.7	177.4	-64.1	92.2	0	0	0	112.8	N757 Q758 I759 R763 Y764 C765	N757-H761 WeakPolarHBondContact O-CB 3.49Å; N757-H761 PolarHBondContact O-N 3.13Å; N757-H761 PolarHBondContact O-ND1 3.3Å; N757-H761 VanDerWaalsContact O-ND1 3.07Å; N757-H761 PolarHBondContact OD1-CE1 3.42Å; N757-H761 PolarHBondContact OD1-ND1 2.87Å; Q758-H761 CarbonylContact O-C 3.33Å; Q758-H761 VanDerWaalsContact O-C 3.31Å; Q758-H761 PolarHBondContact O-N 2.9Å; I759-H761 PolarHBondContact O-N 3.01Å; H761-R763 PolarHBondContact O-N 3.46Å; H761-Y764 PolarHBondContact O-N 3.03Å; H761-C765 PolarHBondContact O-N 2.99Å
762	F	86.8	Confident	84.3	Confident	1 Å²	1	30 Å²	30	0%	0.004	16%	0.16	C	C	.	.	H	α-helix	trans	-54.5	-35.7	-170	71.4	-89.6	0	0	0	113.9	Q758 I759 Y764 F766 L775 L807 A810 H858	Q758-F762 VanDerWaalsContact O-CA 3.31Å; Q758-F762 WeakPolarHBondContact O-CA 3.41Å; Q758-F762 PolarHBondContact O-N 3.33Å; Q758-F762 VanDerWaalsContact O-N 3.07Å; I759-F762 WeakPolarHBondContact O-CB 3.35Å; I759-F762 WeakPolarHBondContact O-CD1 3.48Å; I759-F762 PolarHBondContact O-N 2.64Å; F762-Y764 PolarHBondContact O-N 3.36Å; F762-F766 HydrophobicContact CB-CD2 4.43Å; F762-F766 CarbonylContact O-C 3.6Å; F762-F766 WeakPolarHBondContact O-CA 3.49Å; F762-F766 WeakPolarHBondContact O-CB 3.39Å; F762-F766 PolarHBondContact O-N 3.46Å; F762-L775 HydrophobicContact CB-CD1 4.14Å; F762-L775 HydrophobicContact CB-CD2 4.4Å; F762-L807 HydrophobicContact CE1-CD2 4.29Å; F762-A810 HydrophobicContact CD1-CB 4.15Å; F762-A810 HydrophobicContact CE1-CB 3.91Å; F762-H858 AromaticContact CD2-CD2 3.7Å; F762-H858 AromaticContact CD2-CE1 3.92Å; F762-H858 AromaticContact CD2-CG 3.9Å; F762-H858 AromaticContact CD2-NE2 3.7Å; F762-H858 HydrophobicContact CE2-CB 4.46Å; F762-H858 AromaticContact CE2-CD2 3.44Å; F762-H858 VanDerWaalsContact CE2-CD2 3.44Å; F762-H858 WeakPolarHBondContact CE2-CD2 3.35Å; F762-H858 AromaticContact CE2-CG 3.89Å; F762-H858 AromaticContact CE2-NE2 3.81Å
763	R	83.5	Confident	83.5	Confident	17 Å²	17	30.8 Å²	30.8	6%	0.064	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-24.3	175.9	-72.9	179.9	69.1	107.7	-7.9	114.1	R158 H761 P767 N814 V850 Q853 N854	R158-R763 WeakPolarHBondContact CD-O 3.43Å; H761-R763 PolarHBondContact O-N 3.46Å; R763-P767 WeakPolarHBondContact O-CA 3.5Å; R763-N814 WeakPolarHBondContact CD-OD1 3.37Å; R763-V850 PolarHBondContact NH1-O 3.03Å; R763-Q853 VanDerWaalsContact NH2-OE1 3.16Å; R763-N854 WeakPolarHBondContact CD-OD1 3.36Å; R763-N854 WeakPolarHBondContact CG-OD1 3.45Å; R763-N854 PolarHBondContact NH1-OD1 3.05Å
764	Y	81.6	Confident	83	Confident	62 Å²	62	27.1 Å²	27.1	24%	0.243	15%	0.146	C	C	.	.	H	α-helix	trans	-103.9	-37.1	-177.5	-67.3	-82	0	0	0	112.5	R158 H761 F762 R817	R158-Y764 HydrophobicContact CG-CD1 3.78Å; R158-Y764 HydrophobicContact CG-CE1 3.66Å; H761-Y764 PolarHBondContact O-N 3.03Å; F762-Y764 PolarHBondContact O-N 3.36Å; Y764-R817 VanDerWaalsContact CE1-NH1 3.25Å; Y764-R817 WeakPolarHBondContact OH-CD 3.4Å; Y764-R817 PolarHBondContact OH-NH1 2.89Å
765	C	81.8	Confident	82.7	Confident	44 Å²	44	27 Å²	27	30%	0.297	15%	0.145	S	C	.	.	H	α-helix	trans	-74.1	-29.5	174.9	-65.6	0	0	0	0	112	Q758 H761	Q758-C765 HydrophobicContact CB-CB 4.41Å; Q758-C765 HydrophobicContact CG-CB 4.49Å; H761-C765 PolarHBondContact O-N 2.99Å
766	F	82.7	Confident	82.4	Confident	8 Å²	8	30.3 Å²	30.3	4%	0.035	16%	0.159	C	C	.	.	S	Bend	trans	-132.3	63.2	179.6	-49.8	-71.8	0	0	0	111.3	P711 Q758 F762 F768 G769 R770 A774 L775 T778 H858	P711-F766 HydrophobicContact CG-CE1 4.25Å; Q758-F766 HydrophobicContact CB-CE2 4.24Å; Q758-F766 HydrophobicContact CB-CZ 4.46Å; F762-F766 HydrophobicContact CB-CD2 4.43Å; F762-F766 CarbonylContact O-C 3.6Å; F762-F766 WeakPolarHBondContact O-CA 3.49Å; F762-F766 WeakPolarHBondContact O-CB 3.39Å; F762-F766 PolarHBondContact O-N 3.46Å; F766-F768 PolarHBondContact O-N 3.45Å; F766-G769 PolarHBondContact O-N 3.4Å; F766-G769 VanDerWaalsContact O-N 3.17Å; F766-R770 CarbonylContact C-O 3.58Å; F766-R770 VanDerWaalsContact CA-O 3.29Å; F766-R770 WeakPolarHBondContact CA-O 3.5Å; F766-A774 HydrophobicContact CD1-CB 3.7Å; F766-A774 HydrophobicContact CE1-CB 3.65Å; F766-L775 HydrophobicContact CD2-CB 4.02Å; F766-L775 HydrophobicContact CD2-CD1 3.71Å; F766-L775 HydrophobicContact CD2-CG 4.36Å; F766-L775 HydrophobicContact CE2-CB 4.38Å; F766-L775 HydrophobicContact CE2-CD1 3.74Å; F766-L775 HydrophobicContact CG-CB 4.16Å; F766-T778 HydrophobicContact CZ-CG2 4.38Å; F766-T778 WeakPolarHBondContact CZ-OG1 3.17Å; F766-H858 PolarHBondContact O-CE1 3.34Å; F766-H858 VanDerWaalsContact O-CE1 3.27Å
767	P	81.1	Confident	82.1	Confident	4 Å²	4	28.7 Å²	28.7	3%	0.026	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-62.3	130.2	-174.7	29.4	-35.4	0	0	0	110.8	R158 M162 R763 G769 R770	R158-P767 HydrophobicContact CB-CB 3.97Å; M162-P767 HydrophobicContact CB-CG 3.99Å; M162-P767 HydrophobicContact CE-CG 4.32Å; M162-P767 HydrophobicContact CG-CG 4.09Å; M162-P767 HydrophobicContact SD-CG 3.5Å; M162-P767 WeakPolarHBondContact SD-CG 3.4Å; R763-P767 WeakPolarHBondContact O-CA 3.5Å; P767-G769 PolarHBondContact O-N 2.89Å; P767-G769 VanDerWaalsContact O-N 3.16Å; P767-R770 PolarHBondContact O-N 2.85Å; P767-R770 VanDerWaalsContact O-N 3.11Å
768	F	76.7	Confident	82	Confident	5 Å²	5	24.6 Å²	24.6	2%	0.022	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	55	29.5	-178.4	-52	-88.5	0	0	0	113.9	F153 V159 V176 F766 R770 H857	F153-F768 HydrophobicContact CB-CZ 4.42Å; F153-F768 HydrophobicContact CD2-CD1 4.03Å; F153-F768 AromaticContact CD2-CD2 3.44Å; F153-F768 HydrophobicContact CD2-CD2 3.44Å; F153-F768 VanDerWaalsContact CD2-CD2 3.44Å; F153-F768 HydrophobicContact CD2-CE1 4.02Å; F153-F768 AromaticContact CD2-CE2 3.44Å; F153-F768 HydrophobicContact CD2-CE2 3.44Å; F153-F768 VanDerWaalsContact CD2-CE2 3.44Å; F153-F768 AromaticContact CD2-CG 3.76Å; F153-F768 HydrophobicContact CD2-CG 3.76Å; F153-F768 AromaticContact CD2-CZ 3.73Å; F153-F768 HydrophobicContact CD2-CZ 3.73Å; F153-F768 HydrophobicContact CE2-CB 4.34Å; F153-F768 AromaticContact CE2-CD2 3.48Å; F153-F768 HydrophobicContact CE2-CD2 3.48Å; F153-F768 VanDerWaalsContact CE2-CD2 3.48Å; F153-F768 AromaticContact CE2-CE2 3.88Å; F153-F768 HydrophobicContact CE2-CE2 3.88Å; F153-F768 AromaticContact CE2-CG 3.9Å; F153-F768 HydrophobicContact CE2-CG 3.9Å; F153-F768 HydrophobicContact CG-CE2 4.5Å; V159-F768 HydrophobicContact CG2-CD2 4.13Å; V159-F768 HydrophobicContact CG2-CE2 3.64Å; V176-F768 HydrophobicContact CG2-CB 4.33Å; F766-F768 PolarHBondContact O-N 3.45Å; F768-R770 VanDerWaalsContact C-N 3.34Å; F768-R770 PolarHBondContact O-N 2.77Å; F768-H857 AromaticContact CD1-CD2 3.77Å; F768-H857 AromaticContact CD1-NE2 3.54Å
769	G	73.7	Confident	81.9	Confident	10 Å²	10	24.3 Å²	24.3	10%	0.103	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	75.1	19	179.4	0	0	0	0	0	114.4	F766 P767 P771	F766-G769 PolarHBondContact O-N 3.4Å; F766-G769 VanDerWaalsContact O-N 3.17Å; P767-G769 PolarHBondContact O-N 2.89Å; P767-G769 VanDerWaalsContact O-N 3.16Å; G769-P771 CarbonylContact O-C 3.59Å
770	R	76.9	Confident	81.8	Confident	7 Å²	7	26.4 Å²	26.4	3%	0.026	15%	0.147	C	C	.	.			trans	-107.4	141.8	-178.8	-61.2	-64.7	176.7	-168.4	-8.8	112.4	M162 V176 F766 P767 F768 E772	M162-R770 HydrophobicContact SD-CB 4.31Å; V176-R770 HydrophobicContact CG2-CG 4.1Å; F766-R770 CarbonylContact C-O 3.58Å; F766-R770 VanDerWaalsContact CA-O 3.29Å; F766-R770 WeakPolarHBondContact CA-O 3.5Å; P767-R770 PolarHBondContact O-N 2.85Å; P767-R770 VanDerWaalsContact O-N 3.11Å; F768-R770 VanDerWaalsContact C-N 3.34Å; F768-R770 PolarHBondContact O-N 2.77Å; R770-E772 IonicContact CZ-OE2 3.12Å; R770-E772 IonicContact NH1-OE2 3.3Å; R770-E772 PolarHBondContact NH1-OE2 2.79Å
771	P	73.1	Confident	81.7	Confident	15 Å²	15	26.1 Å²	26.1	10%	0.097	15%	0.145	C	C	.	.	S	Bend	cis	-63.8	151.7	-5.9	-19.9	32.6	0	0	0	113.1	L666 V708 G769 G773 A774	L666-P771 HydrophobicContact CD1-CB 4.13Å; L666-P771 HydrophobicContact CD1-CG 4.01Å; L666-P771 HydrophobicContact CD2-CG 4.14Å; V708-P771 HydrophobicContact CG1-CG 3.93Å; G769-P771 CarbonylContact O-C 3.59Å; P771-G773 PolarHBondContact O-N 3.09Å; P771-A774 HydrophobicContact CB-CB 4.22Å; P771-A774 WeakPolarHBondContact O-CB 3.36Å; P771-A774 PolarHBondContact O-N 3.01Å; P771-A774 VanDerWaalsContact O-N 3.07Å
772	E	72.7	Confident	81.7	Confident	139 Å²	139	24 Å²	24	65%	0.65	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	130.8	-173.6	-164.7	171.1	145.9	0	0	112.1	R770 A774	R770-E772 IonicContact CZ-OE2 3.12Å; R770-E772 IonicContact NH1-OE2 3.3Å; R770-E772 PolarHBondContact NH1-OE2 2.79Å; E772-A774 PolarHBondContact O-N 3.24Å; E772-A774 VanDerWaalsContact O-N 3.14Å
773	G	75.1	Confident	81.7	Confident	36 Å²	36	27.7 Å²	27.7	37%	0.371	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	0.4	-179.5	0	0	0	0	0	114.9	P771 K776 A777	P771-G773 PolarHBondContact O-N 3.09Å; G773-K776 WeakPolarHBondContact O-CB 3.43Å; G773-K776 PolarHBondContact O-N 3.09Å; G773-A777 PolarHBondContact O-N 3.07Å
774	A	81.1	Confident	81.8	Confident	3 Å²	3	32 Å²	32	3%	0.025	17%	0.169	C	C	.	.	H	α-helix	trans	-61.3	-48	-178.4	0	0	0	0	0	111.8	P711 F766 P771 E772 K776 A777 T778	P711-A774 HydrophobicContact CG-CB 3.93Å; F766-A774 HydrophobicContact CD1-CB 3.7Å; F766-A774 HydrophobicContact CE1-CB 3.65Å; P771-A774 HydrophobicContact CB-CB 4.22Å; P771-A774 WeakPolarHBondContact O-CB 3.36Å; P771-A774 PolarHBondContact O-N 3.01Å; P771-A774 VanDerWaalsContact O-N 3.07Å; E772-A774 PolarHBondContact O-N 3.24Å; E772-A774 VanDerWaalsContact O-N 3.14Å; A774-K776 VanDerWaalsContact C-N 3.27Å; A774-K776 PolarHBondContact O-N 2.99Å; A774-A777 CarbonylContact O-C 3.5Å; A774-A777 WeakPolarHBondContact O-CB 3.33Å; A774-A777 PolarHBondContact O-N 3.13Å; A774-A777 VanDerWaalsContact O-N 3.1Å; A774-T778 PolarHBondContact O-N 3.49Å; A774-T778 PolarHBondContact O-OG1 2.79Å; A774-T778 VanDerWaalsContact O-OG1 3.08Å
775	L	84.1	Confident	82	Confident	9 Å²	9	29.2 Å²	29.2	5%	0.047	16%	0.158	C	C	.	.	H	α-helix	trans	-60	-37.2	177.8	-179	61.1	0	0	0	112.3	F762 F766 T778 L779 H858 A864 F865	F762-L775 HydrophobicContact CB-CD1 4.14Å; F762-L775 HydrophobicContact CB-CD2 4.4Å; F766-L775 HydrophobicContact CD2-CB 4.02Å; F766-L775 HydrophobicContact CD2-CD1 3.71Å; F766-L775 HydrophobicContact CD2-CG 4.36Å; F766-L775 HydrophobicContact CE2-CB 4.38Å; F766-L775 HydrophobicContact CE2-CD1 3.74Å; F766-L775 HydrophobicContact CG-CB 4.16Å; L775-T778 WeakPolarHBondContact O-CB 3.35Å; L775-T778 PolarHBondContact O-N 2.72Å; L775-L779 WeakPolarHBondContact O-CG 3.07Å; L775-L779 PolarHBondContact O-N 3.3Å; L775-H858 HydrophobicContact CD2-CB 4.48Å; L775-A864 HydrophobicContact CB-CB 3.87Å; L775-A864 HydrophobicContact CD2-CB 3.75Å; L775-A864 HydrophobicContact CG-CB 3.49Å; L775-A864 VanDerWaalsContact CG-CB 3.49Å; L775-F865 HydrophobicContact CD2-CD2 4.26Å; L775-F865 HydrophobicContact CD2-CE2 3.75Å
776	K	84.1	Confident	82.2	Confident	69 Å²	69	29.2 Å²	29.2	30%	0.3	16%	0.155	S	C	.	.	H	α-helix	trans	-66.5	-43.2	175.9	-177.1	-178.2	-179.5	176.3	0	111.2	G773 A774 T778 L779 S780 A864 W867	G773-K776 WeakPolarHBondContact O-CB 3.43Å; G773-K776 PolarHBondContact O-N 3.09Å; A774-K776 VanDerWaalsContact C-N 3.27Å; A774-K776 PolarHBondContact O-N 2.99Å; K776-T778 VanDerWaalsContact C-N 3.32Å; K776-L779 PolarHBondContact O-N 3.13Å; K776-S780 PolarHBondContact O-N 3.16Å; K776-A864 HydrophobicContact CB-CB 3.94Å; K776-W867 HydrophobicContact CD-CH2 4.45Å; K776-W867 VanDerWaalsContact CE-CZ2 3.48Å
777	A	83.9	Confident	82.1	Confident	19 Å²	19	30.4 Å²	30.4	16%	0.157	16%	0.161	C	C	.	.	H	α-helix	trans	-64.1	-36.8	174.2	0	0	0	0	0	111.7	P711 G773 A774 S780 L781	P711-A777 HydrophobicContact CB-CB 3.93Å; G773-A777 PolarHBondContact O-N 3.07Å; A774-A777 CarbonylContact O-C 3.5Å; A774-A777 WeakPolarHBondContact O-CB 3.33Å; A774-A777 PolarHBondContact O-N 3.13Å; A774-A777 VanDerWaalsContact O-N 3.1Å; A777-S780 PolarHBondContact O-N 3.49Å; A777-L781 VanDerWaalsContact O-CB 3.27Å; A777-L781 WeakPolarHBondContact O-CB 3.39Å; A777-L781 PolarHBondContact O-N 3.11Å
778	T	87.9	Confident	81.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.9	-45	172.8	-62.1	0	0	0	0	111.7	P711 L755 Q758 I759 F766 A774 L775 K776 L781 L782	P711-T778 WeakPolarHBondContact CB-OG1 3.5Å; P711-T778 VanDerWaalsContact CG-OG1 3.29Å; P711-T778 WeakPolarHBondContact CG-OG1 3.37Å; L755-T778 HydrophobicContact CD2-CG2 3.7Å; Q758-T778 HydrophobicContact CB-CG2 4.47Å; I759-T778 HydrophobicContact CD1-CG2 4.4Å; I759-T778 HydrophobicContact CG1-CG2 4.03Å; F766-T778 HydrophobicContact CZ-CG2 4.38Å; F766-T778 WeakPolarHBondContact CZ-OG1 3.17Å; A774-T778 PolarHBondContact O-N 3.49Å; A774-T778 PolarHBondContact O-OG1 2.79Å; A774-T778 VanDerWaalsContact O-OG1 3.08Å; L775-T778 WeakPolarHBondContact O-CB 3.35Å; L775-T778 PolarHBondContact O-N 2.72Å; K776-T778 VanDerWaalsContact C-N 3.32Å; T778-L781 PolarHBondContact O-N 3.3Å; T778-L782 PolarHBondContact O-N 3.12Å
779	L	86.9	Confident	81.1	Confident	12 Å²	12	41.9 Å²	41.9	6%	0.063	21%	0.213	C	C	.	.	H	α-helix	trans	-64.3	-42.8	175.6	-69.2	177.7	0	0	0	112.1	I759 L775 K776 L781 L782 E783 V803 A864 F865	I759-L779 HydrophobicContact CD1-CD2 3.79Å; I759-L779 HydrophobicContact CG1-CD2 4.17Å; L775-L779 WeakPolarHBondContact O-CG 3.07Å; L775-L779 PolarHBondContact O-N 3.3Å; K776-L779 PolarHBondContact O-N 3.13Å; L779-L781 VanDerWaalsContact C-N 3.32Å; L779-L781 PolarHBondContact O-N 3.47Å; L779-L782 WeakPolarHBondContact O-CB 3.29Å; L779-L782 PolarHBondContact O-N 3.03Å; L779-E783 PolarHBondContact O-N 2.86Å; L779-V803 HydrophobicContact CD2-CG1 4.44Å; L779-V803 HydrophobicContact CD2-CG2 3.94Å; L779-A864 HydrophobicContact CD1-CB 3.85Å; L779-A864 WeakPolarHBondContact CD1-O 3.48Å; L779-F865 HydrophobicContact CD1-CD1 4.21Å; L779-F865 HydrophobicContact CD1-CE1 3.97Å; L779-F865 HydrophobicContact CD1-CZ 4.44Å
780	S	86.2	Confident	80.8	Confident	43 Å²	43	44.5 Å²	44.5	30%	0.301	22%	0.224	S	C	.	.	H	α-helix	trans	-66.1	-34.8	176.5	-176	0	0	0	0	112.4	K776 A777 R784	K776-S780 PolarHBondContact O-N 3.16Å; A777-S780 PolarHBondContact O-N 3.49Å; S780-R784 PolarHBondContact O-N 3.09Å
781	L	88.3	Confident	80	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.9	-41.4	172.6	-178.2	53.5	0	0	0	111.8	L714 H715 F718 L751 L755 A777 T778 L779 E783 R784 V785	L714-L781 HydrophobicContact CB-CD2 3.65Å; H715-L781 HydrophobicContact CB-CB 4.35Å; H715-L781 HydrophobicContact CB-CD1 3.94Å; H715-L781 HydrophobicContact CB-CD2 4.32Å; H715-L781 HydrophobicContact CB-CG 4.43Å; F718-L781 HydrophobicContact CB-CD1 4.15Å; F718-L781 HydrophobicContact CD1-CD1 4.11Å; F718-L781 HydrophobicContact CG-CD1 4.27Å; L751-L781 HydrophobicContact CD2-CD2 4.42Å; L755-L781 HydrophobicContact CD1-CB 4.41Å; L755-L781 HydrophobicContact CD1-CD2 4.26Å; L755-L781 HydrophobicContact CD1-CG 3.88Å; L755-L781 HydrophobicContact CD2-CD2 4.03Å; L755-L781 HydrophobicContact CD2-CG 4.39Å; A777-L781 VanDerWaalsContact O-CB 3.27Å; A777-L781 WeakPolarHBondContact O-CB 3.39Å; A777-L781 PolarHBondContact O-N 3.11Å; T778-L781 PolarHBondContact O-N 3.3Å; L779-L781 VanDerWaalsContact C-N 3.32Å; L779-L781 PolarHBondContact O-N 3.47Å; L781-E783 VanDerWaalsContact C-N 3.32Å; L781-E783 PolarHBondContact O-N 3.02Å; L781-R784 PolarHBondContact O-N 3.12Å; L781-R784 VanDerWaalsContact O-N 3.15Å; L781-V785 HydrophobicContact CD1-CG2 4.04Å; L781-V785 HydrophobicContact CG-CG2 4.28Å; L781-V785 VanDerWaalsContact O-CG2 3.31Å; L781-V785 WeakPolarHBondContact O-CG2 3.5Å; L781-V785 PolarHBondContact O-N 3.09Å
782	L	88.6	Confident	79.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-58.3	-45.8	174.9	179.4	66.3	0	0	0	111	L755 I759 T778 L779 R784 V785 L786 V802 V803	L755-L782 HydrophobicContact CB-CD1 4.28Å; L755-L782 HydrophobicContact CD1-CB 4.28Å; L755-L782 HydrophobicContact CD1-CD1 4.42Å; I759-L782 HydrophobicContact CD1-CD2 3.58Å; T778-L782 PolarHBondContact O-N 3.12Å; L779-L782 WeakPolarHBondContact O-CB 3.29Å; L779-L782 PolarHBondContact O-N 3.03Å; L782-R784 VanDerWaalsContact C-N 3.29Å; L782-R784 PolarHBondContact O-N 3.08Å; L782-V785 PolarHBondContact O-N 3.44Å; L782-L786 HydrophobicContact CD1-CD1 4.11Å; L782-L786 HydrophobicContact CD1-CG 4.15Å; L782-L786 HydrophobicContact CG-CD1 3.95Å; L782-L786 HydrophobicContact CG-CG 4.39Å; L782-L786 VanDerWaalsContact O-CG 3.28Å; L782-L786 WeakPolarHBondContact O-CG 3.13Å; L782-L786 PolarHBondContact O-N 3.17Å; L782-V802 HydrophobicContact CD2-CG1 4.15Å; L782-V803 HydrophobicContact CD2-CG2 4.06Å
783	E	86	Confident	79.6	Confident	80 Å²	80	49 Å²	49	37%	0.374	27%	0.271	S	S	.	.	H	α-helix	trans	-53.3	-47	174.9	178.4	179.2	-175.7	0	0	111.4	L779 L781 L786 M787 I794 V799	L779-E783 PolarHBondContact O-N 2.86Å; L781-E783 VanDerWaalsContact C-N 3.32Å; L781-E783 PolarHBondContact O-N 3.02Å; E783-L786 PolarHBondContact O-N 2.81Å; E783-M787 WeakPolarHBondContact O-CG 3.31Å; E783-M787 PolarHBondContact O-N 2.82Å; E783-I794 HydrophobicContact CG-CG2 3.98Å; E783-V799 HydrophobicContact CB-CG1 4.46Å; E783-V799 HydrophobicContact CB-CG2 4.29Å; E783-V799 HydrophobicContact CG-CG2 4.15Å
784	R	84.7	Confident	79.6	Confident	108 Å²	108	48.3 Å²	48.3	41%	0.408	26%	0.259	S	S	.	.	H	α-helix	trans	-68.9	-36.8	178.2	-73.1	-161.3	179.7	167.8	2.2	114.5	H715 F718 S780 L781 L782 L786 M787	H715-R784 PolarHBondContact CE1-NH1 2.9Å; H715-R784 WeakPolarHBondContact NE2-CD 3.45Å; H715-R784 VanDerWaalsContact NE2-CZ 3.26Å; H715-R784 PolarHBondContact NE2-NE 3.3Å; H715-R784 PolarHBondContact NE2-NH1 3.07Å; H715-R784 VanDerWaalsContact NE2-NH1 3.12Å; F718-R784 HydrophobicContact CE1-CB 4.49Å; S780-R784 PolarHBondContact O-N 3.09Å; L781-R784 PolarHBondContact O-N 3.12Å; L781-R784 VanDerWaalsContact O-N 3.15Å; L782-R784 VanDerWaalsContact C-N 3.29Å; L782-R784 PolarHBondContact O-N 3.08Å; R784-L786 VanDerWaalsContact C-N 3.28Å; R784-L786 PolarHBondContact O-N 3.33Å; R784-M787 HydrophobicContact CG-SD 4.33Å; R784-M787 WeakPolarHBondContact O-CB 3.36Å; R784-M787 PolarHBondContact O-N 3.33Å
785	V	87.2	Confident	79.5	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.018	28%	0.281	C	S	.	.	H	α-helix	trans	-66.2	-34.7	177.8	170.8	0	0	0	0	110.7	F718 K748 L751 L755 L781 L782 M787	F718-V785 HydrophobicContact CD1-CG2 4.13Å; F718-V785 HydrophobicContact CD2-CG2 4.32Å; F718-V785 HydrophobicContact CE1-CB 4.42Å; F718-V785 HydrophobicContact CE1-CG2 3.79Å; F718-V785 HydrophobicContact CE2-CG2 3.99Å; F718-V785 HydrophobicContact CG-CG2 4.39Å; F718-V785 HydrophobicContact CZ-CB 4.22Å; F718-V785 HydrophobicContact CZ-CG2 3.72Å; K748-V785 WeakPolarHBondContact CE-O 3.44Å; K748-V785 HydrophobicContact CG-CG1 4.02Å; L751-V785 HydrophobicContact CD2-CG2 3.68Å; L751-V785 HydrophobicContact CG-CG2 4.12Å; L755-V785 HydrophobicContact CD1-CG2 4.03Å; L781-V785 HydrophobicContact CD1-CG2 4.04Å; L781-V785 HydrophobicContact CG-CG2 4.28Å; L781-V785 VanDerWaalsContact O-CG2 3.31Å; L781-V785 WeakPolarHBondContact O-CG2 3.5Å; L781-V785 PolarHBondContact O-N 3.09Å; L782-V785 PolarHBondContact O-N 3.44Å; V785-M787 VanDerWaalsContact C-N 3.26Å; V785-M787 PolarHBondContact O-N 2.94Å
786	L	84.8	Confident	79.2	Confident	44 Å²	44	53.9 Å²	53.9	23%	0.23	30%	0.3	C	S	.	.	H	α-helix	trans	-74.3	-14.2	177.6	-66	172.9	0	0	0	113.5	L782 E783 R784 I794 V799 V802	L782-L786 HydrophobicContact CD1-CD1 4.11Å; L782-L786 HydrophobicContact CD1-CG 4.15Å; L782-L786 HydrophobicContact CG-CD1 3.95Å; L782-L786 HydrophobicContact CG-CG 4.39Å; L782-L786 VanDerWaalsContact O-CG 3.28Å; L782-L786 WeakPolarHBondContact O-CG 3.13Å; L782-L786 PolarHBondContact O-N 3.17Å; E783-L786 PolarHBondContact O-N 2.81Å; R784-L786 VanDerWaalsContact C-N 3.28Å; R784-L786 PolarHBondContact O-N 3.33Å; L786-I794 HydrophobicContact CB-CD1 3.57Å; L786-V799 HydrophobicContact CD1-CG2 4.27Å; L786-V802 HydrophobicContact CD1-CB 4.45Å; L786-V802 HydrophobicContact CD1-CG2 4.08Å
787	M	81.6	Confident	79.1	Confident	32 Å²	32	55.9 Å²	55.9	16%	0.158	31%	0.31	C	S	.	.			trans	-64	137.8	176.5	-63.6	177	72.2	0	0	111.4	K748 E783 R784 V785 D789 T792 I794	K748-M787 PolarHBondContact NZ-O 3.5Å; E783-M787 WeakPolarHBondContact O-CG 3.31Å; E783-M787 PolarHBondContact O-N 2.82Å; R784-M787 HydrophobicContact CG-SD 4.33Å; R784-M787 WeakPolarHBondContact O-CB 3.36Å; R784-M787 PolarHBondContact O-N 3.33Å; V785-M787 VanDerWaalsContact C-N 3.26Å; V785-M787 PolarHBondContact O-N 2.94Å; M787-D789 WeakPolarHBondContact CE-O 3.49Å; M787-T792 WeakPolarHBondContact CE-O 3.47Å; M787-I794 HydrophobicContact CG-CB 4.47Å; M787-I794 HydrophobicContact CG-CG2 4.4Å
788	K	71.6	Confident	79.1	Confident	190 Å²	190	60.2 Å²	60.2	83%	0.826	33%	0.327	S	S	*	.	S	Bend	trans	-78	-37.4	174.6	-70.8	-175.2	179.4	175.9	0	112.1
789	D	65.8	Low	78.9	Confident	60 Å²	60	60.4 Å²	60.4	32%	0.321	33%	0.328	S	S	.	.	S	Bend	trans	-143.6	169.2	173.6	62.9	48.9	0	0	0	109.6	M787 A791 T792	M787-D789 WeakPolarHBondContact CE-O 3.49Å; D789-A791 VanDerWaalsContact C-N 3.3Å; D789-A791 PolarHBondContact O-N 2.92Å; D789-A791 PolarHBondContact OD1-N 3.39Å; D789-T792 WeakPolarHBondContact OD1-CA 3.43Å; D789-T792 WeakPolarHBondContact OD1-CB 3.15Å; D789-T792 PolarHBondContact OD1-N 3.27Å; D789-T792 PolarHBondContact OD1-OG1 3.18Å; D789-T792 PolarHBondContact OD2-OG1 3.23Å
790	I	66.3	Low	78.8	Confident	66 Å²	66	61.9 Å²	61.9	34%	0.338	33%	0.334	S	S	.	.	S	Bend	trans	-75.1	-19.6	-179.1	-77.6	164.8	0	0	0	112.9	A722 H726 N728	A722-I790 HydrophobicContact CB-CD1 3.97Å; A722-I790 HydrophobicContact CB-CG1 4.43Å; A722-I790 WeakPolarHBondContact O-CD1 3.47Å; H726-I790 HydrophobicContact CB-CD1 4.24Å; N728-I790 HydrophobicContact CB-CG2 4.49Å
791	A	59.5	Low	78.8	Confident	76 Å²	76	67.1 Å²	67.1	63%	0.628	35%	0.352	S	S	*	.	S	Bend	trans	-88.9	-23.9	-172.3	0	0	0	0	0	113	D789 P793	D789-A791 VanDerWaalsContact C-N 3.3Å; D789-A791 PolarHBondContact O-N 2.92Å; D789-A791 PolarHBondContact OD1-N 3.39Å; A791-P793 WeakPolarHBondContact O-CD 3.38Å
792	T	68.7	Low	78.9	Confident	84 Å²	84	68.7 Å²	68.7	52%	0.515	36%	0.361	S	S	.	.	S	Bend	trans	-109.3	97	-173.9	-46.5	0	0	0	0	109	M787 D789 I794	M787-T792 WeakPolarHBondContact CE-O 3.47Å; D789-T792 WeakPolarHBondContact OD1-CA 3.43Å; D789-T792 WeakPolarHBondContact OD1-CB 3.15Å; D789-T792 PolarHBondContact OD1-N 3.27Å; D789-T792 PolarHBondContact OD1-OG1 3.18Å; D789-T792 PolarHBondContact OD2-OG1 3.23Å; T792-I794 PolarHBondContact O-N 3.45Å
793	P	68.9	Low	78.8	Confident	94 Å²	94	68.7 Å²	68.7	61%	0.61	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-59.8	136.4	175	25.9	-32.5	0	0	0	109.7	A791	A791-P793 WeakPolarHBondContact O-CD 3.38Å
794	I	75.3	Confident	79	Confident	22 Å²	22	69.1 Å²	69.1	11%	0.113	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-68	140.8	175.6	-167.3	168.5	0	0	0	109.3	E783 L786 M787 T792 A796 E798 V799	E783-I794 HydrophobicContact CG-CG2 3.98Å; L786-I794 HydrophobicContact CB-CD1 3.57Å; M787-I794 HydrophobicContact CG-CB 4.47Å; M787-I794 HydrophobicContact CG-CG2 4.4Å; T792-I794 PolarHBondContact O-N 3.45Å; I794-A796 PolarHBondContact O-N 2.8Å; I794-E798 HydrophobicContact CD1-CB 3.9Å; I794-E798 WeakPolarHBondContact CD1-OE2 3.49Å; I794-E798 HydrophobicContact CG1-CB 3.94Å; I794-E798 WeakPolarHBondContact CG1-OE2 3.26Å; I794-V799 HydrophobicContact CD1-CG2 4.4Å; I794-V799 HydrophobicContact CG2-CG2 3.48Å; I794-V799 VanDerWaalsContact CG2-CG2 3.48Å
795	P	78.8	Confident	79.2	Confident	75 Å²	75	69.3 Å²	69.3	49%	0.487	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-58.7	134.6	173.2	-23.2	33.7	0	0	0	110.7	E797 E798	P795-E797 PolarHBondContact O-N 2.68Å; P795-E798 HydrophobicContact CB-CG 4.47Å; P795-E798 PolarHBondContact O-N 2.8Å
796	A	78	Confident	79.4	Confident	55 Å²	55	69.2 Å²	69.2	46%	0.455	36%	0.363	S	S	.	.	H	α-helix	trans	-54.6	-29.3	-179.7	0	0	0	0	0	113	I794 E798 V799 K800	I794-A796 PolarHBondContact O-N 2.8Å; A796-E798 PolarHBondContact O-N 3.17Å; A796-V799 PolarHBondContact O-N 3.18Å; A796-K800 WeakPolarHBondContact O-CB 3.26Å; A796-K800 VanDerWaalsContact O-CG 3.29Å; A796-K800 WeakPolarHBondContact O-CG 3.48Å; A796-K800 PolarHBondContact O-N 3.12Å
797	E	81.6	Confident	79.6	Confident	111 Å²	111	67.2 Å²	67.2	52%	0.519	35%	0.352	S	S	.	.	H	α-helix	trans	-66.5	-30.9	177.2	-68.2	-54.4	130.3	0	0	114	P795 K800 K801	P795-E797 PolarHBondContact O-N 2.68Å; E797-K800 WeakPolarHBondContact OE1-CD 3.43Å; E797-K800 IonicContact OE1-NZ 3.23Å; E797-K800 PolarHBondContact OE1-NZ 2.87Å; E797-K801 WeakPolarHBondContact O-CB 3.28Å; E797-K801 PolarHBondContact O-N 3.47Å
798	E	83.7	Confident	79.9	Confident	110 Å²	110	69.4 Å²	69.4	51%	0.514	36%	0.362	S	S	.	.	H	α-helix	trans	-71.7	-40.8	176.6	-65.9	-171.6	-178.2	0	0	111.1	I794 P795 A796 K801 V802	I794-E798 HydrophobicContact CD1-CB 3.9Å; I794-E798 WeakPolarHBondContact CD1-OE2 3.49Å; I794-E798 HydrophobicContact CG1-CB 3.94Å; I794-E798 WeakPolarHBondContact CG1-OE2 3.26Å; P795-E798 HydrophobicContact CB-CG 4.47Å; P795-E798 PolarHBondContact O-N 2.8Å; A796-E798 PolarHBondContact O-N 3.17Å; E798-K801 WeakPolarHBondContact O-CB 3.42Å; E798-K801 PolarHBondContact O-N 3.36Å; E798-V802 PolarHBondContact O-N 3.03Å
799	V	84.3	Confident	80.8	Confident	3 Å²	3	64.8 Å²	64.8	2%	0.018	34%	0.342	C	S	.	.	H	α-helix	trans	-64.5	-46.7	174.2	-176.5	0	0	0	0	110.3	E783 L786 I794 A796 K801 V802 V803 W868	E783-V799 HydrophobicContact CB-CG1 4.46Å; E783-V799 HydrophobicContact CB-CG2 4.29Å; E783-V799 HydrophobicContact CG-CG2 4.15Å; L786-V799 HydrophobicContact CD1-CG2 4.27Å; I794-V799 HydrophobicContact CD1-CG2 4.4Å; I794-V799 HydrophobicContact CG2-CG2 3.48Å; I794-V799 VanDerWaalsContact CG2-CG2 3.48Å; A796-V799 PolarHBondContact O-N 3.18Å; V799-K801 PolarHBondContact O-N 3.1Å; V799-V802 PolarHBondContact O-N 2.79Å; V799-V802 VanDerWaalsContact O-N 3.13Å; V799-V803 HydrophobicContact CG1-CG2 4.29Å; V799-V803 WeakPolarHBondContact O-CG2 3.49Å; V799-V803 PolarHBondContact O-N 3.11Å; V799-W868 HydrophobicContact CG1-CH2 3.99Å
800	K	84.7	Confident	81.9	Confident	44 Å²	44	62 Å²	62	19%	0.191	33%	0.327	C	S	.	.	H	α-helix	trans	-55.9	-39	174.5	-75.9	178.8	-175.9	176.3	0	112.1	A796 E797 V802 V803 R804 W868 L871	A796-K800 WeakPolarHBondContact O-CB 3.26Å; A796-K800 VanDerWaalsContact O-CG 3.29Å; A796-K800 WeakPolarHBondContact O-CG 3.48Å; A796-K800 PolarHBondContact O-N 3.12Å; E797-K800 WeakPolarHBondContact OE1-CD 3.43Å; E797-K800 IonicContact OE1-NZ 3.23Å; E797-K800 PolarHBondContact OE1-NZ 2.87Å; K800-V802 PolarHBondContact O-N 3.3Å; K800-V803 PolarHBondContact O-N 3.3Å; K800-R804 VanDerWaalsContact O-CB 3.24Å; K800-R804 WeakPolarHBondContact O-CB 3.45Å; K800-R804 PolarHBondContact O-N 3.47Å; K800-W868 HydrophobicContact CG-CD2 4.12Å; K800-W868 HydrophobicContact CG-CG 4.48Å; K800-W868 HydrophobicContact CG-CZ2 4.1Å; K800-L871 HydrophobicContact CB-CD1 4.4Å; K800-L871 HydrophobicContact CG-CD1 4.24Å
801	K	87.7	Confident	83	Confident	153 Å²	153	58.9 Å²	58.9	67%	0.665	31%	0.311	S	S	*	.	H	α-helix	trans	-62.6	-41.4	177.9	-174.6	-179.1	179	-178.7	0	112.4	E797 E798 V799 K805	E797-K801 WeakPolarHBondContact O-CB 3.28Å; E797-K801 PolarHBondContact O-N 3.47Å; E798-K801 WeakPolarHBondContact O-CB 3.42Å; E798-K801 PolarHBondContact O-N 3.36Å; V799-K801 PolarHBondContact O-N 3.1Å; K801-K805 PolarHBondContact O-N 3.07Å
802	V	88.4	Confident	84.4	Confident	33 Å²	33	59.7 Å²	59.7	20%	0.2	30%	0.304	C	S	.	.	H	α-helix	trans	-68	-47.7	176	179	0	0	0	0	110.2	E756 L782 L786 E798 V799 K800 R804 K805 C806	E756-V802 HydrophobicContact CG-CG1 4.08Å; L782-V802 HydrophobicContact CD2-CG1 4.15Å; L786-V802 HydrophobicContact CD1-CB 4.45Å; L786-V802 HydrophobicContact CD1-CG2 4.08Å; E798-V802 PolarHBondContact O-N 3.03Å; V799-V802 PolarHBondContact O-N 2.79Å; V799-V802 VanDerWaalsContact O-N 3.13Å; K800-V802 PolarHBondContact O-N 3.3Å; V802-R804 VanDerWaalsContact C-N 3.35Å; V802-R804 PolarHBondContact O-N 3.28Å; V802-K805 WeakPolarHBondContact O-CB 3.24Å; V802-K805 PolarHBondContact O-N 2.98Å; V802-K805 VanDerWaalsContact O-N 3.14Å; V802-C806 PolarHBondContact O-N 3.15Å; V802-C806 PolarHBondContact O-SG 3.24Å
803	V	87.9	Confident	85.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-42.6	179.1	176	0	0	0	0	111.5	L779 L782 V799 K800 K805 C806 L807 F865 W868 L871	L779-V803 HydrophobicContact CD2-CG1 4.44Å; L779-V803 HydrophobicContact CD2-CG2 3.94Å; L782-V803 HydrophobicContact CD2-CG2 4.06Å; V799-V803 HydrophobicContact CG1-CG2 4.29Å; V799-V803 WeakPolarHBondContact O-CG2 3.49Å; V799-V803 PolarHBondContact O-N 3.11Å; K800-V803 PolarHBondContact O-N 3.3Å; V803-K805 VanDerWaalsContact C-N 3.34Å; V803-K805 PolarHBondContact O-N 3.44Å; V803-C806 WeakPolarHBondContact O-CB 3.39Å; V803-C806 PolarHBondContact O-N 3.38Å; V803-C806 VanDerWaalsContact O-N 3.13Å; V803-L807 HydrophobicContact CG1-CD1 3.98Å; V803-L807 HydrophobicContact CG1-CG 4.26Å; V803-L807 WeakPolarHBondContact O-CG 3.27Å; V803-L807 PolarHBondContact O-N 2.94Å; V803-F865 HydrophobicContact CG1-CE1 4Å; V803-W868 HydrophobicContact CG2-CZ3 4.22Å; V803-L871 HydrophobicContact CB-CD1 4.35Å; V803-L871 HydrophobicContact CG1-CD1 3.98Å
804	R	88.9	Confident	86.1	Confident	88 Å²	88	53.4 Å²	53.4	33%	0.332	26%	0.262	S	S	.	.	H	α-helix	trans	-53.4	-49.7	173.1	178.7	-175.5	-73.2	140.5	-3.2	111.2	K800 V802 C806 L807 E808 L871 E874	K800-R804 VanDerWaalsContact O-CB 3.24Å; K800-R804 WeakPolarHBondContact O-CB 3.45Å; K800-R804 PolarHBondContact O-N 3.47Å; V802-R804 VanDerWaalsContact C-N 3.35Å; V802-R804 PolarHBondContact O-N 3.28Å; R804-C806 VanDerWaalsContact C-N 3.31Å; R804-C806 PolarHBondContact O-N 3.06Å; R804-L807 PolarHBondContact O-N 3.39Å; R804-E808 WeakPolarHBondContact O-CG 3.42Å; R804-E808 PolarHBondContact O-N 3.22Å; R804-L871 HydrophobicContact CB-CD2 4.01Å; R804-E874 WeakPolarHBondContact CD-OE2 3.43Å; R804-E874 WeakPolarHBondContact CG-OE2 3.28Å; R804-E874 IonicContact CZ-OE1 2.74Å; R804-E874 IonicContact CZ-OE2 2.71Å; R804-E874 IonicContact NE-OE1 2.61Å; R804-E874 PolarHBondContact NE-OE1 3.06Å; R804-E874 IonicContact NE-OE2 3.58Å; R804-E874 PolarHBondContact NE-OE2 3.4Å; R804-E874 IonicContact NH2-OE1 3.07Å; R804-E874 PolarHBondContact NH2-OE1 3.45Å; R804-E874 IonicContact NH2-OE2 2.95Å
805	K	89.9	Confident	86.7	Confident	112 Å²	112	53 Å²	53	49%	0.487	26%	0.259	S	S	.	.	H	α-helix	trans	-62.2	-37.8	178.5	-171.8	-175.6	179.6	-171.5	0	112.2	K801 V802 V803 K809	K801-K805 PolarHBondContact O-N 3.07Å; V802-K805 WeakPolarHBondContact O-CB 3.24Å; V802-K805 PolarHBondContact O-N 2.98Å; V802-K805 VanDerWaalsContact O-N 3.14Å; V803-K805 VanDerWaalsContact C-N 3.34Å; V803-K805 PolarHBondContact O-N 3.44Å; K805-K809 WeakPolarHBondContact O-CG 3.41Å; K805-K809 PolarHBondContact O-N 3Å
806	C	90.5	Very high	87.1	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.007	25%	0.251	C	S	.	.	H	α-helix	trans	-66.6	-41.5	174.3	-66.1	0	0	0	0	111.8	I759 V802 V803 R804 K809 A810	I759-C806 HydrophobicContact CB-CB 4.12Å; I759-C806 HydrophobicContact CG2-CB 3.62Å; V802-C806 PolarHBondContact O-N 3.15Å; V802-C806 PolarHBondContact O-SG 3.24Å; V803-C806 WeakPolarHBondContact O-CB 3.39Å; V803-C806 PolarHBondContact O-N 3.38Å; V803-C806 VanDerWaalsContact O-N 3.13Å; R804-C806 VanDerWaalsContact C-N 3.31Å; R804-C806 PolarHBondContact O-N 3.06Å; C806-K809 PolarHBondContact O-N 2.99Å; C806-A810 WeakPolarHBondContact O-CB 3.32Å; C806-A810 PolarHBondContact O-N 3.49Å
807	L	88.9	Confident	87.3	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-69.2	-34.7	178.1	-72.2	176.5	0	0	0	112.8	F762 V803 R804 A810 A811 F865 L871 H875	F762-L807 HydrophobicContact CE1-CD2 4.29Å; V803-L807 HydrophobicContact CG1-CD1 3.98Å; V803-L807 HydrophobicContact CG1-CG 4.26Å; V803-L807 WeakPolarHBondContact O-CG 3.27Å; V803-L807 PolarHBondContact O-N 2.94Å; R804-L807 PolarHBondContact O-N 3.39Å; L807-A810 WeakPolarHBondContact O-CB 3.45Å; L807-A810 PolarHBondContact O-N 2.92Å; L807-A811 PolarHBondContact O-N 3.48Å; L807-F865 HydrophobicContact CD1-CE1 4.13Å; L807-F865 HydrophobicContact CD2-CE1 4.29Å; L807-F865 HydrophobicContact CD2-CE2 4.47Å; L807-F865 HydrophobicContact CD2-CZ 3.86Å; L807-L871 HydrophobicContact CD1-CB 3.83Å; L807-H875 HydrophobicContact CB-CB 4.23Å; L807-H875 PolarHBondContact O-ND1 3.29Å
808	E	89.1	Confident	87.5	Confident	79 Å²	79	48.4 Å²	48.4	37%	0.369	22%	0.223	S	C	.	.	H	α-helix	trans	-61.2	-45.5	170.9	-74.2	-177.9	146.3	0	0	111.2	R804 A810 A811 L812 K878	R804-E808 WeakPolarHBondContact O-CG 3.42Å; R804-E808 PolarHBondContact O-N 3.22Å; E808-A810 VanDerWaalsContact C-N 3.32Å; E808-A810 PolarHBondContact O-N 2.99Å; E808-A811 PolarHBondContact O-N 3.13Å; E808-L812 PolarHBondContact O-N 3.23Å; E808-K878 HydrophobicContact CG-CG 4.36Å; E808-K878 VanDerWaalsContact OE1-CE 3.26Å; E808-K878 WeakPolarHBondContact OE1-CE 3.42Å; E808-K878 IonicContact OE1-NZ 3.54Å; E808-K878 PolarHBondContact OE1-NZ 3.35Å
809	K	89.8	Confident	87.4	Confident	93 Å²	93	43.6 Å²	43.6	40%	0.404	20%	0.201	S	C	.	.	H	α-helix	trans	-63	-40.2	172.9	-71	175.8	178.6	-179.7	0	111.7	K805 C806 A811 L812 I813	K805-K809 WeakPolarHBondContact O-CG 3.41Å; K805-K809 PolarHBondContact O-N 3Å; C806-K809 PolarHBondContact O-N 2.99Å; K809-A811 VanDerWaalsContact C-N 3.32Å; K809-A811 PolarHBondContact O-N 2.98Å; K809-L812 PolarHBondContact O-N 2.88Å; K809-I813 WeakPolarHBondContact O-CD1 3.32Å; K809-I813 VanDerWaalsContact O-CG1 3.29Å; K809-I813 WeakPolarHBondContact O-CG1 3.41Å; K809-I813 PolarHBondContact O-N 3.17Å
810	A	89.1	Confident	87.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.7	-39.1	178	0	0	0	0	0	111.8	S760 F762 C806 L807 E808 L812 I813 N814	S760-A810 WeakPolarHBondContact O-CA 3.36Å; S760-A810 WeakPolarHBondContact O-CB 3.4Å; F762-A810 HydrophobicContact CD1-CB 4.15Å; F762-A810 HydrophobicContact CE1-CB 3.91Å; C806-A810 WeakPolarHBondContact O-CB 3.32Å; C806-A810 PolarHBondContact O-N 3.49Å; L807-A810 WeakPolarHBondContact O-CB 3.45Å; L807-A810 PolarHBondContact O-N 2.92Å; E808-A810 VanDerWaalsContact C-N 3.32Å; E808-A810 PolarHBondContact O-N 2.99Å; A810-L812 VanDerWaalsContact C-N 3.34Å; A810-L812 PolarHBondContact O-N 3.49Å; A810-I813 PolarHBondContact O-N 3.46Å; A810-N814 VanDerWaalsContact O-CB 3.23Å; A810-N814 WeakPolarHBondContact O-CB 3.32Å; A810-N814 PolarHBondContact O-N 3.01Å; A810-N814 PolarHBondContact O-ND2 3.01Å
811	A	88.6	Confident	86.8	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-60.2	-46.7	177	0	0	0	0	0	110.6	L807 E808 K809 N814 Y815 H875 K878 F879	L807-A811 PolarHBondContact O-N 3.48Å; E808-A811 PolarHBondContact O-N 3.13Å; K809-A811 VanDerWaalsContact C-N 3.32Å; K809-A811 PolarHBondContact O-N 2.98Å; A811-N814 PolarHBondContact O-N 3.45Å; A811-Y815 WeakPolarHBondContact O-CB 3.42Å; A811-Y815 PolarHBondContact O-N 3.39Å; A811-H875 VanDerWaalsContact CA-CE1 3.42Å; A811-H875 WeakPolarHBondContact CA-CE1 3.35Å; A811-H875 PolarHBondContact N-CE1 3.32Å; A811-H875 VanDerWaalsContact N-CE1 3.27Å; A811-K878 HydrophobicContact CB-CB 4.08Å; A811-F879 HydrophobicContact CB-CB 4.27Å
812	L	89.1	Confident	86	Confident	93 Å²	93	49.2 Å²	49.2	49%	0.487	23%	0.227	S	C	.	.	H	α-helix	trans	-60.9	-50.4	175.9	-177.9	64.9	0	0	0	112.2	E808 K809 A810 N814 Y815 T816 L882	E808-L812 PolarHBondContact O-N 3.23Å; K809-L812 PolarHBondContact O-N 2.88Å; A810-L812 VanDerWaalsContact C-N 3.34Å; A810-L812 PolarHBondContact O-N 3.49Å; L812-N814 VanDerWaalsContact C-N 3.32Å; L812-N814 PolarHBondContact O-N 2.99Å; L812-Y815 PolarHBondContact O-N 3.03Å; L812-T816 WeakPolarHBondContact O-CB 3.48Å; L812-T816 PolarHBondContact O-N 3.05Å; L812-T816 PolarHBondContact O-OG1 3.35Å; L812-L882 HydrophobicContact CB-CD1 4.35Å; L812-L882 HydrophobicContact CD1-CD1 3.99Å; L812-L882 HydrophobicContact CD1-CD2 4.23Å
813	I	87.9	Confident	85	Confident	38 Å²	38	54.5 Å²	54.5	20%	0.195	25%	0.247	C	C	.	.	H	α-helix	trans	-61.1	-42.8	-179.4	-67.1	159.2	0	0	0	111.2	K809 A810 R817	K809-I813 WeakPolarHBondContact O-CD1 3.32Å; K809-I813 VanDerWaalsContact O-CG1 3.29Å; K809-I813 WeakPolarHBondContact O-CG1 3.41Å; K809-I813 PolarHBondContact O-N 3.17Å; A810-I813 PolarHBondContact O-N 3.46Å; I813-R817 WeakPolarHBondContact O-CB 3.35Å; I813-R817 WeakPolarHBondContact O-CG 3.47Å; I813-R817 PolarHBondContact O-N 3.33Å; I813-R817 VanDerWaalsContact O-N 3.15Å
814	N	86.6	Confident	83.8	Confident	8 Å²	8	54.8 Å²	54.8	4%	0.043	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-43.7	179.5	-69.6	-19.3	0	0	0	111	R763 A810 A811 L812 L818 F879	R763-N814 WeakPolarHBondContact CD-OD1 3.37Å; A810-N814 VanDerWaalsContact O-CB 3.23Å; A810-N814 WeakPolarHBondContact O-CB 3.32Å; A810-N814 PolarHBondContact O-N 3.01Å; A810-N814 PolarHBondContact O-ND2 3.01Å; A811-N814 PolarHBondContact O-N 3.45Å; L812-N814 VanDerWaalsContact C-N 3.32Å; L812-N814 PolarHBondContact O-N 2.99Å; N814-L818 WeakPolarHBondContact O-CB 3.21Å; N814-L818 PolarHBondContact O-N 3.2Å; N814-L818 VanDerWaalsContact O-N 3.07Å; N814-F879 HydrophobicContact CB-CD2 4.33Å; N814-F879 HydrophobicContact CB-CE2 3.87Å
815	Y	87.8	Confident	82.3	Confident	13 Å²	13	57.2 Å²	57.2	5%	0.051	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-51.4	179.5	-172.1	-101.1	0	0	0	111.7	A811 L812 R817 L818 T819 F879 L882 F883 D886	A811-Y815 WeakPolarHBondContact O-CB 3.42Å; A811-Y815 PolarHBondContact O-N 3.39Å; L812-Y815 PolarHBondContact O-N 3.03Å; Y815-R817 VanDerWaalsContact C-N 3.29Å; Y815-R817 PolarHBondContact O-N 3.49Å; Y815-L818 WeakPolarHBondContact O-CA 3.34Å; Y815-L818 WeakPolarHBondContact O-CB 3.48Å; Y815-L818 PolarHBondContact O-N 3.44Å; Y815-T819 HydrophobicContact CD1-CG2 4.09Å; Y815-T819 HydrophobicContact CE1-CG2 3.61Å; Y815-T819 HydrophobicContact CE2-CG2 4.22Å; Y815-T819 PolarHBondContact O-N 3.28Å; Y815-T819 PolarHBondContact O-OG1 2.84Å; Y815-F879 HydrophobicContact CD2-CE1 4.15Å; Y815-F879 HydrophobicContact CD2-CE2 4.21Å; Y815-F879 AromaticContact CD2-CZ 3.94Å; Y815-F879 HydrophobicContact CD2-CZ 3.94Å; Y815-L882 HydrophobicContact CD1-CB 3.7Å; Y815-L882 HydrophobicContact CD1-CD1 4.2Å; Y815-L882 HydrophobicContact CD2-CB 4.19Å; Y815-L882 HydrophobicContact CE1-CB 3.96Å; Y815-L882 HydrophobicContact CE2-CB 4.44Å; Y815-L882 HydrophobicContact CG-CB 3.82Å; Y815-L882 HydrophobicContact CG-CD1 4.07Å; Y815-F883 HydrophobicContact CE2-CB 3.86Å; Y815-F883 HydrophobicContact CE2-CD2 4.41Å; Y815-F883 WeakPolarHBondContact OH-CA 3.34Å; Y815-D886 PolarHBondContact OH-OD2 3.49Å
816	T	86.8	Confident	80.7	Confident	52 Å²	52	59.6 Å²	59.6	32%	0.319	28%	0.276	S	S	.	.	H	α-helix	trans	-58	-40	179.2	-56.9	0	0	0	0	112.3	L812 L818 T819 E820	L812-T816 WeakPolarHBondContact O-CB 3.48Å; L812-T816 PolarHBondContact O-N 3.05Å; L812-T816 PolarHBondContact O-OG1 3.35Å; T816-L818 VanDerWaalsContact C-N 3.34Å; T816-T819 PolarHBondContact O-OG1 3.1Å; T816-E820 WeakPolarHBondContact O-CB 3.45Å; T816-E820 VanDerWaalsContact O-CG 3.27Å; T816-E820 WeakPolarHBondContact O-CG 3.48Å; T816-E820 PolarHBondContact O-N 3.47Å
817	R	82.9	Confident	79.2	Confident	77 Å²	77	61.6 Å²	61.6	29%	0.291	29%	0.289	S	S	.	.	H	α-helix	trans	-71.6	-29.6	176.6	-73.1	-170.6	179.2	179.5	6.6	113.2	Y764 I813 Y815 Y821	Y764-R817 VanDerWaalsContact CE1-NH1 3.25Å; Y764-R817 WeakPolarHBondContact OH-CD 3.4Å; Y764-R817 PolarHBondContact OH-NH1 2.89Å; I813-R817 WeakPolarHBondContact O-CB 3.35Å; I813-R817 WeakPolarHBondContact O-CG 3.47Å; I813-R817 PolarHBondContact O-N 3.33Å; I813-R817 VanDerWaalsContact O-N 3.15Å; Y815-R817 VanDerWaalsContact C-N 3.29Å; Y815-R817 PolarHBondContact O-N 3.49Å; R817-Y821 WeakPolarHBondContact O-CB 3.48Å; R817-Y821 PolarHBondContact O-N 3.32Å
818	L	84.3	Confident	77.8	Confident	16 Å²	16	62.8 Å²	62.8	8%	0.084	29%	0.294	C	S	.	.	H	α-helix	trans	-69.5	-44.8	175.8	-168	65.7	0	0	0	110.8	N814 Y815 T816 Y821 A822 L843 L846 C847 V850 F879	N814-L818 WeakPolarHBondContact O-CB 3.21Å; N814-L818 PolarHBondContact O-N 3.2Å; N814-L818 VanDerWaalsContact O-N 3.07Å; Y815-L818 WeakPolarHBondContact O-CA 3.34Å; Y815-L818 WeakPolarHBondContact O-CB 3.48Å; Y815-L818 PolarHBondContact O-N 3.44Å; T816-L818 VanDerWaalsContact C-N 3.34Å; L818-Y821 PolarHBondContact O-N 3.12Å; L818-A822 WeakPolarHBondContact O-CB 3.39Å; L818-A822 PolarHBondContact O-N 3.06Å; L818-L843 HydrophobicContact CD2-CD1 4.01Å; L818-L843 HydrophobicContact CG-CD1 4.16Å; L818-L846 HydrophobicContact CD1-CB 3.99Å; L818-L846 HydrophobicContact CD2-CB 4.14Å; L818-L846 HydrophobicContact CG-CB 4.29Å; L818-C847 HydrophobicContact CD2-CB 4.41Å; L818-C847 VanDerWaalsContact CD2-SG 3.55Å; L818-V850 HydrophobicContact CD1-CG2 3.8Å; L818-V850 HydrophobicContact CD2-CG2 4.19Å; L818-F879 HydrophobicContact CD2-CZ 4.03Å
819	T	82.7	Confident	76.4	Confident	9 Å²	9	65.6 Å²	65.6	6%	0.055	31%	0.312	C	S	.	.	H	α-helix	trans	-66.8	-36.4	177.1	57.1	0	0	0	0	112.1	Y815 T816 A822 K823 I824 L843	Y815-T819 HydrophobicContact CD1-CG2 4.09Å; Y815-T819 HydrophobicContact CE1-CG2 3.61Å; Y815-T819 HydrophobicContact CE2-CG2 4.22Å; Y815-T819 PolarHBondContact O-N 3.28Å; Y815-T819 PolarHBondContact O-OG1 2.84Å; T816-T819 PolarHBondContact O-OG1 3.1Å; T819-A822 PolarHBondContact O-N 3.2Å; T819-K823 PolarHBondContact O-N 3.4Å; T819-I824 PolarHBondContact O-N 3.41Å; T819-L843 HydrophobicContact CG2-CD1 4.35Å; T819-L843 HydrophobicContact CG2-CD2 4.38Å
820	E	80.4	Confident	75	Confident	125 Å²	125	69.9 Å²	69.9	58%	0.584	33%	0.333	S	S	*	.	H	α-helix	trans	-61.4	-45.3	169.9	-78.2	173.3	-174.8	0	0	112.1	T816 K823	T816-E820 WeakPolarHBondContact O-CB 3.45Å; T816-E820 VanDerWaalsContact O-CG 3.27Å; T816-E820 WeakPolarHBondContact O-CG 3.48Å; T816-E820 PolarHBondContact O-N 3.47Å; E820-K823 PolarHBondContact O-N 2.94Å
821	Y	74.5	Confident	74	Confident	178 Å²	178	70.7 Å²	70.7	70%	0.698	34%	0.34	S	S	*	.	H	α-helix	trans	-63.4	-42.1	178.2	176.9	-97.9	0	0	0	111.9	R817 L818 K823	R817-Y821 WeakPolarHBondContact O-CB 3.48Å; R817-Y821 PolarHBondContact O-N 3.32Å; L818-Y821 PolarHBondContact O-N 3.12Å; Y821-K823 PolarHBondContact O-N 3.01Å
822	A	71.1	Confident	73.5	Confident	16 Å²	16	73.9 Å²	73.9	13%	0.132	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-5.8	178.2	0	0	0	0	0	113.5	L818 T819 I824 L846	L818-A822 WeakPolarHBondContact O-CB 3.39Å; L818-A822 PolarHBondContact O-N 3.06Å; T819-A822 PolarHBondContact O-N 3.2Å; A822-I824 HydrophobicContact CB-CD1 3.51Å; A822-I824 HydrophobicContact CB-CG1 3.57Å; A822-I824 PolarHBondContact O-N 2.86Å; A822-L846 HydrophobicContact CB-CD1 4Å
823	K	69.3	Low	72.9	Confident	144 Å²	144	72.1 Å²	72.1	63%	0.626	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	36.8	-179.7	-58.8	-178.3	-179	177.9	0	114	T819 E820 Y821 T827	T819-K823 PolarHBondContact O-N 3.4Å; E820-K823 PolarHBondContact O-N 2.94Å; Y821-K823 PolarHBondContact O-N 3.01Å; K823-T827 PolarHBondContact O-OG1 2.85Å
824	I	61.5	Low	72.5	Confident	5 Å²	5	72.9 Å²	72.9	3%	0.026	37%	0.369	C	S	.	.	H	α-helix	trans	-73.4	-35.8	-170.9	-68.2	176.4	0	0	0	111.4	T819 A822 E826 T827 M828 L843	T819-I824 PolarHBondContact O-N 3.41Å; A822-I824 HydrophobicContact CB-CD1 3.51Å; A822-I824 HydrophobicContact CB-CG1 3.57Å; A822-I824 PolarHBondContact O-N 2.86Å; I824-E826 PolarHBondContact O-N 3.01Å; I824-T827 PolarHBondContact O-N 3.18Å; I824-M828 HydrophobicContact CG2-CE 4.49Å; I824-M828 HydrophobicContact CG2-CG 3.49Å; I824-M828 VanDerWaalsContact CG2-CG 3.49Å; I824-M828 HydrophobicContact CG2-SD 3.5Å; I824-M828 WeakPolarHBondContact CG2-SD 3.48Å; I824-M828 WeakPolarHBondContact O-CB 3.3Å; I824-M828 VanDerWaalsContact O-CG 3.29Å; I824-M828 WeakPolarHBondContact O-CG 3.23Å; I824-M828 PolarHBondContact O-N 2.93Å; I824-L843 HydrophobicContact CD1-CB 3.59Å; I824-L843 HydrophobicContact CD1-CD1 3.61Å; I824-L843 HydrophobicContact CD1-CD2 3.62Å; I824-L843 HydrophobicContact CD1-CG 3.76Å
825	E	57.8	Low	72.2	Confident	139 Å²	139	79.6 Å²	79.6	65%	0.65	39%	0.393	S	S	*	.	H	α-helix	trans	-62.9	-36.3	-176.8	-68.1	-172.2	171.4	0	0	114.2	N829	E825-N829 PolarHBondContact O-ND2 3.38Å
826	E	56.6	Low	71.9	Confident	162 Å²	162	81.3 Å²	81.3	76%	0.757	40%	0.401	S	S	*	.	H	α-helix	trans	-75.5	-33.6	176.3	-75.2	-173.3	158.9	0	0	111.9	I824	I824-E826 PolarHBondContact O-N 3.01Å
827	T	58.9	Low	71.8	Confident	44 Å²	44	79.3 Å²	79.3	27%	0.27	39%	0.388	S	S	.	.	H	α-helix	trans	-84.1	-37.7	-172.2	-47.2	0	0	0	0	111.9	K823 I824 N829 Q830 A831 E839	K823-T827 PolarHBondContact O-OG1 2.85Å; I824-T827 PolarHBondContact O-N 3.18Å; T827-N829 VanDerWaalsContact C-N 3.34Å; T827-N829 PolarHBondContact O-N 3.32Å; T827-Q830 PolarHBondContact O-N 3.1Å; T827-A831 WeakPolarHBondContact O-CB 2.9Å; T827-A831 PolarHBondContact O-N 3.37Å; T827-A831 VanDerWaalsContact O-N 3.16Å; T827-E839 HydrophobicContact CG2-CG 4.3Å
828	M	59.5	Low	71.9	Confident	26 Å²	26	81.8 Å²	81.8	13%	0.128	40%	0.403	C	S	.	.	H	α-helix	trans	-69.5	-25.6	-176.9	-73.1	-150.9	123.4	0	0	114.9	I824 Q830 K836 I840 A890	I824-M828 HydrophobicContact CG2-CE 4.49Å; I824-M828 HydrophobicContact CG2-CG 3.49Å; I824-M828 VanDerWaalsContact CG2-CG 3.49Å; I824-M828 HydrophobicContact CG2-SD 3.5Å; I824-M828 WeakPolarHBondContact CG2-SD 3.48Å; I824-M828 WeakPolarHBondContact O-CB 3.3Å; I824-M828 VanDerWaalsContact O-CG 3.29Å; I824-M828 WeakPolarHBondContact O-CG 3.23Å; I824-M828 PolarHBondContact O-N 2.93Å; M828-Q830 VanDerWaalsContact C-N 3.33Å; M828-Q830 PolarHBondContact O-N 2.81Å; M828-K836 HydrophobicContact CE-CB 4.15Å; M828-K836 WeakPolarHBondContact CE-O 3.23Å; M828-K836 WeakPolarHBondContact O-CE 3.48Å; M828-K836 PolarHBondContact O-NZ 3.13Å; M828-K836 VanDerWaalsContact O-NZ 3.13Å; M828-I840 HydrophobicContact CE-CD1 3.53Å; M828-I840 HydrophobicContact CE-CG1 3.43Å; M828-I840 VanDerWaalsContact CE-CG1 3.43Å; M828-I840 HydrophobicContact SD-CD1 4.25Å; M828-A890 HydrophobicContact CE-CB 4.18Å
829	N	60.2	Low	71.8	Confident	139 Å²	139	83 Å²	83	74%	0.743	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-16.7	-179.3	-77.1	-45.3	0	0	0	113.5	E825 T827	E825-N829 PolarHBondContact O-ND2 3.38Å; T827-N829 VanDerWaalsContact C-N 3.34Å; T827-N829 PolarHBondContact O-N 3.32Å
830	Q	60	Low	72.1	Confident	182 Å²	182	82.6 Å²	82.6	85%	0.85	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127	-1	-175.6	-61.4	-178.5	14.3	0	0	114.4	T827 M828	T827-Q830 PolarHBondContact O-N 3.1Å; M828-Q830 VanDerWaalsContact C-N 3.33Å; M828-Q830 PolarHBondContact O-N 2.81Å
831	A	68.2	Low	72.4	Confident	18 Å²	18	78.9 Å²	78.9	15%	0.149	39%	0.39	C	S	.	.			trans	-84.2	152.3	-174.9	0	0	0	0	0	114.5	T827 R835 K836	T827-A831 WeakPolarHBondContact O-CB 2.9Å; T827-A831 PolarHBondContact O-N 3.37Å; T827-A831 VanDerWaalsContact O-N 3.16Å; A831-R835 HydrophobicContact CB-CB 4.19Å; A831-K836 HydrophobicContact CB-CG 3.87Å; A831-K836 WeakPolarHBondContact O-CE 3.11Å
832	S	77.6	Confident	73	Confident	67 Å²	67	74.3 Å²	74.3	47%	0.469	37%	0.374	S	S	.	.			trans	-66	156.1	168.3	58.7	0	0	0	0	111.2	A834 R835 K836	S832-A834 VanDerWaalsContact C-N 3.32Å; S832-A834 PolarHBondContact O-N 2.7Å; S832-R835 PolarHBondContact O-N 2.84Å; S832-R835 WeakPolarHBondContact OG-CB 3.34Å; S832-K836 WeakPolarHBondContact O-CG 3.18Å; S832-K836 PolarHBondContact O-N 2.91Å
833	P	77.2	Confident	73.8	Confident	57 Å²	57	73.5 Å²	73.5	37%	0.37	37%	0.368	S	S	.	.	H	α-helix	trans	-51.9	-45.4	179.2	-28.9	35.9	0	0	0	114	R835 K836 L837 Q894	P833-R835 VanDerWaalsContact C-N 3.34Å; P833-R835 PolarHBondContact O-N 3.01Å; P833-K836 WeakPolarHBondContact O-CB 3.43Å; P833-K836 PolarHBondContact O-N 3.45Å; P833-L837 PolarHBondContact O-N 3.21Å; P833-L837 VanDerWaalsContact O-N 3.15Å; P833-Q894 PolarHBondContact O-NE2 3.28Å
834	A	78.5	Confident	74.7	Confident	54 Å²	54	66.7 Å²	66.7	45%	0.446	34%	0.338	S	S	.	.	H	α-helix	trans	-59.7	-42.8	177.3	0	0	0	0	0	112.6	S832 L837 E838	S832-A834 VanDerWaalsContact C-N 3.32Å; S832-A834 PolarHBondContact O-N 2.7Å; A834-L837 WeakPolarHBondContact O-CB 3.38Å; A834-L837 PolarHBondContact O-N 3.19Å; A834-E838 PolarHBondContact O-N 3.07Å; A834-E838 VanDerWaalsContact O-N 3.09Å
835	R	80.3	Confident	76	Confident	148 Å²	148	70.3 Å²	70.3	56%	0.558	36%	0.355	S	S	*	.	H	α-helix	trans	-71	-34.2	-179.9	-156.7	-179	-164.1	166.5	5.6	111.6	A831 S832 P833 L837 E838 E839	A831-R835 HydrophobicContact CB-CB 4.19Å; S832-R835 PolarHBondContact O-N 2.84Å; S832-R835 WeakPolarHBondContact OG-CB 3.34Å; P833-R835 VanDerWaalsContact C-N 3.34Å; P833-R835 PolarHBondContact O-N 3.01Å; R835-L837 VanDerWaalsContact C-N 3.25Å; R835-L837 PolarHBondContact O-N 3.35Å; R835-E838 PolarHBondContact O-N 3.28Å; R835-E839 VanDerWaalsContact O-CG 3.23Å; R835-E839 WeakPolarHBondContact O-CG 3.4Å; R835-E839 PolarHBondContact O-N 2.89Å; R835-E839 VanDerWaalsContact O-N 3.07Å
836	K	81.8	Confident	77.4	Confident	50 Å²	50	64.6 Å²	64.6	22%	0.217	33%	0.329	C	S	.	.	H	α-helix	trans	-60.5	-36.7	171.6	-68.2	-175.4	-174.7	-156.8	0	112.2	M828 A831 S832 P833 I840 A893	M828-K836 HydrophobicContact CE-CB 4.15Å; M828-K836 WeakPolarHBondContact CE-O 3.23Å; M828-K836 WeakPolarHBondContact O-CE 3.48Å; M828-K836 PolarHBondContact O-NZ 3.13Å; M828-K836 VanDerWaalsContact O-NZ 3.13Å; A831-K836 HydrophobicContact CB-CG 3.87Å; A831-K836 WeakPolarHBondContact O-CE 3.11Å; S832-K836 WeakPolarHBondContact O-CG 3.18Å; S832-K836 PolarHBondContact O-N 2.91Å; P833-K836 WeakPolarHBondContact O-CB 3.43Å; P833-K836 PolarHBondContact O-N 3.45Å; K836-I840 WeakPolarHBondContact O-CG1 3.46Å; K836-I840 PolarHBondContact O-N 3.4Å; K836-I840 VanDerWaalsContact O-N 3.11Å; K836-A893 HydrophobicContact CD-CB 4.43Å
837	L	84.4	Confident	78.9	Confident	9 Å²	9	56.9 Å²	56.9	5%	0.047	29%	0.293	C	S	.	.	H	α-helix	trans	-72.5	-41.2	179	-174.6	61.2	0	0	0	112.3	P833 A834 R835 E839 I840 L841 L891 D900 L904	P833-L837 PolarHBondContact O-N 3.21Å; P833-L837 VanDerWaalsContact O-N 3.15Å; A834-L837 WeakPolarHBondContact O-CB 3.38Å; A834-L837 PolarHBondContact O-N 3.19Å; R835-L837 VanDerWaalsContact C-N 3.25Å; R835-L837 PolarHBondContact O-N 3.35Å; L837-E839 VanDerWaalsContact C-N 3.33Å; L837-E839 PolarHBondContact O-N 3.03Å; L837-I840 PolarHBondContact O-N 3.38Å; L837-L841 WeakPolarHBondContact O-CB 3.35Å; L837-L841 PolarHBondContact O-N 2.9Å; L837-L891 HydrophobicContact CD1-CD2 4.36Å; L837-D900 VanDerWaalsContact CD2-C 3.45Å; L837-D900 HydrophobicContact CD2-CB 3.76Å; L837-D900 VanDerWaalsContact CD2-O 3.3Å; L837-D900 WeakPolarHBondContact CD2-O 3.26Å; L837-L904 HydrophobicContact CD1-CD2 4.18Å
838	E	84.4	Confident	80.3	Confident	129 Å²	129	55.4 Å²	55.4	60%	0.603	28%	0.283	S	S	*	.	H	α-helix	trans	-58.3	-43.9	172.3	-72.1	175.1	176.7	0	0	111.7	A834 R835 L841 H842	A834-E838 PolarHBondContact O-N 3.07Å; A834-E838 VanDerWaalsContact O-N 3.09Å; R835-E838 PolarHBondContact O-N 3.28Å; E838-L841 PolarHBondContact O-N 2.97Å; E838-H842 PolarHBondContact O-N 3.47Å
839	E	83.9	Confident	81.4	Confident	43 Å²	43	59 Å²	59	20%	0.201	30%	0.3	C	S	.	.	H	α-helix	trans	-65.6	-38.5	177.7	-64.6	-69.1	165.1	0	0	112.3	T827 R835 L837 H842 L843	T827-E839 HydrophobicContact CG2-CG 4.3Å; R835-E839 VanDerWaalsContact O-CG 3.23Å; R835-E839 WeakPolarHBondContact O-CG 3.4Å; R835-E839 PolarHBondContact O-N 2.89Å; R835-E839 VanDerWaalsContact O-N 3.07Å; L837-E839 VanDerWaalsContact C-N 3.33Å; L837-E839 PolarHBondContact O-N 3.03Å; E839-H842 PolarHBondContact O-N 3.45Å; E839-L843 WeakPolarHBondContact O-CB 3.26Å; E839-L843 PolarHBondContact O-N 3Å
840	I	88.4	Confident	82.6	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-68.2	-37.6	173.8	-73.2	-57.7	0	0	0	112	M828 K836 L837 H842 L843 A844 F883 D886 A890 L904	M828-I840 HydrophobicContact CE-CD1 3.53Å; M828-I840 HydrophobicContact CE-CG1 3.43Å; M828-I840 VanDerWaalsContact CE-CG1 3.43Å; M828-I840 HydrophobicContact SD-CD1 4.25Å; K836-I840 WeakPolarHBondContact O-CG1 3.46Å; K836-I840 PolarHBondContact O-N 3.4Å; K836-I840 VanDerWaalsContact O-N 3.11Å; L837-I840 PolarHBondContact O-N 3.38Å; I840-H842 VanDerWaalsContact C-N 3.35Å; I840-L843 HydrophobicContact CD1-CD2 4.24Å; I840-L843 PolarHBondContact O-N 3.34Å; I840-A844 WeakPolarHBondContact O-CB 3.36Å; I840-A844 PolarHBondContact O-N 3.44Å; I840-F883 HydrophobicContact CG2-CE2 4.23Å; I840-F883 HydrophobicContact CG2-CZ 3.84Å; I840-D886 HydrophobicContact CD1-CB 3.93Å; I840-A890 HydrophobicContact CB-CB 4.43Å; I840-A890 HydrophobicContact CD1-CB 4.43Å; I840-A890 HydrophobicContact CG1-CB 3.5Å; I840-A890 VanDerWaalsContact CG1-CB 3.5Å; I840-L904 HydrophobicContact CG2-CD1 4.06Å; I840-L904 HydrophobicContact CG2-CD2 3.69Å
841	L	87.3	Confident	83.8	Confident	47 Å²	47	45 Å²	45	25%	0.246	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-44.8	175.6	-170.5	147.4	0	0	0	110.4	L837 E838 L843 A844 E845 P903 L907	L837-L841 WeakPolarHBondContact O-CB 3.35Å; L837-L841 PolarHBondContact O-N 2.9Å; E838-L841 PolarHBondContact O-N 2.97Å; L841-L843 VanDerWaalsContact C-N 3.35Å; L841-L843 PolarHBondContact O-N 2.93Å; L841-A844 WeakPolarHBondContact O-CB 3.26Å; L841-A844 PolarHBondContact O-N 3.22Å; L841-E845 HydrophobicContact CD2-CG 4.48Å; L841-E845 WeakPolarHBondContact O-CG 3.46Å; L841-E845 PolarHBondContact O-N 3.49Å; L841-P903 HydrophobicContact CD1-CB 3.99Å; L841-L907 HydrophobicContact CG-CD2 4.41Å
842	H	86.1	Confident	84.5	Confident	81 Å²	81	48 Å²	48	38%	0.375	24%	0.242	S	C	.	.	H	α-helix	trans	-62.4	-40.9	173.6	-172.9	49.1	0	0	0	112.3	E838 E839 I840 A844 E845 L846	E838-H842 PolarHBondContact O-N 3.47Å; E839-H842 PolarHBondContact O-N 3.45Å; I840-H842 VanDerWaalsContact C-N 3.35Å; H842-A844 VanDerWaalsContact C-N 3.32Å; H842-A844 PolarHBondContact O-N 3.47Å; H842-E845 IonicContact ND1-OE2 3.78Å; H842-E845 PolarHBondContact O-N 3.4Å; H842-L846 WeakPolarHBondContact O-CG 3.33Å; H842-L846 PolarHBondContact O-N 3.36Å
843	L	88.1	Confident	84.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.8	-40	173.7	-177.6	57.4	0	0	0	111.8	L818 T819 I824 E839 I840 L841 L846 C847 F883	L818-L843 HydrophobicContact CD2-CD1 4.01Å; L818-L843 HydrophobicContact CG-CD1 4.16Å; T819-L843 HydrophobicContact CG2-CD1 4.35Å; T819-L843 HydrophobicContact CG2-CD2 4.38Å; I824-L843 HydrophobicContact CD1-CB 3.59Å; I824-L843 HydrophobicContact CD1-CD1 3.61Å; I824-L843 HydrophobicContact CD1-CD2 3.62Å; I824-L843 HydrophobicContact CD1-CG 3.76Å; E839-L843 WeakPolarHBondContact O-CB 3.26Å; E839-L843 PolarHBondContact O-N 3Å; I840-L843 HydrophobicContact CD1-CD2 4.24Å; I840-L843 PolarHBondContact O-N 3.34Å; L841-L843 VanDerWaalsContact C-N 3.35Å; L841-L843 PolarHBondContact O-N 2.93Å; L843-L846 PolarHBondContact O-N 3.16Å; L843-C847 WeakPolarHBondContact O-CB 3.47Å; L843-C847 PolarHBondContact O-N 3.3Å; L843-C847 PolarHBondContact O-SG 3.01Å; L843-F883 HydrophobicContact CB-CE2 4.24Å; L843-F883 HydrophobicContact CD2-CD2 3.83Å; L843-F883 HydrophobicContact CD2-CE2 3.9Å; L843-F883 HydrophobicContact CG-CD2 4.02Å; L843-F883 HydrophobicContact CG-CE2 3.9Å
844	A	88.9	Confident	84.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.9	-43.5	177.5	0	0	0	0	0	111.4	I840 L841 H842 C847 I848 F883 L904 L907 L908	I840-A844 WeakPolarHBondContact O-CB 3.36Å; I840-A844 PolarHBondContact O-N 3.44Å; L841-A844 WeakPolarHBondContact O-CB 3.26Å; L841-A844 PolarHBondContact O-N 3.22Å; H842-A844 VanDerWaalsContact C-N 3.32Å; H842-A844 PolarHBondContact O-N 3.47Å; A844-C847 WeakPolarHBondContact O-CB 3.38Å; A844-C847 PolarHBondContact O-N 3.29Å; A844-I848 VanDerWaalsContact O-CG1 3.27Å; A844-I848 WeakPolarHBondContact O-CG1 3.45Å; A844-I848 PolarHBondContact O-N 3.39Å; A844-F883 HydrophobicContact CB-CE2 4.21Å; A844-F883 HydrophobicContact CB-CZ 3.84Å; A844-L904 HydrophobicContact CB-CD1 3.78Å; A844-L907 HydrophobicContact CB-CD2 3.99Å; A844-L908 HydrophobicContact CB-CD2 4.02Å
845	E	88	Confident	84.6	Confident	81 Å²	81	45.5 Å²	45.5	38%	0.379	21%	0.209	S	C	.	.	H	α-helix	trans	-57.3	-50.1	173.2	-67.8	174	163.8	0	0	111	L841 H842 C847 I848 E849 L907	L841-E845 HydrophobicContact CD2-CG 4.48Å; L841-E845 WeakPolarHBondContact O-CG 3.46Å; L841-E845 PolarHBondContact O-N 3.49Å; H842-E845 IonicContact ND1-OE2 3.78Å; H842-E845 PolarHBondContact O-N 3.4Å; E845-C847 VanDerWaalsContact C-N 3.32Å; E845-C847 PolarHBondContact O-N 3.04Å; E845-I848 PolarHBondContact O-N 2.94Å; E845-E849 WeakPolarHBondContact O-CG 3.38Å; E845-E849 PolarHBondContact O-N 2.92Å; E845-L907 HydrophobicContact CG-CD2 3.69Å
846	L	86.2	Confident	84.3	Confident	20 Å²	20	42 Å²	42	11%	0.105	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-38.5	177.8	-70.7	177	0	0	0	112.5	L818 A822 H842 L843 E849 V850	L818-L846 HydrophobicContact CD1-CB 3.99Å; L818-L846 HydrophobicContact CD2-CB 4.14Å; L818-L846 HydrophobicContact CG-CB 4.29Å; A822-L846 HydrophobicContact CB-CD1 4Å; H842-L846 WeakPolarHBondContact O-CG 3.33Å; H842-L846 PolarHBondContact O-N 3.36Å; L843-L846 PolarHBondContact O-N 3.16Å; L846-E849 PolarHBondContact O-N 3.15Å; L846-V850 WeakPolarHBondContact O-CB 3.46Å; L846-V850 WeakPolarHBondContact O-CG2 3.36Å; L846-V850 PolarHBondContact O-N 3.3Å
847	C	89.1	Confident	83.9	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63.2	-45.8	175.8	-73.7	0	0	0	0	111.2	L818 L843 A844 E845 V850 L851 F879 W880	L818-C847 HydrophobicContact CD2-CB 4.41Å; L818-C847 VanDerWaalsContact CD2-SG 3.55Å; L843-C847 WeakPolarHBondContact O-CB 3.47Å; L843-C847 PolarHBondContact O-N 3.3Å; L843-C847 PolarHBondContact O-SG 3.01Å; A844-C847 WeakPolarHBondContact O-CB 3.38Å; A844-C847 PolarHBondContact O-N 3.29Å; E845-C847 VanDerWaalsContact C-N 3.32Å; E845-C847 PolarHBondContact O-N 3.04Å; C847-V850 PolarHBondContact O-N 3.06Å; C847-L851 WeakPolarHBondContact O-CG 3.27Å; C847-L851 PolarHBondContact O-N 2.91Å; C847-F879 HydrophobicContact CB-CE1 3.77Å; C847-F879 VanDerWaalsContact SG-CE1 3.59Å; C847-W880 HydrophobicContact CB-CH2 3.8Å; C847-W880 HydrophobicContact CB-CZ3 3.88Å
848	I	87.5	Confident	83.4	Confident	13 Å²	13	40.8 Å²	40.8	7%	0.067	19%	0.194	C	C	.	.	H	α-helix	trans	-59.9	-49	175.7	-70.5	167.4	0	0	0	110	A844 E845 V850 L851 Q852 W880 L907 F911	A844-I848 VanDerWaalsContact O-CG1 3.27Å; A844-I848 WeakPolarHBondContact O-CG1 3.45Å; A844-I848 PolarHBondContact O-N 3.39Å; E845-I848 PolarHBondContact O-N 2.94Å; I848-V850 VanDerWaalsContact C-N 3.32Å; I848-V850 PolarHBondContact O-N 3.47Å; I848-L851 PolarHBondContact O-N 3.06Å; I848-Q852 HydrophobicContact CG2-CG 4.21Å; I848-Q852 WeakPolarHBondContact O-CB 3.3Å; I848-Q852 VanDerWaalsContact O-CG 3.3Å; I848-Q852 WeakPolarHBondContact O-CG 3.39Å; I848-Q852 PolarHBondContact O-N 2.9Å; I848-W880 HydrophobicContact CG1-CH2 3.94Å; I848-W880 HydrophobicContact CG1-CZ2 4.27Å; I848-L907 HydrophobicContact CD1-CD1 4.01Å; I848-L907 HydrophobicContact CD1-CD2 4.33Å; I848-L907 HydrophobicContact CD1-CG 3.81Å; I848-F911 HydrophobicContact CB-CD2 4.44Å; I848-F911 HydrophobicContact CD1-CB 3.89Å; I848-F911 HydrophobicContact CD1-CG 4.14Å; I848-F911 HydrophobicContact CG1-CB 4.16Å; I848-F911 HydrophobicContact CG1-CD1 3.98Å; I848-F911 HydrophobicContact CG1-CD2 4.26Å; I848-F911 HydrophobicContact CG1-CE1 4.49Å; I848-F911 HydrophobicContact CG1-CG 3.84Å; I848-F911 HydrophobicContact CG2-CD2 3.53Å; I848-F911 HydrophobicContact CG2-CE2 3.83Å; I848-F911 HydrophobicContact CG2-CG 4Å
849	E	83.5	Confident	82.4	Confident	100 Å²	100	35.6 Å²	35.6	47%	0.467	17%	0.173	S	C	.	.	H	α-helix	trans	-59.2	-42.3	178.1	-73.3	-175.5	176.9	0	0	112.3	E845 L846 Q853	E845-E849 WeakPolarHBondContact O-CG 3.38Å; E845-E849 PolarHBondContact O-N 2.92Å; L846-E849 PolarHBondContact O-N 3.15Å; E849-Q853 WeakPolarHBondContact O-CB 3.16Å; E849-Q853 WeakPolarHBondContact O-CG 3.39Å; E849-Q853 PolarHBondContact O-N 3.09Å
850	V	85.4	Confident	80.7	Confident	13 Å²	13	38.4 Å²	38.4	8%	0.079	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-45.4	178	162.2	0	0	0	0	111	R763 L818 L846 C847 I848 N854 F879	R763-V850 PolarHBondContact NH1-O 3.03Å; L818-V850 HydrophobicContact CD1-CG2 3.8Å; L818-V850 HydrophobicContact CD2-CG2 4.19Å; L846-V850 WeakPolarHBondContact O-CB 3.46Å; L846-V850 WeakPolarHBondContact O-CG2 3.36Å; L846-V850 PolarHBondContact O-N 3.3Å; C847-V850 PolarHBondContact O-N 3.06Å; I848-V850 VanDerWaalsContact C-N 3.32Å; I848-V850 PolarHBondContact O-N 3.47Å; V850-N854 PolarHBondContact O-N 2.69Å; V850-N854 VanDerWaalsContact O-N 3.07Å; V850-F879 HydrophobicContact CG1-CE2 4.32Å; V850-F879 HydrophobicContact CG1-CZ 4.16Å
851	L	84.9	Confident	78.8	Confident	14 Å²	14	41.4 Å²	41.4	7%	0.073	22%	0.217	C	C	.	.	H	α-helix	trans	-70.6	-42	-180	-70.8	176.2	0	0	0	112	C847 I848 Q853 N854 E855 A876 F879 W880 F911	C847-L851 WeakPolarHBondContact O-CG 3.27Å; C847-L851 PolarHBondContact O-N 2.91Å; I848-L851 PolarHBondContact O-N 3.06Å; L851-Q853 PolarHBondContact O-N 3.39Å; L851-N854 WeakPolarHBondContact O-CB 3.5Å; L851-N854 PolarHBondContact O-N 3.03Å; L851-N854 VanDerWaalsContact O-N 3.09Å; L851-E855 PolarHBondContact O-N 3.34Å; L851-A876 HydrophobicContact CD1-CB 4.44Å; L851-A876 HydrophobicContact CD2-CB 4.09Å; L851-F879 HydrophobicContact CD1-CD1 4.15Å; L851-F879 HydrophobicContact CD2-CD1 4.3Å; L851-F879 HydrophobicContact CD2-CG 4.31Å; L851-F879 HydrophobicContact CG-CD1 4.31Å; L851-W880 HydrophobicContact CD1-CD2 4.33Å; L851-W880 HydrophobicContact CD1-CH2 4.45Å; L851-W880 HydrophobicContact CD1-CZ2 3.48Å; L851-W880 VanDerWaalsContact CD1-CZ2 3.48Å; L851-W880 VanDerWaalsContact CD1-NE1 3.28Å; L851-F911 HydrophobicContact CB-CZ 4.34Å; L851-F911 HydrophobicContact CD1-CE1 4.46Å
852	Q	82.6	Confident	76.9	Confident	83 Å²	83	50.4 Å²	50.4	39%	0.388	25%	0.247	S	C	.	.	H	α-helix	trans	-56.7	-52.8	172.2	-74.3	177.4	-8.1	0	0	110	I848 N854 E855 E856 F911	I848-Q852 HydrophobicContact CG2-CG 4.21Å; I848-Q852 WeakPolarHBondContact O-CB 3.3Å; I848-Q852 VanDerWaalsContact O-CG 3.3Å; I848-Q852 WeakPolarHBondContact O-CG 3.39Å; I848-Q852 PolarHBondContact O-N 2.9Å; Q852-N854 PolarHBondContact O-N 3.49Å; Q852-N854 VanDerWaalsContact O-N 3.13Å; Q852-E855 CarbonylContact O-C 3.59Å; Q852-E855 WeakPolarHBondContact O-CA 3.39Å; Q852-E855 WeakPolarHBondContact O-CB 3.41Å; Q852-E855 PolarHBondContact O-N 3.43Å; Q852-E856 WeakPolarHBondContact O-CG 3.3Å; Q852-E856 PolarHBondContact O-N 3.13Å; Q852-F911 HydrophobicContact CG-CE2 3.7Å; Q852-F911 HydrophobicContact CG-CZ 4.47Å
853	Q	77.6	Confident	75.6	Confident	30 Å²	30	47.6 Å²	47.6	14%	0.14	23%	0.234	C	C	.	.	H	α-helix	trans	-55.2	-34.7	176.3	-76.3	175.4	17.9	0	0	113.3	R158 R763 E849 L851 H857	R158-Q853 VanDerWaalsContact NH2-OE1 3.13Å; R763-Q853 VanDerWaalsContact NH2-OE1 3.16Å; E849-Q853 WeakPolarHBondContact O-CB 3.16Å; E849-Q853 WeakPolarHBondContact O-CG 3.39Å; E849-Q853 PolarHBondContact O-N 3.09Å; L851-Q853 PolarHBondContact O-N 3.39Å; Q853-H857 WeakPolarHBondContact O-CB 3.33Å; Q853-H857 PolarHBondContact O-CD2 2.99Å; Q853-H857 VanDerWaalsContact O-CD2 3.3Å; Q853-H857 PolarHBondContact O-N 2.89Å; Q853-H857 VanDerWaalsContact O-N 3.13Å
854	N	81.8	Confident	74.2	Confident	5 Å²	5	47.8 Å²	47.8	3%	0.027	24%	0.236	C	C	.	.	H	α-helix	trans	-65.8	-43.2	174.9	-73.9	-20.5	0	0	0	111.1	R763 V850 L851 Q852 H858 A859	R763-N854 WeakPolarHBondContact CD-OD1 3.36Å; R763-N854 WeakPolarHBondContact CG-OD1 3.45Å; R763-N854 PolarHBondContact NH1-OD1 3.05Å; V850-N854 PolarHBondContact O-N 2.69Å; V850-N854 VanDerWaalsContact O-N 3.07Å; L851-N854 WeakPolarHBondContact O-CB 3.5Å; L851-N854 PolarHBondContact O-N 3.03Å; L851-N854 VanDerWaalsContact O-N 3.09Å; Q852-N854 PolarHBondContact O-N 3.49Å; Q852-N854 VanDerWaalsContact O-N 3.13Å; N854-H858 WeakPolarHBondContact O-CA 3.46Å; N854-H858 VanDerWaalsContact O-CB 3.24Å; N854-H858 WeakPolarHBondContact O-CB 3.3Å; N854-H858 PolarHBondContact O-N 3.04Å; N854-A859 PolarHBondContact O-N 2.98Å
855	E	75.9	Confident	72.9	Confident	90 Å²	90	47.9 Å²	47.9	42%	0.421	24%	0.237	S	C	.	.	I	π-helix	trans	-63.6	-46.1	176.1	-162.1	178.6	178.8	0	0	111.5	L851 Q852 H857 A859 E860	L851-E855 PolarHBondContact O-N 3.34Å; Q852-E855 CarbonylContact O-C 3.59Å; Q852-E855 WeakPolarHBondContact O-CA 3.39Å; Q852-E855 WeakPolarHBondContact O-CB 3.41Å; Q852-E855 PolarHBondContact O-N 3.43Å; E855-H857 PolarHBondContact O-N 2.96Å; E855-A859 HydrophobicContact CB-CB 4.4Å; E855-A859 HydrophobicContact CG-CB 3.97Å; E855-A859 WeakPolarHBondContact O-CA 3.43Å; E855-A859 VanDerWaalsContact O-CB 3.27Å; E855-A859 WeakPolarHBondContact O-CB 3.46Å; E855-A859 PolarHBondContact O-N 2.96Å; E855-E860 PolarHBondContact O-N 3.22Å
856	E	74	Confident	71.6	Confident	74 Å²	74	46.3 Å²	46.3	35%	0.346	24%	0.237	S	C	.	.	I	π-helix	trans	-67.5	-33.9	-176.1	-51.4	-155.4	125.9	0	0	114.4	K183 Q852	K183-E856 WeakPolarHBondContact CD-OE1 3.42Å; K183-E856 WeakPolarHBondContact CE-OE1 3.22Å; K183-E856 VanDerWaalsContact NZ-CD 3.32Å; K183-E856 VanDerWaalsContact NZ-CG 3.3Å; K183-E856 IonicContact NZ-OE1 3.95Å; K183-E856 PolarHBondContact NZ-OE1 2.99Å; Q852-E856 WeakPolarHBondContact O-CG 3.3Å; Q852-E856 PolarHBondContact O-N 3.13Å
857	H	73.3	Confident	70.4	Confident	27 Å²	27	53.4 Å²	53.4	13%	0.125	26%	0.263	C	S	.	.	I	π-helix	trans	-112.4	-4.8	-171.5	-60.9	-47.5	0	0	0	114.5	F768 Q853 E855	F768-H857 AromaticContact CD1-CD2 3.77Å; F768-H857 AromaticContact CD1-NE2 3.54Å; Q853-H857 WeakPolarHBondContact O-CB 3.33Å; Q853-H857 PolarHBondContact O-CD2 2.99Å; Q853-H857 VanDerWaalsContact O-CD2 3.3Å; Q853-H857 PolarHBondContact O-N 2.89Å; Q853-H857 VanDerWaalsContact O-N 3.13Å; E855-H857 PolarHBondContact O-N 2.96Å
858	H	74.8	Confident	69.5	Low	6 Å²	6	55.7 Å²	55.7	3%	0.028	27%	0.272	C	S	.	.	I	π-helix	trans	-137.6	-14.3	-179.3	-54.4	-67.4	0	0	0	114.4	F762 F766 L775 N854 E863 F865	F762-H858 AromaticContact CD2-CD2 3.7Å; F762-H858 AromaticContact CD2-CE1 3.92Å; F762-H858 AromaticContact CD2-CG 3.9Å; F762-H858 AromaticContact CD2-NE2 3.7Å; F762-H858 HydrophobicContact CE2-CB 4.46Å; F762-H858 AromaticContact CE2-CD2 3.44Å; F762-H858 VanDerWaalsContact CE2-CD2 3.44Å; F762-H858 WeakPolarHBondContact CE2-CD2 3.35Å; F762-H858 AromaticContact CE2-CG 3.89Å; F762-H858 AromaticContact CE2-NE2 3.81Å; F766-H858 PolarHBondContact O-CE1 3.34Å; F766-H858 VanDerWaalsContact O-CE1 3.27Å; L775-H858 HydrophobicContact CD2-CB 4.48Å; N854-H858 WeakPolarHBondContact O-CA 3.46Å; N854-H858 VanDerWaalsContact O-CB 3.24Å; N854-H858 WeakPolarHBondContact O-CB 3.3Å; N854-H858 PolarHBondContact O-N 3.04Å; H858-E863 PolarHBondContact N-OE2 3.39Å; H858-F865 HydrophobicContact CB-CD2 4.28Å; H858-F865 PolarHBondContact O-N 3.32Å
859	A	63.3	Low	68.8	Low	20 Å²	20	58 Å²	58	17%	0.165	29%	0.287	C	S	.	.	I	π-helix	trans	-111.7	-44.1	-177.5	0	0	0	0	0	114.7	N854 E855 L872	N854-A859 PolarHBondContact O-N 2.98Å; E855-A859 HydrophobicContact CB-CB 4.4Å; E855-A859 HydrophobicContact CG-CB 3.97Å; E855-A859 WeakPolarHBondContact O-CA 3.43Å; E855-A859 VanDerWaalsContact O-CB 3.27Å; E855-A859 WeakPolarHBondContact O-CB 3.46Å; E855-A859 PolarHBondContact O-N 2.96Å; A859-L872 HydrophobicContact CB-CD1 3.48Å; A859-L872 VanDerWaalsContact CB-CD1 3.48Å
860	E	48.2	Very low	68.6	Low	103 Å²	103	58 Å²	58	48%	0.481	29%	0.291	S	S	.	.	S	Bend	trans	-77.3	130.5	-175.6	-85.5	-169.3	123.2	0	0	114.1	K183 E855	K183-E860 WeakPolarHBondContact CE-OE2 3.48Å; K183-E860 IonicContact NZ-OE2 3.31Å; K183-E860 PolarHBondContact NZ-OE2 3.35Å; E855-E860 PolarHBondContact O-N 3.22Å
861	G	48.4	Very low	68.5	Low	62 Å²	62	57.7 Å²	57.7	64%	0.639	29%	0.288	S	S	*	.	S	Bend	trans	63.4	93	157.9	0	0	0	0	0	117.4	E863	G861-E863 VanDerWaalsContact C-N 3.25Å; G861-E863 PolarHBondContact O-N 3.26Å
862	R	48.2	Very low	68.3	Low	236 Å²	236	58.2 Å²	58.2	89%	0.891	29%	0.291	S	S	*	.	S	Bend	trans	65.7	10.1	177	-56	-174.4	-172	-178.7	4	116.3
863	E	57.5	Low	68.3	Low	22 Å²	22	55.1 Å²	55.1	10%	0.103	28%	0.28	C	S	.	.	S	Bend	trans	-99.6	176.8	179.3	-67.5	-177.4	175.3	0	0	113.9	K179 H858 G861 F865 A866	K179-E863 IonicContact NZ-OE1 3.49Å; K179-E863 PolarHBondContact NZ-OE1 2.91Å; H858-E863 PolarHBondContact N-OE2 3.39Å; G861-E863 VanDerWaalsContact C-N 3.25Å; G861-E863 PolarHBondContact O-N 3.26Å; E863-F865 PolarHBondContact O-N 2.74Å; E863-A866 PolarHBondContact O-N 2.61Å
864	A	58.3	Low	68.6	Low	5 Å²	5	57.1 Å²	57.1	4%	0.041	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-32	-155.4	0	0	0	0	0	116.2	L775 K776 L779	L775-A864 HydrophobicContact CB-CB 3.87Å; L775-A864 HydrophobicContact CD2-CB 3.75Å; L775-A864 HydrophobicContact CG-CB 3.49Å; L775-A864 VanDerWaalsContact CG-CB 3.49Å; K776-A864 HydrophobicContact CB-CB 3.94Å; L779-A864 HydrophobicContact CD1-CB 3.85Å; L779-A864 WeakPolarHBondContact CD1-O 3.48Å
865	F	63.4	Low	68.9	Low	1 Å²	1	57 Å²	57	0%	0.004	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	1.8	-176.9	-67.3	-65.9	0	0	0	114.5	L775 L779 V803 L807 H858 E863 W867 W868 L872	L775-F865 HydrophobicContact CD2-CD2 4.26Å; L775-F865 HydrophobicContact CD2-CE2 3.75Å; L779-F865 HydrophobicContact CD1-CD1 4.21Å; L779-F865 HydrophobicContact CD1-CE1 3.97Å; L779-F865 HydrophobicContact CD1-CZ 4.44Å; V803-F865 HydrophobicContact CG1-CE1 4Å; L807-F865 HydrophobicContact CD1-CE1 4.13Å; L807-F865 HydrophobicContact CD2-CE1 4.29Å; L807-F865 HydrophobicContact CD2-CE2 4.47Å; L807-F865 HydrophobicContact CD2-CZ 3.86Å; H858-F865 HydrophobicContact CB-CD2 4.28Å; H858-F865 PolarHBondContact O-N 3.32Å; E863-F865 PolarHBondContact O-N 2.74Å; F865-W867 PolarHBondContact O-N 2.81Å; F865-W868 CarbonylContact O-C 3.52Å; F865-W868 PolarHBondContact O-N 3.43Å; F865-L872 HydrophobicContact CB-CD1 3.46Å; F865-L872 VanDerWaalsContact CB-CD1 3.46Å; F865-L872 HydrophobicContact CB-CD2 4.48Å; F865-L872 HydrophobicContact CB-CG 3.83Å; F865-L872 HydrophobicContact CD2-CD1 4.22Å; F865-L872 HydrophobicContact CD2-CD2 4.04Å; F865-L872 HydrophobicContact CD2-CG 4.3Å; F865-L872 HydrophobicContact CE2-CD2 4.44Å; F865-L872 HydrophobicContact CG-CD1 4.05Å; F865-L872 HydrophobicContact CG-CD2 4.2Å; F865-L872 HydrophobicContact CG-CG 4.02Å
866	A	60.4	Low	69.4	Low	48 Å²	48	53.2 Å²	53.2	40%	0.397	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-19.4	176.9	0	0	0	0	0	113.4	E863	E863-A866 PolarHBondContact O-N 2.61Å
867	W	59.5	Low	70.1	Confident	170 Å²	170	51.5 Å²	51.5	64%	0.644	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-16.3	177.7	-61.7	-27.1	0	0	0	114.2	K776 F865	K776-W867 HydrophobicContact CD-CH2 4.45Å; K776-W867 VanDerWaalsContact CE-CZ2 3.48Å; F865-W867 PolarHBondContact O-N 2.81Å
868	W	71.9	Confident	70.8	Confident	48 Å²	48	55 Å²	55	18%	0.182	28%	0.279	C	S	.	.			trans	-137.4	66.6	179.7	-59.9	-39.4	0	0	0	111.8	V799 K800 V803 F865 D870 L871	V799-W868 HydrophobicContact CG1-CH2 3.99Å; K800-W868 HydrophobicContact CG-CD2 4.12Å; K800-W868 HydrophobicContact CG-CG 4.48Å; K800-W868 HydrophobicContact CG-CZ2 4.1Å; V803-W868 HydrophobicContact CG2-CZ3 4.22Å; F865-W868 CarbonylContact O-C 3.52Å; F865-W868 PolarHBondContact O-N 3.43Å; W868-D870 PolarHBondContact O-N 2.87Å; W868-L871 HydrophobicContact CB-CB 4.21Å; W868-L871 HydrophobicContact CB-CD1 3.79Å; W868-L871 HydrophobicContact CB-CG 4Å; W868-L871 HydrophobicContact CD2-CD1 4.02Å; W868-L871 HydrophobicContact CE3-CD1 3.82Å; W868-L871 HydrophobicContact CG-CD1 4.04Å; W868-L871 PolarHBondContact O-N 3.38Å; W868-L871 VanDerWaalsContact O-N 3.1Å
869	P	72.9	Confident	71.5	Confident	61 Å²	61	54.8 Å²	54.8	40%	0.396	28%	0.278	S	S	.	.	H	α-helix	trans	-57.5	-34.6	178.6	23.9	-33.5	0	0	0	112.2	L871 L872 A873 L917	P869-L871 VanDerWaalsContact C-N 3.25Å; P869-L871 PolarHBondContact O-N 2.97Å; P869-L872 PolarHBondContact O-N 3.28Å; P869-L872 VanDerWaalsContact O-N 3.14Å; P869-A873 PolarHBondContact O-N 3.37Å; P869-L917 HydrophobicContact CB-CD1 3.83Å
870	D	79.3	Confident	72.8	Confident	101 Å²	101	53.9 Å²	53.9	54%	0.54	27%	0.27	S	S	.	.	H	α-helix	trans	-57.6	-35.2	177.6	-49.3	-32.2	0	0	0	112.9	W868 A873 E874	W868-D870 PolarHBondContact O-N 2.87Å; D870-A873 PolarHBondContact O-N 2.79Å; D870-E874 WeakPolarHBondContact O-CG 3.47Å; D870-E874 PolarHBondContact O-N 2.93Å
871	L	81.4	Confident	74.8	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-73.5	-32.7	-179.7	-71.1	-179.1	0	0	0	112.5	K800 V803 R804 L807 W868 P869 H875	K800-L871 HydrophobicContact CB-CD1 4.4Å; K800-L871 HydrophobicContact CG-CD1 4.24Å; V803-L871 HydrophobicContact CB-CD1 4.35Å; V803-L871 HydrophobicContact CG1-CD1 3.98Å; R804-L871 HydrophobicContact CB-CD2 4.01Å; L807-L871 HydrophobicContact CD1-CB 3.83Å; W868-L871 HydrophobicContact CB-CB 4.21Å; W868-L871 HydrophobicContact CB-CD1 3.79Å; W868-L871 HydrophobicContact CB-CG 4Å; W868-L871 HydrophobicContact CD2-CD1 4.02Å; W868-L871 HydrophobicContact CE3-CD1 3.82Å; W868-L871 HydrophobicContact CG-CD1 4.04Å; W868-L871 PolarHBondContact O-N 3.38Å; W868-L871 VanDerWaalsContact O-N 3.1Å; P869-L871 VanDerWaalsContact C-N 3.25Å; P869-L871 PolarHBondContact O-N 2.97Å; L871-H875 PolarHBondContact O-N 3.04Å
872	L	81.1	Confident	76.7	Confident	26 Å²	26	51.1 Å²	51.1	14%	0.136	25%	0.251	C	S	.	.	H	α-helix	trans	-73.6	-35.9	173	-80.1	-178.3	0	0	0	111.4	A859 F865 P869 H875 A876	A859-L872 HydrophobicContact CB-CD1 3.48Å; A859-L872 VanDerWaalsContact CB-CD1 3.48Å; F865-L872 HydrophobicContact CB-CD1 3.46Å; F865-L872 VanDerWaalsContact CB-CD1 3.46Å; F865-L872 HydrophobicContact CB-CD2 4.48Å; F865-L872 HydrophobicContact CB-CG 3.83Å; F865-L872 HydrophobicContact CD2-CD1 4.22Å; F865-L872 HydrophobicContact CD2-CD2 4.04Å; F865-L872 HydrophobicContact CD2-CG 4.3Å; F865-L872 HydrophobicContact CE2-CD2 4.44Å; F865-L872 HydrophobicContact CG-CD1 4.05Å; F865-L872 HydrophobicContact CG-CD2 4.2Å; F865-L872 HydrophobicContact CG-CG 4.02Å; P869-L872 PolarHBondContact O-N 3.28Å; P869-L872 VanDerWaalsContact O-N 3.14Å; L872-H875 WeakPolarHBondContact O-CB 3.5Å; L872-H875 PolarHBondContact O-N 3.4Å; L872-A876 WeakPolarHBondContact O-CB 3.34Å; L872-A876 PolarHBondContact O-N 3.24Å
873	A	82.6	Confident	78.7	Confident	17 Å²	17	39.9 Å²	39.9	14%	0.14	21%	0.209	C	C	.	.	H	α-helix	trans	-62	-44.3	170.3	0	0	0	0	0	111.2	P869 D870 H875 A876 E877 L917 L918	P869-A873 PolarHBondContact O-N 3.37Å; D870-A873 PolarHBondContact O-N 2.79Å; A873-H875 VanDerWaalsContact C-N 3.34Å; A873-H875 PolarHBondContact O-N 2.79Å; A873-A876 PolarHBondContact O-N 3.4Å; A873-E877 WeakPolarHBondContact O-CB 3.24Å; A873-E877 WeakPolarHBondContact O-CG 3.48Å; A873-E877 PolarHBondContact O-N 3.29Å; A873-L917 HydrophobicContact CB-CB 3.91Å; A873-L917 HydrophobicContact CB-CD1 4.32Å; A873-L918 HydrophobicContact CB-CD2 4.43Å
874	E	83.9	Confident	80.3	Confident	72 Å²	72	39.7 Å²	39.7	34%	0.336	21%	0.209	S	C	.	.	H	α-helix	trans	-60	-40.5	173	-75.9	-178.5	-158.7	0	0	112.3	R804 D870 K878	R804-E874 WeakPolarHBondContact CD-OE2 3.43Å; R804-E874 WeakPolarHBondContact CG-OE2 3.28Å; R804-E874 IonicContact CZ-OE1 2.74Å; R804-E874 IonicContact CZ-OE2 2.71Å; R804-E874 IonicContact NE-OE1 2.61Å; R804-E874 PolarHBondContact NE-OE1 3.06Å; R804-E874 IonicContact NE-OE2 3.58Å; R804-E874 PolarHBondContact NE-OE2 3.4Å; R804-E874 IonicContact NH2-OE1 3.07Å; R804-E874 PolarHBondContact NH2-OE1 3.45Å; R804-E874 IonicContact NH2-OE2 2.95Å; D870-E874 WeakPolarHBondContact O-CG 3.47Å; D870-E874 PolarHBondContact O-N 2.93Å; E874-K878 VanDerWaalsContact O-CG 3.27Å; E874-K878 WeakPolarHBondContact O-CG 3.16Å; E874-K878 PolarHBondContact O-N 3.43Å
875	H	88	Confident	81.7	Confident	4 Å²	4	43.9 Å²	43.9	2%	0.019	23%	0.234	C	C	.	.	H	α-helix	trans	-61	-47.2	174	172.7	85.9	0	0	0	111.9	L807 A811 L871 L872 A873 K878 F879	L807-H875 HydrophobicContact CB-CB 4.23Å; L807-H875 PolarHBondContact O-ND1 3.29Å; A811-H875 VanDerWaalsContact CA-CE1 3.42Å; A811-H875 WeakPolarHBondContact CA-CE1 3.35Å; A811-H875 PolarHBondContact N-CE1 3.32Å; A811-H875 VanDerWaalsContact N-CE1 3.27Å; L871-H875 PolarHBondContact O-N 3.04Å; L872-H875 WeakPolarHBondContact O-CB 3.5Å; L872-H875 PolarHBondContact O-N 3.4Å; A873-H875 VanDerWaalsContact C-N 3.34Å; A873-H875 PolarHBondContact O-N 2.79Å; H875-K878 PolarHBondContact O-N 2.95Å; H875-F879 WeakPolarHBondContact O-CB 3.33Å; H875-F879 PolarHBondContact O-N 2.93Å
876	A	87.3	Confident	82.8	Confident	9 Å²	9	46 Å²	46	7%	0.074	25%	0.245	C	C	.	.	H	α-helix	trans	-64.5	-42	178.5	0	0	0	0	0	111.6	L851 L872 A873 K878 F879 W880 L918	L851-A876 HydrophobicContact CD1-CB 4.44Å; L851-A876 HydrophobicContact CD2-CB 4.09Å; L872-A876 WeakPolarHBondContact O-CB 3.34Å; L872-A876 PolarHBondContact O-N 3.24Å; A873-A876 PolarHBondContact O-N 3.4Å; A876-K878 VanDerWaalsContact C-N 3.34Å; A876-K878 PolarHBondContact O-N 3.49Å; A876-F879 WeakPolarHBondContact O-CB 3.12Å; A876-F879 PolarHBondContact O-N 3.02Å; A876-F879 VanDerWaalsContact O-N 3.16Å; A876-W880 PolarHBondContact O-N 2.93Å; A876-L918 HydrophobicContact CB-CD1 3.85Å; A876-L918 HydrophobicContact CB-CD2 4.01Å
877	E	88	Confident	84.2	Confident	38 Å²	38	43.7 Å²	43.7	18%	0.178	23%	0.226	C	C	.	.	H	α-helix	trans	-60.4	-40.8	173.8	-77.6	-77	-170.5	0	0	112.4	A873 A881 L918 G921 K922 F923	A873-E877 WeakPolarHBondContact O-CB 3.24Å; A873-E877 WeakPolarHBondContact O-CG 3.48Å; A873-E877 PolarHBondContact O-N 3.29Å; E877-A881 WeakPolarHBondContact O-CB 3.3Å; E877-A881 PolarHBondContact O-N 3.39Å; E877-L918 HydrophobicContact CG-CD2 3.92Å; E877-G921 WeakPolarHBondContact OE1-CA 3.45Å; E877-K922 PolarHBondContact OE1-N 2.73Å; E877-F923 PolarHBondContact OE2-N 2.93Å
878	K	88.9	Confident	85.6	Confident	102 Å²	102	37.3 Å²	37.3	44%	0.443	21%	0.205	S	C	.	.	H	α-helix	trans	-66.8	-38.2	174.3	-71.9	-75.2	-173.2	165.7	0	112.1	E808 A811 E874 H875 A876 A881 L882	E808-K878 HydrophobicContact CG-CG 4.36Å; E808-K878 VanDerWaalsContact OE1-CE 3.26Å; E808-K878 WeakPolarHBondContact OE1-CE 3.42Å; E808-K878 IonicContact OE1-NZ 3.54Å; E808-K878 PolarHBondContact OE1-NZ 3.35Å; A811-K878 HydrophobicContact CB-CB 4.08Å; E874-K878 VanDerWaalsContact O-CG 3.27Å; E874-K878 WeakPolarHBondContact O-CG 3.16Å; E874-K878 PolarHBondContact O-N 3.43Å; H875-K878 PolarHBondContact O-N 2.95Å; A876-K878 VanDerWaalsContact C-N 3.34Å; A876-K878 PolarHBondContact O-N 3.49Å; K878-A881 PolarHBondContact O-N 3.11Å; K878-L882 PolarHBondContact O-N 3.45Å
879	F	89.3	Confident	86.3	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.8	-47.2	176.1	-171.5	-84.3	0	0	0	110.9	A811 N814 Y815 L818 C847 V850 L851 H875 A876 A881 L882 F883	A811-F879 HydrophobicContact CB-CB 4.27Å; N814-F879 HydrophobicContact CB-CD2 4.33Å; N814-F879 HydrophobicContact CB-CE2 3.87Å; Y815-F879 HydrophobicContact CD2-CE1 4.15Å; Y815-F879 HydrophobicContact CD2-CE2 4.21Å; Y815-F879 AromaticContact CD2-CZ 3.94Å; Y815-F879 HydrophobicContact CD2-CZ 3.94Å; L818-F879 HydrophobicContact CD2-CZ 4.03Å; C847-F879 HydrophobicContact CB-CE1 3.77Å; C847-F879 VanDerWaalsContact SG-CE1 3.59Å; V850-F879 HydrophobicContact CG1-CE2 4.32Å; V850-F879 HydrophobicContact CG1-CZ 4.16Å; L851-F879 HydrophobicContact CD1-CD1 4.15Å; L851-F879 HydrophobicContact CD2-CD1 4.3Å; L851-F879 HydrophobicContact CD2-CG 4.31Å; L851-F879 HydrophobicContact CG-CD1 4.31Å; H875-F879 WeakPolarHBondContact O-CB 3.33Å; H875-F879 PolarHBondContact O-N 2.93Å; A876-F879 WeakPolarHBondContact O-CB 3.12Å; A876-F879 PolarHBondContact O-N 3.02Å; A876-F879 VanDerWaalsContact O-N 3.16Å; F879-A881 VanDerWaalsContact C-N 3.33Å; F879-A881 PolarHBondContact O-N 3.23Å; F879-L882 WeakPolarHBondContact O-CB 3.4Å; F879-L882 PolarHBondContact O-N 3.44Å; F879-F883 PolarHBondContact O-N 2.94Å
880	W	90.7	Very high	86.9	Confident	1 Å²	1	36 Å²	36	0%	0.004	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-33.3	175.1	-72	124.5	0	0	0	113.3	C847 I848 L851 A876 L882 F883 T884 L908 F911 F923	C847-W880 HydrophobicContact CB-CH2 3.8Å; C847-W880 HydrophobicContact CB-CZ3 3.88Å; I848-W880 HydrophobicContact CG1-CH2 3.94Å; I848-W880 HydrophobicContact CG1-CZ2 4.27Å; L851-W880 HydrophobicContact CD1-CD2 4.33Å; L851-W880 HydrophobicContact CD1-CH2 4.45Å; L851-W880 HydrophobicContact CD1-CZ2 3.48Å; L851-W880 VanDerWaalsContact CD1-CZ2 3.48Å; L851-W880 VanDerWaalsContact CD1-NE1 3.28Å; A876-W880 PolarHBondContact O-N 2.93Å; W880-L882 VanDerWaalsContact C-N 3.26Å; W880-L882 PolarHBondContact O-N 3.33Å; W880-F883 HydrophobicContact CE3-CB 4.06Å; W880-F883 AromaticContact CE3-CD1 3.76Å; W880-F883 HydrophobicContact CE3-CD1 3.76Å; W880-F883 HydrophobicContact CE3-CG 4.03Å; W880-F883 AromaticContact CZ3-CD1 3.87Å; W880-F883 HydrophobicContact CZ3-CD1 3.87Å; W880-F883 HydrophobicContact CZ3-CE1 4.24Å; W880-F883 HydrophobicContact CZ3-CG 4.11Å; W880-F883 WeakPolarHBondContact O-CB 3.35Å; W880-F883 PolarHBondContact O-N 3.31Å; W880-T884 PolarHBondContact O-N 3.44Å; W880-T884 PolarHBondContact O-OG1 2.94Å; W880-L908 HydrophobicContact CH2-CD2 3.74Å; W880-L908 HydrophobicContact CZ3-CD2 3.71Å; W880-F911 AromaticContact CZ2-CD1 3.95Å; W880-F911 HydrophobicContact CZ2-CD1 3.95Å; W880-F911 AromaticContact CZ2-CE1 3.78Å; W880-F911 HydrophobicContact CZ2-CE1 3.78Å; W880-F923 HydrophobicContact CB-CB 3.81Å; W880-F923 HydrophobicContact CB-CD1 3.75Å; W880-F923 HydrophobicContact CB-CD2 3.94Å; W880-F923 HydrophobicContact CB-CE1 4.28Å; W880-F923 HydrophobicContact CB-CE2 4.44Å; W880-F923 HydrophobicContact CB-CG 3.55Å; W880-F923 AromaticContact CD2-CD1 3.97Å; W880-F923 HydrophobicContact CD2-CD1 3.97Å; W880-F923 AromaticContact CD2-CE1 3.85Å; W880-F923 HydrophobicContact CD2-CE1 3.85Å; W880-F923 HydrophobicContact CD2-CZ 4.45Å; W880-F923 HydrophobicContact CE3-CD1 4.26Å; W880-F923 AromaticContact CE3-CE1 3.7Å; W880-F923 HydrophobicContact CE3-CE1 3.7Å; W880-F923 AromaticContact CE3-CZ 3.92Å; W880-F923 HydrophobicContact CE3-CZ 3.92Å; W880-F923 HydrophobicContact CG-CB 4.47Å; W880-F923 AromaticContact CG-CD1 3.74Å; W880-F923 HydrophobicContact CG-CD1 3.74Å; W880-F923 HydrophobicContact CG-CE1 4.12Å; W880-F923 HydrophobicContact CG-CG 4.08Å; W880-F923 HydrophobicContact CZ3-CE1 4.34Å
881	A	89.3	Confident	87.2	Confident	52 Å²	52	32.4 Å²	32.4	43%	0.43	18%	0.182	S	C	.	.	H	α-helix	trans	-63.3	-31.8	173.6	0	0	0	0	0	112.8	E877 K878 F879	E877-A881 WeakPolarHBondContact O-CB 3.3Å; E877-A881 PolarHBondContact O-N 3.39Å; K878-A881 PolarHBondContact O-N 3.11Å; F879-A881 VanDerWaalsContact C-N 3.33Å; F879-A881 PolarHBondContact O-N 3.23Å
882	L	88.9	Confident	87.4	Confident	55 Å²	55	39.9 Å²	39.9	29%	0.288	22%	0.217	S	C	.	.	H	α-helix	trans	-70.7	-45	172.2	-64.6	170.2	0	0	0	110.8	L812 Y815 K878 F879 W880 T884 V885	L812-L882 HydrophobicContact CB-CD1 4.35Å; L812-L882 HydrophobicContact CD1-CD1 3.99Å; L812-L882 HydrophobicContact CD1-CD2 4.23Å; Y815-L882 HydrophobicContact CD1-CB 3.7Å; Y815-L882 HydrophobicContact CD1-CD1 4.2Å; Y815-L882 HydrophobicContact CD2-CB 4.19Å; Y815-L882 HydrophobicContact CE1-CB 3.96Å; Y815-L882 HydrophobicContact CE2-CB 4.44Å; Y815-L882 HydrophobicContact CG-CB 3.82Å; Y815-L882 HydrophobicContact CG-CD1 4.07Å; K878-L882 PolarHBondContact O-N 3.45Å; F879-L882 WeakPolarHBondContact O-CB 3.4Å; F879-L882 PolarHBondContact O-N 3.44Å; W880-L882 VanDerWaalsContact C-N 3.26Å; W880-L882 PolarHBondContact O-N 3.33Å; L882-T884 PolarHBondContact O-N 3.47Å; L882-V885 PolarHBondContact O-N 3.09Å
883	F	90.4	Very high	87.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59	-34.9	174.8	176.5	-98.6	0	0	0	113.3	Y815 I840 L843 A844 F879 W880 V885 D886 M887 L908 F923	Y815-F883 HydrophobicContact CE2-CB 3.86Å; Y815-F883 HydrophobicContact CE2-CD2 4.41Å; Y815-F883 WeakPolarHBondContact OH-CA 3.34Å; I840-F883 HydrophobicContact CG2-CE2 4.23Å; I840-F883 HydrophobicContact CG2-CZ 3.84Å; L843-F883 HydrophobicContact CB-CE2 4.24Å; L843-F883 HydrophobicContact CD2-CD2 3.83Å; L843-F883 HydrophobicContact CD2-CE2 3.9Å; L843-F883 HydrophobicContact CG-CD2 4.02Å; L843-F883 HydrophobicContact CG-CE2 3.9Å; A844-F883 HydrophobicContact CB-CE2 4.21Å; A844-F883 HydrophobicContact CB-CZ 3.84Å; F879-F883 PolarHBondContact O-N 2.94Å; W880-F883 HydrophobicContact CE3-CB 4.06Å; W880-F883 AromaticContact CE3-CD1 3.76Å; W880-F883 HydrophobicContact CE3-CD1 3.76Å; W880-F883 HydrophobicContact CE3-CG 4.03Å; W880-F883 AromaticContact CZ3-CD1 3.87Å; W880-F883 HydrophobicContact CZ3-CD1 3.87Å; W880-F883 HydrophobicContact CZ3-CE1 4.24Å; W880-F883 HydrophobicContact CZ3-CG 4.11Å; W880-F883 WeakPolarHBondContact O-CB 3.35Å; W880-F883 PolarHBondContact O-N 3.31Å; F883-V885 PolarHBondContact O-N 3.02Å; F883-D886 PolarHBondContact O-N 3.17Å; F883-D886 VanDerWaalsContact O-N 3.15Å; F883-M887 HydrophobicContact CD1-CB 4.21Å; F883-M887 HydrophobicContact CE1-CB 3.81Å; F883-M887 HydrophobicContact CE1-CG 4.1Å; F883-M887 HydrophobicContact CE1-SD 3.91Å; F883-M887 HydrophobicContact CZ-CB 4.2Å; F883-M887 WeakPolarHBondContact O-CB 3.38Å; F883-M887 PolarHBondContact O-N 3.12Å; F883-L908 HydrophobicContact CE1-CD1 4.05Å; F883-L908 HydrophobicContact CE1-CD2 4.44Å; F883-F923 HydrophobicContact CD1-CE2 4.17Å; F883-F923 AromaticContact CD1-CZ 3.85Å; F883-F923 HydrophobicContact CD1-CZ 3.85Å; F883-F923 HydrophobicContact CE1-CZ 4.13Å
884	T	89.9	Confident	87.6	Confident	19 Å²	19	41 Å²	41	12%	0.117	23%	0.225	C	C	.	.	H	α-helix	trans	-55.5	-39.5	-179.6	-57.3	0	0	0	0	112	W880 L882 D886 M887 D888 F923 H926	W880-T884 PolarHBondContact O-N 3.44Å; W880-T884 PolarHBondContact O-OG1 2.94Å; L882-T884 PolarHBondContact O-N 3.47Å; T884-D886 VanDerWaalsContact C-N 3.35Å; T884-D886 PolarHBondContact O-N 3.32Å; T884-M887 PolarHBondContact O-N 3.11Å; T884-D888 WeakPolarHBondContact CG2-OD2 3.4Å; T884-D888 WeakPolarHBondContact O-CB 3.32Å; T884-D888 PolarHBondContact O-N 3.3Å; T884-F923 WeakPolarHBondContact OG1-CD2 3.18Å; T884-F923 VanDerWaalsContact OG1-CE2 3.27Å; T884-F923 WeakPolarHBondContact OG1-CE2 3.24Å; T884-H926 WeakPolarHBondContact CG2-CD2 3.19Å; T884-H926 WeakPolarHBondContact CG2-NE2 3.26Å
885	V	88.2	Confident	87.4	Confident	92 Å²	92	41.5 Å²	41.5	56%	0.558	24%	0.235	S	C	*	.	H	α-helix	trans	-62.6	-43.6	-179	-179.4	0	0	0	0	111.2	L882 F883 T889	L882-V885 PolarHBondContact O-N 3.09Å; F883-V885 PolarHBondContact O-N 3.02Å; V885-T889 WeakPolarHBondContact O-CB 3.49Å; V885-T889 PolarHBondContact O-N 2.94Å; V885-T889 PolarHBondContact O-OG1 3.05Å
886	D	86.8	Confident	86.5	Confident	45 Å²	45	48.2 Å²	48.2	24%	0.241	27%	0.266	C	S	.	.	H	α-helix	trans	-74.8	-37	-179.7	-66.4	-41.6	0	0	0	111.5	Y815 I840 F883 T884 A890	Y815-D886 PolarHBondContact OH-OD2 3.49Å; I840-D886 HydrophobicContact CD1-CB 3.93Å; F883-D886 PolarHBondContact O-N 3.17Å; F883-D886 VanDerWaalsContact O-N 3.15Å; T884-D886 VanDerWaalsContact C-N 3.35Å; T884-D886 PolarHBondContact O-N 3.32Å; D886-A890 WeakPolarHBondContact O-CB 3.16Å; D886-A890 PolarHBondContact O-N 2.91Å; D886-A890 VanDerWaalsContact O-N 3.12Å
887	M	89.3	Confident	85.8	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-53.4	174.2	-176.6	-169.6	75.1	0	0	111.8	F883 T884 T889 A890 L891 L904 L908 F923 L927 I930	F883-M887 HydrophobicContact CD1-CB 4.21Å; F883-M887 HydrophobicContact CE1-CB 3.81Å; F883-M887 HydrophobicContact CE1-CG 4.1Å; F883-M887 HydrophobicContact CE1-SD 3.91Å; F883-M887 HydrophobicContact CZ-CB 4.2Å; F883-M887 WeakPolarHBondContact O-CB 3.38Å; F883-M887 PolarHBondContact O-N 3.12Å; T884-M887 PolarHBondContact O-N 3.11Å; M887-T889 VanDerWaalsContact C-N 3.29Å; M887-T889 PolarHBondContact O-N 3.45Å; M887-A890 PolarHBondContact O-N 3.3Å; M887-L891 HydrophobicContact CE-CD1 4.26Å; M887-L891 HydrophobicContact CG-CD1 3.83Å; M887-L891 HydrophobicContact CG-CG 4.3Å; M887-L891 WeakPolarHBondContact O-CG 3.49Å; M887-L891 PolarHBondContact O-N 3.43Å; M887-L891 HydrophobicContact SD-CD1 4.32Å; M887-L904 HydrophobicContact CG-CD2 4.13Å; M887-L908 HydrophobicContact SD-CD1 4.14Å; M887-F923 HydrophobicContact CE-CE2 4.3Å; M887-F923 HydrophobicContact SD-CE2 4.44Å; M887-F923 HydrophobicContact SD-CZ 4.32Å; M887-L927 HydrophobicContact CE-CD1 4.36Å; M887-L927 HydrophobicContact SD-CD1 4.03Å; M887-I930 HydrophobicContact CE-CD1 4.02Å
888	D	89.6	Confident	85.3	Confident	37 Å²	37	50.9 Å²	50.9	20%	0.198	28%	0.282	C	S	.	.	H	α-helix	trans	-59.7	-43.2	-178	-70.4	-5.7	0	0	0	110.2	T884 A890 L891 E892 H926 I930	T884-D888 WeakPolarHBondContact CG2-OD2 3.4Å; T884-D888 WeakPolarHBondContact O-CB 3.32Å; T884-D888 PolarHBondContact O-N 3.3Å; D888-A890 VanDerWaalsContact C-N 3.3Å; D888-A890 PolarHBondContact O-N 2.78Å; D888-L891 PolarHBondContact O-N 3.28Å; D888-E892 WeakPolarHBondContact O-CB 3.48Å; D888-E892 WeakPolarHBondContact O-CG 3.47Å; D888-E892 PolarHBondContact O-N 2.83Å; D888-H926 IonicContact OD1-CD2 3.5Å; D888-H926 IonicContact OD1-NE2 2.86Å; D888-H926 PolarHBondContact OD1-NE2 3.13Å; D888-H926 VanDerWaalsContact OD1-NE2 3.08Å; D888-H926 IonicContact OD2-CE1 3.48Å; D888-H926 PolarHBondContact OD2-CE1 3.39Å; D888-H926 IonicContact OD2-NE2 2.69Å; D888-H926 PolarHBondContact OD2-NE2 3.44Å; D888-I930 WeakPolarHBondContact OD1-CD1 3.09Å
889	T	86.9	Confident	85	Confident	80 Å²	80	49.2 Å²	49.2	49%	0.491	27%	0.273	S	S	.	.	H	α-helix	trans	-59.9	-38.9	176.1	-57.3	0	0	0	0	112.3	V885 M887 A893	V885-T889 WeakPolarHBondContact O-CB 3.49Å; V885-T889 PolarHBondContact O-N 2.94Å; V885-T889 PolarHBondContact O-OG1 3.05Å; M887-T889 VanDerWaalsContact C-N 3.29Å; M887-T889 PolarHBondContact O-N 3.45Å; T889-A893 PolarHBondContact O-N 2.85Å
890	A	85.7	Confident	84.6	Confident	2 Å²	2	54.4 Å²	54.4	2%	0.017	30%	0.3	C	S	.	.	H	α-helix	trans	-75.3	-34	178.6	0	0	0	0	0	113.1	M828 I840 D886 M887 D888 Q894	M828-A890 HydrophobicContact CE-CB 4.18Å; I840-A890 HydrophobicContact CB-CB 4.43Å; I840-A890 HydrophobicContact CD1-CB 4.43Å; I840-A890 HydrophobicContact CG1-CB 3.5Å; I840-A890 VanDerWaalsContact CG1-CB 3.5Å; D886-A890 WeakPolarHBondContact O-CB 3.16Å; D886-A890 PolarHBondContact O-N 2.91Å; D886-A890 VanDerWaalsContact O-N 3.12Å; M887-A890 PolarHBondContact O-N 3.3Å; D888-A890 VanDerWaalsContact C-N 3.3Å; D888-A890 PolarHBondContact O-N 2.78Å; A890-Q894 WeakPolarHBondContact O-CG 3.38Å; A890-Q894 PolarHBondContact O-NE2 2.85Å
891	L	85.9	Confident	84.4	Confident	24 Å²	24	54.6 Å²	54.6	13%	0.126	30%	0.302	C	S	.	.	H	α-helix	trans	-71.8	-41.8	176.5	-69.1	176.9	0	0	0	111.5	L837 M887 D888 A893 Q894 L904 I930 F931	L837-L891 HydrophobicContact CD1-CD2 4.36Å; M887-L891 HydrophobicContact CE-CD1 4.26Å; M887-L891 HydrophobicContact CG-CD1 3.83Å; M887-L891 HydrophobicContact CG-CG 4.3Å; M887-L891 WeakPolarHBondContact O-CG 3.49Å; M887-L891 PolarHBondContact O-N 3.43Å; M887-L891 HydrophobicContact SD-CD1 4.32Å; D888-L891 PolarHBondContact O-N 3.28Å; L891-A893 PolarHBondContact O-N 3.17Å; L891-Q894 WeakPolarHBondContact O-CB 3.38Å; L891-Q894 PolarHBondContact O-N 3.29Å; L891-Q894 VanDerWaalsContact O-N 3.08Å; L891-L904 HydrophobicContact CD2-CD2 4.42Å; L891-I930 HydrophobicContact CD1-CG2 3.95Å; L891-F931 HydrophobicContact CD1-CE2 4.03Å; L891-F931 HydrophobicContact CD1-CZ 4.21Å; L891-F931 HydrophobicContact CD2-CZ 4.18Å
892	E	85.6	Confident	84.3	Confident	163 Å²	163	52.4 Å²	52.4	76%	0.762	28%	0.282	S	S	*	.	H	α-helix	trans	-62.6	-28.9	174.8	-75	-178.8	178.6	0	0	112.9	D888 Q894	D888-E892 WeakPolarHBondContact O-CB 3.48Å; D888-E892 WeakPolarHBondContact O-CG 3.47Å; D888-E892 PolarHBondContact O-N 2.83Å; E892-Q894 VanDerWaalsContact C-N 3.26Å; E892-Q894 PolarHBondContact O-N 3.47Å
893	A	84.8	Confident	84.3	Confident	40 Å²	40	52.7 Å²	52.7	33%	0.331	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-12.7	176.6	0	0	0	0	0	113.5	K836 T889 L891	K836-A893 HydrophobicContact CD-CB 4.43Å; T889-A893 PolarHBondContact O-N 2.85Å; L891-A893 PolarHBondContact O-N 3.17Å
894	Q	82.6	Confident	84.2	Confident	25 Å²	25	52.7 Å²	52.7	12%	0.117	29%	0.288	C	S	.	.	S	Bend	trans	-77.3	149.3	179.4	-59.8	-48.6	-48.6	0	0	112	P833 A890 L891 E892	P833-Q894 PolarHBondContact O-NE2 3.28Å; A890-Q894 WeakPolarHBondContact O-CG 3.38Å; A890-Q894 PolarHBondContact O-NE2 2.85Å; L891-Q894 WeakPolarHBondContact O-CB 3.38Å; L891-Q894 PolarHBondContact O-N 3.29Å; L891-Q894 VanDerWaalsContact O-N 3.08Å; E892-Q894 VanDerWaalsContact C-N 3.26Å; E892-Q894 PolarHBondContact O-N 3.47Å
895	P	79.6	Confident	84.1	Confident	84 Å²	84	51.8 Å²	51.8	55%	0.545	28%	0.282	S	S	.	.			trans	-57.5	144.8	168.1	-21.4	32.5	0	0	0	111.9	D897 S898	P895-D897 PolarHBondContact O-N 2.88Å; P895-S898 WeakPolarHBondContact O-CB 3.42Å; P895-S898 PolarHBondContact O-N 2.75Å
896	Q	69.3	Low	84	Confident	145 Å²	145	49.9 Å²	49.9	68%	0.678	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-19.8	-178.2	-70.6	-171.1	-9.6	0	0	115.1
897	D	71.9	Confident	84.2	Confident	89 Å²	89	50.2 Å²	50.2	48%	0.476	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	26.6	178.3	-61.3	-53.5	0	0	0	112	P895 R937	P895-D897 PolarHBondContact O-N 2.88Å; D897-R937 VanDerWaalsContact CG-NH2 3.3Å; D897-R937 IonicContact OD1-CZ 2.63Å; D897-R937 IonicContact OD1-NE 3.24Å; D897-R937 PolarHBondContact OD1-NE 3.37Å; D897-R937 IonicContact OD1-NH2 2.92Å; D897-R937 PolarHBondContact OD1-NH2 2.89Å; D897-R937 IonicContact OD2-NH2 3.89Å; D897-R937 PolarHBondContact OD2-NH2 3.46Å
898	S	77.8	Confident	84.1	Confident	14 Å²	14	50.2 Å²	50.2	10%	0.098	27%	0.269	C	S	.	.			trans	-88.3	134.3	169.3	172.5	0	0	0	0	110.4	P895 D900	P895-S898 WeakPolarHBondContact O-CB 3.42Å; P895-S898 PolarHBondContact O-N 2.75Å; S898-D900 PolarHBondContact OG-N 3.46Å; S898-D900 PolarHBondContact OG-OD2 3.41Å
899	W	81.6	Confident	84.1	Confident	67 Å²	67	48.4 Å²	48.4	25%	0.254	26%	0.259	S	S	.	.			trans	-108.4	3.8	178.3	-47.7	115.5	0	0	0	112.3	S901 F902 L934 R937 Y938 L941	W899-S901 PolarHBondContact O-N 3.45Å; W899-S901 VanDerWaalsContact O-N 3.11Å; W899-F902 HydrophobicContact CB-CD2 3.91Å; W899-F902 HydrophobicContact CB-CE2 3.85Å; W899-F902 HydrophobicContact CD2-CE2 4.08Å; W899-F902 AromaticContact CE3-CE2 3.44Å; W899-F902 HydrophobicContact CE3-CE2 3.44Å; W899-F902 VanDerWaalsContact CE3-CE2 3.44Å; W899-F902 AromaticContact CE3-CZ 3.71Å; W899-F902 HydrophobicContact CE3-CZ 3.71Å; W899-F902 HydrophobicContact CG-CE2 4.27Å; W899-F902 HydrophobicContact CZ3-CE2 4.33Å; W899-F902 HydrophobicContact CZ3-CZ 4.19Å; W899-F902 VanDerWaalsContact O-CD2 3.28Å; W899-F902 WeakPolarHBondContact O-CD2 3.17Å; W899-F902 PolarHBondContact O-N 3.38Å; W899-L934 WeakPolarHBondContact CZ3-O 3.44Å; W899-R937 HydrophobicContact CH2-CB 4.41Å; W899-R937 HydrophobicContact CH2-CG 4.22Å; W899-Y938 AromaticContact CD2-CD2 3.44Å; W899-Y938 HydrophobicContact CD2-CD2 3.44Å; W899-Y938 VanDerWaalsContact CD2-CD2 3.44Å; W899-Y938 HydrophobicContact CD2-CE2 4.06Å; W899-Y938 HydrophobicContact CD2-CG 4.32Å; W899-Y938 AromaticContact CE2-CD2 3.49Å; W899-Y938 VanDerWaalsContact CE2-CD2 3.49Å; W899-Y938 AromaticContact CE3-CD2 3.73Å; W899-Y938 HydrophobicContact CE3-CD2 3.73Å; W899-Y938 HydrophobicContact CE3-CG 4.17Å; W899-Y938 AromaticContact CG-CD2 3.93Å; W899-Y938 HydrophobicContact CG-CD2 3.93Å; W899-Y938 HydrophobicContact CG-CE2 4.06Å; W899-Y938 VanDerWaalsContact CH2-CA 3.42Å; W899-Y938 HydrophobicContact CH2-CD2 4.04Å; W899-Y938 HydrophobicContact CH2-CG 4.4Å; W899-Y938 AromaticContact CZ2-CD2 3.8Å; W899-Y938 HydrophobicContact CZ2-CD2 3.8Å; W899-Y938 VanDerWaalsContact CZ3-CB 3.5Å; W899-Y938 HydrophobicContact CZ3-CD2 4.02Å; W899-Y938 HydrophobicContact CZ3-CG 4.22Å; W899-Y938 AromaticContact NE1-CD2 3.96Å; W899-L941 HydrophobicContact CH2-CD1 4.1Å; W899-L941 HydrophobicContact CZ2-CD1 3.7Å
900	D	81.6	Confident	84	Confident	109 Å²	109	47.3 Å²	47.3	58%	0.583	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-10.8	-175	-55.1	-47.9	0	0	0	112	L837 S898 P903	L837-D900 VanDerWaalsContact CD2-C 3.45Å; L837-D900 HydrophobicContact CD2-CB 3.76Å; L837-D900 VanDerWaalsContact CD2-O 3.3Å; L837-D900 WeakPolarHBondContact CD2-O 3.26Å; S898-D900 PolarHBondContact OG-N 3.46Å; S898-D900 PolarHBondContact OG-OD2 3.41Å; D900-P903 VanDerWaalsContact O-CD 3.32Å; D900-P903 WeakPolarHBondContact O-CD 3.41Å
901	S	85.7	Confident	84	Confident	4 Å²	4	48.3 Å²	48.3	3%	0.028	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-12.7	-179.4	59.5	0	0	0	0	114.4	W899 L904 F905 F931	W899-S901 PolarHBondContact O-N 3.45Å; W899-S901 VanDerWaalsContact O-N 3.11Å; S901-L904 WeakPolarHBondContact O-CB 3.21Å; S901-L904 PolarHBondContact O-N 3.15Å; S901-F905 PolarHBondContact O-N 2.91Å; S901-F931 WeakPolarHBondContact O-CE1 3.27Å
902	F	88.2	Confident	84	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-36.3	178.6	-69	-52	0	0	0	115	W899 L904 F905 Q906 F931 L934 V935 Y938 F982 L986	W899-F902 HydrophobicContact CB-CD2 3.91Å; W899-F902 HydrophobicContact CB-CE2 3.85Å; W899-F902 HydrophobicContact CD2-CE2 4.08Å; W899-F902 AromaticContact CE3-CE2 3.44Å; W899-F902 HydrophobicContact CE3-CE2 3.44Å; W899-F902 VanDerWaalsContact CE3-CE2 3.44Å; W899-F902 AromaticContact CE3-CZ 3.71Å; W899-F902 HydrophobicContact CE3-CZ 3.71Å; W899-F902 HydrophobicContact CG-CE2 4.27Å; W899-F902 HydrophobicContact CZ3-CE2 4.33Å; W899-F902 HydrophobicContact CZ3-CZ 4.19Å; W899-F902 VanDerWaalsContact O-CD2 3.28Å; W899-F902 WeakPolarHBondContact O-CD2 3.17Å; W899-F902 PolarHBondContact O-N 3.38Å; F902-L904 PolarHBondContact O-N 3.46Å; F902-F905 WeakPolarHBondContact O-CB 3.2Å; F902-F905 PolarHBondContact O-N 3.09Å; F902-F905 VanDerWaalsContact O-N 3.13Å; F902-Q906 PolarHBondContact O-N 3.44Å; F902-F931 HydrophobicContact CD1-CD1 4.11Å; F902-F931 HydrophobicContact CD1-CE1 4.36Å; F902-F931 HydrophobicContact CE1-CD1 4.28Å; F902-L934 HydrophobicContact CE1-CB 4.35Å; F902-V935 HydrophobicContact CD1-CG2 4.49Å; F902-V935 HydrophobicContact CE1-CG2 3.66Å; F902-V935 HydrophobicContact CZ-CG2 4.31Å; F902-Y938 HydrophobicContact CE2-CD2 4.4Å; F902-Y938 HydrophobicContact CE2-CG 4.22Å; F902-Y938 HydrophobicContact CZ-CG 4.47Å; F902-F982 HydrophobicContact CB-CE2 4.19Å; F902-F982 HydrophobicContact CB-CZ 4.38Å; F902-F982 HydrophobicContact CD1-CZ 4.09Å; F902-F982 AromaticContact CD2-CE2 3.73Å; F902-F982 HydrophobicContact CD2-CE2 3.73Å; F902-F982 AromaticContact CD2-CZ 3.43Å; F902-F982 HydrophobicContact CD2-CZ 3.43Å; F902-F982 VanDerWaalsContact CD2-CZ 3.43Å; F902-F982 HydrophobicContact CE1-CZ 4.2Å; F902-F982 HydrophobicContact CE2-CE1 4.36Å; F902-F982 HydrophobicContact CE2-CE2 4.24Å; F902-F982 AromaticContact CE2-CZ 3.52Å; F902-F982 HydrophobicContact CE2-CZ 3.52Å; F902-F982 AromaticContact CG-CE2 4Å; F902-F982 HydrophobicContact CG-CE2 4Å; F902-F982 AromaticContact CG-CZ 3.73Å; F902-F982 HydrophobicContact CG-CZ 3.73Å; F902-F982 AromaticContact CZ-CZ 3.93Å; F902-F982 HydrophobicContact CZ-CZ 3.93Å; F902-L986 HydrophobicContact CD1-CD2 4.33Å
903	P	88.4	Confident	83.8	Confident	61 Å²	61	43.8 Å²	43.8	40%	0.396	23%	0.229	S	C	.	.	H	α-helix	trans	-56.9	-35.9	172.5	-27.1	36.3	0	0	0	113.3	L841 D900 Q906 L907	L841-P903 HydrophobicContact CD1-CB 3.99Å; D900-P903 VanDerWaalsContact O-CD 3.32Å; D900-P903 WeakPolarHBondContact O-CD 3.41Å; P903-Q906 PolarHBondContact O-N 3.39Å; P903-L907 WeakPolarHBondContact O-CB 3.14Å; P903-L907 PolarHBondContact O-N 3.14Å
904	L	87.8	Confident	83.4	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-64.6	-44	175.7	178.4	64.8	0	0	0	111.1	L837 I840 A844 M887 L891 S901 F902 L907 L908	L837-L904 HydrophobicContact CD1-CD2 4.18Å; I840-L904 HydrophobicContact CG2-CD1 4.06Å; I840-L904 HydrophobicContact CG2-CD2 3.69Å; A844-L904 HydrophobicContact CB-CD1 3.78Å; M887-L904 HydrophobicContact CG-CD2 4.13Å; L891-L904 HydrophobicContact CD2-CD2 4.42Å; S901-L904 WeakPolarHBondContact O-CB 3.21Å; S901-L904 PolarHBondContact O-N 3.15Å; F902-L904 PolarHBondContact O-N 3.46Å; L904-L907 PolarHBondContact O-N 2.85Å; L904-L908 HydrophobicContact CD1-CD1 3.96Å; L904-L908 HydrophobicContact CD1-CG 4.31Å; L904-L908 HydrophobicContact CG-CD1 4.07Å; L904-L908 WeakPolarHBondContact O-CG 3.46Å; L904-L908 PolarHBondContact O-N 3.12Å; L904-L908 VanDerWaalsContact O-N 3.1Å
905	F	88.9	Confident	83.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.9	-47.7	174.2	176.1	-96.4	0	0	0	111.6	S901 F902 L907 L908 N909 L927 F931 L986 W988	S901-F905 PolarHBondContact O-N 2.91Å; F902-F905 WeakPolarHBondContact O-CB 3.2Å; F902-F905 PolarHBondContact O-N 3.09Å; F902-F905 VanDerWaalsContact O-N 3.13Å; F905-L907 PolarHBondContact O-N 3.45Å; F905-L908 PolarHBondContact O-N 3.43Å; F905-N909 HydrophobicContact CD1-CB 4.42Å; F905-N909 HydrophobicContact CE1-CB 4.12Å; F905-N909 HydrophobicContact CE2-CB 4.47Å; F905-N909 HydrophobicContact CZ-CB 4.14Å; F905-N909 WeakPolarHBondContact O-CB 3.28Å; F905-N909 PolarHBondContact O-N 3.32Å; F905-L927 HydrophobicContact CD2-CD1 4.19Å; F905-L927 HydrophobicContact CD2-CD2 3.91Å; F905-L927 HydrophobicContact CD2-CG 3.75Å; F905-L927 HydrophobicContact CE2-CD2 4.12Å; F905-L927 HydrophobicContact CE2-CG 4.02Å; F905-F931 HydrophobicContact CB-CD1 3.82Å; F905-F931 HydrophobicContact CB-CD2 4.15Å; F905-F931 HydrophobicContact CB-CE1 3.73Å; F905-F931 HydrophobicContact CB-CE2 4.07Å; F905-F931 HydrophobicContact CB-CG 4.03Å; F905-F931 HydrophobicContact CB-CZ 3.86Å; F905-F931 HydrophobicContact CD2-CB 3.84Å; F905-F931 HydrophobicContact CD2-CD1 4.29Å; F905-F931 AromaticContact CD2-CD2 3.68Å; F905-F931 HydrophobicContact CD2-CD2 3.68Å; F905-F931 HydrophobicContact CD2-CE2 4.3Å; F905-F931 AromaticContact CD2-CG 3.67Å; F905-F931 HydrophobicContact CD2-CG 3.67Å; F905-F931 HydrophobicContact CE2-CB 4.16Å; F905-F931 HydrophobicContact CE2-CG 4.46Å; F905-F931 HydrophobicContact CG-CB 4.41Å; F905-F931 HydrophobicContact CG-CD1 4.21Å; F905-F931 HydrophobicContact CG-CD2 4.3Å; F905-F931 HydrophobicContact CG-CG 4.05Å; F905-L986 HydrophobicContact CD1-CD2 3.94Å; F905-L986 HydrophobicContact CE1-CB 4.3Å; F905-L986 HydrophobicContact CE1-CD2 4.33Å; F905-L986 WeakPolarHBondContact CE1-O 3.42Å; F905-W988 AromaticContact CE1-CE3 3.99Å; F905-W988 HydrophobicContact CE1-CE3 3.99Å; F905-W988 HydrophobicContact CE1-CZ3 4Å; F905-W988 HydrophobicContact CE2-CH2 4.31Å; F905-W988 AromaticContact CE2-CZ3 3.97Å; F905-W988 HydrophobicContact CE2-CZ3 3.97Å; F905-W988 HydrophobicContact CZ-CD2 4.45Å; F905-W988 AromaticContact CZ-CE3 3.63Å; F905-W988 HydrophobicContact CZ-CE3 3.63Å; F905-W988 HydrophobicContact CZ-CH2 4.16Å; F905-W988 AromaticContact CZ-CZ3 3.47Å; F905-W988 HydrophobicContact CZ-CZ3 3.47Å; F905-W988 VanDerWaalsContact CZ-CZ3 3.47Å
906	Q	86.9	Confident	82.6	Confident	51 Å²	51	50.8 Å²	50.8	24%	0.238	26%	0.261	C	S	.	.	H	α-helix	trans	-59.3	-45.6	179.6	-73.9	178.9	-27.8	0	0	111.8	F902 P903 N910 D985 L986	F902-Q906 PolarHBondContact O-N 3.44Å; P903-Q906 PolarHBondContact O-N 3.39Å; Q906-N910 WeakPolarHBondContact O-CB 3.32Å; Q906-N910 PolarHBondContact O-N 3.36Å; Q906-N910 PolarHBondContact O-ND2 3.22Å; Q906-N910 VanDerWaalsContact O-ND2 3.11Å; Q906-D985 PolarHBondContact NE2-O 2.97Å; Q906-L986 HydrophobicContact CG-CD2 4.04Å
907	L	89.2	Confident	82.8	Confident	52 Å²	52	47.7 Å²	47.7	27%	0.272	25%	0.249	S	C	.	.	H	α-helix	trans	-58.4	-52.5	177.9	178.5	65.9	0	0	0	111.5	L841 A844 E845 I848 P903 L904 F905 F911	L841-L907 HydrophobicContact CG-CD2 4.41Å; A844-L907 HydrophobicContact CB-CD2 3.99Å; E845-L907 HydrophobicContact CG-CD2 3.69Å; I848-L907 HydrophobicContact CD1-CD1 4.01Å; I848-L907 HydrophobicContact CD1-CD2 4.33Å; I848-L907 HydrophobicContact CD1-CG 3.81Å; P903-L907 WeakPolarHBondContact O-CB 3.14Å; P903-L907 PolarHBondContact O-N 3.14Å; L904-L907 PolarHBondContact O-N 2.85Å; F905-L907 PolarHBondContact O-N 3.45Å; L907-F911 PolarHBondContact O-N 2.93Å
908	L	88.8	Confident	83.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-67.8	-43.3	-177.9	-68	172.5	0	0	0	112	A844 W880 F883 M887 L904 F905 F911 L912 F923 L927	A844-L908 HydrophobicContact CB-CD2 4.02Å; W880-L908 HydrophobicContact CH2-CD2 3.74Å; W880-L908 HydrophobicContact CZ3-CD2 3.71Å; F883-L908 HydrophobicContact CE1-CD1 4.05Å; F883-L908 HydrophobicContact CE1-CD2 4.44Å; M887-L908 HydrophobicContact SD-CD1 4.14Å; L904-L908 HydrophobicContact CD1-CD1 3.96Å; L904-L908 HydrophobicContact CD1-CG 4.31Å; L904-L908 HydrophobicContact CG-CD1 4.07Å; L904-L908 WeakPolarHBondContact O-CG 3.46Å; L904-L908 PolarHBondContact O-N 3.12Å; L904-L908 VanDerWaalsContact O-N 3.1Å; F905-L908 PolarHBondContact O-N 3.43Å; L908-F911 PolarHBondContact O-N 2.84Å; L908-L912 WeakPolarHBondContact O-CB 3.32Å; L908-L912 VanDerWaalsContact O-CG 3.26Å; L908-L912 WeakPolarHBondContact O-CG 3.38Å; L908-L912 PolarHBondContact O-N 3.48Å; L908-F923 HydrophobicContact CD1-CZ 4.21Å; L908-L927 HydrophobicContact CB-CD2 3.76Å; L908-L927 HydrophobicContact CD1-CD1 4.04Å; L908-L927 HydrophobicContact CD1-CD2 4.37Å
909	N	88.4	Confident	83.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65	-42.4	179.4	-176.5	37.3	0	0	0	111.8	F905 F911 L912 R913 H924 L986 H987 P989	F905-N909 HydrophobicContact CD1-CB 4.42Å; F905-N909 HydrophobicContact CE1-CB 4.12Å; F905-N909 HydrophobicContact CE2-CB 4.47Å; F905-N909 HydrophobicContact CZ-CB 4.14Å; F905-N909 WeakPolarHBondContact O-CB 3.28Å; F905-N909 PolarHBondContact O-N 3.32Å; N909-F911 VanDerWaalsContact C-N 3.28Å; N909-F911 PolarHBondContact O-N 2.97Å; N909-L912 PolarHBondContact O-N 3.37Å; N909-R913 WeakPolarHBondContact O-CB 3.46Å; N909-R913 PolarHBondContact O-N 2.93Å; N909-H924 PolarHBondContact OD1-NE2 3.44Å; N909-H924 VanDerWaalsContact OD1-NE2 3.1Å; N909-L986 PolarHBondContact ND2-O 3.48Å; N909-H987 PolarHBondContact ND2-O 2.93Å; N909-P989 WeakPolarHBondContact OD1-CG 3.33Å
910	N	86.2	Confident	83.2	Confident	56 Å²	56	45.6 Å²	45.6	30%	0.299	25%	0.245	S	C	.	.	H	α-helix	trans	-62.4	-36.6	176.7	-73.4	-21.2	0	0	0	112.2	Q906 R913 N914	Q906-N910 WeakPolarHBondContact O-CB 3.32Å; Q906-N910 PolarHBondContact O-N 3.36Å; Q906-N910 PolarHBondContact O-ND2 3.22Å; Q906-N910 VanDerWaalsContact O-ND2 3.11Å; N910-R913 PolarHBondContact OD1-NH2 3.27Å; N910-N914 PolarHBondContact O-ND2 3.47Å
911	F	84.9	Confident	83.2	Confident	24 Å²	24	41.1 Å²	41.1	11%	0.105	22%	0.224	C	C	.	.	H	α-helix	trans	-68.7	-54.3	174.1	175.9	-106.6	0	0	0	111.9	I848 L851 Q852 W880 L907 L908 N909 R913 N914	I848-F911 HydrophobicContact CB-CD2 4.44Å; I848-F911 HydrophobicContact CD1-CB 3.89Å; I848-F911 HydrophobicContact CD1-CG 4.14Å; I848-F911 HydrophobicContact CG1-CB 4.16Å; I848-F911 HydrophobicContact CG1-CD1 3.98Å; I848-F911 HydrophobicContact CG1-CD2 4.26Å; I848-F911 HydrophobicContact CG1-CE1 4.49Å; I848-F911 HydrophobicContact CG1-CG 3.84Å; I848-F911 HydrophobicContact CG2-CD2 3.53Å; I848-F911 HydrophobicContact CG2-CE2 3.83Å; I848-F911 HydrophobicContact CG2-CG 4Å; L851-F911 HydrophobicContact CB-CZ 4.34Å; L851-F911 HydrophobicContact CD1-CE1 4.46Å; Q852-F911 HydrophobicContact CG-CE2 3.7Å; Q852-F911 HydrophobicContact CG-CZ 4.47Å; W880-F911 AromaticContact CZ2-CD1 3.95Å; W880-F911 HydrophobicContact CZ2-CD1 3.95Å; W880-F911 AromaticContact CZ2-CE1 3.78Å; W880-F911 HydrophobicContact CZ2-CE1 3.78Å; L907-F911 PolarHBondContact O-N 2.93Å; L908-F911 PolarHBondContact O-N 2.84Å; N909-F911 VanDerWaalsContact C-N 3.28Å; N909-F911 PolarHBondContact O-N 2.97Å; F911-R913 VanDerWaalsContact C-N 3.34Å; F911-R913 PolarHBondContact O-N 2.94Å; F911-N914 PolarHBondContact O-N 2.83Å
912	L	85.4	Confident	83.2	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-66.3	-33.1	-173	-68	168.5	0	0	0	113.5	L908 N909 N914 D915 L918 C919 F923 H924 L927	L908-L912 WeakPolarHBondContact O-CB 3.32Å; L908-L912 VanDerWaalsContact O-CG 3.26Å; L908-L912 WeakPolarHBondContact O-CG 3.38Å; L908-L912 PolarHBondContact O-N 3.48Å; N909-L912 PolarHBondContact O-N 3.37Å; L912-N914 VanDerWaalsContact C-N 3.31Å; L912-N914 PolarHBondContact O-N 2.88Å; L912-D915 PolarHBondContact O-N 2.84Å; L912-L918 HydrophobicContact CD2-CB 3.96Å; L912-L918 HydrophobicContact CD2-CD1 4.31Å; L912-C919 PolarHBondContact O-N 3.39Å; L912-F923 HydrophobicContact CD1-CD1 3.79Å; L912-F923 HydrophobicContact CD1-CE1 3.96Å; L912-F923 HydrophobicContact CD2-CD1 4.5Å; L912-H924 HydrophobicContact CD1-CB 4.15Å; L912-L927 HydrophobicContact CD1-CD2 4.44Å
913	R	81.4	Confident	83.2	Confident	90 Å²	90	49.4 Å²	49.4	34%	0.34	26%	0.26	S	S	.	.	H	α-helix	trans	-69.3	-28.3	179.4	177.1	171.9	48.9	137.4	-1.8	113.4	N909 N910 F911 D915 H987	N909-R913 WeakPolarHBondContact O-CB 3.46Å; N909-R913 PolarHBondContact O-N 2.93Å; N910-R913 PolarHBondContact OD1-NH2 3.27Å; F911-R913 VanDerWaalsContact C-N 3.34Å; F911-R913 PolarHBondContact O-N 2.94Å; R913-D915 VanDerWaalsContact C-N 3.3Å; R913-H987 VanDerWaalsContact NH1-CB 3.32Å; R913-H987 PolarHBondContact NH1-CD2 3.27Å; R913-H987 PolarHBondContact NH2-CD2 3.25Å; R913-H987 PolarHBondContact NH2-ND1 3.35Å
914	N	76.9	Confident	83.1	Confident	133 Å²	133	46.5 Å²	46.5	71%	0.711	24%	0.241	S	C	*	.	H	α-helix	trans	-76.8	-20.3	177.6	-69.9	-22.5	0	0	0	112.2	N910 F911 L912	N910-N914 PolarHBondContact O-ND2 3.47Å; F911-N914 PolarHBondContact O-N 2.83Å; L912-N914 VanDerWaalsContact C-N 3.31Å; L912-N914 PolarHBondContact O-N 2.88Å
915	D	76.4	Confident	83.1	Confident	31 Å²	31	51.5 Å²	51.5	17%	0.166	26%	0.263	C	S	.	.			trans	-91.8	120	179.2	-172.6	-26	0	0	0	111.3	L912 R913 L917 L918 C919	L912-D915 PolarHBondContact O-N 2.84Å; R913-D915 VanDerWaalsContact C-N 3.3Å; D915-L917 VanDerWaalsContact C-N 3.27Å; D915-L917 PolarHBondContact O-N 2.9Å; D915-L917 PolarHBondContact OD1-N 3.42Å; D915-L918 HydrophobicContact CB-CB 4.17Å; D915-L918 PolarHBondContact OD1-N 3.04Å; D915-L918 VanDerWaalsContact OD2-CD1 3.28Å; D915-L918 WeakPolarHBondContact OD2-CD1 3.41Å; D915-L918 WeakPolarHBondContact OD2-CG 3.42Å; D915-C919 WeakPolarHBondContact O-CB 3.47Å; D915-C919 PolarHBondContact O-N 3.27Å
916	T	68.8	Low	83.1	Confident	131 Å²	131	54.2 Å²	54.2	80%	0.804	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-23.9	-179.2	57.8	0	0	0	0	115
917	L	73.9	Confident	83.2	Confident	81 Å²	81	51.8 Å²	51.8	42%	0.424	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-28.3	-174.8	-64.5	169.4	0	0	0	112.7	P869 A873 D915	P869-L917 HydrophobicContact CB-CD1 3.83Å; A873-L917 HydrophobicContact CB-CB 3.91Å; A873-L917 HydrophobicContact CB-CD1 4.32Å; D915-L917 VanDerWaalsContact C-N 3.27Å; D915-L917 PolarHBondContact O-N 2.9Å; D915-L917 PolarHBondContact OD1-N 3.42Å
918	L	79.1	Confident	83	Confident	6 Å²	6	49.5 Å²	49.5	3%	0.031	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-18.1	178.6	-62.1	179.5	0	0	0	113.2	A873 A876 E877 L912 D915 N920 G921	A873-L918 HydrophobicContact CB-CD2 4.43Å; A876-L918 HydrophobicContact CB-CD1 3.85Å; A876-L918 HydrophobicContact CB-CD2 4.01Å; E877-L918 HydrophobicContact CG-CD2 3.92Å; L912-L918 HydrophobicContact CD2-CB 3.96Å; L912-L918 HydrophobicContact CD2-CD1 4.31Å; D915-L918 HydrophobicContact CB-CB 4.17Å; D915-L918 PolarHBondContact OD1-N 3.04Å; D915-L918 VanDerWaalsContact OD2-CD1 3.28Å; D915-L918 WeakPolarHBondContact OD2-CD1 3.41Å; D915-L918 WeakPolarHBondContact OD2-CG 3.42Å; L918-N920 PolarHBondContact O-N 3.41Å; L918-G921 PolarHBondContact O-N 2.84Å
919	C	80.3	Confident	83	Confident	45 Å²	45	56.1 Å²	56.1	30%	0.304	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	122.1	174.4	-174.9	0	0	0	0	110.6	L912 D915 G921	L912-C919 PolarHBondContact O-N 3.39Å; D915-C919 WeakPolarHBondContact O-CB 3.47Å; D915-C919 PolarHBondContact O-N 3.27Å; C919-G921 PolarHBondContact O-N 3.44Å
920	N	79.1	Confident	83	Confident	74 Å²	74	58.2 Å²	58.2	40%	0.396	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	22.9	-175.5	-59.3	-35.1	0	0	0	114.2	L918 H924 K925 Q928	L918-N920 PolarHBondContact O-N 3.41Å; N920-H924 PolarHBondContact N-ND1 3.1Å; N920-H924 PolarHBondContact OD1-ND1 3.41Å; N920-K925 WeakPolarHBondContact O-CE 3.35Å; N920-Q928 PolarHBondContact OD1-NE2 3.48Å
921	G	82.4	Confident	83.1	Confident	15 Å²	15	55.5 Å²	55.5	16%	0.155	28%	0.279	C	S	.	.			trans	-65.7	-174.9	166.9	0	0	0	0	0	113.5	E877 L918 C919 H924 K925	E877-G921 WeakPolarHBondContact OE1-CA 3.45Å; L918-G921 PolarHBondContact O-N 2.84Å; C919-G921 PolarHBondContact O-N 3.44Å; G921-H924 PolarHBondContact O-N 3.14Å; G921-K925 WeakPolarHBondContact O-CG 3.41Å; G921-K925 PolarHBondContact O-N 2.83Å; G921-K925 VanDerWaalsContact O-N 3.13Å
922	K	85.7	Confident	83.3	Confident	177 Å²	177	56.3 Å²	56.3	77%	0.77	29%	0.286	S	S	*	.	H	α-helix	trans	-67.7	-46.9	-174.3	-69	178.9	-178.5	173.6	0	111.3	E877 K925 H926	E877-K922 PolarHBondContact OE1-N 2.73Å; K922-K925 PolarHBondContact O-N 3.41Å; K922-H926 PolarHBondContact O-N 2.97Å; K922-H926 VanDerWaalsContact O-N 3.11Å
923	F	87.6	Confident	83.4	Confident	7 Å²	7	59.8 Å²	59.8	3%	0.031	31%	0.309	C	S	.	.	H	α-helix	trans	-63.6	-41.4	176.4	178	-113.1	0	0	0	112.3	E877 W880 F883 T884 M887 L908 L912 K925 H926 L927	E877-F923 PolarHBondContact OE2-N 2.93Å; W880-F923 HydrophobicContact CB-CB 3.81Å; W880-F923 HydrophobicContact CB-CD1 3.75Å; W880-F923 HydrophobicContact CB-CD2 3.94Å; W880-F923 HydrophobicContact CB-CE1 4.28Å; W880-F923 HydrophobicContact CB-CE2 4.44Å; W880-F923 HydrophobicContact CB-CG 3.55Å; W880-F923 AromaticContact CD2-CD1 3.97Å; W880-F923 HydrophobicContact CD2-CD1 3.97Å; W880-F923 AromaticContact CD2-CE1 3.85Å; W880-F923 HydrophobicContact CD2-CE1 3.85Å; W880-F923 HydrophobicContact CD2-CZ 4.45Å; W880-F923 HydrophobicContact CE3-CD1 4.26Å; W880-F923 AromaticContact CE3-CE1 3.7Å; W880-F923 HydrophobicContact CE3-CE1 3.7Å; W880-F923 AromaticContact CE3-CZ 3.92Å; W880-F923 HydrophobicContact CE3-CZ 3.92Å; W880-F923 HydrophobicContact CG-CB 4.47Å; W880-F923 AromaticContact CG-CD1 3.74Å; W880-F923 HydrophobicContact CG-CD1 3.74Å; W880-F923 HydrophobicContact CG-CE1 4.12Å; W880-F923 HydrophobicContact CG-CG 4.08Å; W880-F923 HydrophobicContact CZ3-CE1 4.34Å; F883-F923 HydrophobicContact CD1-CE2 4.17Å; F883-F923 AromaticContact CD1-CZ 3.85Å; F883-F923 HydrophobicContact CD1-CZ 3.85Å; F883-F923 HydrophobicContact CE1-CZ 4.13Å; T884-F923 WeakPolarHBondContact OG1-CD2 3.18Å; T884-F923 VanDerWaalsContact OG1-CE2 3.27Å; T884-F923 WeakPolarHBondContact OG1-CE2 3.24Å; M887-F923 HydrophobicContact CE-CE2 4.3Å; M887-F923 HydrophobicContact SD-CE2 4.44Å; M887-F923 HydrophobicContact SD-CZ 4.32Å; L908-F923 HydrophobicContact CD1-CZ 4.21Å; L912-F923 HydrophobicContact CD1-CD1 3.79Å; L912-F923 HydrophobicContact CD1-CE1 3.96Å; L912-F923 HydrophobicContact CD2-CD1 4.5Å; F923-K925 VanDerWaalsContact C-N 3.31Å; F923-K925 PolarHBondContact O-N 3.32Å; F923-H926 PolarHBondContact O-N 3.32Å; F923-L927 WeakPolarHBondContact O-CB 3.39Å; F923-L927 PolarHBondContact O-N 3.3Å
924	H	87.7	Confident	83.7	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-39.2	-179.9	-166.2	-151.2	0	0	0	112.3	N909 L912 N920 G921 L927 Q928 P989	N909-H924 PolarHBondContact OD1-NE2 3.44Å; N909-H924 VanDerWaalsContact OD1-NE2 3.1Å; L912-H924 HydrophobicContact CD1-CB 4.15Å; N920-H924 PolarHBondContact N-ND1 3.1Å; N920-H924 PolarHBondContact OD1-ND1 3.41Å; G921-H924 PolarHBondContact O-N 3.14Å; H924-L927 PolarHBondContact O-N 3.16Å; H924-Q928 PolarHBondContact CE1-NE2 3.07Å; H924-Q928 PolarHBondContact ND1-NE2 3.36Å; H924-Q928 VanDerWaalsContact O-CG 3.26Å; H924-Q928 WeakPolarHBondContact O-CG 3.32Å; H924-Q928 PolarHBondContact O-N 3.15Å; H924-Q928 PolarHBondContact O-NE2 2.84Å; H924-P989 VanDerWaalsContact CE1-CB 3.48Å; H924-P989 WeakPolarHBondContact CE1-CB 3.38Å; H924-P989 WeakPolarHBondContact CE1-CG 3.4Å; H924-P989 WeakPolarHBondContact NE2-CG 3.33Å
925	K	86.5	Confident	84.2	Confident	105 Å²	105	51.3 Å²	51.3	46%	0.457	27%	0.27	S	S	.	.	H	α-helix	trans	-67.6	-42.9	174.5	-72.3	-178.4	178.2	-174	0	112.6	N920 G921 K922 F923 L927 Q928 E929	N920-K925 WeakPolarHBondContact O-CE 3.35Å; G921-K925 WeakPolarHBondContact O-CG 3.41Å; G921-K925 PolarHBondContact O-N 2.83Å; G921-K925 VanDerWaalsContact O-N 3.13Å; K922-K925 PolarHBondContact O-N 3.41Å; F923-K925 VanDerWaalsContact C-N 3.31Å; F923-K925 PolarHBondContact O-N 3.32Å; K925-L927 VanDerWaalsContact C-N 3.3Å; K925-L927 PolarHBondContact O-N 3.49Å; K925-Q928 WeakPolarHBondContact O-CB 3.28Å; K925-Q928 PolarHBondContact O-N 3.48Å; K925-Q928 VanDerWaalsContact O-N 3.15Å; K925-E929 WeakPolarHBondContact O-CG 3.27Å; K925-E929 PolarHBondContact O-N 2.85Å
926	H	89	Confident	84.7	Confident	57 Å²	57	51.7 Å²	51.7	26%	0.264	27%	0.273	S	S	.	.	H	α-helix	trans	-58.4	-43.5	174.4	-177.8	73.9	0	0	0	111.7	T884 D888 K922 F923 Q928 E929 I930	T884-H926 WeakPolarHBondContact CG2-CD2 3.19Å; T884-H926 WeakPolarHBondContact CG2-NE2 3.26Å; D888-H926 IonicContact OD1-CD2 3.5Å; D888-H926 IonicContact OD1-NE2 2.86Å; D888-H926 PolarHBondContact OD1-NE2 3.13Å; D888-H926 VanDerWaalsContact OD1-NE2 3.08Å; D888-H926 IonicContact OD2-CE1 3.48Å; D888-H926 PolarHBondContact OD2-CE1 3.39Å; D888-H926 IonicContact OD2-NE2 2.69Å; D888-H926 PolarHBondContact OD2-NE2 3.44Å; K922-H926 PolarHBondContact O-N 2.97Å; K922-H926 VanDerWaalsContact O-N 3.11Å; F923-H926 PolarHBondContact O-N 3.32Å; H926-Q928 VanDerWaalsContact C-N 3.34Å; H926-Q928 PolarHBondContact O-N 2.9Å; H926-E929 PolarHBondContact O-N 3.03Å; H926-I930 WeakPolarHBondContact NE2-CD1 3.24Å; H926-I930 WeakPolarHBondContact O-CG1 3.43Å; H926-I930 PolarHBondContact O-N 3.47Å; H926-I930 VanDerWaalsContact O-N 3.13Å
927	L	88.5	Confident	85.6	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.7	-43.9	174.8	-175.3	70	0	0	0	111.5	M887 F905 L908 L912 F923 H924 K925 F931	M887-L927 HydrophobicContact CE-CD1 4.36Å; M887-L927 HydrophobicContact SD-CD1 4.03Å; F905-L927 HydrophobicContact CD2-CD1 4.19Å; F905-L927 HydrophobicContact CD2-CD2 3.91Å; F905-L927 HydrophobicContact CD2-CG 3.75Å; F905-L927 HydrophobicContact CE2-CD2 4.12Å; F905-L927 HydrophobicContact CE2-CG 4.02Å; L908-L927 HydrophobicContact CB-CD2 3.76Å; L908-L927 HydrophobicContact CD1-CD1 4.04Å; L908-L927 HydrophobicContact CD1-CD2 4.37Å; L912-L927 HydrophobicContact CD1-CD2 4.44Å; F923-L927 WeakPolarHBondContact O-CB 3.39Å; F923-L927 PolarHBondContact O-N 3.3Å; H924-L927 PolarHBondContact O-N 3.16Å; K925-L927 VanDerWaalsContact C-N 3.3Å; K925-L927 PolarHBondContact O-N 3.49Å; L927-F931 HydrophobicContact CD1-CD2 3.75Å; L927-F931 HydrophobicContact CD1-CE2 3.58Å; L927-F931 HydrophobicContact CG-CD2 4.3Å; L927-F931 WeakPolarHBondContact O-CD2 3.5Å; L927-F931 PolarHBondContact O-N 3.25Å
928	Q	86.9	Confident	86.3	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.019	24%	0.239	C	C	.	.	H	α-helix	trans	-62	-49.5	175.6	-69.1	165.3	33.2	0	0	111.2	N920 H924 K925 H926 I930 F931 V932 W988 P989 E990	N920-Q928 PolarHBondContact OD1-NE2 3.48Å; H924-Q928 PolarHBondContact CE1-NE2 3.07Å; H924-Q928 PolarHBondContact ND1-NE2 3.36Å; H924-Q928 VanDerWaalsContact O-CG 3.26Å; H924-Q928 WeakPolarHBondContact O-CG 3.32Å; H924-Q928 PolarHBondContact O-N 3.15Å; H924-Q928 PolarHBondContact O-NE2 2.84Å; K925-Q928 WeakPolarHBondContact O-CB 3.28Å; K925-Q928 PolarHBondContact O-N 3.48Å; K925-Q928 VanDerWaalsContact O-N 3.15Å; H926-Q928 VanDerWaalsContact C-N 3.34Å; H926-Q928 PolarHBondContact O-N 2.9Å; Q928-I930 VanDerWaalsContact C-N 3.25Å; Q928-I930 PolarHBondContact O-N 3.42Å; Q928-F931 PolarHBondContact O-N 3.24Å; Q928-F931 VanDerWaalsContact O-N 3.12Å; Q928-V932 VanDerWaalsContact O-CG2 3.26Å; Q928-V932 WeakPolarHBondContact O-CG2 3.4Å; Q928-V932 PolarHBondContact O-N 3.47Å; Q928-W988 HydrophobicContact CB-CH2 4.43Å; Q928-W988 HydrophobicContact CB-CZ2 3.92Å; Q928-W988 HydrophobicContact CG-CZ2 4.07Å; Q928-P989 HydrophobicContact CG-CG 4.4Å; Q928-E990 VanDerWaalsContact OE1-CG 3.29Å; Q928-E990 PolarHBondContact OE1-OE1 3.12Å
929	E	88.3	Confident	86.7	Confident	139 Å²	139	47.6 Å²	47.6	65%	0.65	24%	0.238	S	C	*	.	H	α-helix	trans	-56.1	-36.8	-179.1	-73.8	174.3	-167.7	0	0	113	K925 H926 P933	K925-E929 WeakPolarHBondContact O-CG 3.27Å; K925-E929 PolarHBondContact O-N 2.85Å; H926-E929 PolarHBondContact O-N 3.03Å; E929-P933 VanDerWaalsContact O-CD 3.26Å; E929-P933 WeakPolarHBondContact O-CD 3.49Å
930	I	88.2	Confident	87.1	Confident	44 Å²	44	48.5 Å²	48.5	23%	0.226	24%	0.239	C	C	.	.	H	α-helix	trans	-72.4	-44.2	176.7	-68.9	173.3	0	0	0	112	M887 D888 L891 H926 Q928 P933	M887-I930 HydrophobicContact CE-CD1 4.02Å; D888-I930 WeakPolarHBondContact OD1-CD1 3.09Å; L891-I930 HydrophobicContact CD1-CG2 3.95Å; H926-I930 WeakPolarHBondContact NE2-CD1 3.24Å; H926-I930 WeakPolarHBondContact O-CG1 3.43Å; H926-I930 PolarHBondContact O-N 3.47Å; H926-I930 VanDerWaalsContact O-N 3.13Å; Q928-I930 VanDerWaalsContact C-N 3.25Å; Q928-I930 PolarHBondContact O-N 3.42Å; I930-P933 WeakPolarHBondContact O-CD 3.41Å; I930-P933 WeakPolarHBondContact O-CG 3.26Å
931	F	88.6	Confident	87.5	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-86.1	-20.9	-172.3	-79.9	-89.1	0	0	0	114.1	L891 S901 F902 F905 L927 Q928 L934 V935 W988	L891-F931 HydrophobicContact CD1-CE2 4.03Å; L891-F931 HydrophobicContact CD1-CZ 4.21Å; L891-F931 HydrophobicContact CD2-CZ 4.18Å; S901-F931 WeakPolarHBondContact O-CE1 3.27Å; F902-F931 HydrophobicContact CD1-CD1 4.11Å; F902-F931 HydrophobicContact CD1-CE1 4.36Å; F902-F931 HydrophobicContact CE1-CD1 4.28Å; F905-F931 HydrophobicContact CB-CD1 3.82Å; F905-F931 HydrophobicContact CB-CD2 4.15Å; F905-F931 HydrophobicContact CB-CE1 3.73Å; F905-F931 HydrophobicContact CB-CE2 4.07Å; F905-F931 HydrophobicContact CB-CG 4.03Å; F905-F931 HydrophobicContact CB-CZ 3.86Å; F905-F931 HydrophobicContact CD2-CB 3.84Å; F905-F931 HydrophobicContact CD2-CD1 4.29Å; F905-F931 AromaticContact CD2-CD2 3.68Å; F905-F931 HydrophobicContact CD2-CD2 3.68Å; F905-F931 HydrophobicContact CD2-CE2 4.3Å; F905-F931 AromaticContact CD2-CG 3.67Å; F905-F931 HydrophobicContact CD2-CG 3.67Å; F905-F931 HydrophobicContact CE2-CB 4.16Å; F905-F931 HydrophobicContact CE2-CG 4.46Å; F905-F931 HydrophobicContact CG-CB 4.41Å; F905-F931 HydrophobicContact CG-CD1 4.21Å; F905-F931 HydrophobicContact CG-CD2 4.3Å; F905-F931 HydrophobicContact CG-CG 4.05Å; L927-F931 HydrophobicContact CD1-CD2 3.75Å; L927-F931 HydrophobicContact CD1-CE2 3.58Å; L927-F931 HydrophobicContact CG-CD2 4.3Å; L927-F931 WeakPolarHBondContact O-CD2 3.5Å; L927-F931 PolarHBondContact O-N 3.25Å; Q928-F931 PolarHBondContact O-N 3.24Å; Q928-F931 VanDerWaalsContact O-N 3.12Å; F931-L934 HydrophobicContact CD1-CD1 3.97Å; F931-L934 HydrophobicContact CE1-CD1 4.2Å; F931-L934 PolarHBondContact O-N 3.11Å; F931-V935 WeakPolarHBondContact O-CG2 3.46Å; F931-V935 PolarHBondContact O-N 3.36Å; F931-W988 HydrophobicContact CB-CH2 4.3Å; F931-W988 HydrophobicContact CB-CZ3 4.39Å
932	V	88.6	Confident	87.7	Confident	40 Å²	40	49.9 Å²	49.9	24%	0.242	24%	0.242	C	C	.	.	H	α-helix	trans	-49.7	-57.1	173.5	165.2	0	0	0	0	112.3	Q928 L934 V935 V936 W988 F993	Q928-V932 VanDerWaalsContact O-CG2 3.26Å; Q928-V932 WeakPolarHBondContact O-CG2 3.4Å; Q928-V932 PolarHBondContact O-N 3.47Å; V932-L934 VanDerWaalsContact C-N 3.27Å; V932-L934 PolarHBondContact O-N 3Å; V932-V935 PolarHBondContact O-N 3.16Å; V932-V936 WeakPolarHBondContact O-CG2 3.3Å; V932-V936 PolarHBondContact O-N 3.49Å; V932-W988 HydrophobicContact CB-CH2 4.39Å; V932-W988 HydrophobicContact CB-CZ2 4.47Å; V932-W988 HydrophobicContact CG2-CH2 3.58Å; V932-W988 HydrophobicContact CG2-CZ2 3.26Å; V932-F993 HydrophobicContact CB-CZ 4.39Å; V932-F993 HydrophobicContact CG1-CE2 3.97Å; V932-F993 HydrophobicContact CG1-CZ 3.86Å; V932-F993 HydrophobicContact CG2-CE1 4.16Å; V932-F993 HydrophobicContact CG2-CZ 4.19Å
933	P	87.9	Confident	87.8	Confident	76 Å²	76	44.2 Å²	44.2	49%	0.494	22%	0.218	S	C	.	.	H	α-helix	trans	-65.2	-29.9	-178.2	24.9	-34.8	0	0	0	112.9	E929 I930 R937	E929-P933 VanDerWaalsContact O-CD 3.26Å; E929-P933 WeakPolarHBondContact O-CD 3.49Å; I930-P933 WeakPolarHBondContact O-CD 3.41Å; I930-P933 WeakPolarHBondContact O-CG 3.26Å; P933-R937 VanDerWaalsContact O-CB 3.3Å; P933-R937 WeakPolarHBondContact O-CB 3.42Å; P933-R937 PolarHBondContact O-N 3.06Å
934	L	86.8	Confident	87.8	Confident	44 Å²	44	46.8 Å²	46.8	23%	0.23	24%	0.237	C	C	.	.	H	α-helix	trans	-68.9	-45.9	177	-64.3	176.5	0	0	0	111.4	W899 F902 F931 V932 R937 Y938	W899-L934 WeakPolarHBondContact CZ3-O 3.44Å; F902-L934 HydrophobicContact CE1-CB 4.35Å; F931-L934 HydrophobicContact CD1-CD1 3.97Å; F931-L934 HydrophobicContact CE1-CD1 4.2Å; F931-L934 PolarHBondContact O-N 3.11Å; V932-L934 VanDerWaalsContact C-N 3.27Å; V932-L934 PolarHBondContact O-N 3Å; L934-R937 PolarHBondContact O-N 3.39Å; L934-Y938 WeakPolarHBondContact O-CB 3.38Å; L934-Y938 PolarHBondContact O-N 3.27Å
935	V	88.2	Confident	87.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.9	-43.7	177.2	176	0	0	0	0	110.8	F902 F931 V932 Y938 V939 L986 W988 L997	F902-V935 HydrophobicContact CD1-CG2 4.49Å; F902-V935 HydrophobicContact CE1-CG2 3.66Å; F902-V935 HydrophobicContact CZ-CG2 4.31Å; F931-V935 WeakPolarHBondContact O-CG2 3.46Å; F931-V935 PolarHBondContact O-N 3.36Å; V932-V935 PolarHBondContact O-N 3.16Å; V935-Y938 WeakPolarHBondContact O-CB 3.47Å; V935-Y938 PolarHBondContact O-N 3.47Å; V935-V939 WeakPolarHBondContact O-CG2 3.25Å; V935-V939 PolarHBondContact O-N 2.93Å; V935-L986 HydrophobicContact CG1-CD1 4.11Å; V935-L986 HydrophobicContact CG2-CD1 3.82Å; V935-W988 HydrophobicContact CG2-CZ3 4.16Å; V935-L997 HydrophobicContact CG1-CD1 3.79Å; V935-L997 HydrophobicContact CG1-CD2 4.29Å
936	V	87.6	Confident	87.8	Confident	40 Å²	40	44.5 Å²	44.5	24%	0.242	23%	0.234	C	C	.	.	H	α-helix	trans	-60.7	-47.8	177	173.9	0	0	0	0	111	V932 Y938 V939 D940 F993	V932-V936 WeakPolarHBondContact O-CG2 3.3Å; V932-V936 PolarHBondContact O-N 3.49Å; V936-Y938 VanDerWaalsContact C-N 3.32Å; V936-Y938 PolarHBondContact O-N 2.98Å; V936-V939 PolarHBondContact O-N 3.35Å; V936-D940 PolarHBondContact O-N 2.88Å; V936-F993 HydrophobicContact CG2-CE2 4.16Å; V936-F993 HydrophobicContact CG2-CZ 3.91Å
937	R	87.6	Confident	87.6	Confident	88 Å²	88	43.6 Å²	43.6	33%	0.332	24%	0.237	S	C	.	.	H	α-helix	trans	-61.8	-38.1	177.8	-174.3	179.4	175.6	147.2	-2.2	112.3	D897 W899 P933 L934 D940 L941	D897-R937 VanDerWaalsContact CG-NH2 3.3Å; D897-R937 IonicContact OD1-CZ 2.63Å; D897-R937 IonicContact OD1-NE 3.24Å; D897-R937 PolarHBondContact OD1-NE 3.37Å; D897-R937 IonicContact OD1-NH2 2.92Å; D897-R937 PolarHBondContact OD1-NH2 2.89Å; D897-R937 IonicContact OD2-NH2 3.89Å; D897-R937 PolarHBondContact OD2-NH2 3.46Å; W899-R937 HydrophobicContact CH2-CB 4.41Å; W899-R937 HydrophobicContact CH2-CG 4.22Å; P933-R937 VanDerWaalsContact O-CB 3.3Å; P933-R937 WeakPolarHBondContact O-CB 3.42Å; P933-R937 PolarHBondContact O-N 3.06Å; L934-R937 PolarHBondContact O-N 3.39Å; R937-D940 PolarHBondContact O-N 2.94Å; R937-L941 HydrophobicContact CG-CD1 4.14Å; R937-L941 WeakPolarHBondContact O-CB 3.31Å; R937-L941 WeakPolarHBondContact O-CG 3.46Å; R937-L941 PolarHBondContact O-N 3.41Å
938	Y	87.7	Confident	87.5	Confident	43 Å²	43	49 Å²	49	17%	0.169	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-49	175.2	-177.9	-112	0	0	0	111.4	W899 F902 L934 V935 V936 D940 L941 M942 L979 F982	W899-Y938 AromaticContact CD2-CD2 3.44Å; W899-Y938 HydrophobicContact CD2-CD2 3.44Å; W899-Y938 VanDerWaalsContact CD2-CD2 3.44Å; W899-Y938 HydrophobicContact CD2-CE2 4.06Å; W899-Y938 HydrophobicContact CD2-CG 4.32Å; W899-Y938 AromaticContact CE2-CD2 3.49Å; W899-Y938 VanDerWaalsContact CE2-CD2 3.49Å; W899-Y938 AromaticContact CE3-CD2 3.73Å; W899-Y938 HydrophobicContact CE3-CD2 3.73Å; W899-Y938 HydrophobicContact CE3-CG 4.17Å; W899-Y938 AromaticContact CG-CD2 3.93Å; W899-Y938 HydrophobicContact CG-CD2 3.93Å; W899-Y938 HydrophobicContact CG-CE2 4.06Å; W899-Y938 VanDerWaalsContact CH2-CA 3.42Å; W899-Y938 HydrophobicContact CH2-CD2 4.04Å; W899-Y938 HydrophobicContact CH2-CG 4.4Å; W899-Y938 AromaticContact CZ2-CD2 3.8Å; W899-Y938 HydrophobicContact CZ2-CD2 3.8Å; W899-Y938 VanDerWaalsContact CZ3-CB 3.5Å; W899-Y938 HydrophobicContact CZ3-CD2 4.02Å; W899-Y938 HydrophobicContact CZ3-CG 4.22Å; W899-Y938 AromaticContact NE1-CD2 3.96Å; F902-Y938 HydrophobicContact CE2-CD2 4.4Å; F902-Y938 HydrophobicContact CE2-CG 4.22Å; F902-Y938 HydrophobicContact CZ-CG 4.47Å; L934-Y938 WeakPolarHBondContact O-CB 3.38Å; L934-Y938 PolarHBondContact O-N 3.27Å; V935-Y938 WeakPolarHBondContact O-CB 3.47Å; V935-Y938 PolarHBondContact O-N 3.47Å; V936-Y938 VanDerWaalsContact C-N 3.32Å; V936-Y938 PolarHBondContact O-N 2.98Å; Y938-D940 PolarHBondContact O-N 3.01Å; Y938-L941 PolarHBondContact O-N 3.17Å; Y938-M942 HydrophobicContact CD1-CG 4.29Å; Y938-M942 HydrophobicContact CD2-CG 4.23Å; Y938-M942 HydrophobicContact CE1-CG 3.94Å; Y938-M942 HydrophobicContact CE2-CG 3.89Å; Y938-M942 HydrophobicContact CE2-SD 4.27Å; Y938-M942 HydrophobicContact CG-CG 4.44Å; Y938-M942 WeakPolarHBondContact O-CB 3.41Å; Y938-M942 VanDerWaalsContact O-CG 3.3Å; Y938-M942 WeakPolarHBondContact O-CG 3.37Å; Y938-M942 PolarHBondContact O-N 3.05Å; Y938-L979 HydrophobicContact CD1-CD1 4.02Å; Y938-L979 HydrophobicContact CE1-CD1 3.55Å; Y938-F982 AromaticContact CD1-CD1 3.89Å; Y938-F982 HydrophobicContact CD1-CD1 3.89Å; Y938-F982 AromaticContact CD1-CE1 3.47Å; Y938-F982 HydrophobicContact CD1-CE1 3.47Å; Y938-F982 VanDerWaalsContact CD1-CE1 3.47Å; Y938-F982 HydrophobicContact CD1-CZ 4.17Å; Y938-F982 AromaticContact CE1-CD1 3.54Å; Y938-F982 HydrophobicContact CE1-CD1 3.54Å; Y938-F982 AromaticContact CE1-CE1 3.54Å; Y938-F982 HydrophobicContact CE1-CE1 3.54Å; Y938-F982 HydrophobicContact CE1-CG 4.17Å; Y938-F982 HydrophobicContact CE1-CZ 4.16Å; Y938-F982 HydrophobicContact CG-CE1 4.46Å
939	V	87.9	Confident	87.3	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-62	-43.4	178.3	175.1	0	0	0	0	110.8	V935 V936 L941 M942 E943 V983 L1001	V935-V939 WeakPolarHBondContact O-CG2 3.25Å; V935-V939 PolarHBondContact O-N 2.93Å; V936-V939 PolarHBondContact O-N 3.35Å; V939-L941 VanDerWaalsContact C-N 3.35Å; V939-L941 PolarHBondContact O-N 3.4Å; V939-M942 PolarHBondContact O-N 2.98Å; V939-E943 VanDerWaalsContact O-CB 3.27Å; V939-E943 WeakPolarHBondContact O-CB 3.41Å; V939-E943 PolarHBondContact O-N 3.12Å; V939-V983 HydrophobicContact CG2-CG2 4.46Å; V939-L1001 HydrophobicContact CG1-CD2 4.04Å; V939-L1001 HydrophobicContact CG2-CD2 4.42Å
940	D	87.9	Confident	87.1	Confident	63 Å²	63	44.1 Å²	44.1	34%	0.337	24%	0.243	S	C	.	.	H	α-helix	trans	-58.5	-43.7	177.2	-66.2	-12.8	0	0	0	112.5	V936 R937 Y938 S944 R1000	V936-D940 PolarHBondContact O-N 2.88Å; R937-D940 PolarHBondContact O-N 2.94Å; Y938-D940 PolarHBondContact O-N 3.01Å; D940-S944 PolarHBondContact O-N 3.47Å; D940-S944 VanDerWaalsContact O-N 3.1Å; D940-S944 PolarHBondContact O-OG 2.95Å; D940-R1000 IonicContact OD1-CZ 3.85Å; D940-R1000 IonicContact OD1-NH1 3.57Å; D940-R1000 PolarHBondContact OD1-NH1 3.01Å; D940-R1000 IonicContact OD1-NH2 2.64Å; D940-R1000 PolarHBondContact OD1-NH2 3.07Å
941	L	87.1	Confident	86.8	Confident	78 Å²	78	46.5 Å²	46.5	41%	0.408	25%	0.253	S	S	.	.	H	α-helix	trans	-72.1	-38.8	179.8	-74.1	171.2	0	0	0	111.8	W899 R937 Y938 V939 S944 S945	W899-L941 HydrophobicContact CH2-CD1 4.1Å; W899-L941 HydrophobicContact CZ2-CD1 3.7Å; R937-L941 HydrophobicContact CG-CD1 4.14Å; R937-L941 WeakPolarHBondContact O-CB 3.31Å; R937-L941 WeakPolarHBondContact O-CG 3.46Å; R937-L941 PolarHBondContact O-N 3.41Å; Y938-L941 PolarHBondContact O-N 3.17Å; V939-L941 VanDerWaalsContact C-N 3.35Å; V939-L941 PolarHBondContact O-N 3.4Å; L941-S944 PolarHBondContact O-N 2.91Å; L941-S945 VanDerWaalsContact O-CB 3.25Å; L941-S945 WeakPolarHBondContact O-CB 3.38Å; L941-S945 PolarHBondContact O-N 3.33Å
942	M	87.8	Confident	86.4	Confident	41 Å²	41	54.5 Å²	54.5	20%	0.202	28%	0.283	C	S	.	.	H	α-helix	trans	-66.4	-41.9	175.1	-73.1	-60.9	-66.9	0	0	111.6	Y938 V939 S944 S945 I946 L979	Y938-M942 HydrophobicContact CD1-CG 4.29Å; Y938-M942 HydrophobicContact CD2-CG 4.23Å; Y938-M942 HydrophobicContact CE1-CG 3.94Å; Y938-M942 HydrophobicContact CE2-CG 3.89Å; Y938-M942 HydrophobicContact CE2-SD 4.27Å; Y938-M942 HydrophobicContact CG-CG 4.44Å; Y938-M942 WeakPolarHBondContact O-CB 3.41Å; Y938-M942 VanDerWaalsContact O-CG 3.3Å; Y938-M942 WeakPolarHBondContact O-CG 3.37Å; Y938-M942 PolarHBondContact O-N 3.05Å; V939-M942 PolarHBondContact O-N 2.98Å; M942-S944 VanDerWaalsContact C-N 3.34Å; M942-S944 PolarHBondContact O-N 2.93Å; M942-S945 PolarHBondContact O-N 3.37Å; M942-I946 WeakPolarHBondContact O-CB 3.44Å; M942-I946 WeakPolarHBondContact O-CG1 3.41Å; M942-I946 PolarHBondContact O-N 3.28Å; M942-L979 HydrophobicContact CB-CD1 4.28Å; M942-L979 HydrophobicContact CB-CD2 3.89Å; M942-L979 HydrophobicContact CG-CD1 4.23Å
943	E	87.4	Confident	86	Confident	57 Å²	57	53.5 Å²	53.5	27%	0.266	28%	0.281	S	S	.	.	H	α-helix	trans	-54.7	-50.2	172.5	-178.5	171.7	-179.3	0	0	111	V939 S945 I946 A947 R1000 M1004 M1008	V939-E943 VanDerWaalsContact O-CB 3.27Å; V939-E943 WeakPolarHBondContact O-CB 3.41Å; V939-E943 PolarHBondContact O-N 3.12Å; E943-S945 PolarHBondContact O-N 2.94Å; E943-I946 PolarHBondContact O-N 3.22Å; E943-A947 VanDerWaalsContact O-CB 3.3Å; E943-A947 WeakPolarHBondContact O-CB 3.34Å; E943-A947 PolarHBondContact O-N 3.01Å; E943-R1000 IonicContact OE2-CZ 3.99Å; E943-R1000 IonicContact OE2-NE 3.58Å; E943-R1000 IonicContact OE2-NH2 3.12Å; E943-R1000 PolarHBondContact OE2-NH2 3.29Å; E943-M1004 HydrophobicContact CB-CG 4.37Å; E943-M1004 HydrophobicContact CB-SD 3.46Å; E943-M1004 WeakPolarHBondContact CB-SD 3.28Å; E943-M1004 HydrophobicContact CG-CG 3.91Å; E943-M1004 HydrophobicContact CG-SD 3.67Å; E943-M1008 HydrophobicContact CG-CE 4.24Å
944	S	87.8	Confident	85.7	Confident	62 Å²	62	50.9 Å²	50.9	43%	0.434	26%	0.262	S	S	.	.	H	α-helix	trans	-63.5	-42	177.8	-62.1	0	0	0	0	112.6	D940 L941 M942 Q948	D940-S944 PolarHBondContact O-N 3.47Å; D940-S944 VanDerWaalsContact O-N 3.1Å; D940-S944 PolarHBondContact O-OG 2.95Å; L941-S944 PolarHBondContact O-N 2.91Å; M942-S944 VanDerWaalsContact C-N 3.34Å; M942-S944 PolarHBondContact O-N 2.93Å; S944-Q948 WeakPolarHBondContact O-CB 3.3Å; S944-Q948 VanDerWaalsContact O-CG 3.28Å; S944-Q948 WeakPolarHBondContact O-CG 3.39Å; S944-Q948 PolarHBondContact O-N 3.48Å
945	S	86.9	Confident	85.1	Confident	56 Å²	56	55.4 Å²	55.4	39%	0.392	28%	0.282	S	S	.	.	H	α-helix	trans	-65	-45.4	179.2	-178.4	0	0	0	0	111.7	L941 M942 E943 Q948 S949	L941-S945 VanDerWaalsContact O-CB 3.25Å; L941-S945 WeakPolarHBondContact O-CB 3.38Å; L941-S945 PolarHBondContact O-N 3.33Å; M942-S945 PolarHBondContact O-N 3.37Å; E943-S945 PolarHBondContact O-N 2.94Å; S945-Q948 PolarHBondContact O-N 3.47Å; S945-S949 WeakPolarHBondContact O-CB 3.41Å; S945-S949 PolarHBondContact O-N 3.01Å
946	I	86.7	Confident	84.6	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-64.5	-45.4	177.3	-67.5	167.7	0	0	0	110.1	M942 E943 Q948 S949 I950 L972 K975 L976 L979 M1008	M942-I946 WeakPolarHBondContact O-CB 3.44Å; M942-I946 WeakPolarHBondContact O-CG1 3.41Å; M942-I946 PolarHBondContact O-N 3.28Å; E943-I946 PolarHBondContact O-N 3.22Å; I946-Q948 VanDerWaalsContact C-N 3.34Å; I946-Q948 PolarHBondContact O-N 3.27Å; I946-S949 WeakPolarHBondContact O-CB 3.3Å; I946-S949 PolarHBondContact O-N 3.32Å; I946-I950 HydrophobicContact CG2-CD1 4.12Å; I946-I950 WeakPolarHBondContact O-CG1 3.34Å; I946-I950 PolarHBondContact O-N 2.93Å; I946-L972 HydrophobicContact CG2-CD1 3.35Å; I946-K975 HydrophobicContact CD1-CB 4.1Å; I946-K975 HydrophobicContact CG1-CB 4.07Å; I946-K975 HydrophobicContact CG1-CD 4.28Å; I946-L976 HydrophobicContact CD1-CD2 4.07Å; I946-L976 HydrophobicContact CG2-CD2 4.48Å; I946-L979 HydrophobicContact CD1-CD2 4.39Å; I946-M1008 HydrophobicContact CG2-CB 4.49Å; I946-M1008 HydrophobicContact CG2-CG 3.92Å; I946-M1008 HydrophobicContact CG2-SD 4.2Å
947	A	85.5	Confident	84.2	Confident	38 Å²	38	62.4 Å²	62.4	31%	0.314	31%	0.312	S	S	.	.	H	α-helix	trans	-59.6	-42.7	176.8	0	0	0	0	0	112.5	E943 H951 M1008	E943-A947 VanDerWaalsContact O-CB 3.3Å; E943-A947 WeakPolarHBondContact O-CB 3.34Å; E943-A947 PolarHBondContact O-N 3.01Å; A947-H951 PolarHBondContact O-N 3.47Å; A947-M1008 HydrophobicContact CB-CE 3.83Å; A947-M1008 HydrophobicContact CB-SD 4.03Å
948	Q	85.3	Confident	83.7	Confident	114 Å²	114	62.9 Å²	62.9	53%	0.533	33%	0.325	S	S	.	.	H	α-helix	trans	-67.2	-39.4	175.4	-73.8	-179.9	21	0	0	112.3	S944 S945 I946 I950 H951 R952	S944-Q948 WeakPolarHBondContact O-CB 3.3Å; S944-Q948 VanDerWaalsContact O-CG 3.28Å; S944-Q948 WeakPolarHBondContact O-CG 3.39Å; S944-Q948 PolarHBondContact O-N 3.48Å; S945-Q948 PolarHBondContact O-N 3.47Å; I946-Q948 VanDerWaalsContact C-N 3.34Å; I946-Q948 PolarHBondContact O-N 3.27Å; Q948-I950 VanDerWaalsContact C-N 3.34Å; Q948-H951 PolarHBondContact O-N 2.96Å; Q948-R952 PolarHBondContact O-N 3.48Å
949	S	84.4	Confident	83.5	Confident	36 Å²	36	62 Å²	62	25%	0.252	32%	0.321	S	S	.	.	H	α-helix	trans	-60.2	-44.7	176.3	-159	0	0	0	0	110.9	S945 I946 G953 D971 K975	S945-S949 WeakPolarHBondContact O-CB 3.41Å; S945-S949 PolarHBondContact O-N 3.01Å; I946-S949 WeakPolarHBondContact O-CB 3.3Å; I946-S949 PolarHBondContact O-N 3.32Å; S949-G953 VanDerWaalsContact O-CA 3.29Å; S949-G953 WeakPolarHBondContact O-CA 3.36Å; S949-G953 PolarHBondContact O-N 3.18Å; S949-D971 PolarHBondContact OG-OD2 2.64Å; S949-K975 PolarHBondContact OG-NZ 3.5Å
950	I	83.4	Confident	83.1	Confident	4 Å²	4	68.2 Å²	68.2	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-59.9	-49.7	173.5	-69.9	164.4	0	0	0	110.4	I946 Q948 F954 L972 M1008 A1011	I946-I950 HydrophobicContact CG2-CD1 4.12Å; I946-I950 WeakPolarHBondContact O-CG1 3.34Å; I946-I950 PolarHBondContact O-N 2.93Å; Q948-I950 VanDerWaalsContact C-N 3.34Å; I950-F954 HydrophobicContact CG2-CD2 3.81Å; I950-F954 HydrophobicContact CG2-CE2 4.09Å; I950-F954 VanDerWaalsContact O-CD2 3.29Å; I950-F954 WeakPolarHBondContact O-CD2 3.5Å; I950-F954 PolarHBondContact O-N 2.87Å; I950-F954 VanDerWaalsContact O-N 3.16Å; I950-L972 HydrophobicContact CD1-CD1 3.59Å; I950-L972 HydrophobicContact CD1-CD2 3.87Å; I950-L972 HydrophobicContact CD1-CG 4.35Å; I950-L972 HydrophobicContact CG1-CD1 3.9Å; I950-L972 HydrophobicContact CG1-CD2 3.98Å; I950-L972 HydrophobicContact CG1-CG 4.41Å; I950-M1008 HydrophobicContact CD1-CB 3.72Å; I950-M1008 HydrophobicContact CD1-CG 4.02Å; I950-M1008 HydrophobicContact CD1-SD 3.54Å; I950-M1008 VanDerWaalsContact CD1-SD 3.54Å; I950-A1011 HydrophobicContact CG2-CB 4.38Å
951	H	81.3	Confident	82.6	Confident	95 Å²	95	69.7 Å²	69.7	44%	0.44	36%	0.363	S	S	.	.	H	α-helix	trans	-65	-47.4	-172.9	-168	14.5	0	0	0	112.7	A947 Q948 E955	A947-H951 PolarHBondContact O-N 3.47Å; Q948-H951 PolarHBondContact O-N 2.96Å; H951-E955 IonicContact CE1-OE1 3.55Å; H951-E955 PolarHBondContact CE1-OE1 3.48Å; H951-E955 IonicContact ND1-OE1 2.83Å; H951-E955 IonicContact NE2-OE1 2.7Å; H951-E955 WeakPolarHBondContact O-CG 3.3Å
952	R	81.4	Confident	82	Confident	168 Å²	168	68.8 Å²	68.8	63%	0.634	36%	0.361	S	S	*	.	H	α-helix	trans	-77	-36.9	179.7	-68.4	-176.6	179.3	169.5	3	112.6	Q948 E955 Q956	Q948-R952 PolarHBondContact O-N 3.48Å; R952-E955 PolarHBondContact O-N 3.46Å; R952-Q956 PolarHBondContact O-N 3.25Å
953	G	80.1	Confident	81.4	Confident	19 Å²	19	73.3 Å²	73.3	20%	0.196	39%	0.386	C	S	.	.	H	α-helix	trans	-62.4	-50.2	-178.7	0	0	0	0	0	111.8	S949 E955 Q956 E957	S949-G953 VanDerWaalsContact O-CA 3.29Å; S949-G953 WeakPolarHBondContact O-CA 3.36Å; S949-G953 PolarHBondContact O-N 3.18Å; G953-E955 VanDerWaalsContact C-N 3.28Å; G953-E955 PolarHBondContact O-N 2.96Å; G953-Q956 CarbonylContact O-C 3.59Å; G953-Q956 PolarHBondContact O-N 3.49Å; G953-E957 WeakPolarHBondContact O-CB 3.35Å; G953-E957 PolarHBondContact O-N 3.24Å
954	F	80.3	Confident	80.7	Confident	20 Å²	20	74.2 Å²	74.2	9%	0.088	39%	0.393	C	S	.	.	H	α-helix	trans	-68.8	-22.1	179.8	-79.9	-71.1	0	0	0	114.2	I950 W959 T968 C1012 R1015	I950-F954 HydrophobicContact CG2-CD2 3.81Å; I950-F954 HydrophobicContact CG2-CE2 4.09Å; I950-F954 VanDerWaalsContact O-CD2 3.29Å; I950-F954 WeakPolarHBondContact O-CD2 3.5Å; I950-F954 PolarHBondContact O-N 2.87Å; I950-F954 VanDerWaalsContact O-N 3.16Å; F954-W959 AromaticContact CD1-CH2 3.69Å; F954-W959 HydrophobicContact CD1-CH2 3.69Å; F954-W959 AromaticContact CD1-CZ2 3.99Å; F954-W959 HydrophobicContact CD1-CZ2 3.99Å; F954-W959 AromaticContact CE1-CH2 3.69Å; F954-W959 HydrophobicContact CE1-CH2 3.69Å; F954-W959 HydrophobicContact CE1-CZ2 4.44Å; F954-W959 HydrophobicContact CE1-CZ3 4.23Å; F954-T968 HydrophobicContact CD2-CG2 3.84Å; F954-T968 HydrophobicContact CE2-CG2 3.78Å; F954-T968 HydrophobicContact CG-CG2 4.28Å; F954-T968 HydrophobicContact CZ-CG2 4.19Å; F954-C1012 HydrophobicContact CE2-CB 4.26Å; F954-C1012 HydrophobicContact CZ-CB 4.33Å; F954-C1012 VanDerWaalsContact CZ-SG 3.5Å; F954-R1015 HydrophobicContact CB-CB 4.46Å; F954-R1015 HydrophobicContact CG-CB 4.31Å
955	E	75.1	Confident	80.4	Confident	139 Å²	139	71.4 Å²	71.4	65%	0.65	37%	0.373	S	S	*	.	H	α-helix	trans	-73.8	-32	173.4	-77.1	-179.9	175.4	0	0	112.9	H951 R952 G953	H951-E955 IonicContact CE1-OE1 3.55Å; H951-E955 PolarHBondContact CE1-OE1 3.48Å; H951-E955 IonicContact ND1-OE1 2.83Å; H951-E955 IonicContact NE2-OE1 2.7Å; H951-E955 WeakPolarHBondContact O-CG 3.3Å; R952-E955 PolarHBondContact O-N 3.46Å; G953-E955 VanDerWaalsContact C-N 3.28Å; G953-E955 PolarHBondContact O-N 2.96Å
956	Q	76.6	Confident	80.3	Confident	162 Å²	162	68.7 Å²	68.7	76%	0.757	35%	0.354	S	S	*	.	H	α-helix	trans	-101.9	4	-178.8	-61.5	-178.1	7.7	0	0	113	R952 G953 T958	R952-Q956 PolarHBondContact O-N 3.25Å; G953-Q956 CarbonylContact O-C 3.59Å; G953-Q956 PolarHBondContact O-N 3.49Å; Q956-T958 PolarHBondContact O-N 3.03Å
957	E	79.9	Confident	80.1	Confident	26 Å²	26	71.2 Å²	71.2	12%	0.121	38%	0.375	C	S	.	.			trans	-64.9	128.6	-172.4	-172.6	52.9	-101	0	0	111.9	G953 W959 T968	G953-E957 WeakPolarHBondContact O-CB 3.35Å; G953-E957 PolarHBondContact O-N 3.24Å; E957-W959 HydrophobicContact CB-CD2 4.48Å; E957-W959 HydrophobicContact CB-CZ2 4.32Å; E957-W959 HydrophobicContact CG-CD2 3.65Å; E957-W959 HydrophobicContact CG-CE3 4.08Å; E957-W959 HydrophobicContact CG-CG 3.92Å; E957-W959 HydrophobicContact CG-CH2 4.48Å; E957-W959 HydrophobicContact CG-CZ2 4.07Å; E957-W959 HydrophobicContact CG-CZ3 4.48Å; E957-W959 VanDerWaalsContact O-CD1 3.26Å; E957-W959 PolarHBondContact O-NE1 3.35Å; E957-W959 PolarHBondContact OE1-N 3.07Å; E957-T968 WeakPolarHBondContact OE2-CB 3.34Å; E957-T968 PolarHBondContact OE2-N 2.85Å; E957-T968 PolarHBondContact OE2-OG1 2.67Å
958	T	76.5	Confident	80.1	Confident	98 Å²	98	70.2 Å²	70.2	60%	0.601	37%	0.365	S	S	*	.			trans	-90.2	-14.5	178.9	62	0	0	0	0	112	Q956 Q960	Q956-T958 PolarHBondContact O-N 3.03Å; T958-Q960 PolarHBondContact O-N 3.39Å
959	W	83.8	Confident	80.1	Confident	24 Å²	24	64.8 Å²	64.8	9%	0.091	34%	0.34	C	S	.	.			trans	59.8	34.9	179.5	-55.1	90.5	0	0	0	112.7	F954 E957 T1016 A1019 M1042	F954-W959 AromaticContact CD1-CH2 3.69Å; F954-W959 HydrophobicContact CD1-CH2 3.69Å; F954-W959 AromaticContact CD1-CZ2 3.99Å; F954-W959 HydrophobicContact CD1-CZ2 3.99Å; F954-W959 AromaticContact CE1-CH2 3.69Å; F954-W959 HydrophobicContact CE1-CH2 3.69Å; F954-W959 HydrophobicContact CE1-CZ2 4.44Å; F954-W959 HydrophobicContact CE1-CZ3 4.23Å; E957-W959 HydrophobicContact CB-CD2 4.48Å; E957-W959 HydrophobicContact CB-CZ2 4.32Å; E957-W959 HydrophobicContact CG-CD2 3.65Å; E957-W959 HydrophobicContact CG-CE3 4.08Å; E957-W959 HydrophobicContact CG-CG 3.92Å; E957-W959 HydrophobicContact CG-CH2 4.48Å; E957-W959 HydrophobicContact CG-CZ2 4.07Å; E957-W959 HydrophobicContact CG-CZ3 4.48Å; E957-W959 VanDerWaalsContact O-CD1 3.26Å; E957-W959 PolarHBondContact O-NE1 3.35Å; E957-W959 PolarHBondContact OE1-N 3.07Å; W959-T1016 HydrophobicContact CH2-CG2 4.14Å; W959-T1016 HydrophobicContact CZ3-CG2 4.06Å; W959-A1019 HydrophobicContact CH2-CB 4.17Å; W959-A1019 HydrophobicContact CZ2-CB 3.49Å; W959-A1019 VanDerWaalsContact CZ2-CB 3.49Å; W959-M1042 HydrophobicContact CB-CE 4.36Å; W959-M1042 HydrophobicContact CD2-CE 3.35Å; W959-M1042 HydrophobicContact CD2-CG 3.72Å; W959-M1042 HydrophobicContact CD2-SD 4.42Å; W959-M1042 HydrophobicContact CE3-CB 4.33Å; W959-M1042 HydrophobicContact CE3-CE 3.98Å; W959-M1042 HydrophobicContact CE3-CG 3.27Å; W959-M1042 HydrophobicContact CG-CE 3.52Å; W959-M1042 HydrophobicContact CG-CG 4.46Å; W959-M1042 HydrophobicContact CH2-CG 4.05Å; W959-M1042 HydrophobicContact CZ2-CE 3.98Å; W959-M1042 HydrophobicContact CZ2-CG 4.44Å; W959-M1042 HydrophobicContact CZ3-CB 4.3Å; W959-M1042 HydrophobicContact CZ3-CG 3.46Å; W959-M1042 VanDerWaalsContact CZ3-CG 3.46Å
960	Q	80	Confident	80.1	Confident	132 Å²	132	65 Å²	65	62%	0.617	34%	0.337	S	S	*	.			trans	-75.7	140.5	167.1	-66.9	-172.7	0.6	0	0	109.3	T958 V962	T958-Q960 PolarHBondContact O-N 3.39Å; Q960-V962 PolarHBondContact O-N 3.5Å
961	P	76.3	Confident	80.2	Confident	94 Å²	94	67.4 Å²	67.4	61%	0.61	35%	0.349	S	S	*	.			trans	-66.6	122.5	178.7	27.6	-33	0	0	0	110
962	V	74.6	Confident	80.5	Confident	59 Å²	59	63 Å²	63	36%	0.358	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-128	117.5	171.6	-179.5	0	0	0	0	106.4	Q960 N964 G965 A967	Q960-V962 PolarHBondContact O-N 3.5Å; V962-N964 PolarHBondContact O-N 3.45Å; V962-G965 PolarHBondContact N-O 2.89Å; V962-G965 CarbonylContact O-C 3.59Å; V962-G965 PolarHBondContact O-N 2.9Å; V962-A967 HydrophobicContact CG2-CB 4.24Å
963	N	76.4	Confident	80.7	Confident	135 Å²	135	55.5 Å²	55.5	72%	0.722	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	-116	-172.7	-60.2	-25.1	0	0	0	112.8	E970	N963-E970 HydrophobicContact CB-CG 4.45Å
964	N	73.3	Confident	81.1	Confident	77 Å²	77	62.6 Å²	62.6	41%	0.412	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-3.7	-176	-69	-23.9	0	0	0	112.9	V962 E970 N1044 D1048	V962-N964 PolarHBondContact O-N 3.45Å; N964-E970 PolarHBondContact N-OE1 3.19Å; N964-N1044 WeakPolarHBondContact O-CB 3.34Å; N964-D1048 HydrophobicContact CB-CB 4.34Å
965	G	80.8	Confident	81.4	Confident	2 Å²	2	63.6 Å²	63.6	2%	0.021	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-152.9	-127.9	-177.2	0	0	0	0	0	113.6	V962 E970 T1041	V962-G965 PolarHBondContact N-O 2.89Å; V962-G965 CarbonylContact O-C 3.59Å; V962-G965 PolarHBondContact O-N 2.9Å; G965-E970 PolarHBondContact N-OE1 2.83Å; G965-T1041 VanDerWaalsContact O-CG2 3.24Å; G965-T1041 WeakPolarHBondContact O-CG2 3.37Å
966	S	84.8	Confident	82	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.296	C	S	.	.			trans	-116.3	161.9	179.9	65.5	0	0	0	0	110.9	T968 S969 E970	S966-T968 VanDerWaalsContact C-N 3.27Å; S966-T968 PolarHBondContact O-N 3.2Å; S966-S969 PolarHBondContact N-OG 3.03Å; S966-S969 PolarHBondContact O-N 3.15Å; S966-S969 PolarHBondContact O-OG 3.49Å; S966-S969 WeakPolarHBondContact OG-CB 3.38Å; S966-S969 PolarHBondContact OG-N 3.42Å; S966-S969 PolarHBondContact OG-OG 3.12Å; S966-E970 WeakPolarHBondContact O-CB 3.48Å; S966-E970 VanDerWaalsContact O-CG 3.3Å; S966-E970 WeakPolarHBondContact O-CG 3.39Å; S966-E970 PolarHBondContact O-N 2.99Å
967	A	83.3	Confident	82.3	Confident	53 Å²	53	51.6 Å²	51.6	44%	0.438	27%	0.272	S	S	.	.	H	α-helix	trans	-55.1	-42.5	177.6	0	0	0	0	0	112.3	V962 D971	V962-A967 HydrophobicContact CG2-CB 4.24Å; A967-D971 WeakPolarHBondContact O-CB 3.28Å; A967-D971 PolarHBondContact O-N 2.93Å
968	T	84.2	Confident	82.6	Confident	17 Å²	17	52.2 Å²	52.2	10%	0.104	28%	0.282	C	S	.	.	H	α-helix	trans	-71.5	-37.5	179.5	-55.5	0	0	0	0	112.9	F954 E957 S966 L972	F954-T968 HydrophobicContact CD2-CG2 3.84Å; F954-T968 HydrophobicContact CE2-CG2 3.78Å; F954-T968 HydrophobicContact CG-CG2 4.28Å; F954-T968 HydrophobicContact CZ-CG2 4.19Å; E957-T968 WeakPolarHBondContact OE2-CB 3.34Å; E957-T968 PolarHBondContact OE2-N 2.85Å; E957-T968 PolarHBondContact OE2-OG1 2.67Å; S966-T968 VanDerWaalsContact C-N 3.27Å; S966-T968 PolarHBondContact O-N 3.2Å; T968-L972 WeakPolarHBondContact O-CB 3.48Å; T968-L972 PolarHBondContact O-N 3.4Å; T968-L972 VanDerWaalsContact O-N 3.11Å
969	S	85.5	Confident	83.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-72.1	-38.9	179.8	61.7	0	0	0	0	112.6	S966 L972 F973	S966-S969 PolarHBondContact N-OG 3.03Å; S966-S969 PolarHBondContact O-N 3.15Å; S966-S969 PolarHBondContact O-OG 3.49Å; S966-S969 WeakPolarHBondContact OG-CB 3.38Å; S966-S969 PolarHBondContact OG-N 3.42Å; S966-S969 PolarHBondContact OG-OG 3.12Å; S969-L972 WeakPolarHBondContact O-CB 3.45Å; S969-L972 PolarHBondContact O-N 3.41Å; S969-F973 WeakPolarHBondContact O-CD2 3.19Å; S969-F973 VanDerWaalsContact O-CG 3.31Å; S969-F973 WeakPolarHBondContact O-CG 3.36Å; S969-F973 PolarHBondContact O-N 3.18Å
970	E	84.9	Confident	83.2	Confident	41 Å²	41	48.5 Å²	48.5	19%	0.192	26%	0.258	C	S	.	.	H	α-helix	trans	-67.4	-43.6	177.5	-68.4	-80	162.8	0	0	111.3	N963 N964 G965 S966 L972 F973 W974	N963-E970 HydrophobicContact CB-CG 4.45Å; N964-E970 PolarHBondContact N-OE1 3.19Å; G965-E970 PolarHBondContact N-OE1 2.83Å; S966-E970 WeakPolarHBondContact O-CB 3.48Å; S966-E970 VanDerWaalsContact O-CG 3.3Å; S966-E970 WeakPolarHBondContact O-CG 3.39Å; S966-E970 PolarHBondContact O-N 2.99Å; E970-L972 VanDerWaalsContact C-N 3.3Å; E970-L972 PolarHBondContact O-N 3.4Å; E970-F973 PolarHBondContact O-N 2.84Å; E970-W974 WeakPolarHBondContact O-CB 3.38Å; E970-W974 PolarHBondContact O-N 3.25Å
971	D	84.8	Confident	83.4	Confident	54 Å²	54	46.4 Å²	46.4	29%	0.289	25%	0.25	S	C	.	.	H	α-helix	trans	-61.1	-38.4	174.1	176.4	66.2	0	0	0	112	S949 A967 K975	S949-D971 PolarHBondContact OG-OD2 2.64Å; A967-D971 WeakPolarHBondContact O-CB 3.28Å; A967-D971 PolarHBondContact O-N 2.93Å; D971-K975 WeakPolarHBondContact O-CB 3.49Å; D971-K975 VanDerWaalsContact O-CG 3.27Å; D971-K975 WeakPolarHBondContact O-CG 3.28Å; D971-K975 PolarHBondContact O-N 3.4Å; D971-K975 WeakPolarHBondContact OD1-CE 3.45Å; D971-K975 IonicContact OD1-NZ 3.49Å; D971-K975 PolarHBondContact OD1-NZ 3.23Å; D971-K975 WeakPolarHBondContact OD2-CE 3.48Å; D971-K975 IonicContact OD2-NZ 3.99Å; D971-K975 PolarHBondContact OD2-NZ 2.92Å
972	L	87.1	Confident	83.9	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.021	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-53.1	173.8	171.1	60.8	0	0	0	111.9	I946 I950 T968 S969 E970 W974 K975 L976 M1008 C1012	I946-L972 HydrophobicContact CG2-CD1 3.35Å; I950-L972 HydrophobicContact CD1-CD1 3.59Å; I950-L972 HydrophobicContact CD1-CD2 3.87Å; I950-L972 HydrophobicContact CD1-CG 4.35Å; I950-L972 HydrophobicContact CG1-CD1 3.9Å; I950-L972 HydrophobicContact CG1-CD2 3.98Å; I950-L972 HydrophobicContact CG1-CG 4.41Å; T968-L972 WeakPolarHBondContact O-CB 3.48Å; T968-L972 PolarHBondContact O-N 3.4Å; T968-L972 VanDerWaalsContact O-N 3.11Å; S969-L972 WeakPolarHBondContact O-CB 3.45Å; S969-L972 PolarHBondContact O-N 3.41Å; E970-L972 VanDerWaalsContact C-N 3.3Å; E970-L972 PolarHBondContact O-N 3.4Å; L972-W974 VanDerWaalsContact C-N 3.32Å; L972-W974 PolarHBondContact O-N 3.38Å; L972-K975 PolarHBondContact O-N 2.98Å; L972-L976 HydrophobicContact CD1-CD1 3.81Å; L972-L976 HydrophobicContact CD1-CG 4.06Å; L972-L976 HydrophobicContact CG-CD1 4.11Å; L972-L976 WeakPolarHBondContact O-CG 3.03Å; L972-L976 PolarHBondContact O-N 2.87Å; L972-M1008 HydrophobicContact CD1-CB 4.16Å; L972-C1012 HydrophobicContact CD2-CB 3.84Å
973	F	86.9	Confident	84.4	Confident	9 Å²	9	41.7 Å²	41.7	4%	0.039	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-40.4	-177.6	-61.2	-33	0	0	0	111.6	S969 E970 L976 D977 L1009 D1048 A1049 Q1052 L1056	S969-F973 WeakPolarHBondContact O-CD2 3.19Å; S969-F973 VanDerWaalsContact O-CG 3.31Å; S969-F973 WeakPolarHBondContact O-CG 3.36Å; S969-F973 PolarHBondContact O-N 3.18Å; E970-F973 PolarHBondContact O-N 2.84Å; F973-L976 PolarHBondContact O-N 3.38Å; F973-D977 WeakPolarHBondContact O-CB 3.32Å; F973-D977 PolarHBondContact O-N 3.31Å; F973-L1009 HydrophobicContact CD1-CD2 4.35Å; F973-L1009 HydrophobicContact CE1-CD2 3.44Å; F973-L1009 VanDerWaalsContact CE1-CD2 3.44Å; F973-L1009 HydrophobicContact CE1-CG 4.43Å; F973-L1009 HydrophobicContact CZ-CD2 4.11Å; F973-D1048 WeakPolarHBondContact CD2-OD2 3.36Å; F973-D1048 HydrophobicContact CE2-CB 4.5Å; F973-D1048 VanDerWaalsContact CE2-OD2 3.3Å; F973-D1048 WeakPolarHBondContact CE2-OD2 3.46Å; F973-A1049 HydrophobicContact CZ-CB 3.94Å; F973-Q1052 HydrophobicContact CB-CG 4.4Å; F973-Q1052 HydrophobicContact CD1-CB 4.25Å; F973-Q1052 HydrophobicContact CD1-CG 4.32Å; F973-Q1052 HydrophobicContact CD2-CB 4.49Å; F973-Q1052 HydrophobicContact CD2-CG 3.76Å; F973-Q1052 HydrophobicContact CE1-CB 4.39Å; F973-Q1052 HydrophobicContact CE2-CG 4.05Å; F973-Q1052 HydrophobicContact CG-CB 4.33Å; F973-Q1052 HydrophobicContact CG-CG 3.91Å; F973-Q1052 HydrophobicContact CZ-CG 4.48Å; F973-L1056 HydrophobicContact CD1-CD1 4.48Å
974	W	87.6	Confident	84.7	Confident	169 Å²	169	42 Å²	42	64%	0.64	21%	0.212	S	C	*	.	H	α-helix	trans	-61.3	-44.6	174.8	179.1	77.4	0	0	0	112.3	E970 L972 L976 D977 A978	E970-W974 WeakPolarHBondContact O-CB 3.38Å; E970-W974 PolarHBondContact O-N 3.25Å; L972-W974 VanDerWaalsContact C-N 3.32Å; L972-W974 PolarHBondContact O-N 3.38Å; W974-L976 PolarHBondContact O-N 3.24Å; W974-D977 PolarHBondContact O-N 3.47Å; W974-A978 VanDerWaalsContact O-CB 3.22Å; W974-A978 WeakPolarHBondContact O-CB 3.15Å; W974-A978 PolarHBondContact O-N 2.94Å
975	K	87.6	Confident	85.2	Confident	41 Å²	41	41.6 Å²	41.6	18%	0.178	21%	0.209	C	C	.	.	H	α-helix	trans	-64	-40	177.7	-77.6	172	178.1	162.9	0	112.9	I946 S949 D971 L972 L979	I946-K975 HydrophobicContact CD1-CB 4.1Å; I946-K975 HydrophobicContact CG1-CB 4.07Å; I946-K975 HydrophobicContact CG1-CD 4.28Å; S949-K975 PolarHBondContact OG-NZ 3.5Å; D971-K975 WeakPolarHBondContact O-CB 3.49Å; D971-K975 VanDerWaalsContact O-CG 3.27Å; D971-K975 WeakPolarHBondContact O-CG 3.28Å; D971-K975 PolarHBondContact O-N 3.4Å; D971-K975 WeakPolarHBondContact OD1-CE 3.45Å; D971-K975 IonicContact OD1-NZ 3.49Å; D971-K975 PolarHBondContact OD1-NZ 3.23Å; D971-K975 WeakPolarHBondContact OD2-CE 3.48Å; D971-K975 IonicContact OD2-NZ 3.99Å; D971-K975 PolarHBondContact OD2-NZ 2.92Å; L972-K975 PolarHBondContact O-N 2.98Å; K975-L979 WeakPolarHBondContact O-CB 3.25Å; K975-L979 PolarHBondContact O-N 2.99Å; K975-L979 VanDerWaalsContact O-N 3.07Å
976	L	87.1	Confident	85.4	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-67	-44.8	177	-71.7	173.2	0	0	0	111.6	I946 L972 F973 W974 L979 Q980 M1004 A1005 M1008 L1056	I946-L976 HydrophobicContact CD1-CD2 4.07Å; I946-L976 HydrophobicContact CG2-CD2 4.48Å; L972-L976 HydrophobicContact CD1-CD1 3.81Å; L972-L976 HydrophobicContact CD1-CG 4.06Å; L972-L976 HydrophobicContact CG-CD1 4.11Å; L972-L976 WeakPolarHBondContact O-CG 3.03Å; L972-L976 PolarHBondContact O-N 2.87Å; F973-L976 PolarHBondContact O-N 3.38Å; W974-L976 PolarHBondContact O-N 3.24Å; L976-L979 PolarHBondContact O-N 3.04Å; L976-Q980 WeakPolarHBondContact O-CG 3.49Å; L976-Q980 PolarHBondContact O-N 2.91Å; L976-M1004 HydrophobicContact CD2-CE 3.97Å; L976-A1005 HydrophobicContact CD1-CB 4.26Å; L976-A1005 HydrophobicContact CD2-CB 4.21Å; L976-M1008 HydrophobicContact CD1-CB 4.26Å; L976-L1056 HydrophobicContact CB-CD1 4.18Å; L976-L1056 HydrophobicContact CD1-CD1 4.43Å
977	D	83.8	Confident	85.2	Confident	47 Å²	47	44.7 Å²	44.7	25%	0.251	22%	0.223	S	C	.	.	H	α-helix	trans	-63.1	-46.6	177.2	-165.8	74.4	0	0	0	111	F973 W974 L979 Q980 M981 K1055 L1056	F973-D977 WeakPolarHBondContact O-CB 3.32Å; F973-D977 PolarHBondContact O-N 3.31Å; W974-D977 PolarHBondContact O-N 3.47Å; D977-L979 VanDerWaalsContact C-N 3.32Å; D977-L979 PolarHBondContact O-N 3.31Å; D977-Q980 PolarHBondContact O-N 3.22Å; D977-M981 WeakPolarHBondContact O-CB 3.24Å; D977-M981 WeakPolarHBondContact O-CG 3.26Å; D977-M981 PolarHBondContact O-N 3.43Å; D977-K1055 IonicContact OD1-NZ 3.03Å; D977-K1055 PolarHBondContact OD1-NZ 3.37Å; D977-K1055 IonicContact OD2-NZ 2.56Å; D977-L1056 HydrophobicContact CB-CD2 4.1Å
978	A	86.3	Confident	85.3	Confident	39 Å²	39	43.3 Å²	43.3	32%	0.322	21%	0.207	S	C	.	.	H	α-helix	trans	-60.6	-39	177.6	0	0	0	0	0	112.6	W974 F982	W974-A978 VanDerWaalsContact O-CB 3.22Å; W974-A978 WeakPolarHBondContact O-CB 3.15Å; W974-A978 PolarHBondContact O-N 2.94Å; A978-F982 WeakPolarHBondContact O-CB 3.45Å; A978-F982 PolarHBondContact O-N 3Å
979	L	87.4	Confident	85	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-70.9	-38.2	177.6	-177.8	61.4	0	0	0	112.5	Y938 M942 I946 K975 L976 D977 F982 V983 L1001 M1004	Y938-L979 HydrophobicContact CD1-CD1 4.02Å; Y938-L979 HydrophobicContact CE1-CD1 3.55Å; M942-L979 HydrophobicContact CB-CD1 4.28Å; M942-L979 HydrophobicContact CB-CD2 3.89Å; M942-L979 HydrophobicContact CG-CD1 4.23Å; I946-L979 HydrophobicContact CD1-CD2 4.39Å; K975-L979 WeakPolarHBondContact O-CB 3.25Å; K975-L979 PolarHBondContact O-N 2.99Å; K975-L979 VanDerWaalsContact O-N 3.07Å; L976-L979 PolarHBondContact O-N 3.04Å; D977-L979 VanDerWaalsContact C-N 3.32Å; D977-L979 PolarHBondContact O-N 3.31Å; L979-F982 HydrophobicContact CD1-CD1 4.38Å; L979-F982 PolarHBondContact O-N 3.49Å; L979-V983 PolarHBondContact O-N 3Å; L979-V983 VanDerWaalsContact O-N 3.13Å; L979-L1001 HydrophobicContact CD2-CD2 3.7Å; L979-L1001 HydrophobicContact CG-CD2 3.75Å; L979-M1004 HydrophobicContact CD2-CE 3.33Å; L979-M1004 HydrophobicContact CD2-SD 4.37Å
980	Q	84.8	Confident	84.8	Confident	41 Å²	41	47.8 Å²	47.8	19%	0.192	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-44.6	173.7	-73.9	-176	-1.3	0	0	111.7	L976 D977 F982 V983 F984 L1001 L1056	L976-Q980 WeakPolarHBondContact O-CG 3.49Å; L976-Q980 PolarHBondContact O-N 2.91Å; D977-Q980 PolarHBondContact O-N 3.22Å; Q980-F982 VanDerWaalsContact C-N 3.35Å; Q980-F982 PolarHBondContact O-N 3.25Å; Q980-V983 PolarHBondContact O-N 3.2Å; Q980-F984 WeakPolarHBondContact O-CB 3.3Å; Q980-F984 PolarHBondContact O-N 2.69Å; Q980-L1001 HydrophobicContact CG-CB 4.38Å; Q980-L1001 HydrophobicContact CG-CD1 4.33Å; Q980-L1056 PolarHBondContact NE2-O 3.45Å
981	M	84.9	Confident	84.5	Confident	89 Å²	89	54 Å²	54	44%	0.438	26%	0.257	S	S	.	.	H	α-helix	trans	-61.7	-42.8	174.9	-70.3	-55.4	-54.5	0	0	111.6	D977 V983 F984 D985	D977-M981 WeakPolarHBondContact O-CB 3.24Å; D977-M981 WeakPolarHBondContact O-CG 3.26Å; D977-M981 PolarHBondContact O-N 3.43Å; M981-V983 PolarHBondContact O-N 2.93Å; M981-F984 WeakPolarHBondContact O-CB 3.2Å; M981-F984 PolarHBondContact O-N 3.08Å; M981-D985 WeakPolarHBondContact O-CB 3.44Å; M981-D985 PolarHBondContact O-N 3.46Å
982	F	86.5	Confident	84.4	Confident	37 Å²	37	59.8 Å²	59.8	16%	0.162	28%	0.283	C	S	.	.	H	α-helix	trans	-56.1	-51.1	175.9	169.1	-99.7	0	0	0	112.1	F902 Y938 A978 L979 Q980 F984 D985 L986	F902-F982 HydrophobicContact CB-CE2 4.19Å; F902-F982 HydrophobicContact CB-CZ 4.38Å; F902-F982 HydrophobicContact CD1-CZ 4.09Å; F902-F982 AromaticContact CD2-CE2 3.73Å; F902-F982 HydrophobicContact CD2-CE2 3.73Å; F902-F982 AromaticContact CD2-CZ 3.43Å; F902-F982 HydrophobicContact CD2-CZ 3.43Å; F902-F982 VanDerWaalsContact CD2-CZ 3.43Å; F902-F982 HydrophobicContact CE1-CZ 4.2Å; F902-F982 HydrophobicContact CE2-CE1 4.36Å; F902-F982 HydrophobicContact CE2-CE2 4.24Å; F902-F982 AromaticContact CE2-CZ 3.52Å; F902-F982 HydrophobicContact CE2-CZ 3.52Å; F902-F982 AromaticContact CG-CE2 4Å; F902-F982 HydrophobicContact CG-CE2 4Å; F902-F982 AromaticContact CG-CZ 3.73Å; F902-F982 HydrophobicContact CG-CZ 3.73Å; F902-F982 AromaticContact CZ-CZ 3.93Å; F902-F982 HydrophobicContact CZ-CZ 3.93Å; Y938-F982 AromaticContact CD1-CD1 3.89Å; Y938-F982 HydrophobicContact CD1-CD1 3.89Å; Y938-F982 AromaticContact CD1-CE1 3.47Å; Y938-F982 HydrophobicContact CD1-CE1 3.47Å; Y938-F982 VanDerWaalsContact CD1-CE1 3.47Å; Y938-F982 HydrophobicContact CD1-CZ 4.17Å; Y938-F982 AromaticContact CE1-CD1 3.54Å; Y938-F982 HydrophobicContact CE1-CD1 3.54Å; Y938-F982 AromaticContact CE1-CE1 3.54Å; Y938-F982 HydrophobicContact CE1-CE1 3.54Å; Y938-F982 HydrophobicContact CE1-CG 4.17Å; Y938-F982 HydrophobicContact CE1-CZ 4.16Å; Y938-F982 HydrophobicContact CG-CE1 4.46Å; A978-F982 WeakPolarHBondContact O-CB 3.45Å; A978-F982 PolarHBondContact O-N 3Å; L979-F982 HydrophobicContact CD1-CD1 4.38Å; L979-F982 PolarHBondContact O-N 3.49Å; Q980-F982 VanDerWaalsContact C-N 3.35Å; Q980-F982 PolarHBondContact O-N 3.25Å; F982-F984 VanDerWaalsContact C-N 3.33Å; F982-F984 PolarHBondContact O-N 2.75Å; F982-D985 PolarHBondContact O-N 3.05Å; F982-L986 HydrophobicContact CD1-CD1 4.4Å; F982-L986 HydrophobicContact CE1-CD1 3.75Å; F982-L986 HydrophobicContact CE1-CG 4.33Å; F982-L986 HydrophobicContact CE2-CD2 4.25Å; F982-L986 HydrophobicContact CZ-CD1 3.9Å; F982-L986 HydrophobicContact CZ-CD2 4.07Å; F982-L986 HydrophobicContact CZ-CG 4.19Å; F982-L986 WeakPolarHBondContact O-CG 3.44Å; F982-L986 PolarHBondContact O-N 3.22Å; F982-L986 VanDerWaalsContact O-N 3.16Å
983	V	84.9	Confident	84.3	Confident	17 Å²	17	61 Å²	61	10%	0.103	29%	0.288	C	S	.	.	H	α-helix	trans	-67.8	-34.4	-179.9	171.8	0	0	0	0	112	V939 L979 Q980 M981 L986 L997 L1001	V939-V983 HydrophobicContact CG2-CG2 4.46Å; L979-V983 PolarHBondContact O-N 3Å; L979-V983 VanDerWaalsContact O-N 3.13Å; Q980-V983 PolarHBondContact O-N 3.2Å; M981-V983 PolarHBondContact O-N 2.93Å; V983-L986 WeakPolarHBondContact O-CB 3.35Å; V983-L986 PolarHBondContact O-N 3.38Å; V983-L997 HydrophobicContact CG1-CB 4.09Å; V983-L997 HydrophobicContact CG1-CD1 4.2Å; V983-L1001 HydrophobicContact CB-CD1 3.64Å; V983-L1001 HydrophobicContact CG1-CD1 3.95Å; V983-L1001 HydrophobicContact CG2-CD1 3.66Å
984	F	82.8	Confident	84.1	Confident	142 Å²	142	62 Å²	62	62%	0.623	30%	0.298	S	S	*	.	H	α-helix	trans	-62.3	-46.1	173.3	-176.7	-96.8	0	0	0	111.6	Q980 M981 F982 L986 H987	Q980-F984 WeakPolarHBondContact O-CB 3.3Å; Q980-F984 PolarHBondContact O-N 2.69Å; M981-F984 WeakPolarHBondContact O-CB 3.2Å; M981-F984 PolarHBondContact O-N 3.08Å; F982-F984 VanDerWaalsContact C-N 3.33Å; F982-F984 PolarHBondContact O-N 2.75Å; F984-L986 PolarHBondContact O-N 3.38Å; F984-H987 PolarHBondContact O-N 2.93Å
985	D	83.7	Confident	83.8	Confident	68 Å²	68	58.7 Å²	58.7	36%	0.364	29%	0.289	S	S	.	.	H	α-helix	trans	-68.7	-19.4	-179	-69.9	-18.7	0	0	0	113.3	Q906 M981 F982 H987	Q906-D985 PolarHBondContact NE2-O 2.97Å; M981-D985 WeakPolarHBondContact O-CB 3.44Å; M981-D985 PolarHBondContact O-N 3.46Å; F982-D985 PolarHBondContact O-N 3.05Å; D985-H987 PolarHBondContact O-N 3.25Å; D985-H987 PolarHBondContact O-ND1 2.91Å
986	L	83.8	Confident	83.7	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.005	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-24.4	170.9	-69.6	177.1	0	0	0	112.5	F902 F905 Q906 N909 V935 F982 V983 F984 W988	F902-L986 HydrophobicContact CD1-CD2 4.33Å; F905-L986 HydrophobicContact CD1-CD2 3.94Å; F905-L986 HydrophobicContact CE1-CB 4.3Å; F905-L986 HydrophobicContact CE1-CD2 4.33Å; F905-L986 WeakPolarHBondContact CE1-O 3.42Å; Q906-L986 HydrophobicContact CG-CD2 4.04Å; N909-L986 PolarHBondContact ND2-O 3.48Å; V935-L986 HydrophobicContact CG1-CD1 4.11Å; V935-L986 HydrophobicContact CG2-CD1 3.82Å; F982-L986 HydrophobicContact CD1-CD1 4.4Å; F982-L986 HydrophobicContact CE1-CD1 3.75Å; F982-L986 HydrophobicContact CE1-CG 4.33Å; F982-L986 HydrophobicContact CE2-CD2 4.25Å; F982-L986 HydrophobicContact CZ-CD1 3.9Å; F982-L986 HydrophobicContact CZ-CD2 4.07Å; F982-L986 HydrophobicContact CZ-CG 4.19Å; F982-L986 WeakPolarHBondContact O-CG 3.44Å; F982-L986 PolarHBondContact O-N 3.22Å; F982-L986 VanDerWaalsContact O-N 3.16Å; V983-L986 WeakPolarHBondContact O-CB 3.35Å; V983-L986 PolarHBondContact O-N 3.38Å; F984-L986 PolarHBondContact O-N 3.38Å; L986-W988 PolarHBondContact O-N 3Å
987	H	81.4	Confident	83.6	Confident	65 Å²	65	61.4 Å²	61.4	30%	0.301	30%	0.302	S	S	.	.			trans	50	53.6	179	-62.6	102.7	0	0	0	114.5	N909 R913 F984 D985	N909-H987 PolarHBondContact ND2-O 2.93Å; R913-H987 VanDerWaalsContact NH1-CB 3.32Å; R913-H987 PolarHBondContact NH1-CD2 3.27Å; R913-H987 PolarHBondContact NH2-CD2 3.25Å; R913-H987 PolarHBondContact NH2-ND1 3.35Å; F984-H987 PolarHBondContact O-N 2.93Å; D985-H987 PolarHBondContact O-N 3.25Å; D985-H987 PolarHBondContact O-ND1 2.91Å
988	W	84.6	Confident	83.6	Confident	24 Å²	24	63.4 Å²	63.4	9%	0.091	31%	0.31	C	S	.	.			trans	-57.6	128.3	-170.8	-162.4	-89.4	0	0	0	112.9	F905 Q928 F931 V932 V935 L986 F993 A994	F905-W988 AromaticContact CE1-CE3 3.99Å; F905-W988 HydrophobicContact CE1-CE3 3.99Å; F905-W988 HydrophobicContact CE1-CZ3 4Å; F905-W988 HydrophobicContact CE2-CH2 4.31Å; F905-W988 AromaticContact CE2-CZ3 3.97Å; F905-W988 HydrophobicContact CE2-CZ3 3.97Å; F905-W988 HydrophobicContact CZ-CD2 4.45Å; F905-W988 AromaticContact CZ-CE3 3.63Å; F905-W988 HydrophobicContact CZ-CE3 3.63Å; F905-W988 HydrophobicContact CZ-CH2 4.16Å; F905-W988 AromaticContact CZ-CZ3 3.47Å; F905-W988 HydrophobicContact CZ-CZ3 3.47Å; F905-W988 VanDerWaalsContact CZ-CZ3 3.47Å; Q928-W988 HydrophobicContact CB-CH2 4.43Å; Q928-W988 HydrophobicContact CB-CZ2 3.92Å; Q928-W988 HydrophobicContact CG-CZ2 4.07Å; F931-W988 HydrophobicContact CB-CH2 4.3Å; F931-W988 HydrophobicContact CB-CZ3 4.39Å; V932-W988 HydrophobicContact CB-CH2 4.39Å; V932-W988 HydrophobicContact CB-CZ2 4.47Å; V932-W988 HydrophobicContact CG2-CH2 3.58Å; V932-W988 HydrophobicContact CG2-CZ2 3.26Å; V935-W988 HydrophobicContact CG2-CZ3 4.16Å; L986-W988 PolarHBondContact O-N 3Å; W988-F993 AromaticContact CD1-CD1 3.6Å; W988-F993 AromaticContact CD2-CD1 3.7Å; W988-F993 HydrophobicContact CD2-CD1 3.7Å; W988-F993 AromaticContact CD2-CE1 3.99Å; W988-F993 HydrophobicContact CD2-CE1 3.99Å; W988-F993 AromaticContact CE2-CD1 3.37Å; W988-F993 AromaticContact CE2-CE1 3.77Å; W988-F993 HydrophobicContact CE3-CD1 4.46Å; W988-F993 HydrophobicContact CE3-CE1 4.31Å; W988-F993 AromaticContact CG-CD1 3.87Å; W988-F993 HydrophobicContact CG-CD1 3.87Å; W988-F993 HydrophobicContact CH2-CE1 4.27Å; W988-F993 AromaticContact CZ2-CD1 3.93Å; W988-F993 HydrophobicContact CZ2-CD1 3.93Å; W988-F993 AromaticContact CZ2-CE1 3.95Å; W988-F993 HydrophobicContact CZ2-CE1 3.95Å; W988-F993 HydrophobicContact CZ3-CE1 4.44Å; W988-F993 AromaticContact NE1-CD1 3.29Å; W988-F993 VanDerWaalsContact NE1-CD1 3.29Å; W988-F993 AromaticContact NE1-CG 3.92Å; W988-A994 HydrophobicContact CB-CB 3.97Å
989	P	79.3	Confident	83.4	Confident	24 Å²	24	63.8 Å²	63.8	16%	0.156	31%	0.306	C	S	.	.	S	Bend	trans	-66.7	-39.4	-174.5	-24.6	34.3	0	0	0	115.1	N909 H924 Q928 Q991	N909-P989 WeakPolarHBondContact OD1-CG 3.33Å; H924-P989 VanDerWaalsContact CE1-CB 3.48Å; H924-P989 WeakPolarHBondContact CE1-CB 3.38Å; H924-P989 WeakPolarHBondContact CE1-CG 3.4Å; H924-P989 WeakPolarHBondContact NE2-CG 3.33Å; Q928-P989 HydrophobicContact CG-CG 4.4Å; P989-Q991 PolarHBondContact O-N 2.73Å
990	E	81.6	Confident	83.3	Confident	87 Å²	87	66.7 Å²	66.7	41%	0.407	32%	0.316	S	S	.	.			trans	-79.7	111	-178.8	-65.4	-175.6	153	0	0	110.2	Q928 E992 F993 A994	Q928-E990 VanDerWaalsContact OE1-CG 3.29Å; Q928-E990 PolarHBondContact OE1-OE1 3.12Å; E990-E992 PolarHBondContact O-N 3.43Å; E990-F993 HydrophobicContact CB-CB 4.29Å; E990-F993 PolarHBondContact O-N 3.29Å; E990-A994 WeakPolarHBondContact O-CB 3.41Å; E990-A994 PolarHBondContact O-N 2.78Å
991	Q	78.3	Confident	83.4	Confident	172 Å²	172	65 Å²	65	80%	0.804	31%	0.309	S	S	*	.	H	α-helix	trans	-57.9	-35.5	-178.7	-69.2	-175.8	-9.6	0	0	112.7	P989 H995	P989-Q991 PolarHBondContact O-N 2.73Å; Q991-H995 WeakPolarHBondContact O-CB 3.41Å; Q991-H995 PolarHBondContact O-N 3.13Å
992	E	82.8	Confident	83.2	Confident	175 Å²	175	62 Å²	62	82%	0.818	29%	0.293	S	S	*	.	H	α-helix	trans	-64.6	-48.1	179.4	-64.6	-174.1	176.5	0	0	112	E990 H996	E990-E992 PolarHBondContact O-N 3.43Å; E992-H996 WeakPolarHBondContact O-CB 3.4Å; E992-H996 PolarHBondContact O-N 2.94Å
993	F	83.8	Confident	83.1	Confident	31 Å²	31	63.2 Å²	63.2	14%	0.136	30%	0.301	C	S	.	.	H	α-helix	trans	-72.8	-38	179.1	-175	-104	0	0	0	112.2	V932 V936 W988 E990 H995 H996 L997	V932-F993 HydrophobicContact CB-CZ 4.39Å; V932-F993 HydrophobicContact CG1-CE2 3.97Å; V932-F993 HydrophobicContact CG1-CZ 3.86Å; V932-F993 HydrophobicContact CG2-CE1 4.16Å; V932-F993 HydrophobicContact CG2-CZ 4.19Å; V936-F993 HydrophobicContact CG2-CE2 4.16Å; V936-F993 HydrophobicContact CG2-CZ 3.91Å; W988-F993 AromaticContact CD1-CD1 3.6Å; W988-F993 AromaticContact CD2-CD1 3.7Å; W988-F993 HydrophobicContact CD2-CD1 3.7Å; W988-F993 AromaticContact CD2-CE1 3.99Å; W988-F993 HydrophobicContact CD2-CE1 3.99Å; W988-F993 AromaticContact CE2-CD1 3.37Å; W988-F993 AromaticContact CE2-CE1 3.77Å; W988-F993 HydrophobicContact CE3-CD1 4.46Å; W988-F993 HydrophobicContact CE3-CE1 4.31Å; W988-F993 AromaticContact CG-CD1 3.87Å; W988-F993 HydrophobicContact CG-CD1 3.87Å; W988-F993 HydrophobicContact CH2-CE1 4.27Å; W988-F993 AromaticContact CZ2-CD1 3.93Å; W988-F993 HydrophobicContact CZ2-CD1 3.93Å; W988-F993 AromaticContact CZ2-CE1 3.95Å; W988-F993 HydrophobicContact CZ2-CE1 3.95Å; W988-F993 HydrophobicContact CZ3-CE1 4.44Å; W988-F993 AromaticContact NE1-CD1 3.29Å; W988-F993 VanDerWaalsContact NE1-CD1 3.29Å; W988-F993 AromaticContact NE1-CG 3.92Å; E990-F993 HydrophobicContact CB-CB 4.29Å; E990-F993 PolarHBondContact O-N 3.29Å; F993-H995 VanDerWaalsContact C-N 3.33Å; F993-H995 PolarHBondContact O-N 3.12Å; F993-H996 PolarHBondContact O-N 3.06Å; F993-L997 HydrophobicContact CD1-CD1 3.75Å; F993-L997 HydrophobicContact CD1-CG 4.14Å; F993-L997 HydrophobicContact CE1-CD1 3.3Å; F993-L997 HydrophobicContact CE1-CD2 4.37Å; F993-L997 HydrophobicContact CE1-CG 3.81Å; F993-L997 HydrophobicContact CE2-CG 4.42Å; F993-L997 HydrophobicContact CZ-CD1 3.86Å; F993-L997 HydrophobicContact CZ-CD2 4.07Å; F993-L997 HydrophobicContact CZ-CG 3.94Å; F993-L997 WeakPolarHBondContact O-CG 3.29Å; F993-L997 PolarHBondContact O-N 2.98Å
994	A	83.3	Confident	83.2	Confident	30 Å²	30	62.7 Å²	62.7	25%	0.248	30%	0.297	C	S	.	.	H	α-helix	trans	-57.6	-47.3	173.6	0	0	0	0	0	111	W988 E990 L997 E998	W988-A994 HydrophobicContact CB-CB 3.97Å; E990-A994 WeakPolarHBondContact O-CB 3.41Å; E990-A994 PolarHBondContact O-N 2.78Å; A994-L997 PolarHBondContact O-N 2.93Å; A994-E998 WeakPolarHBondContact O-CB 3.41Å; A994-E998 PolarHBondContact O-N 3.28Å
995	H	82.1	Confident	83.4	Confident	98 Å²	98	55.9 Å²	55.9	45%	0.454	27%	0.268	S	S	.	.	H	α-helix	trans	-65.2	-41.6	177.2	-172.1	64.8	0	0	0	111.9	Q991 F993 L997 E998 Q999	Q991-H995 WeakPolarHBondContact O-CB 3.41Å; Q991-H995 PolarHBondContact O-N 3.13Å; F993-H995 VanDerWaalsContact C-N 3.33Å; F993-H995 PolarHBondContact O-N 3.12Å; H995-L997 PolarHBondContact O-N 3.46Å; H995-E998 PolarHBondContact O-N 2.98Å; H995-Q999 VanDerWaalsContact O-CB 3.24Å; H995-Q999 WeakPolarHBondContact O-CB 3.27Å; H995-Q999 PolarHBondContact O-N 3.23Å
996	H	85.1	Confident	83.4	Confident	97 Å²	97	53 Å²	53	45%	0.449	25%	0.253	S	S	.	.	H	α-helix	trans	-60.8	-43.4	175.2	175	-98.5	0	0	0	112.4	E992 F993 R1000	E992-H996 WeakPolarHBondContact O-CB 3.4Å; E992-H996 PolarHBondContact O-N 2.94Å; F993-H996 PolarHBondContact O-N 3.06Å; H996-R1000 VanDerWaalsContact O-CB 3.26Å; H996-R1000 WeakPolarHBondContact O-CB 3.35Å; H996-R1000 PolarHBondContact O-N 3.16Å
997	L	85	Confident	83.5	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-64.4	-46.7	175.2	-76.4	178.6	0	0	0	111.7	V935 V983 F993 A994 H995 Q999 R1000 L1001	V935-L997 HydrophobicContact CG1-CD1 3.79Å; V935-L997 HydrophobicContact CG1-CD2 4.29Å; V983-L997 HydrophobicContact CG1-CB 4.09Å; V983-L997 HydrophobicContact CG1-CD1 4.2Å; F993-L997 HydrophobicContact CD1-CD1 3.75Å; F993-L997 HydrophobicContact CD1-CG 4.14Å; F993-L997 HydrophobicContact CE1-CD1 3.3Å; F993-L997 HydrophobicContact CE1-CD2 4.37Å; F993-L997 HydrophobicContact CE1-CG 3.81Å; F993-L997 HydrophobicContact CE2-CG 4.42Å; F993-L997 HydrophobicContact CZ-CD1 3.86Å; F993-L997 HydrophobicContact CZ-CD2 4.07Å; F993-L997 HydrophobicContact CZ-CG 3.94Å; F993-L997 WeakPolarHBondContact O-CG 3.29Å; F993-L997 PolarHBondContact O-N 2.98Å; A994-L997 PolarHBondContact O-N 2.93Å; H995-L997 PolarHBondContact O-N 3.46Å; L997-Q999 PolarHBondContact O-N 2.82Å; L997-R1000 PolarHBondContact O-N 3.36Å; L997-L1001 WeakPolarHBondContact O-CG 3.39Å; L997-L1001 PolarHBondContact O-N 3.02Å
998	E	82.9	Confident	83.8	Confident	89 Å²	89	55 Å²	55	42%	0.416	27%	0.266	S	S	.	.	H	α-helix	trans	-59.3	-47	177.7	-174.7	-174.6	-179.4	0	0	111.4	A994 H995 R1000 L1001 K1002	A994-E998 WeakPolarHBondContact O-CB 3.41Å; A994-E998 PolarHBondContact O-N 3.28Å; H995-E998 PolarHBondContact O-N 2.98Å; E998-R1000 VanDerWaalsContact C-N 3.34Å; E998-R1000 PolarHBondContact O-N 2.68Å; E998-L1001 PolarHBondContact O-N 3.49Å; E998-K1002 HydrophobicContact CG-CD 4.24Å; E998-K1002 WeakPolarHBondContact O-CG 3.22Å; E998-K1002 PolarHBondContact O-N 3.39Å; E998-K1002 VanDerWaalsContact OE1-CE 3.3Å; E998-K1002 WeakPolarHBondContact OE1-CE 3.29Å; E998-K1002 IonicContact OE1-NZ 2.68Å; E998-K1002 PolarHBondContact OE1-NZ 2.86Å
999	Q	82.6	Confident	84	Confident	48 Å²	48	53.9 Å²	53.9	22%	0.224	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-45.5	176.6	-171.8	-179.1	23.5	0	0	111	H995 L997 L1001 K1002 L1003 E1064	H995-Q999 VanDerWaalsContact O-CB 3.24Å; H995-Q999 WeakPolarHBondContact O-CB 3.27Å; H995-Q999 PolarHBondContact O-N 3.23Å; L997-Q999 PolarHBondContact O-N 2.82Å; Q999-L1001 PolarHBondContact O-N 3.32Å; Q999-K1002 PolarHBondContact O-N 3.39Å; Q999-L1003 HydrophobicContact CG-CD1 4.42Å; Q999-L1003 WeakPolarHBondContact O-CG 3.17Å; Q999-L1003 PolarHBondContact O-N 3.5Å; Q999-E1064 VanDerWaalsContact NE2-CD 3.27Å; Q999-E1064 PolarHBondContact NE2-OE1 3Å; Q999-E1064 PolarHBondContact NE2-OE2 3.37Å
1000	R	85.7	Confident	84.4	Confident	62 Å²	62	55.6 Å²	55.6	23%	0.234	27%	0.267	C	S	.	.	H	α-helix	trans	-60.8	-44.5	177.4	-176.6	176.3	178.6	-174.4	-1.8	112.3	D940 E943 H996 L997 E998 K1002 L1003 M1004	D940-R1000 IonicContact OD1-CZ 3.85Å; D940-R1000 IonicContact OD1-NH1 3.57Å; D940-R1000 PolarHBondContact OD1-NH1 3.01Å; D940-R1000 IonicContact OD1-NH2 2.64Å; D940-R1000 PolarHBondContact OD1-NH2 3.07Å; E943-R1000 IonicContact OE2-CZ 3.99Å; E943-R1000 IonicContact OE2-NE 3.58Å; E943-R1000 IonicContact OE2-NH2 3.12Å; E943-R1000 PolarHBondContact OE2-NH2 3.29Å; H996-R1000 VanDerWaalsContact O-CB 3.26Å; H996-R1000 WeakPolarHBondContact O-CB 3.35Å; H996-R1000 PolarHBondContact O-N 3.16Å; L997-R1000 PolarHBondContact O-N 3.36Å; E998-R1000 VanDerWaalsContact C-N 3.34Å; E998-R1000 PolarHBondContact O-N 2.68Å; R1000-K1002 VanDerWaalsContact C-N 3.32Å; R1000-K1002 PolarHBondContact O-N 3.26Å; R1000-L1003 PolarHBondContact O-N 3.23Å; R1000-M1004 WeakPolarHBondContact O-CB 3.47Å; R1000-M1004 PolarHBondContact O-N 3.49Å
1001	L	85.6	Confident	84.7	Confident	6 Å²	6	52.4 Å²	52.4	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-38.2	177.5	-71.8	179.7	0	0	0	112.4	V939 L979 Q980 V983 L997 E998 Q999 M1004 A1005	V939-L1001 HydrophobicContact CG1-CD2 4.04Å; V939-L1001 HydrophobicContact CG2-CD2 4.42Å; L979-L1001 HydrophobicContact CD2-CD2 3.7Å; L979-L1001 HydrophobicContact CG-CD2 3.75Å; Q980-L1001 HydrophobicContact CG-CB 4.38Å; Q980-L1001 HydrophobicContact CG-CD1 4.33Å; V983-L1001 HydrophobicContact CB-CD1 3.64Å; V983-L1001 HydrophobicContact CG1-CD1 3.95Å; V983-L1001 HydrophobicContact CG2-CD1 3.66Å; L997-L1001 WeakPolarHBondContact O-CG 3.39Å; L997-L1001 PolarHBondContact O-N 3.02Å; E998-L1001 PolarHBondContact O-N 3.49Å; Q999-L1001 PolarHBondContact O-N 3.32Å; L1001-M1004 HydrophobicContact CD2-CE 3.75Å; L1001-M1004 PolarHBondContact O-N 2.56Å; L1001-A1005 WeakPolarHBondContact O-CB 3.17Å; L1001-A1005 PolarHBondContact O-N 3.37Å
1002	K	82.3	Confident	85.2	Confident	25 Å²	25	44.2 Å²	44.2	11%	0.109	22%	0.218	C	C	.	.	H	α-helix	trans	-68.2	-41.8	176.7	-72	173.2	-177.6	179	0	111.9	E998 Q999 R1000 A1005 S1006 C1057 A1058 L1059	E998-K1002 HydrophobicContact CG-CD 4.24Å; E998-K1002 WeakPolarHBondContact O-CG 3.22Å; E998-K1002 PolarHBondContact O-N 3.39Å; E998-K1002 VanDerWaalsContact OE1-CE 3.3Å; E998-K1002 WeakPolarHBondContact OE1-CE 3.29Å; E998-K1002 IonicContact OE1-NZ 2.68Å; E998-K1002 PolarHBondContact OE1-NZ 2.86Å; Q999-K1002 PolarHBondContact O-N 3.39Å; R1000-K1002 VanDerWaalsContact C-N 3.32Å; R1000-K1002 PolarHBondContact O-N 3.26Å; K1002-A1005 PolarHBondContact O-N 3.24Å; K1002-S1006 VanDerWaalsContact O-CB 3.32Å; K1002-S1006 WeakPolarHBondContact O-CB 3.13Å; K1002-S1006 PolarHBondContact O-N 3.13Å; K1002-C1057 WeakPolarHBondContact CD-O 3.4Å; K1002-A1058 VanDerWaalsContact CE-O 3.24Å; K1002-A1058 WeakPolarHBondContact CE-O 3.33Å; K1002-A1058 PolarHBondContact NZ-O 2.79Å; K1002-L1059 HydrophobicContact CB-CD2 4.49Å; K1002-L1059 HydrophobicContact CD-CD2 3.31Å; K1002-L1059 HydrophobicContact CD-CG 3.83Å
1003	L	83.6	Confident	85.5	Confident	64 Å²	64	35.9 Å²	35.9	34%	0.335	18%	0.179	S	C	.	.	H	α-helix	trans	-61.9	-44.8	173.5	-72.5	173.6	0	0	0	111.7	Q999 R1000 S1006 D1007 Y1067	Q999-L1003 HydrophobicContact CG-CD1 4.42Å; Q999-L1003 WeakPolarHBondContact O-CG 3.17Å; Q999-L1003 PolarHBondContact O-N 3.5Å; R1000-L1003 PolarHBondContact O-N 3.23Å; L1003-S1006 VanDerWaalsContact O-CB 3.25Å; L1003-S1006 WeakPolarHBondContact O-CB 3.3Å; L1003-S1006 PolarHBondContact O-N 3.12Å; L1003-D1007 PolarHBondContact O-N 3.4Å; L1003-Y1067 HydrophobicContact CD2-CD1 4.31Å; L1003-Y1067 HydrophobicContact CD2-CE1 4.33Å; L1003-Y1067 HydrophobicContact CD2-CG 4.43Å
1004	M	87	Confident	85.7	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.025	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-45.9	175.8	178.6	-171.2	71.3	0	0	111.6	E943 L976 L979 R1000 L1001 S1006 D1007 M1008	E943-M1004 HydrophobicContact CB-CG 4.37Å; E943-M1004 HydrophobicContact CB-SD 3.46Å; E943-M1004 WeakPolarHBondContact CB-SD 3.28Å; E943-M1004 HydrophobicContact CG-CG 3.91Å; E943-M1004 HydrophobicContact CG-SD 3.67Å; L976-M1004 HydrophobicContact CD2-CE 3.97Å; L979-M1004 HydrophobicContact CD2-CE 3.33Å; L979-M1004 HydrophobicContact CD2-SD 4.37Å; R1000-M1004 WeakPolarHBondContact O-CB 3.47Å; R1000-M1004 PolarHBondContact O-N 3.49Å; L1001-M1004 HydrophobicContact CD2-CE 3.75Å; L1001-M1004 PolarHBondContact O-N 2.56Å; M1004-S1006 VanDerWaalsContact C-N 3.26Å; M1004-S1006 PolarHBondContact O-N 2.91Å; M1004-D1007 PolarHBondContact O-N 2.98Å; M1004-M1008 HydrophobicContact CG-CE 4.2Å; M1004-M1008 HydrophobicContact CG-CG 4.32Å; M1004-M1008 WeakPolarHBondContact O-CB 3.17Å; M1004-M1008 WeakPolarHBondContact O-CG 3.25Å; M1004-M1008 PolarHBondContact O-N 2.93Å
1005	A	86.4	Confident	85.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.4	-41.3	175.7	0	0	0	0	0	111.5	L976 L1001 K1002 M1008 L1009 L1056	L976-A1005 HydrophobicContact CD1-CB 4.26Å; L976-A1005 HydrophobicContact CD2-CB 4.21Å; L1001-A1005 WeakPolarHBondContact O-CB 3.17Å; L1001-A1005 PolarHBondContact O-N 3.37Å; K1002-A1005 PolarHBondContact O-N 3.24Å; A1005-M1008 PolarHBondContact O-N 3.14Å; A1005-L1009 VanDerWaalsContact O-CB 3.3Å; A1005-L1009 WeakPolarHBondContact O-CB 3.41Å; A1005-L1009 WeakPolarHBondContact O-CD1 3.23Å; A1005-L1009 WeakPolarHBondContact O-CG 3.14Å; A1005-L1009 PolarHBondContact O-N 3.2Å; A1005-L1056 HydrophobicContact CB-CB 4.47Å
1006	S	84.8	Confident	86.3	Confident	8 Å²	8	37.8 Å²	37.8	6%	0.056	18%	0.177	C	C	.	.	H	α-helix	trans	-56.8	-53.5	173.6	153.2	0	0	0	0	112	K1002 L1003 M1004 M1008 L1009 E1010 I1071	K1002-S1006 VanDerWaalsContact O-CB 3.32Å; K1002-S1006 WeakPolarHBondContact O-CB 3.13Å; K1002-S1006 PolarHBondContact O-N 3.13Å; L1003-S1006 VanDerWaalsContact O-CB 3.25Å; L1003-S1006 WeakPolarHBondContact O-CB 3.3Å; L1003-S1006 PolarHBondContact O-N 3.12Å; M1004-S1006 VanDerWaalsContact C-N 3.26Å; M1004-S1006 PolarHBondContact O-N 2.91Å; S1006-M1008 VanDerWaalsContact C-N 3.33Å; S1006-M1008 PolarHBondContact O-N 3.14Å; S1006-L1009 PolarHBondContact O-N 3.35Å; S1006-E1010 PolarHBondContact O-N 3.12Å; S1006-I1071 VanDerWaalsContact O-CD1 3.25Å; S1006-I1071 WeakPolarHBondContact O-CD1 3.47Å; S1006-I1071 WeakPolarHBondContact OG-CD1 3.48Å
1007	D	85.6	Confident	86.4	Confident	90 Å²	90	36.6 Å²	36.6	48%	0.481	17%	0.169	S	C	.	.	H	α-helix	trans	-63.3	-39.2	-178.8	-71.4	-8.3	0	0	0	112.2	L1003 M1004 E1010 A1011	L1003-D1007 PolarHBondContact O-N 3.4Å; M1004-D1007 PolarHBondContact O-N 2.98Å; D1007-E1010 PolarHBondContact O-N 3.36Å; D1007-A1011 VanDerWaalsContact O-CB 3.26Å; D1007-A1011 WeakPolarHBondContact O-CB 3.41Å; D1007-A1011 PolarHBondContact O-N 3.44Å
1008	M	88.4	Confident	86.5	Confident	18 Å²	18	40.1 Å²	40.1	9%	0.089	19%	0.19	C	C	.	.	H	α-helix	trans	-70.4	-36.2	178.6	-64.5	-51	151.6	0	0	112.4	E943 I946 A947 I950 L972 L976 M1004 A1005 S1006 C1012	E943-M1008 HydrophobicContact CG-CE 4.24Å; I946-M1008 HydrophobicContact CG2-CB 4.49Å; I946-M1008 HydrophobicContact CG2-CG 3.92Å; I946-M1008 HydrophobicContact CG2-SD 4.2Å; A947-M1008 HydrophobicContact CB-CE 3.83Å; A947-M1008 HydrophobicContact CB-SD 4.03Å; I950-M1008 HydrophobicContact CD1-CB 3.72Å; I950-M1008 HydrophobicContact CD1-CG 4.02Å; I950-M1008 HydrophobicContact CD1-SD 3.54Å; I950-M1008 VanDerWaalsContact CD1-SD 3.54Å; L972-M1008 HydrophobicContact CD1-CB 4.16Å; L976-M1008 HydrophobicContact CD1-CB 4.26Å; M1004-M1008 HydrophobicContact CG-CE 4.2Å; M1004-M1008 HydrophobicContact CG-CG 4.32Å; M1004-M1008 WeakPolarHBondContact O-CB 3.17Å; M1004-M1008 WeakPolarHBondContact O-CG 3.25Å; M1004-M1008 PolarHBondContact O-N 2.93Å; A1005-M1008 PolarHBondContact O-N 3.14Å; S1006-M1008 VanDerWaalsContact C-N 3.33Å; S1006-M1008 PolarHBondContact O-N 3.14Å; M1008-C1012 WeakPolarHBondContact O-CB 3.4Å; M1008-C1012 PolarHBondContact O-N 3.17Å
1009	L	87.6	Confident	86.7	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.1	-46.5	172	-86	161.6	0	0	0	111.6	F973 A1005 S1006 A1011 C1012 V1013 A1049	F973-L1009 HydrophobicContact CD1-CD2 4.35Å; F973-L1009 HydrophobicContact CE1-CD2 3.44Å; F973-L1009 VanDerWaalsContact CE1-CD2 3.44Å; F973-L1009 HydrophobicContact CE1-CG 4.43Å; F973-L1009 HydrophobicContact CZ-CD2 4.11Å; A1005-L1009 VanDerWaalsContact O-CB 3.3Å; A1005-L1009 WeakPolarHBondContact O-CB 3.41Å; A1005-L1009 WeakPolarHBondContact O-CD1 3.23Å; A1005-L1009 WeakPolarHBondContact O-CG 3.14Å; A1005-L1009 PolarHBondContact O-N 3.2Å; S1006-L1009 PolarHBondContact O-N 3.35Å; L1009-A1011 VanDerWaalsContact C-N 3.3Å; L1009-A1011 PolarHBondContact O-N 2.7Å; L1009-C1012 WeakPolarHBondContact O-CB 3.45Å; L1009-C1012 PolarHBondContact O-N 2.82Å; L1009-C1012 VanDerWaalsContact O-N 3.14Å; L1009-V1013 WeakPolarHBondContact O-CG2 3.33Å; L1009-V1013 PolarHBondContact O-N 3.43Å; L1009-A1049 HydrophobicContact CD2-CB 4.12Å
1010	E	87.5	Confident	86.9	Confident	59 Å²	59	34.7 Å²	34.7	28%	0.276	17%	0.169	S	C	.	.	H	α-helix	trans	-58.9	-44.8	176.9	-176.4	-179.5	161.2	0	0	111.1	S1006 D1007 C1012 V1013 K1014 L1074	S1006-E1010 PolarHBondContact O-N 3.12Å; D1007-E1010 PolarHBondContact O-N 3.36Å; E1010-C1012 VanDerWaalsContact C-N 3.33Å; E1010-C1012 PolarHBondContact O-N 3.12Å; E1010-V1013 PolarHBondContact O-N 3.38Å; E1010-K1014 HydrophobicContact CG-CD 4.11Å; E1010-K1014 WeakPolarHBondContact O-CB 3.49Å; E1010-K1014 WeakPolarHBondContact O-CG 3.32Å; E1010-K1014 PolarHBondContact O-N 3.34Å; E1010-K1014 WeakPolarHBondContact OE1-CE 3.37Å; E1010-K1014 IonicContact OE1-NZ 3.53Å; E1010-K1014 PolarHBondContact OE1-NZ 3.02Å; E1010-L1074 HydrophobicContact CG-CD1 4Å; E1010-L1074 HydrophobicContact CG-CD2 4.44Å
1011	A	87.6	Confident	87	Confident	21 Å²	21	34.6 Å²	34.6	17%	0.174	17%	0.172	C	C	.	.	H	α-helix	trans	-59.9	-38.8	175.2	0	0	0	0	0	113.1	I950 D1007 L1009 R1015	I950-A1011 HydrophobicContact CG2-CB 4.38Å; D1007-A1011 VanDerWaalsContact O-CB 3.26Å; D1007-A1011 WeakPolarHBondContact O-CB 3.41Å; D1007-A1011 PolarHBondContact O-N 3.44Å; L1009-A1011 VanDerWaalsContact C-N 3.3Å; L1009-A1011 PolarHBondContact O-N 2.7Å; A1011-R1015 VanDerWaalsContact CB-NH1 3.31Å; A1011-R1015 WeakPolarHBondContact O-CB 3.46Å; A1011-R1015 VanDerWaalsContact O-CG 3.32Å; A1011-R1015 WeakPolarHBondContact O-CG 3.42Å; A1011-R1015 PolarHBondContact O-N 3.29Å; A1011-R1015 PolarHBondContact O-NH1 3.11Å; A1011-R1015 VanDerWaalsContact O-NH1 3.13Å
1012	C	88.8	Confident	87	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66.5	-48.6	175.2	176.6	0	0	0	0	111.5	F954 L972 M1008 L1009 E1010 R1015 T1016	F954-C1012 HydrophobicContact CE2-CB 4.26Å; F954-C1012 HydrophobicContact CZ-CB 4.33Å; F954-C1012 VanDerWaalsContact CZ-SG 3.5Å; L972-C1012 HydrophobicContact CD2-CB 3.84Å; M1008-C1012 WeakPolarHBondContact O-CB 3.4Å; M1008-C1012 PolarHBondContact O-N 3.17Å; L1009-C1012 WeakPolarHBondContact O-CB 3.45Å; L1009-C1012 PolarHBondContact O-N 2.82Å; L1009-C1012 VanDerWaalsContact O-N 3.14Å; E1010-C1012 VanDerWaalsContact C-N 3.33Å; E1010-C1012 PolarHBondContact O-N 3.12Å; C1012-R1015 PolarHBondContact O-N 3.2Å; C1012-T1016 WeakPolarHBondContact O-CB 3.31Å; C1012-T1016 PolarHBondContact O-N 3.05Å; C1012-T1016 PolarHBondContact O-OG1 2.99Å
1013	V	89.4	Confident	87.1	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-47.4	-178	171.5	0	0	0	0	111.4	L1009 E1010 R1015 T1016 R1017 L1046 A1049 L1074 I1075	L1009-V1013 WeakPolarHBondContact O-CG2 3.33Å; L1009-V1013 PolarHBondContact O-N 3.43Å; E1010-V1013 PolarHBondContact O-N 3.38Å; V1013-R1015 PolarHBondContact O-N 3.21Å; V1013-T1016 PolarHBondContact O-N 3.32Å; V1013-R1017 WeakPolarHBondContact O-CB 3.22Å; V1013-R1017 PolarHBondContact O-N 2.93Å; V1013-L1046 HydrophobicContact CB-CD2 4.02Å; V1013-L1046 HydrophobicContact CG1-CD2 3.69Å; V1013-L1046 HydrophobicContact CG2-CD2 3.95Å; V1013-A1049 HydrophobicContact CG2-CB 4.17Å; V1013-L1074 HydrophobicContact CB-CD2 3.83Å; V1013-L1074 HydrophobicContact CG1-CD2 3.43Å; V1013-L1074 VanDerWaalsContact CG1-CD2 3.43Å; V1013-L1074 HydrophobicContact CG2-CD2 4.44Å; V1013-I1075 HydrophobicContact CG2-CD1 4.38Å; V1013-I1075 HydrophobicContact CG2-CG1 3.79Å
1014	K	88.9	Confident	87.1	Confident	107 Å²	107	40 Å²	40	47%	0.465	20%	0.197	S	C	.	.	H	α-helix	trans	-60.4	-42.3	178.9	-76.2	178.1	171.3	174.8	0	112.6	E1010 T1018	E1010-K1014 HydrophobicContact CG-CD 4.11Å; E1010-K1014 WeakPolarHBondContact O-CB 3.49Å; E1010-K1014 WeakPolarHBondContact O-CG 3.32Å; E1010-K1014 PolarHBondContact O-N 3.34Å; E1010-K1014 WeakPolarHBondContact OE1-CE 3.37Å; E1010-K1014 IonicContact OE1-NZ 3.53Å; E1010-K1014 PolarHBondContact OE1-NZ 3.02Å; K1014-T1018 PolarHBondContact O-N 2.57Å; K1014-T1018 PolarHBondContact O-OG1 3.19Å
1015	R	87.9	Confident	86.7	Confident	91 Å²	91	46.6 Å²	46.6	34%	0.343	23%	0.228	S	C	.	.	H	α-helix	trans	-70.2	-42.1	178.5	-74.2	-177.7	179.6	83.5	-6.7	111.8	F954 A1011 C1012 V1013 R1017 T1018 A1019	F954-R1015 HydrophobicContact CB-CB 4.46Å; F954-R1015 HydrophobicContact CG-CB 4.31Å; A1011-R1015 VanDerWaalsContact CB-NH1 3.31Å; A1011-R1015 WeakPolarHBondContact O-CB 3.46Å; A1011-R1015 VanDerWaalsContact O-CG 3.32Å; A1011-R1015 WeakPolarHBondContact O-CG 3.42Å; A1011-R1015 PolarHBondContact O-N 3.29Å; A1011-R1015 PolarHBondContact O-NH1 3.11Å; A1011-R1015 VanDerWaalsContact O-NH1 3.13Å; C1012-R1015 PolarHBondContact O-N 3.2Å; V1013-R1015 PolarHBondContact O-N 3.21Å; R1015-R1017 PolarHBondContact O-N 3Å; R1015-T1018 PolarHBondContact O-N 3.17Å; R1015-A1019 WeakPolarHBondContact O-CB 3.45Å; R1015-A1019 PolarHBondContact O-N 3.4Å
1016	T	88.6	Confident	86.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.3	-45.3	175.8	-59.6	0	0	0	0	111.3	W959 C1012 V1013 T1018 A1019 F1020 M1042 V1045 L1046	W959-T1016 HydrophobicContact CH2-CG2 4.14Å; W959-T1016 HydrophobicContact CZ3-CG2 4.06Å; C1012-T1016 WeakPolarHBondContact O-CB 3.31Å; C1012-T1016 PolarHBondContact O-N 3.05Å; C1012-T1016 PolarHBondContact O-OG1 2.99Å; V1013-T1016 PolarHBondContact O-N 3.32Å; T1016-T1018 PolarHBondContact O-N 3.27Å; T1016-A1019 PolarHBondContact O-N 3.39Å; T1016-F1020 VanDerWaalsContact O-CB 3.31Å; T1016-F1020 WeakPolarHBondContact O-CB 3.35Å; T1016-F1020 PolarHBondContact O-N 3.42Å; T1016-M1042 HydrophobicContact CG2-CB 3.99Å; T1016-M1042 HydrophobicContact CG2-CG 4.39Å; T1016-M1042 WeakPolarHBondContact CG2-O 3.41Å; T1016-V1045 HydrophobicContact CG2-CB 4.23Å; T1016-V1045 HydrophobicContact CG2-CG1 4.12Å; T1016-L1046 HydrophobicContact CG2-CD2 4.06Å; T1016-L1046 HydrophobicContact CG2-CG 4Å
1017	R	88.1	Confident	86	Confident	73 Å²	73	55.8 Å²	55.8	28%	0.275	27%	0.271	S	S	.	.	H	α-helix	trans	-58.6	-48.1	173.9	177.6	-173.7	168.7	160.7	10.1	112.3	V1013 R1015 A1019 F1020 E1021 E1081	V1013-R1017 WeakPolarHBondContact O-CB 3.22Å; V1013-R1017 PolarHBondContact O-N 2.93Å; R1015-R1017 PolarHBondContact O-N 3Å; R1017-A1019 VanDerWaalsContact C-N 3.33Å; R1017-A1019 PolarHBondContact O-N 3.18Å; R1017-F1020 WeakPolarHBondContact O-CB 3.43Å; R1017-F1020 PolarHBondContact O-N 3.29Å; R1017-E1021 IonicContact CZ-OE1 3.42Å; R1017-E1021 IonicContact NE-OE1 3.25Å; R1017-E1021 PolarHBondContact NE-OE1 3.1Å; R1017-E1021 IonicContact NH2-OE1 4Å; R1017-E1021 WeakPolarHBondContact O-CG 3.1Å; R1017-E1021 PolarHBondContact O-N 2.95Å; R1017-E1081 VanDerWaalsContact CZ-CD 3.5Å; R1017-E1081 IonicContact CZ-OE1 3.51Å; R1017-E1081 IonicContact CZ-OE2 3.76Å; R1017-E1081 IonicContact NE-OE2 2.95Å; R1017-E1081 IonicContact NH1-OE1 2.89Å; R1017-E1081 IonicContact NH1-OE2 3.65Å; R1017-E1081 PolarHBondContact NH1-OE2 2.87Å; R1017-E1081 IonicContact NH2-OE1 2.64Å; R1017-E1081 PolarHBondContact NH2-OE1 3.1Å; R1017-E1081 IonicContact NH2-OE2 3.75Å; R1017-E1081 PolarHBondContact NH2-OE2 3.46Å
1018	T	87.9	Confident	85.4	Confident	76 Å²	76	54.1 Å²	54.1	47%	0.466	27%	0.266	S	S	.	.	H	α-helix	trans	-61.7	-42.8	-179.6	-55.2	0	0	0	0	111.2	K1014 R1015 T1016 F1020 E1021 L1022	K1014-T1018 PolarHBondContact O-N 2.57Å; K1014-T1018 PolarHBondContact O-OG1 3.19Å; R1015-T1018 PolarHBondContact O-N 3.17Å; T1016-T1018 PolarHBondContact O-N 3.27Å; T1018-F1020 VanDerWaalsContact C-N 3.34Å; T1018-F1020 PolarHBondContact O-N 3.19Å; T1018-E1021 PolarHBondContact O-N 2.72Å; T1018-L1022 HydrophobicContact CG2-CD1 4.25Å; T1018-L1022 WeakPolarHBondContact O-CG 3.21Å; T1018-L1022 PolarHBondContact O-N 2.98Å; T1018-L1022 VanDerWaalsContact O-N 3.13Å
1019	A	86.6	Confident	84.8	Confident	24 Å²	24	60.3 Å²	60.3	20%	0.198	29%	0.292	C	S	.	.	H	α-helix	trans	-64.2	-39.1	176	0	0	0	0	0	112.1	W959 R1015 T1016 R1017 L1022 K1023 M1042	W959-A1019 HydrophobicContact CH2-CB 4.17Å; W959-A1019 HydrophobicContact CZ2-CB 3.49Å; W959-A1019 VanDerWaalsContact CZ2-CB 3.49Å; R1015-A1019 WeakPolarHBondContact O-CB 3.45Å; R1015-A1019 PolarHBondContact O-N 3.4Å; T1016-A1019 PolarHBondContact O-N 3.39Å; R1017-A1019 VanDerWaalsContact C-N 3.33Å; R1017-A1019 PolarHBondContact O-N 3.18Å; A1019-L1022 PolarHBondContact O-N 3.42Å; A1019-K1023 WeakPolarHBondContact O-CB 3.31Å; A1019-K1023 PolarHBondContact O-N 3.23Å; A1019-M1042 HydrophobicContact CB-CE 3.92Å
1020	F	87.7	Confident	84.3	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.2	-51.3	175.6	-177.1	-81.6	0	0	0	112	T1016 R1017 T1018 L1022 K1023 L1024 V1039 M1042 I1082 L1085 L1086	T1016-F1020 VanDerWaalsContact O-CB 3.31Å; T1016-F1020 WeakPolarHBondContact O-CB 3.35Å; T1016-F1020 PolarHBondContact O-N 3.42Å; R1017-F1020 WeakPolarHBondContact O-CB 3.43Å; R1017-F1020 PolarHBondContact O-N 3.29Å; T1018-F1020 VanDerWaalsContact C-N 3.34Å; T1018-F1020 PolarHBondContact O-N 3.19Å; F1020-L1022 VanDerWaalsContact C-N 3.34Å; F1020-L1022 PolarHBondContact O-N 2.86Å; F1020-K1023 PolarHBondContact O-N 3.42Å; F1020-L1024 HydrophobicContact CE1-CB 4.35Å; F1020-L1024 HydrophobicContact CE1-CD2 3.68Å; F1020-L1024 HydrophobicContact CZ-CD2 4.19Å; F1020-L1024 WeakPolarHBondContact O-CB 3.45Å; F1020-L1024 PolarHBondContact O-N 2.84Å; F1020-V1039 HydrophobicContact CD2-CG1 4.01Å; F1020-V1039 HydrophobicContact CE2-CB 4.41Å; F1020-V1039 HydrophobicContact CE2-CG1 3.25Å; F1020-V1039 HydrophobicContact CZ-CG1 3.73Å; F1020-M1042 VanDerWaalsContact CA-SD 3.56Å; F1020-M1042 HydrophobicContact CB-SD 4.02Å; F1020-M1042 HydrophobicContact CD2-CB 3.97Å; F1020-M1042 HydrophobicContact CD2-SD 4.23Å; F1020-I1082 HydrophobicContact CB-CD1 4.28Å; F1020-I1082 HydrophobicContact CD1-CB 4.42Å; F1020-I1082 HydrophobicContact CD1-CD1 4.18Å; F1020-I1082 HydrophobicContact CD1-CG1 3.64Å; F1020-I1082 HydrophobicContact CD1-CG2 4.28Å; F1020-I1082 HydrophobicContact CD2-CD1 4.24Å; F1020-I1082 HydrophobicContact CD2-CG1 4.39Å; F1020-I1082 HydrophobicContact CD2-CG2 4.16Å; F1020-I1082 HydrophobicContact CE1-CB 4.14Å; F1020-I1082 HydrophobicContact CE1-CG1 3.86Å; F1020-I1082 HydrophobicContact CE1-CG2 3.74Å; F1020-I1082 HydrophobicContact CE2-CG2 3.58Å; F1020-I1082 HydrophobicContact CG-CD1 3.97Å; F1020-I1082 HydrophobicContact CG-CG1 3.95Å; F1020-I1082 HydrophobicContact CG-CG2 4.49Å; F1020-I1082 HydrophobicContact CZ-CB 4.31Å; F1020-I1082 HydrophobicContact CZ-CG1 4.34Å; F1020-I1082 HydrophobicContact CZ-CG2 3.41Å; F1020-I1082 VanDerWaalsContact CZ-CG2 3.41Å; F1020-L1085 HydrophobicContact CE1-CB 4.46Å; F1020-L1086 HydrophobicContact CE1-CG 4.4Å; F1020-L1086 HydrophobicContact CE2-CD1 4.41Å; F1020-L1086 HydrophobicContact CZ-CD1 3.86Å; F1020-L1086 HydrophobicContact CZ-CD2 3.82Å; F1020-L1086 HydrophobicContact CZ-CG 3.64Å
1021	E	86.3	Confident	83.8	Confident	60 Å²	60	60.9 Å²	60.9	28%	0.28	30%	0.3	S	S	.	.	H	α-helix	trans	-58.1	-46.6	178.8	-72.9	176.5	-167.4	0	0	111.2	R1017 T1018 K1023 L1024 Q1025 L1085	R1017-E1021 IonicContact CZ-OE1 3.42Å; R1017-E1021 IonicContact NE-OE1 3.25Å; R1017-E1021 PolarHBondContact NE-OE1 3.1Å; R1017-E1021 IonicContact NH2-OE1 4Å; R1017-E1021 WeakPolarHBondContact O-CG 3.1Å; R1017-E1021 PolarHBondContact O-N 2.95Å; T1018-E1021 PolarHBondContact O-N 2.72Å; E1021-K1023 PolarHBondContact O-N 3.39Å; E1021-L1024 PolarHBondContact O-N 2.81Å; E1021-Q1025 WeakPolarHBondContact O-CB 3.13Å; E1021-Q1025 VanDerWaalsContact O-CG 3.28Å; E1021-Q1025 WeakPolarHBondContact O-CG 3.37Å; E1021-Q1025 PolarHBondContact O-N 3.47Å; E1021-L1085 HydrophobicContact CG-CD1 3.77Å
1022	L	85.6	Confident	83.3	Confident	92 Å²	92	65.2 Å²	65.2	48%	0.482	32%	0.32	S	S	.	.	H	α-helix	trans	-62.3	-38.8	177.9	-73.3	169.5	0	0	0	112.8	T1018 A1019 F1020 K1026	T1018-L1022 HydrophobicContact CG2-CD1 4.25Å; T1018-L1022 WeakPolarHBondContact O-CG 3.21Å; T1018-L1022 PolarHBondContact O-N 2.98Å; T1018-L1022 VanDerWaalsContact O-N 3.13Å; A1019-L1022 PolarHBondContact O-N 3.42Å; F1020-L1022 VanDerWaalsContact C-N 3.34Å; F1020-L1022 PolarHBondContact O-N 2.86Å; L1022-K1026 WeakPolarHBondContact O-CG 3.27Å
1023	K	84.4	Confident	83	Confident	97 Å²	97	65.6 Å²	65.6	42%	0.422	32%	0.323	S	S	.	.	H	α-helix	trans	-72.4	-40.4	179.5	-160.4	77	176.2	-165.6	0	111.4	A1019 F1020 E1021 K1026 V1039 M1042	A1019-K1023 WeakPolarHBondContact O-CB 3.31Å; A1019-K1023 PolarHBondContact O-N 3.23Å; F1020-K1023 PolarHBondContact O-N 3.42Å; E1021-K1023 PolarHBondContact O-N 3.39Å; K1023-K1026 PolarHBondContact O-N 3.2Å; K1023-V1039 HydrophobicContact CB-CG2 4.43Å; K1023-V1039 HydrophobicContact CG-CG2 4Å; K1023-M1042 HydrophobicContact CB-CE 4.44Å
1024	L	83.6	Confident	82.8	Confident	19 Å²	19	69.4 Å²	69.4	10%	0.099	34%	0.337	C	S	.	.	H	α-helix	trans	-72.7	-33.1	-179.5	-171.7	63.1	0	0	0	112.8	F1020 E1021 K1026 A1027 L1085 L1086 K1089	F1020-L1024 HydrophobicContact CE1-CB 4.35Å; F1020-L1024 HydrophobicContact CE1-CD2 3.68Å; F1020-L1024 HydrophobicContact CZ-CD2 4.19Å; F1020-L1024 WeakPolarHBondContact O-CB 3.45Å; F1020-L1024 PolarHBondContact O-N 2.84Å; E1021-L1024 PolarHBondContact O-N 2.81Å; L1024-K1026 VanDerWaalsContact C-N 3.27Å; L1024-K1026 PolarHBondContact O-N 2.87Å; L1024-A1027 WeakPolarHBondContact O-CB 3.31Å; L1024-A1027 PolarHBondContact O-N 2.73Å; L1024-L1085 HydrophobicContact CD2-CB 3.83Å; L1024-L1086 HydrophobicContact CD1-CD2 4Å; L1024-L1086 HydrophobicContact CD2-CD2 4.23Å; L1024-K1089 HydrophobicContact CD1-CB 4.22Å; L1024-K1089 HydrophobicContact CD1-CG 4.03Å; L1024-K1089 PolarHBondContact O-NZ 3.22Å; L1024-K1089 VanDerWaalsContact O-NZ 3.11Å
1025	Q	80	Confident	82.5	Confident	144 Å²	144	64.9 Å²	64.9	67%	0.673	32%	0.317	S	S	*	.	H	α-helix	trans	-58.7	-39.5	172.2	-79.9	-179.2	10.1	0	0	112	E1021 A1027	E1021-Q1025 WeakPolarHBondContact O-CB 3.13Å; E1021-Q1025 VanDerWaalsContact O-CG 3.28Å; E1021-Q1025 WeakPolarHBondContact O-CG 3.37Å; E1021-Q1025 PolarHBondContact O-N 3.47Å; Q1025-A1027 VanDerWaalsContact C-N 3.28Å; Q1025-A1027 PolarHBondContact O-N 3.07Å
1026	K	78.8	Confident	82.4	Confident	178 Å²	178	63.1 Å²	63.1	77%	0.774	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-10.3	179.3	-67.3	175.8	-177.3	178.1	0	114.3	L1022 K1023 L1024	L1022-K1026 WeakPolarHBondContact O-CG 3.27Å; K1023-K1026 PolarHBondContact O-N 3.2Å; L1024-K1026 VanDerWaalsContact C-N 3.27Å; L1024-K1026 PolarHBondContact O-N 2.87Å
1027	A	77	Confident	82.1	Confident	23 Å²	23	64.9 Å²	64.9	19%	0.19	33%	0.333	C	S	.	.	S	Bend	trans	-73.5	149.7	-178.1	0	0	0	0	0	112.7	L1024 Q1025 L1033 K1089	L1024-A1027 WeakPolarHBondContact O-CB 3.31Å; L1024-A1027 PolarHBondContact O-N 2.73Å; Q1025-A1027 VanDerWaalsContact C-N 3.28Å; Q1025-A1027 PolarHBondContact O-N 3.07Å; A1027-L1033 HydrophobicContact CB-CD1 3.82Å; A1027-K1089 WeakPolarHBondContact O-CE 3.48Å; A1027-K1089 PolarHBondContact O-NZ 2.98Å
1028	S	72.9	Confident	81.8	Confident	55 Å²	55	62.2 Å²	62.2	39%	0.385	33%	0.325	S	S	.	.			trans	-60.3	155.2	177.4	178.4	0	0	0	0	112.6	T1030 K1089	S1028-T1030 PolarHBondContact OG-N 3.49Å; S1028-T1030 PolarHBondContact OG-OG1 3.47Å; S1028-K1089 WeakPolarHBondContact O-CE 3.4Å
1029	K	76.1	Confident	81.7	Confident	147 Å²	147	58.8 Å²	58.8	64%	0.639	30%	0.304	S	S	*	.			trans	-107.3	16.7	170.7	-62.1	-175.3	-180	-175.8	0	112.7
1030	T	77.4	Confident	81.7	Confident	58 Å²	58	57.7 Å²	57.7	36%	0.356	30%	0.295	S	S	.	.	S	Bend	trans	-99	169	177.7	67	0	0	0	0	111.6	S1028 D1032 L1033	S1028-T1030 PolarHBondContact OG-N 3.49Å; S1028-T1030 PolarHBondContact OG-OG1 3.47Å; T1030-D1032 PolarHBondContact O-N 2.9Å; T1030-D1032 VanDerWaalsContact O-N 3.14Å; T1030-D1032 PolarHBondContact OG1-OD2 2.85Å; T1030-L1033 VanDerWaalsContact O-CB 3.22Å; T1030-L1033 WeakPolarHBondContact O-CB 3.25Å; T1030-L1033 PolarHBondContact O-N 3.39Å
1031	T	75.9	Confident	81.7	Confident	13 Å²	13	58 Å²	58	8%	0.08	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-10.5	175.6	46.5	0	0	0	0	113.7	L1033 R1034 V1093 V1097 T1137 Y1138 F1141	T1031-L1033 PolarHBondContact O-N 3.01Å; T1031-R1034 PolarHBondContact O-NH1 3.2Å; T1031-V1093 HydrophobicContact CG2-CG1 3.88Å; T1031-V1097 HydrophobicContact CG2-CG2 3.71Å; T1031-T1137 HydrophobicContact CG2-CG2 4.39Å; T1031-T1137 WeakPolarHBondContact OG1-CG2 3.39Å; T1031-Y1138 HydrophobicContact CG2-CD2 4.45Å; T1031-F1141 WeakPolarHBondContact O-CB 3.34Å
1032	D	77.7	Confident	81.8	Confident	112 Å²	112	55.3 Å²	55.3	60%	0.599	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-3.3	173.6	-45.2	-53.7	0	0	0	112.4	T1030 R1034	T1030-D1032 PolarHBondContact O-N 2.9Å; T1030-D1032 VanDerWaalsContact O-N 3.14Å; T1030-D1032 PolarHBondContact OG1-OD2 2.85Å; D1032-R1034 PolarHBondContact O-N 3.07Å; D1032-R1034 VanDerWaalsContact O-N 3.16Å
1033	L	82.8	Confident	81.8	Confident	9 Å²	9	51.2 Å²	51.2	5%	0.047	26%	0.263	C	S	.	.			trans	-57.9	121.2	176.9	174.1	65.6	0	0	0	110	A1027 T1030 T1031 K1089 F1090 V1093 F1141 N1145	A1027-L1033 HydrophobicContact CB-CD1 3.82Å; T1030-L1033 VanDerWaalsContact O-CB 3.22Å; T1030-L1033 WeakPolarHBondContact O-CB 3.25Å; T1030-L1033 PolarHBondContact O-N 3.39Å; T1031-L1033 PolarHBondContact O-N 3.01Å; L1033-K1089 HydrophobicContact CD2-CG 4.02Å; L1033-F1090 HydrophobicContact CD2-CD1 4.38Å; L1033-V1093 HydrophobicContact CD2-CG2 4.04Å; L1033-F1141 HydrophobicContact CB-CD2 4.42Å; L1033-F1141 HydrophobicContact CB-CE2 3.88Å; L1033-F1141 HydrophobicContact CD2-CE2 4.17Å; L1033-F1141 HydrophobicContact CG-CE2 4.21Å; L1033-F1141 WeakPolarHBondContact O-CD2 3.46Å; L1033-F1141 WeakPolarHBondContact O-CE2 3.18Å; L1033-N1145 PolarHBondContact O-ND2 2.83Å
1034	R	84.6	Confident	82.1	Confident	80 Å²	80	47.2 Å²	47.2	30%	0.302	25%	0.246	S	C	.	.			trans	-119.7	130.3	166.7	-60.7	-61.8	173.3	-88.6	-1.3	107.9	T1031 D1032 P1036 N1145 I1148	T1031-R1034 PolarHBondContact O-NH1 3.2Å; D1032-R1034 PolarHBondContact O-N 3.07Å; D1032-R1034 VanDerWaalsContact O-N 3.16Å; R1034-P1036 VanDerWaalsContact O-CD 3.31Å; R1034-P1036 WeakPolarHBondContact O-CD 3.34Å; R1034-N1145 WeakPolarHBondContact CA-OD1 3.44Å; R1034-I1148 HydrophobicContact CB-CD1 4.29Å
1035	I	83.8	Confident	82.3	Confident	11 Å²	11	46.3 Å²	46.3	6%	0.056	24%	0.241	C	C	.	.			trans	-60.3	123.1	176.8	-72.1	-174.2	0	0	0	109.1	V1039 L1086 F1090 N1145 L1149	I1035-V1039 HydrophobicContact CG2-CB 3.91Å; I1035-V1039 HydrophobicContact CG2-CG1 4.04Å; I1035-L1086 HydrophobicContact CD1-CD2 3.92Å; I1035-F1090 HydrophobicContact CD1-CE1 3.7Å; I1035-F1090 HydrophobicContact CD1-CE2 4.13Å; I1035-F1090 HydrophobicContact CD1-CZ 3.21Å; I1035-F1090 HydrophobicContact CG1-CE1 3.91Å; I1035-F1090 HydrophobicContact CG1-CZ 3.92Å; I1035-N1145 PolarHBondContact N-OD1 3.49Å; I1035-L1149 HydrophobicContact CD1-CD1 3.97Å; I1035-L1149 HydrophobicContact CD1-CD2 3.77Å; I1035-L1149 HydrophobicContact CD1-CG 3.96Å
1036	P	84.4	Confident	82.7	Confident	54 Å²	54	39.5 Å²	39.5	35%	0.351	21%	0.209	S	C	.	.			trans	-63.9	141.5	173.8	-20.1	32.2	0	0	0	110.9	R1034 S1038 V1039	R1034-P1036 VanDerWaalsContact O-CD 3.31Å; R1034-P1036 WeakPolarHBondContact O-CD 3.34Å; P1036-S1038 PolarHBondContact O-N 3.25Å; P1036-S1038 VanDerWaalsContact O-N 3.1Å; P1036-V1039 HydrophobicContact CB-CG2 4.25Å; P1036-V1039 HydrophobicContact CG-CG2 4.21Å; P1036-V1039 WeakPolarHBondContact O-CB 3.35Å; P1036-V1039 PolarHBondContact O-N 2.91Å
1037	A	81.8	Confident	83	Confident	38 Å²	38	31.1 Å²	31.1	31%	0.314	17%	0.173	S	C	.	.	H	α-helix	trans	-53.9	-34.4	177.5	0	0	0	0	0	112.9	V1039 C1040 T1041 K1152	A1037-V1039 PolarHBondContact O-N 3.48Å; A1037-C1040 WeakPolarHBondContact O-CB 3.23Å; A1037-C1040 PolarHBondContact O-N 2.84Å; A1037-C1040 VanDerWaalsContact O-N 3.08Å; A1037-T1041 PolarHBondContact O-N 3.35Å; A1037-T1041 PolarHBondContact O-OG1 3.41Å; A1037-K1152 HydrophobicContact CB-CD 4.16Å
1038	S	83.5	Confident	83.4	Confident	16 Å²	16	30.3 Å²	30.3	11%	0.112	17%	0.165	C	C	.	.	H	α-helix	trans	-57.8	-31.4	176.3	61.9	0	0	0	0	113.8	P1036 T1041 M1042	P1036-S1038 PolarHBondContact O-N 3.25Å; P1036-S1038 VanDerWaalsContact O-N 3.1Å; S1038-T1041 PolarHBondContact O-N 2.93Å; S1038-M1042 VanDerWaalsContact O-CG 3.23Å; S1038-M1042 WeakPolarHBondContact O-CG 3.34Å; S1038-M1042 PolarHBondContact O-N 3.42Å
1039	V	85.6	Confident	84	Confident	4 Å²	4	27.7 Å²	27.7	2%	0.024	15%	0.147	C	C	.	.	H	α-helix	trans	-73.7	-38	178.7	176.2	0	0	0	0	110.2	F1020 K1023 I1035 P1036 A1037 F1043 L1086	F1020-V1039 HydrophobicContact CD2-CG1 4.01Å; F1020-V1039 HydrophobicContact CE2-CB 4.41Å; F1020-V1039 HydrophobicContact CE2-CG1 3.25Å; F1020-V1039 HydrophobicContact CZ-CG1 3.73Å; K1023-V1039 HydrophobicContact CB-CG2 4.43Å; K1023-V1039 HydrophobicContact CG-CG2 4Å; I1035-V1039 HydrophobicContact CG2-CB 3.91Å; I1035-V1039 HydrophobicContact CG2-CG1 4.04Å; P1036-V1039 HydrophobicContact CB-CG2 4.25Å; P1036-V1039 HydrophobicContact CG-CG2 4.21Å; P1036-V1039 WeakPolarHBondContact O-CB 3.35Å; P1036-V1039 PolarHBondContact O-N 2.91Å; A1037-V1039 PolarHBondContact O-N 3.48Å; V1039-F1043 PolarHBondContact O-N 2.86Å; V1039-F1043 VanDerWaalsContact O-N 3.08Å; V1039-L1086 HydrophobicContact CG1-CD2 4.1Å
1040	C	85.6	Confident	84.4	Confident	2 Å²	2	23.1 Å²	23.1	1%	0.014	13%	0.127	C	C	.	.	H	α-helix	trans	-66.2	-40	171.4	-55.9	0	0	0	0	111.2	A1037 F1043 N1044 K1152 V1153	A1037-C1040 WeakPolarHBondContact O-CB 3.23Å; A1037-C1040 PolarHBondContact O-N 2.84Å; A1037-C1040 VanDerWaalsContact O-N 3.08Å; C1040-F1043 WeakPolarHBondContact O-CB 3.3Å; C1040-F1043 PolarHBondContact O-N 2.93Å; C1040-N1044 PolarHBondContact O-N 3Å; C1040-K1152 HydrophobicContact CB-CB 3.77Å; C1040-V1153 HydrophobicContact CB-CG2 4.29Å
1041	T	87.1	Confident	84.7	Confident	6 Å²	6	25 Å²	25	4%	0.037	13%	0.131	C	C	.	.	H	α-helix	trans	-61.8	-45.8	175	-55.6	0	0	0	0	111.9	G965 A1037 S1038 F1043 N1044 V1045	G965-T1041 VanDerWaalsContact O-CG2 3.24Å; G965-T1041 WeakPolarHBondContact O-CG2 3.37Å; A1037-T1041 PolarHBondContact O-N 3.35Å; A1037-T1041 PolarHBondContact O-OG1 3.41Å; S1038-T1041 PolarHBondContact O-N 2.93Å; T1041-F1043 VanDerWaalsContact C-N 3.27Å; T1041-F1043 PolarHBondContact O-N 2.99Å; T1041-N1044 PolarHBondContact O-N 3.24Å; T1041-V1045 WeakPolarHBondContact O-CG2 3.36Å; T1041-V1045 PolarHBondContact O-N 3.47Å
1042	M	89.3	Confident	84.9	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.015	14%	0.137	C	C	.	.	H	α-helix	trans	-58.9	-37.9	173.8	-70.8	162.5	-178.4	0	0	112.4	W959 T1016 A1019 F1020 K1023 S1038 L1046	W959-M1042 HydrophobicContact CB-CE 4.36Å; W959-M1042 HydrophobicContact CD2-CE 3.35Å; W959-M1042 HydrophobicContact CD2-CG 3.72Å; W959-M1042 HydrophobicContact CD2-SD 4.42Å; W959-M1042 HydrophobicContact CE3-CB 4.33Å; W959-M1042 HydrophobicContact CE3-CE 3.98Å; W959-M1042 HydrophobicContact CE3-CG 3.27Å; W959-M1042 HydrophobicContact CG-CE 3.52Å; W959-M1042 HydrophobicContact CG-CG 4.46Å; W959-M1042 HydrophobicContact CH2-CG 4.05Å; W959-M1042 HydrophobicContact CZ2-CE 3.98Å; W959-M1042 HydrophobicContact CZ2-CG 4.44Å; W959-M1042 HydrophobicContact CZ3-CB 4.3Å; W959-M1042 HydrophobicContact CZ3-CG 3.46Å; W959-M1042 VanDerWaalsContact CZ3-CG 3.46Å; T1016-M1042 HydrophobicContact CG2-CB 3.99Å; T1016-M1042 HydrophobicContact CG2-CG 4.39Å; T1016-M1042 WeakPolarHBondContact CG2-O 3.41Å; A1019-M1042 HydrophobicContact CB-CE 3.92Å; F1020-M1042 VanDerWaalsContact CA-SD 3.56Å; F1020-M1042 HydrophobicContact CB-SD 4.02Å; F1020-M1042 HydrophobicContact CD2-CB 3.97Å; F1020-M1042 HydrophobicContact CD2-SD 4.23Å; K1023-M1042 HydrophobicContact CB-CE 4.44Å; S1038-M1042 VanDerWaalsContact O-CG 3.23Å; S1038-M1042 WeakPolarHBondContact O-CG 3.34Å; S1038-M1042 PolarHBondContact O-N 3.42Å; M1042-L1046 PolarHBondContact O-N 3.03Å
1043	F	86.8	Confident	85.1	Confident	7 Å²	7	21.3 Å²	21.3	3%	0.031	11%	0.109	C	C	.	.	H	α-helix	trans	-64.1	-47.3	175	-165.8	-79.8	0	0	0	111.1	V1039 C1040 T1041 V1045 L1046 V1047 V1079 I1082 I1083 L1086 V1153 Y1158	V1039-F1043 PolarHBondContact O-N 2.86Å; V1039-F1043 VanDerWaalsContact O-N 3.08Å; C1040-F1043 WeakPolarHBondContact O-CB 3.3Å; C1040-F1043 PolarHBondContact O-N 2.93Å; T1041-F1043 VanDerWaalsContact C-N 3.27Å; T1041-F1043 PolarHBondContact O-N 2.99Å; F1043-V1045 VanDerWaalsContact C-N 3.32Å; F1043-V1045 PolarHBondContact O-N 2.91Å; F1043-L1046 PolarHBondContact O-N 2.93Å; F1043-L1046 VanDerWaalsContact O-N 3.16Å; F1043-V1047 HydrophobicContact CD1-CG2 3.84Å; F1043-V1047 HydrophobicContact CE1-CG2 3.7Å; F1043-V1047 WeakPolarHBondContact O-CG2 3.46Å; F1043-V1047 PolarHBondContact O-N 2.87Å; F1043-V1047 VanDerWaalsContact O-N 3.17Å; F1043-V1079 HydrophobicContact CZ-CG1 4.16Å; F1043-I1082 HydrophobicContact CD2-CG2 3.55Å; F1043-I1082 HydrophobicContact CE2-CG2 3.84Å; F1043-I1083 HydrophobicContact CE2-CD1 4.49Å; F1043-I1083 HydrophobicContact CE2-CG1 3.79Å; F1043-I1083 HydrophobicContact CZ-CD1 4.25Å; F1043-I1083 HydrophobicContact CZ-CG1 4.02Å; F1043-L1086 HydrophobicContact CD2-CD1 4.41Å; F1043-V1153 HydrophobicContact CD1-CG1 3.68Å; F1043-V1153 HydrophobicContact CD1-CG2 4.3Å; F1043-V1153 HydrophobicContact CE1-CG1 3.79Å; F1043-Y1158 HydrophobicContact CE1-CG 4.33Å; F1043-Y1158 HydrophobicContact CZ-CG 4.4Å
1044	N	88.8	Confident	84.8	Confident	12 Å²	12	24.9 Å²	24.9	6%	0.064	13%	0.131	C	C	.	.	H	α-helix	trans	-63.1	-35.8	178.2	-69	-18.8	0	0	0	112.6	N964 C1040 T1041 L1046 V1047 D1048 K1152 V1153 N1154	N964-N1044 WeakPolarHBondContact O-CB 3.34Å; C1040-N1044 PolarHBondContact O-N 3Å; T1041-N1044 PolarHBondContact O-N 3.24Å; N1044-L1046 VanDerWaalsContact C-N 3.27Å; N1044-L1046 PolarHBondContact O-N 2.83Å; N1044-V1047 PolarHBondContact O-N 2.9Å; N1044-D1048 WeakPolarHBondContact O-CB 3.3Å; N1044-D1048 PolarHBondContact O-N 3.32Å; N1044-K1152 PolarHBondContact ND2-O 2.9Å; N1044-V1153 VanDerWaalsContact OD1-CA 3.3Å; N1044-V1153 WeakPolarHBondContact OD1-CA 3.48Å; N1044-N1154 PolarHBondContact OD1-N 2.95Å
1045	V	88.9	Confident	84.4	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-58	-39.1	174	169.8	0	0	0	0	111.9	T1016 T1041 F1043 A1049	T1016-V1045 HydrophobicContact CG2-CB 4.23Å; T1016-V1045 HydrophobicContact CG2-CG1 4.12Å; T1041-V1045 WeakPolarHBondContact O-CG2 3.36Å; T1041-V1045 PolarHBondContact O-N 3.47Å; F1043-V1045 VanDerWaalsContact C-N 3.32Å; F1043-V1045 PolarHBondContact O-N 2.91Å; V1045-A1049 VanDerWaalsContact O-CB 3.23Å; V1045-A1049 WeakPolarHBondContact O-CB 3.3Å; V1045-A1049 PolarHBondContact O-N 3.47Å
1046	L	87.6	Confident	84	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-73.9	-36.4	178.4	-65.1	179.3	0	0	0	112.9	V1013 T1016 M1042 F1043 N1044 K1050 V1079 I1082	V1013-L1046 HydrophobicContact CB-CD2 4.02Å; V1013-L1046 HydrophobicContact CG1-CD2 3.69Å; V1013-L1046 HydrophobicContact CG2-CD2 3.95Å; T1016-L1046 HydrophobicContact CG2-CD2 4.06Å; T1016-L1046 HydrophobicContact CG2-CG 4Å; M1042-L1046 PolarHBondContact O-N 3.03Å; F1043-L1046 PolarHBondContact O-N 2.93Å; F1043-L1046 VanDerWaalsContact O-N 3.16Å; N1044-L1046 VanDerWaalsContact C-N 3.27Å; N1044-L1046 PolarHBondContact O-N 2.83Å; L1046-K1050 PolarHBondContact O-N 2.98Å; L1046-K1050 VanDerWaalsContact O-N 3.07Å; L1046-V1079 HydrophobicContact CB-CG2 3.96Å; L1046-V1079 HydrophobicContact CD1-CG2 4.5Å; L1046-I1082 HydrophobicContact CD1-CD1 3.12Å
1047	V	85.8	Confident	83.3	Confident	3 Å²	3	24.1 Å²	24.1	2%	0.018	13%	0.125	C	C	.	.	H	α-helix	trans	-66.1	-43.7	174.8	173.7	0	0	0	0	110.5	F1043 N1044 K1050 K1051 E1155 Y1158	F1043-V1047 HydrophobicContact CD1-CG2 3.84Å; F1043-V1047 HydrophobicContact CE1-CG2 3.7Å; F1043-V1047 WeakPolarHBondContact O-CG2 3.46Å; F1043-V1047 PolarHBondContact O-N 2.87Å; F1043-V1047 VanDerWaalsContact O-N 3.17Å; N1044-V1047 PolarHBondContact O-N 2.9Å; V1047-K1050 VanDerWaalsContact O-CB 3.28Å; V1047-K1050 WeakPolarHBondContact O-CB 3.44Å; V1047-K1050 PolarHBondContact O-N 2.64Å; V1047-K1051 PolarHBondContact O-N 2.61Å; V1047-E1155 HydrophobicContact CG1-CB 3.89Å; V1047-E1155 HydrophobicContact CG1-CG 3.46Å; V1047-E1155 VanDerWaalsContact CG1-CG 3.46Å; V1047-E1155 WeakPolarHBondContact CG1-OE1 3.29Å; V1047-Y1158 HydrophobicContact CG1-CD2 4.3Å; V1047-Y1158 HydrophobicContact CG1-CE2 4.15Å; V1047-Y1158 HydrophobicContact CG2-CD2 3.77Å; V1047-Y1158 HydrophobicContact CG2-CE2 3.94Å
1048	D	84.8	Confident	82.4	Confident	5 Å²	5	24.8 Å²	24.8	3%	0.027	13%	0.13	C	C	.	.	H	α-helix	trans	-68.5	-40.5	176.5	-165.9	53	0	0	0	111.4	N964 F973 N1044 K1050 K1051 Q1052	N964-D1048 HydrophobicContact CB-CB 4.34Å; F973-D1048 WeakPolarHBondContact CD2-OD2 3.36Å; F973-D1048 HydrophobicContact CE2-CB 4.5Å; F973-D1048 VanDerWaalsContact CE2-OD2 3.3Å; F973-D1048 WeakPolarHBondContact CE2-OD2 3.46Å; N1044-D1048 WeakPolarHBondContact O-CB 3.3Å; N1044-D1048 PolarHBondContact O-N 3.32Å; D1048-K1050 PolarHBondContact O-N 2.97Å; D1048-K1051 PolarHBondContact O-N 2.95Å; D1048-Q1052 WeakPolarHBondContact O-CG 3.47Å; D1048-Q1052 PolarHBondContact O-N 2.98Å
1049	A	86.1	Confident	81.1	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-55	-37.3	170.9	0	0	0	0	0	112.1	F973 L1009 V1013 V1045 Q1052 S1053 I1075	F973-A1049 HydrophobicContact CZ-CB 3.94Å; L1009-A1049 HydrophobicContact CD2-CB 4.12Å; V1013-A1049 HydrophobicContact CG2-CB 4.17Å; V1045-A1049 VanDerWaalsContact O-CB 3.23Å; V1045-A1049 WeakPolarHBondContact O-CB 3.3Å; V1045-A1049 PolarHBondContact O-N 3.47Å; A1049-Q1052 PolarHBondContact O-N 2.87Å; A1049-S1053 VanDerWaalsContact O-CB 3.25Å; A1049-S1053 WeakPolarHBondContact O-CB 3.19Å; A1049-S1053 PolarHBondContact O-N 3.41Å; A1049-S1053 PolarHBondContact O-OG 2.96Å; A1049-I1075 HydrophobicContact CB-CD1 4.37Å
1050	K	84.8	Confident	79.3	Confident	52 Å²	52	33.7 Å²	33.7	23%	0.226	18%	0.177	C	C	.	.	H	α-helix	trans	-62.8	-48.1	173.7	-164.3	176.3	175.3	167.2	0	111.8	L1046 V1047 D1048 Q1052 S1053 I1075 D1076 Y1158	L1046-K1050 PolarHBondContact O-N 2.98Å; L1046-K1050 VanDerWaalsContact O-N 3.07Å; V1047-K1050 VanDerWaalsContact O-CB 3.28Å; V1047-K1050 WeakPolarHBondContact O-CB 3.44Å; V1047-K1050 PolarHBondContact O-N 2.64Å; D1048-K1050 PolarHBondContact O-N 2.97Å; K1050-Q1052 VanDerWaalsContact C-N 3.35Å; K1050-Q1052 PolarHBondContact O-N 3.47Å; K1050-S1053 PolarHBondContact O-N 2.85Å; K1050-S1053 PolarHBondContact O-OG 3.47Å; K1050-I1075 HydrophobicContact CB-CG2 3.83Å; K1050-I1075 HydrophobicContact CD-CG2 4.46Å; K1050-I1075 HydrophobicContact CG-CG2 4.19Å; K1050-D1076 WeakPolarHBondContact CE-OD1 3.28Å; K1050-D1076 IonicContact NZ-OD1 2.61Å; K1050-D1076 PolarHBondContact NZ-OD1 3.42Å; K1050-D1076 IonicContact NZ-OD2 2.97Å; K1050-Y1158 WeakPolarHBondContact CD-OH 3.17Å; K1050-Y1158 PolarHBondContact NZ-OH 2.97Å
1051	K	82.6	Confident	77.4	Confident	98 Å²	98	35.5 Å²	35.5	43%	0.426	20%	0.195	S	C	.	.	H	α-helix	trans	-62.4	-41.1	177.5	-66	-175.3	-170.8	178.2	0	112.4	V1047 D1048 T1054 E1155	V1047-K1051 PolarHBondContact O-N 2.61Å; D1048-K1051 PolarHBondContact O-N 2.95Å; K1051-T1054 PolarHBondContact O-OG1 3.19Å; K1051-E1155 WeakPolarHBondContact CE-OE1 3.46Å; K1051-E1155 IonicContact NZ-OE1 3.08Å; K1051-E1155 PolarHBondContact NZ-OE1 3.04Å
1052	Q	81.6	Confident	75.5	Confident	46 Å²	46	38.6 Å²	38.6	22%	0.215	23%	0.228	C	C	.	.	H	α-helix	trans	-74.5	-30.8	-179.4	-61.6	-57.2	-24.7	0	0	112.1	F973 D1048 A1049 K1050 T1054 K1055 L1056	F973-Q1052 HydrophobicContact CB-CG 4.4Å; F973-Q1052 HydrophobicContact CD1-CB 4.25Å; F973-Q1052 HydrophobicContact CD1-CG 4.32Å; F973-Q1052 HydrophobicContact CD2-CB 4.49Å; F973-Q1052 HydrophobicContact CD2-CG 3.76Å; F973-Q1052 HydrophobicContact CE1-CB 4.39Å; F973-Q1052 HydrophobicContact CE2-CG 4.05Å; F973-Q1052 HydrophobicContact CG-CB 4.33Å; F973-Q1052 HydrophobicContact CG-CG 3.91Å; F973-Q1052 HydrophobicContact CZ-CG 4.48Å; D1048-Q1052 WeakPolarHBondContact O-CG 3.47Å; D1048-Q1052 PolarHBondContact O-N 2.98Å; A1049-Q1052 PolarHBondContact O-N 2.87Å; K1050-Q1052 VanDerWaalsContact C-N 3.35Å; K1050-Q1052 PolarHBondContact O-N 3.47Å; Q1052-T1054 VanDerWaalsContact C-N 3.31Å; Q1052-T1054 PolarHBondContact O-N 3.15Å; Q1052-K1055 PolarHBondContact O-N 3.42Å; Q1052-K1055 VanDerWaalsContact O-N 3.12Å; Q1052-L1056 HydrophobicContact CB-CD1 4.13Å; Q1052-L1056 WeakPolarHBondContact O-CB 3.38Å; Q1052-L1056 WeakPolarHBondContact O-CG 3.48Å; Q1052-L1056 PolarHBondContact O-N 3.16Å
1053	S	81.9	Confident	73.4	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.007	27%	0.27	C	S	.	.	H	α-helix	trans	-62	-36.9	178	71.1	0	0	0	0	113.1	A1049 K1050 K1055 C1057 D1072	A1049-S1053 VanDerWaalsContact O-CB 3.25Å; A1049-S1053 WeakPolarHBondContact O-CB 3.19Å; A1049-S1053 PolarHBondContact O-N 3.41Å; A1049-S1053 PolarHBondContact O-OG 2.96Å; K1050-S1053 PolarHBondContact O-N 2.85Å; K1050-S1053 PolarHBondContact O-OG 3.47Å; S1053-K1055 VanDerWaalsContact C-N 3.29Å; S1053-K1055 PolarHBondContact O-N 2.89Å; S1053-C1057 VanDerWaalsContact O-CB 3.3Å; S1053-C1057 WeakPolarHBondContact O-CB 3.39Å; S1053-C1057 PolarHBondContact O-N 3.33Å; S1053-C1057 VanDerWaalsContact O-N 3.14Å; S1053-D1072 PolarHBondContact OG-OD1 3.18Å
1054	T	75.4	Confident	71.6	Confident	83 Å²	83	50.5 Å²	50.5	51%	0.509	28%	0.284	S	S	.	.	H	α-helix	trans	-70.7	-25.9	176.6	60.9	0	0	0	0	112.5	K1051 Q1052 A1058	K1051-T1054 PolarHBondContact O-OG1 3.19Å; Q1052-T1054 VanDerWaalsContact C-N 3.31Å; Q1052-T1054 PolarHBondContact O-N 3.15Å; T1054-A1058 WeakPolarHBondContact O-CB 3.4Å
1055	K	77.2	Confident	69.7	Low	121 Å²	121	56.1 Å²	56.1	53%	0.526	31%	0.31	S	S	.	.	H	α-helix	trans	-84.5	-51.6	176.9	-169.3	-167.3	-179.8	-152	0	112.1	D977 Q1052 S1053	D977-K1055 IonicContact OD1-NZ 3.03Å; D977-K1055 PolarHBondContact OD1-NZ 3.37Å; D977-K1055 IonicContact OD2-NZ 2.56Å; Q1052-K1055 PolarHBondContact O-N 3.42Å; Q1052-K1055 VanDerWaalsContact O-N 3.12Å; S1053-K1055 VanDerWaalsContact C-N 3.29Å; S1053-K1055 PolarHBondContact O-N 2.89Å
1056	L	74.5	Confident	68	Low	1 Å²	1	62.3 Å²	62.3	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-83	-24.7	-168.5	-66.7	173.3	0	0	0	113.6	F973 L976 D977 Q980 A1005 Q1052	F973-L1056 HydrophobicContact CD1-CD1 4.48Å; L976-L1056 HydrophobicContact CB-CD1 4.18Å; L976-L1056 HydrophobicContact CD1-CD1 4.43Å; D977-L1056 HydrophobicContact CB-CD2 4.1Å; Q980-L1056 PolarHBondContact NE2-O 3.45Å; A1005-L1056 HydrophobicContact CB-CB 4.47Å; Q1052-L1056 HydrophobicContact CB-CD1 4.13Å; Q1052-L1056 WeakPolarHBondContact O-CB 3.38Å; Q1052-L1056 WeakPolarHBondContact O-CG 3.48Å; Q1052-L1056 PolarHBondContact O-N 3.16Å
1057	C	70.1	Confident	66.4	Low	8 Å²	8	67.5 Å²	67.5	5%	0.054	36%	0.359	C	S	.	.	S	Bend	trans	-96.5	-18.9	-177.1	-62.2	0	0	0	0	112.7	K1002 S1053 L1059 H1068	K1002-C1057 WeakPolarHBondContact CD-O 3.4Å; S1053-C1057 VanDerWaalsContact O-CB 3.3Å; S1053-C1057 WeakPolarHBondContact O-CB 3.39Å; S1053-C1057 PolarHBondContact O-N 3.33Å; S1053-C1057 VanDerWaalsContact O-N 3.14Å; C1057-L1059 PolarHBondContact O-N 3.22Å; C1057-H1068 WeakPolarHBondContact CB-CE1 3.12Å; C1057-H1068 PolarHBondContact O-CE1 3.4Å; C1057-H1068 PolarHBondContact O-NE2 3.17Å
1058	A	61.6	Low	65.2	Low	51 Å²	51	69 Å²	69	42%	0.421	37%	0.366	S	S	.	.			trans	-50.5	112.9	-159.1	0	0	0	0	0	114.6	K1002 T1054 H1068	K1002-A1058 VanDerWaalsContact CE-O 3.24Å; K1002-A1058 WeakPolarHBondContact CE-O 3.33Å; K1002-A1058 PolarHBondContact NZ-O 2.79Å; T1054-A1058 WeakPolarHBondContact O-CB 3.4Å; A1058-H1068 WeakPolarHBondContact CA-CE1 3.28Å; A1058-H1068 WeakPolarHBondContact CA-NE2 3.48Å; A1058-H1068 PolarHBondContact N-CE1 3.5Å; A1058-H1068 PolarHBondContact N-NE2 2.93Å
1059	L	56.5	Low	64.1	Low	32 Å²	32	71.5 Å²	71.5	17%	0.168	38%	0.384	C	S	.	.			trans	-100.7	121.3	177	-73.1	164.8	0	0	0	111.8	K1002 C1057 G1061 E1064 H1068	K1002-L1059 HydrophobicContact CB-CD2 4.49Å; K1002-L1059 HydrophobicContact CD-CD2 3.31Å; K1002-L1059 HydrophobicContact CD-CG 3.83Å; C1057-L1059 PolarHBondContact O-N 3.22Å; L1059-G1061 PolarHBondContact O-N 3.39Å; L1059-E1064 HydrophobicContact CD1-CB 3.89Å; L1059-H1068 PolarHBondContact N-NE2 2.95Å
1060	D	47.8	Very low	63.4	Low	176 Å²	176	76.6 Å²	76.6	94%	0.941	41%	0.406	S	S	*	.			trans	-80.5	91.2	165.9	-98.9	-20.2	0	0	0	109.4
1061	G	47.4	Very low	63.2	Low	39 Å²	39	74.5 Å²	74.5	40%	0.402	40%	0.397	S	S	.	.	S	Bend	trans	169	121.3	175.6	0	0	0	0	0	114.4	L1059 Q1063 E1064	L1059-G1061 PolarHBondContact O-N 3.39Å; G1061-Q1063 PolarHBondContact O-N 3.42Å; G1061-E1064 PolarHBondContact O-N 3.21Å
1062	G	46.6	Very low	63	Low	71 Å²	71	71.9 Å²	71.9	73%	0.732	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-3.8	-171.8	0	0	0	0	0	117.7
1063	Q	44	Very low	63.1	Low	193 Å²	193	73.6 Å²	73.6	90%	0.902	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-11.5	175.5	-84	-179.8	-26.8	0	0	114.1	G1061	G1061-Q1063 PolarHBondContact O-N 3.42Å
1064	E	49.4	Very low	63.3	Low	67 Å²	67	75.6 Å²	75.6	31%	0.313	41%	0.409	S	S	.	.	S	Bend	trans	-121.1	13.4	-174.3	-60.1	-170.1	171.4	0	0	113.9	Q999 L1059 G1061 Q1066	Q999-E1064 VanDerWaalsContact NE2-CD 3.27Å; Q999-E1064 PolarHBondContact NE2-OE1 3Å; Q999-E1064 PolarHBondContact NE2-OE2 3.37Å; L1059-E1064 HydrophobicContact CD1-CB 3.89Å; G1061-E1064 PolarHBondContact O-N 3.21Å; E1064-Q1066 PolarHBondContact O-N 3.42Å
1065	Q	50.1	Low	63.7	Low	130 Å²	130	71.6 Å²	71.6	61%	0.607	39%	0.385	S	S	*	.	H	α-helix	trans	-60.2	-8.8	167.1	-72.3	-176	-17.1	0	0	113.7	Y1067 S1069	Q1065-Y1067 PolarHBondContact O-N 3.49Å; Q1065-S1069 PolarHBondContact O-N 3.18Å
1066	Q	51.6	Low	64.1	Low	130 Å²	130	68 Å²	68	61%	0.607	37%	0.371	S	S	*	.	H	α-helix	trans	-71.9	-26.7	-176.6	-134.3	179.9	33.8	0	0	113.5	E1064 K1070	E1064-Q1066 PolarHBondContact O-N 3.42Å; Q1066-K1070 WeakPolarHBondContact O-CD 3.44Å; Q1066-K1070 WeakPolarHBondContact O-CG 3.31Å; Q1066-K1070 PolarHBondContact O-N 3.2Å
1067	Y	54.6	Low	64.8	Low	111 Å²	111	71.9 Å²	71.9	44%	0.435	39%	0.392	S	S	.	.	H	α-helix	trans	-82.6	-41.6	-179.7	-73.5	-84.6	0	0	0	112.3	L1003 Q1065 S1069 K1070 I1071	L1003-Y1067 HydrophobicContact CD2-CD1 4.31Å; L1003-Y1067 HydrophobicContact CD2-CE1 4.33Å; L1003-Y1067 HydrophobicContact CD2-CG 4.43Å; Q1065-Y1067 PolarHBondContact O-N 3.49Å; Y1067-S1069 PolarHBondContact O-N 2.9Å; Y1067-K1070 WeakPolarHBondContact O-CB 3.33Å; Y1067-K1070 PolarHBondContact O-N 3.08Å; Y1067-K1070 VanDerWaalsContact O-N 3.13Å; Y1067-I1071 PolarHBondContact O-N 3.13Å; Y1067-I1071 VanDerWaalsContact O-N 3.12Å
1068	H	59.9	Low	65.6	Low	33 Å²	33	71.7 Å²	71.7	15%	0.153	39%	0.391	C	S	.	.	H	α-helix	trans	-52.5	-53.7	168.4	-85	-71.5	0	0	0	113.4	C1057 A1058 L1059 K1070 I1071 D1072	C1057-H1068 WeakPolarHBondContact CB-CE1 3.12Å; C1057-H1068 PolarHBondContact O-CE1 3.4Å; C1057-H1068 PolarHBondContact O-NE2 3.17Å; A1058-H1068 WeakPolarHBondContact CA-CE1 3.28Å; A1058-H1068 WeakPolarHBondContact CA-NE2 3.48Å; A1058-H1068 PolarHBondContact N-CE1 3.5Å; A1058-H1068 PolarHBondContact N-NE2 2.93Å; L1059-H1068 PolarHBondContact N-NE2 2.95Å; H1068-K1070 PolarHBondContact O-N 2.99Å; H1068-I1071 PolarHBondContact O-N 3.06Å; H1068-D1072 WeakPolarHBondContact O-CB 3.37Å; H1068-D1072 PolarHBondContact O-N 2.93Å
1069	S	62.7	Low	66.8	Low	59 Å²	59	69.5 Å²	69.5	41%	0.413	37%	0.372	S	S	.	.	H	α-helix	trans	-54	-42.5	176.7	-179.7	0	0	0	0	110.9	Q1065 Y1067 D1073	Q1065-S1069 PolarHBondContact O-N 3.18Å; Y1067-S1069 PolarHBondContact O-N 2.9Å; S1069-D1073 WeakPolarHBondContact O-CB 3.43Å; S1069-D1073 PolarHBondContact O-N 3.35Å; S1069-D1073 PolarHBondContact OG-OD2 3.05Å
1070	K	71.2	Confident	68.3	Low	107 Å²	107	73.9 Å²	73.9	47%	0.465	39%	0.39	S	S	.	.	H	α-helix	trans	-65	-41	-178.6	-75	167.1	-170	172.7	0	113.4	Q1066 Y1067 H1068 L1074	Q1066-K1070 WeakPolarHBondContact O-CD 3.44Å; Q1066-K1070 WeakPolarHBondContact O-CG 3.31Å; Q1066-K1070 PolarHBondContact O-N 3.2Å; Y1067-K1070 WeakPolarHBondContact O-CB 3.33Å; Y1067-K1070 PolarHBondContact O-N 3.08Å; Y1067-K1070 VanDerWaalsContact O-N 3.13Å; H1068-K1070 PolarHBondContact O-N 2.99Å; K1070-L1074 WeakPolarHBondContact O-CB 3.42Å; K1070-L1074 PolarHBondContact O-N 3.41Å
1071	I	79.9	Confident	70.2	Confident	7 Å²	7	69 Å²	69	4%	0.036	36%	0.361	C	S	.	.	H	α-helix	trans	-75	-44	178.8	-75.2	178.4	0	0	0	111.2	S1006 Y1067 H1068 D1073 L1074 I1075	S1006-I1071 VanDerWaalsContact O-CD1 3.25Å; S1006-I1071 WeakPolarHBondContact O-CD1 3.47Å; S1006-I1071 WeakPolarHBondContact OG-CD1 3.48Å; Y1067-I1071 PolarHBondContact O-N 3.13Å; Y1067-I1071 VanDerWaalsContact O-N 3.12Å; H1068-I1071 PolarHBondContact O-N 3.06Å; I1071-D1073 VanDerWaalsContact C-N 3.29Å; I1071-D1073 PolarHBondContact O-N 3.28Å; I1071-L1074 PolarHBondContact O-N 2.82Å; I1071-L1074 VanDerWaalsContact O-N 3.1Å; I1071-I1075 HydrophobicContact CG2-CD1 3.62Å; I1071-I1075 HydrophobicContact CG2-CG1 4.21Å; I1071-I1075 VanDerWaalsContact O-CG1 3.31Å; I1071-I1075 WeakPolarHBondContact O-CG1 3.34Å; I1071-I1075 PolarHBondContact O-N 3.3Å
1072	D	79.4	Confident	72.1	Confident	44 Å²	44	67.1 Å²	67.1	24%	0.235	34%	0.342	C	S	.	.	H	α-helix	trans	-59.1	-44.4	175.8	-76.1	-28.2	0	0	0	110.5	S1053 H1068 L1074 I1075 D1076	S1053-D1072 PolarHBondContact OG-OD1 3.18Å; H1068-D1072 WeakPolarHBondContact O-CB 3.37Å; H1068-D1072 PolarHBondContact O-N 2.93Å; D1072-L1074 PolarHBondContact O-N 3.19Å; D1072-I1075 PolarHBondContact O-N 3.43Å; D1072-D1076 VanDerWaalsContact O-CB 3.31Å; D1072-D1076 WeakPolarHBondContact O-CB 3.28Å; D1072-D1076 PolarHBondContact O-N 3.18Å
1073	D	83.3	Confident	74.1	Confident	82 Å²	82	64 Å²	64	44%	0.439	31%	0.309	S	S	.	.	H	α-helix	trans	-62.1	-41.3	174.3	-72.1	-33.3	0	0	0	111.5	S1069 I1071 N1077	S1069-D1073 WeakPolarHBondContact O-CB 3.43Å; S1069-D1073 PolarHBondContact O-N 3.35Å; S1069-D1073 PolarHBondContact OG-OD2 3.05Å; I1071-D1073 VanDerWaalsContact C-N 3.29Å; I1071-D1073 PolarHBondContact O-N 3.28Å; D1073-N1077 WeakPolarHBondContact O-CB 3.44Å; D1073-N1077 PolarHBondContact O-N 2.94Å; D1073-N1077 PolarHBondContact O-ND2 3.11Å
1074	L	85.3	Confident	76.3	Confident	42 Å²	42	57.5 Å²	57.5	22%	0.22	28%	0.284	C	S	.	.	H	α-helix	trans	-67	-40.9	178.8	179.3	140.1	0	0	0	112.1	E1010 V1013 K1070 I1071 D1072 S1078	E1010-L1074 HydrophobicContact CG-CD1 4Å; E1010-L1074 HydrophobicContact CG-CD2 4.44Å; V1013-L1074 HydrophobicContact CB-CD2 3.83Å; V1013-L1074 HydrophobicContact CG1-CD2 3.43Å; V1013-L1074 VanDerWaalsContact CG1-CD2 3.43Å; V1013-L1074 HydrophobicContact CG2-CD2 4.44Å; K1070-L1074 WeakPolarHBondContact O-CB 3.42Å; K1070-L1074 PolarHBondContact O-N 3.41Å; I1071-L1074 PolarHBondContact O-N 2.82Å; I1071-L1074 VanDerWaalsContact O-N 3.1Å; D1072-L1074 PolarHBondContact O-N 3.19Å; L1074-S1078 VanDerWaalsContact O-CB 3.27Å; L1074-S1078 WeakPolarHBondContact O-CB 3.4Å; L1074-S1078 PolarHBondContact O-N 3.47Å; L1074-S1078 PolarHBondContact O-OG 2.92Å
1075	I	85.3	Confident	78.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-67.2	-48.4	175.9	-66.4	169.5	0	0	0	109.7	V1013 A1049 K1050 I1071 D1072 N1077 S1078 V1079	V1013-I1075 HydrophobicContact CG2-CD1 4.38Å; V1013-I1075 HydrophobicContact CG2-CG1 3.79Å; A1049-I1075 HydrophobicContact CB-CD1 4.37Å; K1050-I1075 HydrophobicContact CB-CG2 3.83Å; K1050-I1075 HydrophobicContact CD-CG2 4.46Å; K1050-I1075 HydrophobicContact CG-CG2 4.19Å; I1071-I1075 HydrophobicContact CG2-CD1 3.62Å; I1071-I1075 HydrophobicContact CG2-CG1 4.21Å; I1071-I1075 VanDerWaalsContact O-CG1 3.31Å; I1071-I1075 WeakPolarHBondContact O-CG1 3.34Å; I1071-I1075 PolarHBondContact O-N 3.3Å; D1072-I1075 PolarHBondContact O-N 3.43Å; I1075-N1077 VanDerWaalsContact C-N 3.34Å; I1075-N1077 PolarHBondContact O-N 3.49Å; I1075-S1078 PolarHBondContact O-N 3.19Å; I1075-S1078 VanDerWaalsContact O-N 3.15Å; I1075-V1079 HydrophobicContact CG2-CG2 4.33Å; I1075-V1079 WeakPolarHBondContact O-CG2 3.3Å; I1075-V1079 PolarHBondContact O-N 3.08Å
1076	D	86.1	Confident	80	Confident	44 Å²	44	51.4 Å²	51.4	24%	0.235	26%	0.258	C	S	.	.	H	α-helix	trans	-62.3	-40.6	179.4	-87.1	-8.3	0	0	0	112.4	K1050 D1072 K1080	K1050-D1076 WeakPolarHBondContact CE-OD1 3.28Å; K1050-D1076 IonicContact NZ-OD1 2.61Å; K1050-D1076 PolarHBondContact NZ-OD1 3.42Å; K1050-D1076 IonicContact NZ-OD2 2.97Å; D1072-D1076 VanDerWaalsContact O-CB 3.31Å; D1072-D1076 WeakPolarHBondContact O-CB 3.28Å; D1072-D1076 PolarHBondContact O-N 3.18Å; D1076-K1080 WeakPolarHBondContact O-CB 3.23Å; D1076-K1080 WeakPolarHBondContact O-CD 3.24Å; D1076-K1080 WeakPolarHBondContact O-CG 3.34Å; D1076-K1080 PolarHBondContact O-N 2.93Å
1077	N	87.4	Confident	81.8	Confident	83 Å²	83	45.4 Å²	45.4	44%	0.444	23%	0.23	S	C	.	.	H	α-helix	trans	-65.4	-43.4	174.2	-71.2	-30.8	0	0	0	111.2	D1073 I1075 V1079 K1080 E1081	D1073-N1077 WeakPolarHBondContact O-CB 3.44Å; D1073-N1077 PolarHBondContact O-N 2.94Å; D1073-N1077 PolarHBondContact O-ND2 3.11Å; I1075-N1077 VanDerWaalsContact C-N 3.34Å; I1075-N1077 PolarHBondContact O-N 3.49Å; N1077-V1079 PolarHBondContact O-N 3.39Å; N1077-K1080 PolarHBondContact O-N 3.38Å; N1077-E1081 WeakPolarHBondContact O-CB 3.48Å; N1077-E1081 VanDerWaalsContact O-CG 3.3Å; N1077-E1081 WeakPolarHBondContact O-CG 3.34Å; N1077-E1081 PolarHBondContact O-N 3.38Å
1078	S	87.1	Confident	83.4	Confident	5 Å²	5	43.7 Å²	43.7	4%	0.035	23%	0.234	C	C	.	.	H	α-helix	trans	-63.4	-41.5	178.2	-61.4	0	0	0	0	112.3	L1074 I1075 E1081 I1082	L1074-S1078 VanDerWaalsContact O-CB 3.27Å; L1074-S1078 WeakPolarHBondContact O-CB 3.4Å; L1074-S1078 PolarHBondContact O-N 3.47Å; L1074-S1078 PolarHBondContact O-OG 2.92Å; I1075-S1078 PolarHBondContact O-N 3.19Å; I1075-S1078 VanDerWaalsContact O-N 3.15Å; S1078-E1081 PolarHBondContact O-N 2.94Å; S1078-I1082 WeakPolarHBondContact O-CB 3.41Å; S1078-I1082 WeakPolarHBondContact O-CG1 3.49Å; S1078-I1082 PolarHBondContact O-N 3.49Å
1079	V	87.4	Confident	84.7	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.024	23%	0.231	C	C	.	.	H	α-helix	trans	-65.8	-45.4	175.8	173.6	0	0	0	0	110.7	F1043 L1046 I1075 N1077 E1081 I1082 I1083 Y1158	F1043-V1079 HydrophobicContact CZ-CG1 4.16Å; L1046-V1079 HydrophobicContact CB-CG2 3.96Å; L1046-V1079 HydrophobicContact CD1-CG2 4.5Å; I1075-V1079 HydrophobicContact CG2-CG2 4.33Å; I1075-V1079 WeakPolarHBondContact O-CG2 3.3Å; I1075-V1079 PolarHBondContact O-N 3.08Å; N1077-V1079 PolarHBondContact O-N 3.39Å; V1079-E1081 VanDerWaalsContact C-N 3.33Å; V1079-E1081 PolarHBondContact O-N 2.77Å; V1079-I1082 PolarHBondContact O-N 3.5Å; V1079-I1083 HydrophobicContact CG1-CD1 3.92Å; V1079-I1083 HydrophobicContact CG1-CG1 4.42Å; V1079-I1083 WeakPolarHBondContact O-CB 3.28Å; V1079-I1083 VanDerWaalsContact O-CG1 3.28Å; V1079-I1083 WeakPolarHBondContact O-CG1 3.03Å; V1079-I1083 PolarHBondContact O-N 3.38Å; V1079-Y1158 HydrophobicContact CG1-CD1 3.61Å; V1079-Y1158 HydrophobicContact CG1-CE1 3.62Å; V1079-Y1158 HydrophobicContact CG1-CG 4.38Å
1080	K	87.7	Confident	86	Confident	125 Å²	125	40.4 Å²	40.4	54%	0.543	21%	0.212	S	C	.	.	H	α-helix	trans	-58.7	-43.8	175.6	-75.6	168.6	-171.2	164.3	0	112.1	D1076 N1077 I1083 S1084	D1076-K1080 WeakPolarHBondContact O-CB 3.23Å; D1076-K1080 WeakPolarHBondContact O-CD 3.24Å; D1076-K1080 WeakPolarHBondContact O-CG 3.34Å; D1076-K1080 PolarHBondContact O-N 2.93Å; N1077-K1080 PolarHBondContact O-N 3.38Å; K1080-I1083 PolarHBondContact O-N 3.47Å; K1080-S1084 WeakPolarHBondContact O-CB 2.67Å; K1080-S1084 PolarHBondContact O-N 3.04Å
1081	E	87.4	Confident	86.8	Confident	73 Å²	73	35.9 Å²	35.9	34%	0.341	19%	0.193	S	C	.	.	H	α-helix	trans	-65.5	-42.8	178.5	-74.7	170.9	131.3	0	0	111.6	R1017 N1077 S1078 V1079 S1084 L1085	R1017-E1081 VanDerWaalsContact CZ-CD 3.5Å; R1017-E1081 IonicContact CZ-OE1 3.51Å; R1017-E1081 IonicContact CZ-OE2 3.76Å; R1017-E1081 IonicContact NE-OE2 2.95Å; R1017-E1081 IonicContact NH1-OE1 2.89Å; R1017-E1081 IonicContact NH1-OE2 3.65Å; R1017-E1081 PolarHBondContact NH1-OE2 2.87Å; R1017-E1081 IonicContact NH2-OE1 2.64Å; R1017-E1081 PolarHBondContact NH2-OE1 3.1Å; R1017-E1081 IonicContact NH2-OE2 3.75Å; R1017-E1081 PolarHBondContact NH2-OE2 3.46Å; N1077-E1081 WeakPolarHBondContact O-CB 3.48Å; N1077-E1081 VanDerWaalsContact O-CG 3.3Å; N1077-E1081 WeakPolarHBondContact O-CG 3.34Å; N1077-E1081 PolarHBondContact O-N 3.38Å; S1078-E1081 PolarHBondContact O-N 2.94Å; V1079-E1081 VanDerWaalsContact C-N 3.33Å; V1079-E1081 PolarHBondContact O-N 2.77Å; E1081-S1084 CarbonylContact O-C 3.5Å; E1081-S1084 WeakPolarHBondContact O-CB 3.12Å; E1081-S1084 PolarHBondContact O-N 2.92Å; E1081-L1085 WeakPolarHBondContact O-CB 3.45Å; E1081-L1085 VanDerWaalsContact O-CG 3.28Å; E1081-L1085 WeakPolarHBondContact O-CG 3.3Å; E1081-L1085 PolarHBondContact O-N 3.21Å
1082	I	88.6	Confident	87.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-44	176.4	-81	169.4	0	0	0	111.9	F1020 F1043 L1046 S1078 V1079 S1084 L1085 L1086	F1020-I1082 HydrophobicContact CB-CD1 4.28Å; F1020-I1082 HydrophobicContact CD1-CB 4.42Å; F1020-I1082 HydrophobicContact CD1-CD1 4.18Å; F1020-I1082 HydrophobicContact CD1-CG1 3.64Å; F1020-I1082 HydrophobicContact CD1-CG2 4.28Å; F1020-I1082 HydrophobicContact CD2-CD1 4.24Å; F1020-I1082 HydrophobicContact CD2-CG1 4.39Å; F1020-I1082 HydrophobicContact CD2-CG2 4.16Å; F1020-I1082 HydrophobicContact CE1-CB 4.14Å; F1020-I1082 HydrophobicContact CE1-CG1 3.86Å; F1020-I1082 HydrophobicContact CE1-CG2 3.74Å; F1020-I1082 HydrophobicContact CE2-CG2 3.58Å; F1020-I1082 HydrophobicContact CG-CD1 3.97Å; F1020-I1082 HydrophobicContact CG-CG1 3.95Å; F1020-I1082 HydrophobicContact CG-CG2 4.49Å; F1020-I1082 HydrophobicContact CZ-CB 4.31Å; F1020-I1082 HydrophobicContact CZ-CG1 4.34Å; F1020-I1082 HydrophobicContact CZ-CG2 3.41Å; F1020-I1082 VanDerWaalsContact CZ-CG2 3.41Å; F1043-I1082 HydrophobicContact CD2-CG2 3.55Å; F1043-I1082 HydrophobicContact CE2-CG2 3.84Å; L1046-I1082 HydrophobicContact CD1-CD1 3.12Å; S1078-I1082 WeakPolarHBondContact O-CB 3.41Å; S1078-I1082 WeakPolarHBondContact O-CG1 3.49Å; S1078-I1082 PolarHBondContact O-N 3.49Å; V1079-I1082 PolarHBondContact O-N 3.5Å; I1082-S1084 VanDerWaalsContact C-N 3.32Å; I1082-S1084 PolarHBondContact O-N 2.97Å; I1082-L1085 PolarHBondContact O-N 3.37Å; I1082-L1086 HydrophobicContact CG2-CD1 4.2Å; I1082-L1086 WeakPolarHBondContact O-CG 3.36Å; I1082-L1086 PolarHBondContact O-N 3.27Å
1083	I	88.7	Confident	87.5	Confident	6 Å²	6	34.7 Å²	34.7	3%	0.031	19%	0.189	C	C	.	.	H	α-helix	trans	-56.7	-48.9	172.2	-71.6	174.3	0	0	0	109.6	F1043 V1079 K1080 L1085 L1086 V1087 Y1158 L1162	F1043-I1083 HydrophobicContact CE2-CD1 4.49Å; F1043-I1083 HydrophobicContact CE2-CG1 3.79Å; F1043-I1083 HydrophobicContact CZ-CD1 4.25Å; F1043-I1083 HydrophobicContact CZ-CG1 4.02Å; V1079-I1083 HydrophobicContact CG1-CD1 3.92Å; V1079-I1083 HydrophobicContact CG1-CG1 4.42Å; V1079-I1083 WeakPolarHBondContact O-CB 3.28Å; V1079-I1083 VanDerWaalsContact O-CG1 3.28Å; V1079-I1083 WeakPolarHBondContact O-CG1 3.03Å; V1079-I1083 PolarHBondContact O-N 3.38Å; K1080-I1083 PolarHBondContact O-N 3.47Å; I1083-L1085 VanDerWaalsContact C-N 3.34Å; I1083-L1085 PolarHBondContact O-N 3.21Å; I1083-L1086 PolarHBondContact O-N 2.91Å; I1083-V1087 HydrophobicContact CG2-CG2 4.42Å; I1083-V1087 WeakPolarHBondContact O-CB 3.36Å; I1083-V1087 VanDerWaalsContact O-CG2 3.27Å; I1083-V1087 WeakPolarHBondContact O-CG2 3.45Å; I1083-V1087 PolarHBondContact O-N 3.29Å; I1083-Y1158 HydrophobicContact CD1-CD1 4.33Å; I1083-L1162 HydrophobicContact CB-CD1 4.21Å; I1083-L1162 HydrophobicContact CG1-CD1 4.29Å; I1083-L1162 HydrophobicContact CG2-CB 4.31Å; I1083-L1162 HydrophobicContact CG2-CD1 3.74Å
1084	S	89.1	Confident	87.7	Confident	56 Å²	56	30.8 Å²	30.8	39%	0.392	17%	0.168	S	C	.	.	H	α-helix	trans	-61.2	-39.6	178.9	-172.5	0	0	0	0	112.9	K1080 E1081 I1082 S1088	K1080-S1084 WeakPolarHBondContact O-CB 2.67Å; K1080-S1084 PolarHBondContact O-N 3.04Å; E1081-S1084 CarbonylContact O-C 3.5Å; E1081-S1084 WeakPolarHBondContact O-CB 3.12Å; E1081-S1084 PolarHBondContact O-N 2.92Å; I1082-S1084 VanDerWaalsContact C-N 3.32Å; I1082-S1084 PolarHBondContact O-N 2.97Å; S1084-S1088 VanDerWaalsContact O-CB 3.24Å; S1084-S1088 WeakPolarHBondContact O-CB 3.27Å; S1084-S1088 PolarHBondContact O-N 3.48Å
1085	L	88.7	Confident	87.7	Confident	66 Å²	66	33.6 Å²	33.6	35%	0.346	18%	0.18	S	C	.	.	H	α-helix	trans	-67.7	-41.6	177.6	-72.6	170.9	0	0	0	111.9	F1020 E1021 L1024 E1081 I1082 I1083 S1088 K1089	F1020-L1085 HydrophobicContact CE1-CB 4.46Å; E1021-L1085 HydrophobicContact CG-CD1 3.77Å; L1024-L1085 HydrophobicContact CD2-CB 3.83Å; E1081-L1085 WeakPolarHBondContact O-CB 3.45Å; E1081-L1085 VanDerWaalsContact O-CG 3.28Å; E1081-L1085 WeakPolarHBondContact O-CG 3.3Å; E1081-L1085 PolarHBondContact O-N 3.21Å; I1082-L1085 PolarHBondContact O-N 3.37Å; I1083-L1085 VanDerWaalsContact C-N 3.34Å; I1083-L1085 PolarHBondContact O-N 3.21Å; L1085-S1088 PolarHBondContact O-N 3.2Å; L1085-K1089 WeakPolarHBondContact O-CB 3.48Å; L1085-K1089 PolarHBondContact O-N 3.04Å
1086	L	88.1	Confident	87.7	Confident	3 Å²	3	35 Å²	35	2%	0.016	20%	0.195	C	C	.	.	H	α-helix	trans	-62.2	-49.1	173.9	-75.6	168	0	0	0	111.5	F1020 L1024 I1035 V1039 F1043 I1082 I1083 S1088 K1089 F1090 L1162	F1020-L1086 HydrophobicContact CE1-CG 4.4Å; F1020-L1086 HydrophobicContact CE2-CD1 4.41Å; F1020-L1086 HydrophobicContact CZ-CD1 3.86Å; F1020-L1086 HydrophobicContact CZ-CD2 3.82Å; F1020-L1086 HydrophobicContact CZ-CG 3.64Å; L1024-L1086 HydrophobicContact CD1-CD2 4Å; L1024-L1086 HydrophobicContact CD2-CD2 4.23Å; I1035-L1086 HydrophobicContact CD1-CD2 3.92Å; V1039-L1086 HydrophobicContact CG1-CD2 4.1Å; F1043-L1086 HydrophobicContact CD2-CD1 4.41Å; I1082-L1086 HydrophobicContact CG2-CD1 4.2Å; I1082-L1086 WeakPolarHBondContact O-CG 3.36Å; I1082-L1086 PolarHBondContact O-N 3.27Å; I1083-L1086 PolarHBondContact O-N 2.91Å; L1086-S1088 VanDerWaalsContact C-N 3.35Å; L1086-S1088 PolarHBondContact O-N 3.33Å; L1086-K1089 WeakPolarHBondContact O-CB 3.27Å; L1086-K1089 PolarHBondContact O-N 3.4Å; L1086-K1089 VanDerWaalsContact O-N 3.12Å; L1086-F1090 WeakPolarHBondContact O-CD2 3.24Å; L1086-F1090 WeakPolarHBondContact O-CG 3.39Å; L1086-F1090 PolarHBondContact O-N 3.23Å; L1086-L1162 HydrophobicContact CB-CD1 4.06Å; L1086-L1162 HydrophobicContact CD1-CD1 4.33Å
1087	V	89.4	Confident	87.5	Confident	3 Å²	3	33 Å²	33	2%	0.018	18%	0.184	C	C	.	.	H	α-helix	trans	-59.8	-46.9	177.9	171.3	0	0	0	0	110.6	I1083 K1089 F1090 V1091 L1162 Q1165 W1166	I1083-V1087 HydrophobicContact CG2-CG2 4.42Å; I1083-V1087 WeakPolarHBondContact O-CB 3.36Å; I1083-V1087 VanDerWaalsContact O-CG2 3.27Å; I1083-V1087 WeakPolarHBondContact O-CG2 3.45Å; I1083-V1087 PolarHBondContact O-N 3.29Å; V1087-K1089 VanDerWaalsContact C-N 3.25Å; V1087-K1089 PolarHBondContact O-N 3.12Å; V1087-F1090 PolarHBondContact O-N 3.31Å; V1087-V1091 HydrophobicContact CG1-CG2 4.03Å; V1087-V1091 WeakPolarHBondContact O-CB 3.49Å; V1087-V1091 WeakPolarHBondContact O-CG2 3.4Å; V1087-V1091 PolarHBondContact O-N 3.42Å; V1087-L1162 HydrophobicContact CG2-CD1 3.85Å; V1087-Q1165 HydrophobicContact CG1-CG 4.27Å; V1087-Q1165 HydrophobicContact CG2-CB 4.14Å; V1087-Q1165 HydrophobicContact CG2-CG 4.13Å; V1087-W1166 HydrophobicContact CG1-CB 4.49Å; V1087-W1166 HydrophobicContact CG2-CB 4.06Å
1088	S	88.8	Confident	87.3	Confident	76 Å²	76	29.2 Å²	29.2	53%	0.531	16%	0.164	S	C	.	.	H	α-helix	trans	-57.1	-41.1	176.2	179.2	0	0	0	0	111.5	S1084 L1085 L1086 V1091 S1092	S1084-S1088 VanDerWaalsContact O-CB 3.24Å; S1084-S1088 WeakPolarHBondContact O-CB 3.27Å; S1084-S1088 PolarHBondContact O-N 3.48Å; L1085-S1088 PolarHBondContact O-N 3.2Å; L1086-S1088 VanDerWaalsContact C-N 3.35Å; L1086-S1088 PolarHBondContact O-N 3.33Å; S1088-V1091 PolarHBondContact O-N 2.91Å; S1088-S1092 PolarHBondContact O-N 3.25Å
1089	K	87.7	Confident	87.1	Confident	21 Å²	21	32.2 Å²	32.2	9%	0.091	19%	0.185	C	C	.	.	H	α-helix	trans	-64.2	-46.1	176.3	-167.5	71.8	177	-147.2	0	112	L1024 A1027 S1028 L1033 L1085 L1086 V1087 S1092 V1093	L1024-K1089 HydrophobicContact CD1-CB 4.22Å; L1024-K1089 HydrophobicContact CD1-CG 4.03Å; L1024-K1089 PolarHBondContact O-NZ 3.22Å; L1024-K1089 VanDerWaalsContact O-NZ 3.11Å; A1027-K1089 WeakPolarHBondContact O-CE 3.48Å; A1027-K1089 PolarHBondContact O-NZ 2.98Å; S1028-K1089 WeakPolarHBondContact O-CE 3.4Å; L1033-K1089 HydrophobicContact CD2-CG 4.02Å; L1085-K1089 WeakPolarHBondContact O-CB 3.48Å; L1085-K1089 PolarHBondContact O-N 3.04Å; L1086-K1089 WeakPolarHBondContact O-CB 3.27Å; L1086-K1089 PolarHBondContact O-N 3.4Å; L1086-K1089 VanDerWaalsContact O-N 3.12Å; V1087-K1089 VanDerWaalsContact C-N 3.25Å; V1087-K1089 PolarHBondContact O-N 3.12Å; K1089-S1092 PolarHBondContact O-N 2.73Å; K1089-S1092 PolarHBondContact O-OG 3.42Å; K1089-V1093 PolarHBondContact O-N 2.98Å
1090	F	89.5	Confident	86.7	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.009	20%	0.203	C	C	.	.	H	α-helix	trans	-64.3	-41.3	177.7	-65.9	-35.6	0	0	0	112.9	L1033 I1035 L1086 V1087 S1092 V1093 L1094 F1141 N1145 L1149 W1166	L1033-F1090 HydrophobicContact CD2-CD1 4.38Å; I1035-F1090 HydrophobicContact CD1-CE1 3.7Å; I1035-F1090 HydrophobicContact CD1-CE2 4.13Å; I1035-F1090 HydrophobicContact CD1-CZ 3.21Å; I1035-F1090 HydrophobicContact CG1-CE1 3.91Å; I1035-F1090 HydrophobicContact CG1-CZ 3.92Å; L1086-F1090 WeakPolarHBondContact O-CD2 3.24Å; L1086-F1090 WeakPolarHBondContact O-CG 3.39Å; L1086-F1090 PolarHBondContact O-N 3.23Å; V1087-F1090 PolarHBondContact O-N 3.31Å; F1090-S1092 VanDerWaalsContact C-N 3.29Å; F1090-S1092 PolarHBondContact O-N 3.31Å; F1090-V1093 WeakPolarHBondContact O-CB 3.4Å; F1090-V1093 PolarHBondContact O-N 2.86Å; F1090-V1093 VanDerWaalsContact O-N 3.11Å; F1090-L1094 PolarHBondContact O-N 2.93Å; F1090-F1141 HydrophobicContact CB-CZ 4.46Å; F1090-F1141 HydrophobicContact CD1-CE2 4.36Å; F1090-F1141 AromaticContact CD1-CZ 3.69Å; F1090-F1141 HydrophobicContact CD1-CZ 3.69Å; F1090-F1141 HydrophobicContact CE1-CZ 4.24Å; F1090-F1141 HydrophobicContact CG-CZ 4.43Å; F1090-N1145 HydrophobicContact CE1-CB 4.05Å; F1090-N1145 HydrophobicContact CZ-CB 3.97Å; F1090-L1149 HydrophobicContact CE2-CD1 3.92Å; F1090-L1149 HydrophobicContact CZ-CD1 3.89Å; F1090-W1166 HydrophobicContact CB-CD2 4.21Å; F1090-W1166 HydrophobicContact CB-CG 4.44Å; F1090-W1166 HydrophobicContact CB-CZ2 3.88Å; F1090-W1166 HydrophobicContact CD1-CZ2 4.29Å; F1090-W1166 AromaticContact CD2-CD2 3.48Å; F1090-W1166 HydrophobicContact CD2-CD2 3.48Å; F1090-W1166 VanDerWaalsContact CD2-CD2 3.48Å; F1090-W1166 AromaticContact CD2-CE2 3.57Å; F1090-W1166 AromaticContact CD2-CE3 3.65Å; F1090-W1166 HydrophobicContact CD2-CE3 3.65Å; F1090-W1166 HydrophobicContact CD2-CG 4.04Å; F1090-W1166 AromaticContact CD2-CH2 3.99Å; F1090-W1166 HydrophobicContact CD2-CH2 3.99Å; F1090-W1166 AromaticContact CD2-CZ2 3.84Å; F1090-W1166 HydrophobicContact CD2-CZ2 3.84Å; F1090-W1166 AromaticContact CD2-CZ3 3.9Å; F1090-W1166 HydrophobicContact CD2-CZ3 3.9Å; F1090-W1166 HydrophobicContact CE1-CH2 4.42Å; F1090-W1166 AromaticContact CE2-CD2 3.99Å; F1090-W1166 HydrophobicContact CE2-CD2 3.99Å; F1090-W1166 AromaticContact CE2-CE3 3.64Å; F1090-W1166 HydrophobicContact CE2-CE3 3.64Å; F1090-W1166 AromaticContact CE2-CH2 3.91Å; F1090-W1166 HydrophobicContact CE2-CH2 3.91Å; F1090-W1166 HydrophobicContact CE2-CZ2 4.25Å; F1090-W1166 AromaticContact CE2-CZ3 3.59Å; F1090-W1166 HydrophobicContact CE2-CZ3 3.59Å; F1090-W1166 HydrophobicContact CG-CD2 4.16Å; F1090-W1166 AromaticContact CG-CE2 3.75Å; F1090-W1166 HydrophobicContact CG-CH2 4.24Å; F1090-W1166 AromaticContact CG-CZ2 3.8Å; F1090-W1166 HydrophobicContact CG-CZ2 3.8Å; F1090-W1166 HydrophobicContact CZ-CH2 4.06Å; F1090-W1166 HydrophobicContact CZ-CZ3 4.03Å
1091	V	88.6	Confident	86.2	Confident	11 Å²	11	30.6 Å²	30.6	7%	0.067	18%	0.177	C	C	.	.	H	α-helix	trans	-63.4	-36.7	175.5	172.2	0	0	0	0	110.8	V1087 S1088 V1093 L1094 E1095 V1173	V1087-V1091 HydrophobicContact CG1-CG2 4.03Å; V1087-V1091 WeakPolarHBondContact O-CB 3.49Å; V1087-V1091 WeakPolarHBondContact O-CG2 3.4Å; V1087-V1091 PolarHBondContact O-N 3.42Å; S1088-V1091 PolarHBondContact O-N 2.91Å; V1091-V1093 PolarHBondContact O-N 2.95Å; V1091-L1094 CarbonylContact O-C 3.57Å; V1091-L1094 WeakPolarHBondContact O-CA 3.17Å; V1091-L1094 WeakPolarHBondContact O-CB 3.47Å; V1091-L1094 PolarHBondContact O-N 3.1Å; V1091-E1095 HydrophobicContact CG1-CG 4.43Å; V1091-E1095 WeakPolarHBondContact O-CG 3.22Å; V1091-E1095 PolarHBondContact O-N 2.76Å; V1091-V1173 HydrophobicContact CG1-CB 4.26Å; V1091-V1173 HydrophobicContact CG1-CG2 3.45Å; V1091-V1173 VanDerWaalsContact CG1-CG2 3.45Å
1092	S	86.9	Confident	85.6	Confident	24 Å²	24	28.6 Å²	28.6	17%	0.168	17%	0.171	C	C	.	.	H	α-helix	trans	-62.2	-28.2	174.9	79.6	0	0	0	0	113.5	S1088 K1089 F1090 G1096	S1088-S1092 PolarHBondContact O-N 3.25Å; K1089-S1092 PolarHBondContact O-N 2.73Å; K1089-S1092 PolarHBondContact O-OG 3.42Å; F1090-S1092 VanDerWaalsContact C-N 3.29Å; F1090-S1092 PolarHBondContact O-N 3.31Å; S1092-G1096 PolarHBondContact O-N 3.02Å
1093	V	87	Confident	84.9	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.012	20%	0.2	C	C	.	.	H	α-helix	trans	-69.5	-42.3	172.4	179.3	0	0	0	0	110.2	T1031 L1033 K1089 F1090 V1091 G1096 V1097 F1141	T1031-V1093 HydrophobicContact CG2-CG1 3.88Å; L1033-V1093 HydrophobicContact CD2-CG2 4.04Å; K1089-V1093 PolarHBondContact O-N 2.98Å; F1090-V1093 WeakPolarHBondContact O-CB 3.4Å; F1090-V1093 PolarHBondContact O-N 2.86Å; F1090-V1093 VanDerWaalsContact O-N 3.11Å; V1091-V1093 PolarHBondContact O-N 2.95Å; V1093-G1096 PolarHBondContact O-N 3.49Å; V1093-V1097 WeakPolarHBondContact O-CG2 3.47Å; V1093-V1097 PolarHBondContact O-N 2.86Å; V1093-F1141 HydrophobicContact CB-CE1 4.07Å; V1093-F1141 HydrophobicContact CB-CZ 3.98Å; V1093-F1141 HydrophobicContact CG1-CD1 4.16Å; V1093-F1141 HydrophobicContact CG1-CE1 3.94Å; V1093-F1141 HydrophobicContact CG1-CE2 4.36Å; V1093-F1141 HydrophobicContact CG1-CG 4.46Å; V1093-F1141 HydrophobicContact CG1-CZ 4.04Å; V1093-F1141 HydrophobicContact CG2-CE2 4.27Å; V1093-F1141 HydrophobicContact CG2-CZ 3.92Å
1094	L	86.6	Confident	83.9	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-62.9	-44.5	174.6	178.4	58.3	0	0	0	111.8	F1090 V1091 G1096 V1097 L1098 Y1138 I1174	F1090-L1094 PolarHBondContact O-N 2.93Å; V1091-L1094 CarbonylContact O-C 3.57Å; V1091-L1094 WeakPolarHBondContact O-CA 3.17Å; V1091-L1094 WeakPolarHBondContact O-CB 3.47Å; V1091-L1094 PolarHBondContact O-N 3.1Å; L1094-G1096 VanDerWaalsContact C-N 3.25Å; L1094-G1096 PolarHBondContact O-N 3.07Å; L1094-V1097 CarbonylContact O-C 3.52Å; L1094-V1097 WeakPolarHBondContact O-CA 3.35Å; L1094-V1097 WeakPolarHBondContact O-CB 3.38Å; L1094-V1097 PolarHBondContact O-N 2.8Å; L1094-L1098 HydrophobicContact CD1-CD1 4.33Å; L1094-L1098 HydrophobicContact CD1-CG 4.19Å; L1094-L1098 HydrophobicContact CG-CD1 4.07Å; L1094-L1098 HydrophobicContact CG-CG 4.37Å; L1094-L1098 WeakPolarHBondContact O-CG 3.25Å; L1094-L1098 PolarHBondContact O-N 3.03Å; L1094-Y1138 HydrophobicContact CB-CE2 3.77Å; L1094-Y1138 HydrophobicContact CD1-CD1 4.47Å; L1094-Y1138 HydrophobicContact CD1-CE1 3.87Å; L1094-Y1138 HydrophobicContact CD1-CE2 3.95Å; L1094-Y1138 HydrophobicContact CG-CE2 4.41Å; L1094-I1174 HydrophobicContact CD1-CD1 4.47Å; L1094-I1174 HydrophobicContact CD1-CG1 4.47Å; L1094-I1174 HydrophobicContact CD2-CD1 4.14Å; L1094-I1174 HydrophobicContact CD2-CG1 4.05Å
1095	E	86.1	Confident	83.1	Confident	100 Å²	100	37 Å²	37	47%	0.467	20%	0.196	S	C	.	.	H	α-helix	trans	-57.8	-39.5	172.9	-70.3	176	163.2	0	0	111.5	V1091 V1097 L1098 S1099 V1173	V1091-E1095 HydrophobicContact CG1-CG 4.43Å; V1091-E1095 WeakPolarHBondContact O-CG 3.22Å; V1091-E1095 PolarHBondContact O-N 2.76Å; E1095-V1097 VanDerWaalsContact C-N 3.34Å; E1095-V1097 PolarHBondContact O-N 3.34Å; E1095-L1098 PolarHBondContact O-N 2.87Å; E1095-S1099 VanDerWaalsContact O-CB 3.26Å; E1095-S1099 WeakPolarHBondContact O-CB 3.37Å; E1095-S1099 PolarHBondContact O-N 3.47Å; E1095-V1173 HydrophobicContact CG-CG1 3.67Å
1096	G	83.9	Confident	81.7	Confident	31 Å²	31	39.7 Å²	39.7	32%	0.32	21%	0.207	S	C	.	.	H	α-helix	trans	-62.1	-38.3	173	0	0	0	0	0	113.3	S1092 V1093 L1094 K1100	S1092-G1096 PolarHBondContact O-N 3.02Å; V1093-G1096 PolarHBondContact O-N 3.49Å; L1094-G1096 VanDerWaalsContact C-N 3.25Å; L1094-G1096 PolarHBondContact O-N 3.07Å; G1096-K1100 WeakPolarHBondContact O-CG 3.31Å; G1096-K1100 PolarHBondContact O-N 2.84Å; G1096-K1100 VanDerWaalsContact O-N 3.15Å
1097	V	83.1	Confident	80.3	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.012	25%	0.247	C	C	.	.	H	α-helix	trans	-68.3	-45.3	174	171.4	0	0	0	0	111	T1031 V1093 L1094 E1095 S1099 K1100 L1101 L1134 Y1138 I1197	T1031-V1097 HydrophobicContact CG2-CG2 3.71Å; V1093-V1097 WeakPolarHBondContact O-CG2 3.47Å; V1093-V1097 PolarHBondContact O-N 2.86Å; L1094-V1097 CarbonylContact O-C 3.52Å; L1094-V1097 WeakPolarHBondContact O-CA 3.35Å; L1094-V1097 WeakPolarHBondContact O-CB 3.38Å; L1094-V1097 PolarHBondContact O-N 2.8Å; E1095-V1097 VanDerWaalsContact C-N 3.34Å; E1095-V1097 PolarHBondContact O-N 3.34Å; V1097-S1099 VanDerWaalsContact C-N 3.34Å; V1097-S1099 PolarHBondContact O-N 3.24Å; V1097-K1100 WeakPolarHBondContact O-CB 3.32Å; V1097-K1100 PolarHBondContact O-N 2.64Å; V1097-L1101 HydrophobicContact CG1-CD1 4.29Å; V1097-L1101 WeakPolarHBondContact O-CG 3.3Å; V1097-L1101 PolarHBondContact O-N 3.03Å; V1097-L1134 HydrophobicContact CG1-CD1 4.3Å; V1097-L1134 HydrophobicContact CG1-CD2 4.05Å; V1097-L1134 HydrophobicContact CG1-CG 3.92Å; V1097-L1134 HydrophobicContact CG2-CD1 4.42Å; V1097-Y1138 HydrophobicContact CG2-CD2 3.92Å; V1097-Y1138 HydrophobicContact CG2-CG 4.38Å; V1097-I1197 HydrophobicContact CG1-CD1 4.22Å
1098	L	83.6	Confident	78.7	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-65.2	-35.2	177	-67.7	174.7	0	0	0	112.4	L1094 E1095 L1101 S1102 V1173 I1174 W1177 L1194	L1094-L1098 HydrophobicContact CD1-CD1 4.33Å; L1094-L1098 HydrophobicContact CD1-CG 4.19Å; L1094-L1098 HydrophobicContact CG-CD1 4.07Å; L1094-L1098 HydrophobicContact CG-CG 4.37Å; L1094-L1098 WeakPolarHBondContact O-CG 3.25Å; L1094-L1098 PolarHBondContact O-N 3.03Å; E1095-L1098 PolarHBondContact O-N 2.87Å; L1098-L1101 HydrophobicContact CD2-CD1 4.21Å; L1098-L1101 CarbonylContact O-C 3.57Å; L1098-L1101 WeakPolarHBondContact O-CB 3.46Å; L1098-L1101 PolarHBondContact O-N 2.89Å; L1098-S1102 PolarHBondContact O-N 3.23Å; L1098-V1173 HydrophobicContact CD1-CG1 3.68Å; L1098-I1174 HydrophobicContact CD1-CG1 4.26Å; L1098-W1177 HydrophobicContact CB-CG 4.19Å; L1098-W1177 HydrophobicContact CD1-CB 4.09Å; L1098-W1177 HydrophobicContact CD1-CG 4.16Å; L1098-W1177 HydrophobicContact CD2-CD2 4.18Å; L1098-W1177 HydrophobicContact CD2-CG 4.27Å; L1098-W1177 HydrophobicContact CG-CG 4.45Å; L1098-W1177 PolarHBondContact O-NE1 3.46Å; L1098-L1194 HydrophobicContact CD2-CD2 3.6Å
1099	S	82.3	Confident	76.8	Confident	68 Å²	68	51 Å²	51	48%	0.476	27%	0.274	S	S	.	.	H	α-helix	trans	-65.1	-41.2	172.8	179.8	0	0	0	0	111.5	E1095 V1097 L1101 S1102	E1095-S1099 VanDerWaalsContact O-CB 3.26Å; E1095-S1099 WeakPolarHBondContact O-CB 3.37Å; E1095-S1099 PolarHBondContact O-N 3.47Å; V1097-S1099 VanDerWaalsContact C-N 3.34Å; V1097-S1099 PolarHBondContact O-N 3.24Å; S1099-L1101 VanDerWaalsContact C-N 3.27Å; S1099-L1101 PolarHBondContact O-N 3.11Å; S1099-S1102 PolarHBondContact O-N 3.38Å; S1099-S1102 PolarHBondContact O-OG 3.43Å
1100	K	79.1	Confident	75	Confident	95 Å²	95	56 Å²	56	41%	0.413	30%	0.296	S	S	.	.	H	α-helix	trans	-62.7	-36	171.6	-70.9	173.3	-177.3	179.8	0	111.7	G1096 V1097 R1103 L1134	G1096-K1100 WeakPolarHBondContact O-CG 3.31Å; G1096-K1100 PolarHBondContact O-N 2.84Å; G1096-K1100 VanDerWaalsContact O-N 3.15Å; V1097-K1100 WeakPolarHBondContact O-CB 3.32Å; V1097-K1100 PolarHBondContact O-N 2.64Å; K1100-R1103 WeakPolarHBondContact O-CB 3.39Å; K1100-R1103 PolarHBondContact O-N 3.26Å; K1100-L1134 HydrophobicContact CB-CD2 4.21Å; K1100-L1134 HydrophobicContact CD-CD1 4.17Å
1101	L	76.7	Confident	73	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-69.3	-33.4	175.6	-72.8	167.7	0	0	0	113.1	V1097 L1098 S1099 R1103 Y1104 L1134 W1177 Y1189 Q1190 T1193 L1194	V1097-L1101 HydrophobicContact CG1-CD1 4.29Å; V1097-L1101 WeakPolarHBondContact O-CG 3.3Å; V1097-L1101 PolarHBondContact O-N 3.03Å; L1098-L1101 HydrophobicContact CD2-CD1 4.21Å; L1098-L1101 CarbonylContact O-C 3.57Å; L1098-L1101 WeakPolarHBondContact O-CB 3.46Å; L1098-L1101 PolarHBondContact O-N 2.89Å; S1099-L1101 VanDerWaalsContact C-N 3.27Å; S1099-L1101 PolarHBondContact O-N 3.11Å; L1101-R1103 PolarHBondContact O-N 3.48Å; L1101-R1103 VanDerWaalsContact O-N 3.08Å; L1101-Y1104 WeakPolarHBondContact O-CD2 3.26Å; L1101-Y1104 PolarHBondContact O-N 2.83Å; L1101-Y1104 VanDerWaalsContact O-N 3.12Å; L1101-L1134 HydrophobicContact CD2-CD2 4.05Å; L1101-L1134 HydrophobicContact CG-CD2 3.97Å; L1101-W1177 HydrophobicContact CB-CZ2 4.26Å; L1101-Y1189 HydrophobicContact CD2-CD1 4.4Å; L1101-Y1189 HydrophobicContact CD2-CE1 4.12Å; L1101-Q1190 PolarHBondContact O-NE2 2.93Å; L1101-T1193 HydrophobicContact CD1-CG2 3.81Å; L1101-T1193 HydrophobicContact CD2-CG2 3.86Å; L1101-T1193 HydrophobicContact CG-CG2 4.4Å; L1101-L1194 HydrophobicContact CD1-CD2 4.29Å
1102	S	75.8	Confident	71.1	Confident	31 Å²	31	60.8 Å²	60.8	22%	0.217	33%	0.331	C	S	.	.	H	α-helix	trans	-61.3	-17.4	177.1	70.2	0	0	0	0	114.4	L1098 S1099 Y1104 D1105 R1181	L1098-S1102 PolarHBondContact O-N 3.23Å; S1099-S1102 PolarHBondContact O-N 3.38Å; S1099-S1102 PolarHBondContact O-OG 3.43Å; S1102-Y1104 PolarHBondContact O-N 3.31Å; S1102-Y1104 VanDerWaalsContact O-N 3.1Å; S1102-D1105 WeakPolarHBondContact O-CB 3.26Å; S1102-D1105 PolarHBondContact O-N 2.94Å; S1102-D1105 VanDerWaalsContact O-N 3.15Å; S1102-R1181 VanDerWaalsContact CB-NH2 3.26Å
1103	R	72.7	Confident	69.4	Low	158 Å²	158	64.2 Å²	64.2	60%	0.596	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-10.7	174.6	-60.9	-179	-179.1	-174.6	-1.6	114	K1100 L1101 T1108	K1100-R1103 WeakPolarHBondContact O-CB 3.39Å; K1100-R1103 PolarHBondContact O-N 3.26Å; L1101-R1103 PolarHBondContact O-N 3.48Å; L1101-R1103 VanDerWaalsContact O-N 3.08Å; R1103-T1108 PolarHBondContact O-OG1 2.93Å
1104	Y	68.8	Low	67.6	Low	59 Å²	59	67.1 Å²	67.1	23%	0.231	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	5.6	179	-61.3	-91.9	0	0	0	112.8	L1101 S1102 L1114 Y1189	L1101-Y1104 WeakPolarHBondContact O-CD2 3.26Å; L1101-Y1104 PolarHBondContact O-N 2.83Å; L1101-Y1104 VanDerWaalsContact O-N 3.12Å; S1102-Y1104 PolarHBondContact O-N 3.31Å; S1102-Y1104 VanDerWaalsContact O-N 3.1Å; Y1104-L1114 HydrophobicContact CD1-CD1 4.45Å; Y1104-L1114 HydrophobicContact CE1-CD1 3.87Å; Y1104-Y1189 HydrophobicContact CD1-CD1 4.14Å; Y1104-Y1189 HydrophobicContact CD2-CD1 4.04Å; Y1104-Y1189 HydrophobicContact CD2-CE1 4.29Å; Y1104-Y1189 AromaticContact CE1-CD1 3.93Å; Y1104-Y1189 HydrophobicContact CE1-CD1 3.93Å; Y1104-Y1189 HydrophobicContact CE1-CE1 4.33Å; Y1104-Y1189 AromaticContact CE2-CD1 3.84Å; Y1104-Y1189 HydrophobicContact CE2-CD1 3.84Å; Y1104-Y1189 AromaticContact CE2-CE1 3.7Å; Y1104-Y1189 HydrophobicContact CE2-CE1 3.7Å; Y1104-Y1189 HydrophobicContact CG-CD1 4.2Å; Y1104-Y1189 AromaticContact CZ-CD1 3.78Å; Y1104-Y1189 AromaticContact CZ-CE1 3.73Å
1105	D	70.9	Confident	65.7	Low	22 Å²	22	71 Å²	71	12%	0.118	39%	0.388	C	S	.	.	S	Bend	trans	-64.8	139.7	176.8	-66.4	-19.4	0	0	0	111.1	S1102 G1107 T1108 R1181 Q1190	S1102-D1105 WeakPolarHBondContact O-CB 3.26Å; S1102-D1105 PolarHBondContact O-N 2.94Å; S1102-D1105 VanDerWaalsContact O-N 3.15Å; D1105-G1107 PolarHBondContact O-N 2.74Å; D1105-T1108 HydrophobicContact CB-CG2 4.4Å; D1105-T1108 PolarHBondContact O-N 2.64Å; D1105-T1108 PolarHBondContact O-OG1 3.15Å; D1105-R1181 VanDerWaalsContact CG-NE 3.31Å; D1105-R1181 IonicContact OD1-NE 3.08Å; D1105-R1181 PolarHBondContact OD1-NE 3.33Å; D1105-R1181 IonicContact OD2-CZ 3.06Å; D1105-R1181 VanDerWaalsContact OD2-CZ 3.26Å; D1105-R1181 IonicContact OD2-NE 2.7Å; D1105-R1181 PolarHBondContact OD2-NE 3.17Å; D1105-R1181 IonicContact OD2-NH2 3.3Å; D1105-R1181 PolarHBondContact OD2-NH2 2.7Å; D1105-Q1190 PolarHBondContact OD1-NE2 3.31Å
1106	E	60.2	Low	63.5	Low	123 Å²	123	74.4 Å²	74.4	58%	0.575	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	129.9	179	-69.5	-165.6	156.2	0	0	111.6
1107	G	58.6	Low	61.7	Low	82 Å²	82	76.3 Å²	76.3	85%	0.845	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.6	-1.8	-174.6	0	0	0	0	0	115.8	D1105	D1105-G1107 PolarHBondContact O-N 2.74Å
1108	T	56.6	Low	59.9	Low	50 Å²	50	80 Å²	80	31%	0.307	43%	0.43	S	S	.	.	S	Bend	trans	-90.1	144.3	173.5	57	0	0	0	0	112.4	R1103 D1105 F1110 S1111	R1103-T1108 PolarHBondContact O-OG1 2.93Å; D1105-T1108 HydrophobicContact CB-CG2 4.4Å; D1105-T1108 PolarHBondContact O-N 2.64Å; D1105-T1108 PolarHBondContact O-OG1 3.15Å; T1108-F1110 PolarHBondContact O-N 2.99Å; T1108-S1111 PolarHBondContact O-N 2.88Å; T1108-S1111 PolarHBondContact O-OG 2.91Å
1109	F	48.7	Very low	58	Low	186 Å²	186	89 Å²	89	82%	0.816	47%	0.469	S	S	*	.	H	α-helix	trans	-52.3	-23.6	-177.2	-110.3	-86.7	0	0	0	114.7
1110	F	48.9	Very low	56.1	Low	126 Å²	126	89.5 Å²	89.5	55%	0.553	48%	0.477	S	S	*	.	H	α-helix	trans	-87.4	-23.3	-178.4	-73.9	-79.9	0	0	0	114.1	T1108 S1112 I1113 L1114	T1108-F1110 PolarHBondContact O-N 2.99Å; F1110-S1112 VanDerWaalsContact C-N 3.26Å; F1110-S1112 PolarHBondContact O-N 3.22Å; F1110-I1113 PolarHBondContact O-N 3.14Å; F1110-L1114 HydrophobicContact CB-CD1 4.5Å; F1110-L1114 PolarHBondContact O-N 2.93Å
1111	S	47.4	Very low	54.5	Low	33 Å²	33	87.6 Å²	87.6	23%	0.231	48%	0.479	C	S	.	.	H	α-helix	trans	-65.9	-32.8	180	82.2	0	0	0	0	111.8	T1108 S1115	T1108-S1111 PolarHBondContact O-N 2.88Å; T1108-S1111 PolarHBondContact O-OG 2.91Å; S1111-S1115 WeakPolarHBondContact O-CB 3.23Å; S1111-S1115 PolarHBondContact O-N 3.34Å
1112	S	49.7	Very low	53	Low	82 Å²	82	91.9 Å²	91.9	57%	0.573	52%	0.515	S	S	*	.	H	α-helix	trans	-75.2	-34.5	180	-26.2	0	0	0	0	112.9	F1110	F1110-S1112 VanDerWaalsContact C-N 3.26Å; F1110-S1112 PolarHBondContact O-N 3.22Å
1113	I	50	Low	51.4	Low	96 Å²	96	98.6 Å²	98.6	49%	0.492	54%	0.54	S	S	.	.	H	α-helix	trans	-80.3	-37.7	-177	-64	174.3	0	0	0	111.3	F1110 F1116 T1117	F1110-I1113 PolarHBondContact O-N 3.14Å; I1113-F1116 PolarHBondContact O-N 3.16Å; I1113-T1117 PolarHBondContact O-N 3.05Å; I1113-T1117 PolarHBondContact O-OG1 3.07Å
1114	L	50	Low	50.1	Low	63 Å²	63	101.2 Å²	101.2	33%	0.33	55%	0.551	S	S	.	*	H	α-helix	trans	-74	-36	-179.9	-80.6	156.1	0	0	0	112.6	Y1104 F1110 F1116 V1118	Y1104-L1114 HydrophobicContact CD1-CD1 4.45Å; Y1104-L1114 HydrophobicContact CE1-CD1 3.87Å; F1110-L1114 HydrophobicContact CB-CD1 4.5Å; F1110-L1114 PolarHBondContact O-N 2.93Å; L1114-F1116 VanDerWaalsContact C-N 3.27Å; L1114-F1116 PolarHBondContact O-N 2.89Å; L1114-V1118 WeakPolarHBondContact O-CB 3.22Å; L1114-V1118 WeakPolarHBondContact O-CG2 3.39Å; L1114-V1118 PolarHBondContact O-N 3.33Å
1115	S	45.9	Very low	48.6	Very low	82 Å²	82	103.7 Å²	103.7	57%	0.573	57%	0.572	S	S	*	*	H	α-helix	trans	-63.8	-32.7	173.1	-172.9	0	0	0	0	112.4	S1111	S1111-S1115 WeakPolarHBondContact O-CB 3.23Å; S1111-S1115 PolarHBondContact O-N 3.34Å
1116	F	40.1	Very low	47.1	Very low	172 Å²	172	110.8 Å²	110.8	75%	0.754	61%	0.61	S	S	*	*	H	α-helix	trans	-81.7	-35.7	179.4	-153	-93.6	0	0	0	113.4	I1113 L1114	I1113-F1116 PolarHBondContact O-N 3.16Å; L1114-F1116 VanDerWaalsContact C-N 3.27Å; L1114-F1116 PolarHBondContact O-N 2.89Å
1117	T	46.5	Very low	45.9	Very low	70 Å²	70	108.9 Å²	108.9	43%	0.429	61%	0.607	S	S	.	*	H	α-helix	trans	-79.1	-27	-178.8	38.1	0	0	0	0	113.8	I1113 A1120 A1121	I1113-T1117 PolarHBondContact O-N 3.05Å; I1113-T1117 PolarHBondContact O-OG1 3.07Å; T1117-A1120 PolarHBondContact O-N 3.48Å; T1117-A1121 VanDerWaalsContact O-CB 3.29Å; T1117-A1121 WeakPolarHBondContact O-CB 3.41Å; T1117-A1121 PolarHBondContact O-N 3.16Å; T1117-A1121 VanDerWaalsContact O-N 3.08Å
1118	V	45.8	Very low	44.7	Very low	80 Å²	80	110.5 Å²	110.5	49%	0.485	60%	0.603	S	S	.	*	H	α-helix	trans	-71.4	-31.7	177.4	172.6	0	0	0	0	112.6	L1114 P1130	L1114-V1118 WeakPolarHBondContact O-CB 3.22Å; L1114-V1118 WeakPolarHBondContact O-CG2 3.39Å; L1114-V1118 PolarHBondContact O-N 3.33Å; V1118-P1130 HydrophobicContact CG2-CG 4.43Å
1119	K	42.9	Very low	43.7	Very low	191 Å²	191	117.1 Å²	117.1	83%	0.83	63%	0.627	S	S	*	*	H	α-helix	trans	-78.1	-25.3	175.5	-88.3	178.9	177.4	170	0	114
1120	A	43.1	Very low	43.7	Very low	78 Å²	78	113 Å²	113	65%	0.645	62%	0.618	S	S	*	*	H	α-helix	trans	-95.2	-29.3	-177.3	0	0	0	0	0	114.2	T1117	T1117-A1120 PolarHBondContact O-N 3.48Å
1121	A	44.8	Very low	43.8	Very low	55 Å²	55	108.4 Å²	108.4	46%	0.455	61%	0.607	S	S	.	*	H	α-helix	trans	-87.5	-10.5	-174.9	0	0	0	0	0	115.1	T1117 K1123	T1117-A1121 VanDerWaalsContact O-CB 3.29Å; T1117-A1121 WeakPolarHBondContact O-CB 3.41Å; T1117-A1121 PolarHBondContact O-N 3.16Å; T1117-A1121 VanDerWaalsContact O-N 3.08Å; A1121-K1123 PolarHBondContact O-N 2.98Å
1122	A	44.9	Very low	44.1	Very low	91 Å²	91	111.9 Å²	111.9	75%	0.752	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	10.2	-175.6	0	0	0	0	0	115.6
1123	K	43.8	Very low	44.9	Very low	172 Å²	172	113.9 Å²	113.9	75%	0.748	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	-10.6	-173.9	-131.2	177.9	-173.4	179.3	0	116.6	A1121	A1121-K1123 PolarHBondContact O-N 2.98Å
1124	Y	45.6	Very low	46	Very low	213 Å²	213	110.6 Å²	110.6	84%	0.835	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.1	0.8	-172.1	-77.9	-74.1	0	0	0	119.2
1125	V	35.4	Very low	47.3	Very low	111 Å²	111	107.7 Å²	107.7	67%	0.673	59%	0.593	S	S	*	*	S	Bend	trans	-147.4	139.8	170.8	-177.7	0	0	0	0	108.9	V1127	V1125-V1127 HydrophobicContact CB-CG2 4.08Å; V1125-V1127 HydrophobicContact CG1-CG2 4.18Å; V1125-V1127 PolarHBondContact O-N 3.47Å
1126	D	41.2	Very low	48.9	Very low	170 Å²	170	106.4 Å²	106.4	91%	0.909	58%	0.58	S	S	*	*			trans	-68.9	77.2	171.2	-138	-3.4	0	0	0	108.7
1127	V	33.6	Very low	50.9	Low	84 Å²	84	100.2 Å²	100.2	51%	0.509	56%	0.557	S	S	.	*			trans	-82.8	127.1	173.3	179.4	0	0	0	0	106.6	V1125 K1129	V1125-V1127 HydrophobicContact CB-CG2 4.08Å; V1125-V1127 HydrophobicContact CG1-CG2 4.18Å; V1125-V1127 PolarHBondContact O-N 3.47Å; V1127-K1129 PolarHBondContact O-N 3.36Å; V1127-K1129 VanDerWaalsContact O-N 3.13Å
1128	P	33.7	Very low	52.8	Low	116 Å²	116	97 Å²	97	75%	0.753	54%	0.536	S	S	*	.			trans	-53.5	125.4	176.9	-19.4	28.9	0	0	0	109	P1130	P1128-P1130 VanDerWaalsContact O-CD 3.32Å; P1128-P1130 WeakPolarHBondContact O-CD 3.31Å
1129	K	36.8	Very low	54.7	Low	189 Å²	189	93.4 Å²	93.4	82%	0.822	52%	0.515	S	S	*	.			trans	-45.1	117.4	179.3	-72.3	177.9	178.2	174.8	0	109.8	V1127 G1131	V1127-K1129 PolarHBondContact O-N 3.36Å; V1127-K1129 VanDerWaalsContact O-N 3.13Å; K1129-G1131 VanDerWaalsContact C-N 3.26Å; K1129-G1131 PolarHBondContact O-N 2.99Å
1130	P	47.2	Very low	56.7	Low	98 Å²	98	89 Å²	89	64%	0.636	50%	0.498	S	S	*	.	S	Bend	trans	-73.9	88	171	27.9	-28.4	0	0	0	107.5	V1118 P1128	V1118-P1130 HydrophobicContact CG2-CG 4.43Å; P1128-P1130 VanDerWaalsContact O-CD 3.32Å; P1128-P1130 WeakPolarHBondContact O-CD 3.31Å
1131	G	51.8	Low	59	Low	30 Å²	30	85.3 Å²	85.3	31%	0.309	47%	0.468	S	S	.	.	S	Bend	trans	165.5	67.4	-174	0	0	0	0	0	115	K1129	K1129-G1131 VanDerWaalsContact C-N 3.26Å; K1129-G1131 PolarHBondContact O-N 2.99Å
1132	M	53.4	Low	61	Low	106 Å²	106	82.7 Å²	82.7	52%	0.522	45%	0.446	S	S	.	.	S	Bend	trans	170.8	-14.9	149.5	-99	178.7	-78.5	0	0	114.8	L1134 D1136	M1132-L1134 PolarHBondContact O-N 3.34Å; M1132-D1136 VanDerWaalsContact O-OD2 3.12Å
1133	D	65.9	Low	63	Low	124 Å²	124	83.1 Å²	83.1	66%	0.663	43%	0.428	S	S	*	.	H	α-helix	trans	-69.3	-35.1	-166	-154.7	15.6	0	0	0	115.4	A1135 D1136 T1137	D1133-A1135 PolarHBondContact O-N 3Å; D1133-D1136 PolarHBondContact O-N 3.15Å; D1133-T1137 WeakPolarHBondContact O-CB 3.36Å; D1133-T1137 PolarHBondContact O-N 2.92Å; D1133-T1137 PolarHBondContact O-OG1 2.73Å
1134	L	73.9	Confident	65.1	Low	28 Å²	28	78.4 Å²	78.4	15%	0.147	41%	0.409	C	S	.	.	H	α-helix	trans	-68.3	-37.1	-175.4	-171.5	65.4	0	0	0	113.2	V1097 K1100 L1101 M1132 Y1138	V1097-L1134 HydrophobicContact CG1-CD1 4.3Å; V1097-L1134 HydrophobicContact CG1-CD2 4.05Å; V1097-L1134 HydrophobicContact CG1-CG 3.92Å; V1097-L1134 HydrophobicContact CG2-CD1 4.42Å; K1100-L1134 HydrophobicContact CB-CD2 4.21Å; K1100-L1134 HydrophobicContact CD-CD1 4.17Å; L1101-L1134 HydrophobicContact CD2-CD2 4.05Å; L1101-L1134 HydrophobicContact CG-CD2 3.97Å; M1132-L1134 PolarHBondContact O-N 3.34Å; L1134-Y1138 PolarHBondContact O-N 3.47Å
1135	A	76.4	Confident	67.2	Low	1 Å²	1	68.3 Å²	68.3	1%	0.008	37%	0.369	C	S	.	.	H	α-helix	trans	-66.8	-47.7	175.2	0	0	0	0	0	110.9	D1133 Y1138 I1139 T1193 K1196 I1197	D1133-A1135 PolarHBondContact O-N 3Å; A1135-Y1138 PolarHBondContact O-N 3.4Å; A1135-I1139 WeakPolarHBondContact O-CB 3.47Å; A1135-I1139 WeakPolarHBondContact O-CD1 3.21Å; A1135-I1139 VanDerWaalsContact O-CG1 3.23Å; A1135-I1139 WeakPolarHBondContact O-CG1 3.45Å; A1135-I1139 PolarHBondContact O-N 2.89Å; A1135-T1193 HydrophobicContact CB-CG2 4Å; A1135-K1196 HydrophobicContact CB-CB 4.26Å; A1135-K1196 HydrophobicContact CB-CD 3.86Å; A1135-K1196 HydrophobicContact CB-CG 4.21Å; A1135-I1197 HydrophobicContact CB-CG1 4.13Å
1136	D	80.1	Confident	69.7	Low	56 Å²	56	63.1 Å²	63.1	30%	0.299	34%	0.337	S	S	.	.	H	α-helix	trans	-65.9	-40	-177.9	-70.6	-42.6	0	0	0	111.4	M1132 D1133 Y1138 I1139 M1140 K1196	M1132-D1136 VanDerWaalsContact O-OD2 3.12Å; D1133-D1136 PolarHBondContact O-N 3.15Å; D1136-Y1138 VanDerWaalsContact C-N 3.34Å; D1136-Y1138 PolarHBondContact O-N 3.17Å; D1136-I1139 PolarHBondContact O-N 3.24Å; D1136-M1140 WeakPolarHBondContact O-CB 3.46Å; D1136-M1140 VanDerWaalsContact O-CG 3.28Å; D1136-M1140 WeakPolarHBondContact O-CG 3.42Å; D1136-M1140 PolarHBondContact O-N 3.36Å; D1136-K1196 WeakPolarHBondContact OD1-CE 3.28Å; D1136-K1196 IonicContact OD1-NZ 2.67Å; D1136-K1196 PolarHBondContact OD1-NZ 2.99Å; D1136-K1196 IonicContact OD2-NZ 2.67Å; D1136-K1196 PolarHBondContact OD2-NZ 3.45Å
1137	T	82.3	Confident	71.9	Confident	42 Å²	42	59.3 Å²	59.3	26%	0.258	32%	0.317	S	S	.	.	H	α-helix	trans	-63.1	-39.6	175.6	-51.7	0	0	0	0	111.8	T1031 D1133 F1141	T1031-T1137 HydrophobicContact CG2-CG2 4.39Å; T1031-T1137 WeakPolarHBondContact OG1-CG2 3.39Å; D1133-T1137 WeakPolarHBondContact O-CB 3.36Å; D1133-T1137 PolarHBondContact O-N 2.92Å; D1133-T1137 PolarHBondContact O-OG1 2.73Å; T1137-F1141 WeakPolarHBondContact O-CB 3.22Å; T1137-F1141 PolarHBondContact O-N 3.35Å
1138	Y	85.4	Confident	74.4	Confident	1 Å²	1	56.9 Å²	56.9	0%	0.004	30%	0.301	C	S	.	.	H	α-helix	trans	-71.2	-41.2	175.8	-179.2	-100.9	0	0	0	112.5	T1031 L1094 V1097 L1134 A1135 D1136 F1141 V1142 I1197	T1031-Y1138 HydrophobicContact CG2-CD2 4.45Å; L1094-Y1138 HydrophobicContact CB-CE2 3.77Å; L1094-Y1138 HydrophobicContact CD1-CD1 4.47Å; L1094-Y1138 HydrophobicContact CD1-CE1 3.87Å; L1094-Y1138 HydrophobicContact CD1-CE2 3.95Å; L1094-Y1138 HydrophobicContact CG-CE2 4.41Å; V1097-Y1138 HydrophobicContact CG2-CD2 3.92Å; V1097-Y1138 HydrophobicContact CG2-CG 4.38Å; L1134-Y1138 PolarHBondContact O-N 3.47Å; A1135-Y1138 PolarHBondContact O-N 3.4Å; D1136-Y1138 VanDerWaalsContact C-N 3.34Å; D1136-Y1138 PolarHBondContact O-N 3.17Å; Y1138-F1141 AromaticContact CD2-CD1 3.92Å; Y1138-F1141 HydrophobicContact CD2-CD1 3.92Å; Y1138-F1141 HydrophobicContact CD2-CE1 4.5Å; Y1138-F1141 AromaticContact CE2-CD1 3.83Å; Y1138-F1141 HydrophobicContact CE2-CD1 3.83Å; Y1138-F1141 HydrophobicContact CE2-CE1 4Å; Y1138-F1141 VanDerWaalsContact O-CB 3.31Å; Y1138-F1141 WeakPolarHBondContact O-CB 3.39Å; Y1138-F1141 PolarHBondContact O-N 2.92Å; Y1138-V1142 HydrophobicContact CD1-CG2 4.25Å; Y1138-V1142 HydrophobicContact CE1-CG2 3.71Å; Y1138-V1142 HydrophobicContact CE2-CG2 4.34Å; Y1138-V1142 WeakPolarHBondContact O-CG2 3.36Å; Y1138-V1142 PolarHBondContact O-N 2.82Å; Y1138-I1197 HydrophobicContact CD1-CD1 4.21Å; Y1138-I1197 HydrophobicContact CD1-CG1 4.15Å; Y1138-I1197 HydrophobicContact CD1-CG2 3.87Å; Y1138-I1197 HydrophobicContact CE1-CG2 3.85Å
1139	I	85.8	Confident	77	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-64.1	-42.5	176.4	-68.5	159.5	0	0	0	110.5	A1135 D1136 F1141 V1142 R1143 K1196 K1200	A1135-I1139 WeakPolarHBondContact O-CB 3.47Å; A1135-I1139 WeakPolarHBondContact O-CD1 3.21Å; A1135-I1139 VanDerWaalsContact O-CG1 3.23Å; A1135-I1139 WeakPolarHBondContact O-CG1 3.45Å; A1135-I1139 PolarHBondContact O-N 2.89Å; D1136-I1139 PolarHBondContact O-N 3.24Å; I1139-F1141 VanDerWaalsContact C-N 3.31Å; I1139-F1141 PolarHBondContact O-N 2.77Å; I1139-V1142 PolarHBondContact O-N 3.04Å; I1139-R1143 WeakPolarHBondContact O-CG 3.49Å; I1139-R1143 PolarHBondContact O-N 3.32Å; I1139-K1196 HydrophobicContact CD1-CG 4.07Å; I1139-K1200 HydrophobicContact CD1-CB 3.61Å; I1139-K1200 HydrophobicContact CD1-CG 3.84Å; I1139-K1200 HydrophobicContact CG1-CB 4.01Å; I1139-K1200 HydrophobicContact CG2-CB 4.3Å
1140	M	85.8	Confident	79.3	Confident	99 Å²	99	46.6 Å²	46.6	49%	0.488	24%	0.242	S	C	.	.	H	α-helix	trans	-62.2	-38.9	173.4	-75.7	-175.2	66.5	0	0	112.1	D1136 Q1144	D1136-M1140 WeakPolarHBondContact O-CB 3.46Å; D1136-M1140 VanDerWaalsContact O-CG 3.28Å; D1136-M1140 WeakPolarHBondContact O-CG 3.42Å; D1136-M1140 PolarHBondContact O-N 3.36Å; M1140-Q1144 VanDerWaalsContact O-CB 3.31Å; M1140-Q1144 WeakPolarHBondContact O-CB 3.22Å; M1140-Q1144 VanDerWaalsContact O-CG 3.26Å; M1140-Q1144 WeakPolarHBondContact O-CG 3.24Å; M1140-Q1144 PolarHBondContact O-N 3.48Å
1141	F	90.3	Very high	81.1	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.2	-47.1	172.8	158.3	-99.1	0	0	0	112.1	T1031 L1033 F1090 V1093 T1137 Y1138 I1139 N1145 W1166	T1031-F1141 WeakPolarHBondContact O-CB 3.34Å; L1033-F1141 HydrophobicContact CB-CD2 4.42Å; L1033-F1141 HydrophobicContact CB-CE2 3.88Å; L1033-F1141 HydrophobicContact CD2-CE2 4.17Å; L1033-F1141 HydrophobicContact CG-CE2 4.21Å; L1033-F1141 WeakPolarHBondContact O-CD2 3.46Å; L1033-F1141 WeakPolarHBondContact O-CE2 3.18Å; F1090-F1141 HydrophobicContact CB-CZ 4.46Å; F1090-F1141 HydrophobicContact CD1-CE2 4.36Å; F1090-F1141 AromaticContact CD1-CZ 3.69Å; F1090-F1141 HydrophobicContact CD1-CZ 3.69Å; F1090-F1141 HydrophobicContact CE1-CZ 4.24Å; F1090-F1141 HydrophobicContact CG-CZ 4.43Å; V1093-F1141 HydrophobicContact CB-CE1 4.07Å; V1093-F1141 HydrophobicContact CB-CZ 3.98Å; V1093-F1141 HydrophobicContact CG1-CD1 4.16Å; V1093-F1141 HydrophobicContact CG1-CE1 3.94Å; V1093-F1141 HydrophobicContact CG1-CE2 4.36Å; V1093-F1141 HydrophobicContact CG1-CG 4.46Å; V1093-F1141 HydrophobicContact CG1-CZ 4.04Å; V1093-F1141 HydrophobicContact CG2-CE2 4.27Å; V1093-F1141 HydrophobicContact CG2-CZ 3.92Å; T1137-F1141 WeakPolarHBondContact O-CB 3.22Å; T1137-F1141 PolarHBondContact O-N 3.35Å; Y1138-F1141 AromaticContact CD2-CD1 3.92Å; Y1138-F1141 HydrophobicContact CD2-CD1 3.92Å; Y1138-F1141 HydrophobicContact CD2-CE1 4.5Å; Y1138-F1141 AromaticContact CE2-CD1 3.83Å; Y1138-F1141 HydrophobicContact CE2-CD1 3.83Å; Y1138-F1141 HydrophobicContact CE2-CE1 4Å; Y1138-F1141 VanDerWaalsContact O-CB 3.31Å; Y1138-F1141 WeakPolarHBondContact O-CB 3.39Å; Y1138-F1141 PolarHBondContact O-N 2.92Å; I1139-F1141 VanDerWaalsContact C-N 3.31Å; I1139-F1141 PolarHBondContact O-N 2.77Å; F1141-N1145 WeakPolarHBondContact CD2-ND2 3.33Å; F1141-N1145 WeakPolarHBondContact CE2-ND2 3.33Å; F1141-N1145 PolarHBondContact O-N 3.21Å; F1141-N1145 PolarHBondContact O-ND2 2.86Å; F1141-W1166 HydrophobicContact CE1-CZ2 4.04Å; F1141-W1166 HydrophobicContact CZ-CZ2 4.45Å
1142	V	87.8	Confident	82.7	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-53.3	178.3	170.7	0	0	0	0	110.1	Y1138 I1139 Q1144 N1145 Q1146 W1166 F1205	Y1138-V1142 HydrophobicContact CD1-CG2 4.25Å; Y1138-V1142 HydrophobicContact CE1-CG2 3.71Å; Y1138-V1142 HydrophobicContact CE2-CG2 4.34Å; Y1138-V1142 WeakPolarHBondContact O-CG2 3.36Å; Y1138-V1142 PolarHBondContact O-N 2.82Å; I1139-V1142 PolarHBondContact O-N 3.04Å; V1142-Q1144 PolarHBondContact O-N 3.02Å; V1142-N1145 PolarHBondContact O-N 3.4Å; V1142-Q1146 HydrophobicContact CG1-CG 4.36Å; V1142-Q1146 WeakPolarHBondContact O-CB 3.48Å; V1142-Q1146 VanDerWaalsContact O-CG 3.29Å; V1142-Q1146 WeakPolarHBondContact O-CG 3.49Å; V1142-Q1146 PolarHBondContact O-N 3.34Å; V1142-W1166 HydrophobicContact CB-CH2 4.47Å; V1142-W1166 HydrophobicContact CB-CZ2 4.46Å; V1142-W1166 HydrophobicContact CG1-CH2 4.26Å; V1142-W1166 HydrophobicContact CG1-CZ2 4.39Å; V1142-W1166 HydrophobicContact CG2-CZ2 4.05Å; V1142-F1205 HydrophobicContact CG1-CD2 4.34Å; V1142-F1205 HydrophobicContact CG1-CE2 3.55Å; V1142-F1205 HydrophobicContact CG1-CZ 4.12Å
1143	R	87.9	Confident	84.1	Confident	100 Å²	100	47.1 Å²	47.1	38%	0.377	23%	0.226	S	C	.	.	H	α-helix	trans	-58.7	-50.8	-178.9	-70.1	173	-179.9	-164.6	-13.2	112.6	I1139 N1145 Q1146 D1147 D1204	I1139-R1143 WeakPolarHBondContact O-CG 3.49Å; I1139-R1143 PolarHBondContact O-N 3.32Å; R1143-N1145 VanDerWaalsContact C-N 3.3Å; R1143-N1145 PolarHBondContact O-N 3.18Å; R1143-Q1146 WeakPolarHBondContact O-CB 3.46Å; R1143-Q1146 PolarHBondContact O-N 3.21Å; R1143-Q1146 VanDerWaalsContact O-N 3.15Å; R1143-D1147 PolarHBondContact O-N 3.01Å; R1143-D1204 IonicContact CZ-OD1 2.76Å; R1143-D1204 IonicContact CZ-OD2 3.47Å; R1143-D1204 VanDerWaalsContact NE-CG 3.34Å; R1143-D1204 IonicContact NE-OD1 2.88Å; R1143-D1204 PolarHBondContact NE-OD1 2.77Å; R1143-D1204 IonicContact NE-OD2 3.33Å; R1143-D1204 PolarHBondContact NE-OD2 3.43Å; R1143-D1204 IonicContact NH2-OD1 3.26Å; R1143-D1204 PolarHBondContact NH2-OD1 3.45Å; R1143-D1204 IonicContact NH2-OD2 2.78Å; R1143-D1204 PolarHBondContact NH2-OD2 3.38Å
1144	Q	87.8	Confident	84.8	Confident	73 Å²	73	44.9 Å²	44.9	34%	0.341	22%	0.215	S	C	.	.	H	α-helix	trans	-65.3	-33.3	-176.3	-70.9	-177.2	0.7	0	0	112.6	M1140 V1142 I1148	M1140-Q1144 VanDerWaalsContact O-CB 3.31Å; M1140-Q1144 WeakPolarHBondContact O-CB 3.22Å; M1140-Q1144 VanDerWaalsContact O-CG 3.26Å; M1140-Q1144 WeakPolarHBondContact O-CG 3.24Å; M1140-Q1144 PolarHBondContact O-N 3.48Å; V1142-Q1144 PolarHBondContact O-N 3.02Å; Q1144-I1148 WeakPolarHBondContact O-CD1 3.37Å; Q1144-I1148 WeakPolarHBondContact O-CG1 3.44Å; Q1144-I1148 PolarHBondContact O-N 3.25Å; Q1144-I1148 VanDerWaalsContact O-N 3.16Å
1145	N	89.4	Confident	85.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-78.3	-32.6	174.8	-74.6	-81.4	0	0	0	112.5	L1033 R1034 I1035 F1090 F1141 V1142 R1143 L1149 W1166	L1033-N1145 PolarHBondContact O-ND2 2.83Å; R1034-N1145 WeakPolarHBondContact CA-OD1 3.44Å; I1035-N1145 PolarHBondContact N-OD1 3.49Å; F1090-N1145 HydrophobicContact CE1-CB 4.05Å; F1090-N1145 HydrophobicContact CZ-CB 3.97Å; F1141-N1145 WeakPolarHBondContact CD2-ND2 3.33Å; F1141-N1145 WeakPolarHBondContact CE2-ND2 3.33Å; F1141-N1145 PolarHBondContact O-N 3.21Å; F1141-N1145 PolarHBondContact O-ND2 2.86Å; V1142-N1145 PolarHBondContact O-N 3.4Å; R1143-N1145 VanDerWaalsContact C-N 3.3Å; R1143-N1145 PolarHBondContact O-N 3.18Å; N1145-L1149 WeakPolarHBondContact O-CB 3.43Å; N1145-L1149 WeakPolarHBondContact O-CD1 3.33Å; N1145-L1149 VanDerWaalsContact O-CG 3.25Å; N1145-L1149 WeakPolarHBondContact O-CG 3.26Å; N1145-L1149 PolarHBondContact O-N 2.85Å; N1145-W1166 HydrophobicContact CB-CH2 4.16Å
1146	Q	87.9	Confident	85.4	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.009	23%	0.234	C	C	.	.	H	α-helix	trans	-60.9	-46.2	170.4	-74.6	174.2	-34.4	0	0	111.1	V1142 R1143 L1149 R1150 F1163 W1166 F1205 Q1208	V1142-Q1146 HydrophobicContact CG1-CG 4.36Å; V1142-Q1146 WeakPolarHBondContact O-CB 3.48Å; V1142-Q1146 VanDerWaalsContact O-CG 3.29Å; V1142-Q1146 WeakPolarHBondContact O-CG 3.49Å; V1142-Q1146 PolarHBondContact O-N 3.34Å; R1143-Q1146 WeakPolarHBondContact O-CB 3.46Å; R1143-Q1146 PolarHBondContact O-N 3.21Å; R1143-Q1146 VanDerWaalsContact O-N 3.15Å; Q1146-L1149 PolarHBondContact O-N 3.17Å; Q1146-R1150 WeakPolarHBondContact O-CB 3.49Å; Q1146-R1150 PolarHBondContact O-N 3.15Å; Q1146-F1163 HydrophobicContact CB-CE1 4.28Å; Q1146-F1163 HydrophobicContact CB-CZ 3.86Å; Q1146-F1163 HydrophobicContact CG-CD1 4.44Å; Q1146-F1163 HydrophobicContact CG-CE1 3.82Å; Q1146-F1163 HydrophobicContact CG-CE2 4.45Å; Q1146-F1163 HydrophobicContact CG-CZ 3.83Å; Q1146-W1166 HydrophobicContact CG-CH2 4.36Å; Q1146-W1166 HydrophobicContact CG-CZ3 3.79Å; Q1146-F1205 VanDerWaalsContact NE2-CE1 3.3Å; Q1146-F1205 VanDerWaalsContact NE2-CZ 3.34Å; Q1146-Q1208 HydrophobicContact CB-CG 4.49Å
1147	D	86.9	Confident	85.6	Confident	90 Å²	90	51.4 Å²	51.4	48%	0.481	24%	0.244	S	C	.	.	H	α-helix	trans	-61.2	-47.3	178.5	-64.4	-23.6	0	0	0	111.2	R1143 L1149 R1150 E1151	R1143-D1147 PolarHBondContact O-N 3.01Å; D1147-L1149 VanDerWaalsContact C-N 3.35Å; D1147-L1149 PolarHBondContact O-N 3.3Å; D1147-R1150 PolarHBondContact O-N 2.97Å; D1147-E1151 VanDerWaalsContact O-CB 3.26Å; D1147-E1151 WeakPolarHBondContact O-CB 3.42Å; D1147-E1151 PolarHBondContact O-N 3.36Å
1148	I	87.1	Confident	85.7	Confident	33 Å²	33	49.9 Å²	49.9	17%	0.169	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-41.7	177.8	-69.8	165.3	0	0	0	111.8	R1034 Q1144 K1152	R1034-I1148 HydrophobicContact CB-CD1 4.29Å; Q1144-I1148 WeakPolarHBondContact O-CD1 3.37Å; Q1144-I1148 WeakPolarHBondContact O-CG1 3.44Å; Q1144-I1148 PolarHBondContact O-N 3.25Å; Q1144-I1148 VanDerWaalsContact O-N 3.16Å; I1148-K1152 HydrophobicContact CG2-CD 4.25Å; I1148-K1152 VanDerWaalsContact O-CB 3.32Å; I1148-K1152 WeakPolarHBondContact O-CB 3.31Å; I1148-K1152 WeakPolarHBondContact O-CG 3.48Å; I1148-K1152 PolarHBondContact O-N 2.95Å; I1148-K1152 VanDerWaalsContact O-N 3.1Å
1149	L	87.3	Confident	85.7	Confident	5 Å²	5	50 Å²	50	3%	0.026	23%	0.234	C	C	.	.	H	α-helix	trans	-67.5	-42.3	179.5	-76.8	166.3	0	0	0	111.3	I1035 F1090 N1145 Q1146 D1147 V1153 L1162 F1163	I1035-L1149 HydrophobicContact CD1-CD1 3.97Å; I1035-L1149 HydrophobicContact CD1-CD2 3.77Å; I1035-L1149 HydrophobicContact CD1-CG 3.96Å; F1090-L1149 HydrophobicContact CE2-CD1 3.92Å; F1090-L1149 HydrophobicContact CZ-CD1 3.89Å; N1145-L1149 WeakPolarHBondContact O-CB 3.43Å; N1145-L1149 WeakPolarHBondContact O-CD1 3.33Å; N1145-L1149 VanDerWaalsContact O-CG 3.25Å; N1145-L1149 WeakPolarHBondContact O-CG 3.26Å; N1145-L1149 PolarHBondContact O-N 2.85Å; Q1146-L1149 PolarHBondContact O-N 3.17Å; D1147-L1149 VanDerWaalsContact C-N 3.35Å; D1147-L1149 PolarHBondContact O-N 3.3Å; L1149-V1153 HydrophobicContact CD2-CG2 4.27Å; L1149-V1153 VanDerWaalsContact O-CB 3.22Å; L1149-V1153 WeakPolarHBondContact O-CB 3.45Å; L1149-V1153 WeakPolarHBondContact O-CG2 3.34Å; L1149-V1153 PolarHBondContact O-N 3.01Å; L1149-L1162 HydrophobicContact CD1-CD2 3.62Å; L1149-L1162 HydrophobicContact CD2-CD2 4.04Å; L1149-L1162 HydrophobicContact CG-CD2 4.36Å; L1149-F1163 HydrophobicContact CB-CE1 4.39Å; L1149-F1163 HydrophobicContact CB-CZ 4.35Å; L1149-F1163 HydrophobicContact CD1-CE1 3.98Å
1150	R	85.9	Confident	85.7	Confident	85 Å²	85	53.5 Å²	53.5	32%	0.321	25%	0.25	S	S	.	.	H	α-helix	trans	-71.6	-33.7	179.2	-174.7	174.5	-89.3	-78.3	-0.5	112.9	Q1146 D1147 E1156 Q1208	Q1146-R1150 WeakPolarHBondContact O-CB 3.49Å; Q1146-R1150 PolarHBondContact O-N 3.15Å; D1147-R1150 PolarHBondContact O-N 2.97Å; R1150-E1156 IonicContact CZ-OE1 3.46Å; R1150-E1156 IonicContact CZ-OE2 2.74Å; R1150-E1156 VanDerWaalsContact NH1-CD 3.33Å; R1150-E1156 IonicContact NH1-OE1 2.75Å; R1150-E1156 PolarHBondContact NH1-OE1 2.96Å; R1150-E1156 IonicContact NH1-OE2 2.64Å; R1150-E1156 PolarHBondContact NH1-OE2 2.9Å; R1150-E1156 IonicContact NH2-OE1 3.31Å; R1150-E1156 PolarHBondContact NH2-OE1 2.92Å; R1150-Q1208 PolarHBondContact NH2-O 3.48Å
1151	E	84.6	Confident	85.7	Confident	152 Å²	152	53.3 Å²	53.3	71%	0.71	25%	0.246	S	C	*	.	H	α-helix	trans	-72.8	-35.5	176.5	-174.1	-171.8	-172.5	0	0	112.2	D1147	D1147-E1151 VanDerWaalsContact O-CB 3.26Å; D1147-E1151 WeakPolarHBondContact O-CB 3.42Å; D1147-E1151 PolarHBondContact O-N 3.36Å
1152	K	84.2	Confident	85.6	Confident	80 Å²	80	53.5 Å²	53.5	35%	0.348	25%	0.247	S	C	.	.	H	α-helix	trans	-110.2	-10.6	-167.2	-60.2	-171.4	-178.9	-178.9	0	115.6	A1037 C1040 N1044 I1148	A1037-K1152 HydrophobicContact CB-CD 4.16Å; C1040-K1152 HydrophobicContact CB-CB 3.77Å; N1044-K1152 PolarHBondContact ND2-O 2.9Å; I1148-K1152 HydrophobicContact CG2-CD 4.25Å; I1148-K1152 VanDerWaalsContact O-CB 3.32Å; I1148-K1152 WeakPolarHBondContact O-CB 3.31Å; I1148-K1152 WeakPolarHBondContact O-CG 3.48Å; I1148-K1152 PolarHBondContact O-N 2.95Å; I1148-K1152 VanDerWaalsContact O-N 3.1Å
1153	V	84.7	Confident	85.8	Confident	12 Å²	12	53.5 Å²	53.5	7%	0.073	25%	0.247	C	C	.	.			trans	-98.7	129.8	175.8	176.1	0	0	0	0	109.7	C1040 F1043 N1044 L1149 E1155 I1159	C1040-V1153 HydrophobicContact CB-CG2 4.29Å; F1043-V1153 HydrophobicContact CD1-CG1 3.68Å; F1043-V1153 HydrophobicContact CD1-CG2 4.3Å; F1043-V1153 HydrophobicContact CE1-CG1 3.79Å; N1044-V1153 VanDerWaalsContact OD1-CA 3.3Å; N1044-V1153 WeakPolarHBondContact OD1-CA 3.48Å; L1149-V1153 HydrophobicContact CD2-CG2 4.27Å; L1149-V1153 VanDerWaalsContact O-CB 3.22Å; L1149-V1153 WeakPolarHBondContact O-CB 3.45Å; L1149-V1153 WeakPolarHBondContact O-CG2 3.34Å; L1149-V1153 PolarHBondContact O-N 3.01Å; V1153-E1155 PolarHBondContact O-N 2.7Å; V1153-I1159 HydrophobicContact CB-CD1 3.98Å; V1153-I1159 HydrophobicContact CB-CG1 4Å; V1153-I1159 HydrophobicContact CG1-CD1 4.18Å; V1153-I1159 HydrophobicContact CG1-CG1 3.92Å
1154	N	79.8	Confident	85.8	Confident	78 Å²	78	50.3 Å²	50.3	42%	0.417	24%	0.238	S	C	.	.	S	Bend	trans	-79	-19.9	-167.5	-68	-11.6	0	0	0	114.4	N1044	N1044-N1154 PolarHBondContact OD1-N 2.95Å
1155	E	81.1	Confident	85.8	Confident	39 Å²	39	50.2 Å²	50.2	18%	0.182	24%	0.237	C	C	.	.			trans	-117.4	117.1	-176	-84.4	-162.4	-156	0	0	113.8	V1047 K1051 V1153 M1157 Y1158 I1159	V1047-E1155 HydrophobicContact CG1-CB 3.89Å; V1047-E1155 HydrophobicContact CG1-CG 3.46Å; V1047-E1155 VanDerWaalsContact CG1-CG 3.46Å; V1047-E1155 WeakPolarHBondContact CG1-OE1 3.29Å; K1051-E1155 WeakPolarHBondContact CE-OE1 3.46Å; K1051-E1155 IonicContact NZ-OE1 3.08Å; K1051-E1155 PolarHBondContact NZ-OE1 3.04Å; V1153-E1155 PolarHBondContact O-N 2.7Å; E1155-M1157 PolarHBondContact O-N 3.01Å; E1155-Y1158 HydrophobicContact CB-CD2 3.8Å; E1155-Y1158 HydrophobicContact CB-CE2 4.47Å; E1155-Y1158 PolarHBondContact O-N 3.27Å; E1155-Y1158 VanDerWaalsContact OE2-CD2 3.3Å; E1155-Y1158 WeakPolarHBondContact OE2-CD2 3.35Å; E1155-Y1158 WeakPolarHBondContact OE2-CE2 3.22Å; E1155-I1159 PolarHBondContact O-N 2.92Å
1156	E	81.6	Confident	85.9	Confident	79 Å²	79	50.2 Å²	50.2	37%	0.369	24%	0.237	S	C	.	.	H	α-helix	trans	-60	-40.8	-178.5	-167.2	68.7	-169.2	0	0	113	R1150 Y1158 I1159 E1160	R1150-E1156 IonicContact CZ-OE1 3.46Å; R1150-E1156 IonicContact CZ-OE2 2.74Å; R1150-E1156 VanDerWaalsContact NH1-CD 3.33Å; R1150-E1156 IonicContact NH1-OE1 2.75Å; R1150-E1156 PolarHBondContact NH1-OE1 2.96Å; R1150-E1156 IonicContact NH1-OE2 2.64Å; R1150-E1156 PolarHBondContact NH1-OE2 2.9Å; R1150-E1156 IonicContact NH2-OE1 3.31Å; R1150-E1156 PolarHBondContact NH2-OE1 2.92Å; E1156-Y1158 VanDerWaalsContact C-N 3.25Å; E1156-Y1158 PolarHBondContact O-N 3.34Å; E1156-I1159 WeakPolarHBondContact O-CB 3.16Å; E1156-I1159 PolarHBondContact O-N 3.1Å; E1156-E1160 WeakPolarHBondContact O-CG 3.4Å; E1156-E1160 PolarHBondContact O-N 2.73Å
1157	M	85.1	Confident	86	Confident	104 Å²	104	50.1 Å²	50.1	51%	0.512	24%	0.237	S	C	.	.	H	α-helix	trans	-58.5	-36.3	-178.3	-168	-149.3	-164	0	0	112.7	E1155 K1161	E1155-M1157 PolarHBondContact O-N 3.01Å; M1157-K1161 VanDerWaalsContact CE-NZ 3.33Å; M1157-K1161 WeakPolarHBondContact O-CG 3.43Å; M1157-K1161 PolarHBondContact O-N 2.88Å
1158	Y	84.3	Confident	86.1	Confident	9 Å²	9	48.1 Å²	48.1	4%	0.035	23%	0.23	C	C	.	.	H	α-helix	trans	-79.5	-30	178.5	-69	-66.5	0	0	0	112.4	F1043 V1047 K1050 V1079 I1083 E1155 E1156 L1162	F1043-Y1158 HydrophobicContact CE1-CG 4.33Å; F1043-Y1158 HydrophobicContact CZ-CG 4.4Å; V1047-Y1158 HydrophobicContact CG1-CD2 4.3Å; V1047-Y1158 HydrophobicContact CG1-CE2 4.15Å; V1047-Y1158 HydrophobicContact CG2-CD2 3.77Å; V1047-Y1158 HydrophobicContact CG2-CE2 3.94Å; K1050-Y1158 WeakPolarHBondContact CD-OH 3.17Å; K1050-Y1158 PolarHBondContact NZ-OH 2.97Å; V1079-Y1158 HydrophobicContact CG1-CD1 3.61Å; V1079-Y1158 HydrophobicContact CG1-CE1 3.62Å; V1079-Y1158 HydrophobicContact CG1-CG 4.38Å; I1083-Y1158 HydrophobicContact CD1-CD1 4.33Å; E1155-Y1158 HydrophobicContact CB-CD2 3.8Å; E1155-Y1158 HydrophobicContact CB-CE2 4.47Å; E1155-Y1158 PolarHBondContact O-N 3.27Å; E1155-Y1158 VanDerWaalsContact OE2-CD2 3.3Å; E1155-Y1158 WeakPolarHBondContact OE2-CD2 3.35Å; E1155-Y1158 WeakPolarHBondContact OE2-CE2 3.22Å; E1156-Y1158 VanDerWaalsContact C-N 3.25Å; E1156-Y1158 PolarHBondContact O-N 3.34Å; Y1158-L1162 VanDerWaalsContact O-CB 3.27Å; Y1158-L1162 WeakPolarHBondContact O-CB 3.47Å; Y1158-L1162 PolarHBondContact O-N 2.86Å
1159	I	85.3	Confident	86.2	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.015	23%	0.234	C	C	.	.	H	α-helix	trans	-64.3	-46.9	171.9	-66.2	163.5	0	0	0	109.8	V1153 E1155 E1156 K1161 L1162 F1163	V1153-I1159 HydrophobicContact CB-CD1 3.98Å; V1153-I1159 HydrophobicContact CB-CG1 4Å; V1153-I1159 HydrophobicContact CG1-CD1 4.18Å; V1153-I1159 HydrophobicContact CG1-CG1 3.92Å; E1155-I1159 PolarHBondContact O-N 2.92Å; E1156-I1159 WeakPolarHBondContact O-CB 3.16Å; E1156-I1159 PolarHBondContact O-N 3.1Å; I1159-K1161 PolarHBondContact O-N 3.42Å; I1159-L1162 WeakPolarHBondContact O-CB 3.29Å; I1159-L1162 PolarHBondContact O-N 3.33Å; I1159-F1163 HydrophobicContact CG2-CD2 3.7Å; I1159-F1163 HydrophobicContact CG2-CE1 4.34Å; I1159-F1163 HydrophobicContact CG2-CE2 3.31Å; I1159-F1163 HydrophobicContact CG2-CG 4.37Å; I1159-F1163 HydrophobicContact CG2-CZ 3.68Å; I1159-F1163 WeakPolarHBondContact O-CB 3.48Å; I1159-F1163 WeakPolarHBondContact O-CG 3.43Å; I1159-F1163 PolarHBondContact O-N 3.03Å
1160	E	85.4	Confident	86.2	Confident	81 Å²	81	48 Å²	48	38%	0.379	23%	0.233	S	C	.	.	H	α-helix	trans	-57.4	-49.8	176.4	-71.2	176.6	172.7	0	0	111.3	E1156 L1162 F1163 D1164	E1156-E1160 WeakPolarHBondContact O-CG 3.4Å; E1156-E1160 PolarHBondContact O-N 2.73Å; E1160-L1162 VanDerWaalsContact C-N 3.33Å; E1160-L1162 PolarHBondContact O-N 3.27Å; E1160-F1163 PolarHBondContact O-N 2.87Å; E1160-D1164 WeakPolarHBondContact O-CB 3.39Å; E1160-D1164 PolarHBondContact O-N 3.46Å
1161	K	86.2	Confident	86.4	Confident	94 Å²	94	44 Å²	44	41%	0.409	22%	0.217	S	C	.	.	H	α-helix	trans	-59.3	-41.2	176.2	-75.1	174.3	179.9	169.6	0	112.9	M1157 I1159 Q1165	M1157-K1161 VanDerWaalsContact CE-NZ 3.33Å; M1157-K1161 WeakPolarHBondContact O-CG 3.43Å; M1157-K1161 PolarHBondContact O-N 2.88Å; I1159-K1161 PolarHBondContact O-N 3.42Å; K1161-Q1165 WeakPolarHBondContact O-CB 3.46Å; K1161-Q1165 PolarHBondContact O-N 3.44Å; K1161-Q1165 VanDerWaalsContact O-N 3.07Å
1162	L	88.4	Confident	86.6	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-44.9	177.6	177.6	72.6	0	0	0	111.1	I1083 L1086 V1087 L1149 Y1158 I1159 E1160 Q1165 W1166	I1083-L1162 HydrophobicContact CB-CD1 4.21Å; I1083-L1162 HydrophobicContact CG1-CD1 4.29Å; I1083-L1162 HydrophobicContact CG2-CB 4.31Å; I1083-L1162 HydrophobicContact CG2-CD1 3.74Å; L1086-L1162 HydrophobicContact CB-CD1 4.06Å; L1086-L1162 HydrophobicContact CD1-CD1 4.33Å; V1087-L1162 HydrophobicContact CG2-CD1 3.85Å; L1149-L1162 HydrophobicContact CD1-CD2 3.62Å; L1149-L1162 HydrophobicContact CD2-CD2 4.04Å; L1149-L1162 HydrophobicContact CG-CD2 4.36Å; Y1158-L1162 VanDerWaalsContact O-CB 3.27Å; Y1158-L1162 WeakPolarHBondContact O-CB 3.47Å; Y1158-L1162 PolarHBondContact O-N 2.86Å; I1159-L1162 WeakPolarHBondContact O-CB 3.29Å; I1159-L1162 PolarHBondContact O-N 3.33Å; E1160-L1162 VanDerWaalsContact C-N 3.33Å; E1160-L1162 PolarHBondContact O-N 3.27Å; L1162-Q1165 PolarHBondContact O-N 2.89Å; L1162-W1166 VanDerWaalsContact O-CB 3.23Å; L1162-W1166 WeakPolarHBondContact O-CB 3.46Å; L1162-W1166 PolarHBondContact O-N 3.42Å
1163	F	90.7	Very high	86.9	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-69.7	-39.8	179.2	-69.9	-13.4	0	0	0	112.7	Q1146 L1149 I1159 E1160 Q1165 W1166 Y1167 F1205 Q1208 V1210	Q1146-F1163 HydrophobicContact CB-CE1 4.28Å; Q1146-F1163 HydrophobicContact CB-CZ 3.86Å; Q1146-F1163 HydrophobicContact CG-CD1 4.44Å; Q1146-F1163 HydrophobicContact CG-CE1 3.82Å; Q1146-F1163 HydrophobicContact CG-CE2 4.45Å; Q1146-F1163 HydrophobicContact CG-CZ 3.83Å; L1149-F1163 HydrophobicContact CB-CE1 4.39Å; L1149-F1163 HydrophobicContact CB-CZ 4.35Å; L1149-F1163 HydrophobicContact CD1-CE1 3.98Å; I1159-F1163 HydrophobicContact CG2-CD2 3.7Å; I1159-F1163 HydrophobicContact CG2-CE1 4.34Å; I1159-F1163 HydrophobicContact CG2-CE2 3.31Å; I1159-F1163 HydrophobicContact CG2-CG 4.37Å; I1159-F1163 HydrophobicContact CG2-CZ 3.68Å; I1159-F1163 WeakPolarHBondContact O-CB 3.48Å; I1159-F1163 WeakPolarHBondContact O-CG 3.43Å; I1159-F1163 PolarHBondContact O-N 3.03Å; E1160-F1163 PolarHBondContact O-N 2.87Å; F1163-Q1165 PolarHBondContact O-N 3.26Å; F1163-W1166 HydrophobicContact CD1-CE3 4.06Å; F1163-W1166 HydrophobicContact CE1-CE3 4.3Å; F1163-W1166 HydrophobicContact CE1-CZ3 4.32Å; F1163-W1166 PolarHBondContact O-N 3.46Å; F1163-Y1167 VanDerWaalsContact O-CB 3.31Å; F1163-Y1167 WeakPolarHBondContact O-CB 3.49Å; F1163-Y1167 PolarHBondContact O-N 3.49Å; F1163-F1205 HydrophobicContact CB-CD1 4.03Å; F1163-F1205 HydrophobicContact CB-CE1 4.05Å; F1163-F1205 HydrophobicContact CD1-CE1 4.36Å; F1163-F1205 HydrophobicContact CG-CE1 4.35Å; F1163-F1205 WeakPolarHBondContact O-CE1 3.38Å; F1163-Q1208 HydrophobicContact CD2-CB 3.85Å; F1163-Q1208 HydrophobicContact CE2-CB 3.95Å; F1163-Q1208 HydrophobicContact CE2-CG 4.36Å; F1163-V1210 HydrophobicContact CB-CG2 3.79Å
1164	D	87.6	Confident	86.9	Confident	33 Å²	33	40.2 Å²	40.2	18%	0.176	20%	0.2	C	C	.	.	H	α-helix	trans	-56.9	-48.7	172.6	-85	-0.7	0	0	0	111.4	E1160 S1168 V1210 T1214	E1160-D1164 WeakPolarHBondContact O-CB 3.39Å; E1160-D1164 PolarHBondContact O-N 3.46Å; D1164-S1168 VanDerWaalsContact O-CB 3.3Å; D1164-S1168 WeakPolarHBondContact O-CB 3.31Å; D1164-S1168 PolarHBondContact O-N 3.15Å; D1164-S1168 PolarHBondContact O-OG 3.16Å; D1164-V1210 WeakPolarHBondContact OD1-CA 3.26Å; D1164-V1210 WeakPolarHBondContact OD1-CG1 3.37Å; D1164-T1214 HydrophobicContact CB-CG2 4.36Å
1165	Q	88.8	Confident	87.2	Confident	71 Å²	71	37.4 Å²	37.4	33%	0.332	19%	0.187	S	C	.	.	H	α-helix	trans	-70.5	-37.5	-179.8	-170	177	-16.7	0	0	111.9	V1087 K1161 L1162 F1163 S1169	V1087-Q1165 HydrophobicContact CG1-CG 4.27Å; V1087-Q1165 HydrophobicContact CG2-CB 4.14Å; V1087-Q1165 HydrophobicContact CG2-CG 4.13Å; K1161-Q1165 WeakPolarHBondContact O-CB 3.46Å; K1161-Q1165 PolarHBondContact O-N 3.44Å; K1161-Q1165 VanDerWaalsContact O-N 3.07Å; L1162-Q1165 PolarHBondContact O-N 2.89Å; F1163-Q1165 PolarHBondContact O-N 3.26Å; Q1165-S1169 VanDerWaalsContact O-CB 3.26Å; Q1165-S1169 WeakPolarHBondContact O-CB 3.43Å; Q1165-S1169 PolarHBondContact O-N 2.92Å; Q1165-S1169 PolarHBondContact O-OG 2.99Å
1166	W	91	Very high	87.6	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.3	-48.1	176.3	-174.8	8.6	0	0	0	111.5	V1087 F1090 F1141 V1142 N1145 Q1146 L1162 F1163 S1169 S1170 F1205	V1087-W1166 HydrophobicContact CG1-CB 4.49Å; V1087-W1166 HydrophobicContact CG2-CB 4.06Å; F1090-W1166 HydrophobicContact CB-CD2 4.21Å; F1090-W1166 HydrophobicContact CB-CG 4.44Å; F1090-W1166 HydrophobicContact CB-CZ2 3.88Å; F1090-W1166 HydrophobicContact CD1-CZ2 4.29Å; F1090-W1166 AromaticContact CD2-CD2 3.48Å; F1090-W1166 HydrophobicContact CD2-CD2 3.48Å; F1090-W1166 VanDerWaalsContact CD2-CD2 3.48Å; F1090-W1166 AromaticContact CD2-CE2 3.57Å; F1090-W1166 AromaticContact CD2-CE3 3.65Å; F1090-W1166 HydrophobicContact CD2-CE3 3.65Å; F1090-W1166 HydrophobicContact CD2-CG 4.04Å; F1090-W1166 AromaticContact CD2-CH2 3.99Å; F1090-W1166 HydrophobicContact CD2-CH2 3.99Å; F1090-W1166 AromaticContact CD2-CZ2 3.84Å; F1090-W1166 HydrophobicContact CD2-CZ2 3.84Å; F1090-W1166 AromaticContact CD2-CZ3 3.9Å; F1090-W1166 HydrophobicContact CD2-CZ3 3.9Å; F1090-W1166 HydrophobicContact CE1-CH2 4.42Å; F1090-W1166 AromaticContact CE2-CD2 3.99Å; F1090-W1166 HydrophobicContact CE2-CD2 3.99Å; F1090-W1166 AromaticContact CE2-CE3 3.64Å; F1090-W1166 HydrophobicContact CE2-CE3 3.64Å; F1090-W1166 AromaticContact CE2-CH2 3.91Å; F1090-W1166 HydrophobicContact CE2-CH2 3.91Å; F1090-W1166 HydrophobicContact CE2-CZ2 4.25Å; F1090-W1166 AromaticContact CE2-CZ3 3.59Å; F1090-W1166 HydrophobicContact CE2-CZ3 3.59Å; F1090-W1166 HydrophobicContact CG-CD2 4.16Å; F1090-W1166 AromaticContact CG-CE2 3.75Å; F1090-W1166 HydrophobicContact CG-CH2 4.24Å; F1090-W1166 AromaticContact CG-CZ2 3.8Å; F1090-W1166 HydrophobicContact CG-CZ2 3.8Å; F1090-W1166 HydrophobicContact CZ-CH2 4.06Å; F1090-W1166 HydrophobicContact CZ-CZ3 4.03Å; F1141-W1166 HydrophobicContact CE1-CZ2 4.04Å; F1141-W1166 HydrophobicContact CZ-CZ2 4.45Å; V1142-W1166 HydrophobicContact CB-CH2 4.47Å; V1142-W1166 HydrophobicContact CB-CZ2 4.46Å; V1142-W1166 HydrophobicContact CG1-CH2 4.26Å; V1142-W1166 HydrophobicContact CG1-CZ2 4.39Å; V1142-W1166 HydrophobicContact CG2-CZ2 4.05Å; N1145-W1166 HydrophobicContact CB-CH2 4.16Å; Q1146-W1166 HydrophobicContact CG-CH2 4.36Å; Q1146-W1166 HydrophobicContact CG-CZ3 3.79Å; L1162-W1166 VanDerWaalsContact O-CB 3.23Å; L1162-W1166 WeakPolarHBondContact O-CB 3.46Å; L1162-W1166 PolarHBondContact O-N 3.42Å; F1163-W1166 HydrophobicContact CD1-CE3 4.06Å; F1163-W1166 HydrophobicContact CE1-CE3 4.3Å; F1163-W1166 HydrophobicContact CE1-CZ3 4.32Å; F1163-W1166 PolarHBondContact O-N 3.46Å; W1166-S1169 PolarHBondContact O-N 3.27Å; W1166-S1170 VanDerWaalsContact CD1-OG 3.3Å; W1166-S1170 VanDerWaalsContact O-CB 3.31Å; W1166-S1170 WeakPolarHBondContact O-CB 3.36Å; W1166-S1170 PolarHBondContact O-N 2.62Å; W1166-S1170 PolarHBondContact O-OG 3.41Å; W1166-F1205 HydrophobicContact CB-CE1 4.16Å; W1166-F1205 HydrophobicContact CB-CZ 4.3Å; W1166-F1205 HydrophobicContact CD2-CE1 4.08Å; W1166-F1205 AromaticContact CD2-CZ 3.57Å; W1166-F1205 HydrophobicContact CD2-CZ 3.57Å; W1166-F1205 AromaticContact CE2-CZ 3.99Å; W1166-F1205 AromaticContact CE3-CE1 3.97Å; W1166-F1205 HydrophobicContact CE3-CE1 3.97Å; W1166-F1205 AromaticContact CE3-CZ 3.71Å; W1166-F1205 HydrophobicContact CE3-CZ 3.71Å; W1166-F1205 HydrophobicContact CG-CE1 4.21Å; W1166-F1205 AromaticContact CG-CZ 3.87Å; W1166-F1205 HydrophobicContact CG-CZ 3.87Å; W1166-F1205 HydrophobicContact CZ2-CZ 4.5Å; W1166-F1205 HydrophobicContact CZ3-CZ 4.24Å
1167	Y	89.8	Confident	87.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60.6	-51.2	177.5	178.7	-95.1	0	0	0	111.4	F1163 S1169 S1170 M1171 T1201 Y1202 F1205 T1214 L1215 Y1220	F1163-Y1167 VanDerWaalsContact O-CB 3.31Å; F1163-Y1167 WeakPolarHBondContact O-CB 3.49Å; F1163-Y1167 PolarHBondContact O-N 3.49Å; Y1167-S1169 VanDerWaalsContact C-N 3.32Å; Y1167-S1169 PolarHBondContact O-N 3.05Å; Y1167-S1170 WeakPolarHBondContact O-CB 3.23Å; Y1167-S1170 PolarHBondContact O-N 3.26Å; Y1167-S1170 VanDerWaalsContact O-N 3.17Å; Y1167-M1171 HydrophobicContact CD1-CG 4.27Å; Y1167-M1171 HydrophobicContact CD2-CE 4.28Å; Y1167-M1171 HydrophobicContact CD2-CG 4.45Å; Y1167-M1171 HydrophobicContact CE1-CG 3.72Å; Y1167-M1171 HydrophobicContact CE2-CE 3.7Å; Y1167-M1171 HydrophobicContact CE2-CG 3.96Å; Y1167-M1171 HydrophobicContact CE2-SD 4.37Å; Y1167-M1171 WeakPolarHBondContact O-CG 3.41Å; Y1167-M1171 PolarHBondContact O-N 3.47Å; Y1167-T1201 HydrophobicContact CD2-CG2 4.24Å; Y1167-T1201 HydrophobicContact CE2-CG2 4.39Å; Y1167-Y1202 WeakPolarHBondContact OH-CD2 3.46Å; Y1167-F1205 HydrophobicContact CD2-CB 3.81Å; Y1167-F1205 HydrophobicContact CD2-CD1 4.43Å; Y1167-F1205 AromaticContact CD2-CD2 3.9Å; Y1167-F1205 HydrophobicContact CD2-CD2 3.9Å; Y1167-F1205 AromaticContact CD2-CG 3.79Å; Y1167-F1205 HydrophobicContact CD2-CG 3.79Å; Y1167-F1205 HydrophobicContact CE2-CB 4.49Å; Y1167-F1205 HydrophobicContact CG-CB 4.38Å; Y1167-F1205 HydrophobicContact CG-CG 4.31Å; Y1167-T1214 HydrophobicContact CD1-CG2 4.33Å; Y1167-T1214 WeakPolarHBondContact CE1-O 3.49Å; Y1167-L1215 HydrophobicContact CD1-CD2 4.29Å; Y1167-L1215 HydrophobicContact CD2-CD2 4.23Å; Y1167-L1215 HydrophobicContact CE1-CD2 4.01Å; Y1167-L1215 HydrophobicContact CE2-CD2 3.92Å; Y1167-L1215 HydrophobicContact CG-CD2 4.4Å; Y1167-L1215 PolarHBondContact OH-O 2.99Å; Y1167-Y1220 VanDerWaalsContact OH-CD2 3.23Å; Y1167-Y1220 WeakPolarHBondContact OH-CD2 3.31Å
1168	S	88.6	Confident	87.7	Confident	48 Å²	48	31.6 Å²	31.6	34%	0.336	16%	0.162	S	C	.	.	H	α-helix	trans	-57.9	-44.2	-179.7	-62.6	0	0	0	0	112.2	D1164 K1172 T1214	D1164-S1168 VanDerWaalsContact O-CB 3.3Å; D1164-S1168 WeakPolarHBondContact O-CB 3.31Å; D1164-S1168 PolarHBondContact O-N 3.15Å; D1164-S1168 PolarHBondContact O-OG 3.16Å; S1168-K1172 WeakPolarHBondContact O-CB 3.42Å; S1168-K1172 PolarHBondContact O-N 3.18Å; S1168-T1214 WeakPolarHBondContact OG-CG2 3.45Å
1169	S	89.7	Confident	87.6	Confident	35 Å²	35	34.5 Å²	34.5	25%	0.245	18%	0.181	C	C	.	.	H	α-helix	trans	-69.5	-38.2	179.2	-56.3	0	0	0	0	111.8	Q1165 W1166 Y1167 K1172 V1173	Q1165-S1169 VanDerWaalsContact O-CB 3.26Å; Q1165-S1169 WeakPolarHBondContact O-CB 3.43Å; Q1165-S1169 PolarHBondContact O-N 2.92Å; Q1165-S1169 PolarHBondContact O-OG 2.99Å; W1166-S1169 PolarHBondContact O-N 3.27Å; Y1167-S1169 VanDerWaalsContact C-N 3.32Å; Y1167-S1169 PolarHBondContact O-N 3.05Å; S1169-K1172 PolarHBondContact O-N 2.61Å; S1169-V1173 WeakPolarHBondContact O-CG2 3.5Å; S1169-V1173 PolarHBondContact O-N 3.4Å
1170	S	88.1	Confident	87.4	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.007	21%	0.211	C	C	.	.	H	α-helix	trans	-62.7	-46.9	175.9	-59.9	0	0	0	0	111.6	W1166 Y1167 K1172 V1173 I1174	W1166-S1170 VanDerWaalsContact CD1-OG 3.3Å; W1166-S1170 VanDerWaalsContact O-CB 3.31Å; W1166-S1170 WeakPolarHBondContact O-CB 3.36Å; W1166-S1170 PolarHBondContact O-N 2.62Å; W1166-S1170 PolarHBondContact O-OG 3.41Å; Y1167-S1170 WeakPolarHBondContact O-CB 3.23Å; Y1167-S1170 PolarHBondContact O-N 3.26Å; Y1167-S1170 VanDerWaalsContact O-N 3.17Å; S1170-K1172 VanDerWaalsContact C-N 3.33Å; S1170-K1172 PolarHBondContact O-N 2.85Å; S1170-V1173 PolarHBondContact O-N 2.82Å; S1170-I1174 WeakPolarHBondContact O-CG1 3.33Å; S1170-I1174 PolarHBondContact O-N 2.93Å
1171	M	89.7	Confident	87.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.3	-36.7	177	-68.1	-57.5	131.1	0	0	112	Y1167 I1174 C1175 V1198 T1201 T1219 Y1220	Y1167-M1171 HydrophobicContact CD1-CG 4.27Å; Y1167-M1171 HydrophobicContact CD2-CE 4.28Å; Y1167-M1171 HydrophobicContact CD2-CG 4.45Å; Y1167-M1171 HydrophobicContact CE1-CG 3.72Å; Y1167-M1171 HydrophobicContact CE2-CE 3.7Å; Y1167-M1171 HydrophobicContact CE2-CG 3.96Å; Y1167-M1171 HydrophobicContact CE2-SD 4.37Å; Y1167-M1171 WeakPolarHBondContact O-CG 3.41Å; Y1167-M1171 PolarHBondContact O-N 3.47Å; M1171-I1174 HydrophobicContact CE-CD1 4.24Å; M1171-I1174 PolarHBondContact O-N 2.88Å; M1171-I1174 HydrophobicContact SD-CD1 4.49Å; M1171-C1175 VanDerWaalsContact O-CB 3.23Å; M1171-C1175 WeakPolarHBondContact O-CB 3.38Å; M1171-C1175 PolarHBondContact O-N 3.44Å; M1171-V1198 HydrophobicContact SD-CG1 4.48Å; M1171-T1201 HydrophobicContact CE-CG2 3.89Å; M1171-T1219 HydrophobicContact CB-CG2 4.5Å; M1171-Y1220 HydrophobicContact SD-CD2 3.98Å
1172	K	89.2	Confident	86.6	Confident	136 Å²	136	38 Å²	38	59%	0.591	20%	0.204	S	C	*	.	H	α-helix	trans	-62.6	-44.6	174.3	-170.9	177.9	-179.6	-178.5	0	112.2	S1168 S1169 S1170 C1175 V1176 T1219	S1168-K1172 WeakPolarHBondContact O-CB 3.42Å; S1168-K1172 PolarHBondContact O-N 3.18Å; S1169-K1172 PolarHBondContact O-N 2.61Å; S1170-K1172 VanDerWaalsContact C-N 3.33Å; S1170-K1172 PolarHBondContact O-N 2.85Å; K1172-C1175 WeakPolarHBondContact O-CB 3.4Å; K1172-C1175 PolarHBondContact O-N 2.95Å; K1172-V1176 WeakPolarHBondContact O-CG2 3.27Å; K1172-V1176 PolarHBondContact O-N 3.39Å; K1172-T1219 HydrophobicContact CB-CG2 4.4Å
1173	V	89.2	Confident	85.8	Confident	29 Å²	29	45.7 Å²	45.7	18%	0.176	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-40.5	178.3	168.5	0	0	0	0	111.8	V1091 E1095 L1098 S1169 S1170 C1175 V1176 W1177	V1091-V1173 HydrophobicContact CG1-CB 4.26Å; V1091-V1173 HydrophobicContact CG1-CG2 3.45Å; V1091-V1173 VanDerWaalsContact CG1-CG2 3.45Å; E1095-V1173 HydrophobicContact CG-CG1 3.67Å; L1098-V1173 HydrophobicContact CD1-CG1 3.68Å; S1169-V1173 WeakPolarHBondContact O-CG2 3.5Å; S1169-V1173 PolarHBondContact O-N 3.4Å; S1170-V1173 PolarHBondContact O-N 2.82Å; V1173-C1175 VanDerWaalsContact C-N 3.33Å; V1173-C1175 PolarHBondContact O-N 3.3Å; V1173-V1176 PolarHBondContact O-N 3Å; V1173-W1177 WeakPolarHBondContact O-CB 3.41Å; V1173-W1177 PolarHBondContact O-N 2.9Å
1174	I	85.9	Confident	84.9	Confident	1 Å²	1	49 Å²	49	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-62.6	-42.7	173.5	-66	166.4	0	0	0	110.6	L1094 L1098 S1170 M1171 W1177 L1178 L1194 I1197 V1198 V1223	L1094-I1174 HydrophobicContact CD1-CD1 4.47Å; L1094-I1174 HydrophobicContact CD1-CG1 4.47Å; L1094-I1174 HydrophobicContact CD2-CD1 4.14Å; L1094-I1174 HydrophobicContact CD2-CG1 4.05Å; L1098-I1174 HydrophobicContact CD1-CG1 4.26Å; S1170-I1174 WeakPolarHBondContact O-CG1 3.33Å; S1170-I1174 PolarHBondContact O-N 2.93Å; M1171-I1174 HydrophobicContact CE-CD1 4.24Å; M1171-I1174 PolarHBondContact O-N 2.88Å; M1171-I1174 HydrophobicContact SD-CD1 4.49Å; I1174-W1177 PolarHBondContact O-N 3.22Å; I1174-L1178 HydrophobicContact CG2-CD1 4Å; I1174-L1178 HydrophobicContact CG2-CG 4.48Å; I1174-L1178 WeakPolarHBondContact O-CB 3.43Å; I1174-L1178 WeakPolarHBondContact O-CG 3.32Å; I1174-L1178 PolarHBondContact O-N 3.35Å; I1174-L1194 HydrophobicContact CG2-CD2 4.45Å; I1174-I1197 HydrophobicContact CD1-CG2 4.37Å; I1174-V1198 HydrophobicContact CD1-CG2 4.11Å; I1174-V1198 HydrophobicContact CG2-CG2 4.26Å; I1174-V1223 HydrophobicContact CG2-CG1 3.88Å; I1174-V1223 HydrophobicContact CG2-CG2 4.34Å
1175	C	86.7	Confident	84.1	Confident	19 Å²	19	51.6 Å²	51.6	13%	0.128	27%	0.274	C	S	.	.	H	α-helix	trans	-61	-47.1	177	-172.2	0	0	0	0	112.2	M1171 K1172 V1173 L1178 T1179 T1219 V1223	M1171-C1175 VanDerWaalsContact O-CB 3.23Å; M1171-C1175 WeakPolarHBondContact O-CB 3.38Å; M1171-C1175 PolarHBondContact O-N 3.44Å; K1172-C1175 WeakPolarHBondContact O-CB 3.4Å; K1172-C1175 PolarHBondContact O-N 2.95Å; V1173-C1175 VanDerWaalsContact C-N 3.33Å; V1173-C1175 PolarHBondContact O-N 3.3Å; C1175-L1178 PolarHBondContact O-N 3.37Å; C1175-T1179 WeakPolarHBondContact O-CB 3.04Å; C1175-T1179 PolarHBondContact O-N 3.01Å; C1175-T1179 PolarHBondContact O-OG1 3.21Å; C1175-T1219 HydrophobicContact CB-CG2 3.56Å; C1175-V1223 HydrophobicContact CB-CG2 3.46Å; C1175-V1223 VanDerWaalsContact CB-CG2 3.46Å
1176	V	87.8	Confident	83.5	Confident	73 Å²	73	48.7 Å²	48.7	44%	0.442	26%	0.26	S	S	.	.	H	α-helix	trans	-60.8	-46.9	175.5	171.6	0	0	0	0	110.3	K1172 V1173 L1178 T1179 D1180	K1172-V1176 WeakPolarHBondContact O-CG2 3.27Å; K1172-V1176 PolarHBondContact O-N 3.39Å; V1173-V1176 PolarHBondContact O-N 3Å; V1176-L1178 VanDerWaalsContact C-N 3.27Å; V1176-L1178 PolarHBondContact O-N 3.21Å; V1176-T1179 WeakPolarHBondContact O-CB 3.29Å; V1176-T1179 PolarHBondContact O-N 3.29Å; V1176-D1180 PolarHBondContact O-N 3.31Å
1177	W	87.1	Confident	82.7	Confident	20 Å²	20	52.3 Å²	52.3	8%	0.076	28%	0.277	C	S	.	.	H	α-helix	trans	-59.9	-36	179.4	-174	93	0	0	0	113.4	L1098 L1101 V1173 I1174 R1181 L1186 L1194	L1098-W1177 HydrophobicContact CB-CG 4.19Å; L1098-W1177 HydrophobicContact CD1-CB 4.09Å; L1098-W1177 HydrophobicContact CD1-CG 4.16Å; L1098-W1177 HydrophobicContact CD2-CD2 4.18Å; L1098-W1177 HydrophobicContact CD2-CG 4.27Å; L1098-W1177 HydrophobicContact CG-CG 4.45Å; L1098-W1177 PolarHBondContact O-NE1 3.46Å; L1101-W1177 HydrophobicContact CB-CZ2 4.26Å; V1173-W1177 WeakPolarHBondContact O-CB 3.41Å; V1173-W1177 PolarHBondContact O-N 2.9Å; I1174-W1177 PolarHBondContact O-N 3.22Å; W1177-R1181 VanDerWaalsContact CD1-NH1 3.35Å; W1177-R1181 VanDerWaalsContact CE2-NH1 3.31Å; W1177-R1181 PolarHBondContact O-NH1 3.44Å; W1177-L1186 HydrophobicContact CH2-CD2 4.22Å; W1177-L1186 HydrophobicContact CZ3-CD2 3.96Å; W1177-L1194 HydrophobicContact CE3-CD1 4.05Å; W1177-L1194 HydrophobicContact CH2-CD1 4.12Å; W1177-L1194 HydrophobicContact CZ3-CD1 3.44Å; W1177-L1194 VanDerWaalsContact CZ3-CD1 3.44Å
1178	L	82.6	Confident	81.8	Confident	7 Å²	7	54.7 Å²	54.7	4%	0.037	29%	0.289	C	S	.	.	H	α-helix	trans	-73.7	-36	173.2	-72.5	171.4	0	0	0	112.4	I1174 C1175 V1176 R1181 L1182 L1186 L1194 V1223 L1227	I1174-L1178 HydrophobicContact CG2-CD1 4Å; I1174-L1178 HydrophobicContact CG2-CG 4.48Å; I1174-L1178 WeakPolarHBondContact O-CB 3.43Å; I1174-L1178 WeakPolarHBondContact O-CG 3.32Å; I1174-L1178 PolarHBondContact O-N 3.35Å; C1175-L1178 PolarHBondContact O-N 3.37Å; V1176-L1178 VanDerWaalsContact C-N 3.27Å; V1176-L1178 PolarHBondContact O-N 3.21Å; L1178-R1181 CarbonylContact O-C 3.39Å; L1178-R1181 PolarHBondContact O-N 2.75Å; L1178-R1181 VanDerWaalsContact O-N 3.13Å; L1178-L1182 PolarHBondContact O-N 2.89Å; L1178-L1186 HydrophobicContact CD2-CD1 3.68Å; L1178-L1186 HydrophobicContact CD2-CD2 4.38Å; L1178-L1194 HydrophobicContact CD2-CD1 4.13Å; L1178-V1223 HydrophobicContact CD1-CB 4.36Å; L1178-V1223 HydrophobicContact CD1-CG1 3.85Å; L1178-V1223 HydrophobicContact CD1-CG2 4.22Å; L1178-L1227 HydrophobicContact CD1-CD2 4.29Å; L1178-L1227 HydrophobicContact CD1-CG 4.32Å; L1178-L1227 HydrophobicContact CD2-CD2 4.26Å
1179	T	82.8	Confident	81	Confident	69 Å²	69	54.3 Å²	54.3	42%	0.423	28%	0.281	S	S	.	.	H	α-helix	trans	-67.2	-40.1	179.1	-56.8	0	0	0	0	111.1	C1175 V1176 R1181 L1182	C1175-T1179 WeakPolarHBondContact O-CB 3.04Å; C1175-T1179 PolarHBondContact O-N 3.01Å; C1175-T1179 PolarHBondContact O-OG1 3.21Å; V1176-T1179 WeakPolarHBondContact O-CB 3.29Å; V1176-T1179 PolarHBondContact O-N 3.29Å; T1179-R1181 PolarHBondContact O-N 2.78Å; T1179-L1182 HydrophobicContact CG2-CD1 3.75Å; T1179-L1182 HydrophobicContact CG2-CG 4.43Å; T1179-L1182 WeakPolarHBondContact O-CD1 3.46Å; T1179-L1182 WeakPolarHBondContact O-CG 3.33Å; T1179-L1182 PolarHBondContact O-N 2.83Å; T1179-L1182 VanDerWaalsContact O-N 3.17Å
1180	D	80.9	Confident	80.3	Confident	122 Å²	122	52.7 Å²	52.7	65%	0.652	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-10.6	173.8	-67.3	-18.2	0	0	0	113	V1176	V1176-D1180 PolarHBondContact O-N 3.31Å
1181	R	80.1	Confident	79.8	Confident	31 Å²	31	52.8 Å²	52.8	12%	0.117	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	25.9	-178.3	-64.9	174.5	176.5	62.5	12.5	112.5	S1102 D1105 W1177 L1178 T1179 D1183 L1184 R1226	S1102-R1181 VanDerWaalsContact CB-NH2 3.26Å; D1105-R1181 VanDerWaalsContact CG-NE 3.31Å; D1105-R1181 IonicContact OD1-NE 3.08Å; D1105-R1181 PolarHBondContact OD1-NE 3.33Å; D1105-R1181 IonicContact OD2-CZ 3.06Å; D1105-R1181 VanDerWaalsContact OD2-CZ 3.26Å; D1105-R1181 IonicContact OD2-NE 2.7Å; D1105-R1181 PolarHBondContact OD2-NE 3.17Å; D1105-R1181 IonicContact OD2-NH2 3.3Å; D1105-R1181 PolarHBondContact OD2-NH2 2.7Å; W1177-R1181 VanDerWaalsContact CD1-NH1 3.35Å; W1177-R1181 VanDerWaalsContact CE2-NH1 3.31Å; W1177-R1181 PolarHBondContact O-NH1 3.44Å; L1178-R1181 CarbonylContact O-C 3.39Å; L1178-R1181 PolarHBondContact O-N 2.75Å; L1178-R1181 VanDerWaalsContact O-N 3.13Å; T1179-R1181 PolarHBondContact O-N 2.78Å; R1181-D1183 PolarHBondContact O-N 3.32Å; R1181-D1183 VanDerWaalsContact O-N 3.16Å; R1181-L1184 HydrophobicContact CB-CB 4.41Å; R1181-L1184 HydrophobicContact CG-CD1 4.28Å; R1181-L1184 PolarHBondContact O-N 2.9Å; R1181-L1184 VanDerWaalsContact O-N 3.1Å; R1181-R1226 PolarHBondContact O-NH2 2.86Å
1182	L	74.7	Confident	79.1	Confident	98 Å²	98	55.6 Å²	55.6	51%	0.513	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-38.3	-178.8	-86.1	160.7	0	0	0	113.2	L1178 T1179 R1226	L1178-L1182 PolarHBondContact O-N 2.89Å; T1179-L1182 HydrophobicContact CG2-CD1 3.75Å; T1179-L1182 HydrophobicContact CG2-CG 4.43Å; T1179-L1182 WeakPolarHBondContact O-CD1 3.46Å; T1179-L1182 WeakPolarHBondContact O-CG 3.33Å; T1179-L1182 PolarHBondContact O-N 2.83Å; T1179-L1182 VanDerWaalsContact O-N 3.17Å; L1182-R1226 PolarHBondContact O-NH1 3.23Å; L1182-R1226 PolarHBondContact O-NH2 3.13Å
1183	D	71	Confident	78.5	Confident	167 Å²	167	49.3 Å²	49.3	89%	0.893	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	0.5	-176	-58.4	-38.6	0	0	0	114.3	R1181	R1181-D1183 PolarHBondContact O-N 3.32Å; R1181-D1183 VanDerWaalsContact O-N 3.16Å
1184	L	72.6	Confident	78.2	Confident	70 Å²	70	48 Å²	48	37%	0.366	25%	0.247	S	C	.	.	S	Bend	trans	-109.7	139.9	179.8	-63.4	173.2	0	0	0	110.6	R1181 R1226	R1181-L1184 HydrophobicContact CB-CB 4.41Å; R1181-L1184 HydrophobicContact CG-CD1 4.28Å; R1181-L1184 PolarHBondContact O-N 2.9Å; R1181-L1184 VanDerWaalsContact O-N 3.1Å; L1184-R1226 PolarHBondContact O-NH2 3.48Å
1185	Q	70.9	Confident	78	Confident	87 Å²	87	47.9 Å²	47.9	41%	0.407	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-78.7	132.5	169.7	-169.1	172.4	2	0	0	109.4
1186	L	75	Confident	77.8	Confident	10 Å²	10	48.6 Å²	48.6	5%	0.052	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-73.7	134.2	-178.1	-66.2	176.7	0	0	0	111	W1177 L1178 L1191 L1227 E1230	W1177-L1186 HydrophobicContact CH2-CD2 4.22Å; W1177-L1186 HydrophobicContact CZ3-CD2 3.96Å; L1178-L1186 HydrophobicContact CD2-CD1 3.68Å; L1178-L1186 HydrophobicContact CD2-CD2 4.38Å; L1186-L1191 HydrophobicContact CB-CB 4.45Å; L1186-L1191 HydrophobicContact CD1-CD1 4.35Å; L1186-L1227 HydrophobicContact CD1-CD2 4.21Å; L1186-E1230 HydrophobicContact CD1-CG 4.12Å; L1186-E1230 HydrophobicContact CG-CG 4.49Å
1187	H	73.5	Confident	77.7	Confident	76 Å²	76	45.2 Å²	45.2	35%	0.352	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-63.2	143.3	174	-178.6	-91.4	0	0	0	110.5	Y1189 Q1190 L1191	H1187-Y1189 WeakPolarHBondContact ND1-CB 3.37Å; H1187-Y1189 PolarHBondContact ND1-N 3.42Å; H1187-Y1189 VanDerWaalsContact ND1-N 3.14Å; H1187-Y1189 PolarHBondContact O-N 3.17Å; H1187-Q1190 HydrophobicContact CB-CG 4.12Å; H1187-Q1190 WeakPolarHBondContact O-CA 3.38Å; H1187-Q1190 WeakPolarHBondContact O-CB 3.31Å; H1187-Q1190 PolarHBondContact O-N 3.13Å; H1187-L1191 PolarHBondContact O-N 3.12Å
1188	I	71.6	Confident	77.6	Confident	50 Å²	50	44.2 Å²	44.2	26%	0.256	22%	0.223	S	C	.	.	H	α-helix	trans	-53	-36.8	-175.3	-66.4	168	0	0	0	112.4	K1192 E1238	I1188-K1192 HydrophobicContact CG2-CD 4.2Å; I1188-K1192 HydrophobicContact CG2-CG 4.48Å; I1188-K1192 WeakPolarHBondContact O-CB 3.23Å; I1188-K1192 WeakPolarHBondContact O-CG 3.49Å; I1188-K1192 PolarHBondContact O-N 2.75Å; I1188-E1238 WeakPolarHBondContact CD1-OE2 3.31Å
1189	Y	71.3	Confident	77.7	Confident	40 Å²	40	46.2 Å²	46.2	16%	0.157	23%	0.231	C	C	.	.	H	α-helix	trans	-68.2	-38	175.5	-179.9	-112.8	0	0	0	113.5	L1101 Y1104 H1187 T1193	L1101-Y1189 HydrophobicContact CD2-CD1 4.4Å; L1101-Y1189 HydrophobicContact CD2-CE1 4.12Å; Y1104-Y1189 HydrophobicContact CD1-CD1 4.14Å; Y1104-Y1189 HydrophobicContact CD2-CD1 4.04Å; Y1104-Y1189 HydrophobicContact CD2-CE1 4.29Å; Y1104-Y1189 AromaticContact CE1-CD1 3.93Å; Y1104-Y1189 HydrophobicContact CE1-CD1 3.93Å; Y1104-Y1189 HydrophobicContact CE1-CE1 4.33Å; Y1104-Y1189 AromaticContact CE2-CD1 3.84Å; Y1104-Y1189 HydrophobicContact CE2-CD1 3.84Å; Y1104-Y1189 AromaticContact CE2-CE1 3.7Å; Y1104-Y1189 HydrophobicContact CE2-CE1 3.7Å; Y1104-Y1189 HydrophobicContact CG-CD1 4.2Å; Y1104-Y1189 AromaticContact CZ-CD1 3.78Å; Y1104-Y1189 AromaticContact CZ-CE1 3.73Å; H1187-Y1189 WeakPolarHBondContact ND1-CB 3.37Å; H1187-Y1189 PolarHBondContact ND1-N 3.42Å; H1187-Y1189 VanDerWaalsContact ND1-N 3.14Å; H1187-Y1189 PolarHBondContact O-N 3.17Å; Y1189-T1193 VanDerWaalsContact O-CB 3.27Å; Y1189-T1193 WeakPolarHBondContact O-CB 3.33Å; Y1189-T1193 PolarHBondContact O-N 2.99Å; Y1189-T1193 VanDerWaalsContact O-N 3.08Å; Y1189-T1193 PolarHBondContact O-OG1 2.72Å
1190	Q	75.9	Confident	77.8	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-67.4	-46.2	175.8	-62.9	172.4	-43.6	0	0	110.1	L1101 D1105 H1187 T1193 L1194	L1101-Q1190 PolarHBondContact O-NE2 2.93Å; D1105-Q1190 PolarHBondContact OD1-NE2 3.31Å; H1187-Q1190 HydrophobicContact CB-CG 4.12Å; H1187-Q1190 WeakPolarHBondContact O-CA 3.38Å; H1187-Q1190 WeakPolarHBondContact O-CB 3.31Å; H1187-Q1190 PolarHBondContact O-N 3.13Å; Q1190-T1193 PolarHBondContact O-N 2.96Å; Q1190-L1194 WeakPolarHBondContact O-CB 3.34Å; Q1190-L1194 VanDerWaalsContact O-CG 3.28Å; Q1190-L1194 WeakPolarHBondContact O-CG 3.22Å; Q1190-L1194 PolarHBondContact O-N 3.4Å
1191	L	76.7	Confident	78	Confident	2 Å²	2	41 Å²	41	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-60	-50.9	178.4	-175.5	60.1	0	0	0	111.5	L1186 H1187 T1193 L1194 I1195 L1227 E1230 A1234	L1186-L1191 HydrophobicContact CB-CB 4.45Å; L1186-L1191 HydrophobicContact CD1-CD1 4.35Å; H1187-L1191 PolarHBondContact O-N 3.12Å; L1191-T1193 VanDerWaalsContact C-N 3.33Å; L1191-T1193 PolarHBondContact O-N 3.05Å; L1191-L1194 PolarHBondContact O-N 3.1Å; L1191-I1195 HydrophobicContact CD1-CD1 3.81Å; L1191-I1195 HydrophobicContact CD1-CG1 4.17Å; L1191-I1195 HydrophobicContact CG-CD1 3.82Å; L1191-I1195 WeakPolarHBondContact O-CB 3.18Å; L1191-I1195 WeakPolarHBondContact O-CG1 3.49Å; L1191-I1195 PolarHBondContact O-N 3.15Å; L1191-L1227 HydrophobicContact CD1-CD2 3.91Å; L1191-E1230 HydrophobicContact CD1-CB 3.77Å; L1191-E1230 HydrophobicContact CD2-CB 4.28Å; L1191-A1234 HydrophobicContact CD2-CB 3.94Å
1192	K	75.1	Confident	78.2	Confident	59 Å²	59	41.2 Å²	41.2	26%	0.257	20%	0.198	S	C	.	.	H	α-helix	trans	-59.5	-40.7	176.2	-76.1	-178.6	178.4	-175	0	113.2	I1188 K1196 G1241 L1242	I1188-K1192 HydrophobicContact CG2-CD 4.2Å; I1188-K1192 HydrophobicContact CG2-CG 4.48Å; I1188-K1192 WeakPolarHBondContact O-CB 3.23Å; I1188-K1192 WeakPolarHBondContact O-CG 3.49Å; I1188-K1192 PolarHBondContact O-N 2.75Å; K1192-K1196 VanDerWaalsContact O-CB 3.31Å; K1192-K1196 WeakPolarHBondContact O-CB 3.34Å; K1192-K1196 PolarHBondContact O-N 3.14Å; K1192-K1196 VanDerWaalsContact O-N 3.12Å; K1192-G1241 WeakPolarHBondContact CE-O 3.28Å; K1192-G1241 PolarHBondContact NZ-O 2.76Å; K1192-L1242 HydrophobicContact CG-CD2 4.03Å
1193	T	78.3	Confident	78.6	Confident	4 Å²	4	41.4 Å²	41.4	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-68.4	-44.7	-179.9	-61.4	0	0	0	0	111.3	L1101 A1135 Y1189 Q1190 L1191 K1196 I1197	L1101-T1193 HydrophobicContact CD1-CG2 3.81Å; L1101-T1193 HydrophobicContact CD2-CG2 3.86Å; L1101-T1193 HydrophobicContact CG-CG2 4.4Å; A1135-T1193 HydrophobicContact CB-CG2 4Å; Y1189-T1193 VanDerWaalsContact O-CB 3.27Å; Y1189-T1193 WeakPolarHBondContact O-CB 3.33Å; Y1189-T1193 PolarHBondContact O-N 2.99Å; Y1189-T1193 VanDerWaalsContact O-N 3.08Å; Y1189-T1193 PolarHBondContact O-OG1 2.72Å; Q1190-T1193 PolarHBondContact O-N 2.96Å; L1191-T1193 VanDerWaalsContact C-N 3.33Å; L1191-T1193 PolarHBondContact O-N 3.05Å; T1193-K1196 PolarHBondContact O-N 2.88Å; T1193-I1197 HydrophobicContact CG2-CD1 3.8Å; T1193-I1197 HydrophobicContact CG2-CG1 4.49Å; T1193-I1197 WeakPolarHBondContact O-CB 3.23Å; T1193-I1197 VanDerWaalsContact O-CG1 3.28Å; T1193-I1197 WeakPolarHBondContact O-CG1 3.26Å; T1193-I1197 PolarHBondContact O-N 3.06Å
1194	L	82.9	Confident	79.3	Confident	1 Å²	1	34 Å²	34	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-68.8	-42.6	179.2	-71.1	170	0	0	0	112.4	L1098 L1101 I1174 W1177 L1178 Q1190 L1191 K1196 I1197 V1198 L1227	L1098-L1194 HydrophobicContact CD2-CD2 3.6Å; L1101-L1194 HydrophobicContact CD1-CD2 4.29Å; I1174-L1194 HydrophobicContact CG2-CD2 4.45Å; W1177-L1194 HydrophobicContact CE3-CD1 4.05Å; W1177-L1194 HydrophobicContact CH2-CD1 4.12Å; W1177-L1194 HydrophobicContact CZ3-CD1 3.44Å; W1177-L1194 VanDerWaalsContact CZ3-CD1 3.44Å; L1178-L1194 HydrophobicContact CD2-CD1 4.13Å; Q1190-L1194 WeakPolarHBondContact O-CB 3.34Å; Q1190-L1194 VanDerWaalsContact O-CG 3.28Å; Q1190-L1194 WeakPolarHBondContact O-CG 3.22Å; Q1190-L1194 PolarHBondContact O-N 3.4Å; L1191-L1194 PolarHBondContact O-N 3.1Å; L1194-K1196 VanDerWaalsContact C-N 3.29Å; L1194-K1196 PolarHBondContact O-N 3.12Å; L1194-I1197 PolarHBondContact O-N 3.49Å; L1194-V1198 WeakPolarHBondContact O-CB 3.35Å; L1194-V1198 VanDerWaalsContact O-CG2 3.26Å; L1194-V1198 WeakPolarHBondContact O-CG2 3.29Å; L1194-V1198 PolarHBondContact O-N 3.08Å; L1194-L1227 HydrophobicContact CB-CD1 4.45Å; L1194-L1227 HydrophobicContact CB-CD2 4.13Å
1195	I	81.8	Confident	80	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-57.5	-46.4	173.8	-68.5	172.1	0	0	0	110	L1191 K1199 L1227 E1231 I1245 M1247	L1191-I1195 HydrophobicContact CD1-CD1 3.81Å; L1191-I1195 HydrophobicContact CD1-CG1 4.17Å; L1191-I1195 HydrophobicContact CG-CD1 3.82Å; L1191-I1195 WeakPolarHBondContact O-CB 3.18Å; L1191-I1195 WeakPolarHBondContact O-CG1 3.49Å; L1191-I1195 PolarHBondContact O-N 3.15Å; I1195-K1199 HydrophobicContact CG2-CD 3.98Å; I1195-K1199 HydrophobicContact CG2-CG 4.39Å; I1195-K1199 WeakPolarHBondContact O-CB 3.39Å; I1195-K1199 WeakPolarHBondContact O-CG 3.31Å; I1195-K1199 PolarHBondContact O-N 2.72Å; I1195-L1227 HydrophobicContact CG1-CB 4.36Å; I1195-E1231 HydrophobicContact CD1-CB 4.32Å; I1195-E1231 HydrophobicContact CD1-CG 4.47Å; I1195-I1245 HydrophobicContact CB-CG2 4.03Å; I1195-I1245 HydrophobicContact CG2-CG2 3.43Å; I1195-I1245 VanDerWaalsContact CG2-CG2 3.43Å; I1195-M1247 HydrophobicContact CB-CG 4.46Å; I1195-M1247 HydrophobicContact CB-SD 3.96Å; I1195-M1247 HydrophobicContact CD1-CG 3.96Å; I1195-M1247 HydrophobicContact CG1-CG 3.76Å; I1195-M1247 HydrophobicContact CG1-SD 3.68Å; I1195-M1247 HydrophobicContact CG2-CG 4.01Å; I1195-M1247 HydrophobicContact CG2-SD 3.6Å; I1195-M1247 VanDerWaalsContact CG2-SD 3.6Å
1196	K	82.4	Confident	80.6	Confident	34 Å²	34	32.2 Å²	32.2	15%	0.148	14%	0.137	C	C	.	.	H	α-helix	trans	-64.2	-45.2	179.2	-168.4	172.9	179.4	-178.3	0	112.1	A1135 D1136 I1139 K1192 T1193 L1194 K1200 I1245	A1135-K1196 HydrophobicContact CB-CB 4.26Å; A1135-K1196 HydrophobicContact CB-CD 3.86Å; A1135-K1196 HydrophobicContact CB-CG 4.21Å; D1136-K1196 WeakPolarHBondContact OD1-CE 3.28Å; D1136-K1196 IonicContact OD1-NZ 2.67Å; D1136-K1196 PolarHBondContact OD1-NZ 2.99Å; D1136-K1196 IonicContact OD2-NZ 2.67Å; D1136-K1196 PolarHBondContact OD2-NZ 3.45Å; I1139-K1196 HydrophobicContact CD1-CG 4.07Å; K1192-K1196 VanDerWaalsContact O-CB 3.31Å; K1192-K1196 WeakPolarHBondContact O-CB 3.34Å; K1192-K1196 PolarHBondContact O-N 3.14Å; K1192-K1196 VanDerWaalsContact O-N 3.12Å; T1193-K1196 PolarHBondContact O-N 2.88Å; L1194-K1196 VanDerWaalsContact C-N 3.29Å; L1194-K1196 PolarHBondContact O-N 3.12Å; K1196-K1200 HydrophobicContact CG-CG 4.45Å; K1196-K1200 VanDerWaalsContact O-CB 3.26Å; K1196-K1200 WeakPolarHBondContact O-CB 3.33Å; K1196-K1200 WeakPolarHBondContact O-CG 3.48Å; K1196-K1200 PolarHBondContact O-N 3.41Å; K1196-I1245 HydrophobicContact CB-CD1 4.43Å; K1196-I1245 HydrophobicContact CD-CD1 4.1Å
1197	I	84.9	Confident	81	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-50.5	177	-71	170.7	0	0	0	110.3	V1097 A1135 Y1138 I1174 T1193 L1194 T1201	V1097-I1197 HydrophobicContact CG1-CD1 4.22Å; A1135-I1197 HydrophobicContact CB-CG1 4.13Å; Y1138-I1197 HydrophobicContact CD1-CD1 4.21Å; Y1138-I1197 HydrophobicContact CD1-CG1 4.15Å; Y1138-I1197 HydrophobicContact CD1-CG2 3.87Å; Y1138-I1197 HydrophobicContact CE1-CG2 3.85Å; I1174-I1197 HydrophobicContact CD1-CG2 4.37Å; T1193-I1197 HydrophobicContact CG2-CD1 3.8Å; T1193-I1197 HydrophobicContact CG2-CG1 4.49Å; T1193-I1197 WeakPolarHBondContact O-CB 3.23Å; T1193-I1197 VanDerWaalsContact O-CG1 3.28Å; T1193-I1197 WeakPolarHBondContact O-CG1 3.26Å; T1193-I1197 PolarHBondContact O-N 3.06Å; L1194-I1197 PolarHBondContact O-N 3.49Å; I1197-T1201 WeakPolarHBondContact O-CB 3.47Å; I1197-T1201 PolarHBondContact O-N 3.32Å; I1197-T1201 PolarHBondContact O-OG1 2.87Å
1198	V	85.4	Confident	81.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.2	-47.9	-177.1	172.5	0	0	0	0	111.2	M1171 I1174 L1194 Y1202 Y1220 V1223 L1227	M1171-V1198 HydrophobicContact SD-CG1 4.48Å; I1174-V1198 HydrophobicContact CD1-CG2 4.11Å; I1174-V1198 HydrophobicContact CG2-CG2 4.26Å; L1194-V1198 WeakPolarHBondContact O-CB 3.35Å; L1194-V1198 VanDerWaalsContact O-CG2 3.26Å; L1194-V1198 WeakPolarHBondContact O-CG2 3.29Å; L1194-V1198 PolarHBondContact O-N 3.08Å; V1198-Y1202 VanDerWaalsContact O-CB 3.29Å; V1198-Y1202 WeakPolarHBondContact O-CB 3.28Å; V1198-Y1202 PolarHBondContact O-N 3.41Å; V1198-Y1220 HydrophobicContact CG1-CD2 4.25Å; V1198-Y1220 HydrophobicContact CG1-CE2 3.65Å; V1198-V1223 HydrophobicContact CG1-CG1 4.42Å; V1198-V1223 HydrophobicContact CG2-CG1 4.02Å; V1198-L1227 HydrophobicContact CB-CD1 4.34Å; V1198-L1227 HydrophobicContact CG2-CD1 3.98Å
1199	K	84.2	Confident	81.6	Confident	49 Å²	49	34.8 Å²	34.8	21%	0.213	16%	0.162	C	C	.	.	H	α-helix	trans	-64.7	-46.9	178.9	-72.8	-171.7	66	159.7	0	113.3	I1195 R1203 T1246 M1247 K1248	I1195-K1199 HydrophobicContact CG2-CD 3.98Å; I1195-K1199 HydrophobicContact CG2-CG 4.39Å; I1195-K1199 WeakPolarHBondContact O-CB 3.39Å; I1195-K1199 WeakPolarHBondContact O-CG 3.31Å; I1195-K1199 PolarHBondContact O-N 2.72Å; K1199-R1203 PolarHBondContact O-N 3.01Å; K1199-R1203 VanDerWaalsContact O-N 3.11Å; K1199-T1246 WeakPolarHBondContact CD-O 3.44Å; K1199-T1246 WeakPolarHBondContact CE-O 3.28Å; K1199-T1246 PolarHBondContact NZ-O 2.78Å; K1199-M1247 HydrophobicContact CD-SD 4.44Å; K1199-M1247 HydrophobicContact CG-SD 4.23Å; K1199-K1248 PolarHBondContact NZ-O 3.37Å
1200	K	84.7	Confident	82.2	Confident	80 Å²	80	33.2 Å²	33.2	35%	0.348	16%	0.156	S	C	.	.	H	α-helix	trans	-71.2	-39.4	-178.7	-68.8	-67.7	-173.6	-174.8	0	111.5	I1139 K1196 R1203 D1204	I1139-K1200 HydrophobicContact CD1-CB 3.61Å; I1139-K1200 HydrophobicContact CD1-CG 3.84Å; I1139-K1200 HydrophobicContact CG1-CB 4.01Å; I1139-K1200 HydrophobicContact CG2-CB 4.3Å; K1196-K1200 HydrophobicContact CG-CG 4.45Å; K1196-K1200 VanDerWaalsContact O-CB 3.26Å; K1196-K1200 WeakPolarHBondContact O-CB 3.33Å; K1196-K1200 WeakPolarHBondContact O-CG 3.48Å; K1196-K1200 PolarHBondContact O-N 3.41Å; K1200-R1203 PolarHBondContact O-N 2.82Å; K1200-D1204 VanDerWaalsContact O-CB 3.29Å; K1200-D1204 WeakPolarHBondContact O-CB 3.36Å; K1200-D1204 PolarHBondContact O-N 2.95Å
1201	T	84.2	Confident	82.4	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-62.9	-43.4	174.3	-55.2	0	0	0	0	111	Y1167 M1171 I1197 R1203 D1204 F1205	Y1167-T1201 HydrophobicContact CD2-CG2 4.24Å; Y1167-T1201 HydrophobicContact CE2-CG2 4.39Å; M1171-T1201 HydrophobicContact CE-CG2 3.89Å; I1197-T1201 WeakPolarHBondContact O-CB 3.47Å; I1197-T1201 PolarHBondContact O-N 3.32Å; I1197-T1201 PolarHBondContact O-OG1 2.87Å; T1201-R1203 PolarHBondContact O-N 3.36Å; T1201-D1204 PolarHBondContact O-N 3.11Å; T1201-F1205 HydrophobicContact CG2-CD2 3.46Å; T1201-F1205 VanDerWaalsContact CG2-CD2 3.46Å; T1201-F1205 HydrophobicContact CG2-CE2 3.53Å; T1201-F1205 WeakPolarHBondContact O-CB 3.33Å; T1201-F1205 VanDerWaalsContact O-CD2 3.29Å; T1201-F1205 WeakPolarHBondContact O-CD2 3.26Å; T1201-F1205 PolarHBondContact O-N 2.7Å
1202	Y	84.6	Confident	82.4	Confident	35 Å²	35	45.2 Å²	45.2	14%	0.137	22%	0.215	C	C	.	.	H	α-helix	trans	-56	-49.4	173.8	-178.9	-84.9	0	0	0	111.8	Y1167 V1198 R1206 L1215 N1216 Y1220	Y1167-Y1202 WeakPolarHBondContact OH-CD2 3.46Å; V1198-Y1202 VanDerWaalsContact O-CB 3.29Å; V1198-Y1202 WeakPolarHBondContact O-CB 3.28Å; V1198-Y1202 PolarHBondContact O-N 3.41Å; Y1202-R1206 VanDerWaalsContact O-CB 3.27Å; Y1202-R1206 WeakPolarHBondContact O-CB 3.48Å; Y1202-R1206 PolarHBondContact O-N 2.92Å; Y1202-L1215 HydrophobicContact CD2-CB 4.31Å; Y1202-L1215 HydrophobicContact CD2-CD2 4.33Å; Y1202-L1215 HydrophobicContact CE2-CB 3.69Å; Y1202-L1215 HydrophobicContact CE2-CD2 4.47Å; Y1202-N1216 PolarHBondContact OH-OD1 3.43Å; Y1202-N1216 VanDerWaalsContact OH-OD1 3.14Å; Y1202-Y1220 HydrophobicContact CD2-CD2 4.25Å; Y1202-Y1220 AromaticContact CD2-CE1 3.92Å; Y1202-Y1220 HydrophobicContact CD2-CE1 3.92Å; Y1202-Y1220 AromaticContact CD2-CE2 3.62Å; Y1202-Y1220 HydrophobicContact CD2-CE2 3.62Å; Y1202-Y1220 AromaticContact CD2-CZ 3.42Å; Y1202-Y1220 VanDerWaalsContact CD2-CZ 3.42Å; Y1202-Y1220 HydrophobicContact CE2-CD1 4.38Å; Y1202-Y1220 AromaticContact CE2-CE1 3.82Å; Y1202-Y1220 HydrophobicContact CE2-CE1 3.82Å; Y1202-Y1220 HydrophobicContact CE2-CE2 4.36Å; Y1202-Y1220 AromaticContact CE2-CZ 3.8Å; Y1202-Y1220 HydrophobicContact CG-CE2 4.3Å
1203	R	84.1	Confident	82.4	Confident	102 Å²	102	45.6 Å²	45.6	39%	0.385	24%	0.236	S	C	.	.	H	α-helix	trans	-65.6	-43.5	179.1	-176.2	171.8	174	161.4	-3.7	112.8	K1199 K1200 T1201 R1206 L1207 D1251	K1199-R1203 PolarHBondContact O-N 3.01Å; K1199-R1203 VanDerWaalsContact O-N 3.11Å; K1200-R1203 PolarHBondContact O-N 2.82Å; T1201-R1203 PolarHBondContact O-N 3.36Å; R1203-R1206 PolarHBondContact O-N 2.67Å; R1203-L1207 HydrophobicContact CG-CD1 4.28Å; R1203-L1207 WeakPolarHBondContact O-CG 3.35Å; R1203-L1207 PolarHBondContact O-N 3.1Å; R1203-D1251 IonicContact CZ-OD2 3.9Å; R1203-D1251 IonicContact NH1-OD2 3Å; R1203-D1251 PolarHBondContact NH1-OD2 2.85Å
1204	D	85.1	Confident	82.5	Confident	12 Å²	12	46.9 Å²	46.9	6%	0.064	24%	0.244	C	C	.	.	H	α-helix	trans	-67.5	-43.2	-177.3	-67.7	-15.2	0	0	0	110.9	R1143 K1200 T1201 L1207 Q1208	R1143-D1204 IonicContact CZ-OD1 2.76Å; R1143-D1204 IonicContact CZ-OD2 3.47Å; R1143-D1204 VanDerWaalsContact NE-CG 3.34Å; R1143-D1204 IonicContact NE-OD1 2.88Å; R1143-D1204 PolarHBondContact NE-OD1 2.77Å; R1143-D1204 IonicContact NE-OD2 3.33Å; R1143-D1204 PolarHBondContact NE-OD2 3.43Å; R1143-D1204 IonicContact NH2-OD1 3.26Å; R1143-D1204 PolarHBondContact NH2-OD1 3.45Å; R1143-D1204 IonicContact NH2-OD2 2.78Å; R1143-D1204 PolarHBondContact NH2-OD2 3.38Å; K1200-D1204 VanDerWaalsContact O-CB 3.29Å; K1200-D1204 WeakPolarHBondContact O-CB 3.36Å; K1200-D1204 PolarHBondContact O-N 2.95Å; T1201-D1204 PolarHBondContact O-N 3.11Å; D1204-L1207 PolarHBondContact O-N 3.22Å; D1204-Q1208 WeakPolarHBondContact O-CG 3.37Å; D1204-Q1208 PolarHBondContact O-N 3.19Å
1205	F	87.8	Confident	82.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-70.5	-31.7	174.9	-81.5	-90.7	0	0	0	113	V1142 Q1146 F1163 W1166 Y1167 T1201 Q1208 G1209 V1210 L1215	V1142-F1205 HydrophobicContact CG1-CD2 4.34Å; V1142-F1205 HydrophobicContact CG1-CE2 3.55Å; V1142-F1205 HydrophobicContact CG1-CZ 4.12Å; Q1146-F1205 VanDerWaalsContact NE2-CE1 3.3Å; Q1146-F1205 VanDerWaalsContact NE2-CZ 3.34Å; F1163-F1205 HydrophobicContact CB-CD1 4.03Å; F1163-F1205 HydrophobicContact CB-CE1 4.05Å; F1163-F1205 HydrophobicContact CD1-CE1 4.36Å; F1163-F1205 HydrophobicContact CG-CE1 4.35Å; F1163-F1205 WeakPolarHBondContact O-CE1 3.38Å; W1166-F1205 HydrophobicContact CB-CE1 4.16Å; W1166-F1205 HydrophobicContact CB-CZ 4.3Å; W1166-F1205 HydrophobicContact CD2-CE1 4.08Å; W1166-F1205 AromaticContact CD2-CZ 3.57Å; W1166-F1205 HydrophobicContact CD2-CZ 3.57Å; W1166-F1205 AromaticContact CE2-CZ 3.99Å; W1166-F1205 AromaticContact CE3-CE1 3.97Å; W1166-F1205 HydrophobicContact CE3-CE1 3.97Å; W1166-F1205 AromaticContact CE3-CZ 3.71Å; W1166-F1205 HydrophobicContact CE3-CZ 3.71Å; W1166-F1205 HydrophobicContact CG-CE1 4.21Å; W1166-F1205 AromaticContact CG-CZ 3.87Å; W1166-F1205 HydrophobicContact CG-CZ 3.87Å; W1166-F1205 HydrophobicContact CZ2-CZ 4.5Å; W1166-F1205 HydrophobicContact CZ3-CZ 4.24Å; Y1167-F1205 HydrophobicContact CD2-CB 3.81Å; Y1167-F1205 HydrophobicContact CD2-CD1 4.43Å; Y1167-F1205 AromaticContact CD2-CD2 3.9Å; Y1167-F1205 HydrophobicContact CD2-CD2 3.9Å; Y1167-F1205 AromaticContact CD2-CG 3.79Å; Y1167-F1205 HydrophobicContact CD2-CG 3.79Å; Y1167-F1205 HydrophobicContact CE2-CB 4.49Å; Y1167-F1205 HydrophobicContact CG-CB 4.38Å; Y1167-F1205 HydrophobicContact CG-CG 4.31Å; T1201-F1205 HydrophobicContact CG2-CD2 3.46Å; T1201-F1205 VanDerWaalsContact CG2-CD2 3.46Å; T1201-F1205 HydrophobicContact CG2-CE2 3.53Å; T1201-F1205 WeakPolarHBondContact O-CB 3.33Å; T1201-F1205 VanDerWaalsContact O-CD2 3.29Å; T1201-F1205 WeakPolarHBondContact O-CD2 3.26Å; T1201-F1205 PolarHBondContact O-N 2.7Å; F1205-Q1208 PolarHBondContact O-N 3.4Å; F1205-G1209 PolarHBondContact O-N 3.16Å; F1205-V1210 HydrophobicContact CB-CB 4.39Å; F1205-V1210 HydrophobicContact CB-CG2 3.96Å; F1205-V1210 HydrophobicContact CD1-CG2 3.82Å; F1205-V1210 HydrophobicContact CG-CG2 4.4Å; F1205-V1210 WeakPolarHBondContact O-CB 3.47Å; F1205-V1210 WeakPolarHBondContact O-CG2 2.99Å; F1205-V1210 PolarHBondContact O-N 2.94Å; F1205-L1215 HydrophobicContact CB-CD2 4.25Å
1206	R	83.7	Confident	82.4	Confident	119 Å²	119	50.4 Å²	50.4	45%	0.449	26%	0.263	S	S	.	.	H	α-helix	trans	-61.8	-42.9	170.8	-172.9	178.7	70.6	177.3	1.4	112.2	Y1202 R1203 Q1208 G1209 L1215	Y1202-R1206 VanDerWaalsContact O-CB 3.27Å; Y1202-R1206 WeakPolarHBondContact O-CB 3.48Å; Y1202-R1206 PolarHBondContact O-N 2.92Å; R1203-R1206 PolarHBondContact O-N 2.67Å; R1206-Q1208 PolarHBondContact O-N 2.67Å; R1206-G1209 PolarHBondContact O-N 3Å; R1206-L1215 HydrophobicContact CB-CD1 3.66Å; R1206-L1215 HydrophobicContact CG-CD1 3.8Å
1207	L	83.8	Confident	82.5	Confident	124 Å²	124	49.9 Å²	49.9	65%	0.649	26%	0.263	S	S	*	.	H	α-helix	trans	-67.1	-22.2	176	-71.1	170.9	0	0	0	112.9	R1203 D1204	R1203-L1207 HydrophobicContact CG-CD1 4.28Å; R1203-L1207 WeakPolarHBondContact O-CG 3.35Å; R1203-L1207 PolarHBondContact O-N 3.1Å; D1204-L1207 PolarHBondContact O-N 3.22Å
1208	Q	81.1	Confident	82.4	Confident	27 Å²	27	58.5 Å²	58.5	13%	0.126	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	5.9	179.7	-66.7	-72.8	-18.9	0	0	113.6	Q1146 R1150 F1163 D1204 F1205 R1206	Q1146-Q1208 HydrophobicContact CB-CG 4.49Å; R1150-Q1208 PolarHBondContact NH2-O 3.48Å; F1163-Q1208 HydrophobicContact CD2-CB 3.85Å; F1163-Q1208 HydrophobicContact CE2-CB 3.95Å; F1163-Q1208 HydrophobicContact CE2-CG 4.36Å; D1204-Q1208 WeakPolarHBondContact O-CG 3.37Å; D1204-Q1208 PolarHBondContact O-N 3.19Å; F1205-Q1208 PolarHBondContact O-N 3.4Å; R1206-Q1208 PolarHBondContact O-N 2.67Å
1209	G	75.9	Confident	82.4	Confident	39 Å²	39	60.7 Å²	60.7	40%	0.402	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.8	9.1	171.6	0	0	0	0	0	116.3	F1205 R1206 L1211	F1205-G1209 PolarHBondContact O-N 3.16Å; R1206-G1209 PolarHBondContact O-N 3Å; G1209-L1211 PolarHBondContact O-N 3.5Å
1210	V	83.3	Confident	82.5	Confident	7 Å²	7	59.1 Å²	59.1	4%	0.042	31%	0.307	C	S	.	.			trans	-63.6	132	175.7	173.2	0	0	0	0	110.4	F1163 D1164 F1205 T1214 L1215	F1163-V1210 HydrophobicContact CB-CG2 3.79Å; D1164-V1210 WeakPolarHBondContact OD1-CA 3.26Å; D1164-V1210 WeakPolarHBondContact OD1-CG1 3.37Å; F1205-V1210 HydrophobicContact CB-CB 4.39Å; F1205-V1210 HydrophobicContact CB-CG2 3.96Å; F1205-V1210 HydrophobicContact CD1-CG2 3.82Å; F1205-V1210 HydrophobicContact CG-CG2 4.4Å; F1205-V1210 WeakPolarHBondContact O-CB 3.47Å; F1205-V1210 WeakPolarHBondContact O-CG2 2.99Å; F1205-V1210 PolarHBondContact O-N 2.94Å; V1210-T1214 HydrophobicContact CG1-CG2 4.05Å; V1210-L1215 HydrophobicContact CB-CD2 4.2Å; V1210-L1215 HydrophobicContact CB-CG 4.25Å; V1210-L1215 HydrophobicContact CG1-CD2 3.8Å; V1210-L1215 HydrophobicContact CG1-CG 3.74Å; V1210-L1215 WeakPolarHBondContact O-CD1 3.27Å
1211	L	81.8	Confident	82.4	Confident	114 Å²	114	58 Å²	58	60%	0.597	31%	0.305	S	S	*	.			trans	-60.5	141.4	-176.2	-67.9	170.9	0	0	0	112.3	G1209 G1213 T1214 L1215	G1209-L1211 PolarHBondContact O-N 3.5Å; L1211-G1213 PolarHBondContact O-N 3.4Å; L1211-G1213 VanDerWaalsContact O-N 3.15Å; L1211-T1214 WeakPolarHBondContact O-CA 3.24Å; L1211-T1214 WeakPolarHBondContact O-CB 3.46Å; L1211-T1214 PolarHBondContact O-N 3.36Å; L1211-L1215 PolarHBondContact O-N 2.87Å
1212	E	75.5	Confident	82.4	Confident	140 Å²	140	61.6 Å²	61.6	65%	0.654	33%	0.327	S	S	*	.	H	α-helix	trans	-56.9	-32.7	178	-73.7	-167	158.2	0	0	113	T1214 L1215 N1216	E1212-T1214 VanDerWaalsContact C-N 3.28Å; E1212-T1214 PolarHBondContact O-N 2.99Å; E1212-L1215 PolarHBondContact O-N 3.41Å; E1212-N1216 WeakPolarHBondContact O-CB 3.15Å; E1212-N1216 PolarHBondContact O-N 3.48Å; E1212-N1216 PolarHBondContact O-ND2 3.25Å
1213	G	74.8	Confident	82.4	Confident	67 Å²	67	60 Å²	60	69%	0.691	32%	0.321	S	S	*	.	H	α-helix	trans	-65.7	-27.5	175.1	0	0	0	0	0	114	L1211	L1211-G1213 PolarHBondContact O-N 3.4Å; L1211-G1213 VanDerWaalsContact O-N 3.15Å
1214	T	79.8	Confident	82.4	Confident	31 Å²	31	57.5 Å²	57.5	19%	0.19	31%	0.313	C	S	.	.	H	α-helix	trans	-85.1	-39.7	175.4	-56	0	0	0	0	110.9	D1164 Y1167 S1168 V1210 L1211 E1212 S1217	D1164-T1214 HydrophobicContact CB-CG2 4.36Å; Y1167-T1214 HydrophobicContact CD1-CG2 4.33Å; Y1167-T1214 WeakPolarHBondContact CE1-O 3.49Å; S1168-T1214 WeakPolarHBondContact OG-CG2 3.45Å; V1210-T1214 HydrophobicContact CG1-CG2 4.05Å; L1211-T1214 WeakPolarHBondContact O-CA 3.24Å; L1211-T1214 WeakPolarHBondContact O-CB 3.46Å; L1211-T1214 PolarHBondContact O-N 3.36Å; E1212-T1214 VanDerWaalsContact C-N 3.28Å; E1212-T1214 PolarHBondContact O-N 2.99Å; T1214-S1217 WeakPolarHBondContact O-CB 3.4Å; T1214-S1217 PolarHBondContact O-N 2.9Å
1215	L	81	Confident	82.4	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-61.6	-47.7	175.5	-70.5	170.8	0	0	0	111.7	Y1167 Y1202 F1205 R1206 V1210 L1211 E1212 S1217 Y1220	Y1167-L1215 HydrophobicContact CD1-CD2 4.29Å; Y1167-L1215 HydrophobicContact CD2-CD2 4.23Å; Y1167-L1215 HydrophobicContact CE1-CD2 4.01Å; Y1167-L1215 HydrophobicContact CE2-CD2 3.92Å; Y1167-L1215 HydrophobicContact CG-CD2 4.4Å; Y1167-L1215 PolarHBondContact OH-O 2.99Å; Y1202-L1215 HydrophobicContact CD2-CB 4.31Å; Y1202-L1215 HydrophobicContact CD2-CD2 4.33Å; Y1202-L1215 HydrophobicContact CE2-CB 3.69Å; Y1202-L1215 HydrophobicContact CE2-CD2 4.47Å; F1205-L1215 HydrophobicContact CB-CD2 4.25Å; R1206-L1215 HydrophobicContact CB-CD1 3.66Å; R1206-L1215 HydrophobicContact CG-CD1 3.8Å; V1210-L1215 HydrophobicContact CB-CD2 4.2Å; V1210-L1215 HydrophobicContact CB-CG 4.25Å; V1210-L1215 HydrophobicContact CG1-CD2 3.8Å; V1210-L1215 HydrophobicContact CG1-CG 3.74Å; V1210-L1215 WeakPolarHBondContact O-CD1 3.27Å; L1211-L1215 PolarHBondContact O-N 2.87Å; E1212-L1215 PolarHBondContact O-N 3.41Å; L1215-S1217 PolarHBondContact O-N 3.28Å; L1215-S1217 VanDerWaalsContact O-N 3.16Å; L1215-Y1220 WeakPolarHBondContact O-CB 3.4Å
1216	N	82.4	Confident	82.2	Confident	74 Å²	74	67.4 Å²	67.4	40%	0.396	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	45.3	177.9	-63.5	-43	0	0	0	112.1	Y1202 E1212	Y1202-N1216 PolarHBondContact OH-OD1 3.43Å; Y1202-N1216 VanDerWaalsContact OH-OD1 3.14Å; E1212-N1216 WeakPolarHBondContact O-CB 3.15Å; E1212-N1216 PolarHBondContact O-N 3.48Å; E1212-N1216 PolarHBondContact O-ND2 3.25Å
1217	S	85.4	Confident	82.1	Confident	23 Å²	23	61.7 Å²	61.7	16%	0.161	33%	0.328	C	S	.	.			trans	-67.3	152.4	176.7	67.9	0	0	0	0	111.4	T1214 L1215 T1219 Y1220 D1221	T1214-S1217 WeakPolarHBondContact O-CB 3.4Å; T1214-S1217 PolarHBondContact O-N 2.9Å; L1215-S1217 PolarHBondContact O-N 3.28Å; L1215-S1217 VanDerWaalsContact O-N 3.16Å; S1217-T1219 PolarHBondContact O-N 2.97Å; S1217-Y1220 WeakPolarHBondContact O-CA 3.17Å; S1217-Y1220 WeakPolarHBondContact O-CB 3.37Å; S1217-Y1220 PolarHBondContact O-N 3.03Å; S1217-Y1220 PolarHBondContact OG-N 3.3Å; S1217-Y1220 VanDerWaalsContact OG-N 3.15Å; S1217-D1221 PolarHBondContact O-N 2.92Å
1218	K	82.7	Confident	81.9	Confident	182 Å²	182	58.3 Å²	58.3	79%	0.791	31%	0.313	S	S	*	.	H	α-helix	trans	-53	-31.5	172.8	-66.8	-177.9	179.9	177.9	0	112.6	T1222	K1218-T1222 WeakPolarHBondContact O-CB 3.43Å; K1218-T1222 PolarHBondContact O-N 3.33Å; K1218-T1222 VanDerWaalsContact O-N 3.1Å; K1218-T1222 PolarHBondContact O-OG1 3.42Å
1219	T	84.1	Confident	81.9	Confident	47 Å²	47	61.2 Å²	61.2	29%	0.288	33%	0.332	S	S	.	.	H	α-helix	trans	-67.4	-46.4	175.8	-50.2	0	0	0	0	111.2	M1171 K1172 C1175 S1217 T1222 V1223	M1171-T1219 HydrophobicContact CB-CG2 4.5Å; K1172-T1219 HydrophobicContact CB-CG2 4.4Å; C1175-T1219 HydrophobicContact CB-CG2 3.56Å; S1217-T1219 PolarHBondContact O-N 2.97Å; T1219-T1222 PolarHBondContact O-N 3.05Å; T1219-V1223 WeakPolarHBondContact O-CG2 3.19Å; T1219-V1223 PolarHBondContact O-N 2.95Å
1220	Y	85.9	Confident	81.9	Confident	15 Å²	15	60 Å²	60	6%	0.059	32%	0.316	C	S	.	.	H	α-helix	trans	-61.1	-47.2	174.1	174.5	-100.7	0	0	0	111.4	Y1167 M1171 V1198 Y1202 L1215 S1217 T1222 V1223 H1224	Y1167-Y1220 VanDerWaalsContact OH-CD2 3.23Å; Y1167-Y1220 WeakPolarHBondContact OH-CD2 3.31Å; M1171-Y1220 HydrophobicContact SD-CD2 3.98Å; V1198-Y1220 HydrophobicContact CG1-CD2 4.25Å; V1198-Y1220 HydrophobicContact CG1-CE2 3.65Å; Y1202-Y1220 HydrophobicContact CD2-CD2 4.25Å; Y1202-Y1220 AromaticContact CD2-CE1 3.92Å; Y1202-Y1220 HydrophobicContact CD2-CE1 3.92Å; Y1202-Y1220 AromaticContact CD2-CE2 3.62Å; Y1202-Y1220 HydrophobicContact CD2-CE2 3.62Å; Y1202-Y1220 AromaticContact CD2-CZ 3.42Å; Y1202-Y1220 VanDerWaalsContact CD2-CZ 3.42Å; Y1202-Y1220 HydrophobicContact CE2-CD1 4.38Å; Y1202-Y1220 AromaticContact CE2-CE1 3.82Å; Y1202-Y1220 HydrophobicContact CE2-CE1 3.82Å; Y1202-Y1220 HydrophobicContact CE2-CE2 4.36Å; Y1202-Y1220 AromaticContact CE2-CZ 3.8Å; Y1202-Y1220 HydrophobicContact CG-CE2 4.3Å; L1215-Y1220 WeakPolarHBondContact O-CB 3.4Å; S1217-Y1220 WeakPolarHBondContact O-CA 3.17Å; S1217-Y1220 WeakPolarHBondContact O-CB 3.37Å; S1217-Y1220 PolarHBondContact O-N 3.03Å; S1217-Y1220 PolarHBondContact OG-N 3.3Å; S1217-Y1220 VanDerWaalsContact OG-N 3.15Å; Y1220-T1222 PolarHBondContact O-N 2.91Å; Y1220-V1223 PolarHBondContact O-N 3.36Å; Y1220-V1223 VanDerWaalsContact O-N 3.12Å; Y1220-H1224 HydrophobicContact CE1-CB 4.38Å; Y1220-H1224 AromaticContact CZ-CD2 3.97Å; Y1220-H1224 VanDerWaalsContact O-CB 3.28Å; Y1220-H1224 WeakPolarHBondContact O-CB 3.28Å; Y1220-H1224 PolarHBondContact O-N 3.39Å
1221	D	83.9	Confident	81.5	Confident	58 Å²	58	60.8 Å²	60.8	31%	0.31	32%	0.319	S	S	.	.	H	α-helix	trans	-56.6	-39	176.9	-77.3	-16.4	0	0	0	112.4	S1217 R1225	S1217-D1221 PolarHBondContact O-N 2.92Å; D1221-R1225 VanDerWaalsContact O-CB 3.31Å; D1221-R1225 WeakPolarHBondContact O-CB 3.16Å; D1221-R1225 WeakPolarHBondContact O-CG 3.47Å; D1221-R1225 PolarHBondContact O-N 2.83Å
1222	T	84.3	Confident	81.1	Confident	77 Å²	77	58.1 Å²	58.1	47%	0.472	31%	0.314	S	S	.	.	H	α-helix	trans	-67.5	-45.6	178.3	-57.2	0	0	0	0	111.1	K1218 T1219 Y1220 R1226	K1218-T1222 WeakPolarHBondContact O-CB 3.43Å; K1218-T1222 PolarHBondContact O-N 3.33Å; K1218-T1222 VanDerWaalsContact O-N 3.1Å; K1218-T1222 PolarHBondContact O-OG1 3.42Å; T1219-T1222 PolarHBondContact O-N 3.05Å; Y1220-T1222 PolarHBondContact O-N 2.91Å; T1222-R1226 WeakPolarHBondContact O-CB 3.35Å; T1222-R1226 PolarHBondContact O-N 3.12Å
1223	V	84.8	Confident	80.9	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.006	30%	0.302	C	S	.	.	H	α-helix	trans	-61.7	-48.3	174.5	170.9	0	0	0	0	110.7	I1174 C1175 L1178 V1198 T1219 Y1220 R1226 L1227	I1174-V1223 HydrophobicContact CG2-CG1 3.88Å; I1174-V1223 HydrophobicContact CG2-CG2 4.34Å; C1175-V1223 HydrophobicContact CB-CG2 3.46Å; C1175-V1223 VanDerWaalsContact CB-CG2 3.46Å; L1178-V1223 HydrophobicContact CD1-CB 4.36Å; L1178-V1223 HydrophobicContact CD1-CG1 3.85Å; L1178-V1223 HydrophobicContact CD1-CG2 4.22Å; V1198-V1223 HydrophobicContact CG1-CG1 4.42Å; V1198-V1223 HydrophobicContact CG2-CG1 4.02Å; T1219-V1223 WeakPolarHBondContact O-CG2 3.19Å; T1219-V1223 PolarHBondContact O-N 2.95Å; Y1220-V1223 PolarHBondContact O-N 3.36Å; Y1220-V1223 VanDerWaalsContact O-N 3.12Å; V1223-R1226 PolarHBondContact O-N 2.7Å; V1223-L1227 HydrophobicContact CG1-CD1 3.83Å; V1223-L1227 HydrophobicContact CG1-CG 4.38Å; V1223-L1227 WeakPolarHBondContact O-CG 3.32Å; V1223-L1227 PolarHBondContact O-N 3Å
1224	H	84.4	Confident	80.5	Confident	49 Å²	49	51.9 Å²	51.9	23%	0.227	27%	0.273	C	S	.	.	H	α-helix	trans	-58.8	-52.5	-179.6	-175.4	-72.1	0	0	0	110.8	Y1220 R1226 L1227 T1228 M1247	Y1220-H1224 HydrophobicContact CE1-CB 4.38Å; Y1220-H1224 AromaticContact CZ-CD2 3.97Å; Y1220-H1224 VanDerWaalsContact O-CB 3.28Å; Y1220-H1224 WeakPolarHBondContact O-CB 3.28Å; Y1220-H1224 PolarHBondContact O-N 3.39Å; H1224-R1226 PolarHBondContact O-N 3.18Å; H1224-L1227 PolarHBondContact O-N 2.93Å; H1224-T1228 PolarHBondContact CE1-OG1 2.61Å; H1224-T1228 PolarHBondContact ND1-OG1 3.49Å; H1224-T1228 PolarHBondContact O-N 3.41Å; H1224-T1228 PolarHBondContact O-OG1 2.81Å; H1224-M1247 HydrophobicContact CB-CE 4.15Å; H1224-M1247 WeakPolarHBondContact CD2-CE 3.38Å; H1224-M1247 WeakPolarHBondContact NE2-CE 3.4Å
1225	R	83.8	Confident	79.8	Confident	164 Å²	164	53.3 Å²	53.3	62%	0.619	28%	0.284	S	S	*	.	H	α-helix	trans	-58.9	-43.9	177.5	-72.4	173.9	-163.1	177.3	7.6	112.1	D1221 T1228 V1229	D1221-R1225 VanDerWaalsContact O-CB 3.31Å; D1221-R1225 WeakPolarHBondContact O-CB 3.16Å; D1221-R1225 WeakPolarHBondContact O-CG 3.47Å; D1221-R1225 PolarHBondContact O-N 2.83Å; R1225-T1228 PolarHBondContact O-N 2.95Å; R1225-V1229 VanDerWaalsContact O-CG2 3.28Å; R1225-V1229 WeakPolarHBondContact O-CG2 3.15Å; R1225-V1229 PolarHBondContact O-N 3.37Å
1226	R	83	Confident	78.8	Confident	56 Å²	56	59.6 Å²	59.6	21%	0.211	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-47	177.2	178.1	59.6	-175.7	-132.5	-1.7	111.1	R1181 L1182 L1184 T1222 V1223 H1224 T1228 V1229 E1230	R1181-R1226 PolarHBondContact O-NH2 2.86Å; L1182-R1226 PolarHBondContact O-NH1 3.23Å; L1182-R1226 PolarHBondContact O-NH2 3.13Å; L1184-R1226 PolarHBondContact O-NH2 3.48Å; T1222-R1226 WeakPolarHBondContact O-CB 3.35Å; T1222-R1226 PolarHBondContact O-N 3.12Å; V1223-R1226 PolarHBondContact O-N 2.7Å; H1224-R1226 PolarHBondContact O-N 3.18Å; R1226-T1228 PolarHBondContact O-N 3.48Å; R1226-V1229 PolarHBondContact O-N 3.14Å; R1226-E1230 HydrophobicContact CG-CG 4.45Å; R1226-E1230 IonicContact CZ-OE1 3.06Å; R1226-E1230 IonicContact NE-OE1 2.94Å; R1226-E1230 PolarHBondContact NE-OE1 3.37Å; R1226-E1230 IonicContact NH2-OE1 3.02Å; R1226-E1230 PolarHBondContact NH2-OE1 2.72Å; R1226-E1230 WeakPolarHBondContact O-CB 3.28Å; R1226-E1230 VanDerWaalsContact O-CG 3.24Å; R1226-E1230 WeakPolarHBondContact O-CG 3.4Å; R1226-E1230 PolarHBondContact O-N 3.08Å
1227	L	81.9	Confident	77.6	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-66.1	-36.6	179.2	-66.7	176.1	0	0	0	112.5	L1178 L1186 L1191 L1194 I1195 V1198 V1223 H1224 E1230 E1231 M1247	L1178-L1227 HydrophobicContact CD1-CD2 4.29Å; L1178-L1227 HydrophobicContact CD1-CG 4.32Å; L1178-L1227 HydrophobicContact CD2-CD2 4.26Å; L1186-L1227 HydrophobicContact CD1-CD2 4.21Å; L1191-L1227 HydrophobicContact CD1-CD2 3.91Å; L1194-L1227 HydrophobicContact CB-CD1 4.45Å; L1194-L1227 HydrophobicContact CB-CD2 4.13Å; I1195-L1227 HydrophobicContact CG1-CB 4.36Å; V1198-L1227 HydrophobicContact CB-CD1 4.34Å; V1198-L1227 HydrophobicContact CG2-CD1 3.98Å; V1223-L1227 HydrophobicContact CG1-CD1 3.83Å; V1223-L1227 HydrophobicContact CG1-CG 4.38Å; V1223-L1227 WeakPolarHBondContact O-CG 3.32Å; V1223-L1227 PolarHBondContact O-N 3Å; H1224-L1227 PolarHBondContact O-N 2.93Å; L1227-E1230 PolarHBondContact O-N 3.18Å; L1227-E1231 VanDerWaalsContact O-CB 3.29Å; L1227-E1231 WeakPolarHBondContact O-CB 3.46Å; L1227-E1231 PolarHBondContact O-N 2.67Å; L1227-M1247 HydrophobicContact CB-CE 4.31Å; L1227-M1247 HydrophobicContact CB-CG 4.13Å; L1227-M1247 HydrophobicContact CB-SD 4.08Å; L1227-M1247 HydrophobicContact CD1-SD 4.29Å
1228	T	80.4	Confident	76	Confident	52 Å²	52	64.3 Å²	64.3	32%	0.319	35%	0.348	S	S	.	.	H	α-helix	trans	-65.6	-40.8	174.7	-53.6	0	0	0	0	112.2	H1224 R1225 R1226 E1231 A1232	H1224-T1228 PolarHBondContact CE1-OG1 2.61Å; H1224-T1228 PolarHBondContact ND1-OG1 3.49Å; H1224-T1228 PolarHBondContact O-N 3.41Å; H1224-T1228 PolarHBondContact O-OG1 2.81Å; R1225-T1228 PolarHBondContact O-N 2.95Å; R1226-T1228 PolarHBondContact O-N 3.48Å; T1228-E1231 PolarHBondContact O-N 2.85Å; T1228-A1232 WeakPolarHBondContact O-CB 3.29Å; T1228-A1232 PolarHBondContact O-N 2.87Å
1229	V	81.1	Confident	74.4	Confident	88 Å²	88	60 Å²	60	53%	0.533	36%	0.355	S	S	.	.	H	α-helix	trans	-67.3	-42.3	176.9	171.3	0	0	0	0	110.9	R1225 R1226 A1232 T1233	R1225-V1229 VanDerWaalsContact O-CG2 3.28Å; R1225-V1229 WeakPolarHBondContact O-CG2 3.15Å; R1225-V1229 PolarHBondContact O-N 3.37Å; R1226-V1229 PolarHBondContact O-N 3.14Å; V1229-A1232 PolarHBondContact O-N 3.2Å; V1229-T1233 WeakPolarHBondContact O-CB 3.13Å; V1229-T1233 PolarHBondContact O-N 3.5Å; V1229-T1233 PolarHBondContact O-OG1 2.78Å
1230	E	75.4	Confident	72.9	Confident	15 Å²	15	61 Å²	61	7%	0.07	38%	0.375	C	S	.	.	H	α-helix	trans	-64.9	-39.5	175.4	-71.1	-74.4	174.6	0	0	112.1	L1186 L1191 R1226 L1227 T1233 A1234	L1186-E1230 HydrophobicContact CD1-CG 4.12Å; L1186-E1230 HydrophobicContact CG-CG 4.49Å; L1191-E1230 HydrophobicContact CD1-CB 3.77Å; L1191-E1230 HydrophobicContact CD2-CB 4.28Å; R1226-E1230 HydrophobicContact CG-CG 4.45Å; R1226-E1230 IonicContact CZ-OE1 3.06Å; R1226-E1230 IonicContact NE-OE1 2.94Å; R1226-E1230 PolarHBondContact NE-OE1 3.37Å; R1226-E1230 IonicContact NH2-OE1 3.02Å; R1226-E1230 PolarHBondContact NH2-OE1 2.72Å; R1226-E1230 WeakPolarHBondContact O-CB 3.28Å; R1226-E1230 VanDerWaalsContact O-CG 3.24Å; R1226-E1230 WeakPolarHBondContact O-CG 3.4Å; R1226-E1230 PolarHBondContact O-N 3.08Å; L1227-E1230 PolarHBondContact O-N 3.18Å; E1230-T1233 PolarHBondContact O-N 3.45Å; E1230-A1234 VanDerWaalsContact O-CB 3.28Å; E1230-A1234 WeakPolarHBondContact O-CB 3.33Å; E1230-A1234 PolarHBondContact O-N 3.46Å
1231	E	75.8	Confident	71.2	Confident	22 Å²	22	61.7 Å²	61.7	10%	0.103	39%	0.386	C	S	.	.	H	α-helix	trans	-62.1	-47.5	173.1	-176.7	-171.5	171.8	0	0	112	I1195 L1227 T1228 T1233 A1234 S1235 L1242 T1246 M1247	I1195-E1231 HydrophobicContact CD1-CB 4.32Å; I1195-E1231 HydrophobicContact CD1-CG 4.47Å; L1227-E1231 VanDerWaalsContact O-CB 3.29Å; L1227-E1231 WeakPolarHBondContact O-CB 3.46Å; L1227-E1231 PolarHBondContact O-N 2.67Å; T1228-E1231 PolarHBondContact O-N 2.85Å; E1231-T1233 VanDerWaalsContact C-N 3.28Å; E1231-T1233 PolarHBondContact O-N 3.39Å; E1231-A1234 PolarHBondContact O-N 3.19Å; E1231-S1235 VanDerWaalsContact O-CB 3.31Å; E1231-S1235 WeakPolarHBondContact O-CB 3.29Å; E1231-S1235 PolarHBondContact O-N 3.48Å; E1231-S1235 PolarHBondContact O-OG 3.38Å; E1231-L1242 HydrophobicContact CG-CD1 4.4Å; E1231-T1246 WeakPolarHBondContact OE1-CA 3.13Å; E1231-T1246 WeakPolarHBondContact OE1-CB 3.21Å; E1231-T1246 PolarHBondContact OE1-OG1 3.31Å; E1231-M1247 PolarHBondContact OE1-N 2.69Å; E1231-M1247 WeakPolarHBondContact OE2-CB 3.32Å; E1231-M1247 WeakPolarHBondContact OE2-CG 3.12Å; E1231-M1247 PolarHBondContact OE2-N 3.4Å
1232	A	72	Confident	69.8	Low	59 Å²	59	60.9 Å²	60.9	49%	0.488	38%	0.382	S	S	.	.	H	α-helix	trans	-61.6	-40.1	177.1	0	0	0	0	0	111.2	T1228 V1229 V1236	T1228-A1232 WeakPolarHBondContact O-CB 3.29Å; T1228-A1232 PolarHBondContact O-N 2.87Å; V1229-A1232 PolarHBondContact O-N 3.2Å; A1232-V1236 WeakPolarHBondContact O-CG2 3.5Å; A1232-V1236 PolarHBondContact O-N 3.12Å
1233	T	71.6	Confident	68.3	Low	67 Å²	67	66 Å²	66	41%	0.411	40%	0.4	S	S	.	.	H	α-helix	trans	-66.9	-46.6	177.9	-54.2	0	0	0	0	111.4	V1229 E1230 E1231 S1235 V1236 S1237	V1229-T1233 WeakPolarHBondContact O-CB 3.13Å; V1229-T1233 PolarHBondContact O-N 3.5Å; V1229-T1233 PolarHBondContact O-OG1 2.78Å; E1230-T1233 PolarHBondContact O-N 3.45Å; E1231-T1233 VanDerWaalsContact C-N 3.28Å; E1231-T1233 PolarHBondContact O-N 3.39Å; T1233-S1235 PolarHBondContact O-N 2.8Å; T1233-V1236 PolarHBondContact O-N 2.68Å; T1233-S1237 PolarHBondContact O-N 3.05Å; T1233-S1237 PolarHBondContact O-OG 3.36Å
1234	A	66.3	Low	67	Low	9 Å²	9	69.7 Å²	69.7	7%	0.074	44%	0.439	C	S	.	.	H	α-helix	trans	-66.5	-33	178.4	0	0	0	0	0	113.4	L1191 E1230 E1231 V1236 S1237 E1238 L1242	L1191-A1234 HydrophobicContact CD2-CB 3.94Å; E1230-A1234 VanDerWaalsContact O-CB 3.28Å; E1230-A1234 WeakPolarHBondContact O-CB 3.33Å; E1230-A1234 PolarHBondContact O-N 3.46Å; E1231-A1234 PolarHBondContact O-N 3.19Å; A1234-V1236 VanDerWaalsContact C-N 3.29Å; A1234-V1236 PolarHBondContact O-N 3.43Å; A1234-S1237 WeakPolarHBondContact CA-OG 3.27Å; A1234-S1237 PolarHBondContact O-N 3.16Å; A1234-S1237 PolarHBondContact O-OG 3.45Å; A1234-E1238 PolarHBondContact O-N 3.08Å; A1234-L1242 HydrophobicContact CB-CD1 4.22Å
1235	S	64.7	Low	65.6	Low	61 Å²	61	69.1 Å²	69.1	43%	0.427	44%	0.437	S	S	.	.	H	α-helix	trans	-68.6	-26.3	177.6	-59	0	0	0	0	113.1	E1231 T1233 L1242	E1231-S1235 VanDerWaalsContact O-CB 3.31Å; E1231-S1235 WeakPolarHBondContact O-CB 3.29Å; E1231-S1235 PolarHBondContact O-N 3.48Å; E1231-S1235 PolarHBondContact O-OG 3.38Å; T1233-S1235 PolarHBondContact O-N 2.8Å; S1235-L1242 VanDerWaalsContact OG-CD1 3.27Å; S1235-L1242 WeakPolarHBondContact OG-CD1 3.49Å
1236	V	61.3	Low	64.7	Low	133 Å²	133	63.4 Å²	63.4	81%	0.806	42%	0.42	S	S	*	.	H	α-helix	trans	-85.9	-30.2	178.4	175.5	0	0	0	0	111.7	A1232 T1233 A1234	A1232-V1236 WeakPolarHBondContact O-CG2 3.5Å; A1232-V1236 PolarHBondContact O-N 3.12Å; T1233-V1236 PolarHBondContact O-N 2.68Å; A1234-V1236 VanDerWaalsContact C-N 3.29Å; A1234-V1236 PolarHBondContact O-N 3.43Å
1237	S	56.6	Low	63.9	Low	79 Å²	79	60.9 Å²	60.9	55%	0.552	41%	0.411	S	S	*	.	H	α-helix	trans	-83.1	-30.6	-176.6	55.6	0	0	0	0	115.3	T1233 A1234	T1233-S1237 PolarHBondContact O-N 3.05Å; T1233-S1237 PolarHBondContact O-OG 3.36Å; A1234-S1237 WeakPolarHBondContact CA-OG 3.27Å; A1234-S1237 PolarHBondContact O-N 3.16Å; A1234-S1237 PolarHBondContact O-OG 3.45Å
1238	E	52.6	Low	62.9	Low	117 Å²	117	68.7 Å²	68.7	55%	0.547	45%	0.445	S	S	.	.	S	Bend	trans	-132.3	100.3	176.5	-76.1	-166.4	156.6	0	0	111	I1188 A1234 G1240	I1188-E1238 WeakPolarHBondContact CD1-OE2 3.31Å; A1234-E1238 PolarHBondContact O-N 3.08Å; E1238-G1240 PolarHBondContact O-N 2.91Å
1239	G	49.2	Very low	61.7	Low	91 Å²	91	71.5 Å²	71.5	94%	0.938	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	90.2	174.7	0	0	0	0	0	112.1
1240	G	52	Low	60.1	Low	69 Å²	69	70.9 Å²	70.9	71%	0.711	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	140.5	-3.9	169.6	0	0	0	0	0	117	E1238	E1238-G1240 PolarHBondContact O-N 2.91Å
1241	G	49.9	Very low	58.8	Low	28 Å²	28	75.4 Å²	75.4	29%	0.289	48%	0.483	S	S	.	.			trans	-84.4	-15.7	-167.9	0	0	0	0	0	118.1	K1192	K1192-G1241 WeakPolarHBondContact CE-O 3.28Å; K1192-G1241 PolarHBondContact NZ-O 2.76Å
1242	L	54.3	Low	57.3	Low	41 Å²	41	82.8 Å²	82.8	22%	0.215	52%	0.517	C	S	.	.			trans	-110.6	39.7	-167.9	-81.1	157.1	0	0	0	114.7	K1192 E1231 A1234 S1235 G1244	K1192-L1242 HydrophobicContact CG-CD2 4.03Å; E1231-L1242 HydrophobicContact CG-CD1 4.4Å; A1234-L1242 HydrophobicContact CB-CD1 4.22Å; S1235-L1242 VanDerWaalsContact OG-CD1 3.27Å; S1235-L1242 WeakPolarHBondContact OG-CD1 3.49Å; L1242-G1244 PolarHBondContact O-N 3.39Å; L1242-G1244 VanDerWaalsContact O-N 3.12Å
1243	Q	52.6	Low	55.7	Low	184 Å²	184	88.8 Å²	88.8	86%	0.86	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	114.6	174.2	-91.4	178.4	-7.7	0	0	112.1
1244	G	57.8	Low	54	Low	79 Å²	79	94.5 Å²	94.5	81%	0.814	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	99	0.9	159.2	0	0	0	0	0	118.3	L1242	L1242-G1244 PolarHBondContact O-N 3.39Å; L1242-G1244 VanDerWaalsContact O-N 3.12Å
1245	I	56	Low	52.5	Low	38 Å²	38	103.5 Å²	103.5	20%	0.195	60%	0.598	C	S	.	*			trans	-140.2	103.5	178	-58.1	174.9	0	0	0	108.9	I1195 K1196	I1195-I1245 HydrophobicContact CB-CG2 4.03Å; I1195-I1245 HydrophobicContact CG2-CG2 3.43Å; I1195-I1245 VanDerWaalsContact CG2-CG2 3.43Å; K1196-I1245 HydrophobicContact CB-CD1 4.43Å; K1196-I1245 HydrophobicContact CD-CD1 4.1Å
1246	T	64.9	Low	51	Low	43 Å²	43	107.8 Å²	107.8	26%	0.264	65%	0.651	S	S	.	*			trans	-117.8	151.6	174.8	179.1	0	0	0	0	110.9	K1199 E1231 K1248	K1199-T1246 WeakPolarHBondContact CD-O 3.44Å; K1199-T1246 WeakPolarHBondContact CE-O 3.28Å; K1199-T1246 PolarHBondContact NZ-O 2.78Å; E1231-T1246 WeakPolarHBondContact OE1-CA 3.13Å; E1231-T1246 WeakPolarHBondContact OE1-CB 3.21Å; E1231-T1246 PolarHBondContact OE1-OG1 3.31Å; T1246-K1248 HydrophobicContact CG2-CB 4.13Å; T1246-K1248 PolarHBondContact OG1-N 3.31Å
1247	M	65.3	Low	50.4	Low	3 Å²	3	106.5 Å²	106.5	2%	0.015	64%	0.643	C	S	.	*	S	Bend	trans	-70.1	-17.9	169.1	-73.9	-66	-62	0	0	113.1	I1195 K1199 H1224 L1227 E1231	I1195-M1247 HydrophobicContact CB-CG 4.46Å; I1195-M1247 HydrophobicContact CB-SD 3.96Å; I1195-M1247 HydrophobicContact CD1-CG 3.96Å; I1195-M1247 HydrophobicContact CG1-CG 3.76Å; I1195-M1247 HydrophobicContact CG1-SD 3.68Å; I1195-M1247 HydrophobicContact CG2-CG 4.01Å; I1195-M1247 HydrophobicContact CG2-SD 3.6Å; I1195-M1247 VanDerWaalsContact CG2-SD 3.6Å; K1199-M1247 HydrophobicContact CD-SD 4.44Å; K1199-M1247 HydrophobicContact CG-SD 4.23Å; H1224-M1247 HydrophobicContact CB-CE 4.15Å; H1224-M1247 WeakPolarHBondContact CD2-CE 3.38Å; H1224-M1247 WeakPolarHBondContact NE2-CE 3.4Å; L1227-M1247 HydrophobicContact CB-CE 4.31Å; L1227-M1247 HydrophobicContact CB-CG 4.13Å; L1227-M1247 HydrophobicContact CB-SD 4.08Å; L1227-M1247 HydrophobicContact CD1-SD 4.29Å; E1231-M1247 PolarHBondContact OE1-N 2.69Å; E1231-M1247 WeakPolarHBondContact OE2-CB 3.32Å; E1231-M1247 WeakPolarHBondContact OE2-CG 3.12Å; E1231-M1247 PolarHBondContact OE2-N 3.4Å
1248	K	60.8	Low	50.1	Low	164 Å²	164	107.9 Å²	107.9	71%	0.713	65%	0.648	S	S	*	*	S	Bend	trans	-65.1	136.5	174.7	-72.9	-174.6	174.9	-175.7	0	111	K1199 T1246 S1250	K1199-K1248 PolarHBondContact NZ-O 3.37Å; T1246-K1248 HydrophobicContact CG2-CB 4.13Å; T1246-K1248 PolarHBondContact OG1-N 3.31Å; K1248-S1250 PolarHBondContact O-N 3.02Å; K1248-S1250 PolarHBondContact O-OG 3.48Å
1249	D	55.2	Low	50	Low	111 Å²	111	107.4 Å²	107.4	59%	0.594	65%	0.654	S	S	*	*			trans	-69.8	110.9	174	-74.9	-34.1	0	0	0	108.9	D1251	D1249-D1251 PolarHBondContact O-N 3.45Å
1250	S	48.7	Very low	50	Low	76 Å²	76	108.4 Å²	108.4	53%	0.531	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.6	6.9	179.2	-42.7	0	0	0	0	112.2	K1248	K1248-S1250 PolarHBondContact O-N 3.02Å; K1248-S1250 PolarHBondContact O-OG 3.48Å
1251	D	47.3	Very low	49.9	Very low	110 Å²	110	110.9 Å²	110.9	59%	0.588	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	1.9	-176.7	-68.4	-3.2	0	0	0	112.1	R1203 D1249	R1203-D1251 IonicContact CZ-OD2 3.9Å; R1203-D1251 IonicContact NH1-OD2 3Å; R1203-D1251 PolarHBondContact NH1-OD2 2.85Å; D1249-D1251 PolarHBondContact O-N 3.45Å
1252	E	43.5	Very low	49.9	Very low	177 Å²	177	116.4 Å²	116.4	83%	0.827	66%	0.655	S	S	*	*	S	Bend	trans	-96.5	4.3	172.7	-74.8	-166.5	167.6	0	0	114.1
1253	E	38.6	Very low	49.6	Very low	184 Å²	184	121.8 Å²	121.8	86%	0.86	69%	0.687	S	S	*	*	S	Bend	trans	-112.3	13.4	179.9	-75.2	-173.2	167.1	0	0	114.6
1254	E	36.9	Very low	49.4	Very low	187 Å²	187	117 Å²	117	87%	0.874	67%	0.673	S	S	*	*	S	Bend	trans	-116	18.1	176.2	-93.1	-170.5	173.1	0	0	115.3
1255	E	34.8	Very low	48.7	Very low	199 Å²	199	120.2 Å²	120.2	93%	0.93	66%	0.661	S	S	*	*			trans	-120.1	82.2	158.7	-79	-167.6	167.7	0	0	110.2
1256	G	32.1	Very low	48	Very low	150 Å²	150	127.6 Å²	127.6	100%	1.546	70%	0.704	S	S	*	*			trans	-150.8	0	169.4	0	0	0	0	0	110.6

Retrieved 1,256 of 1,256 residues in 2222.8 ms (Link to these results)

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