A0A087XLJ0_POEFO Loading...

Solute carrier family 8 member 1b

AlphaFold DB , UniProt , Accession A0A087XLJ0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 946 aa.

						>A0A087XLJ0_POEFO|A0A087XLJ0
MGFRCHSSALSPVLRLAVVTVILLLKPRSALAGTAPEHSLGSSVSAVSTNKTECSKPEQCTNGVLLPVWEPRNPSFGDKVARATVYFVALVYMFLGVSIIADRFMASIEVITSQEKEITIKKPNGETTTTTVRIWNETVSNLTLMALGSSAPEILLSVIEIIGHGFEAGTLGPSTIVGSAAFNMFVIIGLCVYVVPDGETRKVKHLRVFFVTATWSIFAYIWLYLILSVISPGVVQVWEGLLTFFFFPICVVFAWVADRRLLFYKYVYKRYRTGKQRGMIIETEGDRPLPSKVDIEMDGKMLNSHGVDFLDGPLGLDIDEKDLDEEETRRDMAKILKELKQKHPDKEVEQLIELANYQVLSQQQKSRAFYRCQATRLMTGAGNILKKHAADQARKAVSMHEVRSDAGDNDPVSKIFFEPGSYQCLENCGTVAVNVVRRGGDLGKTVSVEYRTEDGTANAGSDYEFTEGVVVFKPGETMKEIRVGIIDDDIFEEDENFLIHLSNVKVLTSEGEEPEENESANHVDSVACVGIPSTATVTIFDDDHAGIFTFEEPVCHVSESVGTMEVKVLRTSGARGVVMLPYKTVEGTARGNGEDFEDAHGVLEFQNDEILKTITVRILDREEYSKESSFFIVLETPEWRRNRKEQTEEKPKAEGEEEEPLTGKDEEERRIAEMGRPMLGDHVKLEVIIEESYEFKNTVDKLIKKTNLALLVGTNSWRDQFIEAITVSAGEDDDDEECGEEKLPSCFDYVMHFLTVFWKVLFAFVPPTDYWSGWACFVVSICMIGLLTAVIGDLASHFGCTVGLKDSVTAVVFVALGTSVPDTFASKVAAIQDQYADASIGNVTGSNAVNVFLGIGVAWSIAAIYHNSKGHEFKVDPGTLAFSVTLFTIFAFICVATLMYRRRPEIGGELGGPRTAKVLTTMLFFSLWLLYILFSSLEAYCHIQGF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.5	Very low	28.4	Very low	253 Å²	253	145.4 Å²	145.4	100%	1.246	82%	0.816	S	S	*	*				0	104.8	0	-85.1	159.8	154.5	0	0	106.7
2	G	31.7	Very low	29.2	Very low	66 Å²	66	141.7 Å²	141.7	68%	0.68	80%	0.802	S	S	*	*			cis	120.4	66.8	10.6	0	0	0	0	0	112
3	F	23.2	Very low	30	Very low	200 Å²	200	138.6 Å²	138.6	88%	0.877	79%	0.788	S	S	*	*			trans	-153.3	95.7	164.4	-92.2	-83	0	0	0	108.1
4	R	23.6	Very low	30.6	Very low	233 Å²	233	136.1 Å²	136.1	88%	0.879	77%	0.77	S	S	*	*				70.1	88.8	90.1	-81.6	-171.5	179.2	-179.9	1.6	114.2
5	C	24.9	Very low	31.3	Very low	136 Å²	136	140.3 Å²	140.3	92%	0.919	77%	0.769	S	S	*	*			trans	-82.3	122.7	158.8	-119.4	0	0	0	0	109.2	S7	C5-S7 PolarHBondContact O-N 3.01Å
6	H	26	Very low	31.5	Very low	194 Å²	194	138.9 Å²	138.9	90%	0.898	76%	0.76	S	S	*	*			trans	-80.6	101.5	170.4	-100.6	-48.2	0	0	0	109.4
7	S	28.1	Very low	32.2	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	74%	0.739	S	S	*	*			trans	-74	128.9	160.1	177.7	0	0	0	0	108.5	C5 A9	C5-S7 PolarHBondContact O-N 3.01Å; S7-A9 PolarHBondContact O-N 3.44Å
8	S	29	Very low	32.7	Very low	116 Å²	116	130.8 Å²	130.8	81%	0.811	73%	0.725	S	S	*	*			trans	-61.5	103.8	178.1	37.4	0	0	0	0	110.5	L10	S8-L10 PolarHBondContact O-N 2.81Å; S8-L10 VanDerWaalsContact O-N 3.16Å
9	A	28.8	Very low	33.4	Very low	88 Å²	88	127.9 Å²	127.9	73%	0.727	71%	0.712	S	S	*	*			trans	-65.5	109	177.4	0	0	0	0	0	110.9	S7 S11	S7-A9 PolarHBondContact O-N 3.44Å; A9-S11 PolarHBondContact O-N 2.84Å
10	L	28.9	Very low	33.6	Very low	145 Å²	145	124.9 Å²	124.9	76%	0.759	70%	0.696	S	S	*	*			trans	-54.8	121.6	151.3	-108.1	94.3	0	0	0	107.6	S8 L14	S8-L10 PolarHBondContact O-N 2.81Å; S8-L10 VanDerWaalsContact O-N 3.16Å; L10-L14 HydrophobicContact CD2-CD2 4.11Å
11	S	37.1	Very low	34	Very low	60 Å²	60	123 Å²	123	42%	0.42	69%	0.688	S	S	.	*			trans	-50	134.4	-168.8	174.2	0	0	0	0	113.4	A9 V13 L14	A9-S11 PolarHBondContact O-N 2.84Å; S11-V13 PolarHBondContact O-N 2.9Å; S11-V13 VanDerWaalsContact OG-CB 3.26Å; S11-V13 WeakPolarHBondContact OG-CB 3.5Å; S11-V13 VanDerWaalsContact OG-CG2 3.27Å; S11-V13 WeakPolarHBondContact OG-CG2 3.44Å; S11-V13 PolarHBondContact OG-N 3.36Å; S11-V13 VanDerWaalsContact OG-N 3.16Å; S11-L14 PolarHBondContact O-N 2.84Å
12	P	37.5	Very low	34.5	Very low	101 Å²	101	116.4 Å²	116.4	66%	0.656	66%	0.657	S	S	*	*	H	α-helix	trans	-58.7	-14.9	172.1	24.2	-32.5	0	0	0	112.8	L14 L16	P12-L14 VanDerWaalsContact C-N 3.35Å; P12-L16 VanDerWaalsContact O-CB 3.29Å; P12-L16 WeakPolarHBondContact O-CB 2.93Å; P12-L16 PolarHBondContact O-N 2.85Å
13	V	40.3	Very low	34.6	Very low	102 Å²	102	118.4 Å²	118.4	62%	0.618	65%	0.651	S	S	*	*	H	α-helix	trans	-65.8	-34.3	174.5	-178.7	0	0	0	0	112	S11 L16 A17	S11-V13 PolarHBondContact O-N 2.9Å; S11-V13 VanDerWaalsContact OG-CB 3.26Å; S11-V13 WeakPolarHBondContact OG-CB 3.5Å; S11-V13 VanDerWaalsContact OG-CG2 3.27Å; S11-V13 WeakPolarHBondContact OG-CG2 3.44Å; S11-V13 PolarHBondContact OG-N 3.36Å; S11-V13 VanDerWaalsContact OG-N 3.16Å; V13-L16 PolarHBondContact O-N 2.83Å; V13-A17 VanDerWaalsContact O-CB 3.28Å; V13-A17 WeakPolarHBondContact O-CB 3.43Å; V13-A17 PolarHBondContact O-N 2.95Å
14	L	37.6	Very low	35.3	Very low	103 Å²	103	115.6 Å²	115.6	54%	0.539	65%	0.645	S	S	.	*	H	α-helix	trans	-74.7	-38.8	180	-166.2	71.8	0	0	0	111.4	L10 S11 P12 A17 V18	L10-L14 HydrophobicContact CD2-CD2 4.11Å; S11-L14 PolarHBondContact O-N 2.84Å; P12-L14 VanDerWaalsContact C-N 3.35Å; L14-A17 PolarHBondContact O-N 3.14Å; L14-V18 VanDerWaalsContact O-CG2 3.3Å; L14-V18 WeakPolarHBondContact O-CG2 3.46Å; L14-V18 PolarHBondContact O-N 3.33Å
15	R	40.8	Very low	35.7	Very low	200 Å²	200	110.9 Å²	110.9	76%	0.755	64%	0.636	S	S	*	*	H	α-helix	trans	-67.1	-38.6	172.1	-69	-171.7	-179.4	-154.1	0.2	111.4	V19	R15-V19 WeakPolarHBondContact O-CB 3.19Å; R15-V19 WeakPolarHBondContact O-CG2 3.41Å; R15-V19 PolarHBondContact O-N 3.29Å
16	L	35.7	Very low	35.9	Very low	118 Å²	118	112.3 Å²	112.3	62%	0.618	63%	0.627	S	S	*	*	H	α-helix	trans	-67.4	-39.2	175.7	-155.5	77.5	0	0	0	111.3	P12 V13 V19 T20	P12-L16 VanDerWaalsContact O-CB 3.29Å; P12-L16 WeakPolarHBondContact O-CB 2.93Å; P12-L16 PolarHBondContact O-N 2.85Å; V13-L16 PolarHBondContact O-N 2.83Å; L16-V19 PolarHBondContact O-N 3.19Å; L16-T20 VanDerWaalsContact O-CB 3.25Å; L16-T20 WeakPolarHBondContact O-CB 3.24Å; L16-T20 PolarHBondContact O-N 2.8Å; L16-T20 PolarHBondContact O-OG1 2.79Å
17	A	42.6	Very low	36.2	Very low	48 Å²	48	108.8 Å²	108.8	40%	0.397	62%	0.621	S	S	.	*	H	α-helix	trans	-64	-44.8	176.2	0	0	0	0	0	111.9	V13 L14 T20 V21	V13-A17 VanDerWaalsContact O-CB 3.28Å; V13-A17 WeakPolarHBondContact O-CB 3.43Å; V13-A17 PolarHBondContact O-N 2.95Å; L14-A17 PolarHBondContact O-N 3.14Å; A17-T20 PolarHBondContact O-N 2.78Å; A17-V21 VanDerWaalsContact O-CG2 3.28Å; A17-V21 WeakPolarHBondContact O-CG2 3.39Å; A17-V21 PolarHBondContact O-N 2.84Å
18	V	41.8	Very low	36.3	Very low	83 Å²	83	115.4 Å²	115.4	50%	0.503	63%	0.63	S	S	.	*	H	α-helix	trans	-65.9	-41.8	176.9	174.1	0	0	0	0	111.3	L14 T20 V21 I22	L14-V18 VanDerWaalsContact O-CG2 3.3Å; L14-V18 WeakPolarHBondContact O-CG2 3.46Å; L14-V18 PolarHBondContact O-N 3.33Å; V18-T20 VanDerWaalsContact C-N 3.34Å; V18-T20 PolarHBondContact O-N 3.07Å; V18-V21 PolarHBondContact O-N 3.03Å; V18-I22 HydrophobicContact CG1-CD1 3.79Å; V18-I22 WeakPolarHBondContact O-CB 3.47Å; V18-I22 WeakPolarHBondContact O-CD1 3.46Å; V18-I22 WeakPolarHBondContact O-CG1 3.44Å; V18-I22 PolarHBondContact O-N 3.01Å
19	V	45.6	Very low	36.3	Very low	76 Å²	76	115.2 Å²	115.2	46%	0.461	63%	0.628	S	S	.	*	H	α-helix	trans	-68.5	-32.9	176.3	171.5	0	0	0	0	111.9	R15 L16 I22 L23	R15-V19 WeakPolarHBondContact O-CB 3.19Å; R15-V19 WeakPolarHBondContact O-CG2 3.41Å; R15-V19 PolarHBondContact O-N 3.29Å; L16-V19 PolarHBondContact O-N 3.19Å; V19-I22 PolarHBondContact O-N 2.85Å; V19-L23 HydrophobicContact CG1-CD1 3.75Å; V19-L23 HydrophobicContact CG1-CG 4.44Å; V19-L23 VanDerWaalsContact O-CB 3.29Å; V19-L23 WeakPolarHBondContact O-CB 3.49Å; V19-L23 WeakPolarHBondContact O-CG 3.35Å; V19-L23 PolarHBondContact O-N 3.32Å
20	T	38.2	Very low	36.3	Very low	67 Å²	67	115.7 Å²	115.7	41%	0.411	63%	0.632	S	S	.	*	H	α-helix	trans	-72.7	-37	176.9	-51	0	0	0	0	111.3	L16 A17 V18 L23 L24	L16-T20 VanDerWaalsContact O-CB 3.25Å; L16-T20 WeakPolarHBondContact O-CB 3.24Å; L16-T20 PolarHBondContact O-N 2.8Å; L16-T20 PolarHBondContact O-OG1 2.79Å; A17-T20 PolarHBondContact O-N 2.78Å; V18-T20 VanDerWaalsContact C-N 3.34Å; V18-T20 PolarHBondContact O-N 3.07Å; T20-L23 PolarHBondContact O-N 3.02Å; T20-L24 HydrophobicContact CG2-CD1 4.09Å; T20-L24 WeakPolarHBondContact O-CB 3.22Å; T20-L24 WeakPolarHBondContact O-CD1 3.08Å; T20-L24 VanDerWaalsContact O-CG 3.3Å; T20-L24 WeakPolarHBondContact O-CG 3.24Å; T20-L24 PolarHBondContact O-N 2.77Å
21	V	42	Very low	36.3	Very low	87 Å²	87	116.8 Å²	116.8	53%	0.527	64%	0.638	S	S	.	*	H	α-helix	trans	-66.9	-40.2	172.6	171.4	0	0	0	0	111.1	A17 V18 L24 L25	A17-V21 VanDerWaalsContact O-CG2 3.28Å; A17-V21 WeakPolarHBondContact O-CG2 3.39Å; A17-V21 PolarHBondContact O-N 2.84Å; V18-V21 PolarHBondContact O-N 3.03Å; V21-L24 PolarHBondContact O-N 3.06Å; V21-L25 HydrophobicContact CG1-CD1 4.18Å; V21-L25 PolarHBondContact O-N 3Å
22	I	42	Very low	35.9	Very low	113 Å²	113	119 Å²	119	58%	0.579	66%	0.66	S	S	*	*	H	α-helix	trans	-68.6	-34.6	175.3	-67.4	167.7	0	0	0	111.7	V18 V19	V18-I22 HydrophobicContact CG1-CD1 3.79Å; V18-I22 WeakPolarHBondContact O-CB 3.47Å; V18-I22 WeakPolarHBondContact O-CD1 3.46Å; V18-I22 WeakPolarHBondContact O-CG1 3.44Å; V18-I22 PolarHBondContact O-N 3.01Å; V19-I22 PolarHBondContact O-N 2.85Å
23	L	33.8	Very low	35.3	Very low	108 Å²	108	117.7 Å²	117.7	57%	0.565	67%	0.665	S	S	*	*	H	α-helix	trans	-76.3	-27.6	176.7	-81.6	165.2	0	0	0	113.6	V19 T20 L25	V19-L23 HydrophobicContact CG1-CD1 3.75Å; V19-L23 HydrophobicContact CG1-CG 4.44Å; V19-L23 VanDerWaalsContact O-CB 3.29Å; V19-L23 WeakPolarHBondContact O-CB 3.49Å; V19-L23 WeakPolarHBondContact O-CG 3.35Å; V19-L23 PolarHBondContact O-N 3.32Å; T20-L23 PolarHBondContact O-N 3.02Å; L23-L25 VanDerWaalsContact C-N 3.31Å
24	L	37.2	Very low	34.7	Very low	142 Å²	142	119.8 Å²	119.8	74%	0.743	68%	0.678	S	S	*	*	H	α-helix	trans	-75.9	-17.9	173.6	-78.1	164.5	0	0	0	113	T20 V21	T20-L24 HydrophobicContact CG2-CD1 4.09Å; T20-L24 WeakPolarHBondContact O-CB 3.22Å; T20-L24 WeakPolarHBondContact O-CD1 3.08Å; T20-L24 VanDerWaalsContact O-CG 3.3Å; T20-L24 WeakPolarHBondContact O-CG 3.24Å; T20-L24 PolarHBondContact O-N 2.77Å; V21-L24 PolarHBondContact O-N 3.06Å
25	L	32.2	Very low	34.1	Very low	134 Å²	134	119.5 Å²	119.5	70%	0.702	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	26.4	178.6	-79.2	163.9	0	0	0	114.2	V21 L23 P27	V21-L25 HydrophobicContact CG1-CD1 4.18Å; V21-L25 PolarHBondContact O-N 3Å; L23-L25 VanDerWaalsContact C-N 3.31Å; L25-P27 WeakPolarHBondContact O-CD 3.43Å
26	K	28.1	Very low	33.6	Very low	165 Å²	165	116 Å²	116	72%	0.717	69%	0.693	S	S	*	*			trans	-78.1	119.9	167.6	-91.9	-170.1	175	-178.3	0	110.6	R28	K26-R28 PolarHBondContact O-N 3.31Å
27	P	33.7	Very low	33.2	Very low	120 Å²	120	118.9 Å²	118.9	78%	0.779	70%	0.704	S	S	*	*			trans	-70.5	124.6	170.1	28.5	-29.6	0	0	0	108.7	L25 S29	L25-P27 WeakPolarHBondContact O-CD 3.43Å; P27-S29 PolarHBondContact O-N 3.08Å; P27-S29 VanDerWaalsContact O-N 3.15Å
28	R	28.9	Very low	32.5	Very low	248 Å²	248	125.5 Å²	125.5	94%	0.936	73%	0.726	S	S	*	*			trans	-68.4	108.9	165.1	-85.4	-177.1	172.8	171.5	-1.5	107.8	K26 A30	K26-R28 PolarHBondContact O-N 3.31Å; R28-A30 PolarHBondContact O-N 3.26Å; R28-A30 VanDerWaalsContact O-N 3.17Å
29	S	29.3	Very low	31.7	Very low	111 Å²	111	126.1 Å²	126.1	78%	0.776	73%	0.734	S	S	*	*			trans	-55.4	110.6	167.6	44.6	0	0	0	0	110.4	P27	P27-S29 PolarHBondContact O-N 3.08Å; P27-S29 VanDerWaalsContact O-N 3.15Å
30	A	28.4	Very low	30.8	Very low	99 Å²	99	130.9 Å²	130.9	82%	0.818	76%	0.756	S	S	*	*			trans	-75.5	121.5	169.7	0	0	0	0	0	109.3	R28 A32	R28-A30 PolarHBondContact O-N 3.26Å; R28-A30 VanDerWaalsContact O-N 3.17Å; A30-A32 PolarHBondContact O-N 3.16Å
31	L	29	Very low	30.1	Very low	168 Å²	168	130.7 Å²	130.7	88%	0.88	77%	0.767	S	S	*	*			trans	-57.1	129.6	171.1	-108.9	78.1	0	0	0	110	G33	L31-G33 PolarHBondContact O-N 2.79Å
32	A	28.4	Very low	29.2	Very low	107 Å²	107	132.6 Å²	132.6	88%	0.884	79%	0.785	S	S	*	*			trans	-64.3	112.7	166.1	0	0	0	0	0	109.8	A30	A30-A32 PolarHBondContact O-N 3.16Å
33	G	25.7	Very low	28.6	Very low	73 Å²	73	132.5 Å²	132.5	75%	0.753	79%	0.794	S	S	*	*			trans	-102	117.8	165.3	0	0	0	0	0	109.5	L31	L31-G33 PolarHBondContact O-N 2.79Å
34	T	27	Very low	28.2	Very low	146 Å²	146	134 Å²	134	90%	0.896	81%	0.807	S	S	*	*			trans	-57.5	137.2	172.7	45.5	0	0	0	0	112.2
35	A	26	Very low	28	Very low	96 Å²	96	133.4 Å²	133.4	79%	0.793	82%	0.815	S	S	*	*			trans	-111.1	139.9	167.7	0	0	0	0	0	110.7
36	P	29.6	Very low	27.6	Very low	126 Å²	126	131.2 Å²	131.2	82%	0.818	82%	0.816	S	S	*	*			trans	-88.7	158.1	176.5	35.3	-31.4	0	0	0	112.6
37	E	28.6	Very low	27.6	Very low	179 Å²	179	130.2 Å²	130.2	84%	0.836	82%	0.823	S	S	*	*			trans	-63	141.2	170.5	-64.6	177.1	137.7	0	0	112.3
38	H	26.2	Very low	27.1	Very low	187 Å²	187	129.2 Å²	129.2	87%	0.866	82%	0.819	S	S	*	*				-175.6	157.8	121.9	-106.4	-79.3	0	0	0	112.9
39	S	25.5	Very low	27.2	Very low	96 Å²	96	123.3 Å²	123.3	67%	0.671	81%	0.811	S	S	*	*			trans	-81.4	160.8	-161.2	50.8	0	0	0	0	118.8
40	L	27	Very low	27.4	Very low	177 Å²	177	125.2 Å²	125.2	93%	0.927	81%	0.812	S	S	*	*			trans	104.4	116.3	137.6	-147	79	0	0	0	118.9
41	G	24.1	Very low	27.7	Very low	62 Å²	62	129.5 Å²	129.5	64%	0.639	81%	0.812	S	S	*	*				111.2	109.8	128.2	0	0	0	0	0	119.9
42	S	23.3	Very low	28.2	Very low	128 Å²	128	126.7 Å²	126.7	90%	0.895	80%	0.803	S	S	*	*			trans	92.9	135	144.9	79.5	0	0	0	0	120.7
43	S	28.4	Very low	29.3	Very low	110 Å²	110	129.6 Å²	129.6	77%	0.769	80%	0.798	S	S	*	*			trans	-73.5	130.8	-174.9	49	0	0	0	0	114.2
44	V	26.1	Very low	30.7	Very low	140 Å²	140	128.9 Å²	128.9	85%	0.848	78%	0.781	S	S	*	*			trans	-146.2	123.1	145.3	-177.7	0	0	0	0	108.6	A46	V44-A46 PolarHBondContact O-N 2.74Å
45	S	32.1	Very low	31.6	Very low	130 Å²	130	127.7 Å²	127.7	91%	0.909	78%	0.778	S	S	*	*			trans	-60.5	114.6	172.2	-51.8	0	0	0	0	110.6
46	A	25.2	Very low	33.1	Very low	87 Å²	87	130.3 Å²	130.3	72%	0.719	77%	0.772	S	S	*	*			trans	-132.4	121.1	162.3	0	0	0	0	0	107.6	V44 S48	V44-A46 PolarHBondContact O-N 2.74Å; A46-S48 PolarHBondContact O-N 2.71Å
47	V	28.1	Very low	34.4	Very low	145 Å²	145	129.7 Å²	129.7	88%	0.879	77%	0.768	S	S	*	*			trans	-48.8	107.8	176.1	173.8	0	0	0	0	109.1	T49	V47-T49 PolarHBondContact O-N 3.22Å
48	S	23.2	Very low	36.1	Very low	99 Å²	99	125.6 Å²	125.6	69%	0.692	75%	0.749	S	S	*	*			trans	-76.1	112.8	173.3	55.1	0	0	0	0	108.7	A46 N50	A46-S48 PolarHBondContact O-N 2.71Å; S48-N50 PolarHBondContact O-N 3.2Å
49	T	29.6	Very low	38	Very low	124 Å²	124	124.5 Å²	124.5	76%	0.761	74%	0.744	S	S	*	*			trans	-58.3	121.5	163.9	30.9	0	0	0	0	109.5	V47 K51	V47-T49 PolarHBondContact O-N 3.22Å; T49-K51 PolarHBondContact O-N 3.47Å
50	N	34	Very low	40.5	Very low	151 Å²	151	121.2 Å²	121.2	81%	0.807	72%	0.72	S	S	*	*			trans	-61	89.2	176.6	-78.2	-17.1	0	0	0	111.2	S48	S48-N50 PolarHBondContact O-N 3.2Å
51	K	35.1	Very low	42.9	Very low	188 Å²	188	117 Å²	117	82%	0.817	70%	0.703	S	S	*	*			trans	-113	72.3	161.2	-85.3	-173.4	173.4	179.9	0	108.6	T49	T49-K51 PolarHBondContact O-N 3.47Å
52	T	39.3	Very low	45.6	Very low	110 Å²	110	119.1 Å²	119.1	68%	0.675	70%	0.699	S	S	*	*			trans	-152.5	14.6	-178.2	18	0	0	0	0	117.8
53	E	51.1	Low	48.3	Very low	167 Å²	167	114 Å²	114	78%	0.78	67%	0.667	S	S	*	*	S	Bend	trans	-112	-19.3	176.9	-79.2	-176	160.1	0	0	116.2	S55	E53-S55 VanDerWaalsContact C-N 3.28Å; E53-S55 PolarHBondContact O-N 2.89Å
54	C	56	Low	50.7	Low	59 Å²	59	111.7 Å²	111.7	40%	0.399	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.4	-7	-174.2	-63.8	0	0	0	0	116.3	C941	C54-C941 HydrophobicContact CB-CB 3.49Å; C54-C941 VanDerWaalsContact CB-CB 3.49Å; C54-C941 WeakPolarHBondContact CB-SG 3.48Å; C54-C941 WeakPolarHBondContact SG-CB 3.23Å; C54-C941 CovalentContact SG-SG 2.02Å; C54-C941 PolarHBondContact SG-SG 3.37Å
55	S	46.1	Very low	53.5	Low	120 Å²	120	109.2 Å²	109.2	84%	0.839	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	9.2	-170.2	-51.1	0	0	0	0	114.8	E53	E53-S55 VanDerWaalsContact C-N 3.28Å; E53-S55 PolarHBondContact O-N 2.89Å
56	K	56.1	Low	56.1	Low	151 Å²	151	105.9 Å²	105.9	66%	0.657	60%	0.601	S	S	*	*	S	Bend	trans	-89.5	128	175.8	-67.9	179.6	-174.3	168.6	0	109.5	E58	K56-E58 PolarHBondContact O-N 2.93Å
57	P	57	Low	58.9	Low	114 Å²	114	106.2 Å²	106.2	74%	0.74	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-61	130.1	168.2	25.1	-30.8	0	0	0	108.8	Q59	P57-Q59 PolarHBondContact O-N 2.87Å
58	E	63.8	Low	61.5	Low	92 Å²	92	100.2 Å²	100.2	43%	0.43	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-60	128.7	177.6	-146.8	157.7	-140.2	0	0	108.5	K56 C800 K805 D806	K56-E58 PolarHBondContact O-N 2.93Å; E58-C800 PolarHBondContact O-SG 3.36Å; E58-C800 VanDerWaalsContact O-SG 3.42Å; E58-K805 VanDerWaalsContact OE2-CA 3.27Å; E58-K805 WeakPolarHBondContact OE2-CA 3.24Å; E58-D806 PolarHBondContact OE2-N 2.77Å; E58-D806 VanDerWaalsContact OE2-N 3.16Å
59	Q	67.6	Low	64.4	Low	165 Å²	165	101 Å²	101	77%	0.771	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-85.1	131.3	-177.8	-71	-177.6	8.9	0	0	109.3	P57 T61	P57-Q59 PolarHBondContact O-N 2.87Å; Q59-T61 PolarHBondContact O-N 3.22Å; Q59-T61 VanDerWaalsContact O-N 3.12Å
60	C	76.4	Confident	66.8	Low	26 Å²	26	101.5 Å²	101.5	18%	0.176	54%	0.541	C	S	.	.	P	Polyproline II helix	trans	-66.7	116.9	-178.7	-48.3	0	0	0	0	110.2	V68 C800	C60-V68 HydrophobicContact CB-CG1 3.88Å; C60-V68 HydrophobicContact CB-CG2 4.15Å; C60-C800 WeakPolarHBondContact CA-SG 3.28Å; C60-C800 HydrophobicContact CB-CB 3.95Å; C60-C800 WeakPolarHBondContact CB-SG 3.49Å; C60-C800 PolarHBondContact N-SG 3.37Å; C60-C800 WeakPolarHBondContact SG-CB 3.35Å; C60-C800 CovalentContact SG-SG 2.03Å; C60-C800 PolarHBondContact SG-SG 3.31Å
61	T	78.4	Confident	68.9	Low	90 Å²	90	98.2 Å²	98.2	55%	0.552	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-95.6	157.2	171.9	48.5	0	0	0	0	110.5	Q59 G63 V68 H797	Q59-T61 PolarHBondContact O-N 3.22Å; Q59-T61 VanDerWaalsContact O-N 3.12Å; T61-G63 PolarHBondContact O-N 3.29Å; T61-V68 WeakPolarHBondContact O-CG2 3.47Å; T61-H797 PolarHBondContact O-NE2 3.46Å
62	N	80.3	Confident	70.4	Confident	105 Å²	105	96.7 Å²	96.7	56%	0.561	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-63.6	135.5	172.3	-70.2	-28.8	0	0	0	110	V68	N62-V68 WeakPolarHBondContact OD1-CG2 3.45Å; N62-V68 PolarHBondContact OD1-N 3.43Å
63	G	79.5	Confident	71.9	Confident	21 Å²	21	98.3 Å²	98.3	22%	0.216	52%	0.522	C	S	.	.			trans	-70.1	176.2	170.8	0	0	0	0	0	112.4	T61 L65 L66 D793	T61-G63 PolarHBondContact O-N 3.29Å; G63-L65 VanDerWaalsContact C-N 3.35Å; G63-L66 WeakPolarHBondContact CA-O 3.35Å; G63-L66 PolarHBondContact N-O 2.93Å; G63-L66 VanDerWaalsContact N-O 3.11Å; G63-D793 VanDerWaalsContact CA-OD1 3.24Å; G63-D793 WeakPolarHBondContact CA-OD1 3.44Å
64	V	80.7	Confident	73.2	Confident	62 Å²	62	91.3 Å²	91.3	38%	0.376	49%	0.491	S	S	.	.	S	Bend	trans	-67.5	-36.7	-178.8	-178.3	0	0	0	0	111.2	D793	V64-D793 PolarHBondContact N-OD1 3.46Å; V64-D793 PolarHBondContact N-OD2 3.4Å
65	L	84.1	Confident	74.5	Confident	88 Å²	88	91.7 Å²	91.7	46%	0.461	49%	0.494	S	S	.	.	S	Bend	trans	-117.8	-41.6	180	-73	165.9	0	0	0	112.8	G63 L786 A789 V790 D793	G63-L65 VanDerWaalsContact C-N 3.35Å; L65-L786 HydrophobicContact CD1-CD1 4.11Å; L65-A789 HydrophobicContact CD1-CB 3.38Å; L65-A789 HydrophobicContact CG-CB 4.39Å; L65-V790 HydrophobicContact CD1-CG2 3.83Å; L65-D793 WeakPolarHBondContact CA-OD2 3.32Å; L65-D793 WeakPolarHBondContact CB-OD2 3.4Å; L65-D793 PolarHBondContact N-OD2 3.37Å
66	L	86.3	Confident	76.4	Confident	60 Å²	60	94 Å²	94	31%	0.314	49%	0.489	S	S	.	.	S	Bend	trans	-97.6	131.7	-174.2	-65.3	179	0	0	0	112	G63 V790 D793 L794 H797	G63-L66 WeakPolarHBondContact CA-O 3.35Å; G63-L66 PolarHBondContact N-O 2.93Å; G63-L66 VanDerWaalsContact N-O 3.11Å; L66-V790 HydrophobicContact CD1-CG1 4.07Å; L66-D793 HydrophobicContact CB-CB 4.06Å; L66-D793 HydrophobicContact CD1-CB 4.25Å; L66-D793 HydrophobicContact CG-CB 4.34Å; L66-D793 PolarHBondContact N-OD2 2.85Å; L66-L794 HydrophobicContact CD1-CD2 3.8Å; L66-L794 HydrophobicContact CD1-CG 3.98Å; L66-H797 PolarHBondContact O-CE1 3.31Å; L66-H797 VanDerWaalsContact O-CE1 3.29Å
67	P	85.2	Confident	77.8	Confident	94 Å²	94	89 Å²	89	61%	0.61	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-73.4	153.9	171.4	30.8	-34	0	0	0	111.7	H797	P67-H797 PolarHBondContact O-CE1 3.14Å
68	V	82.7	Confident	79.1	Confident	19 Å²	19	87.4 Å²	87.4	12%	0.115	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-64.9	139.1	174.1	178.1	0	0	0	0	110.7	C60 T61 N62 E70	C60-V68 HydrophobicContact CB-CG1 3.88Å; C60-V68 HydrophobicContact CB-CG2 4.15Å; T61-V68 WeakPolarHBondContact O-CG2 3.47Å; N62-V68 WeakPolarHBondContact OD1-CG2 3.45Å; N62-V68 PolarHBondContact OD1-N 3.43Å; V68-E70 PolarHBondContact O-N 3.34Å
69	W	83.8	Confident	80.2	Confident	116 Å²	116	87 Å²	87	44%	0.439	46%	0.463	S	S	.	.			trans	-74.4	111.4	173.2	-167.9	-13.6	0	0	0	111.6	R82 V85 Y86	W69-R82 HydrophobicContact CD2-CG 4.04Å; W69-R82 HydrophobicContact CE3-CG 3.93Å; W69-R82 HydrophobicContact CH2-CG 4.45Å; W69-R82 HydrophobicContact CZ3-CG 4.14Å; W69-R82 PolarHBondContact O-NH1 3.44Å; W69-V85 HydrophobicContact CZ3-CB 4.2Å; W69-V85 HydrophobicContact CZ3-CG1 3.95Å; W69-Y86 WeakPolarHBondContact CB-OH 3.29Å; W69-Y86 HydrophobicContact CE3-CE2 4.28Å
70	E	79.7	Confident	81.1	Confident	134 Å²	134	82.7 Å²	82.7	63%	0.626	45%	0.447	S	S	*	.	S	Bend	trans	-83.5	153.2	177.2	-62.5	-164.8	154.2	0	0	113.5	V68 R82	V68-E70 PolarHBondContact O-N 3.34Å; E70-R82 PolarHBondContact O-NH2 3.42Å
71	P	78.3	Confident	81.7	Confident	82 Å²	82	83.9 Å²	83.9	53%	0.532	46%	0.459	S	S	.	.			cis	-73.7	153.6	-3.5	28.7	-37.8	0	0	0	113.6	N73 P74 R82	P71-N73 VanDerWaalsContact C-N 3.3Å; P71-N73 PolarHBondContact O-N 2.91Å; P71-P74 WeakPolarHBondContact O-CD 3.32Å; P71-R82 VanDerWaalsContact CD-NH2 3.3Å; P71-R82 PolarHBondContact O-NH1 2.58Å
72	R	67.1	Low	82.2	Confident	155 Å²	155	80.7 Å²	80.7	59%	0.585	44%	0.437	S	S	*	.	S	Bend	trans	-67.3	-23.5	-178.1	-64.2	-178.7	-174.2	175	-0.4	114.5	P74	R72-P74 VanDerWaalsContact C-CD 3.41Å; R72-P74 VanDerWaalsContact O-CD 3.3Å; R72-P74 WeakPolarHBondContact O-CD 3.29Å
73	N	70.1	Confident	82.6	Confident	145 Å²	145	76.4 Å²	76.4	78%	0.775	42%	0.416	S	S	*	.	S	Bend	trans	-119.5	75.3	176.3	-76.2	-34.7	0	0	0	111.2	P71	P71-N73 VanDerWaalsContact C-N 3.3Å; P71-N73 PolarHBondContact O-N 2.91Å
74	P	78.4	Confident	83.2	Confident	20 Å²	20	79 Å²	79	13%	0.13	43%	0.428	C	S	.	.			trans	-80.3	164.6	-179.4	32.9	-32.8	0	0	0	111.7	P71 R72 D78 K79	P71-P74 WeakPolarHBondContact O-CD 3.32Å; R72-P74 VanDerWaalsContact C-CD 3.41Å; R72-P74 VanDerWaalsContact O-CD 3.3Å; R72-P74 WeakPolarHBondContact O-CD 3.29Å; P74-D78 HydrophobicContact CB-CB 3.72Å; P74-K79 HydrophobicContact CG-CG 3.68Å; P74-K79 WeakPolarHBondContact O-CE 3.38Å
75	S	84.1	Confident	83.7	Confident	67 Å²	67	79.7 Å²	79.7	47%	0.469	43%	0.432	S	S	.	.			trans	-60.9	160.6	176.3	76.9	0	0	0	0	111.1	G77 D78 K79	S75-G77 VanDerWaalsContact C-N 3.26Å; S75-G77 PolarHBondContact O-N 3.45Å; S75-D78 PolarHBondContact O-N 2.8Å; S75-D78 VanDerWaalsContact O-N 3.11Å; S75-D78 PolarHBondContact OG-N 2.79Å; S75-D78 PolarHBondContact OG-OD2 2.93Å; S75-K79 WeakPolarHBondContact O-CG 3.29Å; S75-K79 PolarHBondContact O-N 2.85Å
76	F	84.3	Confident	84.1	Confident	168 Å²	168	76.4 Å²	76.4	74%	0.737	41%	0.413	S	S	*	.	H	α-helix	trans	-56.8	-39.8	179.9	178.9	-97.8	0	0	0	112.5	K79 V80	F76-K79 PolarHBondContact O-N 2.97Å; F76-V80 HydrophobicContact CD1-CG2 4.43Å; F76-V80 HydrophobicContact CE1-CG2 4Å; F76-V80 HydrophobicContact CE2-CG2 4.42Å; F76-V80 HydrophobicContact CZ-CG2 4Å; F76-V80 WeakPolarHBondContact O-CG2 3.48Å; F76-V80 PolarHBondContact O-N 2.81Å; F76-V80 VanDerWaalsContact O-N 3.1Å
77	G	85.9	Confident	84.3	Confident	45 Å²	45	77.5 Å²	77.5	46%	0.464	42%	0.416	S	S	.	.	H	α-helix	trans	-63.2	-43.7	175.9	0	0	0	0	0	112.4	S75 K79 V80 A81	S75-G77 VanDerWaalsContact C-N 3.26Å; S75-G77 PolarHBondContact O-N 3.45Å; G77-K79 PolarHBondContact O-N 3.25Å; G77-V80 PolarHBondContact O-N 3.07Å; G77-A81 WeakPolarHBondContact O-CB 3.42Å; G77-A81 PolarHBondContact O-N 2.9Å
78	D	85.2	Confident	84.7	Confident	82 Å²	82	77.3 Å²	77.3	44%	0.439	41%	0.413	S	S	.	.	H	α-helix	trans	-67.4	-34.9	177.1	-64.1	-34.4	0	0	0	112.3	P74 S75 A81 R82	P74-D78 HydrophobicContact CB-CB 3.72Å; S75-D78 PolarHBondContact O-N 2.8Å; S75-D78 VanDerWaalsContact O-N 3.11Å; S75-D78 PolarHBondContact OG-N 2.79Å; S75-D78 PolarHBondContact OG-OD2 2.93Å; D78-A81 PolarHBondContact O-N 3Å; D78-R82 WeakPolarHBondContact O-CB 3.34Å; D78-R82 WeakPolarHBondContact O-CG 3.46Å; D78-R82 PolarHBondContact O-N 3.32Å
79	K	85.6	Confident	85.1	Confident	84 Å²	84	77.9 Å²	77.9	37%	0.365	42%	0.419	S	S	.	.	H	α-helix	trans	-59.8	-47.9	172.4	-74.4	-174.7	179.7	-168.5	0	111.1	P74 S75 F76 G77 R82 A83	P74-K79 HydrophobicContact CG-CG 3.68Å; P74-K79 WeakPolarHBondContact O-CE 3.38Å; S75-K79 WeakPolarHBondContact O-CG 3.29Å; S75-K79 PolarHBondContact O-N 2.85Å; F76-K79 PolarHBondContact O-N 2.97Å; G77-K79 PolarHBondContact O-N 3.25Å; K79-R82 PolarHBondContact O-N 3.03Å; K79-A83 VanDerWaalsContact O-CB 3.29Å; K79-A83 WeakPolarHBondContact O-CB 3.3Å; K79-A83 PolarHBondContact O-N 2.89Å
80	V	88	Confident	85.5	Confident	73 Å²	73	72.5 Å²	72.5	44%	0.442	40%	0.399	S	S	.	.	H	α-helix	trans	-64.4	-43.2	178.8	174.2	0	0	0	0	111	F76 G77 A83 T84	F76-V80 HydrophobicContact CD1-CG2 4.43Å; F76-V80 HydrophobicContact CE1-CG2 4Å; F76-V80 HydrophobicContact CE2-CG2 4.42Å; F76-V80 HydrophobicContact CZ-CG2 4Å; F76-V80 WeakPolarHBondContact O-CG2 3.48Å; F76-V80 PolarHBondContact O-N 2.81Å; F76-V80 VanDerWaalsContact O-N 3.1Å; G77-V80 PolarHBondContact O-N 3.07Å; V80-A83 PolarHBondContact O-N 3.05Å; V80-T84 WeakPolarHBondContact O-CB 3.19Å; V80-T84 PolarHBondContact O-N 2.95Å; V80-T84 PolarHBondContact O-OG1 3.05Å
81	A	88.6	Confident	86	Confident	52 Å²	52	69.8 Å²	69.8	43%	0.43	39%	0.392	S	S	.	.	H	α-helix	trans	-61.2	-47.3	177	0	0	0	0	0	111.6	G77 D78 T84 V85	G77-A81 WeakPolarHBondContact O-CB 3.42Å; G77-A81 PolarHBondContact O-N 2.9Å; D78-A81 PolarHBondContact O-N 3Å; A81-T84 WeakPolarHBondContact O-CB 3.41Å; A81-T84 PolarHBondContact O-N 2.92Å; A81-V85 WeakPolarHBondContact O-CG2 3.43Å; A81-V85 PolarHBondContact O-N 3.26Å
82	R	89.4	Confident	86.7	Confident	23 Å²	23	69.7 Å²	69.7	9%	0.087	38%	0.381	C	S	.	.	H	α-helix	trans	-62.8	-47.4	176.7	-72.9	174.7	-174.7	-161.5	-1.4	112.6	W69 E70 P71 D78 K79 T84 V85 Y86	W69-R82 HydrophobicContact CD2-CG 4.04Å; W69-R82 HydrophobicContact CE3-CG 3.93Å; W69-R82 HydrophobicContact CH2-CG 4.45Å; W69-R82 HydrophobicContact CZ3-CG 4.14Å; W69-R82 PolarHBondContact O-NH1 3.44Å; E70-R82 PolarHBondContact O-NH2 3.42Å; P71-R82 VanDerWaalsContact CD-NH2 3.3Å; P71-R82 PolarHBondContact O-NH1 2.58Å; D78-R82 WeakPolarHBondContact O-CB 3.34Å; D78-R82 WeakPolarHBondContact O-CG 3.46Å; D78-R82 PolarHBondContact O-N 3.32Å; K79-R82 PolarHBondContact O-N 3.03Å; R82-T84 PolarHBondContact O-N 2.8Å; R82-V85 PolarHBondContact O-N 3.17Å; R82-V85 VanDerWaalsContact O-N 3.14Å; R82-Y86 HydrophobicContact CB-CD2 4.44Å; R82-Y86 HydrophobicContact CB-CE2 4.39Å; R82-Y86 VanDerWaalsContact O-CD2 3.23Å; R82-Y86 WeakPolarHBondContact O-CD2 3.45Å; R82-Y86 PolarHBondContact O-N 3.01Å
83	A	88.4	Confident	87.8	Confident	14 Å²	14	63.3 Å²	63.3	12%	0.116	36%	0.358	C	S	.	.	H	α-helix	trans	-58.5	-39.6	176.7	0	0	0	0	0	111.1	K79 V80 F87 F798 V802	K79-A83 VanDerWaalsContact O-CB 3.29Å; K79-A83 WeakPolarHBondContact O-CB 3.3Å; K79-A83 PolarHBondContact O-N 2.89Å; V80-A83 PolarHBondContact O-N 3.05Å; A83-F87 WeakPolarHBondContact O-CB 3.31Å; A83-F87 PolarHBondContact O-N 2.85Å; A83-F798 HydrophobicContact CB-CD2 4.49Å; A83-F798 HydrophobicContact CB-CE2 4.29Å; A83-F798 WeakPolarHBondContact O-CD2 3.39Å; A83-V802 HydrophobicContact CB-CG2 3.8Å
84	T	90.5	Very high	88.8	Confident	77 Å²	77	57.2 Å²	57.2	47%	0.472	33%	0.325	S	S	.	.	H	α-helix	trans	-64.9	-44.6	175.4	-53.5	0	0	0	0	111.5	V80 A81 R82 F87 V88	V80-T84 WeakPolarHBondContact O-CB 3.19Å; V80-T84 PolarHBondContact O-N 2.95Å; V80-T84 PolarHBondContact O-OG1 3.05Å; A81-T84 WeakPolarHBondContact O-CB 3.41Å; A81-T84 PolarHBondContact O-N 2.92Å; R82-T84 PolarHBondContact O-N 2.8Å; T84-F87 PolarHBondContact O-N 2.71Å; T84-V88 HydrophobicContact CG2-CG2 4.36Å; T84-V88 WeakPolarHBondContact O-CB 3.32Å; T84-V88 VanDerWaalsContact O-CG2 3.29Å; T84-V88 WeakPolarHBondContact O-CG2 3.4Å; T84-V88 PolarHBondContact O-N 3.1Å
85	V	92.9	Very high	89.2	Confident	75 Å²	75	58.2 Å²	58.2	46%	0.455	33%	0.329	S	S	.	.	H	α-helix	trans	-62.5	-47.8	177.3	172.7	0	0	0	0	111.1	W69 A81 R82 F87 V88 A89	W69-V85 HydrophobicContact CZ3-CB 4.2Å; W69-V85 HydrophobicContact CZ3-CG1 3.95Å; A81-V85 WeakPolarHBondContact O-CG2 3.43Å; A81-V85 PolarHBondContact O-N 3.26Å; R82-V85 PolarHBondContact O-N 3.17Å; R82-V85 VanDerWaalsContact O-N 3.14Å; V85-F87 VanDerWaalsContact C-N 3.34Å; V85-F87 PolarHBondContact O-N 2.94Å; V85-V88 PolarHBondContact O-N 2.91Å; V85-A89 WeakPolarHBondContact O-CB 3.48Å; V85-A89 PolarHBondContact O-N 3.27Å
86	Y	92.3	Very high	89.5	Confident	19 Å²	19	55 Å²	55	8%	0.075	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-40.8	177.4	-73.5	-54.4	0	0	0	112.1	W69 R82 A89 L90 L794 H797 T801	W69-Y86 WeakPolarHBondContact CB-OH 3.29Å; W69-Y86 HydrophobicContact CE3-CE2 4.28Å; R82-Y86 HydrophobicContact CB-CD2 4.44Å; R82-Y86 HydrophobicContact CB-CE2 4.39Å; R82-Y86 VanDerWaalsContact O-CD2 3.23Å; R82-Y86 WeakPolarHBondContact O-CD2 3.45Å; R82-Y86 PolarHBondContact O-N 3.01Å; Y86-A89 PolarHBondContact O-N 3.5Å; Y86-L90 WeakPolarHBondContact O-CB 3.48Å; Y86-L90 PolarHBondContact O-N 2.9Å; Y86-L794 HydrophobicContact CD1-CD2 3.74Å; Y86-L794 HydrophobicContact CE1-CD2 4.19Å; Y86-H797 HydrophobicContact CD1-CB 4.26Å; Y86-H797 HydrophobicContact CD2-CB 4.46Å; Y86-H797 HydrophobicContact CE1-CB 3.88Å; Y86-H797 HydrophobicContact CE2-CB 4.09Å; Y86-T801 HydrophobicContact CD2-CG2 3.98Å; Y86-T801 HydrophobicContact CE2-CG2 3.74Å
87	F	90.9	Very high	89.7	Confident	83 Å²	83	47.2 Å²	47.2	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-64.9	-46.9	177.2	-175.9	-102.2	0	0	0	112.4	A83 T84 V85 A89 L90 V91 F798 F813	A83-F87 WeakPolarHBondContact O-CB 3.31Å; A83-F87 PolarHBondContact O-N 2.85Å; T84-F87 PolarHBondContact O-N 2.71Å; V85-F87 VanDerWaalsContact C-N 3.34Å; V85-F87 PolarHBondContact O-N 2.94Å; F87-A89 VanDerWaalsContact C-N 3.34Å; F87-L90 PolarHBondContact O-N 3.04Å; F87-V91 HydrophobicContact CD1-CG2 4.48Å; F87-V91 HydrophobicContact CE1-CG2 4.1Å; F87-V91 HydrophobicContact CZ-CG2 4.13Å; F87-V91 WeakPolarHBondContact O-CG2 3.3Å; F87-V91 PolarHBondContact O-N 3.23Å; F87-F798 HydrophobicContact CB-CD2 4.12Å; F87-F798 HydrophobicContact CB-CE2 3.78Å; F87-F798 HydrophobicContact CD2-CE2 4.12Å; F87-F798 HydrophobicContact CD2-CZ 4.01Å; F87-F798 HydrophobicContact CG-CE2 4.36Å; F87-F813 HydrophobicContact CE2-CD1 4.04Å; F87-F813 HydrophobicContact CE2-CE1 4Å
88	V	91.9	Very high	89.7	Confident	91 Å²	91	45.8 Å²	45.8	55%	0.552	26%	0.255	S	S	*	.	H	α-helix	trans	-63.8	-41.8	177	171.4	0	0	0	0	110.8	T84 V85 V91 Y92	T84-V88 HydrophobicContact CG2-CG2 4.36Å; T84-V88 WeakPolarHBondContact O-CB 3.32Å; T84-V88 VanDerWaalsContact O-CG2 3.29Å; T84-V88 WeakPolarHBondContact O-CG2 3.4Å; T84-V88 PolarHBondContact O-N 3.1Å; V85-V88 PolarHBondContact O-N 2.91Å; V88-V91 PolarHBondContact O-N 3.14Å; V88-Y92 WeakPolarHBondContact O-CB 3.44Å; V88-Y92 PolarHBondContact O-N 3.35Å
89	A	92.5	Very high	89.7	Confident	30 Å²	30	42.6 Å²	42.6	25%	0.248	24%	0.238	C	C	.	.	H	α-helix	trans	-61.8	-44.2	175	0	0	0	0	0	111.5	V85 Y86 F87 Y92 M93 L794	V85-A89 WeakPolarHBondContact O-CB 3.48Å; V85-A89 PolarHBondContact O-N 3.27Å; Y86-A89 PolarHBondContact O-N 3.5Å; F87-A89 VanDerWaalsContact C-N 3.34Å; A89-Y92 WeakPolarHBondContact O-CB 3.45Å; A89-Y92 PolarHBondContact O-N 3.27Å; A89-M93 WeakPolarHBondContact O-CB 3.44Å; A89-M93 VanDerWaalsContact O-CG 3.23Å; A89-M93 WeakPolarHBondContact O-CG 3.05Å; A89-M93 PolarHBondContact O-N 2.94Å; A89-L794 HydrophobicContact CB-CD1 4.09Å; A89-L794 HydrophobicContact CB-CD2 4.21Å
90	L	91.4	Very high	89.9	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-61.6	-45.1	178	176.9	138.1	0	0	0	111.7	Y86 F87 Y92 M93 F94 A795	Y86-L90 WeakPolarHBondContact O-CB 3.48Å; Y86-L90 PolarHBondContact O-N 2.9Å; F87-L90 PolarHBondContact O-N 3.04Å; L90-Y92 PolarHBondContact O-N 2.98Å; L90-M93 PolarHBondContact O-N 3.32Å; L90-F94 HydrophobicContact CD1-CE2 4.37Å; L90-F94 HydrophobicContact CD2-CD2 3.9Å; L90-F94 HydrophobicContact CD2-CE2 3.46Å; L90-F94 VanDerWaalsContact CD2-CE2 3.46Å; L90-F94 HydrophobicContact CG-CD2 4.13Å; L90-F94 HydrophobicContact CG-CE2 3.63Å; L90-F94 HydrophobicContact CG-CZ 4.48Å; L90-F94 WeakPolarHBondContact O-CD2 3.49Å; L90-F94 PolarHBondContact O-N 3.1Å; L90-A795 HydrophobicContact CD1-CB 3.88Å
91	V	89.9	Confident	89.8	Confident	77 Å²	77	35.1 Å²	35.1	47%	0.467	20%	0.2	S	C	.	.	H	α-helix	trans	-61.3	-43.2	173.3	172.8	0	0	0	0	111.5	F87 V88 M93 F94 L95	F87-V91 HydrophobicContact CD1-CG2 4.48Å; F87-V91 HydrophobicContact CE1-CG2 4.1Å; F87-V91 HydrophobicContact CZ-CG2 4.13Å; F87-V91 WeakPolarHBondContact O-CG2 3.3Å; F87-V91 PolarHBondContact O-N 3.23Å; V88-V91 PolarHBondContact O-N 3.14Å; V91-M93 VanDerWaalsContact C-N 3.34Å; V91-M93 PolarHBondContact O-N 3.08Å; V91-F94 PolarHBondContact O-N 3.35Å; V91-L95 PolarHBondContact O-N 3.49Å; V91-L95 VanDerWaalsContact O-N 3.15Å
92	Y	92.4	Very high	89.4	Confident	80 Å²	80	33.3 Å²	33.3	31%	0.314	18%	0.183	S	C	.	.	H	α-helix	trans	-64	-38.2	178.6	-173.5	-111.1	0	0	0	112.7	V88 A89 L90 L95 G96 L754 F757 W758	V88-Y92 WeakPolarHBondContact O-CB 3.44Å; V88-Y92 PolarHBondContact O-N 3.35Å; A89-Y92 WeakPolarHBondContact O-CB 3.45Å; A89-Y92 PolarHBondContact O-N 3.27Å; L90-Y92 PolarHBondContact O-N 2.98Å; Y92-L95 WeakPolarHBondContact O-CB 3.2Å; Y92-L95 PolarHBondContact O-N 3.49Å; Y92-G96 PolarHBondContact O-N 2.89Å; Y92-G96 VanDerWaalsContact O-N 3.16Å; Y92-L754 WeakPolarHBondContact CE2-O 2.87Å; Y92-F757 HydrophobicContact CE1-CD1 4.38Å; Y92-F757 WeakPolarHBondContact OH-CB 3.25Å; Y92-F757 WeakPolarHBondContact OH-CD1 3.35Å; Y92-W758 AromaticContact CD1-CZ2 3.91Å; Y92-W758 HydrophobicContact CD1-CZ2 3.91Å; Y92-W758 AromaticContact CD1-NE1 3.71Å; Y92-W758 AromaticContact CE1-CE2 3.63Å; Y92-W758 AromaticContact CE1-CZ2 3.66Å; Y92-W758 HydrophobicContact CE1-CZ2 3.66Å; Y92-W758 AromaticContact CE1-NE1 3.26Å; Y92-W758 VanDerWaalsContact CE1-NE1 3.26Å; Y92-W758 AromaticContact CE2-NE1 3.6Å; Y92-W758 AromaticContact CZ-CD1 3.8Å; Y92-W758 AromaticContact CZ-CE2 3.97Å; Y92-W758 AromaticContact CZ-NE1 3.21Å; Y92-W758 PolarHBondContact O-NE1 3.31Å
93	M	91.6	Very high	89.2	Confident	21 Å²	21	34.4 Å²	34.4	10%	0.103	19%	0.187	C	C	.	.	H	α-helix	trans	-69.7	-37.3	176.2	-69.2	-61.7	-63.3	0	0	112.3	A89 L90 V91 L95 G96 V97 W758 L787 V790 I791 L794	A89-M93 WeakPolarHBondContact O-CB 3.44Å; A89-M93 VanDerWaalsContact O-CG 3.23Å; A89-M93 WeakPolarHBondContact O-CG 3.05Å; A89-M93 PolarHBondContact O-N 2.94Å; L90-M93 PolarHBondContact O-N 3.32Å; V91-M93 VanDerWaalsContact C-N 3.34Å; V91-M93 PolarHBondContact O-N 3.08Å; M93-L95 VanDerWaalsContact C-N 3.28Å; M93-L95 PolarHBondContact O-N 3.25Å; M93-G96 WeakPolarHBondContact O-CA 3.41Å; M93-G96 PolarHBondContact O-N 2.9Å; M93-G96 VanDerWaalsContact O-N 3.11Å; M93-V97 PolarHBondContact O-N 2.99Å; M93-W758 HydrophobicContact CE-CH2 4.12Å; M93-W758 HydrophobicContact SD-CH2 3.65Å; M93-W758 HydrophobicContact SD-CZ2 3.62Å; M93-L787 HydrophobicContact CE-CB 4.13Å; M93-L787 HydrophobicContact CE-CD2 3.39Å; M93-L787 HydrophobicContact CE-CG 4.35Å; M93-V790 HydrophobicContact CE-CB 3.82Å; M93-V790 HydrophobicContact CE-CG1 3.63Å; M93-V790 HydrophobicContact CG-CG1 4.42Å; M93-V790 HydrophobicContact SD-CG1 4.3Å; M93-I791 HydrophobicContact CB-CD1 4.1Å; M93-I791 HydrophobicContact CB-CG1 3.64Å; M93-L794 HydrophobicContact CB-CD1 4.48Å; M93-L794 HydrophobicContact CG-CD1 3.69Å
94	F	89.8	Confident	89.2	Confident	17 Å²	17	33.8 Å²	33.8	8%	0.075	18%	0.181	C	C	.	.	H	α-helix	trans	-62.7	-36.1	173.1	-78.6	-53	0	0	0	112.8	L90 V91 G96 V97 S98 I791 V814 T818	L90-F94 HydrophobicContact CD1-CE2 4.37Å; L90-F94 HydrophobicContact CD2-CD2 3.9Å; L90-F94 HydrophobicContact CD2-CE2 3.46Å; L90-F94 VanDerWaalsContact CD2-CE2 3.46Å; L90-F94 HydrophobicContact CG-CD2 4.13Å; L90-F94 HydrophobicContact CG-CE2 3.63Å; L90-F94 HydrophobicContact CG-CZ 4.48Å; L90-F94 WeakPolarHBondContact O-CD2 3.49Å; L90-F94 PolarHBondContact O-N 3.1Å; V91-F94 PolarHBondContact O-N 3.35Å; F94-G96 VanDerWaalsContact C-N 3.32Å; F94-V97 PolarHBondContact O-N 3.1Å; F94-S98 WeakPolarHBondContact O-CB 3.32Å; F94-S98 PolarHBondContact O-N 2.75Å; F94-S98 PolarHBondContact O-OG 3.04Å; F94-I791 HydrophobicContact CD1-CD1 3.88Å; F94-I791 HydrophobicContact CE1-CD1 3.88Å; F94-I791 HydrophobicContact CE1-CG2 3.71Å; F94-I791 HydrophobicContact CE2-CG2 4.43Å; F94-I791 HydrophobicContact CZ-CG2 3.56Å; F94-V814 HydrophobicContact CZ-CB 4.48Å; F94-V814 HydrophobicContact CZ-CG1 4.18Å; F94-T818 HydrophobicContact CD1-CG2 4.49Å; F94-T818 HydrophobicContact CE1-CG2 3.75Å
95	L	87.9	Confident	88.9	Confident	40 Å²	40	30.1 Å²	30.1	21%	0.209	16%	0.159	C	C	.	.	H	α-helix	trans	-63.1	-41.1	172.2	-179.9	147.1	0	0	0	111.1	V91 Y92 M93 S98 I99 T755 W758	V91-L95 PolarHBondContact O-N 3.49Å; V91-L95 VanDerWaalsContact O-N 3.15Å; Y92-L95 WeakPolarHBondContact O-CB 3.2Å; Y92-L95 PolarHBondContact O-N 3.49Å; M93-L95 VanDerWaalsContact C-N 3.28Å; M93-L95 PolarHBondContact O-N 3.25Å; L95-S98 PolarHBondContact O-N 2.64Å; L95-I99 HydrophobicContact CD2-CD1 3.86Å; L95-I99 WeakPolarHBondContact O-CG1 3.4Å; L95-I99 PolarHBondContact O-N 3.01Å; L95-T755 HydrophobicContact CD1-CG2 3.67Å; L95-T755 HydrophobicContact CD2-CG2 3.49Å; L95-T755 VanDerWaalsContact CD2-CG2 3.49Å; L95-T755 HydrophobicContact CG-CG2 3.95Å; L95-W758 VanDerWaalsContact CD2-CD1 3.46Å; L95-W758 HydrophobicContact CD2-CG 4.4Å
96	G	89.9	Confident	88.5	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.2	-51.4	171.8	0	0	0	0	0	112.7	Y92 M93 F94 S98 I99 I100 F762	Y92-G96 PolarHBondContact O-N 2.89Å; Y92-G96 VanDerWaalsContact O-N 3.16Å; M93-G96 WeakPolarHBondContact O-CA 3.41Å; M93-G96 PolarHBondContact O-N 2.9Å; M93-G96 VanDerWaalsContact O-N 3.11Å; F94-G96 VanDerWaalsContact C-N 3.32Å; G96-S98 VanDerWaalsContact C-N 3.27Å; G96-S98 PolarHBondContact O-N 3.05Å; G96-I99 PolarHBondContact O-N 3.41Å; G96-I100 WeakPolarHBondContact O-CG2 3.28Å; G96-I100 PolarHBondContact O-N 2.87Å; G96-I100 VanDerWaalsContact O-N 3.15Å; G96-F762 WeakPolarHBondContact O-CE2 3.39Å
97	V	88.5	Confident	88.3	Confident	5 Å²	5	25.9 Å²	25.9	3%	0.03	14%	0.136	C	C	.	.	H	α-helix	trans	-57.9	-39.2	177.4	170.3	0	0	0	0	112	M93 F94 I99 I100 A101 P152 L787 I791	M93-V97 PolarHBondContact O-N 2.99Å; F94-V97 PolarHBondContact O-N 3.1Å; V97-I99 PolarHBondContact O-N 2.85Å; V97-I100 WeakPolarHBondContact O-CG2 3.5Å; V97-A101 WeakPolarHBondContact O-CB 3.37Å; V97-A101 PolarHBondContact O-N 3.04Å; V97-P152 HydrophobicContact CG1-CB 4.06Å; V97-P152 HydrophobicContact CG1-CG 3.69Å; V97-L787 HydrophobicContact CG2-CB 3.61Å; V97-L787 HydrophobicContact CG2-CD1 4.07Å; V97-L787 HydrophobicContact CG2-CG 4.49Å; V97-I791 HydrophobicContact CB-CD1 4.32Å; V97-I791 HydrophobicContact CG2-CD1 3.4Å; V97-I791 VanDerWaalsContact CG2-CD1 3.4Å
98	S	85.2	Confident	87.9	Confident	14 Å²	14	21.9 Å²	21.9	10%	0.098	12%	0.118	C	C	.	.	H	α-helix	trans	-60.1	-46.1	178.2	-57.6	0	0	0	0	111.7	F94 L95 G96 A101 D102 P821	F94-S98 WeakPolarHBondContact O-CB 3.32Å; F94-S98 PolarHBondContact O-N 2.75Å; F94-S98 PolarHBondContact O-OG 3.04Å; L95-S98 PolarHBondContact O-N 2.64Å; G96-S98 VanDerWaalsContact C-N 3.27Å; G96-S98 PolarHBondContact O-N 3.05Å; S98-A101 PolarHBondContact O-N 3.4Å; S98-D102 VanDerWaalsContact O-CG 3.32Å; S98-D102 PolarHBondContact O-N 2.89Å; S98-P821 VanDerWaalsContact OG-CG 3.29Å; S98-P821 WeakPolarHBondContact OG-CG 3.16Å
99	I	87.2	Confident	87.5	Confident	15 Å²	15	17.9 Å²	17.9	8%	0.077	9%	0.094	C	C	.	.	H	α-helix	trans	-67.2	-46	-178.7	-62	166.9	0	0	0	111.6	L95 G96 V97 A101 D102 R103 T375 T379 T755 W758 F762	L95-I99 HydrophobicContact CD2-CD1 3.86Å; L95-I99 WeakPolarHBondContact O-CG1 3.4Å; L95-I99 PolarHBondContact O-N 3.01Å; G96-I99 PolarHBondContact O-N 3.41Å; V97-I99 PolarHBondContact O-N 2.85Å; I99-A101 VanDerWaalsContact C-N 3.32Å; I99-D102 PolarHBondContact O-N 2.82Å; I99-R103 PolarHBondContact O-N 2.69Å; I99-T375 HydrophobicContact CG1-CG2 4.35Å; I99-T379 HydrophobicContact CD1-CG2 4.13Å; I99-T379 HydrophobicContact CG1-CG2 4.06Å; I99-T755 HydrophobicContact CD1-CG2 4.24Å; I99-W758 HydrophobicContact CD1-CB 3.75Å; I99-F762 HydrophobicContact CB-CD2 4.02Å; I99-F762 HydrophobicContact CB-CE2 4.12Å; I99-F762 HydrophobicContact CG2-CD2 3.7Å; I99-F762 HydrophobicContact CG2-CE2 4.31Å
100	I	89.6	Confident	87	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-69.8	-32.9	179.8	-173.8	62.2	0	0	0	111.8	G96 V97 D102 R103 F104 F762 V765 M783 I784 L787	G96-I100 WeakPolarHBondContact O-CG2 3.28Å; G96-I100 PolarHBondContact O-N 2.87Å; G96-I100 VanDerWaalsContact O-N 3.15Å; V97-I100 WeakPolarHBondContact O-CG2 3.5Å; I100-D102 PolarHBondContact O-N 3.13Å; I100-R103 HydrophobicContact CD1-CB 4.3Å; I100-R103 PolarHBondContact O-N 3.19Å; I100-R103 VanDerWaalsContact O-N 3.14Å; I100-F104 PolarHBondContact O-N 2.88Å; I100-F762 HydrophobicContact CB-CD1 4.13Å; I100-F762 HydrophobicContact CB-CD2 3.96Å; I100-F762 HydrophobicContact CB-CE1 3.99Å; I100-F762 HydrophobicContact CB-CE2 3.82Å; I100-F762 HydrophobicContact CB-CG 4.12Å; I100-F762 HydrophobicContact CB-CZ 3.84Å; I100-F762 HydrophobicContact CD1-CB 4.24Å; I100-F762 HydrophobicContact CD1-CD1 3.82Å; I100-F762 HydrophobicContact CD1-CE1 4.36Å; I100-F762 HydrophobicContact CD1-CG 3.98Å; I100-F762 HydrophobicContact CG1-CD1 4.25Å; I100-F762 HydrophobicContact CG1-CE1 4.3Å; I100-F762 HydrophobicContact CG2-CE2 4.33Å; I100-F762 HydrophobicContact CG2-CZ 4.14Å; I100-V765 HydrophobicContact CD1-CG2 3.74Å; I100-M783 HydrophobicContact CD1-CB 4.32Å; I100-M783 HydrophobicContact CG1-CB 4.04Å; I100-I784 HydrophobicContact CB-CG1 4.41Å; I100-I784 HydrophobicContact CG1-CG1 4Å; I100-I784 HydrophobicContact CG2-CG1 3.62Å; I100-L787 HydrophobicContact CG2-CD1 3.75Å
101	A	84.9	Confident	86.8	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-64.6	-26.1	176	0	0	0	0	0	112	V97 S98 I99 F104 M105 I784	V97-A101 WeakPolarHBondContact O-CB 3.37Å; V97-A101 PolarHBondContact O-N 3.04Å; S98-A101 PolarHBondContact O-N 3.4Å; I99-A101 VanDerWaalsContact C-N 3.32Å; A101-F104 WeakPolarHBondContact O-CB 3.5Å; A101-F104 PolarHBondContact O-N 2.93Å; A101-M105 WeakPolarHBondContact O-CB 3.16Å; A101-M105 WeakPolarHBondContact O-CG 3.17Å; A101-M105 PolarHBondContact O-N 3.41Å; A101-I784 HydrophobicContact CB-CD1 4.45Å
102	D	80.8	Confident	86.4	Confident	14 Å²	14	14 Å²	14	8%	0.075	7%	0.067	C	C	.	.	H	α-helix	trans	-72.7	-39	172.4	-59.7	-29	0	0	0	112.6	S98 I99 I100 F104 M105 A106 R371 T375	S98-D102 VanDerWaalsContact O-CG 3.32Å; S98-D102 PolarHBondContact O-N 2.89Å; I99-D102 PolarHBondContact O-N 2.82Å; I100-D102 PolarHBondContact O-N 3.13Å; D102-F104 PolarHBondContact O-N 2.89Å; D102-M105 PolarHBondContact O-N 3.33Å; D102-M105 VanDerWaalsContact O-N 3.17Å; D102-A106 WeakPolarHBondContact O-CB 3.06Å; D102-A106 PolarHBondContact O-N 2.88Å; D102-R371 IonicContact OD1-NE 2.67Å; D102-R371 PolarHBondContact OD1-NE 3.36Å; D102-T375 PolarHBondContact OD1-OG1 3.14Å; D102-T375 WeakPolarHBondContact OD2-CB 3.4Å; D102-T375 WeakPolarHBondContact OD2-CG2 3.4Å; D102-T375 PolarHBondContact OD2-OG1 3.39Å
103	R	85.2	Confident	85.8	Confident	47 Å²	47	11.2 Å²	11.2	18%	0.177	6%	0.059	C	C	.	.	H	α-helix	trans	-63.1	-38.1	173.3	-65.6	-73.4	156.6	157.2	-10	110.8	I99 I100 S107 E723	I99-R103 PolarHBondContact O-N 2.69Å; I100-R103 HydrophobicContact CD1-CB 4.3Å; I100-R103 PolarHBondContact O-N 3.19Å; I100-R103 VanDerWaalsContact O-N 3.14Å; R103-S107 PolarHBondContact O-N 3.34Å; R103-S107 VanDerWaalsContact O-N 3.08Å; R103-E723 IonicContact CZ-OE2 3.74Å; R103-E723 IonicContact NH2-OE2 3.94Å; R103-E723 PolarHBondContact NH2-OE2 2.73Å
104	F	87.8	Confident	85.2	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-61.5	-47.3	171.3	-178.3	-125.4	0	0	0	111.7	I100 A101 D102 A106 S107 I108 L147 G148 A151 F777 S780 I781 I784	I100-F104 PolarHBondContact O-N 2.88Å; A101-F104 WeakPolarHBondContact O-CB 3.5Å; A101-F104 PolarHBondContact O-N 2.93Å; D102-F104 PolarHBondContact O-N 2.89Å; F104-A106 PolarHBondContact O-N 2.78Å; F104-S107 PolarHBondContact O-N 3.28Å; F104-S107 PolarHBondContact O-OG 3.01Å; F104-I108 HydrophobicContact CD1-CD1 4.14Å; F104-I108 HydrophobicContact CD2-CD1 4.49Å; F104-I108 HydrophobicContact CE1-CD1 3.86Å; F104-I108 HydrophobicContact CE2-CD1 4.24Å; F104-I108 HydrophobicContact CG-CD1 4.45Å; F104-I108 HydrophobicContact CZ-CD1 3.9Å; F104-I108 WeakPolarHBondContact O-CG1 3.28Å; F104-I108 PolarHBondContact O-N 2.87Å; F104-I108 VanDerWaalsContact O-N 3.14Å; F104-L147 HydrophobicContact CE1-CD2 3.98Å; F104-L147 HydrophobicContact CZ-CD2 3.61Å; F104-G148 WeakPolarHBondContact CD1-O 3.4Å; F104-G148 VanDerWaalsContact CE1-CA 3.49Å; F104-A151 HydrophobicContact CD1-CB 4.2Å; F104-A151 HydrophobicContact CE1-CB 3.56Å; F104-A151 HydrophobicContact CZ-CB 4.29Å; F104-F777 AromaticContact CD2-CD2 3.99Å; F104-F777 HydrophobicContact CD2-CD2 3.99Å; F104-F777 HydrophobicContact CD2-CE2 4.23Å; F104-F777 HydrophobicContact CD2-CG 4.49Å; F104-F777 HydrophobicContact CE2-CD1 4.38Å; F104-F777 AromaticContact CE2-CD2 3.4Å; F104-F777 HydrophobicContact CE2-CD2 3.4Å; F104-F777 VanDerWaalsContact CE2-CD2 3.4Å; F104-F777 HydrophobicContact CE2-CE1 4.25Å; F104-F777 AromaticContact CE2-CE2 3.25Å; F104-F777 HydrophobicContact CE2-CE2 3.25Å; F104-F777 AromaticContact CE2-CG 3.98Å; F104-F777 HydrophobicContact CE2-CG 3.98Å; F104-F777 AromaticContact CE2-CZ 3.71Å; F104-F777 HydrophobicContact CE2-CZ 3.71Å; F104-F777 HydrophobicContact CZ-CD2 4.22Å; F104-F777 AromaticContact CZ-CE2 3.63Å; F104-F777 HydrophobicContact CZ-CE2 3.63Å; F104-F777 AromaticContact CZ-CZ 3.96Å; F104-F777 HydrophobicContact CZ-CZ 3.96Å; F104-S780 WeakPolarHBondContact CD2-OG 3.31Å; F104-I781 HydrophobicContact CD2-CB 4.46Å; F104-I781 HydrophobicContact CE2-CB 4Å; F104-I781 HydrophobicContact CE2-CD1 4.37Å; F104-I781 HydrophobicContact CE2-CG1 4.4Å; F104-I781 HydrophobicContact CZ-CD1 4.21Å; F104-I781 HydrophobicContact CZ-CG1 4.44Å; F104-I784 HydrophobicContact CB-CD1 3.76Å; F104-I784 HydrophobicContact CD1-CD1 3.9Å; F104-I784 HydrophobicContact CG-CD1 3.86Å
105	M	84.1	Confident	84.8	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64.4	-39.7	177.2	-73.7	-70.2	-65.5	0	0	113.3	A101 D102 S107 I108 E109 G148 R367 A368	A101-M105 WeakPolarHBondContact O-CB 3.16Å; A101-M105 WeakPolarHBondContact O-CG 3.17Å; A101-M105 PolarHBondContact O-N 3.41Å; D102-M105 PolarHBondContact O-N 3.33Å; D102-M105 VanDerWaalsContact O-N 3.17Å; M105-S107 VanDerWaalsContact C-N 3.3Å; M105-S107 PolarHBondContact O-N 3.07Å; M105-I108 WeakPolarHBondContact O-CB 2.9Å; M105-I108 PolarHBondContact O-N 2.95Å; M105-I108 HydrophobicContact SD-CD1 4.36Å; M105-E109 PolarHBondContact O-N 3.29Å; M105-G148 WeakPolarHBondContact SD-CA 3.33Å; M105-R367 HydrophobicContact CE-CG 4.4Å; M105-A368 HydrophobicContact CB-CB 4.22Å; M105-A368 HydrophobicContact CE-CB 4.01Å
106	A	83.8	Confident	84.4	Confident	5 Å²	5	21 Å²	21	4%	0.041	10%	0.102	C	C	.	.	H	α-helix	trans	-60.3	-40.7	174.4	0	0	0	0	0	111.4	D102 F104 I108 E109 V110 V712 T768	D102-A106 WeakPolarHBondContact O-CB 3.06Å; D102-A106 PolarHBondContact O-N 2.88Å; F104-A106 PolarHBondContact O-N 2.78Å; A106-I108 VanDerWaalsContact C-N 3.34Å; A106-I108 PolarHBondContact O-N 2.89Å; A106-E109 PolarHBondContact O-N 3.06Å; A106-V110 WeakPolarHBondContact O-CG2 3.46Å; A106-V110 PolarHBondContact O-N 2.89Å; A106-V110 VanDerWaalsContact O-N 3.1Å; A106-V712 HydrophobicContact CB-CG1 3.84Å; A106-T768 HydrophobicContact CB-CG2 4.21Å
107	S	88.1	Confident	83.9	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.1	-38.1	175.5	76.5	0	0	0	0	112.7	R103 F104 M105 V110 I111 F777	R103-S107 PolarHBondContact O-N 3.34Å; R103-S107 VanDerWaalsContact O-N 3.08Å; F104-S107 PolarHBondContact O-N 3.28Å; F104-S107 PolarHBondContact O-OG 3.01Å; M105-S107 VanDerWaalsContact C-N 3.3Å; M105-S107 PolarHBondContact O-N 3.07Å; S107-V110 PolarHBondContact O-N 2.83Å; S107-I111 WeakPolarHBondContact O-CD1 3.25Å; S107-I111 WeakPolarHBondContact O-CG1 3.46Å; S107-I111 PolarHBondContact O-N 2.9Å; S107-F777 WeakPolarHBondContact OG-CA 3.28Å
108	I	84.3	Confident	83.4	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.1	-40.3	176.3	-69.3	169.4	0	0	0	111	F104 M105 A106 I111 T112 L144 M145 G148 F777	F104-I108 HydrophobicContact CD1-CD1 4.14Å; F104-I108 HydrophobicContact CD2-CD1 4.49Å; F104-I108 HydrophobicContact CE1-CD1 3.86Å; F104-I108 HydrophobicContact CE2-CD1 4.24Å; F104-I108 HydrophobicContact CG-CD1 4.45Å; F104-I108 HydrophobicContact CZ-CD1 3.9Å; F104-I108 WeakPolarHBondContact O-CG1 3.28Å; F104-I108 PolarHBondContact O-N 2.87Å; F104-I108 VanDerWaalsContact O-N 3.14Å; M105-I108 WeakPolarHBondContact O-CB 2.9Å; M105-I108 PolarHBondContact O-N 2.95Å; M105-I108 HydrophobicContact SD-CD1 4.36Å; A106-I108 VanDerWaalsContact C-N 3.34Å; A106-I108 PolarHBondContact O-N 2.89Å; I108-I111 PolarHBondContact O-N 3.4Å; I108-T112 HydrophobicContact CG2-CG2 4.24Å; I108-T112 WeakPolarHBondContact O-CB 3.47Å; I108-T112 WeakPolarHBondContact O-CG2 3.45Å; I108-T112 PolarHBondContact O-N 2.95Å; I108-T112 PolarHBondContact O-OG1 3.38Å; I108-L144 WeakPolarHBondContact CD1-O 3.41Å; I108-L144 HydrophobicContact CG2-CB 3.6Å; I108-M145 HydrophobicContact CG2-CG 4.21Å; I108-G148 VanDerWaalsContact CD1-CA 3.49Å; I108-F777 HydrophobicContact CD1-CD2 4.45Å; I108-F777 HydrophobicContact CD1-CE2 4.07Å; I108-F777 HydrophobicContact CG1-CD2 3.79Å; I108-F777 HydrophobicContact CG1-CE2 3.76Å
109	E	81.9	Confident	83	Confident	7 Å²	7	35.6 Å²	35.6	3%	0.033	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-48	176.8	-173.8	166.3	-167.8	0	0	111.5	M105 A106 I111 T112 S113 S366 A368 F369 A709 V712	M105-E109 PolarHBondContact O-N 3.29Å; A106-E109 PolarHBondContact O-N 3.06Å; E109-I111 VanDerWaalsContact C-N 3.33Å; E109-I111 PolarHBondContact O-N 2.8Å; E109-T112 PolarHBondContact O-N 2.88Å; E109-T112 PolarHBondContact O-OG1 2.81Å; E109-T112 VanDerWaalsContact O-OG1 3.13Å; E109-S113 VanDerWaalsContact O-CB 3.27Å; E109-S113 WeakPolarHBondContact O-CB 3.41Å; E109-S113 PolarHBondContact O-N 2.87Å; E109-S113 PolarHBondContact O-OG 3.15Å; E109-S113 VanDerWaalsContact O-OG 3.13Å; E109-S366 VanDerWaalsContact OE1-CB 3.25Å; E109-S366 WeakPolarHBondContact OE1-CB 3.35Å; E109-S366 PolarHBondContact OE1-OG 2.86Å; E109-S366 PolarHBondContact OE2-OG 2.86Å; E109-A368 HydrophobicContact CB-CB 3.77Å; E109-A368 HydrophobicContact CG-CB 4.28Å; E109-A368 WeakPolarHBondContact OE2-CB 3.5Å; E109-F369 PolarHBondContact OE2-N 3.4Å; E109-A709 HydrophobicContact CG-CB 3.87Å; E109-V712 VanDerWaalsContact OE2-CB 3.3Å; E109-V712 WeakPolarHBondContact OE2-CB 3.39Å; E109-V712 VanDerWaalsContact OE2-CG1 3.28Å; E109-V712 WeakPolarHBondContact OE2-CG1 3.44Å; E109-V712 VanDerWaalsContact OE2-CG2 3.27Å; E109-V712 WeakPolarHBondContact OE2-CG2 3.22Å
110	V	83.7	Confident	82.5	Confident	18 Å²	18	38.9 Å²	38.9	11%	0.109	19%	0.194	C	C	.	.	H	α-helix	trans	-62.7	-37.8	176.9	174.1	0	0	0	0	112.3	A106 S107 T112 S113 Q114	A106-V110 WeakPolarHBondContact O-CG2 3.46Å; A106-V110 PolarHBondContact O-N 2.89Å; A106-V110 VanDerWaalsContact O-N 3.1Å; S107-V110 PolarHBondContact O-N 2.83Å; V110-T112 VanDerWaalsContact C-N 3.35Å; V110-S113 PolarHBondContact O-OG 3.1Å; V110-Q114 WeakPolarHBondContact O-CG 3.41Å
111	I	85.9	Confident	81.9	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-65.8	-39.8	176.1	-70.2	163.7	0	0	0	111	S107 I108 E109 Q114 W135 L144 S772 W774 F777	S107-I111 WeakPolarHBondContact O-CD1 3.25Å; S107-I111 WeakPolarHBondContact O-CG1 3.46Å; S107-I111 PolarHBondContact O-N 2.9Å; I108-I111 PolarHBondContact O-N 3.4Å; E109-I111 VanDerWaalsContact C-N 3.33Å; E109-I111 PolarHBondContact O-N 2.8Å; I111-Q114 WeakPolarHBondContact O-CG 3.21Å; I111-W135 PolarHBondContact O-NE1 2.86Å; I111-L144 HydrophobicContact CG2-CD1 4.17Å; I111-S772 WeakPolarHBondContact CG1-O 3.4Å; I111-W774 HydrophobicContact CD1-CD2 3.86Å; I111-W774 HydrophobicContact CD1-CE3 4.08Å; I111-W774 HydrophobicContact CD1-CG 4.23Å; I111-W774 HydrophobicContact CD1-CZ2 4.4Å; I111-W774 HydrophobicContact CD1-CZ3 4.44Å; I111-W774 HydrophobicContact CG1-CD2 4.39Å; I111-W774 HydrophobicContact CG1-CG 4.48Å; I111-W774 HydrophobicContact CG2-CZ2 3.83Å; I111-F777 HydrophobicContact CD1-CB 4.09Å; I111-F777 HydrophobicContact CD1-CD2 4.17Å; I111-F777 HydrophobicContact CD1-CG 4.31Å
112	T	81.6	Confident	81.3	Confident	10 Å²	10	49.7 Å²	49.7	6%	0.061	24%	0.241	C	C	.	.	H	α-helix	trans	-86	-21.5	-172.5	57	0	0	0	0	113.4	I108 E109 V110 Q114 S140 L144	I108-T112 HydrophobicContact CG2-CG2 4.24Å; I108-T112 WeakPolarHBondContact O-CB 3.47Å; I108-T112 WeakPolarHBondContact O-CG2 3.45Å; I108-T112 PolarHBondContact O-N 2.95Å; I108-T112 PolarHBondContact O-OG1 3.38Å; E109-T112 PolarHBondContact O-N 2.88Å; E109-T112 PolarHBondContact O-OG1 2.81Å; E109-T112 VanDerWaalsContact O-OG1 3.13Å; V110-T112 VanDerWaalsContact C-N 3.35Å; T112-Q114 VanDerWaalsContact C-N 3.28Å; T112-Q114 PolarHBondContact O-N 3.07Å; T112-S140 WeakPolarHBondContact CB-OG 3.34Å; T112-S140 WeakPolarHBondContact CG2-OG 3.5Å; T112-L144 HydrophobicContact CG2-CB 4.18Å; T112-L144 HydrophobicContact CG2-CD1 3.67Å
113	S	79.4	Confident	80.7	Confident	21 Å²	21	56 Å²	56	15%	0.147	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	4.1	176.2	70.7	0	0	0	0	114.3	E109 V110 E115 A709	E109-S113 VanDerWaalsContact O-CB 3.27Å; E109-S113 WeakPolarHBondContact O-CB 3.41Å; E109-S113 PolarHBondContact O-N 2.87Å; E109-S113 PolarHBondContact O-OG 3.15Å; E109-S113 VanDerWaalsContact O-OG 3.13Å; V110-S113 PolarHBondContact O-OG 3.1Å; S113-E115 PolarHBondContact O-N 3.49Å; S113-A709 WeakPolarHBondContact OG-CB 3.36Å
114	Q	80.1	Confident	80	Confident	54 Å²	54	58.6 Å²	58.6	25%	0.252	30%	0.3	S	S	.	.			trans	-63.1	129.1	179.3	-67	-177.2	9.4	0	0	110.9	V110 I111 T112 I134 S772	V110-Q114 WeakPolarHBondContact O-CG 3.41Å; I111-Q114 WeakPolarHBondContact O-CG 3.21Å; T112-Q114 VanDerWaalsContact C-N 3.28Å; T112-Q114 PolarHBondContact O-N 3.07Å; Q114-I134 HydrophobicContact CB-CD1 3.77Å; Q114-I134 HydrophobicContact CB-CG1 4.38Å; Q114-I134 WeakPolarHBondContact O-CG1 3.42Å; Q114-I134 PolarHBondContact O-N 3.33Å; Q114-S772 PolarHBondContact NE2-O 3.09Å
115	E	80.3	Confident	79.4	Confident	99 Å²	99	60.6 Å²	60.6	46%	0.463	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	142.1	177.6	-65.5	-179.2	179.9	0	0	109.8	S113 R133	S113-E115 PolarHBondContact O-N 3.49Å; E115-R133 HydrophobicContact CG-CG 4Å
116	K	79.8	Confident	78.8	Confident	131 Å²	131	66.1 Å²	66.1	57%	0.57	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.9	131.2	175.5	-177.7	172.8	-177.1	177.2	0	109.2	I118 V132 I134	K116-I118 HydrophobicContact CG-CG1 4.49Å; K116-I118 PolarHBondContact O-N 3.42Å; K116-V132 PolarHBondContact N-O 3.16Å; K116-V132 PolarHBondContact O-N 2.85Å; K116-I134 HydrophobicContact CB-CD1 4.1Å; K116-I134 HydrophobicContact CB-CG1 3.65Å
117	E	78.8	Confident	78.3	Confident	150 Å²	150	70.5 Å²	70.5	70%	0.701	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	123.2	171	-71	177.8	-170.5	0	0	109.8	T131	E117-T131 HydrophobicContact CG-CG2 3.64Å
118	I	79.1	Confident	77.6	Confident	75 Å²	75	72.3 Å²	72.3	39%	0.385	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	126.2	176.5	-54.4	178.1	0	0	0	108	K116 I120 T130 V132	K116-I118 HydrophobicContact CG-CG1 4.49Å; K116-I118 PolarHBondContact O-N 3.42Å; I118-I120 HydrophobicContact CG2-CG1 4.25Å; I118-I120 PolarHBondContact O-N 2.81Å; I118-T130 PolarHBondContact N-O 2.85Å; I118-T130 PolarHBondContact O-N 2.77Å; I118-V132 HydrophobicContact CD1-CB 4Å; I118-V132 HydrophobicContact CD1-CG2 4.17Å
119	T	76.3	Confident	77	Confident	101 Å²	101	75.9 Å²	75.9	62%	0.62	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	104.4	170.7	51.6	0	0	0	0	109	T129	T119-T129 HydrophobicContact CG2-CG2 3.79Å
120	I	77.4	Confident	76.5	Confident	84 Å²	84	78.3 Å²	78.3	43%	0.431	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	120.5	173.8	-58	175.6	0	0	0	107.5	I118 K122 T128	I118-I120 HydrophobicContact CG2-CG1 4.25Å; I118-I120 PolarHBondContact O-N 2.81Å; I120-K122 PolarHBondContact O-N 3Å; I120-T128 PolarHBondContact N-O 2.97Å; I120-T128 PolarHBondContact O-N 3.22Å; I120-T128 PolarHBondContact O-OG1 3.39Å
121	K	75.9	Confident	75.9	Confident	154 Å²	154	81 Å²	81	67%	0.67	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	111.8	172.5	-167.6	172.4	-176.6	174.4	0	108.6	T127	K121-T127 HydrophobicContact CB-CG2 4.48Å; K121-T127 HydrophobicContact CG-CG2 4.32Å
122	K	73.2	Confident	75.3	Confident	73 Å²	73	83.9 Å²	83.9	32%	0.317	46%	0.455	S	S	.	.			trans	-68.5	157.8	175	-74.6	178.9	178	175.4	0	109.8	I120 N124 G125 E126 T128	I120-K122 PolarHBondContact O-N 3Å; K122-N124 WeakPolarHBondContact CB-OD1 3.19Å; K122-N124 PolarHBondContact O-N 3.1Å; K122-N124 VanDerWaalsContact O-N 3.15Å; K122-G125 PolarHBondContact O-N 3.09Å; K122-E126 PolarHBondContact N-O 3.33Å; K122-T128 HydrophobicContact CD-CG2 4.06Å; K122-T128 VanDerWaalsContact CE-CG2 3.48Å
123	P	69	Low	74.7	Confident	147 Å²	147	90 Å²	90	96%	0.955	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-15.3	-179.6	22.7	-31.9	0	0	0	114.4	G125	P123-G125 VanDerWaalsContact C-N 3.32Å
124	N	70.4	Confident	74.8	Confident	101 Å²	101	93.2 Å²	93.2	54%	0.54	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-3.7	172.2	61.7	-10	0	0	0	113.5	K122 E126	K122-N124 WeakPolarHBondContact CB-OD1 3.19Å; K122-N124 PolarHBondContact O-N 3.1Å; K122-N124 VanDerWaalsContact O-N 3.15Å; N124-E126 PolarHBondContact ND2-OE2 3.44Å; N124-E126 PolarHBondContact OD1-N 3.43Å
125	G	73.4	Confident	74.6	Confident	41 Å²	41	94.7 Å²	94.7	42%	0.423	50%	0.495	S	S	.	.	S	Bend	trans	94.9	-12.3	176.3	0	0	0	0	0	115.2	K122 P123	K122-G125 PolarHBondContact O-N 3.09Å; P123-G125 VanDerWaalsContact C-N 3.32Å
126	E	73.5	Confident	74.6	Confident	116 Å²	116	91.8 Å²	91.8	54%	0.542	48%	0.482	S	S	.	.			trans	-72.5	141.7	175.5	-72	170	167.2	0	0	111.8	K122 N124	K122-E126 PolarHBondContact N-O 3.33Å; N124-E126 PolarHBondContact ND2-OE2 3.44Å; N124-E126 PolarHBondContact OD1-N 3.43Å
127	T	73.3	Confident	74.2	Confident	98 Å²	98	91.1 Å²	91.1	60%	0.601	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	108.7	177.3	51.2	0	0	0	0	109.6	K121	K121-T127 HydrophobicContact CB-CG2 4.48Å; K121-T127 HydrophobicContact CG-CG2 4.32Å
128	T	71.6	Confident	74	Confident	37 Å²	37	85 Å²	85	23%	0.227	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	127.7	173.4	49.7	0	0	0	0	110.2	I120 K122	I120-T128 PolarHBondContact N-O 2.97Å; I120-T128 PolarHBondContact O-N 3.22Å; I120-T128 PolarHBondContact O-OG1 3.39Å; K122-T128 HydrophobicContact CD-CG2 4.06Å; K122-T128 VanDerWaalsContact CE-CG2 3.48Å
129	T	72.9	Confident	74.1	Confident	76 Å²	76	82.8 Å²	82.8	47%	0.466	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	110.6	172.8	47.7	0	0	0	0	109.7	T119 K321	T119-T129 HydrophobicContact CG2-CG2 3.79Å; T129-K321 PolarHBondContact O-NZ 3.44Å
130	T	70.9	Confident	74.2	Confident	58 Å²	58	78.1 Å²	78.1	36%	0.356	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129.7	175.9	-51.8	0	0	0	0	109.1	I118 V132	I118-T130 PolarHBondContact N-O 2.85Å; I118-T130 PolarHBondContact O-N 2.77Å; T130-V132 HydrophobicContact CG2-CG2 4.16Å
131	T	70.9	Confident	74.1	Confident	75 Å²	75	76.3 Å²	76.3	46%	0.46	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	124.1	169.1	46.7	0	0	0	0	108.7	E117	E117-T131 HydrophobicContact CG-CG2 3.64Å
132	V	72.6	Confident	74	Confident	61 Å²	61	69.5 Å²	69.5	37%	0.37	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	135.7	177.8	-175.7	0	0	0	0	108.3	K116 I118 T130 I134	K116-V132 PolarHBondContact N-O 3.16Å; K116-V132 PolarHBondContact O-N 2.85Å; I118-V132 HydrophobicContact CD1-CB 4Å; I118-V132 HydrophobicContact CD1-CG2 4.17Å; T130-V132 HydrophobicContact CG2-CG2 4.16Å; V132-I134 PolarHBondContact O-N 2.86Å
133	R	70.6	Confident	74.3	Confident	137 Å²	137	67 Å²	67	52%	0.517	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	133.3	172.2	-69.8	-177.2	179.2	175.9	-0.6	110.3	E115 W135	E115-R133 HydrophobicContact CG-CG 4Å; R133-W135 VanDerWaalsContact C-N 3.29Å; R133-W135 PolarHBondContact O-N 3.47Å
134	I	80.4	Confident	74.6	Confident	90 Å²	90	61 Å²	61	46%	0.462	33%	0.329	S	S	.	.	S	Bend	trans	-64.1	-40.8	179.2	-64.2	177.3	0	0	0	110.1	Q114 K116 V132	Q114-I134 HydrophobicContact CB-CD1 3.77Å; Q114-I134 HydrophobicContact CB-CG1 4.38Å; Q114-I134 WeakPolarHBondContact O-CG1 3.42Å; Q114-I134 PolarHBondContact O-N 3.33Å; K116-I134 HydrophobicContact CB-CD1 4.1Å; K116-I134 HydrophobicContact CB-CG1 3.65Å; V132-I134 PolarHBondContact O-N 2.86Å
135	W	76.1	Confident	74.7	Confident	85 Å²	85	56.9 Å²	56.9	32%	0.322	31%	0.306	S	S	.	.	S	Bend	trans	-93.1	134.5	-178.7	-65.1	91	0	0	0	111.4	I111 R133 L144	I111-W135 PolarHBondContact O-NE1 2.86Å; R133-W135 VanDerWaalsContact C-N 3.29Å; R133-W135 PolarHBondContact O-N 3.47Å; W135-L144 HydrophobicContact CH2-CD1 4.18Å; W135-L144 HydrophobicContact CZ2-CD1 4.23Å; W135-L144 HydrophobicContact CZ3-CD1 4.46Å
136	N	79.4	Confident	74.8	Confident	37 Å²	37	55 Å²	55	20%	0.198	29%	0.287	C	S	.	.			trans	-70.3	133.7	165.7	170.9	-84.4	0	0	0	108.9	T138 V139 S140 D258	N136-T138 PolarHBondContact O-N 3.38Å; N136-T138 WeakPolarHBondContact OD1-CB 3.5Å; N136-T138 PolarHBondContact OD1-N 2.85Å; N136-V139 HydrophobicContact CB-CB 4.22Å; N136-V139 HydrophobicContact CB-CG2 4.15Å; N136-V139 PolarHBondContact O-N 3.43Å; N136-V139 PolarHBondContact OD1-N 2.82Å; N136-V139 VanDerWaalsContact OD1-N 3.09Å; N136-S140 WeakPolarHBondContact O-CB 3.41Å; N136-S140 PolarHBondContact O-N 3.43Å; N136-D258 PolarHBondContact ND2-OD2 3.12Å
137	E	73	Confident	75.1	Confident	118 Å²	118	51 Å²	51	55%	0.551	27%	0.269	S	S	*	.	H	α-helix	trans	-58.1	-46.3	-175.2	-170.4	179.2	171	0	0	112.9	V139 S140 N141	E137-V139 VanDerWaalsContact C-N 3.33Å; E137-V139 PolarHBondContact O-N 2.87Å; E137-S140 PolarHBondContact O-N 2.95Å; E137-N141 WeakPolarHBondContact O-CB 3.35Å; E137-N141 PolarHBondContact O-N 2.81Å; E137-N141 PolarHBondContact O-ND2 3.35Å; E137-N141 PolarHBondContact O-OD1 3.15Å
138	T	73.5	Confident	75.4	Confident	22 Å²	22	46.4 Å²	46.4	14%	0.135	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-42.7	177.3	-56.1	0	0	0	0	111.8	N136 L142 V208 A254 D258	N136-T138 PolarHBondContact O-N 3.38Å; N136-T138 WeakPolarHBondContact OD1-CB 3.5Å; N136-T138 PolarHBondContact OD1-N 2.85Å; T138-L142 WeakPolarHBondContact O-CB 3.14Å; T138-L142 PolarHBondContact O-N 3.35Å; T138-L142 VanDerWaalsContact O-N 3.14Å; T138-V208 HydrophobicContact CG2-CG1 3.74Å; T138-V208 HydrophobicContact CG2-CG2 4.45Å; T138-A254 HydrophobicContact CG2-CB 4.19Å; T138-D258 HydrophobicContact CG2-CB 4.29Å; T138-D258 PolarHBondContact OG1-OD2 3.45Å; T138-D258 VanDerWaalsContact OG1-OD2 3.06Å
139	V	81.4	Confident	75.6	Confident	27 Å²	27	44.6 Å²	44.6	16%	0.164	23%	0.23	C	C	.	.	H	α-helix	trans	-67.8	-46.2	178.1	174.3	0	0	0	0	110.8	N136 E137 N141 L142 T143 V251 W255	N136-V139 HydrophobicContact CB-CB 4.22Å; N136-V139 HydrophobicContact CB-CG2 4.15Å; N136-V139 PolarHBondContact O-N 3.43Å; N136-V139 PolarHBondContact OD1-N 2.82Å; N136-V139 VanDerWaalsContact OD1-N 3.09Å; E137-V139 VanDerWaalsContact C-N 3.33Å; E137-V139 PolarHBondContact O-N 2.87Å; V139-N141 PolarHBondContact O-N 2.81Å; V139-L142 PolarHBondContact O-N 3.39Å; V139-T143 HydrophobicContact CG1-CG2 4.17Å; V139-T143 VanDerWaalsContact O-CB 3.31Å; V139-T143 WeakPolarHBondContact O-CB 3.49Å; V139-T143 WeakPolarHBondContact O-CG2 3.27Å; V139-T143 PolarHBondContact O-N 3.25Å; V139-T143 PolarHBondContact O-OG1 3.38Å; V139-V251 HydrophobicContact CB-CG1 4.47Å; V139-V251 HydrophobicContact CG1-CG1 3.85Å; V139-V251 HydrophobicContact CG2-CG1 4.24Å; V139-W255 HydrophobicContact CG2-CB 3.8Å; V139-W255 HydrophobicContact CG2-CG 4.04Å
140	S	79	Confident	76.3	Confident	4 Å²	4	41 Å²	41	3%	0.028	21%	0.208	C	C	.	.	H	α-helix	trans	-57.1	-47.9	177.1	175.7	0	0	0	0	111.7	T112 N136 E137 L142 T143 L144 M145	T112-S140 WeakPolarHBondContact CB-OG 3.34Å; T112-S140 WeakPolarHBondContact CG2-OG 3.5Å; N136-S140 WeakPolarHBondContact O-CB 3.41Å; N136-S140 PolarHBondContact O-N 3.43Å; E137-S140 PolarHBondContact O-N 2.95Å; S140-L142 PolarHBondContact O-N 2.77Å; S140-T143 PolarHBondContact O-N 2.83Å; S140-L144 PolarHBondContact O-N 3.07Å; S140-L144 VanDerWaalsContact O-N 3.1Å; S140-M145 PolarHBondContact O-N 3.15Å
141	N	73.9	Confident	77.1	Confident	46 Å²	46	38.4 Å²	38.4	25%	0.246	19%	0.192	C	C	.	.	I	π-helix	trans	-62.9	-43.5	-178.7	-69.8	-7.9	0	0	0	111.8	E137 V139 M145 A146	E137-N141 WeakPolarHBondContact O-CB 3.35Å; E137-N141 PolarHBondContact O-N 2.81Å; E137-N141 PolarHBondContact O-ND2 3.35Å; E137-N141 PolarHBondContact O-OD1 3.15Å; V139-N141 PolarHBondContact O-N 2.81Å; N141-M145 WeakPolarHBondContact OD1-CE 3Å; N141-M145 PolarHBondContact OD1-SD 3.2Å; N141-A146 PolarHBondContact O-N 3.37Å
142	L	74.7	Confident	77.8	Confident	11 Å²	11	35 Å²	35	6%	0.058	17%	0.171	C	C	.	.	I	π-helix	trans	-79.2	-27.7	-178.4	-168.6	65	0	0	0	113.4	T138 V139 S140 A146 T212 V251 A254	T138-L142 WeakPolarHBondContact O-CB 3.14Å; T138-L142 PolarHBondContact O-N 3.35Å; T138-L142 VanDerWaalsContact O-N 3.14Å; V139-L142 PolarHBondContact O-N 3.39Å; S140-L142 PolarHBondContact O-N 2.77Å; L142-A146 WeakPolarHBondContact O-CB 3.39Å; L142-T212 HydrophobicContact CD1-CG2 4.08Å; L142-T212 HydrophobicContact CD2-CG2 4.41Å; L142-V251 HydrophobicContact CD2-CG2 4.04Å; L142-V251 HydrophobicContact CG-CG2 4.35Å; L142-A254 HydrophobicContact CD2-CB 3.69Å
143	T	79.8	Confident	78.7	Confident	20 Å²	20	32.1 Å²	32.1	12%	0.123	15%	0.153	C	C	.	.	I	π-helix	trans	-92.1	-78.5	-177.6	55.3	0	0	0	0	111.8	V139 S140 L147 F247 V251	V139-T143 HydrophobicContact CG1-CG2 4.17Å; V139-T143 VanDerWaalsContact O-CB 3.31Å; V139-T143 WeakPolarHBondContact O-CB 3.49Å; V139-T143 WeakPolarHBondContact O-CG2 3.27Å; V139-T143 PolarHBondContact O-N 3.25Å; V139-T143 PolarHBondContact O-OG1 3.38Å; S140-T143 PolarHBondContact O-N 2.83Å; T143-L147 WeakPolarHBondContact O-CB 3.32Å; T143-L147 PolarHBondContact O-N 2.9Å; T143-L147 VanDerWaalsContact O-N 3.13Å; T143-F247 HydrophobicContact CG2-CZ 3.93Å; T143-V251 HydrophobicContact CG2-CB 4.22Å; T143-V251 HydrophobicContact CG2-CG1 3.69Å; T143-V251 HydrophobicContact CG2-CG2 3.45Å; T143-V251 VanDerWaalsContact CG2-CG2 3.45Å
144	L	75.9	Confident	79.6	Confident	22 Å²	22	26.3 Å²	26.3	12%	0.115	13%	0.133	C	C	.	.	I	π-helix	trans	-77.5	-41.6	-171.7	-67.4	172.2	0	0	0	111.2	I108 I111 T112 W135 S140 L147 G148	I108-L144 WeakPolarHBondContact CD1-O 3.41Å; I108-L144 HydrophobicContact CG2-CB 3.6Å; I111-L144 HydrophobicContact CG2-CD1 4.17Å; T112-L144 HydrophobicContact CG2-CB 4.18Å; T112-L144 HydrophobicContact CG2-CD1 3.67Å; W135-L144 HydrophobicContact CH2-CD1 4.18Å; W135-L144 HydrophobicContact CZ2-CD1 4.23Å; W135-L144 HydrophobicContact CZ3-CD1 4.46Å; S140-L144 PolarHBondContact O-N 3.07Å; S140-L144 VanDerWaalsContact O-N 3.1Å; L144-L147 PolarHBondContact O-N 2.98Å; L144-G148 PolarHBondContact O-N 3.38Å
145	M	72.4	Confident	80.1	Confident	13 Å²	13	23.6 Å²	23.6	6%	0.064	12%	0.119	C	C	.	.	I	π-helix	trans	-69.4	-42.4	-178.5	-56.6	-162.7	-173.2	0	0	112	I108 S140 N141 G148 R367	I108-M145 HydrophobicContact CG2-CG 4.21Å; S140-M145 PolarHBondContact O-N 3.15Å; N141-M145 WeakPolarHBondContact OD1-CE 3Å; N141-M145 PolarHBondContact OD1-SD 3.2Å; M145-G148 PolarHBondContact O-N 2.77Å; M145-R367 PolarHBondContact O-NH1 3.25Å; M145-R367 HydrophobicContact SD-CB 4.15Å
146	A	74.4	Confident	80.8	Confident	2 Å²	2	19.9 Å²	19.9	2%	0.017	11%	0.105	C	C	.	.	H	α-helix	trans	-65	-40.9	175.8	0	0	0	0	0	112.5	N141 L142 G148 S149 S150 V849	N141-A146 PolarHBondContact O-N 3.37Å; L142-A146 WeakPolarHBondContact O-CB 3.39Å; A146-G148 VanDerWaalsContact C-N 3.27Å; A146-G148 PolarHBondContact O-N 3.07Å; A146-S149 PolarHBondContact O-N 3.3Å; A146-S149 PolarHBondContact O-OG 3.45Å; A146-S150 WeakPolarHBondContact O-CB 3.31Å; A146-S150 PolarHBondContact O-N 3.18Å; A146-S150 PolarHBondContact O-OG 2.81Å; A146-V849 HydrophobicContact CB-CG2 3.9Å
147	L	81.1	Confident	81.3	Confident	33 Å²	33	18.1 Å²	18.1	17%	0.173	10%	0.096	C	C	.	.	H	α-helix	trans	-59.9	-40.5	172.1	-177.1	159.7	0	0	0	111.3	F104 T143 L144 S149 S150 A151 L853	F104-L147 HydrophobicContact CE1-CD2 3.98Å; F104-L147 HydrophobicContact CZ-CD2 3.61Å; T143-L147 WeakPolarHBondContact O-CB 3.32Å; T143-L147 PolarHBondContact O-N 2.9Å; T143-L147 VanDerWaalsContact O-N 3.13Å; L144-L147 PolarHBondContact O-N 2.98Å; L147-S149 VanDerWaalsContact C-N 3.27Å; L147-S149 PolarHBondContact O-N 3.42Å; L147-S150 CarbonylContact O-C 3.6Å; L147-S150 PolarHBondContact O-N 2.85Å; L147-S150 VanDerWaalsContact O-N 3.09Å; L147-A151 PolarHBondContact O-N 2.86Å; L147-L853 HydrophobicContact CD1-CD2 3.53Å; L147-L853 HydrophobicContact CG-CD2 4.05Å
148	G	78	Confident	82.1	Confident	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-48.7	-43.6	178.1	0	0	0	0	0	114.7	F104 M105 I108 L144 M145 A146	F104-G148 WeakPolarHBondContact CD1-O 3.4Å; F104-G148 VanDerWaalsContact CE1-CA 3.49Å; M105-G148 WeakPolarHBondContact SD-CA 3.33Å; I108-G148 VanDerWaalsContact CD1-CA 3.49Å; L144-G148 PolarHBondContact O-N 3.38Å; M145-G148 PolarHBondContact O-N 2.77Å; A146-G148 VanDerWaalsContact C-N 3.27Å; A146-G148 PolarHBondContact O-N 3.07Å
149	S	77.2	Confident	82.9	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-81.4	-31.9	177.3	51.1	0	0	0	0	114.8	A146 L147 R367 D822	A146-S149 PolarHBondContact O-N 3.3Å; A146-S149 PolarHBondContact O-OG 3.45Å; L147-S149 VanDerWaalsContact C-N 3.27Å; L147-S149 PolarHBondContact O-N 3.42Å; S149-R367 VanDerWaalsContact OG-CZ 3.28Å; S149-R367 PolarHBondContact OG-NH1 2.95Å; S149-R367 PolarHBondContact OG-NH2 3.13Å; S149-D822 WeakPolarHBondContact CB-OD1 3.19Å; S149-D822 WeakPolarHBondContact CB-OD2 3.1Å
150	S	87.3	Confident	83.3	Confident	1 Å²	1	13.9 Å²	13.9	1%	0.007	8%	0.075	C	C	.	.	H	α-helix	trans	-88.4	-3.7	-173.4	-68.6	0	0	0	0	113.7	A146 L147 P152 E153 I154 S846 N850	A146-S150 WeakPolarHBondContact O-CB 3.31Å; A146-S150 PolarHBondContact O-N 3.18Å; A146-S150 PolarHBondContact O-OG 2.81Å; L147-S150 CarbonylContact O-C 3.6Å; L147-S150 PolarHBondContact O-N 2.85Å; L147-S150 VanDerWaalsContact O-N 3.09Å; S150-P152 VanDerWaalsContact C-CD 3.5Å; S150-E153 WeakPolarHBondContact CA-OE2 3.29Å; S150-E153 PolarHBondContact O-N 2.92Å; S150-E153 VanDerWaalsContact O-OE2 3.07Å; S150-I154 WeakPolarHBondContact O-CB 2.93Å; S150-I154 WeakPolarHBondContact O-CD1 3.17Å; S150-I154 WeakPolarHBondContact O-CG1 3.39Å; S150-I154 PolarHBondContact O-N 2.99Å; S150-S846 WeakPolarHBondContact OG-CB 3.31Å; S150-N850 WeakPolarHBondContact CB-OD1 3.48Å; S150-N850 PolarHBondContact OG-OD1 3Å
151	A	87.8	Confident	83.8	Confident	2 Å²	2	13.9 Å²	13.9	2%	0.017	8%	0.075	C	C	.	.	H	α-helix	trans	-57.2	-41.7	-175.1	0	0	0	0	0	113.2	F104 L147 E153 I154 L155	F104-A151 HydrophobicContact CD1-CB 4.2Å; F104-A151 HydrophobicContact CE1-CB 3.56Å; F104-A151 HydrophobicContact CZ-CB 4.29Å; L147-A151 PolarHBondContact O-N 2.86Å; A151-E153 PolarHBondContact O-N 2.88Å; A151-I154 PolarHBondContact O-N 2.84Å; A151-L155 VanDerWaalsContact O-CB 3.24Å; A151-L155 WeakPolarHBondContact O-CB 3.5Å; A151-L155 WeakPolarHBondContact O-CD1 3.29Å; A151-L155 VanDerWaalsContact O-CG 3.22Å; A151-L155 WeakPolarHBondContact O-CG 3.35Å; A151-L155 PolarHBondContact O-N 2.84Å
152	P	86.1	Confident	84.5	Confident	3 Å²	3	16 Å²	16	2%	0.019	9%	0.085	C	C	.	.	H	α-helix	trans	-59	-44.3	176.8	-25.4	36.2	0	0	0	113.5	V97 S150 L156 I784 T788 T818	V97-P152 HydrophobicContact CG1-CB 4.06Å; V97-P152 HydrophobicContact CG1-CG 3.69Å; S150-P152 VanDerWaalsContact C-CD 3.5Å; P152-L156 VanDerWaalsContact O-CB 3.3Å; P152-L156 WeakPolarHBondContact O-CB 3.34Å; P152-L156 PolarHBondContact O-N 3.02Å; P152-I784 HydrophobicContact CB-CG2 4.43Å; P152-I784 HydrophobicContact CG-CG2 4.08Å; P152-T788 HydrophobicContact CB-CG2 3.78Å; P152-T818 HydrophobicContact CB-CG2 4.12Å
153	E	89.8	Confident	85	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-69.2	-43.2	-179.8	-61.3	86.3	169.9	0	0	112	S150 A151 L156 S157 T175 I176 T818	S150-E153 WeakPolarHBondContact CA-OE2 3.29Å; S150-E153 PolarHBondContact O-N 2.92Å; S150-E153 VanDerWaalsContact O-OE2 3.07Å; A151-E153 PolarHBondContact O-N 2.88Å; E153-L156 PolarHBondContact O-N 2.87Å; E153-S157 PolarHBondContact O-N 2.85Å; E153-T175 HydrophobicContact CG-CG2 4.41Å; E153-I176 HydrophobicContact CB-CG1 4.22Å; E153-T818 WeakPolarHBondContact OE1-CB 3.24Å; E153-T818 PolarHBondContact OE1-OG1 2.83Å
154	I	90.8	Very high	85.2	Confident	16 Å²	16	20.1 Å²	20.1	8%	0.082	11%	0.112	C	C	.	.	H	α-helix	trans	-62.4	-48.2	178.1	-68.8	164.2	0	0	0	110	S150 A151 S157 V158 V849 L853	S150-I154 WeakPolarHBondContact O-CB 2.93Å; S150-I154 WeakPolarHBondContact O-CD1 3.17Å; S150-I154 WeakPolarHBondContact O-CG1 3.39Å; S150-I154 PolarHBondContact O-N 2.99Å; A151-I154 PolarHBondContact O-N 2.84Å; I154-S157 PolarHBondContact O-N 3.13Å; I154-V158 WeakPolarHBondContact O-CG2 3.31Å; I154-V158 PolarHBondContact O-N 2.97Å; I154-V158 VanDerWaalsContact O-N 3.11Å; I154-V849 HydrophobicContact CD1-CG1 4.09Å; I154-L853 HydrophobicContact CD1-CB 4.4Å; I154-L853 HydrophobicContact CD1-CD2 4.04Å; I154-L853 HydrophobicContact CD1-CG 4.45Å
155	L	90.9	Very high	85.6	Confident	32 Å²	32	21 Å²	21	17%	0.168	13%	0.126	C	C	.	.	H	α-helix	trans	-66.7	-38	-179.8	-72	167.1	0	0	0	111.5	A151 S157 V158 I159 I781 I784	A151-L155 VanDerWaalsContact O-CB 3.24Å; A151-L155 WeakPolarHBondContact O-CB 3.5Å; A151-L155 WeakPolarHBondContact O-CD1 3.29Å; A151-L155 VanDerWaalsContact O-CG 3.22Å; A151-L155 WeakPolarHBondContact O-CG 3.35Å; A151-L155 PolarHBondContact O-N 2.84Å; L155-S157 VanDerWaalsContact C-N 3.34Å; L155-S157 PolarHBondContact O-N 3.32Å; L155-V158 PolarHBondContact O-N 2.87Å; L155-I159 HydrophobicContact CB-CD1 4.28Å; L155-I159 VanDerWaalsContact O-CB 3.28Å; L155-I159 WeakPolarHBondContact O-CB 3.29Å; L155-I159 WeakPolarHBondContact O-CD1 3.42Å; L155-I159 WeakPolarHBondContact O-CG1 3.29Å; L155-I159 PolarHBondContact O-N 3.14Å; L155-I781 HydrophobicContact CD1-CG1 3.89Å; L155-I784 HydrophobicContact CD1-CB 4.09Å; L155-I784 HydrophobicContact CD1-CG2 3.69Å
156	L	90	Very high	86.4	Confident	7 Å²	7	22.4 Å²	22.4	4%	0.037	13%	0.132	C	C	.	.	H	α-helix	trans	-57.4	-47.9	175.3	-175.9	67.8	0	0	0	111.3	P152 E153 V158 I159 E160 L171 T175 T788 V814	P152-L156 VanDerWaalsContact O-CB 3.3Å; P152-L156 WeakPolarHBondContact O-CB 3.34Å; P152-L156 PolarHBondContact O-N 3.02Å; E153-L156 PolarHBondContact O-N 2.87Å; L156-V158 PolarHBondContact O-N 3.14Å; L156-I159 PolarHBondContact O-N 2.67Å; L156-E160 VanDerWaalsContact O-CB 3.31Å; L156-E160 WeakPolarHBondContact O-CB 3.18Å; L156-E160 PolarHBondContact O-N 3.3Å; L156-L171 HydrophobicContact CD1-CD2 4.44Å; L156-T175 HydrophobicContact CD2-CG2 3.96Å; L156-T788 WeakPolarHBondContact CD1-O 3.27Å; L156-V814 HydrophobicContact CD2-CG1 3.92Å
157	S	89.8	Confident	86.9	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.007	16%	0.16	C	C	.	.	H	α-helix	trans	-62.8	-41.6	178.4	-178.8	0	0	0	0	112.7	E153 I154 L155 I161	E153-S157 PolarHBondContact O-N 2.85Å; I154-S157 PolarHBondContact O-N 3.13Å; L155-S157 VanDerWaalsContact C-N 3.34Å; L155-S157 PolarHBondContact O-N 3.32Å; S157-I161 WeakPolarHBondContact O-CG1 3.31Å; S157-I161 PolarHBondContact O-N 3.06Å
158	V	91.2	Very high	87	Confident	24 Å²	24	28.7 Å²	28.7	15%	0.145	17%	0.166	C	C	.	.	H	α-helix	trans	-68.7	-44.7	178.5	173.5	0	0	0	0	111.5	I154 L155 L156 I162 V857 A858	I154-V158 WeakPolarHBondContact O-CG2 3.31Å; I154-V158 PolarHBondContact O-N 2.97Å; I154-V158 VanDerWaalsContact O-N 3.11Å; L155-V158 PolarHBondContact O-N 2.87Å; L156-V158 PolarHBondContact O-N 3.14Å; V158-I162 HydrophobicContact CG1-CD1 3.79Å; V158-I162 WeakPolarHBondContact O-CG1 3.37Å; V158-I162 PolarHBondContact O-N 2.73Å; V158-I162 VanDerWaalsContact O-N 3.15Å; V158-V857 HydrophobicContact CG2-CG1 4.15Å; V158-A858 HydrophobicContact CG2-CB 3.92Å
159	I	89.8	Confident	87.1	Confident	38 Å²	38	29.2 Å²	29.2	20%	0.195	17%	0.171	C	C	.	.	H	α-helix	trans	-68.1	-40.1	-177.3	-68.6	167.2	0	0	0	111.1	L155 L156 I161 I162 G163 G785 A789	L155-I159 HydrophobicContact CB-CD1 4.28Å; L155-I159 VanDerWaalsContact O-CB 3.28Å; L155-I159 WeakPolarHBondContact O-CB 3.29Å; L155-I159 WeakPolarHBondContact O-CD1 3.42Å; L155-I159 WeakPolarHBondContact O-CG1 3.29Å; L155-I159 PolarHBondContact O-N 3.14Å; L156-I159 PolarHBondContact O-N 2.67Å; I159-I161 PolarHBondContact O-N 3.28Å; I159-I162 PolarHBondContact O-N 3.44Å; I159-G163 PolarHBondContact O-N 2.86Å; I159-G785 WeakPolarHBondContact CD1-O 3.31Å; I159-A789 HydrophobicContact CD1-CB 4.28Å; I159-A789 HydrophobicContact CG2-CB 3.86Å
160	E	88.6	Confident	87.3	Confident	16 Å²	16	32.5 Å²	32.5	8%	0.075	19%	0.191	C	C	.	.	H	α-helix	trans	-59.7	-46.6	178	-174.8	-176.7	-163.8	0	0	111.4	L156 I162 G163 H164 G169 T170 L171 G172	L156-E160 VanDerWaalsContact O-CB 3.31Å; L156-E160 WeakPolarHBondContact O-CB 3.18Å; L156-E160 PolarHBondContact O-N 3.3Å; E160-I162 PolarHBondContact O-N 3.4Å; E160-G163 PolarHBondContact O-N 2.94Å; E160-H164 WeakPolarHBondContact O-CB 3.32Å; E160-H164 PolarHBondContact O-N 3.37Å; E160-G169 VanDerWaalsContact CD-CA 3.5Å; E160-G169 WeakPolarHBondContact OE1-CA 3.33Å; E160-T170 PolarHBondContact OE1-N 3.09Å; E160-L171 VanDerWaalsContact OE1-CB 3.24Å; E160-L171 WeakPolarHBondContact OE1-CB 3.4Å; E160-L171 PolarHBondContact OE1-N 2.93Å; E160-G172 WeakPolarHBondContact OE2-CA 3.3Å; E160-G172 PolarHBondContact OE2-N 2.96Å
161	I	89.4	Confident	87.2	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.021	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-46.4	177.5	-70.7	-172.4	0	0	0	111	S157 I159 G163 F166 A858 A862	S157-I161 WeakPolarHBondContact O-CG1 3.31Å; S157-I161 PolarHBondContact O-N 3.06Å; I159-I161 PolarHBondContact O-N 3.28Å; I161-G163 VanDerWaalsContact C-N 3.34Å; I161-F166 HydrophobicContact CG2-CB 4.45Å; I161-F166 HydrophobicContact CG2-CD1 4.18Å; I161-F166 WeakPolarHBondContact O-CA 3.43Å; I161-F166 PolarHBondContact O-N 3.29Å; I161-A858 HydrophobicContact CD1-CB 3.59Å; I161-A858 HydrophobicContact CG1-CB 4.49Å; I161-A862 HydrophobicContact CD1-CB 4.43Å; I161-A862 HydrophobicContact CG2-CB 3.76Å
162	I	89.1	Confident	87.1	Confident	90 Å²	90	32.6 Å²	32.6	46%	0.462	19%	0.191	S	C	.	.	H	α-helix	trans	-65.4	-41.2	179.6	-65.7	171	0	0	0	110.5	V158 I159 E160 G165 F166	V158-I162 HydrophobicContact CG1-CD1 3.79Å; V158-I162 WeakPolarHBondContact O-CG1 3.37Å; V158-I162 PolarHBondContact O-N 2.73Å; V158-I162 VanDerWaalsContact O-N 3.15Å; I159-I162 PolarHBondContact O-N 3.44Å; E160-I162 PolarHBondContact O-N 3.4Å; I162-G165 PolarHBondContact O-N 3.07Å; I162-F166 HydrophobicContact CG1-CE1 4.27Å
163	G	85	Confident	87.2	Confident	35 Å²	35	32.8 Å²	32.8	36%	0.361	19%	0.192	S	C	.	.	H	α-helix	trans	-67.6	-33.6	-178.4	0	0	0	0	0	113.8	I159 E160 I161 G165	I159-G163 PolarHBondContact O-N 2.86Å; E160-G163 PolarHBondContact O-N 2.94Å; I161-G163 VanDerWaalsContact C-N 3.34Å; G163-G165 VanDerWaalsContact C-N 3.32Å; G163-G165 PolarHBondContact O-N 3.42Å
164	H	84.8	Confident	87.2	Confident	83 Å²	83	33 Å²	33	38%	0.384	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	21	177.4	-64.6	171.7	0	0	0	113.4	E160 E167	E160-H164 WeakPolarHBondContact O-CB 3.32Å; E160-H164 PolarHBondContact O-N 3.37Å; H164-E167 PolarHBondContact O-N 2.9Å
165	G	84.5	Confident	87.2	Confident	39 Å²	39	32.3 Å²	32.3	40%	0.402	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	31.7	175.1	0	0	0	0	0	114.4	I162 G163 E167	I162-G165 PolarHBondContact O-N 3.07Å; G163-G165 VanDerWaalsContact C-N 3.32Å; G163-G165 PolarHBondContact O-N 3.42Å; G165-E167 VanDerWaalsContact C-N 3.33Å
166	F	88.3	Confident	87.2	Confident	43 Å²	43	30.8 Å²	30.8	19%	0.189	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	21	-176.9	-53.4	-90.1	0	0	0	114.7	I161 I162 I861 Y865 H866	I161-F166 HydrophobicContact CG2-CB 4.45Å; I161-F166 HydrophobicContact CG2-CD1 4.18Å; I161-F166 WeakPolarHBondContact O-CA 3.43Å; I161-F166 PolarHBondContact O-N 3.29Å; I162-F166 HydrophobicContact CG1-CE1 4.27Å; F166-I861 HydrophobicContact CD1-CG2 4.02Å; F166-I861 HydrophobicContact CE1-CG2 3.61Å; F166-Y865 HydrophobicContact CB-CD1 3.41Å; F166-Y865 VanDerWaalsContact CB-CD1 3.41Å; F166-Y865 HydrophobicContact CB-CE1 3.7Å; F166-Y865 HydrophobicContact CB-CG 4.06Å; F166-Y865 HydrophobicContact CD1-CD1 4.32Å; F166-Y865 HydrophobicContact CD1-CG 4.11Å; F166-Y865 AromaticContact CD2-CD1 3.54Å; F166-Y865 HydrophobicContact CD2-CD1 3.54Å; F166-Y865 AromaticContact CD2-CD2 3.79Å; F166-Y865 HydrophobicContact CD2-CD2 3.79Å; F166-Y865 AromaticContact CD2-CE1 3.36Å; F166-Y865 HydrophobicContact CD2-CE1 3.36Å; F166-Y865 AromaticContact CD2-CE2 3.64Å; F166-Y865 HydrophobicContact CD2-CE2 3.64Å; F166-Y865 AromaticContact CD2-CG 3.7Å; F166-Y865 HydrophobicContact CD2-CG 3.7Å; F166-Y865 AromaticContact CD2-CZ 3.35Å; F166-Y865 HydrophobicContact CE2-CD1 4.39Å; F166-Y865 AromaticContact CE2-CD2 3.79Å; F166-Y865 HydrophobicContact CE2-CD2 3.79Å; F166-Y865 HydrophobicContact CE2-CE1 4.22Å; F166-Y865 AromaticContact CE2-CE2 3.62Å; F166-Y865 HydrophobicContact CE2-CE2 3.62Å; F166-Y865 HydrophobicContact CE2-CG 4.14Å; F166-Y865 AromaticContact CE2-CZ 3.79Å; F166-Y865 AromaticContact CG-CD1 3.49Å; F166-Y865 HydrophobicContact CG-CD1 3.49Å; F166-Y865 VanDerWaalsContact CG-CD1 3.49Å; F166-Y865 HydrophobicContact CG-CD2 4.21Å; F166-Y865 AromaticContact CG-CE1 3.76Å; F166-Y865 HydrophobicContact CG-CE1 3.76Å; F166-Y865 HydrophobicContact CG-CE2 4.45Å; F166-Y865 AromaticContact CG-CG 3.68Å; F166-Y865 HydrophobicContact CG-CG 3.68Å; F166-Y865 HydrophobicContact CZ-CD2 4.22Å; F166-Y865 HydrophobicContact CZ-CE2 4.44Å; F166-H866 PolarHBondContact O-CD2 2.95Å; F166-H866 PolarHBondContact O-NE2 2.91Å
167	E	86.2	Confident	87.2	Confident	133 Å²	133	30.5 Å²	30.5	62%	0.621	18%	0.181	S	C	*	.			trans	-84.4	153.5	168.4	-64.1	-174	175.1	0	0	111.1	H164 G165 G169	H164-E167 PolarHBondContact O-N 2.9Å; G165-E167 VanDerWaalsContact C-N 3.33Å; E167-G169 PolarHBondContact O-N 2.97Å
168	A	82.7	Confident	87.3	Confident	34 Å²	34	30.5 Å²	30.5	28%	0.281	18%	0.182	S	C	.	.			trans	-74.9	111.3	-179	0	0	0	0	0	110.3	F873 V875	A168-F873 HydrophobicContact CB-CE2 3.83Å; A168-F873 HydrophobicContact CB-CZ 3.81Å; A168-V875 HydrophobicContact CB-CB 4.32Å; A168-V875 HydrophobicContact CB-CG1 4.19Å; A168-V875 HydrophobicContact CB-CG2 3.89Å
169	G	80.8	Confident	87.3	Confident	11 Å²	11	29.4 Å²	29.4	11%	0.113	18%	0.175	C	C	.	.			trans	-77.1	157	171.1	0	0	0	0	0	112.7	E160 E167 P173	E160-G169 VanDerWaalsContact CD-CA 3.5Å; E160-G169 WeakPolarHBondContact OE1-CA 3.33Å; E167-G169 PolarHBondContact O-N 2.97Å; G169-P173 WeakPolarHBondContact O-CD 3.46Å; G169-P173 WeakPolarHBondContact O-CG 3.43Å
170	T	81.3	Confident	87.3	Confident	69 Å²	69	27.6 Å²	27.6	42%	0.423	17%	0.165	S	C	.	.	S	Bend	trans	-95.8	-22.2	179.7	60.8	0	0	0	0	112.5	E160 S174	E160-T170 PolarHBondContact OE1-N 3.09Å; T170-S174 WeakPolarHBondContact O-CB 3.32Å; T170-S174 PolarHBondContact O-N 3.19Å; T170-S174 PolarHBondContact O-OG 3.38Å
171	L	83.4	Confident	87.5	Confident	6 Å²	6	26.8 Å²	26.8	3%	0.031	16%	0.162	C	C	.	.	H	α-helix	trans	-73.5	-48.7	-171.6	-165.2	83.2	0	0	0	111.3	L156 E160 T175 A795 D806 A810	L156-L171 HydrophobicContact CD1-CD2 4.44Å; E160-L171 VanDerWaalsContact OE1-CB 3.24Å; E160-L171 WeakPolarHBondContact OE1-CB 3.4Å; E160-L171 PolarHBondContact OE1-N 2.93Å; L171-T175 VanDerWaalsContact O-CB 3.28Å; L171-T175 WeakPolarHBondContact O-CB 3.48Å; L171-T175 PolarHBondContact O-N 3.06Å; L171-T175 PolarHBondContact O-OG1 2.79Å; L171-A795 HydrophobicContact CD1-CB 4.48Å; L171-A795 HydrophobicContact CD2-CB 4.46Å; L171-D806 HydrophobicContact CD1-CB 4.22Å; L171-A810 HydrophobicContact CD1-CB 3.88Å; L171-A810 HydrophobicContact CG-CB 4.24Å; L171-A810 WeakPolarHBondContact O-CB 3.33Å
172	G	85.8	Confident	87.7	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.2	-57	-177.3	0	0	0	0	0	113.1	E160 S174 T175 I176	E160-G172 WeakPolarHBondContact OE2-CA 3.3Å; E160-G172 PolarHBondContact OE2-N 2.96Å; G172-S174 VanDerWaalsContact C-N 3.28Å; G172-S174 PolarHBondContact O-N 3.4Å; G172-T175 WeakPolarHBondContact O-CB 3.45Å; G172-T175 PolarHBondContact O-N 2.72Å; G172-T175 VanDerWaalsContact O-N 3.14Å; G172-I176 PolarHBondContact O-N 3.32Å
173	P	88.7	Confident	87.7	Confident	6 Å²	6	23.1 Å²	23.1	4%	0.039	14%	0.142	C	C	.	.	H	α-helix	trans	-58.2	-38.8	176.4	-26.7	36.2	0	0	0	112.9	G169 I176 V177 W859 L880	G169-P173 WeakPolarHBondContact O-CD 3.46Å; G169-P173 WeakPolarHBondContact O-CG 3.43Å; P173-I176 PolarHBondContact O-N 3.15Å; P173-V177 WeakPolarHBondContact O-CG2 3.38Å; P173-V177 PolarHBondContact O-N 3.46Å; P173-V177 VanDerWaalsContact O-N 3.17Å; P173-W859 HydrophobicContact CB-CZ2 4.49Å; P173-W859 HydrophobicContact CG-CZ2 4.26Å; P173-L880 HydrophobicContact CB-CD1 3.93Å; P173-L880 HydrophobicContact CB-CD2 3.75Å
174	S	89.6	Confident	88	Confident	7 Å²	7	21.7 Å²	21.7	5%	0.049	13%	0.126	C	C	.	.	H	α-helix	trans	-71.6	-33.3	178.1	-61.6	0	0	0	0	112.3	T170 G172 G178	T170-S174 WeakPolarHBondContact O-CB 3.32Å; T170-S174 PolarHBondContact O-N 3.19Å; T170-S174 PolarHBondContact O-OG 3.38Å; G172-S174 VanDerWaalsContact C-N 3.28Å; G172-S174 PolarHBondContact O-N 3.4Å; S174-G178 PolarHBondContact O-N 3.17Å
175	T	90.6	Very high	88.4	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.006	11%	0.108	C	C	.	.	H	α-helix	trans	-65.4	-42.8	172.5	-60.6	0	0	0	0	110.8	E153 L156 L171 G172 G178 S179 A810 V814	E153-T175 HydrophobicContact CG-CG2 4.41Å; L156-T175 HydrophobicContact CD2-CG2 3.96Å; L171-T175 VanDerWaalsContact O-CB 3.28Å; L171-T175 WeakPolarHBondContact O-CB 3.48Å; L171-T175 PolarHBondContact O-N 3.06Å; L171-T175 PolarHBondContact O-OG1 2.79Å; G172-T175 WeakPolarHBondContact O-CB 3.45Å; G172-T175 PolarHBondContact O-N 2.72Å; G172-T175 VanDerWaalsContact O-N 3.14Å; T175-G178 PolarHBondContact O-N 3.11Å; T175-S179 WeakPolarHBondContact O-CB 3.38Å; T175-S179 PolarHBondContact O-N 3.04Å; T175-S179 PolarHBondContact O-OG 3Å; T175-A810 WeakPolarHBondContact OG1-CB 3.33Å; T175-V814 HydrophobicContact CG2-CB 4.24Å; T175-V814 HydrophobicContact CG2-CG1 3.69Å
176	I	91.2	Very high	88.8	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.9	-46.5	178	-76.9	169.7	0	0	0	111.8	E153 G172 P173 S179 A180 N850 V851 I855	E153-I176 HydrophobicContact CB-CG1 4.22Å; G172-I176 PolarHBondContact O-N 3.32Å; P173-I176 PolarHBondContact O-N 3.15Å; I176-S179 PolarHBondContact O-OG 3.43Å; I176-S179 VanDerWaalsContact O-OG 3.14Å; I176-A180 WeakPolarHBondContact O-CB 3.33Å; I176-A180 PolarHBondContact O-N 3.33Å; I176-N850 HydrophobicContact CG2-CB 3.79Å; I176-V851 HydrophobicContact CG2-CG2 4.26Å; I176-I855 HydrophobicContact CD1-CD1 4.45Å; I176-I855 HydrophobicContact CD1-CG1 3.67Å; I176-I855 HydrophobicContact CG2-CD1 4.02Å; I176-I855 HydrophobicContact CG2-CG1 4.28Å
177	V	91.1	Very high	89	Confident	1 Å²	1	14.3 Å²	14.3	1%	0.006	8%	0.083	C	C	.	.	H	α-helix	trans	-72	-38.6	179.2	-175.7	0	0	0	0	110.8	P173 A180 A181 Y220 L223 L880 V884 F887 Y931	P173-V177 WeakPolarHBondContact O-CG2 3.38Å; P173-V177 PolarHBondContact O-N 3.46Å; P173-V177 VanDerWaalsContact O-N 3.17Å; V177-A180 PolarHBondContact O-N 3.31Å; V177-A181 PolarHBondContact O-N 2.92Å; V177-A181 VanDerWaalsContact O-N 3.07Å; V177-Y220 HydrophobicContact CG1-CE1 4.47Å; V177-Y220 HydrophobicContact CG2-CD1 4.39Å; V177-Y220 HydrophobicContact CG2-CE1 4.15Å; V177-L223 HydrophobicContact CG2-CD2 4.25Å; V177-L880 HydrophobicContact CG2-CD1 3.92Å; V177-V884 HydrophobicContact CG1-CG2 4.04Å; V177-V884 HydrophobicContact CG2-CG2 3.68Å; V177-F887 HydrophobicContact CG1-CB 4.36Å; V177-Y931 WeakPolarHBondContact CG1-OH 3.48Å
178	G	91.7	Very high	89.3	Confident	1 Å²	1	8.1 Å²	8.1	1%	0.01	5%	0.054	C	C	.	.	H	α-helix	trans	-62.1	-45.4	175.7	0	0	0	0	0	113.3	S174 T175 A180 A181 F182 A815	S174-G178 PolarHBondContact O-N 3.17Å; T175-G178 PolarHBondContact O-N 3.11Å; G178-A180 VanDerWaalsContact C-N 3.32Å; G178-A180 PolarHBondContact O-N 2.83Å; G178-A181 PolarHBondContact O-N 2.83Å; G178-F182 PolarHBondContact O-N 2.91Å; G178-A815 VanDerWaalsContact C-CB 3.5Å
179	S	90.4	Very high	89.8	Confident	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-67.6	-35.8	179.7	66.5	0	0	0	0	110.8	T175 I176 A181 F182 N183 A815 N850	T175-S179 WeakPolarHBondContact O-CB 3.38Å; T175-S179 PolarHBondContact O-N 3.04Å; T175-S179 PolarHBondContact O-OG 3Å; I176-S179 PolarHBondContact O-OG 3.43Å; I176-S179 VanDerWaalsContact O-OG 3.14Å; S179-A181 PolarHBondContact O-N 3.11Å; S179-F182 PolarHBondContact O-N 2.81Å; S179-N183 VanDerWaalsContact O-CB 3.25Å; S179-N183 WeakPolarHBondContact O-CB 3.43Å; S179-N183 PolarHBondContact O-N 3.03Å; S179-N183 PolarHBondContact O-OD1 2.82Å; S179-A815 VanDerWaalsContact N-CB 3.35Å; S179-N850 PolarHBondContact OG-ND2 3.38Å
180	A	90.3	Very high	90.3	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-63.9	-40.8	173.7	0	0	0	0	0	113.3	I176 V177 G178 M184 Y220 N847 F887	I176-A180 WeakPolarHBondContact O-CB 3.33Å; I176-A180 PolarHBondContact O-N 3.33Å; V177-A180 PolarHBondContact O-N 3.31Å; G178-A180 VanDerWaalsContact C-N 3.32Å; G178-A180 PolarHBondContact O-N 2.83Å; A180-M184 VanDerWaalsContact O-CB 3.24Å; A180-M184 WeakPolarHBondContact O-CB 3.46Å; A180-M184 PolarHBondContact O-N 2.9Å; A180-Y220 HydrophobicContact CB-CE1 4.03Å; A180-Y220 HydrophobicContact CB-CE2 4.29Å; A180-Y220 WeakPolarHBondContact CB-OH 3.1Å; A180-N847 WeakPolarHBondContact CA-OD1 3.49Å; A180-N847 HydrophobicContact CB-CB 4.44Å; A180-N847 PolarHBondContact O-ND2 3.17Å; A180-F887 HydrophobicContact CB-CE2 4.23Å; A180-F887 HydrophobicContact CB-CZ 4.09Å
181	A	92.8	Very high	90.8	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-63.5	-45	173.3	0	0	0	0	0	111.6	V177 G178 S179 F185 F887 Y931	V177-A181 PolarHBondContact O-N 2.92Å; V177-A181 VanDerWaalsContact O-N 3.07Å; G178-A181 PolarHBondContact O-N 2.83Å; S179-A181 PolarHBondContact O-N 3.11Å; A181-F185 HydrophobicContact CB-CD2 4.11Å; A181-F185 HydrophobicContact CB-CE2 3.87Å; A181-F185 WeakPolarHBondContact O-CB 3.4Å; A181-F185 WeakPolarHBondContact O-CD2 3.27Å; A181-F185 VanDerWaalsContact O-CG 3.26Å; A181-F185 WeakPolarHBondContact O-CG 3.34Å; A181-F185 PolarHBondContact O-N 2.79Å; A181-F887 HydrophobicContact CB-CD2 3.82Å; A181-F887 HydrophobicContact CB-CE2 4.31Å; A181-Y931 HydrophobicContact CB-CD1 3.75Å; A181-Y931 HydrophobicContact CB-CE1 3.56Å; A181-Y931 HydrophobicContact CB-CE2 4.36Å; A181-Y931 HydrophobicContact CB-CG 4.24Å
182	F	92.8	Very high	91.3	Very high	16 Å²	16	4.6 Å²	4.6	7%	0.07	3%	0.025	C	C	.	.	I	π-helix	trans	-63.3	-47.2	176.9	-175.3	-87.9	0	0	0	111.7	G178 S179 M184 V186 I187 L816 T823 W928	G178-F182 PolarHBondContact O-N 2.91Å; S179-F182 PolarHBondContact O-N 2.81Å; F182-M184 PolarHBondContact O-N 3.19Å; F182-V186 HydrophobicContact CD1-CB 4.44Å; F182-V186 HydrophobicContact CD2-CB 3.93Å; F182-V186 HydrophobicContact CD2-CG1 4.31Å; F182-V186 HydrophobicContact CD2-CG2 3.71Å; F182-V186 HydrophobicContact CE1-CB 4.39Å; F182-V186 HydrophobicContact CE1-CG1 4.38Å; F182-V186 HydrophobicContact CE2-CB 3.86Å; F182-V186 HydrophobicContact CE2-CG1 3.72Å; F182-V186 HydrophobicContact CE2-CG2 3.9Å; F182-V186 HydrophobicContact CG-CB 4.23Å; F182-V186 HydrophobicContact CG-CG2 4.31Å; F182-V186 HydrophobicContact CZ-CB 4.11Å; F182-V186 HydrophobicContact CZ-CG1 3.77Å; F182-V186 WeakPolarHBondContact O-CA 3.17Å; F182-V186 VanDerWaalsContact O-CB 3.31Å; F182-V186 WeakPolarHBondContact O-CB 3.43Å; F182-V186 PolarHBondContact O-N 2.77Å; F182-I187 HydrophobicContact CD1-CD1 4.38Å; F182-I187 HydrophobicContact CD1-CG1 4.16Å; F182-I187 HydrophobicContact CE1-CD1 4.38Å; F182-I187 HydrophobicContact CE1-CG1 4.01Å; F182-I187 PolarHBondContact O-N 2.89Å; F182-L816 HydrophobicContact CD2-CG 4.49Å; F182-L816 HydrophobicContact CE2-CD1 4Å; F182-L816 HydrophobicContact CE2-CG 3.95Å; F182-L816 HydrophobicContact CZ-CG 4.32Å; F182-T823 WeakPolarHBondContact CE1-OG1 3.45Å; F182-W928 AromaticContact CD2-CE2 3.79Å; F182-W928 AromaticContact CD2-CZ2 3.8Å; F182-W928 HydrophobicContact CD2-CZ2 3.8Å; F182-W928 AromaticContact CD2-NE1 3.73Å; F182-W928 HydrophobicContact CE2-CZ2 4.17Å
183	N	90.7	Very high	91.6	Very high	1 Å²	1	10.7 Å²	10.7	1%	0.005	5%	0.049	C	C	.	.	I	π-helix	trans	-60.7	-45.8	178.8	-70.7	-3	0	0	0	111.3	S179 I187 S819 V843	S179-N183 VanDerWaalsContact O-CB 3.25Å; S179-N183 WeakPolarHBondContact O-CB 3.43Å; S179-N183 PolarHBondContact O-N 3.03Å; S179-N183 PolarHBondContact O-OD1 2.82Å; N183-I187 HydrophobicContact CB-CD1 4.13Å; N183-I187 WeakPolarHBondContact O-CB 3.42Å; N183-I187 VanDerWaalsContact OD1-CD1 3.24Å; N183-I187 WeakPolarHBondContact OD1-CD1 3.39Å; N183-S819 VanDerWaalsContact OD1-CB 3.22Å; N183-S819 WeakPolarHBondContact OD1-CB 3.34Å; N183-S819 PolarHBondContact OD1-OG 3.43Å; N183-V843 HydrophobicContact CB-CG1 4Å; N183-V843 WeakPolarHBondContact O-CG1 3.22Å
184	M	90.1	Very high	91.6	Very high	4 Å²	4	12 Å²	12	2%	0.02	6%	0.057	C	C	.	.	I	π-helix	trans	-74.6	-35.7	-176.3	-163.5	164.6	-175.7	0	0	113.2	A180 F182 I188 F887 A891 C894 V895	A180-M184 VanDerWaalsContact O-CB 3.24Å; A180-M184 WeakPolarHBondContact O-CB 3.46Å; A180-M184 PolarHBondContact O-N 2.9Å; F182-M184 PolarHBondContact O-N 3.19Å; M184-I188 HydrophobicContact CG-CD1 4.33Å; M184-I188 WeakPolarHBondContact O-CB 3.37Å; M184-I188 VanDerWaalsContact O-CD1 3.29Å; M184-I188 WeakPolarHBondContact O-CD1 3.12Å; M184-I188 WeakPolarHBondContact O-CG1 3.21Å; M184-F887 HydrophobicContact CB-CE2 4.25Å; M184-F887 HydrophobicContact SD-CE2 4.08Å; M184-F887 HydrophobicContact SD-CZ 3.86Å; M184-A891 HydrophobicContact CE-CB 3.69Å; M184-A891 WeakPolarHBondContact CE-O 3.11Å; M184-A891 HydrophobicContact SD-CB 3.55Å; M184-A891 VanDerWaalsContact SD-CB 3.55Å; M184-C894 HydrophobicContact CE-CB 4.27Å; M184-V895 HydrophobicContact CE-CG2 3.49Å; M184-V895 VanDerWaalsContact CE-CG2 3.49Å
185	F	93.3	Very high	91.6	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	5%	0.054	C	C	.	.	I	π-helix	trans	-96.9	-54.1	-175	-52.4	-37	0	0	0	112.2	A181 G189 F887 F890 C894 F924 W928	A181-F185 HydrophobicContact CB-CD2 4.11Å; A181-F185 HydrophobicContact CB-CE2 3.87Å; A181-F185 WeakPolarHBondContact O-CB 3.4Å; A181-F185 WeakPolarHBondContact O-CD2 3.27Å; A181-F185 VanDerWaalsContact O-CG 3.26Å; A181-F185 WeakPolarHBondContact O-CG 3.34Å; A181-F185 PolarHBondContact O-N 2.79Å; F185-G189 PolarHBondContact O-N 2.92Å; F185-F887 HydrophobicContact CE2-CD2 4.07Å; F185-F887 HydrophobicContact CE2-CE2 4.46Å; F185-F887 AromaticContact CZ-CD2 3.89Å; F185-F887 HydrophobicContact CZ-CD2 3.89Å; F185-F887 HydrophobicContact CZ-CE2 4.09Å; F185-F890 HydrophobicContact CE1-CB 3.92Å; F185-F890 HydrophobicContact CE2-CB 4.03Å; F185-F890 HydrophobicContact CE2-CD2 4.45Å; F185-F890 HydrophobicContact CZ-CB 3.38Å; F185-C894 HydrophobicContact CD1-CB 4.22Å; F185-C894 HydrophobicContact CE1-CB 4.1Å; F185-F924 VanDerWaalsContact O-CB 3.32Å; F185-F924 WeakPolarHBondContact O-CB 3.35Å; F185-W928 HydrophobicContact CB-CB 4Å; F185-W928 HydrophobicContact CD2-CB 4.25Å
186	V	93.6	Very high	91.3	Very high	11 Å²	11	14.2 Å²	14.2	7%	0.067	7%	0.071	C	C	.	.	I	π-helix	trans	-75.6	-50	-173	-178.4	0	0	0	0	110.8	F182 G189 L190 F925 W928	F182-V186 HydrophobicContact CD1-CB 4.44Å; F182-V186 HydrophobicContact CD2-CB 3.93Å; F182-V186 HydrophobicContact CD2-CG1 4.31Å; F182-V186 HydrophobicContact CD2-CG2 3.71Å; F182-V186 HydrophobicContact CE1-CB 4.39Å; F182-V186 HydrophobicContact CE1-CG1 4.38Å; F182-V186 HydrophobicContact CE2-CB 3.86Å; F182-V186 HydrophobicContact CE2-CG1 3.72Å; F182-V186 HydrophobicContact CE2-CG2 3.9Å; F182-V186 HydrophobicContact CG-CB 4.23Å; F182-V186 HydrophobicContact CG-CG2 4.31Å; F182-V186 HydrophobicContact CZ-CB 4.11Å; F182-V186 HydrophobicContact CZ-CG1 3.77Å; F182-V186 WeakPolarHBondContact O-CA 3.17Å; F182-V186 VanDerWaalsContact O-CB 3.31Å; F182-V186 WeakPolarHBondContact O-CB 3.43Å; F182-V186 PolarHBondContact O-N 2.77Å; V186-G189 PolarHBondContact O-N 3.16Å; V186-L190 WeakPolarHBondContact O-CB 3.4Å; V186-L190 PolarHBondContact O-N 2.77Å; V186-F925 HydrophobicContact CG1-CE1 3.85Å; V186-F925 HydrophobicContact CG1-CE2 4.46Å; V186-F925 HydrophobicContact CG1-CZ 3.75Å; V186-W928 HydrophobicContact CG2-CB 3.87Å; V186-W928 HydrophobicContact CG2-CD2 3.53Å; V186-W928 HydrophobicContact CG2-CE3 3.99Å; V186-W928 HydrophobicContact CG2-CG 3.47Å; V186-W928 VanDerWaalsContact CG2-CG 3.47Å
187	I	92.5	Very high	90.9	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.091	C	C	.	.	I	π-helix	trans	-64.6	-48.7	-177.5	-57	-177.4	0	0	0	110.5	F182 N183 G189 L190 C191 D822 T823 S826 V843	F182-I187 HydrophobicContact CD1-CD1 4.38Å; F182-I187 HydrophobicContact CD1-CG1 4.16Å; F182-I187 HydrophobicContact CE1-CD1 4.38Å; F182-I187 HydrophobicContact CE1-CG1 4.01Å; F182-I187 PolarHBondContact O-N 2.89Å; N183-I187 HydrophobicContact CB-CD1 4.13Å; N183-I187 WeakPolarHBondContact O-CB 3.42Å; N183-I187 VanDerWaalsContact OD1-CD1 3.24Å; N183-I187 WeakPolarHBondContact OD1-CD1 3.39Å; I187-G189 VanDerWaalsContact C-N 3.31Å; I187-G189 PolarHBondContact O-N 2.89Å; I187-L190 WeakPolarHBondContact O-CB 3.41Å; I187-L190 PolarHBondContact O-N 2.98Å; I187-L190 VanDerWaalsContact O-N 3.15Å; I187-C191 PolarHBondContact O-N 3.16Å; I187-C191 PolarHBondContact O-SG 3.39Å; I187-D822 HydrophobicContact CD1-CB 3.94Å; I187-T823 HydrophobicContact CG1-CG2 4.33Å; I187-S826 VanDerWaalsContact CG2-CB 3.44Å; I187-V843 HydrophobicContact CG2-CG2 4.15Å
188	I	91.8	Very high	90.2	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.015	13%	0.127	C	C	.	.	H	α-helix	trans	-61.9	-41.5	177.3	-57	-174.5	0	0	0	110.7	M184 L190 C191 V192 I840 V843 L898 F924	M184-I188 HydrophobicContact CG-CD1 4.33Å; M184-I188 WeakPolarHBondContact O-CB 3.37Å; M184-I188 VanDerWaalsContact O-CD1 3.29Å; M184-I188 WeakPolarHBondContact O-CD1 3.12Å; M184-I188 WeakPolarHBondContact O-CG1 3.21Å; I188-L190 VanDerWaalsContact C-N 3.3Å; I188-L190 PolarHBondContact O-N 3.49Å; I188-C191 PolarHBondContact O-N 2.96Å; I188-V192 VanDerWaalsContact O-CG2 3.25Å; I188-V192 WeakPolarHBondContact O-CG2 3.5Å; I188-V192 PolarHBondContact O-N 3.27Å; I188-I840 HydrophobicContact CD1-CG2 4.32Å; I188-V843 HydrophobicContact CD1-CG1 4.12Å; I188-V843 HydrophobicContact CG1-CG1 4.19Å; I188-L898 HydrophobicContact CD1-CD1 4.3Å; I188-L898 HydrophobicContact CG2-CD1 4.17Å; I188-L898 HydrophobicContact CG2-CD2 3.95Å; I188-F924 HydrophobicContact CB-CD2 4.47Å; I188-F924 HydrophobicContact CB-CE2 4.41Å; I188-F924 HydrophobicContact CG2-CD2 4.3Å; I188-F924 HydrophobicContact CG2-CE2 3.81Å
189	G	92.9	Very high	89.9	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.6	-40.3	175.3	0	0	0	0	0	112.6	F185 V186 I187 V192 Y193 T921	F185-G189 PolarHBondContact O-N 2.92Å; V186-G189 PolarHBondContact O-N 3.16Å; I187-G189 VanDerWaalsContact C-N 3.31Å; I187-G189 PolarHBondContact O-N 2.89Å; G189-V192 WeakPolarHBondContact O-CB 3.4Å; G189-V192 PolarHBondContact O-N 3.46Å; G189-Y193 PolarHBondContact O-N 2.98Å; G189-T921 PolarHBondContact O-OG1 2.87Å
190	L	92.7	Very high	89.8	Confident	43 Å²	43	27.7 Å²	27.7	23%	0.225	16%	0.16	C	C	.	.	H	α-helix	trans	-67.3	-46.4	174.7	-175.7	68.5	0	0	0	111.7	V186 I187 I188 V192 Y193 V194 T823 K827	V186-L190 WeakPolarHBondContact O-CB 3.4Å; V186-L190 PolarHBondContact O-N 2.77Å; I187-L190 WeakPolarHBondContact O-CB 3.41Å; I187-L190 PolarHBondContact O-N 2.98Å; I187-L190 VanDerWaalsContact O-N 3.15Å; I188-L190 VanDerWaalsContact C-N 3.3Å; I188-L190 PolarHBondContact O-N 3.49Å; L190-V192 PolarHBondContact O-N 3.47Å; L190-Y193 CarbonylContact O-C 3.29Å; L190-Y193 WeakPolarHBondContact O-CA 3.35Å; L190-Y193 PolarHBondContact O-N 2.72Å; L190-V194 HydrophobicContact CD1-CG2 3.76Å; L190-V194 HydrophobicContact CG-CG2 3.93Å; L190-V194 VanDerWaalsContact O-CG2 3.29Å; L190-V194 WeakPolarHBondContact O-CG2 3.23Å; L190-V194 PolarHBondContact O-N 3.28Å; L190-T823 HydrophobicContact CD2-CG2 3.43Å; L190-T823 VanDerWaalsContact CD2-CG2 3.43Å; L190-K827 HydrophobicContact CD2-CB 4.34Å; L190-K827 HydrophobicContact CD2-CD 4.45Å
191	C	91.6	Very high	89.7	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.014	17%	0.165	C	C	.	.	H	α-helix	trans	-58.2	-35.1	176.8	-68	0	0	0	0	111.7	I187 I188 V195 S826 A830 L910	I187-C191 PolarHBondContact O-N 3.16Å; I187-C191 PolarHBondContact O-SG 3.39Å; I188-C191 PolarHBondContact O-N 2.96Å; C191-V195 WeakPolarHBondContact O-CG2 3.38Å; C191-S826 VanDerWaalsContact SG-C 3.53Å; C191-S826 PolarHBondContact SG-O 3.18Å; C191-A830 HydrophobicContact CB-CB 3.94Å; C191-L910 HydrophobicContact CB-CD1 4.24Å; C191-L910 HydrophobicContact CB-CD2 3.98Å
192	V	92.1	Very high	89.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-43.9	172.4	162.3	0	0	0	0	111.6	I188 G189 L190 L910 K917	I188-V192 VanDerWaalsContact O-CG2 3.25Å; I188-V192 WeakPolarHBondContact O-CG2 3.5Å; I188-V192 PolarHBondContact O-N 3.27Å; G189-V192 WeakPolarHBondContact O-CB 3.4Å; G189-V192 PolarHBondContact O-N 3.46Å; L190-V192 PolarHBondContact O-N 3.47Å; V192-L910 HydrophobicContact CG2-CD2 3.6Å; V192-K917 HydrophobicContact CG1-CG 4.18Å; V192-K917 WeakPolarHBondContact O-CE 3.23Å; V192-K917 WeakPolarHBondContact O-CG 3.21Å
193	Y	92.1	Very high	89	Confident	129 Å²	129	33.3 Å²	33.3	51%	0.506	18%	0.184	S	C	.	.	H	α-helix	trans	-77.3	-25.3	-175.8	-175.1	-101.2	0	0	0	114.1	G189 L190 K917 V918	G189-Y193 PolarHBondContact O-N 2.98Å; L190-Y193 CarbonylContact O-C 3.29Å; L190-Y193 WeakPolarHBondContact O-CA 3.35Å; L190-Y193 PolarHBondContact O-N 2.72Å; Y193-K917 HydrophobicContact CD2-CG 4.42Å; Y193-K917 WeakPolarHBondContact O-CE 3.41Å; Y193-K917 PolarHBondContact O-NZ 2.69Å; Y193-V918 HydrophobicContact CE2-CG2 4.42Å
194	V	90.2	Very high	88.5	Confident	32 Å²	32	38.7 Å²	38.7	19%	0.194	21%	0.207	C	C	.	.	H	α-helix	trans	-87.4	-22.9	-172.3	174	0	0	0	0	112.8	L190 K827 I831	L190-V194 HydrophobicContact CD1-CG2 3.76Å; L190-V194 HydrophobicContact CG-CG2 3.93Å; L190-V194 VanDerWaalsContact O-CG2 3.29Å; L190-V194 WeakPolarHBondContact O-CG2 3.23Å; L190-V194 PolarHBondContact O-N 3.28Å; V194-K827 HydrophobicContact CB-CG 4.21Å; V194-K827 HydrophobicContact CG1-CD 4.37Å; V194-K827 HydrophobicContact CG1-CG 3.77Å; V194-K827 HydrophobicContact CG2-CD 4.32Å; V194-K827 HydrophobicContact CG2-CG 4.03Å; V194-I831 HydrophobicContact CG1-CD1 3.31Å; V194-I831 HydrophobicContact CG1-CG1 3.38Å
195	V	88.5	Confident	87.6	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.225	C	C	.	.	S	Bend	trans	-57.2	131.1	175.3	174.9	0	0	0	0	110.6	C191 E199 R201 A830 L910 K917	C191-V195 WeakPolarHBondContact O-CG2 3.38Å; V195-E199 HydrophobicContact CG1-CB 3.9Å; V195-R201 HydrophobicContact CG1-CG 4.43Å; V195-R201 HydrophobicContact CG2-CG 4.17Å; V195-A830 HydrophobicContact CG2-CB 4.43Å; V195-L910 HydrophobicContact CG2-CB 4.01Å; V195-K917 PolarHBondContact O-NZ 3.18Å
196	P	85.8	Confident	86.9	Confident	55 Å²	55	44.3 Å²	44.3	36%	0.357	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-52.9	152	-179.9	-28.1	35.3	0	0	0	114.1	G198 E199	P196-G198 PolarHBondContact O-N 3.07Å; P196-E199 HydrophobicContact CB-CG 4.44Å; P196-E199 PolarHBondContact O-N 3.11Å
197	D	82.6	Confident	86.3	Confident	80 Å²	80	48.3 Å²	48.3	43%	0.428	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	126.3	-175.9	-66.7	-35.4	0	0	0	111.5	R914 K917	D197-R914 VanDerWaalsContact CG-NE 3.33Å; D197-R914 IonicContact OD1-NE 3.06Å; D197-R914 IonicContact OD2-CZ 3.75Å; D197-R914 IonicContact OD2-NE 3.42Å; D197-R914 PolarHBondContact OD2-NE 3.43Å; D197-R914 IonicContact OD2-NH2 2.79Å; D197-R914 PolarHBondContact OD2-NH2 3.25Å; D197-K917 IonicContact OD1-NZ 3.81Å; D197-K917 PolarHBondContact OD1-NZ 3.45Å
198	G	75.1	Confident	85.6	Confident	73 Å²	73	49.4 Å²	49.4	75%	0.753	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.9	-15.4	-176.4	0	0	0	0	0	113.5	P196	P196-G198 PolarHBondContact O-N 3.07Å
199	E	86.8	Confident	85.2	Confident	80 Å²	80	49.7 Å²	49.7	37%	0.374	26%	0.255	S	S	.	.			trans	-90.7	148	174.5	-65.5	-172.2	-160.5	0	0	112.2	V195 P196 R201 G912	V195-E199 HydrophobicContact CG1-CB 3.9Å; P196-E199 HydrophobicContact CB-CG 4.44Å; P196-E199 PolarHBondContact O-N 3.11Å; E199-R201 IonicContact OE2-CZ 2.72Å; E199-R201 IonicContact OE2-NH1 2.68Å; E199-R201 PolarHBondContact OE2-NH1 3.07Å; E199-R201 IonicContact OE2-NH2 3.28Å; E199-R201 PolarHBondContact OE2-NH2 3.39Å; E199-G912 PolarHBondContact O-N 2.77Å
200	T	87.9	Confident	84.8	Confident	53 Å²	53	54.4 Å²	54.4	33%	0.325	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	145.2	173.5	56.3	0	0	0	0	109	L910	T200-L910 WeakPolarHBondContact CA-O 3.33Å
201	R	87.8	Confident	84.4	Confident	31 Å²	31	54 Å²	54	12%	0.117	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	134	173.3	-53	-67.5	-169.6	-111.9	-1	108.8	V195 E199 I831 D833 Q834 A836 E909 L910	V195-R201 HydrophobicContact CG1-CG 4.43Å; V195-R201 HydrophobicContact CG2-CG 4.17Å; E199-R201 IonicContact OE2-CZ 2.72Å; E199-R201 IonicContact OE2-NH1 2.68Å; E199-R201 PolarHBondContact OE2-NH1 3.07Å; E199-R201 IonicContact OE2-NH2 3.28Å; E199-R201 PolarHBondContact OE2-NH2 3.39Å; R201-I831 PolarHBondContact NH2-O 2.85Å; R201-D833 VanDerWaalsContact CD-O 3.24Å; R201-D833 WeakPolarHBondContact CD-O 3.34Å; R201-D833 PolarHBondContact NE-O 3.47Å; R201-Q834 WeakPolarHBondContact CD-O 3.33Å; R201-A836 HydrophobicContact CB-CB 4.19Å; R201-E909 PolarHBondContact O-N 3.28Å; R201-L910 HydrophobicContact CB-CB 4.16Å; R201-L910 HydrophobicContact CB-CD1 4.49Å; R201-L910 PolarHBondContact N-O 3.14Å; R201-L910 VanDerWaalsContact N-O 3.09Å; R201-L910 PolarHBondContact O-N 3.31Å
202	K	87.3	Confident	84	Confident	97 Å²	97	54.4 Å²	54.4	42%	0.422	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-113.7	148.4	179	-67.8	177	-177	167.6	0	111.5	K204 Y835 A836 G907 E909	K202-K204 PolarHBondContact O-N 3.13Å; K202-Y835 WeakPolarHBondContact O-CA 3.49Å; K202-Y835 WeakPolarHBondContact O-CB 3.33Å; K202-A836 PolarHBondContact O-N 3.42Å; K202-G907 WeakPolarHBondContact CE-O 3.29Å; K202-E909 WeakPolarHBondContact CA-OE2 3.33Å
203	V	82.9	Confident	83.7	Confident	6 Å²	6	54.7 Å²	54.7	4%	0.036	28%	0.28	C	S	.	.			trans	-75.2	121.6	169.3	179.9	0	0	0	0	108.9	L206 F209 A836 D837 I840 E909	V203-L206 HydrophobicContact CB-CD2 4.26Å; V203-L206 HydrophobicContact CG1-CD2 4.37Å; V203-F209 HydrophobicContact CG1-CB 3.9Å; V203-F209 HydrophobicContact CG1-CG 4.2Å; V203-A836 HydrophobicContact CG2-CB 3.86Å; V203-D837 WeakPolarHBondContact CG1-OD1 3.15Å; V203-I840 HydrophobicContact CG2-CD1 4.29Å; V203-E909 HydrophobicContact CG2-CG 4.37Å; V203-E909 PolarHBondContact N-OE2 3.44Å
204	K	79.9	Confident	83.6	Confident	114 Å²	114	52.9 Å²	52.9	50%	0.496	28%	0.283	S	S	.	.	S	Bend	trans	-77.5	-45.7	-179.9	-176.1	-179.5	177.4	-177	0	111.3	K202 L206 Y835 D837	K202-K204 PolarHBondContact O-N 3.13Å; K204-L206 PolarHBondContact O-N 3.01Å; K204-Y835 HydrophobicContact CB-CD1 3.99Å; K204-Y835 HydrophobicContact CB-CE1 4.35Å; K204-Y835 HydrophobicContact CB-CG 4.18Å; K204-Y835 HydrophobicContact CD-CD2 4.25Å; K204-Y835 HydrophobicContact CD-CE1 4.36Å; K204-Y835 HydrophobicContact CD-CE2 4.01Å; K204-D837 WeakPolarHBondContact CB-OD2 3.47Å; K204-D837 PolarHBondContact N-OD1 3.36Å; K204-D837 PolarHBondContact N-OD2 2.94Å
205	H	73.3	Confident	83.6	Confident	86 Å²	86	53 Å²	53	40%	0.398	28%	0.28	S	S	.	.			trans	-98	64.9	-173	-65.3	-91.2	0	0	0	112.6	R207 V208 F209 D837	H205-R207 VanDerWaalsContact C-N 3.25Å; H205-R207 PolarHBondContact O-N 3.39Å; H205-R207 VanDerWaalsContact O-N 3.1Å; H205-V208 HydrophobicContact CB-CB 4.29Å; H205-V208 HydrophobicContact CB-CG2 4.34Å; H205-V208 PolarHBondContact O-N 3.04Å; H205-V208 VanDerWaalsContact O-N 3.1Å; H205-F209 PolarHBondContact O-N 3.42Å; H205-D837 IonicContact CD2-OD1 3.67Å; H205-D837 PolarHBondContact N-OD1 3.48Å
206	L	78.4	Confident	83.6	Confident	35 Å²	35	53.1 Å²	53.1	18%	0.183	28%	0.281	C	S	.	.	H	α-helix	trans	-53.9	-37.3	-174.9	-60.3	165.1	0	0	0	114.8	V203 K204 F209 F210 R902	V203-L206 HydrophobicContact CB-CD2 4.26Å; V203-L206 HydrophobicContact CG1-CD2 4.37Å; K204-L206 PolarHBondContact O-N 3.01Å; L206-F209 WeakPolarHBondContact O-CB 3.37Å; L206-F209 PolarHBondContact O-N 3.14Å; L206-F210 HydrophobicContact CB-CD2 4.41Å; L206-F210 HydrophobicContact CB-CE2 4.3Å; L206-F210 WeakPolarHBondContact O-CD2 3.16Å; L206-F210 PolarHBondContact O-N 3.04Å; L206-R902 VanDerWaalsContact CD1-CZ 3.5Å; L206-R902 VanDerWaalsContact CD2-NH1 3.28Å
207	R	79.9	Confident	83.8	Confident	96 Å²	96	51.1 Å²	51.1	36%	0.362	27%	0.267	S	S	.	.	H	α-helix	trans	-64.4	-45.8	-179.2	-66.2	179.1	-63.5	-163.8	-2.4	111.5	H205 F209 F210 V211	H205-R207 VanDerWaalsContact C-N 3.25Å; H205-R207 PolarHBondContact O-N 3.39Å; H205-R207 VanDerWaalsContact O-N 3.1Å; R207-F209 VanDerWaalsContact C-N 3.31Å; R207-F210 PolarHBondContact O-N 3.33Å; R207-V211 WeakPolarHBondContact O-CG2 3.4Å; R207-V211 PolarHBondContact O-N 3.12Å; R207-V211 VanDerWaalsContact O-N 3.08Å
208	V	78.4	Confident	84.3	Confident	22 Å²	22	50.5 Å²	50.5	13%	0.133	26%	0.26	C	S	.	.	H	α-helix	trans	-65.8	-40.8	177.4	-178.9	0	0	0	0	109.5	T138 H205 V211 T212 D258	T138-V208 HydrophobicContact CG2-CG1 3.74Å; T138-V208 HydrophobicContact CG2-CG2 4.45Å; H205-V208 HydrophobicContact CB-CB 4.29Å; H205-V208 HydrophobicContact CB-CG2 4.34Å; H205-V208 PolarHBondContact O-N 3.04Å; H205-V208 VanDerWaalsContact O-N 3.1Å; V208-V211 PolarHBondContact O-N 3.42Å; V208-T212 HydrophobicContact CG1-CG2 4.29Å; V208-T212 WeakPolarHBondContact O-CB 3.46Å; V208-T212 WeakPolarHBondContact O-CG2 3.44Å; V208-T212 PolarHBondContact O-N 3.47Å; V208-T212 PolarHBondContact O-OG1 3.39Å; V208-D258 HydrophobicContact CG2-CB 4.29Å
209	F	82.4	Confident	85.1	Confident	9 Å²	9	47 Å²	47	4%	0.039	22%	0.224	C	C	.	.	H	α-helix	trans	-58.9	-47.2	173.8	175.7	-101.5	0	0	0	112.7	V203 H205 L206 R207 V211 T212 A213 I840 T844 M899	V203-F209 HydrophobicContact CG1-CB 3.9Å; V203-F209 HydrophobicContact CG1-CG 4.2Å; H205-F209 PolarHBondContact O-N 3.42Å; L206-F209 WeakPolarHBondContact O-CB 3.37Å; L206-F209 PolarHBondContact O-N 3.14Å; R207-F209 VanDerWaalsContact C-N 3.31Å; F209-V211 PolarHBondContact O-N 3.39Å; F209-T212 WeakPolarHBondContact CA-OG1 3.44Å; F209-T212 PolarHBondContact O-N 3.18Å; F209-T212 PolarHBondContact O-OG1 3.42Å; F209-T212 VanDerWaalsContact O-OG1 3.04Å; F209-A213 HydrophobicContact CZ-CB 4.39Å; F209-A213 WeakPolarHBondContact O-CB 3.4Å; F209-A213 PolarHBondContact O-N 3.2Å; F209-I840 HydrophobicContact CD2-CG2 4.38Å; F209-I840 HydrophobicContact CE2-CG2 3.57Å; F209-I840 HydrophobicContact CZ-CG2 4.32Å; F209-T844 HydrophobicContact CE2-CG2 4.34Å; F209-M899 HydrophobicContact CD1-CE 4.4Å; F209-M899 HydrophobicContact CE1-CE 3.62Å; F209-M899 HydrophobicContact CE1-SD 4.49Å; F209-M899 HydrophobicContact CZ-CE 4.33Å
210	F	84.4	Confident	85.4	Confident	99 Å²	99	43.2 Å²	43.2	43%	0.434	21%	0.207	S	C	.	.	H	α-helix	trans	-63.5	-41	178	-80	-62.2	0	0	0	112.6	L206 R207 T214 M899	L206-F210 HydrophobicContact CB-CD2 4.41Å; L206-F210 HydrophobicContact CB-CE2 4.3Å; L206-F210 WeakPolarHBondContact O-CD2 3.16Å; L206-F210 PolarHBondContact O-N 3.04Å; R207-F210 PolarHBondContact O-N 3.33Å; F210-T214 VanDerWaalsContact O-CB 3.27Å; F210-T214 WeakPolarHBondContact O-CB 3.29Å; F210-T214 PolarHBondContact O-N 2.71Å; F210-T214 PolarHBondContact O-OG1 3.49Å; F210-M899 HydrophobicContact CE1-SD 3.91Å; F210-M899 HydrophobicContact CZ-SD 3.75Å
211	V	85.2	Confident	85.6	Confident	34 Å²	34	43.6 Å²	43.6	21%	0.206	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-51.7	176.9	172.1	0	0	0	0	110.3	R207 V208 F209 T214 W215 F253 A257	R207-V211 WeakPolarHBondContact O-CG2 3.4Å; R207-V211 PolarHBondContact O-N 3.12Å; R207-V211 VanDerWaalsContact O-N 3.08Å; V208-V211 PolarHBondContact O-N 3.42Å; F209-V211 PolarHBondContact O-N 3.39Å; V211-T214 PolarHBondContact O-N 3.23Å; V211-W215 VanDerWaalsContact O-CD1 3.23Å; V211-W215 PolarHBondContact O-N 2.71Å; V211-F253 HydrophobicContact CG1-CB 4.19Å; V211-A257 HydrophobicContact CG2-CB 3.92Å
212	T	83.6	Confident	85.8	Confident	11 Å²	11	43.2 Å²	43.2	7%	0.067	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-41	-178.8	52.2	0	0	0	0	112.5	L142 V208 F209 W215 S216	L142-T212 HydrophobicContact CD1-CG2 4.08Å; L142-T212 HydrophobicContact CD2-CG2 4.41Å; V208-T212 HydrophobicContact CG1-CG2 4.29Å; V208-T212 WeakPolarHBondContact O-CB 3.46Å; V208-T212 WeakPolarHBondContact O-CG2 3.44Å; V208-T212 PolarHBondContact O-N 3.47Å; V208-T212 PolarHBondContact O-OG1 3.39Å; F209-T212 WeakPolarHBondContact CA-OG1 3.44Å; F209-T212 PolarHBondContact O-N 3.18Å; F209-T212 PolarHBondContact O-OG1 3.42Å; F209-T212 VanDerWaalsContact O-OG1 3.04Å; T212-W215 PolarHBondContact O-N 2.98Å; T212-S216 VanDerWaalsContact O-CB 3.24Å; T212-S216 WeakPolarHBondContact O-CB 3.48Å; T212-S216 PolarHBondContact O-N 2.93Å
213	A	85.8	Confident	86	Confident	6 Å²	6	38.6 Å²	38.6	5%	0.05	19%	0.185	C	C	.	.	H	α-helix	trans	-64.2	-40.1	175.1	0	0	0	0	0	112.4	F209 S216 I217	F209-A213 HydrophobicContact CZ-CB 4.39Å; F209-A213 WeakPolarHBondContact O-CB 3.4Å; F209-A213 PolarHBondContact O-N 3.2Å; A213-S216 WeakPolarHBondContact O-CB 3.22Å; A213-S216 PolarHBondContact O-N 3.14Å; A213-I217 PolarHBondContact O-N 3.48Å; A213-I217 VanDerWaalsContact O-N 3.08Å
214	T	89.1	Confident	86.3	Confident	92 Å²	92	41.2 Å²	41.2	56%	0.564	19%	0.194	S	C	*	.	H	α-helix	trans	-65.6	-46.6	177.4	-57.1	0	0	0	0	111	F210 V211 S216 I217 F218	F210-T214 VanDerWaalsContact O-CB 3.27Å; F210-T214 WeakPolarHBondContact O-CB 3.29Å; F210-T214 PolarHBondContact O-N 2.71Å; F210-T214 PolarHBondContact O-OG1 3.49Å; V211-T214 PolarHBondContact O-N 3.23Å; T214-S216 VanDerWaalsContact C-N 3.31Å; T214-S216 PolarHBondContact O-N 3.45Å; T214-I217 PolarHBondContact O-N 3.1Å; T214-F218 WeakPolarHBondContact O-CB 3.38Å; T214-F218 PolarHBondContact O-N 3.44Å
215	W	91.1	Very high	86.8	Confident	35 Å²	35	38.3 Å²	38.3	13%	0.133	18%	0.184	C	C	.	.	H	α-helix	trans	-65.5	-34.5	176.7	-82.7	104.5	0	0	0	112.6	V211 T212 F218 A219 F246 I249 C250 F852	V211-W215 VanDerWaalsContact O-CD1 3.23Å; V211-W215 PolarHBondContact O-N 2.71Å; T212-W215 PolarHBondContact O-N 2.98Å; W215-F218 AromaticContact CE3-CD1 3.7Å; W215-F218 HydrophobicContact CE3-CD1 3.7Å; W215-F218 HydrophobicContact CE3-CE1 4.24Å; W215-F218 AromaticContact CZ3-CD1 3.68Å; W215-F218 HydrophobicContact CZ3-CD1 3.68Å; W215-F218 AromaticContact CZ3-CE1 3.74Å; W215-F218 HydrophobicContact CZ3-CE1 3.74Å; W215-F218 PolarHBondContact O-N 2.92Å; W215-A219 WeakPolarHBondContact O-CB 3.4Å; W215-A219 PolarHBondContact O-N 3.09Å; W215-F246 AromaticContact CH2-CD1 3.99Å; W215-F246 HydrophobicContact CH2-CD1 3.99Å; W215-F246 HydrophobicContact CZ3-CB 4.12Å; W215-F246 AromaticContact CZ3-CD1 3.75Å; W215-F246 HydrophobicContact CZ3-CD1 3.75Å; W215-F246 HydrophobicContact CZ3-CE1 4.45Å; W215-F246 HydrophobicContact CZ3-CG 4.08Å; W215-I249 HydrophobicContact CH2-CB 4.49Å; W215-I249 HydrophobicContact CH2-CG2 3.71Å; W215-I249 HydrophobicContact CZ2-CG2 3.8Å; W215-C250 HydrophobicContact CB-CB 4.45Å; W215-C250 WeakPolarHBondContact CB-SG 3.42Å; W215-C250 HydrophobicContact CD2-CB 3.94Å; W215-C250 HydrophobicContact CE3-CB 4.19Å; W215-C250 HydrophobicContact CG-CB 4.05Å; W215-F852 AromaticContact CE3-CE2 3.87Å; W215-F852 HydrophobicContact CE3-CE2 3.87Å; W215-F852 AromaticContact CE3-CZ 3.71Å; W215-F852 HydrophobicContact CE3-CZ 3.71Å; W215-F852 HydrophobicContact CZ3-CZ 4.19Å
216	S	89.1	Confident	87.7	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.014	17%	0.165	C	C	.	.	H	α-helix	trans	-60.7	-51.6	174.3	-169.5	0	0	0	0	111.6	T212 A213 T214 A219 Y220 T844 N847	T212-S216 VanDerWaalsContact O-CB 3.24Å; T212-S216 WeakPolarHBondContact O-CB 3.48Å; T212-S216 PolarHBondContact O-N 2.93Å; A213-S216 WeakPolarHBondContact O-CB 3.22Å; A213-S216 PolarHBondContact O-N 3.14Å; T214-S216 VanDerWaalsContact C-N 3.31Å; T214-S216 PolarHBondContact O-N 3.45Å; S216-A219 WeakPolarHBondContact O-CB 3.5Å; S216-A219 PolarHBondContact O-N 3.16Å; S216-Y220 WeakPolarHBondContact O-CD2 3.33Å; S216-T844 VanDerWaalsContact CB-O 3.32Å; S216-T844 WeakPolarHBondContact CB-O 3.42Å; S216-T844 PolarHBondContact OG-O 3.05Å; S216-T844 VanDerWaalsContact OG-O 3.07Å; S216-N847 WeakPolarHBondContact OG-CB 3.42Å
217	I	89.8	Confident	88.1	Confident	13 Å²	13	32.6 Å²	32.6	7%	0.067	16%	0.157	C	C	.	.	H	α-helix	trans	-66.9	-41.5	177.2	-63.8	172	0	0	0	111	A213 T214 A219 Y220 I221 A891 F892 V895	A213-I217 PolarHBondContact O-N 3.48Å; A213-I217 VanDerWaalsContact O-N 3.08Å; T214-I217 PolarHBondContact O-N 3.1Å; I217-A219 PolarHBondContact O-N 2.96Å; I217-Y220 PolarHBondContact O-N 2.92Å; I217-I221 HydrophobicContact CG2-CD1 3.81Å; I217-I221 HydrophobicContact CG2-CG1 4.33Å; I217-I221 WeakPolarHBondContact O-CG1 3.23Å; I217-I221 PolarHBondContact O-N 2.93Å; I217-I221 VanDerWaalsContact O-N 3.13Å; I217-A891 HydrophobicContact CG1-CB 4.4Å; I217-F892 HydrophobicContact CD1-CD1 4.23Å; I217-F892 HydrophobicContact CD1-CE1 4.17Å; I217-F892 HydrophobicContact CD1-CZ 4.48Å; I217-F892 HydrophobicContact CG2-CD2 4.4Å; I217-F892 HydrophobicContact CG2-CE1 4.39Å; I217-F892 HydrophobicContact CG2-CE2 3.68Å; I217-F892 HydrophobicContact CG2-CZ 3.68Å; I217-V895 HydrophobicContact CD1-CG2 4.2Å
218	F	92.9	Very high	88.4	Confident	66 Å²	66	29.8 Å²	29.8	29%	0.289	15%	0.151	S	C	.	.	H	α-helix	trans	-58.4	-36.7	178.4	174.8	-104.4	0	0	0	112.2	T214 W215 Y220 I221 W222 F246 F852	T214-F218 WeakPolarHBondContact O-CB 3.38Å; T214-F218 PolarHBondContact O-N 3.44Å; W215-F218 AromaticContact CE3-CD1 3.7Å; W215-F218 HydrophobicContact CE3-CD1 3.7Å; W215-F218 HydrophobicContact CE3-CE1 4.24Å; W215-F218 AromaticContact CZ3-CD1 3.68Å; W215-F218 HydrophobicContact CZ3-CD1 3.68Å; W215-F218 AromaticContact CZ3-CE1 3.74Å; W215-F218 HydrophobicContact CZ3-CE1 3.74Å; W215-F218 PolarHBondContact O-N 2.92Å; F218-Y220 VanDerWaalsContact C-N 3.31Å; F218-Y220 PolarHBondContact O-N 2.74Å; F218-I221 PolarHBondContact O-N 3.4Å; F218-W222 HydrophobicContact CE1-CB 4.32Å; F218-W222 HydrophobicContact CZ-CB 4.28Å; F218-W222 HydrophobicContact CZ-CE3 4.28Å; F218-W222 VanDerWaalsContact O-CB 3.28Å; F218-W222 WeakPolarHBondContact O-CB 3.42Å; F218-W222 PolarHBondContact O-N 2.84Å; F218-F246 HydrophobicContact CE1-CD1 4.47Å; F218-F246 HydrophobicContact CE1-CD2 4.19Å; F218-F246 HydrophobicContact CE1-CE1 4.29Å; F218-F246 AromaticContact CE1-CE2 3.99Å; F218-F246 HydrophobicContact CE1-CE2 3.99Å; F218-F246 HydrophobicContact CE1-CG 4.44Å; F218-F246 HydrophobicContact CE1-CZ 4.05Å; F218-F246 HydrophobicContact CZ-CE2 4.27Å; F218-F246 HydrophobicContact CZ-CZ 4.13Å; F218-F852 HydrophobicContact CD1-CZ 4.18Å
219	A	92	Very high	88.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-57.4	-43.6	178.9	0	0	0	0	0	112.4	W215 S216 I217 W222 L223 V851 F852	W215-A219 WeakPolarHBondContact O-CB 3.4Å; W215-A219 PolarHBondContact O-N 3.09Å; S216-A219 WeakPolarHBondContact O-CB 3.5Å; S216-A219 PolarHBondContact O-N 3.16Å; I217-A219 PolarHBondContact O-N 2.96Å; A219-W222 PolarHBondContact O-N 3.47Å; A219-L223 WeakPolarHBondContact O-CB 3.35Å; A219-L223 PolarHBondContact O-N 2.78Å; A219-V851 HydrophobicContact CB-CB 3.85Å; A219-V851 HydrophobicContact CB-CG1 4.03Å; A219-V851 HydrophobicContact CB-CG2 4.22Å; A219-F852 HydrophobicContact CB-CD1 4.18Å; A219-F852 HydrophobicContact CB-CE1 3.53Å; A219-F852 HydrophobicContact CB-CE2 3.99Å; A219-F852 HydrophobicContact CB-CZ 3.4Å; A219-F852 VanDerWaalsContact CB-CZ 3.4Å
220	Y	91.6	Very high	89.2	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-76	-34.6	178.8	-66.9	-86.9	0	0	0	112.5	V177 A180 S216 I217 F218 W222 L223 Y224 N847 V851 V884 F887	V177-Y220 HydrophobicContact CG1-CE1 4.47Å; V177-Y220 HydrophobicContact CG2-CD1 4.39Å; V177-Y220 HydrophobicContact CG2-CE1 4.15Å; A180-Y220 HydrophobicContact CB-CE1 4.03Å; A180-Y220 HydrophobicContact CB-CE2 4.29Å; A180-Y220 WeakPolarHBondContact CB-OH 3.1Å; S216-Y220 WeakPolarHBondContact O-CD2 3.33Å; I217-Y220 PolarHBondContact O-N 2.92Å; F218-Y220 VanDerWaalsContact C-N 3.31Å; F218-Y220 PolarHBondContact O-N 2.74Å; Y220-W222 VanDerWaalsContact C-N 3.32Å; Y220-L223 PolarHBondContact O-N 2.7Å; Y220-Y224 PolarHBondContact O-N 2.93Å; Y220-N847 HydrophobicContact CE2-CB 4.42Å; Y220-N847 WeakPolarHBondContact CE2-O 3.42Å; Y220-N847 PolarHBondContact OH-O 3Å; Y220-V851 HydrophobicContact CD1-CG2 4.02Å; Y220-V851 HydrophobicContact CD2-CG2 4.32Å; Y220-V851 HydrophobicContact CE1-CG2 3.54Å; Y220-V851 HydrophobicContact CE2-CG2 3.87Å; Y220-V851 HydrophobicContact CG-CG2 4.37Å; Y220-V851 VanDerWaalsContact CZ-CG2 3.41Å; Y220-V884 WeakPolarHBondContact O-CG1 3.2Å; Y220-F887 AromaticContact CD1-CD1 3.81Å; Y220-F887 HydrophobicContact CD1-CD1 3.81Å; Y220-F887 AromaticContact CD1-CE1 3.92Å; Y220-F887 HydrophobicContact CD1-CE1 3.92Å; Y220-F887 HydrophobicContact CD2-CD1 4.05Å; Y220-F887 AromaticContact CD2-CE1 3.39Å; Y220-F887 HydrophobicContact CD2-CE1 3.39Å; Y220-F887 HydrophobicContact CD2-CZ 4.32Å; Y220-F887 HydrophobicContact CE1-CD1 4.31Å; Y220-F887 HydrophobicContact CE1-CE1 4.17Å; Y220-F887 AromaticContact CE2-CE1 3.7Å; Y220-F887 HydrophobicContact CE2-CE1 3.7Å; Y220-F887 HydrophobicContact CE2-CZ 4.24Å; Y220-F887 AromaticContact CG-CD1 3.69Å; Y220-F887 HydrophobicContact CG-CD1 3.69Å; Y220-F887 AromaticContact CG-CE1 3.54Å; Y220-F887 HydrophobicContact CG-CE1 3.54Å
221	I	91.9	Very high	89.3	Confident	62 Å²	62	31.5 Å²	31.5	32%	0.318	17%	0.168	S	C	.	.	H	α-helix	trans	-61.9	-44.6	170.7	-65.4	172.7	0	0	0	109.9	I217 F218 L223 Y224 L225 T888 F892	I217-I221 HydrophobicContact CG2-CD1 3.81Å; I217-I221 HydrophobicContact CG2-CG1 4.33Å; I217-I221 WeakPolarHBondContact O-CG1 3.23Å; I217-I221 PolarHBondContact O-N 2.93Å; I217-I221 VanDerWaalsContact O-N 3.13Å; F218-I221 PolarHBondContact O-N 3.4Å; I221-L223 PolarHBondContact O-N 3.22Å; I221-Y224 WeakPolarHBondContact O-CB 3.49Å; I221-Y224 PolarHBondContact O-N 3.33Å; I221-L225 HydrophobicContact CG2-CD1 4.29Å; I221-L225 HydrophobicContact CG2-CG 4.45Å; I221-L225 WeakPolarHBondContact O-CG 3.36Å; I221-L225 PolarHBondContact O-N 3.38Å; I221-T888 HydrophobicContact CG1-CG2 4.04Å; I221-F892 HydrophobicContact CD1-CE2 4.39Å
222	W	93.5	Very high	89.4	Confident	23 Å²	23	34.2 Å²	34.2	9%	0.087	19%	0.186	C	C	.	.	H	α-helix	trans	-61	-43.9	176.7	177.3	-104.1	0	0	0	111.8	F218 A219 Y220 Y224 L225 I226 I230 W238 L242 T243 F246	F218-W222 HydrophobicContact CE1-CB 4.32Å; F218-W222 HydrophobicContact CZ-CB 4.28Å; F218-W222 HydrophobicContact CZ-CE3 4.28Å; F218-W222 VanDerWaalsContact O-CB 3.28Å; F218-W222 WeakPolarHBondContact O-CB 3.42Å; F218-W222 PolarHBondContact O-N 2.84Å; A219-W222 PolarHBondContact O-N 3.47Å; Y220-W222 VanDerWaalsContact C-N 3.32Å; W222-Y224 VanDerWaalsContact C-N 3.31Å; W222-Y224 PolarHBondContact O-N 2.96Å; W222-L225 HydrophobicContact CE3-CD1 4.32Å; W222-L225 WeakPolarHBondContact O-CB 3.43Å; W222-L225 PolarHBondContact O-N 2.93Å; W222-L225 VanDerWaalsContact O-N 3.09Å; W222-I226 HydrophobicContact CD2-CG2 4.2Å; W222-I226 HydrophobicContact CH2-CG2 4.24Å; W222-I226 HydrophobicContact CZ2-CG2 3.59Å; W222-I226 PolarHBondContact O-N 3.42Å; W222-I230 HydrophobicContact CH2-CD1 4Å; W222-I230 HydrophobicContact CZ3-CD1 4.02Å; W222-W238 HydrophobicContact CH2-CZ3 4.25Å; W222-L242 HydrophobicContact CH2-CD2 3.7Å; W222-L242 HydrophobicContact CZ2-CD2 3.72Å; W222-L242 HydrophobicContact CZ2-CG 4.22Å; W222-T243 PolarHBondContact NE1-OG1 3Å; W222-F246 HydrophobicContact CD2-CD2 4.49Å; W222-F246 AromaticContact CD2-CE2 3.64Å; W222-F246 HydrophobicContact CD2-CE2 3.64Å; W222-F246 HydrophobicContact CD2-CZ 4.47Å; W222-F246 AromaticContact CE2-CE2 3.58Å; W222-F246 HydrophobicContact CE3-CE2 4.13Å; W222-F246 HydrophobicContact CG-CD2 4.38Å; W222-F246 AromaticContact CG-CE2 3.95Å; W222-F246 HydrophobicContact CG-CE2 3.95Å; W222-F246 HydrophobicContact CH2-CE2 4.47Å; W222-F246 HydrophobicContact CZ2-CE2 4.02Å; W222-F246 AromaticContact NE1-CE2 3.78Å
223	L	90.4	Very high	89.4	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-57.5	-42.7	174.2	-176.3	62.4	0	0	0	112.2	V177 A219 Y220 I221 I226 L227 V851 I855 W859 V884	V177-L223 HydrophobicContact CG2-CD2 4.25Å; A219-L223 WeakPolarHBondContact O-CB 3.35Å; A219-L223 PolarHBondContact O-N 2.78Å; Y220-L223 PolarHBondContact O-N 2.7Å; I221-L223 PolarHBondContact O-N 3.22Å; L223-I226 HydrophobicContact CD1-CD1 4.13Å; L223-I226 HydrophobicContact CD1-CG1 4.47Å; L223-I226 VanDerWaalsContact O-CG1 3.23Å; L223-I226 WeakPolarHBondContact O-CG1 3.41Å; L223-L227 HydrophobicContact CD1-CD1 4.27Å; L223-L227 HydrophobicContact CG-CD1 4.27Å; L223-L227 WeakPolarHBondContact O-CG 3.43Å; L223-L227 PolarHBondContact O-N 3.3Å; L223-V851 HydrophobicContact CB-CG1 4.34Å; L223-I855 HydrophobicContact CD1-CD1 3.81Å; L223-I855 HydrophobicContact CD1-CG2 4.04Å; L223-I855 HydrophobicContact CD2-CD1 3.56Å; L223-I855 HydrophobicContact CG-CD1 4.35Å; L223-W859 HydrophobicContact CD1-CH2 3.49Å; L223-W859 VanDerWaalsContact CD1-CH2 3.49Å; L223-W859 HydrophobicContact CD1-CZ2 4.48Å; L223-W859 HydrophobicContact CD1-CZ3 3.55Å; L223-V884 HydrophobicContact CD2-CG2 3.81Å; L223-V884 HydrophobicContact CG-CG2 4.44Å
224	Y	90.1	Very high	89.6	Confident	61 Å²	61	35.7 Å²	35.7	24%	0.239	20%	0.197	C	C	.	.	H	α-helix	trans	-64	-41.9	173.6	171.6	-98.7	0	0	0	112.2	Y220 I221 W222 I226 L227 S228 V229 A881 T885	Y220-Y224 PolarHBondContact O-N 2.93Å; I221-Y224 WeakPolarHBondContact O-CB 3.49Å; I221-Y224 PolarHBondContact O-N 3.33Å; W222-Y224 VanDerWaalsContact C-N 3.31Å; W222-Y224 PolarHBondContact O-N 2.96Å; Y224-I226 PolarHBondContact O-N 2.89Å; Y224-L227 PolarHBondContact O-N 3.28Å; Y224-S228 PolarHBondContact O-N 3.35Å; Y224-V229 HydrophobicContact CD1-CG2 4.44Å; Y224-V229 HydrophobicContact CE1-CG2 3.86Å; Y224-A881 HydrophobicContact CD2-CB 4.35Å; Y224-T885 HydrophobicContact CD2-CG2 3.4Å; Y224-T885 VanDerWaalsContact CD2-CG2 3.4Å; Y224-T885 HydrophobicContact CE2-CG2 3.4Å; Y224-T885 VanDerWaalsContact CE2-CG2 3.4Å; Y224-T885 HydrophobicContact CG-CG2 4.11Å
225	L	90.6	Very high	89.7	Confident	53 Å²	53	31.5 Å²	31.5	28%	0.277	17%	0.171	S	C	.	.	H	α-helix	trans	-61.6	-45.4	179.8	-71.3	175.2	0	0	0	112.1	I221 W222 L227 V229 I230	I221-L225 HydrophobicContact CG2-CD1 4.29Å; I221-L225 HydrophobicContact CG2-CG 4.45Å; I221-L225 WeakPolarHBondContact O-CG 3.36Å; I221-L225 PolarHBondContact O-N 3.38Å; W222-L225 HydrophobicContact CE3-CD1 4.32Å; W222-L225 WeakPolarHBondContact O-CB 3.43Å; W222-L225 PolarHBondContact O-N 2.93Å; W222-L225 VanDerWaalsContact O-N 3.09Å; L225-L227 VanDerWaalsContact C-N 3.33Å; L225-L227 PolarHBondContact O-N 3.3Å; L225-V229 HydrophobicContact CD2-CB 3.97Å; L225-V229 HydrophobicContact CD2-CG1 4.18Å; L225-V229 HydrophobicContact CD2-CG2 3.94Å; L225-V229 WeakPolarHBondContact O-CA 3.36Å; L225-V229 PolarHBondContact O-N 2.76Å; L225-I230 HydrophobicContact CB-CD1 4.09Å; L225-I230 HydrophobicContact CB-CG1 4.35Å; L225-I230 PolarHBondContact O-N 2.71Å
226	I	91	Very high	89.7	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.184	C	C	.	.	I	π-helix	trans	-68.6	-31.4	-179.7	62.6	178.1	0	0	0	112.4	W222 L223 Y224 I230 E239 W859	W222-I226 HydrophobicContact CD2-CG2 4.2Å; W222-I226 HydrophobicContact CH2-CG2 4.24Å; W222-I226 HydrophobicContact CZ2-CG2 3.59Å; W222-I226 PolarHBondContact O-N 3.42Å; L223-I226 HydrophobicContact CD1-CD1 4.13Å; L223-I226 HydrophobicContact CD1-CG1 4.47Å; L223-I226 VanDerWaalsContact O-CG1 3.23Å; L223-I226 WeakPolarHBondContact O-CG1 3.41Å; Y224-I226 PolarHBondContact O-N 2.89Å; I226-I230 HydrophobicContact CG2-CD1 4.26Å; I226-E239 HydrophobicContact CG2-CB 4.14Å; I226-E239 HydrophobicContact CG2-CG 4.31Å; I226-W859 HydrophobicContact CD1-CE3 3.98Å; I226-W859 HydrophobicContact CD1-CZ3 3.64Å; I226-W859 HydrophobicContact CG1-CZ3 4.29Å
227	L	87.3	Confident	89.9	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	19%	0.194	C	C	.	.	I	π-helix	trans	-82.3	-36.5	-178.7	-72.6	176	0	0	0	114.4	L223 Y224 L225 P232 G233 V235 W859 V875 P877 L880	L223-L227 HydrophobicContact CD1-CD1 4.27Å; L223-L227 HydrophobicContact CG-CD1 4.27Å; L223-L227 WeakPolarHBondContact O-CG 3.43Å; L223-L227 PolarHBondContact O-N 3.3Å; Y224-L227 PolarHBondContact O-N 3.28Å; L225-L227 VanDerWaalsContact C-N 3.33Å; L225-L227 PolarHBondContact O-N 3.3Å; L227-P232 WeakPolarHBondContact O-CA 2.94Å; L227-G233 PolarHBondContact O-N 2.96Å; L227-V235 HydrophobicContact CD2-CG2 4.35Å; L227-W859 HydrophobicContact CD1-CH2 4.09Å; L227-W859 HydrophobicContact CD2-CH2 3.67Å; L227-W859 HydrophobicContact CD2-CZ3 3.93Å; L227-W859 HydrophobicContact CG-CH2 4.06Å; L227-W859 HydrophobicContact CG-CZ3 4.27Å; L227-V875 HydrophobicContact CD2-CB 4Å; L227-V875 HydrophobicContact CD2-CG1 3.61Å; L227-P877 HydrophobicContact CB-CB 4.32Å; L227-L880 HydrophobicContact CD1-CD2 3.67Å; L227-L880 HydrophobicContact CD1-CG 4.11Å
228	S	85.9	Confident	90.1	Very high	36 Å²	36	40.5 Å²	40.5	25%	0.252	21%	0.212	S	C	.	.	I	π-helix	trans	-122.2	-16.4	-167.1	-59.4	0	0	0	0	115	Y224	Y224-S228 PolarHBondContact O-N 3.35Å
229	V	88.1	Confident	90.1	Very high	83 Å²	83	37.3 Å²	37.3	50%	0.503	20%	0.198	S	C	.	.	I	π-helix	trans	-118.9	-49.2	-171.6	-177	0	0	0	0	113	Y224 L225	Y224-V229 HydrophobicContact CD1-CG2 4.44Å; Y224-V229 HydrophobicContact CE1-CG2 3.86Å; L225-V229 HydrophobicContact CD2-CB 3.97Å; L225-V229 HydrophobicContact CD2-CG1 4.18Å; L225-V229 HydrophobicContact CD2-CG2 3.94Å; L225-V229 WeakPolarHBondContact O-CA 3.36Å; L225-V229 PolarHBondContact O-N 2.76Å
230	I	89.9	Confident	90	Very high	70 Å²	70	37.4 Å²	37.4	36%	0.359	20%	0.199	S	C	.	.	I	π-helix	trans	-80.3	-62.2	-173	-58.4	174.1	0	0	0	110.2	W222 L225 I226 W238 E239	W222-I230 HydrophobicContact CH2-CD1 4Å; W222-I230 HydrophobicContact CZ3-CD1 4.02Å; L225-I230 HydrophobicContact CB-CD1 4.09Å; L225-I230 HydrophobicContact CB-CG1 4.35Å; L225-I230 PolarHBondContact O-N 2.71Å; I226-I230 HydrophobicContact CG2-CD1 4.26Å; I230-W238 HydrophobicContact CG2-CH2 3.99Å; I230-W238 HydrophobicContact CG2-CZ2 3.9Å; I230-E239 WeakPolarHBondContact CG2-OE1 3.4Å
231	S	87.6	Confident	90.2	Very high	13 Å²	13	40.2 Å²	40.2	9%	0.091	21%	0.213	C	C	.	.	S	Bend	trans	-127.6	80.2	179.6	-59.4	0	0	0	0	109	G233 V234 Q236 E239	S231-G233 PolarHBondContact O-N 2.78Å; S231-G233 VanDerWaalsContact O-N 3.12Å; S231-V234 WeakPolarHBondContact CB-O 3.38Å; S231-V234 PolarHBondContact O-N 3.06Å; S231-V234 VanDerWaalsContact O-N 3.15Å; S231-Q236 PolarHBondContact OG-NE2 3.3Å; S231-E239 WeakPolarHBondContact CB-OE1 3.4Å; S231-E239 PolarHBondContact OG-OE1 3.06Å
232	P	86.4	Confident	90.3	Very high	92 Å²	92	40 Å²	40	60%	0.597	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	120.3	-170.5	23.5	-32.5	0	0	0	111.5	L227 V234	L227-P232 WeakPolarHBondContact O-CA 2.94Å; P232-V234 VanDerWaalsContact C-N 3.3Å; P232-V234 PolarHBondContact O-N 3.34Å
233	G	83.2	Confident	90.3	Very high	14 Å²	14	38.9 Å²	38.9	14%	0.144	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	0.9	178.3	0	0	0	0	0	116.2	L227 S231 K874 V875	L227-G233 PolarHBondContact O-N 2.96Å; S231-G233 PolarHBondContact O-N 2.78Å; S231-G233 VanDerWaalsContact O-N 3.12Å; G233-K874 WeakPolarHBondContact O-CA 3.37Å; G233-V875 CarbonylContact C-O 3.54Å; G233-V875 VanDerWaalsContact CA-O 3.32Å; G233-V875 WeakPolarHBondContact CA-O 3.43Å; G233-V875 PolarHBondContact O-N 3.31Å
234	V	89.7	Confident	90.5	Very high	34 Å²	34	42.5 Å²	42.5	21%	0.206	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-141.1	124.9	-178.2	179.4	0	0	0	0	109.8	S231 P232 E872 F873 K874	S231-V234 WeakPolarHBondContact CB-O 3.38Å; S231-V234 PolarHBondContact O-N 3.06Å; S231-V234 VanDerWaalsContact O-N 3.15Å; P232-V234 VanDerWaalsContact C-N 3.3Å; P232-V234 PolarHBondContact O-N 3.34Å; V234-E872 HydrophobicContact CG1-CB 3.93Å; V234-E872 HydrophobicContact CG1-CG 4.44Å; V234-F873 WeakPolarHBondContact CA-O 3.45Å; V234-K874 HydrophobicContact CG2-CG 4.42Å
235	V	91.4	Very high	90.6	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.018	24%	0.236	C	C	.	.			trans	-98.8	118.2	176.9	175.8	0	0	0	0	110	L227 E239 W859 F873 V875	L227-V235 HydrophobicContact CD2-CG2 4.35Å; V235-E239 WeakPolarHBondContact CA-OE2 3.43Å; V235-E239 HydrophobicContact CG1-CB 4.23Å; V235-W859 HydrophobicContact CB-CE3 4.49Å; V235-W859 HydrophobicContact CG1-CB 4.5Å; V235-W859 HydrophobicContact CG1-CE3 4.09Å; V235-W859 HydrophobicContact CG2-CE3 3.82Å; V235-W859 HydrophobicContact CG2-CZ3 3.92Å; V235-F873 HydrophobicContact CB-CD1 3.81Å; V235-F873 HydrophobicContact CB-CE1 4.18Å; V235-F873 HydrophobicContact CG1-CD1 4.37Å; V235-F873 PolarHBondContact N-O 2.86Å; V235-V875 HydrophobicContact CB-CG2 4.22Å; V235-V875 HydrophobicContact CG2-CB 4.14Å; V235-V875 HydrophobicContact CG2-CG2 3.67Å
236	Q	92.1	Very high	90.8	Very high	87 Å²	87	43.5 Å²	43.5	41%	0.407	23%	0.228	S	C	.	.			trans	-80.5	157.9	179.3	-58.4	-173.4	10.8	0	0	111.8	S231 W238 E239 G240	S231-Q236 PolarHBondContact OG-NE2 3.3Å; Q236-W238 VanDerWaalsContact C-N 3.27Å; Q236-W238 PolarHBondContact O-N 3.34Å; Q236-W238 VanDerWaalsContact OE1-CD1 3.3Å; Q236-E239 HydrophobicContact CB-CG 4.19Å; Q236-E239 PolarHBondContact N-OE2 2.99Å; Q236-E239 WeakPolarHBondContact O-CB 3.49Å; Q236-E239 PolarHBondContact O-N 3.44Å; Q236-G240 PolarHBondContact O-N 3.38Å; Q236-G240 VanDerWaalsContact O-N 3.1Å
237	V	92.9	Very high	90.8	Very high	35 Å²	35	45 Å²	45	21%	0.212	23%	0.234	C	C	.	.	H	α-helix	trans	-55.8	-41.7	-179.8	179.4	0	0	0	0	112	L241 A863 I864 N867	V237-L241 HydrophobicContact CG1-CD1 3.85Å; V237-L241 HydrophobicContact CG1-CG 4.34Å; V237-L241 WeakPolarHBondContact O-CB 3.36Å; V237-L241 VanDerWaalsContact O-CG 3.3Å; V237-L241 WeakPolarHBondContact O-CG 3.32Å; V237-L241 PolarHBondContact O-N 3.16Å; V237-A863 HydrophobicContact CG2-CB 4.16Å; V237-I864 HydrophobicContact CG1-CG1 3.84Å; V237-N867 HydrophobicContact CG2-CB 3.59Å
238	W	93.4	Very high	91	Very high	117 Å²	117	47.6 Å²	47.6	44%	0.443	25%	0.252	S	S	.	.	H	α-helix	trans	-71	-31.4	179.9	73.6	-92.4	0	0	0	112.6	W222 I230 Q236 L242	W222-W238 HydrophobicContact CH2-CZ3 4.25Å; I230-W238 HydrophobicContact CG2-CH2 3.99Å; I230-W238 HydrophobicContact CG2-CZ2 3.9Å; Q236-W238 VanDerWaalsContact C-N 3.27Å; Q236-W238 PolarHBondContact O-N 3.34Å; Q236-W238 VanDerWaalsContact OE1-CD1 3.3Å; W238-L242 HydrophobicContact CE3-CD2 4.22Å; W238-L242 HydrophobicContact CZ3-CD2 3.98Å; W238-L242 WeakPolarHBondContact O-CB 3.35Å; W238-L242 PolarHBondContact O-N 2.9Å
239	E	93	Very high	91.2	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.8	-44.6	177.1	-65.9	171.2	157.4	0	0	110.3	I226 I230 S231 V235 Q236 T243	I226-E239 HydrophobicContact CG2-CB 4.14Å; I226-E239 HydrophobicContact CG2-CG 4.31Å; I230-E239 WeakPolarHBondContact CG2-OE1 3.4Å; S231-E239 WeakPolarHBondContact CB-OE1 3.4Å; S231-E239 PolarHBondContact OG-OE1 3.06Å; V235-E239 WeakPolarHBondContact CA-OE2 3.43Å; V235-E239 HydrophobicContact CG1-CB 4.23Å; Q236-E239 HydrophobicContact CB-CG 4.19Å; Q236-E239 PolarHBondContact N-OE2 2.99Å; Q236-E239 WeakPolarHBondContact O-CB 3.49Å; Q236-E239 PolarHBondContact O-N 3.44Å; E239-T243 WeakPolarHBondContact O-CB 3.02Å; E239-T243 PolarHBondContact O-N 2.92Å; E239-T243 PolarHBondContact O-OG1 3.45Å
240	G	91	Very high	91.3	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-60.2	-52.8	172.8	0	0	0	0	0	112	Q236 L242 T243 F244 S860	Q236-G240 PolarHBondContact O-N 3.38Å; Q236-G240 VanDerWaalsContact O-N 3.1Å; G240-L242 PolarHBondContact O-N 3.38Å; G240-T243 WeakPolarHBondContact O-CB 3.48Å; G240-T243 PolarHBondContact O-N 3.29Å; G240-F244 PolarHBondContact O-N 3.25Å; G240-S860 PolarHBondContact O-OG 3.2Å
241	L	93.9	Very high	91.2	Very high	59 Å²	59	42.6 Å²	42.6	31%	0.309	22%	0.22	S	C	.	.	H	α-helix	trans	-62.5	-41.4	-178.6	-73.6	175.7	0	0	0	112.3	V237 T243 F244 F245 S860 I864	V237-L241 HydrophobicContact CG1-CD1 3.85Å; V237-L241 HydrophobicContact CG1-CG 4.34Å; V237-L241 WeakPolarHBondContact O-CB 3.36Å; V237-L241 VanDerWaalsContact O-CG 3.3Å; V237-L241 WeakPolarHBondContact O-CG 3.32Å; V237-L241 PolarHBondContact O-N 3.16Å; L241-T243 VanDerWaalsContact C-N 3.33Å; L241-T243 PolarHBondContact O-N 3.37Å; L241-F244 WeakPolarHBondContact O-CB 3.4Å; L241-F244 PolarHBondContact O-N 3.33Å; L241-F245 HydrophobicContact CB-CD2 4.42Å; L241-F245 HydrophobicContact CB-CE2 4.41Å; L241-F245 WeakPolarHBondContact O-CD2 3.38Å; L241-F245 PolarHBondContact O-N 2.77Å; L241-S860 PolarHBondContact N-OG 3.11Å; L241-I864 HydrophobicContact CD2-CD1 4.39Å
242	L	94.6	Very high	91.2	Very high	57 Å²	57	45.9 Å²	45.9	30%	0.298	24%	0.239	S	C	.	.	H	α-helix	trans	-65	-39.2	177.7	-176.8	60.7	0	0	0	111.4	W222 W238 G240 F244 F245 F246	W222-L242 HydrophobicContact CH2-CD2 3.7Å; W222-L242 HydrophobicContact CZ2-CD2 3.72Å; W222-L242 HydrophobicContact CZ2-CG 4.22Å; W238-L242 HydrophobicContact CE3-CD2 4.22Å; W238-L242 HydrophobicContact CZ3-CD2 3.98Å; W238-L242 WeakPolarHBondContact O-CB 3.35Å; W238-L242 PolarHBondContact O-N 2.9Å; G240-L242 PolarHBondContact O-N 3.38Å; L242-F244 VanDerWaalsContact C-N 3.28Å; L242-F244 PolarHBondContact O-N 3.28Å; L242-F245 PolarHBondContact O-N 3.21Å; L242-F246 HydrophobicContact CD1-CE1 4.11Å; L242-F246 HydrophobicContact CD1-CE2 4.46Å; L242-F246 HydrophobicContact CD1-CZ 4Å; L242-F246 HydrophobicContact CD2-CE2 4.29Å; L242-F246 HydrophobicContact CD2-CZ 4.01Å; L242-F246 HydrophobicContact CG-CD2 4.47Å; L242-F246 HydrophobicContact CG-CE1 4.33Å; L242-F246 HydrophobicContact CG-CE2 3.83Å; L242-F246 HydrophobicContact CG-CZ 3.74Å; L242-F246 WeakPolarHBondContact O-CD2 3.34Å; L242-F246 WeakPolarHBondContact O-CG 3.4Å; L242-F246 PolarHBondContact O-N 3.44Å
243	T	93.9	Very high	91.3	Very high	1 Å²	1	47 Å²	47	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-57.6	-43.6	172.9	-54.6	0	0	0	0	111	W222 E239 G240 L241 F246 V851 F852	W222-T243 PolarHBondContact NE1-OG1 3Å; E239-T243 WeakPolarHBondContact O-CB 3.02Å; E239-T243 PolarHBondContact O-N 2.92Å; E239-T243 PolarHBondContact O-OG1 3.45Å; G240-T243 WeakPolarHBondContact O-CB 3.48Å; G240-T243 PolarHBondContact O-N 3.29Å; L241-T243 VanDerWaalsContact C-N 3.33Å; L241-T243 PolarHBondContact O-N 3.37Å; T243-F246 PolarHBondContact O-N 3.45Å; T243-V851 HydrophobicContact CG2-CG1 4.49Å; T243-F852 HydrophobicContact CG2-CD1 4.43Å; T243-F852 WeakPolarHBondContact O-CA 3.42Å
244	F	93.5	Very high	91.3	Very high	75 Å²	75	46.5 Å²	46.5	33%	0.329	23%	0.229	S	C	.	.	H	α-helix	trans	-64.8	-42.9	174.1	176.3	-114.5	0	0	0	112.9	G240 L241 L242 F246 F247 P248 F852 L853 V857	G240-F244 PolarHBondContact O-N 3.25Å; L241-F244 WeakPolarHBondContact O-CB 3.4Å; L241-F244 PolarHBondContact O-N 3.33Å; L242-F244 VanDerWaalsContact C-N 3.28Å; L242-F244 PolarHBondContact O-N 3.28Å; F244-F246 VanDerWaalsContact C-N 3.28Å; F244-F246 PolarHBondContact O-N 2.89Å; F244-F247 PolarHBondContact O-N 3.36Å; F244-P248 WeakPolarHBondContact O-CD 2.9Å; F244-F852 WeakPolarHBondContact CA-O 3.33Å; F244-L853 HydrophobicContact CD2-CD1 4.08Å; F244-L853 HydrophobicContact CE2-CD1 3.65Å; F244-V857 HydrophobicContact CD2-CG2 3.52Å; F244-V857 HydrophobicContact CE2-CG2 3.57Å
245	F	93.8	Very high	91.1	Very high	110 Å²	110	49.6 Å²	49.6	48%	0.482	24%	0.237	S	C	.	.	H	α-helix	trans	-69.5	-18.8	178.6	-79	-62.9	0	0	0	114.3	L241 L242 F247 P248 I249	L241-F245 HydrophobicContact CB-CD2 4.42Å; L241-F245 HydrophobicContact CB-CE2 4.41Å; L241-F245 WeakPolarHBondContact O-CD2 3.38Å; L241-F245 PolarHBondContact O-N 2.77Å; L242-F245 PolarHBondContact O-N 3.21Å; F245-F247 PolarHBondContact O-N 3.45Å; F245-P248 HydrophobicContact CD1-CG 4.4Å; F245-P248 WeakPolarHBondContact O-CD 3.26Å; F245-P248 VanDerWaalsContact O-CG 3.22Å; F245-P248 WeakPolarHBondContact O-CG 3.27Å; F245-I249 WeakPolarHBondContact O-CD1 3.31Å; F245-I249 VanDerWaalsContact O-CG1 3.29Å; F245-I249 WeakPolarHBondContact O-CG1 3.44Å; F245-I249 PolarHBondContact O-N 3.06Å
246	F	93.9	Very high	90.8	Very high	25 Å²	25	50.9 Å²	50.9	11%	0.11	25%	0.245	C	C	.	.	H	α-helix	trans	-64.7	-24.5	173.3	-76.3	-42.9	0	0	0	113.4	W215 F218 W222 L242 T243 F244 I249 C250 F852	W215-F246 AromaticContact CH2-CD1 3.99Å; W215-F246 HydrophobicContact CH2-CD1 3.99Å; W215-F246 HydrophobicContact CZ3-CB 4.12Å; W215-F246 AromaticContact CZ3-CD1 3.75Å; W215-F246 HydrophobicContact CZ3-CD1 3.75Å; W215-F246 HydrophobicContact CZ3-CE1 4.45Å; W215-F246 HydrophobicContact CZ3-CG 4.08Å; F218-F246 HydrophobicContact CE1-CD1 4.47Å; F218-F246 HydrophobicContact CE1-CD2 4.19Å; F218-F246 HydrophobicContact CE1-CE1 4.29Å; F218-F246 AromaticContact CE1-CE2 3.99Å; F218-F246 HydrophobicContact CE1-CE2 3.99Å; F218-F246 HydrophobicContact CE1-CG 4.44Å; F218-F246 HydrophobicContact CE1-CZ 4.05Å; F218-F246 HydrophobicContact CZ-CE2 4.27Å; F218-F246 HydrophobicContact CZ-CZ 4.13Å; W222-F246 HydrophobicContact CD2-CD2 4.49Å; W222-F246 AromaticContact CD2-CE2 3.64Å; W222-F246 HydrophobicContact CD2-CE2 3.64Å; W222-F246 HydrophobicContact CD2-CZ 4.47Å; W222-F246 AromaticContact CE2-CE2 3.58Å; W222-F246 HydrophobicContact CE3-CE2 4.13Å; W222-F246 HydrophobicContact CG-CD2 4.38Å; W222-F246 AromaticContact CG-CE2 3.95Å; W222-F246 HydrophobicContact CG-CE2 3.95Å; W222-F246 HydrophobicContact CH2-CE2 4.47Å; W222-F246 HydrophobicContact CZ2-CE2 4.02Å; W222-F246 AromaticContact NE1-CE2 3.78Å; L242-F246 HydrophobicContact CD1-CE1 4.11Å; L242-F246 HydrophobicContact CD1-CE2 4.46Å; L242-F246 HydrophobicContact CD1-CZ 4Å; L242-F246 HydrophobicContact CD2-CE2 4.29Å; L242-F246 HydrophobicContact CD2-CZ 4.01Å; L242-F246 HydrophobicContact CG-CD2 4.47Å; L242-F246 HydrophobicContact CG-CE1 4.33Å; L242-F246 HydrophobicContact CG-CE2 3.83Å; L242-F246 HydrophobicContact CG-CZ 3.74Å; L242-F246 WeakPolarHBondContact O-CD2 3.34Å; L242-F246 WeakPolarHBondContact O-CG 3.4Å; L242-F246 PolarHBondContact O-N 3.44Å; T243-F246 PolarHBondContact O-N 3.45Å; F244-F246 VanDerWaalsContact C-N 3.28Å; F244-F246 PolarHBondContact O-N 2.89Å; F246-I249 HydrophobicContact CD1-CD1 4.09Å; F246-I249 PolarHBondContact O-N 2.95Å; F246-C250 VanDerWaalsContact O-CB 3.26Å; F246-C250 WeakPolarHBondContact O-CB 3.26Å; F246-C250 PolarHBondContact O-N 2.9Å; F246-F852 HydrophobicContact CB-CD1 3.52Å; F246-F852 HydrophobicContact CB-CD2 4.26Å; F246-F852 HydrophobicContact CB-CE1 3.51Å; F246-F852 HydrophobicContact CB-CE2 4.26Å; F246-F852 HydrophobicContact CB-CG 3.93Å; F246-F852 HydrophobicContact CB-CZ 3.91Å; F246-F852 HydrophobicContact CD2-CD1 4.32Å; F246-F852 AromaticContact CD2-CE1 3.96Å; F246-F852 HydrophobicContact CD2-CE1 3.96Å; F246-F852 HydrophobicContact CG-CD1 4.41Å; F246-F852 HydrophobicContact CG-CE1 4.09Å
247	F	90.6	Very high	90.2	Very high	31 Å²	31	47.5 Å²	47.5	14%	0.136	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-58.7	174.7	175.6	-117.1	0	0	0	112.9	T143 F244 F245 I249 C250 V251 V849 F852	T143-F247 HydrophobicContact CG2-CZ 3.93Å; F244-F247 PolarHBondContact O-N 3.36Å; F245-F247 PolarHBondContact O-N 3.45Å; F247-I249 VanDerWaalsContact C-N 3.25Å; F247-I249 PolarHBondContact O-N 3.31Å; F247-C250 WeakPolarHBondContact O-CB 3.49Å; F247-C250 PolarHBondContact O-N 2.9Å; F247-C250 VanDerWaalsContact O-N 3.16Å; F247-V251 HydrophobicContact CD2-CG2 4.32Å; F247-V251 HydrophobicContact CE2-CG2 4.02Å; F247-V251 HydrophobicContact CZ-CG2 4.26Å; F247-V251 WeakPolarHBondContact O-CG2 3.45Å; F247-V251 PolarHBondContact O-N 3.44Å; F247-V849 HydrophobicContact CD2-CG2 4.1Å; F247-V849 HydrophobicContact CE2-CG1 4.46Å; F247-V849 HydrophobicContact CE2-CG2 3.66Å; F247-F852 HydrophobicContact CB-CB 3.78Å
248	P	91.4	Very high	89.5	Confident	57 Å²	57	47.8 Å²	47.8	37%	0.37	23%	0.232	S	C	.	.	H	α-helix	trans	-62.2	-31.8	177.2	22.2	-32.4	0	0	0	112.8	F244 F245 V251 V252	F244-P248 WeakPolarHBondContact O-CD 2.9Å; F245-P248 HydrophobicContact CD1-CG 4.4Å; F245-P248 WeakPolarHBondContact O-CD 3.26Å; F245-P248 VanDerWaalsContact O-CG 3.22Å; F245-P248 WeakPolarHBondContact O-CG 3.27Å; P248-V251 PolarHBondContact O-N 3.34Å; P248-V252 WeakPolarHBondContact O-CG2 3.48Å; P248-V252 PolarHBondContact O-N 2.88Å
249	I	91.4	Very high	88.5	Confident	65 Å²	65	49.4 Å²	49.4	33%	0.333	24%	0.238	S	C	.	.	H	α-helix	trans	-63.2	-47.5	174.2	-65.7	168	0	0	0	110.6	W215 F245 F246 F247 V251 V252 F253	W215-I249 HydrophobicContact CH2-CB 4.49Å; W215-I249 HydrophobicContact CH2-CG2 3.71Å; W215-I249 HydrophobicContact CZ2-CG2 3.8Å; F245-I249 WeakPolarHBondContact O-CD1 3.31Å; F245-I249 VanDerWaalsContact O-CG1 3.29Å; F245-I249 WeakPolarHBondContact O-CG1 3.44Å; F245-I249 PolarHBondContact O-N 3.06Å; F246-I249 HydrophobicContact CD1-CD1 4.09Å; F246-I249 PolarHBondContact O-N 2.95Å; F247-I249 VanDerWaalsContact C-N 3.25Å; F247-I249 PolarHBondContact O-N 3.31Å; I249-V251 VanDerWaalsContact C-N 3.29Å; I249-V251 PolarHBondContact O-N 3.14Å; I249-V252 PolarHBondContact O-N 3.44Å; I249-F253 HydrophobicContact CG2-CD2 3.91Å; I249-F253 HydrophobicContact CG2-CE2 3.88Å; I249-F253 VanDerWaalsContact O-CD2 3.24Å; I249-F253 WeakPolarHBondContact O-CD2 3.32Å; I249-F253 PolarHBondContact O-N 3.38Å
250	C	89.3	Confident	87.2	Confident	3 Å²	3	55.7 Å²	55.7	2%	0.02	26%	0.262	C	S	.	.	H	α-helix	trans	-57.3	-43.4	176.6	-177.9	0	0	0	0	111.5	W215 F246 F247 F253 A254 F852	W215-C250 HydrophobicContact CB-CB 4.45Å; W215-C250 WeakPolarHBondContact CB-SG 3.42Å; W215-C250 HydrophobicContact CD2-CB 3.94Å; W215-C250 HydrophobicContact CE3-CB 4.19Å; W215-C250 HydrophobicContact CG-CB 4.05Å; F246-C250 VanDerWaalsContact O-CB 3.26Å; F246-C250 WeakPolarHBondContact O-CB 3.26Å; F246-C250 PolarHBondContact O-N 2.9Å; F247-C250 WeakPolarHBondContact O-CB 3.49Å; F247-C250 PolarHBondContact O-N 2.9Å; F247-C250 VanDerWaalsContact O-N 3.16Å; C250-F253 PolarHBondContact O-N 3.12Å; C250-A254 WeakPolarHBondContact O-CB 3.43Å; C250-A254 PolarHBondContact O-N 2.95Å; C250-F852 HydrophobicContact CB-CE2 4.49Å
251	V	88.2	Confident	85.5	Confident	15 Å²	15	61 Å²	61	9%	0.091	29%	0.29	C	S	.	.	H	α-helix	trans	-63.5	-45	178.4	175.4	0	0	0	0	112	V139 L142 T143 F247 P248 I249 F253 A254 W255	V139-V251 HydrophobicContact CB-CG1 4.47Å; V139-V251 HydrophobicContact CG1-CG1 3.85Å; V139-V251 HydrophobicContact CG2-CG1 4.24Å; L142-V251 HydrophobicContact CD2-CG2 4.04Å; L142-V251 HydrophobicContact CG-CG2 4.35Å; T143-V251 HydrophobicContact CG2-CB 4.22Å; T143-V251 HydrophobicContact CG2-CG1 3.69Å; T143-V251 HydrophobicContact CG2-CG2 3.45Å; T143-V251 VanDerWaalsContact CG2-CG2 3.45Å; F247-V251 HydrophobicContact CD2-CG2 4.32Å; F247-V251 HydrophobicContact CE2-CG2 4.02Å; F247-V251 HydrophobicContact CZ-CG2 4.26Å; F247-V251 WeakPolarHBondContact O-CG2 3.45Å; F247-V251 PolarHBondContact O-N 3.44Å; P248-V251 PolarHBondContact O-N 3.34Å; I249-V251 VanDerWaalsContact C-N 3.29Å; I249-V251 PolarHBondContact O-N 3.14Å; V251-F253 VanDerWaalsContact C-N 3.34Å; V251-F253 PolarHBondContact O-N 3.33Å; V251-A254 PolarHBondContact O-N 2.84Å; V251-W255 WeakPolarHBondContact O-CB 3.39Å; V251-W255 PolarHBondContact O-N 3.34Å
252	V	88.3	Confident	83.3	Confident	82 Å²	82	64.4 Å²	64.4	50%	0.497	31%	0.307	S	S	.	.	H	α-helix	trans	-62.5	-42.9	175.9	171	0	0	0	0	110.6	P248 I249 A254 W255 V256	P248-V252 WeakPolarHBondContact O-CG2 3.48Å; P248-V252 PolarHBondContact O-N 2.88Å; I249-V252 PolarHBondContact O-N 3.44Å; V252-A254 PolarHBondContact O-N 3.48Å; V252-W255 PolarHBondContact O-N 3.15Å; V252-V256 HydrophobicContact CG1-CG2 4.35Å; V252-V256 WeakPolarHBondContact O-CB 2.93Å; V252-V256 VanDerWaalsContact O-CG2 3.29Å; V252-V256 WeakPolarHBondContact O-CG2 3.29Å; V252-V256 PolarHBondContact O-N 3.22Å
253	F	87.6	Confident	80.8	Confident	117 Å²	117	68.5 Å²	68.5	51%	0.513	32%	0.323	S	S	.	.	H	α-helix	trans	-63	-41.2	176.8	-89.5	-116.1	0	0	0	112.2	V211 I249 C250 V251 V256 A257	V211-F253 HydrophobicContact CG1-CB 4.19Å; I249-F253 HydrophobicContact CG2-CD2 3.91Å; I249-F253 HydrophobicContact CG2-CE2 3.88Å; I249-F253 VanDerWaalsContact O-CD2 3.24Å; I249-F253 WeakPolarHBondContact O-CD2 3.32Å; I249-F253 PolarHBondContact O-N 3.38Å; C250-F253 PolarHBondContact O-N 3.12Å; V251-F253 VanDerWaalsContact C-N 3.34Å; V251-F253 PolarHBondContact O-N 3.33Å; F253-V256 PolarHBondContact O-N 2.81Å; F253-A257 WeakPolarHBondContact O-CB 3.26Å; F253-A257 PolarHBondContact O-N 2.82Å
254	A	83.7	Confident	78.3	Confident	2 Å²	2	78.5 Å²	78.5	2%	0.017	36%	0.362	C	S	.	.	H	α-helix	trans	-63.6	-43.5	175	0	0	0	0	0	111.6	T138 L142 C250 V251 V252 A257 D258	T138-A254 HydrophobicContact CG2-CB 4.19Å; L142-A254 HydrophobicContact CD2-CB 3.69Å; C250-A254 WeakPolarHBondContact O-CB 3.43Å; C250-A254 PolarHBondContact O-N 2.95Å; V251-A254 PolarHBondContact O-N 2.84Å; V252-A254 PolarHBondContact O-N 3.48Å; A254-A257 PolarHBondContact O-N 3.21Å; A254-D258 WeakPolarHBondContact O-CB 3.35Å; A254-D258 PolarHBondContact O-N 3.45Å
255	W	84.8	Confident	75.5	Confident	99 Å²	99	84 Å²	84	38%	0.375	39%	0.386	S	S	.	.	H	α-helix	trans	-62.9	-42.1	175.5	178.3	81.5	0	0	0	112.8	V139 V251 V252 A257 D258 R259 L261	V139-W255 HydrophobicContact CG2-CB 3.8Å; V139-W255 HydrophobicContact CG2-CG 4.04Å; V251-W255 WeakPolarHBondContact O-CB 3.39Å; V251-W255 PolarHBondContact O-N 3.34Å; V252-W255 PolarHBondContact O-N 3.15Å; W255-A257 VanDerWaalsContact C-N 3.35Å; W255-D258 PolarHBondContact O-N 3.49Å; W255-R259 HydrophobicContact CD2-CG 4.31Å; W255-R259 HydrophobicContact CZ2-CG 4.01Å; W255-R259 WeakPolarHBondContact O-CB 3.47Å; W255-R259 PolarHBondContact O-N 3.02Å; W255-L261 HydrophobicContact CH2-CD1 4.38Å; W255-L261 HydrophobicContact CZ3-CD1 4.26Å
256	V	85.2	Confident	72.8	Confident	31 Å²	31	88.8 Å²	88.8	19%	0.188	40%	0.402	C	S	.	.	H	α-helix	trans	-64.2	-40.5	175.7	170.4	0	0	0	0	111.2	V252 F253 D258 R259 R260 L261 L262	V252-V256 HydrophobicContact CG1-CG2 4.35Å; V252-V256 WeakPolarHBondContact O-CB 2.93Å; V252-V256 VanDerWaalsContact O-CG2 3.29Å; V252-V256 WeakPolarHBondContact O-CG2 3.29Å; V252-V256 PolarHBondContact O-N 3.22Å; F253-V256 PolarHBondContact O-N 2.81Å; V256-D258 VanDerWaalsContact C-N 3.31Å; V256-R259 PolarHBondContact O-N 3.29Å; V256-R260 PolarHBondContact O-N 3.02Å; V256-L261 HydrophobicContact CG1-CB 4.39Å; V256-L262 HydrophobicContact CG1-CD1 3.46Å; V256-L262 VanDerWaalsContact CG1-CD1 3.46Å; V256-L262 HydrophobicContact CG1-CG 3.78Å
257	A	79.9	Confident	69.9	Low	16 Å²	16	93 Å²	93	13%	0.132	43%	0.429	C	S	.	.	H	α-helix	trans	-64.7	-36.5	176.7	0	0	0	0	0	112.2	V211 F253 A254 W255	V211-A257 HydrophobicContact CG2-CB 3.92Å; F253-A257 WeakPolarHBondContact O-CB 3.26Å; F253-A257 PolarHBondContact O-N 2.82Å; A254-A257 PolarHBondContact O-N 3.21Å; W255-A257 VanDerWaalsContact C-N 3.35Å
258	D	77.8	Confident	67	Low	40 Å²	40	102.7 Å²	102.7	21%	0.214	47%	0.467	C	S	.	.	H	α-helix	trans	-67.8	-48.4	175.2	-172.4	38.8	0	0	0	111.9	N136 T138 V208 A254 W255 V256 R260	N136-D258 PolarHBondContact ND2-OD2 3.12Å; T138-D258 HydrophobicContact CG2-CB 4.29Å; T138-D258 PolarHBondContact OG1-OD2 3.45Å; T138-D258 VanDerWaalsContact OG1-OD2 3.06Å; V208-D258 HydrophobicContact CG2-CB 4.29Å; A254-D258 WeakPolarHBondContact O-CB 3.35Å; A254-D258 PolarHBondContact O-N 3.45Å; W255-D258 PolarHBondContact O-N 3.49Å; V256-D258 VanDerWaalsContact C-N 3.31Å; D258-R260 PolarHBondContact O-N 3.44Å; D258-R260 VanDerWaalsContact O-N 3.09Å
259	R	73.1	Confident	64.2	Low	152 Å²	152	105 Å²	105	57%	0.574	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	0.7	-179.6	-73	-72	-175.3	169.6	-0.3	115.3	W255 V256 L261	W255-R259 HydrophobicContact CD2-CG 4.31Å; W255-R259 HydrophobicContact CZ2-CG 4.01Å; W255-R259 WeakPolarHBondContact O-CB 3.47Å; W255-R259 PolarHBondContact O-N 3.02Å; V256-R259 PolarHBondContact O-N 3.29Å; R259-L261 HydrophobicContact CB-CD1 4.07Å; R259-L261 HydrophobicContact CB-CG 4.25Å; R259-L261 PolarHBondContact O-N 3.02Å; R259-L261 VanDerWaalsContact O-N 3.17Å
260	R	65.3	Low	61.1	Low	131 Å²	131	114 Å²	114	49%	0.494	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	22.6	176.3	-49.3	-169.2	176.9	-160.2	-1.9	115.4	V256 D258 L262 E282	V256-R260 PolarHBondContact O-N 3.02Å; D258-R260 PolarHBondContact O-N 3.44Å; D258-R260 VanDerWaalsContact O-N 3.09Å; R260-L262 VanDerWaalsContact C-N 3.29Å; R260-L262 PolarHBondContact O-N 3.4Å; R260-E282 IonicContact NH1-OE2 2.63Å
261	L	54.8	Low	58.3	Low	114 Å²	114	121.6 Å²	121.6	60%	0.597	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-18.6	-171.3	-78.9	160.7	0	0	0	115.1	W255 V256 R259	W255-L261 HydrophobicContact CH2-CD1 4.38Å; W255-L261 HydrophobicContact CZ3-CD1 4.26Å; V256-L261 HydrophobicContact CG1-CB 4.39Å; R259-L261 HydrophobicContact CB-CD1 4.07Å; R259-L261 HydrophobicContact CB-CG 4.25Å; R259-L261 PolarHBondContact O-N 3.02Å; R259-L261 VanDerWaalsContact O-N 3.17Å
262	L	49.5	Very low	55.4	Low	130 Å²	130	132.7 Å²	132.7	68%	0.681	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	-11.9	-169.1	-68.3	173.2	0	0	0	116.1	V256 R260	V256-L262 HydrophobicContact CG1-CD1 3.46Å; V256-L262 VanDerWaalsContact CG1-CD1 3.46Å; V256-L262 HydrophobicContact CG1-CG 3.78Å; R260-L262 VanDerWaalsContact C-N 3.29Å; R260-L262 PolarHBondContact O-N 3.4Å
263	F	41.1	Very low	52.6	Low	142 Å²	142	135 Å²	135	62%	0.623	59%	0.585	S	S	*	*			trans	-115.7	2.7	-168.2	-72.2	-79.8	0	0	0	116.1	K265	F263-K265 PolarHBondContact O-N 3.36Å
264	Y	42.4	Very low	49.8	Very low	212 Å²	212	132.1 Å²	132.1	83%	0.831	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-4.3	-178	-131.7	-87.1	0	0	0	114.5
265	K	34.4	Very low	47.8	Very low	189 Å²	189	142.2 Å²	142.2	82%	0.822	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	-11.6	-172.1	-147.6	172.2	-176.2	177.6	0	115.9	F263	F263-K265 PolarHBondContact O-N 3.36Å
266	Y	36.2	Very low	45.4	Very low	212 Å²	212	146.2 Å²	146.2	83%	0.831	66%	0.655	S	S	*	*	S	Bend	trans	-121.1	2.1	-169.7	-98.5	-81.6	0	0	0	117.1
267	V	33.7	Very low	43.3	Very low	112 Å²	112	156 Å²	156	68%	0.679	69%	0.689	S	S	*	*			trans	-126.1	93.4	174.3	-173	0	0	0	0	109	K269	V267-K269 HydrophobicContact CG1-CG 4.45Å; V267-K269 PolarHBondContact O-N 3.2Å
268	Y	30	Very low	40.9	Very low	236 Å²	236	160 Å²	160	93%	0.925	73%	0.731	S	S	*	*			trans	-60.1	120.8	165.3	-90	-90.6	0	0	0	108.8
269	K	32.3	Very low	38.5	Very low	104 Å²	104	164.8 Å²	164.8	45%	0.452	75%	0.754	S	S	.	*			trans	-113	126	162.4	-83.6	-172.4	179.1	179.7	0	110.2	V267 E282	V267-K269 HydrophobicContact CG1-CG 4.45Å; V267-K269 PolarHBondContact O-N 3.2Å; K269-E282 VanDerWaalsContact CD-OE1 3.28Å; K269-E282 WeakPolarHBondContact CD-OE1 3.41Å; K269-E282 WeakPolarHBondContact CE-OE1 3.35Å; K269-E282 IonicContact NZ-OE1 3.83Å; K269-E282 PolarHBondContact NZ-OE1 3.25Å
270	R	25.6	Very low	36.5	Very low	254 Å²	254	163.9 Å²	163.9	96%	0.958	76%	0.759	S	S	*	*			trans	-72.4	126	167.5	-89.6	176.8	170.8	172.3	-3.8	108.5
271	Y	30.7	Very low	34.9	Very low	164 Å²	164	163 Å²	163	64%	0.643	76%	0.763	S	S	*	*			trans	-89	131.9	169	-73.8	-89.5	0	0	0	109.8	I280	Y271-I280 HydrophobicContact CD1-CD1 4.32Å; Y271-I280 HydrophobicContact CE1-CD1 3.94Å; Y271-I280 HydrophobicContact CE1-CG2 3.98Å
272	R	27	Very low	33.6	Very low	247 Å²	247	162.9 Å²	162.9	93%	0.932	76%	0.759	S	S	*	*			trans	-119.6	113.6	164.3	-171.1	175.4	-174.8	164.4	1.6	108.1
273	T	29.5	Very low	32.6	Very low	130 Å²	130	162.3 Å²	162.3	80%	0.798	76%	0.761	S	S	*	*			trans	-74.2	120.4	-179.6	-42.4	0	0	0	0	110.1
274	G	28.9	Very low	32	Very low	58 Å²	58	163.8 Å²	163.8	60%	0.598	77%	0.77	S	S	*	*			trans	-85.3	131.7	164.1	0	0	0	0	0	109.9	Q276	G274-Q276 VanDerWaalsContact C-N 3.29Å; G274-Q276 PolarHBondContact O-N 2.94Å
275	K	41.1	Very low	31.4	Very low	213 Å²	213	156.5 Å²	156.5	93%	0.926	76%	0.759	S	S	*	*	S	Bend	trans	-78.8	77.4	173.7	-78.8	-178.1	174	-178	0	109.7
276	Q	35.1	Very low	31	Very low	184 Å²	184	154.9 Å²	154.9	86%	0.86	76%	0.76	S	S	*	*	S	Bend	trans	168.3	128.6	149.8	-96.9	-173.9	-12.6	0	0	107.3	G274	G274-Q276 VanDerWaalsContact C-N 3.29Å; G274-Q276 PolarHBondContact O-N 2.94Å
277	R	40.4	Very low	30.5	Very low	237 Å²	237	156 Å²	156	89%	0.894	76%	0.763	S	S	*	*			trans	67.6	100.9	-168.4	-70.4	-179.2	163.7	167	-5.6	114.8	M279	R277-M279 PolarHBondContact O-N 3.39Å
278	G	30.7	Very low	30.2	Very low	98 Å²	98	156.5 Å²	156.5	100%	1.01	77%	0.768	S	S	*	*			trans	-71.1	63.7	165.7	0	0	0	0	0	112.4
279	M	27.8	Very low	30	Very low	142 Å²	142	153.3 Å²	153.3	70%	0.7	77%	0.766	S	S	*	*			trans	-125.2	113.8	169.6	-165.8	-176.1	-90.2	0	0	109.1	R277 I281	R277-M279 PolarHBondContact O-N 3.39Å; M279-I281 HydrophobicContact CG-CD1 4.29Å; M279-I281 HydrophobicContact CG-CG1 3.85Å; M279-I281 PolarHBondContact O-N 3.15Å; M279-I281 HydrophobicContact SD-CD1 3.53Å; M279-I281 VanDerWaalsContact SD-CD1 3.53Å; M279-I281 HydrophobicContact SD-CG1 3.69Å
280	I	30	Very low	29.8	Very low	133 Å²	133	154.2 Å²	154.2	68%	0.682	78%	0.782	S	S	*	*			trans	-84.3	91.5	171	-61.9	168.2	0	0	0	106.6	Y271	Y271-I280 HydrophobicContact CD1-CD1 4.32Å; Y271-I280 HydrophobicContact CE1-CD1 3.94Å; Y271-I280 HydrophobicContact CE1-CG2 3.98Å
281	I	31.1	Very low	29.6	Very low	113 Å²	113	147.7 Å²	147.7	58%	0.579	78%	0.776	S	S	*	*			trans	-90.2	113.4	164.4	-63.9	170.4	0	0	0	107.4	M279 T283	M279-I281 HydrophobicContact CG-CD1 4.29Å; M279-I281 HydrophobicContact CG-CG1 3.85Å; M279-I281 PolarHBondContact O-N 3.15Å; M279-I281 HydrophobicContact SD-CD1 3.53Å; M279-I281 VanDerWaalsContact SD-CD1 3.53Å; M279-I281 HydrophobicContact SD-CG1 3.69Å; I281-T283 HydrophobicContact CG2-CG2 3.78Å; I281-T283 PolarHBondContact O-N 3.44Å
282	E	28.7	Very low	29.4	Very low	110 Å²	110	149.4 Å²	149.4	51%	0.514	79%	0.787	S	S	.	*			trans	-87.5	79.4	168.8	-160.4	179.4	-147.2	0	0	108.6	R260 K269 E284	R260-E282 IonicContact NH1-OE2 2.63Å; K269-E282 VanDerWaalsContact CD-OE1 3.28Å; K269-E282 WeakPolarHBondContact CD-OE1 3.41Å; K269-E282 WeakPolarHBondContact CE-OE1 3.35Å; K269-E282 IonicContact NZ-OE1 3.83Å; K269-E282 PolarHBondContact NZ-OE1 3.25Å; E282-E284 PolarHBondContact O-N 3.49Å
283	T	27.3	Very low	29.3	Very low	119 Å²	119	144.1 Å²	144.1	73%	0.73	78%	0.781	S	S	*	*			trans	-79.1	100.8	165.1	33.1	0	0	0	0	108.7	I281 G285	I281-T283 HydrophobicContact CG2-CG2 3.78Å; I281-T283 PolarHBondContact O-N 3.44Å; T283-G285 PolarHBondContact O-N 2.9Å
284	E	29.4	Very low	28.9	Very low	172 Å²	172	145 Å²	145	80%	0.804	78%	0.782	S	S	*	*			trans	-76.2	102.1	167	-168.3	170.5	-156.8	0	0	109.1	E282	E282-E284 PolarHBondContact O-N 3.49Å
285	G	30.3	Very low	28.9	Very low	59 Å²	59	150.3 Å²	150.3	61%	0.608	80%	0.795	S	S	*	*			trans	111.5	73.2	162.1	0	0	0	0	0	115.2	T283	T283-G285 PolarHBondContact O-N 2.9Å
286	D	26.4	Very low	28	Very low	155 Å²	155	148.3 Å²	148.3	83%	0.829	79%	0.788	S	S	*	*			trans	-149.6	136.9	134.9	-110.3	-19.6	0	0	0	112.2
287	R	23.6	Very low	27.5	Very low	236 Å²	236	148 Å²	148	89%	0.891	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-89.1	126.5	172.2	-70.5	176.7	176.5	-178.9	-2	107.8
288	P	28.4	Very low	26.7	Very low	123 Å²	123	144.1 Å²	144.1	80%	0.799	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-80.5	134.5	158.9	-6.5	24.2	0	0	0	109.5
289	L	25.3	Very low	26.3	Very low	169 Å²	169	142.2 Å²	142.2	89%	0.885	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-59.8	155.7	169.1	-85.4	121.2	0	0	0	111.8
290	P	28.1	Very low	26.1	Very low	122 Å²	122	145.3 Å²	145.3	79%	0.792	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-89.4	137.3	-161.2	34.6	-31.5	0	0	0	112.7
291	S	22.8	Very low	25.7	Very low	118 Å²	118	147.3 Å²	147.3	83%	0.825	79%	0.785	S	S	*	*			trans	-125	97	156.9	65.8	0	0	0	0	110.5
292	K	25.1	Very low	25.4	Very low	200 Å²	200	150.1 Å²	150.1	87%	0.87	80%	0.8	S	S	*	*			trans	43.6	131.8	144.7	-92.1	-178.6	175.3	177.8	0	121.5
293	V	25.1	Very low	25	Very low	135 Å²	135	151.8 Å²	151.8	82%	0.818	81%	0.812	S	S	*	*			trans	98.5	104.6	151.4	-150.1	0	0	0	0	116.9
294	D	22.4	Very low	24.8	Very low	150 Å²	150	150.3 Å²	150.3	80%	0.802	81%	0.807	S	S	*	*			trans	-59	153.3	166.3	-62.9	-56.9	0	0	0	113
295	I	27.5	Very low	24.5	Very low	169 Å²	169	150.8 Å²	150.8	87%	0.867	81%	0.809	S	S	*	*				-172	133.7	125.9	-87	147.8	0	0	0	109.1
296	E	22.9	Very low	24.1	Very low	170 Å²	170	151 Å²	151	79%	0.794	81%	0.811	S	S	*	*			trans	-73.1	173.9	-175.1	-73.4	178.2	125	0	0	116.5
297	M	25.1	Very low	24	Very low	177 Å²	177	149.9 Å²	149.9	87%	0.872	81%	0.81	S	S	*	*			trans	97.3	145.5	153.4	-66.4	-162	-163	0	0	116.9
298	D	22.3	Very low	24	Very low	156 Å²	156	145.4 Å²	145.4	83%	0.834	80%	0.804	S	S	*	*			cis	-179.8	152.1	-19.7	-175.9	20.8	0	0	0	104.4
299	G	22.5	Very low	23.6	Very low	59 Å²	59	148.1 Å²	148.1	61%	0.608	80%	0.803	S	S	*	*			trans	91.8	118.9	147.8	0	0	0	0	0	121.3
300	K	23.1	Very low	23.6	Very low	206 Å²	206	145.6 Å²	145.6	90%	0.896	79%	0.79	S	S	*	*			trans	81	98.3	139.4	-75.1	177.5	174.5	175.2	0	121.9
301	M	22.5	Very low	23.4	Very low	176 Å²	176	147.2 Å²	147.2	87%	0.867	79%	0.792	S	S	*	*				4.2	123.3	120.3	-153.2	179.5	-161.4	0	0	117.9
302	L	23.9	Very low	23.5	Very low	172 Å²	172	145 Å²	145	90%	0.901	79%	0.787	S	S	*	*			trans	-166.3	149.7	144	-108.2	150.6	0	0	0	113.1
303	N	20.7	Very low	23.7	Very low	144 Å²	144	141.2 Å²	141.2	77%	0.77	78%	0.783	S	S	*	*			trans	-76.4	157.4	-167.1	-80.6	-28.1	0	0	0	116.2
304	S	23.8	Very low	23.9	Very low	89 Å²	89	142.9 Å²	142.9	62%	0.622	79%	0.787	S	S	*	*			trans	47.6	124.1	132.6	-162.1	0	0	0	0	120.6
305	H	21.9	Very low	24.1	Very low	181 Å²	181	139.1 Å²	139.1	84%	0.838	78%	0.784	S	S	*	*				169.4	137.3	105.2	-99.4	-79.1	0	0	0	110.5
306	G	23.1	Very low	24.2	Very low	63 Å²	63	138.9 Å²	138.9	65%	0.649	78%	0.783	S	S	*	*			trans	-83.1	161	166.4	0	0	0	0	0	112.5
307	V	24	Very low	24.6	Very low	132 Å²	132	138.7 Å²	138.7	80%	0.8	79%	0.788	S	S	*	*				-176.2	128.9	128	-93.5	0	0	0	0	109.7
308	D	22.5	Very low	25	Very low	143 Å²	143	135.6 Å²	135.6	77%	0.765	77%	0.774	S	S	*	*			trans	50	126.6	136.6	-59.8	-18.1	0	0	0	122.1
309	F	20.6	Very low	25.9	Very low	179 Å²	179	132.9 Å²	132.9	79%	0.785	76%	0.759	S	S	*	*				165.6	127.1	87.7	-148.7	-121.1	0	0	0	113.3
310	L	26.3	Very low	26.9	Very low	117 Å²	117	137.3 Å²	137.3	61%	0.613	76%	0.764	S	S	*	*			trans	81.1	117.3	144.3	-110.2	82.7	0	0	0	126.6
311	D	23.9	Very low	27.8	Very low	155 Å²	155	132.6 Å²	132.6	83%	0.829	74%	0.743	S	S	*	*				64.5	122.1	129.1	-80.8	-7.8	0	0	0	124.7
312	G	23.7	Very low	29	Very low	71 Å²	71	128 Å²	128	73%	0.732	72%	0.723	S	S	*	*			trans	171.9	125.2	160.3	0	0	0	0	0	111.1
313	P	29.8	Very low	30.2	Very low	121 Å²	121	123.6 Å²	123.6	79%	0.786	70%	0.699	S	S	*	*			trans	-91.9	148.9	-152.2	35.5	-35	0	0	0	115.8
314	L	28.8	Very low	31.9	Very low	170 Å²	170	121.6 Å²	121.6	89%	0.89	69%	0.688	S	S	*	*			trans	47	80.6	146.5	-70.5	162.1	0	0	0	117.6
315	G	27	Very low	33.4	Very low	72 Å²	72	120.9 Å²	120.9	74%	0.742	68%	0.676	S	S	*	*			trans	-89.6	115.5	147.5	0	0	0	0	0	108.3	D317	G315-D317 PolarHBondContact O-N 3.29Å
316	L	30.2	Very low	35.2	Very low	163 Å²	163	115.8 Å²	115.8	85%	0.853	65%	0.652	S	S	*	*			trans	-53.9	123.1	169.7	-78.7	153.2	0	0	0	109.2	I318	L316-I318 PolarHBondContact O-N 3.41Å
317	D	30.2	Very low	37.1	Very low	166 Å²	166	118.1 Å²	118.1	89%	0.888	65%	0.646	S	S	*	*			trans	-62.3	100.1	165.4	-73.4	-43.7	0	0	0	107.6	G315 D319	G315-D317 PolarHBondContact O-N 3.29Å; D317-D319 PolarHBondContact O-N 3.46Å
318	I	34.3	Very low	38.9	Very low	113 Å²	113	114.5 Å²	114.5	58%	0.579	62%	0.624	S	S	*	*			trans	-65.8	125.5	166.3	-62.7	172.1	0	0	0	106.3	L316 E320 D322 L323	L316-I318 PolarHBondContact O-N 3.41Å; I318-E320 PolarHBondContact O-N 2.89Å; I318-D322 HydrophobicContact CG2-CB 4.39Å; I318-L323 HydrophobicContact CG2-CD2 4.48Å; I318-L323 HydrophobicContact CG2-CG 4.21Å
319	D	40.9	Very low	41	Very low	98 Å²	98	111.2 Å²	111.2	52%	0.524	60%	0.601	S	S	.	*			trans	-50.5	128.2	-179.4	-102.2	-46	0	0	0	110.8	D317 K321 D322 L323	D317-D319 PolarHBondContact O-N 3.46Å; D319-K321 PolarHBondContact O-N 3.35Å; D319-D322 HydrophobicContact CB-CB 4.4Å; D319-D322 PolarHBondContact O-N 2.97Å; D319-L323 PolarHBondContact O-N 2.98Å
320	E	43.3	Very low	43.2	Very low	153 Å²	153	107.5 Å²	107.5	72%	0.715	58%	0.582	S	S	*	*	H	α-helix	trans	-52.3	-24.3	174.5	-106.7	179.8	149.3	0	0	112.6	I318 D324	I318-E320 PolarHBondContact O-N 2.89Å; E320-D324 PolarHBondContact O-N 2.94Å
321	K	43.1	Very low	45.2	Very low	107 Å²	107	105.3 Å²	105.3	47%	0.465	57%	0.571	S	S	.	*	H	α-helix	trans	-76.7	-33.9	179.2	-149.7	175.9	179.8	-179.5	0	112.5	T129 D319 E325	T129-K321 PolarHBondContact O-NZ 3.44Å; D319-K321 PolarHBondContact O-N 3.35Å; K321-E325 PolarHBondContact O-N 3.4Å
322	D	46.8	Very low	47.3	Very low	80 Å²	80	99.6 Å²	99.6	43%	0.428	54%	0.54	S	S	.	.	H	α-helix	trans	-74.6	-31.6	176.8	-66.9	-18.1	0	0	0	110.7	I318 D319 E325 E326	I318-D322 HydrophobicContact CG2-CB 4.39Å; D319-D322 HydrophobicContact CB-CB 4.4Å; D319-D322 PolarHBondContact O-N 2.97Å; D322-E325 PolarHBondContact O-N 3.28Å; D322-E326 WeakPolarHBondContact O-CB 3.3Å; D322-E326 WeakPolarHBondContact O-CG 3.45Å; D322-E326 PolarHBondContact O-N 2.79Å
323	L	49.8	Very low	49.3	Very low	79 Å²	79	97.1 Å²	97.1	41%	0.414	51%	0.512	S	S	.	.	H	α-helix	trans	-65.1	-42.7	173.5	-71.9	166.4	0	0	0	112.4	I318 D319 E326 E327	I318-L323 HydrophobicContact CG2-CD2 4.48Å; I318-L323 HydrophobicContact CG2-CG 4.21Å; D319-L323 PolarHBondContact O-N 2.98Å; L323-E326 PolarHBondContact O-N 3.05Å; L323-E327 WeakPolarHBondContact O-CB 3.2Å; L323-E327 PolarHBondContact O-N 3.34Å
324	D	55	Low	51.4	Low	101 Å²	101	97 Å²	97	54%	0.54	50%	0.499	S	S	.	.	H	α-helix	trans	-64.6	-40.8	176.3	-85.6	-6.4	0	0	0	111.5	E320 E327 T328	E320-D324 PolarHBondContact O-N 2.94Å; D324-E327 PolarHBondContact O-N 2.99Å; D324-T328 WeakPolarHBondContact O-CG2 3.36Å; D324-T328 PolarHBondContact O-N 3.07Å; D324-T328 PolarHBondContact O-OG1 3.31Å
325	E	56.7	Low	53.6	Low	75 Å²	75	89.9 Å²	89.9	35%	0.35	46%	0.462	S	S	.	.	H	α-helix	trans	-67	-46	176.8	-72.2	-171.4	-178.4	0	0	111.2	K321 D322 E327 T328 R329	K321-E325 PolarHBondContact O-N 3.4Å; D322-E325 PolarHBondContact O-N 3.28Å; E325-E327 VanDerWaalsContact C-N 3.34Å; E325-E327 PolarHBondContact O-N 3.5Å; E325-T328 WeakPolarHBondContact CA-OG1 3.35Å; E325-T328 PolarHBondContact O-N 2.83Å; E325-T328 PolarHBondContact O-OG1 2.98Å; E325-R329 WeakPolarHBondContact O-CG 3.38Å; E325-R329 PolarHBondContact O-N 2.98Å
326	E	59.1	Low	55.7	Low	74 Å²	74	87.3 Å²	87.3	35%	0.346	43%	0.431	S	S	.	.	H	α-helix	trans	-58.8	-41.2	173.1	-81.1	-169.6	179.1	0	0	113.2	D322 L323 R329 R330	D322-E326 WeakPolarHBondContact O-CB 3.3Å; D322-E326 WeakPolarHBondContact O-CG 3.45Å; D322-E326 PolarHBondContact O-N 2.79Å; L323-E326 PolarHBondContact O-N 3.05Å; E326-R329 WeakPolarHBondContact O-CB 3.25Å; E326-R329 PolarHBondContact O-N 3.36Å; E326-R330 WeakPolarHBondContact O-CG 3.4Å; E326-R330 PolarHBondContact O-N 3.19Å; E326-R330 IonicContact OE2-CZ 3.97Å; E326-R330 IonicContact OE2-NH2 2.87Å; E326-R330 PolarHBondContact OE2-NH2 3.39Å
327	E	63.8	Low	57.5	Low	112 Å²	112	83.3 Å²	83.3	52%	0.523	41%	0.407	S	S	.	.	H	α-helix	trans	-64.8	-41.6	177.5	-169.7	165.8	-159.8	0	0	111	L323 D324 E325 R329 R330 D331	L323-E327 WeakPolarHBondContact O-CB 3.2Å; L323-E327 PolarHBondContact O-N 3.34Å; D324-E327 PolarHBondContact O-N 2.99Å; E325-E327 VanDerWaalsContact C-N 3.34Å; E325-E327 PolarHBondContact O-N 3.5Å; E327-R329 PolarHBondContact O-N 2.95Å; E327-R330 PolarHBondContact O-N 3.23Å; E327-D331 PolarHBondContact O-N 3.13Å
328	T	61.5	Low	59.7	Low	55 Å²	55	79.9 Å²	79.9	34%	0.337	39%	0.385	S	S	.	.	H	α-helix	trans	-65.8	-36.2	173.3	57.7	0	0	0	0	113.4	D324 E325 R330 D331 M332	D324-T328 WeakPolarHBondContact O-CG2 3.36Å; D324-T328 PolarHBondContact O-N 3.07Å; D324-T328 PolarHBondContact O-OG1 3.31Å; E325-T328 WeakPolarHBondContact CA-OG1 3.35Å; E325-T328 PolarHBondContact O-N 2.83Å; E325-T328 PolarHBondContact O-OG1 2.98Å; T328-R330 VanDerWaalsContact C-N 3.34Å; T328-D331 PolarHBondContact O-N 3.16Å; T328-M332 PolarHBondContact O-N 3.42Å
329	R	65.4	Low	61.7	Low	75 Å²	75	75 Å²	75	28%	0.283	36%	0.36	S	S	.	.	H	α-helix	trans	-60.3	-45.6	172.5	-59.7	-145.9	167.7	67.7	2.9	110.5	E325 E326 E327 M332 A333 D700 I703	E325-R329 WeakPolarHBondContact O-CG 3.38Å; E325-R329 PolarHBondContact O-N 2.98Å; E326-R329 WeakPolarHBondContact O-CB 3.25Å; E326-R329 PolarHBondContact O-N 3.36Å; E327-R329 PolarHBondContact O-N 2.95Å; R329-M332 PolarHBondContact O-N 2.64Å; R329-A333 WeakPolarHBondContact O-CB 3.26Å; R329-A333 PolarHBondContact O-N 3.22Å; R329-D700 IonicContact CZ-OD1 3.1Å; R329-D700 IonicContact NE-OD1 2.69Å; R329-D700 PolarHBondContact NE-OD1 2.9Å; R329-D700 IonicContact NH2-OD1 2.74Å; R329-I703 HydrophobicContact CB-CD1 4Å; R329-I703 VanDerWaalsContact CD-CD1 3.41Å; R329-I703 HydrophobicContact CG-CD1 3.33Å; R329-I703 HydrophobicContact CG-CG1 4.26Å
330	R	68.4	Low	63.1	Low	101 Å²	101	77.2 Å²	77.2	38%	0.381	37%	0.365	S	S	.	.	H	α-helix	trans	-63.5	-41.8	179	-73.1	178.5	-168.7	130.8	14.2	112.1	E326 E327 T328 A333 K334	E326-R330 WeakPolarHBondContact O-CG 3.4Å; E326-R330 PolarHBondContact O-N 3.19Å; E326-R330 IonicContact OE2-CZ 3.97Å; E326-R330 IonicContact OE2-NH2 2.87Å; E326-R330 PolarHBondContact OE2-NH2 3.39Å; E327-R330 PolarHBondContact O-N 3.23Å; T328-R330 VanDerWaalsContact C-N 3.34Å; R330-A333 PolarHBondContact O-N 2.88Å; R330-K334 WeakPolarHBondContact O-CG 3.47Å; R330-K334 PolarHBondContact O-N 3.49Å
331	D	68	Low	64.5	Low	71 Å²	71	75.7 Å²	75.7	38%	0.38	36%	0.358	S	S	.	.	H	α-helix	trans	-70.6	-37.8	179.1	-75.1	-13.8	0	0	0	112.3	E327 T328 K334 I335	E327-D331 PolarHBondContact O-N 3.13Å; T328-D331 PolarHBondContact O-N 3.16Å; D331-K334 PolarHBondContact O-N 3.29Å; D331-K334 IonicContact OD1-NZ 3.11Å; D331-K334 PolarHBondContact OD1-NZ 3.32Å; D331-I335 WeakPolarHBondContact O-CG1 3.49Å; D331-I335 PolarHBondContact O-N 2.89Å
332	M	66.9	Low	66.1	Low	35 Å²	35	77 Å²	77	17%	0.172	36%	0.364	C	S	.	.	H	α-helix	trans	-62.7	-41.4	171.1	-79.5	-169	164.2	0	0	112.2	T328 R329 K334 I335 L336 V359 L702 I703	T328-M332 PolarHBondContact O-N 3.42Å; R329-M332 PolarHBondContact O-N 2.64Å; M332-K334 PolarHBondContact O-N 3.02Å; M332-I335 PolarHBondContact O-N 3.44Å; M332-L336 PolarHBondContact O-N 3.47Å; M332-V359 HydrophobicContact CE-CG1 3.92Å; M332-V359 HydrophobicContact CE-CG2 4.13Å; M332-V359 HydrophobicContact CG-CG2 4.38Å; M332-L702 HydrophobicContact SD-CB 4.12Å; M332-I703 HydrophobicContact SD-CG1 3.82Å
333	A	67.2	Low	67.5	Low	19 Å²	19	75.9 Å²	75.9	16%	0.157	36%	0.356	C	S	.	.	H	α-helix	trans	-62.9	-40.9	176.1	0	0	0	0	0	112	R329 R330 K337 F695	R329-A333 WeakPolarHBondContact O-CB 3.26Å; R329-A333 PolarHBondContact O-N 3.22Å; R330-A333 PolarHBondContact O-N 2.88Å; A333-K337 VanDerWaalsContact O-CB 3.27Å; A333-K337 WeakPolarHBondContact O-CB 3.17Å; A333-K337 PolarHBondContact O-N 2.91Å; A333-F695 HydrophobicContact CB-CE1 4.21Å; A333-F695 HydrophobicContact CB-CZ 4.21Å
334	K	73.6	Confident	68.5	Low	119 Å²	119	76.7 Å²	76.7	52%	0.517	37%	0.366	S	S	.	.	H	α-helix	trans	-60.9	-44.1	173.6	-72.4	173.4	-160.6	152.4	0	112.1	R330 D331 M332 K337 E338	R330-K334 WeakPolarHBondContact O-CG 3.47Å; R330-K334 PolarHBondContact O-N 3.49Å; D331-K334 PolarHBondContact O-N 3.29Å; D331-K334 IonicContact OD1-NZ 3.11Å; D331-K334 PolarHBondContact OD1-NZ 3.32Å; M332-K334 PolarHBondContact O-N 3.02Å; K334-K337 WeakPolarHBondContact O-CB 3.43Å; K334-K337 PolarHBondContact O-N 3.04Å; K334-E338 PolarHBondContact O-N 2.69Å
335	I	73.7	Confident	69.3	Low	20 Å²	20	79.4 Å²	79.4	10%	0.103	38%	0.38	C	S	.	.	H	α-helix	trans	-64.2	-48.2	-180	-69.2	166.9	0	0	0	110.9	D331 M332 K337 E338 L339 A355 Q358 V359	D331-I335 WeakPolarHBondContact O-CG1 3.49Å; D331-I335 PolarHBondContact O-N 2.89Å; M332-I335 PolarHBondContact O-N 3.44Å; I335-K337 VanDerWaalsContact C-N 3.25Å; I335-K337 PolarHBondContact O-N 2.78Å; I335-E338 PolarHBondContact O-N 2.72Å; I335-L339 HydrophobicContact CG2-CD1 3.92Å; I335-L339 WeakPolarHBondContact O-CB 3.21Å; I335-L339 WeakPolarHBondContact O-CG 3.24Å; I335-L339 PolarHBondContact O-N 2.71Å; I335-A355 HydrophobicContact CG2-CB 4.32Å; I335-Q358 HydrophobicContact CG2-CB 4.34Å; I335-Q358 HydrophobicContact CG2-CG 4.36Å; I335-V359 HydrophobicContact CD1-CG2 3.93Å
336	L	71.1	Confident	69.9	Low	18 Å²	18	78.1 Å²	78.1	9%	0.094	37%	0.374	C	S	.	.	H	α-helix	trans	-58.1	-39.6	175.3	-95.9	155.5	0	0	0	111.9	M332 L339 K340 A355 V699 L702	M332-L336 PolarHBondContact O-N 3.47Å; L336-L339 PolarHBondContact O-N 3.08Å; L336-K340 WeakPolarHBondContact O-CB 3.37Å; L336-K340 PolarHBondContact O-N 2.8Å; L336-A355 HydrophobicContact CD2-CB 4.19Å; L336-A355 HydrophobicContact CG-CB 3.93Å; L336-V699 HydrophobicContact CD1-CG2 4.14Å; L336-L702 HydrophobicContact CD1-CD1 3.72Å
337	K	68.9	Low	70.5	Confident	78 Å²	78	81 Å²	81	34%	0.339	39%	0.387	S	S	.	.	H	α-helix	trans	-65.3	-47.5	176.6	-173.1	177.7	-179.1	178.6	0	112.2	A333 K334 I335 L339 K340 Q341 E622	A333-K337 VanDerWaalsContact O-CB 3.27Å; A333-K337 WeakPolarHBondContact O-CB 3.17Å; A333-K337 PolarHBondContact O-N 2.91Å; K334-K337 WeakPolarHBondContact O-CB 3.43Å; K334-K337 PolarHBondContact O-N 3.04Å; I335-K337 VanDerWaalsContact C-N 3.25Å; I335-K337 PolarHBondContact O-N 2.78Å; K337-L339 VanDerWaalsContact C-N 3.27Å; K337-L339 PolarHBondContact O-N 3.26Å; K337-K340 PolarHBondContact O-N 3.05Å; K337-Q341 WeakPolarHBondContact O-CG 2.99Å; K337-Q341 PolarHBondContact O-N 3.01Å; K337-E622 WeakPolarHBondContact CE-OE2 3.4Å; K337-E622 PolarHBondContact NZ-O 3.48Å; K337-E622 IonicContact NZ-OE2 3.65Å; K337-E622 PolarHBondContact NZ-OE2 3.3Å
338	E	76.8	Confident	70.8	Confident	94 Å²	94	80.3 Å²	80.3	44%	0.439	39%	0.39	S	S	.	.	H	α-helix	trans	-59.3	-39.8	175.2	-78.1	-171.5	-171.9	0	0	111.9	K334 I335 Q341 K342	K334-E338 PolarHBondContact O-N 2.69Å; I335-E338 PolarHBondContact O-N 2.72Å; E338-Q341 PolarHBondContact O-N 3.07Å; E338-K342 WeakPolarHBondContact O-CB 3.45Å; E338-K342 VanDerWaalsContact O-CG 3.32Å; E338-K342 WeakPolarHBondContact O-CG 3.39Å; E338-K342 PolarHBondContact O-N 3.3Å
339	L	75.3	Confident	71	Confident	10 Å²	10	81.5 Å²	81.5	5%	0.052	39%	0.392	C	S	.	.	H	α-helix	trans	-68.4	-41.5	178.3	-72.8	169.7	0	0	0	112	I335 L336 K337 Q341 K342 H343 L351 L354 A355	I335-L339 HydrophobicContact CG2-CD1 3.92Å; I335-L339 WeakPolarHBondContact O-CB 3.21Å; I335-L339 WeakPolarHBondContact O-CG 3.24Å; I335-L339 PolarHBondContact O-N 2.71Å; L336-L339 PolarHBondContact O-N 3.08Å; K337-L339 VanDerWaalsContact C-N 3.27Å; K337-L339 PolarHBondContact O-N 3.26Å; L339-Q341 VanDerWaalsContact C-N 3.34Å; L339-Q341 PolarHBondContact O-N 3.16Å; L339-K342 PolarHBondContact O-N 3.32Å; L339-H343 WeakPolarHBondContact O-CB 3.35Å; L339-H343 PolarHBondContact O-N 3.37Å; L339-L351 HydrophobicContact CB-CD2 3.85Å; L339-L351 WeakPolarHBondContact O-CD2 3.37Å; L339-L354 HydrophobicContact CD1-CB 3.86Å; L339-L354 HydrophobicContact CD2-CB 4.05Å; L339-A355 VanDerWaalsContact CD1-CA 3.44Å; L339-A355 HydrophobicContact CD1-CB 3.72Å; L339-A355 VanDerWaalsContact CD1-N 3.32Å
340	K	70.7	Confident	71.3	Confident	146 Å²	146	81.5 Å²	81.5	64%	0.635	40%	0.395	S	S	*	.	H	α-helix	trans	-64.3	-37.2	175.4	-168.5	177.5	-178.9	-176.4	0	111.9	L336 K337 H343 L351	L336-K340 WeakPolarHBondContact O-CB 3.37Å; L336-K340 PolarHBondContact O-N 2.8Å; K337-K340 PolarHBondContact O-N 3.05Å; K340-H343 CarbonylContact O-C 3.59Å; K340-L351 HydrophobicContact CB-CD1 4.36Å; K340-L351 HydrophobicContact CG-CD1 4.33Å
341	Q	72.3	Confident	71.4	Confident	120 Å²	120	77.3 Å²	77.3	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-69.4	-38.6	175	-74.5	-176.7	-4.7	0	0	112.9	K337 E338 L339	K337-Q341 WeakPolarHBondContact O-CG 2.99Å; K337-Q341 PolarHBondContact O-N 3.01Å; E338-Q341 PolarHBondContact O-N 3.07Å; L339-Q341 VanDerWaalsContact C-N 3.34Å; L339-Q341 PolarHBondContact O-N 3.16Å
342	K	76.6	Confident	71.5	Confident	134 Å²	134	75.4 Å²	75.4	58%	0.583	37%	0.37	S	S	*	.	H	α-helix	trans	-74.6	-28.7	177.5	-75	174.3	-178.5	168.5	0	112.9	E338 L339	E338-K342 WeakPolarHBondContact O-CB 3.45Å; E338-K342 VanDerWaalsContact O-CG 3.32Å; E338-K342 WeakPolarHBondContact O-CG 3.39Å; E338-K342 PolarHBondContact O-N 3.3Å; L339-K342 PolarHBondContact O-N 3.32Å
343	H	76.2	Confident	71.5	Confident	58 Å²	58	76.7 Å²	76.7	27%	0.269	38%	0.376	S	S	.	.			trans	-134.6	72.7	-176.5	-60.6	-55.1	0	0	0	111.5	L339 K340 D345 K346 L351	L339-H343 WeakPolarHBondContact O-CB 3.35Å; L339-H343 PolarHBondContact O-N 3.37Å; K340-H343 CarbonylContact O-C 3.59Å; H343-D345 PolarHBondContact O-N 2.83Å; H343-K346 HydrophobicContact CB-CB 4.09Å; H343-K346 HydrophobicContact CB-CD 3.66Å; H343-K346 HydrophobicContact CB-CG 3.84Å; H343-K346 PolarHBondContact CD2-NZ 2.93Å; H343-K346 PolarHBondContact CE1-NZ 3.23Å; H343-K346 PolarHBondContact NE2-NZ 3.12Å; H343-K346 PolarHBondContact O-N 3.32Å; H343-L351 HydrophobicContact CB-CD2 4.24Å
344	P	71.1	Confident	71.8	Confident	95 Å²	95	78.4 Å²	78.4	62%	0.617	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-22.2	178.4	26.7	-33.6	0	0	0	112.9
345	D	71.9	Confident	71.7	Confident	158 Å²	158	73 Å²	73	85%	0.845	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-5.4	-175.7	-49.8	-38.2	0	0	0	113.6	H343	H343-D345 PolarHBondContact O-N 2.83Å
346	K	69.9	Low	71.6	Confident	49 Å²	49	72.5 Å²	72.5	21%	0.213	36%	0.357	C	S	.	.	S	Bend	trans	-89.7	140.5	-178.2	-71.9	-173.9	-174.4	169.9	0	111	H343 Q350 L351 L354	H343-K346 HydrophobicContact CB-CB 4.09Å; H343-K346 HydrophobicContact CB-CD 3.66Å; H343-K346 HydrophobicContact CB-CG 3.84Å; H343-K346 PolarHBondContact CD2-NZ 2.93Å; H343-K346 PolarHBondContact CE1-NZ 3.23Å; H343-K346 PolarHBondContact NE2-NZ 3.12Å; H343-K346 PolarHBondContact O-N 3.32Å; K346-Q350 HydrophobicContact CB-CB 4.32Å; K346-L351 HydrophobicContact CB-CG 4.32Å; K346-L354 HydrophobicContact CD-CD1 3.97Å
347	E	72.1	Confident	71.6	Confident	133 Å²	133	74.6 Å²	74.6	62%	0.621	36%	0.364	S	S	*	.			trans	-61.7	152.9	175.1	-66	-179.8	173.8	0	0	111.3	E349 Q350 L351	E347-E349 PolarHBondContact O-N 2.86Å; E347-E349 VanDerWaalsContact O-N 3.11Å; E347-Q350 PolarHBondContact O-N 3.38Å; E347-L351 PolarHBondContact O-N 3.02Å; E347-L351 VanDerWaalsContact O-N 3.16Å
348	V	68.6	Low	71.8	Confident	99 Å²	99	73.2 Å²	73.2	60%	0.6	36%	0.359	S	S	*	.	H	α-helix	trans	-55.7	-32.5	-179.2	-177.4	0	0	0	0	111.4	L351 I352	V348-L351 PolarHBondContact O-N 3.37Å; V348-I352 HydrophobicContact CG1-CD1 3.97Å; V348-I352 HydrophobicContact CG1-CG1 4.47Å; V348-I352 WeakPolarHBondContact O-CD1 3.41Å; V348-I352 VanDerWaalsContact O-CG1 3.22Å; V348-I352 WeakPolarHBondContact O-CG1 3.32Å; V348-I352 PolarHBondContact O-N 2.98Å
349	E	66.9	Low	71.6	Confident	79 Å²	79	70.1 Å²	70.1	37%	0.369	35%	0.346	S	S	.	.	H	α-helix	trans	-61.6	-48.7	175.6	-175.3	175.7	-176.5	0	0	112.8	E347 L351 I352 E353 A393	E347-E349 PolarHBondContact O-N 2.86Å; E347-E349 VanDerWaalsContact O-N 3.11Å; E349-L351 VanDerWaalsContact C-N 3.29Å; E349-L351 PolarHBondContact O-N 2.82Å; E349-I352 WeakPolarHBondContact O-CB 3.24Å; E349-I352 PolarHBondContact O-N 3.38Å; E349-E353 PolarHBondContact O-N 2.95Å; E349-A393 HydrophobicContact CG-CB 4.24Å
350	Q	70.3	Confident	71.3	Confident	75 Å²	75	70 Å²	70	35%	0.35	35%	0.345	S	S	.	.	H	α-helix	trans	-66.8	-34.8	-179.9	-65.7	-178.9	0.4	0	0	111.3	K346 E347 E353 L354	K346-Q350 HydrophobicContact CB-CB 4.32Å; E347-Q350 PolarHBondContact O-N 3.38Å; Q350-E353 PolarHBondContact O-N 3.44Å; Q350-L354 WeakPolarHBondContact O-CB 3.3Å; Q350-L354 WeakPolarHBondContact O-CD1 3.34Å; Q350-L354 WeakPolarHBondContact O-CG 3.45Å; Q350-L354 PolarHBondContact O-N 3.14Å
351	L	71.7	Confident	71.1	Confident	13 Å²	13	65.2 Å²	65.2	7%	0.068	33%	0.33	C	S	.	.	H	α-helix	trans	-65.3	-39.5	174.4	-72	168.4	0	0	0	111.8	L339 K340 H343 K346 E347 V348 E349 L354 A355	L339-L351 HydrophobicContact CB-CD2 3.85Å; L339-L351 WeakPolarHBondContact O-CD2 3.37Å; K340-L351 HydrophobicContact CB-CD1 4.36Å; K340-L351 HydrophobicContact CG-CD1 4.33Å; H343-L351 HydrophobicContact CB-CD2 4.24Å; K346-L351 HydrophobicContact CB-CG 4.32Å; E347-L351 PolarHBondContact O-N 3.02Å; E347-L351 VanDerWaalsContact O-N 3.16Å; V348-L351 PolarHBondContact O-N 3.37Å; E349-L351 VanDerWaalsContact C-N 3.29Å; E349-L351 PolarHBondContact O-N 2.82Å; L351-L354 PolarHBondContact O-N 2.99Å; L351-A355 VanDerWaalsContact O-CB 3.31Å; L351-A355 WeakPolarHBondContact O-CB 3.43Å; L351-A355 PolarHBondContact O-N 2.84Å
352	I	68.9	Low	70.9	Confident	32 Å²	32	65.9 Å²	65.9	16%	0.164	33%	0.334	C	S	.	.	H	α-helix	trans	-65.2	-42	174.7	-71.4	166.2	0	0	0	111	V348 E349 A355 N356 T698 L702	V348-I352 HydrophobicContact CG1-CD1 3.97Å; V348-I352 HydrophobicContact CG1-CG1 4.47Å; V348-I352 WeakPolarHBondContact O-CD1 3.41Å; V348-I352 VanDerWaalsContact O-CG1 3.22Å; V348-I352 WeakPolarHBondContact O-CG1 3.32Å; V348-I352 PolarHBondContact O-N 2.98Å; E349-I352 WeakPolarHBondContact O-CB 3.24Å; E349-I352 PolarHBondContact O-N 3.38Å; I352-A355 PolarHBondContact O-N 3.42Å; I352-N356 WeakPolarHBondContact O-CB 3.35Å; I352-N356 PolarHBondContact O-N 3.39Å; I352-N356 PolarHBondContact O-ND2 2.96Å; I352-T698 HydrophobicContact CD1-CG2 4.25Å; I352-L702 HydrophobicContact CG1-CD1 4.44Å; I352-L702 HydrophobicContact CG2-CD1 4.34Å; I352-L702 HydrophobicContact CG2-CD2 3.76Å; I352-L702 HydrophobicContact CG2-CG 4.47Å
353	E	68.4	Low	70.4	Confident	62 Å²	62	62.8 Å²	62.8	29%	0.29	32%	0.321	S	S	.	.	H	α-helix	trans	-60.6	-48.7	175.4	-174.5	-177.2	174	0	0	111.5	E349 Q350 A355 N356 Y357 A389 A393	E349-E353 PolarHBondContact O-N 2.95Å; Q350-E353 PolarHBondContact O-N 3.44Å; E353-A355 VanDerWaalsContact C-N 3.33Å; E353-A355 PolarHBondContact O-N 3.43Å; E353-N356 PolarHBondContact O-N 2.95Å; E353-Y357 WeakPolarHBondContact O-CB 3.46Å; E353-Y357 PolarHBondContact O-N 3.25Å; E353-A389 HydrophobicContact CG-CB 3.81Å; E353-A393 HydrophobicContact CB-CB 4.46Å
354	L	72	Confident	69.6	Low	54 Å²	54	67.8 Å²	67.8	28%	0.283	35%	0.345	S	S	.	.	H	α-helix	trans	-60.6	-41.3	177	-79.5	154	0	0	0	111.9	L339 K346 Q350 L351 Y357 Q358	L339-L354 HydrophobicContact CD1-CB 3.86Å; L339-L354 HydrophobicContact CD2-CB 4.05Å; K346-L354 HydrophobicContact CD-CD1 3.97Å; Q350-L354 WeakPolarHBondContact O-CB 3.3Å; Q350-L354 WeakPolarHBondContact O-CD1 3.34Å; Q350-L354 WeakPolarHBondContact O-CG 3.45Å; Q350-L354 PolarHBondContact O-N 3.14Å; L351-L354 PolarHBondContact O-N 2.99Å; L354-Y357 PolarHBondContact O-N 3.29Å; L354-Q358 WeakPolarHBondContact O-CB 3.5Å; L354-Q358 PolarHBondContact O-N 2.87Å
355	A	71.9	Confident	69.7	Low	5 Å²	5	64.8 Å²	64.8	4%	0.041	32%	0.322	C	S	.	.	H	α-helix	trans	-64.7	-47	177.9	0	0	0	0	0	111.5	I335 L336 L339 L351 I352 E353 Y357 Q358 V359	I335-A355 HydrophobicContact CG2-CB 4.32Å; L336-A355 HydrophobicContact CD2-CB 4.19Å; L336-A355 HydrophobicContact CG-CB 3.93Å; L339-A355 VanDerWaalsContact CD1-CA 3.44Å; L339-A355 HydrophobicContact CD1-CB 3.72Å; L339-A355 VanDerWaalsContact CD1-N 3.32Å; L351-A355 VanDerWaalsContact O-CB 3.31Å; L351-A355 WeakPolarHBondContact O-CB 3.43Å; L351-A355 PolarHBondContact O-N 2.84Å; I352-A355 PolarHBondContact O-N 3.42Å; E353-A355 VanDerWaalsContact C-N 3.33Å; E353-A355 PolarHBondContact O-N 3.43Å; A355-Y357 VanDerWaalsContact C-N 3.34Å; A355-Y357 PolarHBondContact O-N 3.49Å; A355-Q358 PolarHBondContact O-N 3.21Å; A355-V359 VanDerWaalsContact O-CG2 3.32Å; A355-V359 WeakPolarHBondContact O-CG2 3.36Å; A355-V359 PolarHBondContact O-N 3.42Å
356	N	71.1	Confident	69.5	Low	11 Å²	11	58.5 Å²	58.5	6%	0.059	29%	0.29	C	S	.	.	H	α-helix	trans	-59.3	-45.3	174.9	-82.8	-38.4	0	0	0	111.9	I352 E353 Q358 V359 L360 A389 L702	I352-N356 WeakPolarHBondContact O-CB 3.35Å; I352-N356 PolarHBondContact O-N 3.39Å; I352-N356 PolarHBondContact O-ND2 2.96Å; E353-N356 PolarHBondContact O-N 2.95Å; N356-Q358 PolarHBondContact O-N 3.25Å; N356-V359 PolarHBondContact O-N 3.21Å; N356-L360 WeakPolarHBondContact O-CB 3.32Å; N356-L360 VanDerWaalsContact O-CG 3.23Å; N356-L360 WeakPolarHBondContact O-CG 3.34Å; N356-L360 PolarHBondContact O-N 2.9Å; N356-A389 HydrophobicContact CB-CB 4.35Å; N356-L702 WeakPolarHBondContact ND2-CD2 3.24Å; N356-L702 WeakPolarHBondContact OD1-CD2 3.26Å
357	Y	72.8	Confident	69.3	Low	61 Å²	61	57 Å²	57	24%	0.239	28%	0.283	C	S	.	.	H	α-helix	trans	-61	-44.6	177.3	178	-103.9	0	0	0	111.8	E353 L354 A355 L360 S361 L385 K386	E353-Y357 WeakPolarHBondContact O-CB 3.46Å; E353-Y357 PolarHBondContact O-N 3.25Å; L354-Y357 PolarHBondContact O-N 3.29Å; A355-Y357 VanDerWaalsContact C-N 3.34Å; A355-Y357 PolarHBondContact O-N 3.49Å; Y357-L360 PolarHBondContact O-N 3.08Å; Y357-S361 VanDerWaalsContact O-CB 3.23Å; Y357-S361 WeakPolarHBondContact O-CB 3.46Å; Y357-S361 PolarHBondContact O-N 3.44Å; Y357-L385 HydrophobicContact CD2-CB 3.87Å; Y357-L385 HydrophobicContact CE2-CB 3.66Å; Y357-L385 HydrophobicContact CE2-CD1 4.49Å; Y357-K386 HydrophobicContact CD2-CG 3.81Å; Y357-K386 HydrophobicContact CE2-CB 4.49Å; Y357-K386 HydrophobicContact CE2-CD 4.46Å; Y357-K386 HydrophobicContact CE2-CG 3.46Å; Y357-K386 VanDerWaalsContact CE2-CG 3.46Å
358	Q	72.1	Confident	69.1	Low	50 Å²	50	50.7 Å²	50.7	23%	0.234	25%	0.254	C	S	.	.	H	α-helix	trans	-64.8	-42.2	-180	-168.7	170.9	-10.3	0	0	111.8	I335 L354 A355 N356 S361 Q362	I335-Q358 HydrophobicContact CG2-CB 4.34Å; I335-Q358 HydrophobicContact CG2-CG 4.36Å; L354-Q358 WeakPolarHBondContact O-CB 3.5Å; L354-Q358 PolarHBondContact O-N 2.87Å; A355-Q358 PolarHBondContact O-N 3.21Å; N356-Q358 PolarHBondContact O-N 3.25Å; Q358-S361 PolarHBondContact O-N 2.82Å; Q358-Q362 WeakPolarHBondContact O-CG 3.5Å; Q358-Q362 PolarHBondContact O-N 3.02Å; Q358-Q362 VanDerWaalsContact O-N 3.14Å
359	V	72.1	Confident	69.5	Low	28 Å²	28	46 Å²	46	17%	0.17	23%	0.225	C	C	.	.	H	α-helix	trans	-62.9	-47.7	175.2	171.3	0	0	0	0	111	M332 I335 A355 N356 S361 Q362 Q363	M332-V359 HydrophobicContact CE-CG1 3.92Å; M332-V359 HydrophobicContact CE-CG2 4.13Å; M332-V359 HydrophobicContact CG-CG2 4.38Å; I335-V359 HydrophobicContact CD1-CG2 3.93Å; A355-V359 VanDerWaalsContact O-CG2 3.32Å; A355-V359 WeakPolarHBondContact O-CG2 3.36Å; A355-V359 PolarHBondContact O-N 3.42Å; N356-V359 PolarHBondContact O-N 3.21Å; V359-S361 VanDerWaalsContact C-N 3.3Å; V359-S361 PolarHBondContact O-N 3.04Å; V359-Q362 PolarHBondContact O-N 3.46Å; V359-Q363 PolarHBondContact O-N 3.14Å
360	L	69.4	Low	69.8	Low	7 Å²	7	42.4 Å²	42.4	4%	0.037	21%	0.208	C	C	.	.	H	α-helix	trans	-67.4	-31.1	179.4	-67.4	168.9	0	0	0	112.4	N356 Y357 L385 L708	N356-L360 WeakPolarHBondContact O-CB 3.32Å; N356-L360 VanDerWaalsContact O-CG 3.23Å; N356-L360 WeakPolarHBondContact O-CG 3.34Å; N356-L360 PolarHBondContact O-N 2.9Å; Y357-L360 PolarHBondContact O-N 3.08Å; L360-L385 HydrophobicContact CB-CD2 3.56Å; L360-L385 HydrophobicContact CD1-CD2 4.4Å; L360-L708 HydrophobicContact CD2-CD1 4.27Å
361	S	67.6	Low	69.9	Low	46 Å²	46	38.9 Å²	38.9	32%	0.322	19%	0.192	S	C	.	.	H	α-helix	trans	-70.9	-34.5	178.2	-170.9	0	0	0	0	112.7	Y357 Q358 V359 Q363 K365	Y357-S361 VanDerWaalsContact O-CB 3.23Å; Y357-S361 WeakPolarHBondContact O-CB 3.46Å; Y357-S361 PolarHBondContact O-N 3.44Å; Q358-S361 PolarHBondContact O-N 2.82Å; V359-S361 VanDerWaalsContact C-N 3.3Å; V359-S361 PolarHBondContact O-N 3.04Å; S361-Q363 VanDerWaalsContact C-N 3.34Å; S361-K365 PolarHBondContact O-NZ 3.42Å
362	Q	66.4	Low	70	Confident	135 Å²	135	38.7 Å²	38.7	63%	0.631	19%	0.191	S	C	*	.	H	α-helix	trans	-76.4	-18.8	178.9	-73.4	178.9	-3.2	0	0	113.6	Q358 V359	Q358-Q362 WeakPolarHBondContact O-CG 3.5Å; Q358-Q362 PolarHBondContact O-N 3.02Å; Q358-Q362 VanDerWaalsContact O-N 3.14Å; V359-Q362 PolarHBondContact O-N 3.46Å
363	Q	66.8	Low	70.4	Confident	69 Å²	69	37.3 Å²	37.3	32%	0.322	18%	0.184	S	C	.	.	S	Bend	trans	-67.2	148.9	176.8	-73.4	-176.9	0.6	0	0	112	V359 S361 K365 L708	V359-Q363 PolarHBondContact O-N 3.14Å; S361-Q363 VanDerWaalsContact C-N 3.34Å; Q363-K365 PolarHBondContact O-N 3.21Å; Q363-L708 HydrophobicContact CB-CD1 3.96Å
364	Q	60.2	Low	70.7	Confident	163 Å²	163	34.6 Å²	34.6	76%	0.762	17%	0.173	S	C	*	.	P	Polyproline II helix	trans	-67	122.5	173.3	-73.8	179.8	-5.1	0	0	110.2
365	K	73.5	Confident	70.7	Confident	31 Å²	31	32.2 Å²	32.2	14%	0.135	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-93.1	148.7	-176.2	-66.6	152.4	-177.9	171.3	0	111.1	S361 Q363 F369 Y370 L708	S361-K365 PolarHBondContact O-NZ 3.42Å; Q363-K365 PolarHBondContact O-N 3.21Å; K365-F369 HydrophobicContact CB-CB 4.47Å; K365-F369 HydrophobicContact CB-CD1 3.75Å; K365-F369 HydrophobicContact CB-CE1 4.33Å; K365-F369 HydrophobicContact CB-CG 4.19Å; K365-F369 HydrophobicContact CD-CD1 3.95Å; K365-F369 HydrophobicContact CD-CE1 3.66Å; K365-F369 HydrophobicContact CD-CZ 4.37Å; K365-F369 HydrophobicContact CG-CD1 3.8Å; K365-F369 HydrophobicContact CG-CE1 3.9Å; K365-F369 HydrophobicContact CG-CG 4.32Å; K365-F369 HydrophobicContact CG-CZ 4.46Å; K365-Y370 HydrophobicContact CB-CD2 4.48Å; K365-Y370 HydrophobicContact CB-CE1 4.07Å; K365-Y370 HydrophobicContact CB-CE2 3.78Å; K365-Y370 HydrophobicContact CD-CE1 3.68Å; K365-Y370 WeakPolarHBondContact CD-OH 3.17Å; K365-L708 HydrophobicContact CB-CD2 4.26Å; K365-L708 HydrophobicContact CG-CD2 3.94Å
366	S	66.3	Low	70.9	Confident	26 Å²	26	33.4 Å²	33.4	18%	0.182	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-83.9	165.4	177.4	81.9	0	0	0	0	111.8	E109 A368 F369 Y370	E109-S366 VanDerWaalsContact OE1-CB 3.25Å; E109-S366 WeakPolarHBondContact OE1-CB 3.35Å; E109-S366 PolarHBondContact OE1-OG 2.86Å; E109-S366 PolarHBondContact OE2-OG 2.86Å; S366-A368 VanDerWaalsContact C-N 3.3Å; S366-A368 PolarHBondContact O-N 3.16Å; S366-A368 PolarHBondContact OG-N 2.83Å; S366-F369 WeakPolarHBondContact O-CB 3.34Å; S366-F369 PolarHBondContact O-N 3.26Å; S366-F369 PolarHBondContact OG-N 3.39Å; S366-Y370 VanDerWaalsContact O-CD2 3.26Å; S366-Y370 WeakPolarHBondContact O-CD2 3.46Å; S366-Y370 PolarHBondContact O-N 3.21Å
367	R	66.6	Low	71	Confident	17 Å²	17	35.3 Å²	35.3	6%	0.064	17%	0.173	C	C	.	.	H	α-helix	trans	-60	-42.5	171.9	-176	-166.3	-179.6	-165.1	3.5	112.1	M105 M145 S149 F369 Y370 R371 D822 N842	M105-R367 HydrophobicContact CE-CG 4.4Å; M145-R367 PolarHBondContact O-NH1 3.25Å; M145-R367 HydrophobicContact SD-CB 4.15Å; S149-R367 VanDerWaalsContact OG-CZ 3.28Å; S149-R367 PolarHBondContact OG-NH1 2.95Å; S149-R367 PolarHBondContact OG-NH2 3.13Å; R367-F369 VanDerWaalsContact C-N 3.27Å; R367-F369 PolarHBondContact O-N 3.3Å; R367-Y370 PolarHBondContact O-N 3.3Å; R367-R371 PolarHBondContact O-N 3.43Å; R367-D822 IonicContact NH2-OD1 3.97Å; R367-D822 PolarHBondContact NH2-OD1 3.29Å; R367-D822 IonicContact NH2-OD2 3.78Å; R367-N842 WeakPolarHBondContact CD-ND2 3.49Å; R367-N842 WeakPolarHBondContact CG-ND2 3.49Å
368	A	67.1	Low	71	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.008	17%	0.173	C	C	.	.	H	α-helix	trans	-62.7	-39.1	-179.2	0	0	0	0	0	110.5	M105 E109 S366 R371 C372	M105-A368 HydrophobicContact CB-CB 4.22Å; M105-A368 HydrophobicContact CE-CB 4.01Å; E109-A368 HydrophobicContact CB-CB 3.77Å; E109-A368 HydrophobicContact CG-CB 4.28Å; E109-A368 WeakPolarHBondContact OE2-CB 3.5Å; S366-A368 VanDerWaalsContact C-N 3.3Å; S366-A368 PolarHBondContact O-N 3.16Å; S366-A368 PolarHBondContact OG-N 2.83Å; A368-R371 PolarHBondContact O-N 3.11Å; A368-C372 VanDerWaalsContact O-CB 3.3Å; A368-C372 WeakPolarHBondContact O-CB 3.08Å; A368-C372 PolarHBondContact O-N 3.11Å; A368-C372 PolarHBondContact O-SG 3.5Å
369	F	77.4	Confident	71	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-55.5	-54.6	171.3	176.9	-84.7	0	0	0	112.3	E109 K365 S366 R367 R371 C372 Q373 I384 L385 L708 L711 V712	E109-F369 PolarHBondContact OE2-N 3.4Å; K365-F369 HydrophobicContact CB-CB 4.47Å; K365-F369 HydrophobicContact CB-CD1 3.75Å; K365-F369 HydrophobicContact CB-CE1 4.33Å; K365-F369 HydrophobicContact CB-CG 4.19Å; K365-F369 HydrophobicContact CD-CD1 3.95Å; K365-F369 HydrophobicContact CD-CE1 3.66Å; K365-F369 HydrophobicContact CD-CZ 4.37Å; K365-F369 HydrophobicContact CG-CD1 3.8Å; K365-F369 HydrophobicContact CG-CE1 3.9Å; K365-F369 HydrophobicContact CG-CG 4.32Å; K365-F369 HydrophobicContact CG-CZ 4.46Å; S366-F369 WeakPolarHBondContact O-CB 3.34Å; S366-F369 PolarHBondContact O-N 3.26Å; S366-F369 PolarHBondContact OG-N 3.39Å; R367-F369 VanDerWaalsContact C-N 3.27Å; R367-F369 PolarHBondContact O-N 3.3Å; F369-R371 VanDerWaalsContact C-N 3.29Å; F369-R371 PolarHBondContact O-N 3.47Å; F369-C372 PolarHBondContact O-N 3.43Å; F369-Q373 HydrophobicContact CE1-CB 4.44Å; F369-Q373 WeakPolarHBondContact O-CB 3.48Å; F369-Q373 PolarHBondContact O-N 3.3Å; F369-I384 HydrophobicContact CD2-CG2 4.09Å; F369-I384 HydrophobicContact CE2-CG2 3.24Å; F369-I384 HydrophobicContact CZ-CG2 3.63Å; F369-L385 HydrophobicContact CE1-CD1 4.39Å; F369-L385 HydrophobicContact CE2-CD1 4.26Å; F369-L385 HydrophobicContact CE2-CD2 4.09Å; F369-L385 HydrophobicContact CE2-CG 3.89Å; F369-L385 HydrophobicContact CZ-CD1 3.53Å; F369-L385 HydrophobicContact CZ-CD2 4.19Å; F369-L385 HydrophobicContact CZ-CG 3.63Å; F369-L708 HydrophobicContact CD2-CD2 3.88Å; F369-L708 HydrophobicContact CE2-CD2 4.38Å; F369-L708 HydrophobicContact CG-CD2 4.23Å; F369-L711 HydrophobicContact CE2-CD2 4.27Å; F369-V712 HydrophobicContact CB-CG2 3.99Å; F369-V712 HydrophobicContact CD2-CG2 3.75Å; F369-V712 HydrophobicContact CG-CG2 4.36Å
370	Y	72.8	Confident	70.8	Confident	4 Å²	4	31.5 Å²	31.5	2%	0.016	16%	0.158	C	C	.	.	H	α-helix	trans	-62.3	-37.7	-177.2	-71.5	-54.4	0	0	0	113.1	K365 S366 R367 A374 V828 A829 Q832 D833	K365-Y370 HydrophobicContact CB-CD2 4.48Å; K365-Y370 HydrophobicContact CB-CE1 4.07Å; K365-Y370 HydrophobicContact CB-CE2 3.78Å; K365-Y370 HydrophobicContact CD-CE1 3.68Å; K365-Y370 WeakPolarHBondContact CD-OH 3.17Å; S366-Y370 VanDerWaalsContact O-CD2 3.26Å; S366-Y370 WeakPolarHBondContact O-CD2 3.46Å; S366-Y370 PolarHBondContact O-N 3.21Å; R367-Y370 PolarHBondContact O-N 3.3Å; Y370-A374 WeakPolarHBondContact O-CB 3.27Å; Y370-A374 PolarHBondContact O-N 3.28Å; Y370-V828 HydrophobicContact CD1-CB 4.38Å; Y370-V828 HydrophobicContact CD1-CG1 3.58Å; Y370-V828 HydrophobicContact CE1-CG1 4.2Å; Y370-V828 HydrophobicContact CG-CG1 4.41Å; Y370-A829 HydrophobicContact CD2-CB 3.85Å; Y370-A829 HydrophobicContact CE2-CB 4.14Å; Y370-A829 HydrophobicContact CG-CB 4.25Å; Y370-Q832 HydrophobicContact CE1-CB 3.79Å; Y370-Q832 HydrophobicContact CE1-CG 4.31Å; Y370-D833 VanDerWaalsContact CE2-OD2 3.31Å; Y370-D833 WeakPolarHBondContact CE2-OD2 3.2Å; Y370-D833 VanDerWaalsContact OH-CG 3.28Å; Y370-D833 PolarHBondContact OH-OD1 3.46Å
371	R	72	Confident	70.8	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-68	-49.4	176.6	-173.5	175.2	162.3	126.1	-0	111.6	D102 R367 A368 F369 Q373 A374 T375 P821 D822 A825	D102-R371 IonicContact OD1-NE 2.67Å; D102-R371 PolarHBondContact OD1-NE 3.36Å; R367-R371 PolarHBondContact O-N 3.43Å; A368-R371 PolarHBondContact O-N 3.11Å; F369-R371 VanDerWaalsContact C-N 3.29Å; F369-R371 PolarHBondContact O-N 3.47Å; R371-Q373 VanDerWaalsContact C-N 3.31Å; R371-Q373 PolarHBondContact O-N 2.94Å; R371-A374 PolarHBondContact O-N 2.89Å; R371-T375 PolarHBondContact O-N 3.06Å; R371-T375 VanDerWaalsContact O-N 3.07Å; R371-T375 PolarHBondContact O-OG1 2.9Å; R371-P821 VanDerWaalsContact NH2-CB 3.26Å; R371-D822 IonicContact NH1-OD1 2.72Å; R371-D822 PolarHBondContact NH1-OD1 2.86Å; R371-A825 HydrophobicContact CB-CB 3.67Å; R371-A825 HydrophobicContact CG-CB 4.03Å
372	C	74	Confident	71	Confident	8 Å²	8	29.5 Å²	29.5	5%	0.054	15%	0.145	C	C	.	.	H	α-helix	trans	-60.2	-42.5	177.5	-67.7	0	0	0	0	111	A368 F369 A374 R376 V712	A368-C372 VanDerWaalsContact O-CB 3.3Å; A368-C372 WeakPolarHBondContact O-CB 3.08Å; A368-C372 PolarHBondContact O-N 3.11Å; A368-C372 PolarHBondContact O-SG 3.5Å; F369-C372 PolarHBondContact O-N 3.43Å; C372-A374 PolarHBondContact O-N 3.31Å; C372-R376 VanDerWaalsContact O-CB 3.29Å; C372-R376 WeakPolarHBondContact O-CB 3.07Å; C372-R376 WeakPolarHBondContact O-CD 3.23Å; C372-R376 WeakPolarHBondContact O-CG 3.29Å; C372-R376 PolarHBondContact O-N 2.87Å; C372-V712 HydrophobicContact CB-CG1 4.14Å
373	Q	77.3	Confident	71.5	Confident	4 Å²	4	23.6 Å²	23.6	2%	0.019	12%	0.118	C	C	.	.	H	α-helix	trans	-61.5	-44.9	176.8	-170.6	176.7	42.5	0	0	111.5	F369 R371 R376 L377 N383	F369-Q373 HydrophobicContact CE1-CB 4.44Å; F369-Q373 WeakPolarHBondContact O-CB 3.48Å; F369-Q373 PolarHBondContact O-N 3.3Å; R371-Q373 VanDerWaalsContact C-N 3.31Å; R371-Q373 PolarHBondContact O-N 2.94Å; Q373-R376 PolarHBondContact O-N 3.46Å; Q373-L377 HydrophobicContact CG-CD1 4.39Å; Q373-L377 WeakPolarHBondContact O-CG 3.4Å; Q373-L377 PolarHBondContact O-N 3.46Å; Q373-N383 PolarHBondContact NE2-OD1 2.83Å
374	A	74.4	Confident	71.8	Confident	5 Å²	5	20.8 Å²	20.8	4%	0.041	11%	0.105	C	C	.	.	H	α-helix	trans	-62.3	-46.3	179.7	0	0	0	0	0	113.1	Y370 R371 C372 R376 L377 M378 F824 V828	Y370-A374 WeakPolarHBondContact O-CB 3.27Å; Y370-A374 PolarHBondContact O-N 3.28Å; R371-A374 PolarHBondContact O-N 2.89Å; C372-A374 PolarHBondContact O-N 3.31Å; A374-R376 VanDerWaalsContact C-N 3.34Å; A374-L377 PolarHBondContact O-N 2.93Å; A374-M378 WeakPolarHBondContact O-CG 3.19Å; A374-M378 PolarHBondContact O-N 3.48Å; A374-F824 HydrophobicContact CB-CB 3.74Å; A374-V828 HydrophobicContact CB-CG2 4.2Å
375	T	73.7	Confident	72.3	Confident	4 Å²	4	13.1 Å²	13.1	3%	0.025	7%	0.069	C	C	.	.	H	α-helix	trans	-70.2	-33.1	177.9	-48.5	0	0	0	0	112.2	I99 D102 R371 L377 M378 T379	I99-T375 HydrophobicContact CG1-CG2 4.35Å; D102-T375 PolarHBondContact OD1-OG1 3.14Å; D102-T375 WeakPolarHBondContact OD2-CB 3.4Å; D102-T375 WeakPolarHBondContact OD2-CG2 3.4Å; D102-T375 PolarHBondContact OD2-OG1 3.39Å; R371-T375 PolarHBondContact O-N 3.06Å; R371-T375 VanDerWaalsContact O-N 3.07Å; R371-T375 PolarHBondContact O-OG1 2.9Å; T375-L377 VanDerWaalsContact C-N 3.33Å; T375-L377 PolarHBondContact O-N 2.94Å; T375-M378 HydrophobicContact CG2-CE 4.47Å; T375-M378 PolarHBondContact O-N 3.44Å; T375-T379 HydrophobicContact CG2-CG2 4.02Å; T375-T379 WeakPolarHBondContact O-CB 3.36Å; T375-T379 VanDerWaalsContact O-CG2 3.27Å; T375-T379 WeakPolarHBondContact O-CG2 3.35Å; T375-T379 PolarHBondContact O-N 3.44Å; T375-T379 PolarHBondContact O-OG1 3.32Å
376	R	76.3	Confident	72.2	Confident	29 Å²	29	16 Å²	16	11%	0.109	8%	0.082	C	C	.	.	H	α-helix	trans	-61.3	-43.3	173.3	-74.9	171.5	72.5	96.4	21.3	111.5	C372 Q373 A374 T379 G380 A381 E723	C372-R376 VanDerWaalsContact O-CB 3.29Å; C372-R376 WeakPolarHBondContact O-CB 3.07Å; C372-R376 WeakPolarHBondContact O-CD 3.23Å; C372-R376 WeakPolarHBondContact O-CG 3.29Å; C372-R376 PolarHBondContact O-N 2.87Å; Q373-R376 PolarHBondContact O-N 3.46Å; A374-R376 VanDerWaalsContact C-N 3.34Å; R376-T379 PolarHBondContact O-N 3.15Å; R376-T379 PolarHBondContact O-OG1 2.95Å; R376-G380 PolarHBondContact O-N 2.77Å; R376-G380 VanDerWaalsContact O-N 3.16Å; R376-A381 HydrophobicContact CB-CB 4.02Å; R376-A381 HydrophobicContact CG-CB 4.2Å; R376-A381 PolarHBondContact NH2-O 3.43Å; R376-A381 VanDerWaalsContact NH2-O 3.08Å; R376-A381 PolarHBondContact O-N 3.32Å; R376-E723 IonicContact CZ-OE1 2.86Å; R376-E723 IonicContact NH1-OE1 2.87Å; R376-E723 PolarHBondContact NH1-OE1 3.33Å; R376-E723 IonicContact NH1-OE2 3.97Å; R376-E723 IonicContact NH2-OE1 3.8Å; R376-E723 PolarHBondContact NH2-OE1 2.89Å
377	L	72.6	Confident	72.3	Confident	51 Å²	51	17.8 Å²	17.8	27%	0.267	9%	0.086	S	C	.	.	H	α-helix	trans	-62.3	-46.2	173.8	-69.6	170.6	0	0	0	111.4	Q373 A374 T375 T379 G380	Q373-L377 HydrophobicContact CG-CD1 4.39Å; Q373-L377 WeakPolarHBondContact O-CG 3.4Å; Q373-L377 PolarHBondContact O-N 3.46Å; A374-L377 PolarHBondContact O-N 2.93Å; T375-L377 VanDerWaalsContact C-N 3.33Å; T375-L377 PolarHBondContact O-N 2.94Å; L377-T379 PolarHBondContact O-N 3.33Å; L377-G380 PolarHBondContact O-N 3.23Å
378	M	71.5	Confident	72.4	Confident	48 Å²	48	19.5 Å²	19.5	24%	0.236	10%	0.095	C	C	.	.	H	α-helix	trans	-62.7	-27.8	177.8	-71.9	-169.2	-70.3	0	0	114	A374 T375 M751 F824	A374-M378 WeakPolarHBondContact O-CG 3.19Å; A374-M378 PolarHBondContact O-N 3.48Å; T375-M378 HydrophobicContact CG2-CE 4.47Å; T375-M378 PolarHBondContact O-N 3.44Å; M378-M751 WeakPolarHBondContact O-CB 3.33Å; M378-M751 WeakPolarHBondContact O-CE 3.3Å; M378-F824 HydrophobicContact CE-CB 4.49Å; M378-F824 HydrophobicContact CE-CD2 3.62Å; M378-F824 HydrophobicContact CE-CE2 4.02Å; M378-F824 HydrophobicContact CE-CG 4.14Å; M378-F824 HydrophobicContact SD-CD1 4.4Å; M378-F824 HydrophobicContact SD-CD2 3.49Å; M378-F824 WeakPolarHBondContact SD-CD2 3.49Å; M378-F824 HydrophobicContact SD-CE1 4.23Å; M378-F824 HydrophobicContact SD-CE2 3.26Å; M378-F824 WeakPolarHBondContact SD-CE2 3.1Å; M378-F824 HydrophobicContact SD-CG 4.07Å; M378-F824 HydrophobicContact SD-CZ 3.68Å
379	T	73.1	Confident	72.4	Confident	10 Å²	10	19.5 Å²	19.5	6%	0.061	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	6.2	-176.7	62	0	0	0	0	113.3	I99 T375 R376 L377 T755 K759	I99-T379 HydrophobicContact CD1-CG2 4.13Å; I99-T379 HydrophobicContact CG1-CG2 4.06Å; T375-T379 HydrophobicContact CG2-CG2 4.02Å; T375-T379 WeakPolarHBondContact O-CB 3.36Å; T375-T379 VanDerWaalsContact O-CG2 3.27Å; T375-T379 WeakPolarHBondContact O-CG2 3.35Å; T375-T379 PolarHBondContact O-N 3.44Å; T375-T379 PolarHBondContact O-OG1 3.32Å; R376-T379 PolarHBondContact O-N 3.15Å; R376-T379 PolarHBondContact O-OG1 2.95Å; L377-T379 PolarHBondContact O-N 3.33Å; T379-T755 HydrophobicContact CG2-CG2 3.72Å; T379-K759 PolarHBondContact O-NZ 3.38Å; T379-K759 WeakPolarHBondContact OG1-CE 3.24Å
380	G	68.4	Low	71.8	Confident	1 Å²	1	20.4 Å²	20.4	1%	0.01	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	30.1	179.6	0	0	0	0	0	114.3	R376 L377 S728	R376-G380 PolarHBondContact O-N 2.77Å; R376-G380 VanDerWaalsContact O-N 3.16Å; L377-G380 PolarHBondContact O-N 3.23Å; G380-S728 PolarHBondContact O-N 3.47Å
381	A	68.8	Low	71.5	Confident	8 Å²	8	23.2 Å²	23.2	7%	0.066	12%	0.117	C	C	.	.	B	Isolated β-bridge	trans	-101.2	6.7	178.5	0	0	0	0	0	113.9	R376	R376-A381 HydrophobicContact CB-CB 4.02Å; R376-A381 HydrophobicContact CG-CB 4.2Å; R376-A381 PolarHBondContact NH2-O 3.43Å; R376-A381 VanDerWaalsContact NH2-O 3.08Å; R376-A381 PolarHBondContact O-N 3.32Å
382	G	72.3	Confident	71.2	Confident	3 Å²	3	25.2 Å²	25.2	3%	0.031	13%	0.127	C	C	.	.			trans	68.1	-178.9	173	0	0	0	0	0	116
383	N	76.9	Confident	70.7	Confident	11 Å²	11	25.1 Å²	25.1	6%	0.059	13%	0.127	C	C	.	.			trans	-78.3	126.9	178.9	-173.7	-15.1	0	0	0	111.3	Q373 L385 K386 K387 E731	Q373-N383 PolarHBondContact NE2-OD1 2.83Å; N383-L385 PolarHBondContact O-N 3.29Å; N383-L385 PolarHBondContact OD1-N 3.49Å; N383-L385 VanDerWaalsContact OD1-N 3.12Å; N383-K386 HydrophobicContact CB-CB 4.38Å; N383-K386 HydrophobicContact CB-CD 4.36Å; N383-K386 HydrophobicContact CB-CG 4.43Å; N383-K387 PolarHBondContact O-N 3.29Å; N383-E731 PolarHBondContact ND2-OE1 3.48Å; N383-E731 PolarHBondContact ND2-OE2 3.4Å
384	I	73.4	Confident	70.1	Confident	11 Å²	11	32.1 Å²	32.1	6%	0.056	15%	0.153	C	C	.	.	H	α-helix	trans	-65.8	-34.3	-175.9	-156.7	166.6	0	0	0	113.1	F369 H388 L711	F369-I384 HydrophobicContact CD2-CG2 4.09Å; F369-I384 HydrophobicContact CE2-CG2 3.24Å; F369-I384 HydrophobicContact CZ-CG2 3.63Å; I384-H388 PolarHBondContact O-N 2.75Å; I384-L711 WeakPolarHBondContact CD1-O 3.41Å
385	L	69.6	Low	69.5	Low	1 Å²	1	39.1 Å²	39.1	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-71.5	-48.2	-178.6	-72.5	164.2	0	0	0	111.4	Y357 L360 F369 N383 K387 H388 A389 L711	Y357-L385 HydrophobicContact CD2-CB 3.87Å; Y357-L385 HydrophobicContact CE2-CB 3.66Å; Y357-L385 HydrophobicContact CE2-CD1 4.49Å; L360-L385 HydrophobicContact CB-CD2 3.56Å; L360-L385 HydrophobicContact CD1-CD2 4.4Å; F369-L385 HydrophobicContact CE1-CD1 4.39Å; F369-L385 HydrophobicContact CE2-CD1 4.26Å; F369-L385 HydrophobicContact CE2-CD2 4.09Å; F369-L385 HydrophobicContact CE2-CG 3.89Å; F369-L385 HydrophobicContact CZ-CD1 3.53Å; F369-L385 HydrophobicContact CZ-CD2 4.19Å; F369-L385 HydrophobicContact CZ-CG 3.63Å; N383-L385 PolarHBondContact O-N 3.29Å; N383-L385 PolarHBondContact OD1-N 3.49Å; N383-L385 VanDerWaalsContact OD1-N 3.12Å; L385-K387 PolarHBondContact O-N 3.32Å; L385-H388 PolarHBondContact O-N 3.48Å; L385-A389 WeakPolarHBondContact O-CB 3.34Å; L385-A389 PolarHBondContact O-N 3.43Å; L385-L711 HydrophobicContact CD2-CD2 3.56Å; L385-L711 HydrophobicContact CG-CD2 4.37Å
386	K	71.2	Confident	68.7	Low	93 Å²	93	41 Å²	41	40%	0.404	20%	0.199	S	C	.	.	H	α-helix	trans	-59.8	-46.6	177.8	-72.9	-179.3	172.2	159.2	0	110.9	Y357 N383 H388 A389 A390 E731	Y357-K386 HydrophobicContact CD2-CG 3.81Å; Y357-K386 HydrophobicContact CE2-CB 4.49Å; Y357-K386 HydrophobicContact CE2-CD 4.46Å; Y357-K386 HydrophobicContact CE2-CG 3.46Å; Y357-K386 VanDerWaalsContact CE2-CG 3.46Å; N383-K386 HydrophobicContact CB-CB 4.38Å; N383-K386 HydrophobicContact CB-CD 4.36Å; N383-K386 HydrophobicContact CB-CG 4.43Å; K386-H388 PolarHBondContact O-N 2.92Å; K386-A389 PolarHBondContact O-N 2.91Å; K386-A390 PolarHBondContact O-N 3.27Å; K386-E731 WeakPolarHBondContact CE-OE1 3.23Å; K386-E731 IonicContact NZ-OE1 2.87Å; K386-E731 PolarHBondContact NZ-OE1 3.42Å
387	K	69.4	Low	67.7	Low	63 Å²	63	42.6 Å²	42.6	27%	0.274	21%	0.212	S	C	.	.	H	α-helix	trans	-58	-46	178.1	-178	179.8	172.9	179.6	0	112.6	N383 L385 A390 D391 E723	N383-K387 PolarHBondContact O-N 3.29Å; L385-K387 PolarHBondContact O-N 3.32Å; K387-A390 PolarHBondContact O-N 3.28Å; K387-D391 PolarHBondContact O-N 3.3Å; K387-E723 IonicContact NZ-OE1 3.18Å; K387-E723 PolarHBondContact NZ-OE1 3.24Å
388	H	68.9	Low	66.9	Low	53 Å²	53	43.7 Å²	43.7	25%	0.245	22%	0.223	C	C	.	.	H	α-helix	trans	-70.1	-37.5	-179.8	-176.3	-89	0	0	0	112.8	I384 L385 K386 A390 D391 Q392 L711	I384-H388 PolarHBondContact O-N 2.75Å; L385-H388 PolarHBondContact O-N 3.48Å; K386-H388 PolarHBondContact O-N 2.92Å; H388-A390 VanDerWaalsContact C-N 3.28Å; H388-A390 PolarHBondContact O-N 3.27Å; H388-D391 PolarHBondContact O-N 3.41Å; H388-Q392 PolarHBondContact CE1-OE1 3.48Å; H388-Q392 VanDerWaalsContact CE1-OE1 3.32Å; H388-Q392 VanDerWaalsContact O-CB 3.3Å; H388-Q392 WeakPolarHBondContact O-CB 3.34Å; H388-Q392 PolarHBondContact O-N 3.39Å; H388-L711 HydrophobicContact CB-CD1 3.28Å; H388-L711 HydrophobicContact CB-CG 4.38Å; H388-L711 WeakPolarHBondContact CD2-CD1 3.13Å; H388-L711 WeakPolarHBondContact ND1-CD1 3.44Å
389	A	66.4	Low	65.7	Low	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.2	-45.6	173.4	0	0	0	0	0	110.5	E353 N356 L385 K386 Q392 A393	E353-A389 HydrophobicContact CG-CB 3.81Å; N356-A389 HydrophobicContact CB-CB 4.35Å; L385-A389 WeakPolarHBondContact O-CB 3.34Å; L385-A389 PolarHBondContact O-N 3.43Å; K386-A389 PolarHBondContact O-N 2.91Å; A389-Q392 PolarHBondContact O-N 3.03Å; A389-A393 PolarHBondContact O-N 2.88Å
390	A	65.4	Low	64.4	Low	19 Å²	19	54.2 Å²	54.2	16%	0.157	27%	0.272	C	S	.	.	H	α-helix	trans	-64	-45.2	174.9	0	0	0	0	0	113.2	K386 K387 H388 Q392 A393 R394	K386-A390 PolarHBondContact O-N 3.27Å; K387-A390 PolarHBondContact O-N 3.28Å; H388-A390 VanDerWaalsContact C-N 3.28Å; H388-A390 PolarHBondContact O-N 3.27Å; A390-Q392 VanDerWaalsContact C-N 3.3Å; A390-Q392 PolarHBondContact O-N 3.46Å; A390-A393 PolarHBondContact O-N 2.72Å; A390-R394 WeakPolarHBondContact O-CG 3.15Å; A390-R394 PolarHBondContact O-N 3.03Å
391	D	66.8	Low	63.3	Low	63 Å²	63	61 Å²	61	34%	0.337	30%	0.304	S	S	.	.	H	α-helix	trans	-64.6	-34	179.1	-78.9	-21.2	0	0	0	112.3	K387 H388 K395	K387-D391 PolarHBondContact O-N 3.3Å; H388-D391 PolarHBondContact O-N 3.41Å; D391-K395 WeakPolarHBondContact O-CG 2.95Å; D391-K395 PolarHBondContact O-N 2.87Å; D391-K395 VanDerWaalsContact O-N 3.13Å
392	Q	65.3	Low	61.9	Low	44 Å²	44	65.9 Å²	65.9	21%	0.206	33%	0.333	C	S	.	.	H	α-helix	trans	-73.8	-38.6	177	-170.4	170.7	0.5	0	0	111.9	H388 A389 A390 K395 A396	H388-Q392 PolarHBondContact CE1-OE1 3.48Å; H388-Q392 VanDerWaalsContact CE1-OE1 3.32Å; H388-Q392 VanDerWaalsContact O-CB 3.3Å; H388-Q392 WeakPolarHBondContact O-CB 3.34Å; H388-Q392 PolarHBondContact O-N 3.39Å; A389-Q392 PolarHBondContact O-N 3.03Å; A390-Q392 VanDerWaalsContact C-N 3.3Å; A390-Q392 PolarHBondContact O-N 3.46Å; Q392-K395 PolarHBondContact O-N 3.49Å; Q392-A396 PolarHBondContact O-N 3.04Å; Q392-A396 VanDerWaalsContact O-N 3.07Å
393	A	62.3	Low	60.3	Low	6 Å²	6	76.4 Å²	76.4	5%	0.05	37%	0.372	C	S	.	.	H	α-helix	trans	-58.9	-50.2	171.4	0	0	0	0	0	110.9	E349 E353 A389 A390 K395 A396 V397	E349-A393 HydrophobicContact CG-CB 4.24Å; E353-A393 HydrophobicContact CB-CB 4.46Å; A389-A393 PolarHBondContact O-N 2.88Å; A390-A393 PolarHBondContact O-N 2.72Å; A393-K395 VanDerWaalsContact C-N 3.33Å; A393-K395 PolarHBondContact O-N 3.32Å; A393-A396 WeakPolarHBondContact O-CB 3.28Å; A393-A396 PolarHBondContact O-N 3.42Å; A393-V397 PolarHBondContact O-N 2.74Å
394	R	65.3	Low	58.3	Low	152 Å²	152	80.6 Å²	80.6	57%	0.574	40%	0.401	S	S	*	.	H	α-helix	trans	-58.2	-39.9	177.2	-70.3	178	-174.8	-174.5	3.7	113.4	A390 V397 S398 E741	A390-R394 WeakPolarHBondContact O-CG 3.15Å; A390-R394 PolarHBondContact O-N 3.03Å; R394-V397 PolarHBondContact O-N 2.69Å; R394-S398 PolarHBondContact O-N 2.93Å; R394-E741 IonicContact NH2-OE1 3.15Å
395	K	62.2	Low	56.7	Low	151 Å²	151	87 Å²	87	66%	0.657	44%	0.436	S	S	*	.	H	α-helix	trans	-68.1	-33.7	176.9	-77.2	173.7	-175	170	0	112.9	D391 Q392 A393 V397	D391-K395 WeakPolarHBondContact O-CG 2.95Å; D391-K395 PolarHBondContact O-N 2.87Å; D391-K395 VanDerWaalsContact O-N 3.13Å; Q392-K395 PolarHBondContact O-N 3.49Å; A393-K395 VanDerWaalsContact C-N 3.33Å; A393-K395 PolarHBondContact O-N 3.32Å; K395-V397 VanDerWaalsContact C-N 3.31Å
396	A	57	Low	55.3	Low	45 Å²	45	91.6 Å²	91.6	37%	0.372	47%	0.474	S	S	.	.	H	α-helix	trans	-66.5	-34.7	176.9	0	0	0	0	0	111.9	Q392 A393	Q392-A396 PolarHBondContact O-N 3.04Å; Q392-A396 VanDerWaalsContact O-N 3.07Å; A393-A396 WeakPolarHBondContact O-CB 3.28Å; A393-A396 PolarHBondContact O-N 3.42Å
397	V	55.6	Low	54	Low	62 Å²	62	90.5 Å²	90.5	38%	0.376	49%	0.489	S	S	.	.	H	α-helix	trans	-68	-45.8	177	178	0	0	0	0	111.8	A393 R394 K395 M399 H400	A393-V397 PolarHBondContact O-N 2.74Å; R394-V397 PolarHBondContact O-N 2.69Å; K395-V397 VanDerWaalsContact C-N 3.31Å; V397-M399 PolarHBondContact O-N 3.46Å; V397-M399 VanDerWaalsContact O-N 3.11Å; V397-H400 WeakPolarHBondContact O-CB 3.48Å; V397-H400 PolarHBondContact O-N 3.04Å
398	S	54.5	Low	53	Low	73 Å²	73	94.5 Å²	94.5	51%	0.51	51%	0.514	S	S	.	.	H	α-helix	trans	-60.6	-24.6	-178.9	171.9	0	0	0	0	114.2	R394 V402	R394-S398 PolarHBondContact O-N 2.93Å; S398-V402 WeakPolarHBondContact O-CG2 3.5Å
399	M	47.9	Very low	52.1	Low	132 Å²	132	99.9 Å²	99.9	65%	0.65	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-16.6	174.9	-72.9	-158.3	-58.9	0	0	113.8	V397	V397-M399 PolarHBondContact O-N 3.46Å; V397-M399 VanDerWaalsContact O-N 3.11Å
400	H	44.6	Very low	51.6	Low	147 Å²	147	103.7 Å²	103.7	68%	0.681	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-36.5	179.3	-162.2	56.3	0	0	0	111.5	V397 V402 R403	V397-H400 WeakPolarHBondContact O-CB 3.48Å; V397-H400 PolarHBondContact O-N 3.04Å; H400-V402 VanDerWaalsContact C-N 3.28Å; H400-V402 PolarHBondContact O-N 2.68Å; H400-R403 PolarHBondContact O-N 3Å
401	E	45.2	Very low	51.6	Low	143 Å²	143	108 Å²	108	67%	0.668	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-23.9	176.8	-67.5	-177.9	154.4	0	0	113.6	S404	E401-S404 PolarHBondContact O-OG 2.72Å
402	V	40.6	Very low	51.9	Low	111 Å²	111	107 Å²	107	67%	0.673	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-12.6	-175.8	-179.3	0	0	0	0	112.8	S398 H400	S398-V402 WeakPolarHBondContact O-CG2 3.5Å; H400-V402 VanDerWaalsContact C-N 3.28Å; H400-V402 PolarHBondContact O-N 2.68Å
403	R	37.4	Very low	52.5	Low	225 Å²	225	105.3 Å²	105.3	85%	0.849	58%	0.58	S	S	*	*	S	Bend	trans	-96.5	-11.3	-174	-140	172.9	-176.5	143.6	-3.3	114.4	H400	H400-R403 PolarHBondContact O-N 3Å
404	S	35.2	Very low	53.6	Low	98 Å²	98	108.7 Å²	108.7	69%	0.685	59%	0.593	S	S	*	*	S	Bend	trans	-88.9	-11.5	179.4	52.8	0	0	0	0	114.9	E401	E401-S404 PolarHBondContact O-OG 2.72Å
405	D	39.4	Very low	54.8	Low	147 Å²	147	101.4 Å²	101.4	79%	0.786	57%	0.566	S	S	*	*	S	Bend	trans	-109.4	9.1	-169.7	-105.2	5	0	0	0	115.4	G407	D405-G407 VanDerWaalsContact C-N 3.34Å; D405-G407 PolarHBondContact O-N 3.28Å
406	A	40.3	Very low	56.2	Low	97 Å²	97	95.5 Å²	95.5	80%	0.802	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	27.7	-172.7	0	0	0	0	0	115.4
407	G	43.8	Very low	57.8	Low	70 Å²	70	93.5 Å²	93.5	72%	0.722	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-22.7	-173.1	0	0	0	0	0	117.8	D405	D405-G407 VanDerWaalsContact C-N 3.34Å; D405-G407 PolarHBondContact O-N 3.28Å
408	D	48.6	Very low	59.4	Low	147 Å²	147	94.5 Å²	94.5	79%	0.786	52%	0.524	S	S	*	.	S	Bend	trans	-121.6	18.6	-150.8	-101.9	-4.1	0	0	0	118.1
409	N	49.9	Very low	60.9	Low	165 Å²	165	94.4 Å²	94.4	88%	0.882	52%	0.522	S	S	*	.			trans	-128.3	65.5	178.8	-75.5	-50	0	0	0	113.5
410	D	57.3	Low	62.5	Low	80 Å²	80	89.5 Å²	89.5	43%	0.428	50%	0.504	S	S	.	.			trans	-97.4	118.9	167.8	-150.8	-3.5	0	0	0	109.4	V412 K414 G440	D410-V412 PolarHBondContact O-N 3.35Å; D410-V412 VanDerWaalsContact O-N 3.14Å; D410-K414 IonicContact OD2-NZ 3.71Å; D410-K414 PolarHBondContact OD2-NZ 3.35Å; D410-G440 PolarHBondContact O-N 3.48Å
411	P	63.6	Low	64.6	Low	111 Å²	111	86.1 Å²	86.1	72%	0.721	50%	0.498	S	S	*	.	S	Bend	trans	-73.2	-0.1	-171.6	27.6	-35.3	0	0	0	115.3
412	V	73.5	Confident	66.7	Low	40 Å²	40	80.3 Å²	80.3	24%	0.242	47%	0.47	C	S	.	.	S	Bend	trans	-113	132.6	-174.2	178.6	0	0	0	0	110.3	D410 K414 G439 G440 V526	D410-V412 PolarHBondContact O-N 3.35Å; D410-V412 VanDerWaalsContact O-N 3.14Å; V412-K414 HydrophobicContact CG1-CG 4.5Å; V412-K414 PolarHBondContact O-N 3.16Å; V412-G439 CarbonylContact O-C 3.44Å; V412-G440 PolarHBondContact O-N 3.3Å; V412-V526 HydrophobicContact CG1-CB 4.44Å; V412-V526 VanDerWaalsContact CG1-O 3.32Å; V412-V526 WeakPolarHBondContact CG1-O 3.23Å
413	S	78.3	Confident	68.9	Low	9 Å²	9	81.8 Å²	81.8	6%	0.063	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	113.3	172.2	-79.4	0	0	0	0	110.5	R437 G439 G440 V526 A527 C528	S413-R437 PolarHBondContact OG-NH2 3.14Å; S413-G439 WeakPolarHBondContact CA-O 3.36Å; S413-G439 WeakPolarHBondContact CB-O 3.5Å; S413-G439 PolarHBondContact OG-O 3.18Å; S413-G440 WeakPolarHBondContact OG-CA 3.42Å; S413-V526 PolarHBondContact N-O 2.95Å; S413-A527 VanDerWaalsContact O-CA 3.32Å; S413-A527 WeakPolarHBondContact O-CA 3.49Å; S413-C528 PolarHBondContact O-N 3.42Å; S413-C528 VanDerWaalsContact O-N 3.07Å
414	K	86.3	Confident	71.2	Confident	77 Å²	77	71.6 Å²	71.6	34%	0.335	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	131.5	177.5	-67.1	169.8	179.2	165	0	110.1	D410 V412 F416 R437 R438 C528	D410-K414 IonicContact OD2-NZ 3.71Å; D410-K414 PolarHBondContact OD2-NZ 3.35Å; V412-K414 HydrophobicContact CG1-CG 4.5Å; V412-K414 PolarHBondContact O-N 3.16Å; K414-F416 HydrophobicContact CB-CD1 4.28Å; K414-F416 HydrophobicContact CB-CE1 4.43Å; K414-R437 WeakPolarHBondContact O-CA 3.33Å; K414-R438 PolarHBondContact N-O 3.24Å; K414-R438 PolarHBondContact O-N 3.2Å; K414-C528 WeakPolarHBondContact CA-O 3.31Å
415	I	88.9	Confident	73.5	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.5	176.3	-63.9	166.7	0	0	0	109.8	V435 V436 R437 V446 V448 F472 L501 V504 C528 V529 G530	I415-V435 HydrophobicContact CG2-CG1 3.51Å; I415-V436 WeakPolarHBondContact CA-O 3.3Å; I415-R437 HydrophobicContact CG1-CB 4.28Å; I415-R437 HydrophobicContact CG1-CG 4.27Å; I415-V446 HydrophobicContact CD1-CB 4.14Å; I415-V446 HydrophobicContact CD1-CG1 3.36Å; I415-V448 HydrophobicContact CG2-CB 4.37Å; I415-V448 HydrophobicContact CG2-CG1 4.06Å; I415-V448 HydrophobicContact CG2-CG2 4.46Å; I415-F472 HydrophobicContact CD1-CD2 4.43Å; I415-F472 HydrophobicContact CD1-CE2 4.44Å; I415-F472 HydrophobicContact CG2-CE2 4.22Å; I415-L501 HydrophobicContact CG2-CD1 4.47Å; I415-V504 HydrophobicContact CD1-CG1 3.94Å; I415-V504 HydrophobicContact CD1-CG2 4.39Å; I415-C528 PolarHBondContact N-O 3.48Å; I415-V529 CarbonylContact O-C 3.56Å; I415-V529 WeakPolarHBondContact O-CA 3.19Å; I415-G530 PolarHBondContact O-N 2.89Å
416	F	91.6	Very high	75.6	Confident	27 Å²	27	64 Å²	64	12%	0.118	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	169.8	-175.6	57	-86.3	0	0	0	111.3	K414 E418 V436 R438 P532	K414-F416 HydrophobicContact CB-CD1 4.28Å; K414-F416 HydrophobicContact CB-CE1 4.43Å; F416-E418 HydrophobicContact CD2-CB 4.49Å; F416-E418 HydrophobicContact CE2-CB 4.16Å; F416-V436 PolarHBondContact N-O 3.32Å; F416-V436 PolarHBondContact O-N 3.39Å; F416-R438 HydrophobicContact CE1-CB 3.91Å; F416-R438 HydrophobicContact CZ-CB 4.27Å; F416-P532 WeakPolarHBondContact CB-O 3.4Å
417	F	92.1	Very high	77.6	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.009	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	136.7	174.3	-70.5	-71.6	0	0	0	111.9	P419 V433 N434 V435 I481 I499 L501 P532 A535	F417-P419 CarbonylContact C-O 3.47Å; F417-V433 HydrophobicContact CD1-CG1 3.52Å; F417-V433 HydrophobicContact CE1-CG1 3.41Å; F417-V433 VanDerWaalsContact CE1-CG1 3.41Å; F417-V433 HydrophobicContact CZ-CG1 4.45Å; F417-N434 WeakPolarHBondContact CD1-O 3.32Å; F417-V435 HydrophobicContact CD1-CG2 3.94Å; F417-V435 HydrophobicContact CE1-CG2 3.66Å; F417-I481 HydrophobicContact CE1-CD1 4.22Å; F417-I499 HydrophobicContact CE1-CG2 4.49Å; F417-I499 WeakPolarHBondContact CE2-O 3.45Å; F417-I499 HydrophobicContact CZ-CB 4.08Å; F417-I499 HydrophobicContact CZ-CG2 3.81Å; F417-L501 HydrophobicContact CD1-CD1 4.46Å; F417-L501 HydrophobicContact CD2-CD1 3.79Å; F417-L501 HydrophobicContact CD2-CG 4.08Å; F417-L501 HydrophobicContact CE1-CD1 4.33Å; F417-L501 HydrophobicContact CE1-CD2 4.31Å; F417-L501 HydrophobicContact CE1-CG 4.28Å; F417-L501 HydrophobicContact CE2-CB 4.44Å; F417-L501 HydrophobicContact CE2-CD1 3.68Å; F417-L501 HydrophobicContact CE2-CD2 4.24Å; F417-L501 HydrophobicContact CE2-CG 3.43Å; F417-L501 VanDerWaalsContact CE2-CG 3.43Å; F417-L501 HydrophobicContact CG-CD1 4.2Å; F417-L501 HydrophobicContact CZ-CD1 3.96Å; F417-L501 HydrophobicContact CZ-CD2 3.82Å; F417-L501 HydrophobicContact CZ-CG 3.54Å; F417-P532 HydrophobicContact CB-CG 4.36Å; F417-P532 PolarHBondContact N-O 3.11Å; F417-P532 WeakPolarHBondContact O-CG 3.14Å; F417-A535 HydrophobicContact CB-CB 4.14Å; F417-A535 HydrophobicContact CD1-CB 3.89Å; F417-A535 HydrophobicContact CD2-CB 3.65Å; F417-A535 VanDerWaalsContact CD2-N 3.33Å; F417-A535 HydrophobicContact CE1-CB 4.12Å; F417-A535 HydrophobicContact CE2-CB 3.85Å; F417-A535 HydrophobicContact CG-CB 3.65Å; F417-A535 HydrophobicContact CZ-CB 4.1Å
418	E	87.9	Confident	79.4	Confident	84 Å²	84	62.4 Å²	62.4	39%	0.393	35%	0.348	S	S	.	.	S	Bend	trans	-142.5	109.6	174.8	-171.3	169.5	-163.3	0	0	109.8	F416 Y422 N434 V436	F416-E418 HydrophobicContact CD2-CB 4.49Å; F416-E418 HydrophobicContact CE2-CB 4.16Å; E418-Y422 PolarHBondContact O-OH 3.32Å; E418-N434 PolarHBondContact N-O 3.19Å; E418-N434 WeakPolarHBondContact O-CB 3.01Å; E418-V436 HydrophobicContact CB-CB 4.32Å; E418-V436 HydrophobicContact CB-CG2 3.83Å
419	P	87.4	Confident	81.2	Confident	71 Å²	71	57.1 Å²	57.1	46%	0.461	33%	0.329	S	S	.	.	S	Bend	cis	-69.4	169.4	-3	29.8	-35.7	0	0	0	113.9	F417 Y422	F417-P419 CarbonylContact C-O 3.47Å; P419-Y422 WeakPolarHBondContact CD-OH 3.21Å; P419-Y422 HydrophobicContact CG-CD1 4.45Å; P419-Y422 HydrophobicContact CG-CE1 3.93Å; P419-Y422 HydrophobicContact CG-CE2 4.35Å; P419-Y422 WeakPolarHBondContact O-CE2 3.24Å; P419-Y422 VanDerWaalsContact O-CZ 3.32Å; P419-Y422 PolarHBondContact O-OH 2.86Å; P419-Y422 VanDerWaalsContact O-OH 3.1Å
420	G	81.6	Confident	83	Confident	28 Å²	28	53 Å²	53	29%	0.289	31%	0.31	S	S	.	.	S	Bend	trans	-88	-10.7	177.3	0	0	0	0	0	115.1	A535 T536	G420-A535 WeakPolarHBondContact O-CA 3.17Å; G420-T536 PolarHBondContact O-N 2.58Å; G420-T536 VanDerWaalsContact O-N 3.13Å
421	S	87.8	Confident	84.7	Confident	77 Å²	77	49.7 Å²	49.7	54%	0.538	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	134	175.7	56.2	0	0	0	0	109.5	T536	S421-T536 CarbonylContact C-O 3.59Å; S421-T536 VanDerWaalsContact CA-O 3.32Å; S421-T536 WeakPolarHBondContact CA-O 3.29Å
422	Y	88.5	Confident	86	Confident	21 Å²	21	46.3 Å²	46.3	8%	0.082	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	150.2	179.1	-66.1	-96.9	0	0	0	109.4	E418 P419 A432 V433 N434 A535 T536 V537 T538	E418-Y422 PolarHBondContact O-OH 3.32Å; P419-Y422 WeakPolarHBondContact CD-OH 3.21Å; P419-Y422 HydrophobicContact CG-CD1 4.45Å; P419-Y422 HydrophobicContact CG-CE1 3.93Å; P419-Y422 HydrophobicContact CG-CE2 4.35Å; P419-Y422 WeakPolarHBondContact O-CE2 3.24Å; P419-Y422 VanDerWaalsContact O-CZ 3.32Å; P419-Y422 PolarHBondContact O-OH 2.86Å; P419-Y422 VanDerWaalsContact O-OH 3.1Å; Y422-A432 WeakPolarHBondContact CE1-O 3.44Å; Y422-V433 HydrophobicContact CD1-CG2 4.12Å; Y422-V433 HydrophobicContact CD2-CG1 4.18Å; Y422-V433 HydrophobicContact CD2-CG2 4.02Å; Y422-V433 HydrophobicContact CE1-CB 4.36Å; Y422-V433 HydrophobicContact CE1-CG1 4.43Å; Y422-V433 HydrophobicContact CE1-CG2 4.27Å; Y422-V433 HydrophobicContact CE2-CB 4.28Å; Y422-V433 HydrophobicContact CE2-CG1 3.6Å; Y422-V433 HydrophobicContact CE2-CG2 4.2Å; Y422-V433 HydrophobicContact CG-CG2 4Å; Y422-N434 PolarHBondContact OH-N 3.48Å; Y422-N434 PolarHBondContact OH-O 2.91Å; Y422-A535 HydrophobicContact CD2-CB 4.06Å; Y422-A535 HydrophobicContact CE2-CB 3.94Å; Y422-T536 PolarHBondContact N-O 3.22Å; Y422-V537 CarbonylContact O-C 3.51Å; Y422-V537 WeakPolarHBondContact O-CA 3.37Å; Y422-T538 PolarHBondContact O-N 2.83Å
423	Q	87.6	Confident	86.9	Confident	141 Å²	141	44.4 Å²	44.4	66%	0.659	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	129.6	-176.9	-69.2	-171.8	-14.1	0	0	107.5	T538 F540	Q423-T538 WeakPolarHBondContact CA-O 3.14Å; Q423-F540 HydrophobicContact CB-CD2 4.29Å; Q423-F540 HydrophobicContact CB-CE2 3.69Å; Q423-F540 HydrophobicContact CG-CE2 3.61Å; Q423-F540 HydrophobicContact CG-CZ 4.29Å
424	C	85.9	Confident	87.6	Confident	12 Å²	12	46.1 Å²	46.1	8%	0.081	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	150.4	176.5	53.6	0	0	0	0	110.5	V431 T538 I539 F540	C424-V431 HydrophobicContact CB-CB 4.24Å; C424-V431 HydrophobicContact CB-CG2 4.12Å; C424-T538 PolarHBondContact N-O 3.08Å; C424-I539 WeakPolarHBondContact O-CA 3.19Å; C424-F540 PolarHBondContact O-N 3.32Å
425	L	84.1	Confident	87.9	Confident	78 Å²	78	42.5 Å²	42.5	41%	0.408	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	151.5	168.7	-64.6	168.8	0	0	0	108.9	N427 C428 F540 D542	L425-N427 WeakPolarHBondContact CB-OD1 3.32Å; L425-N427 PolarHBondContact O-N 2.79Å; L425-C428 VanDerWaalsContact O-CB 3.24Å; L425-C428 WeakPolarHBondContact O-CB 3.25Å; L425-C428 PolarHBondContact O-N 3.34Å; L425-C428 VanDerWaalsContact O-N 3.08Å; L425-C428 PolarHBondContact O-SG 3.21Å; L425-F540 HydrophobicContact CD2-CB 4.18Å; L425-D542 HydrophobicContact CD2-CB 4.36Å
426	E	83.3	Confident	88	Confident	8 Å²	8	43.1 Å²	43.1	4%	0.037	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-52.7	-44.2	175.5	-150.1	-168.9	153.4	0	0	111.9	C428 I485 I486 D487 D488 I539 F540	E426-C428 PolarHBondContact O-N 3.47Å; E426-I485 WeakPolarHBondContact O-CG2 3.4Å; E426-I486 VanDerWaalsContact CG-O 3.23Å; E426-I486 WeakPolarHBondContact CG-O 3.13Å; E426-D487 WeakPolarHBondContact OE1-CA 3.21Å; E426-D488 PolarHBondContact OE1-N 3.43Å; E426-I539 HydrophobicContact CB-CG2 4.3Å; E426-I539 HydrophobicContact CG-CG2 4.24Å; E426-F540 PolarHBondContact N-O 3.24Å; E426-F540 VanDerWaalsContact N-O 3.16Å
427	N	82.6	Confident	87.8	Confident	81 Å²	81	42.2 Å²	42.2	43%	0.433	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-70.4	2.1	178.8	72.7	21.3	0	0	0	116.6	L425 G429 D487 D542	L425-N427 WeakPolarHBondContact CB-OD1 3.32Å; L425-N427 PolarHBondContact O-N 2.79Å; N427-G429 VanDerWaalsContact C-N 3.27Å; N427-G429 PolarHBondContact O-N 3.43Å; N427-D487 VanDerWaalsContact CA-OD1 3.28Å; N427-D487 WeakPolarHBondContact CA-OD1 3.21Å; N427-D487 WeakPolarHBondContact CB-OD1 3.05Å; N427-D487 PolarHBondContact N-OD1 2.92Å; N427-D542 PolarHBondContact ND2-OD2 2.86Å
428	C	81.8	Confident	87.4	Confident	51 Å²	51	49.3 Å²	49.3	35%	0.345	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-74.4	-17.7	-174.3	77.2	0	0	0	0	113.7	L425 E426 T430	L425-C428 VanDerWaalsContact O-CB 3.24Å; L425-C428 WeakPolarHBondContact O-CB 3.25Å; L425-C428 PolarHBondContact O-N 3.34Å; L425-C428 VanDerWaalsContact O-N 3.08Å; L425-C428 PolarHBondContact O-SG 3.21Å; E426-C428 PolarHBondContact O-N 3.47Å; C428-T430 PolarHBondContact O-N 3.15Å
429	G	84.4	Confident	87	Confident	37 Å²	37	46.9 Å²	46.9	38%	0.381	28%	0.278	S	S	.	.	S	Bend	trans	69.3	-41.4	-179.1	0	0	0	0	0	115.2	N427 G484 I485	N427-G429 VanDerWaalsContact C-N 3.27Å; N427-G429 PolarHBondContact O-N 3.43Å; G429-G484 WeakPolarHBondContact O-CA 3.27Å; G429-I485 PolarHBondContact O-N 2.88Å
430	T	89.2	Confident	86.4	Confident	79 Å²	79	44.8 Å²	44.8	49%	0.485	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	135.2	173.4	62.5	0	0	0	0	112.2	C428 V483	C428-T430 PolarHBondContact O-N 3.15Å; T430-V483 CarbonylContact C-O 3.57Å; T430-V483 VanDerWaalsContact CA-O 3.24Å; T430-V483 WeakPolarHBondContact CA-O 3.29Å
431	V	91.5	Very high	85.9	Confident	10 Å²	10	47.7 Å²	47.7	6%	0.061	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	138.1	172.6	66.2	0	0	0	0	111.3	C424 V433 R482 V483 I485 F497 V537	C424-V431 HydrophobicContact CB-CB 4.24Å; C424-V431 HydrophobicContact CB-CG2 4.12Å; V431-V433 HydrophobicContact CG2-CG2 4.49Å; V431-R482 WeakPolarHBondContact O-CA 3.34Å; V431-V483 HydrophobicContact CG1-CB 3.84Å; V431-V483 PolarHBondContact N-O 3.33Å; V431-V483 PolarHBondContact O-N 3.43Å; V431-I485 HydrophobicContact CB-CD1 4.46Å; V431-I485 HydrophobicContact CB-CG1 4.31Å; V431-I485 HydrophobicContact CG1-CD1 3.95Å; V431-I485 HydrophobicContact CG1-CG1 4.25Å; V431-F497 HydrophobicContact CG1-CZ 4.22Å; V431-V537 HydrophobicContact CG1-CG1 4.24Å; V431-V537 HydrophobicContact CG2-CG1 4.2Å
432	A	91.9	Very high	85.3	Confident	39 Å²	39	48 Å²	48	32%	0.322	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	122.2	179.3	0	0	0	0	0	111.5	Y422 E480 I481	Y422-A432 WeakPolarHBondContact CE1-O 3.44Å; A432-E480 HydrophobicContact CB-CG 3.88Å; A432-E480 WeakPolarHBondContact CB-OE1 3.2Å; A432-I481 CarbonylContact C-O 3.58Å; A432-I481 WeakPolarHBondContact CA-O 3.3Å
433	V	92.8	Very high	84.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.4	-174.6	174.2	0	0	0	0	110.3	F417 Y422 V431 E480 I481 I499 A535 V537	F417-V433 HydrophobicContact CD1-CG1 3.52Å; F417-V433 HydrophobicContact CE1-CG1 3.41Å; F417-V433 VanDerWaalsContact CE1-CG1 3.41Å; F417-V433 HydrophobicContact CZ-CG1 4.45Å; Y422-V433 HydrophobicContact CD1-CG2 4.12Å; Y422-V433 HydrophobicContact CD2-CG1 4.18Å; Y422-V433 HydrophobicContact CD2-CG2 4.02Å; Y422-V433 HydrophobicContact CE1-CB 4.36Å; Y422-V433 HydrophobicContact CE1-CG1 4.43Å; Y422-V433 HydrophobicContact CE1-CG2 4.27Å; Y422-V433 HydrophobicContact CE2-CB 4.28Å; Y422-V433 HydrophobicContact CE2-CG1 3.6Å; Y422-V433 HydrophobicContact CE2-CG2 4.2Å; Y422-V433 HydrophobicContact CG-CG2 4Å; V431-V433 HydrophobicContact CG2-CG2 4.49Å; V433-E480 CarbonylContact O-C 3.52Å; V433-E480 WeakPolarHBondContact O-CA 3.34Å; V433-I481 HydrophobicContact CB-CB 4.43Å; V433-I481 PolarHBondContact N-O 3.36Å; V433-I481 PolarHBondContact O-N 2.54Å; V433-I499 HydrophobicContact CB-CD1 4.28Å; V433-I499 HydrophobicContact CG1-CD1 4.3Å; V433-I499 HydrophobicContact CG2-CD1 3.8Å; V433-A535 HydrophobicContact CG1-CB 4.21Å; V433-V537 HydrophobicContact CG2-CG2 4.33Å
434	N	92.4	Very high	84	Confident	46 Å²	46	45.7 Å²	45.7	25%	0.246	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	131.3	-174.6	-68.4	-38.4	0	0	0	112.5	F417 E418 Y422 K479	F417-N434 WeakPolarHBondContact CD1-O 3.32Å; E418-N434 PolarHBondContact N-O 3.19Å; E418-N434 WeakPolarHBondContact O-CB 3.01Å; Y422-N434 PolarHBondContact OH-N 3.48Å; Y422-N434 PolarHBondContact OH-O 2.91Å; N434-K479 WeakPolarHBondContact CA-O 3.38Å
435	V	91.9	Very high	83.9	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125	171.9	-172.9	0	0	0	0	108.7	I415 F417 V448 F472 M478 K479 I481 L501	I415-V435 HydrophobicContact CG2-CG1 3.51Å; F417-V435 HydrophobicContact CD1-CG2 3.94Å; F417-V435 HydrophobicContact CE1-CG2 3.66Å; V435-V448 HydrophobicContact CG1-CG1 4.37Å; V435-F472 HydrophobicContact CB-CZ 4.17Å; V435-F472 HydrophobicContact CG1-CE2 4.17Å; V435-F472 HydrophobicContact CG1-CZ 3.86Å; V435-F472 WeakPolarHBondContact O-CZ 3.44Å; V435-M478 WeakPolarHBondContact O-CA 3.37Å; V435-K479 PolarHBondContact N-O 3.37Å; V435-K479 PolarHBondContact O-N 3.2Å; V435-I481 HydrophobicContact CG2-CD1 3.51Å; V435-I481 HydrophobicContact CG2-CG1 4.22Å; V435-L501 HydrophobicContact CG1-CD1 3.99Å; V435-L501 HydrophobicContact CG1-CD2 4.28Å; V435-L501 HydrophobicContact CG2-CD2 4.12Å
436	V	90.9	Very high	84.1	Confident	13 Å²	13	43.1 Å²	43.1	8%	0.079	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	143.2	-175.1	178.8	0	0	0	0	110.7	I415 F416 E418 T477 M478	I415-V436 WeakPolarHBondContact CA-O 3.3Å; F416-V436 PolarHBondContact N-O 3.32Å; F416-V436 PolarHBondContact O-N 3.39Å; E418-V436 HydrophobicContact CB-CB 4.32Å; E418-V436 HydrophobicContact CB-CG2 3.83Å; V436-T477 WeakPolarHBondContact CA-O 3.37Å; V436-M478 HydrophobicContact CG2-CE 3.76Å; V436-M478 HydrophobicContact CG2-CG 4.3Å
437	R	87.3	Confident	84.3	Confident	8 Å²	8	43.4 Å²	43.4	3%	0.03	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.6	173.2	178.3	-171.9	176.2	-176.3	2.4	109.5	S413 K414 I415 D441 K444 F472 T477	S413-R437 PolarHBondContact OG-NH2 3.14Å; K414-R437 WeakPolarHBondContact O-CA 3.33Å; I415-R437 HydrophobicContact CG1-CB 4.28Å; I415-R437 HydrophobicContact CG1-CG 4.27Å; R437-D441 PolarHBondContact NH2-O 3.28Å; R437-K444 PolarHBondContact NH1-O 2.96Å; R437-F472 HydrophobicContact CB-CD1 4.15Å; R437-F472 HydrophobicContact CB-CE1 4.12Å; R437-F472 HydrophobicContact CB-CZ 4.48Å; R437-T477 PolarHBondContact N-O 3.46Å
438	R	85.4	Confident	84.8	Confident	151 Å²	151	39.5 Å²	39.5	57%	0.57	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	138.9	179.3	-155.4	176.4	-149	140.4	4.6	111.6	K414 F416	K414-R438 PolarHBondContact N-O 3.24Å; K414-R438 PolarHBondContact O-N 3.2Å; F416-R438 HydrophobicContact CE1-CB 3.91Å; F416-R438 HydrophobicContact CZ-CB 4.27Å
439	G	78.1	Confident	85.3	Confident	33 Å²	33	40 Å²	40	34%	0.34	24%	0.243	S	C	.	.	S	Bend	trans	76.1	174.3	179.2	0	0	0	0	0	114.9	V412 S413	V412-G439 CarbonylContact O-C 3.44Å; S413-G439 WeakPolarHBondContact CA-O 3.36Å; S413-G439 WeakPolarHBondContact CB-O 3.5Å; S413-G439 PolarHBondContact OG-O 3.18Å
440	G	74.9	Confident	85.8	Confident	28 Å²	28	40 Å²	40	29%	0.289	23%	0.231	S	C	.	.	S	Bend	trans	65.7	-168.3	-177.3	0	0	0	0	0	115.1	D410 V412 S413 L442	D410-G440 PolarHBondContact O-N 3.48Å; V412-G440 PolarHBondContact O-N 3.3Å; S413-G440 WeakPolarHBondContact OG-CA 3.42Å; G440-L442 PolarHBondContact O-N 3.29Å
441	D	72.6	Confident	86	Confident	89 Å²	89	42.1 Å²	42.1	48%	0.476	23%	0.231	S	C	.	.			trans	-83.5	102.7	-173.4	179.6	12.1	0	0	0	112.8	R437 G443 K444	R437-D441 PolarHBondContact NH2-O 3.28Å; D441-G443 PolarHBondContact O-N 2.89Å; D441-G443 PolarHBondContact OD1-N 3.5Å; D441-K444 PolarHBondContact O-N 3.47Å
442	L	75	Confident	86.1	Confident	82 Å²	82	41.9 Å²	41.9	43%	0.429	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-10.5	175.9	-74.9	152.3	0	0	0	114.1	G440 P474 G475 T477	G440-L442 PolarHBondContact O-N 3.29Å; L442-P474 CarbonylContact O-C 3.56Å; L442-P474 WeakPolarHBondContact O-CA 3.41Å; L442-G475 PolarHBondContact O-N 3.21Å; L442-T477 HydrophobicContact CD2-CG2 3.61Å
443	G	71.9	Confident	86.1	Confident	49 Å²	49	44.1 Å²	44.1	51%	0.505	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-17.6	175.9	0	0	0	0	0	115	D441 P474	D441-G443 PolarHBondContact O-N 2.89Å; D441-G443 PolarHBondContact OD1-N 3.5Å; G443-P474 WeakPolarHBondContact O-CG 3.4Å
444	K	76.4	Confident	86	Confident	66 Å²	66	47.7 Å²	47.7	29%	0.287	25%	0.252	S	S	.	.	S	Bend	trans	-96.9	148.7	-178.8	-62.5	-168.5	-176.1	-175	0	113	R437 D441 V506 S525	R437-K444 PolarHBondContact NH1-O 2.96Å; D441-K444 PolarHBondContact O-N 3.47Å; K444-V506 HydrophobicContact CB-CG1 4.1Å; K444-V506 HydrophobicContact CD-CG1 3.94Å; K444-S525 PolarHBondContact NZ-OG 2.78Å
445	T	83.5	Confident	85.8	Confident	35 Å²	35	47.2 Å²	47.2	22%	0.215	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	131.4	174.4	-55.2	0	0	0	0	109.7	V471 F472 L507	T445-V471 HydrophobicContact CG2-CG1 3.71Å; T445-F472 VanDerWaalsContact CA-O 3.29Å; T445-F472 WeakPolarHBondContact CA-O 3.33Å; T445-F472 VanDerWaalsContact CG2-O 3.32Å; T445-F472 WeakPolarHBondContact CG2-O 3.48Å; T445-L507 HydrophobicContact CG2-CB 4.39Å; T445-L507 HydrophobicContact CG2-CD1 4.08Å; T445-L507 PolarHBondContact O-N 2.95Å
446	V	87.3	Confident	85.4	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.4	179.2	-170	0	0	0	0	109.8	I415 F472 V504 K505 V506 A527	I415-V446 HydrophobicContact CD1-CB 4.14Å; I415-V446 HydrophobicContact CD1-CG1 3.36Å; V446-F472 PolarHBondContact N-O 2.88Å; V446-F472 VanDerWaalsContact N-O 3.07Å; V446-F472 PolarHBondContact O-N 3.49Å; V446-V504 HydrophobicContact CG1-CG1 3.75Å; V446-K505 WeakPolarHBondContact CA-O 3.44Å; V446-K505 WeakPolarHBondContact CG1-O 3.47Å; V446-V506 HydrophobicContact CG2-CG2 4.38Å; V446-A527 HydrophobicContact CG1-CB 4.1Å
447	S	88.9	Confident	85.1	Confident	13 Å²	13	50.1 Å²	50.1	9%	0.091	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	141.3	175.4	61.6	0	0	0	0	111.4	V470 V504 K505	S447-V470 CarbonylContact C-O 3.5Å; S447-V470 VanDerWaalsContact CA-O 3.29Å; S447-V470 WeakPolarHBondContact CA-O 3.27Å; S447-V504 CarbonylContact O-C 3.58Å; S447-V504 WeakPolarHBondContact O-CA 3.05Å; S447-K505 PolarHBondContact N-O 2.94Å; S447-K505 PolarHBondContact O-N 3.5Å; S447-K505 PolarHBondContact OG-O 3.42Å
448	V	91.8	Very high	85.1	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	140.5	174.2	64.1	0	0	0	0	109.9	I415 V435 V469 V470 F472 L501 S502 V504	I415-V448 HydrophobicContact CG2-CB 4.37Å; I415-V448 HydrophobicContact CG2-CG1 4.06Å; I415-V448 HydrophobicContact CG2-CG2 4.46Å; V435-V448 HydrophobicContact CG1-CG1 4.37Å; V448-V469 CarbonylContact O-C 3.58Å; V448-V469 WeakPolarHBondContact O-CA 3.3Å; V448-V470 HydrophobicContact CG1-CB 3.84Å; V448-V470 HydrophobicContact CG1-CG1 4.4Å; V448-V470 PolarHBondContact N-O 3.11Å; V448-V470 PolarHBondContact O-N 3.42Å; V448-F472 HydrophobicContact CG1-CE2 4.16Å; V448-L501 HydrophobicContact CG1-CD2 4.19Å; V448-L501 HydrophobicContact CG2-CB 3.96Å; V448-L501 HydrophobicContact CG2-CD2 3.85Å; V448-L501 HydrophobicContact CG2-CG 4.37Å; V448-S502 WeakPolarHBondContact CG2-O 3.28Å; V448-V504 HydrophobicContact CB-CG2 4.04Å; V448-V504 HydrophobicContact CG2-CG2 3.67Å
449	E	92.6	Very high	85.3	Confident	62 Å²	62	48.5 Å²	48.5	29%	0.29	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	143.9	178.2	-60.8	174.6	-174	0	0	109.5	G468 V469 L501 S502 N503 K505	E449-G468 CarbonylContact C-O 3.57Å; E449-G468 WeakPolarHBondContact CA-O 3.35Å; E449-V469 HydrophobicContact CG-CG1 4.36Å; E449-V469 HydrophobicContact CG-CG2 4.01Å; E449-L501 CarbonylContact O-C 3.43Å; E449-L501 WeakPolarHBondContact O-CA 3.49Å; E449-S502 PolarHBondContact N-O 3.27Å; E449-S502 PolarHBondContact O-N 3.45Å; E449-N503 HydrophobicContact CB-CB 4.27Å; E449-N503 HydrophobicContact CG-CB 4.03Å; E449-N503 PolarHBondContact OE1-ND2 3.17Å; E449-N503 VanDerWaalsContact OE2-CB 3.25Å; E449-N503 WeakPolarHBondContact OE2-CB 3.3Å; E449-N503 PolarHBondContact OE2-ND2 3.24Å; E449-K505 IonicContact OE1-NZ 2.95Å; E449-K505 PolarHBondContact OE1-NZ 3.33Å
450	Y	94.4	Very high	85.5	Confident	36 Å²	36	49.9 Å²	49.9	14%	0.141	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	151.1	175.8	75.4	-87.3	0	0	0	112.6	T466 E467 G468 V470 I481 I499 H500	Y450-T466 HydrophobicContact CE2-CG2 3.85Å; Y450-E467 WeakPolarHBondContact O-CA 3.48Å; Y450-G468 VanDerWaalsContact CD1-O 3.3Å; Y450-G468 WeakPolarHBondContact CD1-O 2.73Å; Y450-G468 VanDerWaalsContact CE1-C 3.46Å; Y450-G468 PolarHBondContact N-O 2.91Å; Y450-G468 PolarHBondContact O-N 2.74Å; Y450-V470 HydrophobicContact CD1-CG2 3.8Å; Y450-V470 HydrophobicContact CE1-CG2 3.96Å; Y450-I481 HydrophobicContact CD1-CD1 3.7Å; Y450-I481 HydrophobicContact CD1-CG1 4.1Å; Y450-I481 HydrophobicContact CD2-CD1 3.9Å; Y450-I481 HydrophobicContact CD2-CG1 4.46Å; Y450-I481 HydrophobicContact CD2-CG2 3.85Å; Y450-I481 HydrophobicContact CE1-CD1 4.13Å; Y450-I481 HydrophobicContact CE1-CG1 4Å; Y450-I481 HydrophobicContact CE1-CG2 4.31Å; Y450-I481 HydrophobicContact CE2-CD1 4.33Å; Y450-I481 HydrophobicContact CE2-CG1 4.4Å; Y450-I481 HydrophobicContact CE2-CG2 3.34Å; Y450-I481 HydrophobicContact CG-CD1 3.57Å; Y450-I481 HydrophobicContact CG-CG1 4.31Å; Y450-I499 HydrophobicContact CD2-CG2 4.25Å; Y450-H500 WeakPolarHBondContact CA-O 3.41Å
451	R	93.8	Very high	85.8	Confident	124 Å²	124	51.3 Å²	51.3	47%	0.468	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	145.5	175.8	68.8	179.2	-162.8	177.8	10.5	111.3	E453 E467 I499 H500	R451-E453 IonicContact CZ-OE2 3.98Å; R451-E453 IonicContact NE-OE2 2.71Å; R451-E453 IonicContact NH2-OE2 2.79Å; R451-E453 PolarHBondContact NH2-OE2 3.46Å; R451-E467 HydrophobicContact CB-CB 4.36Å; R451-I499 CarbonylContact O-C 3.57Å; R451-I499 WeakPolarHBondContact O-CA 3.09Å; R451-H500 HydrophobicContact CG-CB 4.14Å; R451-H500 PolarHBondContact N-O 3.1Å; R451-H500 VanDerWaalsContact N-O 3.13Å; R451-H500 PolarHBondContact O-N 3.39Å
452	T	94.6	Very high	86.4	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.031	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	147	168.7	56	0	0	0	0	111.2	Y463 F465 T466 V483 F497 L498 I499	T452-Y463 HydrophobicContact CG2-CE2 4.18Å; T452-F465 WeakPolarHBondContact OG1-CD2 2.93Å; T452-T466 PolarHBondContact N-O 3.29Å; T452-T466 PolarHBondContact OG1-N 3.48Å; T452-T466 PolarHBondContact OG1-O 2.83Å; T452-V483 HydrophobicContact CG2-CG1 4.29Å; T452-V483 HydrophobicContact CG2-CG2 4.07Å; T452-F497 HydrophobicContact CG2-CE2 4.31Å; T452-L498 CarbonylContact C-O 3.59Å; T452-L498 VanDerWaalsContact CA-O 3.31Å; T452-L498 WeakPolarHBondContact CA-O 3.07Å; T452-I499 HydrophobicContact CG2-CG1 4.23Å
453	E	92.3	Very high	87.2	Confident	85 Å²	85	43.8 Å²	43.8	40%	0.397	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	133.6	178.2	-175.1	164.6	161.1	0	0	109.4	R451 L498 H500	R451-E453 IonicContact CZ-OE2 3.98Å; R451-E453 IonicContact NE-OE2 2.71Å; R451-E453 IonicContact NH2-OE2 2.79Å; R451-E453 PolarHBondContact NH2-OE2 3.46Å; E453-L498 PolarHBondContact N-O 2.99Å; E453-L498 PolarHBondContact O-N 3.31Å; E453-H500 IonicContact OE2-CD2 3.15Å; E453-H500 PolarHBondContact OE2-CD2 3.16Å; E453-H500 VanDerWaalsContact OE2-CD2 3.25Å; E453-H500 IonicContact OE2-NE2 3.65Å; E453-H500 PolarHBondContact OE2-NE2 2.68Å; E453-H500 VanDerWaalsContact OE2-NE2 3.15Å
454	D	90.2	Very high	88.1	Confident	75 Å²	75	47.1 Å²	47.1	40%	0.401	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	137.5	-178.2	-62.7	-24.2	0	0	0	111.1	A459 Y463	D454-A459 WeakPolarHBondContact OD1-CB 3.48Å; D454-A459 PolarHBondContact OD1-N 3.26Å; D454-Y463 PolarHBondContact N-OH 2.93Å; D454-Y463 PolarHBondContact OD1-OH 2.88Å
455	G	87.1	Confident	88.8	Confident	37 Å²	37	49.8 Å²	49.8	38%	0.381	28%	0.28	S	S	.	.	S	Bend	trans	-111.1	-113.7	171.8	0	0	0	0	0	110	A457 N496	G455-A457 PolarHBondContact N-O 2.85Å; G455-N496 CarbonylContact C-O 3.52Å; G455-N496 WeakPolarHBondContact CA-O 3.35Å; G455-N496 PolarHBondContact N-O 3.4Å
456	T	83.9	Confident	89.1	Confident	74 Å²	74	49.4 Å²	49.4	45%	0.454	28%	0.277	S	S	.	.	S	Bend	trans	-81.5	-31.1	161.9	49	0	0	0	0	111.7	E495 N496	T456-E495 VanDerWaalsContact OG1-CA 3.31Å; T456-E495 WeakPolarHBondContact OG1-CA 3.48Å; T456-N496 PolarHBondContact N-O 3.06Å; T456-N496 PolarHBondContact OG1-N 3.48Å
457	A	86.1	Confident	89.4	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.308	C	S	.	.	S	Bend	trans	-78.1	134.7	171.1	0	0	0	0	0	110.7	G455 D462 Y463 E495 N496 F497 I539	G455-A457 PolarHBondContact N-O 2.85Å; A457-D462 HydrophobicContact CB-CB 4.03Å; A457-Y463 HydrophobicContact CB-CD1 4.16Å; A457-Y463 HydrophobicContact CB-CE1 4.44Å; A457-E495 VanDerWaalsContact CA-OE2 3.27Å; A457-E495 WeakPolarHBondContact CA-OE2 3.49Å; A457-E495 HydrophobicContact CB-CB 3.76Å; A457-N496 WeakPolarHBondContact CB-O 3.49Å; A457-N496 PolarHBondContact N-O 3.3Å; A457-F497 HydrophobicContact CB-CB 4.33Å; A457-F497 HydrophobicContact CB-CD1 4.46Å; A457-I539 HydrophobicContact CB-CD1 4.08Å
458	N	86.6	Confident	89.5	Confident	84 Å²	84	56.6 Å²	56.6	45%	0.449	32%	0.315	S	S	.	.			trans	-104.8	134.5	-178	-79.8	113.6	0	0	0	112.1	G460 S461 D462	N458-G460 PolarHBondContact O-N 3.43Å; N458-S461 VanDerWaalsContact CB-OG 3.3Å; N458-S461 WeakPolarHBondContact CB-OG 3.29Å; N458-S461 PolarHBondContact O-N 2.88Å; N458-S461 PolarHBondContact O-OG 3.36Å; N458-D462 WeakPolarHBondContact CA-OD2 3.44Å; N458-D462 PolarHBondContact N-OD2 3.33Å; N458-D462 PolarHBondContact O-N 2.85Å; N458-D462 VanDerWaalsContact O-N 3.1Å
459	A	88.6	Confident	89.5	Confident	40 Å²	40	60.7 Å²	60.7	33%	0.331	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-64.2	120.3	174.4	0	0	0	0	0	111.8	D454 Y463 F465	D454-A459 WeakPolarHBondContact OD1-CB 3.48Å; D454-A459 PolarHBondContact OD1-N 3.26Å; A459-Y463 CarbonylContact C-O 3.51Å; A459-Y463 WeakPolarHBondContact CA-O 3.5Å; A459-Y463 HydrophobicContact CB-CE1 4.08Å; A459-Y463 HydrophobicContact CB-CE2 4.21Å; A459-F465 HydrophobicContact CB-CB 4.06Å
460	G	82.3	Confident	89.4	Confident	63 Å²	63	58.4 Å²	58.4	65%	0.649	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.9	-14	178.7	0	0	0	0	0	115.4	N458 Y463	N458-G460 PolarHBondContact O-N 3.43Å; G460-Y463 PolarHBondContact N-O 2.9Å
461	S	81.8	Confident	89.1	Confident	58 Å²	58	59.6 Å²	59.6	41%	0.406	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-51.6	162.5	40.4	0	0	0	0	110.2	N458 I486	N458-S461 VanDerWaalsContact CB-OG 3.3Å; N458-S461 WeakPolarHBondContact CB-OG 3.29Å; N458-S461 PolarHBondContact O-N 2.88Å; N458-S461 PolarHBondContact O-OG 3.36Å; S461-I486 VanDerWaalsContact O-CB 3.24Å; S461-I486 WeakPolarHBondContact O-CB 3.35Å; S461-I486 WeakPolarHBondContact O-CD1 3.47Å; S461-I486 WeakPolarHBondContact O-CG2 3.32Å
462	D	85	Confident	88.9	Confident	12 Å²	12	53.7 Å²	53.7	6%	0.064	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-28.1	-164.1	-35.5	-51.4	0	0	0	111.5	A457 N458 I486 E495 I539	A457-D462 HydrophobicContact CB-CB 4.03Å; N458-D462 WeakPolarHBondContact CA-OD2 3.44Å; N458-D462 PolarHBondContact N-OD2 3.33Å; N458-D462 PolarHBondContact O-N 2.85Å; N458-D462 VanDerWaalsContact O-N 3.1Å; D462-I486 PolarHBondContact O-N 3.1Å; D462-E495 VanDerWaalsContact CG-OE2 3.23Å; D462-I539 HydrophobicContact CB-CD1 4.09Å
463	Y	91.9	Very high	88.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-149.5	164.8	175.6	79.4	-80	0	0	0	113.6	T452 D454 A457 A459 G460 V483 G484 F497	T452-Y463 HydrophobicContact CG2-CE2 4.18Å; D454-Y463 PolarHBondContact N-OH 2.93Å; D454-Y463 PolarHBondContact OD1-OH 2.88Å; A457-Y463 HydrophobicContact CB-CD1 4.16Å; A457-Y463 HydrophobicContact CB-CE1 4.44Å; A459-Y463 CarbonylContact C-O 3.51Å; A459-Y463 WeakPolarHBondContact CA-O 3.5Å; A459-Y463 HydrophobicContact CB-CE1 4.08Å; A459-Y463 HydrophobicContact CB-CE2 4.21Å; G460-Y463 PolarHBondContact N-O 2.9Å; Y463-V483 HydrophobicContact CD2-CG1 3.94Å; Y463-G484 CarbonylContact C-O 3.57Å; Y463-G484 WeakPolarHBondContact CA-O 3.26Å; Y463-G484 WeakPolarHBondContact CB-O 3.44Å; Y463-F497 HydrophobicContact CD1-CB 4.04Å; Y463-F497 AromaticContact CD1-CD1 3.87Å; Y463-F497 HydrophobicContact CD1-CD1 3.87Å; Y463-F497 HydrophobicContact CD1-CE1 4.47Å; Y463-F497 AromaticContact CD1-CG 3.94Å; Y463-F497 HydrophobicContact CD1-CG 3.94Å; Y463-F497 HydrophobicContact CD2-CD1 4.35Å; Y463-F497 HydrophobicContact CD2-CD2 4.04Å; Y463-F497 HydrophobicContact CD2-CE1 4.39Å; Y463-F497 HydrophobicContact CD2-CE2 4.1Å; Y463-F497 HydrophobicContact CD2-CG 4.17Å; Y463-F497 HydrophobicContact CD2-CZ 4.26Å; Y463-F497 HydrophobicContact CE1-CB 3.58Å; Y463-F497 HydrophobicContact CE1-CD1 4.29Å; Y463-F497 HydrophobicContact CE1-CD2 4.45Å; Y463-F497 AromaticContact CE1-CG 3.88Å; Y463-F497 HydrophobicContact CE1-CG 3.88Å; Y463-F497 HydrophobicContact CE2-CB 4.42Å; Y463-F497 AromaticContact CE2-CD2 3.87Å; Y463-F497 HydrophobicContact CE2-CD2 3.87Å; Y463-F497 HydrophobicContact CE2-CE2 4.27Å; Y463-F497 HydrophobicContact CE2-CG 4.11Å; Y463-F497 AromaticContact CG-CD1 3.91Å; Y463-F497 HydrophobicContact CG-CD1 3.91Å; Y463-F497 HydrophobicContact CG-CD2 4.41Å; Y463-F497 HydrophobicContact CG-CE1 4.07Å; Y463-F497 HydrophobicContact CG-CG 4.09Å; Y463-F497 HydrophobicContact CG-CZ 4.38Å; Y463-F497 AromaticContact CZ-CG 3.97Å
464	E	91.6	Very high	88.1	Confident	120 Å²	120	59.3 Å²	59.3	56%	0.561	35%	0.35	S	S	*	.			trans	-91.6	127.8	177.5	-65.9	-172.1	161.4	0	0	112.7	T466 G484	E464-T466 PolarHBondContact O-N 2.96Å; E464-T466 PolarHBondContact O-OG1 3.02Å; E464-T466 VanDerWaalsContact O-OG1 3.07Å; E464-G484 PolarHBondContact N-O 2.98Å
465	F	91	Very high	87.5	Confident	122 Å²	122	58.4 Å²	58.4	54%	0.535	36%	0.358	S	S	.	.			trans	-60	124.7	176.2	179.6	-98.1	0	0	0	112.1	T452 A459 E467	T452-F465 WeakPolarHBondContact OG1-CD2 2.93Å; A459-F465 HydrophobicContact CB-CB 4.06Å; F465-E467 HydrophobicContact CE1-CB 4.43Å; F465-E467 HydrophobicContact CE1-CG 4.14Å
466	T	90.2	Very high	87.5	Confident	27 Å²	27	59.2 Å²	59.2	17%	0.166	35%	0.352	C	S	.	.			trans	-133.7	127.3	-175.6	-50	0	0	0	0	112.2	Y450 T452 E464	Y450-T466 HydrophobicContact CE2-CG2 3.85Å; T452-T466 PolarHBondContact N-O 3.29Å; T452-T466 PolarHBondContact OG1-N 3.48Å; T452-T466 PolarHBondContact OG1-O 2.83Å; E464-T466 PolarHBondContact O-N 2.96Å; E464-T466 PolarHBondContact O-OG1 3.02Å; E464-T466 VanDerWaalsContact O-OG1 3.07Å
467	E	93.4	Very high	87.6	Confident	140 Å²	140	59 Å²	59	65%	0.654	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.1	148.1	171.1	65.6	175.6	-176.3	0	0	111.7	Y450 R451 F465	Y450-E467 WeakPolarHBondContact O-CA 3.48Å; R451-E467 HydrophobicContact CB-CB 4.36Å; F465-E467 HydrophobicContact CE1-CB 4.43Å; F465-E467 HydrophobicContact CE1-CG 4.14Å
468	G	90.8	Very high	87.7	Confident	24 Å²	24	64 Å²	64	25%	0.247	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.3	-175.6	-177.3	0	0	0	0	0	116	E449 Y450	E449-G468 CarbonylContact C-O 3.57Å; E449-G468 WeakPolarHBondContact CA-O 3.35Å; Y450-G468 VanDerWaalsContact CD1-O 3.3Å; Y450-G468 WeakPolarHBondContact CD1-O 2.73Å; Y450-G468 VanDerWaalsContact CE1-C 3.46Å; Y450-G468 PolarHBondContact N-O 2.91Å; Y450-G468 PolarHBondContact O-N 2.74Å
469	V	90.6	Very high	88	Confident	87 Å²	87	63 Å²	63	53%	0.527	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	125.6	179.1	-169.6	0	0	0	0	110.3	V448 E449 V471	V448-V469 CarbonylContact O-C 3.58Å; V448-V469 WeakPolarHBondContact O-CA 3.3Å; E449-V469 HydrophobicContact CG-CG1 4.36Å; E449-V469 HydrophobicContact CG-CG2 4.01Å; V469-V471 HydrophobicContact CG1-CG2 4.4Å
470	V	90.6	Very high	88.1	Confident	13 Å²	13	65.4 Å²	65.4	8%	0.079	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	123.4	175	177.4	0	0	0	0	109.2	S447 V448 Y450 F472 K479 I481	S447-V470 CarbonylContact C-O 3.5Å; S447-V470 VanDerWaalsContact CA-O 3.29Å; S447-V470 WeakPolarHBondContact CA-O 3.27Å; V448-V470 HydrophobicContact CG1-CB 3.84Å; V448-V470 HydrophobicContact CG1-CG1 4.4Å; V448-V470 PolarHBondContact N-O 3.11Å; V448-V470 PolarHBondContact O-N 3.42Å; Y450-V470 HydrophobicContact CD1-CG2 3.8Å; Y450-V470 HydrophobicContact CE1-CG2 3.96Å; V470-F472 HydrophobicContact CG1-CD2 4.29Å; V470-F472 HydrophobicContact CG1-CE2 3.75Å; V470-F472 HydrophobicContact CG1-CZ 4.08Å; V470-K479 HydrophobicContact CG1-CB 3.41Å; V470-K479 VanDerWaalsContact CG1-CB 3.41Å; V470-K479 HydrophobicContact CG1-CG 3.61Å; V470-I481 HydrophobicContact CG2-CD1 4.06Å; V470-I481 HydrophobicContact CG2-CG1 3.88Å
471	V	89.9	Confident	88.6	Confident	62 Å²	62	62.6 Å²	62.6	38%	0.376	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	119.3	179.3	-177.6	0	0	0	0	110	T445 V469 K479	T445-V471 HydrophobicContact CG2-CG1 3.71Å; V469-V471 HydrophobicContact CG1-CG2 4.4Å; V471-K479 WeakPolarHBondContact O-CE 3.35Å
472	F	89.4	Confident	89.1	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	110.9	172.1	-66.6	-90.2	0	0	0	109.8	I415 V435 R437 T445 V446 V448 V470 E476 K479	I415-F472 HydrophobicContact CD1-CD2 4.43Å; I415-F472 HydrophobicContact CD1-CE2 4.44Å; I415-F472 HydrophobicContact CG2-CE2 4.22Å; V435-F472 HydrophobicContact CB-CZ 4.17Å; V435-F472 HydrophobicContact CG1-CE2 4.17Å; V435-F472 HydrophobicContact CG1-CZ 3.86Å; V435-F472 WeakPolarHBondContact O-CZ 3.44Å; R437-F472 HydrophobicContact CB-CD1 4.15Å; R437-F472 HydrophobicContact CB-CE1 4.12Å; R437-F472 HydrophobicContact CB-CZ 4.48Å; T445-F472 VanDerWaalsContact CA-O 3.29Å; T445-F472 WeakPolarHBondContact CA-O 3.33Å; T445-F472 VanDerWaalsContact CG2-O 3.32Å; T445-F472 WeakPolarHBondContact CG2-O 3.48Å; V446-F472 PolarHBondContact N-O 2.88Å; V446-F472 VanDerWaalsContact N-O 3.07Å; V446-F472 PolarHBondContact O-N 3.49Å; V448-F472 HydrophobicContact CG1-CE2 4.16Å; V470-F472 HydrophobicContact CG1-CD2 4.29Å; V470-F472 HydrophobicContact CG1-CE2 3.75Å; V470-F472 HydrophobicContact CG1-CZ 4.08Å; F472-E476 HydrophobicContact CD1-CB 4.49Å; F472-K479 HydrophobicContact CD1-CG 3.99Å; F472-K479 HydrophobicContact CE1-CB 4.08Å; F472-K479 HydrophobicContact CE1-CG 3.75Å; F472-K479 HydrophobicContact CZ-CB 4.11Å; F472-K479 HydrophobicContact CZ-CG 4.1Å
473	K	86.6	Confident	89.4	Confident	130 Å²	130	66.5 Å²	66.5	57%	0.565	35%	0.347	S	S	*	.			trans	-72.8	165.9	172.1	-63	179.8	-179.5	174.9	0	110.8	G475 E476	K473-G475 PolarHBondContact O-N 3.07Å; K473-E476 HydrophobicContact CB-CG 4.07Å; K473-E476 WeakPolarHBondContact CB-OE2 3.26Å; K473-E476 PolarHBondContact N-OE2 3.39Å; K473-E476 WeakPolarHBondContact O-CB 3.49Å; K473-E476 PolarHBondContact O-N 3.42Å
474	P	81.7	Confident	89.4	Confident	77 Å²	77	66.9 Å²	66.9	50%	0.5	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	128.3	176.3	-26.4	36.5	0	0	0	111.5	L442 G443 E476	L442-P474 CarbonylContact O-C 3.56Å; L442-P474 WeakPolarHBondContact O-CA 3.41Å; G443-P474 WeakPolarHBondContact O-CG 3.4Å; P474-E476 VanDerWaalsContact C-N 3.34Å
475	G	79	Confident	89.4	Confident	56 Å²	56	61.8 Å²	61.8	58%	0.577	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	-2.5	-177	0	0	0	0	0	116.4	L442 K473	L442-G475 PolarHBondContact O-N 3.21Å; K473-G475 PolarHBondContact O-N 3.07Å
476	E	86.1	Confident	89.3	Confident	54 Å²	54	58.6 Å²	58.6	25%	0.252	32%	0.315	S	S	.	.			trans	-87.7	125.3	174.4	-63.8	-178.1	155.3	0	0	111	F472 K473 P474 K479	F472-E476 HydrophobicContact CD1-CB 4.49Å; K473-E476 HydrophobicContact CB-CG 4.07Å; K473-E476 WeakPolarHBondContact CB-OE2 3.26Å; K473-E476 PolarHBondContact N-OE2 3.39Å; K473-E476 WeakPolarHBondContact O-CB 3.49Å; K473-E476 PolarHBondContact O-N 3.42Å; P474-E476 VanDerWaalsContact C-N 3.34Å; E476-K479 IonicContact OE1-NZ 2.71Å; E476-K479 PolarHBondContact OE1-NZ 3.04Å; E476-K479 WeakPolarHBondContact OE2-CE 3.42Å; E476-K479 IonicContact OE2-NZ 3.53Å; E476-K479 PolarHBondContact OE2-NZ 3.33Å
477	T	85.8	Confident	89	Confident	71 Å²	71	61.7 Å²	61.7	44%	0.436	33%	0.331	S	S	.	.			trans	-109.3	-14	-178.7	50.7	0	0	0	0	114.1	V436 R437 L442	V436-T477 WeakPolarHBondContact CA-O 3.37Å; R437-T477 PolarHBondContact N-O 3.46Å; L442-T477 HydrophobicContact CD2-CG2 3.61Å
478	M	89.8	Confident	88.3	Confident	105 Å²	105	57.8 Å²	57.8	52%	0.517	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	139.8	-176.1	-176	-179.9	-80.6	0	0	111.9	V435 V436	V435-M478 WeakPolarHBondContact O-CA 3.37Å; V436-M478 HydrophobicContact CG2-CE 3.76Å; V436-M478 HydrophobicContact CG2-CG 4.3Å
479	K	91.1	Very high	87.4	Confident	62 Å²	62	64 Å²	64	27%	0.27	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	148.6	173.3	-73.4	-67.1	-173.2	-166.2	0	110.9	N434 V435 V470 V471 F472 E476	N434-K479 WeakPolarHBondContact CA-O 3.38Å; V435-K479 PolarHBondContact N-O 3.37Å; V435-K479 PolarHBondContact O-N 3.2Å; V470-K479 HydrophobicContact CG1-CB 3.41Å; V470-K479 VanDerWaalsContact CG1-CB 3.41Å; V470-K479 HydrophobicContact CG1-CG 3.61Å; V471-K479 WeakPolarHBondContact O-CE 3.35Å; F472-K479 HydrophobicContact CD1-CG 3.99Å; F472-K479 HydrophobicContact CE1-CB 4.08Å; F472-K479 HydrophobicContact CE1-CG 3.75Å; F472-K479 HydrophobicContact CZ-CB 4.11Å; F472-K479 HydrophobicContact CZ-CG 4.1Å; E476-K479 IonicContact OE1-NZ 2.71Å; E476-K479 PolarHBondContact OE1-NZ 3.04Å; E476-K479 WeakPolarHBondContact OE2-CE 3.42Å; E476-K479 IonicContact OE2-NZ 3.53Å; E476-K479 PolarHBondContact OE2-NZ 3.33Å
480	E	91.4	Very high	86.6	Confident	91 Å²	91	64.9 Å²	64.9	43%	0.425	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	135.4	-178	-173.5	-171.8	-132.9	0	0	110.4	A432 V433 R482	A432-E480 HydrophobicContact CB-CG 3.88Å; A432-E480 WeakPolarHBondContact CB-OE1 3.2Å; V433-E480 CarbonylContact O-C 3.52Å; V433-E480 WeakPolarHBondContact O-CA 3.34Å; E480-R482 IonicContact OE1-NH2 3.44Å; E480-R482 PolarHBondContact OE1-NH2 2.93Å; E480-R482 IonicContact OE2-CZ 3.35Å; E480-R482 IonicContact OE2-NE 3.01Å; E480-R482 PolarHBondContact OE2-NE 3.29Å; E480-R482 IonicContact OE2-NH2 2.81Å; E480-R482 PolarHBondContact OE2-NH2 2.96Å
481	I	92.4	Very high	85.6	Confident	4 Å²	4	69.6 Å²	69.6	2%	0.021	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138.2	170.5	-63.6	166.4	0	0	0	107.6	F417 A432 V433 V435 Y450 V470 V483	F417-I481 HydrophobicContact CE1-CD1 4.22Å; A432-I481 CarbonylContact C-O 3.58Å; A432-I481 WeakPolarHBondContact CA-O 3.3Å; V433-I481 HydrophobicContact CB-CB 4.43Å; V433-I481 PolarHBondContact N-O 3.36Å; V433-I481 PolarHBondContact O-N 2.54Å; V435-I481 HydrophobicContact CG2-CD1 3.51Å; V435-I481 HydrophobicContact CG2-CG1 4.22Å; Y450-I481 HydrophobicContact CD1-CD1 3.7Å; Y450-I481 HydrophobicContact CD1-CG1 4.1Å; Y450-I481 HydrophobicContact CD2-CD1 3.9Å; Y450-I481 HydrophobicContact CD2-CG1 4.46Å; Y450-I481 HydrophobicContact CD2-CG2 3.85Å; Y450-I481 HydrophobicContact CE1-CD1 4.13Å; Y450-I481 HydrophobicContact CE1-CG1 4Å; Y450-I481 HydrophobicContact CE1-CG2 4.31Å; Y450-I481 HydrophobicContact CE2-CD1 4.33Å; Y450-I481 HydrophobicContact CE2-CG1 4.4Å; Y450-I481 HydrophobicContact CE2-CG2 3.34Å; Y450-I481 HydrophobicContact CG-CD1 3.57Å; Y450-I481 HydrophobicContact CG-CG1 4.31Å; V470-I481 HydrophobicContact CG2-CD1 4.06Å; V470-I481 HydrophobicContact CG2-CG1 3.88Å; I481-V483 HydrophobicContact CG2-CG2 4.39Å
482	R	92.2	Very high	84.9	Confident	150 Å²	150	69.5 Å²	69.5	57%	0.566	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.6	178.3	-66	176.5	177	-116.4	-8.8	110.3	V431 E480	V431-R482 WeakPolarHBondContact O-CA 3.34Å; E480-R482 IonicContact OE1-NH2 3.44Å; E480-R482 PolarHBondContact OE1-NH2 2.93Å; E480-R482 IonicContact OE2-CZ 3.35Å; E480-R482 IonicContact OE2-NE 3.01Å; E480-R482 PolarHBondContact OE2-NE 3.29Å; E480-R482 IonicContact OE2-NH2 2.81Å; E480-R482 PolarHBondContact OE2-NH2 2.96Å
483	V	93	Very high	84.2	Confident	1 Å²	1	77.4 Å²	77.4	1%	0.006	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	134.6	177.1	-177.7	0	0	0	0	108.3	T430 V431 T452 Y463 I481 F497 I499	T430-V483 CarbonylContact C-O 3.57Å; T430-V483 VanDerWaalsContact CA-O 3.24Å; T430-V483 WeakPolarHBondContact CA-O 3.29Å; V431-V483 HydrophobicContact CG1-CB 3.84Å; V431-V483 PolarHBondContact N-O 3.33Å; V431-V483 PolarHBondContact O-N 3.43Å; T452-V483 HydrophobicContact CG2-CG1 4.29Å; T452-V483 HydrophobicContact CG2-CG2 4.07Å; Y463-V483 HydrophobicContact CD2-CG1 3.94Å; I481-V483 HydrophobicContact CG2-CG2 4.39Å; V483-F497 HydrophobicContact CB-CZ 4.44Å; V483-F497 HydrophobicContact CG1-CE2 4.01Å; V483-F497 HydrophobicContact CG1-CZ 3.93Å; V483-I499 HydrophobicContact CG2-CD1 3.88Å
484	G	90.1	Very high	83.9	Confident	9 Å²	9	74.9 Å²	74.9	9%	0.093	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	137.2	177.6	0	0	0	0	0	111.8	G429 Y463 E464	G429-G484 WeakPolarHBondContact O-CA 3.27Å; Y463-G484 CarbonylContact C-O 3.57Å; Y463-G484 WeakPolarHBondContact CA-O 3.26Å; Y463-G484 WeakPolarHBondContact CB-O 3.44Å; E464-G484 PolarHBondContact N-O 2.98Å
485	I	92.6	Very high	84.1	Confident	12 Å²	12	73.1 Å²	73.1	6%	0.062	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-110.6	135.7	174.2	-53.9	-58.1	0	0	0	107.7	E426 G429 V431 F497 I539	E426-I485 WeakPolarHBondContact O-CG2 3.4Å; G429-I485 PolarHBondContact O-N 2.88Å; V431-I485 HydrophobicContact CB-CD1 4.46Å; V431-I485 HydrophobicContact CB-CG1 4.31Å; V431-I485 HydrophobicContact CG1-CD1 3.95Å; V431-I485 HydrophobicContact CG1-CG1 4.25Å; I485-F497 HydrophobicContact CD1-CE1 3.84Å; I485-F497 HydrophobicContact CD1-CZ 4.11Å; I485-I539 HydrophobicContact CD1-CD1 4.21Å; I485-I539 HydrophobicContact CD1-CG1 4.36Å; I485-I539 HydrophobicContact CG2-CD1 4.38Å; I485-I539 HydrophobicContact CG2-CG2 4.28Å
486	I	88.5	Confident	84.6	Confident	55 Å²	55	73.1 Å²	73.1	28%	0.282	36%	0.359	S	S	.	.			trans	-96.7	141.7	-179	-58	170.7	0	0	0	107.6	E426 S461 D462	E426-I486 VanDerWaalsContact CG-O 3.23Å; E426-I486 WeakPolarHBondContact CG-O 3.13Å; S461-I486 VanDerWaalsContact O-CB 3.24Å; S461-I486 WeakPolarHBondContact O-CB 3.35Å; S461-I486 WeakPolarHBondContact O-CD1 3.47Å; S461-I486 WeakPolarHBondContact O-CG2 3.32Å; D462-I486 PolarHBondContact O-N 3.1Å
487	D	83.8	Confident	85	Confident	93 Å²	93	70.6 Å²	70.6	50%	0.497	35%	0.347	S	S	.	.			trans	-122	125.8	-170.6	-176.3	49.2	0	0	0	110.5	E426 N427	E426-D487 WeakPolarHBondContact OE1-CA 3.21Å; N427-D487 VanDerWaalsContact CA-OD1 3.28Å; N427-D487 WeakPolarHBondContact CA-OD1 3.21Å; N427-D487 WeakPolarHBondContact CB-OD1 3.05Å; N427-D487 PolarHBondContact N-OD1 2.92Å
488	D	78.9	Confident	85.4	Confident	58 Å²	58	69.4 Å²	69.4	31%	0.31	34%	0.338	S	S	.	.			trans	-129.9	-170.6	173.4	89.1	38	0	0	0	114.5	E426 I490	E426-D488 PolarHBondContact OE1-N 3.43Å; D488-I490 WeakPolarHBondContact OD1-CB 3.14Å; D488-I490 PolarHBondContact OD1-N 3.33Å
489	D	72.8	Confident	85.6	Confident	155 Å²	155	64.4 Å²	64.4	83%	0.829	31%	0.314	S	S	*	.	S	Bend	trans	-120.3	20.3	-172.6	-72.5	-51.7	0	0	0	111.1	D543	D489-D543 VanDerWaalsContact C-OD2 3.31Å
490	I	72.4	Confident	85.6	Confident	105 Å²	105	63.3 Å²	63.3	54%	0.538	31%	0.31	S	S	.	.	S	Bend	trans	-111.5	124.9	-175.6	-57.3	175.2	0	0	0	108.4	D488 E492	D488-I490 WeakPolarHBondContact OD1-CB 3.14Å; D488-I490 PolarHBondContact OD1-N 3.33Å; I490-E492 PolarHBondContact O-N 3.08Å
491	F	69.4	Low	85.6	Confident	112 Å²	112	59.6 Å²	59.6	49%	0.491	29%	0.293	S	S	.	.			trans	-61.2	124.2	173.9	174.9	-95.5	0	0	0	111.8	D541 D543 H544	F491-D541 WeakPolarHBondContact CA-OD2 3.22Å; F491-D541 WeakPolarHBondContact CD2-OD2 3.24Å; F491-D541 WeakPolarHBondContact CE2-OD2 3.43Å; F491-D543 HydrophobicContact CB-CB 4.26Å; F491-D543 HydrophobicContact CD2-CB 4.33Å; F491-H544 HydrophobicContact CD2-CB 4.41Å; F491-H544 HydrophobicContact CE2-CB 3.95Å
492	E	76.2	Confident	85.3	Confident	59 Å²	59	61.8 Å²	61.8	28%	0.276	31%	0.308	S	S	.	.			trans	-128.3	162.3	-179.2	-69	-173.8	143.1	0	0	111.1	I490 D541	I490-E492 PolarHBondContact O-N 3.08Å; E492-D541 PolarHBondContact N-OD2 3.27Å
493	E	74.1	Confident	84.7	Confident	167 Å²	167	58.4 Å²	58.4	78%	0.78	30%	0.301	S	S	*	.			trans	-81	157.6	174.4	-66.2	-174.6	178.3	0	0	110.1	E495	E493-E495 WeakPolarHBondContact O-CG 3.45Å; E493-E495 PolarHBondContact O-N 3Å; E493-E495 VanDerWaalsContact O-N 3.07Å
494	D	80.3	Confident	84.3	Confident	76 Å²	76	59.7 Å²	59.7	41%	0.406	31%	0.309	S	S	.	.			trans	-56.4	116.8	178.5	-63.8	-15.6	0	0	0	111.8	T538 F540	D494-T538 HydrophobicContact CB-CG2 4.38Å; D494-F540 HydrophobicContact CB-CD1 4.37Å; D494-F540 HydrophobicContact CB-CE1 4.44Å; D494-F540 VanDerWaalsContact CG-CD1 3.47Å; D494-F540 VanDerWaalsContact OD1-CD1 3.31Å; D494-F540 WeakPolarHBondContact OD1-CD1 3.23Å; D494-F540 VanDerWaalsContact OD2-CE1 3.29Å; D494-F540 WeakPolarHBondContact OD2-CE1 3.31Å
495	E	86.4	Confident	83.8	Confident	41 Å²	41	63.8 Å²	63.8	19%	0.192	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	157.2	-176.7	-52.8	-156.7	138.8	0	0	112.6	T456 A457 D462 E493 T538 I539	T456-E495 VanDerWaalsContact OG1-CA 3.31Å; T456-E495 WeakPolarHBondContact OG1-CA 3.48Å; A457-E495 VanDerWaalsContact CA-OE2 3.27Å; A457-E495 WeakPolarHBondContact CA-OE2 3.49Å; A457-E495 HydrophobicContact CB-CB 3.76Å; D462-E495 VanDerWaalsContact CG-OE2 3.23Å; E493-E495 WeakPolarHBondContact O-CG 3.45Å; E493-E495 PolarHBondContact O-N 3Å; E493-E495 VanDerWaalsContact O-N 3.07Å; E495-T538 CarbonylContact O-C 3.58Å; E495-T538 WeakPolarHBondContact O-CA 3.39Å; E495-I539 PolarHBondContact N-O 3.46Å; E495-I539 VanDerWaalsContact N-O 3.15Å; E495-I539 PolarHBondContact O-N 2.82Å
496	N	90.4	Very high	83.1	Confident	56 Å²	56	65.3 Å²	65.3	30%	0.299	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	150.6	178.3	62.2	55.8	0	0	0	113.5	G455 T456 A457 T536 V537	G455-N496 CarbonylContact C-O 3.52Å; G455-N496 WeakPolarHBondContact CA-O 3.35Å; G455-N496 PolarHBondContact N-O 3.4Å; T456-N496 PolarHBondContact N-O 3.06Å; T456-N496 PolarHBondContact OG1-N 3.48Å; A457-N496 WeakPolarHBondContact CB-O 3.49Å; A457-N496 PolarHBondContact N-O 3.3Å; N496-T536 HydrophobicContact CB-CG2 4.17Å; N496-V537 WeakPolarHBondContact CA-O 3.08Å; N496-V537 WeakPolarHBondContact CB-O 3.25Å
497	F	93.8	Very high	82.2	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	162.8	167.8	69.8	-88	0	0	0	110.2	V431 T452 A457 Y463 V483 I485 I499 V537 I539	V431-F497 HydrophobicContact CG1-CZ 4.22Å; T452-F497 HydrophobicContact CG2-CE2 4.31Å; A457-F497 HydrophobicContact CB-CB 4.33Å; A457-F497 HydrophobicContact CB-CD1 4.46Å; Y463-F497 HydrophobicContact CD1-CB 4.04Å; Y463-F497 AromaticContact CD1-CD1 3.87Å; Y463-F497 HydrophobicContact CD1-CD1 3.87Å; Y463-F497 HydrophobicContact CD1-CE1 4.47Å; Y463-F497 AromaticContact CD1-CG 3.94Å; Y463-F497 HydrophobicContact CD1-CG 3.94Å; Y463-F497 HydrophobicContact CD2-CD1 4.35Å; Y463-F497 HydrophobicContact CD2-CD2 4.04Å; Y463-F497 HydrophobicContact CD2-CE1 4.39Å; Y463-F497 HydrophobicContact CD2-CE2 4.1Å; Y463-F497 HydrophobicContact CD2-CG 4.17Å; Y463-F497 HydrophobicContact CD2-CZ 4.26Å; Y463-F497 HydrophobicContact CE1-CB 3.58Å; Y463-F497 HydrophobicContact CE1-CD1 4.29Å; Y463-F497 HydrophobicContact CE1-CD2 4.45Å; Y463-F497 AromaticContact CE1-CG 3.88Å; Y463-F497 HydrophobicContact CE1-CG 3.88Å; Y463-F497 HydrophobicContact CE2-CB 4.42Å; Y463-F497 AromaticContact CE2-CD2 3.87Å; Y463-F497 HydrophobicContact CE2-CD2 3.87Å; Y463-F497 HydrophobicContact CE2-CE2 4.27Å; Y463-F497 HydrophobicContact CE2-CG 4.11Å; Y463-F497 AromaticContact CG-CD1 3.91Å; Y463-F497 HydrophobicContact CG-CD1 3.91Å; Y463-F497 HydrophobicContact CG-CD2 4.41Å; Y463-F497 HydrophobicContact CG-CE1 4.07Å; Y463-F497 HydrophobicContact CG-CG 4.09Å; Y463-F497 HydrophobicContact CG-CZ 4.38Å; Y463-F497 AromaticContact CZ-CG 3.97Å; V483-F497 HydrophobicContact CB-CZ 4.44Å; V483-F497 HydrophobicContact CG1-CE2 4.01Å; V483-F497 HydrophobicContact CG1-CZ 3.93Å; I485-F497 HydrophobicContact CD1-CE1 3.84Å; I485-F497 HydrophobicContact CD1-CZ 4.11Å; F497-I499 HydrophobicContact CD2-CG1 4.37Å; F497-I499 HydrophobicContact CE2-CD1 4.15Å; F497-I499 HydrophobicContact CE2-CG1 4Å; F497-V537 HydrophobicContact CD1-CB 4Å; F497-V537 HydrophobicContact CD1-CG1 4.37Å; F497-V537 HydrophobicContact CD2-CB 4.35Å; F497-V537 HydrophobicContact CD2-CG2 4.42Å; F497-V537 HydrophobicContact CE1-CB 3.54Å; F497-V537 HydrophobicContact CE1-CG1 3.54Å; F497-V537 HydrophobicContact CE1-CG2 4.24Å; F497-V537 HydrophobicContact CE2-CB 3.92Å; F497-V537 HydrophobicContact CE2-CG2 3.75Å; F497-V537 HydrophobicContact CG-CB 4.4Å; F497-V537 HydrophobicContact CZ-CB 3.5Å; F497-V537 VanDerWaalsContact CZ-CB 3.5Å; F497-V537 HydrophobicContact CZ-CG1 3.64Å; F497-V537 HydrophobicContact CZ-CG2 3.66Å; F497-V537 PolarHBondContact N-O 3.26Å; F497-V537 PolarHBondContact O-N 3.49Å; F497-I539 HydrophobicContact CD1-CD1 4.05Å; F497-I539 HydrophobicContact CD1-CG1 4.32Å; F497-I539 HydrophobicContact CE1-CD1 4.04Å; F497-I539 HydrophobicContact CE1-CG1 4.15Å
498	L	93.4	Very high	81	Confident	47 Å²	47	67.8 Å²	67.8	25%	0.246	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	148.7	-175	-59.6	99.9	0	0	0	111.8	T452 E453 T534 A535	T452-L498 CarbonylContact C-O 3.59Å; T452-L498 VanDerWaalsContact CA-O 3.31Å; T452-L498 WeakPolarHBondContact CA-O 3.07Å; E453-L498 PolarHBondContact N-O 2.99Å; E453-L498 PolarHBondContact O-N 3.31Å; L498-T534 HydrophobicContact CB-CG2 3.93Å; L498-T534 HydrophobicContact CD2-CG2 3.69Å; L498-T534 HydrophobicContact CG-CG2 4.4Å; L498-A535 CarbonylContact C-O 3.59Å; L498-A535 WeakPolarHBondContact CA-O 3.44Å
499	I	93.9	Very high	79.4	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.7	172.4	-46.3	-174.8	0	0	0	108.8	F417 V433 Y450 R451 T452 V483 F497 T534 A535 V537	F417-I499 HydrophobicContact CE1-CG2 4.49Å; F417-I499 WeakPolarHBondContact CE2-O 3.45Å; F417-I499 HydrophobicContact CZ-CB 4.08Å; F417-I499 HydrophobicContact CZ-CG2 3.81Å; V433-I499 HydrophobicContact CB-CD1 4.28Å; V433-I499 HydrophobicContact CG1-CD1 4.3Å; V433-I499 HydrophobicContact CG2-CD1 3.8Å; Y450-I499 HydrophobicContact CD2-CG2 4.25Å; R451-I499 CarbonylContact O-C 3.57Å; R451-I499 WeakPolarHBondContact O-CA 3.09Å; T452-I499 HydrophobicContact CG2-CG1 4.23Å; V483-I499 HydrophobicContact CG2-CD1 3.88Å; F497-I499 HydrophobicContact CD2-CG1 4.37Å; F497-I499 HydrophobicContact CE2-CD1 4.15Å; F497-I499 HydrophobicContact CE2-CG1 4Å; I499-T534 CarbonylContact O-C 3.56Å; I499-T534 WeakPolarHBondContact O-CA 3.44Å; I499-A535 HydrophobicContact CB-CB 4.44Å; I499-A535 PolarHBondContact N-O 2.67Å; I499-A535 PolarHBondContact O-N 2.98Å; I499-V537 HydrophobicContact CD1-CG2 4.04Å; I499-V537 HydrophobicContact CG1-CG2 4.28Å
500	H	91.4	Very high	77.9	Confident	39 Å²	39	73 Å²	73	18%	0.181	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	135.2	-176.5	-65.4	-72.5	0	0	0	112.3	Y450 R451 E453 T534	Y450-H500 WeakPolarHBondContact CA-O 3.41Å; R451-H500 HydrophobicContact CG-CB 4.14Å; R451-H500 PolarHBondContact N-O 3.1Å; R451-H500 VanDerWaalsContact N-O 3.13Å; R451-H500 PolarHBondContact O-N 3.39Å; E453-H500 IonicContact OE2-CD2 3.15Å; E453-H500 PolarHBondContact OE2-CD2 3.16Å; E453-H500 VanDerWaalsContact OE2-CD2 3.25Å; E453-H500 IonicContact OE2-NE2 3.65Å; E453-H500 PolarHBondContact OE2-NE2 2.68Å; E453-H500 VanDerWaalsContact OE2-NE2 3.15Å; H500-T534 WeakPolarHBondContact CE1-CG2 3.38Å; H500-T534 PolarHBondContact CE1-OG1 3.25Å; H500-T534 WeakPolarHBondContact ND1-CG2 3.2Å; H500-T534 PolarHBondContact ND1-OG1 3.2Å
501	L	91.5	Very high	76.5	Confident	13 Å²	13	71.7 Å²	71.7	7%	0.068	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	134.7	166.7	-65.1	169.9	0	0	0	110.8	I415 F417 V435 V448 E449 V529 S533	I415-L501 HydrophobicContact CG2-CD1 4.47Å; F417-L501 HydrophobicContact CD1-CD1 4.46Å; F417-L501 HydrophobicContact CD2-CD1 3.79Å; F417-L501 HydrophobicContact CD2-CG 4.08Å; F417-L501 HydrophobicContact CE1-CD1 4.33Å; F417-L501 HydrophobicContact CE1-CD2 4.31Å; F417-L501 HydrophobicContact CE1-CG 4.28Å; F417-L501 HydrophobicContact CE2-CB 4.44Å; F417-L501 HydrophobicContact CE2-CD1 3.68Å; F417-L501 HydrophobicContact CE2-CD2 4.24Å; F417-L501 HydrophobicContact CE2-CG 3.43Å; F417-L501 VanDerWaalsContact CE2-CG 3.43Å; F417-L501 HydrophobicContact CG-CD1 4.2Å; F417-L501 HydrophobicContact CZ-CD1 3.96Å; F417-L501 HydrophobicContact CZ-CD2 3.82Å; F417-L501 HydrophobicContact CZ-CG 3.54Å; V435-L501 HydrophobicContact CG1-CD1 3.99Å; V435-L501 HydrophobicContact CG1-CD2 4.28Å; V435-L501 HydrophobicContact CG2-CD2 4.12Å; V448-L501 HydrophobicContact CG1-CD2 4.19Å; V448-L501 HydrophobicContact CG2-CB 3.96Å; V448-L501 HydrophobicContact CG2-CD2 3.85Å; V448-L501 HydrophobicContact CG2-CG 4.37Å; E449-L501 CarbonylContact O-C 3.43Å; E449-L501 WeakPolarHBondContact O-CA 3.49Å; L501-V529 HydrophobicContact CB-CG1 4.25Å; L501-S533 PolarHBondContact N-O 2.93Å
502	S	86.7	Confident	75	Confident	49 Å²	49	75.5 Å²	75.5	34%	0.343	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	167	178.7	65.4	0	0	0	0	112.1	V448 E449 V504	V448-S502 WeakPolarHBondContact CG2-O 3.28Å; E449-S502 PolarHBondContact N-O 3.27Å; E449-S502 PolarHBondContact O-N 3.45Å; S502-V504 PolarHBondContact O-N 3.01Å
503	N	80.1	Confident	73	Confident	79 Å²	79	81.4 Å²	81.4	42%	0.422	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.6	51.4	167.6	-147	12.8	0	0	0	115.9	E449 K505	E449-N503 HydrophobicContact CB-CB 4.27Å; E449-N503 HydrophobicContact CG-CB 4.03Å; E449-N503 PolarHBondContact OE1-ND2 3.17Å; E449-N503 VanDerWaalsContact OE2-CB 3.25Å; E449-N503 WeakPolarHBondContact OE2-CB 3.3Å; E449-N503 PolarHBondContact OE2-ND2 3.24Å; N503-K505 PolarHBondContact ND2-NZ 3.12Å; N503-K505 PolarHBondContact O-N 2.95Å; N503-K505 VanDerWaalsContact OD1-CE 3.28Å; N503-K505 WeakPolarHBondContact OD1-CE 3.35Å
504	V	83.8	Confident	71.4	Confident	28 Å²	28	79.5 Å²	79.5	17%	0.17	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	126.2	175.7	176.4	0	0	0	0	110.7	I415 V446 S447 V448 S502 A527 V529	I415-V504 HydrophobicContact CD1-CG1 3.94Å; I415-V504 HydrophobicContact CD1-CG2 4.39Å; V446-V504 HydrophobicContact CG1-CG1 3.75Å; S447-V504 CarbonylContact O-C 3.58Å; S447-V504 WeakPolarHBondContact O-CA 3.05Å; V448-V504 HydrophobicContact CB-CG2 4.04Å; V448-V504 HydrophobicContact CG2-CG2 3.67Å; S502-V504 PolarHBondContact O-N 3.01Å; V504-A527 HydrophobicContact CG1-CB 3.63Å; V504-V529 HydrophobicContact CB-CG2 4.44Å; V504-V529 HydrophobicContact CG2-CG2 3.43Å; V504-V529 VanDerWaalsContact CG2-CG2 3.43Å
505	K	80.1	Confident	69.2	Low	95 Å²	95	84.8 Å²	84.8	41%	0.413	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136.9	178.3	-64.3	169.4	-172.3	150	0	110.6	V446 S447 E449 N503	V446-K505 WeakPolarHBondContact CA-O 3.44Å; V446-K505 WeakPolarHBondContact CG1-O 3.47Å; S447-K505 PolarHBondContact N-O 2.94Å; S447-K505 PolarHBondContact O-N 3.5Å; S447-K505 PolarHBondContact OG-O 3.42Å; E449-K505 IonicContact OE1-NZ 2.95Å; E449-K505 PolarHBondContact OE1-NZ 3.33Å; N503-K505 PolarHBondContact ND2-NZ 3.12Å; N503-K505 PolarHBondContact O-N 2.95Å; N503-K505 VanDerWaalsContact OD1-CE 3.28Å; N503-K505 WeakPolarHBondContact OD1-CE 3.35Å
506	V	77.1	Confident	67.1	Low	44 Å²	44	91.4 Å²	91.4	27%	0.267	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	119.6	169.7	-176.4	0	0	0	0	107.9	K444 V446 T508 A527	K444-V506 HydrophobicContact CB-CG1 4.1Å; K444-V506 HydrophobicContact CD-CG1 3.94Å; V446-V506 HydrophobicContact CG2-CG2 4.38Å; V506-T508 PolarHBondContact O-N 3.37Å; V506-A527 HydrophobicContact CG2-CB 3.5Å
507	L	69.9	Low	64.5	Low	93 Å²	93	96 Å²	96	49%	0.487	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	103.4	177.7	-69	162.9	0	0	0	108.3	T445	T445-L507 HydrophobicContact CG2-CB 4.39Å; T445-L507 HydrophobicContact CG2-CD1 4.08Å; T445-L507 PolarHBondContact O-N 2.95Å
508	T	58	Low	61.7	Low	107 Å²	107	104.9 Å²	104.9	66%	0.656	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-80.7	132.4	164.8	42.9	0	0	0	0	108.8	V506 E510	V506-T508 PolarHBondContact O-N 3.37Å; T508-E510 PolarHBondContact O-N 2.53Å
509	S	44.8	Very low	58.8	Low	120 Å²	120	107.8 Å²	107.8	84%	0.839	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-58.6	128.1	175.8	46.1	0	0	0	0	110.5
510	E	43.3	Very low	56.4	Low	204 Å²	204	112.4 Å²	112.4	95%	0.953	63%	0.625	S	S	*	*	S	Bend	trans	-47.4	129.1	-176.8	-60.4	-179.1	148.1	0	0	113.2	T508	T508-E510 PolarHBondContact O-N 2.53Å
511	G	42.6	Very low	53.7	Low	76 Å²	76	118.4 Å²	118.4	78%	0.784	66%	0.658	S	S	*	*			trans	164.6	-13.6	169.5	0	0	0	0	0	119.3
512	E	36.8	Very low	51.1	Low	192 Å²	192	125.5 Å²	125.5	90%	0.897	69%	0.691	S	S	*	*			trans	-134.1	117	178.5	-74	177.1	164.4	0	0	110.2
513	E	34.2	Very low	48.7	Very low	183 Å²	183	129.1 Å²	129.1	86%	0.855	71%	0.71	S	S	*	*			trans	-62.3	139	164.7	-65.5	-171.6	163.6	0	0	108.5	E515	E513-E515 PolarHBondContact O-N 3.22Å; E513-E515 VanDerWaalsContact O-N 3.1Å
514	P	40.2	Very low	46.8	Very low	128 Å²	128	131.6 Å²	131.6	83%	0.831	72%	0.724	S	S	*	*			trans	-75.9	105.7	175.1	9.5	4.7	0	0	0	108.6	E516	P514-E516 PolarHBondContact O-N 2.72Å
515	E	35.4	Very low	45.1	Very low	187 Å²	187	132.8 Å²	132.8	87%	0.874	73%	0.733	S	S	*	*			trans	-65.3	121.2	165.2	-72	-166.1	158.7	0	0	109.4	E513 N517	E513-E515 PolarHBondContact O-N 3.22Å; E513-E515 VanDerWaalsContact O-N 3.1Å; E515-N517 PolarHBondContact O-N 3.22Å; E515-N517 VanDerWaalsContact O-N 3.15Å
516	E	42.7	Very low	44.3	Very low	180 Å²	180	132.1 Å²	132.1	84%	0.841	74%	0.737	S	S	*	*	S	Bend	trans	-66.2	107.6	168.7	-71.9	-178.8	164.3	0	0	109.6	P514	P514-E516 PolarHBondContact O-N 2.72Å
517	N	35.1	Very low	44	Very low	151 Å²	151	131 Å²	131	81%	0.807	73%	0.733	S	S	*	*			trans	131.5	106.3	151.6	-71.4	-50.8	0	0	0	111.8	E515	E515-N517 PolarHBondContact O-N 3.22Å; E515-N517 VanDerWaalsContact O-N 3.15Å
518	E	33.9	Very low	44.4	Very low	187 Å²	187	128.8 Å²	128.8	87%	0.874	73%	0.725	S	S	*	*				-176.8	124.3	124.3	-101.3	177.5	-174.7	0	0	112
519	S	33.4	Very low	45.7	Very low	109 Å²	109	126.2 Å²	126.2	76%	0.762	71%	0.709	S	S	*	*			trans	50	113.5	152.5	54.7	0	0	0	0	120.5	N521	S519-N521 PolarHBondContact O-N 3.4Å; S519-N521 VanDerWaalsContact O-N 3.15Å
520	A	43.6	Very low	47.4	Very low	97 Å²	97	121 Å²	121	80%	0.802	67%	0.673	S	S	*	*	S	Bend	trans	-44.7	111.3	163.9	0	0	0	0	0	113.7
521	N	35.3	Very low	49.1	Very low	165 Å²	165	119 Å²	119	88%	0.882	67%	0.668	S	S	*	*			trans	176.3	30.8	137.6	-90.3	-13.1	0	0	0	112.7	S519	S519-N521 PolarHBondContact O-N 3.4Å; S519-N521 VanDerWaalsContact O-N 3.15Å
522	H	35.8	Very low	51	Low	161 Å²	161	117.5 Å²	117.5	75%	0.745	64%	0.644	S	S	*	*			trans	-112.4	108.1	165.6	-162.2	-80.1	0	0	0	107.5	D524	H522-D524 PolarHBondContact O-N 2.87Å; H522-D524 VanDerWaalsContact O-N 3.14Å
523	V	35.5	Very low	53.4	Low	125 Å²	125	110.8 Å²	110.8	76%	0.758	62%	0.618	S	S	*	*			trans	-68.9	109.9	172.7	179.5	0	0	0	0	105.8	S525	V523-S525 PolarHBondContact O-N 2.97Å
524	D	40.6	Very low	56.1	Low	131 Å²	131	103.9 Å²	103.9	70%	0.701	59%	0.589	S	S	*	*			trans	-47	129.7	166.2	-76.7	-37.1	0	0	0	108.1	H522 V526	H522-D524 PolarHBondContact O-N 2.87Å; H522-D524 VanDerWaalsContact O-N 3.14Å; D524-V526 VanDerWaalsContact C-N 3.28Å; D524-V526 WeakPolarHBondContact O-CG2 3.29Å; D524-V526 PolarHBondContact O-N 3.48Å
525	S	49.1	Very low	58.5	Low	53 Å²	53	97.8 Å²	97.8	37%	0.371	55%	0.549	S	S	.	.			trans	-62.8	92.3	179.2	44.1	0	0	0	0	109.2	K444 V523 A527	K444-S525 PolarHBondContact NZ-OG 2.78Å; V523-S525 PolarHBondContact O-N 2.97Å; S525-A527 PolarHBondContact O-N 3.44Å
526	V	62.3	Low	61.2	Low	81 Å²	81	91.2 Å²	91.2	49%	0.491	52%	0.522	S	S	.	.			trans	-72.3	117.9	-179.1	-174.1	0	0	0	0	107.7	V412 S413 D524	V412-V526 HydrophobicContact CG1-CB 4.44Å; V412-V526 VanDerWaalsContact CG1-O 3.32Å; V412-V526 WeakPolarHBondContact CG1-O 3.23Å; S413-V526 PolarHBondContact N-O 2.95Å; D524-V526 VanDerWaalsContact C-N 3.28Å; D524-V526 WeakPolarHBondContact O-CG2 3.29Å; D524-V526 PolarHBondContact O-N 3.48Å
527	A	70.8	Confident	63.5	Low	21 Å²	21	82.7 Å²	82.7	17%	0.174	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	132.5	161	0	0	0	0	0	107.8	S413 V446 V504 V506 S525	S413-A527 VanDerWaalsContact O-CA 3.32Å; S413-A527 WeakPolarHBondContact O-CA 3.49Å; V446-A527 HydrophobicContact CG1-CB 4.1Å; V504-A527 HydrophobicContact CG1-CB 3.63Å; V506-A527 HydrophobicContact CG2-CB 3.5Å; S525-A527 PolarHBondContact O-N 3.44Å
528	C	79.8	Confident	66.1	Low	47 Å²	47	77 Å²	77	32%	0.318	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	157.4	178.7	63.5	0	0	0	0	111.3	S413 K414 I415 G530	S413-C528 PolarHBondContact O-N 3.42Å; S413-C528 VanDerWaalsContact O-N 3.07Å; K414-C528 WeakPolarHBondContact CA-O 3.31Å; I415-C528 PolarHBondContact N-O 3.48Å; C528-G530 PolarHBondContact O-N 2.85Å
529	V	83.9	Confident	68.6	Low	53 Å²	53	68.5 Å²	68.5	32%	0.321	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	122.9	171.1	-172.4	0	0	0	0	107.7	I415 L501 V504	I415-V529 CarbonylContact O-C 3.56Å; I415-V529 WeakPolarHBondContact O-CA 3.19Å; L501-V529 HydrophobicContact CB-CG1 4.25Å; V504-V529 HydrophobicContact CB-CG2 4.44Å; V504-V529 HydrophobicContact CG2-CG2 3.43Å; V504-V529 VanDerWaalsContact CG2-CG2 3.43Å
530	G	81.2	Confident	70.8	Confident	10 Å²	10	65.3 Å²	65.3	10%	0.103	39%	0.386	C	S	.	.			trans	-81.4	179.2	173.5	0	0	0	0	0	111.8	I415 C528 P532 S533	I415-G530 PolarHBondContact O-N 2.89Å; C528-G530 PolarHBondContact O-N 2.85Å; G530-P532 CarbonylContact O-C 3.57Å; G530-S533 PolarHBondContact O-N 2.94Å
531	I	78.4	Confident	72.4	Confident	163 Å²	163	61 Å²	61	84%	0.836	35%	0.349	S	S	*	.	S	Bend	trans	-107.2	127.6	177.2	-54.3	168.7	0	0	0	106.6
532	P	83.1	Confident	74.1	Confident	44 Å²	44	55.1 Å²	55.1	29%	0.286	32%	0.318	S	S	.	.			cis	-82.7	133.5	4.2	31.5	-32.5	0	0	0	113.7	F416 F417 G530 T534	F416-P532 WeakPolarHBondContact CB-O 3.4Å; F417-P532 HydrophobicContact CB-CG 4.36Å; F417-P532 PolarHBondContact N-O 3.11Å; F417-P532 WeakPolarHBondContact O-CG 3.14Å; G530-P532 CarbonylContact O-C 3.57Å; P532-T534 VanDerWaalsContact C-N 3.34Å
533	S	86.9	Confident	75.6	Confident	51 Å²	51	49.1 Å²	49.1	36%	0.357	29%	0.291	S	S	.	.			trans	-85.1	-10.4	173.9	60.7	0	0	0	0	113.5	L501 G530	L501-S533 PolarHBondContact N-O 2.93Å; G530-S533 PolarHBondContact O-N 2.94Å
534	T	90.1	Very high	77.5	Confident	38 Å²	38	43.7 Å²	43.7	23%	0.233	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	130.8	-178	-53	0	0	0	0	107.9	L498 I499 H500 P532	L498-T534 HydrophobicContact CB-CG2 3.93Å; L498-T534 HydrophobicContact CD2-CG2 3.69Å; L498-T534 HydrophobicContact CG-CG2 4.4Å; I499-T534 CarbonylContact O-C 3.56Å; I499-T534 WeakPolarHBondContact O-CA 3.44Å; H500-T534 WeakPolarHBondContact CE1-CG2 3.38Å; H500-T534 PolarHBondContact CE1-OG1 3.25Å; H500-T534 WeakPolarHBondContact ND1-CG2 3.2Å; H500-T534 PolarHBondContact ND1-OG1 3.2Å; P532-T534 VanDerWaalsContact C-N 3.34Å
535	A	92	Very high	79	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	134.4	169.7	0	0	0	0	0	109.4	F417 G420 Y422 V433 L498 I499	F417-A535 HydrophobicContact CB-CB 4.14Å; F417-A535 HydrophobicContact CD1-CB 3.89Å; F417-A535 HydrophobicContact CD2-CB 3.65Å; F417-A535 VanDerWaalsContact CD2-N 3.33Å; F417-A535 HydrophobicContact CE1-CB 4.12Å; F417-A535 HydrophobicContact CE2-CB 3.85Å; F417-A535 HydrophobicContact CG-CB 3.65Å; F417-A535 HydrophobicContact CZ-CB 4.1Å; G420-A535 WeakPolarHBondContact O-CA 3.17Å; Y422-A535 HydrophobicContact CD2-CB 4.06Å; Y422-A535 HydrophobicContact CE2-CB 3.94Å; V433-A535 HydrophobicContact CG1-CB 4.21Å; L498-A535 CarbonylContact C-O 3.59Å; L498-A535 WeakPolarHBondContact CA-O 3.44Å; I499-A535 HydrophobicContact CB-CB 4.44Å; I499-A535 PolarHBondContact N-O 2.67Å; I499-A535 PolarHBondContact O-N 2.98Å
536	T	91.3	Very high	80.6	Confident	49 Å²	49	35.1 Å²	35.1	30%	0.301	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	128.2	170.5	-56.8	0	0	0	0	108.5	G420 S421 Y422 N496	G420-T536 PolarHBondContact O-N 2.58Å; G420-T536 VanDerWaalsContact O-N 3.13Å; S421-T536 CarbonylContact C-O 3.59Å; S421-T536 VanDerWaalsContact CA-O 3.32Å; S421-T536 WeakPolarHBondContact CA-O 3.29Å; Y422-T536 PolarHBondContact N-O 3.22Å; N496-T536 HydrophobicContact CB-CG2 4.17Å
537	V	91.8	Very high	81.7	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	125	172.4	-173.2	0	0	0	0	107.8	Y422 V431 V433 N496 F497 I499	Y422-V537 CarbonylContact O-C 3.51Å; Y422-V537 WeakPolarHBondContact O-CA 3.37Å; V431-V537 HydrophobicContact CG1-CG1 4.24Å; V431-V537 HydrophobicContact CG2-CG1 4.2Å; V433-V537 HydrophobicContact CG2-CG2 4.33Å; N496-V537 WeakPolarHBondContact CA-O 3.08Å; N496-V537 WeakPolarHBondContact CB-O 3.25Å; F497-V537 HydrophobicContact CD1-CB 4Å; F497-V537 HydrophobicContact CD1-CG1 4.37Å; F497-V537 HydrophobicContact CD2-CB 4.35Å; F497-V537 HydrophobicContact CD2-CG2 4.42Å; F497-V537 HydrophobicContact CE1-CB 3.54Å; F497-V537 HydrophobicContact CE1-CG1 3.54Å; F497-V537 HydrophobicContact CE1-CG2 4.24Å; F497-V537 HydrophobicContact CE2-CB 3.92Å; F497-V537 HydrophobicContact CE2-CG2 3.75Å; F497-V537 HydrophobicContact CG-CB 4.4Å; F497-V537 HydrophobicContact CZ-CB 3.5Å; F497-V537 VanDerWaalsContact CZ-CB 3.5Å; F497-V537 HydrophobicContact CZ-CG1 3.64Å; F497-V537 HydrophobicContact CZ-CG2 3.66Å; F497-V537 PolarHBondContact N-O 3.26Å; F497-V537 PolarHBondContact O-N 3.49Å; I499-V537 HydrophobicContact CD1-CG2 4.04Å; I499-V537 HydrophobicContact CG1-CG2 4.28Å
538	T	88.8	Confident	82.6	Confident	31 Å²	31	32.5 Å²	32.5	19%	0.19	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.7	173.9	-54.6	0	0	0	0	109.1	Y422 Q423 C424 D494 E495 F540	Y422-T538 PolarHBondContact O-N 2.83Å; Q423-T538 WeakPolarHBondContact CA-O 3.14Å; C424-T538 PolarHBondContact N-O 3.08Å; D494-T538 HydrophobicContact CB-CG2 4.38Å; E495-T538 CarbonylContact O-C 3.58Å; E495-T538 WeakPolarHBondContact O-CA 3.39Å; T538-F540 HydrophobicContact CG2-CD1 4.5Å; T538-F540 HydrophobicContact CG2-CD2 4.37Å; T538-F540 HydrophobicContact CG2-CE1 4.04Å; T538-F540 HydrophobicContact CG2-CE2 3.9Å; T538-F540 HydrophobicContact CG2-CZ 3.72Å
539	I	86.1	Confident	83.1	Confident	10 Å²	10	31.1 Å²	31.1	5%	0.051	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	119.9	172.8	-54	174.2	0	0	0	106.3	C424 E426 A457 D462 I485 E495 F497	C424-I539 WeakPolarHBondContact O-CA 3.19Å; E426-I539 HydrophobicContact CB-CG2 4.3Å; E426-I539 HydrophobicContact CG-CG2 4.24Å; A457-I539 HydrophobicContact CB-CD1 4.08Å; D462-I539 HydrophobicContact CB-CD1 4.09Å; I485-I539 HydrophobicContact CD1-CD1 4.21Å; I485-I539 HydrophobicContact CD1-CG1 4.36Å; I485-I539 HydrophobicContact CG2-CD1 4.38Å; I485-I539 HydrophobicContact CG2-CG2 4.28Å; E495-I539 PolarHBondContact N-O 3.46Å; E495-I539 VanDerWaalsContact N-O 3.15Å; E495-I539 PolarHBondContact O-N 2.82Å; F497-I539 HydrophobicContact CD1-CD1 4.05Å; F497-I539 HydrophobicContact CD1-CG1 4.32Å; F497-I539 HydrophobicContact CE1-CD1 4.04Å; F497-I539 HydrophobicContact CE1-CG1 4.15Å
540	F	80.9	Confident	83.5	Confident	42 Å²	42	28.7 Å²	28.7	18%	0.184	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	125.3	173.7	-68.4	-78.1	0	0	0	109	Q423 C424 L425 E426 D494 T538	Q423-F540 HydrophobicContact CB-CD2 4.29Å; Q423-F540 HydrophobicContact CB-CE2 3.69Å; Q423-F540 HydrophobicContact CG-CE2 3.61Å; Q423-F540 HydrophobicContact CG-CZ 4.29Å; C424-F540 PolarHBondContact O-N 3.32Å; L425-F540 HydrophobicContact CD2-CB 4.18Å; E426-F540 PolarHBondContact N-O 3.24Å; E426-F540 VanDerWaalsContact N-O 3.16Å; D494-F540 HydrophobicContact CB-CD1 4.37Å; D494-F540 HydrophobicContact CB-CE1 4.44Å; D494-F540 VanDerWaalsContact CG-CD1 3.47Å; D494-F540 VanDerWaalsContact OD1-CD1 3.31Å; D494-F540 WeakPolarHBondContact OD1-CD1 3.23Å; D494-F540 VanDerWaalsContact OD2-CE1 3.29Å; D494-F540 WeakPolarHBondContact OD2-CE1 3.31Å; T538-F540 HydrophobicContact CG2-CD1 4.5Å; T538-F540 HydrophobicContact CG2-CD2 4.37Å; T538-F540 HydrophobicContact CG2-CE1 4.04Å; T538-F540 HydrophobicContact CG2-CE2 3.9Å; T538-F540 HydrophobicContact CG2-CZ 3.72Å
541	D	77.8	Confident	83.7	Confident	7 Å²	7	33.9 Å²	33.9	4%	0.037	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-63.2	140.9	165.3	177.9	17.8	0	0	0	109.6	F491 E492 D543	F491-D541 WeakPolarHBondContact CA-OD2 3.22Å; F491-D541 WeakPolarHBondContact CD2-OD2 3.24Å; F491-D541 WeakPolarHBondContact CE2-OD2 3.43Å; E492-D541 PolarHBondContact N-OD2 3.27Å; D541-D543 WeakPolarHBondContact OD1-CB 3.39Å; D541-D543 PolarHBondContact OD1-N 2.83Å
542	D	69.3	Low	84.1	Confident	41 Å²	41	31.6 Å²	31.6	22%	0.219	17%	0.171	C	C	.	.			trans	-104.5	5	-178.5	75.1	-2.9	0	0	0	114.1	L425 N427	L425-D542 HydrophobicContact CD2-CB 4.36Å; N427-D542 PolarHBondContact ND2-OD2 2.86Å
543	D	68.5	Low	84.3	Confident	34 Å²	34	32.6 Å²	32.6	18%	0.182	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-5.4	-172.2	-90.4	-30.4	0	0	0	117.4	D489 F491 D541 R575	D489-D543 VanDerWaalsContact C-OD2 3.31Å; F491-D543 HydrophobicContact CB-CB 4.26Å; F491-D543 HydrophobicContact CD2-CB 4.33Å; D541-D543 WeakPolarHBondContact OD1-CB 3.39Å; D541-D543 PolarHBondContact OD1-N 2.83Å; D543-R575 IonicContact OD1-CZ 2.7Å; D543-R575 IonicContact OD1-NH1 3.06Å; D543-R575 PolarHBondContact OD1-NH1 2.99Å
544	H	76	Confident	84.4	Confident	11 Å²	11	32.4 Å²	32.4	5%	0.051	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	159.8	178.8	-168.5	58.7	0	0	0	114.6	F491 G546 S572 G573 A574 R575 M674	F491-H544 HydrophobicContact CD2-CB 4.41Å; F491-H544 HydrophobicContact CE2-CB 3.95Å; H544-G546 VanDerWaalsContact C-N 3.32Å; H544-G546 PolarHBondContact CD2-N 2.94Å; H544-G546 PolarHBondContact O-N 2.92Å; H544-S572 WeakPolarHBondContact CB-O 3.42Å; H544-S572 PolarHBondContact CD2-OG 3.44Å; H544-G573 CarbonylContact O-C 3.57Å; H544-G573 VanDerWaalsContact O-CA 3.32Å; H544-G573 WeakPolarHBondContact O-CA 3.41Å; H544-A574 PolarHBondContact O-N 3.25Å; H544-R575 VanDerWaalsContact O-CB 3.32Å; H544-R575 WeakPolarHBondContact O-CB 3.25Å; H544-R575 PolarHBondContact O-N 3.03Å; H544-R575 VanDerWaalsContact O-N 3.1Å; H544-M674 PolarHBondContact CE1-O 3.06Å
545	A	72.1	Confident	84.3	Confident	4 Å²	4	32.4 Å²	32.4	3%	0.033	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	-15.1	175.3	0	0	0	0	0	114.4	R570 R575 G675	A545-R570 VanDerWaalsContact O-CZ 3.31Å; A545-R570 PolarHBondContact O-NE 3.13Å; A545-R570 PolarHBondContact O-NH2 3.15Å; A545-R575 WeakPolarHBondContact CA-O 3.31Å; A545-G675 WeakPolarHBondContact CB-O 3.22Å
546	G	81.1	Confident	84.1	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	104.8	143.9	167.8	0	0	0	0	0	115.7	H544 F548 T571 G573 P677 M678	H544-G546 VanDerWaalsContact C-N 3.32Å; H544-G546 PolarHBondContact CD2-N 2.94Å; H544-G546 PolarHBondContact O-N 2.92Å; G546-F548 WeakPolarHBondContact O-CE2 3.48Å; G546-T571 CarbonylContact C-O 3.19Å; G546-T571 VanDerWaalsContact CA-O 3.29Å; G546-T571 WeakPolarHBondContact CA-O 3.48Å; G546-G573 WeakPolarHBondContact CA-O 3.41Å; G546-G573 PolarHBondContact N-O 3.25Å; G546-P677 VanDerWaalsContact O-CA 3.3Å; G546-P677 WeakPolarHBondContact O-CA 3.26Å; G546-M678 PolarHBondContact O-N 3.03Å
547	I	86.4	Confident	83.9	Confident	48 Å²	48	36 Å²	36	25%	0.246	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	124.8	177.3	-58.9	172.9	0	0	0	109.3	R570 T571 M678	I547-R570 CarbonylContact O-C 3.57Å; I547-R570 WeakPolarHBondContact O-CA 2.68Å; I547-T571 PolarHBondContact N-O 3.28Å; I547-T571 PolarHBondContact O-N 3.32Å; I547-T571 PolarHBondContact O-OG1 3.29Å; I547-M678 CarbonylContact C-O 3.54Å; I547-M678 WeakPolarHBondContact CA-O 3.21Å
548	F	89.2	Confident	83.4	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	123.4	-174.5	-61.8	-88.7	0	0	0	112.2	G546 L569 R570 V578 L580 F605 P637 P677 M678 L679 G680	G546-F548 WeakPolarHBondContact O-CE2 3.48Å; F548-L569 WeakPolarHBondContact CA-O 3.29Å; F548-R570 HydrophobicContact CD1-CB 4.01Å; F548-R570 HydrophobicContact CD1-CG 4.21Å; F548-R570 HydrophobicContact CE1-CB 3.71Å; F548-R570 HydrophobicContact CE1-CG 3.61Å; F548-R570 HydrophobicContact CE2-CG 4.39Å; F548-R570 HydrophobicContact CZ-CB 4.33Å; F548-R570 HydrophobicContact CZ-CG 3.7Å; F548-V578 HydrophobicContact CD2-CG1 4.48Å; F548-V578 HydrophobicContact CE1-CG1 4.47Å; F548-V578 HydrophobicContact CE2-CB 4.07Å; F548-V578 HydrophobicContact CE2-CG1 3.54Å; F548-V578 HydrophobicContact CE2-CG2 4.21Å; F548-V578 HydrophobicContact CZ-CB 3.6Å; F548-V578 HydrophobicContact CZ-CG1 3.53Å; F548-V578 HydrophobicContact CZ-CG2 3.92Å; F548-L580 HydrophobicContact CB-CD1 4.14Å; F548-L580 HydrophobicContact CB-CD2 3.83Å; F548-L580 HydrophobicContact CD1-CD2 3.85Å; F548-L580 HydrophobicContact CG-CD1 4.29Å; F548-L580 HydrophobicContact CG-CD2 3.99Å; F548-F605 HydrophobicContact CD1-CD2 4.1Å; F548-F605 HydrophobicContact CD1-CE1 4.44Å; F548-F605 AromaticContact CD1-CE2 3.79Å; F548-F605 HydrophobicContact CD1-CE2 3.79Å; F548-F605 AromaticContact CD1-CZ 3.96Å; F548-F605 HydrophobicContact CD1-CZ 3.96Å; F548-F605 HydrophobicContact CE1-CB 4.26Å; F548-F605 AromaticContact CE1-CD1 3.98Å; F548-F605 HydrophobicContact CE1-CD1 3.98Å; F548-F605 AromaticContact CE1-CD2 3.5Å; F548-F605 HydrophobicContact CE1-CD2 3.5Å; F548-F605 VanDerWaalsContact CE1-CD2 3.5Å; F548-F605 HydrophobicContact CE1-CE1 4.11Å; F548-F605 AromaticContact CE1-CE2 3.67Å; F548-F605 HydrophobicContact CE1-CE2 3.67Å; F548-F605 AromaticContact CE1-CG 3.66Å; F548-F605 HydrophobicContact CE1-CG 3.66Å; F548-F605 AromaticContact CE1-CZ 3.96Å; F548-F605 HydrophobicContact CE1-CZ 3.96Å; F548-F605 HydrophobicContact CZ-CD2 4.44Å; F548-F605 HydrophobicContact CZ-CG 4.46Å; F548-P637 HydrophobicContact CD2-CB 4.03Å; F548-P637 HydrophobicContact CD2-CG 4.17Å; F548-P637 HydrophobicContact CE2-CB 4.21Å; F548-P677 HydrophobicContact CD2-CB 4.47Å; F548-P677 HydrophobicContact CE2-CB 3.81Å; F548-M678 PolarHBondContact N-O 3.46Å; F548-L679 HydrophobicContact CB-CD2 4.49Å; F548-G680 PolarHBondContact O-N 2.96Å
549	T	90.6	Very high	83	Confident	17 Å²	17	37.6 Å²	37.6	10%	0.104	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	159.7	-177.5	-163.3	0	0	0	0	112.8	L569 H682	T549-L569 PolarHBondContact N-O 3.38Å; T549-L569 PolarHBondContact O-N 3.32Å; T549-H682 WeakPolarHBondContact OG1-CA 3.43Å; T549-H682 WeakPolarHBondContact OG1-CB 3.31Å; T549-H682 PolarHBondContact OG1-N 3.09Å; T549-H682 PolarHBondContact OG1-O 3.28Å; T549-H682 VanDerWaalsContact OG1-O 3.09Å
550	F	92	Very high	82.5	Confident	3 Å²	3	40.6 Å²	40.6	1%	0.013	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	152.4	167	-66.8	-66	0	0	0	111.4	E552 V566 V568 I614 I632 L634 H682 L685	F550-E552 VanDerWaalsContact C-N 3.34Å; F550-V566 HydrophobicContact CD1-CG1 3.79Å; F550-V566 HydrophobicContact CE1-CG1 3.66Å; F550-V568 HydrophobicContact CD1-CG2 4.13Å; F550-V568 HydrophobicContact CE1-CG2 3.75Å; F550-I614 HydrophobicContact CE1-CD1 4.3Å; F550-I632 HydrophobicContact CZ-CB 4.28Å; F550-I632 HydrophobicContact CZ-CG2 3.92Å; F550-L634 HydrophobicContact CD2-CD1 4.1Å; F550-L634 HydrophobicContact CD2-CG 4.34Å; F550-L634 HydrophobicContact CE1-CD1 4.38Å; F550-L634 HydrophobicContact CE1-CD2 4.23Å; F550-L634 HydrophobicContact CE1-CG 4.31Å; F550-L634 HydrophobicContact CE2-CD1 3.84Å; F550-L634 HydrophobicContact CE2-CD2 4.28Å; F550-L634 HydrophobicContact CE2-CG 3.58Å; F550-L634 HydrophobicContact CG-CD1 4.5Å; F550-L634 HydrophobicContact CZ-CD1 3.99Å; F550-L634 HydrophobicContact CZ-CD2 3.72Å; F550-L634 HydrophobicContact CZ-CG 3.56Å; F550-H682 HydrophobicContact CB-CB 3.99Å; F550-H682 WeakPolarHBondContact CD2-O 3.32Å; F550-H682 PolarHBondContact N-O 3.2Å; F550-H682 PolarHBondContact O-ND1 3.07Å; F550-L685 HydrophobicContact CD1-CB 4.37Å; F550-L685 HydrophobicContact CD1-CD2 4.46Å; F550-L685 HydrophobicContact CD2-CB 3.77Å; F550-L685 HydrophobicContact CE1-CB 4.43Å; F550-L685 HydrophobicContact CE2-CB 3.83Å; F550-L685 HydrophobicContact CG-CB 4.04Å; F550-L685 HydrophobicContact CZ-CB 4.18Å
551	E	86.6	Confident	82.4	Confident	119 Å²	119	42.1 Å²	42.1	56%	0.556	23%	0.232	S	C	*	.	S	Bend	trans	-62	-42.3	177.5	-168.1	170.2	-175	0	0	111.6	L569	E551-L569 HydrophobicContact CB-CD1 3.66Å; E551-L569 HydrophobicContact CG-CD1 4.07Å
552	E	86.7	Confident	82.6	Confident	115 Å²	115	43.1 Å²	43.1	54%	0.537	24%	0.244	S	C	.	.			trans	-136.4	152.3	-178.9	-62.6	-177.3	161.1	0	0	110.2	F550 V554 L685	F550-E552 VanDerWaalsContact C-N 3.34Å; E552-V554 VanDerWaalsContact C-N 3.34Å; E552-L685 WeakPolarHBondContact O-CD1 3.33Å
553	P	86.3	Confident	83.4	Confident	64 Å²	64	44.9 Å²	44.9	42%	0.416	26%	0.256	S	S	.	.	S	Bend	trans	-76.8	-20.6	175.7	28.4	-33	0	0	0	113.5	E686	P553-E686 PolarHBondContact O-N 3.3Å
554	V	89.5	Confident	84.3	Confident	47 Å²	47	43.7 Å²	43.7	29%	0.285	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	134.2	-176.8	-175.9	0	0	0	0	109	E552 E686 I688	E552-V554 VanDerWaalsContact C-N 3.34Å; V554-E686 CarbonylContact C-O 3.58Å; V554-E686 VanDerWaalsContact CA-O 3.29Å; V554-E686 WeakPolarHBondContact CA-O 3.39Å; V554-E686 HydrophobicContact CG2-CB 4.37Å; V554-I688 HydrophobicContact CG1-CD1 3.64Å; V554-I688 HydrophobicContact CG1-CG1 4.14Å
555	C	88.1	Confident	85	Confident	39 Å²	39	49.8 Å²	49.8	26%	0.264	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.2	177.1	-179	0	0	0	0	110.2	L685 E686 V687 I688	C555-L685 HydrophobicContact CB-CD1 3.96Å; C555-L685 HydrophobicContact CB-CD2 4.42Å; C555-E686 PolarHBondContact N-O 3.02Å; C555-V687 CarbonylContact O-C 3.51Å; C555-V687 WeakPolarHBondContact O-CA 3.34Å; C555-I688 PolarHBondContact O-N 3.41Å
556	H	87.5	Confident	85.9	Confident	107 Å²	107	50.2 Å²	50.2	50%	0.495	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128.7	177.5	-67.6	-104.5	0	0	0	110.1	I688 E690	H556-I688 WeakPolarHBondContact CA-O 3.25Å; H556-E690 IonicContact CE1-OE1 2.71Å; H556-E690 IonicContact CG-OE1 2.98Å; H556-E690 IonicContact ND1-OE1 3.81Å; H556-E690 PolarHBondContact ND1-OE1 2.69Å
557	V	86.8	Confident	86.3	Confident	17 Å²	17	55 Å²	55	10%	0.103	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	141	-176.7	-65	0	0	0	0	110.9	M564 I618 V687 I688 I689 E690	V557-M564 HydrophobicContact CB-CE 3.93Å; V557-M564 HydrophobicContact CG1-CE 3.55Å; V557-M564 HydrophobicContact CG2-CE 3.48Å; V557-M564 VanDerWaalsContact CG2-CE 3.48Å; V557-I618 HydrophobicContact CB-CD1 3.94Å; V557-I618 HydrophobicContact CG2-CD1 3.55Å; V557-V687 HydrophobicContact CG2-CG1 3.53Å; V557-I688 WeakPolarHBondContact CG2-O 3.26Å; V557-I688 PolarHBondContact N-O 3.48Å; V557-I689 HydrophobicContact CG2-CG1 4.11Å; V557-I689 CarbonylContact O-C 3.6Å; V557-I689 WeakPolarHBondContact O-CA 3.49Å; V557-E690 PolarHBondContact O-N 3.41Å
558	S	81.4	Confident	86.5	Confident	29 Å²	29	52.7 Å²	52.7	20%	0.203	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	143.3	173.1	179.5	0	0	0	0	110.7	S560 V561 E690	S558-S560 PolarHBondContact O-N 3.26Å; S558-S560 PolarHBondContact OG-N 2.93Å; S558-S560 PolarHBondContact OG-OG 3.17Å; S558-V561 WeakPolarHBondContact O-CB 3.21Å; S558-V561 VanDerWaalsContact O-CG2 3.23Å; S558-V561 WeakPolarHBondContact O-CG2 3.29Å; S558-V561 PolarHBondContact O-N 3.31Å; S558-E690 WeakPolarHBondContact CA-O 3.48Å
559	E	81	Confident	86.5	Confident	36 Å²	36	55 Å²	55	17%	0.168	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-52.1	-28.8	171.2	-70.2	177.2	159.5	0	0	113.2	V561 I689 E690	E559-V561 VanDerWaalsContact C-N 3.31Å; E559-V561 PolarHBondContact O-N 3.46Å; E559-I689 HydrophobicContact CB-CG2 4.34Å; E559-I689 HydrophobicContact CG-CG2 3.15Å; E559-E690 PolarHBondContact N-O 2.96Å
560	S	75	Confident	86.3	Confident	72 Å²	72	54.6 Å²	54.6	50%	0.503	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-79.3	-5.8	-178.5	62.6	0	0	0	0	115.2	S558 G562	S558-S560 PolarHBondContact O-N 3.26Å; S558-S560 PolarHBondContact OG-N 2.93Å; S558-S560 PolarHBondContact OG-OG 3.17Å; S560-G562 VanDerWaalsContact C-N 3.28Å; S560-G562 PolarHBondContact O-N 3.49Å
561	V	79.4	Confident	85.7	Confident	74 Å²	74	57 Å²	57	45%	0.448	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-67.6	-29.3	-176.2	173.5	0	0	0	0	111.8	S558 E559 T563	S558-V561 WeakPolarHBondContact O-CB 3.21Å; S558-V561 VanDerWaalsContact O-CG2 3.23Å; S558-V561 WeakPolarHBondContact O-CG2 3.29Å; S558-V561 PolarHBondContact O-N 3.31Å; E559-V561 VanDerWaalsContact C-N 3.31Å; E559-V561 PolarHBondContact O-N 3.46Å; V561-T563 WeakPolarHBondContact CG1-O 3.24Å; V561-T563 PolarHBondContact O-N 3.39Å
562	G	81.9	Confident	85.1	Confident	28 Å²	28	52.6 Å²	52.6	29%	0.289	30%	0.295	S	S	.	.			trans	72.5	-56	177.6	0	0	0	0	0	114.4	S560 R617 I618	S560-G562 VanDerWaalsContact C-N 3.28Å; S560-G562 PolarHBondContact O-N 3.49Å; G562-R617 WeakPolarHBondContact O-CA 3.47Å; G562-R617 WeakPolarHBondContact O-CG 3.39Å; G562-I618 PolarHBondContact O-N 3.12Å; G562-I618 VanDerWaalsContact O-O 3.11Å
563	T	85.6	Confident	84.5	Confident	78 Å²	78	47.6 Å²	47.6	48%	0.479	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	119.1	173.4	-53.8	0	0	0	0	109.5	V561	V561-T563 WeakPolarHBondContact CG1-O 3.24Å; V561-T563 PolarHBondContact O-N 3.39Å
564	M	87.1	Confident	84.1	Confident	9 Å²	9	45.2 Å²	45.2	4%	0.044	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	147	175	60.6	151.7	59.7	0	0	111.3	V557 V566 T615 V616 I618 F630 V687	V557-M564 HydrophobicContact CB-CE 3.93Å; V557-M564 HydrophobicContact CG1-CE 3.55Å; V557-M564 HydrophobicContact CG2-CE 3.48Å; V557-M564 VanDerWaalsContact CG2-CE 3.48Å; M564-V566 HydrophobicContact SD-CG2 3.89Å; M564-T615 WeakPolarHBondContact O-CA 3.46Å; M564-V616 HydrophobicContact CG-CB 3.73Å; M564-V616 WeakPolarHBondContact CG-O 3.41Å; M564-V616 PolarHBondContact N-O 2.98Å; M564-V616 PolarHBondContact O-N 2.97Å; M564-V616 HydrophobicContact SD-CB 3.93Å; M564-V616 HydrophobicContact SD-CG2 4.46Å; M564-I618 HydrophobicContact CB-CD1 4.24Å; M564-I618 HydrophobicContact CE-CD1 3.48Å; M564-I618 VanDerWaalsContact CE-CD1 3.48Å; M564-I618 HydrophobicContact CE-CG1 3.97Å; M564-I618 HydrophobicContact CG-CD1 4.26Å; M564-I618 HydrophobicContact CG-CG1 4.14Å; M564-F630 HydrophobicContact CE-CE1 4.36Å; M564-F630 HydrophobicContact CE-CZ 4Å; M564-F630 HydrophobicContact SD-CZ 4.02Å; M564-V687 HydrophobicContact CE-CB 4.35Å; M564-V687 HydrophobicContact CE-CG1 3.28Å; M564-V687 HydrophobicContact CE-CG2 4.19Å; M564-V687 HydrophobicContact SD-CG1 4.39Å; M564-V687 HydrophobicContact SD-CG2 4.31Å
565	E	90.1	Very high	83.3	Confident	140 Å²	140	49.6 Å²	49.6	65%	0.654	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	116.7	175.6	-61.5	-172.4	170.3	0	0	109.2	I614 T615	E565-I614 WeakPolarHBondContact CA-O 3.35Å; E565-T615 HydrophobicContact CG-CG2 4.38Å
566	V	91.1	Very high	82.8	Confident	12 Å²	12	48.6 Å²	48.6	7%	0.073	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.3	179.6	175.4	0	0	0	0	109.1	F550 M564 T613 I614 I632 L685	F550-V566 HydrophobicContact CD1-CG1 3.79Å; F550-V566 HydrophobicContact CE1-CG1 3.66Å; M564-V566 HydrophobicContact SD-CG2 3.89Å; V566-T613 CarbonylContact O-C 3.54Å; V566-T613 VanDerWaalsContact O-CA 3.31Å; V566-T613 WeakPolarHBondContact O-CA 3.49Å; V566-I614 HydrophobicContact CB-CB 4.39Å; V566-I614 PolarHBondContact N-O 3.18Å; V566-I614 PolarHBondContact O-N 3.34Å; V566-I632 HydrophobicContact CB-CD1 4.48Å; V566-I632 HydrophobicContact CG2-CD1 3.91Å; V566-L685 HydrophobicContact CB-CD2 4.3Å; V566-L685 HydrophobicContact CG1-CD2 3.37Å; V566-L685 HydrophobicContact CG2-CD2 3.91Å
567	K	90.3	Very high	82.8	Confident	100 Å²	100	45.3 Å²	45.3	44%	0.435	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	135	-179.7	-66.5	168.6	179.4	176.3	0	111	L611 T613	K567-L611 HydrophobicContact CB-CD1 4.46Å; K567-L611 HydrophobicContact CD-CD1 4.21Å; K567-L611 HydrophobicContact CG-CD1 4.4Å; K567-L611 HydrophobicContact CG-CD2 4.47Å; K567-T613 HydrophobicContact CG-CG2 3.89Å
568	V	91.4	Very high	82.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	123	169.8	-176.4	0	0	0	0	107.9	F550 L580 L603 F605 L611 K612 I614 L634	F550-V568 HydrophobicContact CD1-CG2 4.13Å; F550-V568 HydrophobicContact CE1-CG2 3.75Å; V568-L580 HydrophobicContact CG1-CD2 3.71Å; V568-L603 HydrophobicContact CB-CD1 4.07Å; V568-L603 HydrophobicContact CG1-CD1 4.46Å; V568-L603 HydrophobicContact CG2-CD1 3.77Å; V568-F605 HydrophobicContact CB-CZ 4.36Å; V568-F605 HydrophobicContact CG1-CZ 4.15Å; V568-L611 WeakPolarHBondContact O-CA 3.5Å; V568-K612 PolarHBondContact N-O 2.66Å; V568-K612 PolarHBondContact O-N 3.18Å; V568-K612 VanDerWaalsContact O-N 3.12Å; V568-I614 HydrophobicContact CG2-CD1 3.71Å; V568-I614 HydrophobicContact CG2-CG1 4.17Å; V568-L634 HydrophobicContact CG1-CD1 4Å; V568-L634 HydrophobicContact CG1-CD2 4.38Å; V568-L634 HydrophobicContact CG2-CD2 4.09Å
569	L	87.6	Confident	83.2	Confident	49 Å²	49	44.9 Å²	44.9	26%	0.257	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	138.6	-176.7	-68.1	145.4	0	0	0	109.8	F548 T549 E551 T571 L611	F548-L569 WeakPolarHBondContact CA-O 3.29Å; T549-L569 PolarHBondContact N-O 3.38Å; T549-L569 PolarHBondContact O-N 3.32Å; E551-L569 HydrophobicContact CB-CD1 3.66Å; E551-L569 HydrophobicContact CG-CD1 4.07Å; L569-T571 HydrophobicContact CB-CG2 4.33Å; L569-L611 HydrophobicContact CD2-CD1 4.3Å
570	R	87.2	Confident	83.6	Confident	8 Å²	8	43.2 Å²	43.2	3%	0.03	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	116.2	166.4	-178.3	-169.3	-169.7	177.3	1	107.5	A545 I547 F548 G573 A574 R575 G576 F605 Q606 E609 I610	A545-R570 VanDerWaalsContact O-CZ 3.31Å; A545-R570 PolarHBondContact O-NE 3.13Å; A545-R570 PolarHBondContact O-NH2 3.15Å; I547-R570 CarbonylContact O-C 3.57Å; I547-R570 WeakPolarHBondContact O-CA 2.68Å; F548-R570 HydrophobicContact CD1-CB 4.01Å; F548-R570 HydrophobicContact CD1-CG 4.21Å; F548-R570 HydrophobicContact CE1-CB 3.71Å; F548-R570 HydrophobicContact CE1-CG 3.61Å; F548-R570 HydrophobicContact CE2-CG 4.39Å; F548-R570 HydrophobicContact CZ-CB 4.33Å; F548-R570 HydrophobicContact CZ-CG 3.7Å; R570-G573 PolarHBondContact NE-O 2.82Å; R570-A574 VanDerWaalsContact CZ-C 3.43Å; R570-A574 PolarHBondContact NH1-O 3.27Å; R570-A574 VanDerWaalsContact NH2-C 3.3Å; R570-A574 PolarHBondContact NH2-O 3.22Å; R570-R575 PolarHBondContact NH2-O 3.41Å; R570-G576 PolarHBondContact NH1-O 3.28Å; R570-G576 PolarHBondContact NH2-O 3.1Å; R570-F605 HydrophobicContact CB-CD1 4.21Å; R570-F605 HydrophobicContact CB-CE1 4.03Å; R570-Q606 PolarHBondContact NH1-O 3.25Å; R570-E609 WeakPolarHBondContact CD-O 3.18Å; R570-E609 PolarHBondContact NH1-O 3.18Å; R570-I610 PolarHBondContact N-O 3.13Å
571	T	79.4	Confident	84.5	Confident	55 Å²	55	41 Å²	41	34%	0.337	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	166.1	-172.2	52.6	0	0	0	0	110.8	G546 I547 L569 G573	G546-T571 CarbonylContact C-O 3.19Å; G546-T571 VanDerWaalsContact CA-O 3.29Å; G546-T571 WeakPolarHBondContact CA-O 3.48Å; I547-T571 PolarHBondContact N-O 3.28Å; I547-T571 PolarHBondContact O-N 3.32Å; I547-T571 PolarHBondContact O-OG1 3.29Å; L569-T571 HydrophobicContact CB-CG2 4.33Å; T571-G573 PolarHBondContact O-N 3.29Å
572	S	74	Confident	85.2	Confident	26 Å²	26	39.1 Å²	39.1	18%	0.182	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	65.7	-6.3	178.5	178.8	0	0	0	0	116.1	H544	H544-S572 WeakPolarHBondContact CB-O 3.42Å; H544-S572 PolarHBondContact CD2-OG 3.44Å
573	G	73.6	Confident	85.7	Confident	10 Å²	10	42 Å²	42	10%	0.103	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.5	157.8	168	0	0	0	0	0	113.5	H544 G546 R570 T571	H544-G573 CarbonylContact O-C 3.57Å; H544-G573 VanDerWaalsContact O-CA 3.32Å; H544-G573 WeakPolarHBondContact O-CA 3.41Å; G546-G573 WeakPolarHBondContact CA-O 3.41Å; G546-G573 PolarHBondContact N-O 3.25Å; R570-G573 PolarHBondContact NE-O 2.82Å; T571-G573 PolarHBondContact O-N 3.29Å
574	A	77.3	Confident	86.1	Confident	13 Å²	13	39.1 Å²	39.1	11%	0.107	20%	0.197	C	C	.	.			trans	-119.4	16.4	-173.1	0	0	0	0	0	113.9	H544 R570 D608 I610	H544-A574 PolarHBondContact O-N 3.25Å; R570-A574 VanDerWaalsContact CZ-C 3.43Å; R570-A574 PolarHBondContact NH1-O 3.27Å; R570-A574 VanDerWaalsContact NH2-C 3.3Å; R570-A574 PolarHBondContact NH2-O 3.22Å; A574-D608 PolarHBondContact O-N 3.14Å; A574-I610 HydrophobicContact CB-CG2 3.96Å
575	R	73.8	Confident	86.3	Confident	140 Å²	140	41.4 Å²	41.4	53%	0.528	21%	0.212	S	C	.	.			trans	-79.9	125.2	-169.7	-159.6	164.9	-178	153.7	1.4	113	D543 H544 A545 R570	D543-R575 IonicContact OD1-CZ 2.7Å; D543-R575 IonicContact OD1-NH1 3.06Å; D543-R575 PolarHBondContact OD1-NH1 2.99Å; H544-R575 VanDerWaalsContact O-CB 3.32Å; H544-R575 WeakPolarHBondContact O-CB 3.25Å; H544-R575 PolarHBondContact O-N 3.03Å; H544-R575 VanDerWaalsContact O-N 3.1Å; A545-R575 WeakPolarHBondContact CA-O 3.31Å; R570-R575 PolarHBondContact NH2-O 3.41Å
576	G	78.1	Confident	86.3	Confident	18 Å²	18	39.5 Å²	39.5	19%	0.186	20%	0.203	C	C	.	.	S	Bend	trans	81.6	171.8	177.6	0	0	0	0	0	115.1	R570 N607	R570-G576 PolarHBondContact NH1-O 3.28Å; R570-G576 PolarHBondContact NH2-O 3.1Å; G576-N607 PolarHBondContact N-OD1 3.4Å
577	V	85.9	Confident	86	Confident	37 Å²	37	40.8 Å²	40.8	22%	0.224	22%	0.218	C	C	.	.			trans	-94.5	123.7	-177	-177.8	0	0	0	0	110.5	E604 F605 R640	V577-E604 HydrophobicContact CG1-CG 4.29Å; V577-F605 VanDerWaalsContact CA-O 3.29Å; V577-F605 WeakPolarHBondContact CA-O 3.28Å; V577-F605 WeakPolarHBondContact CG1-O 3.37Å; V577-R640 PolarHBondContact O-N 2.84Å
578	V	87.7	Confident	85.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	134.2	-176.8	-175.5	0	0	0	0	110.8	F548 F605 P637 P677	F548-V578 HydrophobicContact CD2-CG1 4.48Å; F548-V578 HydrophobicContact CE1-CG1 4.47Å; F548-V578 HydrophobicContact CE2-CB 4.07Å; F548-V578 HydrophobicContact CE2-CG1 3.54Å; F548-V578 HydrophobicContact CE2-CG2 4.21Å; F548-V578 HydrophobicContact CZ-CB 3.6Å; F548-V578 HydrophobicContact CZ-CG1 3.53Å; F548-V578 HydrophobicContact CZ-CG2 3.92Å; V578-F605 PolarHBondContact N-O 2.85Å; V578-F605 PolarHBondContact O-N 3.48Å; V578-P637 HydrophobicContact CG1-CB 3.63Å; V578-P677 HydrophobicContact CG1-CB 4.05Å; V578-P677 HydrophobicContact CG1-CG 4.25Å; V578-P677 HydrophobicContact CG2-CB 4.11Å; V578-P677 HydrophobicContact CG2-CG 4.3Å
579	M	88.8	Confident	85.3	Confident	38 Å²	38	40.5 Å²	40.5	19%	0.187	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	125.5	174.3	-53.8	-61.2	-56.8	0	0	109.6	V602 L603 E604 P637 E638	M579-V602 HydrophobicContact CB-CG1 3.93Å; M579-V602 HydrophobicContact CE-CB 4.44Å; M579-V602 HydrophobicContact CE-CG1 3.64Å; M579-L603 CarbonylContact C-O 3.58Å; M579-L603 WeakPolarHBondContact CA-O 3.27Å; M579-E604 HydrophobicContact CE-CB 3.8Å; M579-E604 HydrophobicContact CE-CG 4.17Å; M579-E604 HydrophobicContact SD-CB 3.83Å; M579-E604 HydrophobicContact SD-CG 3.61Å; M579-P637 CarbonylContact O-C 3.36Å; M579-P637 WeakPolarHBondContact O-CA 3.2Å; M579-E638 HydrophobicContact CB-CB 4.37Å; M579-E638 PolarHBondContact N-O 3.44Å; M579-E638 PolarHBondContact O-N 3.38Å
580	L	90.9	Very high	85.1	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	102.9	-177.7	-176.3	72.9	0	0	0	110.8	F548 V568 L603 F605 L634 E635 P637 L679	F548-L580 HydrophobicContact CB-CD1 4.14Å; F548-L580 HydrophobicContact CB-CD2 3.83Å; F548-L580 HydrophobicContact CD1-CD2 3.85Å; F548-L580 HydrophobicContact CG-CD1 4.29Å; F548-L580 HydrophobicContact CG-CD2 3.99Å; V568-L580 HydrophobicContact CG1-CD2 3.71Å; L580-L603 HydrophobicContact CB-CB 4.35Å; L580-L603 HydrophobicContact CD2-CD1 4.47Å; L580-L603 PolarHBondContact N-O 2.92Å; L580-L603 PolarHBondContact O-N 3.41Å; L580-F605 HydrophobicContact CB-CE2 4.41Å; L580-F605 HydrophobicContact CD2-CE2 4.13Å; L580-L634 HydrophobicContact CD2-CD1 4.29Å; L580-L634 HydrophobicContact CD2-CD2 3.95Å; L580-L634 HydrophobicContact CG-CD2 4.39Å; L580-E635 VanDerWaalsContact CD1-O 3.27Å; L580-E635 WeakPolarHBondContact CD1-O 3.44Å; L580-P637 HydrophobicContact CD1-CB 3.95Å; L580-L679 HydrophobicContact CD1-CD2 3.99Å
581	P	93	Very high	84.8	Confident	25 Å²	25	45.3 Å²	45.3	16%	0.162	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	146.4	176.1	-11.6	26.5	0	0	0	112.2	G601 V602 E635	P581-G601 WeakPolarHBondContact CA-O 3.46Å; P581-V602 HydrophobicContact CB-CG2 4.18Å; P581-V602 HydrophobicContact CG-CG1 4.4Å; P581-V602 HydrophobicContact CG-CG2 4.45Å; P581-E635 HydrophobicContact CB-CB 4.07Å; P581-E635 HydrophobicContact CG-CB 4.39Å; P581-E635 PolarHBondContact O-N 2.96Å
582	Y	93.8	Very high	84.7	Confident	35 Å²	35	49.5 Å²	49.5	14%	0.137	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	155.7	175.3	73.9	-88.6	0	0	0	112.2	A599 H600 G601 L603 I614 V633	Y582-A599 HydrophobicContact CE2-CB 4.27Å; Y582-H600 WeakPolarHBondContact O-CA 3.46Å; Y582-G601 WeakPolarHBondContact CD1-O 3.41Å; Y582-G601 PolarHBondContact N-O 3.47Å; Y582-G601 PolarHBondContact O-N 3.45Å; Y582-G601 VanDerWaalsContact O-N 3.13Å; Y582-L603 HydrophobicContact CD1-CD1 4.35Å; Y582-L603 HydrophobicContact CD1-CD2 4.28Å; Y582-L603 HydrophobicContact CD1-CG 3.85Å; Y582-L603 HydrophobicContact CE1-CD2 3.89Å; Y582-L603 HydrophobicContact CE1-CG 3.98Å; Y582-I614 HydrophobicContact CD1-CD1 4.07Å; Y582-I614 HydrophobicContact CD1-CG1 4.2Å; Y582-I614 HydrophobicContact CD2-CD1 3.76Å; Y582-I614 HydrophobicContact CD2-CG1 4.21Å; Y582-I614 HydrophobicContact CD2-CG2 3.94Å; Y582-I614 HydrophobicContact CE1-CD1 4.48Å; Y582-I614 HydrophobicContact CE1-CG1 4.14Å; Y582-I614 HydrophobicContact CE2-CB 4.41Å; Y582-I614 HydrophobicContact CE2-CD1 4.22Å; Y582-I614 HydrophobicContact CE2-CG1 4.17Å; Y582-I614 HydrophobicContact CE2-CG2 3.41Å; Y582-I614 VanDerWaalsContact CE2-CG2 3.41Å; Y582-I614 HydrophobicContact CG-CD1 3.68Å; Y582-I614 HydrophobicContact CG-CG1 4.23Å; Y582-V633 WeakPolarHBondContact CA-O 3.41Å
583	K	93.1	Very high	84.6	Confident	88 Å²	88	49.4 Å²	49.4	38%	0.383	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	150.1	174.9	67.8	-171.4	176.8	-152.6	0	113.1	V585 V633 E635	K583-V585 HydrophobicContact CG-CG2 4.33Å; K583-V633 PolarHBondContact N-O 2.84Å; K583-V633 PolarHBondContact O-N 3.07Å; K583-E635 WeakPolarHBondContact CE-OE1 3.25Å; K583-E635 IonicContact NZ-OE1 2.72Å; K583-E635 PolarHBondContact NZ-OE1 3.24Å
584	T	93.3	Very high	84.9	Confident	19 Å²	19	52.5 Å²	52.5	12%	0.117	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	144.6	166.2	52.7	0	0	0	0	111.1	F596 D598 A599 V616 F631 I632	T584-F596 HydrophobicContact CG2-CE2 4.36Å; T584-D598 PolarHBondContact OG1-OD1 3.35Å; T584-A599 HydrophobicContact CG2-CB 3.93Å; T584-A599 PolarHBondContact N-O 3.37Å; T584-A599 PolarHBondContact OG1-N 3.35Å; T584-A599 PolarHBondContact OG1-O 2.92Å; T584-V616 HydrophobicContact CG2-CG2 4.38Å; T584-F631 CarbonylContact C-O 3.56Å; T584-F631 WeakPolarHBondContact CA-O 3.22Å; T584-I632 HydrophobicContact CG2-CG1 4.36Å
585	V	91	Very high	85.1	Confident	56 Å²	56	53.7 Å²	53.7	34%	0.339	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128.5	177.2	-179.9	0	0	0	0	108.6	K583 F631 V633	K583-V585 HydrophobicContact CG-CG2 4.33Å; V585-F631 HydrophobicContact CB-CB 4.29Å; V585-F631 PolarHBondContact N-O 3.5Å; V585-F631 PolarHBondContact O-N 2.99Å; V585-V633 HydrophobicContact CG2-CG2 3.93Å
586	E	90.6	Very high	85.8	Confident	101 Å²	101	47 Å²	47	47%	0.472	26%	0.255	S	S	.	.			trans	-62.3	139.5	179.1	-58.8	-178.2	157.5	0	0	111.5	G591 F596	E586-G591 PolarHBondContact OE1-N 2.63Å; E586-F596 HydrophobicContact CG-CZ 4.38Å
587	G	85.6	Confident	86.3	Confident	38 Å²	38	49.9 Å²	49.9	39%	0.392	26%	0.263	S	S	.	.	S	Bend	trans	-117.9	-116.8	175.3	0	0	0	0	0	110.5	A589 S629	G587-A589 PolarHBondContact N-O 3.09Å; G587-S629 CarbonylContact C-O 3.44Å; G587-S629 VanDerWaalsContact CA-O 3.26Å; G587-S629 WeakPolarHBondContact CA-O 3.33Å
588	T	83.4	Confident	86.5	Confident	94 Å²	94	51 Å²	51	58%	0.577	27%	0.268	S	S	*	.	S	Bend	trans	-83.3	-30.5	165.2	51.9	0	0	0	0	111.7	S629	T588-S629 PolarHBondContact N-O 3.37Å; T588-S629 PolarHBondContact OG1-N 3.27Å; T588-S629 PolarHBondContact OG1-O 3.31Å; T588-S629 PolarHBondContact OG1-OG 3Å
589	A	83.4	Confident	86.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	-76.7	138.8	167.6	0	0	0	0	0	110.5	G587 D595 F596 S629 F630 I689	G587-A589 PolarHBondContact N-O 3.09Å; A589-D595 VanDerWaalsContact CA-OD2 3.26Å; A589-D595 WeakPolarHBondContact CA-OD2 3.5Å; A589-D595 HydrophobicContact CB-CB 3.93Å; A589-F596 HydrophobicContact CB-CD1 4.22Å; A589-F596 HydrophobicContact CB-CE1 4.19Å; A589-S629 PolarHBondContact N-O 3.02Å; A589-F630 HydrophobicContact CB-CB 4.2Å; A589-F630 HydrophobicContact CB-CD1 4.42Å; A589-I689 HydrophobicContact CB-CD1 4.25Å
590	R	84.1	Confident	86.6	Confident	157 Å²	157	57.4 Å²	57.4	59%	0.592	30%	0.299	S	S	*	.			trans	-100.7	141.2	-177.6	-71.5	-175.5	172.6	-157.6	1.3	112.5	E594 D595	R590-E594 HydrophobicContact CB-CB 3.92Å; R590-E594 VanDerWaalsContact CB-OE2 3.29Å; R590-E594 WeakPolarHBondContact CB-OE2 3.25Å; R590-E594 WeakPolarHBondContact CD-OE2 3.45Å; R590-E594 IonicContact NH1-OE2 3.07Å; R590-D595 PolarHBondContact N-OD2 3.35Å; R590-D595 PolarHBondContact O-N 3.4Å
591	G	79.3	Confident	86.5	Confident	2 Å²	2	58.6 Å²	58.6	2%	0.021	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-161	176.3	0	0	0	0	0	113	E586 G593 E594	E586-G591 PolarHBondContact OE1-N 2.63Å; G591-G593 VanDerWaalsContact C-N 3.27Å; G591-G593 PolarHBondContact O-N 3.47Å; G591-E594 PolarHBondContact O-N 3.03Å
592	N	77.6	Confident	86.4	Confident	142 Å²	142	61.2 Å²	61.2	76%	0.759	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	29.8	-178.2	-68.2	-66	0	0	0	115.7	D598	N592-D598 PolarHBondContact N-OD2 3.47Å
593	G	72.2	Confident	86.3	Confident	24 Å²	24	60.3 Å²	60.3	25%	0.247	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	20.6	179.1	0	0	0	0	0	113.5	G591 F596 L619 R621	G591-G593 VanDerWaalsContact C-N 3.27Å; G591-G593 PolarHBondContact O-N 3.47Å; G593-F596 PolarHBondContact N-O 3.23Å; G593-L619 WeakPolarHBondContact O-CD1 3.25Å; G593-R621 PolarHBondContact O-NH2 3.07Å
594	E	79.9	Confident	86.1	Confident	76 Å²	76	60.3 Å²	60.3	36%	0.355	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-86	161.2	-71.1	-171.2	169	0	0	111	R590 G591 R621	R590-E594 HydrophobicContact CB-CB 3.92Å; R590-E594 VanDerWaalsContact CB-OE2 3.29Å; R590-E594 WeakPolarHBondContact CB-OE2 3.25Å; R590-E594 WeakPolarHBondContact CD-OE2 3.45Å; R590-E594 IonicContact NH1-OE2 3.07Å; G591-E594 PolarHBondContact O-N 3.03Å; E594-R621 VanDerWaalsContact CA-NH2 3.33Å; E594-R621 WeakPolarHBondContact O-CD 3.44Å; E594-R621 PolarHBondContact O-NE 3.43Å
595	D	82.1	Confident	85.9	Confident	37 Å²	37	59.4 Å²	59.4	20%	0.198	32%	0.32	C	S	.	.	S	Bend	trans	-97.1	-29	-177.5	-54	-45	0	0	0	111.7	A589 R590 L619 I689	A589-D595 VanDerWaalsContact CA-OD2 3.26Å; A589-D595 WeakPolarHBondContact CA-OD2 3.5Å; A589-D595 HydrophobicContact CB-CB 3.93Å; R590-D595 PolarHBondContact N-OD2 3.35Å; R590-D595 PolarHBondContact O-N 3.4Å; D595-L619 PolarHBondContact O-N 3.34Å; D595-I689 HydrophobicContact CB-CD1 4.45Å
596	F	87.9	Confident	85.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-144.1	159.8	174.7	66.3	-83	0	0	0	111.7	T584 E586 A589 G593 D598 V616 R617 F630	T584-F596 HydrophobicContact CG2-CE2 4.36Å; E586-F596 HydrophobicContact CG-CZ 4.38Å; A589-F596 HydrophobicContact CB-CD1 4.22Å; A589-F596 HydrophobicContact CB-CE1 4.19Å; G593-F596 PolarHBondContact N-O 3.23Å; F596-D598 WeakPolarHBondContact CE2-OD1 3.32Å; F596-V616 HydrophobicContact CB-CG1 4.48Å; F596-V616 HydrophobicContact CD2-CG1 4.44Å; F596-R617 WeakPolarHBondContact CA-O 3.3Å; F596-F630 HydrophobicContact CB-CE1 4.4Å; F596-F630 HydrophobicContact CD1-CB 4.03Å; F596-F630 AromaticContact CD1-CD1 3.8Å; F596-F630 HydrophobicContact CD1-CD1 3.8Å; F596-F630 HydrophobicContact CD1-CD2 4.33Å; F596-F630 HydrophobicContact CD1-CE1 4.3Å; F596-F630 AromaticContact CD1-CG 3.8Å; F596-F630 HydrophobicContact CD1-CG 3.8Å; F596-F630 HydrophobicContact CD2-CD2 4.26Å; F596-F630 HydrophobicContact CD2-CE2 4.35Å; F596-F630 HydrophobicContact CE1-CB 3.44Å; F596-F630 VanDerWaalsContact CE1-CB 3.44Å; F596-F630 HydrophobicContact CE1-CD1 4.13Å; F596-F630 HydrophobicContact CE1-CD2 4.2Å; F596-F630 AromaticContact CE1-CG 3.69Å; F596-F630 HydrophobicContact CE1-CG 3.69Å; F596-F630 HydrophobicContact CE2-CD2 4.13Å; F596-F630 HydrophobicContact CE2-CG 4.44Å; F596-F630 HydrophobicContact CG-CD1 4.23Å; F596-F630 HydrophobicContact CG-CD2 4.37Å; F596-F630 HydrophobicContact CG-CE1 4.31Å; F596-F630 HydrophobicContact CG-CE2 4.47Å; F596-F630 HydrophobicContact CG-CG 4.25Å; F596-F630 HydrophobicContact CG-CZ 4.43Å; F596-F630 HydrophobicContact CZ-CB 3.82Å; F596-F630 HydrophobicContact CZ-CD2 4.1Å; F596-F630 HydrophobicContact CZ-CG 4.03Å
597	E	89	Confident	85.2	Confident	79 Å²	79	59.6 Å²	59.6	37%	0.369	32%	0.32	S	S	.	.			trans	-87.7	127.4	170.1	-67.6	-179.1	-177.3	0	0	110	A599 R617 L619	E597-A599 PolarHBondContact O-N 3.44Å; E597-R617 HydrophobicContact CB-CB 4.2Å; E597-R617 VanDerWaalsContact CD-CD 3.47Å; E597-R617 HydrophobicContact CG-CB 4.27Å; E597-R617 PolarHBondContact N-O 2.81Å; E597-R617 WeakPolarHBondContact OE1-CD 3.47Å; E597-R617 IonicContact OE1-CZ 3.84Å; E597-R617 IonicContact OE1-NE 3.98Å; E597-R617 IonicContact OE1-NH1 2.82Å; E597-R617 PolarHBondContact OE1-NH1 3.24Å; E597-R617 WeakPolarHBondContact OE2-CD 3.3Å; E597-R617 IonicContact OE2-NH1 3.54Å; E597-L619 HydrophobicContact CG-CD1 4.35Å
598	D	88.9	Confident	84.9	Confident	60 Å²	60	63.3 Å²	63.3	32%	0.321	33%	0.331	S	S	.	.			trans	-62.5	127.8	-178.6	-70.6	-58.7	0	0	0	112.3	T584 N592 F596	T584-D598 PolarHBondContact OG1-OD1 3.35Å; N592-D598 PolarHBondContact N-OD2 3.47Å; F596-D598 WeakPolarHBondContact CE2-OD1 3.32Å
599	A	88.2	Confident	84.9	Confident	14 Å²	14	61.1 Å²	61.1	12%	0.116	31%	0.314	C	S	.	.			trans	-116.1	127.2	179.6	0	0	0	0	0	110.9	Y582 T584 E597 V616	Y582-A599 HydrophobicContact CE2-CB 4.27Å; T584-A599 HydrophobicContact CG2-CB 3.93Å; T584-A599 PolarHBondContact N-O 3.37Å; T584-A599 PolarHBondContact OG1-N 3.35Å; T584-A599 PolarHBondContact OG1-O 2.92Å; E597-A599 PolarHBondContact O-N 3.44Å; A599-V616 HydrophobicContact CB-CG2 4.03Å
600	H	90.4	Very high	84.8	Confident	158 Å²	158	66 Å²	66	73%	0.731	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.4	140.7	172.6	60	-80.3	0	0	0	109.3	Y582	Y582-H600 WeakPolarHBondContact O-CA 3.46Å
601	G	89.8	Confident	84.9	Confident	25 Å²	25	61.8 Å²	61.8	26%	0.258	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.5	-179.6	-176	0	0	0	0	0	113.3	P581 Y582	P581-G601 WeakPolarHBondContact CA-O 3.46Å; Y582-G601 WeakPolarHBondContact CD1-O 3.41Å; Y582-G601 PolarHBondContact N-O 3.47Å; Y582-G601 PolarHBondContact O-N 3.45Å; Y582-G601 VanDerWaalsContact O-N 3.13Å
602	V	91.2	Very high	85.5	Confident	81 Å²	81	64.6 Å²	64.6	49%	0.491	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	122.4	173.7	-171.7	0	0	0	0	108	M579 P581	M579-V602 HydrophobicContact CB-CG1 3.93Å; M579-V602 HydrophobicContact CE-CB 4.44Å; M579-V602 HydrophobicContact CE-CG1 3.64Å; P581-V602 HydrophobicContact CB-CG2 4.18Å; P581-V602 HydrophobicContact CG-CG1 4.4Å; P581-V602 HydrophobicContact CG-CG2 4.45Å
603	L	90.3	Very high	86.1	Confident	16 Å²	16	60.7 Å²	60.7	8%	0.084	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	126	173.5	-59.9	175.6	0	0	0	108.9	V568 M579 L580 Y582 F605 K612 I614	V568-L603 HydrophobicContact CB-CD1 4.07Å; V568-L603 HydrophobicContact CG1-CD1 4.46Å; V568-L603 HydrophobicContact CG2-CD1 3.77Å; M579-L603 CarbonylContact C-O 3.58Å; M579-L603 WeakPolarHBondContact CA-O 3.27Å; L580-L603 HydrophobicContact CB-CB 4.35Å; L580-L603 HydrophobicContact CD2-CD1 4.47Å; L580-L603 PolarHBondContact N-O 2.92Å; L580-L603 PolarHBondContact O-N 3.41Å; Y582-L603 HydrophobicContact CD1-CD1 4.35Å; Y582-L603 HydrophobicContact CD1-CD2 4.28Å; Y582-L603 HydrophobicContact CD1-CG 3.85Å; Y582-L603 HydrophobicContact CE1-CD2 3.89Å; Y582-L603 HydrophobicContact CE1-CG 3.98Å; L603-F605 HydrophobicContact CB-CD2 4.3Å; L603-F605 HydrophobicContact CB-CE2 3.91Å; L603-F605 HydrophobicContact CD1-CE2 4.31Å; L603-K612 HydrophobicContact CD1-CB 4.14Å; L603-K612 HydrophobicContact CD2-CB 4.24Å; L603-I614 HydrophobicContact CD1-CD1 4.16Å; L603-I614 HydrophobicContact CD1-CG1 3.93Å; L603-I614 HydrophobicContact CD2-CG1 4.26Å; L603-I614 HydrophobicContact CG-CG1 4.5Å
604	E	90.6	Very high	87	Confident	87 Å²	87	59.6 Å²	59.6	41%	0.407	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	108.9	174.7	-180	174.9	-178.8	0	0	109	V577 M579 Q606 K612	V577-E604 HydrophobicContact CG1-CG 4.29Å; M579-E604 HydrophobicContact CE-CB 3.8Å; M579-E604 HydrophobicContact CE-CG 4.17Å; M579-E604 HydrophobicContact SD-CB 3.83Å; M579-E604 HydrophobicContact SD-CG 3.61Å; E604-Q606 VanDerWaalsContact CD-NE2 3.32Å; E604-Q606 PolarHBondContact OE1-NE2 2.88Å; E604-K612 WeakPolarHBondContact O-CE 3.39Å
605	F	88.9	Confident	87.5	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	120.8	173.6	-74.3	-100.4	0	0	0	109.7	F548 V568 R570 V577 V578 L580 L603 E609 K612	F548-F605 HydrophobicContact CD1-CD2 4.1Å; F548-F605 HydrophobicContact CD1-CE1 4.44Å; F548-F605 AromaticContact CD1-CE2 3.79Å; F548-F605 HydrophobicContact CD1-CE2 3.79Å; F548-F605 AromaticContact CD1-CZ 3.96Å; F548-F605 HydrophobicContact CD1-CZ 3.96Å; F548-F605 HydrophobicContact CE1-CB 4.26Å; F548-F605 AromaticContact CE1-CD1 3.98Å; F548-F605 HydrophobicContact CE1-CD1 3.98Å; F548-F605 AromaticContact CE1-CD2 3.5Å; F548-F605 HydrophobicContact CE1-CD2 3.5Å; F548-F605 VanDerWaalsContact CE1-CD2 3.5Å; F548-F605 HydrophobicContact CE1-CE1 4.11Å; F548-F605 AromaticContact CE1-CE2 3.67Å; F548-F605 HydrophobicContact CE1-CE2 3.67Å; F548-F605 AromaticContact CE1-CG 3.66Å; F548-F605 HydrophobicContact CE1-CG 3.66Å; F548-F605 AromaticContact CE1-CZ 3.96Å; F548-F605 HydrophobicContact CE1-CZ 3.96Å; F548-F605 HydrophobicContact CZ-CD2 4.44Å; F548-F605 HydrophobicContact CZ-CG 4.46Å; V568-F605 HydrophobicContact CB-CZ 4.36Å; V568-F605 HydrophobicContact CG1-CZ 4.15Å; R570-F605 HydrophobicContact CB-CD1 4.21Å; R570-F605 HydrophobicContact CB-CE1 4.03Å; V577-F605 VanDerWaalsContact CA-O 3.29Å; V577-F605 WeakPolarHBondContact CA-O 3.28Å; V577-F605 WeakPolarHBondContact CG1-O 3.37Å; V578-F605 PolarHBondContact N-O 2.85Å; V578-F605 PolarHBondContact O-N 3.48Å; L580-F605 HydrophobicContact CB-CE2 4.41Å; L580-F605 HydrophobicContact CD2-CE2 4.13Å; L603-F605 HydrophobicContact CB-CD2 4.3Å; L603-F605 HydrophobicContact CB-CE2 3.91Å; L603-F605 HydrophobicContact CD1-CE2 4.31Å; F605-E609 WeakPolarHBondContact CA-OE2 3.32Å; F605-E609 HydrophobicContact CD1-CG 4.28Å; F605-E609 WeakPolarHBondContact CD1-O 3.28Å; F605-K612 HydrophobicContact CD1-CG 4.02Å; F605-K612 HydrophobicContact CD2-CG 4.19Å; F605-K612 HydrophobicContact CE1-CB 4.01Å; F605-K612 HydrophobicContact CE1-CG 3.75Å; F605-K612 HydrophobicContact CE2-CB 4.07Å; F605-K612 HydrophobicContact CE2-CG 3.92Å; F605-K612 HydrophobicContact CG-CG 4.24Å; F605-K612 HydrophobicContact CZ-CB 3.63Å; F605-K612 HydrophobicContact CZ-CG 3.71Å
606	Q	86.1	Confident	87.9	Confident	84 Å²	84	58.1 Å²	58.1	39%	0.393	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-75.8	173	173.5	-61.3	-59.6	-41.1	0	0	111.9	R570 E604 D608 E609	R570-Q606 PolarHBondContact NH1-O 3.25Å; E604-Q606 VanDerWaalsContact CD-NE2 3.32Å; E604-Q606 PolarHBondContact OE1-NE2 2.88Å; Q606-D608 PolarHBondContact O-N 2.96Å; Q606-E609 HydrophobicContact CB-CB 4.22Å; Q606-E609 PolarHBondContact N-OE2 3.13Å; Q606-E609 WeakPolarHBondContact O-CB 3.47Å; Q606-E609 PolarHBondContact O-N 2.82Å
607	N	80.7	Confident	87.9	Confident	78 Å²	78	64.1 Å²	64.1	42%	0.417	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	136.6	168	-162.1	81	0	0	0	109.3	G576 E609	G576-N607 PolarHBondContact N-OD1 3.4Å; N607-E609 PolarHBondContact O-N 2.94Å
608	D	78.7	Confident	87.9	Confident	116 Å²	116	60.6 Å²	60.6	62%	0.62	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	9.4	-178.4	-43.6	-40.3	0	0	0	114.6	A574 Q606	A574-D608 PolarHBondContact O-N 3.14Å; Q606-D608 PolarHBondContact O-N 2.96Å
609	E	82.7	Confident	87.6	Confident	48 Å²	48	59.8 Å²	59.8	22%	0.224	31%	0.309	C	S	.	.			trans	-91.8	119	175.4	-168.4	168.8	-152.9	0	0	110.8	R570 F605 Q606 N607 K612	R570-E609 WeakPolarHBondContact CD-O 3.18Å; R570-E609 PolarHBondContact NH1-O 3.18Å; F605-E609 WeakPolarHBondContact CA-OE2 3.32Å; F605-E609 HydrophobicContact CD1-CG 4.28Å; F605-E609 WeakPolarHBondContact CD1-O 3.28Å; Q606-E609 HydrophobicContact CB-CB 4.22Å; Q606-E609 PolarHBondContact N-OE2 3.13Å; Q606-E609 WeakPolarHBondContact O-CB 3.47Å; Q606-E609 PolarHBondContact O-N 2.82Å; N607-E609 PolarHBondContact O-N 2.94Å; E609-K612 VanDerWaalsContact CD-CE 3.43Å; E609-K612 VanDerWaalsContact CD-NZ 3.32Å; E609-K612 WeakPolarHBondContact OE1-CD 3.37Å; E609-K612 WeakPolarHBondContact OE1-CE 3.2Å; E609-K612 IonicContact OE1-NZ 2.83Å; E609-K612 PolarHBondContact OE1-NZ 2.99Å; E609-K612 WeakPolarHBondContact OE2-CE 3.39Å; E609-K612 IonicContact OE2-NZ 4Å; E609-K612 PolarHBondContact OE2-NZ 2.89Å
610	I	82.3	Confident	87	Confident	101 Å²	101	64 Å²	64	52%	0.518	33%	0.329	S	S	.	.			trans	-105.4	-12.8	-173.7	60.2	169.4	0	0	0	114.6	R570 A574	R570-I610 PolarHBondContact N-O 3.13Å; A574-I610 HydrophobicContact CB-CG2 3.96Å
611	L	86.8	Confident	85.8	Confident	69 Å²	69	61.6 Å²	61.6	36%	0.361	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	133.9	-172.7	-172.5	148.1	0	0	0	112.2	K567 V568 L569 T613	K567-L611 HydrophobicContact CB-CD1 4.46Å; K567-L611 HydrophobicContact CD-CD1 4.21Å; K567-L611 HydrophobicContact CG-CD1 4.4Å; K567-L611 HydrophobicContact CG-CD2 4.47Å; V568-L611 WeakPolarHBondContact O-CA 3.5Å; L569-L611 HydrophobicContact CD2-CD1 4.3Å; L611-T613 HydrophobicContact CD2-CG2 4.14Å
612	K	90.2	Very high	84.2	Confident	62 Å²	62	66.6 Å²	66.6	27%	0.27	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	152.6	168	-76.2	-65.4	-159.1	-161.3	0	110.4	V568 L603 E604 F605 E609	V568-K612 PolarHBondContact N-O 2.66Å; V568-K612 PolarHBondContact O-N 3.18Å; V568-K612 VanDerWaalsContact O-N 3.12Å; L603-K612 HydrophobicContact CD1-CB 4.14Å; L603-K612 HydrophobicContact CD2-CB 4.24Å; E604-K612 WeakPolarHBondContact O-CE 3.39Å; F605-K612 HydrophobicContact CD1-CG 4.02Å; F605-K612 HydrophobicContact CD2-CG 4.19Å; F605-K612 HydrophobicContact CE1-CB 4.01Å; F605-K612 HydrophobicContact CE1-CG 3.75Å; F605-K612 HydrophobicContact CE2-CB 4.07Å; F605-K612 HydrophobicContact CE2-CG 3.92Å; F605-K612 HydrophobicContact CG-CG 4.24Å; F605-K612 HydrophobicContact CZ-CB 3.63Å; F605-K612 HydrophobicContact CZ-CG 3.71Å; E609-K612 VanDerWaalsContact CD-CE 3.43Å; E609-K612 VanDerWaalsContact CD-NZ 3.32Å; E609-K612 WeakPolarHBondContact OE1-CD 3.37Å; E609-K612 WeakPolarHBondContact OE1-CE 3.2Å; E609-K612 IonicContact OE1-NZ 2.83Å; E609-K612 PolarHBondContact OE1-NZ 2.99Å; E609-K612 WeakPolarHBondContact OE2-CE 3.39Å; E609-K612 IonicContact OE2-NZ 4Å; E609-K612 PolarHBondContact OE2-NZ 2.89Å
613	T	91	Very high	82.5	Confident	60 Å²	60	70 Å²	70	37%	0.368	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.1	177.6	51.1	0	0	0	0	111.9	V566 K567 L611	V566-T613 CarbonylContact O-C 3.54Å; V566-T613 VanDerWaalsContact O-CA 3.31Å; V566-T613 WeakPolarHBondContact O-CA 3.49Å; K567-T613 HydrophobicContact CG-CG2 3.89Å; L611-T613 HydrophobicContact CD2-CG2 4.14Å
614	I	92.1	Very high	80.7	Confident	1 Å²	1	75.7 Å²	75.7	1%	0.005	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	126.5	169.9	-61.9	169.4	0	0	0	107.5	F550 E565 V566 V568 Y582 L603 V616 I632 L634	F550-I614 HydrophobicContact CE1-CD1 4.3Å; E565-I614 WeakPolarHBondContact CA-O 3.35Å; V566-I614 HydrophobicContact CB-CB 4.39Å; V566-I614 PolarHBondContact N-O 3.18Å; V566-I614 PolarHBondContact O-N 3.34Å; V568-I614 HydrophobicContact CG2-CD1 3.71Å; V568-I614 HydrophobicContact CG2-CG1 4.17Å; Y582-I614 HydrophobicContact CD1-CD1 4.07Å; Y582-I614 HydrophobicContact CD1-CG1 4.2Å; Y582-I614 HydrophobicContact CD2-CD1 3.76Å; Y582-I614 HydrophobicContact CD2-CG1 4.21Å; Y582-I614 HydrophobicContact CD2-CG2 3.94Å; Y582-I614 HydrophobicContact CE1-CD1 4.48Å; Y582-I614 HydrophobicContact CE1-CG1 4.14Å; Y582-I614 HydrophobicContact CE2-CB 4.41Å; Y582-I614 HydrophobicContact CE2-CD1 4.22Å; Y582-I614 HydrophobicContact CE2-CG1 4.17Å; Y582-I614 HydrophobicContact CE2-CG2 3.41Å; Y582-I614 VanDerWaalsContact CE2-CG2 3.41Å; Y582-I614 HydrophobicContact CG-CD1 3.68Å; Y582-I614 HydrophobicContact CG-CG1 4.23Å; L603-I614 HydrophobicContact CD1-CD1 4.16Å; L603-I614 HydrophobicContact CD1-CG1 3.93Å; L603-I614 HydrophobicContact CD2-CG1 4.26Å; L603-I614 HydrophobicContact CG-CG1 4.5Å; I614-V616 HydrophobicContact CG2-CG2 4.01Å; I614-I632 HydrophobicContact CD1-CG2 4.25Å; I614-L634 HydrophobicContact CD1-CD2 4.4Å
615	T	90.4	Very high	78.9	Confident	79 Å²	79	73.4 Å²	73.4	49%	0.485	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	123.8	175.2	56.6	0	0	0	0	110.1	M564 E565	M564-T615 WeakPolarHBondContact O-CA 3.46Å; E565-T615 HydrophobicContact CG-CG2 4.38Å
616	V	90.6	Very high	77.6	Confident	2 Å²	2	82 Å²	82	1%	0.012	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	135.4	173.6	-175.4	0	0	0	0	108.9	M564 T584 F596 A599 I614 F630 I632	M564-V616 HydrophobicContact CG-CB 3.73Å; M564-V616 WeakPolarHBondContact CG-O 3.41Å; M564-V616 PolarHBondContact N-O 2.98Å; M564-V616 PolarHBondContact O-N 2.97Å; M564-V616 HydrophobicContact SD-CB 3.93Å; M564-V616 HydrophobicContact SD-CG2 4.46Å; T584-V616 HydrophobicContact CG2-CG2 4.38Å; F596-V616 HydrophobicContact CB-CG1 4.48Å; F596-V616 HydrophobicContact CD2-CG1 4.44Å; A599-V616 HydrophobicContact CB-CG2 4.03Å; I614-V616 HydrophobicContact CG2-CG2 4.01Å; V616-F630 HydrophobicContact CG1-CE2 4.29Å; V616-F630 HydrophobicContact CG1-CZ 4.19Å; V616-I632 HydrophobicContact CG2-CD1 3.92Å
617	R	87.7	Confident	76.8	Confident	127 Å²	127	85.2 Å²	85.2	48%	0.479	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	122.9	179.6	-161.8	-176.4	-178	-167.2	0.8	110.2	G562 F596 E597	G562-R617 WeakPolarHBondContact O-CA 3.47Å; G562-R617 WeakPolarHBondContact O-CG 3.39Å; F596-R617 WeakPolarHBondContact CA-O 3.3Å; E597-R617 HydrophobicContact CB-CB 4.2Å; E597-R617 VanDerWaalsContact CD-CD 3.47Å; E597-R617 HydrophobicContact CG-CB 4.27Å; E597-R617 PolarHBondContact N-O 2.81Å; E597-R617 WeakPolarHBondContact OE1-CD 3.47Å; E597-R617 IonicContact OE1-CZ 3.84Å; E597-R617 IonicContact OE1-NE 3.98Å; E597-R617 IonicContact OE1-NH1 2.82Å; E597-R617 PolarHBondContact OE1-NH1 3.24Å; E597-R617 WeakPolarHBondContact OE2-CD 3.3Å; E597-R617 IonicContact OE2-NH1 3.54Å
618	I	88.5	Confident	76.9	Confident	4 Å²	4	82 Å²	82	2%	0.021	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-94.8	134.8	174.4	-48.8	176.6	0	0	0	107.7	V557 G562 M564 I689	V557-I618 HydrophobicContact CB-CD1 3.94Å; V557-I618 HydrophobicContact CG2-CD1 3.55Å; G562-I618 PolarHBondContact O-N 3.12Å; G562-I618 VanDerWaalsContact O-O 3.11Å; M564-I618 HydrophobicContact CB-CD1 4.24Å; M564-I618 HydrophobicContact CE-CD1 3.48Å; M564-I618 VanDerWaalsContact CE-CD1 3.48Å; M564-I618 HydrophobicContact CE-CG1 3.97Å; M564-I618 HydrophobicContact CG-CD1 4.26Å; M564-I618 HydrophobicContact CG-CG1 4.14Å; I618-I689 HydrophobicContact CG2-CD1 4.24Å
619	L	83.1	Confident	77.4	Confident	43 Å²	43	77.2 Å²	77.2	23%	0.225	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-101.3	117.8	179.5	-63.3	176.2	0	0	0	109.8	G593 D595 E597 R621	G593-L619 WeakPolarHBondContact O-CD1 3.25Å; D595-L619 PolarHBondContact O-N 3.34Å; E597-L619 HydrophobicContact CG-CD1 4.35Å; L619-R621 PolarHBondContact O-N 2.83Å; L619-R621 VanDerWaalsContact O-N 3.16Å
620	D	75.9	Confident	77.9	Confident	102 Å²	102	74.9 Å²	74.9	55%	0.545	36%	0.357	S	S	.	.			trans	-71.2	106.6	170.7	-173.8	-10.2	0	0	0	108.8
621	R	64.4	Low	78.4	Confident	109 Å²	109	71.9 Å²	71.9	41%	0.411	34%	0.34	S	S	.	.			trans	-101.9	126.7	170.1	-71.4	-169.7	173.9	-141.7	-5.6	108.1	G593 E594 L619 E623	G593-R621 PolarHBondContact O-NH2 3.07Å; E594-R621 VanDerWaalsContact CA-NH2 3.33Å; E594-R621 WeakPolarHBondContact O-CD 3.44Å; E594-R621 PolarHBondContact O-NE 3.43Å; L619-R621 PolarHBondContact O-N 2.83Å; L619-R621 VanDerWaalsContact O-N 3.16Å; R621-E623 PolarHBondContact O-N 2.86Å
622	E	55.8	Low	78.6	Confident	130 Å²	130	68.6 Å²	68.6	61%	0.607	32%	0.323	S	S	*	.	S	Bend	trans	-71.9	38.5	177.1	-51.6	-178.6	155.5	0	0	113.4	K337	K337-E622 WeakPolarHBondContact CE-OE2 3.4Å; K337-E622 PolarHBondContact NZ-O 3.48Å; K337-E622 IonicContact NZ-OE2 3.65Å; K337-E622 PolarHBondContact NZ-OE2 3.3Å
623	E	54.9	Low	78.8	Confident	152 Å²	152	67.2 Å²	67.2	71%	0.71	32%	0.319	S	S	*	.	S	Bend	trans	-115	136.6	176.6	-167.9	161.3	-157.8	0	0	108.9	R621 S625	R621-E623 PolarHBondContact O-N 2.86Å; E623-S625 VanDerWaalsContact C-N 3.3Å; E623-S625 PolarHBondContact O-N 2.79Å
624	Y	53.9	Low	78.8	Confident	135 Å²	135	64.5 Å²	64.5	53%	0.529	30%	0.303	S	S	.	.			trans	-70.9	88.1	-179.3	-172.7	-90.8	0	0	0	108.9	E691	Y624-E691 WeakPolarHBondContact CD2-OE1 3.4Å; Y624-E691 VanDerWaalsContact CE2-OE1 3.24Å; Y624-E691 WeakPolarHBondContact CE2-OE1 3.13Å
625	S	52.5	Low	78.7	Confident	40 Å²	40	68 Å²	68	28%	0.28	32%	0.319	S	S	.	.			trans	-92.6	145.2	175.5	-168.5	0	0	0	0	110.1	E623 S628	E623-S625 VanDerWaalsContact C-N 3.3Å; E623-S625 PolarHBondContact O-N 2.79Å; S625-S628 PolarHBondContact OG-OG 3.11Å
626	K	61.2	Low	78.5	Confident	179 Å²	179	69.1 Å²	69.1	78%	0.778	33%	0.326	S	S	*	.			trans	-67.5	167.9	168.4	-68	-179.1	176.9	-175.4	0	109.1	S628	K626-S628 PolarHBondContact O-N 3.45Å; K626-S628 PolarHBondContact O-OG 3.3Å
627	E	70	Confident	78.3	Confident	153 Å²	153	70 Å²	70	72%	0.715	33%	0.332	S	S	*	.	S	Bend	trans	-40.4	112.4	166.7	-70.3	171	-174.6	0	0	109.9
628	S	81.4	Confident	78.1	Confident	9 Å²	9	70.2 Å²	70.2	6%	0.063	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	136.6	-174.1	-63.7	0	0	0	0	107.9	S625 K626 I689	S625-S628 PolarHBondContact OG-OG 3.11Å; K626-S628 PolarHBondContact O-N 3.45Å; K626-S628 PolarHBondContact O-OG 3.3Å; S628-I689 PolarHBondContact N-O 3.01Å; S628-I689 WeakPolarHBondContact O-CB 3.43Å; S628-I689 PolarHBondContact O-N 2.71Å
629	S	89.8	Confident	77.7	Confident	16 Å²	16	74.3 Å²	74.3	11%	0.112	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	144.3	-176.1	71	0	0	0	0	112.8	G587 T588 A589 E686 V687	G587-S629 CarbonylContact C-O 3.44Å; G587-S629 VanDerWaalsContact CA-O 3.26Å; G587-S629 WeakPolarHBondContact CA-O 3.33Å; T588-S629 PolarHBondContact N-O 3.37Å; T588-S629 PolarHBondContact OG1-N 3.27Å; T588-S629 PolarHBondContact OG1-O 3.31Å; T588-S629 PolarHBondContact OG1-OG 3Å; A589-S629 PolarHBondContact N-O 3.02Å; S629-E686 PolarHBondContact OG-OE1 2.86Å; S629-V687 CarbonylContact C-O 3.48Å; S629-V687 WeakPolarHBondContact CA-O 3.41Å; S629-V687 WeakPolarHBondContact CB-O 3.37Å
630	F	92.7	Very high	77.2	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	170.4	170.8	70.3	-84.3	0	0	0	110	M564 A589 F596 V616 I632 V687 I689	M564-F630 HydrophobicContact CE-CE1 4.36Å; M564-F630 HydrophobicContact CE-CZ 4Å; M564-F630 HydrophobicContact SD-CZ 4.02Å; A589-F630 HydrophobicContact CB-CB 4.2Å; A589-F630 HydrophobicContact CB-CD1 4.42Å; F596-F630 HydrophobicContact CB-CE1 4.4Å; F596-F630 HydrophobicContact CD1-CB 4.03Å; F596-F630 AromaticContact CD1-CD1 3.8Å; F596-F630 HydrophobicContact CD1-CD1 3.8Å; F596-F630 HydrophobicContact CD1-CD2 4.33Å; F596-F630 HydrophobicContact CD1-CE1 4.3Å; F596-F630 AromaticContact CD1-CG 3.8Å; F596-F630 HydrophobicContact CD1-CG 3.8Å; F596-F630 HydrophobicContact CD2-CD2 4.26Å; F596-F630 HydrophobicContact CD2-CE2 4.35Å; F596-F630 HydrophobicContact CE1-CB 3.44Å; F596-F630 VanDerWaalsContact CE1-CB 3.44Å; F596-F630 HydrophobicContact CE1-CD1 4.13Å; F596-F630 HydrophobicContact CE1-CD2 4.2Å; F596-F630 AromaticContact CE1-CG 3.69Å; F596-F630 HydrophobicContact CE1-CG 3.69Å; F596-F630 HydrophobicContact CE2-CD2 4.13Å; F596-F630 HydrophobicContact CE2-CG 4.44Å; F596-F630 HydrophobicContact CG-CD1 4.23Å; F596-F630 HydrophobicContact CG-CD2 4.37Å; F596-F630 HydrophobicContact CG-CE1 4.31Å; F596-F630 HydrophobicContact CG-CE2 4.47Å; F596-F630 HydrophobicContact CG-CG 4.25Å; F596-F630 HydrophobicContact CG-CZ 4.43Å; F596-F630 HydrophobicContact CZ-CB 3.82Å; F596-F630 HydrophobicContact CZ-CD2 4.1Å; F596-F630 HydrophobicContact CZ-CG 4.03Å; V616-F630 HydrophobicContact CG1-CE2 4.29Å; V616-F630 HydrophobicContact CG1-CZ 4.19Å; F630-I632 HydrophobicContact CD2-CG1 4.39Å; F630-I632 HydrophobicContact CE2-CD1 4.16Å; F630-I632 HydrophobicContact CE2-CG1 3.9Å; F630-V687 HydrophobicContact CD1-CB 3.9Å; F630-V687 HydrophobicContact CD1-CG1 4Å; F630-V687 HydrophobicContact CD2-CB 4.41Å; F630-V687 HydrophobicContact CE1-CB 3.56Å; F630-V687 HydrophobicContact CE1-CG1 3.31Å; F630-V687 HydrophobicContact CE1-CG2 4.25Å; F630-V687 HydrophobicContact CE2-CB 4.09Å; F630-V687 HydrophobicContact CE2-CG2 4Å; F630-V687 HydrophobicContact CG-CB 4.33Å; F630-V687 HydrophobicContact CZ-CB 3.66Å; F630-V687 HydrophobicContact CZ-CG1 3.62Å; F630-V687 HydrophobicContact CZ-CG2 3.81Å; F630-V687 PolarHBondContact N-O 3.36Å; F630-V687 PolarHBondContact O-N 2.96Å; F630-I689 HydrophobicContact CD1-CD1 4Å; F630-I689 HydrophobicContact CD1-CG1 4.37Å; F630-I689 HydrophobicContact CE1-CD1 3.98Å; F630-I689 HydrophobicContact CE1-CG1 4.19Å
631	F	92.9	Very high	76.4	Confident	38 Å²	38	84.8 Å²	84.8	17%	0.167	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	147.3	-176.2	-56.6	-80	0	0	0	112.6	T584 V585 K684 L685 E686	T584-F631 CarbonylContact C-O 3.56Å; T584-F631 WeakPolarHBondContact CA-O 3.22Å; V585-F631 HydrophobicContact CB-CB 4.29Å; V585-F631 PolarHBondContact N-O 3.5Å; V585-F631 PolarHBondContact O-N 2.99Å; F631-K684 HydrophobicContact CB-CG 4.36Å; F631-K684 HydrophobicContact CD1-CD 4.16Å; F631-K684 HydrophobicContact CD1-CG 4.18Å; F631-L685 CarbonylContact C-O 3.47Å; F631-L685 VanDerWaalsContact CA-O 3.23Å; F631-L685 WeakPolarHBondContact CA-O 3.24Å; F631-E686 HydrophobicContact CD1-CB 3.81Å; F631-E686 HydrophobicContact CD1-CG 4.03Å; F631-E686 HydrophobicContact CE1-CB 3.67Å; F631-E686 HydrophobicContact CE1-CG 3.58Å; F631-E686 HydrophobicContact CZ-CG 4.33Å
632	I	92.4	Very high	75.4	Confident	0 Å²	0	87 Å²	87	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	127.5	168	-50.8	-178.1	0	0	0	107.8	F550 V566 T584 I614 V616 F630 K684 L685 V687	F550-I632 HydrophobicContact CZ-CB 4.28Å; F550-I632 HydrophobicContact CZ-CG2 3.92Å; V566-I632 HydrophobicContact CB-CD1 4.48Å; V566-I632 HydrophobicContact CG2-CD1 3.91Å; T584-I632 HydrophobicContact CG2-CG1 4.36Å; I614-I632 HydrophobicContact CD1-CG2 4.25Å; V616-I632 HydrophobicContact CG2-CD1 3.92Å; F630-I632 HydrophobicContact CD2-CG1 4.39Å; F630-I632 HydrophobicContact CE2-CD1 4.16Å; F630-I632 HydrophobicContact CE2-CG1 3.9Å; I632-K684 WeakPolarHBondContact O-CA 3.48Å; I632-L685 HydrophobicContact CB-CB 4.39Å; I632-L685 HydrophobicContact CD1-CD2 4.39Å; I632-L685 PolarHBondContact N-O 3.3Å; I632-L685 PolarHBondContact O-N 3.11Å; I632-V687 HydrophobicContact CD1-CG2 4.21Å; I632-V687 HydrophobicContact CG1-CG2 4.37Å
633	V	93	Very high	74.6	Confident	32 Å²	32	91 Å²	91	19%	0.194	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	130.5	-174.4	-177.7	0	0	0	0	110.3	Y582 K583 V585 K684	Y582-V633 WeakPolarHBondContact CA-O 3.41Å; K583-V633 PolarHBondContact N-O 2.84Å; K583-V633 PolarHBondContact O-N 3.07Å; V585-V633 HydrophobicContact CG2-CG2 3.93Å; V633-K684 HydrophobicContact CG2-CG 4.06Å
634	L	91.9	Very high	73.9	Confident	4 Å²	4	93.1 Å²	93.1	2%	0.021	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	139.6	168.9	-58.1	174.1	0	0	0	110.1	F550 V568 L580 I614 L679 V683	F550-L634 HydrophobicContact CD2-CD1 4.1Å; F550-L634 HydrophobicContact CD2-CG 4.34Å; F550-L634 HydrophobicContact CE1-CD1 4.38Å; F550-L634 HydrophobicContact CE1-CD2 4.23Å; F550-L634 HydrophobicContact CE1-CG 4.31Å; F550-L634 HydrophobicContact CE2-CD1 3.84Å; F550-L634 HydrophobicContact CE2-CD2 4.28Å; F550-L634 HydrophobicContact CE2-CG 3.58Å; F550-L634 HydrophobicContact CG-CD1 4.5Å; F550-L634 HydrophobicContact CZ-CD1 3.99Å; F550-L634 HydrophobicContact CZ-CD2 3.72Å; F550-L634 HydrophobicContact CZ-CG 3.56Å; V568-L634 HydrophobicContact CG1-CD1 4Å; V568-L634 HydrophobicContact CG1-CD2 4.38Å; V568-L634 HydrophobicContact CG2-CD2 4.09Å; L580-L634 HydrophobicContact CD2-CD1 4.29Å; L580-L634 HydrophobicContact CD2-CD2 3.95Å; L580-L634 HydrophobicContact CG-CD2 4.39Å; I614-L634 HydrophobicContact CD1-CD2 4.4Å; L634-L679 HydrophobicContact CB-CD2 4.13Å; L634-V683 HydrophobicContact CB-CG1 4.13Å; L634-V683 PolarHBondContact N-O 3.33Å; L634-V683 VanDerWaalsContact O-CG1 3.23Å; L634-V683 WeakPolarHBondContact O-CG1 3.34Å
635	E	89.5	Confident	73.4	Confident	75 Å²	75	94.9 Å²	94.9	35%	0.35	43%	0.432	S	S	.	.			trans	-102.6	176	174.1	-56.4	-168.8	154.2	0	0	111	L580 P581 K583	L580-E635 VanDerWaalsContact CD1-O 3.27Å; L580-E635 WeakPolarHBondContact CD1-O 3.44Å; P581-E635 HydrophobicContact CB-CB 4.07Å; P581-E635 HydrophobicContact CG-CB 4.39Å; P581-E635 PolarHBondContact O-N 2.96Å; K583-E635 WeakPolarHBondContact CE-OE1 3.25Å; K583-E635 IonicContact NZ-OE1 2.72Å; K583-E635 PolarHBondContact NZ-OE1 3.24Å
636	T	86.4	Confident	72.6	Confident	101 Å²	101	100.7 Å²	100.7	62%	0.62	46%	0.455	S	S	*	.			trans	-62.1	129.6	-173.4	48.7	0	0	0	0	112.5	L679	T636-L679 HydrophobicContact CG2-CD1 4.49Å
637	P	87.3	Confident	71.4	Confident	22 Å²	22	98.2 Å²	98.2	14%	0.143	45%	0.454	C	S	.	.			trans	-71.1	140.4	179.9	26.5	-33.3	0	0	0	112.4	F548 V578 M579 L580 P677	F548-P637 HydrophobicContact CD2-CB 4.03Å; F548-P637 HydrophobicContact CD2-CG 4.17Å; F548-P637 HydrophobicContact CE2-CB 4.21Å; V578-P637 HydrophobicContact CG1-CB 3.63Å; M579-P637 CarbonylContact O-C 3.36Å; M579-P637 WeakPolarHBondContact O-CA 3.2Å; L580-P637 HydrophobicContact CD1-CB 3.95Å; P637-P677 HydrophobicContact CB-CB 4.16Å; P637-P677 HydrophobicContact CB-CG 4.45Å; P637-P677 HydrophobicContact CG-CB 4.1Å
638	E	83	Confident	70	Confident	130 Å²	130	100 Å²	100	61%	0.607	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	121.2	176.8	-63.6	-174	170.1	0	0	111.1	M579	M579-E638 HydrophobicContact CB-CB 4.37Å; M579-E638 PolarHBondContact N-O 3.44Å; M579-E638 PolarHBondContact O-N 3.38Å
639	W	79.7	Confident	67.8	Low	90 Å²	90	108.3 Å²	108.3	34%	0.341	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	124.1	178.5	-165.9	25.8	0	0	0	112.2	R641 P677	W639-R641 VanDerWaalsContact CH2-NH2 3.32Å; W639-R641 PolarHBondContact O-N 3.35Å; W639-P677 HydrophobicContact CB-CG 3.82Å; W639-P677 HydrophobicContact CG-CG 4.35Å
640	R	71.8	Confident	64.9	Low	187 Å²	187	117 Å²	117	71%	0.706	54%	0.537	S	S	*	.			trans	-88.6	101.5	175.2	-97.7	-159.6	172.4	-170.1	4.5	112	V577	V577-R640 PolarHBondContact O-N 2.84Å
641	R	59	Low	62.2	Low	178 Å²	178	123.2 Å²	123.2	67%	0.672	58%	0.577	S	S	*	*			trans	-87	135	164.1	-90.8	-175.3	-173.6	169.8	-0.7	112.1	W639	W639-R641 VanDerWaalsContact CH2-NH2 3.32Å; W639-R641 PolarHBondContact O-N 3.35Å
642	N	45.2	Very low	59.3	Low	155 Å²	155	131.4 Å²	131.4	83%	0.829	61%	0.612	S	S	*	*			trans	-69.6	136.5	178.7	-90.8	-31.4	0	0	0	112.4	K644	N642-K644 PolarHBondContact O-N 3.44Å
643	R	39	Very low	56.5	Low	214 Å²	214	136 Å²	136	81%	0.808	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	15.4	-171.5	-153.5	-178.5	-164	171.7	6.4	117
644	K	39.9	Very low	53.8	Low	197 Å²	197	144.1 Å²	144.1	86%	0.857	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-2.7	-177.3	-81	-171.9	176.7	178.6	0	115.5	N642	N642-K644 PolarHBondContact O-N 3.44Å
645	E	43.5	Very low	51.4	Low	173 Å²	173	147.3 Å²	147.3	81%	0.808	72%	0.72	S	S	*	*	S	Bend	trans	-108.1	2.8	176	-69.9	175.4	171.4	0	0	114	T647	E645-T647 PolarHBondContact O-N 3.14Å; E645-T647 VanDerWaalsContact O-N 3.14Å
646	Q	35.3	Very low	48.7	Very low	162 Å²	162	153.3 Å²	153.3	76%	0.757	75%	0.748	S	S	*	*			trans	-84.9	34.5	177.6	-88.1	-175.4	0.5	0	0	114.2
647	T	36.5	Very low	46.3	Very low	126 Å²	126	157.8 Å²	157.8	77%	0.773	76%	0.762	S	S	*	*	S	Bend	trans	-121	51.4	174.7	-30	0	0	0	0	111.7	E645	E645-T647 PolarHBondContact O-N 3.14Å; E645-T647 VanDerWaalsContact O-N 3.14Å
648	E	40.8	Very low	44.1	Very low	190 Å²	190	166.1 Å²	166.1	89%	0.888	80%	0.799	S	S	*	*	S	Bend	trans	-167.9	46.5	154.4	-113.8	174.2	-149.9	0	0	114.5
649	E	33.6	Very low	42.1	Very low	185 Å²	185	168.3 Å²	168.3	86%	0.864	81%	0.809	S	S	*	*			trans	-132.2	110.6	161.1	-75.8	-167.4	156.9	0	0	111.2
650	K	30.1	Very low	40.4	Very low	199 Å²	199	170.3 Å²	170.3	87%	0.865	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-70.4	145.7	168	-82.8	178	175.4	174	0	109.5	K652	K650-K652 PolarHBondContact O-N 3.28Å
651	P	35.7	Very low	39	Very low	130 Å²	130	168 Å²	168	84%	0.844	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-70.8	122.3	174.4	28.9	-30.6	0	0	0	110
652	K	32.8	Very low	38.6	Very low	209 Å²	209	164.2 Å²	164.2	91%	0.909	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-80.2	126.7	166.4	-85.5	-174.8	174	-177.4	0	109.1	K650	K650-K652 PolarHBondContact O-N 3.28Å
653	A	31.9	Very low	39	Very low	96 Å²	96	159.4 Å²	159.4	79%	0.793	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-78.4	150.3	168.1	0	0	0	0	0	110.1
654	E	36.8	Very low	39.4	Very low	203 Å²	203	157 Å²	157	95%	0.949	81%	0.813	S	S	*	*	S	Bend	trans	-57.5	131.6	-174.8	-63.3	172.4	158.9	0	0	113.3
655	G	41.6	Very low	40	Very low	71 Å²	71	151.8 Å²	151.8	73%	0.732	80%	0.795	S	S	*	*			trans	109.9	83.2	163.9	0	0	0	0	0	114.7
656	E	31.9	Very low	40.4	Very low	201 Å²	201	148.3 Å²	148.3	94%	0.939	78%	0.779	S	S	*	*			trans	-164.6	142.1	149.1	-107.9	165.7	-156.3	0	0	109.7
657	E	37.8	Very low	41.2	Very low	195 Å²	195	146 Å²	146	91%	0.911	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-62.5	142.9	-168.8	-62.3	171	157.2	0	0	113.1	E659	E657-E659 PolarHBondContact O-N 2.88Å
658	E	39.7	Very low	41.8	Very low	198 Å²	198	146.1 Å²	146.1	93%	0.925	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-68.1	120.5	176.4	-70	-177.7	158.4	0	0	111.3
659	E	41	Very low	42.4	Very low	176 Å²	176	145.7 Å²	145.7	82%	0.822	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-85.2	140.6	157.3	-77.1	-155.2	158.6	0	0	109.9	E657 L661	E657-E659 PolarHBondContact O-N 2.88Å; E659-L661 PolarHBondContact O-N 3.02Å
660	P	43.9	Very low	43.5	Very low	131 Å²	131	143.4 Å²	143.4	85%	0.851	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-77.7	119.9	-178.4	30.6	-30.7	0	0	0	110.6
661	L	42.3	Very low	44.7	Very low	139 Å²	139	138.5 Å²	138.5	73%	0.728	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-88.6	149.7	170.4	-80.4	155.1	0	0	0	110.7	E659	E659-L661 PolarHBondContact O-N 3.02Å
662	T	51.7	Low	45.6	Very low	99 Å²	99	135.4 Å²	135.4	61%	0.607	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-63.6	141	-168.6	37.3	0	0	0	0	115.1	K664 D665	T662-K664 PolarHBondContact O-N 3.31Å; T662-D665 PolarHBondContact O-N 3.29Å
663	G	52.2	Low	46.9	Very low	53 Å²	53	130.3 Å²	130.3	55%	0.546	68%	0.68	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.9	16.9	-174.1	0	0	0	0	0	118.8
664	K	48.9	Very low	48.4	Very low	164 Å²	164	131.4 Å²	131.4	71%	0.713	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-39.9	167.2	-98.4	-172.3	170	-170.4	0	111.9	T662 E666 E667 E668	T662-K664 PolarHBondContact O-N 3.31Å; K664-E666 VanDerWaalsContact C-N 3.32Å; K664-E666 PolarHBondContact O-N 3.06Å; K664-E667 PolarHBondContact O-N 2.69Å; K664-E668 PolarHBondContact O-N 3.3Å; K664-E668 VanDerWaalsContact O-N 3.14Å
665	D	51.7	Low	49.7	Very low	87 Å²	87	122.8 Å²	122.8	47%	0.465	64%	0.637	S	S	.	*	H	α-helix	trans	-75.1	-24.1	178.3	-59.9	-19.8	0	0	0	111.8	T662 R669	T662-D665 PolarHBondContact O-N 3.29Å; D665-R669 VanDerWaalsContact O-CB 3.28Å; D665-R669 WeakPolarHBondContact O-CB 3.37Å; D665-R669 WeakPolarHBondContact O-CG 3.08Å; D665-R669 PolarHBondContact O-N 2.84Å; D665-R669 VanDerWaalsContact O-N 3.08Å
666	E	52.1	Low	51.3	Low	100 Å²	100	125.4 Å²	125.4	47%	0.467	62%	0.624	S	S	.	*	H	α-helix	trans	-71	-36.6	169.2	-82.7	-164.6	150.8	0	0	112.4	K664 R670	K664-E666 VanDerWaalsContact C-N 3.32Å; K664-E666 PolarHBondContact O-N 3.06Å; E666-R670 VanDerWaalsContact O-CB 3.29Å; E666-R670 WeakPolarHBondContact O-CB 3.48Å; E666-R670 WeakPolarHBondContact O-CG 3.46Å; E666-R670 PolarHBondContact O-N 2.85Å; E666-R670 IonicContact OE2-NH2 3.41Å; E666-R670 PolarHBondContact OE2-NH2 3.28Å
667	E	51.4	Low	53.7	Low	113 Å²	113	116.7 Å²	116.7	53%	0.528	59%	0.585	S	S	.	*	H	α-helix	trans	-68	-48.7	178.4	-157.8	91.7	-168.4	0	0	109.7	K664 R669 R670 I671	K664-E667 PolarHBondContact O-N 2.69Å; E667-R669 VanDerWaalsContact C-N 3.35Å; E667-R669 PolarHBondContact O-N 3.4Å; E667-R670 PolarHBondContact O-N 3.46Å; E667-R670 VanDerWaalsContact O-N 3.16Å; E667-I671 HydrophobicContact CG-CD1 4.13Å; E667-I671 WeakPolarHBondContact O-CB 3.42Å; E667-I671 WeakPolarHBondContact O-CD1 3.14Å; E667-I671 WeakPolarHBondContact O-CG1 3.15Å; E667-I671 PolarHBondContact O-N 3.15Å
668	E	49.9	Very low	55.9	Low	129 Å²	129	111.6 Å²	111.6	60%	0.603	56%	0.562	S	S	*	*	H	α-helix	trans	-64.9	-35.5	177.7	-70.2	178.3	-173.5	0	0	112.6	K664 A672	K664-E668 PolarHBondContact O-N 3.3Å; K664-E668 VanDerWaalsContact O-N 3.14Å; E668-A672 WeakPolarHBondContact O-CB 3.35Å; E668-A672 PolarHBondContact O-N 3.39Å
669	R	53	Low	58.1	Low	181 Å²	181	104.9 Å²	104.9	68%	0.683	53%	0.532	S	S	*	.	H	α-helix	trans	-69.2	-40.9	170.7	-84.1	-178.8	168.4	-177.2	-4.1	112.5	D665 E667 I671 A672 E673	D665-R669 VanDerWaalsContact O-CB 3.28Å; D665-R669 WeakPolarHBondContact O-CB 3.37Å; D665-R669 WeakPolarHBondContact O-CG 3.08Å; D665-R669 PolarHBondContact O-N 2.84Å; D665-R669 VanDerWaalsContact O-N 3.08Å; E667-R669 VanDerWaalsContact C-N 3.35Å; E667-R669 PolarHBondContact O-N 3.4Å; R669-I671 VanDerWaalsContact C-N 3.3Å; R669-I671 PolarHBondContact O-N 3.15Å; R669-A672 PolarHBondContact O-N 3.26Å; R669-E673 WeakPolarHBondContact O-CB 3.27Å; R669-E673 VanDerWaalsContact O-CG 3.29Å; R669-E673 WeakPolarHBondContact O-CG 3.34Å; R669-E673 PolarHBondContact O-N 3.17Å
670	R	57.1	Low	60.1	Low	137 Å²	137	97.2 Å²	97.2	52%	0.517	50%	0.501	S	S	.	.	H	α-helix	trans	-61.9	-39.8	174.8	-78.7	175.7	-166.7	159.4	13.4	111	E666 E667 E673 M674	E666-R670 VanDerWaalsContact O-CB 3.29Å; E666-R670 WeakPolarHBondContact O-CB 3.48Å; E666-R670 WeakPolarHBondContact O-CG 3.46Å; E666-R670 PolarHBondContact O-N 2.85Å; E666-R670 IonicContact OE2-NH2 3.41Å; E666-R670 PolarHBondContact OE2-NH2 3.28Å; E667-R670 PolarHBondContact O-N 3.46Å; E667-R670 VanDerWaalsContact O-N 3.16Å; R670-E673 PolarHBondContact O-N 2.94Å; R670-M674 VanDerWaalsContact O-CG 3.31Å; R670-M674 WeakPolarHBondContact O-CG 3.33Å; R670-M674 PolarHBondContact O-N 3.3Å
671	I	55.9	Low	61.9	Low	96 Å²	96	98.5 Å²	98.5	49%	0.492	50%	0.5	S	S	.	.	H	α-helix	trans	-66.2	-43.7	175.7	-64	160.7	0	0	0	111	E667 R669 E673 M674 G675	E667-I671 HydrophobicContact CG-CD1 4.13Å; E667-I671 WeakPolarHBondContact O-CB 3.42Å; E667-I671 WeakPolarHBondContact O-CD1 3.14Å; E667-I671 WeakPolarHBondContact O-CG1 3.15Å; E667-I671 PolarHBondContact O-N 3.15Å; R669-I671 VanDerWaalsContact C-N 3.3Å; R669-I671 PolarHBondContact O-N 3.15Å; I671-E673 VanDerWaalsContact C-N 3.3Å; I671-E673 PolarHBondContact O-N 3.41Å; I671-M674 HydrophobicContact CB-CE 4.43Å; I671-M674 HydrophobicContact CG1-CE 3.99Å; I671-M674 PolarHBondContact O-N 2.94Å; I671-G675 PolarHBondContact O-N 2.94Å
672	A	54.8	Low	64	Low	65 Å²	65	94.8 Å²	94.8	54%	0.537	48%	0.479	S	S	.	.	H	α-helix	trans	-69.4	-24.2	175.3	0	0	0	0	0	114	E668 R669	E668-A672 WeakPolarHBondContact O-CB 3.35Å; E668-A672 PolarHBondContact O-N 3.39Å; R669-A672 PolarHBondContact O-N 3.26Å
673	E	60	Low	65.8	Low	102 Å²	102	92.1 Å²	92.1	48%	0.477	46%	0.463	S	S	.	.	H	α-helix	trans	-78.7	-29.6	171.7	-73.6	-162.3	141.3	0	0	112.8	R669 R670 I671 G675 R676	R669-E673 WeakPolarHBondContact O-CB 3.27Å; R669-E673 VanDerWaalsContact O-CG 3.29Å; R669-E673 WeakPolarHBondContact O-CG 3.34Å; R669-E673 PolarHBondContact O-N 3.17Å; R670-E673 PolarHBondContact O-N 2.94Å; I671-E673 VanDerWaalsContact C-N 3.3Å; I671-E673 PolarHBondContact O-N 3.41Å; E673-G675 PolarHBondContact O-N 2.98Å; E673-R676 PolarHBondContact O-N 3.22Å; E673-R676 IonicContact OE1-CZ 3.29Å; E673-R676 IonicContact OE1-NH1 2.95Å; E673-R676 IonicContact OE1-NH2 2.64Å; E673-R676 PolarHBondContact OE1-NH2 3.38Å
674	M	61.8	Low	67.6	Low	119 Å²	119	94.5 Å²	94.5	59%	0.586	46%	0.458	S	S	*	.	H	α-helix	trans	-65.8	-19.7	171.3	-73.9	-171.9	-73.6	0	0	112.5	H544 R670 I671 R676	H544-M674 PolarHBondContact CE1-O 3.06Å; R670-M674 VanDerWaalsContact O-CG 3.31Å; R670-M674 WeakPolarHBondContact O-CG 3.33Å; R670-M674 PolarHBondContact O-N 3.3Å; I671-M674 HydrophobicContact CB-CE 4.43Å; I671-M674 HydrophobicContact CG1-CE 3.99Å; I671-M674 PolarHBondContact O-N 2.94Å; M674-R676 PolarHBondContact O-N 3.44Å
675	G	64.3	Low	69.7	Low	23 Å²	23	87 Å²	87	24%	0.237	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	11.6	176.1	0	0	0	0	0	116.8	A545 I671 E673	A545-G675 WeakPolarHBondContact CB-O 3.22Å; I671-G675 PolarHBondContact O-N 2.94Å; E673-G675 PolarHBondContact O-N 2.98Å
676	R	76.9	Confident	71.6	Confident	126 Å²	126	85.7 Å²	85.7	48%	0.475	42%	0.417	S	S	.	.	S	Bend	trans	-84.2	150.8	178.6	-67.7	-177.2	-176.3	166.5	10.8	111.2	E673 M674 M678	E673-R676 PolarHBondContact O-N 3.22Å; E673-R676 IonicContact OE1-CZ 3.29Å; E673-R676 IonicContact OE1-NH1 2.95Å; E673-R676 IonicContact OE1-NH2 2.64Å; E673-R676 PolarHBondContact OE1-NH2 3.38Å; M674-R676 PolarHBondContact O-N 3.44Å; R676-M678 WeakPolarHBondContact O-CG 3.38Å; R676-M678 PolarHBondContact O-N 3.32Å
677	P	81.9	Confident	73.5	Confident	17 Å²	17	81 Å²	81	11%	0.11	40%	0.395	C	S	.	.			trans	-65.2	135.7	176.2	27.9	-34.4	0	0	0	110.9	G546 F548 V578 P637 W639	G546-P677 VanDerWaalsContact O-CA 3.3Å; G546-P677 WeakPolarHBondContact O-CA 3.26Å; F548-P677 HydrophobicContact CD2-CB 4.47Å; F548-P677 HydrophobicContact CE2-CB 3.81Å; V578-P677 HydrophobicContact CG1-CB 4.05Å; V578-P677 HydrophobicContact CG1-CG 4.25Å; V578-P677 HydrophobicContact CG2-CB 4.11Å; V578-P677 HydrophobicContact CG2-CG 4.3Å; P637-P677 HydrophobicContact CB-CB 4.16Å; P637-P677 HydrophobicContact CB-CG 4.45Å; P637-P677 HydrophobicContact CG-CB 4.1Å; W639-P677 HydrophobicContact CB-CG 3.82Å; W639-P677 HydrophobicContact CG-CG 4.35Å
678	M	83.1	Confident	75.3	Confident	89 Å²	89	77 Å²	77	44%	0.438	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	163.1	-178.7	-57.5	-165.9	-147.8	0	0	111.5	G546 I547 F548 R676	G546-M678 PolarHBondContact O-N 3.03Å; I547-M678 CarbonylContact C-O 3.54Å; I547-M678 WeakPolarHBondContact CA-O 3.21Å; F548-M678 PolarHBondContact N-O 3.46Å; R676-M678 WeakPolarHBondContact O-CG 3.38Å; R676-M678 PolarHBondContact O-N 3.32Å
679	L	86.6	Confident	77	Confident	56 Å²	56	71.1 Å²	71.1	29%	0.293	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	137.2	169.2	-70.3	170.3	0	0	0	108.9	F548 L580 L634 T636 V683	F548-L679 HydrophobicContact CB-CD2 4.49Å; L580-L679 HydrophobicContact CD1-CD2 3.99Å; L634-L679 HydrophobicContact CB-CD2 4.13Å; T636-L679 HydrophobicContact CG2-CD1 4.49Å; L679-V683 HydrophobicContact CB-CG2 3.87Å; L679-V683 HydrophobicContact CD1-CG1 3.87Å; L679-V683 HydrophobicContact CD1-CG2 4.4Å; L679-V683 HydrophobicContact CD2-CG1 4.36Å
680	G	82.8	Confident	78.2	Confident	16 Å²	16	66.3 Å²	66.3	17%	0.165	34%	0.335	C	S	.	.			trans	-85.9	-161.1	176.7	0	0	0	0	0	113.1	F548 V683	F548-G680 PolarHBondContact O-N 2.96Å; G680-V683 WeakPolarHBondContact O-CG2 3.39Å
681	D	81.6	Confident	78.7	Confident	157 Å²	157	62.7 Å²	62.7	84%	0.84	32%	0.324	S	S	*	.	S	Bend	trans	-66.9	-41.9	-171.6	-65	-26.5	0	0	0	113.3
682	H	86.4	Confident	79.1	Confident	62 Å²	62	59.9 Å²	59.9	29%	0.287	31%	0.313	S	S	.	.			trans	-99.9	91.7	179.6	-49.8	119.6	0	0	0	111.3	T549 F550	T549-H682 WeakPolarHBondContact OG1-CA 3.43Å; T549-H682 WeakPolarHBondContact OG1-CB 3.31Å; T549-H682 PolarHBondContact OG1-N 3.09Å; T549-H682 PolarHBondContact OG1-O 3.28Å; T549-H682 VanDerWaalsContact OG1-O 3.09Å; F550-H682 HydrophobicContact CB-CB 3.99Å; F550-H682 WeakPolarHBondContact CD2-O 3.32Å; F550-H682 PolarHBondContact N-O 3.2Å; F550-H682 PolarHBondContact O-ND1 3.07Å
683	V	89.3	Confident	79.2	Confident	43 Å²	43	65.3 Å²	65.3	26%	0.261	32%	0.32	S	S	.	.			trans	-94.8	-17.5	176.3	-172.4	0	0	0	0	112.1	L634 L679 G680	L634-V683 HydrophobicContact CB-CG1 4.13Å; L634-V683 PolarHBondContact N-O 3.33Å; L634-V683 VanDerWaalsContact O-CG1 3.23Å; L634-V683 WeakPolarHBondContact O-CG1 3.34Å; L679-V683 HydrophobicContact CB-CG2 3.87Å; L679-V683 HydrophobicContact CD1-CG1 3.87Å; L679-V683 HydrophobicContact CD1-CG2 4.4Å; L679-V683 HydrophobicContact CD2-CG1 4.36Å; G680-V683 WeakPolarHBondContact O-CG2 3.39Å
684	K	90.8	Very high	79.1	Confident	103 Å²	103	67.8 Å²	67.8	45%	0.448	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	121.8	-178.2	-177.8	179.5	-167.9	-138.8	0	109	F631 I632 V633	F631-K684 HydrophobicContact CB-CG 4.36Å; F631-K684 HydrophobicContact CD1-CD 4.16Å; F631-K684 HydrophobicContact CD1-CG 4.18Å; I632-K684 WeakPolarHBondContact O-CA 3.48Å; V633-K684 HydrophobicContact CG2-CG 4.06Å
685	L	92.2	Very high	78.9	Confident	5 Å²	5	66.7 Å²	66.7	3%	0.026	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	127.8	173.4	176.4	69.1	0	0	0	109.5	F550 E552 C555 V566 F631 I632 V687	F550-L685 HydrophobicContact CD1-CB 4.37Å; F550-L685 HydrophobicContact CD1-CD2 4.46Å; F550-L685 HydrophobicContact CD2-CB 3.77Å; F550-L685 HydrophobicContact CE1-CB 4.43Å; F550-L685 HydrophobicContact CE2-CB 3.83Å; F550-L685 HydrophobicContact CG-CB 4.04Å; F550-L685 HydrophobicContact CZ-CB 4.18Å; E552-L685 WeakPolarHBondContact O-CD1 3.33Å; C555-L685 HydrophobicContact CB-CD1 3.96Å; C555-L685 HydrophobicContact CB-CD2 4.42Å; V566-L685 HydrophobicContact CB-CD2 4.3Å; V566-L685 HydrophobicContact CG1-CD2 3.37Å; V566-L685 HydrophobicContact CG2-CD2 3.91Å; F631-L685 CarbonylContact C-O 3.47Å; F631-L685 VanDerWaalsContact CA-O 3.23Å; F631-L685 WeakPolarHBondContact CA-O 3.24Å; I632-L685 HydrophobicContact CB-CB 4.39Å; I632-L685 HydrophobicContact CD1-CD2 4.39Å; I632-L685 PolarHBondContact N-O 3.3Å; I632-L685 PolarHBondContact O-N 3.11Å; L685-V687 HydrophobicContact CD2-CG2 4.1Å; L685-V687 HydrophobicContact CG-CG2 4.23Å
686	E	92.6	Very high	78.7	Confident	61 Å²	61	71 Å²	71	29%	0.285	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	122.4	166.2	-175.2	166.2	-162.6	0	0	109.8	P553 V554 C555 S629 F631 I688	P553-E686 PolarHBondContact O-N 3.3Å; V554-E686 CarbonylContact C-O 3.58Å; V554-E686 VanDerWaalsContact CA-O 3.29Å; V554-E686 WeakPolarHBondContact CA-O 3.39Å; V554-E686 HydrophobicContact CG2-CB 4.37Å; C555-E686 PolarHBondContact N-O 3.02Å; S629-E686 PolarHBondContact OG-OE1 2.86Å; F631-E686 HydrophobicContact CD1-CB 3.81Å; F631-E686 HydrophobicContact CD1-CG 4.03Å; F631-E686 HydrophobicContact CE1-CB 3.67Å; F631-E686 HydrophobicContact CE1-CG 3.58Å; F631-E686 HydrophobicContact CZ-CG 4.33Å; E686-I688 HydrophobicContact CG-CG1 4.22Å
687	V	90.8	Very high	77.9	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	118.9	174.2	175.8	0	0	0	0	108.2	C555 V557 M564 S629 F630 I632 L685 I689	C555-V687 CarbonylContact O-C 3.51Å; C555-V687 WeakPolarHBondContact O-CA 3.34Å; V557-V687 HydrophobicContact CG2-CG1 3.53Å; M564-V687 HydrophobicContact CE-CB 4.35Å; M564-V687 HydrophobicContact CE-CG1 3.28Å; M564-V687 HydrophobicContact CE-CG2 4.19Å; M564-V687 HydrophobicContact SD-CG1 4.39Å; M564-V687 HydrophobicContact SD-CG2 4.31Å; S629-V687 CarbonylContact C-O 3.48Å; S629-V687 WeakPolarHBondContact CA-O 3.41Å; S629-V687 WeakPolarHBondContact CB-O 3.37Å; F630-V687 HydrophobicContact CD1-CB 3.9Å; F630-V687 HydrophobicContact CD1-CG1 4Å; F630-V687 HydrophobicContact CD2-CB 4.41Å; F630-V687 HydrophobicContact CE1-CB 3.56Å; F630-V687 HydrophobicContact CE1-CG1 3.31Å; F630-V687 HydrophobicContact CE1-CG2 4.25Å; F630-V687 HydrophobicContact CE2-CB 4.09Å; F630-V687 HydrophobicContact CE2-CG2 4Å; F630-V687 HydrophobicContact CG-CB 4.33Å; F630-V687 HydrophobicContact CZ-CB 3.66Å; F630-V687 HydrophobicContact CZ-CG1 3.62Å; F630-V687 HydrophobicContact CZ-CG2 3.81Å; F630-V687 PolarHBondContact N-O 3.36Å; F630-V687 PolarHBondContact O-N 2.96Å; I632-V687 HydrophobicContact CD1-CG2 4.21Å; I632-V687 HydrophobicContact CG1-CG2 4.37Å; L685-V687 HydrophobicContact CD2-CG2 4.1Å; L685-V687 HydrophobicContact CG-CG2 4.23Å; V687-I689 HydrophobicContact CG1-CG1 4.48Å
688	I	89.3	Confident	77	Confident	30 Å²	30	68.8 Å²	68.8	15%	0.154	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.6	174.9	-58.1	175.7	0	0	0	108.2	V554 C555 H556 V557 E686 E690	V554-I688 HydrophobicContact CG1-CD1 3.64Å; V554-I688 HydrophobicContact CG1-CG1 4.14Å; C555-I688 PolarHBondContact O-N 3.41Å; H556-I688 WeakPolarHBondContact CA-O 3.25Å; V557-I688 WeakPolarHBondContact CG2-O 3.26Å; V557-I688 PolarHBondContact N-O 3.48Å; E686-I688 HydrophobicContact CG-CG1 4.22Å; I688-E690 HydrophobicContact CG2-CG 4.26Å
689	I	85.6	Confident	76	Confident	5 Å²	5	65 Å²	65	3%	0.026	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	115.6	175.7	-58.8	174.9	0	0	0	107.8	V557 E559 A589 D595 I618 S628 F630 V687	V557-I689 HydrophobicContact CG2-CG1 4.11Å; V557-I689 CarbonylContact O-C 3.6Å; V557-I689 WeakPolarHBondContact O-CA 3.49Å; E559-I689 HydrophobicContact CB-CG2 4.34Å; E559-I689 HydrophobicContact CG-CG2 3.15Å; A589-I689 HydrophobicContact CB-CD1 4.25Å; D595-I689 HydrophobicContact CB-CD1 4.45Å; I618-I689 HydrophobicContact CG2-CD1 4.24Å; S628-I689 PolarHBondContact N-O 3.01Å; S628-I689 WeakPolarHBondContact O-CB 3.43Å; S628-I689 PolarHBondContact O-N 2.71Å; F630-I689 HydrophobicContact CD1-CD1 4Å; F630-I689 HydrophobicContact CD1-CG1 4.37Å; F630-I689 HydrophobicContact CE1-CD1 3.98Å; F630-I689 HydrophobicContact CE1-CG1 4.19Å; V687-I689 HydrophobicContact CG1-CG1 4.48Å
690	E	77.6	Confident	74.8	Confident	80 Å²	80	65.5 Å²	65.5	37%	0.374	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	145.8	178.6	-64.2	-170.6	167.8	0	0	111.9	H556 V557 S558 E559 I688	H556-E690 IonicContact CE1-OE1 2.71Å; H556-E690 IonicContact CG-OE1 2.98Å; H556-E690 IonicContact ND1-OE1 3.81Å; H556-E690 PolarHBondContact ND1-OE1 2.69Å; V557-E690 PolarHBondContact O-N 3.41Å; S558-E690 WeakPolarHBondContact CA-O 3.48Å; E559-E690 PolarHBondContact N-O 2.96Å; I688-E690 HydrophobicContact CG2-CG 4.26Å
691	E	69.5	Low	73.7	Confident	62 Å²	62	70.4 Å²	70.4	29%	0.29	34%	0.336	S	S	.	.			trans	-59.7	149.5	171.1	-68.5	-176	157.6	0	0	111.3	Y624 Y693	Y624-E691 WeakPolarHBondContact CD2-OE1 3.4Å; Y624-E691 VanDerWaalsContact CE2-OE1 3.24Å; Y624-E691 WeakPolarHBondContact CE2-OE1 3.13Å; E691-Y693 PolarHBondContact O-N 3.44Å; E691-Y693 VanDerWaalsContact O-N 3.11Å
692	S	63.5	Low	72.6	Confident	37 Å²	37	63.5 Å²	63.5	26%	0.259	30%	0.299	S	S	.	.			trans	-58.1	118.4	175.7	-177.8	0	0	0	0	112	E694 F695 K696	S692-E694 PolarHBondContact O-N 2.98Å; S692-F695 PolarHBondContact O-N 2.96Å; S692-F695 VanDerWaalsContact O-N 3.14Å; S692-K696 PolarHBondContact O-N 3.49Å
693	Y	56.7	Low	71.1	Confident	178 Å²	178	62 Å²	62	70%	0.698	29%	0.293	S	S	*	.	H	α-helix	trans	-57.6	-29.1	179	-170.7	-102.5	0	0	0	113.1	E691 N697	E691-Y693 PolarHBondContact O-N 3.44Å; E691-Y693 VanDerWaalsContact O-N 3.11Å; Y693-N697 WeakPolarHBondContact CD1-ND2 3.43Å; Y693-N697 WeakPolarHBondContact CE1-ND2 3.25Å; Y693-N697 VanDerWaalsContact CZ-ND2 3.3Å; Y693-N697 WeakPolarHBondContact O-CB 3.33Å; Y693-N697 PolarHBondContact O-N 3.27Å; Y693-N697 VanDerWaalsContact O-N 3.12Å
694	E	57.7	Low	69.6	Low	155 Å²	155	68.1 Å²	68.1	72%	0.724	32%	0.316	S	S	*	.	H	α-helix	trans	-69	-45.1	177.4	-65.4	-169.6	160.7	0	0	111.7	S692 N697 T698	S692-E694 PolarHBondContact O-N 2.98Å; E694-N697 PolarHBondContact O-N 2.81Å; E694-T698 WeakPolarHBondContact O-CG2 3.28Å; E694-T698 PolarHBondContact O-N 3.48Å; E694-T698 PolarHBondContact O-OG1 3.49Å
695	F	58.1	Low	67.7	Low	95 Å²	95	70.9 Å²	70.9	42%	0.417	33%	0.328	S	S	.	.	H	α-helix	trans	-66.4	-46	179.9	-170.7	-104.5	0	0	0	111.2	A333 S692 N697 T698 V699	A333-F695 HydrophobicContact CB-CE1 4.21Å; A333-F695 HydrophobicContact CB-CZ 4.21Å; S692-F695 PolarHBondContact O-N 2.96Å; S692-F695 VanDerWaalsContact O-N 3.14Å; F695-N697 PolarHBondContact O-N 3.3Å; F695-T698 PolarHBondContact O-N 3.15Å; F695-T698 VanDerWaalsContact O-N 3.14Å; F695-T698 PolarHBondContact O-OG1 2.99Å; F695-V699 HydrophobicContact CD1-CG2 4.07Å; F695-V699 HydrophobicContact CE1-CG2 3.75Å; F695-V699 HydrophobicContact CE2-CG2 4.3Å; F695-V699 HydrophobicContact CG-CG2 4.48Å; F695-V699 HydrophobicContact CZ-CG2 3.88Å; F695-V699 WeakPolarHBondContact O-CG2 3.44Å; F695-V699 PolarHBondContact O-N 3.11Å
696	K	58.9	Low	65.9	Low	115 Å²	115	72.3 Å²	72.3	50%	0.5	34%	0.337	S	S	.	.	H	α-helix	trans	-59.2	-45.5	177.1	-172.5	170.9	-177.7	169.1	0	112.5	S692 T698 V699 D700	S692-K696 PolarHBondContact O-N 3.49Å; K696-T698 VanDerWaalsContact C-N 3.34Å; K696-T698 PolarHBondContact O-N 3.04Å; K696-V699 PolarHBondContact O-N 2.74Å; K696-D700 WeakPolarHBondContact O-CB 3.3Å; K696-D700 PolarHBondContact O-N 3.2Å
697	N	61.3	Low	64.3	Low	58 Å²	58	72 Å²	72	31%	0.31	34%	0.337	S	S	.	.	H	α-helix	trans	-64.6	-34.5	175.8	-93.9	-31.8	0	0	0	113.4	Y693 E694 F695 K701	Y693-N697 WeakPolarHBondContact CD1-ND2 3.43Å; Y693-N697 WeakPolarHBondContact CE1-ND2 3.25Å; Y693-N697 VanDerWaalsContact CZ-ND2 3.3Å; Y693-N697 WeakPolarHBondContact O-CB 3.33Å; Y693-N697 PolarHBondContact O-N 3.27Å; Y693-N697 VanDerWaalsContact O-N 3.12Å; E694-N697 PolarHBondContact O-N 2.81Å; F695-N697 PolarHBondContact O-N 3.3Å; N697-K701 WeakPolarHBondContact O-CB 3.22Å; N697-K701 WeakPolarHBondContact O-CD 3.39Å; N697-K701 WeakPolarHBondContact O-CG 3.36Å; N697-K701 PolarHBondContact O-N 3.43Å; N697-K701 VanDerWaalsContact O-N 3.14Å
698	T	62.7	Low	62.8	Low	37 Å²	37	72.7 Å²	72.7	23%	0.227	34%	0.341	C	S	.	.	H	α-helix	trans	-68.8	-44.6	174.7	58.3	0	0	0	0	111.8	I352 E694 F695 K696 K701 L702	I352-T698 HydrophobicContact CD1-CG2 4.25Å; E694-T698 WeakPolarHBondContact O-CG2 3.28Å; E694-T698 PolarHBondContact O-N 3.48Å; E694-T698 PolarHBondContact O-OG1 3.49Å; F695-T698 PolarHBondContact O-N 3.15Å; F695-T698 VanDerWaalsContact O-N 3.14Å; F695-T698 PolarHBondContact O-OG1 2.99Å; K696-T698 VanDerWaalsContact C-N 3.34Å; K696-T698 PolarHBondContact O-N 3.04Å; T698-K701 PolarHBondContact O-N 2.83Å; T698-L702 WeakPolarHBondContact O-CD1 3.3Å; T698-L702 VanDerWaalsContact O-CG 3.25Å; T698-L702 WeakPolarHBondContact O-CG 3.46Å; T698-L702 PolarHBondContact O-N 2.98Å; T698-L702 VanDerWaalsContact O-N 3.12Å
699	V	62.7	Low	61.1	Low	11 Å²	11	71.4 Å²	71.4	7%	0.067	34%	0.335	C	S	.	.	H	α-helix	trans	-64.7	-47	178.7	171.3	0	0	0	0	110.6	L336 F695 K696 K701 L702 I703	L336-V699 HydrophobicContact CD1-CG2 4.14Å; F695-V699 HydrophobicContact CD1-CG2 4.07Å; F695-V699 HydrophobicContact CE1-CG2 3.75Å; F695-V699 HydrophobicContact CE2-CG2 4.3Å; F695-V699 HydrophobicContact CG-CG2 4.48Å; F695-V699 HydrophobicContact CZ-CG2 3.88Å; F695-V699 WeakPolarHBondContact O-CG2 3.44Å; F695-V699 PolarHBondContact O-N 3.11Å; K696-V699 PolarHBondContact O-N 2.74Å; V699-K701 VanDerWaalsContact C-N 3.3Å; V699-K701 PolarHBondContact O-N 3.39Å; V699-L702 WeakPolarHBondContact O-CA 3.4Å; V699-L702 WeakPolarHBondContact O-CB 2.69Å; V699-L702 PolarHBondContact O-N 2.88Å; V699-I703 HydrophobicContact CG1-CD1 3.48Å; V699-I703 VanDerWaalsContact CG1-CD1 3.48Å; V699-I703 HydrophobicContact CG1-CG1 4.3Å; V699-I703 VanDerWaalsContact O-CD1 3.24Å; V699-I703 WeakPolarHBondContact O-CD1 3.48Å; V699-I703 WeakPolarHBondContact O-CG1 3.37Å; V699-I703 PolarHBondContact O-N 2.93Å
700	D	61.7	Low	59.8	Low	65 Å²	65	75.7 Å²	75.7	35%	0.348	36%	0.358	S	S	.	.	H	α-helix	trans	-64.6	-30.9	177.6	-78.5	-30.8	0	0	0	113.1	R329 K696 L702	R329-D700 IonicContact CZ-OD1 3.1Å; R329-D700 IonicContact NE-OD1 2.69Å; R329-D700 PolarHBondContact NE-OD1 2.9Å; R329-D700 IonicContact NH2-OD1 2.74Å; K696-D700 WeakPolarHBondContact O-CB 3.3Å; K696-D700 PolarHBondContact O-N 3.2Å; D700-L702 VanDerWaalsContact C-N 3.31Å
701	K	59.6	Low	59.1	Low	119 Å²	119	72.5 Å²	72.5	52%	0.517	34%	0.343	S	S	.	.	H	α-helix	trans	-68.7	-28.9	170.1	-78.3	174.1	-175.6	176.1	0	112.9	N697 T698 V699	N697-K701 WeakPolarHBondContact O-CB 3.22Å; N697-K701 WeakPolarHBondContact O-CD 3.39Å; N697-K701 WeakPolarHBondContact O-CG 3.36Å; N697-K701 PolarHBondContact O-N 3.43Å; N697-K701 VanDerWaalsContact O-N 3.14Å; T698-K701 PolarHBondContact O-N 2.83Å; V699-K701 VanDerWaalsContact C-N 3.3Å; V699-K701 PolarHBondContact O-N 3.39Å
702	L	56.7	Low	58.8	Low	13 Å²	13	70.1 Å²	70.1	7%	0.068	33%	0.332	C	S	.	.	H	α-helix	trans	-83.1	-25.4	-179.7	-72.6	162.4	0	0	0	113.3	M332 L336 I352 N356 T698 V699 D700 K704	M332-L702 HydrophobicContact SD-CB 4.12Å; L336-L702 HydrophobicContact CD1-CD1 3.72Å; I352-L702 HydrophobicContact CG1-CD1 4.44Å; I352-L702 HydrophobicContact CG2-CD1 4.34Å; I352-L702 HydrophobicContact CG2-CD2 3.76Å; I352-L702 HydrophobicContact CG2-CG 4.47Å; N356-L702 WeakPolarHBondContact ND2-CD2 3.24Å; N356-L702 WeakPolarHBondContact OD1-CD2 3.26Å; T698-L702 WeakPolarHBondContact O-CD1 3.3Å; T698-L702 VanDerWaalsContact O-CG 3.25Å; T698-L702 WeakPolarHBondContact O-CG 3.46Å; T698-L702 PolarHBondContact O-N 2.98Å; T698-L702 VanDerWaalsContact O-N 3.12Å; V699-L702 WeakPolarHBondContact O-CA 3.4Å; V699-L702 WeakPolarHBondContact O-CB 2.69Å; V699-L702 PolarHBondContact O-N 2.88Å; D700-L702 VanDerWaalsContact C-N 3.31Å; L702-K704 PolarHBondContact O-N 3.01Å
703	I	56.5	Low	58.8	Low	31 Å²	31	68.9 Å²	68.9	16%	0.159	33%	0.325	C	S	.	.			trans	-71.4	1	-176.6	-72	156.1	0	0	0	113.8	R329 M332 V699 K705	R329-I703 HydrophobicContact CB-CD1 4Å; R329-I703 VanDerWaalsContact CD-CD1 3.41Å; R329-I703 HydrophobicContact CG-CD1 3.33Å; R329-I703 HydrophobicContact CG-CG1 4.26Å; M332-I703 HydrophobicContact SD-CG1 3.82Å; V699-I703 HydrophobicContact CG1-CD1 3.48Å; V699-I703 VanDerWaalsContact CG1-CD1 3.48Å; V699-I703 HydrophobicContact CG1-CG1 4.3Å; V699-I703 VanDerWaalsContact O-CD1 3.24Å; V699-I703 WeakPolarHBondContact O-CD1 3.48Å; V699-I703 WeakPolarHBondContact O-CG1 3.37Å; V699-I703 PolarHBondContact O-N 2.93Å; I703-K705 PolarHBondContact O-N 3.11Å
704	K	56.3	Low	59.6	Low	170 Å²	170	61.2 Å²	61.2	74%	0.739	30%	0.297	S	S	*	.	S	Bend	trans	-70.6	98.5	171	-152.5	172.3	-172.4	176.3	0	109.1	L702 T706	L702-K704 PolarHBondContact O-N 3.01Å; K704-T706 PolarHBondContact O-N 2.03Å; K704-T706 PolarHBondContact O-OG1 3.47Å
705	K	51.7	Low	60.6	Low	161 Å²	161	57.1 Å²	57.1	70%	0.7	28%	0.281	S	S	*	.			trans	-46.6	102.4	174.1	-80	179.3	179.1	166.3	0	108.9	I703 N707	I703-K705 PolarHBondContact O-N 3.11Å; K705-N707 PolarHBondContact O-N 3.49Å
706	T	55.2	Low	61.8	Low	35 Å²	35	54.4 Å²	54.4	22%	0.215	27%	0.273	C	S	.	.			trans	-79.6	115.8	176.1	-57.8	0	0	0	0	106.3	K704 L708	K704-T706 PolarHBondContact O-N 2.03Å; K704-T706 PolarHBondContact O-OG1 3.47Å; T706-L708 PolarHBondContact O-N 2.98Å
707	N	59.1	Low	63.1	Low	54 Å²	54	53 Å²	53	29%	0.289	27%	0.265	S	S	.	.			trans	-70.4	118.4	177	-170.5	-25.2	0	0	0	108.2	K705 A709 L710 L711	K705-N707 PolarHBondContact O-N 3.49Å; N707-A709 PolarHBondContact O-N 3.14Å; N707-A709 WeakPolarHBondContact OD1-CB 3.5Å; N707-A709 PolarHBondContact OD1-N 3.34Å; N707-A709 VanDerWaalsContact OD1-N 3.16Å; N707-L710 HydrophobicContact CB-CB 4.38Å; N707-L710 WeakPolarHBondContact O-CA 2.97Å; N707-L710 VanDerWaalsContact O-CB 3.32Å; N707-L710 WeakPolarHBondContact O-CB 3.5Å; N707-L710 PolarHBondContact O-N 3.35Å; N707-L711 PolarHBondContact O-N 2.86Å
708	L	57.9	Low	64.2	Low	15 Å²	15	59.3 Å²	59.3	8%	0.079	28%	0.284	C	S	.	.	H	α-helix	trans	-56.6	-25.8	-178.2	-140.7	104	0	0	0	112.6	L360 Q363 K365 F369 T706 L710 L711 V712	L360-L708 HydrophobicContact CD2-CD1 4.27Å; Q363-L708 HydrophobicContact CB-CD1 3.96Å; K365-L708 HydrophobicContact CB-CD2 4.26Å; K365-L708 HydrophobicContact CG-CD2 3.94Å; F369-L708 HydrophobicContact CD2-CD2 3.88Å; F369-L708 HydrophobicContact CE2-CD2 4.38Å; F369-L708 HydrophobicContact CG-CD2 4.23Å; T706-L708 PolarHBondContact O-N 2.98Å; L708-L710 VanDerWaalsContact C-N 3.34Å; L708-L711 HydrophobicContact CG-CD2 4.45Å; L708-L711 WeakPolarHBondContact O-CB 3.24Å; L708-L711 PolarHBondContact O-N 2.97Å; L708-V712 PolarHBondContact O-N 2.9Å
709	A	55.2	Low	65	Low	4 Å²	4	61.3 Å²	61.3	3%	0.033	29%	0.293	C	S	.	.	H	α-helix	trans	-70.7	-30.4	175.5	0	0	0	0	0	113.4	E109 S113 N707 L711 V712 G713	E109-A709 HydrophobicContact CG-CB 3.87Å; S113-A709 WeakPolarHBondContact OG-CB 3.36Å; N707-A709 PolarHBondContact O-N 3.14Å; N707-A709 WeakPolarHBondContact OD1-CB 3.5Å; N707-A709 PolarHBondContact OD1-N 3.34Å; N707-A709 VanDerWaalsContact OD1-N 3.16Å; A709-L711 PolarHBondContact O-N 3.43Å; A709-V712 PolarHBondContact O-N 3.46Å; A709-G713 PolarHBondContact O-N 3.44Å
710	L	58.2	Low	66.1	Low	95 Å²	95	60.9 Å²	60.9	50%	0.497	29%	0.291	S	S	.	.	H	α-helix	trans	-73.8	-19	174.2	-143.6	139.9	0	0	0	111.1	N707 L708	N707-L710 HydrophobicContact CB-CB 4.38Å; N707-L710 WeakPolarHBondContact O-CA 2.97Å; N707-L710 VanDerWaalsContact O-CB 3.32Å; N707-L710 WeakPolarHBondContact O-CB 3.5Å; N707-L710 PolarHBondContact O-N 3.35Å; L708-L710 VanDerWaalsContact C-N 3.34Å
711	L	62.9	Low	67.3	Low	12 Å²	12	60.6 Å²	60.6	6%	0.063	29%	0.286	C	S	.	.	H	α-helix	trans	-74.2	-36.5	174.5	-161.2	72.4	0	0	0	113.1	F369 I384 L385 H388 N707 L708 A709	F369-L711 HydrophobicContact CE2-CD2 4.27Å; I384-L711 WeakPolarHBondContact CD1-O 3.41Å; L385-L711 HydrophobicContact CD2-CD2 3.56Å; L385-L711 HydrophobicContact CG-CD2 4.37Å; H388-L711 HydrophobicContact CB-CD1 3.28Å; H388-L711 HydrophobicContact CB-CG 4.38Å; H388-L711 WeakPolarHBondContact CD2-CD1 3.13Å; H388-L711 WeakPolarHBondContact ND1-CD1 3.44Å; N707-L711 PolarHBondContact O-N 2.86Å; L708-L711 HydrophobicContact CG-CD2 4.45Å; L708-L711 WeakPolarHBondContact O-CB 3.24Å; L708-L711 PolarHBondContact O-N 2.97Å; A709-L711 PolarHBondContact O-N 3.43Å
712	V	61.9	Low	68.5	Low	12 Å²	12	58.8 Å²	58.8	7%	0.073	28%	0.282	C	S	.	.	H	α-helix	trans	-81	-26.6	179.8	-177.5	0	0	0	0	110.9	A106 E109 F369 C372 L708 A709	A106-V712 HydrophobicContact CB-CG1 3.84Å; E109-V712 VanDerWaalsContact OE2-CB 3.3Å; E109-V712 WeakPolarHBondContact OE2-CB 3.39Å; E109-V712 VanDerWaalsContact OE2-CG1 3.28Å; E109-V712 WeakPolarHBondContact OE2-CG1 3.44Å; E109-V712 VanDerWaalsContact OE2-CG2 3.27Å; E109-V712 WeakPolarHBondContact OE2-CG2 3.22Å; F369-V712 HydrophobicContact CB-CG2 3.99Å; F369-V712 HydrophobicContact CD2-CG2 3.75Å; F369-V712 HydrophobicContact CG-CG2 4.36Å; C372-V712 HydrophobicContact CB-CG1 4.14Å; L708-V712 PolarHBondContact O-N 2.9Å; A709-V712 PolarHBondContact O-N 3.46Å
713	G	63.7	Low	69.5	Low	11 Å²	11	59 Å²	59	11%	0.113	28%	0.282	C	S	.	.	S	Bend	trans	-68.5	161.3	173.2	0	0	0	0	0	114.2	A709 T768	A709-G713 PolarHBondContact O-N 3.44Å; G713-T768 WeakPolarHBondContact CA-OG1 3.46Å
714	T	74.6	Confident	70.8	Confident	17 Å²	17	57.8 Å²	57.8	10%	0.104	28%	0.277	C	S	.	.			trans	-115.8	136.9	167.7	46.4	0	0	0	0	109.6	Q720 P767 T768	T714-Q720 HydrophobicContact CG2-CG 3.94Å; T714-Q720 PolarHBondContact OG1-NE2 3.42Å; T714-P767 VanDerWaalsContact O-CB 3.24Å; T714-P767 WeakPolarHBondContact O-CB 3.2Å; T714-T768 PolarHBondContact N-OG1 2.94Å; T714-T768 PolarHBondContact O-N 3.09Å; T714-T768 PolarHBondContact O-OG1 3.24Å
715	N	77.1	Confident	72.2	Confident	70 Å²	70	54.9 Å²	54.9	37%	0.374	27%	0.269	S	S	.	.			trans	-99.9	-25.3	-168.3	-57.2	0.9	0	0	0	111.9	D769	N715-D769 WeakPolarHBondContact CA-OD2 3.07Å; N715-D769 WeakPolarHBondContact CB-OD2 3.49Å; N715-D769 PolarHBondContact OD1-OD1 3.35Å; N715-D769 PolarHBondContact OD1-OD2 3.46Å
716	S	83.9	Confident	73.6	Confident	37 Å²	37	49.9 Å²	49.9	26%	0.259	25%	0.251	S	S	.	.			trans	-142.5	151.6	-179.7	84.4	0	0	0	0	112.9	R718 D719 Q720	S716-R718 VanDerWaalsContact C-N 3.25Å; S716-R718 PolarHBondContact O-N 2.86Å; S716-D719 PolarHBondContact O-N 3.47Å; S716-D719 PolarHBondContact OG-N 3.48Å; S716-D719 VanDerWaalsContact OG-N 3.13Å; S716-D719 PolarHBondContact OG-OD2 3.39Å; S716-Q720 WeakPolarHBondContact O-CG 3.07Å; S716-Q720 PolarHBondContact O-N 3.31Å
717	W	86.6	Confident	74.7	Confident	86 Å²	86	50 Å²	50	33%	0.326	25%	0.252	S	S	.	.	H	α-helix	trans	-59.6	-37.9	171.8	-71.2	95.7	0	0	0	112.1	D719 Q720 F721 A763 F764 V765 P766 P767	W717-D719 VanDerWaalsContact C-N 3.3Å; W717-D719 PolarHBondContact O-N 2.87Å; W717-Q720 WeakPolarHBondContact O-CB 3.38Å; W717-Q720 PolarHBondContact O-N 2.9Å; W717-F721 AromaticContact CE3-CE2 3.99Å; W717-F721 HydrophobicContact CE3-CE2 3.99Å; W717-F721 VanDerWaalsContact O-CD2 3.24Å; W717-F721 WeakPolarHBondContact O-CD2 3.38Å; W717-F721 PolarHBondContact O-N 3.28Å; W717-A763 WeakPolarHBondContact CZ3-O 3.3Å; W717-F764 WeakPolarHBondContact CH2-O 3.22Å; W717-V765 WeakPolarHBondContact CH2-O 3.48Å; W717-V765 VanDerWaalsContact CZ3-O 3.28Å; W717-V765 WeakPolarHBondContact CZ3-O 3.24Å; W717-P766 HydrophobicContact CH2-CG 4.49Å; W717-P766 HydrophobicContact CZ2-CB 4.34Å; W717-P766 HydrophobicContact CZ2-CG 4.37Å; W717-P767 HydrophobicContact CD2-CG 4.21Å; W717-P767 VanDerWaalsContact CE2-CD 3.48Å; W717-P767 HydrophobicContact CG-CG 4Å
718	R	84.3	Confident	75.2	Confident	190 Å²	190	49.3 Å²	49.3	72%	0.717	25%	0.251	S	S	*	.	H	α-helix	trans	-56.2	-48.7	178	178.2	-177.4	177.9	-169.8	-1	110.4	S716 Q720 F721 I722	S716-R718 VanDerWaalsContact C-N 3.25Å; S716-R718 PolarHBondContact O-N 2.86Å; R718-Q720 VanDerWaalsContact C-N 3.31Å; R718-Q720 PolarHBondContact O-N 3.43Å; R718-F721 PolarHBondContact O-N 3.26Å; R718-I722 HydrophobicContact CG-CD1 3.74Å; R718-I722 VanDerWaalsContact O-CG1 3.26Å; R718-I722 WeakPolarHBondContact O-CG1 3.39Å; R718-I722 PolarHBondContact O-N 2.88Å
719	D	79.8	Confident	75.3	Confident	79 Å²	79	50 Å²	50	42%	0.422	26%	0.26	S	S	.	.	H	α-helix	trans	-65.1	-37.8	-179	-57	-33.5	0	0	0	111.2	S716 W717 E723	S716-D719 PolarHBondContact O-N 3.47Å; S716-D719 PolarHBondContact OG-N 3.48Å; S716-D719 VanDerWaalsContact OG-N 3.13Å; S716-D719 PolarHBondContact OG-OD2 3.39Å; W717-D719 VanDerWaalsContact C-N 3.3Å; W717-D719 PolarHBondContact O-N 2.87Å; D719-E723 WeakPolarHBondContact O-CB 3.43Å; D719-E723 PolarHBondContact O-N 3.26Å
720	Q	84.8	Confident	75.3	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.009	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-45	175.6	-67	-174.4	-11.1	0	0	113	T714 S716 W717 R718 E723 A724 A763 V765 P767	T714-Q720 HydrophobicContact CG2-CG 3.94Å; T714-Q720 PolarHBondContact OG1-NE2 3.42Å; S716-Q720 WeakPolarHBondContact O-CG 3.07Å; S716-Q720 PolarHBondContact O-N 3.31Å; W717-Q720 WeakPolarHBondContact O-CB 3.38Å; W717-Q720 PolarHBondContact O-N 2.9Å; R718-Q720 VanDerWaalsContact C-N 3.31Å; R718-Q720 PolarHBondContact O-N 3.43Å; Q720-E723 PolarHBondContact O-N 2.63Å; Q720-A724 WeakPolarHBondContact O-CB 3.4Å; Q720-A724 PolarHBondContact O-N 2.8Å; Q720-A763 HydrophobicContact CB-CB 4.4Å; Q720-A763 PolarHBondContact OE1-O 3.02Å; Q720-V765 PolarHBondContact NE2-O 2.94Å; Q720-V765 PolarHBondContact OE1-O 3.32Å; Q720-V765 VanDerWaalsContact OE1-O 3.08Å; Q720-P767 VanDerWaalsContact NE2-CA 3.34Å
721	F	88.3	Confident	75.1	Confident	59 Å²	59	49.3 Å²	49.3	26%	0.259	26%	0.26	S	S	.	.	H	α-helix	trans	-69.4	-39	179.4	-83.3	-72.6	0	0	0	112.1	W717 R718 A724 I725 A763 F764	W717-F721 AromaticContact CE3-CE2 3.99Å; W717-F721 HydrophobicContact CE3-CE2 3.99Å; W717-F721 VanDerWaalsContact O-CD2 3.24Å; W717-F721 WeakPolarHBondContact O-CD2 3.38Å; W717-F721 PolarHBondContact O-N 3.28Å; R718-F721 PolarHBondContact O-N 3.26Å; F721-A724 PolarHBondContact O-N 3.48Å; F721-I725 WeakPolarHBondContact O-CG1 3.21Å; F721-I725 PolarHBondContact O-N 3.43Å; F721-A763 HydrophobicContact CD1-CB 3.85Å; F721-A763 HydrophobicContact CE1-CB 3.8Å; F721-A763 HydrophobicContact CE2-CB 4.5Å; F721-A763 WeakPolarHBondContact CE2-O 3Å; F721-A763 HydrophobicContact CG-CB 4.23Å; F721-A763 HydrophobicContact CZ-CB 4.13Å; F721-A763 WeakPolarHBondContact CZ-O 3.13Å; F721-F764 HydrophobicContact CE1-CE2 4.12Å; F721-F764 HydrophobicContact CE1-CZ 4.16Å; F721-F764 HydrophobicContact CZ-CD1 4.12Å; F721-F764 HydrophobicContact CZ-CD2 4.32Å; F721-F764 AromaticContact CZ-CE1 3.91Å; F721-F764 HydrophobicContact CZ-CE1 3.91Å; F721-F764 HydrophobicContact CZ-CE2 4.11Å; F721-F764 HydrophobicContact CZ-CG 4.32Å; F721-F764 AromaticContact CZ-CZ 3.91Å; F721-F764 HydrophobicContact CZ-CZ 3.91Å
722	I	83.8	Confident	74.1	Confident	82 Å²	82	55 Å²	55	42%	0.421	29%	0.291	S	S	.	.	H	α-helix	trans	-61	-51.1	173.6	-68.4	169.9	0	0	0	108.9	R718 A724 I725 T726	R718-I722 HydrophobicContact CG-CD1 3.74Å; R718-I722 VanDerWaalsContact O-CG1 3.26Å; R718-I722 WeakPolarHBondContact O-CG1 3.39Å; R718-I722 PolarHBondContact O-N 2.88Å; I722-A724 VanDerWaalsContact C-N 3.26Å; I722-A724 PolarHBondContact O-N 2.68Å; I722-I725 PolarHBondContact O-N 3.13Å; I722-T726 HydrophobicContact CG2-CG2 3.92Å; I722-T726 WeakPolarHBondContact O-CG2 3.49Å; I722-T726 PolarHBondContact O-N 3.01Å; I722-T726 PolarHBondContact O-OG1 2.73Å
723	E	76.8	Confident	73.4	Confident	16 Å²	16	61.1 Å²	61.1	8%	0.075	32%	0.323	C	S	.	.	H	α-helix	trans	-59.7	-34.3	178.9	177.4	167.9	-107.7	0	0	113.7	R103 R376 K387 D719 Q720 I725 T726	R103-E723 IonicContact CZ-OE2 3.74Å; R103-E723 IonicContact NH2-OE2 3.94Å; R103-E723 PolarHBondContact NH2-OE2 2.73Å; R376-E723 IonicContact CZ-OE1 2.86Å; R376-E723 IonicContact NH1-OE1 2.87Å; R376-E723 PolarHBondContact NH1-OE1 3.33Å; R376-E723 IonicContact NH1-OE2 3.97Å; R376-E723 IonicContact NH2-OE1 3.8Å; R376-E723 PolarHBondContact NH2-OE1 2.89Å; K387-E723 IonicContact NZ-OE1 3.18Å; K387-E723 PolarHBondContact NZ-OE1 3.24Å; D719-E723 WeakPolarHBondContact O-CB 3.43Å; D719-E723 PolarHBondContact O-N 3.26Å; Q720-E723 PolarHBondContact O-N 2.63Å; E723-I725 VanDerWaalsContact C-N 3.25Å; E723-I725 PolarHBondContact O-N 3.01Å; E723-T726 WeakPolarHBondContact CA-OG1 3.41Å; E723-T726 PolarHBondContact O-OG1 3.23Å
724	A	84.1	Confident	72.2	Confident	6 Å²	6	67.7 Å²	67.7	5%	0.05	36%	0.356	C	S	.	.	H	α-helix	trans	-65.4	-29	177.6	0	0	0	0	0	113	Q720 F721 I722 H752 K759 V760 A763	Q720-A724 WeakPolarHBondContact O-CB 3.4Å; Q720-A724 PolarHBondContact O-N 2.8Å; F721-A724 PolarHBondContact O-N 3.48Å; I722-A724 VanDerWaalsContact C-N 3.26Å; I722-A724 PolarHBondContact O-N 2.68Å; A724-H752 PolarHBondContact O-CE1 2.9Å; A724-H752 VanDerWaalsContact O-CE1 3.29Å; A724-K759 HydrophobicContact CB-CB 3.91Å; A724-V760 HydrophobicContact CB-CG2 4.35Å; A724-A763 HydrophobicContact CB-CB 4.2Å
725	I	85.7	Confident	70.5	Confident	110 Å²	110	71.9 Å²	71.9	56%	0.564	38%	0.377	S	S	*	.	H	α-helix	trans	-103.6	-22.5	-173.2	-59	167.9	0	0	0	111.8	F721 I722 E723 H752 V760	F721-I725 WeakPolarHBondContact O-CG1 3.21Å; F721-I725 PolarHBondContact O-N 3.43Å; I722-I725 PolarHBondContact O-N 3.13Å; E723-I725 VanDerWaalsContact C-N 3.25Å; E723-I725 PolarHBondContact O-N 3.01Å; I725-H752 PolarHBondContact O-NE2 2.68Å; I725-V760 HydrophobicContact CG1-CG2 4.39Å
726	T	81.3	Confident	69.1	Low	55 Å²	55	77.8 Å²	77.8	34%	0.337	40%	0.403	S	S	.	.			trans	-78	141.5	176.6	54.4	0	0	0	0	112.6	I722 E723 H752	I722-T726 HydrophobicContact CG2-CG2 3.92Å; I722-T726 WeakPolarHBondContact O-CG2 3.49Å; I722-T726 PolarHBondContact O-N 3.01Å; I722-T726 PolarHBondContact O-OG1 2.73Å; E723-T726 WeakPolarHBondContact CA-OG1 3.41Å; E723-T726 PolarHBondContact O-OG1 3.23Å; T726-H752 PolarHBondContact O-CE1 3.01Å
727	V	79.4	Confident	67.2	Low	37 Å²	37	84.6 Å²	84.6	22%	0.224	43%	0.431	C	S	.	.			trans	-102	132.5	168.3	-172.1	0	0	0	0	108.2	P744 D748 Y749 H752	V727-P744 HydrophobicContact CB-CG 4.42Å; V727-P744 HydrophobicContact CG1-CB 3.73Å; V727-P744 HydrophobicContact CG1-CG 3.89Å; V727-D748 HydrophobicContact CG1-CB 4.4Å; V727-Y749 HydrophobicContact CB-CD1 4.43Å; V727-Y749 HydrophobicContact CB-CE1 4.11Å; V727-Y749 HydrophobicContact CG1-CD1 4.21Å; V727-Y749 HydrophobicContact CG1-CE1 4.16Å; V727-Y749 HydrophobicContact CG2-CD1 3.97Å; V727-Y749 HydrophobicContact CG2-CE1 3.95Å; V727-H752 HydrophobicContact CG2-CB 3.9Å
728	S	69.4	Low	64.7	Low	40 Å²	40	85.3 Å²	85.3	28%	0.28	45%	0.447	S	S	.	.	B	Isolated β-bridge	trans	-119.8	142.1	172.6	-55.9	0	0	0	0	108.7	G380	G380-S728 PolarHBondContact O-N 3.47Å
729	A	59.8	Low	62.8	Low	31 Å²	31	79.6 Å²	79.6	26%	0.256	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-63.8	138	179.5	0	0	0	0	0	111.8	K742 P744	A729-K742 WeakPolarHBondContact CB-O 2.98Å; A729-P744 HydrophobicContact CB-CB 4.37Å; A729-P744 HydrophobicContact CB-CG 4.44Å
730	G	54.5	Low	61	Low	27 Å²	27	83.9 Å²	83.9	28%	0.278	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-70.8	154.2	170.7	0	0	0	0	0	112.3	D732 D748	G730-D732 PolarHBondContact O-N 2.88Å; G730-D748 PolarHBondContact N-OD2 3.16Å; G730-D748 VanDerWaalsContact N-OD2 3.15Å
731	E	53.5	Low	59.2	Low	56 Å²	56	91.8 Å²	91.8	26%	0.262	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-70.4	121.3	172.6	-87.2	172.1	162.3	0	0	110.8	N383 K386	N383-E731 PolarHBondContact ND2-OE1 3.48Å; N383-E731 PolarHBondContact ND2-OE2 3.4Å; K386-E731 WeakPolarHBondContact CE-OE1 3.23Å; K386-E731 IonicContact NZ-OE1 2.87Å; K386-E731 PolarHBondContact NZ-OE1 3.42Å
732	D	43.5	Very low	57.6	Low	132 Å²	132	94.3 Å²	94.3	71%	0.706	51%	0.513	S	S	*	.			trans	-104.3	118.5	146.6	-80.4	-33.1	0	0	0	106.6	G730 D734	G730-D732 PolarHBondContact O-N 2.88Å; D732-D734 PolarHBondContact O-N 3.46Å
733	D	45.9	Very low	56.4	Low	141 Å²	141	97.8 Å²	97.8	75%	0.754	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	8.9	-170	-79.2	-34.8	0	0	0	115.8
734	D	39.3	Very low	56	Low	148 Å²	148	98.1 Å²	98.1	79%	0.791	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-3.8	-167.3	-75.1	-31.3	0	0	0	116	D732	D732-D734 PolarHBondContact O-N 3.46Å
735	D	39.3	Very low	55.6	Low	105 Å²	105	100.9 Å²	100.9	56%	0.561	55%	0.554	S	S	*	*			trans	-130.4	74.4	-179.4	-60.1	-49.3	0	0	0	112.3	E737 K742	D735-E737 PolarHBondContact O-N 3.39Å; D735-K742 IonicContact OD2-NZ 3.25Å; D735-K742 PolarHBondContact OD2-NZ 3.43Å
736	E	48.3	Very low	55.2	Low	195 Å²	195	100.8 Å²	100.8	91%	0.911	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	3.3	166.2	-71.8	-171.2	154	0	0	113
737	E	42	Very low	55.1	Low	180 Å²	180	104.3 Å²	104.3	84%	0.841	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	-7.8	-164.2	-129	172.3	-163.7	0	0	115.6	D735	D735-E737 PolarHBondContact O-N 3.39Å
738	C	35.3	Very low	55	Low	100 Å²	100	103.4 Å²	103.4	68%	0.676	57%	0.567	S	S	*	*			trans	-137.3	115.9	178.2	-86.9	0	0	0	0	111.6	E740	C738-E740 PolarHBondContact O-N 3.33Å
739	G	45.1	Very low	55.6	Low	70 Å²	70	107.1 Å²	107.1	72%	0.722	58%	0.576	S	S	*	*			trans	-71	30.5	172.4	0	0	0	0	0	114.2
740	E	40	Very low	56.8	Low	170 Å²	170	109.5 Å²	109.5	79%	0.794	59%	0.587	S	S	*	*	S	Bend	trans	-88.9	127	167.6	-71.2	-167.9	163.9	0	0	108.3	C738 K742	C738-E740 PolarHBondContact O-N 3.33Å; E740-K742 VanDerWaalsContact C-N 3.34Å; E740-K742 PolarHBondContact O-N 3.4Å
741	E	48.5	Very low	58.1	Low	168 Å²	168	109.9 Å²	109.9	79%	0.785	58%	0.582	S	S	*	*			trans	-52.9	100.1	168.9	-72.6	-174.3	169.7	0	0	108.4	R394 L743	R394-E741 IonicContact NH2-OE1 3.15Å; E741-L743 PolarHBondContact O-N 2.86Å
742	K	53.4	Low	59.5	Low	112 Å²	112	108 Å²	108	49%	0.487	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-55.1	126.8	177	-134	172.9	-168.4	169.5	0	106.9	A729 D735 E740	A729-K742 WeakPolarHBondContact CB-O 2.98Å; D735-K742 IonicContact OD2-NZ 3.25Å; D735-K742 PolarHBondContact OD2-NZ 3.43Å; E740-K742 VanDerWaalsContact C-N 3.34Å; E740-K742 PolarHBondContact O-N 3.4Å
743	L	59.6	Low	61.6	Low	154 Å²	154	109.4 Å²	109.4	81%	0.806	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-60.8	142.2	176.7	-73.4	164.5	0	0	0	109.3	E741	E741-L743 PolarHBondContact O-N 2.86Å
744	P	68.7	Low	63.6	Low	23 Å²	23	106.5 Å²	106.5	15%	0.149	56%	0.557	C	S	.	*	P	Polyproline II helix	trans	-59.4	142.6	-177.7	-17.5	27.4	0	0	0	111.7	V727 A729 D748 Y749	V727-P744 HydrophobicContact CB-CG 4.42Å; V727-P744 HydrophobicContact CG1-CB 3.73Å; V727-P744 HydrophobicContact CG1-CG 3.89Å; A729-P744 HydrophobicContact CB-CB 4.37Å; A729-P744 HydrophobicContact CB-CG 4.44Å; P744-D748 HydrophobicContact CB-CB 4.15Å; P744-Y749 HydrophobicContact CB-CD2 4.12Å; P744-Y749 HydrophobicContact CB-CE2 3.61Å; P744-Y749 HydrophobicContact CG-CE2 3.98Å; P744-Y749 WeakPolarHBondContact O-CE2 3.38Å
745	S	74.6	Confident	65.9	Low	65 Å²	65	99.4 Å²	99.4	46%	0.455	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-65.5	153.4	177.6	178.2	0	0	0	0	110.6	F747 D748 Y749	S745-F747 PolarHBondContact O-N 3.3Å; S745-F747 VanDerWaalsContact O-N 3.1Å; S745-F747 PolarHBondContact OG-N 2.96Å; S745-D748 PolarHBondContact N-OD2 2.81Å; S745-D748 VanDerWaalsContact N-OD2 3.09Å; S745-D748 WeakPolarHBondContact O-CB 3.46Å; S745-D748 PolarHBondContact O-N 3.06Å; S745-Y749 WeakPolarHBondContact O-CD2 3.1Å; S745-Y749 PolarHBondContact O-N 3.39Å
746	C	78.6	Confident	68.3	Low	108 Å²	108	96.6 Å²	96.6	73%	0.73	51%	0.505	S	S	*	.	H	α-helix	trans	-53.5	-32.5	171.9	-66.3	0	0	0	0	112	V750	C746-V750 WeakPolarHBondContact O-CG2 3.44Å; C746-V750 PolarHBondContact O-N 2.86Å; C746-V750 VanDerWaalsContact O-N 3.15Å
747	F	77.5	Confident	70.5	Confident	129 Å²	129	92.8 Å²	92.8	57%	0.566	49%	0.486	S	S	*	.	H	α-helix	trans	-66	-40.3	175.3	-177.9	-101.3	0	0	0	112.1	S745 Y749 V750 M751	S745-F747 PolarHBondContact O-N 3.3Å; S745-F747 VanDerWaalsContact O-N 3.1Å; S745-F747 PolarHBondContact OG-N 2.96Å; F747-Y749 VanDerWaalsContact C-N 3.35Å; F747-Y749 PolarHBondContact O-N 3.42Å; F747-V750 PolarHBondContact O-N 3.49Å; F747-M751 HydrophobicContact CD1-CG 4.02Å; F747-M751 HydrophobicContact CD2-CG 4.45Å; F747-M751 HydrophobicContact CE1-CG 3.57Å; F747-M751 HydrophobicContact CE1-SD 4.42Å; F747-M751 HydrophobicContact CE2-CG 4.05Å; F747-M751 HydrophobicContact CE2-SD 4.22Å; F747-M751 HydrophobicContact CG-CG 4.45Å; F747-M751 HydrophobicContact CZ-CG 3.59Å; F747-M751 HydrophobicContact CZ-SD 3.87Å; F747-M751 WeakPolarHBondContact O-CG 3.34Å; F747-M751 PolarHBondContact O-N 2.74Å
748	D	77.8	Confident	72.9	Confident	17 Å²	17	84.8 Å²	84.8	9%	0.091	45%	0.448	C	S	.	.	H	α-helix	trans	-64.5	-40.6	178.6	-60.8	-28.7	0	0	0	111.3	V727 G730 P744 S745 M751 H752	V727-D748 HydrophobicContact CG1-CB 4.4Å; G730-D748 PolarHBondContact N-OD2 3.16Å; G730-D748 VanDerWaalsContact N-OD2 3.15Å; P744-D748 HydrophobicContact CB-CB 4.15Å; S745-D748 PolarHBondContact N-OD2 2.81Å; S745-D748 VanDerWaalsContact N-OD2 3.09Å; S745-D748 WeakPolarHBondContact O-CB 3.46Å; S745-D748 PolarHBondContact O-N 3.06Å; D748-M751 PolarHBondContact O-N 3.47Å; D748-H752 VanDerWaalsContact O-CB 3.26Å; D748-H752 WeakPolarHBondContact O-CB 3.35Å; D748-H752 PolarHBondContact O-N 3.14Å
749	Y	82.7	Confident	75.4	Confident	119 Å²	119	81 Å²	81	47%	0.467	42%	0.42	S	S	.	.	H	α-helix	trans	-64	-40.8	174.2	-77.3	-70.7	0	0	0	112.6	V727 P744 S745 F747 H752 F753	V727-Y749 HydrophobicContact CB-CD1 4.43Å; V727-Y749 HydrophobicContact CB-CE1 4.11Å; V727-Y749 HydrophobicContact CG1-CD1 4.21Å; V727-Y749 HydrophobicContact CG1-CE1 4.16Å; V727-Y749 HydrophobicContact CG2-CD1 3.97Å; V727-Y749 HydrophobicContact CG2-CE1 3.95Å; P744-Y749 HydrophobicContact CB-CD2 4.12Å; P744-Y749 HydrophobicContact CB-CE2 3.61Å; P744-Y749 HydrophobicContact CG-CE2 3.98Å; P744-Y749 WeakPolarHBondContact O-CE2 3.38Å; S745-Y749 WeakPolarHBondContact O-CD2 3.1Å; S745-Y749 PolarHBondContact O-N 3.39Å; F747-Y749 VanDerWaalsContact C-N 3.35Å; F747-Y749 PolarHBondContact O-N 3.42Å; Y749-H752 PolarHBondContact O-N 2.87Å; Y749-F753 WeakPolarHBondContact O-CB 3.39Å; Y749-F753 PolarHBondContact O-N 3.04Å
750	V	84.8	Confident	77.6	Confident	81 Å²	81	80 Å²	80	49%	0.491	40%	0.4	S	S	.	.	H	α-helix	trans	-65.5	-45.9	176.6	170.9	0	0	0	0	110.7	C746 F747 H752 F753 L754	C746-V750 WeakPolarHBondContact O-CG2 3.44Å; C746-V750 PolarHBondContact O-N 2.86Å; C746-V750 VanDerWaalsContact O-N 3.15Å; F747-V750 PolarHBondContact O-N 3.49Å; V750-H752 VanDerWaalsContact C-N 3.33Å; V750-H752 PolarHBondContact O-N 2.82Å; V750-F753 PolarHBondContact O-N 3.29Å; V750-L754 HydrophobicContact CG1-CD1 4.22Å; V750-L754 WeakPolarHBondContact O-CG 3.32Å; V750-L754 PolarHBondContact O-N 3.49Å
751	M	81	Confident	80.1	Confident	34 Å²	34	75.4 Å²	75.4	17%	0.167	38%	0.38	C	S	.	.	H	α-helix	trans	-64.3	-39	177.2	-70.7	-57.2	-70.3	0	0	111.6	M378 F747 D748 L754 T755	M378-M751 WeakPolarHBondContact O-CB 3.33Å; M378-M751 WeakPolarHBondContact O-CE 3.3Å; F747-M751 HydrophobicContact CD1-CG 4.02Å; F747-M751 HydrophobicContact CD2-CG 4.45Å; F747-M751 HydrophobicContact CE1-CG 3.57Å; F747-M751 HydrophobicContact CE1-SD 4.42Å; F747-M751 HydrophobicContact CE2-CG 4.05Å; F747-M751 HydrophobicContact CE2-SD 4.22Å; F747-M751 HydrophobicContact CG-CG 4.45Å; F747-M751 HydrophobicContact CZ-CG 3.59Å; F747-M751 HydrophobicContact CZ-SD 3.87Å; F747-M751 WeakPolarHBondContact O-CG 3.34Å; F747-M751 PolarHBondContact O-N 2.74Å; D748-M751 PolarHBondContact O-N 3.47Å; M751-L754 PolarHBondContact O-N 2.96Å; M751-T755 WeakPolarHBondContact O-CB 3.37Å; M751-T755 WeakPolarHBondContact O-CG2 3.37Å; M751-T755 PolarHBondContact O-N 2.93Å; M751-T755 PolarHBondContact O-OG1 3.3Å
752	H	84.3	Confident	82.1	Confident	18 Å²	18	67.6 Å²	67.6	8%	0.083	34%	0.344	C	S	.	.	H	α-helix	trans	-62.6	-47.4	173.2	-174.8	94.7	0	0	0	111.2	A724 I725 T726 V727 D748 Y749 V750 L754 T755 V756	A724-H752 PolarHBondContact O-CE1 2.9Å; A724-H752 VanDerWaalsContact O-CE1 3.29Å; I725-H752 PolarHBondContact O-NE2 2.68Å; T726-H752 PolarHBondContact O-CE1 3.01Å; V727-H752 HydrophobicContact CG2-CB 3.9Å; D748-H752 VanDerWaalsContact O-CB 3.26Å; D748-H752 WeakPolarHBondContact O-CB 3.35Å; D748-H752 PolarHBondContact O-N 3.14Å; Y749-H752 PolarHBondContact O-N 2.87Å; V750-H752 VanDerWaalsContact C-N 3.33Å; V750-H752 PolarHBondContact O-N 2.82Å; H752-L754 VanDerWaalsContact C-N 3.31Å; H752-L754 PolarHBondContact O-N 3.45Å; H752-T755 WeakPolarHBondContact CA-OG1 3.44Å; H752-T755 CarbonylContact O-C 3.53Å; H752-T755 PolarHBondContact O-N 3.14Å; H752-T755 PolarHBondContact O-OG1 3Å; H752-V756 WeakPolarHBondContact O-CB 3.31Å; H752-V756 PolarHBondContact O-N 2.81Å
753	F	87.8	Confident	83.9	Confident	161 Å²	161	62.4 Å²	62.4	71%	0.706	32%	0.322	S	S	*	.	H	α-helix	trans	-59.5	-39.8	178.3	180	-98.1	0	0	0	112.9	Y749 V750 T755 V756	Y749-F753 WeakPolarHBondContact O-CB 3.39Å; Y749-F753 PolarHBondContact O-N 3.04Å; V750-F753 PolarHBondContact O-N 3.29Å; F753-T755 VanDerWaalsContact C-N 3.33Å; F753-V756 WeakPolarHBondContact O-CG1 3.43Å
754	L	86.6	Confident	85.3	Confident	79 Å²	79	61.5 Å²	61.5	41%	0.414	31%	0.312	S	S	.	.	H	α-helix	trans	-68.7	-32.1	175.9	-69.2	174	0	0	0	112.5	Y92 V750 M751 H752	Y92-L754 WeakPolarHBondContact CE2-O 2.87Å; V750-L754 HydrophobicContact CG1-CD1 4.22Å; V750-L754 WeakPolarHBondContact O-CG 3.32Å; V750-L754 PolarHBondContact O-N 3.49Å; M751-L754 PolarHBondContact O-N 2.96Å; H752-L754 VanDerWaalsContact C-N 3.31Å; H752-L754 PolarHBondContact O-N 3.45Å
755	T	88.4	Confident	86.4	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-97.3	-15.4	-173.1	61.5	0	0	0	0	113.8	L95 I99 T379 M751 H752 F753 F757 W758 K759	L95-T755 HydrophobicContact CD1-CG2 3.67Å; L95-T755 HydrophobicContact CD2-CG2 3.49Å; L95-T755 VanDerWaalsContact CD2-CG2 3.49Å; L95-T755 HydrophobicContact CG-CG2 3.95Å; I99-T755 HydrophobicContact CD1-CG2 4.24Å; T379-T755 HydrophobicContact CG2-CG2 3.72Å; M751-T755 WeakPolarHBondContact O-CB 3.37Å; M751-T755 WeakPolarHBondContact O-CG2 3.37Å; M751-T755 PolarHBondContact O-N 2.93Å; M751-T755 PolarHBondContact O-OG1 3.3Å; H752-T755 WeakPolarHBondContact CA-OG1 3.44Å; H752-T755 CarbonylContact O-C 3.53Å; H752-T755 PolarHBondContact O-N 3.14Å; H752-T755 PolarHBondContact O-OG1 3Å; F753-T755 VanDerWaalsContact C-N 3.33Å; T755-F757 VanDerWaalsContact C-N 3.28Å; T755-F757 PolarHBondContact O-N 2.79Å; T755-W758 WeakPolarHBondContact O-CB 3.4Å; T755-W758 PolarHBondContact O-N 2.86Å; T755-K759 WeakPolarHBondContact O-CG 3.48Å; T755-K759 PolarHBondContact O-N 3.5Å
756	V	90.3	Very high	87.2	Confident	45 Å²	45	58.6 Å²	58.6	27%	0.273	29%	0.291	S	S	.	.	H	α-helix	trans	-58.1	-38.5	-172.7	72.4	0	0	0	0	112.4	H752 F753 W758 K759 V760	H752-V756 WeakPolarHBondContact O-CB 3.31Å; H752-V756 PolarHBondContact O-N 2.81Å; F753-V756 WeakPolarHBondContact O-CG1 3.43Å; V756-W758 PolarHBondContact O-N 3.21Å; V756-K759 PolarHBondContact O-N 3.13Å; V756-V760 HydrophobicContact CG2-CG2 4.17Å; V756-V760 WeakPolarHBondContact O-CB 3.38Å; V756-V760 VanDerWaalsContact O-CG2 3.32Å; V756-V760 WeakPolarHBondContact O-CG2 3.33Å; V756-V760 PolarHBondContact O-N 3.08Å
757	F	93.1	Very high	87.8	Confident	115 Å²	115	53.4 Å²	53.4	50%	0.504	26%	0.256	S	S	.	.	H	α-helix	trans	-56.7	-50.1	175.5	169.4	-100.6	0	0	0	111.2	Y92 T755 L761	Y92-F757 HydrophobicContact CE1-CD1 4.38Å; Y92-F757 WeakPolarHBondContact OH-CB 3.25Å; Y92-F757 WeakPolarHBondContact OH-CD1 3.35Å; T755-F757 VanDerWaalsContact C-N 3.28Å; T755-F757 PolarHBondContact O-N 2.79Å; F757-L761 HydrophobicContact CE1-CD2 4.46Å; F757-L761 HydrophobicContact CZ-CD2 4.48Å; F757-L761 VanDerWaalsContact O-CB 3.31Å; F757-L761 WeakPolarHBondContact O-CB 3.04Å; F757-L761 PolarHBondContact O-N 3.46Å
758	W	92.1	Very high	88.1	Confident	13 Å²	13	47.3 Å²	47.3	5%	0.049	23%	0.23	C	C	.	.	H	α-helix	trans	-67.2	-41	178.1	-67.2	119.5	0	0	0	112	Y92 M93 L95 I99 T755 V756 V760 L761 F762 L787	Y92-W758 AromaticContact CD1-CZ2 3.91Å; Y92-W758 HydrophobicContact CD1-CZ2 3.91Å; Y92-W758 AromaticContact CD1-NE1 3.71Å; Y92-W758 AromaticContact CE1-CE2 3.63Å; Y92-W758 AromaticContact CE1-CZ2 3.66Å; Y92-W758 HydrophobicContact CE1-CZ2 3.66Å; Y92-W758 AromaticContact CE1-NE1 3.26Å; Y92-W758 VanDerWaalsContact CE1-NE1 3.26Å; Y92-W758 AromaticContact CE2-NE1 3.6Å; Y92-W758 AromaticContact CZ-CD1 3.8Å; Y92-W758 AromaticContact CZ-CE2 3.97Å; Y92-W758 AromaticContact CZ-NE1 3.21Å; Y92-W758 PolarHBondContact O-NE1 3.31Å; M93-W758 HydrophobicContact CE-CH2 4.12Å; M93-W758 HydrophobicContact SD-CH2 3.65Å; M93-W758 HydrophobicContact SD-CZ2 3.62Å; L95-W758 VanDerWaalsContact CD2-CD1 3.46Å; L95-W758 HydrophobicContact CD2-CG 4.4Å; I99-W758 HydrophobicContact CD1-CB 3.75Å; T755-W758 WeakPolarHBondContact O-CB 3.4Å; T755-W758 PolarHBondContact O-N 2.86Å; V756-W758 PolarHBondContact O-N 3.21Å; W758-V760 PolarHBondContact O-N 2.99Å; W758-L761 HydrophobicContact CE3-CD2 3.83Å; W758-L761 HydrophobicContact CZ3-CD2 3.76Å; W758-L761 PolarHBondContact O-N 3.17Å; W758-F762 HydrophobicContact CB-CD2 4.18Å; W758-F762 HydrophobicContact CB-CE2 3.79Å; W758-F762 HydrophobicContact CD2-CE2 4.26Å; W758-F762 HydrophobicContact CD2-CZ 4.25Å; W758-F762 HydrophobicContact CE3-CE1 4.18Å; W758-F762 AromaticContact CE3-CE2 3.8Å; W758-F762 HydrophobicContact CE3-CE2 3.8Å; W758-F762 AromaticContact CE3-CZ 3.39Å; W758-F762 HydrophobicContact CE3-CZ 3.39Å; W758-F762 HydrophobicContact CG-CE2 4.31Å; W758-F762 AromaticContact CZ3-CZ 3.95Å; W758-F762 HydrophobicContact CZ3-CZ 3.95Å; W758-F762 WeakPolarHBondContact O-CB 3.33Å; W758-F762 WeakPolarHBondContact O-CD2 3.27Å; W758-F762 VanDerWaalsContact O-CG 3.25Å; W758-F762 WeakPolarHBondContact O-CG 3.32Å; W758-F762 PolarHBondContact O-N 3.23Å; W758-L787 HydrophobicContact CH2-CD2 3.64Å; W758-L787 HydrophobicContact CZ3-CD2 3.6Å
759	K	89.3	Confident	88.4	Confident	19 Å²	19	49.8 Å²	49.8	8%	0.083	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-46.5	177.8	-72.7	-177.5	173.2	-177.7	0	112.2	T379 A724 T755 V756 F762 A763	T379-K759 PolarHBondContact O-NZ 3.38Å; T379-K759 WeakPolarHBondContact OG1-CE 3.24Å; A724-K759 HydrophobicContact CB-CB 3.91Å; T755-K759 WeakPolarHBondContact O-CG 3.48Å; T755-K759 PolarHBondContact O-N 3.5Å; V756-K759 PolarHBondContact O-N 3.13Å; K759-F762 PolarHBondContact O-N 3.28Å; K759-A763 WeakPolarHBondContact O-CB 3.27Å; K759-A763 PolarHBondContact O-N 3.49Å
760	V	91.1	Very high	88.5	Confident	49 Å²	49	50.2 Å²	50.2	30%	0.297	24%	0.244	S	C	.	.	H	α-helix	trans	-67.8	-40.1	177.6	174	0	0	0	0	110.8	A724 I725 V756 W758 A763 F764	A724-V760 HydrophobicContact CB-CG2 4.35Å; I725-V760 HydrophobicContact CG1-CG2 4.39Å; V756-V760 HydrophobicContact CG2-CG2 4.17Å; V756-V760 WeakPolarHBondContact O-CB 3.38Å; V756-V760 VanDerWaalsContact O-CG2 3.32Å; V756-V760 WeakPolarHBondContact O-CG2 3.33Å; V756-V760 PolarHBondContact O-N 3.08Å; W758-V760 PolarHBondContact O-N 2.99Å; V760-A763 WeakPolarHBondContact O-CB 3.26Å; V760-A763 PolarHBondContact O-N 2.88Å; V760-F764 VanDerWaalsContact O-CD2 3.3Å; V760-F764 WeakPolarHBondContact O-CD2 3.32Å
761	L	92.3	Very high	88.7	Confident	74 Å²	74	56.3 Å²	56.3	39%	0.387	26%	0.259	S	S	.	.	H	α-helix	trans	-62	-44	176.2	-176.2	67.4	0	0	0	112	F757 W758 A763 F764	F757-L761 HydrophobicContact CE1-CD2 4.46Å; F757-L761 HydrophobicContact CZ-CD2 4.48Å; F757-L761 VanDerWaalsContact O-CB 3.31Å; F757-L761 WeakPolarHBondContact O-CB 3.04Å; F757-L761 PolarHBondContact O-N 3.46Å; W758-L761 HydrophobicContact CE3-CD2 3.83Å; W758-L761 HydrophobicContact CZ3-CD2 3.76Å; W758-L761 PolarHBondContact O-N 3.17Å; L761-A763 VanDerWaalsContact C-N 3.34Å; L761-F764 WeakPolarHBondContact O-CB 3.29Å; L761-F764 WeakPolarHBondContact O-CD2 3.45Å; L761-F764 PolarHBondContact O-N 3Å
762	F	91.1	Very high	88.8	Confident	5 Å²	5	57.7 Å²	57.7	2%	0.022	27%	0.272	C	S	.	.	H	α-helix	trans	-83.3	-10.8	-179.3	-55.6	-38.7	0	0	0	113.6	G96 I99 I100 W758 K759 F764 V765 L787	G96-F762 WeakPolarHBondContact O-CE2 3.39Å; I99-F762 HydrophobicContact CB-CD2 4.02Å; I99-F762 HydrophobicContact CB-CE2 4.12Å; I99-F762 HydrophobicContact CG2-CD2 3.7Å; I99-F762 HydrophobicContact CG2-CE2 4.31Å; I100-F762 HydrophobicContact CB-CD1 4.13Å; I100-F762 HydrophobicContact CB-CD2 3.96Å; I100-F762 HydrophobicContact CB-CE1 3.99Å; I100-F762 HydrophobicContact CB-CE2 3.82Å; I100-F762 HydrophobicContact CB-CG 4.12Å; I100-F762 HydrophobicContact CB-CZ 3.84Å; I100-F762 HydrophobicContact CD1-CB 4.24Å; I100-F762 HydrophobicContact CD1-CD1 3.82Å; I100-F762 HydrophobicContact CD1-CE1 4.36Å; I100-F762 HydrophobicContact CD1-CG 3.98Å; I100-F762 HydrophobicContact CG1-CD1 4.25Å; I100-F762 HydrophobicContact CG1-CE1 4.3Å; I100-F762 HydrophobicContact CG2-CE2 4.33Å; I100-F762 HydrophobicContact CG2-CZ 4.14Å; W758-F762 HydrophobicContact CB-CD2 4.18Å; W758-F762 HydrophobicContact CB-CE2 3.79Å; W758-F762 HydrophobicContact CD2-CE2 4.26Å; W758-F762 HydrophobicContact CD2-CZ 4.25Å; W758-F762 HydrophobicContact CE3-CE1 4.18Å; W758-F762 AromaticContact CE3-CE2 3.8Å; W758-F762 HydrophobicContact CE3-CE2 3.8Å; W758-F762 AromaticContact CE3-CZ 3.39Å; W758-F762 HydrophobicContact CE3-CZ 3.39Å; W758-F762 HydrophobicContact CG-CE2 4.31Å; W758-F762 AromaticContact CZ3-CZ 3.95Å; W758-F762 HydrophobicContact CZ3-CZ 3.95Å; W758-F762 WeakPolarHBondContact O-CB 3.33Å; W758-F762 WeakPolarHBondContact O-CD2 3.27Å; W758-F762 VanDerWaalsContact O-CG 3.25Å; W758-F762 WeakPolarHBondContact O-CG 3.32Å; W758-F762 PolarHBondContact O-N 3.23Å; K759-F762 PolarHBondContact O-N 3.28Å; F762-F764 PolarHBondContact O-N 2.98Å; F762-V765 HydrophobicContact CB-CG2 4.47Å; F762-V765 VanDerWaalsContact O-CB 3.3Å; F762-V765 WeakPolarHBondContact O-CB 3.38Å; F762-V765 WeakPolarHBondContact O-CG2 3.37Å; F762-V765 PolarHBondContact O-N 2.78Å; F762-L787 HydrophobicContact CE1-CD1 4.11Å; F762-L787 HydrophobicContact CZ-CD1 3.64Å
763	A	89.4	Confident	88.9	Confident	3 Å²	3	56.9 Å²	56.9	3%	0.025	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-1.2	163.4	0	0	0	0	0	112.7	W717 Q720 F721 A724 K759 V760 L761	W717-A763 WeakPolarHBondContact CZ3-O 3.3Å; Q720-A763 HydrophobicContact CB-CB 4.4Å; Q720-A763 PolarHBondContact OE1-O 3.02Å; F721-A763 HydrophobicContact CD1-CB 3.85Å; F721-A763 HydrophobicContact CE1-CB 3.8Å; F721-A763 HydrophobicContact CE2-CB 4.5Å; F721-A763 WeakPolarHBondContact CE2-O 3Å; F721-A763 HydrophobicContact CG-CB 4.23Å; F721-A763 HydrophobicContact CZ-CB 4.13Å; F721-A763 WeakPolarHBondContact CZ-O 3.13Å; A724-A763 HydrophobicContact CB-CB 4.2Å; K759-A763 WeakPolarHBondContact O-CB 3.27Å; K759-A763 PolarHBondContact O-N 3.49Å; V760-A763 WeakPolarHBondContact O-CB 3.26Å; V760-A763 PolarHBondContact O-N 2.88Å; L761-A763 VanDerWaalsContact C-N 3.34Å
764	F	90.6	Very high	89	Confident	135 Å²	135	54.6 Å²	54.6	59%	0.592	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	7.6	164.6	-69.3	-82.9	0	0	0	113.5	W717 F721 V760 L761 F762	W717-F764 WeakPolarHBondContact CH2-O 3.22Å; F721-F764 HydrophobicContact CE1-CE2 4.12Å; F721-F764 HydrophobicContact CE1-CZ 4.16Å; F721-F764 HydrophobicContact CZ-CD1 4.12Å; F721-F764 HydrophobicContact CZ-CD2 4.32Å; F721-F764 AromaticContact CZ-CE1 3.91Å; F721-F764 HydrophobicContact CZ-CE1 3.91Å; F721-F764 HydrophobicContact CZ-CE2 4.11Å; F721-F764 HydrophobicContact CZ-CG 4.32Å; F721-F764 AromaticContact CZ-CZ 3.91Å; F721-F764 HydrophobicContact CZ-CZ 3.91Å; V760-F764 VanDerWaalsContact O-CD2 3.3Å; V760-F764 WeakPolarHBondContact O-CD2 3.32Å; L761-F764 WeakPolarHBondContact O-CB 3.29Å; L761-F764 WeakPolarHBondContact O-CD2 3.45Å; L761-F764 PolarHBondContact O-N 3Å; F762-F764 PolarHBondContact O-N 2.98Å
765	V	91.6	Very high	89.2	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.018	24%	0.242	C	C	.	.	S	Bend	trans	-87	132.5	170.6	179.6	0	0	0	0	109.4	I100 W717 Q720 F762 V779	I100-V765 HydrophobicContact CD1-CG2 3.74Å; W717-V765 WeakPolarHBondContact CH2-O 3.48Å; W717-V765 VanDerWaalsContact CZ3-O 3.28Å; W717-V765 WeakPolarHBondContact CZ3-O 3.24Å; Q720-V765 PolarHBondContact NE2-O 2.94Å; Q720-V765 PolarHBondContact OE1-O 3.32Å; Q720-V765 VanDerWaalsContact OE1-O 3.08Å; F762-V765 HydrophobicContact CB-CG2 4.47Å; F762-V765 VanDerWaalsContact O-CB 3.3Å; F762-V765 WeakPolarHBondContact O-CB 3.38Å; F762-V765 WeakPolarHBondContact O-CG2 3.37Å; F762-V765 PolarHBondContact O-N 2.78Å; V765-V779 HydrophobicContact CG1-CB 4.38Å; V765-V779 HydrophobicContact CG1-CG1 4.27Å; V765-V779 HydrophobicContact CG2-CG1 4.29Å
766	P	91.6	Very high	89.3	Confident	23 Å²	23	51.8 Å²	51.8	15%	0.149	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-50.2	140.1	-179.9	-28.2	34.4	0	0	0	113.3	W717 A775 C776 V779	W717-P766 HydrophobicContact CH2-CG 4.49Å; W717-P766 HydrophobicContact CZ2-CB 4.34Å; W717-P766 HydrophobicContact CZ2-CG 4.37Å; P766-A775 HydrophobicContact CB-CB 4.19Å; P766-C776 WeakPolarHBondContact O-CB 3.5Å; P766-V779 HydrophobicContact CG-CG2 4.07Å
767	P	89.4	Confident	89.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-53.8	148.1	171.7	-24.8	33.2	0	0	0	112.2	T714 W717 Q720 D769 Y770	T714-P767 VanDerWaalsContact O-CB 3.24Å; T714-P767 WeakPolarHBondContact O-CB 3.2Å; W717-P767 HydrophobicContact CD2-CG 4.21Å; W717-P767 VanDerWaalsContact CE2-CD 3.48Å; W717-P767 HydrophobicContact CG-CG 4Å; Q720-P767 VanDerWaalsContact NE2-CA 3.34Å; P767-D769 PolarHBondContact O-N 3.26Å; P767-Y770 HydrophobicContact CB-CD2 4.22Å; P767-Y770 HydrophobicContact CG-CD2 4.43Å; P767-Y770 HydrophobicContact CG-CE2 4.48Å; P767-Y770 WeakPolarHBondContact O-CB 3.49Å; P767-Y770 PolarHBondContact O-N 2.89Å; P767-Y770 VanDerWaalsContact O-N 3.11Å
768	T	85.1	Confident	89.4	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-20.3	-175	51.1	0	0	0	0	112.8	A106 G713 T714 Y770 G773 C776	A106-T768 HydrophobicContact CB-CG2 4.21Å; G713-T768 WeakPolarHBondContact CA-OG1 3.46Å; T714-T768 PolarHBondContact N-OG1 2.94Å; T714-T768 PolarHBondContact O-N 3.09Å; T714-T768 PolarHBondContact O-OG1 3.24Å; T768-Y770 PolarHBondContact O-N 3.35Å; T768-G773 WeakPolarHBondContact O-CA 3.17Å; T768-G773 PolarHBondContact O-N 3.49Å; T768-C776 HydrophobicContact CG2-CB 4.3Å
769	D	83.8	Confident	89.4	Confident	68 Å²	68	51.1 Å²	51.1	36%	0.364	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-24.1	175.3	-73.5	1.8	0	0	0	112.5	N715 P767 W771 S772	N715-D769 WeakPolarHBondContact CA-OD2 3.07Å; N715-D769 WeakPolarHBondContact CB-OD2 3.49Å; N715-D769 PolarHBondContact OD1-OD1 3.35Å; N715-D769 PolarHBondContact OD1-OD2 3.46Å; P767-D769 PolarHBondContact O-N 3.26Å; D769-W771 PolarHBondContact O-N 3.38Å; D769-S772 PolarHBondContact O-N 2.88Å
770	Y	85.7	Confident	89.6	Confident	128 Å²	128	50.2 Å²	50.2	50%	0.502	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-69.5	123.6	-179.4	-83.8	-124.9	0	0	0	110.6	P767 T768 S772 G773	P767-Y770 HydrophobicContact CB-CD2 4.22Å; P767-Y770 HydrophobicContact CG-CD2 4.43Å; P767-Y770 HydrophobicContact CG-CE2 4.48Å; P767-Y770 WeakPolarHBondContact O-CB 3.49Å; P767-Y770 PolarHBondContact O-N 2.89Å; P767-Y770 VanDerWaalsContact O-N 3.11Å; T768-Y770 PolarHBondContact O-N 3.35Å; Y770-S772 PolarHBondContact O-N 3.02Å; Y770-G773 PolarHBondContact O-N 3.47Å
771	W	87.5	Confident	89.6	Confident	209 Å²	209	50 Å²	50	79%	0.792	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	49.9	39.1	-176.1	-67.1	-10.7	0	0	0	112.8	D769 G773 W774 A775	D769-W771 PolarHBondContact O-N 3.38Å; W771-G773 PolarHBondContact O-N 2.93Å; W771-G773 VanDerWaalsContact O-N 3.15Å; W771-W774 HydrophobicContact CB-CB 4.4Å; W771-W774 VanDerWaalsContact O-CD1 3.32Å; W771-W774 PolarHBondContact O-N 3.24Å; W771-W774 VanDerWaalsContact O-N 3.13Å; W771-A775 HydrophobicContact CB-CB 4.49Å; W771-A775 HydrophobicContact CE3-CB 4.23Å
772	S	83.6	Confident	89.6	Confident	64 Å²	64	50.6 Å²	50.6	45%	0.448	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	52.4	39.9	176.9	-44.6	0	0	0	0	113	I111 Q114 D769 Y770	I111-S772 WeakPolarHBondContact CG1-O 3.4Å; Q114-S772 PolarHBondContact NE2-O 3.09Å; D769-S772 PolarHBondContact O-N 2.88Å; Y770-S772 PolarHBondContact O-N 3.02Å
773	G	85.7	Confident	89.7	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	98.5	-20.6	176.8	0	0	0	0	0	115.1	T768 Y770 W771 A775 C776 F777	T768-G773 WeakPolarHBondContact O-CA 3.17Å; T768-G773 PolarHBondContact O-N 3.49Å; Y770-G773 PolarHBondContact O-N 3.47Å; W771-G773 PolarHBondContact O-N 2.93Å; W771-G773 VanDerWaalsContact O-N 3.15Å; G773-A775 PolarHBondContact O-N 3.19Å; G773-C776 PolarHBondContact O-N 2.92Å; G773-F777 PolarHBondContact O-N 3Å
774	W	90	Very high	89.8	Confident	114 Å²	114	53.8 Å²	53.8	43%	0.432	27%	0.265	S	S	.	.	H	α-helix	trans	-67.5	-34.1	-171.6	-73.3	102.6	0	0	0	114.3	I111 W771 F777 V778	I111-W774 HydrophobicContact CD1-CD2 3.86Å; I111-W774 HydrophobicContact CD1-CE3 4.08Å; I111-W774 HydrophobicContact CD1-CG 4.23Å; I111-W774 HydrophobicContact CD1-CZ2 4.4Å; I111-W774 HydrophobicContact CD1-CZ3 4.44Å; I111-W774 HydrophobicContact CG1-CD2 4.39Å; I111-W774 HydrophobicContact CG1-CG 4.48Å; I111-W774 HydrophobicContact CG2-CZ2 3.83Å; W771-W774 HydrophobicContact CB-CB 4.4Å; W771-W774 VanDerWaalsContact O-CD1 3.32Å; W771-W774 PolarHBondContact O-N 3.24Å; W771-W774 VanDerWaalsContact O-N 3.13Å; W774-F777 HydrophobicContact CE3-CD1 4.32Å; W774-F777 HydrophobicContact CZ3-CD1 4.38Å; W774-F777 WeakPolarHBondContact O-CB 3.33Å; W774-F777 PolarHBondContact O-N 3.48Å; W774-V778 WeakPolarHBondContact O-CG2 3.38Å; W774-V778 PolarHBondContact O-N 3.31Å; W774-V778 VanDerWaalsContact O-N 3.12Å
775	A	91.7	Very high	89.8	Confident	18 Å²	18	47.8 Å²	47.8	15%	0.149	24%	0.241	C	C	.	.	H	α-helix	trans	-65.1	-45.6	176.8	0	0	0	0	0	111.4	P766 W771 G773 V779	P766-A775 HydrophobicContact CB-CB 4.19Å; W771-A775 HydrophobicContact CB-CB 4.49Å; W771-A775 HydrophobicContact CE3-CB 4.23Å; G773-A775 PolarHBondContact O-N 3.19Å; A775-V779 WeakPolarHBondContact O-CG2 3.24Å; A775-V779 PolarHBondContact O-N 3.32Å; A775-V779 VanDerWaalsContact O-N 3.17Å
776	C	91.1	Very high	89.8	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.007	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-42.8	174.4	-176.2	0	0	0	0	111.4	P766 T768 G773 V778 V779 S780	P766-C776 WeakPolarHBondContact O-CB 3.5Å; T768-C776 HydrophobicContact CG2-CB 4.3Å; G773-C776 PolarHBondContact O-N 2.92Å; C776-V778 PolarHBondContact O-N 3.36Å; C776-V779 PolarHBondContact O-N 3.22Å; C776-S780 VanDerWaalsContact O-CB 3.25Å; C776-S780 WeakPolarHBondContact O-CB 3.16Å; C776-S780 PolarHBondContact O-N 3.3Å; C776-S780 PolarHBondContact O-OG 3.4Å
777	F	91	Very high	89.9	Confident	27 Å²	27	51.7 Å²	51.7	12%	0.118	26%	0.26	C	S	.	.	H	α-helix	trans	-55.7	-51.1	178.2	-177.9	-86.4	0	0	0	112.2	F104 S107 I108 I111 G773 W774 S780 I781	F104-F777 AromaticContact CD2-CD2 3.99Å; F104-F777 HydrophobicContact CD2-CD2 3.99Å; F104-F777 HydrophobicContact CD2-CE2 4.23Å; F104-F777 HydrophobicContact CD2-CG 4.49Å; F104-F777 HydrophobicContact CE2-CD1 4.38Å; F104-F777 AromaticContact CE2-CD2 3.4Å; F104-F777 HydrophobicContact CE2-CD2 3.4Å; F104-F777 VanDerWaalsContact CE2-CD2 3.4Å; F104-F777 HydrophobicContact CE2-CE1 4.25Å; F104-F777 AromaticContact CE2-CE2 3.25Å; F104-F777 HydrophobicContact CE2-CE2 3.25Å; F104-F777 AromaticContact CE2-CG 3.98Å; F104-F777 HydrophobicContact CE2-CG 3.98Å; F104-F777 AromaticContact CE2-CZ 3.71Å; F104-F777 HydrophobicContact CE2-CZ 3.71Å; F104-F777 HydrophobicContact CZ-CD2 4.22Å; F104-F777 AromaticContact CZ-CE2 3.63Å; F104-F777 HydrophobicContact CZ-CE2 3.63Å; F104-F777 AromaticContact CZ-CZ 3.96Å; F104-F777 HydrophobicContact CZ-CZ 3.96Å; S107-F777 WeakPolarHBondContact OG-CA 3.28Å; I108-F777 HydrophobicContact CD1-CD2 4.45Å; I108-F777 HydrophobicContact CD1-CE2 4.07Å; I108-F777 HydrophobicContact CG1-CD2 3.79Å; I108-F777 HydrophobicContact CG1-CE2 3.76Å; I111-F777 HydrophobicContact CD1-CB 4.09Å; I111-F777 HydrophobicContact CD1-CD2 4.17Å; I111-F777 HydrophobicContact CD1-CG 4.31Å; G773-F777 PolarHBondContact O-N 3Å; W774-F777 HydrophobicContact CE3-CD1 4.32Å; W774-F777 HydrophobicContact CZ3-CD1 4.38Å; W774-F777 WeakPolarHBondContact O-CB 3.33Å; W774-F777 PolarHBondContact O-N 3.48Å; F777-S780 PolarHBondContact O-OG 3.03Å; F777-S780 VanDerWaalsContact O-OG 3.09Å; F777-I781 WeakPolarHBondContact O-CB 3.41Å; F777-I781 WeakPolarHBondContact O-CG2 3.22Å; F777-I781 PolarHBondContact O-N 2.65Å; F777-I781 VanDerWaalsContact O-N 3.07Å
778	V	92.8	Very high	89.9	Confident	82 Å²	82	51.9 Å²	51.9	50%	0.497	26%	0.261	S	S	.	.	H	α-helix	trans	-69.7	-41.7	-177.2	177.3	0	0	0	0	112.2	W774 C776 I781 C782	W774-V778 WeakPolarHBondContact O-CG2 3.38Å; W774-V778 PolarHBondContact O-N 3.31Å; W774-V778 VanDerWaalsContact O-N 3.12Å; C776-V778 PolarHBondContact O-N 3.36Å; V778-I781 VanDerWaalsContact O-CG2 3.25Å; V778-I781 WeakPolarHBondContact O-CG2 3.18Å; V778-C782 PolarHBondContact O-N 3.31Å; V778-C782 PolarHBondContact O-SG 2.95Å
779	V	93.5	Very high	90.2	Very high	50 Å²	50	52.2 Å²	52.2	30%	0.303	26%	0.263	S	S	.	.	H	α-helix	trans	-69.4	-41.6	-179.9	176.6	0	0	0	0	111.1	V765 P766 A775 C776 C782 M783	V765-V779 HydrophobicContact CG1-CB 4.38Å; V765-V779 HydrophobicContact CG1-CG1 4.27Å; V765-V779 HydrophobicContact CG2-CG1 4.29Å; P766-V779 HydrophobicContact CG-CG2 4.07Å; A775-V779 WeakPolarHBondContact O-CG2 3.24Å; A775-V779 PolarHBondContact O-N 3.32Å; A775-V779 VanDerWaalsContact O-N 3.17Å; C776-V779 PolarHBondContact O-N 3.22Å; V779-C782 PolarHBondContact O-N 2.77Å; V779-M783 WeakPolarHBondContact O-CG 3.19Å; V779-M783 PolarHBondContact O-N 3.05Å
780	S	92.4	Very high	90.6	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.3	-40.6	179.2	57.7	0	0	0	0	112.8	F104 C776 F777 C782 M783 I784	F104-S780 WeakPolarHBondContact CD2-OG 3.31Å; C776-S780 VanDerWaalsContact O-CB 3.25Å; C776-S780 WeakPolarHBondContact O-CB 3.16Å; C776-S780 PolarHBondContact O-N 3.3Å; C776-S780 PolarHBondContact O-OG 3.4Å; F777-S780 PolarHBondContact O-OG 3.03Å; F777-S780 VanDerWaalsContact O-OG 3.09Å; S780-C782 VanDerWaalsContact C-N 3.31Å; S780-C782 PolarHBondContact O-N 3.34Å; S780-M783 PolarHBondContact O-N 3.47Å; S780-I784 VanDerWaalsContact O-CG1 3.28Å; S780-I784 WeakPolarHBondContact O-CG1 3.08Å; S780-I784 PolarHBondContact O-N 3.06Å
781	I	91.4	Very high	90.9	Very high	46 Å²	46	44.5 Å²	44.5	24%	0.236	23%	0.232	C	C	.	.	H	α-helix	trans	-64	-36.8	176.5	-162.2	171.9	0	0	0	112	F104 L155 F777 V778 I784 G785	F104-I781 HydrophobicContact CD2-CB 4.46Å; F104-I781 HydrophobicContact CE2-CB 4Å; F104-I781 HydrophobicContact CE2-CD1 4.37Å; F104-I781 HydrophobicContact CE2-CG1 4.4Å; F104-I781 HydrophobicContact CZ-CD1 4.21Å; F104-I781 HydrophobicContact CZ-CG1 4.44Å; L155-I781 HydrophobicContact CD1-CG1 3.89Å; F777-I781 WeakPolarHBondContact O-CB 3.41Å; F777-I781 WeakPolarHBondContact O-CG2 3.22Å; F777-I781 PolarHBondContact O-N 2.65Å; F777-I781 VanDerWaalsContact O-N 3.07Å; V778-I781 VanDerWaalsContact O-CG2 3.25Å; V778-I781 WeakPolarHBondContact O-CG2 3.18Å; I781-I784 PolarHBondContact O-N 3.22Å; I781-G785 PolarHBondContact O-N 3.33Å
782	C	92.4	Very high	91	Very high	85 Å²	85	34.9 Å²	34.9	57%	0.574	20%	0.198	S	C	*	.	H	α-helix	trans	-63.9	-43.2	173.3	-71.9	0	0	0	0	112	V778 V779 S780 G785 L786	V778-C782 PolarHBondContact O-N 3.31Å; V778-C782 PolarHBondContact O-SG 2.95Å; V779-C782 PolarHBondContact O-N 2.77Å; S780-C782 VanDerWaalsContact C-N 3.31Å; S780-C782 PolarHBondContact O-N 3.34Å; C782-G785 PolarHBondContact O-N 3.16Å; C782-L786 PolarHBondContact O-N 3.2Å
783	M	92.7	Very high	91.3	Very high	76 Å²	76	32.2 Å²	32.2	37%	0.374	18%	0.178	S	C	.	.	H	α-helix	trans	-66.8	-40.6	177	-70.1	-63.5	175.4	0	0	112.1	I100 V779 S780 G785 L786 L787	I100-M783 HydrophobicContact CD1-CB 4.32Å; I100-M783 HydrophobicContact CG1-CB 4.04Å; V779-M783 WeakPolarHBondContact O-CG 3.19Å; V779-M783 PolarHBondContact O-N 3.05Å; S780-M783 PolarHBondContact O-N 3.47Å; M783-G785 VanDerWaalsContact C-N 3.3Å; M783-G785 PolarHBondContact O-N 2.97Å; M783-L786 PolarHBondContact O-N 3.47Å; M783-L787 VanDerWaalsContact O-CG 3.32Å; M783-L787 WeakPolarHBondContact O-CG 2.86Å; M783-L787 PolarHBondContact O-N 2.85Å
784	I	91.9	Very high	91.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.8	-46.7	172.4	-67.8	164.1	0	0	0	109.5	I100 A101 F104 P152 L155 S780 I781 L786 L787 T788	I100-I784 HydrophobicContact CB-CG1 4.41Å; I100-I784 HydrophobicContact CG1-CG1 4Å; I100-I784 HydrophobicContact CG2-CG1 3.62Å; A101-I784 HydrophobicContact CB-CD1 4.45Å; F104-I784 HydrophobicContact CB-CD1 3.76Å; F104-I784 HydrophobicContact CD1-CD1 3.9Å; F104-I784 HydrophobicContact CG-CD1 3.86Å; P152-I784 HydrophobicContact CB-CG2 4.43Å; P152-I784 HydrophobicContact CG-CG2 4.08Å; L155-I784 HydrophobicContact CD1-CB 4.09Å; L155-I784 HydrophobicContact CD1-CG2 3.69Å; S780-I784 VanDerWaalsContact O-CG1 3.28Å; S780-I784 WeakPolarHBondContact O-CG1 3.08Å; S780-I784 PolarHBondContact O-N 3.06Å; I781-I784 PolarHBondContact O-N 3.22Å; I784-L786 VanDerWaalsContact C-N 3.34Å; I784-L786 PolarHBondContact O-N 3.46Å; I784-L787 PolarHBondContact O-N 3.15Å; I784-T788 HydrophobicContact CG2-CG2 3.92Å; I784-T788 WeakPolarHBondContact O-CB 3.44Å; I784-T788 WeakPolarHBondContact O-CG2 3.36Å; I784-T788 PolarHBondContact O-N 3.47Å; I784-T788 PolarHBondContact O-OG1 2.78Å; I784-T788 VanDerWaalsContact O-OG1 3.1Å
785	G	91.3	Very high	91.6	Very high	8 Å²	8	27.3 Å²	27.3	8%	0.082	16%	0.161	C	C	.	.	H	α-helix	trans	-58.8	-42.2	178.1	0	0	0	0	0	113.3	I159 I781 C782 M783 T788 A789	I159-G785 WeakPolarHBondContact CD1-O 3.31Å; I781-G785 PolarHBondContact O-N 3.33Å; C782-G785 PolarHBondContact O-N 3.16Å; M783-G785 VanDerWaalsContact C-N 3.3Å; M783-G785 PolarHBondContact O-N 2.97Å; G785-T788 WeakPolarHBondContact CA-OG1 3.37Å; G785-T788 PolarHBondContact O-OG1 3.32Å; G785-A789 WeakPolarHBondContact O-CB 3.38Å; G785-A789 PolarHBondContact O-N 3.46Å
786	L	92	Very high	91.5	Very high	95 Å²	95	27.5 Å²	27.5	50%	0.497	16%	0.161	S	C	.	.	H	α-helix	trans	-63.7	-44.5	176.2	-178.9	64.5	0	0	0	111.9	L65 C782 M783 I784 V790	L65-L786 HydrophobicContact CD1-CD1 4.11Å; C782-L786 PolarHBondContact O-N 3.2Å; M783-L786 PolarHBondContact O-N 3.47Å; I784-L786 VanDerWaalsContact C-N 3.34Å; I784-L786 PolarHBondContact O-N 3.46Å; L786-V790 WeakPolarHBondContact O-CG2 3.28Å; L786-V790 PolarHBondContact O-N 3.25Å
787	L	92.4	Very high	91.4	Very high	14 Å²	14	27.7 Å²	27.7	7%	0.073	16%	0.162	C	C	.	.	H	α-helix	trans	-68.8	-38.4	179.6	-63.5	170.5	0	0	0	112	M93 V97 I100 W758 F762 M783 I784 A789 V790 I791	M93-L787 HydrophobicContact CE-CB 4.13Å; M93-L787 HydrophobicContact CE-CD2 3.39Å; M93-L787 HydrophobicContact CE-CG 4.35Å; V97-L787 HydrophobicContact CG2-CB 3.61Å; V97-L787 HydrophobicContact CG2-CD1 4.07Å; V97-L787 HydrophobicContact CG2-CG 4.49Å; I100-L787 HydrophobicContact CG2-CD1 3.75Å; W758-L787 HydrophobicContact CH2-CD2 3.64Å; W758-L787 HydrophobicContact CZ3-CD2 3.6Å; F762-L787 HydrophobicContact CE1-CD1 4.11Å; F762-L787 HydrophobicContact CZ-CD1 3.64Å; M783-L787 VanDerWaalsContact O-CG 3.32Å; M783-L787 WeakPolarHBondContact O-CG 2.86Å; M783-L787 PolarHBondContact O-N 2.85Å; I784-L787 PolarHBondContact O-N 3.15Å; L787-A789 VanDerWaalsContact C-N 3.34Å; L787-V790 PolarHBondContact O-N 3.49Å; L787-I791 WeakPolarHBondContact O-CG1 3.49Å; L787-I791 PolarHBondContact O-N 3.11Å
788	T	90.3	Very high	91.3	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.018	16%	0.159	C	C	.	.	H	α-helix	trans	-69	-34.7	179.1	57	0	0	0	0	111.8	P152 L156 I784 G785 V790 I791 G792	P152-T788 HydrophobicContact CB-CG2 3.78Å; L156-T788 WeakPolarHBondContact CD1-O 3.27Å; I784-T788 HydrophobicContact CG2-CG2 3.92Å; I784-T788 WeakPolarHBondContact O-CB 3.44Å; I784-T788 WeakPolarHBondContact O-CG2 3.36Å; I784-T788 PolarHBondContact O-N 3.47Å; I784-T788 PolarHBondContact O-OG1 2.78Å; I784-T788 VanDerWaalsContact O-OG1 3.1Å; G785-T788 WeakPolarHBondContact CA-OG1 3.37Å; G785-T788 PolarHBondContact O-OG1 3.32Å; T788-V790 VanDerWaalsContact C-N 3.34Å; T788-I791 PolarHBondContact O-N 3.45Å; T788-G792 PolarHBondContact O-N 2.98Å
789	A	90.8	Very high	91.1	Very high	8 Å²	8	23.2 Å²	23.2	7%	0.066	14%	0.136	C	C	.	.	H	α-helix	trans	-58.6	-46.6	170.3	0	0	0	0	0	111.3	L65 I159 G785 L787 I791 G792 D793	L65-A789 HydrophobicContact CD1-CB 3.38Å; L65-A789 HydrophobicContact CG-CB 4.39Å; I159-A789 HydrophobicContact CD1-CB 4.28Å; I159-A789 HydrophobicContact CG2-CB 3.86Å; G785-A789 WeakPolarHBondContact O-CB 3.38Å; G785-A789 PolarHBondContact O-N 3.46Å; L787-A789 VanDerWaalsContact C-N 3.34Å; A789-I791 PolarHBondContact O-N 3.12Å; A789-G792 PolarHBondContact O-N 2.68Å; A789-D793 PolarHBondContact O-N 3.01Å; A789-D793 VanDerWaalsContact O-N 3.15Å
790	V	92.6	Very high	90.8	Very high	30 Å²	30	21.8 Å²	21.8	18%	0.182	13%	0.128	C	C	.	.	H	α-helix	trans	-64.1	-39.5	175.8	175.2	0	0	0	0	111.6	L65 L66 M93 L786 L787 T788 D793 L794	L65-V790 HydrophobicContact CD1-CG2 3.83Å; L66-V790 HydrophobicContact CD1-CG1 4.07Å; M93-V790 HydrophobicContact CE-CB 3.82Å; M93-V790 HydrophobicContact CE-CG1 3.63Å; M93-V790 HydrophobicContact CG-CG1 4.42Å; M93-V790 HydrophobicContact SD-CG1 4.3Å; L786-V790 WeakPolarHBondContact O-CG2 3.28Å; L786-V790 PolarHBondContact O-N 3.25Å; L787-V790 PolarHBondContact O-N 3.49Å; T788-V790 VanDerWaalsContact C-N 3.34Å; V790-D793 PolarHBondContact O-N 3.31Å; V790-L794 HydrophobicContact CG1-CD1 3.91Å; V790-L794 HydrophobicContact CG1-CG 4.23Å; V790-L794 WeakPolarHBondContact O-CB 3.35Å; V790-L794 VanDerWaalsContact O-CG 3.25Å; V790-L794 WeakPolarHBondContact O-CG 3.43Å; V790-L794 PolarHBondContact O-N 3.16Å
791	I	91.8	Very high	90.5	Very high	4 Å²	4	23.2 Å²	23.2	2%	0.021	14%	0.136	C	C	.	.	H	α-helix	trans	-63.5	-42	176	-72.5	165.8	0	0	0	111.3	M93 F94 V97 L787 T788 A789 D793 L794 A795 V814	M93-I791 HydrophobicContact CB-CD1 4.1Å; M93-I791 HydrophobicContact CB-CG1 3.64Å; F94-I791 HydrophobicContact CD1-CD1 3.88Å; F94-I791 HydrophobicContact CE1-CD1 3.88Å; F94-I791 HydrophobicContact CE1-CG2 3.71Å; F94-I791 HydrophobicContact CE2-CG2 4.43Å; F94-I791 HydrophobicContact CZ-CG2 3.56Å; V97-I791 HydrophobicContact CB-CD1 4.32Å; V97-I791 HydrophobicContact CG2-CD1 3.4Å; V97-I791 VanDerWaalsContact CG2-CD1 3.4Å; L787-I791 WeakPolarHBondContact O-CG1 3.49Å; L787-I791 PolarHBondContact O-N 3.11Å; T788-I791 PolarHBondContact O-N 3.45Å; A789-I791 PolarHBondContact O-N 3.12Å; I791-D793 VanDerWaalsContact C-N 3.34Å; I791-D793 PolarHBondContact O-N 3.17Å; I791-L794 PolarHBondContact O-N 2.84Å; I791-A795 VanDerWaalsContact O-CB 3.22Å; I791-A795 WeakPolarHBondContact O-CB 3.09Å; I791-A795 PolarHBondContact O-N 3.36Å; I791-V814 HydrophobicContact CG2-CG1 4.33Å
792	G	89.3	Confident	90.2	Very high	7 Å²	7	24.6 Å²	24.6	7%	0.072	15%	0.147	C	C	.	.	H	α-helix	trans	-57.1	-48	176	0	0	0	0	0	111.7	T788 A789 A795 S796	T788-G792 PolarHBondContact O-N 2.98Å; A789-G792 PolarHBondContact O-N 2.68Å; G792-A795 PolarHBondContact O-N 3.1Å; G792-S796 PolarHBondContact O-N 2.61Å
793	D	90.5	Very high	89.8	Confident	8 Å²	8	23 Å²	23	4%	0.043	14%	0.144	C	C	.	.	H	α-helix	trans	-64.9	-45	177.6	-68.2	-10.4	0	0	0	112.6	G63 V64 L65 L66 A789 V790 I791 A795 S796 H797	G63-D793 VanDerWaalsContact CA-OD1 3.24Å; G63-D793 WeakPolarHBondContact CA-OD1 3.44Å; V64-D793 PolarHBondContact N-OD1 3.46Å; V64-D793 PolarHBondContact N-OD2 3.4Å; L65-D793 WeakPolarHBondContact CA-OD2 3.32Å; L65-D793 WeakPolarHBondContact CB-OD2 3.4Å; L65-D793 PolarHBondContact N-OD2 3.37Å; L66-D793 HydrophobicContact CB-CB 4.06Å; L66-D793 HydrophobicContact CD1-CB 4.25Å; L66-D793 HydrophobicContact CG-CB 4.34Å; L66-D793 PolarHBondContact N-OD2 2.85Å; A789-D793 PolarHBondContact O-N 3.01Å; A789-D793 VanDerWaalsContact O-N 3.15Å; V790-D793 PolarHBondContact O-N 3.31Å; I791-D793 VanDerWaalsContact C-N 3.34Å; I791-D793 PolarHBondContact O-N 3.17Å; D793-A795 VanDerWaalsContact C-N 3.28Å; D793-A795 PolarHBondContact O-N 2.91Å; D793-S796 PolarHBondContact O-N 2.98Å; D793-H797 VanDerWaalsContact O-CB 3.3Å; D793-H797 WeakPolarHBondContact O-CB 3.39Å; D793-H797 PolarHBondContact O-N 3.15Å; D793-H797 PolarHBondContact O-ND1 3.14Å
794	L	91.7	Very high	89.4	Confident	12 Å²	12	21.2 Å²	21.2	6%	0.063	14%	0.136	C	C	.	.	H	α-helix	trans	-62.2	-37.7	177.1	-71.9	174.2	0	0	0	111.6	L66 Y86 A89 M93 V790 I791 F798	L66-L794 HydrophobicContact CD1-CD2 3.8Å; L66-L794 HydrophobicContact CD1-CG 3.98Å; Y86-L794 HydrophobicContact CD1-CD2 3.74Å; Y86-L794 HydrophobicContact CE1-CD2 4.19Å; A89-L794 HydrophobicContact CB-CD1 4.09Å; A89-L794 HydrophobicContact CB-CD2 4.21Å; M93-L794 HydrophobicContact CB-CD1 4.48Å; M93-L794 HydrophobicContact CG-CD1 3.69Å; V790-L794 HydrophobicContact CG1-CD1 3.91Å; V790-L794 HydrophobicContact CG1-CG 4.23Å; V790-L794 WeakPolarHBondContact O-CB 3.35Å; V790-L794 VanDerWaalsContact O-CG 3.25Å; V790-L794 WeakPolarHBondContact O-CG 3.43Å; V790-L794 PolarHBondContact O-N 3.16Å; I791-L794 PolarHBondContact O-N 2.84Å; L794-F798 WeakPolarHBondContact O-CB 3.31Å; L794-F798 PolarHBondContact O-N 2.92Å
795	A	90.7	Very high	89.1	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-67.8	-48.9	178	0	0	0	0	0	111.6	L90 L171 I791 G792 D793 H797 F798 G799 T809 V814	L90-A795 HydrophobicContact CD1-CB 3.88Å; L171-A795 HydrophobicContact CD1-CB 4.48Å; L171-A795 HydrophobicContact CD2-CB 4.46Å; I791-A795 VanDerWaalsContact O-CB 3.22Å; I791-A795 WeakPolarHBondContact O-CB 3.09Å; I791-A795 PolarHBondContact O-N 3.36Å; G792-A795 PolarHBondContact O-N 3.1Å; D793-A795 VanDerWaalsContact C-N 3.28Å; D793-A795 PolarHBondContact O-N 2.91Å; A795-H797 PolarHBondContact O-N 2.96Å; A795-F798 PolarHBondContact O-N 2.88Å; A795-G799 PolarHBondContact O-N 3.17Å; A795-T809 HydrophobicContact CB-CG2 4.38Å; A795-T809 WeakPolarHBondContact O-CG2 3.33Å; A795-V814 HydrophobicContact CB-CG2 3.4Å; A795-V814 VanDerWaalsContact CB-CG2 3.4Å
796	S	88.1	Confident	88.8	Confident	22 Å²	22	24.5 Å²	24.5	15%	0.154	15%	0.149	C	C	.	.	H	α-helix	trans	-63.3	-42.3	177.3	-178.4	0	0	0	0	111.4	G792 D793 F798 G799 C800 D806	G792-S796 PolarHBondContact O-N 2.61Å; D793-S796 PolarHBondContact O-N 2.98Å; S796-F798 PolarHBondContact O-N 3.39Å; S796-G799 PolarHBondContact O-N 3.09Å; S796-C800 WeakPolarHBondContact O-CB 3.44Å; S796-C800 PolarHBondContact O-N 3.41Å; S796-D806 PolarHBondContact OG-OD1 2.74Å; S796-D806 PolarHBondContact OG-OD2 3.35Å
797	H	89.3	Confident	88.5	Confident	5 Å²	5	20.5 Å²	20.5	2%	0.023	13%	0.13	C	C	.	.	H	α-helix	trans	-63.9	-42.2	174.8	-68.4	168.8	0	0	0	112.7	T61 L66 P67 Y86 D793 A795 T801	T61-H797 PolarHBondContact O-NE2 3.46Å; L66-H797 PolarHBondContact O-CE1 3.31Å; L66-H797 VanDerWaalsContact O-CE1 3.29Å; P67-H797 PolarHBondContact O-CE1 3.14Å; Y86-H797 HydrophobicContact CD1-CB 4.26Å; Y86-H797 HydrophobicContact CD2-CB 4.46Å; Y86-H797 HydrophobicContact CE1-CB 3.88Å; Y86-H797 HydrophobicContact CE2-CB 4.09Å; D793-H797 VanDerWaalsContact O-CB 3.3Å; D793-H797 WeakPolarHBondContact O-CB 3.39Å; D793-H797 PolarHBondContact O-N 3.15Å; D793-H797 PolarHBondContact O-ND1 3.14Å; A795-H797 PolarHBondContact O-N 2.96Å; H797-T801 WeakPolarHBondContact O-CB 3.49Å; H797-T801 WeakPolarHBondContact O-CG2 3.16Å; H797-T801 PolarHBondContact O-N 3.39Å; H797-T801 PolarHBondContact O-OG1 3.38Å
798	F	90.4	Very high	88.3	Confident	15 Å²	15	20.5 Å²	20.5	7%	0.066	13%	0.13	C	C	.	.	H	α-helix	trans	-59.8	-51.2	173.8	173.7	-104.1	0	0	0	110.8	A83 F87 L794 A795 S796 C800 T801 V802 L804 T809 F813	A83-F798 HydrophobicContact CB-CD2 4.49Å; A83-F798 HydrophobicContact CB-CE2 4.29Å; A83-F798 WeakPolarHBondContact O-CD2 3.39Å; F87-F798 HydrophobicContact CB-CD2 4.12Å; F87-F798 HydrophobicContact CB-CE2 3.78Å; F87-F798 HydrophobicContact CD2-CE2 4.12Å; F87-F798 HydrophobicContact CD2-CZ 4.01Å; F87-F798 HydrophobicContact CG-CE2 4.36Å; L794-F798 WeakPolarHBondContact O-CB 3.31Å; L794-F798 PolarHBondContact O-N 2.92Å; A795-F798 PolarHBondContact O-N 2.88Å; S796-F798 PolarHBondContact O-N 3.39Å; F798-C800 PolarHBondContact O-N 3.14Å; F798-T801 PolarHBondContact O-N 3.05Å; F798-T801 PolarHBondContact O-OG1 2.91Å; F798-V802 HydrophobicContact CD2-CG2 4.11Å; F798-V802 HydrophobicContact CE1-CG2 4.37Å; F798-V802 HydrophobicContact CE2-CG2 3.7Å; F798-V802 HydrophobicContact CZ-CG2 3.86Å; F798-V802 WeakPolarHBondContact O-CG2 3.32Å; F798-V802 PolarHBondContact O-N 2.82Å; F798-V802 VanDerWaalsContact O-N 3.07Å; F798-L804 HydrophobicContact CE1-CD1 4.44Å; F798-T809 HydrophobicContact CD1-CG2 4.06Å; F798-F813 AromaticContact CE1-CD2 3.88Å; F798-F813 HydrophobicContact CE1-CD2 3.88Å; F798-F813 AromaticContact CE1-CE2 3.74Å; F798-F813 HydrophobicContact CE1-CE2 3.74Å; F798-F813 HydrophobicContact CE1-CG 4.43Å; F798-F813 HydrophobicContact CE1-CZ 4.18Å; F798-F813 HydrophobicContact CZ-CE2 4.45Å; F798-F813 HydrophobicContact CZ-CZ 4.48Å
799	G	87.8	Confident	88.3	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-53.3	-53.9	177.9	0	0	0	0	0	111.3	A795 S796 T801 V802 G803 L804 T809	A795-G799 PolarHBondContact O-N 3.17Å; S796-G799 PolarHBondContact O-N 3.09Å; G799-T801 PolarHBondContact O-N 3.26Å; G799-V802 PolarHBondContact O-N 3.17Å; G799-G803 PolarHBondContact O-N 3.41Å; G799-L804 CarbonylContact C-O 3.09Å; G799-L804 VanDerWaalsContact C-O 3.29Å; G799-L804 PolarHBondContact O-N 2.9Å; G799-T809 WeakPolarHBondContact CA-OG1 3.02Å
800	C	86.1	Confident	88.2	Confident	20 Å²	20	20 Å²	20	14%	0.135	13%	0.126	C	C	.	.	H	α-helix	trans	-60.4	-39.9	178.6	-174.5	0	0	0	0	113.6	E58 C60 S796 F798 V802 G803	E58-C800 PolarHBondContact O-SG 3.36Å; E58-C800 VanDerWaalsContact O-SG 3.42Å; C60-C800 WeakPolarHBondContact CA-SG 3.28Å; C60-C800 HydrophobicContact CB-CB 3.95Å; C60-C800 WeakPolarHBondContact CB-SG 3.49Å; C60-C800 PolarHBondContact N-SG 3.37Å; C60-C800 WeakPolarHBondContact SG-CB 3.35Å; C60-C800 CovalentContact SG-SG 2.03Å; C60-C800 PolarHBondContact SG-SG 3.31Å; S796-C800 WeakPolarHBondContact O-CB 3.44Å; S796-C800 PolarHBondContact O-N 3.41Å; F798-C800 PolarHBondContact O-N 3.14Å; C800-V802 PolarHBondContact O-N 3.05Å; C800-G803 PolarHBondContact O-N 3.19Å
801	T	86.4	Confident	88	Confident	30 Å²	30	19 Å²	19	18%	0.184	12%	0.12	C	C	.	.	H	α-helix	trans	-68	-34.9	-179.8	61.4	0	0	0	0	113.4	Y86 H797 F798 G799	Y86-T801 HydrophobicContact CD2-CG2 3.98Å; Y86-T801 HydrophobicContact CE2-CG2 3.74Å; H797-T801 WeakPolarHBondContact O-CB 3.49Å; H797-T801 WeakPolarHBondContact O-CG2 3.16Å; H797-T801 PolarHBondContact O-N 3.39Å; H797-T801 PolarHBondContact O-OG1 3.38Å; F798-T801 PolarHBondContact O-N 3.05Å; F798-T801 PolarHBondContact O-OG1 2.91Å; G799-T801 PolarHBondContact O-N 3.26Å
802	V	86.8	Confident	87.9	Confident	75 Å²	75	20.6 Å²	20.6	46%	0.455	13%	0.13	S	C	.	.	H	α-helix	trans	-81	-23.5	176.2	-179.2	0	0	0	0	111.1	A83 F798 G799 C800 L804	A83-V802 HydrophobicContact CB-CG2 3.8Å; F798-V802 HydrophobicContact CD2-CG2 4.11Å; F798-V802 HydrophobicContact CE1-CG2 4.37Å; F798-V802 HydrophobicContact CE2-CG2 3.7Å; F798-V802 HydrophobicContact CZ-CG2 3.86Å; F798-V802 WeakPolarHBondContact O-CG2 3.32Å; F798-V802 PolarHBondContact O-N 2.82Å; F798-V802 VanDerWaalsContact O-N 3.07Å; G799-V802 PolarHBondContact O-N 3.17Å; C800-V802 PolarHBondContact O-N 3.05Å; V802-L804 HydrophobicContact CB-CD1 4.4Å; V802-L804 HydrophobicContact CB-CG 4.2Å; V802-L804 HydrophobicContact CG1-CD1 4.06Å; V802-L804 HydrophobicContact CG1-CG 3.86Å
803	G	82.3	Confident	87.9	Confident	50 Å²	50	23.1 Å²	23.1	52%	0.515	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	86	26.4	-173.2	0	0	0	0	0	112.9	G799 C800	G799-G803 PolarHBondContact O-N 3.41Å; C800-G803 PolarHBondContact O-N 3.19Å
804	L	85.5	Confident	87.9	Confident	40 Å²	40	22.7 Å²	22.7	21%	0.209	14%	0.137	C	C	.	.			trans	-89.5	141.2	171.7	-61.5	174.7	0	0	0	110.2	F798 G799 V802 T809 F813 Y940	F798-L804 HydrophobicContact CE1-CD1 4.44Å; G799-L804 CarbonylContact C-O 3.09Å; G799-L804 VanDerWaalsContact C-O 3.29Å; G799-L804 PolarHBondContact O-N 2.9Å; V802-L804 HydrophobicContact CB-CD1 4.4Å; V802-L804 HydrophobicContact CB-CG 4.2Å; V802-L804 HydrophobicContact CG1-CD1 4.06Å; V802-L804 HydrophobicContact CG1-CG 3.86Å; L804-T809 WeakPolarHBondContact CB-OG1 3.49Å; L804-F813 HydrophobicContact CD1-CE2 3.97Å; L804-Y940 WeakPolarHBondContact CA-OH 3.31Å; L804-Y940 WeakPolarHBondContact CD2-OH 2.97Å
805	K	84.8	Confident	87.8	Confident	50 Å²	50	22.2 Å²	22.2	22%	0.217	13%	0.134	C	C	.	.			trans	-64.3	146.7	170.1	-70.4	-170.8	172.4	-169.1	0	111.4	E58 S807 V808 T809 A939 Y940	E58-K805 VanDerWaalsContact OE2-CA 3.27Å; E58-K805 WeakPolarHBondContact OE2-CA 3.24Å; K805-S807 VanDerWaalsContact C-N 3.26Å; K805-S807 PolarHBondContact O-N 3.15Å; K805-V808 HydrophobicContact CB-CG2 4.29Å; K805-V808 PolarHBondContact O-N 3.3Å; K805-T809 PolarHBondContact O-N 3.18Å; K805-T809 PolarHBondContact O-OG1 2.94Å; K805-T809 VanDerWaalsContact O-OG1 3.06Å; K805-A939 HydrophobicContact CD-CB 4.38Å; K805-A939 WeakPolarHBondContact CD-O 3.24Å; K805-A939 VanDerWaalsContact CE-O 3.24Å; K805-A939 WeakPolarHBondContact CE-O 3.43Å; K805-A939 PolarHBondContact NZ-O 3.15Å; K805-Y940 HydrophobicContact CG-CE1 4.21Å; K805-Y940 PolarHBondContact N-OH 3.2Å
806	D	85.6	Confident	87.7	Confident	26 Å²	26	25.3 Å²	25.3	14%	0.139	15%	0.151	C	C	.	.	H	α-helix	trans	-56.6	-38.7	177.9	-80.1	-7.5	0	0	0	112.5	E58 L171 S796 V808 T809 A810	E58-D806 PolarHBondContact OE2-N 2.77Å; E58-D806 VanDerWaalsContact OE2-N 3.16Å; L171-D806 HydrophobicContact CD1-CB 4.22Å; S796-D806 PolarHBondContact OG-OD1 2.74Å; S796-D806 PolarHBondContact OG-OD2 3.35Å; D806-V808 PolarHBondContact O-N 3.44Å; D806-T809 PolarHBondContact O-N 3.32Å; D806-A810 VanDerWaalsContact O-CB 3.31Å; D806-A810 WeakPolarHBondContact O-CB 3.47Å; D806-A810 PolarHBondContact O-N 3.5Å
807	S	85.1	Confident	87.7	Confident	12 Å²	12	24.5 Å²	24.5	8%	0.084	15%	0.146	C	C	.	.	H	α-helix	trans	-62.1	-38.1	175.8	60.2	0	0	0	0	113.6	K805 V811	K805-S807 VanDerWaalsContact C-N 3.26Å; K805-S807 PolarHBondContact O-N 3.15Å; S807-V811 VanDerWaalsContact O-CG2 3.32Å; S807-V811 WeakPolarHBondContact O-CG2 3.33Å; S807-V811 PolarHBondContact O-N 3.44Å; S807-V811 VanDerWaalsContact O-N 3.16Å
808	V	88.3	Confident	87.5	Confident	13 Å²	13	24.7 Å²	24.7	8%	0.079	15%	0.147	C	C	.	.	H	α-helix	trans	-73.7	-40.6	177.4	179.7	0	0	0	0	110.5	K805 D806 A810 V811 V812 A939 Y940	K805-V808 HydrophobicContact CB-CG2 4.29Å; K805-V808 PolarHBondContact O-N 3.3Å; D806-V808 PolarHBondContact O-N 3.44Å; V808-A810 VanDerWaalsContact C-N 3.33Å; V808-A810 PolarHBondContact O-N 3.06Å; V808-V811 PolarHBondContact O-N 3.32Å; V808-V812 HydrophobicContact CG1-CG2 4.28Å; V808-V812 WeakPolarHBondContact O-CB 3.32Å; V808-V812 WeakPolarHBondContact O-CG2 3.44Å; V808-V812 PolarHBondContact O-N 3.1Å; V808-A939 HydrophobicContact CG2-CB 3.64Å; V808-Y940 HydrophobicContact CG2-CE2 4.09Å
809	T	90.1	Very high	87.4	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.2	-41.5	177.5	-53.2	0	0	0	0	111.2	A795 F798 G799 L804 K805 D806 F813 V814	A795-T809 HydrophobicContact CB-CG2 4.38Å; A795-T809 WeakPolarHBondContact O-CG2 3.33Å; F798-T809 HydrophobicContact CD1-CG2 4.06Å; G799-T809 WeakPolarHBondContact CA-OG1 3.02Å; L804-T809 WeakPolarHBondContact CB-OG1 3.49Å; K805-T809 PolarHBondContact O-N 3.18Å; K805-T809 PolarHBondContact O-OG1 2.94Å; K805-T809 VanDerWaalsContact O-OG1 3.06Å; D806-T809 PolarHBondContact O-N 3.32Å; T809-F813 HydrophobicContact CG2-CD2 4.27Å; T809-F813 PolarHBondContact O-N 3.39Å; T809-V814 PolarHBondContact O-N 3.07Å
810	A	89	Confident	87.1	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.157	C	C	.	.	I	π-helix	trans	-58.8	-53.3	173.4	0	0	0	0	0	112.4	L171 T175 D806 V808 V812 V814 A815	L171-A810 HydrophobicContact CD1-CB 3.88Å; L171-A810 HydrophobicContact CG-CB 4.24Å; L171-A810 WeakPolarHBondContact O-CB 3.33Å; T175-A810 WeakPolarHBondContact OG1-CB 3.33Å; D806-A810 VanDerWaalsContact O-CB 3.31Å; D806-A810 WeakPolarHBondContact O-CB 3.47Å; D806-A810 PolarHBondContact O-N 3.5Å; V808-A810 VanDerWaalsContact C-N 3.33Å; V808-A810 PolarHBondContact O-N 3.06Å; A810-V812 PolarHBondContact O-N 2.99Å; A810-V814 PolarHBondContact O-N 2.81Å; A810-A815 VanDerWaalsContact O-CB 3.3Å; A810-A815 WeakPolarHBondContact O-CB 3.35Å; A810-A815 PolarHBondContact O-N 3.07Å
811	V	88.7	Confident	86.7	Confident	11 Å²	11	25.4 Å²	25.4	7%	0.067	15%	0.152	C	C	.	.	I	π-helix	trans	-66.6	-34.9	-175.5	170.1	0	0	0	0	112.9	S807 V808 Y931 I932	S807-V811 VanDerWaalsContact O-CG2 3.32Å; S807-V811 WeakPolarHBondContact O-CG2 3.33Å; S807-V811 PolarHBondContact O-N 3.44Å; S807-V811 VanDerWaalsContact O-N 3.16Å; V808-V811 PolarHBondContact O-N 3.32Å; V811-Y931 HydrophobicContact CG1-CD1 4.43Å; V811-Y931 HydrophobicContact CG1-CE1 3.65Å; V811-I932 HydrophobicContact CG1-CG1 4.31Å
812	V	88.5	Confident	86.5	Confident	36 Å²	36	24 Å²	24	22%	0.218	14%	0.144	C	C	.	.	I	π-helix	trans	-91.2	-46.4	-173.5	177.3	0	0	0	0	112.7	V808 A810 L816 I932	V808-V812 HydrophobicContact CG1-CG2 4.28Å; V808-V812 WeakPolarHBondContact O-CB 3.32Å; V808-V812 WeakPolarHBondContact O-CG2 3.44Å; V808-V812 PolarHBondContact O-N 3.1Å; A810-V812 PolarHBondContact O-N 2.99Å; V812-L816 VanDerWaalsContact O-CB 3.31Å; V812-L816 WeakPolarHBondContact O-CB 3.43Å; V812-I932 HydrophobicContact CG2-CD1 4.48Å; V812-I932 HydrophobicContact CG2-CG2 3.75Å
813	F	89.8	Confident	86.4	Confident	60 Å²	60	21.2 Å²	21.2	26%	0.263	13%	0.127	S	C	.	.	I	π-helix	trans	-104.8	-47.1	-169.7	-63.6	-71.9	0	0	0	112.5	F87 F798 L804 T809 G817	F87-F813 HydrophobicContact CE2-CD1 4.04Å; F87-F813 HydrophobicContact CE2-CE1 4Å; F798-F813 AromaticContact CE1-CD2 3.88Å; F798-F813 HydrophobicContact CE1-CD2 3.88Å; F798-F813 AromaticContact CE1-CE2 3.74Å; F798-F813 HydrophobicContact CE1-CE2 3.74Å; F798-F813 HydrophobicContact CE1-CG 4.43Å; F798-F813 HydrophobicContact CE1-CZ 4.18Å; F798-F813 HydrophobicContact CZ-CE2 4.45Å; F798-F813 HydrophobicContact CZ-CZ 4.48Å; L804-F813 HydrophobicContact CD1-CE2 3.97Å; T809-F813 HydrophobicContact CG2-CD2 4.27Å; T809-F813 PolarHBondContact O-N 3.39Å; F813-G817 PolarHBondContact O-N 3.06Å
814	V	90.6	Very high	86.4	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.117	C	C	.	.	I	π-helix	trans	-71.1	-50.7	-175.6	-173.2	0	0	0	0	110.9	F94 L156 T175 I791 A795 T809 A810 L816 G817 T818	F94-V814 HydrophobicContact CZ-CB 4.48Å; F94-V814 HydrophobicContact CZ-CG1 4.18Å; L156-V814 HydrophobicContact CD2-CG1 3.92Å; T175-V814 HydrophobicContact CG2-CB 4.24Å; T175-V814 HydrophobicContact CG2-CG1 3.69Å; I791-V814 HydrophobicContact CG2-CG1 4.33Å; A795-V814 HydrophobicContact CB-CG2 3.4Å; A795-V814 VanDerWaalsContact CB-CG2 3.4Å; T809-V814 PolarHBondContact O-N 3.07Å; A810-V814 PolarHBondContact O-N 2.81Å; V814-L816 VanDerWaalsContact C-N 3.3Å; V814-L816 PolarHBondContact O-N 3.23Å; V814-G817 PolarHBondContact O-N 3.29Å; V814-G817 VanDerWaalsContact O-N 3.11Å; V814-T818 HydrophobicContact CG1-CG2 4.46Å; V814-T818 PolarHBondContact O-N 3.37Å
815	A	89.9	Confident	86	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.008	11%	0.108	C	C	.	.	H	α-helix	trans	-57.4	-41.2	176.9	0	0	0	0	0	112.7	G178 S179 A810 T818 S819	G178-A815 VanDerWaalsContact C-CB 3.5Å; S179-A815 VanDerWaalsContact N-CB 3.35Å; A810-A815 VanDerWaalsContact O-CB 3.3Å; A810-A815 WeakPolarHBondContact O-CB 3.35Å; A810-A815 PolarHBondContact O-N 3.07Å; A815-T818 PolarHBondContact O-OG1 3.04Å; A815-S819 WeakPolarHBondContact O-CB 3.22Å; A815-S819 PolarHBondContact O-N 3.35Å; A815-S819 PolarHBondContact O-OG 3Å
816	L	88.6	Confident	86	Confident	66 Å²	66	18.3 Å²	18.3	35%	0.346	10%	0.099	S	C	.	.	H	α-helix	trans	-64.8	-45.2	175.9	-176.6	150.4	0	0	0	110.8	F182 V812 V814 S819 V820 W928	F182-L816 HydrophobicContact CD2-CG 4.49Å; F182-L816 HydrophobicContact CE2-CD1 4Å; F182-L816 HydrophobicContact CE2-CG 3.95Å; F182-L816 HydrophobicContact CZ-CG 4.32Å; V812-L816 VanDerWaalsContact O-CB 3.31Å; V812-L816 WeakPolarHBondContact O-CB 3.43Å; V814-L816 VanDerWaalsContact C-N 3.3Å; V814-L816 PolarHBondContact O-N 3.23Å; L816-S819 PolarHBondContact O-N 3.44Å; L816-V820 HydrophobicContact CD2-CG2 4.23Å; L816-V820 WeakPolarHBondContact O-CG2 3.45Å; L816-V820 PolarHBondContact O-N 2.91Å; L816-W928 HydrophobicContact CD1-CH2 4.28Å; L816-W928 HydrophobicContact CD1-CZ2 4.27Å
817	G	87.4	Confident	86	Confident	5 Å²	5	20.5 Å²	20.5	5%	0.052	11%	0.107	C	C	.	.	H	α-helix	trans	-62.1	-44.4	-178.4	0	0	0	0	0	113.8	F813 V814 S819 V820	F813-G817 PolarHBondContact O-N 3.06Å; V814-G817 PolarHBondContact O-N 3.29Å; V814-G817 VanDerWaalsContact O-N 3.11Å; G817-S819 VanDerWaalsContact C-N 3.34Å; G817-V820 PolarHBondContact O-N 2.71Å
818	T	86.3	Confident	85.7	Confident	8 Å²	8	20.9 Å²	20.9	5%	0.049	11%	0.109	C	C	.	.	H	α-helix	trans	-71.2	-29.2	178.9	63.8	0	0	0	0	112.7	F94 P152 E153 V814 A815 P821	F94-T818 HydrophobicContact CD1-CG2 4.49Å; F94-T818 HydrophobicContact CE1-CG2 3.75Å; P152-T818 HydrophobicContact CB-CG2 4.12Å; E153-T818 WeakPolarHBondContact OE1-CB 3.24Å; E153-T818 PolarHBondContact OE1-OG1 2.83Å; V814-T818 HydrophobicContact CG1-CG2 4.46Å; V814-T818 PolarHBondContact O-N 3.37Å; A815-T818 PolarHBondContact O-OG1 3.04Å; T818-P821 WeakPolarHBondContact O-CD 3.49Å
819	S	87.6	Confident	85.4	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-83.2	-7.2	178.2	-70.1	0	0	0	0	115.3	N183 A815 L816 G817 D822 T823	N183-S819 VanDerWaalsContact OD1-CB 3.22Å; N183-S819 WeakPolarHBondContact OD1-CB 3.34Å; N183-S819 PolarHBondContact OD1-OG 3.43Å; A815-S819 WeakPolarHBondContact O-CB 3.22Å; A815-S819 PolarHBondContact O-N 3.35Å; A815-S819 PolarHBondContact O-OG 3Å; L816-S819 PolarHBondContact O-N 3.44Å; G817-S819 VanDerWaalsContact C-N 3.34Å; S819-D822 PolarHBondContact O-N 2.9Å; S819-T823 PolarHBondContact O-N 3.4Å; S819-T823 PolarHBondContact O-OG1 2.91Å
820	V	82.5	Confident	85.1	Confident	46 Å²	46	20.5 Å²	20.5	28%	0.279	11%	0.107	S	C	.	.	H	α-helix	trans	-57.6	-49.2	-179.8	176.6	0	0	0	0	112.3	L816 G817 D822 T823 F824	L816-V820 HydrophobicContact CD2-CG2 4.23Å; L816-V820 WeakPolarHBondContact O-CG2 3.45Å; L816-V820 PolarHBondContact O-N 2.91Å; G817-V820 PolarHBondContact O-N 2.71Å; V820-D822 VanDerWaalsContact C-N 3.29Å; V820-D822 PolarHBondContact O-N 3.26Å; V820-T823 VanDerWaalsContact O-CB 3.24Å; V820-T823 WeakPolarHBondContact O-CB 3.32Å; V820-T823 PolarHBondContact O-N 2.95Å; V820-T823 VanDerWaalsContact O-N 3.08Å; V820-F824 HydrophobicContact CG1-CD2 3.83Å; V820-F824 HydrophobicContact CG1-CE2 3.52Å; V820-F824 VanDerWaalsContact O-CD2 3.31Å; V820-F824 WeakPolarHBondContact O-CD2 3.39Å; V820-F824 PolarHBondContact O-N 3.37Å
821	P	76.3	Confident	84.8	Confident	4 Å²	4	23.7 Å²	23.7	3%	0.026	12%	0.124	C	C	.	.	H	α-helix	trans	-62.2	-36.1	-179.9	-26.3	39	0	0	0	113.2	S98 R371 T818 T823 F824 A825	S98-P821 VanDerWaalsContact OG-CG 3.29Å; S98-P821 WeakPolarHBondContact OG-CG 3.16Å; R371-P821 VanDerWaalsContact NH2-CB 3.26Å; T818-P821 WeakPolarHBondContact O-CD 3.49Å; P821-T823 VanDerWaalsContact C-N 3.3Å; P821-T823 PolarHBondContact O-N 3.38Å; P821-F824 PolarHBondContact O-N 2.93Å; P821-A825 WeakPolarHBondContact O-CB 3.48Å; P821-A825 PolarHBondContact O-N 3.24Å
822	D	82.4	Confident	84.3	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.011	14%	0.137	C	C	.	.	H	α-helix	trans	-66.9	-33.9	175.6	-79.2	-14.8	0	0	0	112.2	S149 I187 R367 R371 S819 V820 F824 A825 S826	S149-D822 WeakPolarHBondContact CB-OD1 3.19Å; S149-D822 WeakPolarHBondContact CB-OD2 3.1Å; I187-D822 HydrophobicContact CD1-CB 3.94Å; R367-D822 IonicContact NH2-OD1 3.97Å; R367-D822 PolarHBondContact NH2-OD1 3.29Å; R367-D822 IonicContact NH2-OD2 3.78Å; R371-D822 IonicContact NH1-OD1 2.72Å; R371-D822 PolarHBondContact NH1-OD1 2.86Å; S819-D822 PolarHBondContact O-N 2.9Å; V820-D822 VanDerWaalsContact C-N 3.29Å; V820-D822 PolarHBondContact O-N 3.26Å; D822-F824 VanDerWaalsContact C-N 3.35Å; D822-F824 PolarHBondContact O-N 2.87Å; D822-A825 PolarHBondContact O-N 2.88Å; D822-S826 WeakPolarHBondContact O-CB 3.46Å; D822-S826 PolarHBondContact O-N 3.5Å; D822-S826 PolarHBondContact O-OG 3.46Å
823	T	86	Confident	83.8	Confident	16 Å²	16	26.4 Å²	26.4	10%	0.098	13%	0.134	C	C	.	.	H	α-helix	trans	-60.2	-47.6	176	-54.2	0	0	0	0	111	F182 I187 L190 S819 V820 P821 K827	F182-T823 WeakPolarHBondContact CE1-OG1 3.45Å; I187-T823 HydrophobicContact CG1-CG2 4.33Å; L190-T823 HydrophobicContact CD2-CG2 3.43Å; L190-T823 VanDerWaalsContact CD2-CG2 3.43Å; S819-T823 PolarHBondContact O-N 3.4Å; S819-T823 PolarHBondContact O-OG1 2.91Å; V820-T823 VanDerWaalsContact O-CB 3.24Å; V820-T823 WeakPolarHBondContact O-CB 3.32Å; V820-T823 PolarHBondContact O-N 2.95Å; V820-T823 VanDerWaalsContact O-N 3.08Å; P821-T823 VanDerWaalsContact C-N 3.3Å; P821-T823 PolarHBondContact O-N 3.38Å; T823-K827 WeakPolarHBondContact O-CB 3.48Å; T823-K827 PolarHBondContact O-N 3.1Å
824	F	80.8	Confident	83.2	Confident	71 Å²	71	30.1 Å²	30.1	31%	0.311	15%	0.153	S	C	.	.	H	α-helix	trans	-71.8	-40.5	-179.6	-71.4	-73.5	0	0	0	112.2	A374 M378 V820 P821 D822 S826 K827 V828	A374-F824 HydrophobicContact CB-CB 3.74Å; M378-F824 HydrophobicContact CE-CB 4.49Å; M378-F824 HydrophobicContact CE-CD2 3.62Å; M378-F824 HydrophobicContact CE-CE2 4.02Å; M378-F824 HydrophobicContact CE-CG 4.14Å; M378-F824 HydrophobicContact SD-CD1 4.4Å; M378-F824 HydrophobicContact SD-CD2 3.49Å; M378-F824 WeakPolarHBondContact SD-CD2 3.49Å; M378-F824 HydrophobicContact SD-CE1 4.23Å; M378-F824 HydrophobicContact SD-CE2 3.26Å; M378-F824 WeakPolarHBondContact SD-CE2 3.1Å; M378-F824 HydrophobicContact SD-CG 4.07Å; M378-F824 HydrophobicContact SD-CZ 3.68Å; V820-F824 HydrophobicContact CG1-CD2 3.83Å; V820-F824 HydrophobicContact CG1-CE2 3.52Å; V820-F824 VanDerWaalsContact O-CD2 3.31Å; V820-F824 WeakPolarHBondContact O-CD2 3.39Å; V820-F824 PolarHBondContact O-N 3.37Å; P821-F824 PolarHBondContact O-N 2.93Å; D822-F824 VanDerWaalsContact C-N 3.35Å; D822-F824 PolarHBondContact O-N 2.87Å; F824-S826 PolarHBondContact O-N 2.95Å; F824-K827 WeakPolarHBondContact O-CB 3.33Å; F824-K827 PolarHBondContact O-N 2.96Å; F824-V828 WeakPolarHBondContact O-CG2 3.34Å; F824-V828 PolarHBondContact O-N 2.95Å
825	A	77.8	Confident	82.9	Confident	3 Å²	3	34.5 Å²	34.5	3%	0.025	17%	0.17	C	C	.	.	H	α-helix	trans	-58.4	-50.1	175.8	0	0	0	0	0	111.9	R371 P821 D822 K827 V828 A829	R371-A825 HydrophobicContact CB-CB 3.67Å; R371-A825 HydrophobicContact CG-CB 4.03Å; P821-A825 WeakPolarHBondContact O-CB 3.48Å; P821-A825 PolarHBondContact O-N 3.24Å; D822-A825 PolarHBondContact O-N 2.88Å; A825-K827 VanDerWaalsContact C-N 3.33Å; A825-K827 PolarHBondContact O-N 3.47Å; A825-V828 PolarHBondContact O-N 3.28Å; A825-A829 WeakPolarHBondContact O-CB 3.46Å; A825-A829 PolarHBondContact O-N 3.33Å
826	S	85.3	Confident	82.6	Confident	4 Å²	4	34.4 Å²	34.4	3%	0.028	17%	0.169	C	C	.	.	H	α-helix	trans	-68.4	-30.9	178.7	-67.1	0	0	0	0	112.8	I187 C191 D822 F824 A830	I187-S826 VanDerWaalsContact CG2-CB 3.44Å; C191-S826 VanDerWaalsContact SG-C 3.53Å; C191-S826 PolarHBondContact SG-O 3.18Å; D822-S826 WeakPolarHBondContact O-CB 3.46Å; D822-S826 PolarHBondContact O-N 3.5Å; D822-S826 PolarHBondContact O-OG 3.46Å; F824-S826 PolarHBondContact O-N 2.95Å; S826-A830 WeakPolarHBondContact O-CB 3.48Å; S826-A830 PolarHBondContact O-N 3.45Å
827	K	85.6	Confident	82.2	Confident	72 Å²	72	33.1 Å²	33.1	31%	0.313	16%	0.163	S	C	.	.	H	α-helix	trans	-63.1	-52	172.5	178.7	-168.6	171	-164.8	0	111.1	L190 V194 T823 F824 A825 A830 I831	L190-K827 HydrophobicContact CD2-CB 4.34Å; L190-K827 HydrophobicContact CD2-CD 4.45Å; V194-K827 HydrophobicContact CB-CG 4.21Å; V194-K827 HydrophobicContact CG1-CD 4.37Å; V194-K827 HydrophobicContact CG1-CG 3.77Å; V194-K827 HydrophobicContact CG2-CD 4.32Å; V194-K827 HydrophobicContact CG2-CG 4.03Å; T823-K827 WeakPolarHBondContact O-CB 3.48Å; T823-K827 PolarHBondContact O-N 3.1Å; F824-K827 WeakPolarHBondContact O-CB 3.33Å; F824-K827 PolarHBondContact O-N 2.96Å; A825-K827 VanDerWaalsContact C-N 3.33Å; A825-K827 PolarHBondContact O-N 3.47Å; K827-A830 PolarHBondContact O-N 3.22Å; K827-I831 HydrophobicContact CG-CD1 4.36Å; K827-I831 PolarHBondContact O-N 3.25Å
828	V	79.4	Confident	81.7	Confident	21 Å²	21	34.1 Å²	34.1	13%	0.127	17%	0.17	C	C	.	.	H	α-helix	trans	-64.4	-43	-178.2	177.5	0	0	0	0	110.3	Y370 A374 F824 A825 A830 I831 Q832	Y370-V828 HydrophobicContact CD1-CB 4.38Å; Y370-V828 HydrophobicContact CD1-CG1 3.58Å; Y370-V828 HydrophobicContact CE1-CG1 4.2Å; Y370-V828 HydrophobicContact CG-CG1 4.41Å; A374-V828 HydrophobicContact CB-CG2 4.2Å; F824-V828 WeakPolarHBondContact O-CG2 3.34Å; F824-V828 PolarHBondContact O-N 2.95Å; A825-V828 PolarHBondContact O-N 3.28Å; V828-A830 VanDerWaalsContact C-N 3.31Å; V828-A830 PolarHBondContact O-N 3.39Å; V828-I831 PolarHBondContact O-N 2.71Å; V828-I831 VanDerWaalsContact O-N 3.12Å; V828-Q832 HydrophobicContact CG1-CG 4.2Å; V828-Q832 PolarHBondContact O-N 2.89Å
829	A	79.9	Confident	81.5	Confident	3 Å²	3	33.8 Å²	33.8	3%	0.025	17%	0.168	C	C	.	.	H	α-helix	trans	-58.1	-41.6	173.8	0	0	0	0	0	112	Y370 A825 I831 D833 A838	Y370-A829 HydrophobicContact CD2-CB 3.85Å; Y370-A829 HydrophobicContact CE2-CB 4.14Å; Y370-A829 HydrophobicContact CG-CB 4.25Å; A825-A829 WeakPolarHBondContact O-CB 3.46Å; A825-A829 PolarHBondContact O-N 3.33Å; A829-I831 VanDerWaalsContact C-N 3.28Å; A829-I831 PolarHBondContact O-N 2.98Å; A829-D833 VanDerWaalsContact O-CB 3.25Å; A829-D833 WeakPolarHBondContact O-CB 3.46Å; A829-D833 PolarHBondContact O-N 3.49Å; A829-A838 HydrophobicContact CB-CB 4.3Å
830	A	84.9	Confident	81.3	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-65.5	-27.3	178	0	0	0	0	0	114	C191 V195 S826 K827 V828 L910	C191-A830 HydrophobicContact CB-CB 3.94Å; V195-A830 HydrophobicContact CG2-CB 4.43Å; S826-A830 WeakPolarHBondContact O-CB 3.48Å; S826-A830 PolarHBondContact O-N 3.45Å; K827-A830 PolarHBondContact O-N 3.22Å; V828-A830 VanDerWaalsContact C-N 3.31Å; V828-A830 PolarHBondContact O-N 3.39Å; A830-L910 HydrophobicContact CB-CD1 4.24Å
831	I	82.9	Confident	81	Confident	67 Å²	67	32.7 Å²	32.7	34%	0.344	17%	0.166	S	C	.	.	H	α-helix	trans	-79.9	-53.3	175.9	-64.2	162.4	0	0	0	110.3	V194 R201 K827 V828 A829	V194-I831 HydrophobicContact CG1-CD1 3.31Å; V194-I831 HydrophobicContact CG1-CG1 3.38Å; R201-I831 PolarHBondContact NH2-O 2.85Å; K827-I831 HydrophobicContact CG-CD1 4.36Å; K827-I831 PolarHBondContact O-N 3.25Å; V828-I831 PolarHBondContact O-N 2.71Å; V828-I831 VanDerWaalsContact O-N 3.12Å; A829-I831 VanDerWaalsContact C-N 3.28Å; A829-I831 PolarHBondContact O-N 2.98Å
832	Q	78	Confident	80.9	Confident	76 Å²	76	33.3 Å²	33.3	36%	0.355	17%	0.169	S	C	.	.	H	α-helix	trans	-83.2	-31.6	-167.1	-63.9	-169	17.6	0	0	113.6	Y370 V828	Y370-Q832 HydrophobicContact CE1-CB 3.79Å; Y370-Q832 HydrophobicContact CE1-CG 4.31Å; V828-Q832 HydrophobicContact CG1-CG 4.2Å; V828-Q832 PolarHBondContact O-N 2.89Å
833	D	77.4	Confident	81	Confident	28 Å²	28	33.4 Å²	33.4	15%	0.15	17%	0.17	C	C	.	.			trans	-83.1	147.1	-179.9	-71.7	-31.8	0	0	0	112.4	R201 Y370 A829 Y835 A838	R201-D833 VanDerWaalsContact CD-O 3.24Å; R201-D833 WeakPolarHBondContact CD-O 3.34Å; R201-D833 PolarHBondContact NE-O 3.47Å; Y370-D833 VanDerWaalsContact CE2-OD2 3.31Å; Y370-D833 WeakPolarHBondContact CE2-OD2 3.2Å; Y370-D833 VanDerWaalsContact OH-CG 3.28Å; Y370-D833 PolarHBondContact OH-OD1 3.46Å; A829-D833 VanDerWaalsContact O-CB 3.25Å; A829-D833 WeakPolarHBondContact O-CB 3.46Å; A829-D833 PolarHBondContact O-N 3.49Å; D833-Y835 VanDerWaalsContact C-N 3.33Å; D833-A838 WeakPolarHBondContact OD2-CB 3.24Å
834	Q	77	Confident	80.9	Confident	139 Å²	139	32.8 Å²	32.8	65%	0.65	17%	0.166	S	C	*	.	S	Bend	trans	-73.9	-22	173.5	-167.2	-178.4	12.7	0	0	113.4	R201	R201-Q834 WeakPolarHBondContact CD-O 3.33Å
835	Y	84.8	Confident	81	Confident	91 Å²	91	29.5 Å²	29.5	36%	0.357	15%	0.152	S	C	.	.	B	Isolated β-bridge	trans	-120	159.8	-176.6	-57.7	-70.3	0	0	0	112.1	K202 K204 D833 D837	K202-Y835 WeakPolarHBondContact O-CA 3.49Å; K202-Y835 WeakPolarHBondContact O-CB 3.33Å; K204-Y835 HydrophobicContact CB-CD1 3.99Å; K204-Y835 HydrophobicContact CB-CE1 4.35Å; K204-Y835 HydrophobicContact CB-CG 4.18Å; K204-Y835 HydrophobicContact CD-CD2 4.25Å; K204-Y835 HydrophobicContact CD-CE1 4.36Å; K204-Y835 HydrophobicContact CD-CE2 4.01Å; D833-Y835 VanDerWaalsContact C-N 3.33Å; Y835-D837 WeakPolarHBondContact CB-OD2 3.46Å
836	A	84.5	Confident	81.3	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-91.1	1.3	-177.9	0	0	0	0	0	114.1	R201 K202 V203 A838 S839 I840 L910	R201-A836 HydrophobicContact CB-CB 4.19Å; K202-A836 PolarHBondContact O-N 3.42Å; V203-A836 HydrophobicContact CG2-CB 3.86Å; A836-A838 PolarHBondContact O-N 2.78Å; A836-S839 PolarHBondContact O-N 3.48Å; A836-S839 PolarHBondContact O-OG 3.44Å; A836-I840 HydrophobicContact CB-CD1 4.04Å; A836-I840 HydrophobicContact CB-CG1 4.37Å; A836-I840 PolarHBondContact O-N 3.23Å; A836-L910 HydrophobicContact CB-CD1 3.69Å; A836-L910 HydrophobicContact CB-CG 4.01Å
837	D	80.4	Confident	81.4	Confident	39 Å²	39	29.2 Å²	29.2	21%	0.209	15%	0.149	C	C	.	.	I	π-helix	trans	-62.1	-42.9	-174.9	-60.3	-101.8	0	0	0	112.1	V203 K204 H205 Y835 G841	V203-D837 WeakPolarHBondContact CG1-OD1 3.15Å; K204-D837 WeakPolarHBondContact CB-OD2 3.47Å; K204-D837 PolarHBondContact N-OD1 3.36Å; K204-D837 PolarHBondContact N-OD2 2.94Å; H205-D837 IonicContact CD2-OD1 3.67Å; H205-D837 PolarHBondContact N-OD1 3.48Å; Y835-D837 WeakPolarHBondContact CB-OD2 3.46Å; D837-G841 VanDerWaalsContact O-CA 3.24Å; D837-G841 WeakPolarHBondContact O-CA 3.16Å; D837-G841 PolarHBondContact O-N 2.98Å
838	A	75.6	Confident	81.6	Confident	25 Å²	25	25.9 Å²	25.9	21%	0.207	14%	0.136	C	C	.	.	I	π-helix	trans	-73.1	-28.3	-179	0	0	0	0	0	113.5	A829 D833 A836 N842	A829-A838 HydrophobicContact CB-CB 4.3Å; D833-A838 WeakPolarHBondContact OD2-CB 3.24Å; A836-A838 PolarHBondContact O-N 2.78Å; A838-N842 WeakPolarHBondContact O-CB 3.08Å; A838-N842 VanDerWaalsContact O-CG 3.26Å; A838-N842 PolarHBondContact O-ND2 3.23Å
839	S	82.3	Confident	82.1	Confident	2 Å²	2	25 Å²	25	1%	0.014	13%	0.13	C	C	.	.	I	π-helix	trans	-85.2	-45.2	179.1	44.4	0	0	0	0	112.1	A836 V843 L910	A836-S839 PolarHBondContact O-N 3.48Å; A836-S839 PolarHBondContact O-OG 3.44Å; S839-V843 WeakPolarHBondContact O-CG2 3.29Å; S839-L910 VanDerWaalsContact OG-CD1 3.26Å; S839-L910 WeakPolarHBondContact OG-CD1 3.23Å
840	I	84.3	Confident	82.5	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.01	13%	0.129	C	C	.	.	I	π-helix	trans	-89	-46.2	-176.9	-54.9	-179.7	0	0	0	111.9	I188 V203 F209 A836 N842 V843 T844 L898 E909 L910	I188-I840 HydrophobicContact CD1-CG2 4.32Å; V203-I840 HydrophobicContact CG2-CD1 4.29Å; F209-I840 HydrophobicContact CD2-CG2 4.38Å; F209-I840 HydrophobicContact CE2-CG2 3.57Å; F209-I840 HydrophobicContact CZ-CG2 4.32Å; A836-I840 HydrophobicContact CB-CD1 4.04Å; A836-I840 HydrophobicContact CB-CG1 4.37Å; A836-I840 PolarHBondContact O-N 3.23Å; I840-N842 VanDerWaalsContact C-N 3.25Å; I840-N842 PolarHBondContact O-N 3.42Å; I840-V843 WeakPolarHBondContact O-CB 3.12Å; I840-V843 PolarHBondContact O-N 3.22Å; I840-V843 VanDerWaalsContact O-N 3.13Å; I840-T844 PolarHBondContact O-N 3.38Å; I840-T844 VanDerWaalsContact O-N 3.08Å; I840-T844 PolarHBondContact O-OG1 3.36Å; I840-L898 HydrophobicContact CG2-CD1 4.47Å; I840-E909 HydrophobicContact CD1-CB 4.03Å; I840-L910 HydrophobicContact CD1-CD1 4.38Å; I840-L910 HydrophobicContact CD1-CD2 3.87Å; I840-L910 HydrophobicContact CD1-CG 4.01Å; I840-L910 HydrophobicContact CG1-CD1 4.32Å; I840-L910 HydrophobicContact CG1-CD2 4.18Å; I840-L910 HydrophobicContact CG1-CG 4.42Å
841	G	76.2	Confident	82.9	Confident	21 Å²	21	24.8 Å²	24.8	22%	0.216	13%	0.129	C	C	.	.	I	π-helix	trans	-62	-34.2	-174.6	0	0	0	0	0	112.9	D837 T844 G845	D837-G841 VanDerWaalsContact O-CA 3.24Å; D837-G841 WeakPolarHBondContact O-CA 3.16Å; D837-G841 PolarHBondContact O-N 2.98Å; G841-T844 PolarHBondContact O-OG1 3.35Å; G841-T844 VanDerWaalsContact O-OG1 3.06Å; G841-G845 PolarHBondContact O-N 3.43Å
842	N	73.9	Confident	83.3	Confident	17 Å²	17	21.6 Å²	21.6	9%	0.091	11%	0.112	C	C	.	.	H	α-helix	trans	-70.7	-35.3	177	-70.8	-22.9	0	0	0	112.7	R367 A838 I840 S846	R367-N842 WeakPolarHBondContact CD-ND2 3.49Å; R367-N842 WeakPolarHBondContact CG-ND2 3.49Å; A838-N842 WeakPolarHBondContact O-CB 3.08Å; A838-N842 VanDerWaalsContact O-CG 3.26Å; A838-N842 PolarHBondContact O-ND2 3.23Å; I840-N842 VanDerWaalsContact C-N 3.25Å; I840-N842 PolarHBondContact O-N 3.42Å; N842-S846 WeakPolarHBondContact O-CB 3.48Å; N842-S846 PolarHBondContact O-N 2.99Å; N842-S846 PolarHBondContact O-OG 3.22Å
843	V	83.8	Confident	83.9	Confident	4 Å²	4	19 Å²	19	2%	0.024	10%	0.101	C	C	.	.	H	α-helix	trans	-66.6	-46.1	174	164.5	0	0	0	0	110.7	N183 I187 I188 S839 I840 G845 S846 N847	N183-V843 HydrophobicContact CB-CG1 4Å; N183-V843 WeakPolarHBondContact O-CG1 3.22Å; I187-V843 HydrophobicContact CG2-CG2 4.15Å; I188-V843 HydrophobicContact CD1-CG1 4.12Å; I188-V843 HydrophobicContact CG1-CG1 4.19Å; S839-V843 WeakPolarHBondContact O-CG2 3.29Å; I840-V843 WeakPolarHBondContact O-CB 3.12Å; I840-V843 PolarHBondContact O-N 3.22Å; I840-V843 VanDerWaalsContact O-N 3.13Å; V843-G845 PolarHBondContact O-N 3.31Å; V843-S846 PolarHBondContact O-OG 2.84Å; V843-N847 WeakPolarHBondContact O-CB 3.47Å; V843-N847 VanDerWaalsContact O-CG 3.22Å; V843-N847 PolarHBondContact O-N 3.04Å; V843-N847 PolarHBondContact O-OD1 3.29Å
844	T	84	Confident	84.5	Confident	3 Å²	3	17.7 Å²	17.7	2%	0.018	9%	0.094	C	C	.	.	H	α-helix	trans	-69.1	-36.2	179.9	52.6	0	0	0	0	112.3	F209 S216 I840 G841 A848	F209-T844 HydrophobicContact CE2-CG2 4.34Å; S216-T844 VanDerWaalsContact CB-O 3.32Å; S216-T844 WeakPolarHBondContact CB-O 3.42Å; S216-T844 PolarHBondContact OG-O 3.05Å; S216-T844 VanDerWaalsContact OG-O 3.07Å; I840-T844 PolarHBondContact O-N 3.38Å; I840-T844 VanDerWaalsContact O-N 3.08Å; I840-T844 PolarHBondContact O-OG1 3.36Å; G841-T844 PolarHBondContact O-OG1 3.35Å; G841-T844 VanDerWaalsContact O-OG1 3.06Å; T844-A848 PolarHBondContact O-N 3.06Å
845	G	82.5	Confident	85.2	Confident	2 Å²	2	11.1 Å²	11.1	2%	0.021	6%	0.063	C	C	.	.	H	α-helix	trans	-63	-54.4	174.8	0	0	0	0	0	112.7	G841 V843 N847 A848 V849	G841-G845 PolarHBondContact O-N 3.43Å; V843-G845 PolarHBondContact O-N 3.31Å; G845-N847 VanDerWaalsContact C-N 3.3Å; G845-N847 PolarHBondContact O-N 3.16Å; G845-A848 WeakPolarHBondContact O-CB 3.36Å; G845-A848 PolarHBondContact O-N 3.37Å; G845-A848 VanDerWaalsContact O-N 3.1Å; G845-V849 WeakPolarHBondContact O-CG2 3.34Å; G845-V849 PolarHBondContact O-N 3.48Å; G845-V849 VanDerWaalsContact O-N 3.15Å
846	S	84.7	Confident	85.5	Confident	0 Å²	0	6.8 Å²	6.8	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-57.5	-40.1	178.9	51.7	0	0	0	0	112.7	S150 N842 V843 A848 V849 N850	S150-S846 WeakPolarHBondContact OG-CB 3.31Å; N842-S846 WeakPolarHBondContact O-CB 3.48Å; N842-S846 PolarHBondContact O-N 2.99Å; N842-S846 PolarHBondContact O-OG 3.22Å; V843-S846 PolarHBondContact O-OG 2.84Å; S846-A848 VanDerWaalsContact C-N 3.29Å; S846-A848 PolarHBondContact O-N 3.38Å; S846-V849 PolarHBondContact O-N 2.89Å; S846-V849 VanDerWaalsContact O-N 3.15Å; S846-N850 VanDerWaalsContact O-CG 3.29Å; S846-N850 PolarHBondContact O-N 3.31Å; S846-N850 PolarHBondContact O-OD1 2.69Å
847	N	88.2	Confident	85.9	Confident	0 Å²	0	8.5 Å²	8.5	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-60.1	-35.7	176.7	-76.5	3.1	0	0	0	113.7	A180 S216 Y220 V843 G845	A180-N847 WeakPolarHBondContact CA-OD1 3.49Å; A180-N847 HydrophobicContact CB-CB 4.44Å; A180-N847 PolarHBondContact O-ND2 3.17Å; S216-N847 WeakPolarHBondContact OG-CB 3.42Å; Y220-N847 HydrophobicContact CE2-CB 4.42Å; Y220-N847 WeakPolarHBondContact CE2-O 3.42Å; Y220-N847 PolarHBondContact OH-O 3Å; V843-N847 WeakPolarHBondContact O-CB 3.47Å; V843-N847 VanDerWaalsContact O-CG 3.22Å; V843-N847 PolarHBondContact O-N 3.04Å; V843-N847 PolarHBondContact O-OD1 3.29Å; G845-N847 VanDerWaalsContact C-N 3.3Å; G845-N847 PolarHBondContact O-N 3.16Å
848	A	88.6	Confident	86.4	Confident	3 Å²	3	6.7 Å²	6.7	3%	0.025	5%	0.047	C	C	.	.	H	α-helix	trans	-72.3	-41.9	175.4	0	0	0	0	0	111.2	T844 G845 S846 N850 V851 F852	T844-A848 PolarHBondContact O-N 3.06Å; G845-A848 WeakPolarHBondContact O-CB 3.36Å; G845-A848 PolarHBondContact O-N 3.37Å; G845-A848 VanDerWaalsContact O-N 3.1Å; S846-A848 VanDerWaalsContact C-N 3.29Å; S846-A848 PolarHBondContact O-N 3.38Å; A848-N850 VanDerWaalsContact C-N 3.34Å; A848-N850 PolarHBondContact O-N 3.18Å; A848-V851 PolarHBondContact O-N 3.21Å; A848-F852 HydrophobicContact CB-CD2 4.3Å; A848-F852 HydrophobicContact CB-CE2 4.14Å; A848-F852 WeakPolarHBondContact O-CD2 3.24Å; A848-F852 PolarHBondContact O-N 2.88Å
849	V	89.6	Confident	87.3	Confident	2 Å²	2	5.6 Å²	5.6	1%	0.012	4%	0.037	C	C	.	.	H	α-helix	trans	-63.1	-38.6	179	178.5	0	0	0	0	111.6	A146 I154 F247 G845 S846 V851 L853 G854	A146-V849 HydrophobicContact CB-CG2 3.9Å; I154-V849 HydrophobicContact CD1-CG1 4.09Å; F247-V849 HydrophobicContact CD2-CG2 4.1Å; F247-V849 HydrophobicContact CE2-CG1 4.46Å; F247-V849 HydrophobicContact CE2-CG2 3.66Å; G845-V849 WeakPolarHBondContact O-CG2 3.34Å; G845-V849 PolarHBondContact O-N 3.48Å; G845-V849 VanDerWaalsContact O-N 3.15Å; S846-V849 PolarHBondContact O-N 2.89Å; S846-V849 VanDerWaalsContact O-N 3.15Å; V849-V851 PolarHBondContact O-N 3.34Å; V849-L853 HydrophobicContact CG1-CB 3.94Å; V849-L853 HydrophobicContact CG1-CD2 4.06Å; V849-L853 WeakPolarHBondContact O-CA 3.4Å; V849-L853 VanDerWaalsContact O-CB 3.22Å; V849-L853 WeakPolarHBondContact O-CB 3.36Å; V849-L853 PolarHBondContact O-N 3.3Å; V849-G854 PolarHBondContact O-N 2.97Å
850	N	90	Very high	87.8	Confident	0 Å²	0	5.9 Å²	5.9	0%	0	4%	0.039	C	C	.	.	I	π-helix	trans	-55.7	-39.2	178	-69.7	-2.4	0	0	0	112.5	S150 I176 S179 S846 A848 G854 I855	S150-N850 WeakPolarHBondContact CB-OD1 3.48Å; S150-N850 PolarHBondContact OG-OD1 3Å; I176-N850 HydrophobicContact CG2-CB 3.79Å; S179-N850 PolarHBondContact OG-ND2 3.38Å; S846-N850 VanDerWaalsContact O-CG 3.29Å; S846-N850 PolarHBondContact O-N 3.31Å; S846-N850 PolarHBondContact O-OD1 2.69Å; A848-N850 VanDerWaalsContact C-N 3.34Å; A848-N850 PolarHBondContact O-N 3.18Å; N850-G854 WeakPolarHBondContact O-CA 3.48Å; N850-G854 PolarHBondContact O-N 3.44Å; N850-I855 PolarHBondContact O-N 2.97Å
851	V	91.8	Very high	88.2	Confident	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.054	C	C	.	.	I	π-helix	trans	-83.6	-53.5	179.9	178.2	0	0	0	0	111	I176 A219 Y220 L223 T243 A848 V849 L853 I855 G856	I176-V851 HydrophobicContact CG2-CG2 4.26Å; A219-V851 HydrophobicContact CB-CB 3.85Å; A219-V851 HydrophobicContact CB-CG1 4.03Å; A219-V851 HydrophobicContact CB-CG2 4.22Å; Y220-V851 HydrophobicContact CD1-CG2 4.02Å; Y220-V851 HydrophobicContact CD2-CG2 4.32Å; Y220-V851 HydrophobicContact CE1-CG2 3.54Å; Y220-V851 HydrophobicContact CE2-CG2 3.87Å; Y220-V851 HydrophobicContact CG-CG2 4.37Å; Y220-V851 VanDerWaalsContact CZ-CG2 3.41Å; L223-V851 HydrophobicContact CB-CG1 4.34Å; T243-V851 HydrophobicContact CG2-CG1 4.49Å; A848-V851 PolarHBondContact O-N 3.21Å; V849-V851 PolarHBondContact O-N 3.34Å; V851-L853 PolarHBondContact O-N 3.29Å; V851-I855 WeakPolarHBondContact O-CB 3.49Å; V851-I855 PolarHBondContact O-N 2.95Å; V851-G856 PolarHBondContact O-N 3.48Å
852	F	92.4	Very high	89	Confident	0 Å²	0	7.8 Å²	7.8	0%	0	4%	0.044	C	C	.	.	I	π-helix	trans	-65.7	-40	-174.8	-61.5	-38.1	0	0	0	112.4	W215 F218 A219 T243 F244 F246 F247 C250 A848 G856	W215-F852 AromaticContact CE3-CE2 3.87Å; W215-F852 HydrophobicContact CE3-CE2 3.87Å; W215-F852 AromaticContact CE3-CZ 3.71Å; W215-F852 HydrophobicContact CE3-CZ 3.71Å; W215-F852 HydrophobicContact CZ3-CZ 4.19Å; F218-F852 HydrophobicContact CD1-CZ 4.18Å; A219-F852 HydrophobicContact CB-CD1 4.18Å; A219-F852 HydrophobicContact CB-CE1 3.53Å; A219-F852 HydrophobicContact CB-CE2 3.99Å; A219-F852 HydrophobicContact CB-CZ 3.4Å; A219-F852 VanDerWaalsContact CB-CZ 3.4Å; T243-F852 HydrophobicContact CG2-CD1 4.43Å; T243-F852 WeakPolarHBondContact O-CA 3.42Å; F244-F852 WeakPolarHBondContact CA-O 3.33Å; F246-F852 HydrophobicContact CB-CD1 3.52Å; F246-F852 HydrophobicContact CB-CD2 4.26Å; F246-F852 HydrophobicContact CB-CE1 3.51Å; F246-F852 HydrophobicContact CB-CE2 4.26Å; F246-F852 HydrophobicContact CB-CG 3.93Å; F246-F852 HydrophobicContact CB-CZ 3.91Å; F246-F852 HydrophobicContact CD2-CD1 4.32Å; F246-F852 AromaticContact CD2-CE1 3.96Å; F246-F852 HydrophobicContact CD2-CE1 3.96Å; F246-F852 HydrophobicContact CG-CD1 4.41Å; F246-F852 HydrophobicContact CG-CE1 4.09Å; F247-F852 HydrophobicContact CB-CB 3.78Å; C250-F852 HydrophobicContact CB-CE2 4.49Å; A848-F852 HydrophobicContact CB-CD2 4.3Å; A848-F852 HydrophobicContact CB-CE2 4.14Å; A848-F852 WeakPolarHBondContact O-CD2 3.24Å; A848-F852 PolarHBondContact O-N 2.88Å; F852-G856 WeakPolarHBondContact O-CA 3.46Å
853	L	90.7	Very high	89.8	Confident	22 Å²	22	7.1 Å²	7.1	12%	0.115	4%	0.04	C	C	.	.	I	π-helix	trans	-92.8	-49.4	179	-163.2	66.4	0	0	0	111.6	L147 I154 F244 V849 V851 V857	L147-L853 HydrophobicContact CD1-CD2 3.53Å; L147-L853 HydrophobicContact CG-CD2 4.05Å; I154-L853 HydrophobicContact CD1-CB 4.4Å; I154-L853 HydrophobicContact CD1-CD2 4.04Å; I154-L853 HydrophobicContact CD1-CG 4.45Å; F244-L853 HydrophobicContact CD2-CD1 4.08Å; F244-L853 HydrophobicContact CE2-CD1 3.65Å; V849-L853 HydrophobicContact CG1-CB 3.94Å; V849-L853 HydrophobicContact CG1-CD2 4.06Å; V849-L853 WeakPolarHBondContact O-CA 3.4Å; V849-L853 VanDerWaalsContact O-CB 3.22Å; V849-L853 WeakPolarHBondContact O-CB 3.36Å; V849-L853 PolarHBondContact O-N 3.3Å; V851-L853 PolarHBondContact O-N 3.29Å; L853-V857 HydrophobicContact CD1-CG2 3.79Å; L853-V857 HydrophobicContact CG-CG2 4.31Å; L853-V857 WeakPolarHBondContact O-CB 3.45Å; L853-V857 WeakPolarHBondContact O-CG2 3.44Å; L853-V857 PolarHBondContact O-N 3.09Å
854	G	89.4	Confident	90.3	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.06	C	C	.	.	I	π-helix	trans	-64.6	-61.5	-176.3	0	0	0	0	0	113.4	V849 N850 A858	V849-G854 PolarHBondContact O-N 2.97Å; N850-G854 WeakPolarHBondContact O-CA 3.48Å; N850-G854 PolarHBondContact O-N 3.44Å; G854-A858 VanDerWaalsContact O-CB 3.29Å; G854-A858 WeakPolarHBondContact O-CB 3.48Å; G854-A858 PolarHBondContact O-N 3.18Å
855	I	90.7	Very high	90.8	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.072	C	C	.	.	I	π-helix	trans	-70.8	-43.3	177.2	-62	-178.6	0	0	0	110.4	I176 L223 N850 V851 V857 A858 W859	I176-I855 HydrophobicContact CD1-CD1 4.45Å; I176-I855 HydrophobicContact CD1-CG1 3.67Å; I176-I855 HydrophobicContact CG2-CD1 4.02Å; I176-I855 HydrophobicContact CG2-CG1 4.28Å; L223-I855 HydrophobicContact CD1-CD1 3.81Å; L223-I855 HydrophobicContact CD1-CG2 4.04Å; L223-I855 HydrophobicContact CD2-CD1 3.56Å; L223-I855 HydrophobicContact CG-CD1 4.35Å; N850-I855 PolarHBondContact O-N 2.97Å; V851-I855 WeakPolarHBondContact O-CB 3.49Å; V851-I855 PolarHBondContact O-N 2.95Å; I855-V857 PolarHBondContact O-N 3.31Å; I855-A858 PolarHBondContact O-N 3.08Å; I855-W859 HydrophobicContact CG2-CD2 3.26Å; I855-W859 VanDerWaalsContact CG2-CE2 3.43Å; I855-W859 HydrophobicContact CG2-CE3 3.42Å; I855-W859 VanDerWaalsContact CG2-CE3 3.42Å; I855-W859 HydrophobicContact CG2-CG 3.8Å; I855-W859 HydrophobicContact CG2-CH2 3.84Å; I855-W859 HydrophobicContact CG2-CZ2 3.72Å; I855-W859 HydrophobicContact CG2-CZ3 3.72Å; I855-W859 VanDerWaalsContact O-CB 3.31Å; I855-W859 WeakPolarHBondContact O-CB 3.49Å; I855-W859 PolarHBondContact O-N 3.26Å
856	G	92.7	Very high	91.2	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-58.9	-45.5	-177.3	0	0	0	0	0	113.9	V851 F852 S860	V851-G856 PolarHBondContact O-N 3.48Å; F852-G856 WeakPolarHBondContact O-CA 3.46Å; G856-S860 WeakPolarHBondContact O-CB 2.99Å; G856-S860 PolarHBondContact O-N 2.87Å; G856-S860 PolarHBondContact O-OG 3.42Å
857	V	92.2	Very high	91.6	Very high	37 Å²	37	20.3 Å²	20.3	22%	0.224	10%	0.104	C	C	.	.	H	α-helix	trans	-67.5	-50.3	177	173.1	0	0	0	0	110.6	V158 F244 L853 I855 W859 S860 I861	V158-V857 HydrophobicContact CG2-CG1 4.15Å; F244-V857 HydrophobicContact CD2-CG2 3.52Å; F244-V857 HydrophobicContact CE2-CG2 3.57Å; L853-V857 HydrophobicContact CD1-CG2 3.79Å; L853-V857 HydrophobicContact CG-CG2 4.31Å; L853-V857 WeakPolarHBondContact O-CB 3.45Å; L853-V857 WeakPolarHBondContact O-CG2 3.44Å; L853-V857 PolarHBondContact O-N 3.09Å; I855-V857 PolarHBondContact O-N 3.31Å; V857-W859 PolarHBondContact O-N 3.17Å; V857-S860 PolarHBondContact O-N 2.02Å; V857-I861 HydrophobicContact CG1-CD1 3.73Å; V857-I861 HydrophobicContact CG1-CG1 4.5Å; V857-I861 VanDerWaalsContact O-CG1 3.28Å; V857-I861 WeakPolarHBondContact O-CG1 3.22Å; V857-I861 PolarHBondContact O-N 2.9Å
858	A	91.9	Very high	91.8	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-61.1	-47	-174.8	0	0	0	0	0	111.4	V158 I161 G854 I855 I861 A862	V158-A858 HydrophobicContact CG2-CB 3.92Å; I161-A858 HydrophobicContact CD1-CB 3.59Å; I161-A858 HydrophobicContact CG1-CB 4.49Å; G854-A858 VanDerWaalsContact O-CB 3.29Å; G854-A858 WeakPolarHBondContact O-CB 3.48Å; G854-A858 PolarHBondContact O-N 3.18Å; I855-A858 PolarHBondContact O-N 3.08Å; A858-I861 PolarHBondContact O-N 2.81Å; A858-A862 PolarHBondContact O-N 3.43Å; A858-A862 VanDerWaalsContact O-N 3.1Å
859	W	93.1	Very high	91.9	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-75.2	-30.6	-179.8	-68.3	6.5	0	0	0	112.9	P173 L223 I226 L227 V235 I855 V857 A862 A863 F873 V875 L880	P173-W859 HydrophobicContact CB-CZ2 4.49Å; P173-W859 HydrophobicContact CG-CZ2 4.26Å; L223-W859 HydrophobicContact CD1-CH2 3.49Å; L223-W859 VanDerWaalsContact CD1-CH2 3.49Å; L223-W859 HydrophobicContact CD1-CZ2 4.48Å; L223-W859 HydrophobicContact CD1-CZ3 3.55Å; I226-W859 HydrophobicContact CD1-CE3 3.98Å; I226-W859 HydrophobicContact CD1-CZ3 3.64Å; I226-W859 HydrophobicContact CG1-CZ3 4.29Å; L227-W859 HydrophobicContact CD1-CH2 4.09Å; L227-W859 HydrophobicContact CD2-CH2 3.67Å; L227-W859 HydrophobicContact CD2-CZ3 3.93Å; L227-W859 HydrophobicContact CG-CH2 4.06Å; L227-W859 HydrophobicContact CG-CZ3 4.27Å; V235-W859 HydrophobicContact CB-CE3 4.49Å; V235-W859 HydrophobicContact CG1-CB 4.5Å; V235-W859 HydrophobicContact CG1-CE3 4.09Å; V235-W859 HydrophobicContact CG2-CE3 3.82Å; V235-W859 HydrophobicContact CG2-CZ3 3.92Å; I855-W859 HydrophobicContact CG2-CD2 3.26Å; I855-W859 VanDerWaalsContact CG2-CE2 3.43Å; I855-W859 HydrophobicContact CG2-CE3 3.42Å; I855-W859 VanDerWaalsContact CG2-CE3 3.42Å; I855-W859 HydrophobicContact CG2-CG 3.8Å; I855-W859 HydrophobicContact CG2-CH2 3.84Å; I855-W859 HydrophobicContact CG2-CZ2 3.72Å; I855-W859 HydrophobicContact CG2-CZ3 3.72Å; I855-W859 VanDerWaalsContact O-CB 3.31Å; I855-W859 WeakPolarHBondContact O-CB 3.49Å; I855-W859 PolarHBondContact O-N 3.26Å; V857-W859 PolarHBondContact O-N 3.17Å; W859-A862 PolarHBondContact O-N 2.9Å; W859-A863 WeakPolarHBondContact O-CB 3.21Å; W859-A863 PolarHBondContact O-N 3.41Å; W859-F873 HydrophobicContact CB-CE1 4.03Å; W859-F873 HydrophobicContact CD2-CE1 4.38Å; W859-F873 AromaticContact CG-CE1 3.9Å; W859-F873 HydrophobicContact CG-CE1 3.9Å; W859-F873 HydrophobicContact CG-CZ 4.39Å; W859-V875 HydrophobicContact CH2-CG1 4.17Å; W859-V875 HydrophobicContact CZ2-CG1 4Å; W859-L880 HydrophobicContact CH2-CD2 4.39Å; W859-L880 HydrophobicContact CZ2-CD2 4.41Å
860	S	93.9	Very high	91.9	Very high	7 Å²	7	33.8 Å²	33.8	5%	0.049	19%	0.194	C	C	.	.	H	α-helix	trans	-61.1	-46.4	171.3	-67	0	0	0	0	111.2	G240 L241 G856 V857 I864	G240-S860 PolarHBondContact O-OG 3.2Å; L241-S860 PolarHBondContact N-OG 3.11Å; G856-S860 WeakPolarHBondContact O-CB 2.99Å; G856-S860 PolarHBondContact O-N 2.87Å; G856-S860 PolarHBondContact O-OG 3.42Å; V857-S860 PolarHBondContact O-N 2.02Å; S860-I864 WeakPolarHBondContact O-CB 3.46Å; S860-I864 WeakPolarHBondContact O-CD1 3.21Å; S860-I864 WeakPolarHBondContact O-CG1 3.38Å; S860-I864 PolarHBondContact O-N 2.91Å
861	I	92.6	Very high	91.9	Very high	64 Å²	64	39.7 Å²	39.7	33%	0.328	22%	0.222	S	C	.	.	H	α-helix	trans	-61.4	-47.9	178.6	-67.2	167.6	0	0	0	110.1	F166 V857 A858 I864 Y865	F166-I861 HydrophobicContact CD1-CG2 4.02Å; F166-I861 HydrophobicContact CE1-CG2 3.61Å; V857-I861 HydrophobicContact CG1-CD1 3.73Å; V857-I861 HydrophobicContact CG1-CG1 4.5Å; V857-I861 VanDerWaalsContact O-CG1 3.28Å; V857-I861 WeakPolarHBondContact O-CG1 3.22Å; V857-I861 PolarHBondContact O-N 2.9Å; A858-I861 PolarHBondContact O-N 2.81Å; I861-I864 PolarHBondContact O-N 3.48Å; I861-Y865 WeakPolarHBondContact O-CB 3.22Å; I861-Y865 PolarHBondContact O-N 3.41Å
862	A	91.7	Very high	91.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-47.4	179.2	0	0	0	0	0	112.6	I161 A858 W859 I864 Y865 H866 F873	I161-A862 HydrophobicContact CD1-CB 4.43Å; I161-A862 HydrophobicContact CG2-CB 3.76Å; A858-A862 PolarHBondContact O-N 3.43Å; A858-A862 VanDerWaalsContact O-N 3.1Å; W859-A862 PolarHBondContact O-N 2.9Å; A862-I864 PolarHBondContact O-N 3.43Å; A862-Y865 PolarHBondContact O-N 2.86Å; A862-H866 PolarHBondContact O-CD2 3.46Å; A862-H866 VanDerWaalsContact O-CD2 3.28Å; A862-H866 PolarHBondContact O-N 3.31Å; A862-F873 HydrophobicContact CB-CD1 4.16Å; A862-F873 HydrophobicContact CB-CD2 3.78Å; A862-F873 HydrophobicContact CB-CE1 3.93Å; A862-F873 HydrophobicContact CB-CE2 3.49Å; A862-F873 VanDerWaalsContact CB-CE2 3.49Å; A862-F873 HydrophobicContact CB-CG 4.12Å; A862-F873 HydrophobicContact CB-CZ 3.59Å
863	A	92.3	Very high	91.7	Very high	2 Å²	2	46.4 Å²	46.4	2%	0.017	25%	0.253	C	S	.	.	H	α-helix	trans	-63	-41.6	179.9	0	0	0	0	0	111.7	V237 W859 N867 F873	V237-A863 HydrophobicContact CG2-CB 4.16Å; W859-A863 WeakPolarHBondContact O-CB 3.21Å; W859-A863 PolarHBondContact O-N 3.41Å; A863-N867 WeakPolarHBondContact O-CB 3.41Å; A863-N867 PolarHBondContact O-N 3.42Å; A863-F873 HydrophobicContact CB-CB 4.39Å; A863-F873 HydrophobicContact CB-CD1 4.27Å
864	I	93.4	Very high	91.6	Very high	83 Å²	83	52.2 Å²	52.2	43%	0.426	28%	0.277	S	S	.	.	H	α-helix	trans	-63.1	-43.8	175.7	-69.5	166.5	0	0	0	110.6	V237 L241 S860 I861 A862 N867 S868	V237-I864 HydrophobicContact CG1-CG1 3.84Å; L241-I864 HydrophobicContact CD2-CD1 4.39Å; S860-I864 WeakPolarHBondContact O-CB 3.46Å; S860-I864 WeakPolarHBondContact O-CD1 3.21Å; S860-I864 WeakPolarHBondContact O-CG1 3.38Å; S860-I864 PolarHBondContact O-N 2.91Å; I861-I864 PolarHBondContact O-N 3.48Å; A862-I864 PolarHBondContact O-N 3.43Å; I864-N867 PolarHBondContact O-N 3.08Å; I864-S868 WeakPolarHBondContact O-CB 3.21Å; I864-S868 PolarHBondContact O-N 3.39Å
865	Y	93.6	Very high	91.4	Very high	69 Å²	69	52.5 Å²	52.5	27%	0.271	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-48.3	179.5	173	-95.7	0	0	0	112.4	F166 I861 A862 S868 K869	F166-Y865 HydrophobicContact CB-CD1 3.41Å; F166-Y865 VanDerWaalsContact CB-CD1 3.41Å; F166-Y865 HydrophobicContact CB-CE1 3.7Å; F166-Y865 HydrophobicContact CB-CG 4.06Å; F166-Y865 HydrophobicContact CD1-CD1 4.32Å; F166-Y865 HydrophobicContact CD1-CG 4.11Å; F166-Y865 AromaticContact CD2-CD1 3.54Å; F166-Y865 HydrophobicContact CD2-CD1 3.54Å; F166-Y865 AromaticContact CD2-CD2 3.79Å; F166-Y865 HydrophobicContact CD2-CD2 3.79Å; F166-Y865 AromaticContact CD2-CE1 3.36Å; F166-Y865 HydrophobicContact CD2-CE1 3.36Å; F166-Y865 AromaticContact CD2-CE2 3.64Å; F166-Y865 HydrophobicContact CD2-CE2 3.64Å; F166-Y865 AromaticContact CD2-CG 3.7Å; F166-Y865 HydrophobicContact CD2-CG 3.7Å; F166-Y865 AromaticContact CD2-CZ 3.35Å; F166-Y865 HydrophobicContact CE2-CD1 4.39Å; F166-Y865 AromaticContact CE2-CD2 3.79Å; F166-Y865 HydrophobicContact CE2-CD2 3.79Å; F166-Y865 HydrophobicContact CE2-CE1 4.22Å; F166-Y865 AromaticContact CE2-CE2 3.62Å; F166-Y865 HydrophobicContact CE2-CE2 3.62Å; F166-Y865 HydrophobicContact CE2-CG 4.14Å; F166-Y865 AromaticContact CE2-CZ 3.79Å; F166-Y865 AromaticContact CG-CD1 3.49Å; F166-Y865 HydrophobicContact CG-CD1 3.49Å; F166-Y865 VanDerWaalsContact CG-CD1 3.49Å; F166-Y865 HydrophobicContact CG-CD2 4.21Å; F166-Y865 AromaticContact CG-CE1 3.76Å; F166-Y865 HydrophobicContact CG-CE1 3.76Å; F166-Y865 HydrophobicContact CG-CE2 4.45Å; F166-Y865 AromaticContact CG-CG 3.68Å; F166-Y865 HydrophobicContact CG-CG 3.68Å; F166-Y865 HydrophobicContact CZ-CD2 4.22Å; F166-Y865 HydrophobicContact CZ-CE2 4.44Å; I861-Y865 WeakPolarHBondContact O-CB 3.22Å; I861-Y865 PolarHBondContact O-N 3.41Å; A862-Y865 PolarHBondContact O-N 2.86Å; Y865-S868 WeakPolarHBondContact O-CB 3.35Å; Y865-S868 PolarHBondContact O-N 3.47Å; Y865-K869 HydrophobicContact CE1-CD 4.01Å; Y865-K869 HydrophobicContact CE2-CD 4.29Å; Y865-K869 PolarHBondContact O-N 2.97Å; Y865-K869 WeakPolarHBondContact OH-CE 3.24Å; Y865-K869 PolarHBondContact OH-NZ 3.08Å
866	H	91.5	Very high	90.9	Very high	25 Å²	25	59.2 Å²	59.2	12%	0.116	32%	0.315	C	S	.	.	H	α-helix	trans	-64.9	-43	177.5	-80.8	-71.3	0	0	0	111.6	F166 A862 S868 K869 G870 H871 F873	F166-H866 PolarHBondContact O-CD2 2.95Å; F166-H866 PolarHBondContact O-NE2 2.91Å; A862-H866 PolarHBondContact O-CD2 3.46Å; A862-H866 VanDerWaalsContact O-CD2 3.28Å; A862-H866 PolarHBondContact O-N 3.31Å; H866-S868 VanDerWaalsContact C-N 3.31Å; H866-S868 PolarHBondContact O-N 2.83Å; H866-K869 CarbonylContact O-C 3.45Å; H866-K869 WeakPolarHBondContact O-CA 3.49Å; H866-K869 PolarHBondContact O-N 3.36Å; H866-G870 PolarHBondContact O-N 3.1Å; H866-H871 CarbonylContact C-O 3.47Å; H866-H871 HydrophobicContact CB-CB 4.34Å; H866-H871 WeakPolarHBondContact CB-O 3.49Å; H866-H871 PolarHBondContact O-N 3.2Å; H866-F873 HydrophobicContact CB-CB 4.18Å; H866-F873 AromaticContact CD2-CD2 3.64Å
867	N	92.4	Very high	90	Very high	110 Å²	110	61 Å²	61	59%	0.588	33%	0.327	S	S	*	.	H	α-helix	trans	-62.1	-37.7	176.2	-173.3	69.9	0	0	0	112.2	V237 A863 I864 K869 G870 H871	V237-N867 HydrophobicContact CG2-CB 3.59Å; A863-N867 WeakPolarHBondContact O-CB 3.41Å; A863-N867 PolarHBondContact O-N 3.42Å; I864-N867 PolarHBondContact O-N 3.08Å; N867-K869 PolarHBondContact O-N 3.45Å; N867-G870 PolarHBondContact O-N 3.37Å; N867-G870 VanDerWaalsContact O-N 3.15Å; N867-H871 PolarHBondContact N-O 2.98Å
868	S	93.4	Very high	89.2	Confident	100 Å²	100	60.9 Å²	60.9	70%	0.699	33%	0.333	S	S	*	.	H	α-helix	trans	-63.1	-26	173.1	176.3	0	0	0	0	113	I864 Y865 H866	I864-S868 WeakPolarHBondContact O-CB 3.21Å; I864-S868 PolarHBondContact O-N 3.39Å; Y865-S868 WeakPolarHBondContact O-CB 3.35Å; Y865-S868 PolarHBondContact O-N 3.47Å; H866-S868 VanDerWaalsContact C-N 3.31Å; H866-S868 PolarHBondContact O-N 2.83Å
869	K	91.1	Very high	88.6	Confident	118 Å²	118	62.4 Å²	62.4	51%	0.513	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-0.6	177.3	-67.2	-173.1	169.1	-167.5	0	113.3	Y865 H866 N867 H871	Y865-K869 HydrophobicContact CE1-CD 4.01Å; Y865-K869 HydrophobicContact CE2-CD 4.29Å; Y865-K869 PolarHBondContact O-N 2.97Å; Y865-K869 WeakPolarHBondContact OH-CE 3.24Å; Y865-K869 PolarHBondContact OH-NZ 3.08Å; H866-K869 CarbonylContact O-C 3.45Å; H866-K869 WeakPolarHBondContact O-CA 3.49Å; H866-K869 PolarHBondContact O-N 3.36Å; N867-K869 PolarHBondContact O-N 3.45Å; K869-H871 VanDerWaalsContact C-N 3.28Å
870	G	89.3	Confident	88.1	Confident	70 Å²	70	63 Å²	63	72%	0.722	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	17.9	-175.6	0	0	0	0	0	114.2	H866 N867	H866-G870 PolarHBondContact O-N 3.1Å; N867-G870 PolarHBondContact O-N 3.37Å; N867-G870 VanDerWaalsContact O-N 3.15Å
871	H	90.5	Very high	87.7	Confident	123 Å²	123	62.7 Å²	62.7	57%	0.569	34%	0.343	S	S	*	.			trans	-102.8	157.7	173.8	-64.2	-68.6	0	0	0	110.8	H866 N867 K869	H866-H871 CarbonylContact C-O 3.47Å; H866-H871 HydrophobicContact CB-CB 4.34Å; H866-H871 WeakPolarHBondContact CB-O 3.49Å; H866-H871 PolarHBondContact O-N 3.2Å; N867-H871 PolarHBondContact N-O 2.98Å; K869-H871 VanDerWaalsContact C-N 3.28Å
872	E	88.8	Confident	87.5	Confident	136 Å²	136	61.1 Å²	61.1	64%	0.636	33%	0.334	S	S	*	.			trans	-93.3	137.4	173.9	-67.8	177.7	164.2	0	0	110	V234 K874	V234-E872 HydrophobicContact CG1-CB 3.93Å; V234-E872 HydrophobicContact CG1-CG 4.44Å; E872-K874 PolarHBondContact O-N 3.35Å
873	F	90.8	Very high	87.3	Confident	5 Å²	5	61.5 Å²	61.5	2%	0.022	34%	0.337	C	S	.	.			trans	-80.7	102	174.9	177.1	-127.3	0	0	0	109.8	A168 V234 V235 W859 A862 A863 H866 V875	A168-F873 HydrophobicContact CB-CE2 3.83Å; A168-F873 HydrophobicContact CB-CZ 3.81Å; V234-F873 WeakPolarHBondContact CA-O 3.45Å; V235-F873 HydrophobicContact CB-CD1 3.81Å; V235-F873 HydrophobicContact CB-CE1 4.18Å; V235-F873 HydrophobicContact CG1-CD1 4.37Å; V235-F873 PolarHBondContact N-O 2.86Å; W859-F873 HydrophobicContact CB-CE1 4.03Å; W859-F873 HydrophobicContact CD2-CE1 4.38Å; W859-F873 AromaticContact CG-CE1 3.9Å; W859-F873 HydrophobicContact CG-CE1 3.9Å; W859-F873 HydrophobicContact CG-CZ 4.39Å; A862-F873 HydrophobicContact CB-CD1 4.16Å; A862-F873 HydrophobicContact CB-CD2 3.78Å; A862-F873 HydrophobicContact CB-CE1 3.93Å; A862-F873 HydrophobicContact CB-CE2 3.49Å; A862-F873 VanDerWaalsContact CB-CE2 3.49Å; A862-F873 HydrophobicContact CB-CG 4.12Å; A862-F873 HydrophobicContact CB-CZ 3.59Å; A863-F873 HydrophobicContact CB-CB 4.39Å; A863-F873 HydrophobicContact CB-CD1 4.27Å; H866-F873 HydrophobicContact CB-CB 4.18Å; H866-F873 AromaticContact CD2-CD2 3.64Å; F873-V875 HydrophobicContact CD1-CG2 3.88Å; F873-V875 HydrophobicContact CE1-CG2 3.38Å; F873-V875 HydrophobicContact CE2-CG2 4.26Å; F873-V875 HydrophobicContact CG-CG2 4.48Å; F873-V875 HydrophobicContact CZ-CG2 3.6Å
874	K	87.6	Confident	87.3	Confident	144 Å²	144	61.4 Å²	61.4	63%	0.626	34%	0.336	S	S	*	.	B	Isolated β-bridge	trans	-85.6	131	-178	-64.5	-177.8	179.2	-179	0	110.7	G233 V234 E872	G233-K874 WeakPolarHBondContact O-CA 3.37Å; V234-K874 HydrophobicContact CG2-CG 4.42Å; E872-K874 PolarHBondContact O-N 3.35Å
875	V	85.2	Confident	87.1	Confident	7 Å²	7	58.6 Å²	58.6	4%	0.042	32%	0.323	C	S	.	.			trans	-134	109.3	176.6	-172.6	0	0	0	0	107.7	A168 L227 G233 V235 W859 F873 P877	A168-V875 HydrophobicContact CB-CB 4.32Å; A168-V875 HydrophobicContact CB-CG1 4.19Å; A168-V875 HydrophobicContact CB-CG2 3.89Å; L227-V875 HydrophobicContact CD2-CB 4Å; L227-V875 HydrophobicContact CD2-CG1 3.61Å; G233-V875 CarbonylContact C-O 3.54Å; G233-V875 VanDerWaalsContact CA-O 3.32Å; G233-V875 WeakPolarHBondContact CA-O 3.43Å; G233-V875 PolarHBondContact O-N 3.31Å; V235-V875 HydrophobicContact CB-CG2 4.22Å; V235-V875 HydrophobicContact CG2-CB 4.14Å; V235-V875 HydrophobicContact CG2-CG2 3.67Å; W859-V875 HydrophobicContact CH2-CG1 4.17Å; W859-V875 HydrophobicContact CZ2-CG1 4Å; F873-V875 HydrophobicContact CD1-CG2 3.88Å; F873-V875 HydrophobicContact CE1-CG2 3.38Å; F873-V875 HydrophobicContact CE2-CG2 4.26Å; F873-V875 HydrophobicContact CG-CG2 4.48Å; F873-V875 HydrophobicContact CZ-CG2 3.6Å; V875-P877 WeakPolarHBondContact O-CD 3.47Å
876	D	79.9	Confident	87	Confident	140 Å²	140	56.2 Å²	56.2	75%	0.749	31%	0.314	S	S	*	.			trans	-71.1	122.5	-178	-68.9	-44.1	0	0	0	110.7	G878	D876-G878 PolarHBondContact O-N 2.83Å
877	P	74.9	Confident	87	Confident	38 Å²	38	55 Å²	55	25%	0.247	31%	0.309	C	S	.	.			trans	-69	-34.9	-174.3	23.4	-31.2	0	0	0	112.8	L227 V875 L880 A881	L227-P877 HydrophobicContact CB-CB 4.32Å; V875-P877 WeakPolarHBondContact O-CD 3.47Å; P877-L880 PolarHBondContact O-N 3.35Å; P877-A881 HydrophobicContact CB-CB 4.1Å; P877-A881 WeakPolarHBondContact O-CB 3.47Å; P877-A881 PolarHBondContact O-N 2.96Å
878	G	74.8	Confident	87	Confident	34 Å²	34	50.7 Å²	50.7	35%	0.351	29%	0.287	S	S	.	.	H	α-helix	trans	5.2	-113.6	179	0	0	0	0	0	117.4	D876 L880	D876-G878 PolarHBondContact O-N 2.83Å; G878-L880 VanDerWaalsContact C-N 3.26Å; G878-L880 PolarHBondContact O-N 3.01Å
879	T	79.4	Confident	86.9	Confident	34 Å²	34	50.7 Å²	50.7	21%	0.209	28%	0.278	C	S	.	.	H	α-helix	trans	-70.5	-22.2	-174	66.9	0	0	0	0	113.5	S883 E938 A939	T879-S883 WeakPolarHBondContact O-CB 3.48Å; T879-S883 PolarHBondContact O-N 2.77Å; T879-S883 VanDerWaalsContact O-N 3.11Å; T879-S883 PolarHBondContact O-OG 3.1Å; T879-E938 WeakPolarHBondContact CA-OE2 3.46Å; T879-E938 WeakPolarHBondContact CB-OE2 3.34Å; T879-E938 WeakPolarHBondContact CG2-OE2 3.45Å; T879-A939 HydrophobicContact CG2-CB 4.12Å
880	L	83.2	Confident	87.1	Confident	13 Å²	13	46.1 Å²	46.1	7%	0.068	26%	0.258	C	S	.	.	H	α-helix	trans	-73.8	-48.5	-177.5	-176.1	64.9	0	0	0	110.9	P173 V177 L227 W859 P877 G878 F882 S883 V884	P173-L880 HydrophobicContact CB-CD1 3.93Å; P173-L880 HydrophobicContact CB-CD2 3.75Å; V177-L880 HydrophobicContact CG2-CD1 3.92Å; L227-L880 HydrophobicContact CD1-CD2 3.67Å; L227-L880 HydrophobicContact CD1-CG 4.11Å; W859-L880 HydrophobicContact CH2-CD2 4.39Å; W859-L880 HydrophobicContact CZ2-CD2 4.41Å; P877-L880 PolarHBondContact O-N 3.35Å; G878-L880 VanDerWaalsContact C-N 3.26Å; G878-L880 PolarHBondContact O-N 3.01Å; L880-F882 VanDerWaalsContact C-N 3.31Å; L880-F882 PolarHBondContact O-N 3.42Å; L880-S883 PolarHBondContact O-N 3.48Å; L880-V884 HydrophobicContact CD1-CG2 4.48Å; L880-V884 WeakPolarHBondContact O-CB 3.47Å; L880-V884 VanDerWaalsContact O-CG2 3.22Å; L880-V884 WeakPolarHBondContact O-CG2 3.35Å; L880-V884 PolarHBondContact O-N 3.16Å
881	A	85.8	Confident	87.2	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.008	22%	0.223	C	C	.	.	H	α-helix	trans	-61.7	-40.3	177.7	0	0	0	0	0	111.5	Y224 P877 V884 T885	Y224-A881 HydrophobicContact CD2-CB 4.35Å; P877-A881 HydrophobicContact CB-CB 4.1Å; P877-A881 WeakPolarHBondContact O-CB 3.47Å; P877-A881 PolarHBondContact O-N 2.96Å; A881-V884 PolarHBondContact O-N 3.22Å; A881-T885 VanDerWaalsContact O-CG2 3.3Å; A881-T885 WeakPolarHBondContact O-CG2 3.23Å; A881-T885 PolarHBondContact O-N 3.43Å; A881-T885 PolarHBondContact O-OG1 3.5Å
882	F	87.9	Confident	87.2	Confident	31 Å²	31	42.5 Å²	42.5	14%	0.136	22%	0.221	C	C	.	.	H	α-helix	trans	-61.8	-47	173.5	-177.4	-96.8	0	0	0	112.1	L880 V884 T885 L886 F934 E938	L880-F882 VanDerWaalsContact C-N 3.31Å; L880-F882 PolarHBondContact O-N 3.42Å; F882-V884 VanDerWaalsContact C-N 3.35Å; F882-V884 PolarHBondContact O-N 2.67Å; F882-T885 PolarHBondContact O-N 3.13Å; F882-T885 PolarHBondContact O-OG1 2.96Å; F882-L886 HydrophobicContact CE1-CD2 4.39Å; F882-L886 WeakPolarHBondContact O-CB 3.19Å; F882-L886 PolarHBondContact O-N 3.38Å; F882-F934 HydrophobicContact CE1-CB 4.1Å; F882-F934 WeakPolarHBondContact CE1-O 3.09Å; F882-F934 HydrophobicContact CZ-CB 4.28Å; F882-E938 HydrophobicContact CB-CG 4.06Å; F882-E938 HydrophobicContact CD1-CB 3.63Å; F882-E938 HydrophobicContact CD1-CG 3.73Å; F882-E938 HydrophobicContact CD2-CG 4.11Å; F882-E938 HydrophobicContact CE1-CB 3.7Å; F882-E938 HydrophobicContact CE1-CG 4.2Å; F882-E938 HydrophobicContact CG-CB 4.11Å; F882-E938 HydrophobicContact CG-CG 3.68Å; F882-E938 HydrophobicContact CZ-CB 4.23Å
883	S	88.2	Confident	87.4	Confident	8 Å²	8	39.3 Å²	39.3	6%	0.056	21%	0.207	C	C	.	.	H	α-helix	trans	-65	-39.1	179.7	-61.6	0	0	0	0	112.1	T879 L880 L886 F887 Y931 S935	T879-S883 WeakPolarHBondContact O-CB 3.48Å; T879-S883 PolarHBondContact O-N 2.77Å; T879-S883 VanDerWaalsContact O-N 3.11Å; T879-S883 PolarHBondContact O-OG 3.1Å; L880-S883 PolarHBondContact O-N 3.48Å; S883-L886 PolarHBondContact O-N 3.38Å; S883-F887 WeakPolarHBondContact O-CB 3.16Å; S883-F887 PolarHBondContact O-N 3.22Å; S883-Y931 WeakPolarHBondContact O-CE2 3.04Å; S883-S935 PolarHBondContact OG-OG 3.46Å
884	V	90.5	Very high	87.4	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.5	-44	176.2	171.5	0	0	0	0	111.9	V177 Y220 L223 L880 A881 F882 L886 F887 T888	V177-V884 HydrophobicContact CG1-CG2 4.04Å; V177-V884 HydrophobicContact CG2-CG2 3.68Å; Y220-V884 WeakPolarHBondContact O-CG1 3.2Å; L223-V884 HydrophobicContact CD2-CG2 3.81Å; L223-V884 HydrophobicContact CG-CG2 4.44Å; L880-V884 HydrophobicContact CD1-CG2 4.48Å; L880-V884 WeakPolarHBondContact O-CB 3.47Å; L880-V884 VanDerWaalsContact O-CG2 3.22Å; L880-V884 WeakPolarHBondContact O-CG2 3.35Å; L880-V884 PolarHBondContact O-N 3.16Å; A881-V884 PolarHBondContact O-N 3.22Å; F882-V884 VanDerWaalsContact C-N 3.35Å; F882-V884 PolarHBondContact O-N 2.67Å; V884-L886 PolarHBondContact O-N 3.48Å; V884-F887 PolarHBondContact O-N 2.63Å; V884-T888 WeakPolarHBondContact O-CG2 3.49Å; V884-T888 PolarHBondContact O-N 2.84Å; V884-T888 PolarHBondContact O-OG1 3.26Å; V884-T888 VanDerWaalsContact O-OG1 3.13Å
885	T	89.5	Confident	87.5	Confident	24 Å²	24	33.3 Å²	33.3	15%	0.147	18%	0.183	C	C	.	.	H	α-helix	trans	-64.8	-40.6	177.1	54.4	0	0	0	0	111.5	Y224 A881 F882 T888 I889 F946	Y224-T885 HydrophobicContact CD2-CG2 3.4Å; Y224-T885 VanDerWaalsContact CD2-CG2 3.4Å; Y224-T885 HydrophobicContact CE2-CG2 3.4Å; Y224-T885 VanDerWaalsContact CE2-CG2 3.4Å; Y224-T885 HydrophobicContact CG-CG2 4.11Å; A881-T885 VanDerWaalsContact O-CG2 3.3Å; A881-T885 WeakPolarHBondContact O-CG2 3.23Å; A881-T885 PolarHBondContact O-N 3.43Å; A881-T885 PolarHBondContact O-OG1 3.5Å; F882-T885 PolarHBondContact O-N 3.13Å; F882-T885 PolarHBondContact O-OG1 2.96Å; T885-T888 WeakPolarHBondContact CA-OG1 3.44Å; T885-T888 PolarHBondContact O-N 2.79Å; T885-T888 PolarHBondContact O-OG1 3.35Å; T885-I889 WeakPolarHBondContact O-CG1 3.28Å; T885-I889 PolarHBondContact O-N 3.1Å; T885-F946 HydrophobicContact CG2-CE2 4.12Å
886	L	91.6	Very high	87.7	Confident	19 Å²	19	35.9 Å²	35.9	10%	0.099	21%	0.205	C	C	.	.	H	α-helix	trans	-64.7	-45.2	176.4	-171.3	63.5	0	0	0	112.1	F882 S883 V884 I889 F890 Y931 F934	F882-L886 HydrophobicContact CE1-CD2 4.39Å; F882-L886 WeakPolarHBondContact O-CB 3.19Å; F882-L886 PolarHBondContact O-N 3.38Å; S883-L886 PolarHBondContact O-N 3.38Å; V884-L886 PolarHBondContact O-N 3.48Å; L886-I889 PolarHBondContact O-N 2.91Å; L886-F890 HydrophobicContact CD1-CD2 4.46Å; L886-F890 HydrophobicContact CD1-CE1 4.01Å; L886-F890 HydrophobicContact CD1-CE2 3.8Å; L886-F890 HydrophobicContact CD1-CZ 3.55Å; L886-F890 HydrophobicContact CD2-CE2 4.34Å; L886-F890 HydrophobicContact CG-CD2 4.29Å; L886-F890 HydrophobicContact CG-CE2 3.87Å; L886-F890 HydrophobicContact CG-CZ 4.16Å; L886-F890 PolarHBondContact O-N 3.49Å; L886-F890 VanDerWaalsContact O-N 3.16Å; L886-Y931 HydrophobicContact CB-CD2 4.38Å; L886-Y931 HydrophobicContact CD2-CD2 3.88Å; L886-Y931 HydrophobicContact CG-CD2 4.1Å; L886-F934 HydrophobicContact CD1-CD2 4.35Å; L886-F934 HydrophobicContact CD2-CB 3.59Å; L886-F934 HydrophobicContact CD2-CD2 4.21Å; L886-F934 HydrophobicContact CD2-CG 4.39Å
887	F	92.4	Very high	88.3	Confident	1 Å²	1	30.5 Å²	30.5	0%	0.004	18%	0.177	C	C	.	.	H	α-helix	trans	-58.4	-48.4	176	168.9	-101.7	0	0	0	111.7	V177 A180 A181 M184 F185 Y220 S883 V884 I889 F890 A891 Y931	V177-F887 HydrophobicContact CG1-CB 4.36Å; A180-F887 HydrophobicContact CB-CE2 4.23Å; A180-F887 HydrophobicContact CB-CZ 4.09Å; A181-F887 HydrophobicContact CB-CD2 3.82Å; A181-F887 HydrophobicContact CB-CE2 4.31Å; M184-F887 HydrophobicContact CB-CE2 4.25Å; M184-F887 HydrophobicContact SD-CE2 4.08Å; M184-F887 HydrophobicContact SD-CZ 3.86Å; F185-F887 HydrophobicContact CE2-CD2 4.07Å; F185-F887 HydrophobicContact CE2-CE2 4.46Å; F185-F887 AromaticContact CZ-CD2 3.89Å; F185-F887 HydrophobicContact CZ-CD2 3.89Å; F185-F887 HydrophobicContact CZ-CE2 4.09Å; Y220-F887 AromaticContact CD1-CD1 3.81Å; Y220-F887 HydrophobicContact CD1-CD1 3.81Å; Y220-F887 AromaticContact CD1-CE1 3.92Å; Y220-F887 HydrophobicContact CD1-CE1 3.92Å; Y220-F887 HydrophobicContact CD2-CD1 4.05Å; Y220-F887 AromaticContact CD2-CE1 3.39Å; Y220-F887 HydrophobicContact CD2-CE1 3.39Å; Y220-F887 HydrophobicContact CD2-CZ 4.32Å; Y220-F887 HydrophobicContact CE1-CD1 4.31Å; Y220-F887 HydrophobicContact CE1-CE1 4.17Å; Y220-F887 AromaticContact CE2-CE1 3.7Å; Y220-F887 HydrophobicContact CE2-CE1 3.7Å; Y220-F887 HydrophobicContact CE2-CZ 4.24Å; Y220-F887 AromaticContact CG-CD1 3.69Å; Y220-F887 HydrophobicContact CG-CD1 3.69Å; Y220-F887 AromaticContact CG-CE1 3.54Å; Y220-F887 HydrophobicContact CG-CE1 3.54Å; S883-F887 WeakPolarHBondContact O-CB 3.16Å; S883-F887 PolarHBondContact O-N 3.22Å; V884-F887 PolarHBondContact O-N 2.63Å; F887-I889 VanDerWaalsContact C-N 3.35Å; F887-I889 PolarHBondContact O-N 3.46Å; F887-F890 PolarHBondContact O-N 2.72Å; F887-A891 HydrophobicContact CE1-CB 4.31Å; F887-A891 HydrophobicContact CE2-CB 4.45Å; F887-A891 HydrophobicContact CZ-CB 4.19Å; F887-A891 VanDerWaalsContact O-CB 3.23Å; F887-A891 WeakPolarHBondContact O-CB 3.15Å; F887-A891 PolarHBondContact O-N 3.35Å; F887-Y931 HydrophobicContact CB-CE2 4.12Å
888	T	91.2	Very high	88.9	Confident	19 Å²	19	28.9 Å²	28.9	12%	0.117	17%	0.166	C	C	.	.	H	α-helix	trans	-60.9	-41.2	-178.4	51.3	0	0	0	0	112.5	I221 V884 T885 A891 F892	I221-T888 HydrophobicContact CG1-CG2 4.04Å; V884-T888 WeakPolarHBondContact O-CG2 3.49Å; V884-T888 PolarHBondContact O-N 2.84Å; V884-T888 PolarHBondContact O-OG1 3.26Å; V884-T888 VanDerWaalsContact O-OG1 3.13Å; T885-T888 WeakPolarHBondContact CA-OG1 3.44Å; T885-T888 PolarHBondContact O-N 2.79Å; T885-T888 PolarHBondContact O-OG1 3.35Å; T888-A891 PolarHBondContact O-N 3.44Å; T888-F892 WeakPolarHBondContact O-CD2 3.4Å; T888-F892 PolarHBondContact O-N 3.37Å; T888-F892 VanDerWaalsContact O-N 3.1Å
889	I	92.4	Very high	89.5	Confident	99 Å²	99	29.5 Å²	29.5	51%	0.508	16%	0.161	S	C	.	.	H	α-helix	trans	-60.8	-48.9	175.6	-66	166.7	0	0	0	110.7	T885 L886 F887 A891 F892 I893	T885-I889 WeakPolarHBondContact O-CG1 3.28Å; T885-I889 PolarHBondContact O-N 3.1Å; L886-I889 PolarHBondContact O-N 2.91Å; F887-I889 VanDerWaalsContact C-N 3.35Å; F887-I889 PolarHBondContact O-N 3.46Å; I889-A891 VanDerWaalsContact C-N 3.34Å; I889-A891 PolarHBondContact O-N 2.86Å; I889-F892 PolarHBondContact O-N 3.49Å; I889-I893 HydrophobicContact CG2-CD1 4.47Å; I889-I893 WeakPolarHBondContact O-CG1 3.28Å; I889-I893 PolarHBondContact O-N 3.44Å
890	F	94.5	Very high	90	Very high	22 Å²	22	33.4 Å²	33.4	10%	0.096	17%	0.173	C	C	.	.	H	α-helix	trans	-69.5	-31.7	-179.6	-67.4	-8.4	0	0	0	112.6	F185 L886 F887 I893 C894 L927 L930	F185-F890 HydrophobicContact CE1-CB 3.92Å; F185-F890 HydrophobicContact CE2-CB 4.03Å; F185-F890 HydrophobicContact CE2-CD2 4.45Å; F185-F890 HydrophobicContact CZ-CB 3.38Å; L886-F890 HydrophobicContact CD1-CD2 4.46Å; L886-F890 HydrophobicContact CD1-CE1 4.01Å; L886-F890 HydrophobicContact CD1-CE2 3.8Å; L886-F890 HydrophobicContact CD1-CZ 3.55Å; L886-F890 HydrophobicContact CD2-CE2 4.34Å; L886-F890 HydrophobicContact CG-CD2 4.29Å; L886-F890 HydrophobicContact CG-CE2 3.87Å; L886-F890 HydrophobicContact CG-CZ 4.16Å; L886-F890 PolarHBondContact O-N 3.49Å; L886-F890 VanDerWaalsContact O-N 3.16Å; F887-F890 PolarHBondContact O-N 2.72Å; F890-I893 HydrophobicContact CD1-CD1 4.18Å; F890-I893 PolarHBondContact O-N 3.05Å; F890-C894 WeakPolarHBondContact O-CB 3.39Å; F890-C894 PolarHBondContact O-N 2.97Å; F890-L927 HydrophobicContact CD1-CD2 3.89Å; F890-L927 HydrophobicContact CD2-CB 4.29Å; F890-L927 HydrophobicContact CD2-CD2 4.27Å; F890-L927 HydrophobicContact CE1-CD2 4.11Å; F890-L927 HydrophobicContact CE2-CD2 4.48Å; F890-L927 WeakPolarHBondContact CE2-O 3.11Å; F890-L927 HydrophobicContact CG-CD2 3.98Å; F890-L927 HydrophobicContact CZ-CD2 4.4Å; F890-L930 HydrophobicContact CE2-CB 4.12Å; F890-L930 HydrophobicContact CZ-CB 4.24Å
891	A	91.1	Very high	90.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.6	-43.2	173.6	0	0	0	0	0	111.6	M184 I217 F887 T888 I889 I893 C894 V895	M184-A891 HydrophobicContact CE-CB 3.69Å; M184-A891 WeakPolarHBondContact CE-O 3.11Å; M184-A891 HydrophobicContact SD-CB 3.55Å; M184-A891 VanDerWaalsContact SD-CB 3.55Å; I217-A891 HydrophobicContact CG1-CB 4.4Å; F887-A891 HydrophobicContact CE1-CB 4.31Å; F887-A891 HydrophobicContact CE2-CB 4.45Å; F887-A891 HydrophobicContact CZ-CB 4.19Å; F887-A891 VanDerWaalsContact O-CB 3.23Å; F887-A891 WeakPolarHBondContact O-CB 3.15Å; F887-A891 PolarHBondContact O-N 3.35Å; T888-A891 PolarHBondContact O-N 3.44Å; I889-A891 VanDerWaalsContact C-N 3.34Å; I889-A891 PolarHBondContact O-N 2.86Å; A891-I893 PolarHBondContact O-N 3.01Å; A891-C894 WeakPolarHBondContact O-CB 3.31Å; A891-C894 PolarHBondContact O-N 3.23Å; A891-V895 WeakPolarHBondContact O-CG2 3.44Å; A891-V895 PolarHBondContact O-N 2.87Å
892	F	91.6	Very high	90.3	Very high	118 Å²	118	37.3 Å²	37.3	52%	0.518	19%	0.186	S	C	.	.	H	α-helix	trans	-61	-42.8	173.2	-84	-69.5	0	0	0	112.3	I217 I221 T888 I889 C894 V895 A896	I217-F892 HydrophobicContact CD1-CD1 4.23Å; I217-F892 HydrophobicContact CD1-CE1 4.17Å; I217-F892 HydrophobicContact CD1-CZ 4.48Å; I217-F892 HydrophobicContact CG2-CD2 4.4Å; I217-F892 HydrophobicContact CG2-CE1 4.39Å; I217-F892 HydrophobicContact CG2-CE2 3.68Å; I217-F892 HydrophobicContact CG2-CZ 3.68Å; I221-F892 HydrophobicContact CD1-CE2 4.39Å; T888-F892 WeakPolarHBondContact O-CD2 3.4Å; T888-F892 PolarHBondContact O-N 3.37Å; T888-F892 VanDerWaalsContact O-N 3.1Å; I889-F892 PolarHBondContact O-N 3.49Å; F892-C894 VanDerWaalsContact C-N 3.32Å; F892-C894 PolarHBondContact O-N 3.04Å; F892-V895 PolarHBondContact O-N 3.18Å; F892-A896 WeakPolarHBondContact O-CB 3.14Å; F892-A896 PolarHBondContact O-N 2.63Å
893	I	93.1	Very high	90	Very high	68 Å²	68	42 Å²	42	35%	0.349	20%	0.203	S	C	.	.	H	α-helix	trans	-61.4	-43	175.9	-63.5	171.2	0	0	0	110.5	I889 F890 A891 A896 T897 L927	I889-I893 HydrophobicContact CG2-CD1 4.47Å; I889-I893 WeakPolarHBondContact O-CG1 3.28Å; I889-I893 PolarHBondContact O-N 3.44Å; F890-I893 HydrophobicContact CD1-CD1 4.18Å; F890-I893 PolarHBondContact O-N 3.05Å; A891-I893 PolarHBondContact O-N 3.01Å; I893-A896 PolarHBondContact O-N 3.34Å; I893-T897 WeakPolarHBondContact O-CB 3.36Å; I893-T897 PolarHBondContact O-N 3.45Å; I893-T897 PolarHBondContact O-OG1 3.3Å; I893-L927 HydrophobicContact CG2-CD1 4.13Å
894	C	91.6	Very high	89.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-52.2	178.6	-176.3	0	0	0	0	111.7	M184 F185 F890 A891 F892 A896 T897 L898 F924	M184-C894 HydrophobicContact CE-CB 4.27Å; F185-C894 HydrophobicContact CD1-CB 4.22Å; F185-C894 HydrophobicContact CE1-CB 4.1Å; F890-C894 WeakPolarHBondContact O-CB 3.39Å; F890-C894 PolarHBondContact O-N 2.97Å; A891-C894 WeakPolarHBondContact O-CB 3.31Å; A891-C894 PolarHBondContact O-N 3.23Å; F892-C894 VanDerWaalsContact C-N 3.32Å; F892-C894 PolarHBondContact O-N 3.04Å; C894-A896 PolarHBondContact O-N 3.42Å; C894-T897 WeakPolarHBondContact O-CB 3.35Å; C894-T897 PolarHBondContact O-N 3.2Å; C894-L898 WeakPolarHBondContact O-CG 3.4Å; C894-L898 PolarHBondContact O-N 3.06Å; C894-F924 HydrophobicContact CB-CE1 4.31Å; C894-F924 HydrophobicContact CB-CZ 4.42Å; C894-F924 VanDerWaalsContact SG-CZ 3.56Å
895	V	88.6	Confident	88.6	Confident	24 Å²	24	55 Å²	55	15%	0.145	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-43.1	178.2	175.9	0	0	0	0	111.2	M184 I217 A891 F892 T897 L898 M899	M184-V895 HydrophobicContact CE-CG2 3.49Å; M184-V895 VanDerWaalsContact CE-CG2 3.49Å; I217-V895 HydrophobicContact CD1-CG2 4.2Å; A891-V895 WeakPolarHBondContact O-CG2 3.44Å; A891-V895 PolarHBondContact O-N 2.87Å; F892-V895 PolarHBondContact O-N 3.18Å; V895-T897 VanDerWaalsContact C-N 3.29Å; V895-T897 PolarHBondContact O-N 3.21Å; V895-L898 PolarHBondContact O-N 3.41Å; V895-M899 HydrophobicContact CG1-CG 4.42Å; V895-M899 WeakPolarHBondContact O-CG 3.36Å; V895-M899 PolarHBondContact O-N 3.28Å
896	A	89.9	Confident	88.2	Confident	60 Å²	60	55.1 Å²	55.1	50%	0.496	27%	0.273	S	S	.	.	H	α-helix	trans	-60.8	-39.3	176.3	0	0	0	0	0	112	F892 I893 C894 M899 Y900	F892-A896 WeakPolarHBondContact O-CB 3.14Å; F892-A896 PolarHBondContact O-N 2.63Å; I893-A896 PolarHBondContact O-N 3.34Å; C894-A896 PolarHBondContact O-N 3.42Å; A896-M899 PolarHBondContact O-N 2.86Å; A896-Y900 WeakPolarHBondContact O-CB 3.16Å; A896-Y900 PolarHBondContact O-N 2.96Å
897	T	91.6	Very high	87.5	Confident	27 Å²	27	55.1 Å²	55.1	17%	0.166	28%	0.278	C	S	.	.	H	α-helix	trans	-66.1	-43.9	176.6	-57.4	0	0	0	0	111.4	I893 C894 V895 M899 Y900 R901 T920 L923 F924	I893-T897 WeakPolarHBondContact O-CB 3.36Å; I893-T897 PolarHBondContact O-N 3.45Å; I893-T897 PolarHBondContact O-OG1 3.3Å; C894-T897 WeakPolarHBondContact O-CB 3.35Å; C894-T897 PolarHBondContact O-N 3.2Å; V895-T897 VanDerWaalsContact C-N 3.29Å; V895-T897 PolarHBondContact O-N 3.21Å; T897-M899 VanDerWaalsContact C-N 3.34Å; T897-M899 PolarHBondContact O-N 3.48Å; T897-Y900 WeakPolarHBondContact O-CB 3.22Å; T897-Y900 PolarHBondContact O-N 3.33Å; T897-R901 WeakPolarHBondContact O-CG 3.44Å; T897-R901 PolarHBondContact O-N 2.98Å; T897-T920 HydrophobicContact CG2-CG2 3.92Å; T897-L923 HydrophobicContact CG2-CD2 4.25Å; T897-F924 HydrophobicContact CG2-CE1 3.92Å; T897-F924 HydrophobicContact CG2-CZ 4.06Å
898	L	88.8	Confident	87.1	Confident	4 Å²	4	55 Å²	55	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-61.2	-43	175.4	-68	175.3	0	0	0	111.6	I188 I840 C894 V895 Y900 R901 F924	I188-L898 HydrophobicContact CD1-CD1 4.3Å; I188-L898 HydrophobicContact CG2-CD1 4.17Å; I188-L898 HydrophobicContact CG2-CD2 3.95Å; I840-L898 HydrophobicContact CG2-CD1 4.47Å; C894-L898 WeakPolarHBondContact O-CG 3.4Å; C894-L898 PolarHBondContact O-N 3.06Å; V895-L898 PolarHBondContact O-N 3.41Å; L898-Y900 VanDerWaalsContact C-N 3.34Å; L898-Y900 PolarHBondContact O-N 3.29Å; L898-R901 PolarHBondContact O-N 2.95Å; L898-F924 HydrophobicContact CD2-CE2 4.22Å; L898-F924 HydrophobicContact CD2-CZ 4.29Å; L898-F924 HydrophobicContact CG-CZ 4.34Å
899	M	86.9	Confident	86.9	Confident	48 Å²	48	54.2 Å²	54.2	24%	0.236	27%	0.272	C	S	.	.	H	α-helix	trans	-66.2	-36	175.6	-66.8	-59.7	95.1	0	0	112.5	F209 F210 V895 A896 T897 R902 E909	F209-M899 HydrophobicContact CD1-CE 4.4Å; F209-M899 HydrophobicContact CE1-CE 3.62Å; F209-M899 HydrophobicContact CE1-SD 4.49Å; F209-M899 HydrophobicContact CZ-CE 4.33Å; F210-M899 HydrophobicContact CE1-SD 3.91Å; F210-M899 HydrophobicContact CZ-SD 3.75Å; V895-M899 HydrophobicContact CG1-CG 4.42Å; V895-M899 WeakPolarHBondContact O-CG 3.36Å; V895-M899 PolarHBondContact O-N 3.28Å; A896-M899 PolarHBondContact O-N 2.86Å; T897-M899 VanDerWaalsContact C-N 3.34Å; T897-M899 PolarHBondContact O-N 3.48Å; M899-R902 VanDerWaalsContact O-CB 3.24Å; M899-R902 WeakPolarHBondContact O-CB 3.29Å; M899-R902 PolarHBondContact O-N 3.3Å; M899-E909 HydrophobicContact CE-CG 4.45Å
900	Y	89.1	Confident	86.8	Confident	116 Å²	116	49.5 Å²	49.5	46%	0.455	25%	0.248	S	C	.	.	H	α-helix	trans	-64.1	-40.5	175.1	-179.9	-95.4	0	0	0	112.1	A896 T897 L898 R902 R903 I906	A896-Y900 WeakPolarHBondContact O-CB 3.16Å; A896-Y900 PolarHBondContact O-N 2.96Å; T897-Y900 WeakPolarHBondContact O-CB 3.22Å; T897-Y900 PolarHBondContact O-N 3.33Å; L898-Y900 VanDerWaalsContact C-N 3.34Å; L898-Y900 PolarHBondContact O-N 3.29Å; Y900-R902 PolarHBondContact O-N 3.48Å; Y900-R902 VanDerWaalsContact O-N 3.16Å; Y900-R903 WeakPolarHBondContact O-CB 3.24Å; Y900-R903 WeakPolarHBondContact O-CG 3.34Å; Y900-R903 PolarHBondContact O-N 3.47Å; Y900-I906 HydrophobicContact CD1-CD1 4.4Å; Y900-I906 HydrophobicContact CE1-CD1 4.18Å
901	R	89.7	Confident	86.5	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.008	24%	0.243	C	C	.	.	H	α-helix	trans	-65.6	-14.9	179	-74.4	-178.5	65.2	177.8	1.6	114.8	T897 L898 R903 I906 E909 G911 T920	T897-R901 WeakPolarHBondContact O-CG 3.44Å; T897-R901 PolarHBondContact O-N 2.98Å; L898-R901 PolarHBondContact O-N 2.95Å; R901-R903 PolarHBondContact O-N 2.87Å; R901-I906 HydrophobicContact CB-CG2 4.1Å; R901-I906 HydrophobicContact CG-CD1 4.17Å; R901-I906 HydrophobicContact CG-CG2 4.27Å; R901-I906 WeakPolarHBondContact O-CB 3.42Å; R901-I906 WeakPolarHBondContact O-CG2 3.26Å; R901-E909 PolarHBondContact NH1-O 2.94Å; R901-E909 PolarHBondContact NH2-O 3.5Å; R901-G911 PolarHBondContact NH2-O 2.99Å; R901-T920 WeakPolarHBondContact CD-OG1 3.2Å; R901-T920 VanDerWaalsContact NH1-CG2 3.26Å
902	R	85.3	Confident	86.3	Confident	94 Å²	94	48.6 Å²	48.6	36%	0.355	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-8.1	175.6	-150.9	166.8	-172.8	-123.7	-23.3	114.1	L206 M899 Y900 E909	L206-R902 VanDerWaalsContact CD1-CZ 3.5Å; L206-R902 VanDerWaalsContact CD2-NH1 3.28Å; M899-R902 VanDerWaalsContact O-CB 3.24Å; M899-R902 WeakPolarHBondContact O-CB 3.29Å; M899-R902 PolarHBondContact O-N 3.3Å; Y900-R902 PolarHBondContact O-N 3.48Å; Y900-R902 VanDerWaalsContact O-N 3.16Å; R902-E909 WeakPolarHBondContact CD-OE1 3.5Å; R902-E909 IonicContact CZ-OE1 2.95Å; R902-E909 IonicContact NE-OE1 3.92Å; R902-E909 PolarHBondContact NE-OE1 3.38Å
903	R	83	Confident	86.2	Confident	128 Å²	128	45.8 Å²	45.8	48%	0.483	24%	0.239	S	C	.	.	S	Bend	trans	-60.8	148.5	174.9	-75.4	-177.9	-179.2	-160.6	2.5	111.6	Y900 R901 E905 I906 G907	Y900-R903 WeakPolarHBondContact O-CB 3.24Å; Y900-R903 WeakPolarHBondContact O-CG 3.34Å; Y900-R903 PolarHBondContact O-N 3.47Å; R901-R903 PolarHBondContact O-N 2.87Å; R903-E905 PolarHBondContact O-N 2.83Å; R903-I906 PolarHBondContact O-N 3.39Å; R903-G907 PolarHBondContact O-N 3.01Å
904	P	73.9	Confident	85.9	Confident	127 Å²	127	50.9 Å²	50.9	83%	0.825	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.7	-177	22.2	-32.6	0	0	0	114.2	I906	P904-I906 VanDerWaalsContact C-N 3.31Å; P904-I906 PolarHBondContact O-N 3.23Å
905	E	75.8	Confident	85.8	Confident	154 Å²	154	56.4 Å²	56.4	72%	0.72	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-26.6	176.7	-64.9	170.2	-173.9	0	0	113.7	R903	R903-E905 PolarHBondContact O-N 2.83Å
906	I	80.1	Confident	85.7	Confident	28 Å²	28	56.2 Å²	56.2	14%	0.144	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-32.3	-178.1	-63.8	167.7	0	0	0	110.5	Y900 R901 R903 P904 G908 A916	Y900-I906 HydrophobicContact CD1-CD1 4.4Å; Y900-I906 HydrophobicContact CE1-CD1 4.18Å; R901-I906 HydrophobicContact CB-CG2 4.1Å; R901-I906 HydrophobicContact CG-CD1 4.17Å; R901-I906 HydrophobicContact CG-CG2 4.27Å; R901-I906 WeakPolarHBondContact O-CB 3.42Å; R901-I906 WeakPolarHBondContact O-CG2 3.26Å; R903-I906 PolarHBondContact O-N 3.39Å; P904-I906 VanDerWaalsContact C-N 3.31Å; P904-I906 PolarHBondContact O-N 3.23Å; I906-G908 PolarHBondContact O-N 3.28Å; I906-A916 HydrophobicContact CG1-CB 4.29Å; I906-A916 HydrophobicContact CG2-CB 4.32Å
907	G	77.9	Confident	85.7	Confident	18 Å²	18	53.9 Å²	53.9	19%	0.186	27%	0.267	C	S	.	.			trans	94.1	-28.3	167.7	0	0	0	0	0	115	K202 R903	K202-G907 WeakPolarHBondContact CE-O 3.29Å; R903-G907 PolarHBondContact O-N 3.01Å
908	G	84.1	Confident	85.7	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.279	C	S	.	.	S	Bend	trans	-170.9	168.8	-179.4	0	0	0	0	0	115	I906	I906-G908 PolarHBondContact O-N 3.28Å
909	E	86.3	Confident	85.9	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	31%	0.308	C	S	.	.	S	Bend	trans	-65.6	-38.3	179.9	-65.8	87.5	164.9	0	0	112.1	R201 K202 V203 I840 M899 R901 R902	R201-E909 PolarHBondContact O-N 3.28Å; K202-E909 WeakPolarHBondContact CA-OE2 3.33Å; V203-E909 HydrophobicContact CG2-CG 4.37Å; V203-E909 PolarHBondContact N-OE2 3.44Å; I840-E909 HydrophobicContact CD1-CB 4.03Å; M899-E909 HydrophobicContact CE-CG 4.45Å; R901-E909 PolarHBondContact NH1-O 2.94Å; R901-E909 PolarHBondContact NH2-O 3.5Å; R902-E909 WeakPolarHBondContact CD-OE1 3.5Å; R902-E909 IonicContact CZ-OE1 2.95Å; R902-E909 IonicContact NE-OE1 3.92Å; R902-E909 PolarHBondContact NE-OE1 3.38Å
910	L	89.9	Confident	86.2	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	151.1	174.3	-51.3	176.7	0	0	0	111.3	C191 V192 V195 T200 R201 A830 A836 S839 I840	C191-L910 HydrophobicContact CB-CD1 4.24Å; C191-L910 HydrophobicContact CB-CD2 3.98Å; V192-L910 HydrophobicContact CG2-CD2 3.6Å; V195-L910 HydrophobicContact CG2-CB 4.01Å; T200-L910 WeakPolarHBondContact CA-O 3.33Å; R201-L910 HydrophobicContact CB-CB 4.16Å; R201-L910 HydrophobicContact CB-CD1 4.49Å; R201-L910 PolarHBondContact N-O 3.14Å; R201-L910 VanDerWaalsContact N-O 3.09Å; R201-L910 PolarHBondContact O-N 3.31Å; A830-L910 HydrophobicContact CB-CD1 4.24Å; A836-L910 HydrophobicContact CB-CD1 3.69Å; A836-L910 HydrophobicContact CB-CG 4.01Å; S839-L910 VanDerWaalsContact OG-CD1 3.26Å; S839-L910 WeakPolarHBondContact OG-CD1 3.23Å; I840-L910 HydrophobicContact CD1-CD1 4.38Å; I840-L910 HydrophobicContact CD1-CD2 3.87Å; I840-L910 HydrophobicContact CD1-CG 4.01Å; I840-L910 HydrophobicContact CG1-CD1 4.32Å; I840-L910 HydrophobicContact CG1-CD2 4.18Å; I840-L910 HydrophobicContact CG1-CG 4.42Å
911	G	88.3	Confident	86.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	73.2	-144.2	-179	0	0	0	0	0	114.2	R901	R901-G911 PolarHBondContact NH2-O 2.99Å
912	G	87.2	Confident	86.7	Confident	4 Å²	4	61 Å²	61	4%	0.041	31%	0.313	C	S	.	.			trans	89.6	-166.1	-178.6	0	0	0	0	0	114	E199	E199-G912 PolarHBondContact O-N 2.77Å
913	P	88.8	Confident	87.2	Confident	59 Å²	59	59.4 Å²	59.4	38%	0.383	31%	0.311	S	S	.	.			trans	-57.6	140.1	-173.9	-23.3	32	0	0	0	112.4	T915 A916 K917	P913-T915 PolarHBondContact O-N 3.34Å; P913-A916 PolarHBondContact O-N 3.25Å; P913-K917 WeakPolarHBondContact O-CB 3.48Å; P913-K917 PolarHBondContact O-N 3.13Å
914	R	87.1	Confident	87.8	Confident	175 Å²	175	53.3 Å²	53.3	66%	0.66	29%	0.288	S	S	*	.	H	α-helix	trans	-48	-41.1	-177.9	-76.7	-174	171.2	176.6	1.2	113.5	D197 V918	D197-R914 VanDerWaalsContact CG-NE 3.33Å; D197-R914 IonicContact OD1-NE 3.06Å; D197-R914 IonicContact OD2-CZ 3.75Å; D197-R914 IonicContact OD2-NE 3.42Å; D197-R914 PolarHBondContact OD2-NE 3.43Å; D197-R914 IonicContact OD2-NH2 2.79Å; D197-R914 PolarHBondContact OD2-NH2 3.25Å; R914-V918 WeakPolarHBondContact O-CB 3.37Å; R914-V918 VanDerWaalsContact O-CG2 3.27Å; R914-V918 WeakPolarHBondContact O-CG2 2.99Å; R914-V918 PolarHBondContact O-N 3.3Å
915	T	88.6	Confident	88.8	Confident	116 Å²	116	50.6 Å²	50.6	71%	0.712	26%	0.263	S	S	*	.	H	α-helix	trans	-65.4	-49.2	179.4	48.4	0	0	0	0	112.5	P913 K917 L919	P913-T915 PolarHBondContact O-N 3.34Å; T915-K917 VanDerWaalsContact C-N 3.33Å; T915-K917 PolarHBondContact O-N 3.24Å; T915-L919 VanDerWaalsContact O-CB 3.26Å; T915-L919 WeakPolarHBondContact O-CB 3.3Å; T915-L919 PolarHBondContact O-N 2.87Å
916	A	88.1	Confident	89.7	Confident	19 Å²	19	45.5 Å²	45.5	16%	0.157	25%	0.245	C	C	.	.	H	α-helix	trans	-65.4	-38.6	178.8	0	0	0	0	0	111.9	I906 P913 T920	I906-A916 HydrophobicContact CG1-CB 4.29Å; I906-A916 HydrophobicContact CG2-CB 4.32Å; P913-A916 PolarHBondContact O-N 3.25Å; A916-T920 WeakPolarHBondContact O-CB 3.5Å; A916-T920 PolarHBondContact O-N 3.27Å; A916-T920 PolarHBondContact O-OG1 2.86Å
917	K	90.1	Very high	90.4	Very high	12 Å²	12	44.7 Å²	44.7	5%	0.052	24%	0.241	C	C	.	.	H	α-helix	trans	-60.9	-53	176.1	178.1	176.8	174.8	-174.1	0	111.9	V192 Y193 V195 D197 P913 T915 T921	V192-K917 HydrophobicContact CG1-CG 4.18Å; V192-K917 WeakPolarHBondContact O-CE 3.23Å; V192-K917 WeakPolarHBondContact O-CG 3.21Å; Y193-K917 HydrophobicContact CD2-CG 4.42Å; Y193-K917 WeakPolarHBondContact O-CE 3.41Å; Y193-K917 PolarHBondContact O-NZ 2.69Å; V195-K917 PolarHBondContact O-NZ 3.18Å; D197-K917 IonicContact OD1-NZ 3.81Å; D197-K917 PolarHBondContact OD1-NZ 3.45Å; P913-K917 WeakPolarHBondContact O-CB 3.48Å; P913-K917 PolarHBondContact O-N 3.13Å; T915-K917 VanDerWaalsContact C-N 3.33Å; T915-K917 PolarHBondContact O-N 3.24Å; K917-T921 WeakPolarHBondContact O-CB 3.27Å; K917-T921 PolarHBondContact O-N 2.92Å; K917-T921 PolarHBondContact O-OG1 3.32Å
918	V	91.4	Very high	91.2	Very high	68 Å²	68	45.7 Å²	45.7	41%	0.412	24%	0.239	S	C	.	.	H	α-helix	trans	-64.6	-43.6	178.3	172	0	0	0	0	111.1	Y193 R914 T920 T921 M922	Y193-V918 HydrophobicContact CE2-CG2 4.42Å; R914-V918 WeakPolarHBondContact O-CB 3.37Å; R914-V918 VanDerWaalsContact O-CG2 3.27Å; R914-V918 WeakPolarHBondContact O-CG2 2.99Å; R914-V918 PolarHBondContact O-N 3.3Å; V918-T920 PolarHBondContact O-N 2.95Å; V918-T921 PolarHBondContact O-N 3.46Å; V918-M922 HydrophobicContact CG1-CG 4.21Å; V918-M922 WeakPolarHBondContact O-CB 3.35Å; V918-M922 VanDerWaalsContact O-CG 3.3Å; V918-M922 WeakPolarHBondContact O-CG 3.46Å; V918-M922 PolarHBondContact O-N 3.24Å
919	L	92.9	Very high	91.7	Very high	123 Å²	123	50.7 Å²	50.7	64%	0.644	27%	0.265	S	S	*	.	H	α-helix	trans	-63.5	-42.9	-179.3	-172.1	139.9	0	0	0	112.1	T915 L923	T915-L919 VanDerWaalsContact O-CB 3.26Å; T915-L919 WeakPolarHBondContact O-CB 3.3Å; T915-L919 PolarHBondContact O-N 2.87Å; L919-L923 WeakPolarHBondContact O-CB 3.09Å; L919-L923 PolarHBondContact O-N 3.22Å
920	T	93.1	Very high	92.1	Very high	7 Å²	7	53.8 Å²	53.8	4%	0.043	28%	0.281	C	S	.	.	H	α-helix	trans	-68	-41.4	177.5	-50.6	0	0	0	0	111.7	T897 R901 A916 V918 L923 F924	T897-T920 HydrophobicContact CG2-CG2 3.92Å; R901-T920 WeakPolarHBondContact CD-OG1 3.2Å; R901-T920 VanDerWaalsContact NH1-CG2 3.26Å; A916-T920 WeakPolarHBondContact O-CB 3.5Å; A916-T920 PolarHBondContact O-N 3.27Å; A916-T920 PolarHBondContact O-OG1 2.86Å; V918-T920 PolarHBondContact O-N 2.95Å; T920-L923 WeakPolarHBondContact O-CB 3.47Å; T920-L923 PolarHBondContact O-N 2.87Å; T920-F924 HydrophobicContact CG2-CD1 4.43Å; T920-F924 HydrophobicContact CG2-CD2 4.31Å; T920-F924 HydrophobicContact CG2-CE1 4.04Å; T920-F924 HydrophobicContact CG2-CE2 3.91Å; T920-F924 HydrophobicContact CG2-CZ 3.77Å; T920-F924 PolarHBondContact O-N 3.49Å
921	T	93.8	Very high	92.3	Very high	15 Å²	15	53.9 Å²	53.9	9%	0.092	28%	0.282	C	S	.	.	H	α-helix	trans	-61.3	-48.8	176.8	-53.9	0	0	0	0	110.5	G189 K917 V918 L923 F924 F925	G189-T921 PolarHBondContact O-OG1 2.87Å; K917-T921 WeakPolarHBondContact O-CB 3.27Å; K917-T921 PolarHBondContact O-N 2.92Å; K917-T921 PolarHBondContact O-OG1 3.32Å; V918-T921 PolarHBondContact O-N 3.46Å; T921-L923 VanDerWaalsContact C-N 3.31Å; T921-L923 PolarHBondContact O-N 3.29Å; T921-F924 PolarHBondContact O-N 2.94Å; T921-F925 HydrophobicContact CG2-CD2 3.77Å; T921-F925 HydrophobicContact CG2-CE2 3.79Å; T921-F925 WeakPolarHBondContact O-CD2 3.35Å; T921-F925 PolarHBondContact O-N 3.24Å
922	M	95	Very high	92.4	Very high	133 Å²	133	55.1 Å²	55.1	66%	0.655	29%	0.288	S	S	*	.	H	α-helix	trans	-59.9	-41.1	177	-75.4	-65.4	-170.5	0	0	112	V918 S926	V918-M922 HydrophobicContact CG1-CG 4.21Å; V918-M922 WeakPolarHBondContact O-CB 3.35Å; V918-M922 VanDerWaalsContact O-CG 3.3Å; V918-M922 WeakPolarHBondContact O-CG 3.46Å; V918-M922 PolarHBondContact O-N 3.24Å; M922-S926 VanDerWaalsContact O-CB 3.22Å; M922-S926 WeakPolarHBondContact O-CB 3.5Å; M922-S926 PolarHBondContact O-N 3.24Å; M922-S926 PolarHBondContact O-OG 3.02Å
923	L	95.6	Very high	92.7	Very high	60 Å²	60	59.1 Å²	59.1	31%	0.314	31%	0.308	S	S	.	.	H	α-helix	trans	-58.6	-51.3	174.8	179.1	66	0	0	0	111.1	T897 L919 T920 T921 S926 L927	T897-L923 HydrophobicContact CG2-CD2 4.25Å; L919-L923 WeakPolarHBondContact O-CB 3.09Å; L919-L923 PolarHBondContact O-N 3.22Å; T920-L923 WeakPolarHBondContact O-CB 3.47Å; T920-L923 PolarHBondContact O-N 2.87Å; T921-L923 VanDerWaalsContact C-N 3.31Å; T921-L923 PolarHBondContact O-N 3.29Å; L923-S926 PolarHBondContact O-N 3.28Å; L923-S926 PolarHBondContact O-OG 3.48Å; L923-L927 HydrophobicContact CG-CD1 4.38Å; L923-L927 WeakPolarHBondContact O-CG 3.17Å; L923-L927 PolarHBondContact O-N 3.46Å
924	F	95.5	Very high	92.8	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-67.9	-41.5	-176	-68.4	-3.7	0	0	0	113.1	F185 I188 C894 T897 L898 T920 T921 S926 L927 W928	F185-F924 VanDerWaalsContact O-CB 3.32Å; F185-F924 WeakPolarHBondContact O-CB 3.35Å; I188-F924 HydrophobicContact CB-CD2 4.47Å; I188-F924 HydrophobicContact CB-CE2 4.41Å; I188-F924 HydrophobicContact CG2-CD2 4.3Å; I188-F924 HydrophobicContact CG2-CE2 3.81Å; C894-F924 HydrophobicContact CB-CE1 4.31Å; C894-F924 HydrophobicContact CB-CZ 4.42Å; C894-F924 VanDerWaalsContact SG-CZ 3.56Å; T897-F924 HydrophobicContact CG2-CE1 3.92Å; T897-F924 HydrophobicContact CG2-CZ 4.06Å; L898-F924 HydrophobicContact CD2-CE2 4.22Å; L898-F924 HydrophobicContact CD2-CZ 4.29Å; L898-F924 HydrophobicContact CG-CZ 4.34Å; T920-F924 HydrophobicContact CG2-CD1 4.43Å; T920-F924 HydrophobicContact CG2-CD2 4.31Å; T920-F924 HydrophobicContact CG2-CE1 4.04Å; T920-F924 HydrophobicContact CG2-CE2 3.91Å; T920-F924 HydrophobicContact CG2-CZ 3.77Å; T920-F924 PolarHBondContact O-N 3.49Å; T921-F924 PolarHBondContact O-N 2.94Å; F924-S926 VanDerWaalsContact C-N 3.28Å; F924-S926 PolarHBondContact O-N 2.92Å; F924-L927 HydrophobicContact CD1-CD1 4.3Å; F924-L927 PolarHBondContact O-N 2.84Å; F924-W928 PolarHBondContact O-N 2.95Å; F924-W928 VanDerWaalsContact O-N 3.09Å
925	F	95.1	Very high	92.9	Very high	70 Å²	70	51.8 Å²	51.8	31%	0.307	28%	0.276	S	S	.	.	H	α-helix	trans	-62	-37.4	172.2	-86.3	-98.6	0	0	0	111.8	V186 T921 W928 L929	V186-F925 HydrophobicContact CG1-CE1 3.85Å; V186-F925 HydrophobicContact CG1-CE2 4.46Å; V186-F925 HydrophobicContact CG1-CZ 3.75Å; T921-F925 HydrophobicContact CG2-CD2 3.77Å; T921-F925 HydrophobicContact CG2-CE2 3.79Å; T921-F925 WeakPolarHBondContact O-CD2 3.35Å; T921-F925 PolarHBondContact O-N 3.24Å; F925-W928 PolarHBondContact O-N 2.99Å; F925-L929 WeakPolarHBondContact O-CG 3.42Å; F925-L929 PolarHBondContact O-N 3.5Å
926	S	95.3	Very high	92.8	Very high	48 Å²	48	47.4 Å²	47.4	34%	0.336	25%	0.25	S	S	.	.	H	α-helix	trans	-66	-39.2	175.8	77.2	0	0	0	0	112.6	M922 L923 F924 W928 L929 L930	M922-S926 VanDerWaalsContact O-CB 3.22Å; M922-S926 WeakPolarHBondContact O-CB 3.5Å; M922-S926 PolarHBondContact O-N 3.24Å; M922-S926 PolarHBondContact O-OG 3.02Å; L923-S926 PolarHBondContact O-N 3.28Å; L923-S926 PolarHBondContact O-OG 3.48Å; F924-S926 VanDerWaalsContact C-N 3.28Å; F924-S926 PolarHBondContact O-N 2.92Å; S926-W928 VanDerWaalsContact C-N 3.33Å; S926-W928 PolarHBondContact O-N 3.1Å; S926-L929 PolarHBondContact O-N 3.01Å; S926-L930 WeakPolarHBondContact O-CB 3.36Å; S926-L930 VanDerWaalsContact O-CG 3.27Å; S926-L930 WeakPolarHBondContact O-CG 3.45Å; S926-L930 PolarHBondContact O-N 3.42Å
927	L	95.3	Very high	92.8	Very high	11 Å²	11	49 Å²	49	6%	0.058	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-40.8	175.5	-70.5	173.8	0	0	0	111.3	F890 I893 L923 F924 L930 Y931	F890-L927 HydrophobicContact CD1-CD2 3.89Å; F890-L927 HydrophobicContact CD2-CB 4.29Å; F890-L927 HydrophobicContact CD2-CD2 4.27Å; F890-L927 HydrophobicContact CE1-CD2 4.11Å; F890-L927 HydrophobicContact CE2-CD2 4.48Å; F890-L927 WeakPolarHBondContact CE2-O 3.11Å; F890-L927 HydrophobicContact CG-CD2 3.98Å; F890-L927 HydrophobicContact CZ-CD2 4.4Å; I893-L927 HydrophobicContact CG2-CD1 4.13Å; L923-L927 HydrophobicContact CG-CD1 4.38Å; L923-L927 WeakPolarHBondContact O-CG 3.17Å; L923-L927 PolarHBondContact O-N 3.46Å; F924-L927 HydrophobicContact CD1-CD1 4.3Å; F924-L927 PolarHBondContact O-N 2.84Å; L927-L930 PolarHBondContact O-N 3.15Å; L927-Y931 WeakPolarHBondContact O-CB 3.41Å; L927-Y931 PolarHBondContact O-N 2.67Å
928	W	94.8	Very high	92.7	Very high	38 Å²	38	49.2 Å²	49.2	14%	0.144	26%	0.257	C	S	.	.	H	α-helix	trans	-65.9	-43.5	175.7	178.7	72.4	0	0	0	112.9	F182 F185 V186 L816 F924 F925 S926 L930 Y931 I932	F182-W928 AromaticContact CD2-CE2 3.79Å; F182-W928 AromaticContact CD2-CZ2 3.8Å; F182-W928 HydrophobicContact CD2-CZ2 3.8Å; F182-W928 AromaticContact CD2-NE1 3.73Å; F182-W928 HydrophobicContact CE2-CZ2 4.17Å; F185-W928 HydrophobicContact CB-CB 4Å; F185-W928 HydrophobicContact CD2-CB 4.25Å; V186-W928 HydrophobicContact CG2-CB 3.87Å; V186-W928 HydrophobicContact CG2-CD2 3.53Å; V186-W928 HydrophobicContact CG2-CE3 3.99Å; V186-W928 HydrophobicContact CG2-CG 3.47Å; V186-W928 VanDerWaalsContact CG2-CG 3.47Å; L816-W928 HydrophobicContact CD1-CH2 4.28Å; L816-W928 HydrophobicContact CD1-CZ2 4.27Å; F924-W928 PolarHBondContact O-N 2.95Å; F924-W928 VanDerWaalsContact O-N 3.09Å; F925-W928 PolarHBondContact O-N 2.99Å; S926-W928 VanDerWaalsContact C-N 3.33Å; S926-W928 PolarHBondContact O-N 3.1Å; W928-L930 PolarHBondContact O-N 3.06Å; W928-Y931 WeakPolarHBondContact O-CB 3.3Å; W928-Y931 PolarHBondContact O-N 3.24Å; W928-I932 HydrophobicContact CD2-CD1 3.93Å; W928-I932 HydrophobicContact CE3-CD1 4.31Å; W928-I932 HydrophobicContact CH2-CD1 3.71Å; W928-I932 HydrophobicContact CZ2-CD1 3.26Å; W928-I932 HydrophobicContact CZ3-CD1 4.21Å; W928-I932 PolarHBondContact O-N 2.85Å
929	L	94.3	Very high	92.3	Very high	106 Å²	106	46 Å²	46	56%	0.555	24%	0.238	S	C	*	.	H	α-helix	trans	-64	-40.5	175.5	-71.5	174.5	0	0	0	112.1	F925 S926 Y931 I932 L933	F925-L929 WeakPolarHBondContact O-CG 3.42Å; F925-L929 PolarHBondContact O-N 3.5Å; S926-L929 PolarHBondContact O-N 3.01Å; L929-Y931 VanDerWaalsContact C-N 3.32Å; L929-I932 PolarHBondContact O-N 2.85Å; L929-L933 VanDerWaalsContact O-CB 3.27Å; L929-L933 WeakPolarHBondContact O-CB 3.43Å; L929-L933 PolarHBondContact O-N 3.04Å
930	L	94.3	Very high	91.9	Very high	66 Å²	66	43.6 Å²	43.6	35%	0.346	22%	0.221	S	C	.	.	H	α-helix	trans	-64.1	-38.9	174.1	-74.2	172	0	0	0	111.6	F890 S926 L927 W928 L933 F934	F890-L930 HydrophobicContact CE2-CB 4.12Å; F890-L930 HydrophobicContact CZ-CB 4.24Å; S926-L930 WeakPolarHBondContact O-CB 3.36Å; S926-L930 VanDerWaalsContact O-CG 3.27Å; S926-L930 WeakPolarHBondContact O-CG 3.45Å; S926-L930 PolarHBondContact O-N 3.42Å; L927-L930 PolarHBondContact O-N 3.15Å; W928-L930 PolarHBondContact O-N 3.06Å; L930-L933 PolarHBondContact O-N 3.25Å; L930-F934 HydrophobicContact CB-CD2 4.34Å; L930-F934 HydrophobicContact CB-CE2 4.23Å; L930-F934 HydrophobicContact CD2-CE2 4.02Å; L930-F934 HydrophobicContact CD2-CZ 4.38Å; L930-F934 WeakPolarHBondContact O-CB 3.42Å; L930-F934 WeakPolarHBondContact O-CD2 3.41Å; L930-F934 WeakPolarHBondContact O-CG 3.32Å; L930-F934 PolarHBondContact O-N 3.47Å
931	Y	93.8	Very high	91.4	Very high	1 Å²	1	46.1 Å²	46.1	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-53.5	174.6	170.1	-99.5	0	0	0	111.2	V177 A181 V811 S883 L886 F887 L927 W928 L929 L933 F934 S935	V177-Y931 WeakPolarHBondContact CG1-OH 3.48Å; A181-Y931 HydrophobicContact CB-CD1 3.75Å; A181-Y931 HydrophobicContact CB-CE1 3.56Å; A181-Y931 HydrophobicContact CB-CE2 4.36Å; A181-Y931 HydrophobicContact CB-CG 4.24Å; V811-Y931 HydrophobicContact CG1-CD1 4.43Å; V811-Y931 HydrophobicContact CG1-CE1 3.65Å; S883-Y931 WeakPolarHBondContact O-CE2 3.04Å; L886-Y931 HydrophobicContact CB-CD2 4.38Å; L886-Y931 HydrophobicContact CD2-CD2 3.88Å; L886-Y931 HydrophobicContact CG-CD2 4.1Å; F887-Y931 HydrophobicContact CB-CE2 4.12Å; L927-Y931 WeakPolarHBondContact O-CB 3.41Å; L927-Y931 PolarHBondContact O-N 2.67Å; W928-Y931 WeakPolarHBondContact O-CB 3.3Å; W928-Y931 PolarHBondContact O-N 3.24Å; L929-Y931 VanDerWaalsContact C-N 3.32Å; Y931-L933 VanDerWaalsContact C-N 3.32Å; Y931-L933 PolarHBondContact O-N 2.98Å; Y931-F934 PolarHBondContact O-N 3.35Å; Y931-S935 WeakPolarHBondContact O-CB 3.37Å; Y931-S935 PolarHBondContact O-N 3.5Å; Y931-S935 PolarHBondContact O-OG 3.09Å
932	I	91.4	Very high	90.9	Very high	26 Å²	26	52.4 Å²	52.4	13%	0.133	27%	0.266	C	S	.	.	H	α-helix	trans	-59.1	-44.7	177.1	-69.8	175.3	0	0	0	111.2	V811 V812 W928 L929 S936	V811-I932 HydrophobicContact CG1-CG1 4.31Å; V812-I932 HydrophobicContact CG2-CD1 4.48Å; V812-I932 HydrophobicContact CG2-CG2 3.75Å; W928-I932 HydrophobicContact CD2-CD1 3.93Å; W928-I932 HydrophobicContact CE3-CD1 4.31Å; W928-I932 HydrophobicContact CH2-CD1 3.71Å; W928-I932 HydrophobicContact CZ2-CD1 3.26Å; W928-I932 HydrophobicContact CZ3-CD1 4.21Å; W928-I932 PolarHBondContact O-N 2.85Å; L929-I932 PolarHBondContact O-N 2.85Å; I932-S936 VanDerWaalsContact O-CB 3.22Å; I932-S936 WeakPolarHBondContact O-CB 3.48Å; I932-S936 PolarHBondContact O-N 2.87Å; I932-S936 PolarHBondContact O-OG 3.15Å
933	L	91.8	Very high	90.3	Very high	88 Å²	88	48.9 Å²	48.9	46%	0.461	25%	0.249	S	C	.	.	H	α-helix	trans	-60.8	-52	-178.3	178.7	63.8	0	0	0	111.3	L929 L930 Y931 S936 L937	L929-L933 VanDerWaalsContact O-CB 3.27Å; L929-L933 WeakPolarHBondContact O-CB 3.43Å; L929-L933 PolarHBondContact O-N 3.04Å; L930-L933 PolarHBondContact O-N 3.25Å; Y931-L933 VanDerWaalsContact C-N 3.32Å; Y931-L933 PolarHBondContact O-N 2.98Å; L933-S936 PolarHBondContact O-N 2.93Å; L933-L937 HydrophobicContact CD1-CD1 4.03Å; L933-L937 HydrophobicContact CD1-CG 4.25Å; L933-L937 HydrophobicContact CG-CD1 3.98Å; L933-L937 WeakPolarHBondContact O-CB 3.43Å; L933-L937 VanDerWaalsContact O-CG 3.24Å; L933-L937 WeakPolarHBondContact O-CG 3.08Å; L933-L937 PolarHBondContact O-N 2.97Å
934	F	91.4	Very high	89.1	Confident	73 Å²	73	54.9 Å²	54.9	32%	0.32	28%	0.275	S	S	.	.	H	α-helix	trans	-69.3	-41.8	-177.8	-70.7	-49	0	0	0	112.2	F882 L886 L930 Y931 S936 L937 E938 I943	F882-F934 HydrophobicContact CE1-CB 4.1Å; F882-F934 WeakPolarHBondContact CE1-O 3.09Å; F882-F934 HydrophobicContact CZ-CB 4.28Å; L886-F934 HydrophobicContact CD1-CD2 4.35Å; L886-F934 HydrophobicContact CD2-CB 3.59Å; L886-F934 HydrophobicContact CD2-CD2 4.21Å; L886-F934 HydrophobicContact CD2-CG 4.39Å; L930-F934 HydrophobicContact CB-CD2 4.34Å; L930-F934 HydrophobicContact CB-CE2 4.23Å; L930-F934 HydrophobicContact CD2-CE2 4.02Å; L930-F934 HydrophobicContact CD2-CZ 4.38Å; L930-F934 WeakPolarHBondContact O-CB 3.42Å; L930-F934 WeakPolarHBondContact O-CD2 3.41Å; L930-F934 WeakPolarHBondContact O-CG 3.32Å; L930-F934 PolarHBondContact O-N 3.47Å; Y931-F934 PolarHBondContact O-N 3.35Å; F934-S936 VanDerWaalsContact C-N 3.28Å; F934-S936 PolarHBondContact O-N 2.89Å; F934-L937 HydrophobicContact CD1-CD1 4.41Å; F934-L937 PolarHBondContact O-N 3.3Å; F934-E938 WeakPolarHBondContact O-CB 3.46Å; F934-E938 PolarHBondContact O-N 3.38Å; F934-I943 HydrophobicContact CD1-CD1 3.87Å; F934-I943 HydrophobicContact CE1-CD1 4.44Å
935	S	88.8	Confident	87.6	Confident	7 Å²	7	56.2 Å²	56.2	5%	0.049	29%	0.29	C	S	.	.	H	α-helix	trans	-60.9	-38	174.1	-70.9	0	0	0	0	111.9	S883 Y931 A939	S883-S935 PolarHBondContact OG-OG 3.46Å; Y931-S935 WeakPolarHBondContact O-CB 3.37Å; Y931-S935 PolarHBondContact O-N 3.5Å; Y931-S935 PolarHBondContact O-OG 3.09Å; S935-A939 VanDerWaalsContact O-CB 3.31Å; S935-A939 WeakPolarHBondContact O-CB 3.22Å; S935-A939 PolarHBondContact O-N 3Å
936	S	88	Confident	85.6	Confident	25 Å²	25	62 Å²	62	18%	0.175	32%	0.315	C	S	.	.	H	α-helix	trans	-69.8	-43.5	175.8	-58.1	0	0	0	0	112.1	I932 L933 F934 E938 A939 Y940	I932-S936 VanDerWaalsContact O-CB 3.22Å; I932-S936 WeakPolarHBondContact O-CB 3.48Å; I932-S936 PolarHBondContact O-N 2.87Å; I932-S936 PolarHBondContact O-OG 3.15Å; L933-S936 PolarHBondContact O-N 2.93Å; F934-S936 VanDerWaalsContact C-N 3.28Å; F934-S936 PolarHBondContact O-N 2.89Å; S936-E938 VanDerWaalsContact C-N 3.31Å; S936-E938 PolarHBondContact O-N 3.04Å; S936-A939 PolarHBondContact O-N 3.12Å; S936-Y940 WeakPolarHBondContact O-CD2 3.14Å; S936-Y940 PolarHBondContact O-N 2.62Å; S936-Y940 VanDerWaalsContact O-N 3.08Å
937	L	88.4	Confident	85.1	Confident	52 Å²	52	62.7 Å²	62.7	27%	0.272	31%	0.314	S	S	.	.	H	α-helix	trans	-63.3	-37.5	179.1	-74.7	172.8	0	0	0	112.3	L933 F934 C941 H942 I943	L933-L937 HydrophobicContact CD1-CD1 4.03Å; L933-L937 HydrophobicContact CD1-CG 4.25Å; L933-L937 HydrophobicContact CG-CD1 3.98Å; L933-L937 WeakPolarHBondContact O-CB 3.43Å; L933-L937 VanDerWaalsContact O-CG 3.24Å; L933-L937 WeakPolarHBondContact O-CG 3.08Å; L933-L937 PolarHBondContact O-N 2.97Å; F934-L937 HydrophobicContact CD1-CD1 4.41Å; F934-L937 PolarHBondContact O-N 3.3Å; L937-C941 PolarHBondContact O-N 3.02Å; L937-H942 HydrophobicContact CB-CB 4.38Å; L937-H942 HydrophobicContact CD2-CB 3.93Å; L937-H942 WeakPolarHBondContact O-CB 3.49Å; L937-H942 PolarHBondContact O-N 3.33Å; L937-I943 HydrophobicContact CB-CD1 3.71Å; L937-I943 HydrophobicContact CB-CG1 4.03Å; L937-I943 HydrophobicContact CD1-CD1 3.88Å; L937-I943 HydrophobicContact CG-CD1 4.46Å; L937-I943 PolarHBondContact O-N 3.02Å
938	E	86.6	Confident	84.6	Confident	16 Å²	16	65.4 Å²	65.4	8%	0.075	33%	0.327	C	S	.	.	H	α-helix	trans	-70.1	-42.7	173.7	-175.3	-80.9	161.9	0	0	111.1	T879 F882 F934 S936 Y940 C941	T879-E938 WeakPolarHBondContact CA-OE2 3.46Å; T879-E938 WeakPolarHBondContact CB-OE2 3.34Å; T879-E938 WeakPolarHBondContact CG2-OE2 3.45Å; F882-E938 HydrophobicContact CB-CG 4.06Å; F882-E938 HydrophobicContact CD1-CB 3.63Å; F882-E938 HydrophobicContact CD1-CG 3.73Å; F882-E938 HydrophobicContact CD2-CG 4.11Å; F882-E938 HydrophobicContact CE1-CB 3.7Å; F882-E938 HydrophobicContact CE1-CG 4.2Å; F882-E938 HydrophobicContact CG-CB 4.11Å; F882-E938 HydrophobicContact CG-CG 3.68Å; F882-E938 HydrophobicContact CZ-CB 4.23Å; F934-E938 WeakPolarHBondContact O-CB 3.46Å; F934-E938 PolarHBondContact O-N 3.38Å; S936-E938 VanDerWaalsContact C-N 3.31Å; S936-E938 PolarHBondContact O-N 3.04Å; E938-Y940 PolarHBondContact O-N 3.18Å; E938-C941 WeakPolarHBondContact O-CA 3.28Å; E938-C941 PolarHBondContact O-N 2.79Å
939	A	83.3	Confident	84	Confident	2 Å²	2	66.9 Å²	66.9	2%	0.017	34%	0.337	C	S	.	.	H	α-helix	trans	-58.7	-34.6	177.5	0	0	0	0	0	112.8	K805 V808 T879 S935 S936 C941	K805-A939 HydrophobicContact CD-CB 4.38Å; K805-A939 WeakPolarHBondContact CD-O 3.24Å; K805-A939 VanDerWaalsContact CE-O 3.24Å; K805-A939 WeakPolarHBondContact CE-O 3.43Å; K805-A939 PolarHBondContact NZ-O 3.15Å; V808-A939 HydrophobicContact CG2-CB 3.64Å; T879-A939 HydrophobicContact CG2-CB 4.12Å; S935-A939 VanDerWaalsContact O-CB 3.31Å; S935-A939 WeakPolarHBondContact O-CB 3.22Å; S935-A939 PolarHBondContact O-N 3Å; S936-A939 PolarHBondContact O-N 3.12Å; A939-C941 VanDerWaalsContact C-N 3.33Å
940	Y	85.6	Confident	83.4	Confident	72 Å²	72	64.6 Å²	64.6	28%	0.282	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	9.6	173.7	-66.4	-71.8	0	0	0	114.2	L804 K805 V808 S936 E938 H942	L804-Y940 WeakPolarHBondContact CA-OH 3.31Å; L804-Y940 WeakPolarHBondContact CD2-OH 2.97Å; K805-Y940 HydrophobicContact CG-CE1 4.21Å; K805-Y940 PolarHBondContact N-OH 3.2Å; V808-Y940 HydrophobicContact CG2-CE2 4.09Å; S936-Y940 WeakPolarHBondContact O-CD2 3.14Å; S936-Y940 PolarHBondContact O-N 2.62Å; S936-Y940 VanDerWaalsContact O-N 3.08Å; E938-Y940 PolarHBondContact O-N 3.18Å; Y940-H942 PolarHBondContact O-N 2.84Å
941	C	81.7	Confident	82.7	Confident	60 Å²	60	64.5 Å²	64.5	41%	0.405	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	28	179	-48.1	0	0	0	0	114.2	C54 L937 E938 A939 I943	C54-C941 HydrophobicContact CB-CB 3.49Å; C54-C941 VanDerWaalsContact CB-CB 3.49Å; C54-C941 WeakPolarHBondContact CB-SG 3.48Å; C54-C941 WeakPolarHBondContact SG-CB 3.23Å; C54-C941 CovalentContact SG-SG 2.02Å; C54-C941 PolarHBondContact SG-SG 3.37Å; L937-C941 PolarHBondContact O-N 3.02Å; E938-C941 WeakPolarHBondContact O-CA 3.28Å; E938-C941 PolarHBondContact O-N 2.79Å; A939-C941 VanDerWaalsContact C-N 3.33Å; C941-I943 VanDerWaalsContact C-N 3.31Å
942	H	83.6	Confident	82	Confident	147 Å²	147	68.7 Å²	68.7	68%	0.681	35%	0.345	S	S	*	.	S	Bend	trans	-73.9	-29.2	168.7	-69.9	-52.6	0	0	0	111.5	L937 Y940	L937-H942 HydrophobicContact CB-CB 4.38Å; L937-H942 HydrophobicContact CD2-CB 3.93Å; L937-H942 WeakPolarHBondContact O-CB 3.49Å; L937-H942 PolarHBondContact O-N 3.33Å; Y940-H942 PolarHBondContact O-N 2.84Å
943	I	82.6	Confident	81.3	Confident	58 Å²	58	71.8 Å²	71.8	30%	0.297	36%	0.36	S	S	.	.	S	Bend	trans	-112.1	138.5	168.9	-61.9	173.2	0	0	0	106.8	F934 L937 C941 G945	F934-I943 HydrophobicContact CD1-CD1 3.87Å; F934-I943 HydrophobicContact CE1-CD1 4.44Å; L937-I943 HydrophobicContact CB-CD1 3.71Å; L937-I943 HydrophobicContact CB-CG1 4.03Å; L937-I943 HydrophobicContact CD1-CD1 3.88Å; L937-I943 HydrophobicContact CG-CD1 4.46Å; L937-I943 PolarHBondContact O-N 3.02Å; C941-I943 VanDerWaalsContact C-N 3.31Å; I943-G945 PolarHBondContact O-N 3.26Å
944	Q	69.5	Low	80.5	Confident	186 Å²	186	70.5 Å²	70.5	87%	0.869	35%	0.352	S	S	*	.			trans	-73.3	112.8	168.6	-76	-172.8	-56	0	0	108.5
945	G	63.5	Low	79.6	Confident	29 Å²	29	70.3 Å²	70.3	30%	0.299	36%	0.355	S	S	.	.			trans	-69.6	-172	163.9	0	0	0	0	0	111.9	I943	I943-G945 PolarHBondContact O-N 3.26Å
946	F	53.5	Low	78.7	Confident	190 Å²	190	76.1 Å²	76.1	83%	0.833	38%	0.382	S	S	*	.			trans	-67.4	0	178.4	-75	-78.2	0	0	0	113.1	T885	T885-F946 HydrophobicContact CG2-CE2 4.12Å

Retrieved 946 of 946 residues in 1380.7 ms (Link to these results)

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