A0A096MR99_PAPAN Loading...

Glutamate receptor

Receptor for glutamate that functions as a ligand-gated ion channel in the central nervous system and plays an important role in excitatory synaptic transmission. L-glutamate acts as an excitatory neurotransmitter at many synapses in the central nervous system.

AlphaFold DB , UniProt , Accession A0A096MR99, Species PAPAN (Papio anubis, Olive baboon), Gene GRIA4, Length 902 aa.

						>A0A096MR99_PAPAN|A0A096MR99|GRIA4
MRIICRQIVLLFSGFWGLAMGAFPSSVQIGGLFIRNTDQEYTAFRLAIFLHNTSPNASEAPFNLVPHVDNIETANSFAVTNAFCSQYSRGVFAIFGLYDKRSVHTLTSFCSALHISLITPSFPTEGESQFVLQLRPSLRGALLSLLDHYEWNCFVFLYDTDRGYSILQAIMEKAGQNGWHVSAICVENFNDVSYRQLLEELDRRQEKKFVIDCEIERLQNILEQIVSVGKHVKGYHYIIANLGFKDISLERFIHGGANVTGFQLVDFNTPMVIKLMDRWKKLDQREYPGSETPPKYTSALTYDGVLVMAETFRSLRRQKIDISRRGNAGDCLANPAAPWGQGIDMERTLKQVRIQGLTGNVQFDHYGRRVNYTMDVFELKSTGPRKVGYWNDMDKLVLIQDVPTLGNDTAAIENRTVVVTTIMESPYVMYKKNHEMFEGNDKYEGYCVDLASEIAKHIGIKYKIAIVPDGKYGARDADTKIWNGMVGELVYGKAEIAIAPLTITLVREEVIDFSKPFMSLGISIMIKKPQKSKPGVFSFLDPLAYEIWMCIVFAYIGVSVVLFLVSRFSPYEWHTEEPEDGKEGPSDQPPNEFGIFNSLWFSLGAFMQQGCDISPRSLSGRIVGGVWWFFTLIIISSYTANLAAFLTVERMVSPIESAEDLAKQTEIAYGTLDSGSTKEFFRRSKIAVYEKMWTYMRSAEPSVFTRTTAEGVARVRKSKGKFAFLLESTMNEYIEQRKPCDTMKVGGNLDSKGYGVATPKGSSLRTPVNLAVLKLSEAGVLDKLKNKWWYDKGECGPKDSGSKDKTSALSLSNVAGVFYILVGGLGLAMLVALIEFCYKSRAEAKRMKLTFSEAIRNKARLSITGSVGENGRVLTPDCPKAVHAGTAIRQSSGLAVIASDLP
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.9	Very low	50.3	Low	235 Å²	235	142.3 Å²	142.3	100%	1.158	69%	0.691	S	S	*	*				0	45.6	0	-150.9	173.7	-170.2	0	0	112.7
2	R	49.2	Very low	49.9	Very low	232 Å²	232	142.5 Å²	142.5	88%	0.875	69%	0.686	S	S	*	*			trans	-136.6	-2.8	176	-95.2	-175.7	177.8	176.9	-0.5	114.5
3	I	49.4	Very low	49.6	Very low	136 Å²	136	137.2 Å²	137.2	70%	0.697	67%	0.673	S	S	*	*	S	Bend	trans	-97.6	-28.8	179.1	-64.3	172.2	0	0	0	111.3
4	I	51.1	Low	49.2	Very low	118 Å²	118	129.7 Å²	129.7	61%	0.605	65%	0.649	S	S	*	*	H	α-helix	trans	-73.7	-30.5	-179.6	-63.3	170.6	0	0	0	112.1	R6 I8	I4-R6 PolarHBondContact O-N 3.07Å; I4-I8 HydrophobicContact CG2-CD1 3.66Å; I4-I8 HydrophobicContact CG2-CG1 4.45Å; I4-I8 WeakPolarHBondContact O-CD1 3.49Å; I4-I8 VanDerWaalsContact O-CG1 3.29Å; I4-I8 WeakPolarHBondContact O-CG1 3.5Å; I4-I8 PolarHBondContact O-N 3.43Å
5	C	47.2	Very low	48.6	Very low	93 Å²	93	132.5 Å²	132.5	63%	0.628	66%	0.656	S	S	*	*	H	α-helix	trans	-73.8	-28.2	-178.7	-151.7	0	0	0	0	112.9	V9	C5-V9 VanDerWaalsContact O-CG2 3.24Å; C5-V9 WeakPolarHBondContact O-CG2 3.47Å; C5-V9 PolarHBondContact O-N 3.02Å
6	R	46.1	Very low	47.9	Very low	202 Å²	202	138 Å²	138	76%	0.762	67%	0.667	S	S	*	*	H	α-helix	trans	-81.9	-30.6	-179.2	-144.8	176.5	-177.4	-163.6	0.1	112.5	I4 L10	I4-R6 PolarHBondContact O-N 3.07Å; R6-L10 PolarHBondContact O-N 3.01Å
7	Q	51.2	Low	47.4	Very low	127 Å²	127	133.4 Å²	133.4	59%	0.593	66%	0.664	S	S	*	*	H	α-helix	trans	-74.6	-34.1	172.7	-80.5	-176.3	-25.2	0	0	112.6	L11	Q7-L11 WeakPolarHBondContact O-CB 3.47Å; Q7-L11 WeakPolarHBondContact O-CD1 3.25Å; Q7-L11 WeakPolarHBondContact O-CG 3.28Å; Q7-L11 PolarHBondContact O-N 2.82Å
8	I	54.3	Low	46.8	Very low	86 Å²	86	134.8 Å²	134.8	44%	0.441	67%	0.673	S	S	.	*	H	α-helix	trans	-71	-36.3	177.3	-67.9	170.3	0	0	0	111.6	I4 L11 F12	I4-I8 HydrophobicContact CG2-CD1 3.66Å; I4-I8 HydrophobicContact CG2-CG1 4.45Å; I4-I8 WeakPolarHBondContact O-CD1 3.49Å; I4-I8 VanDerWaalsContact O-CG1 3.29Å; I4-I8 WeakPolarHBondContact O-CG1 3.5Å; I4-I8 PolarHBondContact O-N 3.43Å; I8-L11 PolarHBondContact O-N 3.38Å; I8-F12 HydrophobicContact CG2-CD2 3.92Å; I8-F12 HydrophobicContact CG2-CE2 4.3Å; I8-F12 WeakPolarHBondContact O-CB 3.37Å; I8-F12 PolarHBondContact O-N 3.33Å
9	V	55	Low	46.4	Very low	94 Å²	94	131.6 Å²	131.6	57%	0.57	67%	0.67	S	S	*	*	H	α-helix	trans	-70.7	-34.7	176.5	174.2	0	0	0	0	112	C5 S13	C5-V9 VanDerWaalsContact O-CG2 3.24Å; C5-V9 WeakPolarHBondContact O-CG2 3.47Å; C5-V9 PolarHBondContact O-N 3.02Å; V9-S13 WeakPolarHBondContact O-CB 3.25Å; V9-S13 PolarHBondContact O-N 3.38Å; V9-S13 PolarHBondContact O-OG 3.32Å
10	L	52.5	Low	46	Very low	122 Å²	122	133.5 Å²	133.5	64%	0.639	68%	0.678	S	S	*	*	H	α-helix	trans	-74.8	-31.2	173.7	-80.9	163.1	0	0	0	113	R6 S13 G14	R6-L10 PolarHBondContact O-N 3.01Å; L10-S13 PolarHBondContact O-OG 3.23Å; L10-G14 PolarHBondContact O-N 3.08Å
11	L	49	Very low	45.7	Very low	120 Å²	120	130.3 Å²	130.3	63%	0.628	68%	0.679	S	S	*	*	H	α-helix	trans	-72.9	-38.3	171.8	-82.6	159.5	0	0	0	111.5	Q7 I8 G14 F15	Q7-L11 WeakPolarHBondContact O-CB 3.47Å; Q7-L11 WeakPolarHBondContact O-CD1 3.25Å; Q7-L11 WeakPolarHBondContact O-CG 3.28Å; Q7-L11 PolarHBondContact O-N 2.82Å; I8-L11 PolarHBondContact O-N 3.38Å; L11-G14 PolarHBondContact O-N 2.7Å; L11-F15 VanDerWaalsContact O-CB 3.25Å; L11-F15 WeakPolarHBondContact O-CB 3.5Å; L11-F15 PolarHBondContact O-N 3.42Å
12	F	45.6	Very low	46	Very low	145 Å²	145	123 Å²	123	64%	0.636	66%	0.655	S	S	*	*	H	α-helix	trans	-71.6	-34.2	176.2	-99.9	-90.8	0	0	0	113.4	I8 W16	I8-F12 HydrophobicContact CG2-CD2 3.92Å; I8-F12 HydrophobicContact CG2-CE2 4.3Å; I8-F12 WeakPolarHBondContact O-CB 3.37Å; I8-F12 PolarHBondContact O-N 3.33Å; F12-W16 PolarHBondContact O-N 3.42Å
13	S	45.8	Very low	46.6	Very low	74 Å²	74	113.5 Å²	113.5	52%	0.517	62%	0.621	S	S	.	*	H	α-helix	trans	-76.5	-31	172.7	61.9	0	0	0	0	112.9	V9 L10 G17	V9-S13 WeakPolarHBondContact O-CB 3.25Å; V9-S13 PolarHBondContact O-N 3.38Å; V9-S13 PolarHBondContact O-OG 3.32Å; L10-S13 PolarHBondContact O-OG 3.23Å; S13-G17 PolarHBondContact O-N 2.9Å
14	G	43.6	Very low	47.5	Very low	32 Å²	32	108.3 Å²	108.3	33%	0.33	60%	0.596	S	S	.	*	H	α-helix	trans	-68.9	-40.2	171.7	0	0	0	0	0	113.2	L10 L11 L18	L10-G14 PolarHBondContact O-N 3.08Å; L11-G14 PolarHBondContact O-N 2.7Å; G14-L18 WeakPolarHBondContact O-CB 3.45Å; G14-L18 WeakPolarHBondContact O-CD1 3.29Å; G14-L18 PolarHBondContact O-N 3.01Å
15	F	39.8	Very low	48.6	Very low	172 Å²	172	107.4 Å²	107.4	75%	0.754	60%	0.6	S	S	*	*	H	α-helix	trans	-79.3	-25.1	-174.2	-142.2	-99.6	0	0	0	113.8	L11	L11-F15 VanDerWaalsContact O-CB 3.25Å; L11-F15 WeakPolarHBondContact O-CB 3.5Å; L11-F15 PolarHBondContact O-N 3.42Å
16	W	38.5	Very low	50.3	Low	220 Å²	220	105.7 Å²	105.7	83%	0.833	59%	0.589	S	S	*	*	H	α-helix	trans	-89.2	-23.8	170.7	-99.5	-6.5	0	0	0	114.3	F12 L18	F12-W16 PolarHBondContact O-N 3.42Å; W16-L18 VanDerWaalsContact C-N 3.32Å
17	G	39.1	Very low	52.3	Low	60 Å²	60	96 Å²	96	62%	0.619	55%	0.553	S	S	*	*	H	α-helix	trans	-73.8	-19.3	173.4	0	0	0	0	0	114.5	S13	S13-G17 PolarHBondContact O-N 2.9Å
18	L	36.8	Very low	54.1	Low	158 Å²	158	93.3 Å²	93.3	83%	0.827	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-0.9	-175.6	-88.7	156.9	0	0	0	114.8	G14 W16	G14-L18 WeakPolarHBondContact O-CB 3.45Å; G14-L18 WeakPolarHBondContact O-CD1 3.29Å; G14-L18 PolarHBondContact O-N 3.01Å; W16-L18 VanDerWaalsContact C-N 3.32Å
19	A	37.7	Very low	56	Low	75 Å²	75	89.2 Å²	89.2	62%	0.62	52%	0.519	S	S	*	.	S	Bend	trans	-107.7	-5.7	-174.4	0	0	0	0	0	115.7
20	M	38.6	Very low	57.7	Low	168 Å²	168	84.8 Å²	84.8	83%	0.828	49%	0.492	S	S	*	.			trans	-142.8	95.8	172.8	-70.2	-152.2	159.3	0	0	111.3	A22	M20-A22 PolarHBondContact O-N 2.91Å; M20-A22 VanDerWaalsContact O-N 3.09Å
21	G	41.4	Very low	59.6	Low	67 Å²	67	79 Å²	79	69%	0.691	46%	0.461	S	S	*	.			trans	-59.8	110.5	161.9	0	0	0	0	0	108.7	F23	G21-F23 PolarHBondContact O-N 3.42Å
22	A	53.8	Low	61.7	Low	81 Å²	81	73.3 Å²	73.3	67%	0.669	43%	0.432	S	S	*	.			trans	-76.5	103.8	-177	0	0	0	0	0	109.5	M20	M20-A22 PolarHBondContact O-N 2.91Å; M20-A22 VanDerWaalsContact O-N 3.09Å
23	F	63.1	Low	63.8	Low	33 Å²	33	66.4 Å²	66.4	15%	0.145	40%	0.402	C	S	.	.			trans	-58.7	134.8	167.8	-166.5	-88.7	0	0	0	109.2	G21 S25 V27 F62 F312 L315 R316 I322	G21-F23 PolarHBondContact O-N 3.42Å; F23-S25 PolarHBondContact O-N 3.26Å; F23-V27 HydrophobicContact CE1-CG2 4.27Å; F23-F62 HydrophobicContact CD1-CD1 4.45Å; F23-F62 AromaticContact CE1-CD1 3.72Å; F23-F62 HydrophobicContact CE1-CD1 3.72Å; F23-F62 HydrophobicContact CE1-CE1 4.31Å; F23-F62 HydrophobicContact CE1-CG 4.23Å; F23-F312 HydrophobicContact CZ-CB 4.31Å; F23-F312 WeakPolarHBondContact CZ-O 3.42Å; F23-L315 HydrophobicContact CE2-CB 4.31Å; F23-R316 HydrophobicContact CB-CG 4.26Å; F23-R316 HydrophobicContact CD1-CB 4.35Å; F23-R316 HydrophobicContact CD1-CG 4.33Å; F23-R316 HydrophobicContact CD2-CB 3.82Å; F23-R316 HydrophobicContact CD2-CG 4.15Å; F23-R316 HydrophobicContact CE1-CB 4.36Å; F23-R316 HydrophobicContact CE2-CB 3.83Å; F23-R316 HydrophobicContact CG-CB 4.08Å; F23-R316 HydrophobicContact CG-CG 3.99Å; F23-R316 HydrophobicContact CZ-CB 4.1Å; F23-I322 HydrophobicContact CD2-CG1 4.31Å; F23-I322 HydrophobicContact CE1-CD1 4.35Å; F23-I322 HydrophobicContact CE2-CD1 3.64Å; F23-I322 HydrophobicContact CE2-CG1 3.83Å; F23-I322 HydrophobicContact CZ-CD1 3.54Å; F23-I322 HydrophobicContact CZ-CG1 4.21Å
24	P	68.3	Low	65.6	Low	28 Å²	28	65.3 Å²	65.3	18%	0.182	39%	0.389	C	S	.	.			trans	-61.8	135.7	-175.2	23.8	-33.1	0	0	0	111.6	S26 I322	P24-S26 VanDerWaalsContact C-N 3.28Å; P24-S26 PolarHBondContact O-N 3.09Å; P24-I322 HydrophobicContact CG-CD1 4.17Å; P24-I322 HydrophobicContact CG-CG1 4.03Å
25	S	74.1	Confident	67.1	Low	98 Å²	98	71.7 Å²	71.7	69%	0.685	40%	0.404	S	S	*	.	S	Bend	trans	-72.5	-21.9	178.4	54.8	0	0	0	0	113.2	F23 N63	F23-S25 PolarHBondContact O-N 3.26Å; S25-N63 PolarHBondContact O-N 3.14Å
26	S	83.1	Confident	68.7	Low	57 Å²	57	70.2 Å²	70.2	40%	0.399	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	131.3	173.4	58.6	0	0	0	0	110.2	P24 N63	P24-S26 VanDerWaalsContact C-N 3.28Å; P24-S26 PolarHBondContact O-N 3.09Å; S26-N63 WeakPolarHBondContact CA-O 3.26Å
27	V	87.1	Confident	70.7	Confident	0 Å²	0	61 Å²	61	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	115.4	-177.7	179.3	0	0	0	0	108.2	F23 I29 F62 N63 L64 V65 F92 F312	F23-V27 HydrophobicContact CE1-CG2 4.27Å; V27-I29 HydrophobicContact CG1-CG2 4.29Å; V27-F62 HydrophobicContact CB-CD2 4.49Å; V27-F62 HydrophobicContact CG2-CB 4.29Å; V27-F62 HydrophobicContact CG2-CD2 3.87Å; V27-F62 HydrophobicContact CG2-CG 4.08Å; V27-N63 PolarHBondContact N-O 2.92Å; V27-L64 HydrophobicContact CB-CD2 4.19Å; V27-L64 HydrophobicContact CG1-CD2 4.32Å; V27-V65 PolarHBondContact O-N 3.01Å; V27-F92 HydrophobicContact CB-CD2 4.5Å; V27-F92 HydrophobicContact CG1-CD2 3.66Å; V27-F92 HydrophobicContact CG1-CE2 4.32Å; V27-F92 HydrophobicContact CG1-CG 4.45Å; V27-F312 HydrophobicContact CG1-CD1 4.02Å; V27-F312 HydrophobicContact CG1-CD2 4Å; V27-F312 HydrophobicContact CG1-CE1 3.67Å; V27-F312 HydrophobicContact CG1-CE2 3.65Å; V27-F312 HydrophobicContact CG1-CG 4.19Å; V27-F312 HydrophobicContact CG1-CZ 3.47Å; V27-F312 VanDerWaalsContact CG1-CZ 3.47Å
28	Q	89.8	Confident	73	Confident	69 Å²	69	62.1 Å²	62.1	32%	0.322	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	122.6	179	-67	176.5	-10.9	0	0	110.4	V65 R89 V91 F92	Q28-V65 WeakPolarHBondContact CA-O 2.98Å; Q28-R89 PolarHBondContact OE1-O 2.95Å; Q28-V91 HydrophobicContact CB-CG1 4.48Å; Q28-F92 WeakPolarHBondContact O-CD2 3.2Å; Q28-F92 PolarHBondContact O-N 3.43Å
29	I	92.4	Very high	75.5	Confident	1 Å²	1	55 Å²	55	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	140.2	177.1	62.3	178	0	0	0	110.1	V27 F44 I48 L64 V65 P66 H67 F312	V27-I29 HydrophobicContact CG1-CG2 4.29Å; I29-F44 HydrophobicContact CD1-CE2 4.48Å; I29-F44 HydrophobicContact CD1-CZ 4.01Å; I29-I48 HydrophobicContact CD1-CD1 3.95Å; I29-L64 HydrophobicContact CD1-CB 4.39Å; I29-L64 HydrophobicContact CG2-CD2 4.4Å; I29-V65 PolarHBondContact N-O 2.95Å; I29-P66 HydrophobicContact CD1-CB 4.4Å; I29-P66 HydrophobicContact CG1-CB 4.12Å; I29-P66 CarbonylContact O-C 3.58Å; I29-P66 WeakPolarHBondContact O-CA 3.35Å; I29-H67 PolarHBondContact O-N 3.47Å; I29-F312 HydrophobicContact CG2-CE2 4.06Å; I29-F312 HydrophobicContact CG2-CZ 4.31Å
30	G	92.7	Very high	78	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	143.8	174.5	0	0	0	0	0	111.2	H67 Q86 A93 I94 F95	G30-H67 CarbonylContact C-O 3.47Å; G30-H67 WeakPolarHBondContact CA-O 3.08Å; G30-Q86 VanDerWaalsContact CA-OE1 3.25Å; G30-A93 PolarHBondContact N-O 2.91Å; G30-I94 CarbonylContact O-C 3.57Å; G30-I94 WeakPolarHBondContact O-CA 3.31Å; G30-F95 PolarHBondContact O-N 3.4Å
31	G	92.3	Very high	80.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	120.5	173.9	0	0	0	0	0	110.7	H67 V68 D69 F95	G31-H67 PolarHBondContact N-O 2.93Å; G31-V68 CarbonylContact O-C 3.59Å; G31-V68 WeakPolarHBondContact O-CA 3.39Å; G31-D69 PolarHBondContact O-N 3.37Å; G31-F95 CarbonylContact C-O 3.58Å; G31-F95 VanDerWaalsContact CA-O 3.3Å; G31-F95 WeakPolarHBondContact CA-O 3.4Å
32	L	91.7	Very high	82.8	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	106.4	175.6	-61.1	175.8	0	0	0	109.2	D69 I71 A82 Q86 I94 F95 G96 L97 L106	L32-D69 HydrophobicContact CD2-CB 4.23Å; L32-I71 HydrophobicContact CD2-CD1 4.19Å; L32-A82 HydrophobicContact CD2-CB 3.75Å; L32-Q86 HydrophobicContact CD2-CG 4.41Å; L32-I94 HydrophobicContact CD1-CG2 3.73Å; L32-I94 HydrophobicContact CG-CG2 3.89Å; L32-F95 PolarHBondContact N-O 3.3Å; L32-G96 WeakPolarHBondContact O-CA 3.22Å; L32-L97 PolarHBondContact O-N 3.46Å; L32-L97 VanDerWaalsContact O-N 3.07Å; L32-L106 HydrophobicContact CD1-CD2 4.12Å
33	F	89.3	Confident	84.6	Confident	1 Å²	1	39.8 Å²	39.8	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	150.1	-178.4	-69.1	-90.5	0	0	0	111.6	Y41 F44 V68 D69 I71 F95 L97	F33-Y41 HydrophobicContact CD1-CD2 4.43Å; F33-Y41 AromaticContact CD2-CD2 3.97Å; F33-Y41 HydrophobicContact CD2-CD2 3.97Å; F33-Y41 HydrophobicContact CE1-CD2 4.43Å; F33-Y41 AromaticContact CE2-CD2 3.97Å; F33-Y41 HydrophobicContact CE2-CD2 3.97Å; F33-Y41 HydrophobicContact CG-CD2 4.2Å; F33-Y41 HydrophobicContact CZ-CD2 4.22Å; F33-F44 HydrophobicContact CE1-CB 4.17Å; F33-F44 HydrophobicContact CE1-CG 4.49Å; F33-F44 AromaticContact CE2-CD1 3.85Å; F33-F44 HydrophobicContact CE2-CD1 3.85Å; F33-F44 HydrophobicContact CE2-CE1 4.1Å; F33-F44 HydrophobicContact CE2-CG 4.11Å; F33-F44 HydrophobicContact CZ-CB 3.61Å; F33-F44 AromaticContact CZ-CD1 3.7Å; F33-F44 HydrophobicContact CZ-CD1 3.7Å; F33-F44 AromaticContact CZ-CD2 3.93Å; F33-F44 HydrophobicContact CZ-CD2 3.93Å; F33-F44 HydrophobicContact CZ-CE1 4.29Å; F33-F44 AromaticContact CZ-CG 3.49Å; F33-F44 HydrophobicContact CZ-CG 3.49Å; F33-F44 VanDerWaalsContact CZ-CG 3.49Å; F33-V68 HydrophobicContact CD2-CG1 3.73Å; F33-V68 HydrophobicContact CE2-CG1 4.26Å; F33-D69 PolarHBondContact N-O 2.91Å; F33-D69 VanDerWaalsContact N-O 3.13Å; F33-I71 PolarHBondContact O-N 3.26Å; F33-F95 HydrophobicContact CE1-CD1 4.13Å; F33-F95 AromaticContact CE1-CE1 3.83Å; F33-F95 HydrophobicContact CE1-CE1 3.83Å; F33-F95 HydrophobicContact CE2-CD1 4.28Å; F33-F95 AromaticContact CZ-CD1 3.61Å; F33-F95 HydrophobicContact CZ-CD1 3.61Å; F33-F95 AromaticContact CZ-CE1 3.75Å; F33-F95 HydrophobicContact CZ-CE1 3.75Å; F33-L97 HydrophobicContact CD1-CD1 4.3Å
34	I	83.9	Confident	86.1	Confident	50 Å²	50	38.2 Å²	38.2	26%	0.256	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	143.7	178	-45.6	-178.1	0	0	0	108.4	N36 T37 I71 T73 L97	I34-N36 PolarHBondContact O-N 3.46Å; I34-T37 HydrophobicContact CB-CG2 3.98Å; I34-T37 HydrophobicContact CG1-CG2 4.46Å; I34-T37 PolarHBondContact N-OG1 2.99Å; I34-T37 PolarHBondContact O-N 3.28Å; I34-T37 PolarHBondContact O-OG1 2.76Å; I34-I71 WeakPolarHBondContact CA-O 3.35Å; I34-T73 HydrophobicContact CD1-CG2 4.22Å; I34-T73 VanDerWaalsContact CD1-OG1 3.23Å; I34-T73 WeakPolarHBondContact CD1-OG1 3.49Å; I34-T73 HydrophobicContact CG1-CG2 3.65Å; I34-T73 WeakPolarHBondContact CG1-OG1 3.39Å; I34-L97 HydrophobicContact CD1-CB 3.86Å; I34-L97 HydrophobicContact CD1-CD1 4.29Å; I34-L97 HydrophobicContact CG1-CB 3.79Å; I34-L97 HydrophobicContact CG1-CD1 4.01Å
35	R	75.4	Confident	87.1	Confident	167 Å²	167	41.2 Å²	41.2	63%	0.63	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	125.5	164.6	-65.5	-178.3	177.4	-176.4	-1.7	108.5	I71	R35-I71 PolarHBondContact N-O 2.9Å
36	N	73.8	Confident	87.9	Confident	141 Å²	141	36.9 Å²	36.9	75%	0.754	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	93.5	0.1	-175.7	-46.5	-20.1	0	0	0	116.8	I34 D38	I34-N36 PolarHBondContact O-N 3.46Å; N36-D38 VanDerWaalsContact C-N 3.35Å; N36-D38 PolarHBondContact O-N 2.99Å
37	T	81.6	Confident	88.3	Confident	25 Å²	25	34.5 Å²	34.5	15%	0.153	16%	0.16	C	C	.	.			trans	-96.5	56.1	172.3	58	0	0	0	0	111.9	I34 Q39 E40 Y41 L97	I34-T37 HydrophobicContact CB-CG2 3.98Å; I34-T37 HydrophobicContact CG1-CG2 4.46Å; I34-T37 PolarHBondContact N-OG1 2.99Å; I34-T37 PolarHBondContact O-N 3.28Å; I34-T37 PolarHBondContact O-OG1 2.76Å; T37-Q39 VanDerWaalsContact C-N 3.34Å; T37-Q39 PolarHBondContact O-N 3.39Å; T37-E40 WeakPolarHBondContact CA-OE2 3.31Å; T37-E40 WeakPolarHBondContact CB-OE2 3.11Å; T37-Y41 PolarHBondContact O-N 2.92Å; T37-L97 HydrophobicContact CG2-CD1 3.98Å
38	D	85.9	Confident	88.4	Confident	85 Å²	85	34.9 Å²	34.9	46%	0.455	16%	0.162	S	C	.	.	H	α-helix	trans	-68	-34.3	-173.9	-66.2	-27.3	0	0	0	112.2	N36 Y41 T42 P288	N36-D38 VanDerWaalsContact C-N 3.35Å; N36-D38 PolarHBondContact O-N 2.99Å; D38-Y41 PolarHBondContact O-N 2.84Å; D38-T42 WeakPolarHBondContact O-CB 3.19Å; D38-T42 PolarHBondContact O-N 3.35Å; D38-T42 PolarHBondContact O-OG1 3.13Å; D38-P288 HydrophobicContact CB-CB 4.31Å; D38-P288 HydrophobicContact CB-CG 4.29Å
39	Q	88.8	Confident	88.4	Confident	9 Å²	9	36.8 Å²	36.8	4%	0.042	17%	0.169	C	C	.	.	H	α-helix	trans	-70.8	-42	-179.1	-161.4	-170.8	59.9	0	0	112	T37 Y41 T42 A43 W279 G289 T292 P293 S298	T37-Q39 VanDerWaalsContact C-N 3.34Å; T37-Q39 PolarHBondContact O-N 3.39Å; Q39-Y41 VanDerWaalsContact C-N 3.33Å; Q39-T42 WeakPolarHBondContact O-CB 3.45Å; Q39-T42 PolarHBondContact O-N 3.21Å; Q39-A43 PolarHBondContact O-N 3.46Å; Q39-W279 HydrophobicContact CG-CH2 4.2Å; Q39-W279 HydrophobicContact CG-CZ2 3.75Å; Q39-G289 PolarHBondContact NE2-O 3.43Å; Q39-T292 PolarHBondContact NE2-O 2.78Å; Q39-T292 PolarHBondContact NE2-OG1 3.25Å; Q39-P293 PolarHBondContact NE2-O 3.31Å; Q39-S298 WeakPolarHBondContact CG-OG 3.09Å; Q39-S298 PolarHBondContact OE1-OG 3.35Å
40	E	90.3	Very high	88.2	Confident	15 Å²	15	38.5 Å²	38.5	7%	0.07	18%	0.178	C	C	.	.	H	α-helix	trans	-62.7	-42.4	175	-68.5	78.8	-178.9	0	0	110.7	T37 A43 F44 T297 T301	T37-E40 WeakPolarHBondContact CA-OE2 3.31Å; T37-E40 WeakPolarHBondContact CB-OE2 3.11Å; E40-A43 PolarHBondContact O-N 3.32Å; E40-F44 PolarHBondContact O-N 2.92Å; E40-T297 WeakPolarHBondContact OE1-CB 3.41Å; E40-T297 PolarHBondContact OE1-OG1 3.28Å; E40-T301 WeakPolarHBondContact O-CG2 3.47Å
41	Y	90.8	Very high	87.9	Confident	53 Å²	53	39.4 Å²	39.4	21%	0.208	18%	0.183	C	C	.	.	H	α-helix	trans	-63.2	-42.4	175.3	179	-122.1	0	0	0	112.3	F33 T37 D38 Q39 A43 F44 R45 V68	F33-Y41 HydrophobicContact CD1-CD2 4.43Å; F33-Y41 AromaticContact CD2-CD2 3.97Å; F33-Y41 HydrophobicContact CD2-CD2 3.97Å; F33-Y41 HydrophobicContact CE1-CD2 4.43Å; F33-Y41 AromaticContact CE2-CD2 3.97Å; F33-Y41 HydrophobicContact CE2-CD2 3.97Å; F33-Y41 HydrophobicContact CG-CD2 4.2Å; F33-Y41 HydrophobicContact CZ-CD2 4.22Å; T37-Y41 PolarHBondContact O-N 2.92Å; D38-Y41 PolarHBondContact O-N 2.84Å; Q39-Y41 VanDerWaalsContact C-N 3.33Å; Y41-A43 PolarHBondContact O-N 2.68Å; Y41-F44 WeakPolarHBondContact O-CB 3.47Å; Y41-F44 PolarHBondContact O-N 2.89Å; Y41-R45 HydrophobicContact CD2-CG 4.41Å; Y41-R45 HydrophobicContact CE1-CG 4.41Å; Y41-R45 HydrophobicContact CE2-CG 3.93Å; Y41-R45 VanDerWaalsContact CZ-CD 3.49Å; Y41-R45 PolarHBondContact O-N 3.46Å; Y41-V68 HydrophobicContact CD2-CG1 4.25Å; Y41-V68 HydrophobicContact CE2-CB 4.21Å; Y41-V68 HydrophobicContact CE2-CG1 3.67Å; Y41-V68 HydrophobicContact CE2-CG2 3.9Å
42	T	91.2	Very high	87.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.1	-45.3	172.9	-77.8	0	0	0	0	111.6	D38 Q39 F44 R45 L46 W279 Y287 P288	D38-T42 WeakPolarHBondContact O-CB 3.19Å; D38-T42 PolarHBondContact O-N 3.35Å; D38-T42 PolarHBondContact O-OG1 3.13Å; Q39-T42 WeakPolarHBondContact O-CB 3.45Å; Q39-T42 PolarHBondContact O-N 3.21Å; T42-F44 VanDerWaalsContact C-N 3.33Å; T42-F44 PolarHBondContact O-N 3.28Å; T42-R45 PolarHBondContact O-N 3.01Å; T42-L46 VanDerWaalsContact O-CB 3.31Å; T42-L46 WeakPolarHBondContact O-CB 3.44Å; T42-L46 PolarHBondContact O-N 3.15Å; T42-W279 HydrophobicContact CG2-CH2 3.59Å; T42-W279 HydrophobicContact CG2-CZ2 4.07Å; T42-W279 HydrophobicContact CG2-CZ3 4.11Å; T42-Y287 HydrophobicContact CG2-CD1 3.87Å; T42-Y287 HydrophobicContact CG2-CG 4.22Å; T42-P288 PolarHBondContact OG1-O 3.45Å
43	A	92	Very high	87.2	Confident	2 Å²	2	45.3 Å²	45.3	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-62.4	-39.6	176.6	0	0	0	0	0	112.4	Q39 E40 Y41 A47 W279 S298	Q39-A43 PolarHBondContact O-N 3.46Å; E40-A43 PolarHBondContact O-N 3.32Å; Y41-A43 PolarHBondContact O-N 2.68Å; A43-A47 WeakPolarHBondContact O-CB 3.22Å; A43-A47 PolarHBondContact O-N 3.48Å; A43-W279 HydrophobicContact CB-CH2 4.08Å; A43-W279 HydrophobicContact CB-CZ3 4.14Å; A43-S298 WeakPolarHBondContact CB-O 3.11Å
44	F	92.8	Very high	86.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.6	-49.6	175.4	-179.5	-105.8	0	0	0	112.1	I29 F33 E40 Y41 T42 L46 A47 I48 P66 V68 F95 T301 V305	I29-F44 HydrophobicContact CD1-CE2 4.48Å; I29-F44 HydrophobicContact CD1-CZ 4.01Å; F33-F44 HydrophobicContact CE1-CB 4.17Å; F33-F44 HydrophobicContact CE1-CG 4.49Å; F33-F44 AromaticContact CE2-CD1 3.85Å; F33-F44 HydrophobicContact CE2-CD1 3.85Å; F33-F44 HydrophobicContact CE2-CE1 4.1Å; F33-F44 HydrophobicContact CE2-CG 4.11Å; F33-F44 HydrophobicContact CZ-CB 3.61Å; F33-F44 AromaticContact CZ-CD1 3.7Å; F33-F44 HydrophobicContact CZ-CD1 3.7Å; F33-F44 AromaticContact CZ-CD2 3.93Å; F33-F44 HydrophobicContact CZ-CD2 3.93Å; F33-F44 HydrophobicContact CZ-CE1 4.29Å; F33-F44 AromaticContact CZ-CG 3.49Å; F33-F44 HydrophobicContact CZ-CG 3.49Å; F33-F44 VanDerWaalsContact CZ-CG 3.49Å; E40-F44 PolarHBondContact O-N 2.92Å; Y41-F44 WeakPolarHBondContact O-CB 3.47Å; Y41-F44 PolarHBondContact O-N 2.89Å; T42-F44 VanDerWaalsContact C-N 3.33Å; T42-F44 PolarHBondContact O-N 3.28Å; F44-L46 PolarHBondContact O-N 2.87Å; F44-A47 PolarHBondContact O-N 3.33Å; F44-I48 HydrophobicContact CD1-CD1 3.89Å; F44-I48 HydrophobicContact CD2-CD1 4.45Å; F44-I48 HydrophobicContact CE1-CD1 3.46Å; F44-I48 VanDerWaalsContact CE1-CD1 3.46Å; F44-I48 HydrophobicContact CE2-CD1 4.07Å; F44-I48 HydrophobicContact CG-CD1 4.37Å; F44-I48 HydrophobicContact CZ-CD1 3.56Å; F44-I48 WeakPolarHBondContact O-CG1 3.38Å; F44-I48 PolarHBondContact O-N 2.82Å; F44-I48 VanDerWaalsContact O-N 3.16Å; F44-P66 HydrophobicContact CE1-CB 3.74Å; F44-P66 HydrophobicContact CZ-CB 4.15Å; F44-V68 HydrophobicContact CE1-CG2 4.1Å; F44-F95 AromaticContact CD2-CD1 3.86Å; F44-F95 HydrophobicContact CD2-CD1 3.86Å; F44-F95 HydrophobicContact CD2-CE1 4.28Å; F44-F95 HydrophobicContact CD2-CG 4.16Å; F44-F95 HydrophobicContact CE2-CB 3.82Å; F44-F95 AromaticContact CE2-CD1 3.94Å; F44-F95 HydrophobicContact CE2-CD1 3.94Å; F44-F95 AromaticContact CE2-CG 3.9Å; F44-F95 HydrophobicContact CE2-CG 3.9Å; F44-F95 HydrophobicContact CZ-CB 4.41Å; F44-T301 HydrophobicContact CB-CG2 3.66Å; F44-T301 HydrophobicContact CD2-CG2 4.3Å; F44-T301 HydrophobicContact CG-CG2 4.48Å; F44-V305 HydrophobicContact CD2-CG2 3.38Å; F44-V305 HydrophobicContact CE2-CG2 3.68Å; F44-V305 HydrophobicContact CG-CG2 4.33Å
45	R	91.1	Very high	85.6	Confident	91 Å²	91	50.8 Å²	50.8	34%	0.343	26%	0.256	S	S	.	.	H	α-helix	trans	-62.5	-43.9	177.9	-70.6	-177.3	75.4	-168.6	-0.7	111.9	Y41 T42 A47 I48 F49 E286 Y287	Y41-R45 HydrophobicContact CD2-CG 4.41Å; Y41-R45 HydrophobicContact CE1-CG 4.41Å; Y41-R45 HydrophobicContact CE2-CG 3.93Å; Y41-R45 VanDerWaalsContact CZ-CD 3.49Å; Y41-R45 PolarHBondContact O-N 3.46Å; T42-R45 PolarHBondContact O-N 3.01Å; R45-A47 PolarHBondContact O-N 3.15Å; R45-I48 PolarHBondContact O-N 3.5Å; R45-F49 WeakPolarHBondContact O-CB 3.31Å; R45-F49 PolarHBondContact O-N 2.9Å; R45-E286 PolarHBondContact NH1-O 2.93Å; R45-Y287 HydrophobicContact CB-CE1 4.18Å
46	L	90.2	Very high	85.3	Confident	7 Å²	7	46.2 Å²	46.2	4%	0.037	25%	0.245	C	C	.	.	H	α-helix	trans	-61.6	-44.1	179	-178.3	65.8	0	0	0	111.4	T42 F44 I48 F49 L50 L275 W279 L282	T42-L46 VanDerWaalsContact O-CB 3.31Å; T42-L46 WeakPolarHBondContact O-CB 3.44Å; T42-L46 PolarHBondContact O-N 3.15Å; F44-L46 PolarHBondContact O-N 2.87Å; L46-I48 VanDerWaalsContact C-N 3.34Å; L46-I48 PolarHBondContact O-N 3.25Å; L46-F49 PolarHBondContact O-N 2.84Å; L46-L50 HydrophobicContact CD1-CD1 4.4Å; L46-L50 HydrophobicContact CD1-CG 4.35Å; L46-L50 HydrophobicContact CG-CD1 4.13Å; L46-L50 HydrophobicContact CG-CG 4.47Å; L46-L50 WeakPolarHBondContact O-CB 3.4Å; L46-L50 VanDerWaalsContact O-CG 3.29Å; L46-L50 WeakPolarHBondContact O-CG 3.28Å; L46-L50 PolarHBondContact O-N 3.29Å; L46-L275 HydrophobicContact CD2-CD1 4.06Å; L46-W279 HydrophobicContact CD2-CE3 3.63Å; L46-W279 HydrophobicContact CD2-CZ3 3.8Å; L46-L282 HydrophobicContact CD1-CD1 4.41Å; L46-L282 HydrophobicContact CD1-CD2 4.03Å; L46-L282 HydrophobicContact CD2-CD1 4.04Å
47	A	90.6	Very high	84.6	Confident	7 Å²	7	43.4 Å²	43.4	6%	0.058	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-42.5	178.3	0	0	0	0	0	112	A43 F44 R45 L50 H51 Y302 V305	A43-A47 WeakPolarHBondContact O-CB 3.22Å; A43-A47 PolarHBondContact O-N 3.48Å; F44-A47 PolarHBondContact O-N 3.33Å; R45-A47 PolarHBondContact O-N 3.15Å; A47-L50 PolarHBondContact O-N 2.9Å; A47-H51 PolarHBondContact O-N 3.49Å; A47-Y302 HydrophobicContact CB-CD2 3.62Å; A47-Y302 HydrophobicContact CB-CE2 3.93Å; A47-Y302 HydrophobicContact CB-CG 4.19Å; A47-V305 HydrophobicContact CB-CB 3.71Å; A47-V305 HydrophobicContact CB-CG1 3.8Å; A47-V305 HydrophobicContact CB-CG2 3.98Å
48	I	90.6	Very high	83.6	Confident	9 Å²	9	46.5 Å²	46.5	5%	0.046	26%	0.264	C	S	.	.	H	α-helix	trans	-64.8	-44.3	176	-68	172.1	0	0	0	111.1	I29 F44 R45 L46 L50 H51 N52 L64 P66 V305	I29-I48 HydrophobicContact CD1-CD1 3.95Å; F44-I48 HydrophobicContact CD1-CD1 3.89Å; F44-I48 HydrophobicContact CD2-CD1 4.45Å; F44-I48 HydrophobicContact CE1-CD1 3.46Å; F44-I48 VanDerWaalsContact CE1-CD1 3.46Å; F44-I48 HydrophobicContact CE2-CD1 4.07Å; F44-I48 HydrophobicContact CG-CD1 4.37Å; F44-I48 HydrophobicContact CZ-CD1 3.56Å; F44-I48 WeakPolarHBondContact O-CG1 3.38Å; F44-I48 PolarHBondContact O-N 2.82Å; F44-I48 VanDerWaalsContact O-N 3.16Å; R45-I48 PolarHBondContact O-N 3.5Å; L46-I48 VanDerWaalsContact C-N 3.34Å; L46-I48 PolarHBondContact O-N 3.25Å; I48-L50 PolarHBondContact O-N 3.47Å; I48-H51 PolarHBondContact O-N 3.24Å; I48-N52 WeakPolarHBondContact O-CB 3.42Å; I48-N52 PolarHBondContact O-N 2.9Å; I48-L64 HydrophobicContact CG2-CB 4.22Å; I48-P66 HydrophobicContact CD1-CB 3.73Å; I48-P66 HydrophobicContact CD1-CG 3.71Å; I48-V305 HydrophobicContact CG1-CG1 3.85Å; I48-V305 HydrophobicContact CG1-CG2 4.45Å
49	F	88.9	Confident	82.3	Confident	108 Å²	108	46.6 Å²	46.6	47%	0.474	26%	0.262	S	S	.	.	H	α-helix	trans	-59.2	-47.1	177.2	176.3	-99.2	0	0	0	111.3	R45 L46 H51 N52 T53	R45-F49 WeakPolarHBondContact O-CB 3.31Å; R45-F49 PolarHBondContact O-N 2.9Å; L46-F49 PolarHBondContact O-N 2.84Å; F49-H51 VanDerWaalsContact C-N 3.32Å; F49-H51 PolarHBondContact O-N 3.13Å; F49-N52 PolarHBondContact O-N 3.13Å; F49-T53 HydrophobicContact CD2-CG2 4.03Å; F49-T53 HydrophobicContact CE1-CG2 4.28Å; F49-T53 HydrophobicContact CE2-CG2 3.68Å; F49-T53 HydrophobicContact CG-CG2 4.48Å; F49-T53 HydrophobicContact CZ-CG2 3.82Å; F49-T53 WeakPolarHBondContact O-CB 3.25Å; F49-T53 WeakPolarHBondContact O-CG2 3.15Å; F49-T53 PolarHBondContact O-N 2.94Å; F49-T53 PolarHBondContact O-OG1 3.41Å
50	L	87.4	Confident	81.1	Confident	37 Å²	37	47.1 Å²	47.1	19%	0.194	27%	0.267	C	S	.	.	H	α-helix	trans	-64.5	-34.9	178.2	-71	176.8	0	0	0	112.9	L46 A47 I48 S54 L275 Y302	L46-L50 HydrophobicContact CD1-CD1 4.4Å; L46-L50 HydrophobicContact CD1-CG 4.35Å; L46-L50 HydrophobicContact CG-CD1 4.13Å; L46-L50 HydrophobicContact CG-CG 4.47Å; L46-L50 WeakPolarHBondContact O-CB 3.4Å; L46-L50 VanDerWaalsContact O-CG 3.29Å; L46-L50 WeakPolarHBondContact O-CG 3.28Å; L46-L50 PolarHBondContact O-N 3.29Å; A47-L50 PolarHBondContact O-N 2.9Å; I48-L50 PolarHBondContact O-N 3.47Å; L50-S54 PolarHBondContact O-N 3.33Å; L50-L275 HydrophobicContact CD1-CD1 4.35Å; L50-Y302 HydrophobicContact CD1-CE2 3.97Å
51	H	86.9	Confident	80	Confident	19 Å²	19	48.1 Å²	48.1	9%	0.088	28%	0.275	C	S	.	.	H	α-helix	trans	-65.9	-53.9	173.5	-179.3	69.8	0	0	0	111.3	A47 I48 F49 T53 S54 E59 A60 F62	A47-H51 PolarHBondContact O-N 3.49Å; I48-H51 PolarHBondContact O-N 3.24Å; F49-H51 VanDerWaalsContact C-N 3.32Å; F49-H51 PolarHBondContact O-N 3.13Å; H51-T53 VanDerWaalsContact C-N 3.26Å; H51-T53 PolarHBondContact O-N 3.18Å; H51-S54 PolarHBondContact O-N 2.91Å; H51-E59 PolarHBondContact CE1-O 3.45Å; H51-A60 VanDerWaalsContact O-CB 3.22Å; H51-A60 WeakPolarHBondContact O-CB 3.33Å; H51-F62 AromaticContact NE2-CE2 3.64Å
52	N	87.7	Confident	79.6	Confident	53 Å²	53	45.7 Å²	45.7	28%	0.283	27%	0.266	S	S	.	.	H	α-helix	trans	-67.5	-24.3	-175.2	-69.4	-13.6	0	0	0	113.3	I48 F49 L64	I48-N52 WeakPolarHBondContact O-CB 3.42Å; I48-N52 PolarHBondContact O-N 2.9Å; F49-N52 PolarHBondContact O-N 3.13Å; N52-L64 PolarHBondContact ND2-O 3.26Å; N52-L64 VanDerWaalsContact ND2-O 3.08Å; N52-L64 PolarHBondContact OD1-N 3.32Å
53	T	83.1	Confident	79.4	Confident	73 Å²	73	49.8 Å²	49.8	45%	0.448	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	3.1	178.8	57.3	0	0	0	0	114	F49 H51	F49-T53 HydrophobicContact CD2-CG2 4.03Å; F49-T53 HydrophobicContact CE1-CG2 4.28Å; F49-T53 HydrophobicContact CE2-CG2 3.68Å; F49-T53 HydrophobicContact CG-CG2 4.48Å; F49-T53 HydrophobicContact CZ-CG2 3.82Å; F49-T53 WeakPolarHBondContact O-CB 3.25Å; F49-T53 WeakPolarHBondContact O-CG2 3.15Å; F49-T53 PolarHBondContact O-N 2.94Å; F49-T53 PolarHBondContact O-OG1 3.41Å; H51-T53 VanDerWaalsContact C-N 3.26Å; H51-T53 PolarHBondContact O-N 3.18Å
54	S	77.7	Confident	79.3	Confident	31 Å²	31	49.8 Å²	49.8	22%	0.217	29%	0.287	C	S	.	.			trans	-63.2	127	178.8	-176	0	0	0	0	110.5	L50 H51 N56 E59	L50-S54 PolarHBondContact O-N 3.33Å; H51-S54 PolarHBondContact O-N 2.91Å; S54-N56 PolarHBondContact O-N 3Å; S54-E59 PolarHBondContact OG-OE2 3.19Å
55	P	61.2	Low	79.2	Confident	134 Å²	134	52.5 Å²	52.5	87%	0.87	30%	0.303	S	S	*	.	S	Bend	trans	-71.3	-11.1	-178.3	29	-34.8	0	0	0	113.1	A57	P55-A57 PolarHBondContact O-N 3.43Å
56	N	68.6	Low	79.2	Confident	72 Å²	72	50.5 Å²	50.5	39%	0.385	30%	0.302	S	S	.	.			trans	-88.7	103.8	-178.2	-161.4	-0.7	0	0	0	109.9	S54 S58 E59 A60	S54-N56 PolarHBondContact O-N 3Å; N56-S58 PolarHBondContact O-N 3.36Å; N56-E59 HydrophobicContact CB-CB 4.08Å; N56-E59 HydrophobicContact CB-CG 4.01Å; N56-E59 PolarHBondContact ND2-OE1 3.32Å; N56-E59 WeakPolarHBondContact O-CA 3.02Å; N56-E59 WeakPolarHBondContact O-CB 3.18Å; N56-E59 PolarHBondContact O-N 3.19Å; N56-A60 PolarHBondContact O-N 3.32Å; N56-A60 VanDerWaalsContact O-N 3.11Å
57	A	59	Low	79.3	Confident	82 Å²	82	52.5 Å²	52.5	68%	0.678	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.4	-178.9	0	0	0	0	0	113.9	P55	P55-A57 PolarHBondContact O-N 3.43Å
58	S	60.7	Low	79.3	Confident	90 Å²	90	54.1 Å²	54.1	63%	0.629	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-24.3	172.4	-62	0	0	0	0	113.3	N56	N56-S58 PolarHBondContact O-N 3.36Å
59	E	59.8	Low	79.3	Confident	87 Å²	87	55.1 Å²	55.1	41%	0.407	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-35.2	178.4	-69.6	172.2	-162.9	0	0	112.1	H51 S54 N56 P61 R313	H51-E59 PolarHBondContact CE1-O 3.45Å; S54-E59 PolarHBondContact OG-OE2 3.19Å; N56-E59 HydrophobicContact CB-CB 4.08Å; N56-E59 HydrophobicContact CB-CG 4.01Å; N56-E59 PolarHBondContact ND2-OE1 3.32Å; N56-E59 WeakPolarHBondContact O-CA 3.02Å; N56-E59 WeakPolarHBondContact O-CB 3.18Å; N56-E59 PolarHBondContact O-N 3.19Å; E59-P61 VanDerWaalsContact O-CD 3.24Å; E59-P61 WeakPolarHBondContact O-CD 3.33Å; E59-R313 PolarHBondContact O-NE 3.07Å; E59-R313 PolarHBondContact O-NH2 3.49Å
60	A	61.9	Low	79.2	Confident	19 Å²	19	54.3 Å²	54.3	16%	0.157	33%	0.327	C	S	.	.			trans	-119.2	69.2	178.1	0	0	0	0	0	112.3	H51 N56 F62	H51-A60 VanDerWaalsContact O-CB 3.22Å; H51-A60 WeakPolarHBondContact O-CB 3.33Å; N56-A60 PolarHBondContact O-N 3.32Å; N56-A60 VanDerWaalsContact O-N 3.11Å; A60-F62 VanDerWaalsContact C-N 3.26Å; A60-F62 PolarHBondContact O-N 3.36Å
61	P	68.4	Low	79.1	Confident	36 Å²	36	53.5 Å²	53.5	23%	0.234	32%	0.322	C	S	.	.	S	Bend	trans	-81.7	-5.5	-174.2	37.2	-38.3	0	0	0	113	E59 R316	E59-P61 VanDerWaalsContact O-CD 3.24Å; E59-P61 WeakPolarHBondContact O-CD 3.33Å; P61-R316 PolarHBondContact O-NH1 3.43Å
62	F	82.1	Confident	78.9	Confident	3 Å²	3	57.9 Å²	57.9	1%	0.013	34%	0.343	C	S	.	.	S	Bend	trans	-146.8	161.3	177	51.5	-99.1	0	0	0	109.4	F23 V27 H51 A60 L64 F312	F23-F62 HydrophobicContact CD1-CD1 4.45Å; F23-F62 AromaticContact CE1-CD1 3.72Å; F23-F62 HydrophobicContact CE1-CD1 3.72Å; F23-F62 HydrophobicContact CE1-CE1 4.31Å; F23-F62 HydrophobicContact CE1-CG 4.23Å; V27-F62 HydrophobicContact CB-CD2 4.49Å; V27-F62 HydrophobicContact CG2-CB 4.29Å; V27-F62 HydrophobicContact CG2-CD2 3.87Å; V27-F62 HydrophobicContact CG2-CG 4.08Å; H51-F62 AromaticContact NE2-CE2 3.64Å; A60-F62 VanDerWaalsContact C-N 3.26Å; A60-F62 PolarHBondContact O-N 3.36Å; F62-L64 HydrophobicContact CD2-CD2 4.22Å; F62-L64 HydrophobicContact CD2-CG 4.5Å; F62-L64 HydrophobicContact CE2-CD2 3.84Å; F62-L64 HydrophobicContact CE2-CG 4.19Å; F62-F312 HydrophobicContact CE1-CB 3.7Å; F62-F312 HydrophobicContact CE2-CB 3.85Å; F62-F312 HydrophobicContact CE2-CD2 4.45Å; F62-F312 HydrophobicContact CE2-CG 4.5Å; F62-F312 HydrophobicContact CZ-CB 3.29Å; F62-F312 HydrophobicContact CZ-CG 4.35Å
63	N	87	Confident	78.1	Confident	86 Å²	86	55.7 Å²	55.7	46%	0.46	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	131.2	175.4	-69.2	-21.5	0	0	0	111.1	S25 S26 V27	S25-N63 PolarHBondContact O-N 3.14Å; S26-N63 WeakPolarHBondContact CA-O 3.26Å; V27-N63 PolarHBondContact N-O 2.92Å
64	L	88.9	Confident	77.7	Confident	2 Å²	2	54 Å²	54	1%	0.01	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	122.5	170.4	-66.4	175.7	0	0	0	109.6	V27 I29 I48 N52 F62 V305 A309 F312	V27-L64 HydrophobicContact CB-CD2 4.19Å; V27-L64 HydrophobicContact CG1-CD2 4.32Å; I29-L64 HydrophobicContact CD1-CB 4.39Å; I29-L64 HydrophobicContact CG2-CD2 4.4Å; I48-L64 HydrophobicContact CG2-CB 4.22Å; N52-L64 PolarHBondContact ND2-O 3.26Å; N52-L64 VanDerWaalsContact ND2-O 3.08Å; N52-L64 PolarHBondContact OD1-N 3.32Å; F62-L64 HydrophobicContact CD2-CD2 4.22Å; F62-L64 HydrophobicContact CD2-CG 4.5Å; F62-L64 HydrophobicContact CE2-CD2 3.84Å; F62-L64 HydrophobicContact CE2-CG 4.19Å; L64-V305 HydrophobicContact CD1-CG1 4.26Å; L64-A309 HydrophobicContact CD1-CB 4.34Å; L64-F312 HydrophobicContact CD2-CD2 4.04Å; L64-F312 HydrophobicContact CD2-CE2 4.2Å
65	V	91	Very high	78.2	Confident	56 Å²	56	56.1 Å²	56.1	34%	0.339	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	104.1	179.2	-177.2	0	0	0	0	108.9	V27 Q28 I29	V27-V65 PolarHBondContact O-N 3.01Å; Q28-V65 WeakPolarHBondContact CA-O 2.98Å; I29-V65 PolarHBondContact N-O 2.95Å
66	P	92.3	Very high	79.5	Confident	50 Å²	50	51.5 Å²	51.5	33%	0.325	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	134.9	-178.5	32	-34.1	0	0	0	112.6	I29 F44 I48 V68	I29-P66 HydrophobicContact CD1-CB 4.4Å; I29-P66 HydrophobicContact CG1-CB 4.12Å; I29-P66 CarbonylContact O-C 3.58Å; I29-P66 WeakPolarHBondContact O-CA 3.35Å; F44-P66 HydrophobicContact CE1-CB 3.74Å; F44-P66 HydrophobicContact CZ-CB 4.15Å; I48-P66 HydrophobicContact CD1-CB 3.73Å; I48-P66 HydrophobicContact CD1-CG 3.71Å; P66-V68 HydrophobicContact CB-CG2 4.22Å
67	H	92.1	Very high	80.5	Confident	49 Å²	49	55.5 Å²	55.5	23%	0.227	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	107	166.2	-68.8	-62.6	0	0	0	109.2	I29 G30 G31 Q86	I29-H67 PolarHBondContact O-N 3.47Å; G30-H67 CarbonylContact C-O 3.47Å; G30-H67 WeakPolarHBondContact CA-O 3.08Å; G31-H67 PolarHBondContact N-O 2.93Å; H67-Q86 PolarHBondContact O-NE2 3.48Å
68	V	90.4	Very high	82	Confident	41 Å²	41	53 Å²	53	25%	0.248	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129.3	-170.4	177.4	0	0	0	0	110.7	G31 F33 Y41 F44 P66	G31-V68 CarbonylContact O-C 3.59Å; G31-V68 WeakPolarHBondContact O-CA 3.39Å; F33-V68 HydrophobicContact CD2-CG1 3.73Å; F33-V68 HydrophobicContact CE2-CG1 4.26Å; Y41-V68 HydrophobicContact CD2-CG1 4.25Å; Y41-V68 HydrophobicContact CE2-CB 4.21Å; Y41-V68 HydrophobicContact CE2-CG1 3.67Å; Y41-V68 HydrophobicContact CE2-CG2 3.9Å; F44-V68 HydrophobicContact CE1-CG2 4.1Å; P66-V68 HydrophobicContact CB-CG2 4.22Å
69	D	89.3	Confident	83.4	Confident	30 Å²	30	48.7 Å²	48.7	16%	0.16	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.7	169.9	-64.6	-40.1	0	0	0	109.7	G31 L32 F33 I71 A82 Q86	G31-D69 PolarHBondContact O-N 3.37Å; L32-D69 HydrophobicContact CD2-CB 4.23Å; F33-D69 PolarHBondContact N-O 2.91Å; F33-D69 VanDerWaalsContact N-O 3.13Å; D69-I71 HydrophobicContact CB-CG2 4.27Å; D69-A82 HydrophobicContact CB-CB 4.31Å; D69-Q86 PolarHBondContact OD2-NE2 2.99Å
70	N	86.9	Confident	84.9	Confident	91 Å²	91	46.1 Å²	46.1	49%	0.487	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	107.7	175.1	-72.1	-14.3	0	0	0	109.4
71	I	87.3	Confident	86.4	Confident	19 Å²	19	50.2 Å²	50.2	10%	0.097	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	164.2	-171.8	59.7	171.1	0	0	0	112	L32 F33 I34 R35 D69 T73 V79 A82	L32-I71 HydrophobicContact CD2-CD1 4.19Å; F33-I71 PolarHBondContact O-N 3.26Å; I34-I71 WeakPolarHBondContact CA-O 3.35Å; R35-I71 PolarHBondContact N-O 2.9Å; D69-I71 HydrophobicContact CB-CG2 4.27Å; I71-T73 HydrophobicContact CD1-CG2 4.33Å; I71-T73 HydrophobicContact CG1-CG2 4.21Å; I71-V79 HydrophobicContact CD1-CB 4.3Å; I71-V79 HydrophobicContact CD1-CG2 3.81Å; I71-A82 HydrophobicContact CD1-CB 4.03Å; I71-A82 HydrophobicContact CG2-CB 3.84Å
72	E	81.8	Confident	87.4	Confident	111 Å²	111	48.9 Å²	48.9	52%	0.519	27%	0.269	S	S	.	.			trans	-92.4	104.8	168.4	-171.9	176.3	-177.1	0	0	108.3	A74 N75	E72-A74 HydrophobicContact CG-CB 4.43Å; E72-A74 PolarHBondContact O-N 3.36Å; E72-N75 PolarHBondContact O-N 3.1Å; E72-N75 VanDerWaalsContact O-N 3.16Å
73	T	70.9	Confident	87.9	Confident	7 Å²	7	48.8 Å²	48.8	4%	0.043	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-14.3	-174	46.9	0	0	0	0	114	I34 I71 N75 V79 S102	I34-T73 HydrophobicContact CD1-CG2 4.22Å; I34-T73 VanDerWaalsContact CD1-OG1 3.23Å; I34-T73 WeakPolarHBondContact CD1-OG1 3.49Å; I34-T73 HydrophobicContact CG1-CG2 3.65Å; I34-T73 WeakPolarHBondContact CG1-OG1 3.39Å; I71-T73 HydrophobicContact CD1-CG2 4.33Å; I71-T73 HydrophobicContact CG1-CG2 4.21Å; T73-N75 PolarHBondContact O-N 3.34Å; T73-V79 HydrophobicContact CG2-CG2 4.43Å; T73-S102 WeakPolarHBondContact O-CB 3.36Å; T73-S102 PolarHBondContact O-OG 2.88Å
74	A	74.9	Confident	88.1	Confident	38 Å²	38	45.4 Å²	45.4	31%	0.314	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-24.2	170.4	0	0	0	0	0	112.2	E72	E72-A74 HydrophobicContact CG-CB 4.43Å; E72-A74 PolarHBondContact O-N 3.36Å
75	N	87	Confident	88.3	Confident	76 Å²	76	46.8 Å²	46.8	41%	0.406	26%	0.261	S	S	.	.			trans	-96.1	98.7	178.5	-173.7	-13.3	0	0	0	111	E72 T73 F77 A78 V79	E72-N75 PolarHBondContact O-N 3.1Å; E72-N75 VanDerWaalsContact O-N 3.16Å; T73-N75 PolarHBondContact O-N 3.34Å; N75-F77 PolarHBondContact O-N 2.92Å; N75-F77 VanDerWaalsContact O-N 3.09Å; N75-F77 WeakPolarHBondContact OD1-CB 3.39Å; N75-F77 PolarHBondContact OD1-N 3.47Å; N75-A78 HydrophobicContact CB-CB 4.1Å; N75-A78 WeakPolarHBondContact O-CB 3.16Å; N75-A78 PolarHBondContact O-N 2.76Å; N75-V79 PolarHBondContact O-N 2.86Å; N75-V79 VanDerWaalsContact O-N 3.15Å
76	S	88.9	Confident	88.3	Confident	36 Å²	36	44.1 Å²	44.1	25%	0.252	25%	0.245	S	C	.	.	H	α-helix	trans	-55.6	-27.8	178.8	-65.4	0	0	0	0	114.3	T80 R101	S76-T80 WeakPolarHBondContact O-CB 3.3Å; S76-T80 PolarHBondContact O-N 3.17Å; S76-T80 PolarHBondContact O-OG1 3.41Å; S76-R101 PolarHBondContact OG-O 3.34Å; S76-R101 VanDerWaalsContact OG-O 3.06Å
77	F	90.1	Very high	88.1	Confident	157 Å²	157	42.1 Å²	42.1	69%	0.689	23%	0.231	S	C	*	.	H	α-helix	trans	-70.6	-42.2	176	-179	-99.2	0	0	0	111.8	N75 V79 T80 N81	N75-F77 PolarHBondContact O-N 2.92Å; N75-F77 VanDerWaalsContact O-N 3.09Å; N75-F77 WeakPolarHBondContact OD1-CB 3.39Å; N75-F77 PolarHBondContact OD1-N 3.47Å; F77-V79 VanDerWaalsContact C-N 3.32Å; F77-V79 PolarHBondContact O-N 3.06Å; F77-T80 WeakPolarHBondContact O-CB 3.36Å; F77-T80 PolarHBondContact O-N 2.91Å; F77-N81 PolarHBondContact O-N 3.38Å
78	A	89.7	Confident	87.9	Confident	28 Å²	28	42.7 Å²	42.7	23%	0.231	24%	0.241	C	C	.	.	H	α-helix	trans	-63.1	-41.3	176.1	0	0	0	0	0	111.2	N75 T80 N81 A82	N75-A78 HydrophobicContact CB-CB 4.1Å; N75-A78 WeakPolarHBondContact O-CB 3.16Å; N75-A78 PolarHBondContact O-N 2.76Å; A78-T80 VanDerWaalsContact C-N 3.34Å; A78-N81 PolarHBondContact O-N 2.98Å; A78-A82 WeakPolarHBondContact O-CB 3.44Å; A78-A82 PolarHBondContact O-N 2.95Å
79	V	91.2	Very high	87.8	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	25%	0.25	C	C	.	.	H	α-helix	trans	-60.9	-43	173.8	177	0	0	0	0	111.3	I71 T73 N75 F77 A82 F83 L106	I71-V79 HydrophobicContact CD1-CB 4.3Å; I71-V79 HydrophobicContact CD1-CG2 3.81Å; T73-V79 HydrophobicContact CG2-CG2 4.43Å; N75-V79 PolarHBondContact O-N 2.86Å; N75-V79 VanDerWaalsContact O-N 3.15Å; F77-V79 VanDerWaalsContact C-N 3.32Å; F77-V79 PolarHBondContact O-N 3.06Å; V79-A82 PolarHBondContact O-N 3.25Å; V79-F83 VanDerWaalsContact O-CB 3.31Å; V79-F83 WeakPolarHBondContact O-CB 3.47Å; V79-F83 PolarHBondContact O-N 3.38Å; V79-L106 HydrophobicContact CG1-CD1 4.06Å; V79-L106 HydrophobicContact CG1-CD2 3.52Å; V79-L106 HydrophobicContact CG1-CG 3.6Å
80	T	91.7	Very high	87.7	Confident	32 Å²	32	45.4 Å²	45.4	20%	0.196	25%	0.248	C	C	.	.	H	α-helix	trans	-61.1	-49.2	177.3	-58.1	0	0	0	0	111.3	S76 F77 A78 A82 F83 C84 T105 F109	S76-T80 WeakPolarHBondContact O-CB 3.3Å; S76-T80 PolarHBondContact O-N 3.17Å; S76-T80 PolarHBondContact O-OG1 3.41Å; F77-T80 WeakPolarHBondContact O-CB 3.36Å; F77-T80 PolarHBondContact O-N 2.91Å; A78-T80 VanDerWaalsContact C-N 3.34Å; T80-A82 PolarHBondContact O-N 3.28Å; T80-F83 PolarHBondContact O-N 3.02Å; T80-C84 WeakPolarHBondContact O-CB 3.28Å; T80-C84 PolarHBondContact O-N 3.07Å; T80-C84 PolarHBondContact O-SG 3.42Å; T80-T105 WeakPolarHBondContact OG1-CG2 3.27Å; T80-F109 HydrophobicContact CG2-CE2 3.74Å; T80-F109 HydrophobicContact CG2-CZ 3.65Å
81	N	91.6	Very high	87.9	Confident	105 Å²	105	41 Å²	41	56%	0.561	23%	0.225	S	C	*	.	H	α-helix	trans	-63	-42.5	180	-170.4	21	0	0	0	112.1	F77 A78 C84 S85	F77-N81 PolarHBondContact O-N 3.38Å; A78-N81 PolarHBondContact O-N 2.98Å; N81-C84 PolarHBondContact O-N 2.6Å; N81-S85 WeakPolarHBondContact O-CB 3.49Å; N81-S85 PolarHBondContact O-N 3.23Å
82	A	91.3	Very high	88	Confident	8 Å²	8	40.9 Å²	40.9	7%	0.066	22%	0.224	C	C	.	.	H	α-helix	trans	-64.9	-43.1	176.2	0	0	0	0	0	112	L32 D69 I71 A78 V79 T80 C84 S85 Q86	L32-A82 HydrophobicContact CD2-CB 3.75Å; D69-A82 HydrophobicContact CB-CB 4.31Å; I71-A82 HydrophobicContact CD1-CB 4.03Å; I71-A82 HydrophobicContact CG2-CB 3.84Å; A78-A82 WeakPolarHBondContact O-CB 3.44Å; A78-A82 PolarHBondContact O-N 2.95Å; V79-A82 PolarHBondContact O-N 3.25Å; T80-A82 PolarHBondContact O-N 3.28Å; A82-C84 VanDerWaalsContact C-N 3.33Å; A82-C84 PolarHBondContact O-N 3.32Å; A82-S85 WeakPolarHBondContact O-CB 3.19Å; A82-S85 PolarHBondContact O-N 2.83Å; A82-Q86 VanDerWaalsContact O-CG 3.29Å; A82-Q86 WeakPolarHBondContact O-CG 3.38Å; A82-Q86 PolarHBondContact O-N 2.93Å
83	F	92.4	Very high	88.5	Confident	1 Å²	1	35.6 Å²	35.6	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-58.3	-46.3	174.5	-175.3	-80.3	0	0	0	111.4	V79 T80 Q86 Y87 I94 L106 F109 L113 I115	V79-F83 VanDerWaalsContact O-CB 3.31Å; V79-F83 WeakPolarHBondContact O-CB 3.47Å; V79-F83 PolarHBondContact O-N 3.38Å; T80-F83 PolarHBondContact O-N 3.02Å; F83-Q86 PolarHBondContact O-N 2.78Å; F83-Y87 WeakPolarHBondContact O-CB 3.44Å; F83-Y87 PolarHBondContact O-N 3.46Å; F83-I94 HydrophobicContact CD2-CD1 3.76Å; F83-I94 HydrophobicContact CE2-CD1 3.6Å; F83-I94 HydrophobicContact CZ-CD1 4.28Å; F83-L106 HydrophobicContact CD2-CD2 3.85Å; F83-F109 HydrophobicContact CD1-CB 3.99Å; F83-F109 HydrophobicContact CD1-CD1 4.22Å; F83-F109 HydrophobicContact CD1-CG 4.14Å; F83-F109 HydrophobicContact CD2-CB 4.4Å; F83-F109 HydrophobicContact CE1-CB 3.76Å; F83-F109 HydrophobicContact CE1-CD1 4.26Å; F83-F109 HydrophobicContact CE1-CG 4.26Å; F83-F109 HydrophobicContact CE2-CB 4.13Å; F83-F109 HydrophobicContact CG-CB 4.33Å; F83-F109 HydrophobicContact CZ-CB 3.81Å; F83-L113 HydrophobicContact CE1-CD1 3.61Å; F83-L113 HydrophobicContact CZ-CD1 4.34Å; F83-I115 HydrophobicContact CZ-CB 4.46Å
84	C	91.2	Very high	89.6	Confident	16 Å²	16	35.3 Å²	35.3	11%	0.108	20%	0.197	C	C	.	.	H	α-helix	trans	-64	-39.7	177.4	-69	0	0	0	0	113	T80 N81 A82 Y87 S88 C331	T80-C84 WeakPolarHBondContact O-CB 3.28Å; T80-C84 PolarHBondContact O-N 3.07Å; T80-C84 PolarHBondContact O-SG 3.42Å; N81-C84 PolarHBondContact O-N 2.6Å; A82-C84 VanDerWaalsContact C-N 3.33Å; A82-C84 PolarHBondContact O-N 3.32Å; C84-Y87 PolarHBondContact O-N 3.47Å; C84-S88 WeakPolarHBondContact O-CB 3.49Å; C84-S88 PolarHBondContact O-N 3.36Å; C84-S88 PolarHBondContact O-OG 3.06Å; C84-C331 HydrophobicContact CB-CB 3.79Å; C84-C331 WeakPolarHBondContact CB-SG 3.3Å; C84-C331 WeakPolarHBondContact SG-CB 3.41Å; C84-C331 CovalentContact SG-SG 2.01Å; C84-C331 PolarHBondContact SG-SG 3.45Å
85	S	91.8	Very high	90.5	Very high	30 Å²	30	33.5 Å²	33.5	21%	0.21	18%	0.182	C	C	.	.	H	α-helix	trans	-57.2	-49.9	171	168.9	0	0	0	0	110.9	N81 A82 Y87 S88 R89	N81-S85 WeakPolarHBondContact O-CB 3.49Å; N81-S85 PolarHBondContact O-N 3.23Å; A82-S85 WeakPolarHBondContact O-CB 3.19Å; A82-S85 PolarHBondContact O-N 2.83Å; S85-Y87 PolarHBondContact O-N 2.99Å; S85-S88 PolarHBondContact O-N 3.01Å; S85-S88 PolarHBondContact O-OG 2.58Å; S85-R89 VanDerWaalsContact O-CG 3.29Å; S85-R89 WeakPolarHBondContact O-CG 3.33Å; S85-R89 PolarHBondContact O-N 3.1Å; S85-R89 VanDerWaalsContact O-N 3.1Å; S85-R89 PolarHBondContact OG-NE 3.15Å
86	Q	90.7	Very high	90.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64	-41.6	178.2	-65.8	-67.1	-19.6	0	0	112.3	G30 L32 H67 D69 A82 F83 R89 G90 V91 I94	G30-Q86 VanDerWaalsContact CA-OE1 3.25Å; L32-Q86 HydrophobicContact CD2-CG 4.41Å; H67-Q86 PolarHBondContact O-NE2 3.48Å; D69-Q86 PolarHBondContact OD2-NE2 2.99Å; A82-Q86 VanDerWaalsContact O-CG 3.29Å; A82-Q86 WeakPolarHBondContact O-CG 3.38Å; A82-Q86 PolarHBondContact O-N 2.93Å; F83-Q86 PolarHBondContact O-N 2.78Å; Q86-R89 PolarHBondContact O-N 2.81Å; Q86-G90 PolarHBondContact O-N 2.86Å; Q86-V91 HydrophobicContact CB-CG2 4.04Å; Q86-V91 WeakPolarHBondContact O-CG2 3.47Å; Q86-V91 PolarHBondContact O-N 3.23Å; Q86-I94 HydrophobicContact CB-CD1 4.17Å
87	Y	89.7	Confident	90.7	Very high	8 Å²	8	28.8 Å²	28.8	3%	0.031	15%	0.154	C	C	.	.	H	α-helix	trans	-58.1	-50.9	175.4	-176.1	-93.3	0	0	0	111.2	F83 C84 S85 R89 G90 L113 I115 A328 C331 A337	F83-Y87 WeakPolarHBondContact O-CB 3.44Å; F83-Y87 PolarHBondContact O-N 3.46Å; C84-Y87 PolarHBondContact O-N 3.47Å; S85-Y87 PolarHBondContact O-N 2.99Å; Y87-R89 VanDerWaalsContact C-N 3.27Å; Y87-R89 PolarHBondContact O-N 3.45Å; Y87-G90 PolarHBondContact O-N 2.91Å; Y87-L113 HydrophobicContact CD2-CB 4.25Å; Y87-L113 HydrophobicContact CD2-CD1 3.9Å; Y87-L113 HydrophobicContact CD2-CG 4.49Å; Y87-L113 HydrophobicContact CE2-CB 3.84Å; Y87-L113 HydrophobicContact CE2-CD1 4.02Å; Y87-L113 HydrophobicContact CE2-CD2 3.95Å; Y87-L113 HydrophobicContact CE2-CG 4.15Å; Y87-L113 HydrophobicContact CG-CD1 4.42Å; Y87-I115 HydrophobicContact CD2-CD1 3.36Å; Y87-I115 HydrophobicContact CD2-CG1 4.32Å; Y87-I115 HydrophobicContact CE2-CD1 3.88Å; Y87-I115 HydrophobicContact CE2-CG1 4.47Å; Y87-I115 HydrophobicContact CG-CD1 4.42Å; Y87-A328 HydrophobicContact CD1-CB 3.93Å; Y87-A328 HydrophobicContact CE1-CB 3.65Å; Y87-A328 WeakPolarHBondContact CE1-O 3.49Å; Y87-A328 WeakPolarHBondContact O-CB 3.32Å; Y87-C331 HydrophobicContact CD1-CB 4.15Å; Y87-C331 HydrophobicContact CG-CB 4.35Å; Y87-A337 PolarHBondContact OH-O 3.07Å
88	S	87.9	Confident	90.6	Very high	62 Å²	62	21.7 Å²	21.7	43%	0.434	12%	0.123	S	C	.	.	H	α-helix	trans	-62	-33.1	-179.5	72.8	0	0	0	0	113.1	C84 S85 G90	C84-S88 WeakPolarHBondContact O-CB 3.49Å; C84-S88 PolarHBondContact O-N 3.36Å; C84-S88 PolarHBondContact O-OG 3.06Å; S85-S88 PolarHBondContact O-N 3.01Å; S85-S88 PolarHBondContact O-OG 2.58Å; S88-G90 PolarHBondContact O-N 3.27Å
89	R	88.1	Confident	90.4	Very high	115 Å²	115	21.6 Å²	21.6	43%	0.434	12%	0.119	S	C	.	.	H	α-helix	trans	-69.5	-15.4	174.1	-71	173.9	-168.8	-151.4	6.9	113.3	Q28 S85 Q86 Y87	Q28-R89 PolarHBondContact OE1-O 2.95Å; S85-R89 VanDerWaalsContact O-CG 3.29Å; S85-R89 WeakPolarHBondContact O-CG 3.33Å; S85-R89 PolarHBondContact O-N 3.1Å; S85-R89 VanDerWaalsContact O-N 3.1Å; S85-R89 PolarHBondContact OG-NE 3.15Å; Q86-R89 PolarHBondContact O-N 2.81Å; Y87-R89 VanDerWaalsContact C-N 3.27Å; Y87-R89 PolarHBondContact O-N 3.45Å
90	G	86.9	Confident	90.1	Very high	12 Å²	12	24.2 Å²	24.2	12%	0.124	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	27.1	175.7	0	0	0	0	0	114.7	Q86 Y87 S88	Q86-G90 PolarHBondContact O-N 2.86Å; Y87-G90 PolarHBondContact O-N 2.91Å; S88-G90 PolarHBondContact O-N 3.27Å
91	V	90.3	Very high	89.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.15	C	C	.	.			trans	-63.3	146	179.3	-56.8	0	0	0	0	112.5	Q28 Q86 I94 R324	Q28-V91 HydrophobicContact CB-CG1 4.48Å; Q86-V91 HydrophobicContact CB-CG2 4.04Å; Q86-V91 WeakPolarHBondContact O-CG2 3.47Å; Q86-V91 PolarHBondContact O-N 3.23Å; V91-I94 HydrophobicContact CG2-CD1 4.31Å; V91-I94 HydrophobicContact CG2-CG1 3.81Å; V91-R324 PolarHBondContact O-NH2 2.94Å; V91-R324 VanDerWaalsContact O-NH2 3.08Å
92	F	89.4	Confident	89.6	Confident	16 Å²	16	25.5 Å²	25.5	7%	0.07	12%	0.123	C	C	.	.	S	Bend	trans	-85.5	-31.1	-177.9	-62.3	-68	0	0	0	113.5	V27 Q28 F312 I322 R324 W339	V27-F92 HydrophobicContact CB-CD2 4.5Å; V27-F92 HydrophobicContact CG1-CD2 3.66Å; V27-F92 HydrophobicContact CG1-CE2 4.32Å; V27-F92 HydrophobicContact CG1-CG 4.45Å; Q28-F92 WeakPolarHBondContact O-CD2 3.2Å; Q28-F92 PolarHBondContact O-N 3.43Å; F92-F312 HydrophobicContact CB-CE1 4.03Å; F92-F312 HydrophobicContact CB-CZ 4.04Å; F92-I322 WeakPolarHBondContact CE1-O 3.25Å; F92-R324 HydrophobicContact CE1-CG 4.2Å; F92-W339 HydrophobicContact CB-CH2 4.15Å; F92-W339 AromaticContact CD1-CH2 3.66Å; F92-W339 HydrophobicContact CD1-CH2 3.66Å; F92-W339 AromaticContact CD1-CZ2 3.68Å; F92-W339 HydrophobicContact CD1-CZ2 3.68Å; F92-W339 HydrophobicContact CE1-CZ2 4.24Å; F92-W339 HydrophobicContact CG-CH2 4.39Å; F92-W339 VanDerWaalsContact O-CZ3 3.26Å; F92-W339 WeakPolarHBondContact O-CZ3 3.32Å
93	A	92.3	Very high	89.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	154.1	176.2	0	0	0	0	0	109.4	G30 I118 F312 M345	G30-A93 PolarHBondContact N-O 2.91Å; A93-I118 HydrophobicContact CB-CD1 4.01Å; A93-F312 HydrophobicContact CB-CZ 4.44Å; A93-M345 HydrophobicContact CB-CE 4.05Å
94	I	94.2	Very high	89.3	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	123.6	177	-62.6	174.4	0	0	0	108.2	G30 L32 F83 Q86 V91 I115 S116 L117 I118	G30-I94 CarbonylContact O-C 3.57Å; G30-I94 WeakPolarHBondContact O-CA 3.31Å; L32-I94 HydrophobicContact CD1-CG2 3.73Å; L32-I94 HydrophobicContact CG-CG2 3.89Å; F83-I94 HydrophobicContact CD2-CD1 3.76Å; F83-I94 HydrophobicContact CE2-CD1 3.6Å; F83-I94 HydrophobicContact CZ-CD1 4.28Å; Q86-I94 HydrophobicContact CB-CD1 4.17Å; V91-I94 HydrophobicContact CG2-CD1 4.31Å; V91-I94 HydrophobicContact CG2-CG1 3.81Å; I94-I115 HydrophobicContact CD1-CG2 3.92Å; I94-I115 HydrophobicContact CG1-CG2 3.96Å; I94-S116 PolarHBondContact N-O 3.48Å; I94-L117 HydrophobicContact CB-CD1 4.35Å; I94-L117 HydrophobicContact CG2-CD1 3.98Å; I94-L117 CarbonylContact O-C 3.57Å; I94-L117 WeakPolarHBondContact O-CA 3.47Å; I94-I118 PolarHBondContact O-N 3.35Å
95	F	94.8	Very high	89.3	Confident	1 Å²	1	32.8 Å²	32.8	0%	0.004	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	129.7	161.8	-173.7	-99.8	0	0	0	108.2	G30 G31 L32 F33 F44 I118 P120 L134 T301 M308	G30-F95 PolarHBondContact O-N 3.4Å; G31-F95 CarbonylContact C-O 3.58Å; G31-F95 VanDerWaalsContact CA-O 3.3Å; G31-F95 WeakPolarHBondContact CA-O 3.4Å; L32-F95 PolarHBondContact N-O 3.3Å; F33-F95 HydrophobicContact CE1-CD1 4.13Å; F33-F95 AromaticContact CE1-CE1 3.83Å; F33-F95 HydrophobicContact CE1-CE1 3.83Å; F33-F95 HydrophobicContact CE2-CD1 4.28Å; F33-F95 AromaticContact CZ-CD1 3.61Å; F33-F95 HydrophobicContact CZ-CD1 3.61Å; F33-F95 AromaticContact CZ-CE1 3.75Å; F33-F95 HydrophobicContact CZ-CE1 3.75Å; F44-F95 AromaticContact CD2-CD1 3.86Å; F44-F95 HydrophobicContact CD2-CD1 3.86Å; F44-F95 HydrophobicContact CD2-CE1 4.28Å; F44-F95 HydrophobicContact CD2-CG 4.16Å; F44-F95 HydrophobicContact CE2-CB 3.82Å; F44-F95 AromaticContact CE2-CD1 3.94Å; F44-F95 HydrophobicContact CE2-CD1 3.94Å; F44-F95 AromaticContact CE2-CG 3.9Å; F44-F95 HydrophobicContact CE2-CG 3.9Å; F44-F95 HydrophobicContact CZ-CB 4.41Å; F95-I118 WeakPolarHBondContact CA-O 3.28Å; F95-I118 HydrophobicContact CD2-CB 4.23Å; F95-I118 HydrophobicContact CD2-CG2 4.07Å; F95-I118 WeakPolarHBondContact CD2-O 3.44Å; F95-I118 HydrophobicContact CE2-CG2 4.34Å; F95-P120 HydrophobicContact CZ-CG 3.82Å; F95-L134 HydrophobicContact CE2-CD1 4.11Å; F95-T301 HydrophobicContact CE1-CG2 3.57Å; F95-T301 HydrophobicContact CE2-CG2 4.41Å; F95-T301 HydrophobicContact CZ-CG2 3.45Å; F95-T301 VanDerWaalsContact CZ-CG2 3.45Å; F95-M308 HydrophobicContact CB-CE 3.5Å; F95-M308 VanDerWaalsContact CB-CE 3.5Å; F95-M308 HydrophobicContact CD2-CE 3.64Å; F95-M308 HydrophobicContact CG-CE 4.02Å
96	G	90.3	Very high	89.2	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	143.9	-177.9	0	0	0	0	0	114.8	L32 I118 T119	L32-G96 WeakPolarHBondContact O-CA 3.22Å; G96-I118 PolarHBondContact N-O 3.26Å; G96-T119 WeakPolarHBondContact O-CA 3.3Å; G96-T119 WeakPolarHBondContact O-CB 3.16Å; G96-T119 PolarHBondContact O-OG1 3.37Å
97	L	89.3	Confident	89.2	Confident	13 Å²	13	32.3 Å²	32.3	7%	0.068	15%	0.152	C	C	.	.			trans	-85	144.2	162.8	-70.1	161.6	0	0	0	109.1	L32 F33 I34 T37 P120 S121	L32-L97 PolarHBondContact O-N 3.46Å; L32-L97 VanDerWaalsContact O-N 3.07Å; F33-L97 HydrophobicContact CD1-CD1 4.3Å; I34-L97 HydrophobicContact CD1-CB 3.86Å; I34-L97 HydrophobicContact CD1-CD1 4.29Å; I34-L97 HydrophobicContact CG1-CB 3.79Å; I34-L97 HydrophobicContact CG1-CD1 4.01Å; T37-L97 HydrophobicContact CG2-CD1 3.98Å; L97-P120 HydrophobicContact CD2-CG 3.55Å; L97-P120 HydrophobicContact CG-CG 4.39Å; L97-S121 WeakPolarHBondContact CA-OG 3.21Å
98	Y	88.1	Confident	89.2	Confident	7 Å²	7	35.6 Å²	35.6	3%	0.027	18%	0.177	C	C	.	.			trans	-133.1	156.4	171.1	60.5	-119.9	0	0	0	110.8	V103 L106 L117 T119 S121 F122	Y98-V103 HydrophobicContact CD1-CG2 4.26Å; Y98-V103 HydrophobicContact CD2-CB 3.72Å; Y98-V103 HydrophobicContact CD2-CG2 3.62Å; Y98-V103 HydrophobicContact CE1-CG2 4.05Å; Y98-V103 HydrophobicContact CE2-CB 4.05Å; Y98-V103 HydrophobicContact CE2-CG2 3.47Å; Y98-V103 VanDerWaalsContact CE2-CG2 3.47Å; Y98-V103 HydrophobicContact CG-CB 4.18Å; Y98-V103 HydrophobicContact CG-CG2 4.08Å; Y98-L106 HydrophobicContact CD1-CD1 4.41Å; Y98-L117 HydrophobicContact CD1-CD2 4.21Å; Y98-L117 HydrophobicContact CE1-CD2 4.47Å; Y98-T119 HydrophobicContact CD1-CG2 4.33Å; Y98-T119 HydrophobicContact CE1-CG2 3.5Å; Y98-T119 VanDerWaalsContact CE1-CG2 3.5Å; Y98-S121 PolarHBondContact N-OG 3.49Å; Y98-F122 HydrophobicContact CD2-CE1 4.1Å; Y98-F122 HydrophobicContact CD2-CZ 4.06Å; Y98-F122 HydrophobicContact CE2-CD1 4.38Å; Y98-F122 HydrophobicContact CE2-CD2 4.45Å; Y98-F122 HydrophobicContact CE2-CE1 4.01Å; Y98-F122 HydrophobicContact CE2-CE2 4.08Å; Y98-F122 AromaticContact CE2-CZ 3.82Å; Y98-F122 HydrophobicContact CE2-CZ 3.82Å; Y98-F122 PolarHBondContact OH-O 3.17Å
99	D	86.4	Confident	89.4	Confident	27 Å²	27	34.6 Å²	34.6	14%	0.144	16%	0.164	C	C	.	.			trans	-105.3	164	172.1	-178.4	25.2	0	0	0	109	R101 S102 V103	D99-R101 PolarHBondContact O-N 2.93Å; D99-R101 VanDerWaalsContact O-N 3.14Å; D99-S102 PolarHBondContact N-OG 3.3Å; D99-S102 VanDerWaalsContact N-OG 3.08Å; D99-S102 PolarHBondContact O-N 2.97Å; D99-S102 PolarHBondContact O-OG 2.85Å; D99-V103 WeakPolarHBondContact O-CB 3.48Å; D99-V103 PolarHBondContact O-N 3.35Å
100	K	83.8	Confident	89.5	Confident	55 Å²	55	29.1 Å²	29.1	24%	0.239	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-30.9	175.7	177.1	177.6	170.8	-166.1	0	113.4	V103 F122 T160 Y164	K100-V103 WeakPolarHBondContact O-CG1 3.4Å; K100-F122 HydrophobicContact CB-CE1 4.47Å; K100-F122 HydrophobicContact CB-CZ 4Å; K100-T160 WeakPolarHBondContact CD-O 3.43Å; K100-T160 PolarHBondContact NZ-O 3.37Å; K100-Y164 PolarHBondContact NZ-OH 3.42Å
101	R	85.2	Confident	89.7	Confident	164 Å²	164	30.4 Å²	30.4	62%	0.619	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-30.3	177.7	-59.8	-177.3	-174.7	-171.6	3.5	112.9	S76 D99	S76-R101 PolarHBondContact OG-O 3.34Å; S76-R101 VanDerWaalsContact OG-O 3.06Å; D99-R101 PolarHBondContact O-N 2.93Å; D99-R101 VanDerWaalsContact O-N 3.14Å
102	S	88.1	Confident	89.7	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-12	-175.2	49.3	0	0	0	0	114.9	T73 D99 H104 T105 L106	T73-S102 WeakPolarHBondContact O-CB 3.36Å; T73-S102 PolarHBondContact O-OG 2.88Å; D99-S102 PolarHBondContact N-OG 3.3Å; D99-S102 VanDerWaalsContact N-OG 3.08Å; D99-S102 PolarHBondContact O-N 2.97Å; D99-S102 PolarHBondContact O-OG 2.85Å; S102-H104 VanDerWaalsContact C-N 3.33Å; S102-H104 PolarHBondContact O-N 3.13Å; S102-T105 WeakPolarHBondContact O-CB 3.4Å; S102-T105 PolarHBondContact O-N 3.44Å; S102-T105 VanDerWaalsContact O-N 3.12Å; S102-L106 PolarHBondContact O-N 2.75Å; S102-L106 VanDerWaalsContact O-N 3.08Å
103	V	88.7	Confident	89.7	Confident	7 Å²	7	32.4 Å²	32.4	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-56.7	-43.4	-178.9	70.3	0	0	0	0	112.7	Y98 D99 K100 T105 L106 T107 T124	Y98-V103 HydrophobicContact CD1-CG2 4.26Å; Y98-V103 HydrophobicContact CD2-CB 3.72Å; Y98-V103 HydrophobicContact CD2-CG2 3.62Å; Y98-V103 HydrophobicContact CE1-CG2 4.05Å; Y98-V103 HydrophobicContact CE2-CB 4.05Å; Y98-V103 HydrophobicContact CE2-CG2 3.47Å; Y98-V103 VanDerWaalsContact CE2-CG2 3.47Å; Y98-V103 HydrophobicContact CG-CB 4.18Å; Y98-V103 HydrophobicContact CG-CG2 4.08Å; D99-V103 WeakPolarHBondContact O-CB 3.48Å; D99-V103 PolarHBondContact O-N 3.35Å; K100-V103 WeakPolarHBondContact O-CG1 3.4Å; V103-T105 VanDerWaalsContact C-N 3.34Å; V103-T105 PolarHBondContact O-N 2.71Å; V103-L106 PolarHBondContact O-N 3.08Å; V103-T107 HydrophobicContact CG2-CG2 4.27Å; V103-T107 WeakPolarHBondContact O-CB 3.2Å; V103-T107 VanDerWaalsContact O-CG2 3.25Å; V103-T107 WeakPolarHBondContact O-CG2 3.24Å; V103-T107 PolarHBondContact O-N 2.9Å; V103-T107 PolarHBondContact O-OG1 3Å; V103-T124 HydrophobicContact CG2-CG2 3.45Å; V103-T124 VanDerWaalsContact CG2-CG2 3.45Å
104	H	88.7	Confident	89.7	Confident	142 Å²	142	34.3 Å²	34.3	66%	0.657	18%	0.179	S	C	*	.	H	α-helix	trans	-67	-35.3	178.9	-67.8	-61.9	0	0	0	112.4	S102 T107 S108	S102-H104 VanDerWaalsContact C-N 3.33Å; S102-H104 PolarHBondContact O-N 3.13Å; H104-T107 WeakPolarHBondContact CA-OG1 3.28Å; H104-T107 PolarHBondContact O-OG1 3.31Å; H104-S108 WeakPolarHBondContact O-CB 3.41Å; H104-S108 PolarHBondContact O-N 3.48Å; H104-S108 VanDerWaalsContact O-N 3.08Å
105	T	91.1	Very high	89.6	Confident	29 Å²	29	34.3 Å²	34.3	18%	0.178	18%	0.179	C	C	.	.	H	α-helix	trans	-62.6	-53.8	175.5	-50.2	0	0	0	0	110.3	T80 S102 V103 S108 F109	T80-T105 WeakPolarHBondContact OG1-CG2 3.27Å; S102-T105 WeakPolarHBondContact O-CB 3.4Å; S102-T105 PolarHBondContact O-N 3.44Å; S102-T105 VanDerWaalsContact O-N 3.12Å; V103-T105 VanDerWaalsContact C-N 3.34Å; V103-T105 PolarHBondContact O-N 2.71Å; T105-S108 PolarHBondContact O-N 2.82Å; T105-F109 HydrophobicContact CG2-CD2 3.88Å; T105-F109 HydrophobicContact CG2-CE2 3.82Å; T105-F109 VanDerWaalsContact O-CD2 3.23Å; T105-F109 WeakPolarHBondContact O-CD2 3.41Å; T105-F109 PolarHBondContact O-N 3.49Å
106	L	89.9	Confident	89.5	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-65.2	-46.6	-177.7	-75.5	175	0	0	0	112.6	L32 V79 F83 Y98 S102 V103 S108 F109 C110 L117	L32-L106 HydrophobicContact CD1-CD2 4.12Å; V79-L106 HydrophobicContact CG1-CD1 4.06Å; V79-L106 HydrophobicContact CG1-CD2 3.52Å; V79-L106 HydrophobicContact CG1-CG 3.6Å; F83-L106 HydrophobicContact CD2-CD2 3.85Å; Y98-L106 HydrophobicContact CD1-CD1 4.41Å; S102-L106 PolarHBondContact O-N 2.75Å; S102-L106 VanDerWaalsContact O-N 3.08Å; V103-L106 PolarHBondContact O-N 3.08Å; L106-S108 VanDerWaalsContact C-N 3.27Å; L106-S108 PolarHBondContact O-N 3.43Å; L106-F109 PolarHBondContact O-N 2.86Å; L106-C110 VanDerWaalsContact O-CB 3.31Å; L106-C110 WeakPolarHBondContact O-CB 3.47Å; L106-C110 PolarHBondContact O-N 3.28Å; L106-C110 PolarHBondContact O-SG 3.35Å; L106-L117 HydrophobicContact CB-CD2 4.04Å; L106-L117 HydrophobicContact CD1-CD2 4.22Å
107	T	90.1	Very high	89.7	Confident	19 Å²	19	34.4 Å²	34.4	12%	0.117	18%	0.18	C	C	.	.	H	α-helix	trans	-60.2	-38	178.7	52.4	0	0	0	0	112	V103 H104 S111 V131	V103-T107 HydrophobicContact CG2-CG2 4.27Å; V103-T107 WeakPolarHBondContact O-CB 3.2Å; V103-T107 VanDerWaalsContact O-CG2 3.25Å; V103-T107 WeakPolarHBondContact O-CG2 3.24Å; V103-T107 PolarHBondContact O-N 2.9Å; V103-T107 PolarHBondContact O-OG1 3Å; H104-T107 WeakPolarHBondContact CA-OG1 3.28Å; H104-T107 PolarHBondContact O-OG1 3.31Å; T107-S111 WeakPolarHBondContact O-CB 3.32Å; T107-S111 PolarHBondContact O-N 3.36Å; T107-S111 VanDerWaalsContact O-N 3.08Å; T107-S111 PolarHBondContact O-OG 3.42Å; T107-V131 HydrophobicContact CG2-CG2 3.85Å
108	S	90.8	Very high	90	Very high	78 Å²	78	33.8 Å²	33.8	55%	0.545	18%	0.176	S	C	.	.	H	α-helix	trans	-65.7	-47	174.9	-171.5	0	0	0	0	112.5	H104 T105 L106 S111 A112	H104-S108 WeakPolarHBondContact O-CB 3.41Å; H104-S108 PolarHBondContact O-N 3.48Å; H104-S108 VanDerWaalsContact O-N 3.08Å; T105-S108 PolarHBondContact O-N 2.82Å; L106-S108 VanDerWaalsContact C-N 3.27Å; L106-S108 PolarHBondContact O-N 3.43Å; S108-S111 PolarHBondContact O-N 3.43Å; S108-A112 WeakPolarHBondContact O-CB 3.47Å; S108-A112 PolarHBondContact O-N 3Å
109	F	90.9	Very high	90.2	Very high	40 Å²	40	33.5 Å²	33.5	18%	0.175	18%	0.175	C	C	.	.	H	α-helix	trans	-66.8	-41.8	178.8	-85.2	-72.3	0	0	0	112.6	T80 F83 T105 L106 S111 A112 L113	T80-F109 HydrophobicContact CG2-CE2 3.74Å; T80-F109 HydrophobicContact CG2-CZ 3.65Å; F83-F109 HydrophobicContact CD1-CB 3.99Å; F83-F109 HydrophobicContact CD1-CD1 4.22Å; F83-F109 HydrophobicContact CD1-CG 4.14Å; F83-F109 HydrophobicContact CD2-CB 4.4Å; F83-F109 HydrophobicContact CE1-CB 3.76Å; F83-F109 HydrophobicContact CE1-CD1 4.26Å; F83-F109 HydrophobicContact CE1-CG 4.26Å; F83-F109 HydrophobicContact CE2-CB 4.13Å; F83-F109 HydrophobicContact CG-CB 4.33Å; F83-F109 HydrophobicContact CZ-CB 3.81Å; T105-F109 HydrophobicContact CG2-CD2 3.88Å; T105-F109 HydrophobicContact CG2-CE2 3.82Å; T105-F109 VanDerWaalsContact O-CD2 3.23Å; T105-F109 WeakPolarHBondContact O-CD2 3.41Å; T105-F109 PolarHBondContact O-N 3.49Å; L106-F109 PolarHBondContact O-N 2.86Å; F109-S111 VanDerWaalsContact C-N 3.33Å; F109-S111 PolarHBondContact O-N 2.98Å; F109-A112 PolarHBondContact O-N 2.82Å; F109-L113 HydrophobicContact CD1-CD1 4.08Å; F109-L113 WeakPolarHBondContact O-CB 3.43Å; F109-L113 PolarHBondContact O-N 3.48Å
110	C	91.2	Very high	90.5	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.9	-43.7	176.2	-74.3	0	0	0	0	112	L106 H114 I115 L117 F130	L106-C110 VanDerWaalsContact O-CB 3.31Å; L106-C110 WeakPolarHBondContact O-CB 3.47Å; L106-C110 PolarHBondContact O-N 3.28Å; L106-C110 PolarHBondContact O-SG 3.35Å; C110-H114 WeakPolarHBondContact O-CA 3.42Å; C110-H114 PolarHBondContact O-N 3.23Å; C110-I115 VanDerWaalsContact CB-O 3.31Å; C110-I115 WeakPolarHBondContact CB-O 3.27Å; C110-I115 PolarHBondContact O-N 2.93Å; C110-I115 PolarHBondContact SG-O 3.23Å; C110-L117 VanDerWaalsContact SG-CB 3.56Å; C110-F130 HydrophobicContact CB-CB 4.17Å
111	S	89.7	Confident	90.8	Very high	40 Å²	40	29.8 Å²	29.8	28%	0.28	16%	0.158	S	C	.	.	H	α-helix	trans	-67.9	-39.9	177.7	-57.4	0	0	0	0	112.3	T107 S108 F109 H114 Q129	T107-S111 WeakPolarHBondContact O-CB 3.32Å; T107-S111 PolarHBondContact O-N 3.36Å; T107-S111 VanDerWaalsContact O-N 3.08Å; T107-S111 PolarHBondContact O-OG 3.42Å; S108-S111 PolarHBondContact O-N 3.43Å; F109-S111 VanDerWaalsContact C-N 3.33Å; F109-S111 PolarHBondContact O-N 2.98Å; S111-H114 PolarHBondContact O-CD2 2.97Å; S111-H114 VanDerWaalsContact O-CD2 3.3Å; S111-Q129 PolarHBondContact OG-O 3.28Å
112	A	90.2	Very high	91	Very high	55 Å²	55	23 Å²	23	46%	0.455	13%	0.133	S	C	.	.	H	α-helix	trans	-71.9	-36.5	-179.3	0	0	0	0	0	113.4	S108 F109	S108-A112 WeakPolarHBondContact O-CB 3.47Å; S108-A112 PolarHBondContact O-N 3Å; F109-A112 PolarHBondContact O-N 2.82Å
113	L	90.8	Very high	90.9	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-104.1	-0.8	-171.9	-65.3	169.4	0	0	0	113.8	F83 Y87 F109 I115 C331 A336 W339	F83-L113 HydrophobicContact CE1-CD1 3.61Å; F83-L113 HydrophobicContact CZ-CD1 4.34Å; Y87-L113 HydrophobicContact CD2-CB 4.25Å; Y87-L113 HydrophobicContact CD2-CD1 3.9Å; Y87-L113 HydrophobicContact CD2-CG 4.49Å; Y87-L113 HydrophobicContact CE2-CB 3.84Å; Y87-L113 HydrophobicContact CE2-CD1 4.02Å; Y87-L113 HydrophobicContact CE2-CD2 3.95Å; Y87-L113 HydrophobicContact CE2-CG 4.15Å; Y87-L113 HydrophobicContact CG-CD1 4.42Å; F109-L113 HydrophobicContact CD1-CD1 4.08Å; F109-L113 WeakPolarHBondContact O-CB 3.43Å; F109-L113 PolarHBondContact O-N 3.48Å; L113-I115 PolarHBondContact O-N 3.37Å; L113-C331 HydrophobicContact CD1-CB 4.16Å; L113-A336 HydrophobicContact CD2-CB 3.82Å; L113-W339 PolarHBondContact O-N 3.36Å
114	H	91.8	Very high	90.6	Very high	41 Å²	41	25.3 Å²	25.3	19%	0.19	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	46.6	-177	-61.7	171.8	0	0	0	112.9	C110 S111 F130 P338 G342	C110-H114 WeakPolarHBondContact O-CA 3.42Å; C110-H114 PolarHBondContact O-N 3.23Å; S111-H114 PolarHBondContact O-CD2 2.97Å; S111-H114 VanDerWaalsContact O-CD2 3.3Å; H114-F130 HydrophobicContact CB-CD1 4.29Å; H114-F130 HydrophobicContact CB-CE1 3.62Å; H114-F130 HydrophobicContact CB-CE2 4.37Å; H114-F130 HydrophobicContact CB-CZ 3.67Å; H114-F130 AromaticContact CD2-CE2 3.25Å; H114-F130 WeakPolarHBondContact CD2-CE2 3.4Å; H114-F130 AromaticContact CD2-CZ 3.16Å; H114-F130 WeakPolarHBondContact CD2-CZ 3.42Å; H114-F130 AromaticContact CG-CE1 3.91Å; H114-F130 AromaticContact CG-CE2 3.96Å; H114-F130 AromaticContact CG-CZ 3.4Å; H114-F130 VanDerWaalsContact CG-CZ 3.4Å; H114-F130 AromaticContact NE2-CE2 3.89Å; H114-F130 AromaticContact NE2-CZ 3.83Å; H114-P338 HydrophobicContact CB-CB 4.18Å; H114-P338 VanDerWaalsContact ND1-CB 3.28Å; H114-P338 WeakPolarHBondContact ND1-CB 3.3Å; H114-G342 WeakPolarHBondContact O-CA 3.36Å
115	I	91.4	Very high	89.6	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.141	C	C	.	.			trans	-110.2	121.9	172.5	-64.6	-166.5	0	0	0	109.6	F83 Y87 I94 C110 L113 L117	F83-I115 HydrophobicContact CZ-CB 4.46Å; Y87-I115 HydrophobicContact CD2-CD1 3.36Å; Y87-I115 HydrophobicContact CD2-CG1 4.32Å; Y87-I115 HydrophobicContact CE2-CD1 3.88Å; Y87-I115 HydrophobicContact CE2-CG1 4.47Å; Y87-I115 HydrophobicContact CG-CD1 4.42Å; I94-I115 HydrophobicContact CD1-CG2 3.92Å; I94-I115 HydrophobicContact CG1-CG2 3.96Å; C110-I115 VanDerWaalsContact CB-O 3.31Å; C110-I115 WeakPolarHBondContact CB-O 3.27Å; C110-I115 PolarHBondContact O-N 2.93Å; C110-I115 PolarHBondContact SG-O 3.23Å; L113-I115 PolarHBondContact O-N 3.37Å; I115-L117 PolarHBondContact O-N 2.94Å
116	S	93.7	Very high	88.7	Confident	2 Å²	2	24.7 Å²	24.7	1%	0.014	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	123.1	178.6	-55.2	0	0	0	0	112	I94 F130	I94-S116 PolarHBondContact N-O 3.48Å; S116-F130 CarbonylContact C-O 3.46Å; S116-F130 WeakPolarHBondContact CA-O 3.49Å
117	L	93.9	Very high	88	Confident	1 Å²	1	32 Å²	32	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	129.1	171.2	175.8	67.8	0	0	0	110	I94 Y98 L106 C110 I115 F130 V131 L132	I94-L117 HydrophobicContact CB-CD1 4.35Å; I94-L117 HydrophobicContact CG2-CD1 3.98Å; I94-L117 CarbonylContact O-C 3.57Å; I94-L117 WeakPolarHBondContact O-CA 3.47Å; Y98-L117 HydrophobicContact CD1-CD2 4.21Å; Y98-L117 HydrophobicContact CE1-CD2 4.47Å; L106-L117 HydrophobicContact CB-CD2 4.04Å; L106-L117 HydrophobicContact CD1-CD2 4.22Å; C110-L117 VanDerWaalsContact SG-CB 3.56Å; I115-L117 PolarHBondContact O-N 2.94Å; L117-F130 PolarHBondContact N-O 3.04Å; L117-V131 CarbonylContact O-C 3.51Å; L117-V131 WeakPolarHBondContact O-CA 3.47Å; L117-L132 PolarHBondContact O-N 3.28Å
118	I	95.3	Very high	87.4	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.5	173.7	-59.2	89.9	0	0	0	108.1	A93 I94 F95 G96 L132 L134 M308 L349	A93-I118 HydrophobicContact CB-CD1 4.01Å; I94-I118 PolarHBondContact O-N 3.35Å; F95-I118 WeakPolarHBondContact CA-O 3.28Å; F95-I118 HydrophobicContact CD2-CB 4.23Å; F95-I118 HydrophobicContact CD2-CG2 4.07Å; F95-I118 WeakPolarHBondContact CD2-O 3.44Å; F95-I118 HydrophobicContact CE2-CG2 4.34Å; G96-I118 PolarHBondContact N-O 3.26Å; I118-L132 HydrophobicContact CG1-CB 4.09Å; I118-L132 HydrophobicContact CG1-CD2 4.1Å; I118-L132 HydrophobicContact CG2-CD2 4.41Å; I118-L134 HydrophobicContact CG2-CD1 3.75Å; I118-L134 HydrophobicContact CG2-CD2 4.15Å; I118-L134 HydrophobicContact CG2-CG 3.98Å; I118-M308 HydrophobicContact CB-CE 3.49Å; I118-M308 VanDerWaalsContact CB-CE 3.49Å; I118-M308 HydrophobicContact CD1-CE 3.46Å; I118-M308 VanDerWaalsContact CD1-CE 3.46Å; I118-M308 HydrophobicContact CD1-CG 4.11Å; I118-M308 HydrophobicContact CD1-SD 4.18Å; I118-M308 HydrophobicContact CG1-CE 3.72Å; I118-M308 HydrophobicContact CG1-CG 4.39Å; I118-M308 HydrophobicContact CG2-CE 3.97Å; I118-L349 HydrophobicContact CD1-CD1 4.34Å; I118-L349 HydrophobicContact CD1-CD2 4.43Å; I118-L349 HydrophobicContact CG1-CD2 4.36Å
119	T	93.4	Very high	87.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	138	-170.9	-165.6	0	0	0	0	113.3	G96 Y98 S121 L132 Q133 L134	G96-T119 WeakPolarHBondContact O-CA 3.3Å; G96-T119 WeakPolarHBondContact O-CB 3.16Å; G96-T119 PolarHBondContact O-OG1 3.37Å; Y98-T119 HydrophobicContact CD1-CG2 4.33Å; Y98-T119 HydrophobicContact CE1-CG2 3.5Å; Y98-T119 VanDerWaalsContact CE1-CG2 3.5Å; T119-S121 VanDerWaalsContact C-N 3.33Å; T119-S121 WeakPolarHBondContact OG1-CB 3.36Å; T119-S121 PolarHBondContact OG1-N 3.03Å; T119-S121 PolarHBondContact OG1-OG 2.81Å; T119-L132 PolarHBondContact N-O 3.14Å; T119-Q133 HydrophobicContact CG2-CG 4.32Å; T119-L134 WeakPolarHBondContact O-CB 3.41Å; T119-L134 WeakPolarHBondContact O-CG 3.39Å; T119-L134 PolarHBondContact O-N 3.2Å
120	P	93.1	Very high	87.2	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.184	C	C	.	.			trans	-91.7	6.5	168.6	39.1	-36.1	0	0	0	112.8	F95 L97 L134 R135 L300	F95-P120 HydrophobicContact CZ-CG 3.82Å; L97-P120 HydrophobicContact CD2-CG 3.55Å; L97-P120 HydrophobicContact CG-CG 4.39Å; P120-L134 HydrophobicContact CB-CD1 4.48Å; P120-R135 VanDerWaalsContact O-CZ 3.3Å; P120-R135 PolarHBondContact O-NE 3.01Å; P120-R135 PolarHBondContact O-NH2 3.35Å; P120-L300 HydrophobicContact CB-CB 3.66Å; P120-L300 HydrophobicContact CB-CD1 4.3Å
121	S	89.9	Confident	87.3	Confident	4 Å²	4	32.2 Å²	32.2	3%	0.028	19%	0.185	C	C	.	.	S	Bend	trans	-70.3	177.4	-179.4	-45.5	0	0	0	0	112	L97 Y98 T119 R135	L97-S121 WeakPolarHBondContact CA-OG 3.21Å; Y98-S121 PolarHBondContact N-OG 3.49Å; T119-S121 VanDerWaalsContact C-N 3.33Å; T119-S121 WeakPolarHBondContact OG1-CB 3.36Å; T119-S121 PolarHBondContact OG1-N 3.03Å; T119-S121 PolarHBondContact OG1-OG 2.81Å; S121-R135 WeakPolarHBondContact O-CB 3.27Å; S121-R135 PolarHBondContact O-NE 2.91Å
122	F	88	Confident	87.4	Confident	22 Å²	22	30.6 Å²	30.6	10%	0.096	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-62.1	146	179.9	62.1	-91.4	0	0	0	111.9	Y98 K100 D161 R162	Y98-F122 HydrophobicContact CD2-CE1 4.1Å; Y98-F122 HydrophobicContact CD2-CZ 4.06Å; Y98-F122 HydrophobicContact CE2-CD1 4.38Å; Y98-F122 HydrophobicContact CE2-CD2 4.45Å; Y98-F122 HydrophobicContact CE2-CE1 4.01Å; Y98-F122 HydrophobicContact CE2-CE2 4.08Å; Y98-F122 AromaticContact CE2-CZ 3.82Å; Y98-F122 HydrophobicContact CE2-CZ 3.82Å; Y98-F122 PolarHBondContact OH-O 3.17Å; K100-F122 HydrophobicContact CB-CE1 4.47Å; K100-F122 HydrophobicContact CB-CZ 4Å; F122-D161 WeakPolarHBondContact CE1-O 3.44Å; F122-R162 WeakPolarHBondContact CD2-O 3.23Å
123	P	87.6	Confident	87.6	Confident	32 Å²	32	28.1 Å²	28.1	21%	0.208	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-71.1	141.2	-177.6	28.5	-34.4	0	0	0	112
124	T	81.8	Confident	87.7	Confident	23 Å²	23	28.2 Å²	28.2	14%	0.141	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-95.2	142.9	174.8	62.3	0	0	0	0	111.1	V103 S128 Q133	V103-T124 HydrophobicContact CG2-CG2 3.45Å; V103-T124 VanDerWaalsContact CG2-CG2 3.45Å; T124-S128 PolarHBondContact OG1-OG 2.98Å; T124-Q133 PolarHBondContact OG1-NE2 3.41Å
125	E	68.1	Low	87.8	Confident	108 Å²	108	27.6 Å²	27.6	51%	0.505	15%	0.148	S	C	.	.			trans	-86	-17.5	-177.7	-64.6	-159.8	149.6	0	0	114.4	R139 S165	E125-R139 IonicContact OE1-NH1 2.67Å; E125-S165 WeakPolarHBondContact OE1-CB 3.42Å
126	G	70.8	Confident	87.8	Confident	51 Å²	51	27.8 Å²	27.8	53%	0.526	15%	0.149	S	C	.	.	S	Bend	trans	-77.1	153.8	177.8	0	0	0	0	0	113.5	S128	G126-S128 VanDerWaalsContact C-N 3.34Å; G126-S128 PolarHBondContact O-N 2.85Å; G126-S128 PolarHBondContact O-OG 3.4Å
127	E	76.6	Confident	87.6	Confident	154 Å²	154	30 Å²	30	72%	0.72	17%	0.165	S	C	*	.			trans	-63.6	91.7	171.4	-63.5	-174.8	178.3	0	0	109.9	Y366	E127-Y366 HydrophobicContact CB-CD1 4.2Å; E127-Y366 HydrophobicContact CB-CE1 4.14Å; E127-Y366 HydrophobicContact CG-CD1 4.08Å; E127-Y366 HydrophobicContact CG-CE1 3.66Å
128	S	77.6	Confident	87.5	Confident	16 Å²	16	30.6 Å²	30.6	11%	0.112	17%	0.168	C	C	.	.			trans	-99.4	121.4	-179	-55.1	0	0	0	0	109.3	T124 G126	T124-S128 PolarHBondContact OG1-OG 2.98Å; G126-S128 VanDerWaalsContact C-N 3.34Å; G126-S128 PolarHBondContact O-N 2.85Å; G126-S128 PolarHBondContact O-OG 3.4Å
129	Q	85.4	Confident	87.2	Confident	119 Å²	119	34.3 Å²	34.3	56%	0.556	18%	0.182	S	C	*	.	S	Bend	trans	-88.5	151.7	172.3	-63.5	-178.8	-13.2	0	0	109.4	S111 V131	S111-Q129 PolarHBondContact OG-O 3.28Å; Q129-V131 PolarHBondContact O-N 3.49Å
130	F	91.2	Very high	87.1	Confident	5 Å²	5	35.4 Å²	35.4	2%	0.022	19%	0.194	C	C	.	.	S	Bend	trans	59.9	21.9	-179.3	-56	-87.6	0	0	0	115.1	C110 H114 S116 L117 I343 E346	C110-F130 HydrophobicContact CB-CB 4.17Å; H114-F130 HydrophobicContact CB-CD1 4.29Å; H114-F130 HydrophobicContact CB-CE1 3.62Å; H114-F130 HydrophobicContact CB-CE2 4.37Å; H114-F130 HydrophobicContact CB-CZ 3.67Å; H114-F130 AromaticContact CD2-CE2 3.25Å; H114-F130 WeakPolarHBondContact CD2-CE2 3.4Å; H114-F130 AromaticContact CD2-CZ 3.16Å; H114-F130 WeakPolarHBondContact CD2-CZ 3.42Å; H114-F130 AromaticContact CG-CE1 3.91Å; H114-F130 AromaticContact CG-CE2 3.96Å; H114-F130 AromaticContact CG-CZ 3.4Å; H114-F130 VanDerWaalsContact CG-CZ 3.4Å; H114-F130 AromaticContact NE2-CE2 3.89Å; H114-F130 AromaticContact NE2-CZ 3.83Å; S116-F130 CarbonylContact C-O 3.46Å; S116-F130 WeakPolarHBondContact CA-O 3.49Å; L117-F130 PolarHBondContact N-O 3.04Å; F130-I343 HydrophobicContact CE1-CG1 4.4Å; F130-I343 HydrophobicContact CZ-CG1 4.04Å; F130-E346 HydrophobicContact CD1-CB 3.97Å; F130-E346 HydrophobicContact CD1-CG 4.31Å; F130-E346 HydrophobicContact CE1-CB 4.11Å; F130-E346 WeakPolarHBondContact CE1-OE2 3.31Å; F130-E346 VanDerWaalsContact N-CD 3.35Å; F130-E346 PolarHBondContact N-OE1 3.45Å
131	V	92.9	Very high	87	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	129.9	176.2	-177.4	0	0	0	0	109.7	T107 L117 Q129 Q133	T107-V131 HydrophobicContact CG2-CG2 3.85Å; L117-V131 CarbonylContact O-C 3.51Å; L117-V131 WeakPolarHBondContact O-CA 3.47Å; Q129-V131 PolarHBondContact O-N 3.49Å; V131-Q133 HydrophobicContact CG1-CG 4.13Å
132	L	93.1	Very high	87.2	Confident	5 Å²	5	35.3 Å²	35.3	3%	0.026	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	113.5	177	-162.7	74.3	0	0	0	109.7	L117 I118 T119 V307 L349 F363	L117-L132 PolarHBondContact O-N 3.28Å; I118-L132 HydrophobicContact CG1-CB 4.09Å; I118-L132 HydrophobicContact CG1-CD2 4.1Å; I118-L132 HydrophobicContact CG2-CD2 4.41Å; T119-L132 PolarHBondContact N-O 3.14Å; L132-V307 HydrophobicContact CD2-CG1 3.78Å; L132-L349 HydrophobicContact CD2-CB 4.36Å; L132-L349 HydrophobicContact CD2-CD2 4.01Å; L132-F363 HydrophobicContact CD1-CB 4.08Å; L132-F363 HydrophobicContact CD1-CD1 3.48Å; L132-F363 VanDerWaalsContact CD1-CD1 3.48Å; L132-F363 HydrophobicContact CD1-CD2 3.78Å; L132-F363 HydrophobicContact CD1-CE1 3.77Å; L132-F363 HydrophobicContact CD1-CE2 4.04Å; L132-F363 HydrophobicContact CD1-CG 3.49Å; L132-F363 VanDerWaalsContact CD1-CG 3.49Å; L132-F363 HydrophobicContact CD1-CZ 4.04Å; L132-F363 HydrophobicContact CD2-CD2 4.37Å; L132-F363 HydrophobicContact CD2-CE1 4.08Å; L132-F363 HydrophobicContact CD2-CE2 3.83Å; L132-F363 HydrophobicContact CD2-CZ 3.66Å; L132-F363 HydrophobicContact CG-CD1 3.91Å; L132-F363 HydrophobicContact CG-CD2 4.41Å; L132-F363 HydrophobicContact CG-CE1 3.64Å; L132-F363 HydrophobicContact CG-CE2 4.17Å; L132-F363 HydrophobicContact CG-CG 4.29Å; L132-F363 HydrophobicContact CG-CZ 3.78Å
133	Q	93.2	Very high	87.4	Confident	3 Å²	3	35.7 Å²	35.7	1%	0.014	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	112	-174.9	-60.4	171.5	17.6	0	0	109.7	T119 T124 V131 G367	T119-Q133 HydrophobicContact CG2-CG 4.32Å; T124-Q133 PolarHBondContact OG1-NE2 3.41Å; V131-Q133 HydrophobicContact CG1-CG 4.13Å; Q133-G367 PolarHBondContact N-O 3.49Å
134	L	93.9	Very high	87.6	Confident	4 Å²	4	35.2 Å²	35.2	2%	0.021	19%	0.193	C	C	.	.			trans	-78.9	-27.4	-179.6	-58	171	0	0	0	111.8	F95 I118 T119 P120 P136 L300 G304 F363 R369	F95-L134 HydrophobicContact CE2-CD1 4.11Å; I118-L134 HydrophobicContact CG2-CD1 3.75Å; I118-L134 HydrophobicContact CG2-CD2 4.15Å; I118-L134 HydrophobicContact CG2-CG 3.98Å; T119-L134 WeakPolarHBondContact O-CB 3.41Å; T119-L134 WeakPolarHBondContact O-CG 3.39Å; T119-L134 PolarHBondContact O-N 3.2Å; P120-L134 HydrophobicContact CB-CD1 4.48Å; L134-P136 WeakPolarHBondContact O-CD 3.26Å; L134-L300 HydrophobicContact CB-CB 4.42Å; L134-L300 HydrophobicContact CB-CD2 3.96Å; L134-L300 WeakPolarHBondContact CD1-O 3.37Å; L134-L300 WeakPolarHBondContact O-CD2 3.46Å; L134-G304 VanDerWaalsContact CD1-CA 3.43Å; L134-F363 HydrophobicContact CD2-CE1 4.18Å; L134-F363 HydrophobicContact CD2-CZ 3.83Å; L134-R369 WeakPolarHBondContact O-CD 3.35Å
135	R	93	Very high	88.1	Confident	29 Å²	29	34.1 Å²	34.1	11%	0.109	19%	0.187	C	C	.	.	S	Bend	trans	-76.4	122.5	-179.2	-165.9	-179.7	-59.7	-173.3	-4.1	110.3	P120 S121 L242 L300	P120-R135 VanDerWaalsContact O-CZ 3.3Å; P120-R135 PolarHBondContact O-NE 3.01Å; P120-R135 PolarHBondContact O-NH2 3.35Å; S121-R135 WeakPolarHBondContact O-CB 3.27Å; S121-R135 PolarHBondContact O-NE 2.91Å; R135-L242 HydrophobicContact CG-CD1 3.56Å; R135-L300 HydrophobicContact CB-CD1 4.11Å; R135-L300 HydrophobicContact CG-CD1 4.23Å
136	P	92.1	Very high	89.3	Confident	3 Å²	3	29 Å²	29	2%	0.019	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-69.1	159.9	174.1	25.8	-30.3	0	0	0	112.3	L134 L242 L264 Y372 M374	L134-P136 WeakPolarHBondContact O-CD 3.26Å; P136-L242 HydrophobicContact CG-CD1 4.03Å; P136-L242 HydrophobicContact CG-CD2 4.49Å; P136-L264 HydrophobicContact CG-CD1 3.93Å; P136-L264 HydrophobicContact CG-CD2 3.94Å; P136-Y372 HydrophobicContact CB-CD1 3.64Å; P136-Y372 HydrophobicContact CB-CD2 3.55Å; P136-Y372 HydrophobicContact CB-CE1 3.54Å; P136-Y372 HydrophobicContact CB-CE2 3.47Å; P136-Y372 VanDerWaalsContact CB-CE2 3.47Å; P136-Y372 HydrophobicContact CB-CG 3.63Å; P136-Y372 VanDerWaalsContact CB-CZ 3.44Å; P136-Y372 HydrophobicContact CG-CD2 4.18Å; P136-Y372 HydrophobicContact CG-CE2 4.35Å; P136-Y372 HydrophobicContact CG-CG 4.41Å; P136-M374 HydrophobicContact CB-CE 4.5Å; P136-M374 HydrophobicContact CG-CE 4.45Å
137	S	89.5	Confident	90.2	Very high	49 Å²	49	29.9 Å²	29.9	34%	0.343	16%	0.155	S	C	.	.	P	Polyproline II helix	trans	-75.2	131.8	174.6	-175.9	0	0	0	0	111.4	R139 Y372	S137-R139 PolarHBondContact OG-N 3.44Å; S137-Y372 PolarHBondContact N-OH 3.35Å; S137-Y372 PolarHBondContact O-OH 2.81Å
138	L	90.8	Very high	90.8	Very high	14 Å²	14	26.6 Å²	26.6	7%	0.073	14%	0.14	C	C	.	.			trans	-90.2	-10.6	175	-169.3	66.1	0	0	0	112.9	G140 A141 L142 I166 A240 L242 F262 M374	L138-G140 PolarHBondContact O-N 3.42Å; L138-A141 HydrophobicContact CD1-CB 4.23Å; L138-A141 PolarHBondContact O-N 3.11Å; L138-L142 PolarHBondContact O-N 3.01Å; L138-I166 HydrophobicContact CB-CD1 4.42Å; L138-A240 HydrophobicContact CD2-CB 3.85Å; L138-L242 HydrophobicContact CD1-CD2 3.97Å; L138-F262 HydrophobicContact CD1-CB 4.1Å; L138-F262 HydrophobicContact CD1-CD1 4.18Å; L138-F262 HydrophobicContact CD1-CD2 3.53Å; L138-F262 HydrophobicContact CD1-CE2 3.93Å; L138-F262 HydrophobicContact CD1-CG 3.66Å; L138-F262 HydrophobicContact CD1-CZ 4.41Å; L138-F262 HydrophobicContact CD2-CD2 4.24Å; L138-F262 HydrophobicContact CD2-CE2 4.47Å; L138-F262 HydrophobicContact CG-CD2 4.35Å; L138-F262 HydrophobicContact CG-CE2 4.45Å; L138-M374 HydrophobicContact CD1-CE 4.15Å; L138-M374 HydrophobicContact CD1-SD 3.95Å
139	R	90.3	Very high	91.3	Very high	77 Å²	77	28.6 Å²	28.6	29%	0.291	15%	0.145	S	C	.	.	H	α-helix	trans	-52.8	-53.6	-173.3	178.1	178.3	172.5	159.2	7.3	112.6	E125 S137 L143 A169 E172	E125-R139 IonicContact OE1-NH1 2.67Å; S137-R139 PolarHBondContact OG-N 3.44Å; R139-L143 HydrophobicContact CG-CD1 4.37Å; R139-L143 WeakPolarHBondContact O-CG 3.39Å; R139-L143 PolarHBondContact O-N 2.92Å; R139-A169 HydrophobicContact CG-CB 3.52Å; R139-E172 IonicContact CZ-OE2 2.56Å; R139-E172 IonicContact NH2-OE2 2.82Å; R139-E172 PolarHBondContact NH2-OE2 3.16Å
140	G	89.7	Confident	91.5	Very high	24 Å²	24	30.5 Å²	30.5	25%	0.247	15%	0.154	C	C	.	.	H	α-helix	trans	-66.7	-38.9	-176.3	0	0	0	0	0	113.3	L138 S144	L138-G140 PolarHBondContact O-N 3.42Å; G140-S144 WeakPolarHBondContact O-CB 3.35Å; G140-S144 PolarHBondContact O-N 3.37Å; G140-S144 PolarHBondContact O-OG 3.44Å
141	A	92	Very high	91.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-67.7	-44.6	180	0	0	0	0	0	112.4	L138 S144 L145 F262 M374 W390	L138-A141 HydrophobicContact CD1-CB 4.23Å; L138-A141 PolarHBondContact O-N 3.11Å; A141-S144 PolarHBondContact O-N 3.32Å; A141-L145 WeakPolarHBondContact O-CB 3.28Å; A141-L145 PolarHBondContact O-N 2.85Å; A141-F262 HydrophobicContact CB-CD1 4.25Å; A141-F262 HydrophobicContact CB-CE1 3.81Å; A141-F262 HydrophobicContact CB-CZ 4.33Å; A141-M374 HydrophobicContact CB-CE 4.43Å; A141-M374 HydrophobicContact CB-CG 4.48Å; A141-M374 HydrophobicContact CB-SD 3.23Å; A141-M374 WeakPolarHBondContact CB-SD 3.28Å; A141-W390 HydrophobicContact CB-CB 4.3Å; A141-W390 HydrophobicContact CB-CD2 3.57Å; A141-W390 HydrophobicContact CB-CE3 3.84Å; A141-W390 HydrophobicContact CB-CG 3.77Å; A141-W390 HydrophobicContact CB-CZ3 4.42Å
142	L	93.3	Very high	91	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-63.7	-44.1	178.5	-175.9	63.2	0	0	0	111.8	L138 L145 L146 I166 I170 V210 I238 A240 F262	L138-L142 PolarHBondContact O-N 3.01Å; L142-L145 PolarHBondContact O-N 3.11Å; L142-L146 HydrophobicContact CG-CD1 4.4Å; L142-L146 WeakPolarHBondContact O-CG 3.44Å; L142-L146 PolarHBondContact O-N 3.1Å; L142-I166 HydrophobicContact CD2-CG2 3.58Å; L142-I170 HydrophobicContact CD2-CD1 3.95Å; L142-V210 HydrophobicContact CD1-CG1 4.1Å; L142-V210 HydrophobicContact CD2-CG1 4.21Å; L142-I238 HydrophobicContact CD1-CG2 3.73Å; L142-A240 HydrophobicContact CD1-CB 4.45Å; L142-A240 HydrophobicContact CD2-CB 4.16Å; L142-F262 HydrophobicContact CD1-CE2 4.16Å; L142-F262 HydrophobicContact CD1-CZ 4.39Å
143	L	92.6	Very high	90.8	Very high	29 Å²	29	37.6 Å²	37.6	15%	0.152	20%	0.195	C	C	.	.	H	α-helix	trans	-63.6	-41.5	176.8	-68.9	177.4	0	0	0	112	R139 L145 L146 D147 A169 I170 K173	R139-L143 HydrophobicContact CG-CD1 4.37Å; R139-L143 WeakPolarHBondContact O-CG 3.39Å; R139-L143 PolarHBondContact O-N 2.92Å; L143-L145 VanDerWaalsContact C-N 3.28Å; L143-L145 PolarHBondContact O-N 3.32Å; L143-L146 PolarHBondContact O-N 3.06Å; L143-D147 PolarHBondContact O-N 3.41Å; L143-A169 HydrophobicContact CD1-CB 4.3Å; L143-I170 HydrophobicContact CD2-CG1 4.23Å; L143-K173 HydrophobicContact CD2-CB 4.13Å; L143-K173 HydrophobicContact CD2-CG 4.3Å
144	S	92	Very high	90.8	Very high	22 Å²	22	37.5 Å²	37.5	15%	0.154	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-35.1	177.2	-56.5	0	0	0	0	112	G140 A141 H148 W390	G140-S144 WeakPolarHBondContact O-CB 3.35Å; G140-S144 PolarHBondContact O-N 3.37Å; G140-S144 PolarHBondContact O-OG 3.44Å; A141-S144 PolarHBondContact O-N 3.32Å; S144-H148 WeakPolarHBondContact O-CB 3.32Å; S144-H148 PolarHBondContact O-N 3.33Å; S144-W390 PolarHBondContact OG-NE1 2.91Å
145	L	92.3	Very high	90.9	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-71.3	-40	176.5	-169.1	65.8	0	0	0	112.1	A141 L142 L143 H148 Y149 I238 F262 V376 L396	A141-L145 WeakPolarHBondContact O-CB 3.28Å; A141-L145 PolarHBondContact O-N 2.85Å; L142-L145 PolarHBondContact O-N 3.11Å; L143-L145 VanDerWaalsContact C-N 3.28Å; L143-L145 PolarHBondContact O-N 3.32Å; L145-H148 PolarHBondContact O-N 2.91Å; L145-Y149 HydrophobicContact CD1-CD2 4.1Å; L145-Y149 HydrophobicContact CD1-CE2 3.52Å; L145-Y149 HydrophobicContact CD2-CE2 4.32Å; L145-Y149 HydrophobicContact CG-CD2 3.99Å; L145-Y149 HydrophobicContact CG-CE2 3.72Å; L145-Y149 VanDerWaalsContact O-CD2 3.28Å; L145-Y149 WeakPolarHBondContact O-CD2 3.35Å; L145-Y149 PolarHBondContact O-N 3.44Å; L145-Y149 VanDerWaalsContact O-N 3.1Å; L145-I238 HydrophobicContact CD2-CD1 4.33Å; L145-I238 HydrophobicContact CD2-CG2 3.82Å; L145-F262 HydrophobicContact CB-CZ 4.2Å; L145-F262 HydrophobicContact CD2-CE1 4.17Å; L145-F262 HydrophobicContact CD2-CE2 4.27Å; L145-F262 HydrophobicContact CD2-CZ 3.6Å; L145-V376 HydrophobicContact CD1-CG1 4.08Å; L145-L396 HydrophobicContact CD1-CD2 4.17Å
146	L	92.7	Very high	91	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.8	-42.4	174.6	-72.8	170.9	0	0	0	112	L142 L143 Y149 E150 W151 F154 I170 W179 V210 I238	L142-L146 HydrophobicContact CG-CD1 4.4Å; L142-L146 WeakPolarHBondContact O-CG 3.44Å; L142-L146 PolarHBondContact O-N 3.1Å; L143-L146 PolarHBondContact O-N 3.06Å; L146-Y149 PolarHBondContact O-N 3.01Å; L146-E150 PolarHBondContact O-N 3.05Å; L146-W151 HydrophobicContact CD2-CB 4.18Å; L146-W151 HydrophobicContact CD2-CD2 4.26Å; L146-W151 HydrophobicContact CD2-CE3 3.68Å; L146-W151 HydrophobicContact CD2-CZ3 4.42Å; L146-W151 PolarHBondContact O-N 3.13Å; L146-F154 HydrophobicContact CD1-CE2 4.47Å; L146-F154 HydrophobicContact CD1-CZ 3.93Å; L146-F154 HydrophobicContact CD2-CD1 4.5Å; L146-F154 HydrophobicContact CD2-CE1 4.14Å; L146-F154 HydrophobicContact CD2-CE2 4.47Å; L146-F154 HydrophobicContact CD2-CZ 4.13Å; L146-I170 HydrophobicContact CD1-CG1 4.48Å; L146-W179 HydrophobicContact CB-CH2 3.94Å; L146-W179 HydrophobicContact CB-CZ3 4.36Å; L146-W179 HydrophobicContact CD1-CH2 4.49Å; L146-W179 HydrophobicContact CD1-CZ3 4.12Å; L146-V210 HydrophobicContact CD2-CG2 4Å; L146-I238 HydrophobicContact CD2-CD1 3.89Å
147	D	89.7	Confident	91.1	Very high	70 Å²	70	36 Å²	36	37%	0.374	19%	0.189	S	C	.	.	H	α-helix	trans	-63.4	-42.3	174.4	-76.4	-19.9	0	0	0	110.7	L143 Y149 E150 W179	L143-D147 PolarHBondContact O-N 3.41Å; D147-Y149 PolarHBondContact O-N 3.34Å; D147-E150 PolarHBondContact O-N 3.49Å; D147-E150 VanDerWaalsContact O-N 3.11Å; D147-W179 VanDerWaalsContact OD1-CZ2 3.31Å; D147-W179 WeakPolarHBondContact OD1-CZ2 3.34Å
148	H	89.3	Confident	91.2	Very high	84 Å²	84	35.5 Å²	35.5	39%	0.389	18%	0.18	S	C	.	.	H	α-helix	trans	-60.8	-40.9	177.9	173.4	56.9	0	0	0	113.3	S144 L145 E150 L396 L398	S144-H148 WeakPolarHBondContact O-CB 3.32Å; S144-H148 PolarHBondContact O-N 3.33Å; L145-H148 PolarHBondContact O-N 2.91Å; H148-E150 VanDerWaalsContact C-N 3.26Å; H148-E150 PolarHBondContact O-N 3.31Å; H148-L396 HydrophobicContact CB-CD2 3.67Å; H148-L398 WeakPolarHBondContact CE1-CD1 3.42Å
149	Y	89.1	Confident	91.1	Very high	59 Å²	59	34.9 Å²	34.9	23%	0.231	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-1.6	177.4	-71.7	-58.2	0	0	0	114.1	L145 L146 D147 W151 H236 I238 T260	L145-Y149 HydrophobicContact CD1-CD2 4.1Å; L145-Y149 HydrophobicContact CD1-CE2 3.52Å; L145-Y149 HydrophobicContact CD2-CE2 4.32Å; L145-Y149 HydrophobicContact CG-CD2 3.99Å; L145-Y149 HydrophobicContact CG-CE2 3.72Å; L145-Y149 VanDerWaalsContact O-CD2 3.28Å; L145-Y149 WeakPolarHBondContact O-CD2 3.35Å; L145-Y149 PolarHBondContact O-N 3.44Å; L145-Y149 VanDerWaalsContact O-N 3.1Å; L146-Y149 PolarHBondContact O-N 3.01Å; D147-Y149 PolarHBondContact O-N 3.34Å; Y149-W151 VanDerWaalsContact C-N 3.28Å; Y149-W151 VanDerWaalsContact O-CD1 3.28Å; Y149-W151 PolarHBondContact O-N 2.85Å; Y149-H236 AromaticContact CE1-CE1 3.87Å; Y149-H236 AromaticContact CE2-CE1 3.93Å; Y149-H236 AromaticContact CZ-CE1 3.81Å; Y149-I238 HydrophobicContact CD2-CD1 4.36Å; Y149-T260 HydrophobicContact CE2-CG2 4.12Å; Y149-T260 WeakPolarHBondContact OH-CG2 3.37Å
150	E	88.3	Confident	90.8	Very high	158 Å²	158	32 Å²	32	74%	0.738	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	43.5	-176.2	-57	-178.9	174.5	0	0	112.3	L146 D147 H148 N152	L146-E150 PolarHBondContact O-N 3.05Å; D147-E150 PolarHBondContact O-N 3.49Å; D147-E150 VanDerWaalsContact O-N 3.11Å; H148-E150 VanDerWaalsContact C-N 3.26Å; H148-E150 PolarHBondContact O-N 3.31Å; E150-N152 PolarHBondContact O-N 3.37Å
151	W	90.4	Very high	90.3	Very high	7 Å²	7	32.3 Å²	32.3	3%	0.027	16%	0.164	C	C	.	.			trans	-81	110	-178.8	-82.3	23.8	0	0	0	112.4	L146 Y149 F154 K208 V210 H236 I238	L146-W151 HydrophobicContact CD2-CB 4.18Å; L146-W151 HydrophobicContact CD2-CD2 4.26Å; L146-W151 HydrophobicContact CD2-CE3 3.68Å; L146-W151 HydrophobicContact CD2-CZ3 4.42Å; L146-W151 PolarHBondContact O-N 3.13Å; Y149-W151 VanDerWaalsContact C-N 3.28Å; Y149-W151 VanDerWaalsContact O-CD1 3.28Å; Y149-W151 PolarHBondContact O-N 2.85Å; W151-F154 HydrophobicContact CB-CD1 4.05Å; W151-F154 HydrophobicContact CB-CE1 4.43Å; W151-F154 HydrophobicContact CE3-CB 3.78Å; W151-F154 HydrophobicContact CE3-CD1 4.13Å; W151-F154 AromaticContact CE3-CG 3.97Å; W151-F154 HydrophobicContact CE3-CG 3.97Å; W151-F154 HydrophobicContact CZ3-CB 4.14Å; W151-K208 HydrophobicContact CD2-CB 4.3Å; W151-K208 HydrophobicContact CD2-CD 3.85Å; W151-K208 HydrophobicContact CD2-CG 4.33Å; W151-K208 HydrophobicContact CE3-CB 4.04Å; W151-K208 HydrophobicContact CE3-CD 4.38Å; W151-K208 HydrophobicContact CG-CD 4.09Å; W151-K208 HydrophobicContact CH2-CB 3.8Å; W151-K208 HydrophobicContact CH2-CG 4.16Å; W151-K208 HydrophobicContact CZ2-CB 4.06Å; W151-K208 HydrophobicContact CZ2-CD 4.2Å; W151-K208 HydrophobicContact CZ2-CG 3.89Å; W151-K208 HydrophobicContact CZ3-CB 3.79Å; W151-K208 HydrophobicContact CZ3-CG 4.48Å; W151-V210 HydrophobicContact CE3-CG2 4.33Å; W151-V210 HydrophobicContact CZ3-CG2 3.89Å; W151-H236 HydrophobicContact CH2-CB 4.13Å; W151-H236 HydrophobicContact CZ2-CB 3.74Å; W151-H236 AromaticContact CZ2-CD2 3.96Å; W151-H236 AromaticContact CZ2-CE1 3.88Å; W151-H236 AromaticContact CZ2-CG 3.47Å; W151-H236 VanDerWaalsContact CZ2-CG 3.47Å; W151-H236 AromaticContact CZ2-ND1 3.46Å; W151-H236 WeakPolarHBondContact CZ2-ND1 3.45Å; W151-I238 HydrophobicContact CD2-CD1 4.48Å; W151-I238 HydrophobicContact CE3-CD1 3.99Å; W151-I238 HydrophobicContact CH2-CD1 3.77Å; W151-I238 HydrophobicContact CH2-CG1 3.67Å; W151-I238 HydrophobicContact CZ2-CD1 4.26Å; W151-I238 HydrophobicContact CZ2-CG1 4.37Å; W151-I238 HydrophobicContact CZ3-CD1 3.61Å; W151-I238 HydrophobicContact CZ3-CG1 3.85Å
152	N	83.8	Confident	89.6	Confident	97 Å²	97	33.4 Å²	33.4	52%	0.519	17%	0.168	S	C	.	.			trans	-101.9	-16.5	177	-60.3	-25.7	0	0	0	114.3	E150 W179 H180	E150-N152 PolarHBondContact O-N 3.37Å; N152-W179 CarbonylContact O-C 3.31Å; N152-W179 WeakPolarHBondContact O-CA 3.43Å; N152-W179 PolarHBondContact OD1-NE1 3.48Å; N152-H180 PolarHBondContact O-N 2.84Å
153	C	88.5	Confident	88.9	Confident	57 Å²	57	34.2 Å²	34.2	39%	0.385	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	121.9	-179.5	-170.4	0	0	0	0	109.4	H180 K208	C153-H180 WeakPolarHBondContact CA-O 3.48Å; C153-H180 HydrophobicContact CB-CB 4.35Å; C153-K208 WeakPolarHBondContact O-CD 3.22Å
154	F	94.1	Very high	88.5	Confident	1 Å²	1	37.5 Å²	37.5	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	162.8	-179	58.3	-89.7	0	0	0	112.4	L146 W151 I170 W179 H180 V181 S182 K208 V210	L146-F154 HydrophobicContact CD1-CE2 4.47Å; L146-F154 HydrophobicContact CD1-CZ 3.93Å; L146-F154 HydrophobicContact CD2-CD1 4.5Å; L146-F154 HydrophobicContact CD2-CE1 4.14Å; L146-F154 HydrophobicContact CD2-CE2 4.47Å; L146-F154 HydrophobicContact CD2-CZ 4.13Å; W151-F154 HydrophobicContact CB-CD1 4.05Å; W151-F154 HydrophobicContact CB-CE1 4.43Å; W151-F154 HydrophobicContact CE3-CB 3.78Å; W151-F154 HydrophobicContact CE3-CD1 4.13Å; W151-F154 AromaticContact CE3-CG 3.97Å; W151-F154 HydrophobicContact CE3-CG 3.97Å; W151-F154 HydrophobicContact CZ3-CB 4.14Å; F154-I170 HydrophobicContact CE2-CG2 4.19Å; F154-I170 HydrophobicContact CZ-CG2 3.98Å; F154-W179 HydrophobicContact CE1-CD2 4.47Å; F154-W179 HydrophobicContact CE1-CE3 4.01Å; F154-W179 HydrophobicContact CE1-CZ3 4.44Å; F154-W179 HydrophobicContact CZ-CE3 4.14Å; F154-W179 HydrophobicContact CZ-CZ3 4.41Å; F154-H180 PolarHBondContact N-O 3.36Å; F154-V181 HydrophobicContact CD2-CG1 4.27Å; F154-V181 HydrophobicContact CE1-CG2 3.94Å; F154-V181 HydrophobicContact CE2-CG1 3.82Å; F154-V181 HydrophobicContact CE2-CG2 4Å; F154-V181 HydrophobicContact CZ-CG1 4.29Å; F154-V181 HydrophobicContact CZ-CG2 3.61Å; F154-V181 WeakPolarHBondContact O-CA 3.34Å; F154-S182 PolarHBondContact O-N 3.32Å; F154-S182 VanDerWaalsContact O-N 3.08Å; F154-K208 HydrophobicContact CB-CB 3.81Å; F154-V210 HydrophobicContact CD2-CB 4.48Å; F154-V210 HydrophobicContact CD2-CG2 3.72Å; F154-V210 HydrophobicContact CE2-CG2 3.97Å; F154-V210 HydrophobicContact CG-CG2 4.48Å
155	V	95.3	Very high	88.2	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	131.9	174.6	-178.1	0	0	0	0	109.4	L157 S182 I184 L201 E206 K208 F209 V210	V155-L157 HydrophobicContact CG1-CD2 3.79Å; V155-L157 HydrophobicContact CG1-CG 4.26Å; V155-S182 WeakPolarHBondContact CA-O 3.33Å; V155-I184 HydrophobicContact CG1-CD1 4.05Å; V155-I184 HydrophobicContact CG1-CG1 4.47Å; V155-L201 HydrophobicContact CG1-CD1 4.08Å; V155-L201 HydrophobicContact CG2-CD1 4.46Å; V155-L201 HydrophobicContact CG2-CD2 4.08Å; V155-E206 HydrophobicContact CG2-CB 3.83Å; V155-E206 HydrophobicContact CG2-CG 3.86Å; V155-K208 PolarHBondContact N-O 3.4Å; V155-F209 HydrophobicContact CB-CD1 3.85Å; V155-F209 HydrophobicContact CB-CE1 4.08Å; V155-F209 HydrophobicContact CG1-CD1 4.17Å; V155-F209 HydrophobicContact CG1-CE1 4.32Å; V155-F209 HydrophobicContact CG2-CD1 4.43Å; V155-F209 HydrophobicContact CG2-CE1 4.19Å; V155-F209 CarbonylContact O-C 3.58Å; V155-F209 WeakPolarHBondContact O-CA 3.32Å; V155-V210 PolarHBondContact O-N 2.92Å
156	F	95.1	Very high	88.1	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	104.9	176	-177.8	-106.2	0	0	0	109.5	Y158 I166 L167 I170 V181 S182 A183 I184 V210 D212	F156-Y158 AromaticContact CD1-CD1 3.75Å; F156-Y158 HydrophobicContact CD1-CD1 3.75Å; F156-Y158 HydrophobicContact CD1-CG 4.13Å; F156-Y158 AromaticContact CE1-CD1 3.86Å; F156-Y158 HydrophobicContact CE1-CD1 3.86Å; F156-Y158 AromaticContact CE1-CG 3.76Å; F156-Y158 HydrophobicContact CE1-CG 3.76Å; F156-I166 HydrophobicContact CE2-CG2 4.24Å; F156-I166 HydrophobicContact CZ-CG2 4.02Å; F156-L167 HydrophobicContact CD1-CD1 3.6Å; F156-L167 HydrophobicContact CE1-CB 3.88Å; F156-L167 HydrophobicContact CE1-CD1 3.6Å; F156-L167 HydrophobicContact CE1-CG 4.29Å; F156-I170 HydrophobicContact CD2-CD1 3.54Å; F156-I170 HydrophobicContact CE2-CD1 3.36Å; F156-I170 HydrophobicContact CG-CD1 4.28Å; F156-I170 HydrophobicContact CZ-CD1 3.92Å; F156-V181 HydrophobicContact CB-CG1 3.91Å; F156-S182 PolarHBondContact N-O 3.35Å; F156-A183 HydrophobicContact CD1-CB 4.34Å; F156-A183 CarbonylContact O-C 3.59Å; F156-A183 WeakPolarHBondContact O-CA 3.43Å; F156-I184 PolarHBondContact O-N 2.94Å; F156-V210 WeakPolarHBondContact CA-O 3.41Å; F156-V210 HydrophobicContact CD2-CB 3.82Å; F156-V210 HydrophobicContact CD2-CG1 3.63Å; F156-V210 HydrophobicContact CE2-CB 4.5Å; F156-V210 HydrophobicContact CE2-CG1 3.82Å; F156-D212 HydrophobicContact CE2-CB 3.84Å; F156-D212 HydrophobicContact CZ-CB 3.68Å
157	L	93.6	Very high	88	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.021	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	122.3	175.5	-58.9	-176.2	0	0	0	108.5	V155 I184 V186 L197 F209 V210 I211 D212	V155-L157 HydrophobicContact CG1-CD2 3.79Å; V155-L157 HydrophobicContact CG1-CG 4.26Å; L157-I184 WeakPolarHBondContact CA-O 3.35Å; L157-I184 HydrophobicContact CD2-CB 3.92Å; L157-I184 HydrophobicContact CD2-CD1 4.43Å; L157-I184 HydrophobicContact CD2-CG2 4.47Å; L157-V186 HydrophobicContact CB-CG1 4.37Å; L157-V186 HydrophobicContact CD2-CG1 4.25Å; L157-L197 HydrophobicContact CD2-CD2 4.19Å; L157-F209 HydrophobicContact CD1-CD1 4.49Å; L157-V210 PolarHBondContact N-O 2.95Å; L157-I211 HydrophobicContact CB-CG2 4.49Å; L157-I211 HydrophobicContact CD1-CG1 4.35Å; L157-D212 PolarHBondContact O-N 2.94Å
158	Y	91.6	Very high	88	Confident	39 Å²	39	40.9 Å²	40.9	15%	0.153	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	156.2	-175.3	74.9	-81.8	0	0	0	114.3	F156 T160 Y164 L167 A183 I184 C185 V186 D212	F156-Y158 AromaticContact CD1-CD1 3.75Å; F156-Y158 HydrophobicContact CD1-CD1 3.75Å; F156-Y158 HydrophobicContact CD1-CG 4.13Å; F156-Y158 AromaticContact CE1-CD1 3.86Å; F156-Y158 HydrophobicContact CE1-CD1 3.86Å; F156-Y158 AromaticContact CE1-CG 3.76Å; F156-Y158 HydrophobicContact CE1-CG 3.76Å; Y158-T160 HydrophobicContact CE2-CG2 4.48Å; Y158-Y164 HydrophobicContact CE2-CD1 4.34Å; Y158-Y164 HydrophobicContact CE2-CE1 4.18Å; Y158-L167 HydrophobicContact CD1-CD2 4.47Å; Y158-L167 HydrophobicContact CD2-CD2 4.27Å; Y158-L167 HydrophobicContact CE1-CD2 4.04Å; Y158-L167 HydrophobicContact CE2-CD2 3.83Å; Y158-A183 HydrophobicContact CD1-CB 4.45Å; Y158-A183 HydrophobicContact CE1-CB 4.07Å; Y158-I184 WeakPolarHBondContact CD1-O 3.44Å; Y158-I184 PolarHBondContact N-O 2.98Å; Y158-C185 HydrophobicContact CE1-CB 4.12Å; Y158-C185 HydrophobicContact CE2-CB 4.13Å; Y158-C185 WeakPolarHBondContact O-CA 3.37Å; Y158-V186 WeakPolarHBondContact O-CG2 3.37Å; Y158-V186 PolarHBondContact O-N 2.57Å; Y158-D212 CarbonylContact C-O 3.58Å; Y158-D212 VanDerWaalsContact CA-O 3.28Å; Y158-D212 WeakPolarHBondContact CA-O 3.4Å
159	D	88.7	Confident	88.1	Confident	1 Å²	1	37 Å²	37	1%	0.005	19%	0.185	C	C	.	.			trans	-106.2	149.7	173.7	-169.9	-7	0	0	0	110.7	D161 D212 R217	D159-D161 PolarHBondContact OD1-N 3.41Å; D159-D212 PolarHBondContact N-O 3.33Å; D159-R217 IonicContact OD1-CZ 2.72Å; D159-R217 IonicContact OD1-NH1 3.87Å; D159-R217 PolarHBondContact OD1-NH1 3.39Å; D159-R217 IonicContact OD1-NH2 2.73Å; D159-R217 IonicContact OD2-CZ 3.56Å; D159-R217 IonicContact OD2-NE 3.48Å; D159-R217 IonicContact OD2-NH1 2.78Å; D159-R217 PolarHBondContact OD2-NH1 2.87Å; D159-R217 IonicContact OD2-NH2 3.76Å; D159-R217 PolarHBondContact OD2-NH2 3.39Å
160	T	84.3	Confident	88.2	Confident	17 Å²	17	34.2 Å²	34.2	10%	0.104	17%	0.174	C	C	.	.	S	Bend	trans	-86.4	-15.6	174.8	88.8	0	0	0	0	113.7	K100 Y158 R162 G163 Y164 E187	K100-T160 WeakPolarHBondContact CD-O 3.43Å; K100-T160 PolarHBondContact NZ-O 3.37Å; Y158-T160 HydrophobicContact CE2-CG2 4.48Å; T160-R162 VanDerWaalsContact C-N 3.34Å; T160-R162 PolarHBondContact O-N 3.03Å; T160-G163 PolarHBondContact O-N 2.88Å; T160-Y164 HydrophobicContact CG2-CE1 4.02Å; T160-E187 WeakPolarHBondContact CB-OE2 3.47Å; T160-E187 WeakPolarHBondContact CG2-OE2 3.38Å; T160-E187 PolarHBondContact OG1-OE2 3Å
161	D	79.5	Confident	88.3	Confident	31 Å²	31	30.2 Å²	30.2	17%	0.166	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-36.1	-176.2	-66	-28.4	0	0	0	112.7	F122 D159 R217	F122-D161 WeakPolarHBondContact CE1-O 3.44Å; D159-D161 PolarHBondContact OD1-N 3.41Å; D161-R217 IonicContact OD2-CZ 3.26Å; D161-R217 IonicContact OD2-NH1 2.81Å; D161-R217 IonicContact OD2-NH2 3.47Å; D161-R217 PolarHBondContact OD2-NH2 3.12Å
162	R	77.1	Confident	88.4	Confident	23 Å²	23	34.9 Å²	34.9	9%	0.087	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	0.3	-179.7	-45.1	-165.6	-39.5	178.2	21.1	114.7	F122 T160 D212 C213 E214 A240	F122-R162 WeakPolarHBondContact CD2-O 3.23Å; T160-R162 VanDerWaalsContact C-N 3.34Å; T160-R162 PolarHBondContact O-N 3.03Å; R162-D212 IonicContact CZ-OD1 3.55Å; R162-D212 IonicContact NE-OD1 2.83Å; R162-D212 PolarHBondContact NE-OD1 3.47Å; R162-D212 IonicContact NH1-OD1 3.99Å; R162-D212 IonicContact NH2-OD1 3.62Å; R162-D212 PolarHBondContact NH2-OD1 3.28Å; R162-D212 IonicContact NH2-OD2 3.94Å; R162-C213 PolarHBondContact NH1-O 2.99Å; R162-C213 VanDerWaalsContact NH1-O 3.15Å; R162-E214 HydrophobicContact CG-CG 4Å; R162-A240 PolarHBondContact NH1-O 3.19Å; R162-A240 PolarHBondContact NH2-O 3.25Å
163	G	79.1	Confident	88.7	Confident	19 Å²	19	32.7 Å²	32.7	20%	0.196	17%	0.165	C	C	.	.			trans	87.3	177.9	-175.1	0	0	0	0	0	114.7	T160	T160-G163 PolarHBondContact O-N 2.88Å
164	Y	84.3	Confident	88.8	Confident	97 Å²	97	30.4 Å²	30.4	38%	0.38	15%	0.15	S	C	.	.	S	Bend	trans	-104.2	4.4	-172	-56.5	-71.5	0	0	0	114.8	K100 Y158 T160 I166 L167 Q168	K100-Y164 PolarHBondContact NZ-OH 3.42Å; Y158-Y164 HydrophobicContact CE2-CD1 4.34Å; Y158-Y164 HydrophobicContact CE2-CE1 4.18Å; T160-Y164 HydrophobicContact CG2-CE1 4.02Å; Y164-I166 VanDerWaalsContact C-N 3.35Å; Y164-I166 PolarHBondContact O-N 3.3Å; Y164-L167 HydrophobicContact CD1-CD2 4.31Å; Y164-L167 PolarHBondContact O-N 3.47Å; Y164-Q168 WeakPolarHBondContact O-CG 3.29Å; Y164-Q168 PolarHBondContact O-N 3.17Å
165	S	85.5	Confident	88.6	Confident	26 Å²	26	33.7 Å²	33.7	18%	0.182	18%	0.184	C	C	.	.	H	α-helix	trans	-58.9	-42.7	-172.7	51.1	0	0	0	0	113.1	E125 A169	E125-S165 WeakPolarHBondContact OE1-CB 3.42Å; S165-A169 WeakPolarHBondContact O-CB 3.35Å; S165-A169 PolarHBondContact O-N 3.2Å; S165-A169 VanDerWaalsContact O-N 3.09Å
166	I	90	Very high	88.2	Confident	18 Å²	18	40.5 Å²	40.5	9%	0.092	22%	0.216	C	C	.	.	H	α-helix	trans	-68.1	-43.8	178.3	-63.4	172.2	0	0	0	110.6	L138 L142 F156 Y164 A169 I170 D212	L138-I166 HydrophobicContact CB-CD1 4.42Å; L142-I166 HydrophobicContact CD2-CG2 3.58Å; F156-I166 HydrophobicContact CE2-CG2 4.24Å; F156-I166 HydrophobicContact CZ-CG2 4.02Å; Y164-I166 VanDerWaalsContact C-N 3.35Å; Y164-I166 PolarHBondContact O-N 3.3Å; I166-A169 WeakPolarHBondContact O-CB 3.36Å; I166-A169 PolarHBondContact O-N 3.28Å; I166-I170 HydrophobicContact CG2-CD1 4.03Å; I166-I170 WeakPolarHBondContact O-CG1 3.12Å; I166-I170 PolarHBondContact O-N 3.27Å; I166-D212 WeakPolarHBondContact CB-OD2 3.23Å; I166-D212 VanDerWaalsContact CD1-OD2 3.26Å; I166-D212 WeakPolarHBondContact CD1-OD2 3.39Å; I166-D212 WeakPolarHBondContact CG2-OD2 3.37Å
167	L	91.1	Very high	87.8	Confident	25 Å²	25	44.3 Å²	44.3	13%	0.131	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-46.7	177.4	176.3	62.1	0	0	0	111.6	F156 Y158 Y164 A169 I170 M171 A183	F156-L167 HydrophobicContact CD1-CD1 3.6Å; F156-L167 HydrophobicContact CE1-CB 3.88Å; F156-L167 HydrophobicContact CE1-CD1 3.6Å; F156-L167 HydrophobicContact CE1-CG 4.29Å; Y158-L167 HydrophobicContact CD1-CD2 4.47Å; Y158-L167 HydrophobicContact CD2-CD2 4.27Å; Y158-L167 HydrophobicContact CE1-CD2 4.04Å; Y158-L167 HydrophobicContact CE2-CD2 3.83Å; Y164-L167 HydrophobicContact CD1-CD2 4.31Å; Y164-L167 PolarHBondContact O-N 3.47Å; L167-A169 VanDerWaalsContact C-N 3.33Å; L167-A169 PolarHBondContact O-N 3.45Å; L167-I170 PolarHBondContact O-N 3.11Å; L167-M171 HydrophobicContact CD1-CE 3.76Å; L167-M171 HydrophobicContact CD1-CG 4.1Å; L167-M171 VanDerWaalsContact O-CG 3.3Å; L167-M171 WeakPolarHBondContact O-CG 3.46Å; L167-M171 PolarHBondContact O-N 3.32Å; L167-A183 HydrophobicContact CD1-CB 3.84Å
168	Q	90.3	Very high	87.5	Confident	95 Å²	95	46.5 Å²	46.5	44%	0.444	26%	0.259	S	S	.	.	H	α-helix	trans	-59.3	-45.3	177.6	-74.9	175	-26.6	0	0	111.1	Y164 I170 M171 E172	Y164-Q168 WeakPolarHBondContact O-CG 3.29Å; Y164-Q168 PolarHBondContact O-N 3.17Å; Q168-I170 VanDerWaalsContact C-N 3.35Å; Q168-I170 PolarHBondContact O-N 3.23Å; Q168-M171 PolarHBondContact O-N 3.01Å; Q168-E172 WeakPolarHBondContact O-CB 3.38Å; Q168-E172 VanDerWaalsContact O-CG 3.3Å; Q168-E172 WeakPolarHBondContact O-CG 3.05Å; Q168-E172 PolarHBondContact O-N 3.5Å
169	A	89.7	Confident	87.4	Confident	3 Å²	3	45.6 Å²	45.6	3%	0.025	26%	0.256	C	S	.	.	H	α-helix	trans	-60.7	-41.1	177.7	0	0	0	0	0	113.4	R139 L143 S165 I166 L167 K173	R139-A169 HydrophobicContact CG-CB 3.52Å; L143-A169 HydrophobicContact CD1-CB 4.3Å; S165-A169 WeakPolarHBondContact O-CB 3.35Å; S165-A169 PolarHBondContact O-N 3.2Å; S165-A169 VanDerWaalsContact O-N 3.09Å; I166-A169 WeakPolarHBondContact O-CB 3.36Å; I166-A169 PolarHBondContact O-N 3.28Å; L167-A169 VanDerWaalsContact C-N 3.33Å; L167-A169 PolarHBondContact O-N 3.45Å; A169-K173 WeakPolarHBondContact O-CB 3.47Å; A169-K173 PolarHBondContact O-N 3.07Å; A169-K173 VanDerWaalsContact O-N 3.16Å
170	I	91.9	Very high	87.4	Confident	1 Å²	1	52 Å²	52	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-67.1	-43.1	176.9	-69.2	170.1	0	0	0	110.5	L142 L143 L146 F154 F156 I166 L167 Q168 K173 A174 V181	L142-I170 HydrophobicContact CD2-CD1 3.95Å; L143-I170 HydrophobicContact CD2-CG1 4.23Å; L146-I170 HydrophobicContact CD1-CG1 4.48Å; F154-I170 HydrophobicContact CE2-CG2 4.19Å; F154-I170 HydrophobicContact CZ-CG2 3.98Å; F156-I170 HydrophobicContact CD2-CD1 3.54Å; F156-I170 HydrophobicContact CE2-CD1 3.36Å; F156-I170 HydrophobicContact CG-CD1 4.28Å; F156-I170 HydrophobicContact CZ-CD1 3.92Å; I166-I170 HydrophobicContact CG2-CD1 4.03Å; I166-I170 WeakPolarHBondContact O-CG1 3.12Å; I166-I170 PolarHBondContact O-N 3.27Å; L167-I170 PolarHBondContact O-N 3.11Å; Q168-I170 VanDerWaalsContact C-N 3.35Å; Q168-I170 PolarHBondContact O-N 3.23Å; I170-K173 PolarHBondContact O-N 3.37Å; I170-A174 VanDerWaalsContact O-CB 3.25Å; I170-A174 WeakPolarHBondContact O-CB 3.49Å; I170-A174 PolarHBondContact O-N 3.17Å; I170-V181 HydrophobicContact CG2-CG1 4.17Å; I170-V181 HydrophobicContact CG2-CG2 4.17Å
171	M	91.4	Very high	87.8	Confident	74 Å²	74	52.5 Å²	52.5	37%	0.365	29%	0.288	S	S	.	.	H	α-helix	trans	-67.8	-39	-179.4	-69.3	-63.4	159	0	0	112.6	L167 Q168 A174 G175 V181 A183	L167-M171 HydrophobicContact CD1-CE 3.76Å; L167-M171 HydrophobicContact CD1-CG 4.1Å; L167-M171 VanDerWaalsContact O-CG 3.3Å; L167-M171 WeakPolarHBondContact O-CG 3.46Å; L167-M171 PolarHBondContact O-N 3.32Å; Q168-M171 PolarHBondContact O-N 3.01Å; M171-A174 PolarHBondContact O-N 3.49Å; M171-G175 PolarHBondContact O-N 3Å; M171-V181 HydrophobicContact CE-CB 4.02Å; M171-V181 HydrophobicContact CE-CG1 3.73Å; M171-A183 HydrophobicContact CE-CB 3.5Å
172	E	91.7	Very high	88.4	Confident	104 Å²	104	52.9 Å²	52.9	49%	0.486	29%	0.293	S	S	.	.	H	α-helix	trans	-58.5	-48	171.9	-75.4	170.5	-177.1	0	0	111.2	R139 Q168 A174 G175 Q176	R139-E172 IonicContact CZ-OE2 2.56Å; R139-E172 IonicContact NH2-OE2 2.82Å; R139-E172 PolarHBondContact NH2-OE2 3.16Å; Q168-E172 WeakPolarHBondContact O-CB 3.38Å; Q168-E172 VanDerWaalsContact O-CG 3.3Å; Q168-E172 WeakPolarHBondContact O-CG 3.05Å; Q168-E172 PolarHBondContact O-N 3.5Å; E172-A174 VanDerWaalsContact C-N 3.35Å; E172-G175 PolarHBondContact O-N 3.49Å; E172-Q176 WeakPolarHBondContact O-CG 3.44Å; E172-Q176 PolarHBondContact O-N 2.89Å
173	K	89.5	Confident	89.1	Confident	52 Å²	52	53.8 Å²	53.8	23%	0.226	31%	0.306	C	S	.	.	H	α-helix	trans	-66.9	-37.9	178.8	-166.5	66.5	172	173.5	0	111.8	L143 A169 I170 G175 Q176 N177 W179	L143-K173 HydrophobicContact CD2-CB 4.13Å; L143-K173 HydrophobicContact CD2-CG 4.3Å; A169-K173 WeakPolarHBondContact O-CB 3.47Å; A169-K173 PolarHBondContact O-N 3.07Å; A169-K173 VanDerWaalsContact O-N 3.16Å; I170-K173 PolarHBondContact O-N 3.37Å; K173-G175 VanDerWaalsContact C-N 3.35Å; K173-G175 PolarHBondContact O-N 3.34Å; K173-Q176 PolarHBondContact O-N 3Å; K173-N177 WeakPolarHBondContact CE-ND2 3.36Å; K173-N177 PolarHBondContact O-N 3.47Å; K173-W179 HydrophobicContact CB-CZ3 4.12Å; K173-W179 HydrophobicContact CG-CE3 4.32Å; K173-W179 HydrophobicContact CG-CH2 3.69Å; K173-W179 HydrophobicContact CG-CZ2 4.22Å; K173-W179 HydrophobicContact CG-CZ3 3.74Å
174	A	90.9	Very high	89.7	Confident	9 Å²	9	54.7 Å²	54.7	7%	0.074	31%	0.306	C	S	.	.	H	α-helix	trans	-62.3	-41.1	176.8	0	0	0	0	0	112.2	I170 M171 E172 Q176 G178 W179 V181	I170-A174 VanDerWaalsContact O-CB 3.25Å; I170-A174 WeakPolarHBondContact O-CB 3.49Å; I170-A174 PolarHBondContact O-N 3.17Å; M171-A174 PolarHBondContact O-N 3.49Å; E172-A174 VanDerWaalsContact C-N 3.35Å; A174-Q176 VanDerWaalsContact C-N 3.31Å; A174-Q176 PolarHBondContact O-N 3.45Å; A174-G178 CarbonylContact O-C 3.05Å; A174-G178 WeakPolarHBondContact O-CA 3.48Å; A174-G178 PolarHBondContact O-N 3.46Å; A174-W179 HydrophobicContact CB-CB 3.78Å; A174-W179 HydrophobicContact CB-CE3 4.43Å; A174-W179 PolarHBondContact O-N 3.15Å; A174-V181 HydrophobicContact CB-CG2 3.98Å
175	G	89.3	Confident	90.1	Very high	69 Å²	69	52.1 Å²	52.1	71%	0.711	30%	0.302	S	S	*	.	H	α-helix	trans	-63.4	-34.7	174.7	0	0	0	0	0	113.5	M171 E172 K173	M171-G175 PolarHBondContact O-N 3Å; E172-G175 PolarHBondContact O-N 3.49Å; K173-G175 VanDerWaalsContact C-N 3.35Å; K173-G175 PolarHBondContact O-N 3.34Å
176	Q	88.8	Confident	90.1	Very high	144 Å²	144	50.9 Å²	50.9	67%	0.673	29%	0.293	S	S	*	.	H	α-helix	trans	-75.3	-43	178.3	-68.2	174	2	0	0	112.9	E172 K173 A174	E172-Q176 WeakPolarHBondContact O-CG 3.44Å; E172-Q176 PolarHBondContact O-N 2.89Å; K173-Q176 PolarHBondContact O-N 3Å; A174-Q176 VanDerWaalsContact C-N 3.31Å; A174-Q176 PolarHBondContact O-N 3.45Å
177	N	86.2	Confident	89.4	Confident	79 Å²	79	52.8 Å²	52.8	42%	0.422	30%	0.301	S	S	.	.	H	α-helix	trans	-98.2	-1.9	-172.3	-72.2	-0.7	0	0	0	113.8	K173 W179	K173-N177 WeakPolarHBondContact CE-ND2 3.36Å; K173-N177 PolarHBondContact O-N 3.47Å; N177-W179 HydrophobicContact CB-CD2 4.41Å; N177-W179 HydrophobicContact CB-CG 4.25Å
178	G	86.1	Confident	88.7	Confident	50 Å²	50	58.4 Å²	58.4	52%	0.515	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	31.5	-176.2	0	0	0	0	0	113.8	A174 H180	A174-G178 CarbonylContact O-C 3.05Å; A174-G178 WeakPolarHBondContact O-CA 3.48Å; A174-G178 PolarHBondContact O-N 3.46Å; G178-H180 PolarHBondContact O-ND1 3.15Å; G178-H180 VanDerWaalsContact O-ND1 3.17Å
179	W	91.1	Very high	88.2	Confident	20 Å²	20	56.7 Å²	56.7	8%	0.076	32%	0.323	C	S	.	.			trans	-72	143.3	177.9	-60.8	-14.5	0	0	0	111.8	L146 D147 N152 F154 K173 A174 N177 V181	L146-W179 HydrophobicContact CB-CH2 3.94Å; L146-W179 HydrophobicContact CB-CZ3 4.36Å; L146-W179 HydrophobicContact CD1-CH2 4.49Å; L146-W179 HydrophobicContact CD1-CZ3 4.12Å; D147-W179 VanDerWaalsContact OD1-CZ2 3.31Å; D147-W179 WeakPolarHBondContact OD1-CZ2 3.34Å; N152-W179 CarbonylContact O-C 3.31Å; N152-W179 WeakPolarHBondContact O-CA 3.43Å; N152-W179 PolarHBondContact OD1-NE1 3.48Å; F154-W179 HydrophobicContact CE1-CD2 4.47Å; F154-W179 HydrophobicContact CE1-CE3 4.01Å; F154-W179 HydrophobicContact CE1-CZ3 4.44Å; F154-W179 HydrophobicContact CZ-CE3 4.14Å; F154-W179 HydrophobicContact CZ-CZ3 4.41Å; K173-W179 HydrophobicContact CB-CZ3 4.12Å; K173-W179 HydrophobicContact CG-CE3 4.32Å; K173-W179 HydrophobicContact CG-CH2 3.69Å; K173-W179 HydrophobicContact CG-CZ2 4.22Å; K173-W179 HydrophobicContact CG-CZ3 3.74Å; A174-W179 HydrophobicContact CB-CB 3.78Å; A174-W179 HydrophobicContact CB-CE3 4.43Å; A174-W179 PolarHBondContact O-N 3.15Å; N177-W179 HydrophobicContact CB-CD2 4.41Å; N177-W179 HydrophobicContact CB-CG 4.25Å; W179-V181 HydrophobicContact CB-CG2 4.06Å
180	H	88.4	Confident	87.8	Confident	136 Å²	136	62.1 Å²	62.1	63%	0.63	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	94.8	176.2	-67.2	59.8	0	0	0	108.8	N152 C153 F154 G178	N152-H180 PolarHBondContact O-N 2.84Å; C153-H180 WeakPolarHBondContact CA-O 3.48Å; C153-H180 HydrophobicContact CB-CB 4.35Å; F154-H180 PolarHBondContact N-O 3.36Å; G178-H180 PolarHBondContact O-ND1 3.15Å; G178-H180 VanDerWaalsContact O-ND1 3.17Å
181	V	92.6	Very high	87.5	Confident	28 Å²	28	65.4 Å²	65.4	17%	0.17	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121.5	-175.5	-174.7	0	0	0	0	110.3	F154 F156 I170 M171 A174 W179	F154-V181 HydrophobicContact CD2-CG1 4.27Å; F154-V181 HydrophobicContact CE1-CG2 3.94Å; F154-V181 HydrophobicContact CE2-CG1 3.82Å; F154-V181 HydrophobicContact CE2-CG2 4Å; F154-V181 HydrophobicContact CZ-CG1 4.29Å; F154-V181 HydrophobicContact CZ-CG2 3.61Å; F154-V181 WeakPolarHBondContact O-CA 3.34Å; F156-V181 HydrophobicContact CB-CG1 3.91Å; I170-V181 HydrophobicContact CG2-CG1 4.17Å; I170-V181 HydrophobicContact CG2-CG2 4.17Å; M171-V181 HydrophobicContact CE-CB 4.02Å; M171-V181 HydrophobicContact CE-CG1 3.73Å; A174-V181 HydrophobicContact CB-CG2 3.98Å; W179-V181 HydrophobicContact CB-CG2 4.06Å
182	S	92	Very high	87.2	Confident	38 Å²	38	66.3 Å²	66.3	27%	0.266	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	97.3	170.9	-67.9	0	0	0	0	109.6	F154 V155 F156	F154-S182 PolarHBondContact O-N 3.32Å; F154-S182 VanDerWaalsContact O-N 3.08Å; V155-S182 WeakPolarHBondContact CA-O 3.33Å; F156-S182 PolarHBondContact N-O 3.35Å
183	A	92.2	Very high	87	Confident	43 Å²	43	63.3 Å²	63.3	36%	0.355	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	125.4	178.6	0	0	0	0	0	111.8	F156 Y158 L167 M171	F156-A183 HydrophobicContact CD1-CB 4.34Å; F156-A183 CarbonylContact O-C 3.59Å; F156-A183 WeakPolarHBondContact O-CA 3.43Å; Y158-A183 HydrophobicContact CD1-CB 4.45Å; Y158-A183 HydrophobicContact CE1-CB 4.07Å; L167-A183 HydrophobicContact CD1-CB 3.84Å; M171-A183 HydrophobicContact CE-CB 3.5Å
184	I	91.8	Very high	86.8	Confident	37 Å²	37	61.2 Å²	61.2	19%	0.19	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	123.6	-174.6	-50.6	-177.8	0	0	0	109.5	V155 F156 L157 Y158 F189 L197 L201	V155-I184 HydrophobicContact CG1-CD1 4.05Å; V155-I184 HydrophobicContact CG1-CG1 4.47Å; F156-I184 PolarHBondContact O-N 2.94Å; L157-I184 WeakPolarHBondContact CA-O 3.35Å; L157-I184 HydrophobicContact CD2-CB 3.92Å; L157-I184 HydrophobicContact CD2-CD1 4.43Å; L157-I184 HydrophobicContact CD2-CG2 4.47Å; Y158-I184 WeakPolarHBondContact CD1-O 3.44Å; Y158-I184 PolarHBondContact N-O 2.98Å; I184-F189 HydrophobicContact CG2-CZ 4.46Å; I184-L197 HydrophobicContact CD1-CD1 3.71Å; I184-L197 HydrophobicContact CG2-CD1 4.29Å; I184-L197 HydrophobicContact CG2-CD2 4.13Å; I184-L201 HydrophobicContact CD1-CD1 4.28Å; I184-L201 HydrophobicContact CD1-CD2 4.14Å
185	C	90.8	Very high	86.6	Confident	44 Å²	44	66 Å²	66	30%	0.297	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126.3	177.9	-178.7	0	0	0	0	110.4	Y158 F189	Y158-C185 HydrophobicContact CE1-CB 4.12Å; Y158-C185 HydrophobicContact CE2-CB 4.13Å; Y158-C185 WeakPolarHBondContact O-CA 3.37Å; C185-F189 VanDerWaalsContact O-CE1 3.28Å; C185-F189 WeakPolarHBondContact O-CE1 3.29Å
186	V	86.6	Confident	86.5	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	37%	0.368	C	S	.	.			trans	-109.2	15.4	-172.6	-63.3	0	0	0	0	114.7	L157 Y158 N188 Y194 C213 I221	L157-V186 HydrophobicContact CB-CG1 4.37Å; L157-V186 HydrophobicContact CD2-CG1 4.25Å; Y158-V186 WeakPolarHBondContact O-CG2 3.37Å; Y158-V186 PolarHBondContact O-N 2.57Å; V186-N188 PolarHBondContact O-N 3.04Å; V186-Y194 HydrophobicContact CB-CE1 4.01Å; V186-Y194 HydrophobicContact CG1-CE1 4.09Å; V186-Y194 PolarHBondContact O-OH 2.94Å; V186-C213 VanDerWaalsContact CG2-SG 3.6Å; V186-I221 HydrophobicContact CG2-CD1 4.03Å
187	E	76.1	Confident	86.5	Confident	57 Å²	57	62.4 Å²	62.4	27%	0.266	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-41.9	-173	-165.6	178.6	157.8	0	0	114.9	T160	T160-E187 WeakPolarHBondContact CB-OE2 3.47Å; T160-E187 WeakPolarHBondContact CG2-OE2 3.38Å; T160-E187 PolarHBondContact OG1-OE2 3Å
188	N	75.3	Confident	86.6	Confident	143 Å²	143	59.1 Å²	59.1	77%	0.765	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	28.9	-174.4	-67.6	-37	0	0	0	113.5	V186	V186-N188 PolarHBondContact O-N 3.04Å
189	F	79.4	Confident	86.6	Confident	60 Å²	60	62.1 Å²	62.1	26%	0.263	32%	0.324	S	S	.	.			trans	-89.1	122.6	-173.5	-84.8	47.3	0	0	0	111.2	I184 C185 Y194 L197	I184-F189 HydrophobicContact CG2-CZ 4.46Å; C185-F189 VanDerWaalsContact O-CE1 3.28Å; C185-F189 WeakPolarHBondContact O-CE1 3.29Å; F189-Y194 HydrophobicContact CB-CD1 4.24Å; F189-Y194 HydrophobicContact CB-CD2 3.82Å; F189-Y194 HydrophobicContact CB-CE1 3.86Å; F189-Y194 HydrophobicContact CB-CE2 3.41Å; F189-Y194 VanDerWaalsContact CB-CE2 3.41Å; F189-Y194 HydrophobicContact CB-CG 4.22Å; F189-Y194 VanDerWaalsContact CB-CZ 3.44Å; F189-Y194 AromaticContact CD2-CD1 3.89Å; F189-Y194 HydrophobicContact CD2-CD1 3.89Å; F189-Y194 AromaticContact CD2-CE1 3.99Å; F189-Y194 HydrophobicContact CD2-CE1 3.99Å; F189-Y194 HydrophobicContact CD2-CG 4.24Å; F189-Y194 HydrophobicContact CG-CE1 4.24Å; F189-Y194 WeakPolarHBondContact O-CE2 3.22Å; F189-L197 HydrophobicContact CD2-CD2 4.43Å; F189-L197 HydrophobicContact CE2-CB 4.04Å; F189-L197 HydrophobicContact CE2-CD2 3.69Å; F189-L197 HydrophobicContact CE2-CG 4.36Å; F189-L197 HydrophobicContact CZ-CD2 4.43Å
190	N	82.9	Confident	86.5	Confident	117 Å²	117	65.5 Å²	65.5	63%	0.626	34%	0.34	S	S	*	.			trans	-80.7	163.5	164.2	-65	-4.4	0	0	0	109.6	V192 S193 Y194	N190-V192 PolarHBondContact O-N 3.36Å; N190-V192 VanDerWaalsContact O-N 3.08Å; N190-S193 WeakPolarHBondContact O-CA 3.22Å; N190-S193 WeakPolarHBondContact O-CB 3.47Å; N190-S193 PolarHBondContact O-N 2.87Å; N190-Y194 WeakPolarHBondContact O-CD2 3.43Å; N190-Y194 PolarHBondContact O-N 3.23Å
191	D	83.8	Confident	86.5	Confident	70 Å²	70	59.1 Å²	59.1	37%	0.374	31%	0.311	S	S	.	.	H	α-helix	trans	-51.8	-36.9	178	-66.4	3.3	0	0	0	113.1	Y194 R195 N220 Q224	D191-Y194 PolarHBondContact O-N 2.91Å; D191-R195 WeakPolarHBondContact O-CG 3.29Å; D191-R195 PolarHBondContact O-N 3.45Å; D191-R195 VanDerWaalsContact O-N 3.13Å; D191-N220 PolarHBondContact OD1-ND2 3.21Å; D191-Q224 VanDerWaalsContact CG-NE2 3.32Å; D191-Q224 PolarHBondContact OD2-NE2 3.3Å
192	V	85.4	Confident	86	Confident	92 Å²	92	59.6 Å²	59.6	56%	0.558	31%	0.313	S	S	*	.	H	α-helix	trans	-65.7	-43.4	176.6	-178.9	0	0	0	0	111.4	N190 Y194 R195 Q196	N190-V192 PolarHBondContact O-N 3.36Å; N190-V192 VanDerWaalsContact O-N 3.08Å; V192-Y194 VanDerWaalsContact C-N 3.31Å; V192-Y194 PolarHBondContact O-N 3.49Å; V192-R195 PolarHBondContact O-N 3.19Å; V192-Q196 WeakPolarHBondContact O-CG 3.26Å; V192-Q196 PolarHBondContact O-N 3.07Å
193	S	87.4	Confident	85.6	Confident	41 Å²	41	67.8 Å²	67.8	29%	0.287	34%	0.338	S	S	.	.	H	α-helix	trans	-64	-37.8	177.8	-54.2	0	0	0	0	111.3	N190 L197	N190-S193 WeakPolarHBondContact O-CA 3.22Å; N190-S193 WeakPolarHBondContact O-CB 3.47Å; N190-S193 PolarHBondContact O-N 2.87Å; S193-L197 WeakPolarHBondContact O-CB 3.04Å; S193-L197 PolarHBondContact O-N 2.97Å
194	Y	85.9	Confident	85.1	Confident	8 Å²	8	72.4 Å²	72.4	3%	0.031	35%	0.346	C	S	.	.	H	α-helix	trans	-61.9	-44.6	173.2	-80	-63.5	0	0	0	112.4	V186 F189 N190 D191 V192 L197 L198 I221 Q224	V186-Y194 HydrophobicContact CB-CE1 4.01Å; V186-Y194 HydrophobicContact CG1-CE1 4.09Å; V186-Y194 PolarHBondContact O-OH 2.94Å; F189-Y194 HydrophobicContact CB-CD1 4.24Å; F189-Y194 HydrophobicContact CB-CD2 3.82Å; F189-Y194 HydrophobicContact CB-CE1 3.86Å; F189-Y194 HydrophobicContact CB-CE2 3.41Å; F189-Y194 VanDerWaalsContact CB-CE2 3.41Å; F189-Y194 HydrophobicContact CB-CG 4.22Å; F189-Y194 VanDerWaalsContact CB-CZ 3.44Å; F189-Y194 AromaticContact CD2-CD1 3.89Å; F189-Y194 HydrophobicContact CD2-CD1 3.89Å; F189-Y194 AromaticContact CD2-CE1 3.99Å; F189-Y194 HydrophobicContact CD2-CE1 3.99Å; F189-Y194 HydrophobicContact CD2-CG 4.24Å; F189-Y194 HydrophobicContact CG-CE1 4.24Å; F189-Y194 WeakPolarHBondContact O-CE2 3.22Å; N190-Y194 WeakPolarHBondContact O-CD2 3.43Å; N190-Y194 PolarHBondContact O-N 3.23Å; D191-Y194 PolarHBondContact O-N 2.91Å; V192-Y194 VanDerWaalsContact C-N 3.31Å; V192-Y194 PolarHBondContact O-N 3.49Å; Y194-L197 PolarHBondContact O-N 3.45Å; Y194-L198 WeakPolarHBondContact O-CB 3.46Å; Y194-L198 VanDerWaalsContact O-CG 3.28Å; Y194-L198 WeakPolarHBondContact O-CG 3.16Å; Y194-L198 PolarHBondContact O-N 3.39Å; Y194-I221 HydrophobicContact CD1-CG1 4.23Å; Y194-I221 HydrophobicContact CE1-CD1 4Å; Y194-I221 HydrophobicContact CE1-CG1 3.48Å; Y194-I221 VanDerWaalsContact CE1-CG1 3.48Å; Y194-Q224 HydrophobicContact CD2-CG 4.49Å; Y194-Q224 HydrophobicContact CG-CG 4.43Å
195	R	85.7	Confident	84.6	Confident	109 Å²	109	72.9 Å²	72.9	41%	0.411	35%	0.348	S	S	.	.	H	α-helix	trans	-64.3	-45.8	178.2	-67.8	-178.9	-169.6	154.3	7.1	112	D191 V192 L197 L198 E199 V228	D191-R195 WeakPolarHBondContact O-CG 3.29Å; D191-R195 PolarHBondContact O-N 3.45Å; D191-R195 VanDerWaalsContact O-N 3.13Å; V192-R195 PolarHBondContact O-N 3.19Å; R195-L197 VanDerWaalsContact C-N 3.31Å; R195-L197 PolarHBondContact O-N 3.07Å; R195-L198 PolarHBondContact O-N 3.46Å; R195-E199 WeakPolarHBondContact O-CB 2.99Å; R195-E199 WeakPolarHBondContact O-CG 3.48Å; R195-E199 PolarHBondContact O-N 3.28Å; R195-V228 HydrophobicContact CB-CG2 4.33Å; R195-V228 HydrophobicContact CG-CG2 3.82Å
196	Q	87.9	Confident	84.4	Confident	120 Å²	120	72.5 Å²	72.5	56%	0.561	34%	0.341	S	S	*	.	H	α-helix	trans	-58.7	-43.3	176.5	-73	177.6	-14.9	0	0	111.8	V192 E199 E200	V192-Q196 WeakPolarHBondContact O-CG 3.26Å; V192-Q196 PolarHBondContact O-N 3.07Å; Q196-E199 PolarHBondContact O-N 2.98Å; Q196-E200 WeakPolarHBondContact O-CB 3.47Å; Q196-E200 PolarHBondContact O-N 3.17Å
197	L	89.5	Confident	84.4	Confident	18 Å²	18	74 Å²	74	9%	0.094	35%	0.348	C	S	.	.	H	α-helix	trans	-61.6	-49.3	175.7	176.3	66.6	0	0	0	111.5	L157 I184 F189 S193 Y194 R195 E199 E200 L201	L157-L197 HydrophobicContact CD2-CD2 4.19Å; I184-L197 HydrophobicContact CD1-CD1 3.71Å; I184-L197 HydrophobicContact CG2-CD1 4.29Å; I184-L197 HydrophobicContact CG2-CD2 4.13Å; F189-L197 HydrophobicContact CD2-CD2 4.43Å; F189-L197 HydrophobicContact CE2-CB 4.04Å; F189-L197 HydrophobicContact CE2-CD2 3.69Å; F189-L197 HydrophobicContact CE2-CG 4.36Å; F189-L197 HydrophobicContact CZ-CD2 4.43Å; S193-L197 WeakPolarHBondContact O-CB 3.04Å; S193-L197 PolarHBondContact O-N 2.97Å; Y194-L197 PolarHBondContact O-N 3.45Å; R195-L197 VanDerWaalsContact C-N 3.31Å; R195-L197 PolarHBondContact O-N 3.07Å; L197-E199 VanDerWaalsContact C-N 3.28Å; L197-E199 PolarHBondContact O-N 2.86Å; L197-E200 PolarHBondContact O-N 2.92Å; L197-L201 HydrophobicContact CD1-CD1 3.89Å; L197-L201 HydrophobicContact CD1-CG 4.05Å; L197-L201 HydrophobicContact CD2-CD1 4.41Å; L197-L201 HydrophobicContact CG-CD1 3.85Å; L197-L201 HydrophobicContact CG-CG 4.34Å; L197-L201 WeakPolarHBondContact O-CB 3.49Å; L197-L201 VanDerWaalsContact O-CG 3.25Å; L197-L201 WeakPolarHBondContact O-CG 3.4Å; L197-L201 PolarHBondContact O-N 3.26Å
198	L	87.6	Confident	85.3	Confident	11 Å²	11	74.9 Å²	74.9	6%	0.058	35%	0.351	C	S	.	.	H	α-helix	trans	-63.3	-34.9	-179.5	-70.1	171.8	0	0	0	112.1	Y194 R195 D202 Q224 I225 V228	Y194-L198 WeakPolarHBondContact O-CB 3.46Å; Y194-L198 VanDerWaalsContact O-CG 3.28Å; Y194-L198 WeakPolarHBondContact O-CG 3.16Å; Y194-L198 PolarHBondContact O-N 3.39Å; R195-L198 PolarHBondContact O-N 3.46Å; L198-D202 WeakPolarHBondContact O-CB 3.43Å; L198-D202 PolarHBondContact O-N 3.02Å; L198-Q224 HydrophobicContact CD1-CB 4.4Å; L198-I225 HydrophobicContact CD1-CG1 4.02Å; L198-I225 HydrophobicContact CD2-CG1 4.08Å; L198-V228 HydrophobicContact CD1-CG2 4.13Å
199	E	86.7	Confident	86.2	Confident	112 Å²	112	68.3 Å²	68.3	52%	0.523	32%	0.315	S	S	.	.	H	α-helix	trans	-68.1	-42.6	173.2	-74.1	176.5	-179.2	0	0	112.1	R195 Q196 L197 D202 R203 V228	R195-E199 WeakPolarHBondContact O-CB 2.99Å; R195-E199 WeakPolarHBondContact O-CG 3.48Å; R195-E199 PolarHBondContact O-N 3.28Å; Q196-E199 PolarHBondContact O-N 2.98Å; L197-E199 VanDerWaalsContact C-N 3.28Å; L197-E199 PolarHBondContact O-N 2.86Å; E199-D202 PolarHBondContact O-N 3.38Å; E199-R203 WeakPolarHBondContact O-CG 3.49Å; E199-R203 PolarHBondContact O-N 2.95Å; E199-V228 HydrophobicContact CG-CG1 4.48Å
200	E	88.4	Confident	87	Confident	91 Å²	91	65.4 Å²	65.4	43%	0.425	30%	0.303	S	S	.	.	H	α-helix	trans	-62.5	-45.1	175.8	-173.5	-178.6	175.5	0	0	111.6	Q196 L197 D202 R203 R204	Q196-E200 WeakPolarHBondContact O-CB 3.47Å; Q196-E200 PolarHBondContact O-N 3.17Å; L197-E200 PolarHBondContact O-N 2.92Å; E200-D202 VanDerWaalsContact C-N 3.3Å; E200-D202 PolarHBondContact O-N 3.43Å; E200-R203 WeakPolarHBondContact O-CB 3.32Å; E200-R203 PolarHBondContact O-N 3.1Å; E200-R204 WeakPolarHBondContact O-CG 3.48Å; E200-R204 PolarHBondContact O-N 2.97Å; E200-R204 VanDerWaalsContact O-N 3.13Å; E200-R204 IonicContact OE1-CZ 3.37Å; E200-R204 IonicContact OE1-NE 3.71Å; E200-R204 IonicContact OE1-NH2 3.16Å; E200-R204 PolarHBondContact OE1-NH2 3.23Å
201	L	87.8	Confident	87.5	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-65.9	-34	177.4	-66	177.2	0	0	0	111.6	V155 I184 L197 R204 Q205 E206 F209	V155-L201 HydrophobicContact CG1-CD1 4.08Å; V155-L201 HydrophobicContact CG2-CD1 4.46Å; V155-L201 HydrophobicContact CG2-CD2 4.08Å; I184-L201 HydrophobicContact CD1-CD1 4.28Å; I184-L201 HydrophobicContact CD1-CD2 4.14Å; L197-L201 HydrophobicContact CD1-CD1 3.89Å; L197-L201 HydrophobicContact CD1-CG 4.05Å; L197-L201 HydrophobicContact CD2-CD1 4.41Å; L197-L201 HydrophobicContact CG-CD1 3.85Å; L197-L201 HydrophobicContact CG-CG 4.34Å; L197-L201 WeakPolarHBondContact O-CB 3.49Å; L197-L201 VanDerWaalsContact O-CG 3.25Å; L197-L201 WeakPolarHBondContact O-CG 3.4Å; L197-L201 PolarHBondContact O-N 3.26Å; L201-R204 CarbonylContact O-C 3.59Å; L201-R204 PolarHBondContact O-N 2.84Å; L201-Q205 PolarHBondContact O-N 2.89Å; L201-E206 HydrophobicContact CB-CB 4.38Å; L201-E206 HydrophobicContact CD2-CG 4.41Å; L201-E206 PolarHBondContact O-N 3.34Å; L201-F209 HydrophobicContact CB-CZ 4.5Å; L201-F209 HydrophobicContact CD1-CE1 3.78Å
202	D	83.5	Confident	88	Confident	39 Å²	39	56.9 Å²	56.9	21%	0.209	26%	0.257	C	S	.	.	H	α-helix	trans	-70.2	-35.5	172.8	-167.9	38	0	0	0	112.4	L198 E199 E200 R204 Q205 K207 K230 Y235	L198-D202 WeakPolarHBondContact O-CB 3.43Å; L198-D202 PolarHBondContact O-N 3.02Å; E199-D202 PolarHBondContact O-N 3.38Å; E200-D202 VanDerWaalsContact C-N 3.3Å; E200-D202 PolarHBondContact O-N 3.43Å; D202-R204 PolarHBondContact O-N 3.23Å; D202-Q205 WeakPolarHBondContact O-CA 3.39Å; D202-Q205 PolarHBondContact O-N 3.32Å; D202-Q205 PolarHBondContact O-NE2 3.45Å; D202-K207 IonicContact OD1-NZ 2.72Å; D202-K207 PolarHBondContact OD1-NZ 3.14Å; D202-K230 WeakPolarHBondContact OD2-CE 3.29Å; D202-K230 IonicContact OD2-NZ 3.61Å; D202-K230 PolarHBondContact OD2-NZ 3.13Å; D202-Y235 PolarHBondContact OD1-OH 3.35Å
203	R	82.9	Confident	88.1	Confident	209 Å²	209	52.5 Å²	52.5	79%	0.789	23%	0.231	S	C	*	.	H	α-helix	trans	-60.1	-34.7	171.2	-73.9	-176.9	68.7	-169.4	0.4	111.9	E199 E200 Q205	E199-R203 WeakPolarHBondContact O-CG 3.49Å; E199-R203 PolarHBondContact O-N 2.95Å; E200-R203 WeakPolarHBondContact O-CB 3.32Å; E200-R203 PolarHBondContact O-N 3.1Å; R203-Q205 PolarHBondContact O-N 3.06Å
204	R	82.6	Confident	88	Confident	140 Å²	140	54.5 Å²	54.5	53%	0.528	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-4.5	173.2	-61.2	177.8	-171	-160.3	3.8	113.4	E200 L201 D202 E206	E200-R204 WeakPolarHBondContact O-CG 3.48Å; E200-R204 PolarHBondContact O-N 2.97Å; E200-R204 VanDerWaalsContact O-N 3.13Å; E200-R204 IonicContact OE1-CZ 3.37Å; E200-R204 IonicContact OE1-NE 3.71Å; E200-R204 IonicContact OE1-NH2 3.16Å; E200-R204 PolarHBondContact OE1-NH2 3.23Å; L201-R204 CarbonylContact O-C 3.59Å; L201-R204 PolarHBondContact O-N 2.84Å; D202-R204 PolarHBondContact O-N 3.23Å; R204-E206 VanDerWaalsContact C-N 3.27Å; R204-E206 HydrophobicContact CB-CG 4.04Å; R204-E206 PolarHBondContact O-N 2.85Å
205	Q	81.1	Confident	87.9	Confident	48 Å²	48	55.1 Å²	55.1	22%	0.224	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	33	-174.3	-63.3	-64.7	-56.6	0	0	113.7	L201 D202 R203 K207 Y491	L201-Q205 PolarHBondContact O-N 2.89Å; D202-Q205 WeakPolarHBondContact O-CA 3.39Å; D202-Q205 PolarHBondContact O-N 3.32Å; D202-Q205 PolarHBondContact O-NE2 3.45Å; R203-Q205 PolarHBondContact O-N 3.06Å; Q205-K207 PolarHBondContact O-N 3.34Å; Q205-Y491 HydrophobicContact CB-CD1 4.22Å; Q205-Y491 HydrophobicContact CB-CE1 3.96Å; Q205-Y491 HydrophobicContact CG-CE1 4.33Å
206	E	85.6	Confident	87.8	Confident	35 Å²	35	56.5 Å²	56.5	16%	0.164	25%	0.25	C	S	.	.			trans	-74.1	123.8	173.9	-64.9	-66.1	172.7	0	0	110.5	V155 L201 R204 F209	V155-E206 HydrophobicContact CG2-CB 3.83Å; V155-E206 HydrophobicContact CG2-CG 3.86Å; L201-E206 HydrophobicContact CB-CB 4.38Å; L201-E206 HydrophobicContact CD2-CG 4.41Å; L201-E206 PolarHBondContact O-N 3.34Å; R204-E206 VanDerWaalsContact C-N 3.27Å; R204-E206 HydrophobicContact CB-CG 4.04Å; R204-E206 PolarHBondContact O-N 2.85Å; E206-F209 HydrophobicContact CB-CZ 4.38Å; E206-F209 WeakPolarHBondContact O-CE2 3.45Å; E206-F209 WeakPolarHBondContact O-CZ 3.3Å
207	K	87.4	Confident	87.7	Confident	33 Å²	33	53.3 Å²	53.3	14%	0.143	23%	0.233	C	C	.	.			trans	-120.9	-8.7	-176.3	-53.8	-58.2	174.8	-161.5	0	114.2	D202 Q205 G234 Y235 H236	D202-K207 IonicContact OD1-NZ 2.72Å; D202-K207 PolarHBondContact OD1-NZ 3.14Å; Q205-K207 PolarHBondContact O-N 3.34Å; K207-G234 WeakPolarHBondContact CB-O 3.37Å; K207-Y235 HydrophobicContact CB-CD1 4.33Å; K207-Y235 HydrophobicContact CD-CD1 3.95Å; K207-Y235 HydrophobicContact CD-CD2 4.3Å; K207-Y235 HydrophobicContact CD-CE1 3.46Å; K207-Y235 VanDerWaalsContact CD-CE1 3.46Å; K207-Y235 HydrophobicContact CD-CE2 3.89Å; K207-Y235 HydrophobicContact CD-CG 4.32Å; K207-Y235 VanDerWaalsContact CD-CZ 3.43Å; K207-Y235 PolarHBondContact NZ-OH 3.41Å; K207-Y235 WeakPolarHBondContact O-CA 3.39Å; K207-H236 PolarHBondContact O-N 3.11Å
208	K	93.9	Very high	87.7	Confident	75 Å²	75	52.5 Å²	52.5	33%	0.326	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	119.6	-174.4	-67.2	178.1	177.7	-170.8	0	109.6	W151 C153 F154 V155 H236	W151-K208 HydrophobicContact CD2-CB 4.3Å; W151-K208 HydrophobicContact CD2-CD 3.85Å; W151-K208 HydrophobicContact CD2-CG 4.33Å; W151-K208 HydrophobicContact CE3-CB 4.04Å; W151-K208 HydrophobicContact CE3-CD 4.38Å; W151-K208 HydrophobicContact CG-CD 4.09Å; W151-K208 HydrophobicContact CH2-CB 3.8Å; W151-K208 HydrophobicContact CH2-CG 4.16Å; W151-K208 HydrophobicContact CZ2-CB 4.06Å; W151-K208 HydrophobicContact CZ2-CD 4.2Å; W151-K208 HydrophobicContact CZ2-CG 3.89Å; W151-K208 HydrophobicContact CZ3-CB 3.79Å; W151-K208 HydrophobicContact CZ3-CG 4.48Å; C153-K208 WeakPolarHBondContact O-CD 3.22Å; F154-K208 HydrophobicContact CB-CB 3.81Å; V155-K208 PolarHBondContact N-O 3.4Å; K208-H236 WeakPolarHBondContact CA-O 3.3Å
209	F	95.3	Very high	87.7	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.018	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	134.4	-172.4	-64.5	-94.9	0	0	0	110.5	V155 L157 L201 E206 Y235 H236 Y237 I238	V155-F209 HydrophobicContact CB-CD1 3.85Å; V155-F209 HydrophobicContact CB-CE1 4.08Å; V155-F209 HydrophobicContact CG1-CD1 4.17Å; V155-F209 HydrophobicContact CG1-CE1 4.32Å; V155-F209 HydrophobicContact CG2-CD1 4.43Å; V155-F209 HydrophobicContact CG2-CE1 4.19Å; V155-F209 CarbonylContact O-C 3.58Å; V155-F209 WeakPolarHBondContact O-CA 3.32Å; L157-F209 HydrophobicContact CD1-CD1 4.49Å; L201-F209 HydrophobicContact CB-CZ 4.5Å; L201-F209 HydrophobicContact CD1-CE1 3.78Å; E206-F209 HydrophobicContact CB-CZ 4.38Å; E206-F209 WeakPolarHBondContact O-CE2 3.45Å; E206-F209 WeakPolarHBondContact O-CZ 3.3Å; F209-Y235 HydrophobicContact CD2-CD1 4.38Å; F209-Y235 AromaticContact CE2-CD1 3.77Å; F209-Y235 HydrophobicContact CE2-CD1 3.77Å; F209-Y235 AromaticContact CE2-CE1 3.98Å; F209-Y235 HydrophobicContact CE2-CE1 3.98Å; F209-H236 PolarHBondContact N-O 3.26Å; F209-Y237 HydrophobicContact CB-CD1 3.52Å; F209-Y237 HydrophobicContact CB-CE1 3.77Å; F209-Y237 HydrophobicContact CB-CG 4.5Å; F209-Y237 HydrophobicContact CD1-CE1 4.47Å; F209-Y237 HydrophobicContact CD2-CD1 4.08Å; F209-Y237 AromaticContact CD2-CE1 3.54Å; F209-Y237 HydrophobicContact CD2-CE1 3.54Å; F209-Y237 HydrophobicContact CE2-CE1 4.28Å; F209-Y237 AromaticContact CG-CD1 3.99Å; F209-Y237 HydrophobicContact CG-CD1 3.99Å; F209-Y237 AromaticContact CG-CE1 3.67Å; F209-Y237 HydrophobicContact CG-CE1 3.67Å; F209-Y237 CarbonylContact O-C 3.57Å; F209-Y237 WeakPolarHBondContact O-CA 3.49Å; F209-I238 PolarHBondContact O-N 2.98Å
210	V	95.8	Very high	87.8	Confident	0 Å²	0	53 Å²	53	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	124	168.1	-179.4	0	0	0	0	106.9	L142 L146 W151 F154 V155 F156 L157 I238	L142-V210 HydrophobicContact CD1-CG1 4.1Å; L142-V210 HydrophobicContact CD2-CG1 4.21Å; L146-V210 HydrophobicContact CD2-CG2 4Å; W151-V210 HydrophobicContact CE3-CG2 4.33Å; W151-V210 HydrophobicContact CZ3-CG2 3.89Å; F154-V210 HydrophobicContact CD2-CB 4.48Å; F154-V210 HydrophobicContact CD2-CG2 3.72Å; F154-V210 HydrophobicContact CE2-CG2 3.97Å; F154-V210 HydrophobicContact CG-CG2 4.48Å; V155-V210 PolarHBondContact O-N 2.92Å; F156-V210 WeakPolarHBondContact CA-O 3.41Å; F156-V210 HydrophobicContact CD2-CB 3.82Å; F156-V210 HydrophobicContact CD2-CG1 3.63Å; F156-V210 HydrophobicContact CE2-CB 4.5Å; F156-V210 HydrophobicContact CE2-CG1 3.82Å; L157-V210 PolarHBondContact N-O 2.95Å; V210-I238 WeakPolarHBondContact CA-O 3.49Å; V210-I238 HydrophobicContact CG2-CB 4.25Å; V210-I238 HydrophobicContact CG2-CD1 4.32Å
211	I	94.1	Very high	87.9	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	113.7	-175.3	-49.1	-180	0	0	0	109.5	L157 C213 L218 I221 I225 Y237 I238 A240	L157-I211 HydrophobicContact CB-CG2 4.49Å; L157-I211 HydrophobicContact CD1-CG1 4.35Å; I211-C213 HydrophobicContact CG2-CB 4.43Å; I211-L218 HydrophobicContact CB-CD1 4.2Å; I211-L218 HydrophobicContact CD1-CD1 4.48Å; I211-L218 HydrophobicContact CG2-CD1 3.59Å; I211-I221 HydrophobicContact CD1-CG2 4.17Å; I211-I221 HydrophobicContact CG2-CD1 4.42Å; I211-I225 HydrophobicContact CD1-CD1 4.13Å; I211-Y237 HydrophobicContact CD1-CD1 4.07Å; I211-I238 PolarHBondContact N-O 3.17Å; I211-A240 WeakPolarHBondContact O-CB 3.32Å; I211-A240 PolarHBondContact O-N 3.44Å
212	D	92.8	Very high	88	Confident	6 Å²	6	49 Å²	49	3%	0.032	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	83.7	178.4	-177	-18.9	0	0	0	109.4	F156 L157 Y158 D159 R162 I166 A240	F156-D212 HydrophobicContact CE2-CB 3.84Å; F156-D212 HydrophobicContact CZ-CB 3.68Å; L157-D212 PolarHBondContact O-N 2.94Å; Y158-D212 CarbonylContact C-O 3.58Å; Y158-D212 VanDerWaalsContact CA-O 3.28Å; Y158-D212 WeakPolarHBondContact CA-O 3.4Å; D159-D212 PolarHBondContact N-O 3.33Å; R162-D212 IonicContact CZ-OD1 3.55Å; R162-D212 IonicContact NE-OD1 2.83Å; R162-D212 PolarHBondContact NE-OD1 3.47Å; R162-D212 IonicContact NH1-OD1 3.99Å; R162-D212 IonicContact NH2-OD1 3.62Å; R162-D212 PolarHBondContact NH2-OD1 3.28Å; R162-D212 IonicContact NH2-OD2 3.94Å; I166-D212 WeakPolarHBondContact CB-OD2 3.23Å; I166-D212 VanDerWaalsContact CD1-OD2 3.26Å; I166-D212 WeakPolarHBondContact CD1-OD2 3.39Å; I166-D212 WeakPolarHBondContact CG2-OD2 3.37Å; D212-A240 HydrophobicContact CB-CB 4.17Å
213	C	89.3	Confident	88.3	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.007	23%	0.228	C	C	.	.			trans	-137.7	165.3	179.5	-60.2	0	0	0	0	111.3	R162 V186 I211 R217 L218 I221	R162-C213 PolarHBondContact NH1-O 2.99Å; R162-C213 VanDerWaalsContact NH1-O 3.15Å; V186-C213 VanDerWaalsContact CG2-SG 3.6Å; I211-C213 HydrophobicContact CG2-CB 4.43Å; C213-R217 HydrophobicContact CB-CB 4.38Å; C213-L218 HydrophobicContact CB-CB 4.38Å; C213-I221 HydrophobicContact CB-CD1 4.5Å
214	E	84.3	Confident	88.6	Confident	83 Å²	83	42.8 Å²	42.8	39%	0.388	19%	0.193	S	C	.	.			trans	-68.4	161.7	166.4	-65	-157	151.2	0	0	112.3	R162 E216 R217 L218	R162-E214 HydrophobicContact CG-CG 4Å; E214-E216 VanDerWaalsContact C-N 3.34Å; E214-E216 PolarHBondContact O-N 2.86Å; E214-R217 PolarHBondContact O-N 3.33Å; E214-L218 WeakPolarHBondContact O-CB 3.33Å; E214-L218 PolarHBondContact O-N 3.16Å
215	I	84.1	Confident	89	Confident	20 Å²	20	36.1 Å²	36.1	10%	0.103	17%	0.168	C	C	.	.	H	α-helix	trans	-58.9	-44	-171.5	-64.1	172.2	0	0	0	111.7	L218 Q219 N241 K295 Y296	I215-L218 PolarHBondContact O-N 2.9Å; I215-Q219 WeakPolarHBondContact O-CG 3.37Å; I215-Q219 PolarHBondContact O-N 2.83Å; I215-N241 WeakPolarHBondContact CG1-ND2 3.35Å; I215-K295 HydrophobicContact CD1-CD 4.24Å; I215-Y296 HydrophobicContact CD1-CD1 4.43Å; I215-Y296 HydrophobicContact CD1-CE1 4.03Å
216	E	82.6	Confident	89.5	Confident	138 Å²	138	35 Å²	35	65%	0.645	16%	0.164	S	C	*	.	H	α-helix	trans	-63.4	-46.5	-177.3	-62.5	-177.8	-179.3	0	0	111.5	E214 Q219 N220	E214-E216 VanDerWaalsContact C-N 3.34Å; E214-E216 PolarHBondContact O-N 2.86Å; E216-Q219 PolarHBondContact O-N 3.36Å; E216-N220 PolarHBondContact O-N 2.99Å
217	R	86.6	Confident	89.6	Confident	54 Å²	54	36.7 Å²	36.7	20%	0.204	18%	0.18	C	C	.	.	H	α-helix	trans	-70.8	-38.3	178.9	-164.1	171.4	-57.2	156.6	16.1	112.1	D159 D161 C213 E214 Q219 N220 I221	D159-R217 IonicContact OD1-CZ 2.72Å; D159-R217 IonicContact OD1-NH1 3.87Å; D159-R217 PolarHBondContact OD1-NH1 3.39Å; D159-R217 IonicContact OD1-NH2 2.73Å; D159-R217 IonicContact OD2-CZ 3.56Å; D159-R217 IonicContact OD2-NE 3.48Å; D159-R217 IonicContact OD2-NH1 2.78Å; D159-R217 PolarHBondContact OD2-NH1 2.87Å; D159-R217 IonicContact OD2-NH2 3.76Å; D159-R217 PolarHBondContact OD2-NH2 3.39Å; D161-R217 IonicContact OD2-CZ 3.26Å; D161-R217 IonicContact OD2-NH1 2.81Å; D161-R217 IonicContact OD2-NH2 3.47Å; D161-R217 PolarHBondContact OD2-NH2 3.12Å; C213-R217 HydrophobicContact CB-CB 4.38Å; E214-R217 PolarHBondContact O-N 3.33Å; R217-Q219 VanDerWaalsContact C-N 3.31Å; R217-Q219 PolarHBondContact O-N 2.94Å; R217-N220 PolarHBondContact O-N 3.1Å; R217-I221 HydrophobicContact CG-CD1 4.21Å; R217-I221 WeakPolarHBondContact O-CG1 3.46Å; R217-I221 PolarHBondContact O-N 3.3Å
218	L	89	Confident	89.6	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-59.1	-42.3	175.5	177.5	63.1	0	0	0	111.5	I211 C213 E214 I215 I221 L222 I239 I247	I211-L218 HydrophobicContact CB-CD1 4.2Å; I211-L218 HydrophobicContact CD1-CD1 4.48Å; I211-L218 HydrophobicContact CG2-CD1 3.59Å; C213-L218 HydrophobicContact CB-CB 4.38Å; E214-L218 WeakPolarHBondContact O-CB 3.33Å; E214-L218 PolarHBondContact O-N 3.16Å; I215-L218 PolarHBondContact O-N 2.9Å; L218-I221 PolarHBondContact O-N 3.42Å; L218-L222 HydrophobicContact CD1-CD1 4.13Å; L218-L222 HydrophobicContact CD1-CG 4.15Å; L218-L222 HydrophobicContact CG-CD1 4Å; L218-L222 HydrophobicContact CG-CG 4.43Å; L218-L222 WeakPolarHBondContact O-CB 3.34Å; L218-L222 VanDerWaalsContact O-CG 3.23Å; L218-L222 WeakPolarHBondContact O-CG 3.48Å; L218-L222 PolarHBondContact O-N 3.02Å; L218-I239 HydrophobicContact CD1-CG2 4.41Å; L218-I239 HydrophobicContact CD2-CG2 3.58Å; L218-I247 HydrophobicContact CD2-CD1 3.39Å; L218-I247 HydrophobicContact CD2-CG1 4Å
219	Q	88.2	Confident	89.3	Confident	80 Å²	80	34.6 Å²	34.6	37%	0.374	18%	0.182	S	C	.	.	H	α-helix	trans	-60.8	-46.2	175.8	-76.3	178.6	-11.7	0	0	111.7	I215 E216 R217 I221 L222 E223	I215-Q219 WeakPolarHBondContact O-CG 3.37Å; I215-Q219 PolarHBondContact O-N 2.83Å; E216-Q219 PolarHBondContact O-N 3.36Å; R217-Q219 VanDerWaalsContact C-N 3.31Å; R217-Q219 PolarHBondContact O-N 2.94Å; Q219-I221 PolarHBondContact O-N 3.46Å; Q219-L222 PolarHBondContact O-N 3.41Å; Q219-E223 WeakPolarHBondContact O-CG 3.4Å; Q219-E223 PolarHBondContact O-N 3.05Å
220	N	88.4	Confident	89	Confident	52 Å²	52	35.9 Å²	35.9	28%	0.278	19%	0.187	S	C	.	.	H	α-helix	trans	-60.2	-46.1	175.9	-170.5	3.1	0	0	0	111.6	D191 E216 R217 L222 E223 Q224	D191-N220 PolarHBondContact OD1-ND2 3.21Å; E216-N220 PolarHBondContact O-N 2.99Å; R217-N220 PolarHBondContact O-N 3.1Å; N220-L222 VanDerWaalsContact C-N 3.33Å; N220-L222 PolarHBondContact O-N 2.82Å; N220-E223 PolarHBondContact O-N 2.99Å; N220-Q224 WeakPolarHBondContact O-CG 3.39Å; N220-Q224 PolarHBondContact O-N 3.26Å; N220-Q224 PolarHBondContact OD1-NE2 3.44Å
221	I	90.3	Very high	88.7	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-58.1	-45.9	178	-68.1	168	0	0	0	111.4	V186 Y194 I211 C213 R217 L218 Q219 E223 Q224 I225	V186-I221 HydrophobicContact CG2-CD1 4.03Å; Y194-I221 HydrophobicContact CD1-CG1 4.23Å; Y194-I221 HydrophobicContact CE1-CD1 4Å; Y194-I221 HydrophobicContact CE1-CG1 3.48Å; Y194-I221 VanDerWaalsContact CE1-CG1 3.48Å; I211-I221 HydrophobicContact CD1-CG2 4.17Å; I211-I221 HydrophobicContact CG2-CD1 4.42Å; C213-I221 HydrophobicContact CB-CD1 4.5Å; R217-I221 HydrophobicContact CG-CD1 4.21Å; R217-I221 WeakPolarHBondContact O-CG1 3.46Å; R217-I221 PolarHBondContact O-N 3.3Å; L218-I221 PolarHBondContact O-N 3.42Å; Q219-I221 PolarHBondContact O-N 3.46Å; I221-E223 VanDerWaalsContact C-N 3.33Å; I221-E223 PolarHBondContact O-N 3.28Å; I221-Q224 PolarHBondContact O-N 3.38Å; I221-I225 HydrophobicContact CG2-CD1 3.76Å; I221-I225 HydrophobicContact CG2-CG1 4.41Å; I221-I225 VanDerWaalsContact O-CG1 3.29Å; I221-I225 WeakPolarHBondContact O-CG1 2.86Å; I221-I225 PolarHBondContact O-N 3.38Å
222	L	90.4	Very high	88.4	Confident	7 Å²	7	40.9 Å²	40.9	4%	0.037	22%	0.215	C	C	.	.	H	α-helix	trans	-63.5	-39	179.1	-70.7	173.9	0	0	0	111.8	L218 Q219 N220 I225 V226 I239 I247 L249 F252	L218-L222 HydrophobicContact CD1-CD1 4.13Å; L218-L222 HydrophobicContact CD1-CG 4.15Å; L218-L222 HydrophobicContact CG-CD1 4Å; L218-L222 HydrophobicContact CG-CG 4.43Å; L218-L222 WeakPolarHBondContact O-CB 3.34Å; L218-L222 VanDerWaalsContact O-CG 3.23Å; L218-L222 WeakPolarHBondContact O-CG 3.48Å; L218-L222 PolarHBondContact O-N 3.02Å; Q219-L222 PolarHBondContact O-N 3.41Å; N220-L222 VanDerWaalsContact C-N 3.33Å; N220-L222 PolarHBondContact O-N 2.82Å; L222-I225 HydrophobicContact CD2-CD1 4.45Å; L222-I225 PolarHBondContact O-N 3.09Å; L222-V226 WeakPolarHBondContact O-CG2 3.3Å; L222-V226 PolarHBondContact O-N 3.35Å; L222-V226 VanDerWaalsContact O-N 3.1Å; L222-I239 HydrophobicContact CD1-CD1 4.49Å; L222-I247 HydrophobicContact CD1-CG2 3.48Å; L222-I247 VanDerWaalsContact CD1-CG2 3.48Å; L222-L249 HydrophobicContact CD1-CD2 4.13Å; L222-F252 HydrophobicContact CB-CE2 3.93Å; L222-F252 HydrophobicContact CB-CZ 4.34Å; L222-F252 HydrophobicContact CD2-CE1 4.36Å; L222-F252 HydrophobicContact CD2-CE2 3.77Å; L222-F252 HydrophobicContact CD2-CZ 3.58Å; L222-F252 HydrophobicContact CG-CE2 4.38Å
223	E	89.9	Confident	87.8	Confident	105 Å²	105	46 Å²	46	49%	0.491	24%	0.237	S	C	.	.	H	α-helix	trans	-63.6	-43.1	174	-73.3	-176.8	174.7	0	0	112.2	Q219 N220 I221 V226 S227	Q219-E223 WeakPolarHBondContact O-CG 3.4Å; Q219-E223 PolarHBondContact O-N 3.05Å; N220-E223 PolarHBondContact O-N 2.99Å; I221-E223 VanDerWaalsContact C-N 3.33Å; I221-E223 PolarHBondContact O-N 3.28Å; E223-V226 PolarHBondContact O-N 2.83Å; E223-S227 PolarHBondContact O-N 2.85Å
224	Q	89.2	Confident	87.5	Confident	11 Å²	11	47.8 Å²	47.8	5%	0.051	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-41.5	176.4	-61	-54.3	-37.4	0	0	111.6	D191 Y194 L198 N220 I221 V226 S227 V228	D191-Q224 VanDerWaalsContact CG-NE2 3.32Å; D191-Q224 PolarHBondContact OD2-NE2 3.3Å; Y194-Q224 HydrophobicContact CD2-CG 4.49Å; Y194-Q224 HydrophobicContact CG-CG 4.43Å; L198-Q224 HydrophobicContact CD1-CB 4.4Å; N220-Q224 WeakPolarHBondContact O-CG 3.39Å; N220-Q224 PolarHBondContact O-N 3.26Å; N220-Q224 PolarHBondContact OD1-NE2 3.44Å; I221-Q224 PolarHBondContact O-N 3.38Å; Q224-V226 VanDerWaalsContact C-N 3.27Å; Q224-V226 PolarHBondContact O-N 3.48Å; Q224-S227 WeakPolarHBondContact CA-OG 3.46Å; Q224-S227 PolarHBondContact O-N 3.23Å; Q224-S227 VanDerWaalsContact O-N 3.09Å; Q224-S227 PolarHBondContact O-OG 3.36Å; Q224-V228 WeakPolarHBondContact O-CG2 3.21Å; Q224-V228 PolarHBondContact O-N 3.33Å
225	I	91.3	Very high	87.8	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-56.4	-42.6	175	-72.9	165	0	0	0	111.2	L198 I211 I221 L222 G229 K230 H231 Y237 F252	L198-I225 HydrophobicContact CD1-CG1 4.02Å; L198-I225 HydrophobicContact CD2-CG1 4.08Å; I211-I225 HydrophobicContact CD1-CD1 4.13Å; I221-I225 HydrophobicContact CG2-CD1 3.76Å; I221-I225 HydrophobicContact CG2-CG1 4.41Å; I221-I225 VanDerWaalsContact O-CG1 3.29Å; I221-I225 WeakPolarHBondContact O-CG1 2.86Å; I221-I225 PolarHBondContact O-N 3.38Å; L222-I225 HydrophobicContact CD2-CD1 4.45Å; L222-I225 PolarHBondContact O-N 3.09Å; I225-G229 PolarHBondContact O-N 3.13Å; I225-K230 HydrophobicContact CG2-CB 4.13Å; I225-K230 PolarHBondContact O-N 3.5Å; I225-H231 HydrophobicContact CG2-CB 4.46Å; I225-Y237 HydrophobicContact CD1-CD1 4.25Å; I225-Y237 HydrophobicContact CD1-CE1 3.71Å; I225-Y237 HydrophobicContact CG1-CE1 4.49Å; I225-Y237 HydrophobicContact CG2-CE1 4.35Å; I225-Y237 HydrophobicContact CG2-CE2 4.27Å; I225-Y237 WeakPolarHBondContact CG2-OH 3.43Å; I225-F252 HydrophobicContact CB-CZ 4.13Å; I225-F252 HydrophobicContact CG2-CE1 3.91Å; I225-F252 HydrophobicContact CG2-CZ 3.64Å
226	V	90.4	Very high	88.2	Confident	25 Å²	25	44.7 Å²	44.7	15%	0.152	24%	0.24	C	C	.	.	H	α-helix	trans	-66.3	-44.4	176.3	174.4	0	0	0	0	110.7	L222 E223 Q224 V228 G229 H231 R251 F252	L222-V226 WeakPolarHBondContact O-CG2 3.3Å; L222-V226 PolarHBondContact O-N 3.35Å; L222-V226 VanDerWaalsContact O-N 3.1Å; E223-V226 PolarHBondContact O-N 2.83Å; Q224-V226 VanDerWaalsContact C-N 3.27Å; Q224-V226 PolarHBondContact O-N 3.48Å; V226-V228 VanDerWaalsContact C-N 3.33Å; V226-V228 PolarHBondContact O-N 2.89Å; V226-G229 WeakPolarHBondContact O-CA 3.41Å; V226-G229 PolarHBondContact O-N 3.34Å; V226-H231 HydrophobicContact CG2-CB 4.32Å; V226-R251 HydrophobicContact CG1-CB 4.23Å; V226-R251 HydrophobicContact CG2-CB 4.04Å; V226-F252 HydrophobicContact CG2-CD2 3.92Å; V226-F252 HydrophobicContact CG2-CE2 3.44Å; V226-F252 VanDerWaalsContact CG2-CE2 3.44Å; V226-F252 HydrophobicContact CG2-CZ 3.95Å
227	S	87.6	Confident	88.8	Confident	70 Å²	70	38.1 Å²	38.1	49%	0.49	21%	0.21	S	C	.	.	H	α-helix	trans	-60.2	-37	-178.9	79.7	0	0	0	0	113.7	E223 Q224 G229	E223-S227 PolarHBondContact O-N 2.85Å; Q224-S227 WeakPolarHBondContact CA-OG 3.46Å; Q224-S227 PolarHBondContact O-N 3.23Å; Q224-S227 VanDerWaalsContact O-N 3.09Å; Q224-S227 PolarHBondContact O-OG 3.36Å; S227-G229 VanDerWaalsContact C-N 3.26Å; S227-G229 PolarHBondContact O-N 3.4Å
228	V	87.9	Confident	89.2	Confident	33 Å²	33	35.6 Å²	35.6	20%	0.2	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	1.2	177.3	-165.1	0	0	0	0	111.5	R195 L198 E199 Q224 V226 K230	R195-V228 HydrophobicContact CB-CG2 4.33Å; R195-V228 HydrophobicContact CG-CG2 3.82Å; L198-V228 HydrophobicContact CD1-CG2 4.13Å; E199-V228 HydrophobicContact CG-CG1 4.48Å; Q224-V228 WeakPolarHBondContact O-CG2 3.21Å; Q224-V228 PolarHBondContact O-N 3.33Å; V226-V228 VanDerWaalsContact C-N 3.33Å; V226-V228 PolarHBondContact O-N 2.89Å; V228-K230 VanDerWaalsContact C-N 3.34Å; V228-K230 HydrophobicContact CB-CG 4.13Å; V228-K230 HydrophobicContact CG1-CG 4.17Å; V228-K230 PolarHBondContact O-N 3.35Å
229	G	87.3	Confident	89.5	Confident	30 Å²	30	35.6 Å²	35.6	31%	0.309	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	25.8	178.3	0	0	0	0	0	114	I225 V226 S227 H231	I225-G229 PolarHBondContact O-N 3.13Å; V226-G229 WeakPolarHBondContact O-CA 3.41Å; V226-G229 PolarHBondContact O-N 3.34Å; S227-G229 VanDerWaalsContact C-N 3.26Å; S227-G229 PolarHBondContact O-N 3.4Å; G229-H231 VanDerWaalsContact C-N 3.28Å; G229-H231 PolarHBondContact O-N 3.04Å
230	K	90.2	Very high	89.8	Confident	32 Å²	32	31.9 Å²	31.9	14%	0.139	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	18.5	-179.3	-51.9	-59.4	179.5	-149.5	0	113.3	D202 I225 V228 Y235 Y237	D202-K230 WeakPolarHBondContact OD2-CE 3.29Å; D202-K230 IonicContact OD2-NZ 3.61Å; D202-K230 PolarHBondContact OD2-NZ 3.13Å; I225-K230 HydrophobicContact CG2-CB 4.13Å; I225-K230 PolarHBondContact O-N 3.5Å; V228-K230 VanDerWaalsContact C-N 3.34Å; V228-K230 HydrophobicContact CB-CG 4.13Å; V228-K230 HydrophobicContact CG1-CG 4.17Å; V228-K230 PolarHBondContact O-N 3.35Å; K230-Y235 HydrophobicContact CB-CE1 4.21Å; K230-Y235 HydrophobicContact CD-CE1 4.47Å; K230-Y235 HydrophobicContact CD-CE2 4.47Å; K230-Y235 WeakPolarHBondContact CD-OH 3.26Å; K230-Y235 VanDerWaalsContact O-CG 3.31Å; K230-Y237 PolarHBondContact O-OH 3.04Å
231	H	89.4	Confident	89.9	Confident	37 Å²	37	29.6 Å²	29.6	17%	0.171	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	13.2	175.9	63.7	-68.8	0	0	0	112.4	I225 V226 G229 F252 G255 A257	I225-H231 HydrophobicContact CG2-CB 4.46Å; V226-H231 HydrophobicContact CG2-CB 4.32Å; G229-H231 VanDerWaalsContact C-N 3.28Å; G229-H231 PolarHBondContact O-N 3.04Å; H231-F252 HydrophobicContact CB-CD1 3.88Å; H231-F252 HydrophobicContact CB-CE1 3.79Å; H231-F252 HydrophobicContact CB-CG 4.49Å; H231-F252 HydrophobicContact CB-CZ 4.31Å; H231-G255 VanDerWaalsContact CD2-CA 3.48Å; H231-G255 WeakPolarHBondContact CD2-CA 3.37Å; H231-G255 CarbonylContact O-C 3.56Å; H231-G255 WeakPolarHBondContact O-CA 3.41Å; H231-A257 VanDerWaalsContact O-CB 3.27Å; H231-A257 WeakPolarHBondContact O-CB 3.31Å; H231-A257 PolarHBondContact O-N 3.31Å; H231-A257 VanDerWaalsContact O-N 3.14Å
232	V	86.5	Confident	89.9	Confident	69 Å²	69	29.6 Å²	29.6	42%	0.418	17%	0.171	S	C	.	.	B	Isolated β-bridge	trans	-79.5	164.6	-177.6	-63.7	0	0	0	0	113.4	G234 Y235 G255	V232-G234 PolarHBondContact O-N 3.33Å; V232-Y235 HydrophobicContact CG2-CD2 3.81Å; V232-Y235 HydrophobicContact CG2-CE2 3.76Å; V232-Y235 WeakPolarHBondContact O-CD2 3.28Å; V232-Y235 PolarHBondContact O-N 3.32Å; V232-G255 CarbonylContact C-O 3.42Å; V232-G255 VanDerWaalsContact CA-O 3.26Å; V232-G255 WeakPolarHBondContact CA-O 3.36Å
233	K	81.5	Confident	89.9	Confident	112 Å²	112	29.3 Å²	29.3	49%	0.487	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	130.1	172.8	-170	178	176.3	-173	0	111.7	G255 G256 E495	K233-G255 PolarHBondContact N-O 3.24Å; K233-G256 WeakPolarHBondContact CA-O 3.23Å; K233-E495 IonicContact NZ-OE1 3.72Å; K233-E495 PolarHBondContact NZ-OE1 2.71Å
234	G	82.3	Confident	89.9	Confident	39 Å²	39	24.4 Å²	24.4	40%	0.402	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	112.7	-22.6	-176.3	0	0	0	0	0	113.7	K207 V232	K207-G234 WeakPolarHBondContact CB-O 3.37Å; V232-G234 PolarHBondContact O-N 3.33Å
235	Y	90.4	Very high	89.8	Confident	15 Å²	15	27.8 Å²	27.8	6%	0.059	16%	0.161	C	C	.	.			trans	-85.7	147.2	172.5	-71.3	-93.8	0	0	0	112	D202 K207 F209 K230 V232 Y237 A257 N258	D202-Y235 PolarHBondContact OD1-OH 3.35Å; K207-Y235 HydrophobicContact CB-CD1 4.33Å; K207-Y235 HydrophobicContact CD-CD1 3.95Å; K207-Y235 HydrophobicContact CD-CD2 4.3Å; K207-Y235 HydrophobicContact CD-CE1 3.46Å; K207-Y235 VanDerWaalsContact CD-CE1 3.46Å; K207-Y235 HydrophobicContact CD-CE2 3.89Å; K207-Y235 HydrophobicContact CD-CG 4.32Å; K207-Y235 VanDerWaalsContact CD-CZ 3.43Å; K207-Y235 PolarHBondContact NZ-OH 3.41Å; K207-Y235 WeakPolarHBondContact O-CA 3.39Å; F209-Y235 HydrophobicContact CD2-CD1 4.38Å; F209-Y235 AromaticContact CE2-CD1 3.77Å; F209-Y235 HydrophobicContact CE2-CD1 3.77Å; F209-Y235 AromaticContact CE2-CE1 3.98Å; F209-Y235 HydrophobicContact CE2-CE1 3.98Å; K230-Y235 HydrophobicContact CB-CE1 4.21Å; K230-Y235 HydrophobicContact CD-CE1 4.47Å; K230-Y235 HydrophobicContact CD-CE2 4.47Å; K230-Y235 WeakPolarHBondContact CD-OH 3.26Å; K230-Y235 VanDerWaalsContact O-CG 3.31Å; V232-Y235 HydrophobicContact CG2-CD2 3.81Å; V232-Y235 HydrophobicContact CG2-CE2 3.76Å; V232-Y235 WeakPolarHBondContact O-CD2 3.28Å; V232-Y235 PolarHBondContact O-N 3.32Å; Y235-Y237 WeakPolarHBondContact CD1-OH 3.48Å; Y235-Y237 HydrophobicContact CG-CE2 4.4Å; Y235-A257 WeakPolarHBondContact O-CA 3.31Å; Y235-N258 PolarHBondContact O-N 2.8Å
236	H	93.1	Very high	89.5	Confident	23 Å²	23	29.3 Å²	29.3	11%	0.106	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	122.9	174	-165	167.7	0	0	0	110.4	Y149 W151 K207 K208 F209 N258 T260	Y149-H236 AromaticContact CE1-CE1 3.87Å; Y149-H236 AromaticContact CE2-CE1 3.93Å; Y149-H236 AromaticContact CZ-CE1 3.81Å; W151-H236 HydrophobicContact CH2-CB 4.13Å; W151-H236 HydrophobicContact CZ2-CB 3.74Å; W151-H236 AromaticContact CZ2-CD2 3.96Å; W151-H236 AromaticContact CZ2-CE1 3.88Å; W151-H236 AromaticContact CZ2-CG 3.47Å; W151-H236 VanDerWaalsContact CZ2-CG 3.47Å; W151-H236 AromaticContact CZ2-ND1 3.46Å; W151-H236 WeakPolarHBondContact CZ2-ND1 3.45Å; K207-H236 PolarHBondContact O-N 3.11Å; K208-H236 WeakPolarHBondContact CA-O 3.3Å; F209-H236 PolarHBondContact N-O 3.26Å; H236-N258 CarbonylContact C-O 3.6Å; H236-N258 VanDerWaalsContact CA-O 3.27Å; H236-N258 WeakPolarHBondContact CA-O 3.49Å; H236-N258 HydrophobicContact CB-CB 4.27Å; H236-N258 PolarHBondContact CD2-O 3.24Å; H236-N258 VanDerWaalsContact CD2-O 3.25Å; H236-T260 WeakPolarHBondContact NE2-CG2 3.5Å
237	Y	94.9	Very high	89.3	Confident	1 Å²	1	28.7 Å²	28.7	0%	0.004	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	131.2	179.5	-60.7	-84.2	0	0	0	111.2	F209 I211 I225 K230 Y235 F252 A257 N258 V259 T260	F209-Y237 HydrophobicContact CB-CD1 3.52Å; F209-Y237 HydrophobicContact CB-CE1 3.77Å; F209-Y237 HydrophobicContact CB-CG 4.5Å; F209-Y237 HydrophobicContact CD1-CE1 4.47Å; F209-Y237 HydrophobicContact CD2-CD1 4.08Å; F209-Y237 AromaticContact CD2-CE1 3.54Å; F209-Y237 HydrophobicContact CD2-CE1 3.54Å; F209-Y237 HydrophobicContact CE2-CE1 4.28Å; F209-Y237 AromaticContact CG-CD1 3.99Å; F209-Y237 HydrophobicContact CG-CD1 3.99Å; F209-Y237 AromaticContact CG-CE1 3.67Å; F209-Y237 HydrophobicContact CG-CE1 3.67Å; F209-Y237 CarbonylContact O-C 3.57Å; F209-Y237 WeakPolarHBondContact O-CA 3.49Å; I211-Y237 HydrophobicContact CD1-CD1 4.07Å; I225-Y237 HydrophobicContact CD1-CD1 4.25Å; I225-Y237 HydrophobicContact CD1-CE1 3.71Å; I225-Y237 HydrophobicContact CG1-CE1 4.49Å; I225-Y237 HydrophobicContact CG2-CE1 4.35Å; I225-Y237 HydrophobicContact CG2-CE2 4.27Å; I225-Y237 WeakPolarHBondContact CG2-OH 3.43Å; K230-Y237 PolarHBondContact O-OH 3.04Å; Y235-Y237 WeakPolarHBondContact CD1-OH 3.48Å; Y235-Y237 HydrophobicContact CG-CE2 4.4Å; Y237-F252 HydrophobicContact CD2-CE1 4.1Å; Y237-F252 HydrophobicContact CE2-CE1 4.07Å; Y237-A257 HydrophobicContact CD2-CB 4.23Å; Y237-A257 HydrophobicContact CE2-CB 4.11Å; Y237-N258 PolarHBondContact N-O 2.89Å; Y237-V259 HydrophobicContact CD2-CG2 4.43Å; Y237-V259 CarbonylContact O-C 3.58Å; Y237-V259 WeakPolarHBondContact O-CA 3.23Å; Y237-T260 PolarHBondContact O-N 3.2Å; Y237-T260 PolarHBondContact O-OG1 3.26Å
238	I	95.9	Very high	89.1	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.5	169.1	-53.9	-174.8	0	0	0	108	L142 L145 L146 Y149 W151 F209 V210 I211 T260	L142-I238 HydrophobicContact CD1-CG2 3.73Å; L145-I238 HydrophobicContact CD2-CD1 4.33Å; L145-I238 HydrophobicContact CD2-CG2 3.82Å; L146-I238 HydrophobicContact CD2-CD1 3.89Å; Y149-I238 HydrophobicContact CD2-CD1 4.36Å; W151-I238 HydrophobicContact CD2-CD1 4.48Å; W151-I238 HydrophobicContact CE3-CD1 3.99Å; W151-I238 HydrophobicContact CH2-CD1 3.77Å; W151-I238 HydrophobicContact CH2-CG1 3.67Å; W151-I238 HydrophobicContact CZ2-CD1 4.26Å; W151-I238 HydrophobicContact CZ2-CG1 4.37Å; W151-I238 HydrophobicContact CZ3-CD1 3.61Å; W151-I238 HydrophobicContact CZ3-CG1 3.85Å; F209-I238 PolarHBondContact O-N 2.98Å; V210-I238 WeakPolarHBondContact CA-O 3.49Å; V210-I238 HydrophobicContact CG2-CB 4.25Å; V210-I238 HydrophobicContact CG2-CD1 4.32Å; I211-I238 PolarHBondContact N-O 3.17Å; I238-T260 WeakPolarHBondContact CA-O 3.48Å; I238-T260 WeakPolarHBondContact CG1-OG1 3.4Å
239	I	94.9	Very high	88.8	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	109.1	178.5	-58.6	-179.8	0	0	0	108.9	L218 L222 N241 F244 I247 L249 V259 T260	L218-I239 HydrophobicContact CD1-CG2 4.41Å; L218-I239 HydrophobicContact CD2-CG2 3.58Å; L222-I239 HydrophobicContact CD1-CD1 4.49Å; I239-N241 VanDerWaalsContact C-N 3.26Å; I239-N241 HydrophobicContact CG2-CB 4.13Å; I239-N241 PolarHBondContact O-N 3.2Å; I239-F244 HydrophobicContact CD1-CD2 4.42Å; I239-F244 HydrophobicContact CD1-CE2 4.1Å; I239-I247 HydrophobicContact CD1-CD1 4.25Å; I239-I247 HydrophobicContact CG2-CD1 3.84Å; I239-L249 HydrophobicContact CD1-CD2 4.18Å; I239-V259 HydrophobicContact CD1-CG1 3.67Å; I239-V259 HydrophobicContact CG1-CG1 4.08Å; I239-T260 PolarHBondContact N-O 2.9Å
240	A	93	Very high	88.6	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.008	18%	0.179	C	C	.	.			trans	-84.6	64.5	-179.9	0	0	0	0	0	111.4	L138 L142 R162 I211 D212	L138-A240 HydrophobicContact CD2-CB 3.85Å; L142-A240 HydrophobicContact CD1-CB 4.45Å; L142-A240 HydrophobicContact CD2-CB 4.16Å; R162-A240 PolarHBondContact NH1-O 3.19Å; R162-A240 PolarHBondContact NH2-O 3.25Å; I211-A240 WeakPolarHBondContact O-CB 3.32Å; I211-A240 PolarHBondContact O-N 3.44Å; D212-A240 HydrophobicContact CB-CB 4.17Å
241	N	91.1	Very high	88.3	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.021	20%	0.201	C	C	.	.	S	Bend	trans	-141.3	160	175.6	-158.5	2.4	0	0	0	110.8	I215 I239 F262 Y296	I215-N241 WeakPolarHBondContact CG1-ND2 3.35Å; I239-N241 VanDerWaalsContact C-N 3.26Å; I239-N241 HydrophobicContact CG2-CB 4.13Å; I239-N241 PolarHBondContact O-N 3.2Å; N241-F262 WeakPolarHBondContact O-CB 3.45Å; N241-F262 VanDerWaalsContact O-O 3.06Å; N241-Y296 VanDerWaalsContact OD1-CE1 3.24Å; N241-Y296 WeakPolarHBondContact OD1-CE1 3.45Å; N241-Y296 PolarHBondContact OD1-OH 3.08Å
242	L	91.5	Very high	88	Confident	5 Å²	5	38.2 Å²	38.2	3%	0.026	19%	0.194	C	C	.	.	S	Bend	trans	-90.1	-2.5	-175.4	-64.3	173.7	0	0	0	114.1	R135 P136 L138 F262 Q263 L264 Y296 M374	R135-L242 HydrophobicContact CG-CD1 3.56Å; P136-L242 HydrophobicContact CG-CD1 4.03Å; P136-L242 HydrophobicContact CG-CD2 4.49Å; L138-L242 HydrophobicContact CD1-CD2 3.97Å; L242-F262 CarbonylContact C-O 3.51Å; L242-F262 VanDerWaalsContact C-O 3.23Å; L242-Q263 CarbonylContact O-C 3.46Å; L242-Q263 WeakPolarHBondContact O-CA 3.27Å; L242-L264 HydrophobicContact CB-CB 4.11Å; L242-L264 HydrophobicContact CD1-CD2 4.27Å; L242-L264 PolarHBondContact O-N 2.83Å; L242-Y296 HydrophobicContact CB-CD1 4.37Å; L242-Y296 HydrophobicContact CB-CD2 3.79Å; L242-Y296 HydrophobicContact CB-CE2 3.97Å; L242-Y296 HydrophobicContact CB-CG 4Å; L242-Y296 HydrophobicContact CD1-CD2 4.24Å; L242-Y296 HydrophobicContact CD1-CE2 4.04Å; L242-M374 HydrophobicContact CD2-CE 3.83Å
243	G	90.3	Very high	87.8	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-124.1	68.8	-178.7	0	0	0	0	0	112	K245 D246 F262	G243-K245 VanDerWaalsContact C-N 3.29Å; G243-K245 PolarHBondContact O-N 3.33Å; G243-D246 WeakPolarHBondContact O-CB 3.12Å; G243-D246 PolarHBondContact O-N 2.64Å; G243-D246 VanDerWaalsContact O-N 3.13Å; G243-F262 PolarHBondContact N-O 2.92Å
244	F	90.1	Very high	87.7	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.009	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-59.3	-39	178	-170.3	-107.7	0	0	0	113	I239 D246 L249 V259 F262 F377 L379 P384	I239-F244 HydrophobicContact CD1-CD2 4.42Å; I239-F244 HydrophobicContact CD1-CE2 4.1Å; F244-D246 VanDerWaalsContact C-N 3.27Å; F244-D246 PolarHBondContact O-N 3.14Å; F244-L249 HydrophobicContact CD1-CD1 4.37Å; F244-L249 HydrophobicContact CD2-CD1 4.33Å; F244-L249 HydrophobicContact CE1-CD1 3.76Å; F244-L249 HydrophobicContact CE2-CD1 3.73Å; F244-L249 HydrophobicContact CZ-CD1 3.41Å; F244-L249 VanDerWaalsContact CZ-CD1 3.41Å; F244-V259 HydrophobicContact CE2-CG1 3.99Å; F244-V259 HydrophobicContact CZ-CG1 4.22Å; F244-F262 WeakPolarHBondContact CB-O 3.24Å; F244-F262 PolarHBondContact N-O 2.86Å; F244-F377 HydrophobicContact CD1-CB 3.5Å; F244-F377 HydrophobicContact CD1-CG 4.21Å; F244-F377 HydrophobicContact CE1-CB 3.82Å; F244-F377 HydrophobicContact CG-CB 4.07Å; F244-L379 HydrophobicContact CZ-CB 4.3Å; F244-P384 HydrophobicContact CD1-CB 4.15Å; F244-P384 HydrophobicContact CE1-CB 3.84Å
245	K	86.3	Confident	87.4	Confident	83 Å²	83	39 Å²	39	36%	0.361	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-79.1	-8.5	177.7	-67.3	-174.3	178.5	-178.8	0	113.8	G243 I247 F267	G243-K245 VanDerWaalsContact C-N 3.29Å; G243-K245 PolarHBondContact O-N 3.33Å; K245-I247 PolarHBondContact O-N 2.89Å; K245-F267 HydrophobicContact CB-CE2 4.04Å; K245-F267 HydrophobicContact CD-CD2 3.74Å; K245-F267 HydrophobicContact CD-CE2 3.69Å; K245-F267 HydrophobicContact CG-CE2 4.4Å
246	D	84.9	Confident	87	Confident	33 Å²	33	40.1 Å²	40.1	18%	0.176	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-77.8	-12.1	177.2	-56.2	-4.8	0	0	0	111	G243 F244 K295 Y296	G243-D246 WeakPolarHBondContact O-CB 3.12Å; G243-D246 PolarHBondContact O-N 2.64Å; G243-D246 VanDerWaalsContact O-N 3.13Å; F244-D246 VanDerWaalsContact C-N 3.27Å; F244-D246 PolarHBondContact O-N 3.14Å; D246-K295 WeakPolarHBondContact OD2-CA 3.43Å; D246-Y296 PolarHBondContact OD2-N 3.01Å
247	I	85.9	Confident	86.8	Confident	11 Å²	11	39.3 Å²	39.3	6%	0.056	20%	0.203	C	C	.	.	S	Bend	trans	-103.3	137.4	-174.4	-56.1	153	0	0	0	110	L218 L222 I239 K245 L249	L218-I247 HydrophobicContact CD2-CD1 3.39Å; L218-I247 HydrophobicContact CD2-CG1 4Å; L222-I247 HydrophobicContact CD1-CG2 3.48Å; L222-I247 VanDerWaalsContact CD1-CG2 3.48Å; I239-I247 HydrophobicContact CD1-CD1 4.25Å; I239-I247 HydrophobicContact CG2-CD1 3.84Å; K245-I247 PolarHBondContact O-N 2.89Å; I247-L249 HydrophobicContact CG2-CD2 4.11Å; I247-L249 HydrophobicContact CG2-CG 4.27Å; I247-L249 PolarHBondContact O-N 3.39Å
248	S	83	Confident	86.6	Confident	84 Å²	84	42.7 Å²	42.7	59%	0.587	22%	0.222	S	C	*	.			trans	-75.4	107.6	172.7	-176	0	0	0	0	110.8
249	L	83.4	Confident	86.5	Confident	12 Å²	12	42.7 Å²	42.7	6%	0.063	22%	0.222	C	C	.	.			trans	-109.4	8.9	-179.5	-67.2	175.3	0	0	0	113.5	L222 I239 F244 I247 R251 F252 I253 V259 L379	L222-L249 HydrophobicContact CD1-CD2 4.13Å; I239-L249 HydrophobicContact CD1-CD2 4.18Å; F244-L249 HydrophobicContact CD1-CD1 4.37Å; F244-L249 HydrophobicContact CD2-CD1 4.33Å; F244-L249 HydrophobicContact CE1-CD1 3.76Å; F244-L249 HydrophobicContact CE2-CD1 3.73Å; F244-L249 HydrophobicContact CZ-CD1 3.41Å; F244-L249 VanDerWaalsContact CZ-CD1 3.41Å; I247-L249 HydrophobicContact CG2-CD2 4.11Å; I247-L249 HydrophobicContact CG2-CG 4.27Å; I247-L249 PolarHBondContact O-N 3.39Å; L249-R251 VanDerWaalsContact C-N 3.29Å; L249-R251 PolarHBondContact O-N 3.28Å; L249-F252 HydrophobicContact CD2-CD2 4.46Å; L249-F252 WeakPolarHBondContact O-CB 3.42Å; L249-F252 PolarHBondContact O-N 3.47Å; L249-I253 PolarHBondContact O-N 2.96Å; L249-V259 HydrophobicContact CD2-CG1 4.41Å; L249-L379 HydrophobicContact CB-CD1 4.16Å; L249-L379 HydrophobicContact CB-CD2 4.05Å; L249-L379 HydrophobicContact CD1-CD1 4.34Å; L249-L379 HydrophobicContact CD1-CD2 4.49Å
250	E	82.9	Confident	86.4	Confident	142 Å²	142	42.6 Å²	42.6	66%	0.664	22%	0.221	S	C	*	.	H	α-helix	trans	-56.1	-40.7	-174.1	-64.6	-178.1	172.9	0	0	113	F252 I253	E250-F252 VanDerWaalsContact C-N 3.27Å; E250-F252 PolarHBondContact O-N 3.31Å; E250-I253 WeakPolarHBondContact O-CB 3.46Å; E250-I253 PolarHBondContact O-N 3.42Å
251	R	82.1	Confident	86.5	Confident	159 Å²	159	42.6 Å²	42.6	60%	0.6	22%	0.221	S	C	*	.	H	α-helix	trans	-67.4	-26.2	178.4	-62.9	-174.4	-178.8	171.9	1.2	113.2	V226 L249	V226-R251 HydrophobicContact CG1-CB 4.23Å; V226-R251 HydrophobicContact CG2-CB 4.04Å; L249-R251 VanDerWaalsContact C-N 3.29Å; L249-R251 PolarHBondContact O-N 3.28Å
252	F	83.4	Confident	86.6	Confident	5 Å²	5	42.4 Å²	42.4	2%	0.022	22%	0.22	C	C	.	.	H	α-helix	trans	-78.8	-25.1	177.6	-81	-100.6	0	0	0	112.6	L222 I225 V226 H231 Y237 L249 E250 H254 G255 V259 L379	L222-F252 HydrophobicContact CB-CE2 3.93Å; L222-F252 HydrophobicContact CB-CZ 4.34Å; L222-F252 HydrophobicContact CD2-CE1 4.36Å; L222-F252 HydrophobicContact CD2-CE2 3.77Å; L222-F252 HydrophobicContact CD2-CZ 3.58Å; L222-F252 HydrophobicContact CG-CE2 4.38Å; I225-F252 HydrophobicContact CB-CZ 4.13Å; I225-F252 HydrophobicContact CG2-CE1 3.91Å; I225-F252 HydrophobicContact CG2-CZ 3.64Å; V226-F252 HydrophobicContact CG2-CD2 3.92Å; V226-F252 HydrophobicContact CG2-CE2 3.44Å; V226-F252 VanDerWaalsContact CG2-CE2 3.44Å; V226-F252 HydrophobicContact CG2-CZ 3.95Å; H231-F252 HydrophobicContact CB-CD1 3.88Å; H231-F252 HydrophobicContact CB-CE1 3.79Å; H231-F252 HydrophobicContact CB-CG 4.49Å; H231-F252 HydrophobicContact CB-CZ 4.31Å; Y237-F252 HydrophobicContact CD2-CE1 4.1Å; Y237-F252 HydrophobicContact CE2-CE1 4.07Å; L249-F252 HydrophobicContact CD2-CD2 4.46Å; L249-F252 WeakPolarHBondContact O-CB 3.42Å; L249-F252 PolarHBondContact O-N 3.47Å; E250-F252 VanDerWaalsContact C-N 3.27Å; E250-F252 PolarHBondContact O-N 3.31Å; F252-H254 PolarHBondContact O-N 3.36Å; F252-G255 PolarHBondContact O-N 3.02Å; F252-V259 HydrophobicContact CB-CG2 4.31Å; F252-V259 HydrophobicContact CD1-CG2 3.71Å; F252-V259 HydrophobicContact CE1-CG2 4.42Å; F252-V259 HydrophobicContact CG-CG2 4.28Å; F252-L379 HydrophobicContact CB-CD2 3.61Å
253	I	82.6	Confident	86.7	Confident	46 Å²	46	42.3 Å²	42.3	24%	0.236	22%	0.219	C	C	.	.	H	α-helix	trans	-57.8	-38.8	179.1	-62.1	176.1	0	0	0	111.1	L249 E250 L379 S381	L249-I253 PolarHBondContact O-N 2.96Å; E250-I253 WeakPolarHBondContact O-CB 3.46Å; E250-I253 PolarHBondContact O-N 3.42Å; I253-L379 HydrophobicContact CD1-CD1 4.48Å; I253-L379 HydrophobicContact CG1-CD1 3.91Å; I253-L379 HydrophobicContact CG1-CD2 4.21Å; I253-L379 HydrophobicContact CG1-CG 4.24Å; I253-S381 WeakPolarHBondContact CG2-O 3.42Å
254	H	79.1	Confident	86.8	Confident	175 Å²	175	42.7 Å²	42.7	81%	0.81	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-10.9	-177.8	-60.6	-64.9	0	0	0	114.4	F252	F252-H254 PolarHBondContact O-N 3.36Å
255	G	77.6	Confident	86.9	Confident	17 Å²	17	42.9 Å²	42.9	18%	0.175	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-36.1	-177.6	0	0	0	0	0	114.4	H231 V232 K233 F252	H231-G255 VanDerWaalsContact CD2-CA 3.48Å; H231-G255 WeakPolarHBondContact CD2-CA 3.37Å; H231-G255 CarbonylContact O-C 3.56Å; H231-G255 WeakPolarHBondContact O-CA 3.41Å; V232-G255 CarbonylContact C-O 3.42Å; V232-G255 VanDerWaalsContact CA-O 3.26Å; V232-G255 WeakPolarHBondContact CA-O 3.36Å; K233-G255 PolarHBondContact N-O 3.24Å; F252-G255 PolarHBondContact O-N 3.02Å
256	G	80.7	Confident	87.1	Confident	38 Å²	38	41.4 Å²	41.4	39%	0.392	22%	0.219	S	C	.	.	B	Isolated β-bridge	trans	88.9	6.2	-179	0	0	0	0	0	115.5	K233	K233-G256 WeakPolarHBondContact CA-O 3.23Å
257	A	88.7	Confident	87.1	Confident	6 Å²	6	41.9 Å²	41.9	5%	0.05	22%	0.219	C	C	.	.			trans	-71.5	143.9	165.1	0	0	0	0	0	111.3	H231 Y235 Y237	H231-A257 VanDerWaalsContact O-CB 3.27Å; H231-A257 WeakPolarHBondContact O-CB 3.31Å; H231-A257 PolarHBondContact O-N 3.31Å; H231-A257 VanDerWaalsContact O-N 3.14Å; Y235-A257 WeakPolarHBondContact O-CA 3.31Å; Y237-A257 HydrophobicContact CD2-CB 4.23Å; Y237-A257 HydrophobicContact CE2-CB 4.11Å
258	N	91.1	Very high	87.2	Confident	72 Å²	72	47.2 Å²	47.2	39%	0.385	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	129.2	174	-73.7	1.4	0	0	0	109.3	Y235 H236 Y237	Y235-N258 PolarHBondContact O-N 2.8Å; H236-N258 CarbonylContact C-O 3.6Å; H236-N258 VanDerWaalsContact CA-O 3.27Å; H236-N258 WeakPolarHBondContact CA-O 3.49Å; H236-N258 HydrophobicContact CB-CB 4.27Å; H236-N258 PolarHBondContact CD2-O 3.24Å; H236-N258 VanDerWaalsContact CD2-O 3.25Å; Y237-N258 PolarHBondContact N-O 2.89Å
259	V	93.8	Very high	87.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	123.6	176.5	-172.3	0	0	0	0	108.6	Y237 I239 F244 L249 F252 E378 L379	Y237-V259 HydrophobicContact CD2-CG2 4.43Å; Y237-V259 CarbonylContact O-C 3.58Å; Y237-V259 WeakPolarHBondContact O-CA 3.23Å; I239-V259 HydrophobicContact CD1-CG1 3.67Å; I239-V259 HydrophobicContact CG1-CG1 4.08Å; F244-V259 HydrophobicContact CE2-CG1 3.99Å; F244-V259 HydrophobicContact CZ-CG1 4.22Å; L249-V259 HydrophobicContact CD2-CG1 4.41Å; F252-V259 HydrophobicContact CB-CG2 4.31Å; F252-V259 HydrophobicContact CD1-CG2 3.71Å; F252-V259 HydrophobicContact CE1-CG2 4.42Å; F252-V259 HydrophobicContact CG-CG2 4.28Å; V259-E378 CarbonylContact O-C 3.59Å; V259-E378 WeakPolarHBondContact O-CA 3.19Å; V259-L379 HydrophobicContact CB-CB 3.92Å; V259-L379 HydrophobicContact CB-CD2 4.17Å; V259-L379 HydrophobicContact CG2-CD2 4.12Å; V259-L379 PolarHBondContact O-N 3.16Å
260	T	94	Very high	87.8	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	153.3	178.8	56.6	0	0	0	0	110	Y149 H236 Y237 I238 I239 F377 E378	Y149-T260 HydrophobicContact CE2-CG2 4.12Å; Y149-T260 WeakPolarHBondContact OH-CG2 3.37Å; H236-T260 WeakPolarHBondContact NE2-CG2 3.5Å; Y237-T260 PolarHBondContact O-N 3.2Å; Y237-T260 PolarHBondContact O-OG1 3.26Å; I238-T260 WeakPolarHBondContact CA-O 3.48Å; I238-T260 WeakPolarHBondContact CG1-OG1 3.4Å; I239-T260 PolarHBondContact N-O 2.9Å; T260-F377 CarbonylContact C-O 3.5Å; T260-F377 VanDerWaalsContact CA-O 3.31Å; T260-F377 WeakPolarHBondContact CA-O 3.41Å; T260-E378 HydrophobicContact CG2-CB 4.24Å; T260-E378 HydrophobicContact CG2-CG 3.84Å
261	G	93.8	Very high	88	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.1	-173.5	175.8	0	0	0	0	0	112.4	F377	G261-F377 PolarHBondContact N-O 2.85Å; G261-F377 PolarHBondContact O-N 2.89Å
262	F	94	Very high	88.4	Confident	1 Å²	1	37.9 Å²	37.9	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	144.2	-171.6	-50.7	-87.9	0	0	0	111.4	L138 A141 L142 L145 N241 L242 G243 F244 M374 D375 V376	L138-F262 HydrophobicContact CD1-CB 4.1Å; L138-F262 HydrophobicContact CD1-CD1 4.18Å; L138-F262 HydrophobicContact CD1-CD2 3.53Å; L138-F262 HydrophobicContact CD1-CE2 3.93Å; L138-F262 HydrophobicContact CD1-CG 3.66Å; L138-F262 HydrophobicContact CD1-CZ 4.41Å; L138-F262 HydrophobicContact CD2-CD2 4.24Å; L138-F262 HydrophobicContact CD2-CE2 4.47Å; L138-F262 HydrophobicContact CG-CD2 4.35Å; L138-F262 HydrophobicContact CG-CE2 4.45Å; A141-F262 HydrophobicContact CB-CD1 4.25Å; A141-F262 HydrophobicContact CB-CE1 3.81Å; A141-F262 HydrophobicContact CB-CZ 4.33Å; L142-F262 HydrophobicContact CD1-CE2 4.16Å; L142-F262 HydrophobicContact CD1-CZ 4.39Å; L145-F262 HydrophobicContact CB-CZ 4.2Å; L145-F262 HydrophobicContact CD2-CE1 4.17Å; L145-F262 HydrophobicContact CD2-CE2 4.27Å; L145-F262 HydrophobicContact CD2-CZ 3.6Å; N241-F262 WeakPolarHBondContact O-CB 3.45Å; N241-F262 VanDerWaalsContact O-O 3.06Å; L242-F262 CarbonylContact C-O 3.51Å; L242-F262 VanDerWaalsContact C-O 3.23Å; G243-F262 PolarHBondContact N-O 2.92Å; F244-F262 WeakPolarHBondContact CB-O 3.24Å; F244-F262 PolarHBondContact N-O 2.86Å; F262-M374 HydrophobicContact CD1-SD 4.19Å; F262-D375 CarbonylContact C-O 3.56Å; F262-D375 WeakPolarHBondContact CA-O 3.49Å; F262-V376 HydrophobicContact CD1-CG2 4.06Å; F262-V376 HydrophobicContact CE1-CG2 4.08Å
263	Q	93.2	Very high	88.7	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.009	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	119.7	176.9	-176.4	64.4	39.6	0	0	109	L242 V265 F267 D375 F377	L242-Q263 CarbonylContact O-C 3.46Å; L242-Q263 WeakPolarHBondContact O-CA 3.27Å; Q263-V265 VanDerWaalsContact CG-O 3.27Å; Q263-V265 WeakPolarHBondContact CG-O 3.48Å; Q263-V265 PolarHBondContact NE2-O 2.92Å; Q263-V265 VanDerWaalsContact NE2-O 3.14Å; Q263-F267 VanDerWaalsContact NE2-CE2 3.34Å; Q263-D375 HydrophobicContact CB-CB 4.41Å; Q263-D375 PolarHBondContact N-O 2.97Å; Q263-D375 PolarHBondContact O-N 3.23Å; Q263-F377 HydrophobicContact CB-CD2 3.45Å; Q263-F377 VanDerWaalsContact CB-CD2 3.45Å; Q263-F377 HydrophobicContact CB-CE2 3.48Å; Q263-F377 VanDerWaalsContact CB-CE2 3.48Å; Q263-F377 HydrophobicContact CG-CD2 4.31Å; Q263-F377 HydrophobicContact CG-CE2 3.91Å
264	L	93	Very high	89	Confident	8 Å²	8	46 Å²	46	4%	0.042	25%	0.25	C	C	.	.			trans	-85.4	-37.7	177.9	-178.1	62.9	0	0	0	112.6	P136 L242 L300 T358	P136-L264 HydrophobicContact CG-CD1 3.93Å; P136-L264 HydrophobicContact CG-CD2 3.94Å; L242-L264 HydrophobicContact CB-CB 4.11Å; L242-L264 HydrophobicContact CD1-CD2 4.27Å; L242-L264 PolarHBondContact O-N 2.83Å; L264-L300 HydrophobicContact CD2-CD2 4.11Å; L264-L300 HydrophobicContact CD2-CG 4.47Å; L264-T358 HydrophobicContact CD2-CG2 3.81Å; L264-T358 HydrophobicContact CG-CG2 4.1Å
265	V	92.1	Very high	89.5	Confident	7 Å²	7	38.3 Å²	38.3	4%	0.042	21%	0.214	C	C	.	.	S	Bend	trans	-91.2	119.3	-177.4	-179	0	0	0	0	109.9	Q263 F267 V272 A299 T358	Q263-V265 VanDerWaalsContact CG-O 3.27Å; Q263-V265 WeakPolarHBondContact CG-O 3.48Å; Q263-V265 PolarHBondContact NE2-O 2.92Å; Q263-V265 VanDerWaalsContact NE2-O 3.14Å; V265-F267 HydrophobicContact CG1-CE1 4.47Å; V265-F267 PolarHBondContact O-N 2.76Å; V265-V272 HydrophobicContact CG1-CG1 4.03Å; V265-V272 HydrophobicContact CG1-CG2 4.16Å; V265-A299 HydrophobicContact CG2-CB 3.62Å; V265-T358 HydrophobicContact CG2-CG2 4.15Å
266	D	89.1	Confident	90	Very high	52 Å²	52	38.8 Å²	38.8	28%	0.278	21%	0.212	S	C	.	.			trans	-87.5	105.4	172.2	-175.6	4.8	0	0	0	111.1	N268 T269 V272	D266-N268 PolarHBondContact O-N 3.12Å; D266-N268 VanDerWaalsContact O-N 3.16Å; D266-N268 WeakPolarHBondContact OD1-CB 3.45Å; D266-N268 PolarHBondContact OD1-N 2.94Å; D266-N268 PolarHBondContact OD1-ND2 3.12Å; D266-T269 WeakPolarHBondContact O-CB 3Å; D266-T269 PolarHBondContact O-N 2.76Å; D266-T269 PolarHBondContact O-OG1 2.62Å; D266-V272 WeakPolarHBondContact O-CG2 2.98Å
267	F	86.8	Confident	90.4	Very high	42 Å²	42	40.9 Å²	40.9	18%	0.184	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-11	179.1	-63.5	-82.2	0	0	0	114.4	K245 Q263 V265 T269 V272 I273	K245-F267 HydrophobicContact CB-CE2 4.04Å; K245-F267 HydrophobicContact CD-CD2 3.74Å; K245-F267 HydrophobicContact CD-CE2 3.69Å; K245-F267 HydrophobicContact CG-CE2 4.4Å; Q263-F267 VanDerWaalsContact NE2-CE2 3.34Å; V265-F267 HydrophobicContact CG1-CE1 4.47Å; V265-F267 PolarHBondContact O-N 2.76Å; F267-T269 VanDerWaalsContact C-N 3.34Å; F267-V272 HydrophobicContact CD1-CG1 4.09Å; F267-I273 VanDerWaalsContact O-CG1 3.3Å; F267-I273 WeakPolarHBondContact O-CG1 3.28Å
268	N	86.9	Confident	90.3	Very high	123 Å²	123	47.8 Å²	47.8	66%	0.658	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-11.1	176.4	-59.8	-40.8	0	0	0	112.9	D266	D266-N268 PolarHBondContact O-N 3.12Å; D266-N268 VanDerWaalsContact O-N 3.16Å; D266-N268 WeakPolarHBondContact OD1-CB 3.45Å; D266-N268 PolarHBondContact OD1-N 2.94Å; D266-N268 PolarHBondContact OD1-ND2 3.12Å
269	T	89.2	Confident	90.2	Very high	43 Å²	43	44.7 Å²	44.7	26%	0.264	22%	0.222	S	C	.	.	S	Bend	trans	-70.5	132.5	-178.8	-61.4	0	0	0	0	110.5	D266 F267 M271 V272 I273	D266-T269 WeakPolarHBondContact O-CB 3Å; D266-T269 PolarHBondContact O-N 2.76Å; D266-T269 PolarHBondContact O-OG1 2.62Å; F267-T269 VanDerWaalsContact C-N 3.34Å; T269-M271 HydrophobicContact CG2-CB 4.24Å; T269-M271 PolarHBondContact O-N 3.4Å; T269-M271 VanDerWaalsContact O-N 3.09Å; T269-V272 PolarHBondContact O-N 2.9Å; T269-I273 PolarHBondContact O-N 3.26Å
270	P	89.5	Confident	89.9	Confident	90 Å²	90	52 Å²	52	58%	0.584	25%	0.254	S	S	*	.	H	α-helix	trans	-55.9	-32.6	-177.9	-28	34.6	0	0	0	114.7	K274	P270-K274 WeakPolarHBondContact O-CB 3.42Å; P270-K274 VanDerWaalsContact O-CG 3.29Å; P270-K274 WeakPolarHBondContact O-CG 3.3Å; P270-K274 PolarHBondContact O-N 3.34Å
271	M	87.8	Confident	89.6	Confident	63 Å²	63	60.4 Å²	60.4	31%	0.31	29%	0.291	S	S	.	.	H	α-helix	trans	-65	-44	175.5	-177.2	173.2	174.8	0	0	111.8	T269 L275 Y302 L306 L357	T269-M271 HydrophobicContact CG2-CB 4.24Å; T269-M271 PolarHBondContact O-N 3.4Å; T269-M271 VanDerWaalsContact O-N 3.09Å; M271-L275 PolarHBondContact O-N 2.83Å; M271-Y302 HydrophobicContact CE-CE1 4.05Å; M271-L306 HydrophobicContact CE-CD2 4.32Å; M271-L357 HydrophobicContact CE-CD2 4.28Å; M271-L357 HydrophobicContact CG-CD2 4.14Å
272	V	89.8	Confident	89.3	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.03	30%	0.3	C	S	.	.	H	α-helix	trans	-67	-45	178.1	-179.6	0	0	0	0	109.9	V265 D266 F267 T269 K274 L275 M276 L357	V265-V272 HydrophobicContact CG1-CG1 4.03Å; V265-V272 HydrophobicContact CG1-CG2 4.16Å; D266-V272 WeakPolarHBondContact O-CG2 2.98Å; F267-V272 HydrophobicContact CD1-CG1 4.09Å; T269-V272 PolarHBondContact O-N 2.9Å; V272-K274 PolarHBondContact O-N 2.84Å; V272-L275 PolarHBondContact O-N 3.5Å; V272-L275 VanDerWaalsContact O-N 3.16Å; V272-M276 HydrophobicContact CG1-CG 4.15Å; V272-M276 WeakPolarHBondContact O-CB 3.3Å; V272-M276 VanDerWaalsContact O-CG 3.22Å; V272-M276 WeakPolarHBondContact O-CG 3.15Å; V272-M276 PolarHBondContact O-N 3.23Å; V272-L357 HydrophobicContact CG2-CB 4.42Å; V272-L357 HydrophobicContact CG2-CD2 3.98Å
273	I	89.8	Confident	88.9	Confident	76 Å²	76	66.6 Å²	66.6	39%	0.39	32%	0.324	S	S	.	.	H	α-helix	trans	-57.3	-48.3	177	-63	169.5	0	0	0	111.1	F267 T269 L275 M276 D277	F267-I273 VanDerWaalsContact O-CG1 3.3Å; F267-I273 WeakPolarHBondContact O-CG1 3.28Å; T269-I273 PolarHBondContact O-N 3.26Å; I273-L275 VanDerWaalsContact C-N 3.31Å; I273-L275 PolarHBondContact O-N 2.89Å; I273-M276 WeakPolarHBondContact O-CB 3.47Å; I273-M276 PolarHBondContact O-N 3.39Å; I273-D277 PolarHBondContact O-N 3.03Å
274	K	90	Very high	88.4	Confident	146 Å²	146	71.8 Å²	71.8	64%	0.635	35%	0.348	S	S	*	.	H	α-helix	trans	-60.6	-39.7	177.3	-76.2	175.8	-176.5	179.2	0	112.6	P270 V272 R278	P270-K274 WeakPolarHBondContact O-CB 3.42Å; P270-K274 VanDerWaalsContact O-CG 3.29Å; P270-K274 WeakPolarHBondContact O-CG 3.3Å; P270-K274 PolarHBondContact O-N 3.34Å; V272-K274 PolarHBondContact O-N 2.84Å; K274-R278 WeakPolarHBondContact O-CG 3.22Å; K274-R278 PolarHBondContact O-N 3.08Å
275	L	88.8	Confident	87.9	Confident	13 Å²	13	82.6 Å²	82.6	7%	0.068	39%	0.388	C	S	.	.	H	α-helix	trans	-68	-43.5	176.3	-175.4	69.8	0	0	0	110.8	L46 L50 M271 V272 I273 D277 R278 W279 Y302 L357	L46-L275 HydrophobicContact CD2-CD1 4.06Å; L50-L275 HydrophobicContact CD1-CD1 4.35Å; M271-L275 PolarHBondContact O-N 2.83Å; V272-L275 PolarHBondContact O-N 3.5Å; V272-L275 VanDerWaalsContact O-N 3.16Å; I273-L275 VanDerWaalsContact C-N 3.31Å; I273-L275 PolarHBondContact O-N 2.89Å; L275-D277 VanDerWaalsContact C-N 3.34Å; L275-D277 PolarHBondContact O-N 3.39Å; L275-R278 CarbonylContact O-C 3.58Å; L275-R278 PolarHBondContact O-N 3.25Å; L275-R278 VanDerWaalsContact O-N 3.11Å; L275-W279 WeakPolarHBondContact O-CB 3.47Å; L275-W279 PolarHBondContact O-N 3.07Å; L275-Y302 HydrophobicContact CD1-CD2 4.46Å; L275-Y302 HydrophobicContact CD1-CE2 3.85Å; L275-Y302 HydrophobicContact CD2-CD2 4.29Å; L275-Y302 HydrophobicContact CD2-CE2 4.29Å; L275-L357 HydrophobicContact CB-CD2 4.36Å; L275-L357 HydrophobicContact CD2-CD1 3.31Å; L275-L357 HydrophobicContact CD2-CD2 3.64Å; L275-L357 HydrophobicContact CD2-CG 4.08Å
276	M	87.9	Confident	87.5	Confident	27 Å²	27	87 Å²	87	13%	0.133	41%	0.408	C	S	.	.	H	α-helix	trans	-58.9	-42.9	177.7	-73.2	-60.1	-66.8	0	0	112.2	V272 I273 R278 W279 K280 P293 P294	V272-M276 HydrophobicContact CG1-CG 4.15Å; V272-M276 WeakPolarHBondContact O-CB 3.3Å; V272-M276 VanDerWaalsContact O-CG 3.22Å; V272-M276 WeakPolarHBondContact O-CG 3.15Å; V272-M276 PolarHBondContact O-N 3.23Å; I273-M276 WeakPolarHBondContact O-CB 3.47Å; I273-M276 PolarHBondContact O-N 3.39Å; M276-R278 VanDerWaalsContact C-N 3.27Å; M276-R278 PolarHBondContact O-N 3.48Å; M276-W279 PolarHBondContact O-N 3.36Å; M276-K280 WeakPolarHBondContact O-CG 3.31Å; M276-K280 PolarHBondContact O-N 3.24Å; M276-P293 HydrophobicContact CE-CB 3.78Å; M276-P293 HydrophobicContact CE-CG 4.17Å; M276-P294 WeakPolarHBondContact SD-CD 3.44Å; M276-P294 HydrophobicContact SD-CG 3.69Å
277	D	88.6	Confident	87.3	Confident	83 Å²	83	85.3 Å²	85.3	44%	0.444	40%	0.398	S	S	.	.	H	α-helix	trans	-65	-31.4	177	-75.2	-18.7	0	0	0	112.8	I273 L275 K281	I273-D277 PolarHBondContact O-N 3.03Å; L275-D277 VanDerWaalsContact C-N 3.34Å; L275-D277 PolarHBondContact O-N 3.39Å; D277-K281 WeakPolarHBondContact O-CD 3.36Å; D277-K281 WeakPolarHBondContact O-CG 3.41Å
278	R	87.6	Confident	87.1	Confident	151 Å²	151	85.7 Å²	85.7	57%	0.57	41%	0.405	S	S	*	.	H	α-helix	trans	-77.5	-42	173.6	-71.7	178.7	179.7	-166.6	-1.5	111.5	K274 L275 M276 K280 K281 L282	K274-R278 WeakPolarHBondContact O-CG 3.22Å; K274-R278 PolarHBondContact O-N 3.08Å; L275-R278 CarbonylContact O-C 3.58Å; L275-R278 PolarHBondContact O-N 3.25Å; L275-R278 VanDerWaalsContact O-N 3.11Å; M276-R278 VanDerWaalsContact C-N 3.27Å; M276-R278 PolarHBondContact O-N 3.48Å; R278-K280 VanDerWaalsContact C-N 3.31Å; R278-K280 PolarHBondContact O-N 3.49Å; R278-K281 PolarHBondContact O-N 3.38Å; R278-L282 PolarHBondContact O-N 2.87Å
279	W	89.3	Confident	86.7	Confident	6 Å²	6	81.3 Å²	81.3	2%	0.023	39%	0.389	C	S	.	.	H	α-helix	trans	-56.9	-45.2	180	-170	-87.9	0	0	0	111.5	Q39 T42 A43 L46 L275 M276 K281 L282 S290 T292 P294	Q39-W279 HydrophobicContact CG-CH2 4.2Å; Q39-W279 HydrophobicContact CG-CZ2 3.75Å; T42-W279 HydrophobicContact CG2-CH2 3.59Å; T42-W279 HydrophobicContact CG2-CZ2 4.07Å; T42-W279 HydrophobicContact CG2-CZ3 4.11Å; A43-W279 HydrophobicContact CB-CH2 4.08Å; A43-W279 HydrophobicContact CB-CZ3 4.14Å; L46-W279 HydrophobicContact CD2-CE3 3.63Å; L46-W279 HydrophobicContact CD2-CZ3 3.8Å; L275-W279 WeakPolarHBondContact O-CB 3.47Å; L275-W279 PolarHBondContact O-N 3.07Å; M276-W279 PolarHBondContact O-N 3.36Å; W279-K281 PolarHBondContact O-N 2.67Å; W279-K281 VanDerWaalsContact O-N 3.14Å; W279-L282 HydrophobicContact CD2-CD1 4.22Å; W279-L282 HydrophobicContact CE3-CD1 4.08Å; W279-L282 WeakPolarHBondContact O-CB 3.42Å; W279-L282 WeakPolarHBondContact O-CG 3.15Å; W279-L282 PolarHBondContact O-N 2.85Å; W279-S290 PolarHBondContact NE1-O 2.94Å; W279-T292 PolarHBondContact NE1-O 3.47Å; W279-P294 HydrophobicContact CD2-CB 4.48Å; W279-P294 HydrophobicContact CH2-CB 4.38Å; W279-P294 HydrophobicContact CZ2-CB 4.24Å
280	K	86.6	Confident	86.3	Confident	154 Å²	154	79.7 Å²	79.7	67%	0.67	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.2	176.2	-72	176	-179.4	178	0	114.6	M276 R278	M276-K280 WeakPolarHBondContact O-CG 3.31Å; M276-K280 PolarHBondContact O-N 3.24Å; R278-K280 VanDerWaalsContact C-N 3.31Å; R278-K280 PolarHBondContact O-N 3.49Å
281	K	88	Confident	85.7	Confident	177 Å²	177	82.5 Å²	82.5	77%	0.77	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-0.1	-178.3	-66	175.4	-176.1	177.1	0	113	D277 R278 W279	D277-K281 WeakPolarHBondContact O-CD 3.36Å; D277-K281 WeakPolarHBondContact O-CG 3.41Å; R278-K281 PolarHBondContact O-N 3.38Å; W279-K281 PolarHBondContact O-N 2.67Å; W279-K281 VanDerWaalsContact O-N 3.14Å
282	L	87.5	Confident	85.4	Confident	36 Å²	36	83.2 Å²	83.2	19%	0.188	39%	0.393	C	S	.	.	S	Bend	trans	-70.3	143	178.7	-65.4	172.6	0	0	0	110.7	L46 R278 W279 Q284 Y287	L46-L282 HydrophobicContact CD1-CD1 4.41Å; L46-L282 HydrophobicContact CD1-CD2 4.03Å; L46-L282 HydrophobicContact CD2-CD1 4.04Å; R278-L282 PolarHBondContact O-N 2.87Å; W279-L282 HydrophobicContact CD2-CD1 4.22Å; W279-L282 HydrophobicContact CE3-CD1 4.08Å; W279-L282 WeakPolarHBondContact O-CB 3.42Å; W279-L282 WeakPolarHBondContact O-CG 3.15Å; W279-L282 PolarHBondContact O-N 2.85Å; L282-Q284 PolarHBondContact O-N 2.72Å; L282-Y287 HydrophobicContact CB-CD2 4.21Å; L282-Y287 HydrophobicContact CB-CG 4.49Å; L282-Y287 HydrophobicContact CD1-CG 4.39Å; L282-Y287 HydrophobicContact CD2-CD2 3.99Å; L282-Y287 HydrophobicContact CD2-CE2 4.15Å; L282-Y287 HydrophobicContact CD2-CG 4.49Å; L282-Y287 HydrophobicContact CG-CD2 4.5Å
283	D	86.3	Confident	85.1	Confident	94 Å²	94	86.6 Å²	86.6	50%	0.503	42%	0.415	S	S	.	.			trans	-74.2	124.7	171.7	-174.2	0.2	0	0	0	109.9	R285 E286 Y287	D283-R285 PolarHBondContact O-N 3.16Å; D283-R285 PolarHBondContact OD1-N 3.42Å; D283-R285 VanDerWaalsContact OD1-N 3.15Å; D283-E286 PolarHBondContact O-N 2.89Å; D283-E286 VanDerWaalsContact O-N 3.17Å; D283-Y287 PolarHBondContact O-N 3.44Å
284	Q	81	Confident	84.9	Confident	111 Å²	111	83.6 Å²	83.6	52%	0.519	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-30.9	-179.1	-66.6	175.2	-16.6	0	0	112.7	L282 E286 Y287 E291	L282-Q284 PolarHBondContact O-N 2.72Å; Q284-E286 VanDerWaalsContact C-N 3.32Å; Q284-Y287 CarbonylContact O-C 3.58Å; Q284-E291 HydrophobicContact CG-CG 4.49Å
285	R	83.2	Confident	84.9	Confident	235 Å²	235	79.6 Å²	79.6	89%	0.887	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-33.4	179.5	-68.1	-178.6	175.8	-177.7	-0.2	112.3	D283	D283-R285 PolarHBondContact O-N 3.16Å; D283-R285 PolarHBondContact OD1-N 3.42Å; D283-R285 VanDerWaalsContact OD1-N 3.15Å
286	E	83.4	Confident	85	Confident	100 Å²	100	79.5 Å²	79.5	47%	0.467	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-34.7	-180	-167.4	-178.2	168.3	0	0	111.9	R45 D283 Q284	R45-E286 PolarHBondContact NH1-O 2.93Å; D283-E286 PolarHBondContact O-N 2.89Å; D283-E286 VanDerWaalsContact O-N 3.17Å; Q284-E286 VanDerWaalsContact C-N 3.32Å
287	Y	84.8	Confident	85.2	Confident	16 Å²	16	78.9 Å²	78.9	6%	0.063	38%	0.379	C	S	.	.	S	Bend	trans	-125.6	83.8	-175.7	-65	-77.5	0	0	0	110.8	T42 R45 L282 D283 Q284 S290	T42-Y287 HydrophobicContact CG2-CD1 3.87Å; T42-Y287 HydrophobicContact CG2-CG 4.22Å; R45-Y287 HydrophobicContact CB-CE1 4.18Å; L282-Y287 HydrophobicContact CB-CD2 4.21Å; L282-Y287 HydrophobicContact CB-CG 4.49Å; L282-Y287 HydrophobicContact CD1-CG 4.39Å; L282-Y287 HydrophobicContact CD2-CD2 3.99Å; L282-Y287 HydrophobicContact CD2-CE2 4.15Å; L282-Y287 HydrophobicContact CD2-CG 4.49Å; L282-Y287 HydrophobicContact CG-CD2 4.5Å; D283-Y287 PolarHBondContact O-N 3.44Å; Q284-Y287 CarbonylContact O-C 3.58Å; Y287-S290 WeakPolarHBondContact O-CB 3.41Å; Y287-S290 PolarHBondContact O-OG 2.92Å
288	P	82.7	Confident	85.3	Confident	50 Å²	50	75 Å²	75	33%	0.325	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	146.7	178.2	27.1	-34.3	0	0	0	111.4	D38 T42 S290	D38-P288 HydrophobicContact CB-CB 4.31Å; D38-P288 HydrophobicContact CB-CG 4.29Å; T42-P288 PolarHBondContact OG1-O 3.45Å; P288-S290 VanDerWaalsContact C-N 3.32Å
289	G	78.4	Confident	85.6	Confident	32 Å²	32	68 Å²	68	33%	0.33	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	6.9	-177.8	0	0	0	0	0	115.2	Q39 E291	Q39-G289 PolarHBondContact NE2-O 3.43Å; G289-E291 PolarHBondContact O-N 2.78Å
290	S	81.1	Confident	85.9	Confident	9 Å²	9	67.7 Å²	67.7	6%	0.063	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-5	177.2	53.8	0	0	0	0	114.6	W279 Y287 P288 T292	W279-S290 PolarHBondContact NE1-O 2.94Å; Y287-S290 WeakPolarHBondContact O-CB 3.41Å; Y287-S290 PolarHBondContact O-OG 2.92Å; P288-S290 VanDerWaalsContact C-N 3.32Å; S290-T292 PolarHBondContact O-N 3.1Å
291	E	77.9	Confident	86.2	Confident	149 Å²	149	60.4 Å²	60.4	70%	0.696	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-35.8	-179.3	-57.9	-172.6	165.6	0	0	113.7	Q284 G289	Q284-E291 HydrophobicContact CG-CG 4.49Å; G289-E291 PolarHBondContact O-N 2.78Å
292	T	81.1	Confident	86.5	Confident	77 Å²	77	53.6 Å²	53.6	47%	0.472	27%	0.27	S	S	.	.	S	Bend	trans	-102.2	155.1	179.8	54.1	0	0	0	0	110.3	Q39 W279 S290	Q39-T292 PolarHBondContact NE2-O 2.78Å; Q39-T292 PolarHBondContact NE2-OG1 3.25Å; W279-T292 PolarHBondContact NE1-O 3.47Å; S290-T292 PolarHBondContact O-N 3.1Å
293	P	83.1	Confident	86.8	Confident	76 Å²	76	51.9 Å²	51.9	49%	0.494	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-48.7	144.6	167.1	-28.4	36.7	0	0	0	111.6	Q39 M276 K295	Q39-P293 PolarHBondContact NE2-O 3.31Å; M276-P293 HydrophobicContact CE-CB 3.78Å; M276-P293 HydrophobicContact CE-CG 4.17Å; P293-K295 PolarHBondContact O-N 3.16Å
294	P	85.8	Confident	87.2	Confident	13 Å²	13	47.4 Å²	47.4	8%	0.084	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-60.4	123.4	177.2	25.7	-32.2	0	0	0	110	M276 W279	M276-P294 WeakPolarHBondContact SD-CD 3.44Å; M276-P294 HydrophobicContact SD-CG 3.69Å; W279-P294 HydrophobicContact CD2-CB 4.48Å; W279-P294 HydrophobicContact CH2-CB 4.38Å; W279-P294 HydrophobicContact CZ2-CB 4.24Å
295	K	89.7	Confident	87.8	Confident	62 Å²	62	42.3 Å²	42.3	27%	0.27	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-57.9	161.5	171.4	-68.4	169.8	-174.9	179.1	0	111	I215 D246 P293 T297 S298 A299	I215-K295 HydrophobicContact CD1-CD 4.24Å; D246-K295 WeakPolarHBondContact OD2-CA 3.43Å; P293-K295 PolarHBondContact O-N 3.16Å; K295-T297 PolarHBondContact O-N 2.93Å; K295-S298 WeakPolarHBondContact O-CB 3.49Å; K295-S298 PolarHBondContact O-N 3.11Å; K295-S298 VanDerWaalsContact O-N 3.07Å; K295-A299 PolarHBondContact O-N 2.81Å
296	Y	91.1	Very high	88.2	Confident	12 Å²	12	33.5 Å²	33.5	5%	0.047	18%	0.184	C	C	.	.	H	α-helix	trans	-58.7	-31.5	174.3	82.6	-90.5	0	0	0	112.9	I215 N241 L242 D246 A299 L300	I215-Y296 HydrophobicContact CD1-CD1 4.43Å; I215-Y296 HydrophobicContact CD1-CE1 4.03Å; N241-Y296 VanDerWaalsContact OD1-CE1 3.24Å; N241-Y296 WeakPolarHBondContact OD1-CE1 3.45Å; N241-Y296 PolarHBondContact OD1-OH 3.08Å; L242-Y296 HydrophobicContact CB-CD1 4.37Å; L242-Y296 HydrophobicContact CB-CD2 3.79Å; L242-Y296 HydrophobicContact CB-CE2 3.97Å; L242-Y296 HydrophobicContact CB-CG 4Å; L242-Y296 HydrophobicContact CD1-CD2 4.24Å; L242-Y296 HydrophobicContact CD1-CE2 4.04Å; D246-Y296 PolarHBondContact OD2-N 3.01Å; Y296-A299 PolarHBondContact O-N 3.26Å; Y296-L300 HydrophobicContact CD2-CD1 3.86Å; Y296-L300 HydrophobicContact CE2-CD1 4.15Å; Y296-L300 VanDerWaalsContact O-CG 3.27Å; Y296-L300 WeakPolarHBondContact O-CG 3.49Å; Y296-L300 PolarHBondContact O-N 3.28Å
297	T	91.3	Very high	88.7	Confident	14 Å²	14	28.8 Å²	28.8	9%	0.086	16%	0.161	C	C	.	.	H	α-helix	trans	-65.7	-40.9	174.7	45.9	0	0	0	0	112.2	E40 K295 L300 T301	E40-T297 WeakPolarHBondContact OE1-CB 3.41Å; E40-T297 PolarHBondContact OE1-OG1 3.28Å; K295-T297 PolarHBondContact O-N 2.93Å; T297-L300 PolarHBondContact O-N 3.39Å; T297-T301 PolarHBondContact O-N 3.49Å; T297-T301 PolarHBondContact O-OG1 2.77Å
298	S	91.9	Very high	89.1	Confident	1 Å²	1	28 Å²	28	1%	0.007	16%	0.159	C	C	.	.	H	α-helix	trans	-66.1	-40.5	173.7	-58	0	0	0	0	111.3	Q39 A43 K295 T301 Y302	Q39-S298 WeakPolarHBondContact CG-OG 3.09Å; Q39-S298 PolarHBondContact OE1-OG 3.35Å; A43-S298 WeakPolarHBondContact CB-O 3.11Å; K295-S298 WeakPolarHBondContact O-CB 3.49Å; K295-S298 PolarHBondContact O-N 3.11Å; K295-S298 VanDerWaalsContact O-N 3.07Å; S298-T301 WeakPolarHBondContact O-CB 3.45Å; S298-T301 PolarHBondContact O-N 3.02Å; S298-Y302 PolarHBondContact O-N 2.81Å
299	A	93.2	Very high	89.5	Confident	3 Å²	3	25.7 Å²	25.7	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-64.4	-41.9	174.5	0	0	0	0	0	112.4	V265 K295 Y296 T301 Y302 D303 L357 T358	V265-A299 HydrophobicContact CG2-CB 3.62Å; K295-A299 PolarHBondContact O-N 2.81Å; Y296-A299 PolarHBondContact O-N 3.26Å; A299-T301 VanDerWaalsContact C-N 3.31Å; A299-T301 PolarHBondContact O-N 2.8Å; A299-Y302 WeakPolarHBondContact O-CB 3.42Å; A299-Y302 PolarHBondContact O-N 2.73Å; A299-D303 PolarHBondContact O-N 3.49Å; A299-L357 HydrophobicContact CB-CB 4.24Å; A299-L357 HydrophobicContact CB-CD1 4.11Å; A299-T358 HydrophobicContact CB-CG2 4.2Å
300	L	94.8	Very high	90.1	Very high	1 Å²	1	26 Å²	26	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-61.9	-40	172.4	-72.8	169.4	0	0	0	111.5	P120 L134 R135 L264 Y296 T297 Y302 D303 G304 T358	P120-L300 HydrophobicContact CB-CB 3.66Å; P120-L300 HydrophobicContact CB-CD1 4.3Å; L134-L300 HydrophobicContact CB-CB 4.42Å; L134-L300 HydrophobicContact CB-CD2 3.96Å; L134-L300 WeakPolarHBondContact CD1-O 3.37Å; L134-L300 WeakPolarHBondContact O-CD2 3.46Å; R135-L300 HydrophobicContact CB-CD1 4.11Å; R135-L300 HydrophobicContact CG-CD1 4.23Å; L264-L300 HydrophobicContact CD2-CD2 4.11Å; L264-L300 HydrophobicContact CD2-CG 4.47Å; Y296-L300 HydrophobicContact CD2-CD1 3.86Å; Y296-L300 HydrophobicContact CE2-CD1 4.15Å; Y296-L300 VanDerWaalsContact O-CG 3.27Å; Y296-L300 WeakPolarHBondContact O-CG 3.49Å; Y296-L300 PolarHBondContact O-N 3.28Å; T297-L300 PolarHBondContact O-N 3.39Å; L300-Y302 PolarHBondContact O-N 3.19Å; L300-D303 PolarHBondContact O-N 3.39Å; L300-G304 PolarHBondContact O-N 2.95Å; L300-T358 HydrophobicContact CD2-CG2 3.79Å; L300-T358 HydrophobicContact CG-CG2 4.12Å
301	T	94.6	Very high	90.6	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.1	-43.5	177.4	-61.3	0	0	0	0	111.9	E40 F44 F95 T297 S298 A299 G304 V305	E40-T301 WeakPolarHBondContact O-CG2 3.47Å; F44-T301 HydrophobicContact CB-CG2 3.66Å; F44-T301 HydrophobicContact CD2-CG2 4.3Å; F44-T301 HydrophobicContact CG-CG2 4.48Å; F95-T301 HydrophobicContact CE1-CG2 3.57Å; F95-T301 HydrophobicContact CE2-CG2 4.41Å; F95-T301 HydrophobicContact CZ-CG2 3.45Å; F95-T301 VanDerWaalsContact CZ-CG2 3.45Å; T297-T301 PolarHBondContact O-N 3.49Å; T297-T301 PolarHBondContact O-OG1 2.77Å; S298-T301 WeakPolarHBondContact O-CB 3.45Å; S298-T301 PolarHBondContact O-N 3.02Å; A299-T301 VanDerWaalsContact C-N 3.31Å; A299-T301 PolarHBondContact O-N 2.8Å; T301-G304 PolarHBondContact O-N 3.29Å; T301-V305 PolarHBondContact O-N 2.79Å
302	Y	93.6	Very high	91.2	Very high	34 Å²	34	18.5 Å²	18.5	13%	0.133	10%	0.1	C	C	.	.	H	α-helix	trans	-59.6	-48	173.9	-176.3	-83	0	0	0	111.9	A47 L50 M271 L275 S298 A299 L300 G304 V305 L306 L357	A47-Y302 HydrophobicContact CB-CD2 3.62Å; A47-Y302 HydrophobicContact CB-CE2 3.93Å; A47-Y302 HydrophobicContact CB-CG 4.19Å; L50-Y302 HydrophobicContact CD1-CE2 3.97Å; M271-Y302 HydrophobicContact CE-CE1 4.05Å; L275-Y302 HydrophobicContact CD1-CD2 4.46Å; L275-Y302 HydrophobicContact CD1-CE2 3.85Å; L275-Y302 HydrophobicContact CD2-CD2 4.29Å; L275-Y302 HydrophobicContact CD2-CE2 4.29Å; S298-Y302 PolarHBondContact O-N 2.81Å; A299-Y302 WeakPolarHBondContact O-CB 3.42Å; A299-Y302 PolarHBondContact O-N 2.73Å; L300-Y302 PolarHBondContact O-N 3.19Å; Y302-G304 VanDerWaalsContact C-N 3.28Å; Y302-G304 PolarHBondContact O-N 3.3Å; Y302-V305 PolarHBondContact O-N 3.28Å; Y302-L306 PolarHBondContact O-N 3.23Å; Y302-L357 HydrophobicContact CD1-CD1 3.45Å; Y302-L357 VanDerWaalsContact CD1-CD1 3.45Å; Y302-L357 HydrophobicContact CD1-CG 3.72Å; Y302-L357 HydrophobicContact CD2-CD1 4.44Å; Y302-L357 HydrophobicContact CE1-CD1 4.17Å; Y302-L357 HydrophobicContact CE1-CD2 4.49Å; Y302-L357 HydrophobicContact CE1-CG 4.15Å; Y302-L357 HydrophobicContact CG-CD1 3.62Å; Y302-L357 HydrophobicContact CG-CG 4.4Å
303	D	94.3	Very high	91.5	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-63.7	-34.8	177.3	-73.7	-11.1	0	0	0	111.8	A299 L300 V305 L306 V307 G356 L357 T358	A299-D303 PolarHBondContact O-N 3.49Å; L300-D303 PolarHBondContact O-N 3.39Å; D303-V305 PolarHBondContact O-N 3.08Å; D303-L306 WeakPolarHBondContact O-CB 3.4Å; D303-L306 PolarHBondContact O-N 3.31Å; D303-L306 VanDerWaalsContact O-N 3.14Å; D303-V307 WeakPolarHBondContact O-CG2 3.26Å; D303-V307 PolarHBondContact O-N 2.86Å; D303-G356 VanDerWaalsContact OD1-CA 3.25Å; D303-G356 WeakPolarHBondContact OD1-CA 3.38Å; D303-L357 PolarHBondContact OD1-N 3.05Å; D303-L357 PolarHBondContact OD2-N 2.81Å; D303-T358 WeakPolarHBondContact OD2-CB 3.49Å; D303-T358 WeakPolarHBondContact OD2-CG2 3.25Å; D303-T358 PolarHBondContact OD2-N 3.05Å; D303-T358 PolarHBondContact OD2-OG1 2.73Å
304	G	94.1	Very high	91.8	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-59.3	-43.4	175.6	0	0	0	0	0	113.2	L134 L300 T301 Y302 L306 V307 M308	L134-G304 VanDerWaalsContact CD1-CA 3.43Å; L300-G304 PolarHBondContact O-N 2.95Å; T301-G304 PolarHBondContact O-N 3.29Å; Y302-G304 VanDerWaalsContact C-N 3.28Å; Y302-G304 PolarHBondContact O-N 3.3Å; G304-L306 VanDerWaalsContact C-N 3.32Å; G304-V307 PolarHBondContact O-N 2.77Å; G304-M308 WeakPolarHBondContact O-CG 3.45Å; G304-M308 PolarHBondContact O-N 3.09Å
305	V	93.4	Very high	91.9	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.018	7%	0.066	C	C	.	.	H	α-helix	trans	-65.2	-38.7	174.6	176.5	0	0	0	0	110.9	F44 A47 I48 L64 T301 Y302 D303 M308 A309	F44-V305 HydrophobicContact CD2-CG2 3.38Å; F44-V305 HydrophobicContact CE2-CG2 3.68Å; F44-V305 HydrophobicContact CG-CG2 4.33Å; A47-V305 HydrophobicContact CB-CB 3.71Å; A47-V305 HydrophobicContact CB-CG1 3.8Å; A47-V305 HydrophobicContact CB-CG2 3.98Å; I48-V305 HydrophobicContact CG1-CG1 3.85Å; I48-V305 HydrophobicContact CG1-CG2 4.45Å; L64-V305 HydrophobicContact CD1-CG1 4.26Å; T301-V305 PolarHBondContact O-N 2.79Å; Y302-V305 PolarHBondContact O-N 3.28Å; D303-V305 PolarHBondContact O-N 3.08Å; V305-M308 PolarHBondContact O-N 3.09Å; V305-A309 WeakPolarHBondContact O-CB 3.39Å; V305-A309 PolarHBondContact O-N 2.93Å
306	L	92.2	Very high	91.7	Very high	51 Å²	51	15.7 Å²	15.7	27%	0.267	7%	0.072	S	C	.	.	H	α-helix	trans	-64.7	-40	176.9	-172.1	60.6	0	0	0	111.9	M271 Y302 D303 G304 A309 E310 I354	M271-L306 HydrophobicContact CE-CD2 4.32Å; Y302-L306 PolarHBondContact O-N 3.23Å; D303-L306 WeakPolarHBondContact O-CB 3.4Å; D303-L306 PolarHBondContact O-N 3.31Å; D303-L306 VanDerWaalsContact O-N 3.14Å; G304-L306 VanDerWaalsContact C-N 3.32Å; L306-A309 PolarHBondContact O-N 3Å; L306-E310 PolarHBondContact O-N 3.3Å; L306-I354 HydrophobicContact CB-CD1 3.95Å; L306-I354 HydrophobicContact CD2-CD1 3.78Å; L306-I354 HydrophobicContact CG-CD1 3.63Å
307	V	94.4	Very high	91.5	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-61.4	-44.8	172.9	172	0	0	0	0	110.9	L132 D303 G304 E310 T311 L349 V352 I354 V361 F363	L132-V307 HydrophobicContact CD2-CG1 3.78Å; D303-V307 WeakPolarHBondContact O-CG2 3.26Å; D303-V307 PolarHBondContact O-N 2.86Å; G304-V307 PolarHBondContact O-N 2.77Å; V307-E310 PolarHBondContact O-N 2.9Å; V307-T311 WeakPolarHBondContact O-CB 3.35Å; V307-T311 PolarHBondContact O-N 3.22Å; V307-T311 PolarHBondContact O-OG1 2.87Å; V307-L349 HydrophobicContact CG1-CD2 4.08Å; V307-V352 HydrophobicContact CG1-CB 4.31Å; V307-V352 HydrophobicContact CG1-CG1 4.19Å; V307-V352 HydrophobicContact CG1-CG2 4.46Å; V307-V352 HydrophobicContact CG2-CG1 4.48Å; V307-I354 HydrophobicContact CB-CD1 4.42Å; V307-I354 HydrophobicContact CG2-CD1 3.52Å; V307-I354 HydrophobicContact CG2-CG1 4.2Å; V307-V361 HydrophobicContact CG2-CG1 3.93Å; V307-F363 HydrophobicContact CG1-CE2 4.11Å; V307-F363 HydrophobicContact CG1-CZ 4.49Å; V307-F363 HydrophobicContact CG2-CE2 4.26Å; V307-F363 HydrophobicContact CG2-CZ 4.31Å
308	M	92.7	Very high	91.2	Very high	1 Å²	1	27 Å²	27	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-61.4	-46.8	176.3	-69.6	-170.6	-154.6	0	0	111.8	F95 I118 G304 V305 E310 T311 F312	F95-M308 HydrophobicContact CB-CE 3.5Å; F95-M308 VanDerWaalsContact CB-CE 3.5Å; F95-M308 HydrophobicContact CD2-CE 3.64Å; F95-M308 HydrophobicContact CG-CE 4.02Å; I118-M308 HydrophobicContact CB-CE 3.49Å; I118-M308 VanDerWaalsContact CB-CE 3.49Å; I118-M308 HydrophobicContact CD1-CE 3.46Å; I118-M308 VanDerWaalsContact CD1-CE 3.46Å; I118-M308 HydrophobicContact CD1-CG 4.11Å; I118-M308 HydrophobicContact CD1-SD 4.18Å; I118-M308 HydrophobicContact CG1-CE 3.72Å; I118-M308 HydrophobicContact CG1-CG 4.39Å; I118-M308 HydrophobicContact CG2-CE 3.97Å; G304-M308 WeakPolarHBondContact O-CG 3.45Å; G304-M308 PolarHBondContact O-N 3.09Å; V305-M308 PolarHBondContact O-N 3.09Å; M308-E310 PolarHBondContact O-N 2.9Å; M308-T311 WeakPolarHBondContact O-CB 3.45Å; M308-T311 PolarHBondContact O-N 3.3Å; M308-F312 HydrophobicContact CB-CE2 4.27Å; M308-F312 WeakPolarHBondContact O-CD2 3.34Å; M308-F312 PolarHBondContact O-N 3.48Å
309	A	90.6	Very high	90.9	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-59.7	-45.1	178.9	0	0	0	0	0	111.8	L64 V305 L306 T311 F312 R313	L64-A309 HydrophobicContact CD1-CB 4.34Å; V305-A309 WeakPolarHBondContact O-CB 3.39Å; V305-A309 PolarHBondContact O-N 2.93Å; L306-A309 PolarHBondContact O-N 3Å; A309-T311 VanDerWaalsContact C-N 3.32Å; A309-T311 PolarHBondContact O-N 3.23Å; A309-F312 PolarHBondContact O-N 3.16Å; A309-R313 WeakPolarHBondContact O-CB 3.46Å; A309-R313 PolarHBondContact O-N 3.28Å
310	E	90.6	Very high	90.4	Very high	38 Å²	38	38.1 Å²	38.1	18%	0.178	17%	0.166	C	C	.	.	H	α-helix	trans	-65.7	-35.9	176.3	-175.5	57.2	-150.7	0	0	112.1	L306 V307 M308 R313 S314 R317 V352 I354	L306-E310 PolarHBondContact O-N 3.3Å; V307-E310 PolarHBondContact O-N 2.9Å; M308-E310 PolarHBondContact O-N 2.9Å; E310-R313 WeakPolarHBondContact O-CB 3.42Å; E310-R313 PolarHBondContact O-N 3.06Å; E310-R313 IonicContact OE2-CZ 3.8Å; E310-R313 IonicContact OE2-NE 4Å; E310-R313 IonicContact OE2-NH1 3.76Å; E310-R313 PolarHBondContact OE2-NH1 2.99Å; E310-S314 WeakPolarHBondContact O-CB 3.49Å; E310-S314 PolarHBondContact O-N 2.82Å; E310-R317 IonicContact OE1-NH1 3.9Å; E310-V352 HydrophobicContact CB-CG1 4.11Å; E310-V352 HydrophobicContact CG-CG1 4.01Å; E310-I354 HydrophobicContact CB-CG2 4.13Å; E310-I354 HydrophobicContact CG-CG2 3.98Å
311	T	91.8	Very high	89.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-53.3	176.2	-57.7	0	0	0	0	110.9	V307 M308 A309 R313 S314 L315 M345 T348 L349 V352	V307-T311 WeakPolarHBondContact O-CB 3.35Å; V307-T311 PolarHBondContact O-N 3.22Å; V307-T311 PolarHBondContact O-OG1 2.87Å; M308-T311 WeakPolarHBondContact O-CB 3.45Å; M308-T311 PolarHBondContact O-N 3.3Å; A309-T311 VanDerWaalsContact C-N 3.32Å; A309-T311 PolarHBondContact O-N 3.23Å; T311-R313 PolarHBondContact O-N 2.66Å; T311-S314 WeakPolarHBondContact O-CB 3.46Å; T311-S314 PolarHBondContact O-N 3.25Å; T311-S314 VanDerWaalsContact O-N 3.11Å; T311-L315 HydrophobicContact CG2-CD1 4.11Å; T311-L315 WeakPolarHBondContact O-CG 3.35Å; T311-L315 PolarHBondContact O-N 2.98Å; T311-M345 HydrophobicContact CG2-CE 3.77Å; T311-M345 HydrophobicContact CG2-SD 3.72Å; T311-T348 HydrophobicContact CG2-CG2 3.83Å; T311-L349 HydrophobicContact CG2-CD2 3.95Å; T311-L349 HydrophobicContact CG2-CG 3.74Å; T311-L349 WeakPolarHBondContact OG1-CD2 3.15Å; T311-V352 VanDerWaalsContact OG1-CG2 3.3Å; T311-V352 WeakPolarHBondContact OG1-CG2 3.4Å
312	F	90	Very high	89	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.7	-34.1	178.6	-68.5	-58	0	0	0	111.8	F23 V27 I29 F62 L64 F92 A93 M308 A309 L315 R316 I322 M345	F23-F312 HydrophobicContact CZ-CB 4.31Å; F23-F312 WeakPolarHBondContact CZ-O 3.42Å; V27-F312 HydrophobicContact CG1-CD1 4.02Å; V27-F312 HydrophobicContact CG1-CD2 4Å; V27-F312 HydrophobicContact CG1-CE1 3.67Å; V27-F312 HydrophobicContact CG1-CE2 3.65Å; V27-F312 HydrophobicContact CG1-CG 4.19Å; V27-F312 HydrophobicContact CG1-CZ 3.47Å; V27-F312 VanDerWaalsContact CG1-CZ 3.47Å; I29-F312 HydrophobicContact CG2-CE2 4.06Å; I29-F312 HydrophobicContact CG2-CZ 4.31Å; F62-F312 HydrophobicContact CE1-CB 3.7Å; F62-F312 HydrophobicContact CE2-CB 3.85Å; F62-F312 HydrophobicContact CE2-CD2 4.45Å; F62-F312 HydrophobicContact CE2-CG 4.5Å; F62-F312 HydrophobicContact CZ-CB 3.29Å; F62-F312 HydrophobicContact CZ-CG 4.35Å; L64-F312 HydrophobicContact CD2-CD2 4.04Å; L64-F312 HydrophobicContact CD2-CE2 4.2Å; F92-F312 HydrophobicContact CB-CE1 4.03Å; F92-F312 HydrophobicContact CB-CZ 4.04Å; A93-F312 HydrophobicContact CB-CZ 4.44Å; M308-F312 HydrophobicContact CB-CE2 4.27Å; M308-F312 WeakPolarHBondContact O-CD2 3.34Å; M308-F312 PolarHBondContact O-N 3.48Å; A309-F312 PolarHBondContact O-N 3.16Å; F312-L315 HydrophobicContact CD1-CD1 4.35Å; F312-R316 WeakPolarHBondContact O-CB 3.36Å; F312-R316 PolarHBondContact O-N 3.43Å; F312-R316 VanDerWaalsContact O-N 3.07Å; F312-I322 HydrophobicContact CD1-CD1 3.92Å; F312-I322 HydrophobicContact CE1-CD1 4.14Å; F312-M345 HydrophobicContact CD1-CE 4.13Å; F312-M345 HydrophobicContact CD1-SD 4.34Å; F312-M345 HydrophobicContact CE1-CE 3.44Å; F312-M345 VanDerWaalsContact CE1-CE 3.44Å; F312-M345 HydrophobicContact CE1-SD 3.88Å; F312-M345 HydrophobicContact CE2-CE 4.12Å; F312-M345 HydrophobicContact CZ-CE 3.43Å; F312-M345 VanDerWaalsContact CZ-CE 3.43Å; F312-M345 HydrophobicContact CZ-SD 4.46Å
313	R	88	Confident	88.3	Confident	34 Å²	34	41.3 Å²	41.3	13%	0.128	19%	0.189	C	C	.	.	H	α-helix	trans	-63.4	-43.4	173.1	-166.3	-175.6	-66.7	145.3	-2.5	111.7	E59 A309 E310 T311 R316 R317	E59-R313 PolarHBondContact O-NE 3.07Å; E59-R313 PolarHBondContact O-NH2 3.49Å; A309-R313 WeakPolarHBondContact O-CB 3.46Å; A309-R313 PolarHBondContact O-N 3.28Å; E310-R313 WeakPolarHBondContact O-CB 3.42Å; E310-R313 PolarHBondContact O-N 3.06Å; E310-R313 IonicContact OE2-CZ 3.8Å; E310-R313 IonicContact OE2-NE 4Å; E310-R313 IonicContact OE2-NH1 3.76Å; E310-R313 PolarHBondContact OE2-NH1 2.99Å; T311-R313 PolarHBondContact O-N 2.66Å; R313-R316 PolarHBondContact O-N 3.34Å; R313-R317 WeakPolarHBondContact O-CG 3.15Å; R313-R317 PolarHBondContact O-N 3.38Å
314	S	89.3	Confident	87.3	Confident	28 Å²	28	43.5 Å²	43.5	20%	0.196	20%	0.197	C	C	.	.	H	α-helix	trans	-66.8	-44.4	177.6	-171.9	0	0	0	0	112.1	E310 T311 R316 R317 Q318	E310-S314 WeakPolarHBondContact O-CB 3.49Å; E310-S314 PolarHBondContact O-N 2.82Å; T311-S314 WeakPolarHBondContact O-CB 3.46Å; T311-S314 PolarHBondContact O-N 3.25Å; T311-S314 VanDerWaalsContact O-N 3.11Å; S314-R316 VanDerWaalsContact C-N 3.3Å; S314-R316 PolarHBondContact O-N 3.1Å; S314-R317 WeakPolarHBondContact O-CB 3.3Å; S314-R317 PolarHBondContact O-N 3.1Å; S314-R317 VanDerWaalsContact O-N 3.09Å; S314-Q318 WeakPolarHBondContact O-CG 3.38Å; S314-Q318 PolarHBondContact O-N 2.84Å; S314-Q318 PolarHBondContact OG-NE2 2.67Å
315	L	88.2	Confident	86	Confident	0 Å²	0	55 Å²	55	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58	-42.7	175.2	-72.6	168.5	0	0	0	112	F23 T311 F312 Q318 K319 I320 I322 M345 T348	F23-L315 HydrophobicContact CE2-CB 4.31Å; T311-L315 HydrophobicContact CG2-CD1 4.11Å; T311-L315 WeakPolarHBondContact O-CG 3.35Å; T311-L315 PolarHBondContact O-N 2.98Å; F312-L315 HydrophobicContact CD1-CD1 4.35Å; L315-Q318 PolarHBondContact O-N 3.1Å; L315-K319 PolarHBondContact O-N 3.5Å; L315-K319 VanDerWaalsContact O-N 3.15Å; L315-I320 HydrophobicContact CD2-CB 4.24Å; L315-I320 HydrophobicContact CD2-CD1 3.94Å; L315-I320 HydrophobicContact CD2-CG2 4.32Å; L315-I320 PolarHBondContact O-N 3.24Å; L315-I320 VanDerWaalsContact O-N 3.09Å; L315-I322 HydrophobicContact CD1-CG2 4.06Å; L315-M345 HydrophobicContact CD1-SD 3.42Å; L315-M345 WeakPolarHBondContact CD1-SD 3.4Å; L315-T348 HydrophobicContact CD2-CG2 4.31Å; L315-T348 VanDerWaalsContact CD2-OG1 3.27Å; L315-T348 WeakPolarHBondContact CD2-OG1 3.09Å; L315-T348 HydrophobicContact CG-CG2 4.09Å
316	R	85.6	Confident	84.9	Confident	107 Å²	107	57.3 Å²	57.3	40%	0.404	27%	0.265	S	S	.	.	H	α-helix	trans	-64.3	-41.5	174.6	-176.3	173.6	173.2	165.3	-8.6	112.4	F23 P61 F312 R313 S314 Q318 K319	F23-R316 HydrophobicContact CB-CG 4.26Å; F23-R316 HydrophobicContact CD1-CB 4.35Å; F23-R316 HydrophobicContact CD1-CG 4.33Å; F23-R316 HydrophobicContact CD2-CB 3.82Å; F23-R316 HydrophobicContact CD2-CG 4.15Å; F23-R316 HydrophobicContact CE1-CB 4.36Å; F23-R316 HydrophobicContact CE2-CB 3.83Å; F23-R316 HydrophobicContact CG-CB 4.08Å; F23-R316 HydrophobicContact CG-CG 3.99Å; F23-R316 HydrophobicContact CZ-CB 4.1Å; P61-R316 PolarHBondContact O-NH1 3.43Å; F312-R316 WeakPolarHBondContact O-CB 3.36Å; F312-R316 PolarHBondContact O-N 3.43Å; F312-R316 VanDerWaalsContact O-N 3.07Å; R313-R316 PolarHBondContact O-N 3.34Å; S314-R316 VanDerWaalsContact C-N 3.3Å; S314-R316 PolarHBondContact O-N 3.1Å; R316-Q318 VanDerWaalsContact C-N 3.3Å; R316-Q318 PolarHBondContact O-N 2.02Å; R316-K319 PolarHBondContact O-N 2.86Å; R316-K319 VanDerWaalsContact O-N 3.09Å
317	R	86.3	Confident	84.1	Confident	173 Å²	173	62.6 Å²	62.6	65%	0.653	29%	0.293	S	S	*	.	H	α-helix	trans	-62.4	-37.7	175.6	-76.2	175.2	176.4	167.7	-0.1	111.9	E310 R313 S314 K319	E310-R317 IonicContact OE1-NH1 3.9Å; R313-R317 WeakPolarHBondContact O-CG 3.15Å; R313-R317 PolarHBondContact O-N 3.38Å; S314-R317 WeakPolarHBondContact O-CB 3.3Å; S314-R317 PolarHBondContact O-N 3.1Å; S314-R317 VanDerWaalsContact O-N 3.09Å; R317-K319 PolarHBondContact O-N 3.4Å
318	Q	86.6	Confident	83.1	Confident	92 Å²	92	63.7 Å²	63.7	43%	0.43	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-4.2	176	-65.7	177.6	16.6	0	0	113.3	S314 L315 R316 I320	S314-Q318 WeakPolarHBondContact O-CG 3.38Å; S314-Q318 PolarHBondContact O-N 2.84Å; S314-Q318 PolarHBondContact OG-NE2 2.67Å; L315-Q318 PolarHBondContact O-N 3.1Å; R316-Q318 VanDerWaalsContact C-N 3.3Å; R316-Q318 PolarHBondContact O-N 2.02Å; Q318-I320 HydrophobicContact CB-CD1 4Å; Q318-I320 HydrophobicContact CB-CG1 3.98Å; Q318-I320 PolarHBondContact O-N 3.35Å
319	K	83.7	Confident	82.5	Confident	194 Å²	194	65.8 Å²	65.8	84%	0.843	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	32.2	-176.8	-56.2	-179.5	179.8	178.4	0	113.3	L315 R316 R317	L315-K319 PolarHBondContact O-N 3.5Å; L315-K319 VanDerWaalsContact O-N 3.15Å; R316-K319 PolarHBondContact O-N 2.86Å; R316-K319 VanDerWaalsContact O-N 3.09Å; R317-K319 PolarHBondContact O-N 3.4Å
320	I	83.1	Confident	82.2	Confident	42 Å²	42	70.3 Å²	70.3	22%	0.215	35%	0.348	C	S	.	.			trans	-81.4	122.7	173.9	-61.6	174.6	0	0	0	108.2	L315 Q318 I322	L315-I320 HydrophobicContact CD2-CB 4.24Å; L315-I320 HydrophobicContact CD2-CD1 3.94Å; L315-I320 HydrophobicContact CD2-CG2 4.32Å; L315-I320 PolarHBondContact O-N 3.24Å; L315-I320 VanDerWaalsContact O-N 3.09Å; Q318-I320 HydrophobicContact CB-CD1 4Å; Q318-I320 HydrophobicContact CB-CG1 3.98Å; Q318-I320 PolarHBondContact O-N 3.35Å; I320-I322 PolarHBondContact O-N 3.23Å
321	D	79.6	Confident	82	Confident	58 Å²	58	68.9 Å²	68.9	31%	0.31	34%	0.342	S	S	.	.			trans	-81.6	113	176.4	-176.3	9.1	0	0	0	110.1	S323	D321-S323 VanDerWaalsContact CG-OG 3.25Å; D321-S323 WeakPolarHBondContact OD1-CB 3.34Å; D321-S323 PolarHBondContact OD1-N 3.22Å; D321-S323 PolarHBondContact OD1-OG 3.17Å; D321-S323 PolarHBondContact OD2-OG 3.19Å; D321-S323 VanDerWaalsContact OD2-OG 3.14Å
322	I	82.1	Confident	81.8	Confident	2 Å²	2	74.5 Å²	74.5	1%	0.01	37%	0.372	C	S	.	.			trans	-94.8	-0.4	178.1	60	171.4	0	0	0	112.9	F23 P24 F92 F312 L315 I320 R324 W339	F23-I322 HydrophobicContact CD2-CG1 4.31Å; F23-I322 HydrophobicContact CE1-CD1 4.35Å; F23-I322 HydrophobicContact CE2-CD1 3.64Å; F23-I322 HydrophobicContact CE2-CG1 3.83Å; F23-I322 HydrophobicContact CZ-CD1 3.54Å; F23-I322 HydrophobicContact CZ-CG1 4.21Å; P24-I322 HydrophobicContact CG-CD1 4.17Å; P24-I322 HydrophobicContact CG-CG1 4.03Å; F92-I322 WeakPolarHBondContact CE1-O 3.25Å; F312-I322 HydrophobicContact CD1-CD1 3.92Å; F312-I322 HydrophobicContact CE1-CD1 4.14Å; L315-I322 HydrophobicContact CD1-CG2 4.06Å; I320-I322 PolarHBondContact O-N 3.23Å; I322-R324 PolarHBondContact O-N 2.89Å; I322-W339 HydrophobicContact CB-CZ2 4.36Å
323	S	78.2	Confident	81.5	Confident	43 Å²	43	76.8 Å²	76.8	30%	0.301	39%	0.39	S	S	.	.			trans	-61.7	126.6	-176.8	65.8	0	0	0	0	111.4	D321 R325	D321-S323 VanDerWaalsContact CG-OG 3.25Å; D321-S323 WeakPolarHBondContact OD1-CB 3.34Å; D321-S323 PolarHBondContact OD1-N 3.22Å; D321-S323 PolarHBondContact OD1-OG 3.17Å; D321-S323 PolarHBondContact OD2-OG 3.19Å; D321-S323 VanDerWaalsContact OD2-OG 3.14Å; S323-R325 PolarHBondContact O-N 3.02Å
324	R	73.9	Confident	81.3	Confident	47 Å²	47	82.8 Å²	82.8	18%	0.177	43%	0.425	C	S	.	.			trans	-75	120.8	175.1	-76.5	-173.4	177.3	-166.3	5.9	109.3	V91 F92 I322 G326 A328	V91-R324 PolarHBondContact O-NH2 2.94Å; V91-R324 VanDerWaalsContact O-NH2 3.08Å; F92-R324 HydrophobicContact CE1-CG 4.2Å; I322-R324 PolarHBondContact O-N 2.89Å; R324-G326 PolarHBondContact O-N 3.05Å; R324-A328 VanDerWaalsContact NH1-CB 3.26Å
325	R	66.5	Low	80.8	Confident	241 Å²	241	86.9 Å²	86.9	91%	0.909	45%	0.451	S	S	*	.	S	Bend	trans	-79.7	68.3	174.5	-63.6	-177.8	-177.3	-178.9	1	110.2	S323	S323-R325 PolarHBondContact O-N 3.02Å
326	G	69.6	Low	80.3	Confident	51 Å²	51	88.9 Å²	88.9	53%	0.526	47%	0.468	S	S	.	.	S	Bend	trans	122.8	176.4	177.9	0	0	0	0	0	114.7	R324	R324-G326 PolarHBondContact O-N 3.05Å
327	N	74.7	Confident	80	Confident	162 Å²	162	87 Å²	87	87%	0.866	48%	0.475	S	S	*	.			trans	-70	143.1	172.9	-70.4	-5	0	0	0	109.9	G329	N327-G329 PolarHBondContact O-N 3.07Å
328	A	73.2	Confident	79.9	Confident	24 Å²	24	81.9 Å²	81.9	20%	0.198	46%	0.464	C	S	.	.			trans	-63.5	-23	-177.4	0	0	0	0	0	113.8	Y87 R324	Y87-A328 HydrophobicContact CD1-CB 3.93Å; Y87-A328 HydrophobicContact CE1-CB 3.65Å; Y87-A328 WeakPolarHBondContact CE1-O 3.49Å; Y87-A328 WeakPolarHBondContact O-CB 3.32Å; R324-A328 VanDerWaalsContact NH1-CB 3.26Å
329	G	80.8	Confident	79.8	Confident	44 Å²	44	78.2 Å²	78.2	45%	0.454	45%	0.447	S	S	.	.			trans	82	-163.5	-173.4	0	0	0	0	0	112.3	N327	N327-G329 PolarHBondContact O-N 3.07Å
330	D	84.3	Confident	79.6	Confident	97 Å²	97	71.3 Å²	71.3	52%	0.519	43%	0.43	S	S	.	.			trans	-82.7	141.3	176.5	-167.6	0.9	0	0	0	110.5	L332 A333	D330-L332 PolarHBondContact O-N 3.42Å; D330-L332 PolarHBondContact OD1-N 3.07Å; D330-A333 WeakPolarHBondContact O-CB 3.48Å; D330-A333 PolarHBondContact O-N 2.95Å
331	C	86.3	Confident	79.7	Confident	7 Å²	7	72.6 Å²	72.6	5%	0.047	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.6	176.2	64.1	0	0	0	0	112.1	C84 Y87 L113	C84-C331 HydrophobicContact CB-CB 3.79Å; C84-C331 WeakPolarHBondContact CB-SG 3.3Å; C84-C331 WeakPolarHBondContact SG-CB 3.41Å; C84-C331 CovalentContact SG-SG 2.01Å; C84-C331 PolarHBondContact SG-SG 3.45Å; Y87-C331 HydrophobicContact CD1-CB 4.15Å; Y87-C331 HydrophobicContact CG-CB 4.35Å; L113-C331 HydrophobicContact CD1-CB 4.16Å
332	L	87.6	Confident	80.1	Confident	119 Å²	119	69.9 Å²	69.9	62%	0.623	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	13.9	179.4	-56.6	177.3	0	0	0	113	D330 N334	D330-L332 PolarHBondContact O-N 3.42Å; D330-L332 PolarHBondContact OD1-N 3.07Å; L332-N334 PolarHBondContact O-N 2.82Å
333	A	85.2	Confident	80.4	Confident	47 Å²	47	73.4 Å²	73.4	39%	0.388	44%	0.439	S	S	.	.			trans	-53.9	138.3	173.8	0	0	0	0	0	110.7	D330 P335 A336	D330-A333 WeakPolarHBondContact O-CB 3.48Å; D330-A333 PolarHBondContact O-N 2.95Å; A333-P335 CarbonylContact O-C 3.23Å; A333-P335 VanDerWaalsContact O-C 3.31Å; A333-A336 WeakPolarHBondContact O-CA 3.34Å; A333-A336 WeakPolarHBondContact O-CB 3.44Å; A333-A336 PolarHBondContact O-N 2.78Å
334	N	83.1	Confident	80.9	Confident	161 Å²	161	73.7 Å²	73.7	86%	0.861	44%	0.437	S	S	*	.	S	Bend	trans	-128	108.8	-178	-170.6	9	0	0	0	110.9	L332	L332-N334 PolarHBondContact O-N 2.82Å
335	P	78.9	Confident	81.7	Confident	113 Å²	113	71.5 Å²	71.5	73%	0.734	43%	0.429	S	S	*	.	S	Bend	cis	-74.1	145.5	-1.3	30.5	-33.4	0	0	0	112.1	A333	A333-P335 CarbonylContact O-C 3.23Å; A333-P335 VanDerWaalsContact O-C 3.31Å
336	A	78.1	Confident	82.9	Confident	43 Å²	43	61 Å²	61	36%	0.355	39%	0.39	S	S	.	.			trans	-66.7	134.6	177.1	0	0	0	0	0	109.8	L113 A333 P338	L113-A336 HydrophobicContact CD2-CB 3.82Å; A333-A336 WeakPolarHBondContact O-CA 3.34Å; A333-A336 WeakPolarHBondContact O-CB 3.44Å; A333-A336 PolarHBondContact O-N 2.78Å; A336-P338 VanDerWaalsContact O-CD 3.28Å; A336-P338 WeakPolarHBondContact O-CD 3.41Å
337	A	78.8	Confident	83.9	Confident	68 Å²	68	64.9 Å²	64.9	56%	0.562	39%	0.389	S	S	*	.			trans	-92.7	107.4	176.2	0	0	0	0	0	109.5	Y87	Y87-A337 PolarHBondContact OH-O 3.07Å
338	P	83.6	Confident	84.7	Confident	64 Å²	64	57.3 Å²	57.3	42%	0.416	35%	0.348	S	S	.	.			trans	-68.7	149.5	179.7	-15.9	31.6	0	0	0	110.8	H114 A336 G340	H114-P338 HydrophobicContact CB-CB 4.18Å; H114-P338 VanDerWaalsContact ND1-CB 3.28Å; H114-P338 WeakPolarHBondContact ND1-CB 3.3Å; A336-P338 VanDerWaalsContact O-CD 3.28Å; A336-P338 WeakPolarHBondContact O-CD 3.41Å; P338-G340 PolarHBondContact O-N 3.49Å; P338-G340 VanDerWaalsContact O-N 3.14Å
339	W	84	Confident	85.6	Confident	16 Å²	16	56.3 Å²	56.3	6%	0.061	34%	0.34	C	S	.	.			trans	-71.4	111.1	175.4	-179.3	35.4	0	0	0	110.2	F92 L113 I322 Q341 G342 M345	F92-W339 HydrophobicContact CB-CH2 4.15Å; F92-W339 AromaticContact CD1-CH2 3.66Å; F92-W339 HydrophobicContact CD1-CH2 3.66Å; F92-W339 AromaticContact CD1-CZ2 3.68Å; F92-W339 HydrophobicContact CD1-CZ2 3.68Å; F92-W339 HydrophobicContact CE1-CZ2 4.24Å; F92-W339 HydrophobicContact CG-CH2 4.39Å; F92-W339 VanDerWaalsContact O-CZ3 3.26Å; F92-W339 WeakPolarHBondContact O-CZ3 3.32Å; L113-W339 PolarHBondContact O-N 3.36Å; I322-W339 HydrophobicContact CB-CZ2 4.36Å; W339-Q341 VanDerWaalsContact C-N 3.28Å; W339-Q341 HydrophobicContact CZ2-CB 3.85Å; W339-Q341 PolarHBondContact O-N 3.43Å; W339-G342 PolarHBondContact O-N 3.15Å; W339-M345 HydrophobicContact CZ3-CB 4.33Å; W339-M345 HydrophobicContact CZ3-CG 4.47Å
340	G	79.8	Confident	86.2	Confident	49 Å²	49	56 Å²	56	51%	0.505	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-36.6	-173.5	0	0	0	0	0	114.5	P338 G342	P338-G340 PolarHBondContact O-N 3.49Å; P338-G340 VanDerWaalsContact O-N 3.14Å; G340-G342 VanDerWaalsContact C-N 3.28Å; G340-G342 PolarHBondContact O-N 3.27Å
341	Q	85.8	Confident	86.5	Confident	69 Å²	69	56.8 Å²	56.8	32%	0.322	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-4.1	177.7	-62.5	72.7	25.2	0	0	113.3	W339 I343 D344 M345	W339-Q341 VanDerWaalsContact C-N 3.28Å; W339-Q341 HydrophobicContact CZ2-CB 3.85Å; W339-Q341 PolarHBondContact O-N 3.43Å; Q341-I343 VanDerWaalsContact C-N 3.27Å; Q341-I343 PolarHBondContact O-N 3.22Å; Q341-D344 PolarHBondContact O-N 3.09Å; Q341-M345 PolarHBondContact O-N 3.12Å
342	G	87	Confident	86.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-61.9	-33.5	177.3	0	0	0	0	0	113.2	H114 W339 G340 M345 E346	H114-G342 WeakPolarHBondContact O-CA 3.36Å; W339-G342 PolarHBondContact O-N 3.15Å; G340-G342 VanDerWaalsContact C-N 3.28Å; G340-G342 PolarHBondContact O-N 3.27Å; G342-M345 WeakPolarHBondContact O-CB 3.45Å; G342-M345 PolarHBondContact O-N 2.54Å; G342-E346 PolarHBondContact O-N 2.92Å
343	I	89.1	Confident	87.2	Confident	76 Å²	76	60.2 Å²	60.2	39%	0.39	33%	0.331	S	S	.	.	H	α-helix	trans	-67.1	-42.1	177.6	-61.9	168.9	0	0	0	110.9	F130 Q341 M345 E346 R347	F130-I343 HydrophobicContact CE1-CG1 4.4Å; F130-I343 HydrophobicContact CZ-CG1 4.04Å; Q341-I343 VanDerWaalsContact C-N 3.27Å; Q341-I343 PolarHBondContact O-N 3.22Å; I343-M345 VanDerWaalsContact C-N 3.33Å; I343-E346 PolarHBondContact O-N 2.99Å; I343-R347 WeakPolarHBondContact O-CB 3.47Å; I343-R347 PolarHBondContact O-N 3.31Å
344	D	89.5	Confident	87.5	Confident	50 Å²	50	59 Å²	59	27%	0.267	32%	0.318	S	S	.	.	H	α-helix	trans	-67.5	-38.2	176.6	-66.3	-43.3	0	0	0	110.6	Q341 R347 T348	Q341-D344 PolarHBondContact O-N 3.09Å; D344-R347 PolarHBondContact O-N 3.2Å; D344-R347 IonicContact OD1-CZ 4Å; D344-R347 IonicContact OD1-NH1 3.05Å; D344-R347 PolarHBondContact OD1-NH1 3.46Å; D344-T348 PolarHBondContact O-N 3.17Å; D344-T348 PolarHBondContact O-OG1 3.29Å
345	M	90.1	Very high	87.9	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-49	173.2	-176.9	66.7	-178.1	0	0	112	A93 T311 F312 L315 W339 Q341 G342 I343 T348 L349	A93-M345 HydrophobicContact CB-CE 4.05Å; T311-M345 HydrophobicContact CG2-CE 3.77Å; T311-M345 HydrophobicContact CG2-SD 3.72Å; F312-M345 HydrophobicContact CD1-CE 4.13Å; F312-M345 HydrophobicContact CD1-SD 4.34Å; F312-M345 HydrophobicContact CE1-CE 3.44Å; F312-M345 VanDerWaalsContact CE1-CE 3.44Å; F312-M345 HydrophobicContact CE1-SD 3.88Å; F312-M345 HydrophobicContact CE2-CE 4.12Å; F312-M345 HydrophobicContact CZ-CE 3.43Å; F312-M345 VanDerWaalsContact CZ-CE 3.43Å; F312-M345 HydrophobicContact CZ-SD 4.46Å; L315-M345 HydrophobicContact CD1-SD 3.42Å; L315-M345 WeakPolarHBondContact CD1-SD 3.4Å; W339-M345 HydrophobicContact CZ3-CB 4.33Å; W339-M345 HydrophobicContact CZ3-CG 4.47Å; Q341-M345 PolarHBondContact O-N 3.12Å; G342-M345 WeakPolarHBondContact O-CB 3.45Å; G342-M345 PolarHBondContact O-N 2.54Å; I343-M345 VanDerWaalsContact C-N 3.33Å; M345-T348 PolarHBondContact O-N 3.14Å; M345-L349 HydrophobicContact CE-CD1 4.16Å; M345-L349 HydrophobicContact CE-CG 4.32Å; M345-L349 HydrophobicContact CG-CD1 4.16Å; M345-L349 WeakPolarHBondContact O-CB 3.27Å; M345-L349 WeakPolarHBondContact O-CG 2.96Å; M345-L349 PolarHBondContact O-N 3.17Å
346	E	91.3	Very high	88.4	Confident	21 Å²	21	51.5 Å²	51.5	10%	0.098	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-45.1	176.5	-173.4	-169.3	-171.8	0	0	111.8	F130 G342 I343 T348 L349 K350	F130-E346 HydrophobicContact CD1-CB 3.97Å; F130-E346 HydrophobicContact CD1-CG 4.31Å; F130-E346 HydrophobicContact CE1-CB 4.11Å; F130-E346 WeakPolarHBondContact CE1-OE2 3.31Å; F130-E346 VanDerWaalsContact N-CD 3.35Å; F130-E346 PolarHBondContact N-OE1 3.45Å; G342-E346 PolarHBondContact O-N 2.92Å; I343-E346 PolarHBondContact O-N 2.99Å; E346-T348 VanDerWaalsContact C-N 3.32Å; E346-T348 PolarHBondContact O-N 3.17Å; E346-L349 PolarHBondContact O-N 3.28Å; E346-K350 HydrophobicContact CG-CD 4.32Å; E346-K350 WeakPolarHBondContact O-CG 3.48Å; E346-K350 PolarHBondContact O-N 2.89Å; E346-K350 WeakPolarHBondContact OE1-CE 3.38Å; E346-K350 IonicContact OE1-NZ 2.75Å; E346-K350 PolarHBondContact OE1-NZ 2.82Å
347	R	91	Very high	89.1	Confident	131 Å²	131	49.9 Å²	49.9	49%	0.494	25%	0.253	S	S	.	.	H	α-helix	trans	-59.1	-44.8	177.6	-173	-171.5	-63.5	132.2	4.4	111	I343 D344 Q351	I343-R347 WeakPolarHBondContact O-CB 3.47Å; I343-R347 PolarHBondContact O-N 3.31Å; D344-R347 PolarHBondContact O-N 3.2Å; D344-R347 IonicContact OD1-CZ 4Å; D344-R347 IonicContact OD1-NH1 3.05Å; D344-R347 PolarHBondContact OD1-NH1 3.46Å; R347-Q351 VanDerWaalsContact O-CG 3.3Å; R347-Q351 WeakPolarHBondContact O-CG 3.38Å; R347-Q351 PolarHBondContact O-N 3.13Å
348	T	92.2	Very high	89.7	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-67.6	-41.4	178.2	-54.8	0	0	0	0	111.7	T311 L315 D344 M345 E346 K350 Q351 V352	T311-T348 HydrophobicContact CG2-CG2 3.83Å; L315-T348 HydrophobicContact CD2-CG2 4.31Å; L315-T348 VanDerWaalsContact CD2-OG1 3.27Å; L315-T348 WeakPolarHBondContact CD2-OG1 3.09Å; L315-T348 HydrophobicContact CG-CG2 4.09Å; D344-T348 PolarHBondContact O-N 3.17Å; D344-T348 PolarHBondContact O-OG1 3.29Å; M345-T348 PolarHBondContact O-N 3.14Å; E346-T348 VanDerWaalsContact C-N 3.32Å; E346-T348 PolarHBondContact O-N 3.17Å; T348-K350 VanDerWaalsContact C-N 3.32Å; T348-K350 PolarHBondContact O-N 2.81Å; T348-Q351 PolarHBondContact O-N 2.89Å; T348-Q351 VanDerWaalsContact O-N 3.07Å; T348-V352 WeakPolarHBondContact O-CG2 3.39Å; T348-V352 PolarHBondContact O-N 3.32Å
349	L	92.3	Very high	90.1	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.016	22%	0.219	C	C	.	.	H	α-helix	trans	-54.9	-46.8	175.7	-82.2	162.8	0	0	0	111.7	I118 L132 V307 T311 M345 E346 Q351 V352	I118-L349 HydrophobicContact CD1-CD1 4.34Å; I118-L349 HydrophobicContact CD1-CD2 4.43Å; I118-L349 HydrophobicContact CG1-CD2 4.36Å; L132-L349 HydrophobicContact CD2-CB 4.36Å; L132-L349 HydrophobicContact CD2-CD2 4.01Å; V307-L349 HydrophobicContact CG1-CD2 4.08Å; T311-L349 HydrophobicContact CG2-CD2 3.95Å; T311-L349 HydrophobicContact CG2-CG 3.74Å; T311-L349 WeakPolarHBondContact OG1-CD2 3.15Å; M345-L349 HydrophobicContact CE-CD1 4.16Å; M345-L349 HydrophobicContact CE-CG 4.32Å; M345-L349 HydrophobicContact CG-CD1 4.16Å; M345-L349 WeakPolarHBondContact O-CB 3.27Å; M345-L349 WeakPolarHBondContact O-CG 2.96Å; M345-L349 PolarHBondContact O-N 3.17Å; E346-L349 PolarHBondContact O-N 3.28Å; L349-Q351 PolarHBondContact O-N 3.01Å; L349-V352 WeakPolarHBondContact O-CB 3.28Å; L349-V352 PolarHBondContact O-N 3.19Å
350	K	92	Very high	90.5	Very high	38 Å²	38	46 Å²	46	17%	0.165	23%	0.226	C	C	.	.	H	α-helix	trans	-67.5	-23	179.5	-68.3	176.2	-177.9	174.2	0	113.3	E346 T348 H365	E346-K350 HydrophobicContact CG-CD 4.32Å; E346-K350 WeakPolarHBondContact O-CG 3.48Å; E346-K350 PolarHBondContact O-N 2.89Å; E346-K350 WeakPolarHBondContact OE1-CE 3.38Å; E346-K350 IonicContact OE1-NZ 2.75Å; E346-K350 PolarHBondContact OE1-NZ 2.82Å; T348-K350 VanDerWaalsContact C-N 3.32Å; T348-K350 PolarHBondContact O-N 2.81Å; K350-H365 WeakPolarHBondContact CD-O 3.49Å; K350-H365 VanDerWaalsContact CE-O 3.27Å; K350-H365 WeakPolarHBondContact CE-O 3.43Å; K350-H365 PolarHBondContact NZ-O 3.22Å
351	Q	92.1	Very high	91.2	Very high	114 Å²	114	43.8 Å²	43.8	53%	0.533	20%	0.203	S	C	.	.	H	α-helix	trans	-86.6	-10.6	178.3	-71.9	174.9	-3.9	0	0	113.6	R347 T348 L349 R353	R347-Q351 VanDerWaalsContact O-CG 3.3Å; R347-Q351 WeakPolarHBondContact O-CG 3.38Å; R347-Q351 PolarHBondContact O-N 3.13Å; T348-Q351 PolarHBondContact O-N 2.89Å; T348-Q351 VanDerWaalsContact O-N 3.07Å; L349-Q351 PolarHBondContact O-N 3.01Å; Q351-R353 PolarHBondContact O-N 3.32Å
352	V	92.9	Very high	91.5	Very high	8 Å²	8	42.1 Å²	42.1	5%	0.048	20%	0.195	C	C	.	.			trans	-62.6	133.1	-179.6	175.6	0	0	0	0	110.6	V307 E310 T311 T348 L349 I354	V307-V352 HydrophobicContact CG1-CB 4.31Å; V307-V352 HydrophobicContact CG1-CG1 4.19Å; V307-V352 HydrophobicContact CG1-CG2 4.46Å; V307-V352 HydrophobicContact CG2-CG1 4.48Å; E310-V352 HydrophobicContact CB-CG1 4.11Å; E310-V352 HydrophobicContact CG-CG1 4.01Å; T311-V352 VanDerWaalsContact OG1-CG2 3.3Å; T311-V352 WeakPolarHBondContact OG1-CG2 3.4Å; T348-V352 WeakPolarHBondContact O-CG2 3.39Å; T348-V352 PolarHBondContact O-N 3.32Å; L349-V352 WeakPolarHBondContact O-CB 3.28Å; L349-V352 PolarHBondContact O-N 3.19Å; V352-I354 HydrophobicContact CG1-CG1 4.38Å; V352-I354 HydrophobicContact CG1-CG2 3.75Å
353	R	93.8	Very high	91.8	Very high	190 Å²	190	43 Å²	43	72%	0.717	20%	0.199	S	C	*	.			trans	-131.4	113.6	172.2	-57.4	-173.7	-179.7	-179.9	-2.2	108.7	Q351 Q362	Q351-R353 PolarHBondContact O-N 3.32Å; R353-Q362 HydrophobicContact CB-CG 4.38Å; R353-Q362 HydrophobicContact CG-CG 4.08Å
354	I	92.6	Very high	91.8	Very high	22 Å²	22	40.9 Å²	40.9	11%	0.113	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	158	-178.4	61.2	169.2	0	0	0	110.9	L306 V307 E310 V352 V361	L306-I354 HydrophobicContact CB-CD1 3.95Å; L306-I354 HydrophobicContact CD2-CD1 3.78Å; L306-I354 HydrophobicContact CG-CD1 3.63Å; V307-I354 HydrophobicContact CB-CD1 4.42Å; V307-I354 HydrophobicContact CG2-CD1 3.52Å; V307-I354 HydrophobicContact CG2-CG1 4.2Å; E310-I354 HydrophobicContact CB-CG2 4.13Å; E310-I354 HydrophobicContact CG-CG2 3.98Å; V352-I354 HydrophobicContact CG1-CG1 4.38Å; V352-I354 HydrophobicContact CG1-CG2 3.75Å; I354-V361 HydrophobicContact CG1-CB 3.86Å; I354-V361 HydrophobicContact CG1-CG1 4.48Å; I354-V361 HydrophobicContact CG1-CG2 4.35Å; I354-V361 PolarHBondContact N-O 3.4Å; I354-V361 PolarHBondContact O-N 2.97Å
355	Q	91.7	Very high	91.8	Very high	115 Å²	115	45.5 Å²	45.5	54%	0.537	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	114.6	165.9	-168.9	70.2	17.2	0	0	108.6	G359	Q355-G359 VanDerWaalsContact NE2-C 3.34Å
356	G	89.9	Confident	91.7	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	-167.4	178.4	0	0	0	0	0	113	D303 T358 G359	D303-G356 VanDerWaalsContact OD1-CA 3.25Å; D303-G356 WeakPolarHBondContact OD1-CA 3.38Å; G356-T358 VanDerWaalsContact C-N 3.26Å; G356-T358 PolarHBondContact O-N 3.34Å; G356-G359 PolarHBondContact N-O 3.2Å; G356-G359 PolarHBondContact O-N 3.35Å
357	L	91.1	Very high	91.6	Very high	8 Å²	8	48.6 Å²	48.6	4%	0.042	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-32.2	173	-58.8	177	0	0	0	112.1	M271 V272 L275 A299 Y302 D303 G359	M271-L357 HydrophobicContact CE-CD2 4.28Å; M271-L357 HydrophobicContact CG-CD2 4.14Å; V272-L357 HydrophobicContact CG2-CB 4.42Å; V272-L357 HydrophobicContact CG2-CD2 3.98Å; L275-L357 HydrophobicContact CB-CD2 4.36Å; L275-L357 HydrophobicContact CD2-CD1 3.31Å; L275-L357 HydrophobicContact CD2-CD2 3.64Å; L275-L357 HydrophobicContact CD2-CG 4.08Å; A299-L357 HydrophobicContact CB-CB 4.24Å; A299-L357 HydrophobicContact CB-CD1 4.11Å; Y302-L357 HydrophobicContact CD1-CD1 3.45Å; Y302-L357 VanDerWaalsContact CD1-CD1 3.45Å; Y302-L357 HydrophobicContact CD1-CG 3.72Å; Y302-L357 HydrophobicContact CD2-CD1 4.44Å; Y302-L357 HydrophobicContact CE1-CD1 4.17Å; Y302-L357 HydrophobicContact CE1-CD2 4.49Å; Y302-L357 HydrophobicContact CE1-CG 4.15Å; Y302-L357 HydrophobicContact CG-CD1 3.62Å; Y302-L357 HydrophobicContact CG-CG 4.4Å; D303-L357 PolarHBondContact OD1-N 3.05Å; D303-L357 PolarHBondContact OD2-N 2.81Å; L357-G359 PolarHBondContact O-N 3.37Å
358	T	92.5	Very high	91.6	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.031	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	15.9	178.7	63.2	0	0	0	0	113	L264 V265 A299 L300 D303 G356 R369	L264-T358 HydrophobicContact CD2-CG2 3.81Å; L264-T358 HydrophobicContact CG-CG2 4.1Å; V265-T358 HydrophobicContact CG2-CG2 4.15Å; A299-T358 HydrophobicContact CB-CG2 4.2Å; L300-T358 HydrophobicContact CD2-CG2 3.79Å; L300-T358 HydrophobicContact CG-CG2 4.12Å; D303-T358 WeakPolarHBondContact OD2-CB 3.49Å; D303-T358 WeakPolarHBondContact OD2-CG2 3.25Å; D303-T358 PolarHBondContact OD2-N 3.05Å; D303-T358 PolarHBondContact OD2-OG1 2.73Å; G356-T358 VanDerWaalsContact C-N 3.26Å; G356-T358 PolarHBondContact O-N 3.34Å; T358-R369 PolarHBondContact O-NH2 2.98Å; T358-R369 PolarHBondContact OG1-NH1 2.99Å; T358-R369 PolarHBondContact OG1-NH2 2.89Å
359	G	91.4	Very high	91.5	Very high	22 Å²	22	47.6 Å²	47.6	23%	0.227	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	88.8	-143.2	-178.3	0	0	0	0	0	112.8	Q355 G356 L357	Q355-G359 VanDerWaalsContact NE2-C 3.34Å; G356-G359 PolarHBondContact N-O 3.2Å; G356-G359 PolarHBondContact O-N 3.35Å; L357-G359 PolarHBondContact O-N 3.37Å
360	N	92.9	Very high	91.4	Very high	40 Å²	40	49.6 Å²	49.6	21%	0.214	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	129.1	178.3	179.2	55.3	0	0	0	110.3	Q362 R369 N371	N360-Q362 PolarHBondContact ND2-NE2 2.93Å; N360-Q362 VanDerWaalsContact ND2-NE2 3.12Å; N360-Q362 PolarHBondContact OD1-NE2 2.91Å; N360-R369 PolarHBondContact O-NH2 3.38Å; N360-N371 PolarHBondContact ND2-ND2 3.35Å; N360-N371 PolarHBondContact ND2-O 2.8Å
361	V	93.8	Very high	91.4	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.012	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	112	179.3	-176.4	0	0	0	0	108.6	V307 I354 F363	V307-V361 HydrophobicContact CG2-CG1 3.93Å; I354-V361 HydrophobicContact CG1-CB 3.86Å; I354-V361 HydrophobicContact CG1-CG1 4.48Å; I354-V361 HydrophobicContact CG1-CG2 4.35Å; I354-V361 PolarHBondContact N-O 3.4Å; I354-V361 PolarHBondContact O-N 2.97Å; V361-F363 HydrophobicContact CG1-CE1 4.38Å; V361-F363 HydrophobicContact CG1-CE2 3.78Å; V361-F363 HydrophobicContact CG1-CZ 3.53Å
362	Q	93.3	Very high	91.3	Very high	34 Å²	34	46.7 Å²	46.7	16%	0.159	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	152.7	178.4	-59.2	-176.8	-0.9	0	0	109.2	R353 N360 R369 V370 N371	R353-Q362 HydrophobicContact CB-CG 4.38Å; R353-Q362 HydrophobicContact CG-CG 4.08Å; N360-Q362 PolarHBondContact ND2-NE2 2.93Å; N360-Q362 VanDerWaalsContact ND2-NE2 3.12Å; N360-Q362 PolarHBondContact OD1-NE2 2.91Å; Q362-R369 WeakPolarHBondContact O-CA 3.28Å; Q362-V370 HydrophobicContact CB-CG2 4.2Å; Q362-V370 PolarHBondContact O-N 3.42Å; Q362-N371 PolarHBondContact OE1-ND2 2.89Å; Q362-N371 VanDerWaalsContact OE1-ND2 3.1Å
363	F	92.4	Very high	91.3	Very high	18 Å²	18	49.4 Å²	49.4	8%	0.079	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	152.9	-175.8	-54.5	-80.8	0	0	0	112.4	L132 L134 V307 V361 R368	L132-F363 HydrophobicContact CD1-CB 4.08Å; L132-F363 HydrophobicContact CD1-CD1 3.48Å; L132-F363 VanDerWaalsContact CD1-CD1 3.48Å; L132-F363 HydrophobicContact CD1-CD2 3.78Å; L132-F363 HydrophobicContact CD1-CE1 3.77Å; L132-F363 HydrophobicContact CD1-CE2 4.04Å; L132-F363 HydrophobicContact CD1-CG 3.49Å; L132-F363 VanDerWaalsContact CD1-CG 3.49Å; L132-F363 HydrophobicContact CD1-CZ 4.04Å; L132-F363 HydrophobicContact CD2-CD2 4.37Å; L132-F363 HydrophobicContact CD2-CE1 4.08Å; L132-F363 HydrophobicContact CD2-CE2 3.83Å; L132-F363 HydrophobicContact CD2-CZ 3.66Å; L132-F363 HydrophobicContact CG-CD1 3.91Å; L132-F363 HydrophobicContact CG-CD2 4.41Å; L132-F363 HydrophobicContact CG-CE1 3.64Å; L132-F363 HydrophobicContact CG-CE2 4.17Å; L132-F363 HydrophobicContact CG-CG 4.29Å; L132-F363 HydrophobicContact CG-CZ 3.78Å; L134-F363 HydrophobicContact CD2-CE1 4.18Å; L134-F363 HydrophobicContact CD2-CZ 3.83Å; V307-F363 HydrophobicContact CG1-CE2 4.11Å; V307-F363 HydrophobicContact CG1-CZ 4.49Å; V307-F363 HydrophobicContact CG2-CE2 4.26Å; V307-F363 HydrophobicContact CG2-CZ 4.31Å; V361-F363 HydrophobicContact CG1-CE1 4.38Å; V361-F363 HydrophobicContact CG1-CE2 3.78Å; V361-F363 HydrophobicContact CG1-CZ 3.53Å; F363-R368 CarbonylContact C-O 3.59Å; F363-R368 VanDerWaalsContact CA-O 3.22Å; F363-R368 WeakPolarHBondContact CA-O 3.49Å
364	D	90.1	Very high	91.2	Very high	33 Å²	33	40.3 Å²	40.3	18%	0.176	20%	0.2	C	C	.	.			trans	-84.8	-177.1	170.6	75.3	-0.7	0	0	0	112.3	Y366 G367 R368 V370	D364-Y366 PolarHBondContact O-N 3.29Å; D364-Y366 VanDerWaalsContact OD1-C 3.26Å; D364-Y366 VanDerWaalsContact OD1-CA 3.31Å; D364-Y366 WeakPolarHBondContact OD1-CA 3.46Å; D364-Y366 WeakPolarHBondContact OD1-CB 3.03Å; D364-Y366 PolarHBondContact OD1-N 3.44Å; D364-G367 PolarHBondContact O-N 3.38Å; D364-G367 VanDerWaalsContact O-N 3.14Å; D364-G367 PolarHBondContact OD1-N 3Å; D364-R368 PolarHBondContact N-O 3.36Å; D364-R368 PolarHBondContact OD1-N 3.24Å; D364-R368 IonicContact OD1-NE 3.54Å; D364-R368 IonicContact OD2-CZ 3.76Å; D364-R368 VanDerWaalsContact OD2-CZ 3.26Å; D364-R368 IonicContact OD2-NE 2.6Å; D364-R368 PolarHBondContact OD2-NE 3.46Å; D364-R368 IonicContact OD2-NH2 2.73Å; D364-R368 PolarHBondContact OD2-NH2 3.39Å; D364-V370 HydrophobicContact CB-CG1 3.88Å
365	H	88.8	Confident	91.2	Very high	147 Å²	147	39.9 Å²	39.9	68%	0.681	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.1	177.3	-172.7	73.6	0	0	0	113.5	K350	K350-H365 WeakPolarHBondContact CD-O 3.49Å; K350-H365 VanDerWaalsContact CE-O 3.27Å; K350-H365 WeakPolarHBondContact CE-O 3.43Å; K350-H365 PolarHBondContact NZ-O 3.22Å
366	Y	88.1	Confident	91.3	Very high	87 Å²	87	34.4 Å²	34.4	34%	0.341	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	3.5	180	-56.5	-72.4	0	0	0	112.9	E127 D364	E127-Y366 HydrophobicContact CB-CD1 4.2Å; E127-Y366 HydrophobicContact CB-CE1 4.14Å; E127-Y366 HydrophobicContact CG-CD1 4.08Å; E127-Y366 HydrophobicContact CG-CE1 3.66Å; D364-Y366 PolarHBondContact O-N 3.29Å; D364-Y366 VanDerWaalsContact OD1-C 3.26Å; D364-Y366 VanDerWaalsContact OD1-CA 3.31Å; D364-Y366 WeakPolarHBondContact OD1-CA 3.46Å; D364-Y366 WeakPolarHBondContact OD1-CB 3.03Å; D364-Y366 PolarHBondContact OD1-N 3.44Å
367	G	88.7	Confident	91.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	78.6	16.1	-179.4	0	0	0	0	0	114.8	Q133 D364	Q133-G367 PolarHBondContact N-O 3.49Å; D364-G367 PolarHBondContact O-N 3.38Å; D364-G367 VanDerWaalsContact O-N 3.14Å; D364-G367 PolarHBondContact OD1-N 3Å
368	R	90.6	Very high	91.5	Very high	101 Å²	101	35.6 Å²	35.6	38%	0.381	18%	0.177	S	C	.	.	B	Isolated β-bridge	trans	-88	145.7	174.4	-59	178.1	-63.3	-168.8	0.3	110.6	F363 D364	F363-R368 CarbonylContact C-O 3.59Å; F363-R368 VanDerWaalsContact CA-O 3.22Å; F363-R368 WeakPolarHBondContact CA-O 3.49Å; D364-R368 PolarHBondContact N-O 3.36Å; D364-R368 PolarHBondContact OD1-N 3.24Å; D364-R368 IonicContact OD1-NE 3.54Å; D364-R368 IonicContact OD2-CZ 3.76Å; D364-R368 VanDerWaalsContact OD2-CZ 3.26Å; D364-R368 IonicContact OD2-NE 2.6Å; D364-R368 PolarHBondContact OD2-NE 3.46Å; D364-R368 IonicContact OD2-NH2 2.73Å; D364-R368 PolarHBondContact OD2-NH2 3.39Å
369	R	90.9	Very high	91.3	Very high	11 Å²	11	35.8 Å²	35.8	4%	0.042	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	132.7	178.7	-158.2	-173.3	-179.1	-175.1	-3.9	111.6	L134 T358 N360 Q362 Y372	L134-R369 WeakPolarHBondContact O-CD 3.35Å; T358-R369 PolarHBondContact O-NH2 2.98Å; T358-R369 PolarHBondContact OG1-NH1 2.99Å; T358-R369 PolarHBondContact OG1-NH2 2.89Å; N360-R369 PolarHBondContact O-NH2 3.38Å; Q362-R369 WeakPolarHBondContact O-CA 3.28Å; R369-Y372 HydrophobicContact CB-CD1 4.4Å; R369-Y372 HydrophobicContact CG-CD1 4.19Å; R369-Y372 WeakPolarHBondContact O-CE1 3.34Å
370	V	90.8	Very high	91	Very high	46 Å²	46	38.4 Å²	38.4	28%	0.279	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	163.1	176.5	-65.8	0	0	0	0	110.9	Q362 D364 Y372	Q362-V370 HydrophobicContact CB-CG2 4.2Å; Q362-V370 PolarHBondContact O-N 3.42Å; D364-V370 HydrophobicContact CB-CG1 3.88Å; V370-Y372 PolarHBondContact O-N 3.02Å
371	N	90.3	Very high	90.2	Very high	84 Å²	84	41.4 Å²	41.4	45%	0.449	21%	0.207	S	C	.	.	S	Bend	trans	55.9	42.8	177.1	-167.5	17.2	0	0	0	112.2	N360 Q362	N360-N371 PolarHBondContact ND2-ND2 3.35Å; N360-N371 PolarHBondContact ND2-O 2.8Å; Q362-N371 PolarHBondContact OE1-ND2 2.89Å; Q362-N371 VanDerWaalsContact OE1-ND2 3.1Å
372	Y	91.5	Very high	89.5	Confident	6 Å²	6	47.6 Å²	47.6	2%	0.024	25%	0.245	C	C	.	.			trans	-101.6	156	173	59.4	-92	0	0	0	109.7	P136 S137 R369 V370 M374 W390	P136-Y372 HydrophobicContact CB-CD1 3.64Å; P136-Y372 HydrophobicContact CB-CD2 3.55Å; P136-Y372 HydrophobicContact CB-CE1 3.54Å; P136-Y372 HydrophobicContact CB-CE2 3.47Å; P136-Y372 VanDerWaalsContact CB-CE2 3.47Å; P136-Y372 HydrophobicContact CB-CG 3.63Å; P136-Y372 VanDerWaalsContact CB-CZ 3.44Å; P136-Y372 HydrophobicContact CG-CD2 4.18Å; P136-Y372 HydrophobicContact CG-CE2 4.35Å; P136-Y372 HydrophobicContact CG-CG 4.41Å; S137-Y372 PolarHBondContact N-OH 3.35Å; S137-Y372 PolarHBondContact O-OH 2.81Å; R369-Y372 HydrophobicContact CB-CD1 4.4Å; R369-Y372 HydrophobicContact CG-CD1 4.19Å; R369-Y372 WeakPolarHBondContact O-CE1 3.34Å; V370-Y372 PolarHBondContact O-N 3.02Å; Y372-M374 HydrophobicContact CD2-CE 4.01Å; Y372-M374 HydrophobicContact CE2-CE 3.41Å; Y372-M374 VanDerWaalsContact CE2-CE 3.41Å; Y372-W390 HydrophobicContact CE2-CE3 4.21Å; Y372-W390 AromaticContact CE2-CZ3 3.69Å; Y372-W390 HydrophobicContact CE2-CZ3 3.69Å; Y372-W390 AromaticContact CZ-CZ3 3.96Å
373	T	91.8	Very high	89	Confident	65 Å²	65	46.4 Å²	46.4	40%	0.399	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	136.2	173.6	-53.5	0	0	0	0	107.9	Y389 W390	T373-Y389 HydrophobicContact CG2-CD2 3.82Å; T373-Y389 HydrophobicContact CG2-CG 4.12Å; T373-W390 WeakPolarHBondContact CA-O 3.42Å
374	M	92.2	Very high	88.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	135.4	173.3	49.3	172.4	67.4	0	0	109.7	P136 L138 A141 L242 F262 Y372 Y389 W390	P136-M374 HydrophobicContact CB-CE 4.5Å; P136-M374 HydrophobicContact CG-CE 4.45Å; L138-M374 HydrophobicContact CD1-CE 4.15Å; L138-M374 HydrophobicContact CD1-SD 3.95Å; A141-M374 HydrophobicContact CB-CE 4.43Å; A141-M374 HydrophobicContact CB-CG 4.48Å; A141-M374 HydrophobicContact CB-SD 3.23Å; A141-M374 WeakPolarHBondContact CB-SD 3.28Å; L242-M374 HydrophobicContact CD2-CE 3.83Å; F262-M374 HydrophobicContact CD1-SD 4.19Å; Y372-M374 HydrophobicContact CD2-CE 4.01Å; Y372-M374 HydrophobicContact CE2-CE 3.41Å; Y372-M374 VanDerWaalsContact CE2-CE 3.41Å; M374-Y389 CarbonylContact O-C 3.57Å; M374-Y389 WeakPolarHBondContact O-CA 3.45Å; M374-W390 HydrophobicContact CE-CE3 4.5Å; M374-W390 HydrophobicContact CG-CB 3.99Å; M374-W390 HydrophobicContact CG-CE3 3.89Å; M374-W390 PolarHBondContact N-O 2.92Å; M374-W390 PolarHBondContact O-N 2.85Å; M374-W390 HydrophobicContact SD-CE3 3.92Å
375	D	93.3	Very high	88.6	Confident	12 Å²	12	52 Å²	52	6%	0.064	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	138.3	-178.4	-71.4	-17.8	0	0	0	110.1	F262 Q263 F377 K386	F262-D375 CarbonylContact C-O 3.56Å; F262-D375 WeakPolarHBondContact CA-O 3.49Å; Q263-D375 HydrophobicContact CB-CB 4.41Å; Q263-D375 PolarHBondContact N-O 2.97Å; Q263-D375 PolarHBondContact O-N 3.23Å; D375-F377 HydrophobicContact CB-CD2 4.02Å; D375-F377 HydrophobicContact CB-CE2 3.6Å; D375-K386 HydrophobicContact CB-CD 4.28Å; D375-K386 HydrophobicContact CB-CG 4.41Å; D375-K386 WeakPolarHBondContact OD1-CE 3.33Å; D375-K386 IonicContact OD1-NZ 3.79Å; D375-K386 PolarHBondContact OD1-NZ 2.82Å; D375-K386 VanDerWaalsContact OD2-CE 3.28Å; D375-K386 WeakPolarHBondContact OD2-CE 3.38Å; D375-K386 IonicContact OD2-NZ 2.91Å; D375-K386 PolarHBondContact OD2-NZ 2.99Å
376	V	94.1	Very high	88.6	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	125.5	173.1	-175.1	0	0	0	0	108.2	L145 F262 V387 G388 L396	L145-V376 HydrophobicContact CD1-CG1 4.08Å; F262-V376 HydrophobicContact CD1-CG2 4.06Å; F262-V376 HydrophobicContact CE1-CG2 4.08Å; V376-V387 HydrophobicContact CB-CG2 3.95Å; V376-V387 HydrophobicContact CG1-CG2 3.65Å; V376-V387 VanDerWaalsContact O-CG2 3.28Å; V376-V387 WeakPolarHBondContact O-CG2 3.44Å; V376-V387 PolarHBondContact O-N 2.95Å; V376-G388 PolarHBondContact N-O 2.86Å; V376-G388 PolarHBondContact O-N 3.4Å; V376-L396 HydrophobicContact CB-CD1 4.5Å; V376-L396 HydrophobicContact CG2-CD1 3.62Å
377	F	92.1	Very high	88.7	Confident	12 Å²	12	45.7 Å²	45.7	5%	0.053	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	143.5	178.7	-83.1	-98.7	0	0	0	110.8	F244 T260 G261 Q263 D375 P384 R385 K386	F244-F377 HydrophobicContact CD1-CB 3.5Å; F244-F377 HydrophobicContact CD1-CG 4.21Å; F244-F377 HydrophobicContact CE1-CB 3.82Å; F244-F377 HydrophobicContact CG-CB 4.07Å; T260-F377 CarbonylContact C-O 3.5Å; T260-F377 VanDerWaalsContact CA-O 3.31Å; T260-F377 WeakPolarHBondContact CA-O 3.41Å; G261-F377 PolarHBondContact N-O 2.85Å; G261-F377 PolarHBondContact O-N 2.89Å; Q263-F377 HydrophobicContact CB-CD2 3.45Å; Q263-F377 VanDerWaalsContact CB-CD2 3.45Å; Q263-F377 HydrophobicContact CB-CE2 3.48Å; Q263-F377 VanDerWaalsContact CB-CE2 3.48Å; Q263-F377 HydrophobicContact CG-CD2 4.31Å; Q263-F377 HydrophobicContact CG-CE2 3.91Å; D375-F377 HydrophobicContact CB-CD2 4.02Å; D375-F377 HydrophobicContact CB-CE2 3.6Å; F377-P384 HydrophobicContact CD1-CB 4.11Å; F377-R385 WeakPolarHBondContact CA-O 3.44Å; F377-R385 VanDerWaalsContact CD1-C 3.45Å; F377-K386 HydrophobicContact CD1-CB 4.41Å; F377-K386 HydrophobicContact CE1-CB 3.92Å; F377-K386 HydrophobicContact CE2-CB 4.25Å; F377-K386 HydrophobicContact CE2-CG 4.44Å; F377-K386 HydrophobicContact CZ-CB 3.84Å; F377-K386 HydrophobicContact CZ-CG 4.44Å
378	E	91.2	Very high	88.8	Confident	22 Å²	22	45.7 Å²	45.7	10%	0.103	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.6	170.1	-169	-178.7	176.6	0	0	109.2	V259 T260 K380 R385 V387	V259-E378 CarbonylContact O-C 3.59Å; V259-E378 WeakPolarHBondContact O-CA 3.19Å; T260-E378 HydrophobicContact CG2-CB 4.24Å; T260-E378 HydrophobicContact CG2-CG 3.84Å; E378-K380 VanDerWaalsContact CD-CE 3.4Å; E378-K380 PolarHBondContact O-N 3.08Å; E378-K380 IonicContact OE1-NZ 2.82Å; E378-K380 PolarHBondContact OE1-NZ 2.93Å; E378-K380 WeakPolarHBondContact OE2-CE 3.48Å; E378-K380 IonicContact OE2-NZ 2.68Å; E378-K380 PolarHBondContact OE2-NZ 3.43Å; E378-R385 PolarHBondContact N-O 2.99Å; E378-R385 PolarHBondContact O-N 3.25Å; E378-V387 HydrophobicContact CB-CG1 3.63Å; E378-V387 HydrophobicContact CB-CG2 4.46Å
379	L	89.3	Confident	88.9	Confident	9 Å²	9	44.3 Å²	44.3	5%	0.047	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	118.6	174.7	-168.9	68.3	0	0	0	109.5	F244 L249 F252 I253 V259	F244-L379 HydrophobicContact CZ-CB 4.3Å; L249-L379 HydrophobicContact CB-CD1 4.16Å; L249-L379 HydrophobicContact CB-CD2 4.05Å; L249-L379 HydrophobicContact CD1-CD1 4.34Å; L249-L379 HydrophobicContact CD1-CD2 4.49Å; F252-L379 HydrophobicContact CB-CD2 3.61Å; I253-L379 HydrophobicContact CD1-CD1 4.48Å; I253-L379 HydrophobicContact CG1-CD1 3.91Å; I253-L379 HydrophobicContact CG1-CD2 4.21Å; I253-L379 HydrophobicContact CG1-CG 4.24Å; V259-L379 HydrophobicContact CB-CB 3.92Å; V259-L379 HydrophobicContact CB-CD2 4.17Å; V259-L379 HydrophobicContact CG2-CD2 4.12Å; V259-L379 PolarHBondContact O-N 3.16Å
380	K	84.5	Confident	89	Confident	77 Å²	77	44.3 Å²	44.3	34%	0.335	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	173.8	171.4	-60.4	-60.7	-174.9	-171.9	0	110	E378 T382 G383 R385	E378-K380 VanDerWaalsContact CD-CE 3.4Å; E378-K380 PolarHBondContact O-N 3.08Å; E378-K380 IonicContact OE1-NZ 2.82Å; E378-K380 PolarHBondContact OE1-NZ 2.93Å; E378-K380 WeakPolarHBondContact OE2-CE 3.48Å; E378-K380 IonicContact OE2-NZ 2.68Å; E378-K380 PolarHBondContact OE2-NZ 3.43Å; K380-T382 PolarHBondContact O-N 2.94Å; K380-G383 PolarHBondContact N-O 2.76Å; K380-G383 PolarHBondContact O-N 3.34Å; K380-R385 HydrophobicContact CG-CB 4.35Å
381	S	77.3	Confident	89	Confident	103 Å²	103	43.1 Å²	43.1	72%	0.72	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.5	177.4	51.9	0	0	0	0	113.6	I253 G383	I253-S381 WeakPolarHBondContact CG2-O 3.42Å; S381-G383 VanDerWaalsContact C-N 3.34Å
382	T	78.8	Confident	88.7	Confident	132 Å²	132	42.8 Å²	42.8	81%	0.81	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-2.9	176.1	53.5	0	0	0	0	113.5	K380	K380-T382 PolarHBondContact O-N 2.94Å
383	G	82.6	Confident	88.4	Confident	9 Å²	9	50.1 Å²	50.1	9%	0.093	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	115.3	-170.2	-176	0	0	0	0	0	113.7	K380 S381 R385	K380-G383 PolarHBondContact N-O 2.76Å; K380-G383 PolarHBondContact O-N 3.34Å; S381-G383 VanDerWaalsContact C-N 3.34Å; G383-R385 PolarHBondContact O-N 3.31Å
384	P	86.5	Confident	88	Confident	62 Å²	62	51.5 Å²	51.5	40%	0.403	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	119.1	-178.7	28.6	-34.2	0	0	0	111.1	F244 F377	F244-P384 HydrophobicContact CD1-CB 4.15Å; F244-P384 HydrophobicContact CE1-CB 3.84Å; F377-P384 HydrophobicContact CD1-CB 4.11Å
385	R	87.4	Confident	87.8	Confident	107 Å²	107	58.1 Å²	58.1	40%	0.404	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	135	179.3	-174.3	179	179.7	-172.5	-0.7	110.5	F377 E378 K380 G383 V387 D401	F377-R385 WeakPolarHBondContact CA-O 3.44Å; F377-R385 VanDerWaalsContact CD1-C 3.45Å; E378-R385 PolarHBondContact N-O 2.99Å; E378-R385 PolarHBondContact O-N 3.25Å; K380-R385 HydrophobicContact CG-CB 4.35Å; G383-R385 PolarHBondContact O-N 3.31Å; R385-V387 PolarHBondContact O-N 3Å; R385-D401 IonicContact CZ-OD2 3.82Å; R385-D401 IonicContact NH1-OD2 3.52Å; R385-D401 VanDerWaalsContact NH2-CG 3.34Å; R385-D401 IonicContact NH2-OD1 2.59Å; R385-D401 PolarHBondContact NH2-OD1 2.97Å; R385-D401 IonicContact NH2-OD2 3.32Å; R385-D401 PolarHBondContact NH2-OD2 3.38Å
386	K	89.4	Confident	87.7	Confident	72 Å²	72	59.1 Å²	59.1	31%	0.313	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	122.1	171.2	-177.8	175.8	177.8	162.8	0	109	D375 F377 I399	D375-K386 HydrophobicContact CB-CD 4.28Å; D375-K386 HydrophobicContact CB-CG 4.41Å; D375-K386 WeakPolarHBondContact OD1-CE 3.33Å; D375-K386 IonicContact OD1-NZ 3.79Å; D375-K386 PolarHBondContact OD1-NZ 2.82Å; D375-K386 VanDerWaalsContact OD2-CE 3.28Å; D375-K386 WeakPolarHBondContact OD2-CE 3.38Å; D375-K386 IonicContact OD2-NZ 2.91Å; D375-K386 PolarHBondContact OD2-NZ 2.99Å; F377-K386 HydrophobicContact CD1-CB 4.41Å; F377-K386 HydrophobicContact CE1-CB 3.92Å; F377-K386 HydrophobicContact CE2-CB 4.25Å; F377-K386 HydrophobicContact CE2-CG 4.44Å; F377-K386 HydrophobicContact CZ-CB 3.84Å; F377-K386 HydrophobicContact CZ-CG 4.44Å; K386-I399 HydrophobicContact CD-CD1 4.13Å; K386-I399 HydrophobicContact CG-CD1 4.2Å
387	V	89.2	Confident	87.5	Confident	30 Å²	30	61.3 Å²	61.3	18%	0.182	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-20.1	-179.9	-65.8	0	0	0	0	112.7	V376 E378 R385 I399	V376-V387 HydrophobicContact CB-CG2 3.95Å; V376-V387 HydrophobicContact CG1-CG2 3.65Å; V376-V387 VanDerWaalsContact O-CG2 3.28Å; V376-V387 WeakPolarHBondContact O-CG2 3.44Å; V376-V387 PolarHBondContact O-N 2.95Å; E378-V387 HydrophobicContact CB-CG1 3.63Å; E378-V387 HydrophobicContact CB-CG2 4.46Å; R385-V387 PolarHBondContact O-N 3Å; V387-I399 PolarHBondContact O-N 2.83Å
388	G	91	Very high	87.2	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.4	-173.1	-177.6	0	0	0	0	0	112.2	V376 V397	V376-G388 PolarHBondContact N-O 2.86Å; V376-G388 PolarHBondContact O-N 3.4Å; G388-V397 CarbonylContact C-O 3.57Å; G388-V397 WeakPolarHBondContact CA-O 3.11Å
389	Y	92.6	Very high	86.7	Confident	71 Å²	71	66.8 Å²	66.8	28%	0.278	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	158.4	169.2	67.5	-88.5	0	0	0	110.1	T373 M374 V397	T373-Y389 HydrophobicContact CG2-CD2 3.82Å; T373-Y389 HydrophobicContact CG2-CG 4.12Å; M374-Y389 CarbonylContact O-C 3.57Å; M374-Y389 WeakPolarHBondContact O-CA 3.45Å; Y389-V397 HydrophobicContact CD1-CB 4.39Å; Y389-V397 HydrophobicContact CE1-CB 3.87Å; Y389-V397 HydrophobicContact CE1-CG1 3.88Å; Y389-V397 HydrophobicContact CE2-CB 4.1Å; Y389-V397 HydrophobicContact CE2-CG2 4.22Å; Y389-V397 PolarHBondContact N-O 3.25Å; Y389-V397 PolarHBondContact O-N 3.43Å
390	W	93.9	Very high	84.8	Confident	11 Å²	11	74.6 Å²	74.6	4%	0.042	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136	174.5	-174.5	95.7	0	0	0	110.1	A141 S144 Y372 T373 M374 D392 K395 L396	A141-W390 HydrophobicContact CB-CB 4.3Å; A141-W390 HydrophobicContact CB-CD2 3.57Å; A141-W390 HydrophobicContact CB-CE3 3.84Å; A141-W390 HydrophobicContact CB-CG 3.77Å; A141-W390 HydrophobicContact CB-CZ3 4.42Å; S144-W390 PolarHBondContact OG-NE1 2.91Å; Y372-W390 HydrophobicContact CE2-CE3 4.21Å; Y372-W390 AromaticContact CE2-CZ3 3.69Å; Y372-W390 HydrophobicContact CE2-CZ3 3.69Å; Y372-W390 AromaticContact CZ-CZ3 3.96Å; T373-W390 WeakPolarHBondContact CA-O 3.42Å; M374-W390 HydrophobicContact CE-CE3 4.5Å; M374-W390 HydrophobicContact CG-CB 3.99Å; M374-W390 HydrophobicContact CG-CE3 3.89Å; M374-W390 PolarHBondContact N-O 2.92Å; M374-W390 PolarHBondContact O-N 2.85Å; M374-W390 HydrophobicContact SD-CE3 3.92Å; W390-D392 WeakPolarHBondContact CH2-OD1 3.47Å; W390-D392 WeakPolarHBondContact CZ3-OD1 3.46Å; W390-K395 VanDerWaalsContact CA-O 3.31Å; W390-K395 WeakPolarHBondContact CA-O 3.42Å; W390-L396 HydrophobicContact CB-CD1 4.42Å; W390-L396 VanDerWaalsContact CD1-N 3.33Å
391	N	90.2	Very high	82.8	Confident	21 Å²	21	74.8 Å²	74.8	11%	0.112	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	167.3	170.9	65.3	11.5	0	0	0	110	M393 D394 K395	N391-M393 PolarHBondContact O-N 3.48Å; N391-M393 PolarHBondContact OD1-N 3.43Å; N391-D394 PolarHBondContact ND2-OD2 3.33Å; N391-D394 VanDerWaalsContact OD1-CA 3.24Å; N391-D394 WeakPolarHBondContact OD1-CA 3.37Å; N391-D394 WeakPolarHBondContact OD1-CB 3.37Å; N391-D394 PolarHBondContact OD1-N 2.92Å; N391-K395 PolarHBondContact N-O 3.27Å; N391-K395 VanDerWaalsContact O-CA 3.25Å; N391-K395 WeakPolarHBondContact O-CA 3.5Å; N391-K395 PolarHBondContact O-N 3.01Å; N391-K395 VanDerWaalsContact O-N 3.11Å; N391-K395 PolarHBondContact OD1-N 3.36Å
392	D	84.6	Confident	80.7	Confident	77 Å²	77	75.4 Å²	75.4	41%	0.412	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.4	-177.7	-64.4	-43.4	0	0	0	113.2	W390	W390-D392 WeakPolarHBondContact CH2-OD1 3.47Å; W390-D392 WeakPolarHBondContact CZ3-OD1 3.46Å
393	M	84.3	Confident	78.6	Confident	161 Å²	161	74 Å²	74	79%	0.793	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-55.3	-172.9	-66.1	-65.7	-68.3	0	0	112.9	N391	N391-M393 PolarHBondContact O-N 3.48Å; N391-M393 PolarHBondContact OD1-N 3.43Å
394	D	83.9	Confident	76.3	Confident	94 Å²	94	78.9 Å²	78.9	50%	0.503	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-6.7	-176	-48.4	-45.5	0	0	0	112.1	N391 V397	N391-D394 PolarHBondContact ND2-OD2 3.33Å; N391-D394 VanDerWaalsContact OD1-CA 3.24Å; N391-D394 WeakPolarHBondContact OD1-CA 3.37Å; N391-D394 WeakPolarHBondContact OD1-CB 3.37Å; N391-D394 PolarHBondContact OD1-N 2.92Å; D394-V397 HydrophobicContact CB-CG2 3.65Å
395	K	88.6	Confident	73.8	Confident	138 Å²	138	84 Å²	84	60%	0.6	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	57.3	-137.9	-173.2	-56.1	-179.6	178.7	179.7	0	110	W390 N391 V397	W390-K395 VanDerWaalsContact CA-O 3.31Å; W390-K395 WeakPolarHBondContact CA-O 3.42Å; N391-K395 PolarHBondContact N-O 3.27Å; N391-K395 VanDerWaalsContact O-CA 3.25Å; N391-K395 WeakPolarHBondContact O-CA 3.5Å; N391-K395 PolarHBondContact O-N 3.01Å; N391-K395 VanDerWaalsContact O-N 3.11Å; N391-K395 PolarHBondContact OD1-N 3.36Å; K395-V397 PolarHBondContact O-N 3.2Å
396	L	90.4	Very high	71.3	Confident	34 Å²	34	81 Å²	81	18%	0.178	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	113.7	-179.7	-177.5	65.3	0	0	0	110.2	L145 H148 V376 W390 L398	L145-L396 HydrophobicContact CD1-CD2 4.17Å; H148-L396 HydrophobicContact CB-CD2 3.67Å; V376-L396 HydrophobicContact CB-CD1 4.5Å; V376-L396 HydrophobicContact CG2-CD1 3.62Å; W390-L396 HydrophobicContact CB-CD1 4.42Å; W390-L396 VanDerWaalsContact CD1-N 3.33Å; L396-L398 HydrophobicContact CD2-CD2 4.48Å; L396-L398 HydrophobicContact CG-CD2 4.44Å
397	V	89.8	Confident	68.8	Low	46 Å²	46	83.6 Å²	83.6	28%	0.279	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	114.3	172.2	-177.6	0	0	0	0	108.5	G388 Y389 D394 K395	G388-V397 CarbonylContact C-O 3.57Å; G388-V397 WeakPolarHBondContact CA-O 3.11Å; Y389-V397 HydrophobicContact CD1-CB 4.39Å; Y389-V397 HydrophobicContact CE1-CB 3.87Å; Y389-V397 HydrophobicContact CE1-CG1 3.88Å; Y389-V397 HydrophobicContact CE2-CB 4.1Å; Y389-V397 HydrophobicContact CE2-CG2 4.22Å; Y389-V397 PolarHBondContact N-O 3.25Å; Y389-V397 PolarHBondContact O-N 3.43Å; D394-V397 HydrophobicContact CB-CG2 3.65Å; K395-V397 PolarHBondContact O-N 3.2Å
398	L	85.3	Confident	66.4	Low	67 Å²	67	86.5 Å²	86.5	35%	0.351	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	135.5	172	-62.1	175.1	0	0	0	109	H148 L396 Q400	H148-L398 WeakPolarHBondContact CE1-CD1 3.42Å; L396-L398 HydrophobicContact CD2-CD2 4.48Å; L396-L398 HydrophobicContact CG-CD2 4.44Å; L398-Q400 PolarHBondContact O-N 2.82Å
399	I	80.6	Confident	64.1	Low	82 Å²	82	90.4 Å²	90.4	42%	0.421	49%	0.489	S	S	.	.			trans	-72.3	94.7	166.6	-64.8	164.9	0	0	0	104.2	K386 V387 D401	K386-I399 HydrophobicContact CD-CD1 4.13Å; K386-I399 HydrophobicContact CG-CD1 4.2Å; V387-I399 PolarHBondContact O-N 2.83Å; I399-D401 PolarHBondContact O-N 2.9Å
400	Q	49.9	Very low	61.5	Low	173 Å²	173	88.7 Å²	88.7	81%	0.808	49%	0.489	S	S	*	.			trans	-58	110.5	160.9	-78.4	-179.6	-13	0	0	104.9	L398 V402	L398-Q400 PolarHBondContact O-N 2.82Å; Q400-V402 VanDerWaalsContact C-N 3.3Å; Q400-V402 PolarHBondContact O-N 3.39Å
401	D	42.3	Very low	59.2	Low	80 Å²	80	90.9 Å²	90.9	43%	0.428	51%	0.51	S	S	.	.			trans	-51.4	113.7	150.2	-71.6	-38.8	0	0	0	104.3	R385 I399 P403	R385-D401 IonicContact CZ-OD2 3.82Å; R385-D401 IonicContact NH1-OD2 3.52Å; R385-D401 VanDerWaalsContact NH2-CG 3.34Å; R385-D401 IonicContact NH2-OD1 2.59Å; R385-D401 PolarHBondContact NH2-OD1 2.97Å; R385-D401 IonicContact NH2-OD2 3.32Å; R385-D401 PolarHBondContact NH2-OD2 3.38Å; I399-D401 PolarHBondContact O-N 2.9Å; D401-P403 WeakPolarHBondContact O-CD 3.47Å
402	V	32.9	Very low	57.1	Low	117 Å²	117	95.8 Å²	95.8	71%	0.709	54%	0.535	S	S	*	.			trans	-44.4	121.7	151.1	176	0	0	0	0	103.1	Q400 T404	Q400-V402 VanDerWaalsContact C-N 3.3Å; Q400-V402 PolarHBondContact O-N 3.39Å; V402-T404 PolarHBondContact O-N 2.99Å
403	P	35.8	Very low	55.4	Low	102 Å²	102	97.7 Å²	97.7	66%	0.662	54%	0.541	S	S	*	.			trans	-62.2	93.9	175.3	24.3	-30	0	0	0	105.1	D401 L405	D401-P403 WeakPolarHBondContact O-CD 3.47Å; P403-L405 PolarHBondContact O-N 2.62Å
404	T	32.7	Very low	54	Low	111 Å²	111	95 Å²	95	68%	0.681	53%	0.53	S	S	*	.			trans	-56.8	102.1	152.3	36.6	0	0	0	0	102.7	V402 G406	V402-T404 PolarHBondContact O-N 2.99Å; T404-G406 PolarHBondContact O-N 3.01Å
405	L	35.9	Very low	53.3	Low	169 Å²	169	96.6 Å²	96.6	89%	0.885	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	48.8	-172.9	-166.9	79.7	0	0	0	112	P403	P403-L405 PolarHBondContact O-N 2.62Å
406	G	35.1	Very low	53.1	Low	44 Å²	44	93.4 Å²	93.4	45%	0.454	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.1	-30.4	-169.5	0	0	0	0	0	116	T404	T404-G406 PolarHBondContact O-N 3.01Å
407	N	35.8	Very low	53	Low	127 Å²	127	92.1 Å²	92.1	68%	0.679	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.6	-27.2	-170	-86.4	2.4	0	0	0	117.2
408	D	39.3	Very low	53.2	Low	92 Å²	92	91.8 Å²	91.8	49%	0.492	51%	0.513	S	S	.	.	S	Bend	trans	-91.9	-19.3	179.4	-77.8	-21.4	0	0	0	114	A410 A411 I412	D408-A410 PolarHBondContact O-N 2.98Å; D408-A411 PolarHBondContact O-N 3.31Å; D408-I412 PolarHBondContact O-N 2.79Å
409	T	41.4	Very low	53.7	Low	81 Å²	81	88.9 Å²	88.9	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-61.5	-34.5	164.1	41.2	0	0	0	0	110.7	A411 I412 E413	T409-A411 VanDerWaalsContact C-N 3.31Å; T409-A411 PolarHBondContact O-N 2.75Å; T409-I412 PolarHBondContact O-N 2.56Å; T409-E413 WeakPolarHBondContact O-CB 3.46Å; T409-E413 VanDerWaalsContact O-CG 3.27Å; T409-E413 WeakPolarHBondContact O-CG 3.5Å; T409-E413 PolarHBondContact O-N 2.94Å
410	A	39.9	Very low	54.4	Low	35 Å²	35	85 Å²	85	29%	0.289	48%	0.478	S	S	.	.	H	α-helix	trans	-67.4	-26.8	175.5	0	0	0	0	0	113.5	D408 N414	D408-A410 PolarHBondContact O-N 2.98Å; A410-N414 WeakPolarHBondContact O-CB 3.41Å; A410-N414 PolarHBondContact O-N 3.43Å
411	A	44.1	Very low	56.6	Low	58 Å²	58	76.9 Å²	76.9	48%	0.479	44%	0.44	S	S	.	.	H	α-helix	trans	-76.7	-30.9	177	0	0	0	0	0	112.6	D408 T409 R415	D408-A411 PolarHBondContact O-N 3.31Å; T409-A411 VanDerWaalsContact C-N 3.31Å; T409-A411 PolarHBondContact O-N 2.75Å; A411-R415 WeakPolarHBondContact O-CB 3.03Å; A411-R415 PolarHBondContact O-N 2.76Å
412	I	46.4	Very low	59	Low	124 Å²	124	73.7 Å²	73.7	64%	0.636	42%	0.423	S	S	*	.	H	α-helix	trans	-77.9	-37.8	170.8	-64.2	175.2	0	0	0	110.5	D408 T409 N414	D408-I412 PolarHBondContact O-N 2.79Å; T409-I412 PolarHBondContact O-N 2.56Å; I412-N414 PolarHBondContact O-N 2.87Å
413	E	49.5	Very low	61.8	Low	117 Å²	117	71.3 Å²	71.3	55%	0.547	41%	0.405	S	S	.	.	H	α-helix	trans	-69.8	-26.6	178	-75.1	174.7	177	0	0	113.7	T409	T409-E413 WeakPolarHBondContact O-CB 3.46Å; T409-E413 VanDerWaalsContact O-CG 3.27Å; T409-E413 WeakPolarHBondContact O-CG 3.5Å; T409-E413 PolarHBondContact O-N 2.94Å
414	N	55.5	Low	64.4	Low	103 Å²	103	67.6 Å²	67.6	55%	0.551	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	-3.5	177.6	-81.1	-41.1	0	0	0	115.5	A410 I412 T416 K461	A410-N414 WeakPolarHBondContact O-CB 3.41Å; A410-N414 PolarHBondContact O-N 3.43Å; I412-N414 PolarHBondContact O-N 2.87Å; N414-T416 PolarHBondContact O-N 2.95Å; N414-K461 PolarHBondContact OD1-NZ 3.25Å
415	R	68.9	Low	67.2	Low	129 Å²	129	64.8 Å²	64.8	49%	0.487	36%	0.364	S	S	.	.			trans	-80.8	119.5	177.1	-178.9	174	169	160.8	-3.3	110.5	A411 V417 E495	A411-R415 WeakPolarHBondContact O-CB 3.03Å; A411-R415 PolarHBondContact O-N 2.76Å; R415-V417 PolarHBondContact O-N 3.23Å; R415-E495 IonicContact CZ-OE1 2.64Å; R415-E495 IonicContact CZ-OE2 2.71Å; R415-E495 IonicContact NE-OE1 2.72Å; R415-E495 PolarHBondContact NE-OE1 2.95Å; R415-E495 IonicContact NE-OE2 2.74Å; R415-E495 IonicContact NH2-OE1 2.74Å; R415-E495 PolarHBondContact NH2-OE1 3.47Å; R415-E495 IonicContact NH2-OE2 2.83Å
416	T	83.3	Confident	70	Confident	71 Å²	71	56.8 Å²	56.8	44%	0.436	32%	0.322	S	S	.	.			trans	-74.9	114	174.3	-50.4	0	0	0	0	110.5	N414 K461 K463	N414-T416 PolarHBondContact O-N 2.95Å; T416-K461 WeakPolarHBondContact CA-O 3.35Å; T416-K463 HydrophobicContact CG2-CB 3.77Å
417	V	89.8	Confident	72.8	Confident	6 Å²	6	54.7 Å²	54.7	4%	0.036	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	130.6	177	179.9	0	0	0	0	109.9	R415 V419 I460 K461 Y462 K463 E495 I496 L764	R415-V417 PolarHBondContact O-N 3.23Å; V417-V419 PolarHBondContact O-N 2.99Å; V417-I460 HydrophobicContact CB-CD1 4.33Å; V417-I460 HydrophobicContact CG2-CB 4.37Å; V417-I460 HydrophobicContact CG2-CD1 3.95Å; V417-K461 PolarHBondContact N-O 2.91Å; V417-Y462 CarbonylContact O-C 3.56Å; V417-Y462 VanDerWaalsContact O-CA 3.24Å; V417-Y462 WeakPolarHBondContact O-CA 3.3Å; V417-K463 PolarHBondContact O-N 2.68Å; V417-E495 HydrophobicContact CG1-CB 3.85Å; V417-I496 HydrophobicContact CG1-CG2 3.78Å; V417-L764 HydrophobicContact CG1-CD1 4.09Å
418	V	92.1	Very high	75.7	Confident	39 Å²	39	48.8 Å²	48.8	24%	0.236	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	112.1	176.1	-177.8	0	0	0	0	109.1	A465 A494 E495 I496	V418-A465 HydrophobicContact CG1-CB 3.86Å; V418-A494 HydrophobicContact CG1-CB 4.36Å; V418-E495 PolarHBondContact O-N 3.32Å; V418-E495 VanDerWaalsContact O-N 3.08Å; V418-I496 PolarHBondContact O-N 3.45Å
419	V	95.9	Very high	78.3	Confident	6 Å²	6	45.9 Å²	45.9	4%	0.036	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	108.8	177.6	-178.6	0	0	0	0	108.1	V417 Y462 K463 A465 I496 I498	V417-V419 PolarHBondContact O-N 2.99Å; V419-Y462 HydrophobicContact CG2-CD2 3.94Å; V419-Y462 HydrophobicContact CG2-CG 4.21Å; V419-K463 PolarHBondContact N-O 2.9Å; V419-A465 PolarHBondContact O-N 3.27Å; V419-I496 CarbonylContact C-O 3.45Å; V419-I496 WeakPolarHBondContact CA-O 3.37Å; V419-I496 HydrophobicContact CB-CG2 4.03Å; V419-I496 HydrophobicContact CG1-CG2 4.19Å; V419-I496 HydrophobicContact CG2-CG2 3.53Å; V419-I498 HydrophobicContact CG1-CB 3.9Å; V419-I498 HydrophobicContact CG1-CD1 4.03Å; V419-I498 HydrophobicContact CG1-CG1 3.95Å
420	T	96.3	Very high	80.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	140.2	173.1	-172.6	0	0	0	0	111.1	A465 M485 E488 L489 A494 I496 A497 I498	T420-A465 CarbonylContact C-O 3.57Å; T420-A465 WeakPolarHBondContact CA-O 3.44Å; T420-M485 HydrophobicContact CG2-CB 4.14Å; T420-M485 HydrophobicContact CG2-CG 4.39Å; T420-E488 WeakPolarHBondContact CB-OE2 3.38Å; T420-E488 PolarHBondContact OG1-OE2 2.93Å; T420-L489 HydrophobicContact CG2-CD2 4.3Å; T420-A494 HydrophobicContact CG2-CB 3.62Å; T420-I496 PolarHBondContact N-O 3.09Å; T420-A497 HydrophobicContact CG2-CB 3.54Å; T420-A497 WeakPolarHBondContact O-CA 3.49Å; T420-I498 PolarHBondContact O-N 3.07Å
421	T	95.8	Very high	83.2	Confident	4 Å²	4	48.3 Å²	48.3	3%	0.025	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	174.5	177.5	-159.3	0	0	0	0	111.8	V428 I464 A465 I466 V467 I498	T421-V428 HydrophobicContact CG2-CG1 4.22Å; T421-V428 HydrophobicContact CG2-CG2 3.95Å; T421-V428 WeakPolarHBondContact OG1-CG2 3.38Å; T421-I464 HydrophobicContact CG2-CG2 3.65Å; T421-A465 PolarHBondContact N-O 3.28Å; T421-I466 HydrophobicContact CG2-CD1 3.69Å; T421-I466 WeakPolarHBondContact O-CA 3.47Å; T421-V467 PolarHBondContact O-N 3.09Å; T421-I498 WeakPolarHBondContact CB-O 3.38Å; T421-I498 PolarHBondContact OG1-O 3.02Å
422	I	93.1	Very high	85.3	Confident	13 Å²	13	55 Å²	55	7%	0.067	27%	0.265	C	S	.	.			trans	-123.5	144.7	-178.7	-170.1	170.1	0	0	0	110.6	E424 V467 G470 Y472 M485 A499 P500	I422-E424 PolarHBondContact O-N 3.41Å; I422-V467 HydrophobicContact CB-CG1 4.1Å; I422-V467 HydrophobicContact CD1-CG1 4.48Å; I422-V467 HydrophobicContact CG1-CG1 4.12Å; I422-G470 WeakPolarHBondContact CD1-O 3.48Å; I422-Y472 HydrophobicContact CD1-CE1 4.43Å; I422-Y472 HydrophobicContact CD1-CE2 4.38Å; I422-Y472 HydrophobicContact CG2-CD1 4.43Å; I422-Y472 HydrophobicContact CG2-CE1 3.98Å; I422-M485 HydrophobicContact CB-CE 4.11Å; I422-M485 HydrophobicContact CB-SD 4.09Å; I422-M485 HydrophobicContact CG2-CE 3.85Å; I422-M485 HydrophobicContact CG2-SD 4.24Å; I422-A499 HydrophobicContact CG2-CB 4.48Å; I422-P500 HydrophobicContact CG2-CG 4.41Å
423	M	91.7	Very high	87.4	Confident	66 Å²	66	53.8 Å²	53.8	33%	0.325	26%	0.26	S	S	.	.			trans	-74.9	103.2	177.3	-66	-61.4	-59.2	0	0	110.6	V428 Y430 Y443 I466	M423-V428 HydrophobicContact SD-CG1 3.95Å; M423-Y430 HydrophobicContact CE-CD1 4.36Å; M423-Y430 HydrophobicContact CE-CD2 3.37Å; M423-Y430 HydrophobicContact CE-CE1 4.36Å; M423-Y430 HydrophobicContact CE-CE2 3.37Å; M423-Y430 HydrophobicContact CE-CG 3.89Å; M423-Y430 HydrophobicContact SD-CE2 4.19Å; M423-Y443 HydrophobicContact SD-CD1 4.22Å; M423-Y443 HydrophobicContact SD-CE1 4.11Å; M423-I466 HydrophobicContact CG-CD1 4.16Å; M423-I466 HydrophobicContact CG-CG1 4.39Å; M423-I466 HydrophobicContact CG-CG2 3.91Å; M423-I466 HydrophobicContact SD-CD1 3.62Å; M423-I466 HydrophobicContact SD-CG1 4.14Å
424	E	90.6	Very high	89.2	Confident	25 Å²	25	51.3 Å²	51.3	12%	0.117	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-151.5	127.4	178.7	-171.5	168	-146.7	0	0	111.5	I422 Y427 V428 Y472 P500	I422-E424 PolarHBondContact O-N 3.41Å; E424-Y427 HydrophobicContact CB-CD2 4.39Å; E424-Y427 HydrophobicContact CG-CD2 4.15Å; E424-Y427 CarbonylContact O-C 3.59Å; E424-Y427 WeakPolarHBondContact O-CA 3.42Å; E424-Y427 WeakPolarHBondContact O-CB 3.48Å; E424-Y427 PolarHBondContact O-N 2.82Å; E424-V428 CarbonylContact C-O 3.51Å; E424-V428 PolarHBondContact N-O 2.91Å; E424-V428 PolarHBondContact O-N 3.34Å; E424-Y472 PolarHBondContact OE1-OH 3.26Å; E424-Y472 VanDerWaalsContact OE1-OH 3.14Å; E424-Y472 PolarHBondContact OE2-OH 3.48Å; E424-P500 WeakPolarHBondContact OE2-CG 3.4Å
425	S	91.6	Very high	90.7	Very high	52 Å²	52	54.6 Å²	54.6	36%	0.364	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	135.9	179	-56.2	0	0	0	0	111.9	M429	S425-M429 VanDerWaalsContact CB-SD 3.55Å; S425-M429 WeakPolarHBondContact OG-CG 3.01Å; S425-M429 PolarHBondContact OG-SD 3.08Å; S425-M429 VanDerWaalsContact OG-SD 3.34Å
426	P	94.3	Very high	91.6	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	cis	-96	18.2	-0.2	38.1	-33.9	0	0	0	114.1	M429 G445 Y446 Y733 W788 W789	P426-M429 HydrophobicContact CB-CE 4.3Å; P426-G445 CarbonylContact O-C 3.57Å; P426-G445 VanDerWaalsContact O-CA 3.27Å; P426-G445 WeakPolarHBondContact O-CA 3.5Å; P426-Y446 PolarHBondContact O-N 3.13Å; P426-Y733 HydrophobicContact CB-CD2 3.99Å; P426-Y733 HydrophobicContact CB-CE2 3.4Å; P426-Y733 HydrophobicContact CG-CD2 3.48Å; P426-Y733 VanDerWaalsContact CG-CD2 3.48Å; P426-Y733 HydrophobicContact CG-CE2 3.46Å; P426-Y733 VanDerWaalsContact CG-CE2 3.46Å; P426-Y733 HydrophobicContact CG-CG 4.02Å; P426-W788 HydrophobicContact CB-CB 4.31Å; P426-W788 HydrophobicContact CB-CE3 4.5Å; P426-W789 HydrophobicContact CG-CD2 4.09Å; P426-W789 HydrophobicContact CG-CE3 4Å; P426-W789 HydrophobicContact CG-CH2 3.57Å; P426-W789 HydrophobicContact CG-CZ2 3.65Å; P426-W789 HydrophobicContact CG-CZ3 3.77Å
427	Y	94.8	Very high	91.7	Very high	1 Å²	1	56.6 Å²	56.6	0%	0.004	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-54.1	-176.7	-59.2	-79.2	0	0	0	112.3	E424 G445 Y446 C447 P500 T729 Y754 W789	E424-Y427 HydrophobicContact CB-CD2 4.39Å; E424-Y427 HydrophobicContact CG-CD2 4.15Å; E424-Y427 CarbonylContact O-C 3.59Å; E424-Y427 WeakPolarHBondContact O-CA 3.42Å; E424-Y427 WeakPolarHBondContact O-CB 3.48Å; E424-Y427 PolarHBondContact O-N 2.82Å; Y427-G445 CarbonylContact O-C 3.56Å; Y427-G445 VanDerWaalsContact O-CA 3.27Å; Y427-G445 WeakPolarHBondContact O-CA 3.42Å; Y427-Y446 HydrophobicContact CD1-CD1 4.33Å; Y427-Y446 PolarHBondContact O-N 3.32Å; Y427-C447 PolarHBondContact O-N 3.29Å; Y427-P500 HydrophobicContact CD1-CB 3.98Å; Y427-P500 HydrophobicContact CD1-CG 4.14Å; Y427-P500 HydrophobicContact CD2-CB 4.03Å; Y427-P500 HydrophobicContact CD2-CG 3.71Å; Y427-P500 HydrophobicContact CE1-CB 3.93Å; Y427-P500 HydrophobicContact CE2-CB 3.98Å; Y427-P500 HydrophobicContact CE2-CG 4.13Å; Y427-P500 HydrophobicContact CG-CB 4.03Å; Y427-P500 HydrophobicContact CG-CG 3.72Å; Y427-T729 WeakPolarHBondContact OH-CB 3.27Å; Y427-T729 PolarHBondContact OH-OG1 3.43Å; Y427-Y754 HydrophobicContact CE1-CD2 4.4Å; Y427-Y754 AromaticContact CE1-CE2 3.99Å; Y427-Y754 HydrophobicContact CE1-CE2 3.99Å; Y427-Y754 AromaticContact CZ-CE2 3.85Å; Y427-Y754 WeakPolarHBondContact OH-CE2 3.42Å; Y427-W789 HydrophobicContact CD1-CH2 4.11Å; Y427-W789 AromaticContact CE1-CH2 3.57Å; Y427-W789 HydrophobicContact CE1-CH2 3.57Å; Y427-W789 HydrophobicContact CE1-CZ2 4.01Å; Y427-W789 HydrophobicContact CE2-CZ2 4.42Å; Y427-W789 AromaticContact CZ-CH2 3.81Å; Y427-W789 AromaticContact CZ-CZ2 3.76Å
428	V	95.8	Very high	91.6	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.012	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-142.5	121.9	176.3	-174.8	0	0	0	0	108.8	T421 M423 E424 Y443 C447 V448	T421-V428 HydrophobicContact CG2-CG1 4.22Å; T421-V428 HydrophobicContact CG2-CG2 3.95Å; T421-V428 WeakPolarHBondContact OG1-CG2 3.38Å; M423-V428 HydrophobicContact SD-CG1 3.95Å; E424-V428 CarbonylContact C-O 3.51Å; E424-V428 PolarHBondContact N-O 2.91Å; E424-V428 PolarHBondContact O-N 3.34Å; V428-Y443 HydrophobicContact CG1-CD1 4.14Å; V428-Y443 HydrophobicContact CG1-CG 4.43Å; V428-C447 HydrophobicContact CG2-CB 3.8Å; V428-V448 HydrophobicContact CG1-CG2 4.2Å; V428-V448 HydrophobicContact CG2-CG2 4.29Å
429	M	93.9	Very high	91.4	Very high	31 Å²	31	64.9 Å²	64.9	15%	0.153	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	156	-178.5	-59	-179	-67.6	0	0	109.3	S425 P426 Y443 E444 W788	S425-M429 VanDerWaalsContact CB-SD 3.55Å; S425-M429 WeakPolarHBondContact OG-CG 3.01Å; S425-M429 PolarHBondContact OG-SD 3.08Å; S425-M429 VanDerWaalsContact OG-SD 3.34Å; P426-M429 HydrophobicContact CB-CE 4.3Å; M429-Y443 CarbonylContact O-C 3.56Å; M429-Y443 WeakPolarHBondContact O-CA 3.27Å; M429-E444 WeakPolarHBondContact CA-O 3.43Å; M429-E444 HydrophobicContact CB-CG 4.39Å; M429-E444 PolarHBondContact N-O 3.16Å; M429-E444 PolarHBondContact O-N 3.35Å; M429-W788 HydrophobicContact CE-CE3 4.02Å; M429-W788 HydrophobicContact CE-CZ3 3.62Å
430	Y	92.6	Very high	91.2	Very high	113 Å²	113	66.3 Å²	66.3	44%	0.443	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	137.4	165.8	-71.7	-65.2	0	0	0	109.5	M423 H434 Y443	M423-Y430 HydrophobicContact CE-CD1 4.36Å; M423-Y430 HydrophobicContact CE-CD2 3.37Å; M423-Y430 HydrophobicContact CE-CE1 4.36Å; M423-Y430 HydrophobicContact CE-CE2 3.37Å; M423-Y430 HydrophobicContact CE-CG 3.89Å; M423-Y430 HydrophobicContact SD-CE2 4.19Å; Y430-H434 HydrophobicContact CD1-CB 4.11Å; Y430-Y443 HydrophobicContact CD1-CD1 4.11Å; Y430-Y443 HydrophobicContact CD1-CE1 4.02Å; Y430-Y443 AromaticContact CE1-CD1 4Å; Y430-Y443 HydrophobicContact CE1-CD1 4Å; Y430-Y443 AromaticContact CE1-CE1 3.44Å; Y430-Y443 HydrophobicContact CE1-CE1 3.44Å; Y430-Y443 VanDerWaalsContact CE1-CE1 3.44Å
431	K	92.3	Very high	90.9	Very high	54 Å²	54	71.1 Å²	71.1	24%	0.235	35%	0.353	C	S	.	.			trans	-60.7	150.5	164.4	-70.5	-173.9	-172.6	161.2	0	109.3	N433 H434 F437 D441 K442 Y443 E444	K431-N433 PolarHBondContact O-N 3.05Å; K431-H434 WeakPolarHBondContact O-CB 3.5Å; K431-H434 PolarHBondContact O-CD2 3.32Å; K431-H434 PolarHBondContact O-N 3.39Å; K431-H434 VanDerWaalsContact O-N 3.09Å; K431-F437 HydrophobicContact CD-CD2 4.47Å; K431-F437 HydrophobicContact CD-CE2 4.44Å; K431-D441 WeakPolarHBondContact CD-O 3.16Å; K431-D441 WeakPolarHBondContact CE-O 3.39Å; K431-D441 PolarHBondContact NZ-O 3.04Å; K431-K442 PolarHBondContact N-O 3.4Å; K431-Y443 WeakPolarHBondContact CE-O 3.37Å; K431-E444 HydrophobicContact CG-CB 3.74Å; K431-E444 HydrophobicContact CG-CG 3.77Å
432	K	87.7	Confident	90.7	Very high	199 Å²	199	74.4 Å²	74.4	87%	0.865	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-31.9	176.8	-67.9	-174.5	178.2	-179.1	0	113.4
433	N	90.4	Very high	90.8	Very high	98 Å²	98	75.3 Å²	75.3	52%	0.524	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	36	-177.7	-50.7	10.5	0	0	0	111.2	K431 E435 M436 F437	K431-N433 PolarHBondContact O-N 3.05Å; N433-E435 PolarHBondContact O-N 2.91Å; N433-E435 VanDerWaalsContact O-N 3.11Å; N433-M436 HydrophobicContact CB-SD 4.42Å; N433-M436 PolarHBondContact O-N 2.78Å; N433-F437 HydrophobicContact CB-CE2 4.2Å; N433-F437 VanDerWaalsContact O-CD2 3.27Å; N433-F437 WeakPolarHBondContact O-CD2 3.36Å
434	H	86.2	Confident	91	Very high	65 Å²	65	74.8 Å²	74.8	30%	0.301	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-58.7	-25.6	-171.4	66.7	80.3	0	0	0	114.4	Y430 K431 M436 F437	Y430-H434 HydrophobicContact CD1-CB 4.11Å; K431-H434 WeakPolarHBondContact O-CB 3.5Å; K431-H434 PolarHBondContact O-CD2 3.32Å; K431-H434 PolarHBondContact O-N 3.39Å; K431-H434 VanDerWaalsContact O-N 3.09Å; H434-M436 PolarHBondContact O-N 3.46Å; H434-F437 PolarHBondContact O-N 3.09Å
435	E	87.9	Confident	91.2	Very high	172 Å²	172	73.6 Å²	73.6	80%	0.804	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-67.9	-24.4	178.6	-59.9	-173.8	162.5	0	0	112.6	N433	N433-E435 PolarHBondContact O-N 2.91Å; N433-E435 VanDerWaalsContact O-N 3.11Å
436	M	86.9	Confident	91.4	Very high	159 Å²	159	71.1 Å²	71.1	78%	0.783	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-86.4	-10.6	-179.7	-54.3	-171.8	93.2	0	0	113.5	N433 H434	N433-M436 HydrophobicContact CB-SD 4.42Å; N433-M436 PolarHBondContact O-N 2.78Å; H434-M436 PolarHBondContact O-N 3.46Å
437	F	87.2	Confident	91.6	Very high	84 Å²	84	71.2 Å²	71.2	37%	0.368	34%	0.344	S	S	.	.			trans	-107.8	149.8	-178	-65.5	-74.3	0	0	0	110.6	K431 N433 H434 D441 K442	K431-F437 HydrophobicContact CD-CD2 4.47Å; K431-F437 HydrophobicContact CD-CE2 4.44Å; N433-F437 HydrophobicContact CB-CE2 4.2Å; N433-F437 VanDerWaalsContact O-CD2 3.27Å; N433-F437 WeakPolarHBondContact O-CD2 3.36Å; H434-F437 PolarHBondContact O-N 3.09Å; F437-D441 HydrophobicContact CB-CB 4.1Å; F437-D441 HydrophobicContact CD1-CB 4.19Å; F437-D441 HydrophobicContact CG-CB 4.36Å; F437-K442 HydrophobicContact CB-CG 4.24Å; F437-K442 WeakPolarHBondContact O-CE 3.26Å; F437-K442 VanDerWaalsContact O-CG 3.28Å; F437-K442 WeakPolarHBondContact O-CG 3.42Å
438	E	86	Confident	91.6	Very high	170 Å²	170	72 Å²	72	79%	0.794	35%	0.349	S	S	*	.			trans	-113.8	155.3	173.6	-69.3	-163.6	165.3	0	0	111.8
439	G	88.6	Confident	91.7	Very high	48 Å²	48	73.6 Å²	73.6	50%	0.495	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	66.2	-135.9	178.1	0	0	0	0	0	114.7	D441	G439-D441 VanDerWaalsContact C-N 3.3Å; G439-D441 PolarHBondContact O-N 3.39Å
440	N	91.3	Very high	91.8	Very high	37 Å²	37	72.1 Å²	72.1	20%	0.198	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-71.7	-24.2	-174.3	-64.1	-16.7	0	0	0	112.8	K442 Y443 Y462 K463 I464	N440-K442 PolarHBondContact O-N 3.29Å; N440-K442 VanDerWaalsContact O-N 3.12Å; N440-Y443 PolarHBondContact O-N 3.35Å; N440-Y443 VanDerWaalsContact O-N 3.14Å; N440-Y462 PolarHBondContact ND2-O 2.94Å; N440-K463 WeakPolarHBondContact OD1-CA 3.42Å; N440-I464 HydrophobicContact CB-CD1 4.35Å; N440-I464 PolarHBondContact OD1-N 3.32Å
441	D	90.3	Very high	91.9	Very high	100 Å²	100	67 Å²	67	54%	0.535	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-69.6	-9.8	-175.8	-72.4	-38.6	0	0	0	113.7	K431 F437 G439 Y443	K431-D441 WeakPolarHBondContact CD-O 3.16Å; K431-D441 WeakPolarHBondContact CE-O 3.39Å; K431-D441 PolarHBondContact NZ-O 3.04Å; F437-D441 HydrophobicContact CB-CB 4.1Å; F437-D441 HydrophobicContact CD1-CB 4.19Å; F437-D441 HydrophobicContact CG-CB 4.36Å; G439-D441 VanDerWaalsContact C-N 3.3Å; G439-D441 PolarHBondContact O-N 3.39Å; D441-Y443 PolarHBondContact O-N 3.18Å
442	K	92.6	Very high	92	Very high	73 Å²	73	67 Å²	67	32%	0.317	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-64.3	-28.4	171.5	-65.4	-176.9	173.7	-179.3	0	112.8	K431 F437 N440	K431-K442 PolarHBondContact N-O 3.4Å; F437-K442 HydrophobicContact CB-CG 4.24Å; F437-K442 WeakPolarHBondContact O-CE 3.26Å; F437-K442 VanDerWaalsContact O-CG 3.28Å; F437-K442 WeakPolarHBondContact O-CG 3.42Å; N440-K442 PolarHBondContact O-N 3.29Å; N440-K442 VanDerWaalsContact O-N 3.12Å
443	Y	94.9	Very high	92.4	Very high	32 Å²	32	60.2 Å²	60.2	13%	0.125	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	149.7	-172.6	-51.9	-72.3	0	0	0	111.2	M423 V428 M429 Y430 K431 N440 D441 I464 I466	M423-Y443 HydrophobicContact SD-CD1 4.22Å; M423-Y443 HydrophobicContact SD-CE1 4.11Å; V428-Y443 HydrophobicContact CG1-CD1 4.14Å; V428-Y443 HydrophobicContact CG1-CG 4.43Å; M429-Y443 CarbonylContact O-C 3.56Å; M429-Y443 WeakPolarHBondContact O-CA 3.27Å; Y430-Y443 HydrophobicContact CD1-CD1 4.11Å; Y430-Y443 HydrophobicContact CD1-CE1 4.02Å; Y430-Y443 AromaticContact CE1-CD1 4Å; Y430-Y443 HydrophobicContact CE1-CD1 4Å; Y430-Y443 AromaticContact CE1-CE1 3.44Å; Y430-Y443 HydrophobicContact CE1-CE1 3.44Å; Y430-Y443 VanDerWaalsContact CE1-CE1 3.44Å; K431-Y443 WeakPolarHBondContact CE-O 3.37Å; N440-Y443 PolarHBondContact O-N 3.35Å; N440-Y443 VanDerWaalsContact O-N 3.14Å; D441-Y443 PolarHBondContact O-N 3.18Å; Y443-I464 HydrophobicContact CD2-CB 4.06Å; Y443-I464 HydrophobicContact CD2-CD1 4.15Å; Y443-I464 HydrophobicContact CD2-CG2 3.91Å; Y443-I464 HydrophobicContact CE2-CB 4.13Å; Y443-I464 HydrophobicContact CE2-CG2 3.95Å; Y443-I466 HydrophobicContact CD1-CD1 4.44Å; Y443-I466 HydrophobicContact CE1-CD1 3.84Å; Y443-I466 HydrophobicContact CE1-CG1 3.95Å
444	E	95	Very high	92.5	Very high	55 Å²	55	55.7 Å²	55.7	26%	0.257	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	149.8	169.8	68.5	173.5	164.3	0	0	110.4	M429 K431 W788	M429-E444 WeakPolarHBondContact CA-O 3.43Å; M429-E444 HydrophobicContact CB-CG 4.39Å; M429-E444 PolarHBondContact N-O 3.16Å; M429-E444 PolarHBondContact O-N 3.35Å; K431-E444 HydrophobicContact CG-CB 3.74Å; K431-E444 HydrophobicContact CG-CG 3.77Å; E444-W788 HydrophobicContact CB-CH2 3.98Å; E444-W788 HydrophobicContact CG-CH2 4.23Å
445	G	95.4	Very high	92.8	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	150.6	178.3	177.2	0	0	0	0	0	112.9	P426 Y427 C447 V448 D449 W788	P426-G445 CarbonylContact O-C 3.57Å; P426-G445 VanDerWaalsContact O-CA 3.27Å; P426-G445 WeakPolarHBondContact O-CA 3.5Å; Y427-G445 CarbonylContact O-C 3.56Å; Y427-G445 VanDerWaalsContact O-CA 3.27Å; Y427-G445 WeakPolarHBondContact O-CA 3.42Å; G445-C447 PolarHBondContact O-N 2.84Å; G445-V448 PolarHBondContact O-N 2.85Å; G445-D449 PolarHBondContact O-N 3.47Å; G445-W788 VanDerWaalsContact CA-CH2 3.47Å; G445-W788 VanDerWaalsContact CA-CZ2 3.46Å; G445-W788 VanDerWaalsContact N-CH2 3.25Å
446	Y	96.4	Very high	93	Very high	1 Å²	1	52.4 Å²	52.4	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-59.4	-45.9	-179.7	179.2	-86.4	0	0	0	112.6	P426 Y427 V448 D449 L450 F517 M518 L784 K785 W789	P426-Y446 PolarHBondContact O-N 3.13Å; Y427-Y446 HydrophobicContact CD1-CD1 4.33Å; Y427-Y446 PolarHBondContact O-N 3.32Å; Y446-V448 VanDerWaalsContact C-N 3.29Å; Y446-V448 PolarHBondContact O-N 3Å; Y446-D449 PolarHBondContact O-N 3.01Å; Y446-L450 HydrophobicContact CE1-CD2 4.12Å; Y446-L450 VanDerWaalsContact O-CB 3.3Å; Y446-L450 WeakPolarHBondContact O-CB 3.49Å; Y446-L450 PolarHBondContact O-N 3.01Å; Y446-F517 HydrophobicContact CD1-CE2 4.44Å; Y446-F517 AromaticContact CE1-CD2 3.85Å; Y446-F517 HydrophobicContact CE1-CD2 3.85Å; Y446-F517 AromaticContact CE1-CE2 3.58Å; Y446-F517 HydrophobicContact CE1-CE2 3.58Å; Y446-M518 HydrophobicContact CD1-CE 4.46Å; Y446-M518 HydrophobicContact CD2-CE 4.39Å; Y446-M518 HydrophobicContact CE1-CE 3.88Å; Y446-M518 HydrophobicContact CE2-CE 3.77Å; Y446-M518 VanDerWaalsContact CZ-CE 3.49Å; Y446-L784 HydrophobicContact CD2-CB 3.84Å; Y446-L784 HydrophobicContact CE2-CB 3.52Å; Y446-K785 HydrophobicContact CE2-CB 4.34Å; Y446-W789 AromaticContact CD2-CZ3 3.75Å; Y446-W789 HydrophobicContact CD2-CZ3 3.75Å; Y446-W789 HydrophobicContact CG-CH2 4.36Å; Y446-W789 AromaticContact CG-CZ3 3.89Å; Y446-W789 HydrophobicContact CG-CZ3 3.89Å
447	C	96.8	Very high	93.1	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.014	25%	0.25	C	C	.	.	H	α-helix	trans	-72	-25.5	-179.7	-71.8	0	0	0	0	112.3	Y427 V428 G445 A451 I498	Y427-C447 PolarHBondContact O-N 3.29Å; V428-C447 HydrophobicContact CG2-CB 3.8Å; G445-C447 PolarHBondContact O-N 2.84Å; C447-A451 VanDerWaalsContact O-CB 3.26Å; C447-A451 WeakPolarHBondContact O-CB 3.28Å; C447-A451 PolarHBondContact O-N 3.5Å; C447-I498 HydrophobicContact CB-CG2 4.26Å
448	V	96.6	Very high	93.1	Very high	16 Å²	16	46.7 Å²	46.7	10%	0.097	24%	0.242	C	C	.	.	H	α-helix	trans	-70	-48	174.2	-176.5	0	0	0	0	110.3	V428 G445 Y446 L450 A451 S452 I464	V428-V448 HydrophobicContact CG1-CG2 4.2Å; V428-V448 HydrophobicContact CG2-CG2 4.29Å; G445-V448 PolarHBondContact O-N 2.85Å; Y446-V448 VanDerWaalsContact C-N 3.29Å; Y446-V448 PolarHBondContact O-N 3Å; V448-L450 VanDerWaalsContact C-N 3.34Å; V448-L450 PolarHBondContact O-N 3.44Å; V448-A451 PolarHBondContact O-N 3.13Å; V448-S452 PolarHBondContact O-N 3.21Å; V448-S452 VanDerWaalsContact O-N 3.1Å; V448-I464 HydrophobicContact CG1-CD1 4.16Å; V448-I464 HydrophobicContact CG2-CD1 4.36Å
449	D	96.3	Very high	93.1	Very high	37 Å²	37	40.9 Å²	40.9	20%	0.198	23%	0.228	C	C	.	.	H	α-helix	trans	-62.7	-42.5	174.9	-72.4	-8.9	0	0	0	111	G445 Y446 A451 S452 E453 L784 K787 W788	G445-D449 PolarHBondContact O-N 3.47Å; Y446-D449 PolarHBondContact O-N 3.01Å; D449-A451 PolarHBondContact O-N 2.92Å; D449-S452 WeakPolarHBondContact O-CB 3.4Å; D449-S452 PolarHBondContact O-N 3.45Å; D449-E453 PolarHBondContact O-N 3.34Å; D449-L784 HydrophobicContact CB-CD1 4.3Å; D449-L784 HydrophobicContact CB-CD2 3.72Å; D449-K787 IonicContact OD1-NZ 3.83Å; D449-K787 IonicContact OD2-NZ 3.64Å; D449-K787 PolarHBondContact OD2-NZ 3.16Å; D449-W788 PolarHBondContact OD2-NE1 3.14Å
450	L	96.2	Very high	92.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62	-43.1	176.6	-179.8	62.5	0	0	0	112.2	Y446 V448 S452 E453 I454 I498 F517 L775 L781	Y446-L450 HydrophobicContact CE1-CD2 4.12Å; Y446-L450 VanDerWaalsContact O-CB 3.3Å; Y446-L450 WeakPolarHBondContact O-CB 3.49Å; Y446-L450 PolarHBondContact O-N 3.01Å; V448-L450 VanDerWaalsContact C-N 3.34Å; V448-L450 PolarHBondContact O-N 3.44Å; L450-S452 VanDerWaalsContact C-N 3.28Å; L450-S452 PolarHBondContact O-N 2.93Å; L450-E453 PolarHBondContact O-N 3.43Å; L450-I454 HydrophobicContact CD1-CD1 3.99Å; L450-I454 HydrophobicContact CD1-CG1 4.19Å; L450-I454 HydrophobicContact CD2-CD1 4.49Å; L450-I454 HydrophobicContact CG-CD1 3.87Å; L450-I454 HydrophobicContact CG-CG1 4.44Å; L450-I454 WeakPolarHBondContact O-CB 3.36Å; L450-I454 WeakPolarHBondContact O-CG1 3.48Å; L450-I454 PolarHBondContact O-N 3.27Å; L450-I498 HydrophobicContact CD2-CG2 4.05Å; L450-I498 HydrophobicContact CG-CG2 4.29Å; L450-F517 HydrophobicContact CD2-CD1 4.21Å; L450-F517 HydrophobicContact CD2-CD2 3.98Å; L450-F517 HydrophobicContact CD2-CE1 4.32Å; L450-F517 HydrophobicContact CD2-CE2 4.13Å; L450-F517 HydrophobicContact CD2-CG 4.04Å; L450-F517 HydrophobicContact CD2-CZ 4.28Å; L450-L775 HydrophobicContact CD1-CD1 4.05Å; L450-L781 HydrophobicContact CD1-CD2 3.65Å
451	A	95.3	Very high	92.9	Very high	4 Å²	4	43.3 Å²	43.3	3%	0.033	22%	0.224	C	C	.	.	H	α-helix	trans	-61.3	-39.1	176.4	0	0	0	0	0	111.7	C447 V448 D449 A455 Y462 I498	C447-A451 VanDerWaalsContact O-CB 3.26Å; C447-A451 WeakPolarHBondContact O-CB 3.28Å; C447-A451 PolarHBondContact O-N 3.5Å; V448-A451 PolarHBondContact O-N 3.13Å; D449-A451 PolarHBondContact O-N 2.92Å; A451-A455 WeakPolarHBondContact O-CB 3.48Å; A451-A455 PolarHBondContact O-N 3.19Å; A451-Y462 HydrophobicContact CB-CE2 4.08Å; A451-I498 HydrophobicContact CB-CD1 3.7Å; A451-I498 HydrophobicContact CB-CG2 4.39Å
452	S	95.3	Very high	93	Very high	56 Å²	56	40.6 Å²	40.6	39%	0.392	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-45.9	175	-165.6	0	0	0	0	112.4	V448 D449 L450 A455 K456	V448-S452 PolarHBondContact O-N 3.21Å; V448-S452 VanDerWaalsContact O-N 3.1Å; D449-S452 WeakPolarHBondContact O-CB 3.4Å; D449-S452 PolarHBondContact O-N 3.45Å; L450-S452 VanDerWaalsContact C-N 3.28Å; L450-S452 PolarHBondContact O-N 2.93Å; S452-A455 PolarHBondContact O-N 2.83Å; S452-K456 VanDerWaalsContact O-CB 3.32Å; S452-K456 WeakPolarHBondContact O-CB 3.36Å; S452-K456 PolarHBondContact O-N 3.1Å
453	E	95	Very high	93	Very high	56 Å²	56	43.2 Å²	43.2	26%	0.262	22%	0.218	S	C	.	.	H	α-helix	trans	-66.7	-42.1	178.2	-69.2	-61.2	162	0	0	112.3	D449 L450 K456 H457 L775 V780	D449-E453 PolarHBondContact O-N 3.34Å; L450-E453 PolarHBondContact O-N 3.43Å; E453-K456 PolarHBondContact O-N 3.2Å; E453-H457 PolarHBondContact O-CD2 2.93Å; E453-H457 VanDerWaalsContact O-CD2 3.28Å; E453-H457 PolarHBondContact O-N 3.07Å; E453-L775 HydrophobicContact CB-CD1 3.98Å; E453-L775 HydrophobicContact CB-CD2 3.96Å; E453-V780 HydrophobicContact CG-CG1 4.42Å
454	I	93.5	Very high	93	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-46.7	174.8	-70.1	174.3	0	0	0	110.2	L450 K456 H457 I458 I498 V756 V768 V772 L775	L450-I454 HydrophobicContact CD1-CD1 3.99Å; L450-I454 HydrophobicContact CD1-CG1 4.19Å; L450-I454 HydrophobicContact CD2-CD1 4.49Å; L450-I454 HydrophobicContact CG-CD1 3.87Å; L450-I454 HydrophobicContact CG-CG1 4.44Å; L450-I454 WeakPolarHBondContact O-CB 3.36Å; L450-I454 WeakPolarHBondContact O-CG1 3.48Å; L450-I454 PolarHBondContact O-N 3.27Å; I454-K456 VanDerWaalsContact C-N 3.33Å; I454-K456 PolarHBondContact O-N 3.44Å; I454-H457 PolarHBondContact O-N 3.46Å; I454-I458 HydrophobicContact CG2-CD1 3.55Å; I454-I458 HydrophobicContact CG2-CG1 4.42Å; I454-I458 VanDerWaalsContact O-CG1 3.31Å; I454-I458 WeakPolarHBondContact O-CG1 3.33Å; I454-I458 PolarHBondContact O-N 2.89Å; I454-I498 HydrophobicContact CD1-CD1 4.17Å; I454-V756 HydrophobicContact CD1-CG2 3.93Å; I454-V768 HydrophobicContact CG2-CG2 4.32Å; I454-V772 HydrophobicContact CD1-CG2 4.17Å; I454-L775 HydrophobicContact CG1-CD1 4.05Å
455	A	92.3	Very high	93	Very high	9 Å²	9	41 Å²	41	7%	0.074	22%	0.215	C	C	.	.	H	α-helix	trans	-61.9	-39.9	178.6	0	0	0	0	0	112.3	A451 S452 I458 G459 I460 Y462	A451-A455 WeakPolarHBondContact O-CB 3.48Å; A451-A455 PolarHBondContact O-N 3.19Å; S452-A455 PolarHBondContact O-N 2.83Å; A455-I458 PolarHBondContact O-N 3.21Å; A455-G459 WeakPolarHBondContact O-CA 3.29Å; A455-G459 PolarHBondContact O-N 2.84Å; A455-I460 HydrophobicContact CB-CG1 4.19Å; A455-I460 PolarHBondContact O-N 2.84Å; A455-Y462 HydrophobicContact CB-CD1 3.42Å; A455-Y462 VanDerWaalsContact CB-CD1 3.42Å; A455-Y462 HydrophobicContact CB-CE1 3.58Å; A455-Y462 HydrophobicContact CB-CG 4.45Å
456	K	91.8	Very high	92.9	Very high	159 Å²	159	43.3 Å²	43.3	69%	0.691	23%	0.226	S	C	*	.	H	α-helix	trans	-63.9	-38.2	176.1	-177.5	-178	176.6	-173.5	0	112.6	S452 E453 I454	S452-K456 VanDerWaalsContact O-CB 3.32Å; S452-K456 WeakPolarHBondContact O-CB 3.36Å; S452-K456 PolarHBondContact O-N 3.1Å; E453-K456 PolarHBondContact O-N 3.2Å; I454-K456 VanDerWaalsContact C-N 3.33Å; I454-K456 PolarHBondContact O-N 3.44Å
457	H	88.2	Confident	92.8	Very high	81 Å²	81	43.5 Å²	43.5	38%	0.375	23%	0.228	S	C	.	.	H	α-helix	trans	-73.5	-34.7	178.3	-89.6	-72.6	0	0	0	113.6	E453 I454 A771	E453-H457 PolarHBondContact O-CD2 2.93Å; E453-H457 VanDerWaalsContact O-CD2 3.28Å; E453-H457 PolarHBondContact O-N 3.07Å; I454-H457 PolarHBondContact O-N 3.46Å; H457-A771 HydrophobicContact CB-CB 4.02Å
458	I	88.6	Confident	92.5	Very high	43 Å²	43	49 Å²	49	22%	0.221	26%	0.263	C	S	.	.	H	α-helix	trans	-88.9	-24.7	-178.4	-57.4	171.8	0	0	0	111.4	I454 A455 I460 P767 V768 A771	I454-I458 HydrophobicContact CG2-CD1 3.55Å; I454-I458 HydrophobicContact CG2-CG1 4.42Å; I454-I458 VanDerWaalsContact O-CG1 3.31Å; I454-I458 WeakPolarHBondContact O-CG1 3.33Å; I454-I458 PolarHBondContact O-N 2.89Å; A455-I458 PolarHBondContact O-N 3.21Å; I458-I460 HydrophobicContact CB-CG1 4.25Å; I458-I460 HydrophobicContact CG2-CD1 4.46Å; I458-I460 HydrophobicContact CG2-CG1 4.31Å; I458-I460 HydrophobicContact CG2-CG2 3.83Å; I458-P767 HydrophobicContact CD1-CB 4.31Å; I458-P767 HydrophobicContact CG1-CB 4.23Å; I458-P767 HydrophobicContact CG2-CB 4.22Å; I458-V768 HydrophobicContact CD1-CB 4.31Å; I458-V768 HydrophobicContact CD1-CG2 3.48Å; I458-V768 VanDerWaalsContact CD1-CG2 3.48Å; I458-A771 HydrophobicContact CG1-CB 4.38Å
459	G	85.3	Confident	92	Very high	48 Å²	48	51.7 Å²	51.7	50%	0.495	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.8	34.3	-177.8	0	0	0	0	0	113.9	A455	A455-G459 WeakPolarHBondContact O-CA 3.29Å; A455-G459 PolarHBondContact O-N 2.84Å
460	I	85.1	Confident	91.5	Very high	25 Å²	25	52.2 Å²	52.2	13%	0.128	29%	0.291	C	S	.	.			trans	-112.1	146.3	-175.8	56.8	169	0	0	0	113.1	V417 A455 I458	V417-I460 HydrophobicContact CB-CD1 4.33Å; V417-I460 HydrophobicContact CG2-CB 4.37Å; V417-I460 HydrophobicContact CG2-CD1 3.95Å; A455-I460 HydrophobicContact CB-CG1 4.19Å; A455-I460 PolarHBondContact O-N 2.84Å; I458-I460 HydrophobicContact CB-CG1 4.25Å; I458-I460 HydrophobicContact CG2-CD1 4.46Å; I458-I460 HydrophobicContact CG2-CG1 4.31Å; I458-I460 HydrophobicContact CG2-CG2 3.83Å
461	K	89.8	Confident	91	Very high	110 Å²	110	56.8 Å²	56.8	48%	0.478	31%	0.311	S	S	.	.			trans	-81.4	141.6	165.1	-68.6	175	-177.6	166.6	0	109.2	N414 T416 V417	N414-K461 PolarHBondContact OD1-NZ 3.25Å; T416-K461 WeakPolarHBondContact CA-O 3.35Å; V417-K461 PolarHBondContact N-O 2.91Å
462	Y	92.6	Very high	90.6	Very high	44 Å²	44	58.4 Å²	58.4	17%	0.173	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	155.8	-179.1	71.7	-83.6	0	0	0	112.7	V417 V419 N440 A451 A455 I464	V417-Y462 CarbonylContact O-C 3.56Å; V417-Y462 VanDerWaalsContact O-CA 3.24Å; V417-Y462 WeakPolarHBondContact O-CA 3.3Å; V419-Y462 HydrophobicContact CG2-CD2 3.94Å; V419-Y462 HydrophobicContact CG2-CG 4.21Å; N440-Y462 PolarHBondContact ND2-O 2.94Å; A451-Y462 HydrophobicContact CB-CE2 4.08Å; A455-Y462 HydrophobicContact CB-CD1 3.42Å; A455-Y462 VanDerWaalsContact CB-CD1 3.42Å; A455-Y462 HydrophobicContact CB-CE1 3.58Å; A455-Y462 HydrophobicContact CB-CG 4.45Å; Y462-I464 HydrophobicContact CD2-CG1 4.13Å; Y462-I464 HydrophobicContact CE2-CD1 4.14Å; Y462-I464 HydrophobicContact CE2-CG1 3.89Å
463	K	94	Very high	90.2	Very high	127 Å²	127	56 Å²	56	55%	0.552	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.8	126.1	172.4	179.5	179.3	177	-178.3	0	109.3	T416 V417 V419 N440	T416-K463 HydrophobicContact CG2-CB 3.77Å; V417-K463 PolarHBondContact O-N 2.68Å; V419-K463 PolarHBondContact N-O 2.9Å; N440-K463 WeakPolarHBondContact OD1-CA 3.42Å
464	I	94.6	Very high	89.7	Confident	12 Å²	12	55.8 Å²	55.8	6%	0.062	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	125.7	174.6	-60.7	174.9	0	0	0	108.9	T421 N440 Y443 V448 Y462 I466	T421-I464 HydrophobicContact CG2-CG2 3.65Å; N440-I464 HydrophobicContact CB-CD1 4.35Å; N440-I464 PolarHBondContact OD1-N 3.32Å; Y443-I464 HydrophobicContact CD2-CB 4.06Å; Y443-I464 HydrophobicContact CD2-CD1 4.15Å; Y443-I464 HydrophobicContact CD2-CG2 3.91Å; Y443-I464 HydrophobicContact CE2-CB 4.13Å; Y443-I464 HydrophobicContact CE2-CG2 3.95Å; V448-I464 HydrophobicContact CG1-CD1 4.16Å; V448-I464 HydrophobicContact CG2-CD1 4.36Å; Y462-I464 HydrophobicContact CD2-CG1 4.13Å; Y462-I464 HydrophobicContact CE2-CD1 4.14Å; Y462-I464 HydrophobicContact CE2-CG1 3.89Å; I464-I466 HydrophobicContact CG2-CD1 4.32Å
465	A	94.1	Very high	89.2	Confident	30 Å²	30	62 Å²	62	25%	0.248	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.7	173.2	0	0	0	0	0	109.2	V418 V419 T420 T421	V418-A465 HydrophobicContact CG1-CB 3.86Å; V419-A465 PolarHBondContact O-N 3.27Å; T420-A465 CarbonylContact C-O 3.57Å; T420-A465 WeakPolarHBondContact CA-O 3.44Å; T421-A465 PolarHBondContact N-O 3.28Å
466	I	94.6	Very high	88.7	Confident	48 Å²	48	64.9 Å²	64.9	25%	0.246	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	132.6	176.4	-56	-54.5	0	0	0	108.7	T421 M423 Y443 I464 P468	T421-I466 HydrophobicContact CG2-CD1 3.69Å; T421-I466 WeakPolarHBondContact O-CA 3.47Å; M423-I466 HydrophobicContact CG-CD1 4.16Å; M423-I466 HydrophobicContact CG-CG1 4.39Å; M423-I466 HydrophobicContact CG-CG2 3.91Å; M423-I466 HydrophobicContact SD-CD1 3.62Å; M423-I466 HydrophobicContact SD-CG1 4.14Å; Y443-I466 HydrophobicContact CD1-CD1 4.44Å; Y443-I466 HydrophobicContact CE1-CD1 3.84Å; Y443-I466 HydrophobicContact CE1-CG1 3.95Å; I464-I466 HydrophobicContact CG2-CD1 4.32Å; I466-P468 WeakPolarHBondContact O-CD 3.5Å
467	V	93.9	Very high	87.9	Confident	5 Å²	5	61.5 Å²	61.5	3%	0.03	35%	0.347	C	S	.	.			trans	-59.3	124.7	176.4	67.3	0	0	0	0	110.6	T421 I422 D469 G470 M485	T421-V467 PolarHBondContact O-N 3.09Å; I422-V467 HydrophobicContact CB-CG1 4.1Å; I422-V467 HydrophobicContact CD1-CG1 4.48Å; I422-V467 HydrophobicContact CG1-CG1 4.12Å; V467-D469 VanDerWaalsContact CG2-OD1 3.26Å; V467-D469 WeakPolarHBondContact CG2-OD1 3.37Å; V467-D469 PolarHBondContact O-N 2.8Å; V467-G470 PolarHBondContact O-N 3.3Å; V467-M485 HydrophobicContact CB-CG 3.86Å; V467-M485 HydrophobicContact CG1-CG 4.05Å; V467-M485 HydrophobicContact CG2-CG 4.07Å
468	P	89.5	Confident	87.6	Confident	117 Å²	117	64.7 Å²	64.7	76%	0.76	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-32.7	-172.3	-25.6	34	0	0	0	115.2	I466 E488	I466-P468 WeakPolarHBondContact O-CD 3.5Å; P468-E488 WeakPolarHBondContact CD-OE1 3.37Å
469	D	85.7	Confident	87.1	Confident	72 Å²	72	66.3 Å²	66.3	39%	0.385	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-4.4	-176.1	70.3	-1.7	0	0	0	113.7	V467 K471 G484	V467-D469 VanDerWaalsContact CG2-OD1 3.26Å; V467-D469 WeakPolarHBondContact CG2-OD1 3.37Å; V467-D469 PolarHBondContact O-N 2.8Å; D469-K471 VanDerWaalsContact C-N 3.25Å; D469-K471 PolarHBondContact O-N 2.9Å; D469-K471 PolarHBondContact OD1-N 2.9Å; D469-G484 WeakPolarHBondContact OD1-CA 3.35Å; D469-G484 WeakPolarHBondContact OD2-CA 3.4Å; D469-G484 PolarHBondContact OD2-N 2.7Å
470	G	86.2	Confident	86.7	Confident	49 Å²	49	70.6 Å²	70.6	51%	0.505	38%	0.384	S	S	.	.			trans	63.5	23.6	-179.4	0	0	0	0	0	114.5	I422 V467	I422-G470 WeakPolarHBondContact CD1-O 3.48Å; V467-G470 PolarHBondContact O-N 3.3Å
471	K	86.5	Confident	86.6	Confident	96 Å²	96	72.2 Å²	72.2	42%	0.417	39%	0.393	S	S	.	.			trans	-114.7	150.1	-178.5	-66.1	176.1	-175.1	176.4	0	112	D469 G484 M485	D469-K471 VanDerWaalsContact C-N 3.25Å; D469-K471 PolarHBondContact O-N 2.9Å; D469-K471 PolarHBondContact OD1-N 2.9Å; K471-G484 WeakPolarHBondContact O-CA 3.31Å; K471-M485 PolarHBondContact O-N 2.97Å
472	Y	86.8	Confident	86.5	Confident	38 Å²	38	67.9 Å²	67.9	15%	0.149	37%	0.373	C	S	.	.			trans	-68.3	-42.6	174.6	-63	-86.5	0	0	0	112.8	I422 E424 M485 V486 P500 L501	I422-Y472 HydrophobicContact CD1-CE1 4.43Å; I422-Y472 HydrophobicContact CD1-CE2 4.38Å; I422-Y472 HydrophobicContact CG2-CD1 4.43Å; I422-Y472 HydrophobicContact CG2-CE1 3.98Å; E424-Y472 PolarHBondContact OE1-OH 3.26Å; E424-Y472 VanDerWaalsContact OE1-OH 3.14Å; E424-Y472 PolarHBondContact OE2-OH 3.48Å; Y472-M485 HydrophobicContact CD1-CE 3.59Å; Y472-M485 HydrophobicContact CE1-CE 4.38Å; Y472-M485 HydrophobicContact CG-CE 4.27Å; Y472-M485 PolarHBondContact O-N 2.82Å; Y472-M485 VanDerWaalsContact O-N 3.15Å; Y472-V486 PolarHBondContact O-N 3.45Å; Y472-P500 HydrophobicContact CE1-CG 4.19Å; Y472-P500 WeakPolarHBondContact CE1-O 3.39Å; Y472-L501 HydrophobicContact CD1-CD1 4.42Å
473	G	86.3	Confident	86.3	Confident	5 Å²	5	68.3 Å²	68.3	5%	0.052	38%	0.379	C	S	.	.			trans	129.5	115.9	-179.3	0	0	0	0	0	112.4	N483 R507	G473-N483 WeakPolarHBondContact CA-O 3.34Å; G473-N483 WeakPolarHBondContact CA-OD1 3.06Å; G473-R507 PolarHBondContact O-NE 2.88Å; G473-R507 PolarHBondContact O-NH2 2.91Å
474	A	84.6	Confident	86.2	Confident	51 Å²	51	62.5 Å²	62.5	42%	0.421	35%	0.354	S	S	.	.			trans	-133.6	149.1	174.2	0	0	0	0	0	108.8	N483	A474-N483 PolarHBondContact N-OD1 2.79Å; A474-N483 PolarHBondContact O-N 3.45Å; A474-N483 PolarHBondContact O-OD1 3.07Å; A474-N483 VanDerWaalsContact O-OD1 3.1Å
475	R	83.6	Confident	86.1	Confident	132 Å²	132	61.9 Å²	61.9	50%	0.498	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-84.3	124.7	175.4	-165.3	178.8	-173.8	-179.7	1.5	109.1	K480 W482	R475-K480 PolarHBondContact NE-O 3.04Å; R475-W482 HydrophobicContact CB-CD2 4Å; R475-W482 HydrophobicContact CB-CE3 4.16Å; R475-W482 HydrophobicContact CB-CH2 4.12Å; R475-W482 HydrophobicContact CB-CZ2 3.92Å; R475-W482 HydrophobicContact CB-CZ3 4.22Å; R475-W482 HydrophobicContact CG-CD2 4.39Å; R475-W482 HydrophobicContact CG-CZ2 4.42Å
476	D	80.4	Confident	86	Confident	71 Å²	71	60.5 Å²	60.5	38%	0.38	34%	0.34	S	S	.	.			trans	-64.7	137.9	171.3	-171.5	-10.8	0	0	0	110	D478 T479 K480 I481	D476-D478 PolarHBondContact OD1-N 2.75Å; D476-T479 VanDerWaalsContact CB-OG1 3.23Å; D476-T479 WeakPolarHBondContact CB-OG1 3.21Å; D476-T479 PolarHBondContact OD2-OG1 3.14Å; D476-K480 WeakPolarHBondContact O-CA 3.44Å; D476-K480 PolarHBondContact O-N 3.05Å; D476-K480 VanDerWaalsContact O-N 3.11Å; D476-I481 PolarHBondContact N-O 3.43Å
477	A	76.5	Confident	85.8	Confident	87 Å²	87	58.4 Å²	58.4	72%	0.719	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-36.4	-175.6	0	0	0	0	0	112
478	D	80.2	Confident	85.7	Confident	149 Å²	149	59.3 Å²	59.3	80%	0.797	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-52.6	-174.6	-60.6	-35.6	0	0	0	110.8	D476	D476-D478 PolarHBondContact OD1-N 2.75Å
479	T	77.9	Confident	85.8	Confident	76 Å²	76	53.9 Å²	53.9	47%	0.466	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-15.8	-175.7	66.1	0	0	0	0	113.3	D476 I481	D476-T479 VanDerWaalsContact CB-OG1 3.23Å; D476-T479 WeakPolarHBondContact CB-OG1 3.21Å; D476-T479 PolarHBondContact OD2-OG1 3.14Å; T479-I481 PolarHBondContact O-N 3.06Å; T479-I481 PolarHBondContact OG1-N 3.38Å
480	K	78.8	Confident	85.9	Confident	138 Å²	138	53 Å²	53	60%	0.6	30%	0.296	S	S	*	.			trans	57.9	11.8	-173.2	-65.9	-179.9	179.6	176.5	0	114.7	R475 D476	R475-K480 PolarHBondContact NE-O 3.04Å; D476-K480 WeakPolarHBondContact O-CA 3.44Å; D476-K480 PolarHBondContact O-N 3.05Å; D476-K480 VanDerWaalsContact O-N 3.11Å
481	I	83.1	Confident	85.8	Confident	60 Å²	60	53.1 Å²	53.1	31%	0.308	28%	0.281	S	S	.	.			trans	-79.9	142.1	179.5	-65.1	172.3	0	0	0	109.7	D476 T479 Y491	D476-I481 PolarHBondContact N-O 3.43Å; T479-I481 PolarHBondContact O-N 3.06Å; T479-I481 PolarHBondContact OG1-N 3.38Å; I481-Y491 HydrophobicContact CG2-CE2 4.34Å; I481-Y491 WeakPolarHBondContact CG2-OH 3.28Å
482	W	87.2	Confident	85.6	Confident	19 Å²	19	50.2 Å²	50.2	7%	0.072	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-90.4	128.9	173.7	-75.6	94.6	0	0	0	110.6	R475 V486 Y491 V506 R507 V510	R475-W482 HydrophobicContact CB-CD2 4Å; R475-W482 HydrophobicContact CB-CE3 4.16Å; R475-W482 HydrophobicContact CB-CH2 4.12Å; R475-W482 HydrophobicContact CB-CZ2 3.92Å; R475-W482 HydrophobicContact CB-CZ3 4.22Å; R475-W482 HydrophobicContact CG-CD2 4.39Å; R475-W482 HydrophobicContact CG-CZ2 4.42Å; W482-V486 HydrophobicContact CB-CG1 4.46Å; W482-V486 HydrophobicContact CD2-CG1 3.8Å; W482-V486 HydrophobicContact CE3-CB 4.01Å; W482-V486 HydrophobicContact CE3-CG1 3.47Å; W482-V486 VanDerWaalsContact CE3-CG1 3.47Å; W482-V486 HydrophobicContact CG-CG1 4.25Å; W482-V486 HydrophobicContact CZ3-CB 4.48Å; W482-V486 HydrophobicContact CZ3-CG1 3.91Å; W482-Y491 PolarHBondContact N-OH 3.34Å; W482-Y491 WeakPolarHBondContact O-CE2 3.35Å; W482-V506 HydrophobicContact CH2-CB 4.31Å; W482-V506 HydrophobicContact CH2-CG2 4.19Å; W482-V506 WeakPolarHBondContact CH2-O 3.41Å; W482-V506 VanDerWaalsContact CZ2-O 3.28Å; W482-V506 WeakPolarHBondContact CZ2-O 3.46Å; W482-R507 HydrophobicContact CH2-CG 4.08Å; W482-R507 HydrophobicContact CZ3-CG 4.08Å; W482-V510 HydrophobicContact CD2-CG2 4.42Å; W482-V510 HydrophobicContact CH2-CG2 4.45Å; W482-V510 HydrophobicContact CZ2-CG1 4.29Å; W482-V510 HydrophobicContact CZ2-CG2 3.81Å
483	N	88.4	Confident	85.5	Confident	53 Å²	53	55 Å²	55	28%	0.283	30%	0.3	S	S	.	.			trans	-98.1	-174.8	170.5	64.2	24.3	0	0	0	111.6	G473 A474 G487	G473-N483 WeakPolarHBondContact CA-O 3.34Å; G473-N483 WeakPolarHBondContact CA-OD1 3.06Å; A474-N483 PolarHBondContact N-OD1 2.79Å; A474-N483 PolarHBondContact O-N 3.45Å; A474-N483 PolarHBondContact O-OD1 3.07Å; A474-N483 VanDerWaalsContact O-OD1 3.1Å; N483-G487 PolarHBondContact O-N 2.83Å; N483-G487 VanDerWaalsContact O-N 3.09Å
484	G	90.6	Very high	85.7	Confident	4 Å²	4	54.8 Å²	54.8	4%	0.041	30%	0.298	C	S	.	.	H	α-helix	trans	62.7	-160.6	174.6	0	0	0	0	0	115	D469 K471 V486 G487 E488	D469-G484 WeakPolarHBondContact OD1-CA 3.35Å; D469-G484 WeakPolarHBondContact OD2-CA 3.4Å; D469-G484 PolarHBondContact OD2-N 2.7Å; K471-G484 WeakPolarHBondContact O-CA 3.31Å; G484-V486 VanDerWaalsContact C-N 3.26Å; G484-V486 PolarHBondContact O-N 3Å; G484-G487 PolarHBondContact O-N 3.09Å; G484-G487 VanDerWaalsContact O-N 3.12Å; G484-E488 PolarHBondContact O-N 2.64Å; G484-E488 VanDerWaalsContact O-N 3.17Å
485	M	93.5	Very high	85.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.3	-34.7	179.3	-60.9	-178.4	-74.6	0	0	112.5	T420 I422 V467 K471 Y472 E488 L489 A499 L501	T420-M485 HydrophobicContact CG2-CB 4.14Å; T420-M485 HydrophobicContact CG2-CG 4.39Å; I422-M485 HydrophobicContact CB-CE 4.11Å; I422-M485 HydrophobicContact CB-SD 4.09Å; I422-M485 HydrophobicContact CG2-CE 3.85Å; I422-M485 HydrophobicContact CG2-SD 4.24Å; V467-M485 HydrophobicContact CB-CG 3.86Å; V467-M485 HydrophobicContact CG1-CG 4.05Å; V467-M485 HydrophobicContact CG2-CG 4.07Å; K471-M485 PolarHBondContact O-N 2.97Å; Y472-M485 HydrophobicContact CD1-CE 3.59Å; Y472-M485 HydrophobicContact CE1-CE 4.38Å; Y472-M485 HydrophobicContact CG-CE 4.27Å; Y472-M485 PolarHBondContact O-N 2.82Å; Y472-M485 VanDerWaalsContact O-N 3.15Å; M485-E488 PolarHBondContact O-N 3.06Å; M485-L489 PolarHBondContact O-N 3.45Å; M485-A499 HydrophobicContact CE-CB 3.69Å; M485-A499 HydrophobicContact SD-CB 3.48Å; M485-A499 WeakPolarHBondContact SD-CB 3.19Å; M485-L501 HydrophobicContact CE-CD1 4.25Å
486	V	92.6	Very high	86.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.9	-45.6	175.3	177.2	0	0	0	0	110.7	Y472 W482 G484 E488 L489 V490 L501 R507 V510 I511	Y472-V486 PolarHBondContact O-N 3.45Å; W482-V486 HydrophobicContact CB-CG1 4.46Å; W482-V486 HydrophobicContact CD2-CG1 3.8Å; W482-V486 HydrophobicContact CE3-CB 4.01Å; W482-V486 HydrophobicContact CE3-CG1 3.47Å; W482-V486 VanDerWaalsContact CE3-CG1 3.47Å; W482-V486 HydrophobicContact CG-CG1 4.25Å; W482-V486 HydrophobicContact CZ3-CB 4.48Å; W482-V486 HydrophobicContact CZ3-CG1 3.91Å; G484-V486 VanDerWaalsContact C-N 3.26Å; G484-V486 PolarHBondContact O-N 3Å; V486-E488 VanDerWaalsContact C-N 3.32Å; V486-E488 PolarHBondContact O-N 2.84Å; V486-L489 PolarHBondContact O-N 3.42Å; V486-V490 HydrophobicContact CG1-CG2 4.26Å; V486-V490 VanDerWaalsContact O-CG2 3.3Å; V486-V490 WeakPolarHBondContact O-CG2 3.39Å; V486-V490 PolarHBondContact O-N 3.02Å; V486-L501 HydrophobicContact CG2-CD1 4.34Å; V486-L501 HydrophobicContact CG2-CD2 4.33Å; V486-R507 HydrophobicContact CG2-CG 4.14Å; V486-V510 HydrophobicContact CG1-CG2 4Å; V486-I511 HydrophobicContact CB-CD1 4.36Å; V486-I511 HydrophobicContact CG1-CD1 4Å; V486-I511 HydrophobicContact CG2-CD1 3.94Å
487	G	89.4	Confident	87.3	Confident	4 Å²	4	44.2 Å²	44.2	4%	0.041	24%	0.244	C	C	.	.	H	α-helix	trans	-60.7	-39.5	175.7	0	0	0	0	0	112.6	N483 G484 L489 V490 Y491	N483-G487 PolarHBondContact O-N 2.83Å; N483-G487 VanDerWaalsContact O-N 3.09Å; G484-G487 PolarHBondContact O-N 3.09Å; G484-G487 VanDerWaalsContact O-N 3.12Å; G487-L489 VanDerWaalsContact C-N 3.3Å; G487-L489 PolarHBondContact O-N 3.14Å; G487-V490 PolarHBondContact O-N 3.3Å; G487-Y491 WeakPolarHBondContact O-CB 3.1Å; G487-Y491 WeakPolarHBondContact O-CD2 3.26Å; G487-Y491 PolarHBondContact O-N 3.33Å
488	E	91.3	Very high	88.2	Confident	25 Å²	25	40.4 Å²	40.4	12%	0.117	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-35.4	177.5	-66.4	-163.3	156.2	0	0	113.6	T420 P468 G484 M485 V486 G492 K493 A494	T420-E488 WeakPolarHBondContact CB-OE2 3.38Å; T420-E488 PolarHBondContact OG1-OE2 2.93Å; P468-E488 WeakPolarHBondContact CD-OE1 3.37Å; G484-E488 PolarHBondContact O-N 2.64Å; G484-E488 VanDerWaalsContact O-N 3.17Å; M485-E488 PolarHBondContact O-N 3.06Å; V486-E488 VanDerWaalsContact C-N 3.32Å; V486-E488 PolarHBondContact O-N 2.84Å; E488-G492 PolarHBondContact O-N 3.09Å; E488-K493 HydrophobicContact CB-CB 4.04Å; E488-K493 HydrophobicContact CG-CB 4.27Å; E488-K493 HydrophobicContact CG-CD 4.3Å; E488-K493 PolarHBondContact O-N 3.44Å; E488-A494 HydrophobicContact CB-CB 4.11Å; E488-A494 PolarHBondContact O-N 3.34Å; E488-A494 VanDerWaalsContact O-N 3.09Å
489	L	91.7	Very high	89	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-74.3	-44	174.7	-63.7	-176.8	0	0	0	112.1	T420 M485 V486 G487 Y491 G492 A494 A497 I511 A757 P759	T420-L489 HydrophobicContact CG2-CD2 4.3Å; M485-L489 PolarHBondContact O-N 3.45Å; V486-L489 PolarHBondContact O-N 3.42Å; G487-L489 VanDerWaalsContact C-N 3.3Å; G487-L489 PolarHBondContact O-N 3.14Å; L489-Y491 VanDerWaalsContact C-N 3.31Å; L489-Y491 PolarHBondContact O-N 3.43Å; L489-G492 PolarHBondContact O-N 2.93Å; L489-A494 HydrophobicContact CD2-CB 4.06Å; L489-A497 HydrophobicContact CD1-CB 3.74Å; L489-A497 HydrophobicContact CD2-CB 4.3Å; L489-A497 HydrophobicContact CG-CB 4.24Å; L489-I511 HydrophobicContact CB-CG2 3.83Å; L489-I511 HydrophobicContact CD1-CD1 4.2Å; L489-I511 HydrophobicContact CD1-CG2 4.31Å; L489-A757 HydrophobicContact CD1-CB 3.64Å; L489-P759 HydrophobicContact CB-CG 4.37Å; L489-P759 HydrophobicContact CD2-CG 4.29Å
490	V	88.1	Confident	89.7	Confident	55 Å²	55	29.7 Å²	29.7	33%	0.333	15%	0.151	S	C	.	.	H	α-helix	trans	-62.4	-40.3	180	172.4	0	0	0	0	111.2	V486 G487 V510 I511	V486-V490 HydrophobicContact CG1-CG2 4.26Å; V486-V490 VanDerWaalsContact O-CG2 3.3Å; V486-V490 WeakPolarHBondContact O-CG2 3.39Å; V486-V490 PolarHBondContact O-N 3.02Å; G487-V490 PolarHBondContact O-N 3.3Å; V490-V510 HydrophobicContact CG2-CB 3.97Å; V490-V510 HydrophobicContact CG2-CG2 4Å; V490-I511 HydrophobicContact CG2-CG2 3.72Å
491	Y	85.1	Confident	90.4	Very high	50 Å²	50	23.1 Å²	23.1	20%	0.196	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	10.1	-177.9	-53.2	-52.4	0	0	0	113.7	Q205 I481 W482 G487 L489 K493	Q205-Y491 HydrophobicContact CB-CD1 4.22Å; Q205-Y491 HydrophobicContact CB-CE1 3.96Å; Q205-Y491 HydrophobicContact CG-CE1 4.33Å; I481-Y491 HydrophobicContact CG2-CE2 4.34Å; I481-Y491 WeakPolarHBondContact CG2-OH 3.28Å; W482-Y491 PolarHBondContact N-OH 3.34Å; W482-Y491 WeakPolarHBondContact O-CE2 3.35Å; G487-Y491 WeakPolarHBondContact O-CB 3.1Å; G487-Y491 WeakPolarHBondContact O-CD2 3.26Å; G487-Y491 PolarHBondContact O-N 3.33Å; L489-Y491 VanDerWaalsContact C-N 3.31Å; L489-Y491 PolarHBondContact O-N 3.43Å; Y491-K493 VanDerWaalsContact C-N 3.29Å; Y491-K493 PolarHBondContact O-N 3.04Å
492	G	81.8	Confident	90.9	Very high	36 Å²	36	20.5 Å²	20.5	37%	0.371	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	20.8	174	0	0	0	0	0	115.6	E488 L489	E488-G492 PolarHBondContact O-N 3.09Å; L489-G492 PolarHBondContact O-N 2.93Å
493	K	84.3	Confident	91.2	Very high	137 Å²	137	22 Å²	22	60%	0.596	12%	0.118	S	C	*	.	S	Bend	trans	-75	-31.5	173.5	-64.3	-178.1	178.5	178.3	0	111.9	E488 Y491	E488-K493 HydrophobicContact CB-CB 4.04Å; E488-K493 HydrophobicContact CG-CB 4.27Å; E488-K493 HydrophobicContact CG-CD 4.3Å; E488-K493 PolarHBondContact O-N 3.44Å; Y491-K493 VanDerWaalsContact C-N 3.29Å; Y491-K493 PolarHBondContact O-N 3.04Å
494	A	89.8	Confident	91.4	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.008	12%	0.115	C	C	.	.			trans	-128.4	154.3	174.9	0	0	0	0	0	110.6	V418 T420 E488 L489	V418-A494 HydrophobicContact CG1-CB 4.36Å; T420-A494 HydrophobicContact CG2-CB 3.62Å; E488-A494 HydrophobicContact CB-CB 4.11Å; E488-A494 PolarHBondContact O-N 3.34Å; E488-A494 VanDerWaalsContact O-N 3.09Å; L489-A494 HydrophobicContact CD2-CB 4.06Å
495	E	90.4	Very high	91.3	Very high	30 Å²	30	27.4 Å²	27.4	14%	0.14	15%	0.146	C	C	.	.	S	Bend	trans	-102.7	-21.6	-175.8	-69.2	177.9	-152.5	0	0	112.2	K233 R415 V417 V418 P759 L764	K233-E495 IonicContact NZ-OE1 3.72Å; K233-E495 PolarHBondContact NZ-OE1 2.71Å; R415-E495 IonicContact CZ-OE1 2.64Å; R415-E495 IonicContact CZ-OE2 2.71Å; R415-E495 IonicContact NE-OE1 2.72Å; R415-E495 PolarHBondContact NE-OE1 2.95Å; R415-E495 IonicContact NE-OE2 2.74Å; R415-E495 IonicContact NH2-OE1 2.74Å; R415-E495 PolarHBondContact NH2-OE1 3.47Å; R415-E495 IonicContact NH2-OE2 2.83Å; V417-E495 HydrophobicContact CG1-CB 3.85Å; V418-E495 PolarHBondContact O-N 3.32Å; V418-E495 VanDerWaalsContact O-N 3.08Å; E495-P759 WeakPolarHBondContact O-CD 3.06Å; E495-L764 HydrophobicContact CB-CD1 4.48Å
496	I	94.8	Very high	91.1	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.015	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	145.5	177.3	-168	171.4	0	0	0	109.7	V417 V418 V419 T420 I498 V756 A757 T758 V768	V417-I496 HydrophobicContact CG1-CG2 3.78Å; V418-I496 PolarHBondContact O-N 3.45Å; V419-I496 CarbonylContact C-O 3.45Å; V419-I496 WeakPolarHBondContact CA-O 3.37Å; V419-I496 HydrophobicContact CB-CG2 4.03Å; V419-I496 HydrophobicContact CG1-CG2 4.19Å; V419-I496 HydrophobicContact CG2-CG2 3.53Å; T420-I496 PolarHBondContact N-O 3.09Å; I496-I498 HydrophobicContact CD1-CD1 4.2Å; I496-I498 HydrophobicContact CD1-CG1 4.2Å; I496-I498 HydrophobicContact CG1-CG1 4.18Å; I496-V756 HydrophobicContact CD1-CG1 3.7Å; I496-V756 HydrophobicContact CG1-CG1 3.66Å; I496-A757 WeakPolarHBondContact CA-O 3.37Å; I496-T758 HydrophobicContact CG1-CG2 4.09Å; I496-V768 HydrophobicContact CD1-CG1 4.37Å; I496-V768 HydrophobicContact CD1-CG2 3.66Å
497	A	97	Very high	91.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	112.8	172.4	0	0	0	0	0	110	T420 L489 A757	T420-A497 HydrophobicContact CG2-CB 3.54Å; T420-A497 WeakPolarHBondContact O-CA 3.49Å; L489-A497 HydrophobicContact CD1-CB 3.74Å; L489-A497 HydrophobicContact CD2-CB 4.3Å; L489-A497 HydrophobicContact CG-CB 4.24Å; A497-A757 HydrophobicContact CB-CB 4.27Å; A497-A757 PolarHBondContact N-O 3.17Å; A497-A757 PolarHBondContact O-N 2.9Å; A497-A757 VanDerWaalsContact O-N 3.1Å
498	I	96.8	Very high	91.2	Very high	6 Å²	6	33.6 Å²	33.6	3%	0.031	18%	0.177	C	C	.	.			trans	-111.4	94.2	174.3	-56.3	175.8	0	0	0	107.1	V419 T420 T421 C447 L450 A451 I454 I496 V756	V419-I498 HydrophobicContact CG1-CB 3.9Å; V419-I498 HydrophobicContact CG1-CD1 4.03Å; V419-I498 HydrophobicContact CG1-CG1 3.95Å; T420-I498 PolarHBondContact O-N 3.07Å; T421-I498 WeakPolarHBondContact CB-O 3.38Å; T421-I498 PolarHBondContact OG1-O 3.02Å; C447-I498 HydrophobicContact CB-CG2 4.26Å; L450-I498 HydrophobicContact CD2-CG2 4.05Å; L450-I498 HydrophobicContact CG-CG2 4.29Å; A451-I498 HydrophobicContact CB-CD1 3.7Å; A451-I498 HydrophobicContact CB-CG2 4.39Å; I454-I498 HydrophobicContact CD1-CD1 4.17Å; I496-I498 HydrophobicContact CD1-CD1 4.2Å; I496-I498 HydrophobicContact CD1-CG1 4.2Å; I496-I498 HydrophobicContact CG1-CG1 4.18Å; I498-V756 HydrophobicContact CG1-CG1 3.87Å
499	A	95.6	Very high	91.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-155	167.6	-172	0	0	0	0	0	109.8	I422 M485 L501	I422-A499 HydrophobicContact CG2-CB 4.48Å; M485-A499 HydrophobicContact CE-CB 3.69Å; M485-A499 HydrophobicContact SD-CB 3.48Å; M485-A499 WeakPolarHBondContact SD-CB 3.19Å; A499-L501 PolarHBondContact O-N 3.42Å
500	P	94	Very high	91.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.206	C	C	.	.	S	Bend	trans	-69.5	63.8	168.1	27.7	-32.4	0	0	0	111.2	I422 E424 Y427 Y472 Y754	I422-P500 HydrophobicContact CG2-CG 4.41Å; E424-P500 WeakPolarHBondContact OE2-CG 3.4Å; Y427-P500 HydrophobicContact CD1-CB 3.98Å; Y427-P500 HydrophobicContact CD1-CG 4.14Å; Y427-P500 HydrophobicContact CD2-CB 4.03Å; Y427-P500 HydrophobicContact CD2-CG 3.71Å; Y427-P500 HydrophobicContact CE1-CB 3.93Å; Y427-P500 HydrophobicContact CE2-CB 3.98Å; Y427-P500 HydrophobicContact CE2-CG 4.13Å; Y427-P500 HydrophobicContact CG-CB 4.03Å; Y427-P500 HydrophobicContact CG-CG 3.72Å; Y472-P500 HydrophobicContact CE1-CG 4.19Å; Y472-P500 WeakPolarHBondContact CE1-O 3.39Å; P500-Y754 VanDerWaalsContact C-CD1 3.48Å; P500-Y754 HydrophobicContact CB-CD1 4.4Å; P500-Y754 HydrophobicContact CB-CD2 4.02Å; P500-Y754 HydrophobicContact CB-CE1 3.99Å; P500-Y754 HydrophobicContact CB-CE2 3.57Å; P500-Y754 HydrophobicContact CB-CG 4.42Å; P500-Y754 WeakPolarHBondContact O-CE1 3.18Å
501	L	93.6	Very high	91.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.19	C	C	.	.			trans	-98.1	109.2	-178.4	-171.3	66.3	0	0	0	110	Y472 M485 V486 A499 I503 R507 I511 F513 G755 A757	Y472-L501 HydrophobicContact CD1-CD1 4.42Å; M485-L501 HydrophobicContact CE-CD1 4.25Å; V486-L501 HydrophobicContact CG2-CD1 4.34Å; V486-L501 HydrophobicContact CG2-CD2 4.33Å; A499-L501 PolarHBondContact O-N 3.42Å; L501-I503 PolarHBondContact O-N 3.05Å; L501-R507 VanDerWaalsContact CD1-NH1 3.34Å; L501-I511 HydrophobicContact CD2-CD1 4.35Å; L501-F513 HydrophobicContact CB-CE1 4.48Å; L501-F513 HydrophobicContact CD2-CE1 3.76Å; L501-F513 HydrophobicContact CD2-CZ 3.81Å; L501-F513 HydrophobicContact CG-CE1 3.98Å; L501-F513 HydrophobicContact CG-CZ 4.11Å; L501-G755 PolarHBondContact O-N 2.92Å; L501-A757 HydrophobicContact CD2-CB 3.9Å
502	T	93.2	Very high	91.9	Very high	6 Å²	6	34.8 Å²	34.8	4%	0.037	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-63.6	129.6	178	-28.9	0	0	0	0	111	T504 R507 E727 K752	T502-T504 PolarHBondContact O-N 3.43Å; T502-R507 PolarHBondContact O-NH1 3.45Å; T502-E727 PolarHBondContact OG1-OE1 2.91Å; T502-K752 HydrophobicContact CG2-CB 4.07Å; T502-K752 HydrophobicContact CG2-CD 3.87Å; T502-K752 HydrophobicContact CG2-CG 4.1Å
503	I	94.2	Very high	92.6	Very high	49 Å²	49	33.5 Å²	33.5	25%	0.251	17%	0.168	S	C	.	.			trans	-69.3	125.1	171.7	-59.6	162.1	0	0	0	108.5	L501 F513 P516 G753	L501-I503 PolarHBondContact O-N 3.05Å; I503-F513 HydrophobicContact CD1-CB 4.45Å; I503-F513 HydrophobicContact CD1-CD1 4.5Å; I503-F513 HydrophobicContact CG1-CB 4.13Å; I503-F513 HydrophobicContact CG1-CD1 3.57Å; I503-F513 HydrophobicContact CG1-CE1 4.01Å; I503-F513 HydrophobicContact CG1-CG 3.86Å; I503-F513 HydrophobicContact CG2-CD2 4.42Å; I503-F513 HydrophobicContact CG2-CG 4.36Å; I503-P516 HydrophobicContact CD1-CB 4.23Å; I503-P516 HydrophobicContact CD1-CG 3.83Å; I503-G753 PolarHBondContact N-O 3.39Å; I503-G753 VanDerWaalsContact N-O 3.07Å
504	T	90.8	Very high	93.2	Very high	36 Å²	36	27.4 Å²	27.4	22%	0.221	14%	0.142	C	C	.	.			trans	-141.9	151.9	179	66.1	0	0	0	0	109.9	T502 V506 R507 E508	T502-T504 PolarHBondContact O-N 3.43Å; T504-V506 VanDerWaalsContact C-N 3.34Å; T504-V506 PolarHBondContact O-N 3.4Å; T504-R507 PolarHBondContact O-N 3.46Å; T504-R507 WeakPolarHBondContact OG1-CD 3.43Å; T504-R507 VanDerWaalsContact OG1-CG 3.31Å; T504-R507 WeakPolarHBondContact OG1-CG 3.26Å; T504-E508 PolarHBondContact O-N 2.98Å
505	L	89.1	Confident	93.4	Very high	135 Å²	135	33 Å²	33	71%	0.707	17%	0.166	S	C	*	.	H	α-helix	trans	-52.4	-48.8	-179.2	-179.8	63.8	0	0	0	112.9	R507 E508 E509	L505-R507 PolarHBondContact O-N 3Å; L505-E508 PolarHBondContact O-N 3.28Å; L505-E509 PolarHBondContact O-N 3.2Å
506	V	90	Very high	93.7	Very high	48 Å²	48	34.8 Å²	34.8	29%	0.291	18%	0.18	S	C	.	.	H	α-helix	trans	-65.6	-23.5	-177.5	-63.2	0	0	0	0	113.7	W482 T504	W482-V506 HydrophobicContact CH2-CB 4.31Å; W482-V506 HydrophobicContact CH2-CG2 4.19Å; W482-V506 WeakPolarHBondContact CH2-O 3.41Å; W482-V506 VanDerWaalsContact CZ2-O 3.28Å; W482-V506 WeakPolarHBondContact CZ2-O 3.46Å; T504-V506 VanDerWaalsContact C-N 3.34Å; T504-V506 PolarHBondContact O-N 3.4Å
507	R	92.3	Very high	93.7	Very high	20 Å²	20	35.1 Å²	35.1	8%	0.075	18%	0.182	C	C	.	.	H	α-helix	trans	-85.2	-39.8	176.1	-68.1	176.2	177.6	163.1	-5.1	110.7	G473 W482 V486 L501 T502 T504 L505 E509 V510 I511 F513	G473-R507 PolarHBondContact O-NE 2.88Å; G473-R507 PolarHBondContact O-NH2 2.91Å; W482-R507 HydrophobicContact CH2-CG 4.08Å; W482-R507 HydrophobicContact CZ3-CG 4.08Å; V486-R507 HydrophobicContact CG2-CG 4.14Å; L501-R507 VanDerWaalsContact CD1-NH1 3.34Å; T502-R507 PolarHBondContact O-NH1 3.45Å; T504-R507 PolarHBondContact O-N 3.46Å; T504-R507 WeakPolarHBondContact OG1-CD 3.43Å; T504-R507 VanDerWaalsContact OG1-CG 3.31Å; T504-R507 WeakPolarHBondContact OG1-CG 3.26Å; L505-R507 PolarHBondContact O-N 3Å; R507-E509 PolarHBondContact O-N 3.34Å; R507-V510 VanDerWaalsContact O-CG2 3.3Å; R507-V510 WeakPolarHBondContact O-CG2 3.33Å; R507-V510 PolarHBondContact O-N 2.88Å; R507-I511 HydrophobicContact CB-CD1 4.41Å; R507-I511 HydrophobicContact CB-CG1 4.37Å; R507-I511 WeakPolarHBondContact O-CG1 3.48Å; R507-I511 PolarHBondContact O-N 3.12Å; R507-F513 HydrophobicContact CB-CE2 3.71Å; R507-F513 HydrophobicContact CB-CZ 4.05Å
508	E	91.6	Very high	93.6	Very high	66 Å²	66	35.7 Å²	35.7	31%	0.308	18%	0.184	S	C	.	.	H	α-helix	trans	-59.1	-28.2	176.3	-161.9	71.8	-157.9	0	0	112.5	T504 L505 V510 I511 F513	T504-E508 PolarHBondContact O-N 2.98Å; L505-E508 PolarHBondContact O-N 3.28Å; E508-V510 VanDerWaalsContact C-N 3.26Å; E508-V510 PolarHBondContact O-N 3.41Å; E508-I511 CarbonylContact C-O 3.53Å; E508-I511 VanDerWaalsContact CA-O 3.3Å; E508-I511 WeakPolarHBondContact CA-O 3.23Å; E508-F513 WeakPolarHBondContact OE2-CD2 3.35Å
509	E	89.9	Confident	93.4	Very high	107 Å²	107	40.1 Å²	40.1	50%	0.5	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-32.2	175.3	-74.3	174.2	-173	0	0	113	L505 R507 K760	L505-E509 PolarHBondContact O-N 3.2Å; R507-E509 PolarHBondContact O-N 3.34Å; E509-K760 PolarHBondContact O-NZ 3.49Å
510	V	91.1	Very high	93.3	Very high	39 Å²	39	40.3 Å²	40.3	24%	0.236	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-23.5	-171	-62	0	0	0	0	114.5	W482 V486 V490 R507 E508	W482-V510 HydrophobicContact CD2-CG2 4.42Å; W482-V510 HydrophobicContact CH2-CG2 4.45Å; W482-V510 HydrophobicContact CZ2-CG1 4.29Å; W482-V510 HydrophobicContact CZ2-CG2 3.81Å; V486-V510 HydrophobicContact CG1-CG2 4Å; V490-V510 HydrophobicContact CG2-CB 3.97Å; V490-V510 HydrophobicContact CG2-CG2 4Å; R507-V510 VanDerWaalsContact O-CG2 3.3Å; R507-V510 WeakPolarHBondContact O-CG2 3.33Å; R507-V510 PolarHBondContact O-N 2.88Å; E508-V510 VanDerWaalsContact C-N 3.26Å; E508-V510 PolarHBondContact O-N 3.41Å
511	I	95.2	Very high	93.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	154.6	177.8	55.3	174.2	0	0	0	109.6	V486 L489 V490 L501 R507 E508 F513 A757	V486-I511 HydrophobicContact CB-CD1 4.36Å; V486-I511 HydrophobicContact CG1-CD1 4Å; V486-I511 HydrophobicContact CG2-CD1 3.94Å; L489-I511 HydrophobicContact CB-CG2 3.83Å; L489-I511 HydrophobicContact CD1-CD1 4.2Å; L489-I511 HydrophobicContact CD1-CG2 4.31Å; V490-I511 HydrophobicContact CG2-CG2 3.72Å; L501-I511 HydrophobicContact CD2-CD1 4.35Å; R507-I511 HydrophobicContact CB-CD1 4.41Å; R507-I511 HydrophobicContact CB-CG1 4.37Å; R507-I511 WeakPolarHBondContact O-CG1 3.48Å; R507-I511 PolarHBondContact O-N 3.12Å; E508-I511 CarbonylContact C-O 3.53Å; E508-I511 VanDerWaalsContact CA-O 3.3Å; E508-I511 WeakPolarHBondContact CA-O 3.23Å; I511-F513 HydrophobicContact CD1-CE2 3.83Å; I511-F513 HydrophobicContact CD1-CZ 3.88Å; I511-F513 HydrophobicContact CG1-CD2 4.44Å; I511-F513 HydrophobicContact CG1-CE2 3.84Å; I511-F513 HydrophobicContact CG1-CZ 4.41Å; I511-A757 HydrophobicContact CD1-CB 3.92Å
512	D	95.2	Very high	93.3	Very high	11 Å²	11	40.3 Å²	40.3	6%	0.059	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	135.3	178.9	-73.8	-31.2	0	0	0	110.6	A757 T758 G761 R765	D512-A757 WeakPolarHBondContact O-CA 3.49Å; D512-T758 PolarHBondContact N-O 2.94Å; D512-T758 PolarHBondContact O-N 3.35Å; D512-T758 PolarHBondContact O-OG1 3.38Å; D512-G761 PolarHBondContact OD2-N 3.41Å; D512-R765 HydrophobicContact CB-CG 4.32Å; D512-R765 IonicContact OD1-CZ 2.86Å; D512-R765 IonicContact OD1-NH1 3.52Å; D512-R765 PolarHBondContact OD1-NH1 3.04Å; D512-R765 IonicContact OD2-CZ 2.8Å; D512-R765 IonicContact OD2-NE 2.93Å; D512-R765 IonicContact OD2-NH1 3.55Å; D512-R765 PolarHBondContact OD2-NH1 2.92Å
513	F	96.3	Very high	93.4	Very high	10 Å²	10	40 Å²	40	4%	0.044	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	150.9	173.8	-74.2	-94.6	0	0	0	113	L501 I503 R507 E508 I511 V756 A757	L501-F513 HydrophobicContact CB-CE1 4.48Å; L501-F513 HydrophobicContact CD2-CE1 3.76Å; L501-F513 HydrophobicContact CD2-CZ 3.81Å; L501-F513 HydrophobicContact CG-CE1 3.98Å; L501-F513 HydrophobicContact CG-CZ 4.11Å; I503-F513 HydrophobicContact CD1-CB 4.45Å; I503-F513 HydrophobicContact CD1-CD1 4.5Å; I503-F513 HydrophobicContact CG1-CB 4.13Å; I503-F513 HydrophobicContact CG1-CD1 3.57Å; I503-F513 HydrophobicContact CG1-CE1 4.01Å; I503-F513 HydrophobicContact CG1-CG 3.86Å; I503-F513 HydrophobicContact CG2-CD2 4.42Å; I503-F513 HydrophobicContact CG2-CG 4.36Å; R507-F513 HydrophobicContact CB-CE2 3.71Å; R507-F513 HydrophobicContact CB-CZ 4.05Å; E508-F513 WeakPolarHBondContact OE2-CD2 3.35Å; I511-F513 HydrophobicContact CD1-CE2 3.83Å; I511-F513 HydrophobicContact CD1-CZ 3.88Å; I511-F513 HydrophobicContact CG1-CD2 4.44Å; I511-F513 HydrophobicContact CG1-CE2 3.84Å; I511-F513 HydrophobicContact CG1-CZ 4.41Å; F513-V756 WeakPolarHBondContact CA-O 3.47Å; F513-A757 HydrophobicContact CD1-CB 3.88Å; F513-A757 HydrophobicContact CE1-CB 3.75Å; F513-A757 HydrophobicContact CG-CB 4.44Å; F513-A757 HydrophobicContact CZ-CB 4.18Å
514	S	95.6	Very high	93.4	Very high	9 Å²	9	37.7 Å²	37.7	6%	0.063	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-71.9	172.6	162.6	74.4	0	0	0	0	111.3	V756	S514-V756 PolarHBondContact N-O 3Å; S514-V756 PolarHBondContact OG-N 3.23Å; S514-V756 PolarHBondContact OG-O 2.74Å
515	K	95.2	Very high	93.6	Very high	119 Å²	119	36 Å²	36	52%	0.517	19%	0.193	S	C	.	.	S	Bend	trans	-56.2	147.5	161.4	-66.9	-55	179.9	-166.4	0	110.3	F517 N769 L773	K515-F517 PolarHBondContact O-N 3.08Å; K515-N769 WeakPolarHBondContact CG-OD1 3.49Å; K515-N769 PolarHBondContact N-OD1 2.9Å; K515-L773 HydrophobicContact CB-CD2 4.21Å; K515-L773 HydrophobicContact CG-CD2 4.15Å; K515-L773 HydrophobicContact CG-CG 4.45Å
516	P	96.1	Very high	93.8	Very high	66 Å²	66	30 Å²	30	43%	0.429	16%	0.161	S	C	.	.	P	Polyproline II helix	trans	-61.7	132.4	-178	-18.5	28.9	0	0	0	111.3	I503 Y754	I503-P516 HydrophobicContact CD1-CB 4.23Å; I503-P516 HydrophobicContact CD1-CG 3.83Å; P516-Y754 CarbonylContact C-O 3.55Å; P516-Y754 WeakPolarHBondContact CA-O 3.43Å
517	F	95.3	Very high	93.9	Very high	11 Å²	11	30 Å²	30	5%	0.048	16%	0.157	C	C	.	.	S	Bend	trans	-91.5	-14.7	174.1	67.9	-99.8	0	0	0	112.4	Y446 L450 K515 Y754 V756 V772 L781	Y446-F517 HydrophobicContact CD1-CE2 4.44Å; Y446-F517 AromaticContact CE1-CD2 3.85Å; Y446-F517 HydrophobicContact CE1-CD2 3.85Å; Y446-F517 AromaticContact CE1-CE2 3.58Å; Y446-F517 HydrophobicContact CE1-CE2 3.58Å; L450-F517 HydrophobicContact CD2-CD1 4.21Å; L450-F517 HydrophobicContact CD2-CD2 3.98Å; L450-F517 HydrophobicContact CD2-CE1 4.32Å; L450-F517 HydrophobicContact CD2-CE2 4.13Å; L450-F517 HydrophobicContact CD2-CG 4.04Å; L450-F517 HydrophobicContact CD2-CZ 4.28Å; K515-F517 PolarHBondContact O-N 3.08Å; F517-Y754 VanDerWaalsContact CD1-O 3.32Å; F517-Y754 WeakPolarHBondContact CD1-O 3.35Å; F517-Y754 HydrophobicContact CE2-CD2 4.37Å; F517-Y754 HydrophobicContact CZ-CD2 4.23Å; F517-Y754 HydrophobicContact CZ-CG 4.22Å; F517-Y754 PolarHBondContact N-O 3.31Å; F517-V756 HydrophobicContact CD1-CG2 4.11Å; F517-V756 HydrophobicContact CE1-CG2 4.41Å; F517-V772 HydrophobicContact CB-CG1 3.88Å; F517-L781 HydrophobicContact CB-CD1 4.03Å; F517-L781 HydrophobicContact CB-CD2 4.46Å
518	M	94.4	Very high	93.6	Very high	11 Å²	11	33.4 Å²	33.4	5%	0.054	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	123.1	178	-174.4	174.6	-68.9	0	0	110.3	Y446 T729 G753 Y754 K785 W789	Y446-M518 HydrophobicContact CD1-CE 4.46Å; Y446-M518 HydrophobicContact CD2-CE 4.39Å; Y446-M518 HydrophobicContact CE1-CE 3.88Å; Y446-M518 HydrophobicContact CE2-CE 3.77Å; Y446-M518 VanDerWaalsContact CZ-CE 3.49Å; M518-T729 HydrophobicContact CG-CG2 4.1Å; M518-T729 HydrophobicContact SD-CG2 3.47Å; M518-T729 WeakPolarHBondContact SD-CG2 3.45Å; M518-G753 WeakPolarHBondContact O-CA 3.48Å; M518-Y754 HydrophobicContact CB-CD2 4.42Å; M518-Y754 PolarHBondContact O-N 2.9Å; M518-Y754 HydrophobicContact SD-CD2 4.47Å; M518-K785 HydrophobicContact CE-CB 4.41Å; M518-K785 HydrophobicContact CE-CD 4.31Å; M518-K785 HydrophobicContact CE-CG 4.2Å; M518-W789 HydrophobicContact CE-CH2 4.24Å; M518-W789 HydrophobicContact CE-CZ3 4.37Å
519	S	93.1	Very high	93	Very high	99 Å²	99	32 Å²	32	69%	0.692	17%	0.169	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85	139	174.1	-57.7	0	0	0	0	111.1
520	L	93.2	Very high	92.1	Very high	4 Å²	4	35 Å²	35	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	176	-177.3	62.8	95.7	0	0	0	111	E727 T729 K752 Y754	L520-E727 HydrophobicContact CD1-CB 4.03Å; L520-E727 HydrophobicContact CD1-CG 3.75Å; L520-T729 HydrophobicContact CB-CG2 3.79Å; L520-T729 HydrophobicContact CD2-CG2 4.2Å; L520-K752 HydrophobicContact CD1-CB 3.72Å; L520-K752 HydrophobicContact CD1-CD 4.43Å; L520-K752 HydrophobicContact CG-CB 4.23Å; L520-K752 PolarHBondContact N-O 3.28Å; L520-K752 CarbonylContact O-C 3.47Å; L520-K752 WeakPolarHBondContact O-CA 3.43Å; L520-K752 PolarHBondContact O-N 2.95Å; L520-Y754 HydrophobicContact CD2-CD1 3.61Å; L520-Y754 HydrophobicContact CD2-CD2 3.46Å; L520-Y754 VanDerWaalsContact CD2-CD2 3.46Å; L520-Y754 HydrophobicContact CD2-CE1 3.41Å; L520-Y754 VanDerWaalsContact CD2-CE1 3.41Å; L520-Y754 HydrophobicContact CD2-CE2 3.25Å; L520-Y754 HydrophobicContact CD2-CG 3.63Å
521	G	93.6	Very high	90.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.198	C	C	.	.			trans	-158.6	175.9	166.8	0	0	0	0	0	111	S523 E727 S728 N748 D750	G521-S523 PolarHBondContact O-N 3.27Å; G521-E727 CarbonylContact O-C 3.51Å; G521-E727 WeakPolarHBondContact O-CA 3.43Å; G521-S728 PolarHBondContact N-OG 3.47Å; G521-S728 WeakPolarHBondContact O-CB 3.44Å; G521-S728 PolarHBondContact O-N 2.88Å; G521-N748 PolarHBondContact N-ND2 2.99Å; G521-D750 WeakPolarHBondContact CA-O 3.36Å; G521-D750 WeakPolarHBondContact CA-OD1 3.3Å
522	I	94.3	Very high	89	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	132.2	172.8	-57.2	164.6	0	0	0	107.6	T677 F680 F681 L725 N748 L749 D750	I522-T677 HydrophobicContact CD1-CG2 3.86Å; I522-T677 HydrophobicContact CG1-CG2 3.92Å; I522-T677 HydrophobicContact CG2-CG2 3.95Å; I522-F680 HydrophobicContact CD1-CB 4.22Å; I522-F680 HydrophobicContact CD1-CD1 3.29Å; I522-F680 HydrophobicContact CD1-CD2 4.37Å; I522-F680 HydrophobicContact CD1-CE1 3.63Å; I522-F680 HydrophobicContact CD1-CG 3.71Å; I522-F680 HydrophobicContact CD1-CZ 4.3Å; I522-F681 HydrophobicContact CD1-CE2 4.29Å; I522-F681 HydrophobicContact CG2-CE2 4.43Å; I522-L725 HydrophobicContact CG2-CB 4.37Å; I522-N748 CarbonylContact O-C 3.55Å; I522-N748 VanDerWaalsContact O-CA 3.29Å; I522-N748 WeakPolarHBondContact O-CA 3.38Å; I522-L749 HydrophobicContact CB-CB 4.21Å; I522-L749 HydrophobicContact CG2-CD1 4.36Å; I522-L749 HydrophobicContact CG2-CD2 4.33Å; I522-L749 VanDerWaalsContact O-CD1 3.23Å; I522-L749 WeakPolarHBondContact O-CD1 3.48Å; I522-L749 PolarHBondContact O-N 2.9Å; I522-D750 WeakPolarHBondContact CD1-OD2 3.27Å; I522-D750 PolarHBondContact N-OD1 3.47Å
523	S	94.8	Very high	87.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	161.5	179.3	70.7	0	0	0	0	110.4	G521 L725 L726 S728 N731	G521-S523 PolarHBondContact O-N 3.27Å; S523-L725 WeakPolarHBondContact O-CA 3.21Å; S523-L726 PolarHBondContact N-O 3.4Å; S523-L726 PolarHBondContact O-N 2.74Å; S523-L726 VanDerWaalsContact O-N 3.16Å; S523-L726 VanDerWaalsContact O-O 3.12Å; S523-L726 PolarHBondContact OG-O 3Å; S523-S728 WeakPolarHBondContact OG-CA 3.49Å; S523-N731 VanDerWaalsContact OG-CB 3.28Å; S523-N731 WeakPolarHBondContact OG-CB 3.37Å; S523-N731 PolarHBondContact OG-ND2 3.19Å
524	I	95	Very high	85.8	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	121.6	-179.9	-54	165.8	0	0	0	108	I526 A658 L661 A723 L725 N731 K744 V745 L749	I524-I526 HydrophobicContact CG2-CG2 4.1Å; I524-A658 HydrophobicContact CD1-CB 4.13Å; I524-L661 HydrophobicContact CD1-CD1 3.84Å; I524-L661 HydrophobicContact CG1-CD1 4.19Å; I524-L661 HydrophobicContact CG2-CD1 3.86Å; I524-A723 HydrophobicContact CG2-CB 4.16Å; I524-L725 HydrophobicContact CB-CD2 4.33Å; I524-L725 HydrophobicContact CG1-CD2 3.68Å; I524-L725 HydrophobicContact CG2-CD2 4.44Å; I524-N731 PolarHBondContact O-ND2 3.37Å; I524-N731 VanDerWaalsContact O-ND2 3.08Å; I524-K744 WeakPolarHBondContact O-CA 3.27Å; I524-V745 HydrophobicContact CB-CG2 3.7Å; I524-V745 HydrophobicContact CG2-CG2 3.6Å; I524-V745 PolarHBondContact O-N 2.93Å; I524-V745 VanDerWaalsContact O-N 3.1Å; I524-L749 HydrophobicContact CD1-CD1 4.41Å; I524-L749 HydrophobicContact CG1-CD1 4.12Å
525	M	94.3	Very high	84.4	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	125.1	170.4	178.8	-175.2	-74.9	0	0	109.6	V712 V715 A723 F724 L726 N731 I734 T742	M525-V712 HydrophobicContact CE-CG2 4.22Å; M525-V712 HydrophobicContact SD-CG2 3.98Å; M525-V715 HydrophobicContact CG-CG1 4.49Å; M525-A723 WeakPolarHBondContact O-CA 3.21Å; M525-F724 WeakPolarHBondContact CB-O 3.35Å; M525-F724 PolarHBondContact N-O 3Å; M525-F724 PolarHBondContact O-N 2.89Å; M525-L726 HydrophobicContact CB-CD2 3.5Å; M525-L726 VanDerWaalsContact CB-CD2 3.5Å; M525-L726 HydrophobicContact CE-CD1 3.9Å; M525-L726 HydrophobicContact CE-CD2 4.04Å; M525-L726 HydrophobicContact CG-CD2 4.5Å; M525-L726 HydrophobicContact SD-CD2 4.35Å; M525-N731 HydrophobicContact CE-CB 4.28Å; M525-N731 VanDerWaalsContact CE-OD1 3.26Å; M525-N731 WeakPolarHBondContact CE-OD1 3.41Å; M525-I734 HydrophobicContact CE-CB 3.66Å; M525-I734 HydrophobicContact CE-CG1 4.2Å; M525-I734 HydrophobicContact CE-CG2 3.65Å; M525-I734 HydrophobicContact SD-CG2 4.32Å; M525-T742 HydrophobicContact CG-CG2 4.23Å; M525-T742 HydrophobicContact SD-CG2 3.95Å
526	I	93.3	Very high	83.4	Confident	8 Å²	8	52.4 Å²	52.4	4%	0.041	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	166	170	64.3	169.1	0	0	0	110.2	I524 I655 A723 T742 M743 V745	I524-I526 HydrophobicContact CG2-CG2 4.1Å; I526-I655 HydrophobicContact CG2-CD1 4.48Å; I526-A723 HydrophobicContact CG2-CB 3.9Å; I526-T742 CarbonylContact O-C 3.53Å; I526-T742 WeakPolarHBondContact O-CA 3.18Å; I526-M743 HydrophobicContact CD1-CG 4.13Å; I526-M743 HydrophobicContact CD1-SD 4.15Å; I526-M743 HydrophobicContact CG1-CG 3.6Å; I526-M743 HydrophobicContact CG1-SD 4.27Å; I526-M743 PolarHBondContact N-O 2.86Å; I526-M743 VanDerWaalsContact N-O 3.12Å; I526-M743 PolarHBondContact O-N 2.91Å; I526-V745 HydrophobicContact CD1-CG1 3.47Å; I526-V745 VanDerWaalsContact CD1-CG1 3.47Å; I526-V745 HydrophobicContact CD1-CG2 4.31Å; I526-V745 HydrophobicContact CG1-CG1 3.79Å; I526-V745 HydrophobicContact CG1-CG2 4.28Å; I526-V745 HydrophobicContact CG2-CG2 4.16Å
527	K	91.1	Very high	82.5	Confident	49 Å²	49	54.7 Å²	54.7	21%	0.213	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	129.9	168.1	-169.3	174.4	-174	164.1	0	108.8	V715 R716 D741	K527-V715 HydrophobicContact CB-CG1 4.19Å; K527-R716 PolarHBondContact NZ-O 3.38Å; K527-D741 CarbonylContact C-O 3.56Å; K527-D741 WeakPolarHBondContact CA-O 3.38Å; K527-D741 WeakPolarHBondContact CG-O 3.38Å
528	K	87	Confident	81.6	Confident	92 Å²	92	54.7 Å²	54.7	40%	0.4	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-57.1	123.2	173.8	-170.2	171.7	-175.2	170.8	0	108.7	Q530 D741 M743	K528-Q530 PolarHBondContact O-N 3.23Å; K528-D741 PolarHBondContact N-O 2.94Å; K528-M743 HydrophobicContact CB-CB 4.45Å; K528-M743 HydrophobicContact CB-CG 4.38Å; K528-M743 HydrophobicContact CB-SD 4.44Å; K528-M743 HydrophobicContact CG-SD 4.28Å
529	P	80	Confident	80.9	Confident	36 Å²	36	55.9 Å²	55.9	23%	0.234	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-62.6	135.6	-179.3	25.2	-31.8	0	0	0	108.9	M651 M743	P529-M651 HydrophobicContact CG-CB 4.43Å; P529-M743 WeakPolarHBondContact CD-SD 3.42Å
530	Q	69.2	Low	80.5	Confident	171 Å²	171	54.3 Å²	54.3	80%	0.799	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-73.1	147	168.4	-68.1	-172.3	-31.3	0	0	108.4	K528 S532	K528-Q530 PolarHBondContact O-N 3.23Å; Q530-S532 PolarHBondContact O-N 2.95Å
531	K	65.2	Low	80.1	Confident	125 Å²	125	58.6 Å²	58.6	54%	0.543	31%	0.305	S	S	.	.			trans	-50.3	114.4	171.6	-66.3	178.8	157.7	-151.5	0	108.4	K533 E649 M651	K531-K533 PolarHBondContact O-N 2.99Å; K531-E649 VanDerWaalsContact CD-OE2 3.3Å; K531-E649 WeakPolarHBondContact CD-OE2 3.25Å; K531-E649 WeakPolarHBondContact CE-OE2 3.46Å; K531-E649 IonicContact NZ-OE2 3.65Å; K531-E649 PolarHBondContact NZ-OE2 3.3Å; K531-M651 HydrophobicContact CG-CE 4.48Å
532	S	57.6	Low	79.8	Confident	100 Å²	100	59.2 Å²	59.2	70%	0.699	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-62.1	126.7	178.7	47.8	0	0	0	0	107.8	Q530	Q530-S532 PolarHBondContact O-N 2.95Å
533	K	58.9	Low	79.5	Confident	183 Å²	183	59.9 Å²	59.9	80%	0.796	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-59.6	126	169.6	-66.2	-177.5	-179.4	-179.3	0	106.8	K531 G535	K531-K533 PolarHBondContact O-N 2.99Å; K533-G535 PolarHBondContact O-N 3.4Å
534	P	64.6	Low	79.3	Confident	38 Å²	38	62.2 Å²	62.2	25%	0.247	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-54.9	141.4	177.2	21	-31.3	0	0	0	109.6	N813	P534-N813 WeakPolarHBondContact CG-OD1 3.44Å
535	G	66.6	Low	79	Confident	46 Å²	46	70.1 Å²	70.1	47%	0.474	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-63.4	162.2	179	0	0	0	0	0	111.5	K533 F537 S538	K533-G535 PolarHBondContact O-N 3.4Å; G535-F537 PolarHBondContact O-N 3.23Å; G535-S538 VanDerWaalsContact O-CB 3.28Å; G535-S538 WeakPolarHBondContact O-CB 3.44Å; G535-S538 PolarHBondContact O-N 3.42Å; G535-S538 PolarHBondContact O-OG 3.28Å
536	V	74.5	Confident	78.9	Confident	60 Å²	60	76.2 Å²	76.2	36%	0.364	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-27.8	179.6	175.8	0	0	0	0	112.7	G816 Y819	V536-G816 VanDerWaalsContact O-CA 3.28Å; V536-G816 WeakPolarHBondContact O-CA 3.12Å; V536-G816 PolarHBondContact O-N 3.11Å; V536-Y819 HydrophobicContact CG1-CD2 3.57Å; V536-Y819 HydrophobicContact CG1-CE2 3.54Å
537	F	76.6	Confident	78.8	Confident	114 Å²	114	79.1 Å²	79.1	50%	0.5	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	19.8	178.7	-62.5	-68.5	0	0	0	113.9	G535 F539 L540	G535-F537 PolarHBondContact O-N 3.23Å; F537-F539 AromaticContact CD1-CE1 3.96Å; F537-F539 HydrophobicContact CD1-CE1 3.96Å; F537-F539 HydrophobicContact CD1-CZ 4.16Å; F537-F539 PolarHBondContact O-N 3.46Å; F537-L540 HydrophobicContact CB-CD1 4.23Å; F537-L540 WeakPolarHBondContact O-CB 3.37Å; F537-L540 PolarHBondContact O-N 3.1Å
538	S	76.6	Confident	78.8	Confident	12 Å²	12	80.5 Å²	80.5	8%	0.084	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.1	-177.2	66.7	0	0	0	0	114.6	G535 L540 D541	G535-S538 VanDerWaalsContact O-CB 3.28Å; G535-S538 WeakPolarHBondContact O-CB 3.44Å; G535-S538 PolarHBondContact O-N 3.42Å; G535-S538 PolarHBondContact O-OG 3.28Å; S538-L540 PolarHBondContact O-N 3.21Å; S538-D541 WeakPolarHBondContact CA-OD2 3.42Å; S538-D541 WeakPolarHBondContact O-CB 3.24Å; S538-D541 PolarHBondContact O-N 2.9Å
539	F	79.8	Confident	79	Confident	35 Å²	35	79.7 Å²	79.7	15%	0.154	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-13.8	173.3	69.8	-90.9	0	0	0	112.8	F537 P542 Y638 V817 I820	F537-F539 AromaticContact CD1-CE1 3.96Å; F537-F539 HydrophobicContact CD1-CE1 3.96Å; F537-F539 HydrophobicContact CD1-CZ 4.16Å; F537-F539 PolarHBondContact O-N 3.46Å; F539-P542 VanDerWaalsContact O-CD 3.26Å; F539-P542 WeakPolarHBondContact O-CD 3.27Å; F539-Y638 WeakPolarHBondContact O-CE2 3.37Å; F539-Y638 PolarHBondContact O-OH 3.47Å; F539-V817 HydrophobicContact CD1-CG2 4.04Å; F539-V817 HydrophobicContact CE1-CG2 4.19Å; F539-V817 HydrophobicContact CG-CG2 4.28Å; F539-I820 HydrophobicContact CE2-CD1 4.45Å; F539-I820 HydrophobicContact CZ-CD1 3.67Å
540	L	85.6	Confident	79.7	Confident	67 Å²	67	81.9 Å²	81.9	35%	0.351	42%	0.424	S	S	.	.	S	Bend	trans	-84	-24.1	173.5	-63	177.3	0	0	0	112.8	F537 S538 L543 W548	F537-L540 HydrophobicContact CB-CD1 4.23Å; F537-L540 WeakPolarHBondContact O-CB 3.37Å; F537-L540 PolarHBondContact O-N 3.1Å; S538-L540 PolarHBondContact O-N 3.21Å; L540-L543 PolarHBondContact O-N 3.19Å; L540-W548 HydrophobicContact CD2-CH2 4.17Å; L540-W548 HydrophobicContact CD2-CZ2 3.66Å; L540-W548 PolarHBondContact O-NE1 3Å
541	D	83.8	Confident	80.8	Confident	94 Å²	94	74.3 Å²	74.3	50%	0.503	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-27	-176.8	-60.5	-16.6	0	0	0	116.1	S538 L543 F645	S538-D541 WeakPolarHBondContact CA-OD2 3.42Å; S538-D541 WeakPolarHBondContact O-CB 3.24Å; S538-D541 PolarHBondContact O-N 2.9Å; D541-L543 PolarHBondContact O-N 3.49Å; D541-L543 VanDerWaalsContact O-N 3.15Å; D541-F645 HydrophobicContact CB-CE1 4.44Å; D541-F645 HydrophobicContact CB-CE2 4.35Å; D541-F645 HydrophobicContact CB-CZ 4.04Å
542	P	87.2	Confident	82	Confident	12 Å²	12	72 Å²	72	8%	0.078	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-17.6	178.1	-25	35	0	0	0	115.1	F539 Y638 N641 L642	F539-P542 VanDerWaalsContact O-CD 3.26Å; F539-P542 WeakPolarHBondContact O-CD 3.27Å; P542-Y638 HydrophobicContact CB-CD2 4.13Å; P542-Y638 HydrophobicContact CB-CE2 4.15Å; P542-Y638 HydrophobicContact CG-CE2 4.09Å; P542-N641 HydrophobicContact CB-CB 3.94Å; P542-N641 PolarHBondContact O-ND2 3.18Å; P542-L642 HydrophobicContact CB-CB 4.43Å; P542-L642 HydrophobicContact CG-CB 4.05Å; P542-L642 HydrophobicContact CG-CD1 3.76Å
543	L	88.6	Confident	83.7	Confident	14 Å²	14	73.7 Å²	73.7	7%	0.073	38%	0.38	C	S	.	.	S	Bend	trans	-122.8	135.8	173	-70.8	175.5	0	0	0	109.2	L540 D541 I547 W548 I551 Y638	L540-L543 PolarHBondContact O-N 3.19Å; D541-L543 PolarHBondContact O-N 3.49Å; D541-L543 VanDerWaalsContact O-N 3.15Å; L543-I547 HydrophobicContact CD1-CG2 4.49Å; L543-I547 HydrophobicContact CD2-CD1 4.11Å; L543-I547 HydrophobicContact CD2-CG2 4.3Å; L543-W548 HydrophobicContact CD1-CZ2 4.31Å; L543-W548 PolarHBondContact O-NE1 3.48Å; L543-I551 HydrophobicContact CD1-CD1 4.35Å; L543-Y638 HydrophobicContact CD1-CD2 4.02Å; L543-Y638 HydrophobicContact CG-CD2 4.14Å
544	A	89.4	Confident	85.2	Confident	49 Å²	49	66.6 Å²	66.6	41%	0.405	36%	0.355	S	S	.	.			trans	-63.1	151.6	177.1	0	0	0	0	0	111.1	E546 I547 W548	A544-E546 VanDerWaalsContact CB-OE2 3.23Å; A544-E546 WeakPolarHBondContact CB-OE2 3.16Å; A544-E546 PolarHBondContact O-N 3.49Å; A544-I547 HydrophobicContact CB-CD1 4.29Å; A544-I547 HydrophobicContact CB-CG1 4.37Å; A544-I547 WeakPolarHBondContact O-CB 3.45Å; A544-I547 PolarHBondContact O-N 2.9Å; A544-W548 PolarHBondContact O-N 3Å
545	Y	89.1	Confident	86.5	Confident	168 Å²	168	66.7 Å²	66.7	66%	0.659	35%	0.351	S	S	*	.	H	α-helix	trans	-57.4	-34.8	-178	176.4	-103.2	0	0	0	112.5	I547 W548 M549	Y545-I547 VanDerWaalsContact C-N 3.3Å; Y545-I547 PolarHBondContact O-N 3.43Å; Y545-W548 WeakPolarHBondContact O-CB 3.48Å; Y545-W548 PolarHBondContact O-N 2.99Å; Y545-M549 HydrophobicContact CD1-CG 4.37Å; Y545-M549 HydrophobicContact CE1-CG 3.86Å; Y545-M549 HydrophobicContact CE1-SD 4.47Å; Y545-M549 HydrophobicContact CE2-CG 4.45Å; Y545-M549 PolarHBondContact O-N 3.34Å; Y545-M549 VanDerWaalsContact O-N 3.11Å
546	E	91.6	Very high	87.7	Confident	128 Å²	128	68.4 Å²	68.4	60%	0.598	35%	0.348	S	S	*	.	H	α-helix	trans	-61.7	-38.7	176.9	-58.7	78.2	-173.4	0	0	111.6	A544 M549 C550	A544-E546 VanDerWaalsContact CB-OE2 3.23Å; A544-E546 WeakPolarHBondContact CB-OE2 3.16Å; A544-E546 PolarHBondContact O-N 3.49Å; E546-M549 PolarHBondContact O-N 3.08Å; E546-C550 PolarHBondContact O-N 2.77Å; E546-C550 PolarHBondContact O-SG 3.44Å
547	I	92.7	Very high	88.5	Confident	68 Å²	68	67.2 Å²	67.2	35%	0.349	35%	0.348	S	S	.	.	H	α-helix	trans	-68.1	-41.2	178.6	-58.5	174.2	0	0	0	109.9	L543 A544 Y545 M549 C550 I551	L543-I547 HydrophobicContact CD1-CG2 4.49Å; L543-I547 HydrophobicContact CD2-CD1 4.11Å; L543-I547 HydrophobicContact CD2-CG2 4.3Å; A544-I547 HydrophobicContact CB-CD1 4.29Å; A544-I547 HydrophobicContact CB-CG1 4.37Å; A544-I547 WeakPolarHBondContact O-CB 3.45Å; A544-I547 PolarHBondContact O-N 2.9Å; Y545-I547 VanDerWaalsContact C-N 3.3Å; Y545-I547 PolarHBondContact O-N 3.43Å; I547-M549 VanDerWaalsContact C-N 3.32Å; I547-M549 PolarHBondContact O-N 3.38Å; I547-C550 PolarHBondContact O-N 2.92Å; I547-I551 HydrophobicContact CG2-CD1 3.95Å; I547-I551 HydrophobicContact CG2-CG1 4.36Å; I547-I551 VanDerWaalsContact O-CG1 3.3Å; I547-I551 WeakPolarHBondContact O-CG1 3.23Å; I547-I551 PolarHBondContact O-N 3.04Å
548	W	91.3	Very high	89.2	Confident	78 Å²	78	63.1 Å²	63.1	30%	0.295	33%	0.332	S	S	.	.	H	α-helix	trans	-58.2	-43.8	174.8	-76.5	110.4	0	0	0	112.1	L540 L543 A544 Y545 I551 V552	L540-W548 HydrophobicContact CD2-CH2 4.17Å; L540-W548 HydrophobicContact CD2-CZ2 3.66Å; L540-W548 PolarHBondContact O-NE1 3Å; L543-W548 HydrophobicContact CD1-CZ2 4.31Å; L543-W548 PolarHBondContact O-NE1 3.48Å; A544-W548 PolarHBondContact O-N 3Å; Y545-W548 WeakPolarHBondContact O-CB 3.48Å; Y545-W548 PolarHBondContact O-N 2.99Å; W548-I551 HydrophobicContact CE3-CD1 4.44Å; W548-I551 PolarHBondContact O-N 2.88Å; W548-V552 WeakPolarHBondContact O-CG2 3.44Å; W548-V552 PolarHBondContact O-N 3.25Å; W548-V552 VanDerWaalsContact O-N 3.14Å
549	M	90.9	Very high	89.8	Confident	75 Å²	75	62.8 Å²	62.8	37%	0.369	33%	0.33	S	S	.	.	H	α-helix	trans	-63.1	-43.6	175.6	-68.5	-62	-68.3	0	0	111.8	Y545 E546 I547 I551 V552 F553	Y545-M549 HydrophobicContact CD1-CG 4.37Å; Y545-M549 HydrophobicContact CE1-CG 3.86Å; Y545-M549 HydrophobicContact CE1-SD 4.47Å; Y545-M549 HydrophobicContact CE2-CG 4.45Å; Y545-M549 PolarHBondContact O-N 3.34Å; Y545-M549 VanDerWaalsContact O-N 3.11Å; E546-M549 PolarHBondContact O-N 3.08Å; I547-M549 VanDerWaalsContact C-N 3.32Å; I547-M549 PolarHBondContact O-N 3.38Å; M549-I551 VanDerWaalsContact C-N 3.34Å; M549-I551 PolarHBondContact O-N 3.2Å; M549-V552 PolarHBondContact O-N 2.97Å; M549-F553 HydrophobicContact CB-CE2 4.5Å; M549-F553 HydrophobicContact CE-CE2 4.15Å; M549-F553 HydrophobicContact CE-CZ 4.17Å; M549-F553 WeakPolarHBondContact O-CD2 3.16Å; M549-F553 PolarHBondContact O-N 3.08Å
550	C	93.4	Very high	90.2	Very high	83 Å²	83	64.6 Å²	64.6	56%	0.561	34%	0.344	S	S	*	.	H	α-helix	trans	-61.8	-38.9	175.7	-71.3	0	0	0	0	112.7	E546 I547 F553 A554	E546-C550 PolarHBondContact O-N 2.77Å; E546-C550 PolarHBondContact O-SG 3.44Å; I547-C550 PolarHBondContact O-N 2.92Å; C550-F553 PolarHBondContact O-N 3.42Å; C550-A554 VanDerWaalsContact O-CB 3.24Å; C550-A554 WeakPolarHBondContact O-CB 3.26Å; C550-A554 PolarHBondContact O-N 3.3Å
551	I	92.3	Very high	90.3	Very high	12 Å²	12	64.6 Å²	64.6	6%	0.062	35%	0.346	C	S	.	.	H	α-helix	trans	-62.2	-44.4	176.2	-70	164.8	0	0	0	110.5	L543 I547 W548 M549 A554 Y555 F606 I634	L543-I551 HydrophobicContact CD1-CD1 4.35Å; I547-I551 HydrophobicContact CG2-CD1 3.95Å; I547-I551 HydrophobicContact CG2-CG1 4.36Å; I547-I551 VanDerWaalsContact O-CG1 3.3Å; I547-I551 WeakPolarHBondContact O-CG1 3.23Å; I547-I551 PolarHBondContact O-N 3.04Å; W548-I551 HydrophobicContact CE3-CD1 4.44Å; W548-I551 PolarHBondContact O-N 2.88Å; M549-I551 VanDerWaalsContact C-N 3.34Å; M549-I551 PolarHBondContact O-N 3.2Å; I551-A554 PolarHBondContact O-N 3.12Å; I551-Y555 VanDerWaalsContact O-CB 3.27Å; I551-Y555 WeakPolarHBondContact O-CB 3.42Å; I551-Y555 PolarHBondContact O-N 3.33Å; I551-F606 HydrophobicContact CG2-CE2 3.84Å; I551-F606 HydrophobicContact CG2-CZ 3.87Å; I551-I634 HydrophobicContact CD1-CG2 3.84Å
552	V	91.4	Very high	90.4	Very high	75 Å²	75	60.1 Å²	60.1	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-63.9	-43.8	178.2	174.2	0	0	0	0	111.4	W548 M549 Y555 I556	W548-V552 WeakPolarHBondContact O-CG2 3.44Å; W548-V552 PolarHBondContact O-N 3.25Å; W548-V552 VanDerWaalsContact O-N 3.14Å; M549-V552 PolarHBondContact O-N 2.97Å; V552-Y555 PolarHBondContact O-N 3.45Å; V552-I556 HydrophobicContact CG1-CD1 4.21Å; V552-I556 WeakPolarHBondContact O-CG1 3.37Å; V552-I556 PolarHBondContact O-N 2.86Å; V552-I556 VanDerWaalsContact O-N 3.13Å
553	F	92.4	Very high	90.2	Very high	136 Å²	136	62.2 Å²	62.2	60%	0.596	33%	0.33	S	S	*	.	H	α-helix	trans	-65.8	-41.7	176.3	-70.1	-49.1	0	0	0	112.6	M549 C550 I556 G557	M549-F553 HydrophobicContact CB-CE2 4.5Å; M549-F553 HydrophobicContact CE-CE2 4.15Å; M549-F553 HydrophobicContact CE-CZ 4.17Å; M549-F553 WeakPolarHBondContact O-CD2 3.16Å; M549-F553 PolarHBondContact O-N 3.08Å; C550-F553 PolarHBondContact O-N 3.42Å; F553-I556 PolarHBondContact O-N 3.46Å; F553-G557 PolarHBondContact O-N 2.87Å
554	A	91.8	Very high	90	Very high	34 Å²	34	65.3 Å²	65.3	28%	0.281	35%	0.347	S	S	.	.	H	α-helix	trans	-64	-41.3	176.6	0	0	0	0	0	111.5	C550 I551 G557 V558 W627 F630	C550-A554 VanDerWaalsContact O-CB 3.24Å; C550-A554 WeakPolarHBondContact O-CB 3.26Å; C550-A554 PolarHBondContact O-N 3.3Å; I551-A554 PolarHBondContact O-N 3.12Å; A554-G557 PolarHBondContact O-N 2.82Å; A554-V558 WeakPolarHBondContact O-CB 3.12Å; A554-V558 VanDerWaalsContact O-CG2 3.28Å; A554-V558 WeakPolarHBondContact O-CG2 3.19Å; A554-V558 PolarHBondContact O-N 2.8Å; A554-W627 HydrophobicContact CB-CZ3 4.17Å; A554-F630 HydrophobicContact CB-CE1 4.5Å
555	Y	91.5	Very high	89.7	Confident	41 Å²	41	64.7 Å²	64.7	16%	0.161	34%	0.337	C	S	.	.	H	α-helix	trans	-56.1	-56	174.7	165.3	-110.8	0	0	0	111.6	I551 V552 G557 V558 S559 L599 S602 L603 W627	I551-Y555 VanDerWaalsContact O-CB 3.27Å; I551-Y555 WeakPolarHBondContact O-CB 3.42Å; I551-Y555 PolarHBondContact O-N 3.33Å; V552-Y555 PolarHBondContact O-N 3.45Å; Y555-G557 VanDerWaalsContact C-N 3.32Å; Y555-G557 PolarHBondContact O-N 2.85Å; Y555-V558 PolarHBondContact O-N 2.84Å; Y555-S559 PolarHBondContact O-N 2.78Å; Y555-S559 PolarHBondContact O-OG 2.73Å; Y555-L599 HydrophobicContact CE1-CD1 4.23Å; Y555-L599 HydrophobicContact CE1-CD2 4.49Å; Y555-L599 HydrophobicContact CE1-CG 4.21Å; Y555-L599 WeakPolarHBondContact OH-CD2 3.31Å; Y555-L599 WeakPolarHBondContact OH-CG 3.38Å; Y555-L599 PolarHBondContact OH-O 2.99Å; Y555-S602 WeakPolarHBondContact CE2-OG 3.22Å; Y555-L603 HydrophobicContact CE2-CB 3.9Å; Y555-L603 HydrophobicContact CE2-CD1 4.33Å; Y555-W627 HydrophobicContact CD2-CZ2 4.31Å
556	I	91.6	Very high	89.1	Confident	82 Å²	82	56.7 Å²	56.7	42%	0.421	31%	0.306	S	S	.	.	H	α-helix	trans	-61.1	-43.7	179	-63	169.3	0	0	0	110.6	V552 F553 V558 S559 V560	V552-I556 HydrophobicContact CG1-CD1 4.21Å; V552-I556 WeakPolarHBondContact O-CG1 3.37Å; V552-I556 PolarHBondContact O-N 2.86Å; V552-I556 VanDerWaalsContact O-N 3.13Å; F553-I556 PolarHBondContact O-N 3.46Å; I556-V558 PolarHBondContact O-N 2.56Å; I556-S559 PolarHBondContact O-N 2.86Å; I556-V560 HydrophobicContact CG2-CG2 4.4Å; I556-V560 WeakPolarHBondContact O-CG2 3.49Å; I556-V560 PolarHBondContact O-N 3.41Å
557	G	91.1	Very high	88.3	Confident	34 Å²	34	55 Å²	55	35%	0.351	29%	0.294	S	S	.	.	H	α-helix	trans	-58.5	-45.9	178.6	0	0	0	0	0	112.4	F553 A554 Y555 V560 V561	F553-G557 PolarHBondContact O-N 2.87Å; A554-G557 PolarHBondContact O-N 2.82Å; Y555-G557 VanDerWaalsContact C-N 3.32Å; Y555-G557 PolarHBondContact O-N 2.85Å; G557-V560 PolarHBondContact O-N 3.08Å; G557-V561 VanDerWaalsContact O-CG2 3.28Å; G557-V561 WeakPolarHBondContact O-CG2 3.24Å; G557-V561 PolarHBondContact O-N 3.36Å
558	V	90.5	Very high	87.4	Confident	28 Å²	28	59.2 Å²	59.2	17%	0.17	31%	0.31	C	S	.	.	H	α-helix	trans	-67.4	-40.8	177.6	170.7	0	0	0	0	111.5	A554 Y555 I556 V560 V561 L562 V623 W627	A554-V558 WeakPolarHBondContact O-CB 3.12Å; A554-V558 VanDerWaalsContact O-CG2 3.28Å; A554-V558 WeakPolarHBondContact O-CG2 3.19Å; A554-V558 PolarHBondContact O-N 2.8Å; Y555-V558 PolarHBondContact O-N 2.84Å; I556-V558 PolarHBondContact O-N 2.56Å; V558-V560 VanDerWaalsContact C-N 3.31Å; V558-V560 PolarHBondContact O-N 3.24Å; V558-V561 PolarHBondContact O-N 3.5Å; V558-L562 HydrophobicContact CG1-CD1 3.95Å; V558-L562 HydrophobicContact CG1-CG 4.43Å; V558-L562 WeakPolarHBondContact O-CB 2.78Å; V558-L562 WeakPolarHBondContact O-CG 3.28Å; V558-L562 PolarHBondContact O-N 3.25Å; V558-V623 HydrophobicContact CG1-CG1 4.22Å; V558-W627 HydrophobicContact CB-CD2 4.36Å; V558-W627 HydrophobicContact CB-CE3 4.14Å; V558-W627 HydrophobicContact CB-CZ3 4.44Å; V558-W627 HydrophobicContact CG1-CB 4.13Å; V558-W627 HydrophobicContact CG1-CD2 3.97Å; V558-W627 HydrophobicContact CG1-CE3 4.2Å; V558-W627 HydrophobicContact CG1-CG 3.96Å; V558-W627 HydrophobicContact CG2-CD2 4.28Å; V558-W627 HydrophobicContact CG2-CE3 3.64Å; V558-W627 HydrophobicContact CG2-CZ3 4Å
559	S	89	Confident	86.5	Confident	5 Å²	5	56.2 Å²	56.2	4%	0.035	30%	0.301	C	S	.	.	H	α-helix	trans	-59.8	-41.9	175.1	-45.4	0	0	0	0	111.9	Y555 I556 F563 S602	Y555-S559 PolarHBondContact O-N 2.78Å; Y555-S559 PolarHBondContact O-OG 2.73Å; I556-S559 PolarHBondContact O-N 2.86Å; S559-F563 WeakPolarHBondContact O-CB 3.27Å; S559-F563 PolarHBondContact O-N 3.48Å; S559-S602 PolarHBondContact OG-OG 2.76Å
560	V	88.8	Confident	85.3	Confident	73 Å²	73	56.8 Å²	56.8	44%	0.442	31%	0.31	S	S	.	.	H	α-helix	trans	-69	-44.2	178.3	172.2	0	0	0	0	111.2	I556 G557 V558 F563 L564	I556-V560 HydrophobicContact CG2-CG2 4.4Å; I556-V560 WeakPolarHBondContact O-CG2 3.49Å; I556-V560 PolarHBondContact O-N 3.41Å; G557-V560 PolarHBondContact O-N 3.08Å; V558-V560 VanDerWaalsContact C-N 3.31Å; V558-V560 PolarHBondContact O-N 3.24Å; V560-F563 PolarHBondContact O-N 3.1Å; V560-L564 HydrophobicContact CG1-CD1 4.03Å; V560-L564 HydrophobicContact CG1-CG 4.39Å; V560-L564 VanDerWaalsContact O-CG 3.31Å; V560-L564 WeakPolarHBondContact O-CG 3.47Å; V560-L564 PolarHBondContact O-N 3.5Å
561	V	88.4	Confident	83.9	Confident	67 Å²	67	62 Å²	62	41%	0.406	32%	0.32	S	S	.	.	H	α-helix	trans	-62.5	-44.3	177.3	170.7	0	0	0	0	110.8	G557 V558 L564 V565 V623	G557-V561 VanDerWaalsContact O-CG2 3.28Å; G557-V561 WeakPolarHBondContact O-CG2 3.24Å; G557-V561 PolarHBondContact O-N 3.36Å; V558-V561 PolarHBondContact O-N 3.5Å; V561-L564 PolarHBondContact O-N 2.72Å; V561-V565 HydrophobicContact CG1-CG2 4.23Å; V561-V565 WeakPolarHBondContact O-CB 3.39Å; V561-V565 VanDerWaalsContact O-CG2 3.25Å; V561-V565 WeakPolarHBondContact O-CG2 3.47Å; V561-V565 PolarHBondContact O-N 3.08Å; V561-V623 HydrophobicContact CG1-CG1 4.17Å; V561-V623 HydrophobicContact CG1-CG2 3.98Å
562	L	84.4	Confident	82.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.1	-46.7	174	-80.3	169.9	0	0	0	111.3	V558 L564 V565 S566 F601 V623	V558-L562 HydrophobicContact CG1-CD1 3.95Å; V558-L562 HydrophobicContact CG1-CG 4.43Å; V558-L562 WeakPolarHBondContact O-CB 2.78Å; V558-L562 WeakPolarHBondContact O-CG 3.28Å; V558-L562 PolarHBondContact O-N 3.25Å; L562-L564 VanDerWaalsContact C-N 3.34Å; L562-L564 PolarHBondContact O-N 2.96Å; L562-V565 PolarHBondContact O-N 2.75Å; L562-S566 VanDerWaalsContact O-CB 3.26Å; L562-S566 WeakPolarHBondContact O-CB 3.28Å; L562-S566 PolarHBondContact O-N 3.01Å; L562-S566 PolarHBondContact O-OG 2.74Å; L562-F601 HydrophobicContact CD1-CD1 3.68Å; L562-F601 HydrophobicContact CD1-CE1 3.85Å; L562-V623 HydrophobicContact CD1-CG1 4.45Å; L562-V623 HydrophobicContact CD2-CB 3.92Å; L562-V623 HydrophobicContact CD2-CG1 3.75Å; L562-V623 HydrophobicContact CG-CB 4.42Å; L562-V623 HydrophobicContact CG-CG1 3.69Å
563	F	84.9	Confident	81.3	Confident	57 Å²	57	63.4 Å²	63.4	25%	0.25	32%	0.317	C	S	.	.	H	α-helix	trans	-57.1	-44.9	176.7	170.7	-107.2	0	0	0	112.7	S559 V560 R567 I595	S559-F563 WeakPolarHBondContact O-CB 3.27Å; S559-F563 PolarHBondContact O-N 3.48Å; V560-F563 PolarHBondContact O-N 3.1Å; F563-R567 PolarHBondContact O-N 3.28Å; F563-I595 HydrophobicContact CD1-CG1 4.02Å; F563-I595 HydrophobicContact CD2-CB 4.4Å; F563-I595 HydrophobicContact CD2-CG1 3.62Å; F563-I595 HydrophobicContact CE1-CD1 4.22Å; F563-I595 HydrophobicContact CE1-CG1 3.81Å; F563-I595 HydrophobicContact CE2-CB 4.49Å; F563-I595 HydrophobicContact CE2-CD1 4.27Å; F563-I595 HydrophobicContact CE2-CG1 3.41Å; F563-I595 VanDerWaalsContact CE2-CG1 3.41Å; F563-I595 HydrophobicContact CG-CG1 3.92Å; F563-I595 HydrophobicContact CZ-CD1 3.93Å; F563-I595 HydrophobicContact CZ-CG1 3.5Å; F563-I595 VanDerWaalsContact CZ-CG1 3.5Å
564	L	83.4	Confident	79.7	Confident	79 Å²	79	59.3 Å²	59.3	41%	0.414	30%	0.299	S	S	.	.	H	α-helix	trans	-66	-50	178.2	-68.4	172.2	0	0	0	111.4	V560 V561 L562 S566 R567 F568	V560-L564 HydrophobicContact CG1-CD1 4.03Å; V560-L564 HydrophobicContact CG1-CG 4.39Å; V560-L564 VanDerWaalsContact O-CG 3.31Å; V560-L564 WeakPolarHBondContact O-CG 3.47Å; V560-L564 PolarHBondContact O-N 3.5Å; V561-L564 PolarHBondContact O-N 2.72Å; L562-L564 VanDerWaalsContact C-N 3.34Å; L562-L564 PolarHBondContact O-N 2.96Å; L564-S566 VanDerWaalsContact C-N 3.26Å; L564-S566 PolarHBondContact O-N 3.2Å; L564-R567 PolarHBondContact O-N 3.28Å; L564-R567 VanDerWaalsContact O-N 3.1Å; L564-F568 HydrophobicContact CB-CD2 4.43Å; L564-F568 HydrophobicContact CD2-CE2 4.14Å; L564-F568 WeakPolarHBondContact O-CD2 3.38Å; L564-F568 PolarHBondContact O-N 3.45Å
565	V	83.8	Confident	77.5	Confident	35 Å²	35	64.3 Å²	64.3	21%	0.212	33%	0.327	C	S	.	.	H	α-helix	trans	-59.3	-41	179.7	171	0	0	0	0	110.6	V561 L562 R567 F568 S569	V561-V565 HydrophobicContact CG1-CG2 4.23Å; V561-V565 WeakPolarHBondContact O-CB 3.39Å; V561-V565 VanDerWaalsContact O-CG2 3.25Å; V561-V565 WeakPolarHBondContact O-CG2 3.47Å; V561-V565 PolarHBondContact O-N 3.08Å; L562-V565 PolarHBondContact O-N 2.75Å; V565-R567 VanDerWaalsContact C-N 3.34Å; V565-R567 PolarHBondContact O-N 3.35Å; V565-F568 PolarHBondContact O-N 2.92Å; V565-S569 WeakPolarHBondContact O-CB 3.28Å; V565-S569 PolarHBondContact O-N 2.88Å
566	S	75.9	Confident	75.3	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-66.2	-35	177.1	-67.2	0	0	0	0	113.2	L562 L564 E572 N591	L562-S566 VanDerWaalsContact O-CB 3.26Å; L562-S566 WeakPolarHBondContact O-CB 3.28Å; L562-S566 PolarHBondContact O-N 3.01Å; L562-S566 PolarHBondContact O-OG 2.74Å; L564-S566 VanDerWaalsContact C-N 3.26Å; L564-S566 PolarHBondContact O-N 3.2Å; S566-E572 WeakPolarHBondContact CA-OE2 3.23Å; S566-E572 WeakPolarHBondContact CB-OE2 3.31Å; S566-E572 PolarHBondContact OG-OE2 3.16Å; S566-N591 VanDerWaalsContact C-ND2 3.32Å; S566-N591 PolarHBondContact O-ND2 2.98Å
567	R	74.9	Confident	72.9	Confident	93 Å²	93	75 Å²	75	35%	0.351	38%	0.376	S	S	.	.	H	α-helix	trans	-73.4	-36	177.2	-167.4	64.2	175.3	107.4	-7.2	112.9	F563 L564 V565 W573	F563-R567 PolarHBondContact O-N 3.28Å; L564-R567 PolarHBondContact O-N 3.28Å; L564-R567 VanDerWaalsContact O-N 3.1Å; V565-R567 VanDerWaalsContact C-N 3.34Å; V565-R567 PolarHBondContact O-N 3.35Å; R567-W573 WeakPolarHBondContact O-CZ2 3.42Å; R567-W573 PolarHBondContact O-NE1 2.85Å
568	F	73.4	Confident	70.6	Confident	157 Å²	157	79.4 Å²	79.4	69%	0.689	40%	0.399	S	S	*	.	H	α-helix	trans	-91	-21.5	-174.8	-73	-66.2	0	0	0	114.7	L564 V565 P570	L564-F568 HydrophobicContact CB-CD2 4.43Å; L564-F568 HydrophobicContact CD2-CE2 4.14Å; L564-F568 WeakPolarHBondContact O-CD2 3.38Å; L564-F568 PolarHBondContact O-N 3.45Å; V565-F568 PolarHBondContact O-N 2.92Å; F568-P570 VanDerWaalsContact O-CD 3.31Å; F568-P570 WeakPolarHBondContact O-CD 3.37Å
569	S	72.5	Confident	68.3	Low	14 Å²	14	87.3 Å²	87.3	10%	0.098	43%	0.434	C	S	.	.			trans	-80.9	115.7	-179.4	-172.7	0	0	0	0	111.1	V565 Y571 E572 S617	V565-S569 WeakPolarHBondContact O-CB 3.28Å; V565-S569 PolarHBondContact O-N 2.88Å; S569-Y571 PolarHBondContact O-N 3.01Å; S569-Y571 VanDerWaalsContact O-N 3.17Å; S569-E572 PolarHBondContact O-N 3.47Å; S569-S617 WeakPolarHBondContact OG-CB 3.18Å
570	P	64.9	Low	66.1	Low	87 Å²	87	94.6 Å²	94.6	57%	0.565	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-63.5	-23.1	-178.8	-20.8	33.2	0	0	0	113.3	F568 E572 W573	F568-P570 VanDerWaalsContact O-CD 3.31Å; F568-P570 WeakPolarHBondContact O-CD 3.37Å; P570-E572 PolarHBondContact O-N 2.97Å; P570-W573 PolarHBondContact O-N 3.4Å
571	Y	64.1	Low	64.1	Low	193 Å²	193	94.9 Å²	94.9	76%	0.757	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-77.7	-4.7	-178	-58.4	-73.5	0	0	0	114.1	S569	S569-Y571 PolarHBondContact O-N 3.01Å; S569-Y571 VanDerWaalsContact O-N 3.17Å
572	E	64	Low	61.8	Low	15 Å²	15	101.3 Å²	101.3	7%	0.07	51%	0.513	C	S	.	.	G	3₁₀ helix	trans	-101.9	-2.1	175	-89.8	177.2	-154.2	0	0	113.4	S566 S569 P570 R616 S617	S566-E572 WeakPolarHBondContact CA-OE2 3.23Å; S566-E572 WeakPolarHBondContact CB-OE2 3.31Å; S566-E572 PolarHBondContact OG-OE2 3.16Å; S569-E572 PolarHBondContact O-N 3.47Å; P570-E572 PolarHBondContact O-N 2.97Å; E572-R616 HydrophobicContact CG-CB 4.29Å; E572-S617 WeakPolarHBondContact OE1-CB 3.39Å; E572-S617 PolarHBondContact OE1-N 3.15Å; E572-S617 VanDerWaalsContact OE1-N 3.1Å; E572-S617 PolarHBondContact OE1-OG 3.28Å
573	W	66	Low	59.6	Low	102 Å²	102	111.3 Å²	111.3	39%	0.386	56%	0.559	S	S	.	*	S	Bend	trans	-83.9	128.7	177.1	-62.4	-0.9	0	0	0	110	R567 P570 T575 P589	R567-W573 WeakPolarHBondContact O-CZ2 3.42Å; R567-W573 PolarHBondContact O-NE1 2.85Å; P570-W573 PolarHBondContact O-N 3.4Å; W573-T575 PolarHBondContact O-N 3.32Å; W573-P589 HydrophobicContact CB-CB 3.99Å; W573-P589 HydrophobicContact CB-CG 3.72Å; W573-P589 HydrophobicContact CD2-CG 3.71Å; W573-P589 HydrophobicContact CE3-CG 3.83Å; W573-P589 HydrophobicContact CG-CB 4.44Å; W573-P589 HydrophobicContact CG-CG 3.67Å
574	H	58	Low	57.3	Low	50 Å²	50	111.2 Å²	111.2	23%	0.231	57%	0.574	C	S	.	*			trans	-71	106.7	169	-79.7	-72.2	0	0	0	108.9	E576 P590 E592 R616	H574-E576 PolarHBondContact O-N 3.42Å; H574-P590 HydrophobicContact CB-CG 4.15Å; H574-P590 PolarHBondContact CD2-O 3.34Å; H574-E592 IonicContact CD2-OE1 3.79Å; H574-E592 IonicContact CE1-OE1 3.14Å; H574-E592 IonicContact NE2-OE1 3.43Å; H574-E592 PolarHBondContact NE2-OE1 3.25Å; H574-R616 PolarHBondContact CE1-NH1 3.34Å; H574-R616 VanDerWaalsContact CE1-NH1 3.32Å
575	T	46.5	Very low	55.4	Low	139 Å²	139	113.9 Å²	113.9	85%	0.853	60%	0.596	S	S	*	*			trans	-83.9	91.6	153.4	24.7	0	0	0	0	107.2	W573	W573-T575 PolarHBondContact O-N 3.32Å
576	E	45.7	Very low	53.4	Low	160 Å²	160	117.3 Å²	117.3	75%	0.748	62%	0.622	S	S	*	*			trans	-71.4	124	157.8	-69.5	-173.9	164.9	0	0	107.3	H574	H574-E576 PolarHBondContact O-N 3.42Å
577	E	41	Very low	51.9	Low	187 Å²	187	125.1 Å²	125.1	87%	0.874	66%	0.664	S	S	*	*			trans	-64.6	128	159.8	-73.5	-176.9	164.3	0	0	107.2	E579	E577-E579 PolarHBondContact O-N 3.34Å; E577-E579 VanDerWaalsContact O-N 3.15Å
578	P	42.6	Very low	50.5	Low	127 Å²	127	127 Å²	127	83%	0.825	68%	0.676	S	S	*	*			trans	-72.8	110	-177.4	26.8	-30.8	0	0	0	110.4
579	E	42.5	Very low	49.5	Very low	194 Å²	194	121.6 Å²	121.6	91%	0.907	66%	0.657	S	S	*	*			trans	-77.9	121.2	153.2	-85.1	-167.2	154.6	0	0	109	E577	E577-E579 PolarHBondContact O-N 3.34Å; E577-E579 VanDerWaalsContact O-N 3.15Å
580	D	41.8	Very low	48.7	Very low	158 Å²	158	124.9 Å²	124.9	85%	0.845	68%	0.678	S	S	*	*	S	Bend	trans	61.6	89.1	168.3	-75.6	-18.6	0	0	0	119.8	K582	D580-K582 PolarHBondContact O-N 3.34Å
581	G	47.4	Very low	48.6	Very low	79 Å²	79	122.5 Å²	122.5	81%	0.814	66%	0.661	S	S	*	*				78.7	24.4	113.5	0	0	0	0	0	119.8
582	K	39.4	Very low	48.7	Very low	202 Å²	202	117.6 Å²	117.6	88%	0.878	65%	0.645	S	S	*	*			trans	-129.1	99.6	167.3	-73.6	-177.4	-178.1	168.2	0	112.4	D580 G584	D580-K582 PolarHBondContact O-N 3.34Å; K582-G584 PolarHBondContact O-N 2.86Å
583	E	38.8	Very low	48.9	Very low	209 Å²	209	117.4 Å²	117.4	98%	0.977	64%	0.644	S	S	*	*			trans	-72.4	115.2	170.4	-69.7	-177.3	162.1	0	0	111.1
584	G	37.4	Very low	49.3	Very low	55 Å²	55	113.9 Å²	113.9	57%	0.567	64%	0.639	S	S	*	*			trans	-157.7	137.5	162.7	0	0	0	0	0	108.3	K582 S586	K582-G584 PolarHBondContact O-N 2.86Å; G584-S586 PolarHBondContact O-N 3.43Å; G584-S586 VanDerWaalsContact O-N 3.13Å
585	P	43.4	Very low	50.3	Low	135 Å²	135	116.4 Å²	116.4	88%	0.877	65%	0.654	S	S	*	*			trans	-73.5	110.7	-169	29.6	-31.9	0	0	0	109.8
586	S	40.5	Very low	52	Low	107 Å²	107	117.9 Å²	117.9	75%	0.748	65%	0.648	S	S	*	*			trans	-110.8	92.6	165	61.4	0	0	0	0	108.8	G584 Q588	G584-S586 PolarHBondContact O-N 3.43Å; G584-S586 VanDerWaalsContact O-N 3.13Å; S586-Q588 PolarHBondContact O-N 3.01Å
587	D	44.7	Very low	53.8	Low	164 Å²	164	113.7 Å²	113.7	88%	0.877	63%	0.631	S	S	*	*			trans	-75.7	24.1	-173.2	-126.4	-2.9	0	0	0	113.8
588	Q	45.8	Very low	55.8	Low	133 Å²	133	104.8 Å²	104.8	62%	0.621	59%	0.589	S	S	*	*	S	Bend	trans	-147.8	121.3	175.2	-66.3	-171.9	1	0	0	110.7	S586	S586-Q588 PolarHBondContact O-N 3.01Å
589	P	52.3	Low	58	Low	44 Å²	44	101.8 Å²	101.8	29%	0.286	57%	0.566	S	S	.	*			trans	-62.8	143.7	169.9	25.4	-30.8	0	0	0	109.4	W573 N591	W573-P589 HydrophobicContact CB-CB 3.99Å; W573-P589 HydrophobicContact CB-CG 3.72Å; W573-P589 HydrophobicContact CD2-CG 3.71Å; W573-P589 HydrophobicContact CE3-CG 3.83Å; W573-P589 HydrophobicContact CG-CB 4.44Å; W573-P589 HydrophobicContact CG-CG 3.67Å; P589-N591 PolarHBondContact O-N 3.44Å
590	P	56.3	Low	60	Low	83 Å²	83	100.4 Å²	100.4	54%	0.539	55%	0.553	S	S	.	*			trans	-68.5	102	179.1	27.1	-30.4	0	0	0	108.5	H574	H574-P590 HydrophobicContact CB-CG 4.15Å; H574-P590 PolarHBondContact CD2-O 3.34Å
591	N	62.8	Low	62.1	Low	37 Å²	37	93.4 Å²	93.4	20%	0.198	52%	0.515	C	S	.	.			trans	-86.2	120	167.7	-167.9	-15.3	0	0	0	108.4	S566 P589 F593	S566-N591 VanDerWaalsContact C-ND2 3.32Å; S566-N591 PolarHBondContact O-ND2 2.98Å; P589-N591 PolarHBondContact O-N 3.44Å; N591-F593 PolarHBondContact O-N 2.95Å; N591-F593 PolarHBondContact OD1-N 3.43Å; N591-F593 VanDerWaalsContact OD1-N 3.07Å
592	E	65.4	Low	64	Low	89 Å²	89	89.7 Å²	89.7	42%	0.416	48%	0.476	S	S	.	.	S	Bend	trans	-66.9	-21.3	178.7	-69.5	174.2	-168.5	0	0	112.1	H574 G594 N597 I613	H574-E592 IonicContact CD2-OE1 3.79Å; H574-E592 IonicContact CE1-OE1 3.14Å; H574-E592 IonicContact NE2-OE1 3.43Å; H574-E592 PolarHBondContact NE2-OE1 3.25Å; E592-G594 PolarHBondContact O-N 3.36Å; E592-N597 WeakPolarHBondContact O-CB 3.49Å; E592-N597 PolarHBondContact O-ND2 2.97Å; E592-I613 HydrophobicContact CB-CG2 4.08Å
593	F	68.9	Low	66.3	Low	11 Å²	11	83.1 Å²	83.1	5%	0.048	45%	0.45	C	S	.	.			trans	-87.5	77.3	176.6	-75.2	-77.5	0	0	0	112.7	N591 F601 I613 P615	N591-F593 PolarHBondContact O-N 2.95Å; N591-F593 PolarHBondContact OD1-N 3.43Å; N591-F593 VanDerWaalsContact OD1-N 3.07Å; F593-F601 HydrophobicContact CE1-CB 4.12Å; F593-F601 HydrophobicContact CE1-CD2 4.27Å; F593-F601 HydrophobicContact CE1-CG 4.06Å; F593-I613 HydrophobicContact CD2-CG2 4.24Å; F593-I613 HydrophobicContact CE1-CG2 4.03Å; F593-I613 HydrophobicContact CE2-CG2 3.67Å; F593-I613 HydrophobicContact CZ-CB 4.46Å; F593-I613 HydrophobicContact CZ-CG2 3.56Å; F593-P615 HydrophobicContact CE2-CB 4.42Å; F593-P615 HydrophobicContact CZ-CB 4.33Å
594	G	74.6	Confident	68.6	Low	29 Å²	29	73.7 Å²	73.7	30%	0.299	41%	0.409	S	S	.	.			trans	-76.8	165.5	161	0	0	0	0	0	112.5	E592 F596 N597 S598	E592-G594 PolarHBondContact O-N 3.36Å; G594-F596 VanDerWaalsContact C-N 3.25Å; G594-F596 PolarHBondContact O-N 3.27Å; G594-F596 VanDerWaalsContact O-N 3.15Å; G594-N597 CarbonylContact O-C 3.21Å; G594-N597 WeakPolarHBondContact O-CA 3.22Å; G594-N597 PolarHBondContact O-N 3.3Å; G594-S598 PolarHBondContact O-N 3.12Å; G594-S598 PolarHBondContact O-OG 2.79Å
595	I	79.3	Confident	70.9	Confident	103 Å²	103	71.5 Å²	71.5	53%	0.528	39%	0.386	S	S	.	.	H	α-helix	trans	-50.1	-44.8	-179	-63.9	163	0	0	0	112.1	F563 L599	F563-I595 HydrophobicContact CD1-CG1 4.02Å; F563-I595 HydrophobicContact CD2-CB 4.4Å; F563-I595 HydrophobicContact CD2-CG1 3.62Å; F563-I595 HydrophobicContact CE1-CD1 4.22Å; F563-I595 HydrophobicContact CE1-CG1 3.81Å; F563-I595 HydrophobicContact CE2-CB 4.49Å; F563-I595 HydrophobicContact CE2-CD1 4.27Å; F563-I595 HydrophobicContact CE2-CG1 3.41Å; F563-I595 VanDerWaalsContact CE2-CG1 3.41Å; F563-I595 HydrophobicContact CG-CG1 3.92Å; F563-I595 HydrophobicContact CZ-CD1 3.93Å; F563-I595 HydrophobicContact CZ-CG1 3.5Å; F563-I595 VanDerWaalsContact CZ-CG1 3.5Å; I595-L599 WeakPolarHBondContact O-CB 3.4Å; I595-L599 PolarHBondContact O-N 3.36Å
596	F	81.8	Confident	73	Confident	169 Å²	169	66.6 Å²	66.6	74%	0.741	35%	0.351	S	S	*	.	H	α-helix	trans	-72.3	-33.8	178.8	-64.5	-72.3	0	0	0	113	G594 L599 W600	G594-F596 VanDerWaalsContact C-N 3.25Å; G594-F596 PolarHBondContact O-N 3.27Å; G594-F596 VanDerWaalsContact O-N 3.15Å; F596-L599 PolarHBondContact O-N 3.45Å; F596-W600 VanDerWaalsContact O-CB 3.3Å; F596-W600 WeakPolarHBondContact O-CB 3.36Å; F596-W600 PolarHBondContact O-N 3.47Å
597	N	82.8	Confident	75.2	Confident	72 Å²	72	66.2 Å²	66.2	39%	0.385	34%	0.338	S	S	.	.	H	α-helix	trans	-73.6	-36.1	177.9	-66	-8.1	0	0	0	111.2	E592 G594 W600 F601 I613	E592-N597 WeakPolarHBondContact O-CB 3.49Å; E592-N597 PolarHBondContact O-ND2 2.97Å; G594-N597 CarbonylContact O-C 3.21Å; G594-N597 WeakPolarHBondContact O-CA 3.22Å; G594-N597 PolarHBondContact O-N 3.3Å; N597-W600 PolarHBondContact O-N 2.92Å; N597-F601 VanDerWaalsContact O-CB 3.31Å; N597-F601 WeakPolarHBondContact O-CB 3.31Å; N597-F601 PolarHBondContact O-N 3.32Å; N597-I613 HydrophobicContact CB-CD1 4.4Å
598	S	84.1	Confident	77	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-65.2	-40.5	170.9	-57.7	0	0	0	0	111.6	G594 F601 S602	G594-S598 PolarHBondContact O-N 3.12Å; G594-S598 PolarHBondContact O-OG 2.79Å; S598-F601 PolarHBondContact O-N 3.46Å; S598-S602 PolarHBondContact O-N 3.11Å; S598-S602 PolarHBondContact O-OG 3.32Å; S598-S602 VanDerWaalsContact O-OG 3.08Å
599	L	87.1	Confident	78.6	Confident	64 Å²	64	66.6 Å²	66.6	34%	0.335	34%	0.335	S	S	.	.	H	α-helix	trans	-63.3	-46.7	174.6	-160.3	114	0	0	0	110.9	Y555 I595 F596 F601 S602 L603	Y555-L599 HydrophobicContact CE1-CD1 4.23Å; Y555-L599 HydrophobicContact CE1-CD2 4.49Å; Y555-L599 HydrophobicContact CE1-CG 4.21Å; Y555-L599 WeakPolarHBondContact OH-CD2 3.31Å; Y555-L599 WeakPolarHBondContact OH-CG 3.38Å; Y555-L599 PolarHBondContact OH-O 2.99Å; I595-L599 WeakPolarHBondContact O-CB 3.4Å; I595-L599 PolarHBondContact O-N 3.36Å; F596-L599 PolarHBondContact O-N 3.45Å; L599-F601 PolarHBondContact O-N 2.96Å; L599-S602 WeakPolarHBondContact CA-OG 3.36Å; L599-S602 PolarHBondContact O-N 2.81Å; L599-S602 PolarHBondContact O-OG 3.46Å; L599-L603 PolarHBondContact O-N 3.29Å
600	W	86.5	Confident	79.6	Confident	165 Å²	165	67 Å²	67	63%	0.625	35%	0.347	S	S	*	.	H	α-helix	trans	-61.5	-43	176	-171.1	-109.5	0	0	0	112.8	F596 N597 L603 G604	F596-W600 VanDerWaalsContact O-CB 3.3Å; F596-W600 WeakPolarHBondContact O-CB 3.36Å; F596-W600 PolarHBondContact O-N 3.47Å; N597-W600 PolarHBondContact O-N 2.92Å; W600-L603 HydrophobicContact CE3-CD2 4.31Å; W600-L603 HydrophobicContact CZ3-CD2 4.23Å; W600-L603 PolarHBondContact O-N 3.18Å; W600-G604 PolarHBondContact O-N 3.1Å
601	F	85.3	Confident	80.5	Confident	12 Å²	12	64.9 Å²	64.9	5%	0.053	33%	0.334	C	S	.	.	H	α-helix	trans	-59.4	-49.3	174.7	174.9	-93.6	0	0	0	111.5	L562 F593 N597 S598 L599 L603 G604 A605 C611 I613 P615	L562-F601 HydrophobicContact CD1-CD1 3.68Å; L562-F601 HydrophobicContact CD1-CE1 3.85Å; F593-F601 HydrophobicContact CE1-CB 4.12Å; F593-F601 HydrophobicContact CE1-CD2 4.27Å; F593-F601 HydrophobicContact CE1-CG 4.06Å; N597-F601 VanDerWaalsContact O-CB 3.31Å; N597-F601 WeakPolarHBondContact O-CB 3.31Å; N597-F601 PolarHBondContact O-N 3.32Å; S598-F601 PolarHBondContact O-N 3.46Å; L599-F601 PolarHBondContact O-N 2.96Å; F601-L603 VanDerWaalsContact C-N 3.26Å; F601-L603 PolarHBondContact O-N 3.39Å; F601-G604 PolarHBondContact O-N 3.4Å; F601-A605 WeakPolarHBondContact O-CB 3.34Å; F601-A605 PolarHBondContact O-N 3.06Å; F601-C611 HydrophobicContact CD2-CB 3.98Å; F601-I613 WeakPolarHBondContact CD2-O 3.31Å; F601-I613 WeakPolarHBondContact CE2-O 3.46Å; F601-P615 HydrophobicContact CZ-CG 4.15Å
602	S	86.1	Confident	80.8	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-62.7	-33.4	179	56	0	0	0	0	112.8	Y555 S559 S598 L599 F606 W627	Y555-S602 WeakPolarHBondContact CE2-OG 3.22Å; S559-S602 PolarHBondContact OG-OG 2.76Å; S598-S602 PolarHBondContact O-N 3.11Å; S598-S602 PolarHBondContact O-OG 3.32Å; S598-S602 VanDerWaalsContact O-OG 3.08Å; L599-S602 WeakPolarHBondContact CA-OG 3.36Å; L599-S602 PolarHBondContact O-N 2.81Å; L599-S602 PolarHBondContact O-OG 3.46Å; S602-F606 WeakPolarHBondContact O-CB 3.25Å; S602-F606 PolarHBondContact O-N 3.04Å; S602-F606 VanDerWaalsContact O-N 3.11Å; S602-W627 PolarHBondContact O-NE1 3.26Å
603	L	88.6	Confident	81.2	Confident	64 Å²	64	68.8 Å²	68.8	34%	0.335	36%	0.357	S	S	.	.	H	α-helix	trans	-72.8	-45.1	176.1	-174.1	66	0	0	0	111.8	Y555 L599 W600 F601 A605 F606 M607	Y555-L603 HydrophobicContact CE2-CB 3.9Å; Y555-L603 HydrophobicContact CE2-CD1 4.33Å; L599-L603 PolarHBondContact O-N 3.29Å; W600-L603 HydrophobicContact CE3-CD2 4.31Å; W600-L603 HydrophobicContact CZ3-CD2 4.23Å; W600-L603 PolarHBondContact O-N 3.18Å; F601-L603 VanDerWaalsContact C-N 3.26Å; F601-L603 PolarHBondContact O-N 3.39Å; L603-A605 VanDerWaalsContact C-N 3.31Å; L603-A605 PolarHBondContact O-N 3.3Å; L603-F606 WeakPolarHBondContact O-CB 3.22Å; L603-F606 PolarHBondContact O-N 2.92Å; L603-F606 VanDerWaalsContact O-N 3.1Å; L603-M607 PolarHBondContact O-N 3.22Å
604	G	86.3	Confident	81.5	Confident	11 Å²	11	72 Å²	72	11%	0.113	38%	0.381	C	S	.	.	H	α-helix	trans	-63	-37.2	177.1	0	0	0	0	0	112.6	W600 F601 M607 Q608 Q609	W600-G604 PolarHBondContact O-N 3.1Å; F601-G604 PolarHBondContact O-N 3.4Å; G604-M607 PolarHBondContact O-N 3.41Å; G604-Q608 PolarHBondContact O-N 3.35Å; G604-Q609 PolarHBondContact O-N 2.98Å
605	A	85.6	Confident	81.6	Confident	9 Å²	9	71.2 Å²	71.2	7%	0.074	37%	0.371	C	S	.	.	H	α-helix	trans	-66.6	-35.3	171.6	0	0	0	0	0	112.8	F601 L603	F601-A605 WeakPolarHBondContact O-CB 3.34Å; F601-A605 PolarHBondContact O-N 3.06Å; L603-A605 VanDerWaalsContact C-N 3.31Å; L603-A605 PolarHBondContact O-N 3.3Å
606	F	87.9	Confident	81.3	Confident	32 Å²	32	73.3 Å²	73.3	14%	0.14	37%	0.372	C	S	.	.	H	α-helix	trans	-71.1	-37	175.3	-173.5	-95.6	0	0	0	112.2	I551 S602 L603 Q608 W627 T631 I635	I551-F606 HydrophobicContact CG2-CE2 3.84Å; I551-F606 HydrophobicContact CG2-CZ 3.87Å; S602-F606 WeakPolarHBondContact O-CB 3.25Å; S602-F606 PolarHBondContact O-N 3.04Å; S602-F606 VanDerWaalsContact O-N 3.11Å; L603-F606 WeakPolarHBondContact O-CB 3.22Å; L603-F606 PolarHBondContact O-N 2.92Å; L603-F606 VanDerWaalsContact O-N 3.1Å; F606-Q608 VanDerWaalsContact C-N 3.31Å; F606-Q608 PolarHBondContact O-N 3.41Å; F606-W627 HydrophobicContact CB-CZ2 4.15Å; F606-W627 HydrophobicContact CD2-CH2 4.32Å; F606-W627 AromaticContact CD2-CZ2 3.92Å; F606-W627 HydrophobicContact CD2-CZ2 3.92Å; F606-W627 HydrophobicContact CG-CZ2 4.42Å; F606-T631 HydrophobicContact CB-CG2 4.19Å; F606-T631 HydrophobicContact CD2-CG2 3.53Å; F606-T631 HydrophobicContact CE2-CG2 4.38Å; F606-T631 HydrophobicContact CG-CG2 4.29Å; F606-I635 WeakPolarHBondContact O-CD1 3.5Å
607	M	86.5	Confident	81.3	Confident	100 Å²	100	65.3 Å²	65.3	49%	0.493	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	4.8	179.2	-69.8	-72.8	101	0	0	114.8	L603 G604 Q609	L603-M607 PolarHBondContact O-N 3.22Å; G604-M607 PolarHBondContact O-N 3.41Å; M607-Q609 PolarHBondContact O-N 3.34Å
608	Q	82.9	Confident	81.2	Confident	133 Å²	133	68.1 Å²	68.1	62%	0.621	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.5	20	180	-55.6	173.6	5.5	0	0	115	G604 F606 I635	G604-Q608 PolarHBondContact O-N 3.35Å; F606-Q608 VanDerWaalsContact C-N 3.31Å; F606-Q608 PolarHBondContact O-N 3.41Å; Q608-I635 HydrophobicContact CG-CD1 4.09Å
609	Q	79.2	Confident	81.2	Confident	171 Å²	171	71.3 Å²	71.3	80%	0.799	37%	0.374	S	S	*	.	S	Bend	trans	-96.2	-10.5	-176.7	-71.6	-179.1	-5.7	0	0	113.9	G604 M607	G604-Q609 PolarHBondContact O-N 2.98Å; M607-Q609 PolarHBondContact O-N 3.34Å
610	G	74	Confident	81	Confident	53 Å²	53	68.3 Å²	68.3	55%	0.546	36%	0.358	S	S	.	.			trans	73.9	170.7	-173.4	0	0	0	0	0	112.4
611	C	75.1	Confident	81	Confident	39 Å²	39	67.6 Å²	67.6	26%	0.264	36%	0.355	S	S	.	.			trans	-139	147.9	173.9	-170.7	0	0	0	0	108	F601 I613	F601-C611 HydrophobicContact CD2-CB 3.98Å; C611-I613 PolarHBondContact O-N 3.29Å
612	D	69.3	Low	81.2	Confident	173 Å²	173	71.9 Å²	71.9	93%	0.925	38%	0.378	S	S	*	.	S	Bend	trans	-64.5	-21.8	177.6	-67	-30.2	0	0	0	112.4
613	I	72.6	Confident	81.3	Confident	35 Å²	35	73.4 Å²	73.4	18%	0.179	39%	0.387	C	S	.	.			trans	-101.3	127.1	-178.5	-48.6	168.7	0	0	0	108.6	E592 F593 N597 F601 C611	E592-I613 HydrophobicContact CB-CG2 4.08Å; F593-I613 HydrophobicContact CD2-CG2 4.24Å; F593-I613 HydrophobicContact CE1-CG2 4.03Å; F593-I613 HydrophobicContact CE2-CG2 3.67Å; F593-I613 HydrophobicContact CZ-CB 4.46Å; F593-I613 HydrophobicContact CZ-CG2 3.56Å; N597-I613 HydrophobicContact CB-CD1 4.4Å; F601-I613 WeakPolarHBondContact CD2-O 3.31Å; F601-I613 WeakPolarHBondContact CE2-O 3.46Å; C611-I613 PolarHBondContact O-N 3.29Å
614	S	75.5	Confident	81.2	Confident	79 Å²	79	70.5 Å²	70.5	55%	0.552	37%	0.373	S	S	*	.			trans	-127.6	140.5	179.1	61.9	0	0	0	0	112	R616	S614-R616 PolarHBondContact O-N 3.03Å
615	P	77	Confident	81.3	Confident	12 Å²	12	71.6 Å²	71.6	8%	0.078	38%	0.384	C	S	.	.			trans	-66.6	127	-180	25.1	-32	0	0	0	110.9	F593 F601 R621	F593-P615 HydrophobicContact CE2-CB 4.42Å; F593-P615 HydrophobicContact CZ-CB 4.33Å; F601-P615 HydrophobicContact CZ-CG 4.15Å; P615-R621 HydrophobicContact CG-CG 4.46Å; P615-R621 VanDerWaalsContact O-CG 3.27Å; P615-R621 WeakPolarHBondContact O-CG 3.43Å; P615-R621 PolarHBondContact O-NE 3.08Å; P615-R621 VanDerWaalsContact O-NE 3.17Å
616	R	72.6	Confident	81.6	Confident	146 Å²	146	75.9 Å²	75.9	55%	0.551	41%	0.409	S	S	*	.			trans	-88.1	-33.3	178.8	-72	-177.3	176.2	155.9	-0.3	112.4	E572 H574 S614 R621	E572-R616 HydrophobicContact CG-CB 4.29Å; H574-R616 PolarHBondContact CE1-NH1 3.34Å; H574-R616 VanDerWaalsContact CE1-NH1 3.32Å; S614-R616 PolarHBondContact O-N 3.03Å; R616-R621 PolarHBondContact O-NE 2.97Å
617	S	82.1	Confident	81.8	Confident	2 Å²	2	74.7 Å²	74.7	1%	0.014	40%	0.404	C	S	.	.	S	Bend	trans	-69.9	147.3	-178.4	73.1	0	0	0	0	112	S569 E572 S619 G620 R621	S569-S617 WeakPolarHBondContact OG-CB 3.18Å; E572-S617 WeakPolarHBondContact OE1-CB 3.39Å; E572-S617 PolarHBondContact OE1-N 3.15Å; E572-S617 VanDerWaalsContact OE1-N 3.1Å; E572-S617 PolarHBondContact OE1-OG 3.28Å; S617-S619 VanDerWaalsContact C-N 3.26Å; S617-S619 PolarHBondContact O-N 2.95Å; S617-G620 PolarHBondContact O-N 2.97Å; S617-G620 PolarHBondContact OG-N 3.33Å; S617-R621 WeakPolarHBondContact O-CG 3.34Å; S617-R621 PolarHBondContact O-N 3.27Å
618	L	81.2	Confident	81.9	Confident	131 Å²	131	77.5 Å²	77.5	69%	0.686	41%	0.409	S	S	*	.	H	α-helix	trans	-58.3	-41.4	175.9	-175.7	65	0	0	0	111.2	R621 I622	L618-R621 PolarHBondContact O-N 2.8Å; L618-I622 HydrophobicContact CG-CD1 4.34Å; L618-I622 WeakPolarHBondContact O-CG1 3.11Å; L618-I622 PolarHBondContact O-N 3.28Å
619	S	83.4	Confident	82.3	Confident	67 Å²	67	78 Å²	78	47%	0.469	41%	0.409	S	S	.	.	H	α-helix	trans	-62.6	-44.9	177.5	-53.6	0	0	0	0	112.4	S617 I622 V623	S617-S619 VanDerWaalsContact C-N 3.26Å; S617-S619 PolarHBondContact O-N 2.95Å; S619-I622 PolarHBondContact O-N 3.01Å; S619-V623 WeakPolarHBondContact O-CG2 3.43Å; S619-V623 PolarHBondContact O-N 3Å
620	G	83.6	Confident	82.9	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-65.6	-37.6	176.1	0	0	0	0	0	112.7	S617 V623 G624	S617-G620 PolarHBondContact O-N 2.97Å; S617-G620 PolarHBondContact OG-N 3.33Å; G620-V623 PolarHBondContact O-N 3.24Å; G620-G624 PolarHBondContact O-N 3.4Å
621	R	86.4	Confident	83.7	Confident	150 Å²	150	70.9 Å²	70.9	57%	0.566	36%	0.361	S	S	*	.	H	α-helix	trans	-65.4	-36.1	175.2	-72.7	177.7	-178.1	179.8	1.9	113.2	P615 R616 S617 L618 G625	P615-R621 HydrophobicContact CG-CG 4.46Å; P615-R621 VanDerWaalsContact O-CG 3.27Å; P615-R621 WeakPolarHBondContact O-CG 3.43Å; P615-R621 PolarHBondContact O-NE 3.08Å; P615-R621 VanDerWaalsContact O-NE 3.17Å; R616-R621 PolarHBondContact O-NE 2.97Å; S617-R621 WeakPolarHBondContact O-CG 3.34Å; S617-R621 PolarHBondContact O-N 3.27Å; L618-R621 PolarHBondContact O-N 2.8Å; R621-G625 PolarHBondContact O-N 3.46Å
622	I	88.6	Confident	84.4	Confident	103 Å²	103	73.5 Å²	73.5	53%	0.528	37%	0.372	S	S	.	.	H	α-helix	trans	-65.5	-47	174.9	-68.6	166.1	0	0	0	110.2	L618 S619 G624 G625 V626	L618-I622 HydrophobicContact CG-CD1 4.34Å; L618-I622 WeakPolarHBondContact O-CG1 3.11Å; L618-I622 PolarHBondContact O-N 3.28Å; S619-I622 PolarHBondContact O-N 3.01Å; I622-G624 PolarHBondContact O-N 2.87Å; I622-G625 PolarHBondContact O-N 3.19Å; I622-V626 WeakPolarHBondContact O-CG2 2.94Å; I622-V626 PolarHBondContact O-N 2.81Å
623	V	88.9	Confident	85.5	Confident	31 Å²	31	69.4 Å²	69.4	19%	0.188	35%	0.349	C	S	.	.	H	α-helix	trans	-60.6	-46.5	177.4	177.6	0	0	0	0	110.8	V558 V561 L562 S619 G620 G625 V626 W627	V558-V623 HydrophobicContact CG1-CG1 4.22Å; V561-V623 HydrophobicContact CG1-CG1 4.17Å; V561-V623 HydrophobicContact CG1-CG2 3.98Å; L562-V623 HydrophobicContact CD1-CG1 4.45Å; L562-V623 HydrophobicContact CD2-CB 3.92Å; L562-V623 HydrophobicContact CD2-CG1 3.75Å; L562-V623 HydrophobicContact CG-CB 4.42Å; L562-V623 HydrophobicContact CG-CG1 3.69Å; S619-V623 WeakPolarHBondContact O-CG2 3.43Å; S619-V623 PolarHBondContact O-N 3Å; G620-V623 PolarHBondContact O-N 3.24Å; V623-G625 PolarHBondContact O-N 3.03Å; V623-V626 PolarHBondContact O-N 2.91Å; V623-W627 WeakPolarHBondContact O-CB 3.31Å; V623-W627 PolarHBondContact O-N 3.42Å
624	G	85.9	Confident	86.4	Confident	4 Å²	4	69.2 Å²	69.2	4%	0.041	35%	0.348	C	S	.	.	H	α-helix	trans	-62	-40.4	175.5	0	0	0	0	0	113.4	G620 I622 W627 W628	G620-G624 PolarHBondContact O-N 3.4Å; I622-G624 PolarHBondContact O-N 2.87Å; G624-W627 PolarHBondContact O-N 3.04Å; G624-W628 PolarHBondContact O-N 2.72Å
625	G	88.1	Confident	87.2	Confident	34 Å²	34	67.2 Å²	67.2	35%	0.351	33%	0.331	S	S	.	.	H	α-helix	trans	-67.1	-41.7	178.4	0	0	0	0	0	113.3	R621 I622 V623 W628 F629	R621-G625 PolarHBondContact O-N 3.46Å; I622-G625 PolarHBondContact O-N 3.19Å; V623-G625 PolarHBondContact O-N 3.03Å; G625-W628 PolarHBondContact O-N 3.42Å; G625-F629 PolarHBondContact O-N 3.35Å
626	V	91.9	Very high	87.8	Confident	99 Å²	99	69.6 Å²	69.6	60%	0.6	35%	0.348	S	S	*	.	H	α-helix	trans	-66.2	-40.6	174	173.9	0	0	0	0	110.7	I622 V623 F629 F630	I622-V626 WeakPolarHBondContact O-CG2 2.94Å; I622-V626 PolarHBondContact O-N 2.81Å; V623-V626 PolarHBondContact O-N 2.91Å; V626-F629 PolarHBondContact O-N 3.4Å; V626-F630 WeakPolarHBondContact O-CB 3.42Å; V626-F630 PolarHBondContact O-N 2.91Å
627	W	91.9	Very high	88.6	Confident	7 Å²	7	65 Å²	65	3%	0.027	34%	0.339	C	S	.	.	H	α-helix	trans	-60	-47.3	173.7	-177	-118.8	0	0	0	111.3	A554 Y555 V558 S602 F606 V623 G624 F629 F630 T631	A554-W627 HydrophobicContact CB-CZ3 4.17Å; Y555-W627 HydrophobicContact CD2-CZ2 4.31Å; V558-W627 HydrophobicContact CB-CD2 4.36Å; V558-W627 HydrophobicContact CB-CE3 4.14Å; V558-W627 HydrophobicContact CB-CZ3 4.44Å; V558-W627 HydrophobicContact CG1-CB 4.13Å; V558-W627 HydrophobicContact CG1-CD2 3.97Å; V558-W627 HydrophobicContact CG1-CE3 4.2Å; V558-W627 HydrophobicContact CG1-CG 3.96Å; V558-W627 HydrophobicContact CG2-CD2 4.28Å; V558-W627 HydrophobicContact CG2-CE3 3.64Å; V558-W627 HydrophobicContact CG2-CZ3 4Å; S602-W627 PolarHBondContact O-NE1 3.26Å; F606-W627 HydrophobicContact CB-CZ2 4.15Å; F606-W627 HydrophobicContact CD2-CH2 4.32Å; F606-W627 AromaticContact CD2-CZ2 3.92Å; F606-W627 HydrophobicContact CD2-CZ2 3.92Å; F606-W627 HydrophobicContact CG-CZ2 4.42Å; V623-W627 WeakPolarHBondContact O-CB 3.31Å; V623-W627 PolarHBondContact O-N 3.42Å; G624-W627 PolarHBondContact O-N 3.04Å; W627-F629 VanDerWaalsContact C-N 3.33Å; W627-F629 PolarHBondContact O-N 3.03Å; W627-F630 AromaticContact CE3-CD1 3.74Å; W627-F630 HydrophobicContact CE3-CD1 3.74Å; W627-F630 HydrophobicContact CE3-CE1 4.39Å; W627-F630 HydrophobicContact CH2-CD1 4.22Å; W627-F630 HydrophobicContact CH2-CE1 4.17Å; W627-F630 AromaticContact CZ3-CD1 3.49Å; W627-F630 HydrophobicContact CZ3-CD1 3.49Å; W627-F630 VanDerWaalsContact CZ3-CD1 3.49Å; W627-F630 AromaticContact CZ3-CE1 3.68Å; W627-F630 HydrophobicContact CZ3-CE1 3.68Å; W627-F630 WeakPolarHBondContact O-CB 3.42Å; W627-F630 PolarHBondContact O-N 3.19Å; W627-F630 VanDerWaalsContact O-N 3.13Å; W627-T631 HydrophobicContact CD2-CG2 3.85Å; W627-T631 HydrophobicContact CE3-CG2 4.37Å; W627-T631 HydrophobicContact CG-CG2 4.22Å; W627-T631 HydrophobicContact CH2-CG2 4.44Å; W627-T631 HydrophobicContact CZ2-CG2 3.9Å; W627-T631 VanDerWaalsContact O-CG2 3.28Å; W627-T631 WeakPolarHBondContact O-CG2 3.47Å; W627-T631 PolarHBondContact O-N 3.25Å; W627-T631 PolarHBondContact O-OG1 3.41Å
628	W	89.9	Confident	89	Confident	159 Å²	159	67.4 Å²	67.4	60%	0.602	35%	0.348	S	S	*	.	H	α-helix	trans	-57.9	-42.1	175.4	-77.6	-9.9	0	0	0	113.6	G624 G625 T631 L632	G624-W628 PolarHBondContact O-N 2.72Å; G625-W628 PolarHBondContact O-N 3.42Å; W628-T631 PolarHBondContact O-N 2.95Å; W628-T631 PolarHBondContact O-OG1 3.15Å; W628-L632 VanDerWaalsContact O-CB 3.27Å; W628-L632 WeakPolarHBondContact O-CB 3.24Å; W628-L632 PolarHBondContact O-N 2.93Å
629	F	91.6	Very high	89.4	Confident	142 Å²	142	65 Å²	65	62%	0.623	34%	0.338	S	S	*	.	H	α-helix	trans	-63.8	-43.6	175.6	-175.9	-105.4	0	0	0	111.4	G625 V626 W627 L632 I633	G625-F629 PolarHBondContact O-N 3.35Å; V626-F629 PolarHBondContact O-N 3.4Å; W627-F629 VanDerWaalsContact C-N 3.33Å; W627-F629 PolarHBondContact O-N 3.03Å; F629-L632 PolarHBondContact O-N 3.03Å; F629-I633 HydrophobicContact CE1-CG1 4.19Å; F629-I633 HydrophobicContact CE2-CD1 4.37Å; F629-I633 HydrophobicContact CE2-CG1 4.32Å; F629-I633 HydrophobicContact CZ-CD1 4.22Å; F629-I633 HydrophobicContact CZ-CG1 4.06Å; F629-I633 WeakPolarHBondContact O-CG1 3.36Å; F629-I633 PolarHBondContact O-N 2.87Å; F629-I633 VanDerWaalsContact O-N 3.17Å
630	F	91.8	Very high	89.6	Confident	70 Å²	70	64.5 Å²	64.5	31%	0.307	34%	0.338	S	S	.	.	H	α-helix	trans	-60.3	-48.6	176	174.9	-98.9	0	0	0	112.2	A554 V626 W627 L632 I633 I634	A554-F630 HydrophobicContact CB-CE1 4.5Å; V626-F630 WeakPolarHBondContact O-CB 3.42Å; V626-F630 PolarHBondContact O-N 2.91Å; W627-F630 AromaticContact CE3-CD1 3.74Å; W627-F630 HydrophobicContact CE3-CD1 3.74Å; W627-F630 HydrophobicContact CE3-CE1 4.39Å; W627-F630 HydrophobicContact CH2-CD1 4.22Å; W627-F630 HydrophobicContact CH2-CE1 4.17Å; W627-F630 AromaticContact CZ3-CD1 3.49Å; W627-F630 HydrophobicContact CZ3-CD1 3.49Å; W627-F630 VanDerWaalsContact CZ3-CD1 3.49Å; W627-F630 AromaticContact CZ3-CE1 3.68Å; W627-F630 HydrophobicContact CZ3-CE1 3.68Å; W627-F630 WeakPolarHBondContact O-CB 3.42Å; W627-F630 PolarHBondContact O-N 3.19Å; W627-F630 VanDerWaalsContact O-N 3.13Å; F630-L632 PolarHBondContact O-N 2.96Å; F630-I633 PolarHBondContact O-N 2.8Å; F630-I634 HydrophobicContact CD1-CG1 4.46Å; F630-I634 HydrophobicContact CD2-CG1 4.36Å; F630-I634 HydrophobicContact CE1-CG1 4.07Å; F630-I634 HydrophobicContact CE2-CD1 4.27Å; F630-I634 HydrophobicContact CE2-CG1 3.96Å; F630-I634 HydrophobicContact CZ-CD1 4.29Å; F630-I634 HydrophobicContact CZ-CG1 3.8Å; F630-I634 WeakPolarHBondContact O-CG1 3.32Å; F630-I634 PolarHBondContact O-N 3.45Å; F630-I634 VanDerWaalsContact O-N 3.07Å
631	T	90.8	Very high	89.7	Confident	5 Å²	5	67.9 Å²	67.9	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-66.3	-37.9	-178.4	63.7	0	0	0	0	112.1	F606 W627 W628 I634 I635	F606-T631 HydrophobicContact CB-CG2 4.19Å; F606-T631 HydrophobicContact CD2-CG2 3.53Å; F606-T631 HydrophobicContact CE2-CG2 4.38Å; F606-T631 HydrophobicContact CG-CG2 4.29Å; W627-T631 HydrophobicContact CD2-CG2 3.85Å; W627-T631 HydrophobicContact CE3-CG2 4.37Å; W627-T631 HydrophobicContact CG-CG2 4.22Å; W627-T631 HydrophobicContact CH2-CG2 4.44Å; W627-T631 HydrophobicContact CZ2-CG2 3.9Å; W627-T631 VanDerWaalsContact O-CG2 3.28Å; W627-T631 WeakPolarHBondContact O-CG2 3.47Å; W627-T631 PolarHBondContact O-N 3.25Å; W627-T631 PolarHBondContact O-OG1 3.41Å; W628-T631 PolarHBondContact O-N 2.95Å; W628-T631 PolarHBondContact O-OG1 3.15Å; T631-I634 PolarHBondContact O-N 2.88Å; T631-I635 WeakPolarHBondContact O-CB 3.23Å; T631-I635 WeakPolarHBondContact O-CD1 3.42Å; T631-I635 VanDerWaalsContact O-CG1 3.31Å; T631-I635 WeakPolarHBondContact O-CG1 3.35Å; T631-I635 PolarHBondContact O-N 2.01Å
632	L	89.9	Confident	89.6	Confident	94 Å²	94	63 Å²	63	49%	0.492	34%	0.341	S	S	.	.	H	α-helix	trans	-58.4	-51	174.7	-173.5	158.2	0	0	0	111.1	W628 F629 F630 I634 I635 S636	W628-L632 VanDerWaalsContact O-CB 3.27Å; W628-L632 WeakPolarHBondContact O-CB 3.24Å; W628-L632 PolarHBondContact O-N 2.93Å; F629-L632 PolarHBondContact O-N 3.03Å; F630-L632 PolarHBondContact O-N 2.96Å; L632-I634 PolarHBondContact O-N 2.81Å; L632-I635 PolarHBondContact O-N 3.2Å; L632-S636 WeakPolarHBondContact O-CB 3.48Å; L632-S636 PolarHBondContact O-N 3.36Å; L632-S636 PolarHBondContact O-OG 3.31Å; L632-S636 VanDerWaalsContact O-OG 3.07Å
633	I	92.2	Very high	89	Confident	88 Å²	88	60.8 Å²	60.8	45%	0.451	34%	0.338	S	S	.	.	H	α-helix	trans	-63.1	-44.3	-179.1	-64.3	-63.3	0	0	0	111.6	F629 F630 S637	F629-I633 HydrophobicContact CE1-CG1 4.19Å; F629-I633 HydrophobicContact CE2-CD1 4.37Å; F629-I633 HydrophobicContact CE2-CG1 4.32Å; F629-I633 HydrophobicContact CZ-CD1 4.22Å; F629-I633 HydrophobicContact CZ-CG1 4.06Å; F629-I633 WeakPolarHBondContact O-CG1 3.36Å; F629-I633 PolarHBondContact O-N 2.87Å; F629-I633 VanDerWaalsContact O-N 3.17Å; F630-I633 PolarHBondContact O-N 2.8Å; I633-S637 VanDerWaalsContact O-CB 3.32Å; I633-S637 WeakPolarHBondContact O-CB 3.44Å; I633-S637 PolarHBondContact O-N 2.87Å
634	I	91.9	Very high	88.5	Confident	30 Å²	30	61.8 Å²	61.8	15%	0.154	35%	0.35	C	S	.	.	H	α-helix	trans	-62.9	-46.4	180	-69.4	-59.7	0	0	0	111.4	I551 F630 T631 L632 S637 Y638	I551-I634 HydrophobicContact CD1-CG2 3.84Å; F630-I634 HydrophobicContact CD1-CG1 4.46Å; F630-I634 HydrophobicContact CD2-CG1 4.36Å; F630-I634 HydrophobicContact CE1-CG1 4.07Å; F630-I634 HydrophobicContact CE2-CD1 4.27Å; F630-I634 HydrophobicContact CE2-CG1 3.96Å; F630-I634 HydrophobicContact CZ-CD1 4.29Å; F630-I634 HydrophobicContact CZ-CG1 3.8Å; F630-I634 WeakPolarHBondContact O-CG1 3.32Å; F630-I634 PolarHBondContact O-N 3.45Å; F630-I634 VanDerWaalsContact O-N 3.07Å; T631-I634 PolarHBondContact O-N 2.88Å; L632-I634 PolarHBondContact O-N 2.81Å; I634-S637 PolarHBondContact O-N 3.32Å; I634-Y638 WeakPolarHBondContact O-CB 3.46Å; I634-Y638 PolarHBondContact O-N 2.84Å
635	I	90.7	Very high	88	Confident	37 Å²	37	66.2 Å²	66.2	19%	0.19	37%	0.368	C	S	.	.	H	α-helix	trans	-69.2	-41.4	-178	-65.5	164.4	0	0	0	110.8	F606 Q608 T631 L632 S637 Y638 T639	F606-I635 WeakPolarHBondContact O-CD1 3.5Å; Q608-I635 HydrophobicContact CG-CD1 4.09Å; T631-I635 WeakPolarHBondContact O-CB 3.23Å; T631-I635 WeakPolarHBondContact O-CD1 3.42Å; T631-I635 VanDerWaalsContact O-CG1 3.31Å; T631-I635 WeakPolarHBondContact O-CG1 3.35Å; T631-I635 PolarHBondContact O-N 2.01Å; L632-I635 PolarHBondContact O-N 3.2Å; I635-S637 VanDerWaalsContact C-N 3.32Å; I635-S637 PolarHBondContact O-N 3.45Å; I635-Y638 PolarHBondContact O-N 3.14Å; I635-T639 HydrophobicContact CG2-CG2 4.46Å; I635-T639 WeakPolarHBondContact O-CG2 3.4Å; I635-T639 PolarHBondContact O-N 2.82Å; I635-T639 PolarHBondContact O-OG1 3.26Å
636	S	89.4	Confident	87.2	Confident	62 Å²	62	68.1 Å²	68.1	43%	0.434	37%	0.37	S	S	.	.	H	α-helix	trans	-62.6	-37.6	174.5	-65	0	0	0	0	112.6	L632 T639 A640	L632-S636 WeakPolarHBondContact O-CB 3.48Å; L632-S636 PolarHBondContact O-N 3.36Å; L632-S636 PolarHBondContact O-OG 3.31Å; L632-S636 VanDerWaalsContact O-OG 3.07Å; S636-T639 PolarHBondContact O-OG1 3.42Å; S636-A640 WeakPolarHBondContact O-CB 3.31Å; S636-A640 PolarHBondContact O-N 2.93Å; S636-A640 VanDerWaalsContact O-N 3.1Å
637	S	90.8	Very high	86.2	Confident	51 Å²	51	68.8 Å²	68.8	36%	0.357	37%	0.374	S	S	.	.	H	α-helix	trans	-69.9	-38.9	175.3	-176.6	0	0	0	0	111.9	I633 I634 I635 A640 N641	I633-S637 VanDerWaalsContact O-CB 3.32Å; I633-S637 WeakPolarHBondContact O-CB 3.44Å; I633-S637 PolarHBondContact O-N 2.87Å; I634-S637 PolarHBondContact O-N 3.32Å; I635-S637 VanDerWaalsContact C-N 3.32Å; I635-S637 PolarHBondContact O-N 3.45Å; S637-A640 PolarHBondContact O-N 3.45Å; S637-N641 WeakPolarHBondContact O-CB 3.12Å; S637-N641 PolarHBondContact O-N 3.02Å
638	Y	91.1	Very high	84.9	Confident	52 Å²	52	72.3 Å²	72.3	20%	0.204	40%	0.396	C	S	.	.	H	α-helix	trans	-61.6	-46.5	174.4	172.9	-96.5	0	0	0	111.6	F539 P542 L543 I634 I635 A640 N641 L642	F539-Y638 WeakPolarHBondContact O-CE2 3.37Å; F539-Y638 PolarHBondContact O-OH 3.47Å; P542-Y638 HydrophobicContact CB-CD2 4.13Å; P542-Y638 HydrophobicContact CB-CE2 4.15Å; P542-Y638 HydrophobicContact CG-CE2 4.09Å; L543-Y638 HydrophobicContact CD1-CD2 4.02Å; L543-Y638 HydrophobicContact CG-CD2 4.14Å; I634-Y638 WeakPolarHBondContact O-CB 3.46Å; I634-Y638 PolarHBondContact O-N 2.84Å; I635-Y638 PolarHBondContact O-N 3.14Å; Y638-A640 VanDerWaalsContact C-N 3.35Å; Y638-A640 PolarHBondContact O-N 3.14Å; Y638-N641 PolarHBondContact O-N 3.46Å; Y638-L642 HydrophobicContact CE1-CD2 4.06Å; Y638-L642 WeakPolarHBondContact O-CB 3.27Å; Y638-L642 PolarHBondContact O-N 3.28Å
639	T	88.8	Confident	83.6	Confident	79 Å²	79	69.5 Å²	69.5	49%	0.485	39%	0.39	S	S	.	.	H	α-helix	trans	-64.9	-38.4	178.9	55.6	0	0	0	0	112.1	I635 S636 A643	I635-T639 HydrophobicContact CG2-CG2 4.46Å; I635-T639 WeakPolarHBondContact O-CG2 3.4Å; I635-T639 PolarHBondContact O-N 2.82Å; I635-T639 PolarHBondContact O-OG1 3.26Å; S636-T639 PolarHBondContact O-OG1 3.42Å; T639-A643 PolarHBondContact O-N 2.87Å; T639-A643 VanDerWaalsContact O-N 3.13Å
640	A	87.8	Confident	82	Confident	57 Å²	57	72.7 Å²	72.7	47%	0.471	40%	0.398	S	S	.	.	H	α-helix	trans	-64	-48	174.7	0	0	0	0	0	112.4	S636 S637 Y638 A643 A644	S636-A640 WeakPolarHBondContact O-CB 3.31Å; S636-A640 PolarHBondContact O-N 2.93Å; S636-A640 VanDerWaalsContact O-N 3.1Å; S637-A640 PolarHBondContact O-N 3.45Å; Y638-A640 VanDerWaalsContact C-N 3.35Å; Y638-A640 PolarHBondContact O-N 3.14Å; A640-A643 PolarHBondContact O-N 2.99Å; A640-A644 PolarHBondContact O-N 2.95Å; A640-A644 VanDerWaalsContact O-N 3.09Å
641	N	86.3	Confident	80.6	Confident	71 Å²	71	74.1 Å²	74.1	38%	0.38	41%	0.407	S	S	.	.	H	α-helix	trans	-68.6	-37.2	179.9	-74.6	-5.7	0	0	0	112.3	P542 S637 Y638 A643 A644 F645	P542-N641 HydrophobicContact CB-CB 3.94Å; P542-N641 PolarHBondContact O-ND2 3.18Å; S637-N641 WeakPolarHBondContact O-CB 3.12Å; S637-N641 PolarHBondContact O-N 3.02Å; Y638-N641 PolarHBondContact O-N 3.46Å; N641-A643 VanDerWaalsContact C-N 3.33Å; N641-A643 PolarHBondContact O-N 3.34Å; N641-A644 PolarHBondContact O-N 3.17Å; N641-F645 WeakPolarHBondContact O-CB 3.25Å; N641-F645 PolarHBondContact O-N 3.27Å
642	L	82.6	Confident	79.6	Confident	48 Å²	48	79.5 Å²	79.5	25%	0.251	44%	0.439	S	S	.	.	H	α-helix	trans	-61.4	-42.7	175.1	-179.6	66.5	0	0	0	111	P542 Y638 F645 L646	P542-L642 HydrophobicContact CB-CB 4.43Å; P542-L642 HydrophobicContact CG-CB 4.05Å; P542-L642 HydrophobicContact CG-CD1 3.76Å; Y638-L642 HydrophobicContact CE1-CD2 4.06Å; Y638-L642 WeakPolarHBondContact O-CB 3.27Å; Y638-L642 PolarHBondContact O-N 3.28Å; L642-F645 PolarHBondContact O-N 2.74Å; L642-L646 HydrophobicContact CD1-CD1 4.33Å; L642-L646 HydrophobicContact CD1-CG 4.46Å; L642-L646 HydrophobicContact CG-CD1 4.19Å; L642-L646 VanDerWaalsContact O-CG 3.29Å; L642-L646 WeakPolarHBondContact O-CG 3.31Å; L642-L646 PolarHBondContact O-N 2.83Å
643	A	76.9	Confident	78.8	Confident	57 Å²	57	76.6 Å²	76.6	47%	0.471	43%	0.427	S	S	.	.	H	α-helix	trans	-63	-41	175.2	0	0	0	0	0	112.3	T639 A640 N641 T647	T639-A643 PolarHBondContact O-N 2.87Å; T639-A643 VanDerWaalsContact O-N 3.13Å; A640-A643 PolarHBondContact O-N 2.99Å; N641-A643 VanDerWaalsContact C-N 3.33Å; N641-A643 PolarHBondContact O-N 3.34Å; A643-T647 WeakPolarHBondContact O-CG2 3.28Å; A643-T647 PolarHBondContact O-N 3.19Å; A643-T647 PolarHBondContact O-OG1 2.87Å; A643-T647 VanDerWaalsContact O-OG1 3.13Å
644	A	78.5	Confident	78.1	Confident	52 Å²	52	77 Å²	77	43%	0.43	44%	0.435	S	S	.	.	H	α-helix	trans	-66.3	-39.9	175.2	0	0	0	0	0	112.5	A640 N641 L646 T647 V648	A640-A644 PolarHBondContact O-N 2.95Å; A640-A644 VanDerWaalsContact O-N 3.09Å; N641-A644 PolarHBondContact O-N 3.17Å; A644-L646 PolarHBondContact O-N 2.8Å; A644-T647 WeakPolarHBondContact CA-OG1 3.16Å; A644-T647 PolarHBondContact O-N 2.92Å; A644-T647 PolarHBondContact O-OG1 3.11Å; A644-V648 PolarHBondContact O-N 3.33Å
645	F	74.4	Confident	77.8	Confident	97 Å²	97	75.8 Å²	75.8	43%	0.425	43%	0.429	S	S	.	.	H	α-helix	trans	-67	-38.7	-179.8	-165.1	-96.5	0	0	0	111.9	D541 N641 L642 T647	D541-F645 HydrophobicContact CB-CE1 4.44Å; D541-F645 HydrophobicContact CB-CE2 4.35Å; D541-F645 HydrophobicContact CB-CZ 4.04Å; N641-F645 WeakPolarHBondContact O-CB 3.25Å; N641-F645 PolarHBondContact O-N 3.27Å; L642-F645 PolarHBondContact O-N 2.74Å; F645-T647 VanDerWaalsContact C-N 3.27Å; F645-T647 PolarHBondContact O-N 3.14Å
646	L	72.1	Confident	77.6	Confident	73 Å²	73	80.5 Å²	80.5	38%	0.382	45%	0.45	S	S	.	.	H	α-helix	trans	-70.6	-20.6	176.8	-70	171.9	0	0	0	113.6	L642 A644 L809	L642-L646 HydrophobicContact CD1-CD1 4.33Å; L642-L646 HydrophobicContact CD1-CG 4.46Å; L642-L646 HydrophobicContact CG-CD1 4.19Å; L642-L646 VanDerWaalsContact O-CG 3.29Å; L642-L646 WeakPolarHBondContact O-CG 3.31Å; L642-L646 PolarHBondContact O-N 2.83Å; A644-L646 PolarHBondContact O-N 2.8Å; L646-L809 HydrophobicContact CD1-CD1 3.94Å; L646-L809 HydrophobicContact CD2-CD1 3.83Å
647	T	70.3	Confident	77.6	Confident	113 Å²	113	79.4 Å²	79.4	69%	0.693	44%	0.443	S	S	*	.	H	α-helix	trans	-91.4	-23	178.7	50.4	0	0	0	0	113.1	A643 A644 F645	A643-T647 WeakPolarHBondContact O-CG2 3.28Å; A643-T647 PolarHBondContact O-N 3.19Å; A643-T647 PolarHBondContact O-OG1 2.87Å; A643-T647 VanDerWaalsContact O-OG1 3.13Å; A644-T647 WeakPolarHBondContact CA-OG1 3.16Å; A644-T647 PolarHBondContact O-N 2.92Å; A644-T647 PolarHBondContact O-OG1 3.11Å; F645-T647 VanDerWaalsContact C-N 3.27Å; F645-T647 PolarHBondContact O-N 3.14Å
648	V	64.9	Low	77.5	Confident	81 Å²	81	77.6 Å²	77.6	49%	0.491	43%	0.431	S	S	.	.			trans	-123.1	85.9	-175.1	-168.1	0	0	0	0	111.9	A644 R650	A644-V648 PolarHBondContact O-N 3.33Å; V648-R650 HydrophobicContact CG1-CG 3.69Å; V648-R650 PolarHBondContact O-N 3.31Å; V648-R650 VanDerWaalsContact O-N 3.16Å
649	E	62.3	Low	77.5	Confident	100 Å²	100	80 Å²	80	47%	0.467	44%	0.444	S	S	.	.			trans	-80.5	89.4	167.2	-64.5	177.3	158.1	0	0	110	K531	K531-E649 VanDerWaalsContact CD-OE2 3.3Å; K531-E649 WeakPolarHBondContact CD-OE2 3.25Å; K531-E649 WeakPolarHBondContact CE-OE2 3.46Å; K531-E649 IonicContact NZ-OE2 3.65Å; K531-E649 PolarHBondContact NZ-OE2 3.3Å
650	R	59.5	Low	77.6	Confident	210 Å²	210	78.8 Å²	78.8	79%	0.792	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-72.9	132.4	175.6	-63.9	-168	175.5	172.8	-1	110.9	V648	V648-R650 HydrophobicContact CG1-CG 3.69Å; V648-R650 PolarHBondContact O-N 3.31Å; V648-R650 VanDerWaalsContact O-N 3.16Å
651	M	61.3	Low	77.7	Confident	100 Å²	100	76 Å²	76	49%	0.493	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-76.8	124.1	167.1	-62	-179.5	-147.5	0	0	108.6	P529 K531	P529-M651 HydrophobicContact CG-CB 4.43Å; K531-M651 HydrophobicContact CG-CE 4.48Å
652	V	69.5	Low	77.9	Confident	118 Å²	118	73.1 Å²	73.1	72%	0.715	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-102.9	123.9	174	-174	0	0	0	0	108.6
653	S	73.6	Confident	78.3	Confident	32 Å²	32	77.8 Å²	77.8	22%	0.224	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-86.3	130.9	173.4	53	0	0	0	0	110.3	I655	S653-I655 VanDerWaalsContact C-N 3.25Å; S653-I655 PolarHBondContact O-N 3.5Å
654	P	77.8	Confident	78.9	Confident	97 Å²	97	77.3 Å²	77.3	63%	0.63	40%	0.404	S	S	*	.	S	Bend	trans	-73.1	-13.9	-179.9	27.3	-33.3	0	0	0	114.3	I667	P654-I667 HydrophobicContact CG-CD1 4.46Å
655	I	84.9	Confident	79.4	Confident	4 Å²	4	80.6 Å²	80.6	2%	0.021	42%	0.419	C	S	.	.			trans	-133.4	130.3	-179.1	-63	159.4	0	0	0	108.4	I526 S653 S657 D660 L661 I667 V745	I526-I655 HydrophobicContact CG2-CD1 4.48Å; S653-I655 VanDerWaalsContact C-N 3.25Å; S653-I655 PolarHBondContact O-N 3.5Å; I655-S657 WeakPolarHBondContact CG2-O 3.19Å; I655-D660 HydrophobicContact CG2-CB 4.3Å; I655-L661 HydrophobicContact CD1-CD2 3.46Å; I655-L661 VanDerWaalsContact CD1-CD2 3.46Å; I655-L661 HydrophobicContact CD1-CG 4.22Å; I655-L661 HydrophobicContact CG1-CD2 4.34Å; I655-L661 HydrophobicContact CG2-CD2 4.45Å; I655-L661 HydrophobicContact CG2-CG 4.02Å; I655-I667 HydrophobicContact CD1-CB 4.25Å; I655-I667 HydrophobicContact CD1-CD1 3.4Å; I655-I667 HydrophobicContact CD1-CG1 4.39Å; I655-I667 HydrophobicContact CD1-CG2 3.97Å; I655-I667 HydrophobicContact CG1-CD1 4.05Å; I655-V745 HydrophobicContact CG2-CG2 4.43Å
656	E	86.1	Confident	80.1	Confident	136 Å²	136	82.4 Å²	82.4	64%	0.636	43%	0.429	S	S	*	.			trans	-114.5	-27.5	173.8	-63.3	-173.2	171.8	0	0	112.2	D660 G746	E656-D660 PolarHBondContact N-OD2 3.41Å; E656-G746 WeakPolarHBondContact O-CA 3.48Å; E656-G746 PolarHBondContact O-N 3.47Å
657	S	90.1	Very high	81.1	Confident	40 Å²	40	79.7 Å²	79.7	28%	0.28	41%	0.414	S	S	.	.	S	Bend	trans	-133.7	165.1	-174.1	75	0	0	0	0	114	I655 E659 D660	I655-S657 WeakPolarHBondContact CG2-O 3.19Å; S657-E659 PolarHBondContact O-N 2.86Å; S657-E659 PolarHBondContact OG-N 2.72Å; S657-D660 PolarHBondContact N-OD2 2.82Å; S657-D660 PolarHBondContact O-N 3.15Å; S657-D660 PolarHBondContact OG-N 3.22Å; S657-D660 PolarHBondContact OG-OD1 3.32Å; S657-D660 PolarHBondContact OG-OD2 3.24Å
658	A	89.3	Confident	82.2	Confident	13 Å²	13	75.4 Å²	75.4	11%	0.107	39%	0.391	C	S	.	.	H	α-helix	trans	-66.3	-25.9	171.7	0	0	0	0	0	112.6	I524 D660 L661 A662 Y689 M692 L749	I524-A658 HydrophobicContact CD1-CB 4.13Å; A658-D660 VanDerWaalsContact C-N 3.35Å; A658-L661 WeakPolarHBondContact O-CB 3.22Å; A658-L661 PolarHBondContact O-N 2.64Å; A658-A662 PolarHBondContact O-N 2.79Å; A658-Y689 HydrophobicContact CB-CE1 4.26Å; A658-M692 HydrophobicContact CB-SD 4.35Å; A658-L749 HydrophobicContact CB-CD1 4.48Å; A658-L749 HydrophobicContact CB-CD2 3.86Å; A658-L749 HydrophobicContact CB-CG 4.11Å
659	E	90.4	Very high	83.6	Confident	102 Å²	102	71.8 Å²	71.8	48%	0.477	37%	0.368	S	S	.	.	H	α-helix	trans	-67.4	-38.4	176.6	-63.2	-173.8	-176.9	0	0	111.7	S657 L661 A662 K663 V688	S657-E659 PolarHBondContact O-N 2.86Å; S657-E659 PolarHBondContact OG-N 2.72Å; E659-L661 VanDerWaalsContact C-N 3.3Å; E659-L661 PolarHBondContact O-N 3.33Å; E659-A662 PolarHBondContact O-N 2.91Å; E659-A662 VanDerWaalsContact O-N 3.07Å; E659-K663 WeakPolarHBondContact O-CG 3.35Å; E659-K663 PolarHBondContact O-N 2.78Å; E659-K663 IonicContact OE2-NZ 2.81Å; E659-V688 HydrophobicContact CG-CG1 4.13Å; E659-V688 HydrophobicContact CG-CG2 4.22Å
660	D	90.7	Very high	85.2	Confident	53 Å²	53	67 Å²	67	28%	0.283	35%	0.346	S	S	.	.	H	α-helix	trans	-61.8	-43.5	178	-56.4	-35.9	0	0	0	109.9	I655 E656 S657 A658 A662 K663 Q664	I655-D660 HydrophobicContact CG2-CB 4.3Å; E656-D660 PolarHBondContact N-OD2 3.41Å; S657-D660 PolarHBondContact N-OD2 2.82Å; S657-D660 PolarHBondContact O-N 3.15Å; S657-D660 PolarHBondContact OG-N 3.22Å; S657-D660 PolarHBondContact OG-OD1 3.32Å; S657-D660 PolarHBondContact OG-OD2 3.24Å; A658-D660 VanDerWaalsContact C-N 3.35Å; D660-A662 VanDerWaalsContact C-N 3.27Å; D660-A662 PolarHBondContact O-N 3.47Å; D660-K663 PolarHBondContact O-N 2.88Å; D660-K663 VanDerWaalsContact O-N 3.17Å; D660-Q664 WeakPolarHBondContact O-CG 3.44Å; D660-Q664 PolarHBondContact O-N 2.84Å
661	L	90.3	Very high	86.9	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-57.5	-38.6	173.1	-76.9	173.9	0	0	0	112.7	I524 I655 A658 E659 Q664 I667 Y669 M692 A723	I524-L661 HydrophobicContact CD1-CD1 3.84Å; I524-L661 HydrophobicContact CG1-CD1 4.19Å; I524-L661 HydrophobicContact CG2-CD1 3.86Å; I655-L661 HydrophobicContact CD1-CD2 3.46Å; I655-L661 VanDerWaalsContact CD1-CD2 3.46Å; I655-L661 HydrophobicContact CD1-CG 4.22Å; I655-L661 HydrophobicContact CG1-CD2 4.34Å; I655-L661 HydrophobicContact CG2-CD2 4.45Å; I655-L661 HydrophobicContact CG2-CG 4.02Å; A658-L661 WeakPolarHBondContact O-CB 3.22Å; A658-L661 PolarHBondContact O-N 2.64Å; E659-L661 VanDerWaalsContact C-N 3.3Å; E659-L661 PolarHBondContact O-N 3.33Å; L661-Q664 PolarHBondContact O-NE2 2.96Å; L661-Q664 VanDerWaalsContact O-O 3.06Å; L661-I667 HydrophobicContact CD2-CG2 4.33Å; L661-Y669 HydrophobicContact CB-CD1 4.12Å; L661-Y669 HydrophobicContact CB-CE1 4.17Å; L661-Y669 HydrophobicContact CD2-CD1 3.97Å; L661-Y669 VanDerWaalsContact O-CE1 3.23Å; L661-Y669 WeakPolarHBondContact O-CE1 3.39Å; L661-M692 HydrophobicContact CB-CE 4.45Å; L661-M692 HydrophobicContact CD1-CE 4.42Å; L661-A723 HydrophobicContact CD1-CB 4.45Å; L661-A723 HydrophobicContact CD2-CB 4.1Å
662	A	91	Very high	88.2	Confident	10 Å²	10	53.6 Å²	53.6	8%	0.083	29%	0.292	C	S	.	.	H	α-helix	trans	-78	-20.7	-179.7	0	0	0	0	0	113.8	A658 E659 D660 V688 K691 M692	A658-A662 PolarHBondContact O-N 2.79Å; E659-A662 PolarHBondContact O-N 2.91Å; E659-A662 VanDerWaalsContact O-N 3.07Å; D660-A662 VanDerWaalsContact C-N 3.27Å; D660-A662 PolarHBondContact O-N 3.47Å; A662-V688 HydrophobicContact CB-CG1 4.04Å; A662-K691 WeakPolarHBondContact O-CE 3.46Å; A662-K691 PolarHBondContact O-NZ 3.2Å; A662-M692 HydrophobicContact CB-CG 3.9Å
663	K	91	Very high	88.8	Confident	145 Å²	145	51.4 Å²	51.4	63%	0.63	28%	0.276	S	S	*	.	H	α-helix	trans	-82.2	-31.9	177.5	-74	169.7	-171.4	162.2	0	112.4	E659 D660	E659-K663 WeakPolarHBondContact O-CG 3.35Å; E659-K663 PolarHBondContact O-N 2.78Å; E659-K663 IonicContact OE2-NZ 2.81Å; D660-K663 PolarHBondContact O-N 2.88Å; D660-K663 VanDerWaalsContact O-N 3.17Å
664	Q	89.9	Confident	88.8	Confident	47 Å²	47	53.3 Å²	53.3	22%	0.22	29%	0.289	C	S	.	.			trans	-105.6	163.7	-175.9	67.2	80.6	43.1	0	0	113	D660 L661 I667	D660-Q664 WeakPolarHBondContact O-CG 3.44Å; D660-Q664 PolarHBondContact O-N 2.84Å; L661-Q664 PolarHBondContact O-NE2 2.96Å; L661-Q664 VanDerWaalsContact O-O 3.06Å; Q664-I667 PolarHBondContact NE2-O 3.2Å
665	T	88.4	Confident	88.8	Confident	121 Å²	121	49.7 Å²	49.7	74%	0.742	27%	0.27	S	S	*	.	S	Bend	trans	-127.8	1.6	178	58	0	0	0	0	113.9
666	E	89.2	Confident	88.8	Confident	136 Å²	136	50.7 Å²	50.7	64%	0.636	28%	0.277	S	S	*	.	S	Bend	trans	-76.6	-35.2	-176.7	-171.6	177.9	-170.4	0	0	112.8	K721	E666-K721 VanDerWaalsContact CD-NZ 3.26Å; E666-K721 HydrophobicContact CG-CD 4.26Å; E666-K721 IonicContact OE1-NZ 2.79Å; E666-K721 PolarHBondContact OE1-NZ 2.8Å
667	I	92.1	Very high	89	Confident	15 Å²	15	44.8 Å²	44.8	8%	0.077	25%	0.25	C	S	.	.	S	Bend	trans	-103.6	107.6	177.6	-58.1	175.8	0	0	0	107	P654 I655 L661 Q664 K721 A723	P654-I667 HydrophobicContact CG-CD1 4.46Å; I655-I667 HydrophobicContact CD1-CB 4.25Å; I655-I667 HydrophobicContact CD1-CD1 3.4Å; I655-I667 HydrophobicContact CD1-CG1 4.39Å; I655-I667 HydrophobicContact CD1-CG2 3.97Å; I655-I667 HydrophobicContact CG1-CD1 4.05Å; L661-I667 HydrophobicContact CD2-CG2 4.33Å; Q664-I667 PolarHBondContact NE2-O 3.2Å; I667-K721 WeakPolarHBondContact CA-O 3.35Å; I667-A723 HydrophobicContact CG2-CB 4.2Å
668	A	94.4	Very high	88.9	Confident	24 Å²	24	44.4 Å²	44.4	20%	0.198	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	152.7	175.4	0	0	0	0	0	110.8	Y695 K721 F722 A723	A668-Y695 WeakPolarHBondContact CA-OH 3.35Å; A668-Y695 WeakPolarHBondContact CB-OH 3.29Å; A668-K721 PolarHBondContact N-O 3.45Å; A668-F722 HydrophobicContact CB-CD2 3.95Å; A668-F722 CarbonylContact O-C 3.57Å; A668-F722 WeakPolarHBondContact O-CA 3.44Å; A668-F722 WeakPolarHBondContact O-CD2 3.4Å; A668-A723 PolarHBondContact O-N 3.19Å
669	Y	95	Very high	88.8	Confident	5 Å²	5	46.5 Å²	46.5	2%	0.02	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	149.5	177.8	53.9	-91.4	0	0	0	112.5	L661 M692 Y695 M696 V703 A723 L725	L661-Y669 HydrophobicContact CB-CD1 4.12Å; L661-Y669 HydrophobicContact CB-CE1 4.17Å; L661-Y669 HydrophobicContact CD2-CD1 3.97Å; L661-Y669 VanDerWaalsContact O-CE1 3.23Å; L661-Y669 WeakPolarHBondContact O-CE1 3.39Å; Y669-M692 HydrophobicContact CD2-CE 3.73Å; Y669-M692 HydrophobicContact CE2-CB 3.79Å; Y669-M692 HydrophobicContact CE2-CE 3.6Å; Y669-M692 HydrophobicContact CE2-CG 3.86Å; Y669-M692 HydrophobicContact CG-CE 4.45Å; Y669-Y695 HydrophobicContact CD1-CD1 4.4Å; Y669-Y695 HydrophobicContact CD1-CE1 4.06Å; Y669-Y695 HydrophobicContact CD2-CD1 4.14Å; Y669-Y695 HydrophobicContact CD2-CE1 4.27Å; Y669-Y695 AromaticContact CE1-CD1 3.82Å; Y669-Y695 HydrophobicContact CE1-CD1 3.82Å; Y669-Y695 AromaticContact CE1-CE1 3.83Å; Y669-Y695 HydrophobicContact CE1-CE1 3.83Å; Y669-Y695 HydrophobicContact CE1-CG 4.49Å; Y669-Y695 AromaticContact CE2-CD1 3.52Å; Y669-Y695 HydrophobicContact CE2-CD1 3.52Å; Y669-Y695 HydrophobicContact CE2-CE1 4.05Å; Y669-Y695 HydrophobicContact CE2-CG 4.42Å; Y669-Y695 HydrophobicContact CG-CE1 4.28Å; Y669-Y695 AromaticContact CZ-CD1 3.34Å; Y669-Y695 AromaticContact CZ-CE1 3.84Å; Y669-Y695 AromaticContact CZ-CG 3.96Å; Y669-M696 HydrophobicContact CD2-CG 4.12Å; Y669-M696 HydrophobicContact CD2-SD 4.37Å; Y669-M696 HydrophobicContact CE2-CG 4.09Å; Y669-V703 WeakPolarHBondContact O-CB 3.42Å; Y669-V703 WeakPolarHBondContact O-CG2 3.32Å; Y669-A723 WeakPolarHBondContact CA-O 3.28Å; Y669-L725 HydrophobicContact CD2-CD1 4.27Å
670	G	94.9	Very high	88.9	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	173.5	-178.5	0	0	0	0	0	113.8	A723 F724 L725	G670-A723 PolarHBondContact N-O 3.01Å; G670-F724 WeakPolarHBondContact O-CD2 3.36Å; G670-L725 PolarHBondContact O-N 3.06Å
671	T	94.2	Very high	89	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	177.8	-176.8	68.1	0	0	0	0	111	T677 F681 M696 F704 T705 L725	T671-T677 HydrophobicContact CG2-CG2 3.6Å; T671-F681 HydrophobicContact CG2-CD2 3.96Å; T671-F681 HydrophobicContact CG2-CE2 3.97Å; T671-M696 HydrophobicContact CG2-SD 4.03Å; T671-F704 VanDerWaalsContact O-CA 3.3Å; T671-F704 WeakPolarHBondContact O-CA 3.38Å; T671-F704 WeakPolarHBondContact OG1-CD1 3.11Å; T671-T705 PolarHBondContact O-N 2.87Å; T671-T705 VanDerWaalsContact O-N 3.12Å; T671-L725 HydrophobicContact CG2-CB 3.74Å; T671-L725 HydrophobicContact CG2-CD1 4.03Å; T671-L725 HydrophobicContact CG2-CG 4.5Å
672	L	89.3	Confident	89	Confident	28 Å²	28	47.6 Å²	47.6	15%	0.147	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-63.6	143.1	165.4	-163.4	73.7	0	0	0	111.4	T705 R706 T707	L672-T705 CarbonylContact C-O 3.52Å; L672-T705 WeakPolarHBondContact CA-O 3.33Å; L672-T705 WeakPolarHBondContact CD1-O 3.18Å; L672-R706 WeakPolarHBondContact CD1-O 3.41Å; L672-T707 VanDerWaalsContact CD1-C 3.42Å
673	D	83.1	Confident	88.9	Confident	71 Å²	71	54.6 Å²	54.6	38%	0.38	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-31.2	-175.1	-169	33.9	0	0	0	113.8	K678 F704 T705	D673-K678 WeakPolarHBondContact O-CD 3.4Å; D673-K678 PolarHBondContact O-NZ 2.87Å; D673-K678 IonicContact OD1-NZ 2.85Å; D673-K678 PolarHBondContact OD1-NZ 2.88Å; D673-F704 HydrophobicContact CB-CB 4.12Å; D673-T705 WeakPolarHBondContact CB-O 3.43Å; D673-T705 PolarHBondContact N-O 2.66Å
674	S	73.3	Confident	88.9	Confident	72 Å²	72	48.7 Å²	48.7	50%	0.503	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.9	56.4	-178.1	60.7	0	0	0	0	112.5
675	G	76.9	Confident	89	Confident	22 Å²	22	55.7 Å²	55.7	23%	0.227	28%	0.279	C	S	.	.	S	Bend	trans	-134.2	163.4	-176.6	0	0	0	0	0	114.9	T677 K678 E679	G675-T677 PolarHBondContact O-N 3.28Å; G675-K678 PolarHBondContact O-N 2.96Å; G675-E679 PolarHBondContact O-N 3.03Å
676	S	84.3	Confident	89.2	Confident	25 Å²	25	54.5 Å²	54.5	18%	0.175	27%	0.267	C	S	.	.	H	α-helix	trans	-60.1	-31.4	175.5	59.1	0	0	0	0	112.3	E679 F680	S676-E679 PolarHBondContact O-N 2.78Å; S676-F680 WeakPolarHBondContact O-CB 3.46Å; S676-F680 PolarHBondContact O-N 3.5Å
677	T	90.3	Very high	89.4	Confident	11 Å²	11	51.7 Å²	51.7	7%	0.067	27%	0.268	C	S	.	.	H	α-helix	trans	-62.9	-41	176.6	-52.6	0	0	0	0	112.7	I522 T671 G675 F680 F681	I522-T677 HydrophobicContact CD1-CG2 3.86Å; I522-T677 HydrophobicContact CG1-CG2 3.92Å; I522-T677 HydrophobicContact CG2-CG2 3.95Å; T671-T677 HydrophobicContact CG2-CG2 3.6Å; G675-T677 PolarHBondContact O-N 3.28Å; T677-F680 WeakPolarHBondContact O-CB 3.42Å; T677-F680 PolarHBondContact O-N 2.89Å; T677-F681 HydrophobicContact CG2-CD2 4.19Å; T677-F681 HydrophobicContact CG2-CE2 3.83Å; T677-F681 WeakPolarHBondContact O-CD2 3.41Å; T677-F681 PolarHBondContact O-N 3.45Å
678	K	89.6	Confident	89.5	Confident	32 Å²	32	53 Å²	53	14%	0.139	28%	0.276	C	S	.	.	H	α-helix	trans	-65.6	-46.4	177.3	-177.4	-177.3	177.8	179.6	0	111.3	D673 G675 F680 F681 R682 W693 F704	D673-K678 WeakPolarHBondContact O-CD 3.4Å; D673-K678 PolarHBondContact O-NZ 2.87Å; D673-K678 IonicContact OD1-NZ 2.85Å; D673-K678 PolarHBondContact OD1-NZ 2.88Å; G675-K678 PolarHBondContact O-N 2.96Å; K678-F680 VanDerWaalsContact C-N 3.28Å; K678-F680 PolarHBondContact O-N 2.87Å; K678-F681 PolarHBondContact O-N 2.9Å; K678-R682 PolarHBondContact O-N 2.74Å; K678-W693 HydrophobicContact CG-CH2 4.08Å; K678-W693 HydrophobicContact CG-CZ3 3.82Å; K678-F704 HydrophobicContact CD-CD1 4.33Å; K678-F704 HydrophobicContact CD-CE1 4.21Å; K678-F704 HydrophobicContact CG-CE1 4.02Å
679	E	87.5	Confident	89.5	Confident	57 Å²	57	53.4 Å²	53.4	27%	0.266	27%	0.273	S	S	.	.	H	α-helix	trans	-67.4	-31.6	179.3	-166.2	62.8	-164.4	0	0	111.8	G675 S676 R682 R683	G675-E679 PolarHBondContact O-N 3.03Å; S676-E679 PolarHBondContact O-N 2.78Å; E679-R682 PolarHBondContact O-N 2.72Å; E679-R682 WeakPolarHBondContact OE2-CD 3.38Å; E679-R682 IonicContact OE2-CZ 3.74Å; E679-R682 IonicContact OE2-NE 3.73Å; E679-R682 IonicContact OE2-NH1 2.57Å; E679-R682 PolarHBondContact OE2-NH1 3.46Å; E679-R683 HydrophobicContact CG-CG 4.38Å; E679-R683 WeakPolarHBondContact O-CB 3.43Å; E679-R683 WeakPolarHBondContact O-CG 3.35Å; E679-R683 PolarHBondContact O-N 2.9Å; E679-R683 IonicContact OE1-CZ 3.78Å; E679-R683 IonicContact OE1-NE 2.62Å; E679-R683 PolarHBondContact OE1-NE 3.32Å; E679-R683 IonicContact OE1-NH2 2.76Å; E679-R683 PolarHBondContact OE1-NH2 3.38Å; E679-R683 VanDerWaalsContact OE1-NH2 3.16Å
680	F	91.2	Very high	89.5	Confident	49 Å²	49	58.3 Å²	58.3	22%	0.215	30%	0.296	C	S	.	.	H	α-helix	trans	-57.1	-53.3	171	169.7	-92.7	0	0	0	111.3	I522 S676 T677 K678 R682 R683 S684 Y689 D750	I522-F680 HydrophobicContact CD1-CB 4.22Å; I522-F680 HydrophobicContact CD1-CD1 3.29Å; I522-F680 HydrophobicContact CD1-CD2 4.37Å; I522-F680 HydrophobicContact CD1-CE1 3.63Å; I522-F680 HydrophobicContact CD1-CG 3.71Å; I522-F680 HydrophobicContact CD1-CZ 4.3Å; S676-F680 WeakPolarHBondContact O-CB 3.46Å; S676-F680 PolarHBondContact O-N 3.5Å; T677-F680 WeakPolarHBondContact O-CB 3.42Å; T677-F680 PolarHBondContact O-N 2.89Å; K678-F680 VanDerWaalsContact C-N 3.28Å; K678-F680 PolarHBondContact O-N 2.87Å; F680-R682 VanDerWaalsContact C-N 3.32Å; F680-R682 PolarHBondContact O-N 3.4Å; F680-R683 PolarHBondContact O-N 3.37Å; F680-S684 VanDerWaalsContact O-CB 3.26Å; F680-S684 WeakPolarHBondContact O-CB 3.11Å; F680-S684 PolarHBondContact O-N 2.82Å; F680-Y689 HydrophobicContact CE1-CD2 4.08Å; F680-Y689 HydrophobicContact CE1-CE2 4.3Å; F680-Y689 HydrophobicContact CE1-CG 4.49Å; F680-Y689 HydrophobicContact CZ-CD2 4.06Å; F680-Y689 HydrophobicContact CZ-CE2 4.05Å; F680-D750 HydrophobicContact CE2-CB 4.12Å; F680-D750 HydrophobicContact CZ-CB 4.25Å
681	F	92.3	Very high	89.4	Confident	1 Å²	1	64.1 Å²	64.1	0%	0.004	32%	0.321	C	S	.	.	H	α-helix	trans	-65.1	-35.8	178.4	-74.2	-70.9	0	0	0	112.4	I522 T671 T677 K678 R683 Y689 M692 W693 M696 L725 L749	I522-F681 HydrophobicContact CD1-CE2 4.29Å; I522-F681 HydrophobicContact CG2-CE2 4.43Å; T671-F681 HydrophobicContact CG2-CD2 3.96Å; T671-F681 HydrophobicContact CG2-CE2 3.97Å; T677-F681 HydrophobicContact CG2-CD2 4.19Å; T677-F681 HydrophobicContact CG2-CE2 3.83Å; T677-F681 WeakPolarHBondContact O-CD2 3.41Å; T677-F681 PolarHBondContact O-N 3.45Å; K678-F681 PolarHBondContact O-N 2.9Å; F681-R683 PolarHBondContact O-N 2.95Å; F681-Y689 HydrophobicContact CD1-CG 4.37Å; F681-Y689 AromaticContact CE1-CD1 3.83Å; F681-Y689 HydrophobicContact CE1-CD1 3.83Å; F681-Y689 HydrophobicContact CE1-CG 4.07Å; F681-M692 HydrophobicContact CE1-CE 4.45Å; F681-M692 HydrophobicContact CE1-SD 4.19Å; F681-W693 HydrophobicContact CB-CB 4.19Å; F681-W693 HydrophobicContact CB-CD2 4.43Å; F681-W693 HydrophobicContact CB-CE3 3.84Å; F681-W693 WeakPolarHBondContact O-CB 3.3Å; F681-M696 HydrophobicContact CB-CE 3.72Å; F681-M696 HydrophobicContact CD1-CE 4Å; F681-M696 HydrophobicContact CD2-CE 3.73Å; F681-M696 HydrophobicContact CE2-CE 4.37Å; F681-M696 HydrophobicContact CG-CE 3.54Å; F681-L725 HydrophobicContact CE2-CD1 3.85Å; F681-L725 HydrophobicContact CZ-CD1 3.9Å; F681-L749 HydrophobicContact CE1-CD2 4.36Å; F681-L749 HydrophobicContact CZ-CD2 3.94Å
682	R	90.3	Very high	89.4	Confident	128 Å²	128	64.1 Å²	64.1	48%	0.483	32%	0.321	S	S	.	.	H	α-helix	trans	-63.1	-37.9	176.1	-175.8	-175.4	-74.3	171.8	-19.1	113.4	K678 E679 F680 W693	K678-R682 PolarHBondContact O-N 2.74Å; E679-R682 PolarHBondContact O-N 2.72Å; E679-R682 WeakPolarHBondContact OE2-CD 3.38Å; E679-R682 IonicContact OE2-CZ 3.74Å; E679-R682 IonicContact OE2-NE 3.73Å; E679-R682 IonicContact OE2-NH1 2.57Å; E679-R682 PolarHBondContact OE2-NH1 3.46Å; F680-R682 VanDerWaalsContact C-N 3.32Å; F680-R682 PolarHBondContact O-N 3.4Å; R682-W693 HydrophobicContact CB-CD2 4.16Å; R682-W693 HydrophobicContact CB-CE3 4.38Å; R682-W693 HydrophobicContact CB-CH2 3.94Å; R682-W693 HydrophobicContact CB-CZ2 3.66Å; R682-W693 HydrophobicContact CB-CZ3 4.28Å; R682-W693 HydrophobicContact CG-CH2 4.32Å; R682-W693 HydrophobicContact CG-CZ2 3.66Å
683	R	89.4	Confident	89.7	Confident	157 Å²	157	64.1 Å²	64.1	59%	0.592	32%	0.319	S	S	*	.	H	α-helix	trans	-95.5	-11.1	-177.7	-66.3	-173.4	-175.5	-162.7	0.9	114	E679 F680 F681	E679-R683 HydrophobicContact CG-CG 4.38Å; E679-R683 WeakPolarHBondContact O-CB 3.43Å; E679-R683 WeakPolarHBondContact O-CG 3.35Å; E679-R683 PolarHBondContact O-N 2.9Å; E679-R683 IonicContact OE1-CZ 3.78Å; E679-R683 IonicContact OE1-NE 2.62Å; E679-R683 PolarHBondContact OE1-NE 3.32Å; E679-R683 IonicContact OE1-NH2 2.76Å; E679-R683 PolarHBondContact OE1-NH2 3.38Å; E679-R683 VanDerWaalsContact OE1-NH2 3.16Å; F680-R683 PolarHBondContact O-N 3.37Å; F681-R683 PolarHBondContact O-N 2.95Å
684	S	91.5	Very high	90.2	Very high	21 Å²	21	63.7 Å²	63.7	15%	0.147	32%	0.319	C	S	.	.			trans	-64.9	138	-175.8	-167.6	0	0	0	0	111.2	F680	F680-S684 VanDerWaalsContact O-CB 3.26Å; F680-S684 WeakPolarHBondContact O-CB 3.11Å; F680-S684 PolarHBondContact O-N 2.82Å
685	K	91.8	Very high	91.3	Very high	194 Å²	194	63.1 Å²	63.1	84%	0.843	31%	0.306	S	S	*	.			trans	-105.2	4.6	176.8	-61.8	-171.4	177.2	-175.1	0	113.2
686	I	92.9	Very high	92.1	Very high	97 Å²	97	62.1 Å²	62.1	50%	0.497	30%	0.296	S	S	.	.	S	Bend	trans	-81.9	125.8	179	-61.1	173.3	0	0	0	107.8	V688 Y689 E690	I686-V688 VanDerWaalsContact C-N 3.26Å; I686-V688 PolarHBondContact O-N 3.49Å; I686-V688 VanDerWaalsContact O-N 3.12Å; I686-Y689 HydrophobicContact CB-CD2 3.78Å; I686-Y689 HydrophobicContact CB-CE2 4.39Å; I686-Y689 HydrophobicContact CB-CG 4.38Å; I686-Y689 HydrophobicContact CD1-CD2 3.84Å; I686-Y689 HydrophobicContact CD1-CE2 3.76Å; I686-Y689 HydrophobicContact CG1-CD2 4.3Å; I686-Y689 HydrophobicContact CG2-CD2 4.09Å; I686-Y689 HydrophobicContact CG2-CE2 4.39Å; I686-Y689 PolarHBondContact O-N 3.35Å; I686-E690 PolarHBondContact O-N 3.34Å
687	A	92.8	Very high	92.6	Very high	77 Å²	77	69 Å²	69	64%	0.636	32%	0.318	S	S	*	.	H	α-helix	trans	-52.6	-39.3	-172	0	0	0	0	0	114.1	K691	A687-K691 WeakPolarHBondContact O-CB 3.41Å; A687-K691 PolarHBondContact O-N 3.07Å
688	V	94.4	Very high	92.7	Very high	42 Å²	42	72.6 Å²	72.6	26%	0.255	34%	0.343	S	S	.	.	H	α-helix	trans	-61.8	-47.3	176.6	179.8	0	0	0	0	111.1	E659 A662 I686 K691 M692	E659-V688 HydrophobicContact CG-CG1 4.13Å; E659-V688 HydrophobicContact CG-CG2 4.22Å; A662-V688 HydrophobicContact CB-CG1 4.04Å; I686-V688 VanDerWaalsContact C-N 3.26Å; I686-V688 PolarHBondContact O-N 3.49Å; I686-V688 VanDerWaalsContact O-N 3.12Å; V688-K691 PolarHBondContact O-N 2.62Å; V688-M692 WeakPolarHBondContact O-CG 3.39Å; V688-M692 PolarHBondContact O-N 3.47Å
689	Y	94.7	Very high	92.8	Very high	33 Å²	33	72 Å²	72	13%	0.129	34%	0.344	C	S	.	.	H	α-helix	trans	-74.9	-31.7	-177.8	-59.8	-28.3	0	0	0	112.9	A658 F680 F681 I686 M692 W693 L749	A658-Y689 HydrophobicContact CB-CE1 4.26Å; F680-Y689 HydrophobicContact CE1-CD2 4.08Å; F680-Y689 HydrophobicContact CE1-CE2 4.3Å; F680-Y689 HydrophobicContact CE1-CG 4.49Å; F680-Y689 HydrophobicContact CZ-CD2 4.06Å; F680-Y689 HydrophobicContact CZ-CE2 4.05Å; F681-Y689 HydrophobicContact CD1-CG 4.37Å; F681-Y689 AromaticContact CE1-CD1 3.83Å; F681-Y689 HydrophobicContact CE1-CD1 3.83Å; F681-Y689 HydrophobicContact CE1-CG 4.07Å; I686-Y689 HydrophobicContact CB-CD2 3.78Å; I686-Y689 HydrophobicContact CB-CE2 4.39Å; I686-Y689 HydrophobicContact CB-CG 4.38Å; I686-Y689 HydrophobicContact CD1-CD2 3.84Å; I686-Y689 HydrophobicContact CD1-CE2 3.76Å; I686-Y689 HydrophobicContact CG1-CD2 4.3Å; I686-Y689 HydrophobicContact CG2-CD2 4.09Å; I686-Y689 HydrophobicContact CG2-CE2 4.39Å; I686-Y689 PolarHBondContact O-N 3.35Å; Y689-M692 HydrophobicContact CD1-SD 4.07Å; Y689-M692 PolarHBondContact O-N 3.33Å; Y689-W693 WeakPolarHBondContact O-CB 3.39Å; Y689-W693 PolarHBondContact O-N 3.25Å; Y689-L749 HydrophobicContact CD1-CD2 4.37Å; Y689-L749 HydrophobicContact CE1-CD2 3.62Å; Y689-L749 HydrophobicContact CE1-CG 4.21Å; Y689-L749 PolarHBondContact OH-O 2.93Å
690	E	94.1	Very high	92.9	Very high	108 Å²	108	78.2 Å²	78.2	51%	0.505	37%	0.373	S	S	.	.	H	α-helix	trans	-65.3	-40.8	172.1	-173.5	175.8	-167.5	0	0	111.3	I686 W693 T694	I686-E690 PolarHBondContact O-N 3.34Å; E690-W693 PolarHBondContact O-N 2.81Å; E690-T694 WeakPolarHBondContact O-CB 3.35Å; E690-T694 PolarHBondContact O-N 3.47Å; E690-T694 PolarHBondContact O-OG1 2.98Å
691	K	93.6	Very high	92.9	Very high	121 Å²	121	80.8 Å²	80.8	53%	0.526	40%	0.395	S	S	.	.	H	α-helix	trans	-62.2	-44.9	172.5	-169.5	-178.4	-176.6	-163.9	0	111.3	A662 A687 V688 T694 Y695	A662-K691 WeakPolarHBondContact O-CE 3.46Å; A662-K691 PolarHBondContact O-NZ 3.2Å; A687-K691 WeakPolarHBondContact O-CB 3.41Å; A687-K691 PolarHBondContact O-N 3.07Å; V688-K691 PolarHBondContact O-N 2.62Å; K691-T694 PolarHBondContact O-N 3.2Å; K691-Y695 PolarHBondContact O-N 2.77Å
692	M	95	Very high	92.9	Very high	0 Å²	0	84.1 Å²	84.1	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-60.7	-43.6	174.8	-70.3	180	78.5	0	0	112.2	A658 L661 A662 Y669 F681 V688 Y689 Y695 M696 L725	A658-M692 HydrophobicContact CB-SD 4.35Å; L661-M692 HydrophobicContact CB-CE 4.45Å; L661-M692 HydrophobicContact CD1-CE 4.42Å; A662-M692 HydrophobicContact CB-CG 3.9Å; Y669-M692 HydrophobicContact CD2-CE 3.73Å; Y669-M692 HydrophobicContact CE2-CB 3.79Å; Y669-M692 HydrophobicContact CE2-CE 3.6Å; Y669-M692 HydrophobicContact CE2-CG 3.86Å; Y669-M692 HydrophobicContact CG-CE 4.45Å; F681-M692 HydrophobicContact CE1-CE 4.45Å; F681-M692 HydrophobicContact CE1-SD 4.19Å; V688-M692 WeakPolarHBondContact O-CG 3.39Å; V688-M692 PolarHBondContact O-N 3.47Å; Y689-M692 HydrophobicContact CD1-SD 4.07Å; Y689-M692 PolarHBondContact O-N 3.33Å; M692-Y695 PolarHBondContact O-N 3.42Å; M692-M696 HydrophobicContact CB-CE 4.42Å; M692-M696 WeakPolarHBondContact O-CG 3.29Å; M692-M696 PolarHBondContact O-N 2.95Å; M692-L725 HydrophobicContact CE-CD1 3.83Å
693	W	95.4	Very high	93.1	Very high	28 Å²	28	78.1 Å²	78.1	11%	0.106	40%	0.396	C	S	.	.	H	α-helix	trans	-63.3	-42.7	176.9	176.5	-115.3	0	0	0	112	K678 F681 R682 Y689 E690 Y695 M696 R697 F704	K678-W693 HydrophobicContact CG-CH2 4.08Å; K678-W693 HydrophobicContact CG-CZ3 3.82Å; F681-W693 HydrophobicContact CB-CB 4.19Å; F681-W693 HydrophobicContact CB-CD2 4.43Å; F681-W693 HydrophobicContact CB-CE3 3.84Å; F681-W693 WeakPolarHBondContact O-CB 3.3Å; R682-W693 HydrophobicContact CB-CD2 4.16Å; R682-W693 HydrophobicContact CB-CE3 4.38Å; R682-W693 HydrophobicContact CB-CH2 3.94Å; R682-W693 HydrophobicContact CB-CZ2 3.66Å; R682-W693 HydrophobicContact CB-CZ3 4.28Å; R682-W693 HydrophobicContact CG-CH2 4.32Å; R682-W693 HydrophobicContact CG-CZ2 3.66Å; Y689-W693 WeakPolarHBondContact O-CB 3.39Å; Y689-W693 PolarHBondContact O-N 3.25Å; E690-W693 PolarHBondContact O-N 2.81Å; W693-Y695 VanDerWaalsContact C-N 3.32Å; W693-Y695 PolarHBondContact O-N 2.75Å; W693-M696 HydrophobicContact CE3-CE 4.18Å; W693-M696 PolarHBondContact O-N 3.39Å; W693-R697 WeakPolarHBondContact O-CB 3.33Å; W693-R697 PolarHBondContact O-N 3.13Å; W693-F704 HydrophobicContact CH2-CZ 4.31Å; W693-F704 HydrophobicContact CZ3-CE1 4.18Å; W693-F704 AromaticContact CZ3-CZ 3.84Å; W693-F704 HydrophobicContact CZ3-CZ 3.84Å
694	T	93.7	Very high	93.3	Very high	63 Å²	63	72.2 Å²	72.2	39%	0.387	38%	0.375	S	S	.	.	H	α-helix	trans	-59.5	-45.7	177.2	-58.5	0	0	0	0	110.6	E690 K691 R697 S698	E690-T694 WeakPolarHBondContact O-CB 3.35Å; E690-T694 PolarHBondContact O-N 3.47Å; E690-T694 PolarHBondContact O-OG1 2.98Å; K691-T694 PolarHBondContact O-N 3.2Å; T694-R697 PolarHBondContact O-N 2.97Å; T694-S698 PolarHBondContact O-N 2.84Å; T694-S698 VanDerWaalsContact O-N 3.11Å; T694-S698 PolarHBondContact O-OG 2.93Å; T694-S698 VanDerWaalsContact O-OG 3.06Å
695	Y	94.9	Very high	93.3	Very high	59 Å²	59	71.3 Å²	71.3	23%	0.231	37%	0.368	C	S	.	.	H	α-helix	trans	-59.1	-51.5	172.4	170.1	-94.9	0	0	0	112	A668 Y669 K691 M692 W693 R697 S698 A699	A668-Y695 WeakPolarHBondContact CA-OH 3.35Å; A668-Y695 WeakPolarHBondContact CB-OH 3.29Å; Y669-Y695 HydrophobicContact CD1-CD1 4.4Å; Y669-Y695 HydrophobicContact CD1-CE1 4.06Å; Y669-Y695 HydrophobicContact CD2-CD1 4.14Å; Y669-Y695 HydrophobicContact CD2-CE1 4.27Å; Y669-Y695 AromaticContact CE1-CD1 3.82Å; Y669-Y695 HydrophobicContact CE1-CD1 3.82Å; Y669-Y695 AromaticContact CE1-CE1 3.83Å; Y669-Y695 HydrophobicContact CE1-CE1 3.83Å; Y669-Y695 HydrophobicContact CE1-CG 4.49Å; Y669-Y695 AromaticContact CE2-CD1 3.52Å; Y669-Y695 HydrophobicContact CE2-CD1 3.52Å; Y669-Y695 HydrophobicContact CE2-CE1 4.05Å; Y669-Y695 HydrophobicContact CE2-CG 4.42Å; Y669-Y695 HydrophobicContact CG-CE1 4.28Å; Y669-Y695 AromaticContact CZ-CD1 3.34Å; Y669-Y695 AromaticContact CZ-CE1 3.84Å; Y669-Y695 AromaticContact CZ-CG 3.96Å; K691-Y695 PolarHBondContact O-N 2.77Å; M692-Y695 PolarHBondContact O-N 3.42Å; W693-Y695 VanDerWaalsContact C-N 3.32Å; W693-Y695 PolarHBondContact O-N 2.75Å; Y695-R697 PolarHBondContact O-N 2.93Å; Y695-S698 CarbonylContact O-C 3.57Å; Y695-S698 PolarHBondContact O-N 3.38Å; Y695-S698 VanDerWaalsContact O-N 3.14Å; Y695-S698 PolarHBondContact O-OG 3.45Å; Y695-A699 HydrophobicContact CE1-CB 4.45Å; Y695-A699 VanDerWaalsContact O-CB 3.29Å; Y695-A699 WeakPolarHBondContact O-CB 3.42Å; Y695-A699 PolarHBondContact O-N 3.13Å
696	M	94.9	Very high	93.1	Very high	2 Å²	2	71.8 Å²	71.8	1%	0.01	37%	0.365	C	S	.	.	H	α-helix	trans	-61.5	-33.2	-178.7	-72.8	-172.8	-74.6	0	0	112.6	Y669 T671 F681 M692 W693 V703 F704 L725	Y669-M696 HydrophobicContact CD2-CG 4.12Å; Y669-M696 HydrophobicContact CD2-SD 4.37Å; Y669-M696 HydrophobicContact CE2-CG 4.09Å; T671-M696 HydrophobicContact CG2-SD 4.03Å; F681-M696 HydrophobicContact CB-CE 3.72Å; F681-M696 HydrophobicContact CD1-CE 4Å; F681-M696 HydrophobicContact CD2-CE 3.73Å; F681-M696 HydrophobicContact CE2-CE 4.37Å; F681-M696 HydrophobicContact CG-CE 3.54Å; M692-M696 HydrophobicContact CB-CE 4.42Å; M692-M696 WeakPolarHBondContact O-CG 3.29Å; M692-M696 PolarHBondContact O-N 2.95Å; W693-M696 HydrophobicContact CE3-CE 4.18Å; W693-M696 PolarHBondContact O-N 3.39Å; M696-V703 HydrophobicContact CB-CG2 4.01Å; M696-V703 HydrophobicContact CG-CG2 4Å; M696-F704 HydrophobicContact CB-CE1 4.3Å; M696-F704 HydrophobicContact CB-CZ 3.8Å; M696-F704 WeakPolarHBondContact O-CE2 3.41Å; M696-F704 HydrophobicContact SD-CE1 4.37Å; M696-L725 HydrophobicContact SD-CD1 4.42Å
697	R	93.5	Very high	92.8	Very high	170 Å²	170	70.8 Å²	70.8	64%	0.642	36%	0.363	S	S	*	.	H	α-helix	trans	-72.2	-34.8	177	-174.3	177.9	67.1	179.5	-2.2	112.4	W693 T694 Y695	W693-R697 WeakPolarHBondContact O-CB 3.33Å; W693-R697 PolarHBondContact O-N 3.13Å; T694-R697 PolarHBondContact O-N 2.97Å; Y695-R697 PolarHBondContact O-N 2.93Å
698	S	93.3	Very high	92.5	Very high	85 Å²	85	68.3 Å²	68.3	59%	0.594	34%	0.34	S	S	*	.	H	α-helix	trans	-97.9	0.9	-178	66.4	0	0	0	0	114.3	T694 Y695 E700	T694-S698 PolarHBondContact O-N 2.84Å; T694-S698 VanDerWaalsContact O-N 3.11Å; T694-S698 PolarHBondContact O-OG 2.93Å; T694-S698 VanDerWaalsContact O-OG 3.06Å; Y695-S698 CarbonylContact O-C 3.57Å; Y695-S698 PolarHBondContact O-N 3.38Å; Y695-S698 VanDerWaalsContact O-N 3.14Å; Y695-S698 PolarHBondContact O-OG 3.45Å; S698-E700 PolarHBondContact O-N 2.91Å
699	A	92.4	Very high	92.4	Very high	19 Å²	19	69.8 Å²	69.8	16%	0.157	36%	0.357	C	S	.	.			trans	-76.4	124.2	-175.1	0	0	0	0	0	112.1	Y695 P701 V703	Y695-A699 HydrophobicContact CE1-CB 4.45Å; Y695-A699 VanDerWaalsContact O-CB 3.29Å; Y695-A699 WeakPolarHBondContact O-CB 3.42Å; Y695-A699 PolarHBondContact O-N 3.13Å; A699-P701 CarbonylContact O-C 3.58Å; A699-V703 HydrophobicContact CB-CB 4.5Å; A699-V703 HydrophobicContact CB-CG1 3.61Å; A699-V703 HydrophobicContact CB-CG2 4.14Å
700	E	88.8	Confident	92.3	Very high	188 Å²	188	72.2 Å²	72.2	88%	0.879	37%	0.37	S	S	*	.	S	Bend	trans	-119.9	124	172.8	-67.4	-174.7	176.1	0	0	109.8	S698	S698-E700 PolarHBondContact O-N 2.91Å
701	P	90.5	Very high	92.2	Very high	104 Å²	104	67.1 Å²	67.1	68%	0.675	35%	0.346	S	S	*	.	S	Bend	cis	-73	161.8	-0.3	32.3	-36.7	0	0	0	113.2	A699 V703	A699-P701 CarbonylContact O-C 3.58Å; P701-V703 PolarHBondContact O-N 3.34Å
702	S	93.4	Very high	92.2	Very high	71 Å²	71	61.6 Å²	61.6	50%	0.497	32%	0.322	S	S	.	.			trans	-47.2	126.4	-178.2	-179.4	0	0	0	0	112.6	F704 R714	S702-F704 VanDerWaalsContact C-N 3.34Å; S702-F704 PolarHBondContact OG-N 3.26Å; S702-R714 PolarHBondContact O-NH1 3.22Å; S702-R714 PolarHBondContact O-NH2 3.21Å
703	V	94.6	Very high	92.2	Very high	2 Å²	2	63.4 Å²	63.4	1%	0.012	34%	0.337	C	S	.	.			trans	-84.6	-12.4	176.4	-65.8	0	0	0	0	112.6	Y669 M696 A699 P701 F722	Y669-V703 WeakPolarHBondContact O-CB 3.42Å; Y669-V703 WeakPolarHBondContact O-CG2 3.32Å; M696-V703 HydrophobicContact CB-CG2 4.01Å; M696-V703 HydrophobicContact CG-CG2 4Å; A699-V703 HydrophobicContact CB-CB 4.5Å; A699-V703 HydrophobicContact CB-CG1 3.61Å; A699-V703 HydrophobicContact CB-CG2 4.14Å; P701-V703 PolarHBondContact O-N 3.34Å; V703-F722 HydrophobicContact CB-CE2 4.42Å
704	F	94	Very high	92.2	Very high	33 Å²	33	65 Å²	65	15%	0.145	34%	0.343	C	S	.	.			trans	-78.8	141.8	178.9	-57.8	-71.3	0	0	0	111.7	T671 D673 K678 W693 M696 S702	T671-F704 VanDerWaalsContact O-CA 3.3Å; T671-F704 WeakPolarHBondContact O-CA 3.38Å; T671-F704 WeakPolarHBondContact OG1-CD1 3.11Å; D673-F704 HydrophobicContact CB-CB 4.12Å; K678-F704 HydrophobicContact CD-CD1 4.33Å; K678-F704 HydrophobicContact CD-CE1 4.21Å; K678-F704 HydrophobicContact CG-CE1 4.02Å; W693-F704 HydrophobicContact CH2-CZ 4.31Å; W693-F704 HydrophobicContact CZ3-CE1 4.18Å; W693-F704 AromaticContact CZ3-CZ 3.84Å; W693-F704 HydrophobicContact CZ3-CZ 3.84Å; M696-F704 HydrophobicContact CB-CE1 4.3Å; M696-F704 HydrophobicContact CB-CZ 3.8Å; M696-F704 WeakPolarHBondContact O-CE2 3.41Å; M696-F704 HydrophobicContact SD-CE1 4.37Å; S702-F704 VanDerWaalsContact C-N 3.34Å; S702-F704 PolarHBondContact OG-N 3.26Å
705	T	90.7	Very high	92.2	Very high	1 Å²	1	62 Å²	62	1%	0.006	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-113.6	152.4	175.9	64.5	0	0	0	0	111.6	T671 L672 D673 T707 E710 F724	T671-T705 PolarHBondContact O-N 2.87Å; T671-T705 VanDerWaalsContact O-N 3.12Å; L672-T705 CarbonylContact C-O 3.52Å; L672-T705 WeakPolarHBondContact CA-O 3.33Å; L672-T705 WeakPolarHBondContact CD1-O 3.18Å; D673-T705 WeakPolarHBondContact CB-O 3.43Å; D673-T705 PolarHBondContact N-O 2.66Å; T705-T707 PolarHBondContact OG1-O 3.23Å; T705-E710 HydrophobicContact CG2-CG 4.26Å; T705-F724 HydrophobicContact CG2-CE2 4.35Å; T705-F724 VanDerWaalsContact OG1-CE2 3.32Å; T705-F724 WeakPolarHBondContact OG1-CE2 3.16Å; T705-F724 WeakPolarHBondContact OG1-CZ 3.37Å
706	R	86.9	Confident	92.2	Very high	205 Å²	205	62.3 Å²	62.3	77%	0.774	33%	0.325	S	S	*	.	S	Bend	trans	-80.8	-34	-179.1	-64.7	179.7	177.4	172.5	0.2	112.3	L672 E710	L672-R706 WeakPolarHBondContact CD1-O 3.41Å; R706-E710 WeakPolarHBondContact CB-OE2 3.38Å; R706-E710 PolarHBondContact N-OE2 3.28Å
707	T	86.8	Confident	92.1	Very high	75 Å²	75	70.4 Å²	70.4	46%	0.46	36%	0.36	S	S	.	.	S	Bend	trans	-128.4	158.1	179.5	64.8	0	0	0	0	111.5	L672 T705 A709 E710 G711	L672-T707 VanDerWaalsContact CD1-C 3.42Å; T705-T707 PolarHBondContact OG1-O 3.23Å; T707-A709 VanDerWaalsContact C-N 3.33Å; T707-E710 PolarHBondContact N-OE2 3.37Å; T707-E710 PolarHBondContact O-N 3.36Å; T707-E710 WeakPolarHBondContact OG1-CB 3.36Å; T707-E710 PolarHBondContact OG1-N 2.88Å; T707-G711 PolarHBondContact O-N 3.48Å
708	T	88	Confident	92	Very high	25 Å²	25	64.1 Å²	64.1	15%	0.153	34%	0.342	C	S	.	.	H	α-helix	trans	-62.6	-41.1	175.2	-50.6	0	0	0	0	111.4	E710 G711 V712 F724 L726 M730	T708-E710 VanDerWaalsContact C-N 3.32Å; T708-E710 PolarHBondContact O-N 3.48Å; T708-G711 PolarHBondContact O-N 3.22Å; T708-V712 WeakPolarHBondContact O-CG2 3.41Å; T708-V712 PolarHBondContact O-N 2.76Å; T708-F724 HydrophobicContact CG2-CE1 4.39Å; T708-L726 HydrophobicContact CG2-CD1 4.26Å; T708-M730 HydrophobicContact CG2-CE 3.82Å; T708-M730 HydrophobicContact CG2-CG 3.84Å
709	A	90.8	Very high	91.7	Very high	74 Å²	74	68.5 Å²	68.5	61%	0.612	35%	0.351	S	S	*	.	H	α-helix	trans	-62.3	-37.8	179	0	0	0	0	0	112.8	T707 V712 A713	T707-A709 VanDerWaalsContact C-N 3.33Å; A709-V712 PolarHBondContact O-N 2.7Å; A709-A713 WeakPolarHBondContact O-CB 3.45Å; A709-A713 PolarHBondContact O-N 3.14Å
710	E	92.6	Very high	91.4	Very high	84 Å²	84	68.9 Å²	68.9	39%	0.393	36%	0.356	S	S	.	.	H	α-helix	trans	-62.5	-44.9	174	-176.4	-169.5	171.7	0	0	111.6	T705 R706 T707 T708 A713 R714	T705-E710 HydrophobicContact CG2-CG 4.26Å; R706-E710 WeakPolarHBondContact CB-OE2 3.38Å; R706-E710 PolarHBondContact N-OE2 3.28Å; T707-E710 PolarHBondContact N-OE2 3.37Å; T707-E710 PolarHBondContact O-N 3.36Å; T707-E710 WeakPolarHBondContact OG1-CB 3.36Å; T707-E710 PolarHBondContact OG1-N 2.88Å; T708-E710 VanDerWaalsContact C-N 3.32Å; T708-E710 PolarHBondContact O-N 3.48Å; E710-A713 PolarHBondContact O-N 2.91Å; E710-R714 WeakPolarHBondContact O-CB 3.42Å; E710-R714 PolarHBondContact O-N 3.04Å
711	G	92.9	Very high	91.6	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-59.8	-47.1	175.9	0	0	0	0	0	112.8	T707 T708 A713 R714 V715	T707-G711 PolarHBondContact O-N 3.48Å; T708-G711 PolarHBondContact O-N 3.22Å; G711-A713 PolarHBondContact O-N 3.45Å; G711-R714 WeakPolarHBondContact O-CB 3.44Å; G711-R714 PolarHBondContact O-N 3.36Å; G711-V715 WeakPolarHBondContact O-CG2 3.47Å; G711-V715 PolarHBondContact O-N 2.91Å; G711-V715 VanDerWaalsContact O-N 3.07Å
712	V	94.1	Very high	91.8	Very high	6 Å²	6	60 Å²	60	4%	0.036	31%	0.305	C	S	.	.	H	α-helix	trans	-60.4	-47.5	175.7	174.3	0	0	0	0	111	M525 T708 A709 R714 V715 R716 I734	M525-V712 HydrophobicContact CE-CG2 4.22Å; M525-V712 HydrophobicContact SD-CG2 3.98Å; T708-V712 WeakPolarHBondContact O-CG2 3.41Å; T708-V712 PolarHBondContact O-N 2.76Å; A709-V712 PolarHBondContact O-N 2.7Å; V712-R714 VanDerWaalsContact C-N 3.28Å; V712-R714 PolarHBondContact O-N 3.28Å; V712-V715 PolarHBondContact O-N 3.37Å; V712-R716 WeakPolarHBondContact O-CG 3.42Å; V712-R716 PolarHBondContact O-N 2.92Å; V712-R716 VanDerWaalsContact O-N 3.08Å; V712-I734 HydrophobicContact CG1-CG2 3.67Å; V712-I734 HydrophobicContact CG2-CD1 4.36Å; V712-I734 HydrophobicContact CG2-CG1 4.13Å; V712-I734 HydrophobicContact CG2-CG2 4.14Å
713	A	94.3	Very high	91.8	Very high	37 Å²	37	56.7 Å²	56.7	31%	0.306	28%	0.281	S	S	.	.	H	α-helix	trans	-62.2	-36.7	178.5	0	0	0	0	0	112.2	A709 E710 G711 R716 K717	A709-A713 WeakPolarHBondContact O-CB 3.45Å; A709-A713 PolarHBondContact O-N 3.14Å; E710-A713 PolarHBondContact O-N 2.91Å; G711-A713 PolarHBondContact O-N 3.45Å; A713-R716 PolarHBondContact O-N 3.35Å; A713-K717 WeakPolarHBondContact O-CB 3.17Å; A713-K717 VanDerWaalsContact O-CG 3.3Å; A713-K717 WeakPolarHBondContact O-CG 3.24Å; A713-K717 PolarHBondContact O-N 2.96Å
714	R	95	Very high	91.9	Very high	63 Å²	63	56.7 Å²	56.7	24%	0.238	28%	0.281	C	S	.	.	H	α-helix	trans	-62.9	-44.9	175.5	-170.9	174.6	179.6	168.1	1.5	111.4	S702 E710 G711 V712 R716 K717 S718 F722	S702-R714 PolarHBondContact O-NH1 3.22Å; S702-R714 PolarHBondContact O-NH2 3.21Å; E710-R714 WeakPolarHBondContact O-CB 3.42Å; E710-R714 PolarHBondContact O-N 3.04Å; G711-R714 WeakPolarHBondContact O-CB 3.44Å; G711-R714 PolarHBondContact O-N 3.36Å; V712-R714 VanDerWaalsContact C-N 3.28Å; V712-R714 PolarHBondContact O-N 3.28Å; R714-R716 PolarHBondContact O-N 3.42Å; R714-K717 PolarHBondContact O-N 3.05Å; R714-S718 VanDerWaalsContact O-CB 3.29Å; R714-S718 WeakPolarHBondContact O-CB 3.45Å; R714-S718 PolarHBondContact O-N 3.3Å; R714-S718 PolarHBondContact O-OG 2.95Å; R714-F722 HydrophobicContact CB-CD1 4.15Å; R714-F722 HydrophobicContact CB-CE1 4.17Å; R714-F722 HydrophobicContact CG-CD1 3.71Å; R714-F722 HydrophobicContact CG-CE1 3.88Å; R714-F722 HydrophobicContact CG-CG 4.12Å; R714-F722 HydrophobicContact CG-CZ 4.43Å
715	V	94.8	Very high	92	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.3	-48.2	174.6	174.6	0	0	0	0	111	M525 K527 G711 V712 K717 S718 F722 F724	M525-V715 HydrophobicContact CG-CG1 4.49Å; K527-V715 HydrophobicContact CB-CG1 4.19Å; G711-V715 WeakPolarHBondContact O-CG2 3.47Å; G711-V715 PolarHBondContact O-N 2.91Å; G711-V715 VanDerWaalsContact O-N 3.07Å; V712-V715 PolarHBondContact O-N 3.37Å; V715-K717 VanDerWaalsContact C-N 3.34Å; V715-K717 PolarHBondContact O-N 2.94Å; V715-S718 PolarHBondContact O-N 2.88Å; V715-F722 HydrophobicContact CG2-CD1 3.74Å; V715-F722 HydrophobicContact CG2-CE1 4.19Å; V715-F724 HydrophobicContact CG2-CB 3.41Å; V715-F724 VanDerWaalsContact CG2-CB 3.41Å
716	R	93.3	Very high	92.1	Very high	65 Å²	65	55.7 Å²	55.7	25%	0.245	28%	0.277	C	S	.	.	H	α-helix	trans	-60.5	-41.4	-178.9	-68.4	-178	168.3	161.9	-0	112.9	K527 V712 A713 R714 D741 T742	K527-R716 PolarHBondContact NZ-O 3.38Å; V712-R716 WeakPolarHBondContact O-CG 3.42Å; V712-R716 PolarHBondContact O-N 2.92Å; V712-R716 VanDerWaalsContact O-N 3.08Å; A713-R716 PolarHBondContact O-N 3.35Å; R714-R716 PolarHBondContact O-N 3.42Å; R716-D741 WeakPolarHBondContact CD-OD2 3.42Å; R716-D741 VanDerWaalsContact CG-OD2 3.27Å; R716-D741 WeakPolarHBondContact CG-OD2 3.36Å; R716-D741 IonicContact CZ-OD1 3.67Å; R716-D741 IonicContact NE-OD1 2.84Å; R716-D741 PolarHBondContact NE-OD1 3.43Å; R716-D741 IonicContact NE-OD2 3.9Å; R716-D741 IonicContact NH2-OD1 2.7Å; R716-T742 HydrophobicContact CG-CG2 4.28Å
717	K	93.4	Very high	92.4	Very high	172 Å²	172	47.1 Å²	47.1	75%	0.748	25%	0.246	S	C	*	.	H	α-helix	trans	-75.5	-30.6	-179.4	-70.7	176.5	-177.5	-178.4	0	113.4	A713 R714 V715 K719	A713-K717 WeakPolarHBondContact O-CB 3.17Å; A713-K717 VanDerWaalsContact O-CG 3.3Å; A713-K717 WeakPolarHBondContact O-CG 3.24Å; A713-K717 PolarHBondContact O-N 2.96Å; R714-K717 PolarHBondContact O-N 3.05Å; V715-K717 VanDerWaalsContact C-N 3.34Å; V715-K717 PolarHBondContact O-N 2.94Å; K717-K719 PolarHBondContact O-N 2.77Å; K717-K719 VanDerWaalsContact O-N 3.14Å
718	S	90.9	Very high	92.7	Very high	37 Å²	37	43.7 Å²	43.7	26%	0.259	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	6.6	-171.9	-57.3	0	0	0	0	115	R714 V715 G720 K721 F722	R714-S718 VanDerWaalsContact O-CB 3.29Å; R714-S718 WeakPolarHBondContact O-CB 3.45Å; R714-S718 PolarHBondContact O-N 3.3Å; R714-S718 PolarHBondContact O-OG 2.95Å; V715-S718 PolarHBondContact O-N 2.88Å; S718-G720 PolarHBondContact O-N 2.92Å; S718-K721 WeakPolarHBondContact O-CB 3.37Å; S718-K721 PolarHBondContact O-N 2.94Å; S718-F722 WeakPolarHBondContact OG-CB 3.47Å
719	K	87.6	Confident	92.9	Very high	177 Å²	177	42.6 Å²	42.6	77%	0.77	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.4	38.5	176.8	-58.7	-176.5	-177.6	178.6	0	114.1	K717	K717-K719 PolarHBondContact O-N 2.77Å; K717-K719 VanDerWaalsContact O-N 3.14Å
720	G	86.9	Confident	93	Very high	27 Å²	27	40 Å²	40	28%	0.278	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.1	6.1	-179.8	0	0	0	0	0	115.9	S718	S718-G720 PolarHBondContact O-N 2.92Å
721	K	91.8	Very high	93	Very high	102 Å²	102	36 Å²	36	44%	0.443	18%	0.175	S	C	.	.	S	Bend	trans	-94.6	4.8	175.4	-58.6	-63.5	-176.4	-170.5	0	114.4	E666 I667 A668 S718	E666-K721 VanDerWaalsContact CD-NZ 3.26Å; E666-K721 HydrophobicContact CG-CD 4.26Å; E666-K721 IonicContact OE1-NZ 2.79Å; E666-K721 PolarHBondContact OE1-NZ 2.8Å; I667-K721 WeakPolarHBondContact CA-O 3.35Å; A668-K721 PolarHBondContact N-O 3.45Å; S718-K721 WeakPolarHBondContact O-CB 3.37Å; S718-K721 PolarHBondContact O-N 2.94Å
722	F	94.6	Very high	93	Very high	5 Å²	5	37.6 Å²	37.6	2%	0.022	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	131.8	175	-174.8	-102.9	0	0	0	110.5	A668 V703 R714 V715 S718 F724	A668-F722 HydrophobicContact CB-CD2 3.95Å; A668-F722 CarbonylContact O-C 3.57Å; A668-F722 WeakPolarHBondContact O-CA 3.44Å; A668-F722 WeakPolarHBondContact O-CD2 3.4Å; V703-F722 HydrophobicContact CB-CE2 4.42Å; R714-F722 HydrophobicContact CB-CD1 4.15Å; R714-F722 HydrophobicContact CB-CE1 4.17Å; R714-F722 HydrophobicContact CG-CD1 3.71Å; R714-F722 HydrophobicContact CG-CE1 3.88Å; R714-F722 HydrophobicContact CG-CG 4.12Å; R714-F722 HydrophobicContact CG-CZ 4.43Å; V715-F722 HydrophobicContact CG2-CD1 3.74Å; V715-F722 HydrophobicContact CG2-CE1 4.19Å; S718-F722 WeakPolarHBondContact OG-CB 3.47Å; F722-F724 HydrophobicContact CE1-CB 4.08Å; F722-F724 HydrophobicContact CE1-CD2 4.18Å; F722-F724 HydrophobicContact CZ-CD2 4.48Å
723	A	95.1	Very high	92.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	137.7	172.8	0	0	0	0	0	110.1	I524 M525 I526 L661 I667 A668 Y669 G670	I524-A723 HydrophobicContact CG2-CB 4.16Å; M525-A723 WeakPolarHBondContact O-CA 3.21Å; I526-A723 HydrophobicContact CG2-CB 3.9Å; L661-A723 HydrophobicContact CD1-CB 4.45Å; L661-A723 HydrophobicContact CD2-CB 4.1Å; I667-A723 HydrophobicContact CG2-CB 4.2Å; A668-A723 PolarHBondContact O-N 3.19Å; Y669-A723 WeakPolarHBondContact CA-O 3.28Å; G670-A723 PolarHBondContact N-O 3.01Å
724	F	95.9	Very high	92.9	Very high	2 Å²	2	37 Å²	37	1%	0.009	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.2	-179.8	-171.2	-127.6	0	0	0	110.4	M525 G670 T705 T708 V715 F722 L726	M525-F724 WeakPolarHBondContact CB-O 3.35Å; M525-F724 PolarHBondContact N-O 3Å; M525-F724 PolarHBondContact O-N 2.89Å; G670-F724 WeakPolarHBondContact O-CD2 3.36Å; T705-F724 HydrophobicContact CG2-CE2 4.35Å; T705-F724 VanDerWaalsContact OG1-CE2 3.32Å; T705-F724 WeakPolarHBondContact OG1-CE2 3.16Å; T705-F724 WeakPolarHBondContact OG1-CZ 3.37Å; T708-F724 HydrophobicContact CG2-CE1 4.39Å; V715-F724 HydrophobicContact CG2-CB 3.41Å; V715-F724 VanDerWaalsContact CG2-CB 3.41Å; F722-F724 HydrophobicContact CE1-CB 4.08Å; F722-F724 HydrophobicContact CE1-CD2 4.18Å; F722-F724 HydrophobicContact CZ-CD2 4.48Å; F724-L726 HydrophobicContact CB-CD2 4.45Å; F724-L726 HydrophobicContact CD1-CB 4.19Å; F724-L726 HydrophobicContact CD1-CD1 4.25Å; F724-L726 HydrophobicContact CD1-CD2 3.65Å; F724-L726 HydrophobicContact CD1-CG 4.25Å; F724-L726 HydrophobicContact CE1-CB 4Å; F724-L726 HydrophobicContact CE1-CD1 4.25Å; F724-L726 HydrophobicContact CE1-CD2 4.3Å; F724-L726 HydrophobicContact CE1-CG 4.42Å; F724-L726 HydrophobicContact CG-CD2 4.33Å; F724-L726 VanDerWaalsContact O-CD2 3.32Å; F724-L726 WeakPolarHBondContact O-CD2 3.26Å
725	L	95.4	Very high	92.7	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	109.9	-178.6	-61.2	171.9	0	0	0	108.9	I522 S523 I524 Y669 G670 T671 F681 M692 M696	I522-L725 HydrophobicContact CG2-CB 4.37Å; S523-L725 WeakPolarHBondContact O-CA 3.21Å; I524-L725 HydrophobicContact CB-CD2 4.33Å; I524-L725 HydrophobicContact CG1-CD2 3.68Å; I524-L725 HydrophobicContact CG2-CD2 4.44Å; Y669-L725 HydrophobicContact CD2-CD1 4.27Å; G670-L725 PolarHBondContact O-N 3.06Å; T671-L725 HydrophobicContact CG2-CB 3.74Å; T671-L725 HydrophobicContact CG2-CD1 4.03Å; T671-L725 HydrophobicContact CG2-CG 4.5Å; F681-L725 HydrophobicContact CE2-CD1 3.85Å; F681-L725 HydrophobicContact CZ-CD1 3.9Å; M692-L725 HydrophobicContact CE-CD1 3.83Å; M696-L725 HydrophobicContact SD-CD1 4.42Å
726	L	93.3	Very high	92.4	Very high	12 Å²	12	37.8 Å²	37.8	6%	0.063	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	168.8	-178.3	69.1	163.8	0	0	0	111.3	S523 M525 T708 F724 M730 N731	S523-L726 PolarHBondContact N-O 3.4Å; S523-L726 PolarHBondContact O-N 2.74Å; S523-L726 VanDerWaalsContact O-N 3.16Å; S523-L726 VanDerWaalsContact O-O 3.12Å; S523-L726 PolarHBondContact OG-O 3Å; M525-L726 HydrophobicContact CB-CD2 3.5Å; M525-L726 VanDerWaalsContact CB-CD2 3.5Å; M525-L726 HydrophobicContact CE-CD1 3.9Å; M525-L726 HydrophobicContact CE-CD2 4.04Å; M525-L726 HydrophobicContact CG-CD2 4.5Å; M525-L726 HydrophobicContact SD-CD2 4.35Å; T708-L726 HydrophobicContact CG2-CD1 4.26Å; F724-L726 HydrophobicContact CB-CD2 4.45Å; F724-L726 HydrophobicContact CD1-CB 4.19Å; F724-L726 HydrophobicContact CD1-CD1 4.25Å; F724-L726 HydrophobicContact CD1-CD2 3.65Å; F724-L726 HydrophobicContact CD1-CG 4.25Å; F724-L726 HydrophobicContact CE1-CB 4Å; F724-L726 HydrophobicContact CE1-CD1 4.25Å; F724-L726 HydrophobicContact CE1-CD2 4.3Å; F724-L726 HydrophobicContact CE1-CG 4.42Å; F724-L726 HydrophobicContact CG-CD2 4.33Å; F724-L726 VanDerWaalsContact O-CD2 3.32Å; F724-L726 WeakPolarHBondContact O-CD2 3.26Å; L726-M730 HydrophobicContact CD1-CB 3.9Å; L726-M730 HydrophobicContact CD1-CG 3.77Å; L726-N731 HydrophobicContact CD2-CB 4.39Å; L726-N731 HydrophobicContact CG-CB 4.29Å
727	E	92.5	Very high	92.3	Very high	24 Å²	24	36.6 Å²	36.6	11%	0.112	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	140.4	178.6	-70.3	169.8	140.7	0	0	111.6	T502 L520 G521 T729 M730 N731 Y754	T502-E727 PolarHBondContact OG1-OE1 2.91Å; L520-E727 HydrophobicContact CD1-CB 4.03Å; L520-E727 HydrophobicContact CD1-CG 3.75Å; G521-E727 CarbonylContact O-C 3.51Å; G521-E727 WeakPolarHBondContact O-CA 3.43Å; E727-T729 PolarHBondContact O-N 3.27Å; E727-M730 PolarHBondContact O-N 2.71Å; E727-M730 VanDerWaalsContact O-N 3.09Å; E727-N731 PolarHBondContact O-N 2.88Å; E727-N731 VanDerWaalsContact O-N 3.09Å; E727-Y754 VanDerWaalsContact CD-OH 3.29Å; E727-Y754 PolarHBondContact OE2-OH 3.48Å
728	S	94.2	Very high	91.9	Very high	4 Å²	4	35 Å²	35	3%	0.028	17%	0.168	C	C	.	.	H	α-helix	trans	-59.2	-34.4	-171.8	61.8	0	0	0	0	113.5	G521 S523 M730 N731 E732 N748	G521-S728 PolarHBondContact N-OG 3.47Å; G521-S728 WeakPolarHBondContact O-CB 3.44Å; G521-S728 PolarHBondContact O-N 2.88Å; S523-S728 WeakPolarHBondContact OG-CA 3.49Å; S728-M730 VanDerWaalsContact C-N 3.33Å; S728-M730 PolarHBondContact O-N 3.39Å; S728-N731 PolarHBondContact O-N 3.2Å; S728-E732 WeakPolarHBondContact O-CB 3.1Å; S728-E732 VanDerWaalsContact O-CG 3.31Å; S728-E732 WeakPolarHBondContact O-CG 3.27Å; S728-E732 PolarHBondContact O-N 3.08Å; S728-N748 VanDerWaalsContact CB-OD1 3.31Å; S728-N748 WeakPolarHBondContact CB-OD1 3.43Å; S728-N748 PolarHBondContact OG-ND2 3.07Å
729	T	92.8	Very high	91.9	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-62.5	-42.5	178	53.2	0	0	0	0	111.3	Y427 M518 L520 E727 Y733 W789	Y427-T729 WeakPolarHBondContact OH-CB 3.27Å; Y427-T729 PolarHBondContact OH-OG1 3.43Å; M518-T729 HydrophobicContact CG-CG2 4.1Å; M518-T729 HydrophobicContact SD-CG2 3.47Å; M518-T729 WeakPolarHBondContact SD-CG2 3.45Å; L520-T729 HydrophobicContact CB-CG2 3.79Å; L520-T729 HydrophobicContact CD2-CG2 4.2Å; E727-T729 PolarHBondContact O-N 3.27Å; T729-Y733 WeakPolarHBondContact O-CB 3.36Å; T729-Y733 PolarHBondContact O-N 2.97Å; T729-Y733 VanDerWaalsContact O-N 3.07Å; T729-W789 PolarHBondContact O-NE1 3.03Å
730	M	92.1	Very high	91.9	Very high	19 Å²	19	30.9 Å²	30.9	9%	0.094	16%	0.159	C	C	.	.	H	α-helix	trans	-74.2	-33.9	178.3	-171.1	54	170.5	0	0	111.4	T708 L726 E727 S728 Y733 I734	T708-M730 HydrophobicContact CG2-CE 3.82Å; T708-M730 HydrophobicContact CG2-CG 3.84Å; L726-M730 HydrophobicContact CD1-CB 3.9Å; L726-M730 HydrophobicContact CD1-CG 3.77Å; E727-M730 PolarHBondContact O-N 2.71Å; E727-M730 VanDerWaalsContact O-N 3.09Å; S728-M730 VanDerWaalsContact C-N 3.33Å; S728-M730 PolarHBondContact O-N 3.39Å; M730-Y733 HydrophobicContact CE-CD1 4.4Å; M730-Y733 WeakPolarHBondContact O-CB 3.33Å; M730-Y733 PolarHBondContact O-N 2.82Å; M730-Y733 HydrophobicContact SD-CD1 3.86Å; M730-I734 HydrophobicContact CE-CD1 3.89Å; M730-I734 HydrophobicContact CE-CG1 4.07Å; M730-I734 HydrophobicContact CG-CG1 4.42Å; M730-I734 VanDerWaalsContact O-CG1 3.24Å; M730-I734 WeakPolarHBondContact O-CG1 3.33Å; M730-I734 PolarHBondContact O-N 2.64Å; M730-I734 HydrophobicContact SD-CG1 4.21Å
731	N	93.5	Very high	92.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.2	-50.3	174.3	-164.1	-0.6	0	0	0	112	S523 I524 M525 L726 E727 S728 Y733 I734 E735	S523-N731 VanDerWaalsContact OG-CB 3.28Å; S523-N731 WeakPolarHBondContact OG-CB 3.37Å; S523-N731 PolarHBondContact OG-ND2 3.19Å; I524-N731 PolarHBondContact O-ND2 3.37Å; I524-N731 VanDerWaalsContact O-ND2 3.08Å; M525-N731 HydrophobicContact CE-CB 4.28Å; M525-N731 VanDerWaalsContact CE-OD1 3.26Å; M525-N731 WeakPolarHBondContact CE-OD1 3.41Å; L726-N731 HydrophobicContact CD2-CB 4.39Å; L726-N731 HydrophobicContact CG-CB 4.29Å; E727-N731 PolarHBondContact O-N 2.88Å; E727-N731 VanDerWaalsContact O-N 3.09Å; S728-N731 PolarHBondContact O-N 3.2Å; N731-Y733 PolarHBondContact O-N 3.42Å; N731-I734 PolarHBondContact O-N 2.9Å; N731-E735 WeakPolarHBondContact O-CB 3.5Å; N731-E735 PolarHBondContact O-N 3.32Å
732	E	92.1	Very high	92	Very high	34 Å²	34	26.3 Å²	26.3	16%	0.159	13%	0.133	C	C	.	.	H	α-helix	trans	-57.8	-37.9	175	-74.5	162.1	-154.7	0	0	111.6	S728 Q736 K744 K785	S728-E732 WeakPolarHBondContact O-CB 3.1Å; S728-E732 VanDerWaalsContact O-CG 3.31Å; S728-E732 WeakPolarHBondContact O-CG 3.27Å; S728-E732 PolarHBondContact O-N 3.08Å; E732-Q736 WeakPolarHBondContact O-CG 3.34Å; E732-Q736 PolarHBondContact O-N 2.87Å; E732-K744 HydrophobicContact CG-CD 4.31Å; E732-K744 IonicContact OE1-NZ 2.67Å; E732-K744 PolarHBondContact OE1-NZ 3.39Å; E732-K785 IonicContact OE2-NZ 3.78Å
733	Y	92.7	Very high	91.8	Very high	12 Å²	12	28 Å²	28	5%	0.047	14%	0.141	C	C	.	.	H	α-helix	trans	-65.4	-49.1	176.4	179.2	-113.5	0	0	0	112.9	P426 T729 M730 N731 E735 Q736 R737	P426-Y733 HydrophobicContact CB-CD2 3.99Å; P426-Y733 HydrophobicContact CB-CE2 3.4Å; P426-Y733 HydrophobicContact CG-CD2 3.48Å; P426-Y733 VanDerWaalsContact CG-CD2 3.48Å; P426-Y733 HydrophobicContact CG-CE2 3.46Å; P426-Y733 VanDerWaalsContact CG-CE2 3.46Å; P426-Y733 HydrophobicContact CG-CG 4.02Å; T729-Y733 WeakPolarHBondContact O-CB 3.36Å; T729-Y733 PolarHBondContact O-N 2.97Å; T729-Y733 VanDerWaalsContact O-N 3.07Å; M730-Y733 HydrophobicContact CE-CD1 4.4Å; M730-Y733 WeakPolarHBondContact O-CB 3.33Å; M730-Y733 PolarHBondContact O-N 2.82Å; M730-Y733 HydrophobicContact SD-CD1 3.86Å; N731-Y733 PolarHBondContact O-N 3.42Å; Y733-E735 VanDerWaalsContact C-N 3.29Å; Y733-E735 PolarHBondContact O-N 3.01Å; Y733-Q736 PolarHBondContact O-N 3.34Å; Y733-Q736 VanDerWaalsContact O-N 3.1Å; Y733-R737 HydrophobicContact CE1-CG 4.31Å; Y733-R737 VanDerWaalsContact CZ-NH2 3.31Å; Y733-R737 WeakPolarHBondContact O-CG 3.27Å; Y733-R737 VanDerWaalsContact OH-CZ 3.22Å; Y733-R737 PolarHBondContact OH-NE 3.29Å; Y733-R737 PolarHBondContact OH-NH2 3.49Å
734	I	92.6	Very high	91.6	Very high	20 Å²	20	30.4 Å²	30.4	10%	0.103	15%	0.152	C	C	.	.	H	α-helix	trans	-67.8	-32.1	-177	-66.3	-66.3	0	0	0	111.3	M525 V712 M730 N731 Q736 R737 T742	M525-I734 HydrophobicContact CE-CB 3.66Å; M525-I734 HydrophobicContact CE-CG1 4.2Å; M525-I734 HydrophobicContact CE-CG2 3.65Å; M525-I734 HydrophobicContact SD-CG2 4.32Å; V712-I734 HydrophobicContact CG1-CG2 3.67Å; V712-I734 HydrophobicContact CG2-CD1 4.36Å; V712-I734 HydrophobicContact CG2-CG1 4.13Å; V712-I734 HydrophobicContact CG2-CG2 4.14Å; M730-I734 HydrophobicContact CE-CD1 3.89Å; M730-I734 HydrophobicContact CE-CG1 4.07Å; M730-I734 HydrophobicContact CG-CG1 4.42Å; M730-I734 VanDerWaalsContact O-CG1 3.24Å; M730-I734 WeakPolarHBondContact O-CG1 3.33Å; M730-I734 PolarHBondContact O-N 2.64Å; M730-I734 HydrophobicContact SD-CG1 4.21Å; N731-I734 PolarHBondContact O-N 2.9Å; I734-Q736 PolarHBondContact O-N 3.2Å; I734-R737 PolarHBondContact O-N 2.81Å; I734-R737 VanDerWaalsContact O-N 3.1Å; I734-T742 HydrophobicContact CG2-CG2 4.24Å
735	E	91.1	Very high	91.3	Very high	53 Å²	53	30.6 Å²	30.6	25%	0.248	15%	0.153	C	C	.	.	H	α-helix	trans	-58.2	-34	171.2	-177.7	176	173.3	0	0	112.6	N731 Y733 R737 C795	N731-E735 WeakPolarHBondContact O-CB 3.5Å; N731-E735 PolarHBondContact O-N 3.32Å; Y733-E735 VanDerWaalsContact C-N 3.29Å; Y733-E735 PolarHBondContact O-N 3.01Å; E735-R737 VanDerWaalsContact C-N 3.28Å; E735-R737 PolarHBondContact O-N 2.81Å; E735-C795 PolarHBondContact O-SG 3.49Å; E735-C795 VanDerWaalsContact O-SG 3.38Å
736	Q	89.7	Confident	91	Very high	25 Å²	25	32.5 Å²	32.5	12%	0.117	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	4.4	177.9	-61.2	-57.4	-37	0	0	114.1	E732 Y733 I734 Y790 E794 C795	E732-Q736 WeakPolarHBondContact O-CG 3.34Å; E732-Q736 PolarHBondContact O-N 2.87Å; Y733-Q736 PolarHBondContact O-N 3.34Å; Y733-Q736 VanDerWaalsContact O-N 3.1Å; I734-Q736 PolarHBondContact O-N 3.2Å; Q736-Y790 HydrophobicContact CG-CD1 4.32Å; Q736-E794 PolarHBondContact O-N 3.1Å; Q736-C795 PolarHBondContact O-N 3.27Å; Q736-C795 VanDerWaalsContact O-N 3.17Å; Q736-C795 PolarHBondContact O-SG 2.93Å; Q736-C795 VanDerWaalsContact O-SG 3.4Å
737	R	89.8	Confident	90.9	Very high	40 Å²	40	34.7 Å²	34.7	15%	0.151	20%	0.199	C	C	.	.	S	Bend	trans	-106	144.3	-179.4	-66.6	-67.5	177.4	-162	-9.4	112.1	Y733 I734 E735 C740 K792 E794 C795	Y733-R737 HydrophobicContact CE1-CG 4.31Å; Y733-R737 VanDerWaalsContact CZ-NH2 3.31Å; Y733-R737 WeakPolarHBondContact O-CG 3.27Å; Y733-R737 VanDerWaalsContact OH-CZ 3.22Å; Y733-R737 PolarHBondContact OH-NE 3.29Å; Y733-R737 PolarHBondContact OH-NH2 3.49Å; I734-R737 PolarHBondContact O-N 2.81Å; I734-R737 VanDerWaalsContact O-N 3.1Å; E735-R737 VanDerWaalsContact C-N 3.28Å; E735-R737 PolarHBondContact O-N 2.81Å; R737-C740 WeakPolarHBondContact O-CA 3.43Å; R737-C740 PolarHBondContact O-N 3.47Å; R737-K792 PolarHBondContact NH1-O 2.86Å; R737-E794 IonicContact CZ-OE1 3.67Å; R737-E794 IonicContact NH1-OE1 3.53Å; R737-E794 PolarHBondContact NH1-OE1 3.49Å; R737-C795 PolarHBondContact N-SG 2.81Å; R737-C795 PolarHBondContact O-SG 3.44Å; R737-C795 VanDerWaalsContact O-SG 3.35Å
738	K	86.8	Confident	90.9	Very high	138 Å²	138	36.7 Å²	36.7	60%	0.6	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	141.7	175	-73.7	175.3	179.7	178.9	0	110.7	E794	K738-E794 HydrophobicContact CD-CB 4.27Å; K738-E794 HydrophobicContact CG-CB 3.93Å
739	P	89.8	Confident	90.8	Very high	87 Å²	87	37.8 Å²	37.8	57%	0.565	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	cis	-90.9	24.5	5.6	36.8	-34.5	0	0	0	115.1	D741	P739-D741 VanDerWaalsContact C-N 3.28Å; P739-D741 HydrophobicContact CG-CB 4.09Å; P739-D741 PolarHBondContact O-N 3.23Å
740	C	88.4	Confident	90.7	Very high	42 Å²	42	38.8 Å²	38.8	28%	0.284	22%	0.221	S	C	.	.			trans	60.9	35.6	177.3	-39	0	0	0	0	113.3	R737 C795	R737-C740 WeakPolarHBondContact O-CA 3.43Å; R737-C740 PolarHBondContact O-N 3.47Å; C740-C795 VanDerWaalsContact CA-SG 3.54Å; C740-C795 HydrophobicContact CB-CB 3.95Å; C740-C795 WeakPolarHBondContact CB-SG 3.36Å; C740-C795 WeakPolarHBondContact SG-CA 3.47Å; C740-C795 WeakPolarHBondContact SG-CB 3.43Å; C740-C795 CovalentContact SG-SG 2.02Å; C740-C795 PolarHBondContact SG-SG 2.98Å
741	D	89.3	Confident	90.5	Very high	31 Å²	31	44 Å²	44	17%	0.166	26%	0.259	C	S	.	.			trans	-103.7	4.6	-170.7	67	-20.2	0	0	0	113.8	K527 K528 R716 P739	K527-D741 CarbonylContact C-O 3.56Å; K527-D741 WeakPolarHBondContact CA-O 3.38Å; K527-D741 WeakPolarHBondContact CG-O 3.38Å; K528-D741 PolarHBondContact N-O 2.94Å; R716-D741 WeakPolarHBondContact CD-OD2 3.42Å; R716-D741 VanDerWaalsContact CG-OD2 3.27Å; R716-D741 WeakPolarHBondContact CG-OD2 3.36Å; R716-D741 IonicContact CZ-OD1 3.67Å; R716-D741 IonicContact NE-OD1 2.84Å; R716-D741 PolarHBondContact NE-OD1 3.43Å; R716-D741 IonicContact NE-OD2 3.9Å; R716-D741 IonicContact NH2-OD1 2.7Å; P739-D741 VanDerWaalsContact C-N 3.28Å; P739-D741 HydrophobicContact CG-CB 4.09Å; P739-D741 PolarHBondContact O-N 3.23Å
742	T	91.3	Very high	90.4	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.006	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	155.5	174.5	55.4	0	0	0	0	110	M525 I526 R716 I734	M525-T742 HydrophobicContact CG-CG2 4.23Å; M525-T742 HydrophobicContact SD-CG2 3.95Å; I526-T742 CarbonylContact O-C 3.53Å; I526-T742 WeakPolarHBondContact O-CA 3.18Å; R716-T742 HydrophobicContact CG-CG2 4.28Å; I734-T742 HydrophobicContact CG2-CG2 4.24Å
743	M	89.1	Confident	90.5	Very high	41 Å²	41	44.5 Å²	44.5	20%	0.202	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	147	171.9	63.8	179.4	-65.7	0	0	110.8	I526 K528 P529 V745	I526-M743 HydrophobicContact CD1-CG 4.13Å; I526-M743 HydrophobicContact CD1-SD 4.15Å; I526-M743 HydrophobicContact CG1-CG 3.6Å; I526-M743 HydrophobicContact CG1-SD 4.27Å; I526-M743 PolarHBondContact N-O 2.86Å; I526-M743 VanDerWaalsContact N-O 3.12Å; I526-M743 PolarHBondContact O-N 2.91Å; K528-M743 HydrophobicContact CB-CB 4.45Å; K528-M743 HydrophobicContact CB-CG 4.38Å; K528-M743 HydrophobicContact CB-SD 4.44Å; K528-M743 HydrophobicContact CG-SD 4.28Å; P529-M743 WeakPolarHBondContact CD-SD 3.42Å; M743-V745 HydrophobicContact CE-CG1 3.78Å; M743-V745 HydrophobicContact CG-CG1 4.32Å; M743-V745 HydrophobicContact SD-CG1 4.4Å
744	K	91.4	Very high	90.6	Very high	51 Å²	51	44 Å²	44	22%	0.222	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	131.7	167.2	-178.2	-179.7	-180	-172.4	0	109.6	I524 E732 N748	I524-K744 WeakPolarHBondContact O-CA 3.27Å; E732-K744 HydrophobicContact CG-CD 4.31Å; E732-K744 IonicContact OE1-NZ 2.67Å; E732-K744 PolarHBondContact OE1-NZ 3.39Å; K744-N748 WeakPolarHBondContact CE-OD1 3.46Å; K744-N748 PolarHBondContact NZ-OD1 3.35Å; K744-N748 VanDerWaalsContact NZ-OD1 3.08Å
745	V	90.3	Very high	90.7	Very high	6 Å²	6	43 Å²	43	4%	0.036	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	143.8	172.4	-68	0	0	0	0	111.2	I524 I526 I655 M743	I524-V745 HydrophobicContact CB-CG2 3.7Å; I524-V745 HydrophobicContact CG2-CG2 3.6Å; I524-V745 PolarHBondContact O-N 2.93Å; I524-V745 VanDerWaalsContact O-N 3.1Å; I526-V745 HydrophobicContact CD1-CG1 3.47Å; I526-V745 VanDerWaalsContact CD1-CG1 3.47Å; I526-V745 HydrophobicContact CD1-CG2 4.31Å; I526-V745 HydrophobicContact CG1-CG1 3.79Å; I526-V745 HydrophobicContact CG1-CG2 4.28Å; I526-V745 HydrophobicContact CG2-CG2 4.16Å; I655-V745 HydrophobicContact CG2-CG2 4.43Å; M743-V745 HydrophobicContact CE-CG1 3.78Å; M743-V745 HydrophobicContact CG-CG1 4.32Å; M743-V745 HydrophobicContact SD-CG1 4.4Å
746	G	88.8	Confident	91	Very high	42 Å²	42	40.5 Å²	40.5	43%	0.433	24%	0.244	S	C	.	.	S	Bend	trans	69.8	179.7	-179.4	0	0	0	0	0	114.8	E656	E656-G746 WeakPolarHBondContact O-CA 3.48Å; E656-G746 PolarHBondContact O-N 3.47Å
747	G	90.4	Very high	91.4	Very high	58 Å²	58	39.3 Å²	39.3	60%	0.598	24%	0.239	S	C	*	.	S	Bend	trans	-75.6	174	168.8	0	0	0	0	0	112.3
748	N	92.9	Very high	91.6	Very high	66 Å²	66	37.5 Å²	37.5	35%	0.353	23%	0.232	S	C	.	.			trans	-70.8	141.1	170.7	-64.5	-7.3	0	0	0	109.7	G521 I522 S728 K744 D750	G521-N748 PolarHBondContact N-ND2 2.99Å; I522-N748 CarbonylContact O-C 3.55Å; I522-N748 VanDerWaalsContact O-CA 3.29Å; I522-N748 WeakPolarHBondContact O-CA 3.38Å; S728-N748 VanDerWaalsContact CB-OD1 3.31Å; S728-N748 WeakPolarHBondContact CB-OD1 3.43Å; S728-N748 PolarHBondContact OG-ND2 3.07Å; K744-N748 WeakPolarHBondContact CE-OD1 3.46Å; K744-N748 PolarHBondContact NZ-OD1 3.35Å; K744-N748 VanDerWaalsContact NZ-OD1 3.08Å; N748-D750 VanDerWaalsContact C-N 3.33Å
749	L	91.5	Very high	92	Very high	26 Å²	26	32.4 Å²	32.4	14%	0.136	21%	0.213	C	C	.	.	S	Bend	trans	-76.3	-23.4	-178.9	-73.5	72.2	0	0	0	112.5	I522 I524 A658 F681 Y689	I522-L749 HydrophobicContact CB-CB 4.21Å; I522-L749 HydrophobicContact CG2-CD1 4.36Å; I522-L749 HydrophobicContact CG2-CD2 4.33Å; I522-L749 VanDerWaalsContact O-CD1 3.23Å; I522-L749 WeakPolarHBondContact O-CD1 3.48Å; I522-L749 PolarHBondContact O-N 2.9Å; I524-L749 HydrophobicContact CD1-CD1 4.41Å; I524-L749 HydrophobicContact CG1-CD1 4.12Å; A658-L749 HydrophobicContact CB-CD1 4.48Å; A658-L749 HydrophobicContact CB-CD2 3.86Å; A658-L749 HydrophobicContact CB-CG 4.11Å; F681-L749 HydrophobicContact CE1-CD2 4.36Å; F681-L749 HydrophobicContact CZ-CD2 3.94Å; Y689-L749 HydrophobicContact CD1-CD2 4.37Å; Y689-L749 HydrophobicContact CE1-CD2 3.62Å; Y689-L749 HydrophobicContact CE1-CG 4.21Å; Y689-L749 PolarHBondContact OH-O 2.93Å
750	D	90.4	Very high	91.8	Very high	23 Å²	23	34.5 Å²	34.5	12%	0.123	21%	0.213	C	C	.	.	S	Bend	trans	-144.2	174	179.2	63.3	-0.1	0	0	0	111.4	G521 I522 F680 N748 K752	G521-D750 WeakPolarHBondContact CA-O 3.36Å; G521-D750 WeakPolarHBondContact CA-OD1 3.3Å; I522-D750 WeakPolarHBondContact CD1-OD2 3.27Å; I522-D750 PolarHBondContact N-OD1 3.47Å; F680-D750 HydrophobicContact CE2-CB 4.12Å; F680-D750 HydrophobicContact CZ-CB 4.25Å; N748-D750 VanDerWaalsContact C-N 3.33Å; D750-K752 WeakPolarHBondContact OD2-CD 3.44Å; D750-K752 WeakPolarHBondContact OD2-CE 3.3Å; D750-K752 IonicContact OD2-NZ 3.85Å; D750-K752 PolarHBondContact OD2-NZ 3.17Å
751	S	89.6	Confident	91.5	Very high	127 Å²	127	35.8 Å²	35.8	89%	0.888	23%	0.234	S	C	*	.			trans	-116.5	105.6	174.7	-65.7	0	0	0	0	109.4
752	K	90.3	Very high	91.4	Very high	37 Å²	37	35.7 Å²	35.7	16%	0.161	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	169.8	179.5	-77.8	168.8	168	152.2	0	110.1	T502 L520 D750	T502-K752 HydrophobicContact CG2-CB 4.07Å; T502-K752 HydrophobicContact CG2-CD 3.87Å; T502-K752 HydrophobicContact CG2-CG 4.1Å; L520-K752 HydrophobicContact CD1-CB 3.72Å; L520-K752 HydrophobicContact CD1-CD 4.43Å; L520-K752 HydrophobicContact CG-CB 4.23Å; L520-K752 PolarHBondContact N-O 3.28Å; L520-K752 CarbonylContact O-C 3.47Å; L520-K752 WeakPolarHBondContact O-CA 3.43Å; L520-K752 PolarHBondContact O-N 2.95Å; D750-K752 WeakPolarHBondContact OD2-CD 3.44Å; D750-K752 WeakPolarHBondContact OD2-CE 3.3Å; D750-K752 IonicContact OD2-NZ 3.85Å; D750-K752 PolarHBondContact OD2-NZ 3.17Å
753	G	93.5	Very high	91.2	Very high	8 Å²	8	40.8 Å²	40.8	8%	0.082	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	151.4	171.4	0	0	0	0	0	112.3	I503 M518	I503-G753 PolarHBondContact N-O 3.39Å; I503-G753 VanDerWaalsContact N-O 3.07Å; M518-G753 WeakPolarHBondContact O-CA 3.48Å
754	Y	95.5	Very high	91.2	Very high	1 Å²	1	40 Å²	40	0%	0.004	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	135.4	165.9	-62.4	-37.7	0	0	0	110.2	Y427 P500 P516 F517 M518 L520 E727	Y427-Y754 HydrophobicContact CE1-CD2 4.4Å; Y427-Y754 AromaticContact CE1-CE2 3.99Å; Y427-Y754 HydrophobicContact CE1-CE2 3.99Å; Y427-Y754 AromaticContact CZ-CE2 3.85Å; Y427-Y754 WeakPolarHBondContact OH-CE2 3.42Å; P500-Y754 VanDerWaalsContact C-CD1 3.48Å; P500-Y754 HydrophobicContact CB-CD1 4.4Å; P500-Y754 HydrophobicContact CB-CD2 4.02Å; P500-Y754 HydrophobicContact CB-CE1 3.99Å; P500-Y754 HydrophobicContact CB-CE2 3.57Å; P500-Y754 HydrophobicContact CB-CG 4.42Å; P500-Y754 WeakPolarHBondContact O-CE1 3.18Å; P516-Y754 CarbonylContact C-O 3.55Å; P516-Y754 WeakPolarHBondContact CA-O 3.43Å; F517-Y754 VanDerWaalsContact CD1-O 3.32Å; F517-Y754 WeakPolarHBondContact CD1-O 3.35Å; F517-Y754 HydrophobicContact CE2-CD2 4.37Å; F517-Y754 HydrophobicContact CZ-CD2 4.23Å; F517-Y754 HydrophobicContact CZ-CG 4.22Å; F517-Y754 PolarHBondContact N-O 3.31Å; M518-Y754 HydrophobicContact CB-CD2 4.42Å; M518-Y754 PolarHBondContact O-N 2.9Å; M518-Y754 HydrophobicContact SD-CD2 4.47Å; L520-Y754 HydrophobicContact CD2-CD1 3.61Å; L520-Y754 HydrophobicContact CD2-CD2 3.46Å; L520-Y754 VanDerWaalsContact CD2-CD2 3.46Å; L520-Y754 HydrophobicContact CD2-CE1 3.41Å; L520-Y754 VanDerWaalsContact CD2-CE1 3.41Å; L520-Y754 HydrophobicContact CD2-CE2 3.25Å; L520-Y754 HydrophobicContact CD2-CG 3.63Å; E727-Y754 VanDerWaalsContact CD-OH 3.29Å; E727-Y754 PolarHBondContact OE2-OH 3.48Å
755	G	95.8	Very high	91.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	27%	0.274	C	S	.	.			trans	-125.5	154.7	174.8	0	0	0	0	0	110.5	L501	L501-G755 PolarHBondContact O-N 2.92Å
756	V	96.9	Very high	91.1	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	30%	0.299	C	S	.	.			trans	-76.7	129.7	168.5	-178.7	0	0	0	0	107.4	I454 I496 I498 F513 S514 F517 V768 V772	I454-V756 HydrophobicContact CD1-CG2 3.93Å; I496-V756 HydrophobicContact CD1-CG1 3.7Å; I496-V756 HydrophobicContact CG1-CG1 3.66Å; I498-V756 HydrophobicContact CG1-CG1 3.87Å; F513-V756 WeakPolarHBondContact CA-O 3.47Å; S514-V756 PolarHBondContact N-O 3Å; S514-V756 PolarHBondContact OG-N 3.23Å; S514-V756 PolarHBondContact OG-O 2.74Å; F517-V756 HydrophobicContact CD1-CG2 4.11Å; F517-V756 HydrophobicContact CE1-CG2 4.41Å; V756-V768 HydrophobicContact CB-CG1 3.89Å; V756-V768 HydrophobicContact CG1-CG1 3.66Å; V756-V768 HydrophobicContact CG2-CG1 4.4Å; V756-V772 HydrophobicContact CG2-CG2 4.14Å
757	A	96.8	Very high	91.2	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	144.3	-177.8	0	0	0	0	0	112	L489 I496 A497 L501 I511 D512 F513	L489-A757 HydrophobicContact CD1-CB 3.64Å; I496-A757 WeakPolarHBondContact CA-O 3.37Å; A497-A757 HydrophobicContact CB-CB 4.27Å; A497-A757 PolarHBondContact N-O 3.17Å; A497-A757 PolarHBondContact O-N 2.9Å; A497-A757 VanDerWaalsContact O-N 3.1Å; L501-A757 HydrophobicContact CD2-CB 3.9Å; I511-A757 HydrophobicContact CD1-CB 3.92Å; D512-A757 WeakPolarHBondContact O-CA 3.49Å; F513-A757 HydrophobicContact CD1-CB 3.88Å; F513-A757 HydrophobicContact CE1-CB 3.75Å; F513-A757 HydrophobicContact CG-CB 4.44Å; F513-A757 HydrophobicContact CZ-CB 4.18Å
758	T	96	Very high	91.4	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.012	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	154.3	178	53.5	0	0	0	0	110	I496 D512 L764	I496-T758 HydrophobicContact CG1-CG2 4.09Å; D512-T758 PolarHBondContact N-O 2.94Å; D512-T758 PolarHBondContact O-N 3.35Å; D512-T758 PolarHBondContact O-OG1 3.38Å; T758-L764 HydrophobicContact CG2-CB 4.42Å
759	P	93.3	Very high	91.5	Very high	30 Å²	30	42.8 Å²	42.8	20%	0.195	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	144.9	169.9	-23.1	34.3	0	0	0	110.3	L489 E495 G761 S762	L489-P759 HydrophobicContact CB-CG 4.37Å; L489-P759 HydrophobicContact CD2-CG 4.29Å; E495-P759 WeakPolarHBondContact O-CD 3.06Å; P759-G761 PolarHBondContact O-N 2.83Å; P759-S762 WeakPolarHBondContact O-CB 3.45Å; P759-S762 PolarHBondContact O-N 3.29Å
760	K	86.8	Confident	91.6	Very high	132 Å²	132	46.7 Å²	46.7	57%	0.574	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	129.1	-177.4	-162	170.1	-169.3	172.3	0	110.7	E509 S762	E509-K760 PolarHBondContact O-NZ 3.49Å; K760-S762 VanDerWaalsContact C-N 3.3Å; K760-S762 PolarHBondContact O-N 3.22Å
761	G	82.8	Confident	91.8	Very high	69 Å²	69	45.9 Å²	45.9	71%	0.711	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	12.6	-177.1	0	0	0	0	0	115.1	D512 P759	D512-G761 PolarHBondContact OD2-N 3.41Å; P759-G761 PolarHBondContact O-N 2.83Å
762	S	86.8	Confident	92.1	Very high	29 Å²	29	40 Å²	40	20%	0.203	24%	0.235	C	C	.	.			trans	-65	138.3	176.8	178.7	0	0	0	0	112.5	P759 K760 L764 R765	P759-S762 WeakPolarHBondContact O-CB 3.45Å; P759-S762 PolarHBondContact O-N 3.29Å; K760-S762 VanDerWaalsContact C-N 3.3Å; K760-S762 PolarHBondContact O-N 3.22Å; S762-L764 PolarHBondContact O-N 3.29Å; S762-L764 PolarHBondContact OG-N 3.1Å; S762-R765 WeakPolarHBondContact O-CB 3.39Å; S762-R765 PolarHBondContact O-N 3.42Å
763	S	86.5	Confident	92.3	Very high	107 Å²	107	41.3 Å²	41.3	75%	0.748	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-19.6	173.7	57.9	0	0	0	0	113.4	R765 P767	S763-R765 VanDerWaalsContact C-N 3.33Å; S763-P767 WeakPolarHBondContact O-CD 3.42Å
764	L	88.4	Confident	92.3	Very high	24 Å²	24	46.8 Å²	46.8	13%	0.126	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-18.8	177.7	-66.1	175.7	0	0	0	113.3	V417 E495 T758 S762 T766 P767 V768	V417-L764 HydrophobicContact CG1-CD1 4.09Å; E495-L764 HydrophobicContact CB-CD1 4.48Å; T758-L764 HydrophobicContact CG2-CB 4.42Å; S762-L764 PolarHBondContact O-N 3.29Å; S762-L764 PolarHBondContact OG-N 3.1Å; L764-T766 PolarHBondContact O-N 3.28Å; L764-P767 WeakPolarHBondContact O-CD 3.28Å; L764-V768 HydrophobicContact CB-CG2 4.4Å; L764-V768 VanDerWaalsContact O-CB 3.26Å; L764-V768 WeakPolarHBondContact O-CB 3.45Å; L764-V768 WeakPolarHBondContact O-CG2 3.43Å; L764-V768 PolarHBondContact O-N 3.37Å
765	R	90	Very high	92.3	Very high	98 Å²	98	46.8 Å²	46.8	37%	0.37	27%	0.266	S	S	.	.	H	α-helix	trans	-57.1	-53.9	-174.7	-179.8	-170.6	173.4	166.4	0.4	112.1	D512 S762 S763 V768 N769	D512-R765 HydrophobicContact CB-CG 4.32Å; D512-R765 IonicContact OD1-CZ 2.86Å; D512-R765 IonicContact OD1-NH1 3.52Å; D512-R765 PolarHBondContact OD1-NH1 3.04Å; D512-R765 IonicContact OD2-CZ 2.8Å; D512-R765 IonicContact OD2-NE 2.93Å; D512-R765 IonicContact OD2-NH1 3.55Å; D512-R765 PolarHBondContact OD2-NH1 2.92Å; S762-R765 WeakPolarHBondContact O-CB 3.39Å; S762-R765 PolarHBondContact O-N 3.42Å; S763-R765 VanDerWaalsContact C-N 3.33Å; R765-V768 PolarHBondContact O-N 3.04Å; R765-N769 WeakPolarHBondContact O-CB 3.34Å; R765-N769 PolarHBondContact O-N 3.12Å
766	T	89.9	Confident	92.2	Very high	92 Å²	92	49.8 Å²	49.8	56%	0.564	29%	0.287	S	S	*	.	H	α-helix	trans	-65.8	-48.6	-175.3	-52.4	0	0	0	0	112	L764 V768 N769 L770	L764-T766 PolarHBondContact O-N 3.28Å; T766-V768 PolarHBondContact O-N 3.07Å; T766-N769 PolarHBondContact O-N 3.26Å; T766-L770 HydrophobicContact CG2-CD1 4.31Å; T766-L770 WeakPolarHBondContact O-CG 3.48Å; T766-L770 PolarHBondContact O-N 2.8Å
767	P	92.1	Very high	92.1	Very high	52 Å²	52	58 Å²	58	34%	0.338	33%	0.325	S	S	.	.	H	α-helix	trans	-58.2	-45.1	174.4	-25.5	34.5	0	0	0	113.7	I458 S763 L764 N769 L770 A771	I458-P767 HydrophobicContact CD1-CB 4.31Å; I458-P767 HydrophobicContact CG1-CB 4.23Å; I458-P767 HydrophobicContact CG2-CB 4.22Å; S763-P767 WeakPolarHBondContact O-CD 3.42Å; L764-P767 WeakPolarHBondContact O-CD 3.28Å; P767-N769 PolarHBondContact O-N 3.32Å; P767-L770 PolarHBondContact O-N 2.92Å; P767-A771 WeakPolarHBondContact O-CB 3.44Å; P767-A771 PolarHBondContact O-N 2.82Å
768	V	93.9	Very high	92	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.012	35%	0.354	C	S	.	.	H	α-helix	trans	-62.7	-44.3	178.1	170.7	0	0	0	0	110.8	I454 I458 I496 V756 L764 R765 T766 L770 A771 V772	I454-V768 HydrophobicContact CG2-CG2 4.32Å; I458-V768 HydrophobicContact CD1-CB 4.31Å; I458-V768 HydrophobicContact CD1-CG2 3.48Å; I458-V768 VanDerWaalsContact CD1-CG2 3.48Å; I496-V768 HydrophobicContact CD1-CG1 4.37Å; I496-V768 HydrophobicContact CD1-CG2 3.66Å; V756-V768 HydrophobicContact CB-CG1 3.89Å; V756-V768 HydrophobicContact CG1-CG1 3.66Å; V756-V768 HydrophobicContact CG2-CG1 4.4Å; L764-V768 HydrophobicContact CB-CG2 4.4Å; L764-V768 VanDerWaalsContact O-CB 3.26Å; L764-V768 WeakPolarHBondContact O-CB 3.45Å; L764-V768 WeakPolarHBondContact O-CG2 3.43Å; L764-V768 PolarHBondContact O-N 3.37Å; R765-V768 PolarHBondContact O-N 3.04Å; T766-V768 PolarHBondContact O-N 3.07Å; V768-L770 VanDerWaalsContact C-N 3.34Å; V768-L770 PolarHBondContact O-N 2.63Å; V768-A771 PolarHBondContact O-N 3.4Å; V768-V772 HydrophobicContact CG1-CG2 4.37Å; V768-V772 WeakPolarHBondContact O-CG2 3.25Å; V768-V772 PolarHBondContact O-N 3.32Å
769	N	94.3	Very high	91.9	Very high	39 Å²	39	62.7 Å²	62.7	21%	0.209	37%	0.367	C	S	.	.	H	α-helix	trans	-61.4	-42.5	179.8	-172.1	59.1	0	0	0	112.4	K515 R765 T766 P767 L773	K515-N769 WeakPolarHBondContact CG-OD1 3.49Å; K515-N769 PolarHBondContact N-OD1 2.9Å; R765-N769 WeakPolarHBondContact O-CB 3.34Å; R765-N769 PolarHBondContact O-N 3.12Å; T766-N769 PolarHBondContact O-N 3.26Å; P767-N769 PolarHBondContact O-N 3.32Å; N769-L773 WeakPolarHBondContact O-CG 3.48Å; N769-L773 PolarHBondContact O-N 3.3Å
770	L	93.8	Very high	92	Very high	108 Å²	108	63 Å²	63	57%	0.565	37%	0.369	S	S	*	.	H	α-helix	trans	-67.6	-39.2	175	-67	175.1	0	0	0	112.1	T766 P767 V768 L773 K774	T766-L770 HydrophobicContact CG2-CD1 4.31Å; T766-L770 WeakPolarHBondContact O-CG 3.48Å; T766-L770 PolarHBondContact O-N 2.8Å; P767-L770 PolarHBondContact O-N 2.92Å; V768-L770 VanDerWaalsContact C-N 3.34Å; V768-L770 PolarHBondContact O-N 2.63Å; L770-L773 PolarHBondContact O-N 2.72Å; L770-K774 WeakPolarHBondContact O-CB 3.49Å; L770-K774 PolarHBondContact O-N 3.18Å
771	A	94.5	Very high	92.4	Very high	6 Å²	6	57 Å²	57	5%	0.05	34%	0.343	C	S	.	.	H	α-helix	trans	-62.2	-44.6	176	0	0	0	0	0	111.7	H457 I458 P767 V768 L773 K774 L775	H457-A771 HydrophobicContact CB-CB 4.02Å; I458-A771 HydrophobicContact CG1-CB 4.38Å; P767-A771 WeakPolarHBondContact O-CB 3.44Å; P767-A771 PolarHBondContact O-N 2.82Å; V768-A771 PolarHBondContact O-N 3.4Å; A771-L773 PolarHBondContact O-N 3.03Å; A771-K774 PolarHBondContact O-N 3.45Å; A771-L775 VanDerWaalsContact O-CG 3.28Å; A771-L775 WeakPolarHBondContact O-CG 3.4Å; A771-L775 PolarHBondContact O-N 3.43Å
772	V	95.8	Very high	93	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.012	34%	0.335	C	S	.	.	H	α-helix	trans	-60.8	-44.3	177.2	171	0	0	0	0	111.4	I454 F517 V756 V768 L775 S776	I454-V772 HydrophobicContact CD1-CG2 4.17Å; F517-V772 HydrophobicContact CB-CG1 3.88Å; V756-V772 HydrophobicContact CG2-CG2 4.14Å; V768-V772 HydrophobicContact CG1-CG2 4.37Å; V768-V772 WeakPolarHBondContact O-CG2 3.25Å; V768-V772 PolarHBondContact O-N 3.32Å; V772-L775 PolarHBondContact O-N 2.94Å; V772-S776 PolarHBondContact O-N 2.74Å
773	L	94.6	Very high	93.4	Very high	66 Å²	66	65 Å²	65	35%	0.346	36%	0.359	S	S	.	.	H	α-helix	trans	-61.4	-45	176.3	-72.6	171.9	0	0	0	111.8	K515 N769 L770 A771 L775 S776 E777	K515-L773 HydrophobicContact CB-CD2 4.21Å; K515-L773 HydrophobicContact CG-CD2 4.15Å; K515-L773 HydrophobicContact CG-CG 4.45Å; N769-L773 WeakPolarHBondContact O-CG 3.48Å; N769-L773 PolarHBondContact O-N 3.3Å; L770-L773 PolarHBondContact O-N 2.72Å; A771-L773 PolarHBondContact O-N 3.03Å; L773-L775 VanDerWaalsContact C-N 3.34Å; L773-L775 PolarHBondContact O-N 2.87Å; L773-S776 WeakPolarHBondContact O-CB 3.31Å; L773-S776 PolarHBondContact O-N 2.6Å; L773-S776 VanDerWaalsContact O-N 3.12Å; L773-E777 WeakPolarHBondContact O-CG 3.32Å; L773-E777 PolarHBondContact O-N 3.32Å
774	K	94.8	Very high	93.8	Very high	122 Å²	122	60.6 Å²	60.6	53%	0.53	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-40.6	177.3	-171.4	170.2	-176.5	172.7	0	112.6	L770 A771 S776 A778	L770-K774 WeakPolarHBondContact O-CB 3.49Å; L770-K774 PolarHBondContact O-N 3.18Å; A771-K774 PolarHBondContact O-N 3.45Å; K774-S776 VanDerWaalsContact C-N 3.3Å; K774-A778 VanDerWaalsContact O-CB 3.24Å; K774-A778 WeakPolarHBondContact O-CB 3.37Å; K774-A778 PolarHBondContact O-N 2.67Å
775	L	95.8	Very high	94.1	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-66.5	-33.4	175.5	-68.8	172.9	0	0	0	112.2	L450 E453 I454 A771 V772 L773 G779 V780 L781	L450-L775 HydrophobicContact CD1-CD1 4.05Å; E453-L775 HydrophobicContact CB-CD1 3.98Å; E453-L775 HydrophobicContact CB-CD2 3.96Å; I454-L775 HydrophobicContact CG1-CD1 4.05Å; A771-L775 VanDerWaalsContact O-CG 3.28Å; A771-L775 WeakPolarHBondContact O-CG 3.4Å; A771-L775 PolarHBondContact O-N 3.43Å; V772-L775 PolarHBondContact O-N 2.94Å; L773-L775 VanDerWaalsContact C-N 3.34Å; L773-L775 PolarHBondContact O-N 2.87Å; L775-G779 PolarHBondContact O-N 3.03Å; L775-V780 HydrophobicContact CB-CB 4.49Å; L775-V780 HydrophobicContact CD2-CB 4.04Å; L775-V780 HydrophobicContact CD2-CG1 4.03Å; L775-V780 HydrophobicContact CD2-CG2 4.26Å; L775-V780 PolarHBondContact O-N 3.42Å; L775-L781 HydrophobicContact CB-CD2 4.08Å; L775-L781 HydrophobicContact CB-CG 4.03Å; L775-L781 PolarHBondContact O-N 3.31Å
776	S	93.3	Very high	94.2	Very high	64 Å²	64	60.5 Å²	60.5	45%	0.448	33%	0.332	S	S	.	.	H	α-helix	trans	-68.8	-50.3	174.2	-167.9	0	0	0	0	111.6	V772 L773 K774 A778 G779	V772-S776 PolarHBondContact O-N 2.74Å; L773-S776 WeakPolarHBondContact O-CB 3.31Å; L773-S776 PolarHBondContact O-N 2.6Å; L773-S776 VanDerWaalsContact O-N 3.12Å; K774-S776 VanDerWaalsContact C-N 3.3Å; S776-A778 VanDerWaalsContact C-N 3.3Å; S776-A778 PolarHBondContact O-N 2.99Å; S776-G779 PolarHBondContact O-N 3.36Å; S776-G779 VanDerWaalsContact O-N 3.08Å
777	E	94.3	Very high	94.4	Very high	172 Å²	172	59.8 Å²	59.8	80%	0.804	32%	0.321	S	S	*	.	H	α-helix	trans	-63.7	-35.1	180	-71.9	174.8	-179	0	0	112.4	L773 G779	L773-E777 WeakPolarHBondContact O-CG 3.32Å; L773-E777 PolarHBondContact O-N 3.32Å; E777-G779 PolarHBondContact O-N 2.88Å
778	A	94.8	Very high	94.5	Very high	73 Å²	73	57.6 Å²	57.6	60%	0.603	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-3.1	175.9	0	0	0	0	0	114	K774 S776 V780	K774-A778 VanDerWaalsContact O-CB 3.24Å; K774-A778 WeakPolarHBondContact O-CB 3.37Å; K774-A778 PolarHBondContact O-N 2.67Å; S776-A778 VanDerWaalsContact C-N 3.3Å; S776-A778 PolarHBondContact O-N 2.99Å; A778-V780 HydrophobicContact CB-CG2 3.98Å; A778-V780 PolarHBondContact O-N 3.28Å
779	G	94.1	Very high	94.4	Very high	29 Å²	29	57.5 Å²	57.5	30%	0.299	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	14.4	-178.1	0	0	0	0	0	114.5	L775 S776 E777 K783	L775-G779 PolarHBondContact O-N 3.03Å; S776-G779 PolarHBondContact O-N 3.36Å; S776-G779 VanDerWaalsContact O-N 3.08Å; E777-G779 PolarHBondContact O-N 2.88Å; G779-K783 PolarHBondContact O-N 3.26Å; G779-K783 VanDerWaalsContact O-N 3.13Å
780	V	95.9	Very high	94.2	Very high	37 Å²	37	60.2 Å²	60.2	22%	0.224	31%	0.313	C	S	.	.	H	α-helix	trans	-69.4	-38.3	-179.7	179.1	0	0	0	0	110.5	E453 L775 A778 D782 K783 L784	E453-V780 HydrophobicContact CG-CG1 4.42Å; L775-V780 HydrophobicContact CB-CB 4.49Å; L775-V780 HydrophobicContact CD2-CB 4.04Å; L775-V780 HydrophobicContact CD2-CG1 4.03Å; L775-V780 HydrophobicContact CD2-CG2 4.26Å; L775-V780 PolarHBondContact O-N 3.42Å; A778-V780 HydrophobicContact CB-CG2 3.98Å; A778-V780 PolarHBondContact O-N 3.28Å; V780-D782 VanDerWaalsContact C-N 3.34Å; V780-D782 PolarHBondContact O-N 3.22Å; V780-K783 WeakPolarHBondContact O-CB 3.32Å; V780-K783 PolarHBondContact O-N 3.03Å; V780-L784 HydrophobicContact CG1-CD1 4.23Å; V780-L784 HydrophobicContact CG1-CG 4.31Å; V780-L784 WeakPolarHBondContact O-CG 3.35Å; V780-L784 PolarHBondContact O-N 3.14Å
781	L	94.9	Very high	93.9	Very high	6 Å²	6	61 Å²	61	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-61.9	-40.8	178.3	-61.8	179.6	0	0	0	112.1	L450 F517 L775 L784 K785	L450-L781 HydrophobicContact CD1-CD2 3.65Å; F517-L781 HydrophobicContact CB-CD1 4.03Å; F517-L781 HydrophobicContact CB-CD2 4.46Å; L775-L781 HydrophobicContact CB-CD2 4.08Å; L775-L781 HydrophobicContact CB-CG 4.03Å; L775-L781 PolarHBondContact O-N 3.31Å; L781-L784 PolarHBondContact O-N 3.23Å; L781-K785 WeakPolarHBondContact O-CB 3.44Å; L781-K785 PolarHBondContact O-N 2.9Å
782	D	93.7	Very high	93.5	Very high	104 Å²	104	64.7 Å²	64.7	56%	0.556	33%	0.333	S	S	*	.	H	α-helix	trans	-68	-41.6	176.1	-68.8	-36.9	0	0	0	111.7	V780 L784 K785 N786	V780-D782 VanDerWaalsContact C-N 3.34Å; V780-D782 PolarHBondContact O-N 3.22Å; D782-L784 VanDerWaalsContact C-N 3.34Å; D782-L784 PolarHBondContact O-N 3.46Å; D782-K785 PolarHBondContact O-N 3.31Å; D782-N786 PolarHBondContact O-N 3.4Å
783	K	95.6	Very high	92.9	Very high	160 Å²	160	65.8 Å²	65.8	70%	0.696	34%	0.344	S	S	*	.	H	α-helix	trans	-59.2	-44.6	173.8	-174.4	179.8	-179.4	179.4	0	111.7	G779 V780 N786 K787	G779-K783 PolarHBondContact O-N 3.26Å; G779-K783 VanDerWaalsContact O-N 3.13Å; V780-K783 WeakPolarHBondContact O-CB 3.32Å; V780-K783 PolarHBondContact O-N 3.03Å; K783-N786 PolarHBondContact O-N 2.92Å; K783-K787 WeakPolarHBondContact O-CB 3.44Å; K783-K787 PolarHBondContact O-N 3.18Å
784	L	95.3	Very high	92.5	Very high	15 Å²	15	67.1 Å²	67.1	8%	0.079	35%	0.349	C	S	.	.	H	α-helix	trans	-65.5	-39	176.1	-71	178.6	0	0	0	111.7	Y446 D449 V780 L781 D782 K787 W788	Y446-L784 HydrophobicContact CD2-CB 3.84Å; Y446-L784 HydrophobicContact CE2-CB 3.52Å; D449-L784 HydrophobicContact CB-CD1 4.3Å; D449-L784 HydrophobicContact CB-CD2 3.72Å; V780-L784 HydrophobicContact CG1-CD1 4.23Å; V780-L784 HydrophobicContact CG1-CG 4.31Å; V780-L784 WeakPolarHBondContact O-CG 3.35Å; V780-L784 PolarHBondContact O-N 3.14Å; L781-L784 PolarHBondContact O-N 3.23Å; D782-L784 VanDerWaalsContact C-N 3.34Å; D782-L784 PolarHBondContact O-N 3.46Å; L784-K787 PolarHBondContact O-N 2.86Å; L784-W788 VanDerWaalsContact O-CD1 3.26Å; L784-W788 PolarHBondContact O-N 3.48Å
785	K	94.1	Very high	91.9	Very high	47 Å²	47	62.2 Å²	62.2	20%	0.204	33%	0.33	C	S	.	.	H	α-helix	trans	-62.1	-47.5	176.5	-173.7	-179	177.9	-177.3	0	110.5	Y446 M518 E732 L781 D782 K787 W788 W789	Y446-K785 HydrophobicContact CE2-CB 4.34Å; M518-K785 HydrophobicContact CE-CB 4.41Å; M518-K785 HydrophobicContact CE-CD 4.31Å; M518-K785 HydrophobicContact CE-CG 4.2Å; E732-K785 IonicContact OE2-NZ 3.78Å; L781-K785 WeakPolarHBondContact O-CB 3.44Å; L781-K785 PolarHBondContact O-N 2.9Å; D782-K785 PolarHBondContact O-N 3.31Å; K785-K787 PolarHBondContact O-N 3.18Å; K785-W788 PolarHBondContact O-N 2.78Å; K785-W789 HydrophobicContact CG-CD2 4.38Å; K785-W789 HydrophobicContact CG-CE3 4.14Å; K785-W789 WeakPolarHBondContact O-CB 3.49Å; K785-W789 PolarHBondContact O-N 3.48Å
786	N	93	Very high	90.4	Very high	74 Å²	74	64.4 Å²	64.4	40%	0.396	35%	0.352	S	S	.	.	H	α-helix	trans	-60.7	-44.3	178.8	-70.6	-17.8	0	0	0	112.3	D782 K783 W788 Y790 D791	D782-N786 PolarHBondContact O-N 3.4Å; K783-N786 PolarHBondContact O-N 2.92Å; N786-W788 VanDerWaalsContact C-N 3.34Å; N786-W788 PolarHBondContact O-N 3.34Å; N786-Y790 HydrophobicContact CB-CD2 4.49Å; N786-Y790 PolarHBondContact O-N 3.36Å; N786-Y790 WeakPolarHBondContact OD1-CD2 3.49Å; N786-D791 PolarHBondContact O-N 3.39Å
787	K	94.3	Very high	88.5	Confident	77 Å²	77	66.6 Å²	66.6	34%	0.335	37%	0.365	S	S	.	.	I	π-helix	trans	-54	-46.7	176.6	179.7	-175	175.6	-169.3	0	112.9	D449 K783 L784 K785 D791 K792	D449-K787 IonicContact OD1-NZ 3.83Å; D449-K787 IonicContact OD2-NZ 3.64Å; D449-K787 PolarHBondContact OD2-NZ 3.16Å; K783-K787 WeakPolarHBondContact O-CB 3.44Å; K783-K787 PolarHBondContact O-N 3.18Å; L784-K787 PolarHBondContact O-N 2.86Å; K785-K787 PolarHBondContact O-N 3.18Å; K787-D791 WeakPolarHBondContact CA-OD2 3.42Å; K787-K792 WeakPolarHBondContact O-CG 3.22Å; K787-K792 PolarHBondContact O-N 2.99Å
788	W	94.4	Very high	86.5	Confident	5 Å²	5	66.9 Å²	66.9	2%	0.019	36%	0.364	C	S	.	.	I	π-helix	trans	-91.7	-21.8	-171	-72.4	106.2	0	0	0	114.6	P426 M429 E444 G445 D449 L784 K785 N786 K792	P426-W788 HydrophobicContact CB-CB 4.31Å; P426-W788 HydrophobicContact CB-CE3 4.5Å; M429-W788 HydrophobicContact CE-CE3 4.02Å; M429-W788 HydrophobicContact CE-CZ3 3.62Å; E444-W788 HydrophobicContact CB-CH2 3.98Å; E444-W788 HydrophobicContact CG-CH2 4.23Å; G445-W788 VanDerWaalsContact CA-CH2 3.47Å; G445-W788 VanDerWaalsContact CA-CZ2 3.46Å; G445-W788 VanDerWaalsContact N-CH2 3.25Å; D449-W788 PolarHBondContact OD2-NE1 3.14Å; L784-W788 VanDerWaalsContact O-CD1 3.26Å; L784-W788 PolarHBondContact O-N 3.48Å; K785-W788 PolarHBondContact O-N 2.78Å; N786-W788 VanDerWaalsContact C-N 3.34Å; N786-W788 PolarHBondContact O-N 3.34Å; W788-K792 HydrophobicContact CE3-CD 3.91Å; W788-K792 HydrophobicContact CZ3-CD 3.97Å
789	W	92.4	Very high	83.9	Confident	1 Å²	1	69.2 Å²	69.2	0%	0.004	37%	0.366	C	S	.	.	I	π-helix	trans	-99.3	-47.1	178.2	-86.1	-107.5	0	0	0	113.7	P426 Y427 Y446 M518 T729 K785	P426-W789 HydrophobicContact CG-CD2 4.09Å; P426-W789 HydrophobicContact CG-CE3 4Å; P426-W789 HydrophobicContact CG-CH2 3.57Å; P426-W789 HydrophobicContact CG-CZ2 3.65Å; P426-W789 HydrophobicContact CG-CZ3 3.77Å; Y427-W789 HydrophobicContact CD1-CH2 4.11Å; Y427-W789 AromaticContact CE1-CH2 3.57Å; Y427-W789 HydrophobicContact CE1-CH2 3.57Å; Y427-W789 HydrophobicContact CE1-CZ2 4.01Å; Y427-W789 HydrophobicContact CE2-CZ2 4.42Å; Y427-W789 AromaticContact CZ-CH2 3.81Å; Y427-W789 AromaticContact CZ-CZ2 3.76Å; Y446-W789 AromaticContact CD2-CZ3 3.75Å; Y446-W789 HydrophobicContact CD2-CZ3 3.75Å; Y446-W789 HydrophobicContact CG-CH2 4.36Å; Y446-W789 AromaticContact CG-CZ3 3.89Å; Y446-W789 HydrophobicContact CG-CZ3 3.89Å; M518-W789 HydrophobicContact CE-CH2 4.24Å; M518-W789 HydrophobicContact CE-CZ3 4.37Å; T729-W789 PolarHBondContact O-NE1 3.03Å; K785-W789 HydrophobicContact CG-CD2 4.38Å; K785-W789 HydrophobicContact CG-CE3 4.14Å; K785-W789 WeakPolarHBondContact O-CB 3.49Å; K785-W789 PolarHBondContact O-N 3.48Å
790	Y	89.1	Confident	81.4	Confident	96 Å²	96	73.1 Å²	73.1	38%	0.376	39%	0.389	S	S	.	.	I	π-helix	trans	-106.6	-47.7	-167.5	-56	-58.7	0	0	0	112.4	Q736 N786 K792 G793	Q736-Y790 HydrophobicContact CG-CD1 4.32Å; N786-Y790 HydrophobicContact CB-CD2 4.49Å; N786-Y790 PolarHBondContact O-N 3.36Å; N786-Y790 WeakPolarHBondContact OD1-CD2 3.49Å; Y790-K792 VanDerWaalsContact C-N 3.31Å; Y790-K792 PolarHBondContact O-N 3.37Å; Y790-G793 PolarHBondContact O-N 3.39Å
791	D	88.4	Confident	79	Confident	125 Å²	125	74.8 Å²	74.8	67%	0.668	41%	0.414	S	S	*	.	I	π-helix	trans	-67.1	-34.8	-177.2	-59.6	-16.7	0	0	0	112	N786 K787 G793	N786-D791 PolarHBondContact O-N 3.39Å; K787-D791 WeakPolarHBondContact CA-OD2 3.42Å; D791-G793 VanDerWaalsContact C-N 3.32Å
792	K	85.7	Confident	76.5	Confident	83 Å²	83	78.7 Å²	78.7	36%	0.361	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	13.9	172.6	-70.7	-173.9	175.5	-171.4	0	113.1	R737 K787 W788 Y790	R737-K792 PolarHBondContact NH1-O 2.86Å; K787-K792 WeakPolarHBondContact O-CG 3.22Å; K787-K792 PolarHBondContact O-N 2.99Å; W788-K792 HydrophobicContact CE3-CD 3.91Å; W788-K792 HydrophobicContact CZ3-CD 3.97Å; Y790-K792 VanDerWaalsContact C-N 3.31Å; Y790-K792 PolarHBondContact O-N 3.37Å
793	G	83.5	Confident	74	Confident	24 Å²	24	83.1 Å²	83.1	25%	0.247	46%	0.456	C	S	.	.			trans	-64.7	137.6	174.2	0	0	0	0	0	110.9	Y790 D791	Y790-G793 PolarHBondContact O-N 3.39Å; D791-G793 VanDerWaalsContact C-N 3.32Å
794	E	85.8	Confident	71.6	Confident	95 Å²	95	82.9 Å²	82.9	44%	0.444	46%	0.462	S	S	.	.	S	Bend	trans	-96.3	-15.7	178.8	-65.4	170.4	-156.7	0	0	112.5	Q736 R737 K738	Q736-E794 PolarHBondContact O-N 3.1Å; R737-E794 IonicContact CZ-OE1 3.67Å; R737-E794 IonicContact NH1-OE1 3.53Å; R737-E794 PolarHBondContact NH1-OE1 3.49Å; K738-E794 HydrophobicContact CD-CB 4.27Å; K738-E794 HydrophobicContact CG-CB 3.93Å
795	C	81.1	Confident	69.2	Low	18 Å²	18	90.8 Å²	90.8	12%	0.122	50%	0.496	C	S	.	.	S	Bend	trans	-82.8	130.9	173.2	-64.2	0	0	0	0	108.8	E735 Q736 R737 C740	E735-C795 PolarHBondContact O-SG 3.49Å; E735-C795 VanDerWaalsContact O-SG 3.38Å; Q736-C795 PolarHBondContact O-N 3.27Å; Q736-C795 VanDerWaalsContact O-N 3.17Å; Q736-C795 PolarHBondContact O-SG 2.93Å; Q736-C795 VanDerWaalsContact O-SG 3.4Å; R737-C795 PolarHBondContact N-SG 2.81Å; R737-C795 PolarHBondContact O-SG 3.44Å; R737-C795 VanDerWaalsContact O-SG 3.35Å; C740-C795 VanDerWaalsContact CA-SG 3.54Å; C740-C795 HydrophobicContact CB-CB 3.95Å; C740-C795 WeakPolarHBondContact CB-SG 3.36Å; C740-C795 WeakPolarHBondContact SG-CA 3.47Å; C740-C795 WeakPolarHBondContact SG-CB 3.43Å; C740-C795 CovalentContact SG-SG 2.02Å; C740-C795 PolarHBondContact SG-SG 2.98Å
796	G	63.8	Low	66.8	Low	47 Å²	47	95 Å²	95	49%	0.485	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-57	166.7	178.8	0	0	0	0	0	112.2
797	P	54.7	Low	65	Low	110 Å²	110	96.8 Å²	96.8	71%	0.714	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-49.8	150.6	178.5	22.2	-32.7	0	0	0	110.4	D799 S800	P797-D799 CarbonylContact O-C 3.54Å; P797-D799 PolarHBondContact O-N 3.39Å; P797-S800 PolarHBondContact O-N 2.93Å; P797-S800 VanDerWaalsContact O-N 3.16Å
798	K	52.1	Low	63.3	Low	179 Å²	179	97.5 Å²	97.5	78%	0.778	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.5	-5.6	-173.8	-84.6	-178.2	171.7	179.3	0	116.2
799	D	41	Very low	61.9	Low	121 Å²	121	102.4 Å²	102.4	65%	0.647	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.1	49.4	178.3	-62.1	-49.5	0	0	0	113.7	P797 G801 S802	P797-D799 CarbonylContact O-C 3.54Å; P797-D799 PolarHBondContact O-N 3.39Å; D799-G801 PolarHBondContact O-N 3.17Å; D799-S802 PolarHBondContact O-N 3.03Å; D799-S802 PolarHBondContact O-OG 3.35Å
800	S	40.8	Very low	60.7	Low	111 Å²	111	105.1 Å²	105.1	78%	0.776	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	22	161.3	62.9	0	0	0	0	113.5	P797	P797-S800 PolarHBondContact O-N 2.93Å; P797-S800 VanDerWaalsContact O-N 3.16Å
801	G	45.7	Very low	59.9	Low	73 Å²	73	106.7 Å²	106.7	75%	0.753	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-9.9	157.9	0	0	0	0	0	113.9	D799	D799-G801 PolarHBondContact O-N 3.17Å
802	S	43.1	Very low	59	Low	88 Å²	88	103.2 Å²	103.2	62%	0.615	61%	0.609	S	S	*	*			trans	-106.7	49	-173.1	77.9	0	0	0	0	114.8	D799	D799-S802 PolarHBondContact O-N 3.03Å; D799-S802 PolarHBondContact O-OG 3.35Å
803	K	40.4	Very low	58.4	Low	197 Å²	197	100.4 Å²	100.4	86%	0.857	60%	0.598	S	S	*	*	S	Bend	trans	-124.9	93	147	-82.7	-167.4	177.5	-176.9	0	107.1	K805	K803-K805 VanDerWaalsContact C-N 3.33Å; K803-K805 PolarHBondContact O-N 2.72Å
804	D	44.5	Very low	58.1	Low	154 Å²	154	101.4 Å²	101.4	82%	0.824	60%	0.599	S	S	*	*			trans	-41.9	92.5	173.5	-65.3	-54	0	0	0	111.1
805	K	44.5	Very low	57.9	Low	182 Å²	182	97.6 Å²	97.6	79%	0.791	58%	0.584	S	S	*	*			trans	-82.9	107.2	145.9	-70.9	-174.4	178.8	-176.7	0	103.7	K803 S807	K803-K805 VanDerWaalsContact C-N 3.33Å; K803-K805 PolarHBondContact O-N 2.72Å; K805-S807 PolarHBondContact O-N 3.15Å; K805-S807 PolarHBondContact O-OG 3.39Å
806	T	44.7	Very low	58	Low	136 Å²	136	96.8 Å²	96.8	83%	0.834	58%	0.578	S	S	*	*			trans	-41.1	106.8	163.8	40	0	0	0	0	107.3	A808	T806-A808 PolarHBondContact O-N 3.45Å
807	S	54.4	Low	59.2	Low	110 Å²	110	98 Å²	98	77%	0.769	58%	0.576	S	S	*	*			trans	-73.2	99.1	-169.5	-68.4	0	0	0	0	106.9	K805 L809	K805-S807 PolarHBondContact O-N 3.15Å; K805-S807 PolarHBondContact O-OG 3.39Å; S807-L809 PolarHBondContact O-N 3.09Å
808	A	58.7	Low	60.7	Low	93 Å²	93	98.1 Å²	98.1	77%	0.769	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-60.6	134.3	174.8	0	0	0	0	0	108.9	T806 S810	T806-A808 PolarHBondContact O-N 3.45Å; A808-S810 PolarHBondContact O-N 3.07Å
809	L	64.6	Low	62.5	Low	108 Å²	108	96.7 Å²	96.7	57%	0.565	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-60.4	119.5	178.5	-164.8	74.7	0	0	0	109.3	L646 S807 N813 V814	L646-L809 HydrophobicContact CD1-CD1 3.94Å; L646-L809 HydrophobicContact CD2-CD1 3.83Å; S807-L809 PolarHBondContact O-N 3.09Å; L809-N813 HydrophobicContact CD1-CB 4.48Å; L809-V814 HydrophobicContact CD2-CG2 3.51Å; L809-V814 HydrophobicContact CG-CG2 4.04Å
810	S	67.1	Low	64.8	Low	57 Å²	57	95.6 Å²	95.6	40%	0.399	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-75.7	144	179	-177.2	0	0	0	0	110.9	A808 S812 N813	A808-S810 PolarHBondContact O-N 3.07Å; S810-S812 WeakPolarHBondContact CB-OG 3.44Å; S810-S812 PolarHBondContact O-N 3.48Å; S810-S812 VanDerWaalsContact O-N 3.1Å; S810-S812 PolarHBondContact OG-N 3.35Å; S810-S812 PolarHBondContact OG-OG 3.15Å; S810-N813 WeakPolarHBondContact O-CB 3.22Å; S810-N813 PolarHBondContact O-N 3.32Å
811	L	73.4	Confident	67.2	Low	130 Å²	130	95.1 Å²	95.1	68%	0.681	54%	0.538	S	S	*	.	H	α-helix	trans	-52.7	-31.4	169.6	-176.9	65.9	0	0	0	111.8	N813 V814 A815 F818	L811-N813 VanDerWaalsContact C-N 3.27Å; L811-N813 PolarHBondContact O-N 2.91Å; L811-V814 PolarHBondContact O-N 2.9Å; L811-V814 VanDerWaalsContact O-N 3.16Å; L811-A815 WeakPolarHBondContact O-CB 3.42Å; L811-A815 PolarHBondContact O-N 3.09Å; L811-F818 HydrophobicContact CD1-CE2 4.25Å
812	S	70.1	Confident	69.4	Low	51 Å²	51	96.5 Å²	96.5	36%	0.357	53%	0.531	S	S	.	.	H	α-helix	trans	-62.5	-30.4	178.1	57.5	0	0	0	0	113.8	S810 V814	S810-S812 WeakPolarHBondContact CB-OG 3.44Å; S810-S812 PolarHBondContact O-N 3.48Å; S810-S812 VanDerWaalsContact O-N 3.1Å; S810-S812 PolarHBondContact OG-N 3.35Å; S810-S812 PolarHBondContact OG-OG 3.15Å; S812-V814 VanDerWaalsContact C-N 3.33Å
813	N	71.7	Confident	71.7	Confident	25 Å²	25	94.4 Å²	94.4	13%	0.134	52%	0.524	C	S	.	.	H	α-helix	trans	-76.2	-23.4	178.5	-59.2	11.2	0	0	0	112	P534 L809 S810 L811	P534-N813 WeakPolarHBondContact CG-OD1 3.44Å; L809-N813 HydrophobicContact CD1-CB 4.48Å; S810-N813 WeakPolarHBondContact O-CB 3.22Å; S810-N813 PolarHBondContact O-N 3.32Å; L811-N813 VanDerWaalsContact C-N 3.27Å; L811-N813 PolarHBondContact O-N 2.91Å
814	V	77.7	Confident	74.2	Confident	44 Å²	44	87 Å²	87	27%	0.267	50%	0.503	S	S	.	.	H	α-helix	trans	-108.7	-8.3	-175.1	-167.7	0	0	0	0	112	L809 L811 S812 G816 V817 F818	L809-V814 HydrophobicContact CD2-CG2 3.51Å; L809-V814 HydrophobicContact CG-CG2 4.04Å; L811-V814 PolarHBondContact O-N 2.9Å; L811-V814 VanDerWaalsContact O-N 3.16Å; S812-V814 VanDerWaalsContact C-N 3.33Å; V814-G816 VanDerWaalsContact C-N 3.27Å; V814-G816 PolarHBondContact O-N 2.84Å; V814-V817 HydrophobicContact CG1-CB 4.23Å; V814-V817 HydrophobicContact CG1-CG2 4.23Å; V814-V817 WeakPolarHBondContact O-CB 3.3Å; V814-V817 PolarHBondContact O-N 2.7Å; V814-F818 HydrophobicContact CG1-CD2 4.36Å; V814-F818 HydrophobicContact CG1-CE2 3.99Å
815	A	81.6	Confident	76.5	Confident	16 Å²	16	85.1 Å²	85.1	13%	0.132	49%	0.492	C	S	.	.	H	α-helix	trans	-54.8	-39.3	-176.5	0	0	0	0	0	113.2	L811 V817 F818 Y819	L811-A815 WeakPolarHBondContact O-CB 3.42Å; L811-A815 PolarHBondContact O-N 3.09Å; A815-V817 VanDerWaalsContact C-N 3.27Å; A815-V817 PolarHBondContact O-N 2.92Å; A815-F818 PolarHBondContact O-N 3.11Å; A815-F818 VanDerWaalsContact O-N 3.16Å; A815-Y819 HydrophobicContact CB-CE2 4.37Å; A815-Y819 PolarHBondContact O-N 3.33Å; A815-Y819 VanDerWaalsContact O-N 3.11Å
816	G	84.3	Confident	78.8	Confident	0 Å²	0	78.5 Å²	78.5	0%	0	48%	0.476	C	S	.	.	H	α-helix	trans	-61.1	-33.4	177.7	0	0	0	0	0	113.9	V536 V814 F818 Y819 I820	V536-G816 VanDerWaalsContact O-CA 3.28Å; V536-G816 WeakPolarHBondContact O-CA 3.12Å; V536-G816 PolarHBondContact O-N 3.11Å; V814-G816 VanDerWaalsContact C-N 3.27Å; V814-G816 PolarHBondContact O-N 2.84Å; G816-F818 VanDerWaalsContact C-N 3.34Å; G816-F818 PolarHBondContact O-N 3.14Å; G816-Y819 PolarHBondContact O-N 3.28Å; G816-I820 WeakPolarHBondContact O-CG1 3.29Å; G816-I820 PolarHBondContact O-N 3.49Å
817	V	87.6	Confident	81	Confident	72 Å²	72	77.2 Å²	77.2	44%	0.436	46%	0.464	S	S	.	.	H	α-helix	trans	-65.3	-40.6	176.9	-174.7	0	0	0	0	110.5	F539 V814 A815 I820 L821	F539-V817 HydrophobicContact CD1-CG2 4.04Å; F539-V817 HydrophobicContact CE1-CG2 4.19Å; F539-V817 HydrophobicContact CG-CG2 4.28Å; V814-V817 HydrophobicContact CG1-CB 4.23Å; V814-V817 HydrophobicContact CG1-CG2 4.23Å; V814-V817 WeakPolarHBondContact O-CB 3.3Å; V814-V817 PolarHBondContact O-N 2.7Å; A815-V817 VanDerWaalsContact C-N 3.27Å; A815-V817 PolarHBondContact O-N 2.92Å; V817-I820 PolarHBondContact O-N 3.48Å; V817-L821 PolarHBondContact O-N 2.96Å
818	F	87	Confident	82.8	Confident	113 Å²	113	74.9 Å²	74.9	50%	0.496	45%	0.451	S	S	.	.	H	α-helix	trans	-66.5	-37.8	175.1	-72.3	-79	0	0	0	112.5	L811 V814 A815 G816 L821 V822	L811-F818 HydrophobicContact CD1-CE2 4.25Å; V814-F818 HydrophobicContact CG1-CD2 4.36Å; V814-F818 HydrophobicContact CG1-CE2 3.99Å; A815-F818 PolarHBondContact O-N 3.11Å; A815-F818 VanDerWaalsContact O-N 3.16Å; G816-F818 VanDerWaalsContact C-N 3.34Å; G816-F818 PolarHBondContact O-N 3.14Å; F818-L821 PolarHBondContact O-N 3.39Å; F818-V822 WeakPolarHBondContact O-CG2 3.47Å; F818-V822 PolarHBondContact O-N 3.09Å
819	Y	89.3	Confident	84.3	Confident	149 Å²	149	77.2 Å²	77.2	58%	0.584	45%	0.447	S	S	*	.	H	α-helix	trans	-63.5	-41.7	175.6	-62.6	-32.8	0	0	0	112.2	V536 A815 G816 G823	V536-Y819 HydrophobicContact CG1-CD2 3.57Å; V536-Y819 HydrophobicContact CG1-CE2 3.54Å; A815-Y819 HydrophobicContact CB-CE2 4.37Å; A815-Y819 PolarHBondContact O-N 3.33Å; A815-Y819 VanDerWaalsContact O-N 3.11Å; G816-Y819 PolarHBondContact O-N 3.28Å; Y819-G823 PolarHBondContact O-N 3.01Å
820	I	90	Very high	85.6	Confident	99 Å²	99	76.4 Å²	76.4	51%	0.508	44%	0.443	S	S	.	.	H	α-helix	trans	-64.2	-42.2	176	-67.8	170.6	0	0	0	110.7	F539 G816 V817 G823 G824	F539-I820 HydrophobicContact CE2-CD1 4.45Å; F539-I820 HydrophobicContact CZ-CD1 3.67Å; G816-I820 WeakPolarHBondContact O-CG1 3.29Å; G816-I820 PolarHBondContact O-N 3.49Å; V817-I820 PolarHBondContact O-N 3.48Å; I820-G823 PolarHBondContact O-N 3.01Å; I820-G824 PolarHBondContact O-N 2.96Å
821	L	90.1	Very high	86.7	Confident	101 Å²	101	76.8 Å²	76.8	53%	0.529	44%	0.443	S	S	.	.	H	α-helix	trans	-60.5	-50.8	177.6	178.5	63.6	0	0	0	112.1	V817 F818 G824 L825	V817-L821 PolarHBondContact O-N 2.96Å; F818-L821 PolarHBondContact O-N 3.39Å; L821-G824 PolarHBondContact O-N 2.91Å; L821-L825 HydrophobicContact CD1-CD1 4.46Å; L821-L825 HydrophobicContact CG-CD1 4.39Å; L821-L825 WeakPolarHBondContact O-CG 3.34Å; L821-L825 PolarHBondContact O-N 3Å
822	V	92.1	Very high	87.4	Confident	101 Å²	101	73.2 Å²	73.2	61%	0.612	43%	0.432	S	S	*	.	H	α-helix	trans	-64.6	-42.1	179.6	174.2	0	0	0	0	111	F818 G824 L825 G826	F818-V822 WeakPolarHBondContact O-CG2 3.47Å; F818-V822 PolarHBondContact O-N 3.09Å; V822-G824 VanDerWaalsContact C-N 3.34Å; V822-G824 PolarHBondContact O-N 2.89Å; V822-L825 PolarHBondContact O-N 3.33Å; V822-G826 PolarHBondContact O-N 3.16Å
823	G	92.9	Very high	88.2	Confident	45 Å²	45	75.7 Å²	75.7	46%	0.464	44%	0.441	S	S	.	.	H	α-helix	trans	-59.7	-43.3	174.4	0	0	0	0	0	112.5	Y819 I820 G826 L827	Y819-G823 PolarHBondContact O-N 3.01Å; I820-G823 PolarHBondContact O-N 3.01Å; G823-G826 PolarHBondContact O-N 3.46Å; G823-L827 WeakPolarHBondContact O-CB 3.47Å; G823-L827 PolarHBondContact O-N 3.16Å
824	G	92.1	Very high	88.9	Confident	40 Å²	40	79.2 Å²	79.2	41%	0.412	46%	0.459	S	S	.	.	H	α-helix	trans	-63.9	-43.9	177.2	0	0	0	0	0	113.1	I820 L821 V822 L827 A828	I820-G824 PolarHBondContact O-N 2.96Å; L821-G824 PolarHBondContact O-N 2.91Å; V822-G824 VanDerWaalsContact C-N 3.34Å; V822-G824 PolarHBondContact O-N 2.89Å; G824-L827 PolarHBondContact O-N 3.41Å; G824-A828 WeakPolarHBondContact O-CB 3.48Å; G824-A828 PolarHBondContact O-N 3.08Å
825	L	92.9	Very high	89.4	Confident	115 Å²	115	83.3 Å²	83.3	60%	0.602	48%	0.475	S	S	*	.	H	α-helix	trans	-62.6	-42.1	174.6	-70.6	171.8	0	0	0	111.9	L821 V822 A828 M829	L821-L825 HydrophobicContact CD1-CD1 4.46Å; L821-L825 HydrophobicContact CG-CD1 4.39Å; L821-L825 WeakPolarHBondContact O-CG 3.34Å; L821-L825 PolarHBondContact O-N 3Å; V822-L825 PolarHBondContact O-N 3.33Å; L825-A828 PolarHBondContact O-N 2.91Å; L825-M829 WeakPolarHBondContact O-CB 3.38Å; L825-M829 PolarHBondContact O-N 3.3Å
826	G	91.9	Very high	89.4	Confident	43 Å²	43	85.7 Å²	85.7	44%	0.443	48%	0.482	S	S	.	.	H	α-helix	trans	-62.3	-43.7	175.5	0	0	0	0	0	112.5	V822 G823 M829 L830	V822-G826 PolarHBondContact O-N 3.16Å; G823-G826 PolarHBondContact O-N 3.46Å; G826-M829 PolarHBondContact O-N 3Å; G826-L830 WeakPolarHBondContact O-CB 3.46Å; G826-L830 PolarHBondContact O-N 3.45Å
827	L	92.4	Very high	89.3	Confident	110 Å²	110	87.7 Å²	87.7	58%	0.576	50%	0.496	S	S	*	.	H	α-helix	trans	-65.1	-43.9	176.8	-176.7	62.9	0	0	0	111.8	G823 G824 M829 L830 V831	G823-L827 WeakPolarHBondContact O-CB 3.47Å; G823-L827 PolarHBondContact O-N 3.16Å; G824-L827 PolarHBondContact O-N 3.41Å; L827-M829 PolarHBondContact O-N 2.82Å; L827-L830 WeakPolarHBondContact O-CB 3.42Å; L827-L830 PolarHBondContact O-N 3.06Å; L827-V831 HydrophobicContact CD1-CG2 4.46Å; L827-V831 WeakPolarHBondContact O-CG2 3.49Å; L827-V831 PolarHBondContact O-N 3.49Å
828	A	91.8	Very high	89.2	Confident	60 Å²	60	92.7 Å²	92.7	50%	0.496	51%	0.508	S	S	.	.	H	α-helix	trans	-61.1	-43.9	177.1	0	0	0	0	0	111.8	G824 L825 L830 V831 A832	G824-A828 WeakPolarHBondContact O-CB 3.48Å; G824-A828 PolarHBondContact O-N 3.08Å; L825-A828 PolarHBondContact O-N 2.91Å; A828-L830 VanDerWaalsContact C-N 3.33Å; A828-L830 PolarHBondContact O-N 3.48Å; A828-V831 PolarHBondContact O-N 2.9Å; A828-A832 WeakPolarHBondContact O-CB 3.38Å; A828-A832 PolarHBondContact O-N 3.42Å
829	M	90.8	Very high	88.9	Confident	142 Å²	142	93.5 Å²	93.5	70%	0.7	51%	0.512	S	S	*	.	H	α-helix	trans	-62.6	-40.5	175.7	-172.5	-178.1	-73.3	0	0	111.7	L825 G826 L827 L833	L825-M829 WeakPolarHBondContact O-CB 3.38Å; L825-M829 PolarHBondContact O-N 3.3Å; G826-M829 PolarHBondContact O-N 3Å; L827-M829 PolarHBondContact O-N 2.82Å; M829-L833 WeakPolarHBondContact O-CB 3.22Å; M829-L833 PolarHBondContact O-N 2.95Å
830	L	90.8	Very high	88.1	Confident	92 Å²	92	86.5 Å²	86.5	48%	0.482	48%	0.484	S	S	.	.	H	α-helix	trans	-63.6	-46.6	176.2	-179.7	65.3	0	0	0	111.7	G826 L827 A828 L833 I834	G826-L830 WeakPolarHBondContact O-CB 3.46Å; G826-L830 PolarHBondContact O-N 3.45Å; L827-L830 WeakPolarHBondContact O-CB 3.42Å; L827-L830 PolarHBondContact O-N 3.06Å; A828-L830 VanDerWaalsContact C-N 3.33Å; A828-L830 PolarHBondContact O-N 3.48Å; L830-L833 PolarHBondContact O-N 3.4Å; L830-I834 HydrophobicContact CD1-CD1 4.14Å; L830-I834 HydrophobicContact CD1-CG1 4.47Å; L830-I834 HydrophobicContact CG-CD1 3.89Å; L830-I834 VanDerWaalsContact O-CG1 3.28Å; L830-I834 WeakPolarHBondContact O-CG1 3.29Å; L830-I834 PolarHBondContact O-N 3.11Å
831	V	91.3	Very high	87.3	Confident	65 Å²	65	89.4 Å²	89.4	39%	0.394	49%	0.489	S	S	.	.	H	α-helix	trans	-61.5	-46.5	177.7	172.9	0	0	0	0	110.6	L827 A828 L833 I834 E835	L827-V831 HydrophobicContact CD1-CG2 4.46Å; L827-V831 WeakPolarHBondContact O-CG2 3.49Å; L827-V831 PolarHBondContact O-N 3.49Å; A828-V831 PolarHBondContact O-N 2.9Å; V831-L833 VanDerWaalsContact C-N 3.28Å; V831-L833 PolarHBondContact O-N 3.07Å; V831-I834 PolarHBondContact O-N 2.77Å; V831-I834 VanDerWaalsContact O-N 3.14Å; V831-E835 HydrophobicContact CG1-CG 4.34Å; V831-E835 WeakPolarHBondContact O-CG 3.46Å; V831-E835 PolarHBondContact O-N 3.14Å
832	A	87	Confident	86.6	Confident	55 Å²	55	87 Å²	87	46%	0.455	48%	0.484	S	S	.	.	H	α-helix	trans	-58.9	-39.8	176.7	0	0	0	0	0	112.2	A828 F836	A828-A832 WeakPolarHBondContact O-CB 3.38Å; A828-A832 PolarHBondContact O-N 3.42Å; A832-F836 VanDerWaalsContact O-CB 3.22Å; A832-F836 WeakPolarHBondContact O-CB 3.24Å; A832-F836 PolarHBondContact O-N 3.44Å
833	L	86.6	Confident	85.3	Confident	103 Å²	103	85.3 Å²	85.3	54%	0.539	47%	0.469	S	S	.	.	H	α-helix	trans	-67.1	-41.6	176.8	-165.5	145.7	0	0	0	111.5	M829 L830 V831 F836 C837	M829-L833 WeakPolarHBondContact O-CB 3.22Å; M829-L833 PolarHBondContact O-N 2.95Å; L830-L833 PolarHBondContact O-N 3.4Å; V831-L833 VanDerWaalsContact C-N 3.28Å; V831-L833 PolarHBondContact O-N 3.07Å; L833-F836 PolarHBondContact O-N 3.31Å; L833-C837 WeakPolarHBondContact O-CB 3.46Å; L833-C837 PolarHBondContact O-N 2.99Å; L833-C837 PolarHBondContact O-SG 3.2Å
834	I	87.4	Confident	83.8	Confident	98 Å²	98	83.6 Å²	83.6	50%	0.503	45%	0.451	S	S	.	.	H	α-helix	trans	-64.2	-46	175.5	-67.7	164.8	0	0	0	110.9	L830 V831 F836 C837 Y838	L830-I834 HydrophobicContact CD1-CD1 4.14Å; L830-I834 HydrophobicContact CD1-CG1 4.47Å; L830-I834 HydrophobicContact CG-CD1 3.89Å; L830-I834 VanDerWaalsContact O-CG1 3.28Å; L830-I834 WeakPolarHBondContact O-CG1 3.29Å; L830-I834 PolarHBondContact O-N 3.11Å; V831-I834 PolarHBondContact O-N 2.77Å; V831-I834 VanDerWaalsContact O-N 3.14Å; I834-F836 PolarHBondContact O-N 3.19Å; I834-C837 PolarHBondContact O-N 3.39Å; I834-Y838 VanDerWaalsContact O-CB 3.28Å; I834-Y838 WeakPolarHBondContact O-CB 3.38Å; I834-Y838 PolarHBondContact O-N 3.33Å
835	E	88.1	Confident	82.6	Confident	131 Å²	131	90.8 Å²	90.8	61%	0.612	47%	0.471	S	S	*	.	H	α-helix	trans	-60.8	-44.8	176.6	-76.2	-174.6	179.4	0	0	111.7	V831 C837 Y838 K839	V831-E835 HydrophobicContact CG1-CG 4.34Å; V831-E835 WeakPolarHBondContact O-CG 3.46Å; V831-E835 PolarHBondContact O-N 3.14Å; E835-C837 PolarHBondContact O-N 3.26Å; E835-Y838 PolarHBondContact O-N 3.36Å; E835-K839 VanDerWaalsContact O-CB 3.25Å; E835-K839 WeakPolarHBondContact O-CB 3.42Å; E835-K839 PolarHBondContact O-N 3.03Å
836	F	81.9	Confident	81.2	Confident	65 Å²	65	96.2 Å²	96.2	29%	0.285	48%	0.483	S	S	.	.	H	α-helix	trans	-59.9	-46.7	175.8	-178.5	-96.9	0	0	0	111.1	A832 L833 I834 S840 I855 K858 A859	A832-F836 VanDerWaalsContact O-CB 3.22Å; A832-F836 WeakPolarHBondContact O-CB 3.24Å; A832-F836 PolarHBondContact O-N 3.44Å; L833-F836 PolarHBondContact O-N 3.31Å; I834-F836 PolarHBondContact O-N 3.19Å; F836-S840 WeakPolarHBondContact O-CB 3.37Å; F836-S840 PolarHBondContact O-N 3.09Å; F836-I855 HydrophobicContact CE1-CG2 4.32Å; F836-K858 HydrophobicContact CD2-CD 4.48Å; F836-K858 HydrophobicContact CE2-CB 3.82Å; F836-K858 HydrophobicContact CE2-CD 3.95Å; F836-K858 HydrophobicContact CE2-CG 3.95Å; F836-K858 HydrophobicContact CZ-CB 3.78Å; F836-K858 HydrophobicContact CZ-CG 4.42Å; F836-A859 HydrophobicContact CZ-CB 4.46Å
837	C	81.9	Confident	79.7	Confident	42 Å²	42	99.8 Å²	99.8	28%	0.284	49%	0.49	S	S	.	.	H	α-helix	trans	-63.8	-42.7	176	-74.2	0	0	0	0	112.6	L833 I834 E835 R841	L833-C837 WeakPolarHBondContact O-CB 3.46Å; L833-C837 PolarHBondContact O-N 2.99Å; L833-C837 PolarHBondContact O-SG 3.2Å; I834-C837 PolarHBondContact O-N 3.39Å; E835-C837 PolarHBondContact O-N 3.26Å; C837-R841 WeakPolarHBondContact O-CG 3.38Å; C837-R841 PolarHBondContact O-N 3.49Å
838	Y	84.5	Confident	78	Confident	178 Å²	178	104.2 Å²	104.2	70%	0.698	50%	0.504	S	S	*	.	H	α-helix	trans	-67.2	-48.2	-179.2	-174.1	-98	0	0	0	111.5	I834 E835 S840 R841 A842	I834-Y838 VanDerWaalsContact O-CB 3.28Å; I834-Y838 WeakPolarHBondContact O-CB 3.38Å; I834-Y838 PolarHBondContact O-N 3.33Å; E835-Y838 PolarHBondContact O-N 3.36Å; Y838-S840 VanDerWaalsContact C-N 3.33Å; Y838-S840 PolarHBondContact O-N 3.09Å; Y838-R841 PolarHBondContact O-N 3.47Å; Y838-A842 PolarHBondContact O-N 2.59Å
839	K	80.6	Confident	76.5	Confident	130 Å²	130	105.1 Å²	105.1	57%	0.565	50%	0.5	S	S	*	.	H	α-helix	trans	-65.2	-37.7	177.3	-163.1	173.5	-175.7	174.6	0	111.3	E835 A842 E843	E835-K839 VanDerWaalsContact O-CB 3.25Å; E835-K839 WeakPolarHBondContact O-CB 3.42Å; E835-K839 PolarHBondContact O-N 3.03Å; K839-A842 PolarHBondContact O-N 3.35Å; K839-E843 WeakPolarHBondContact O-CB 3.48Å; K839-E843 PolarHBondContact O-N 3.44Å
840	S	73	Confident	75	Confident	1 Å²	1	102.7 Å²	102.7	1%	0.007	49%	0.494	C	S	.	.	H	α-helix	trans	-64.2	-40.5	173.2	-173.6	0	0	0	0	112.3	F836 Y838 A844 I855	F836-S840 WeakPolarHBondContact O-CB 3.37Å; F836-S840 PolarHBondContact O-N 3.09Å; Y838-S840 VanDerWaalsContact C-N 3.33Å; Y838-S840 PolarHBondContact O-N 3.09Å; S840-A844 VanDerWaalsContact O-CB 3.25Å; S840-A844 WeakPolarHBondContact O-CB 3.42Å; S840-A844 PolarHBondContact O-N 3.48Å; S840-I855 WeakPolarHBondContact OG-CG1 3.32Å; S840-I855 PolarHBondContact OG-N 3.19Å
841	R	73.8	Confident	73.5	Confident	160 Å²	160	102 Å²	102	60%	0.604	49%	0.487	S	S	*	.	H	α-helix	trans	-64.2	-44.7	172.3	-80.5	-165.8	173.7	173.7	-2.1	112.8	C837 Y838 A844 K845 F851	C837-R841 WeakPolarHBondContact O-CG 3.38Å; C837-R841 PolarHBondContact O-N 3.49Å; Y838-R841 PolarHBondContact O-N 3.47Å; R841-A844 PolarHBondContact O-N 2.71Å; R841-K845 WeakPolarHBondContact O-CB 3.43Å; R841-K845 PolarHBondContact O-N 3.34Å; R841-F851 HydrophobicContact CB-CE2 4.24Å; R841-F851 HydrophobicContact CG-CD2 3.57Å; R841-F851 HydrophobicContact CG-CE2 3.12Å; R841-F851 HydrophobicContact CG-CZ 3.83Å
842	A	74.2	Confident	72	Confident	52 Å²	52	103.3 Å²	103.3	43%	0.43	50%	0.499	S	S	.	.	H	α-helix	trans	-62.5	-42.8	-179.4	0	0	0	0	0	111.6	Y838 K839 K845 R846	Y838-A842 PolarHBondContact O-N 2.59Å; K839-A842 PolarHBondContact O-N 3.35Å; A842-K845 PolarHBondContact O-N 3.05Å; A842-R846 PolarHBondContact O-N 2.93Å
843	E	65.3	Low	70.8	Confident	64 Å²	64	105.4 Å²	105.4	30%	0.299	50%	0.499	S	S	.	.	H	α-helix	trans	-71	-38.5	175	-79.8	169.6	-162.9	0	0	113	K839 K845 R846 M847 K858	K839-E843 WeakPolarHBondContact O-CB 3.48Å; K839-E843 PolarHBondContact O-N 3.44Å; E843-K845 PolarHBondContact O-N 3.38Å; E843-R846 CarbonylContact O-C 3.6Å; E843-R846 WeakPolarHBondContact O-CA 3.49Å; E843-R846 PolarHBondContact O-N 3.23Å; E843-M847 HydrophobicContact CB-CE 4.28Å; E843-M847 PolarHBondContact O-N 3.29Å; E843-K858 IonicContact OE1-NZ 2.89Å; E843-K858 PolarHBondContact OE1-NZ 3.11Å; E843-K858 IonicContact OE2-NZ 2.68Å; E843-K858 PolarHBondContact OE2-NZ 3.03Å
844	A	61.3	Low	69.5	Low	10 Å²	10	101 Å²	101	8%	0.083	48%	0.479	C	S	.	.	H	α-helix	trans	-58.4	-38	173.3	0	0	0	0	0	111.5	S840 R841 K848 L849 A854	S840-A844 VanDerWaalsContact O-CB 3.25Å; S840-A844 WeakPolarHBondContact O-CB 3.42Å; S840-A844 PolarHBondContact O-N 3.48Å; R841-A844 PolarHBondContact O-N 2.71Å; A844-K848 PolarHBondContact O-N 3.39Å; A844-K848 VanDerWaalsContact O-N 3.08Å; A844-L849 PolarHBondContact O-N 2.64Å; A844-A854 HydrophobicContact CB-CB 3.86Å
845	K	66.4	Low	68.5	Low	191 Å²	191	98.8 Å²	98.8	83%	0.83	47%	0.467	S	S	*	.	H	α-helix	trans	-69.7	-32.5	174	-148.8	177.5	-173.1	-176.7	0	112.5	R841 A842 E843	R841-K845 WeakPolarHBondContact O-CB 3.43Å; R841-K845 PolarHBondContact O-N 3.34Å; A842-K845 PolarHBondContact O-N 3.05Å; E843-K845 PolarHBondContact O-N 3.38Å
846	R	64.2	Low	67.5	Low	229 Å²	229	100.7 Å²	100.7	86%	0.864	47%	0.469	S	S	*	.	H	α-helix	trans	-78	-33.7	178.4	-139.6	179.6	-173.3	-176.7	1.1	113.1	A842 E843	A842-R846 PolarHBondContact O-N 2.93Å; E843-R846 CarbonylContact O-C 3.6Å; E843-R846 WeakPolarHBondContact O-CA 3.49Å; E843-R846 PolarHBondContact O-N 3.23Å
847	M	60.3	Low	66.6	Low	118 Å²	118	102 Å²	102	58%	0.581	48%	0.478	S	S	*	.	H	α-helix	trans	-102	2.4	-177.1	-67.7	-163.9	-77.9	0	0	114.8	E843 L849	E843-M847 HydrophobicContact CB-CE 4.28Å; E843-M847 PolarHBondContact O-N 3.29Å; M847-L849 VanDerWaalsContact C-N 3.34Å; M847-L849 HydrophobicContact CB-CD1 4.07Å; M847-L849 HydrophobicContact CB-CG 4.41Å; M847-L849 PolarHBondContact O-N 3.43Å
848	K	56.6	Low	65.6	Low	202 Å²	202	102.2 Å²	102.2	88%	0.878	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	44	-177.1	-64.1	-176.3	178.8	178.4	0	113.7	A844	A844-K848 PolarHBondContact O-N 3.39Å; A844-K848 VanDerWaalsContact O-N 3.08Å
849	L	60.1	Low	64.5	Low	79 Å²	79	95.5 Å²	95.5	41%	0.414	46%	0.456	S	S	.	.			trans	-109.7	155.9	178.1	-74.2	165.7	0	0	0	111.7	A844 M847	A844-L849 PolarHBondContact O-N 2.64Å; M847-L849 VanDerWaalsContact C-N 3.34Å; M847-L849 HydrophobicContact CB-CD1 4.07Å; M847-L849 HydrophobicContact CB-CG 4.41Å; M847-L849 PolarHBondContact O-N 3.43Å
850	T	60.6	Low	63.5	Low	92 Å²	92	97 Å²	97	56%	0.564	46%	0.458	S	S	*	.			trans	-66.4	134.4	174.8	-7.6	0	0	0	0	110.8	S852 E853 A854	T850-S852 PolarHBondContact O-N 3.38Å; T850-S852 VanDerWaalsContact O-N 3.09Å; T850-E853 PolarHBondContact O-N 3.38Å; T850-E853 PolarHBondContact OG1-OE2 3.32Å; T850-A854 PolarHBondContact O-N 2.9Å
851	F	57.9	Low	62.9	Low	76 Å²	76	101.5 Å²	101.5	33%	0.333	48%	0.481	S	S	.	.	H	α-helix	trans	-54	-35.5	-173.8	179.2	-120.3	0	0	0	113.8	R841 E853 I855	R841-F851 HydrophobicContact CB-CE2 4.24Å; R841-F851 HydrophobicContact CG-CD2 3.57Å; R841-F851 HydrophobicContact CG-CE2 3.12Å; R841-F851 HydrophobicContact CG-CZ 3.83Å; F851-E853 VanDerWaalsContact C-N 3.34Å; F851-E853 PolarHBondContact O-N 3.04Å; F851-I855 HydrophobicContact CD1-CD1 4.21Å; F851-I855 HydrophobicContact CD2-CD1 4.27Å; F851-I855 HydrophobicContact CE1-CD1 3.63Å; F851-I855 HydrophobicContact CE2-CD1 3.65Å; F851-I855 HydrophobicContact CE2-CG1 4.12Å; F851-I855 HydrophobicContact CZ-CD1 3.35Å; F851-I855 HydrophobicContact CZ-CG1 4.31Å; F851-I855 PolarHBondContact O-N 3.27Å
852	S	60.7	Low	62.3	Low	94 Å²	94	98.5 Å²	98.5	66%	0.657	49%	0.485	S	S	*	.	H	α-helix	trans	-68.5	-29.1	178	-167.3	0	0	0	0	113.6	T850 R856	T850-S852 PolarHBondContact O-N 3.38Å; T850-S852 VanDerWaalsContact O-N 3.09Å; S852-R856 WeakPolarHBondContact O-CB 3.25Å; S852-R856 PolarHBondContact O-N 2.98Å
853	E	61.8	Low	61.6	Low	98 Å²	98	102.8 Å²	102.8	46%	0.458	50%	0.499	S	S	.	.	H	α-helix	trans	-81.7	-37.1	179.6	-70.1	173.8	144.2	0	0	111.4	T850 F851 I855 R856 N857	T850-E853 PolarHBondContact O-N 3.38Å; T850-E853 PolarHBondContact OG1-OE2 3.32Å; F851-E853 VanDerWaalsContact C-N 3.34Å; F851-E853 PolarHBondContact O-N 3.04Å; E853-I855 VanDerWaalsContact C-N 3.33Å; E853-I855 PolarHBondContact O-N 2.67Å; E853-R856 PolarHBondContact O-N 2.98Å; E853-N857 PolarHBondContact O-N 3.3Å
854	A	60	Low	61.1	Low	12 Å²	12	104.4 Å²	104.4	10%	0.099	51%	0.513	C	S	.	.	H	α-helix	trans	-62.6	-38.6	174.3	0	0	0	0	0	112.3	A844 T850 K858	A844-A854 HydrophobicContact CB-CB 3.86Å; T850-A854 PolarHBondContact O-N 2.9Å; A854-K858 WeakPolarHBondContact O-CB 3.46Å; A854-K858 PolarHBondContact O-N 3.48Å
855	I	66.3	Low	60.5	Low	50 Å²	50	107.4 Å²	107.4	26%	0.256	55%	0.545	S	S	.	.	H	α-helix	trans	-67.1	-45.9	173.6	-73.5	177.6	0	0	0	111	F836 S840 F851 E853 N857 K858 A859	F836-I855 HydrophobicContact CE1-CG2 4.32Å; S840-I855 WeakPolarHBondContact OG-CG1 3.32Å; S840-I855 PolarHBondContact OG-N 3.19Å; F851-I855 HydrophobicContact CD1-CD1 4.21Å; F851-I855 HydrophobicContact CD2-CD1 4.27Å; F851-I855 HydrophobicContact CE1-CD1 3.63Å; F851-I855 HydrophobicContact CE2-CD1 3.65Å; F851-I855 HydrophobicContact CE2-CG1 4.12Å; F851-I855 HydrophobicContact CZ-CD1 3.35Å; F851-I855 HydrophobicContact CZ-CG1 4.31Å; F851-I855 PolarHBondContact O-N 3.27Å; E853-I855 VanDerWaalsContact C-N 3.33Å; E853-I855 PolarHBondContact O-N 2.67Å; I855-N857 PolarHBondContact O-N 3.43Å; I855-K858 PolarHBondContact O-N 2.91Å; I855-A859 VanDerWaalsContact O-CB 3.29Å; I855-A859 WeakPolarHBondContact O-CB 3.29Å; I855-A859 PolarHBondContact O-N 3.36Å
856	R	65.4	Low	59.1	Low	172 Å²	172	102.2 Å²	102.2	65%	0.649	53%	0.533	S	S	*	.	H	α-helix	trans	-64.4	-40.2	-176.6	-168.1	178.3	-173.4	-178.2	2.2	112.7	S852 E853 R860	S852-R856 WeakPolarHBondContact O-CB 3.25Å; S852-R856 PolarHBondContact O-N 2.98Å; E853-R856 PolarHBondContact O-N 2.98Å; R856-R860 PolarHBondContact O-N 3.39Å; R856-R860 VanDerWaalsContact O-N 3.15Å
857	N	63	Low	57.9	Low	91 Å²	91	97.1 Å²	97.1	49%	0.487	53%	0.527	S	S	.	.	H	α-helix	trans	-67.7	-38.9	177.9	-74.7	-11.9	0	0	0	111.9	E853 I855 L861	E853-N857 PolarHBondContact O-N 3.3Å; I855-N857 PolarHBondContact O-N 3.43Å; N857-L861 PolarHBondContact O-N 3.37Å
858	K	61.8	Low	56.8	Low	48 Å²	48	94.3 Å²	94.3	21%	0.209	53%	0.528	C	S	.	.	H	α-helix	trans	-78.8	-33.5	-179.4	-138.3	178.6	-166	159.9	0	113.1	F836 E843 A854 I855 R860 L861 S862	F836-K858 HydrophobicContact CD2-CD 4.48Å; F836-K858 HydrophobicContact CE2-CB 3.82Å; F836-K858 HydrophobicContact CE2-CD 3.95Å; F836-K858 HydrophobicContact CE2-CG 3.95Å; F836-K858 HydrophobicContact CZ-CB 3.78Å; F836-K858 HydrophobicContact CZ-CG 4.42Å; E843-K858 IonicContact OE1-NZ 2.89Å; E843-K858 PolarHBondContact OE1-NZ 3.11Å; E843-K858 IonicContact OE2-NZ 2.68Å; E843-K858 PolarHBondContact OE2-NZ 3.03Å; A854-K858 WeakPolarHBondContact O-CB 3.46Å; A854-K858 PolarHBondContact O-N 3.48Å; I855-K858 PolarHBondContact O-N 2.91Å; K858-R860 VanDerWaalsContact C-N 3.3Å; K858-L861 PolarHBondContact O-N 3.21Å; K858-S862 WeakPolarHBondContact O-CB 3.24Å; K858-S862 PolarHBondContact O-N 3.48Å
859	A	61.7	Low	56	Low	36 Å²	36	93.4 Å²	93.4	30%	0.298	53%	0.527	S	S	.	.	H	α-helix	trans	-63.1	-39.7	171.4	0	0	0	0	0	110.8	F836 I855 I863	F836-A859 HydrophobicContact CZ-CB 4.46Å; I855-A859 VanDerWaalsContact O-CB 3.29Å; I855-A859 WeakPolarHBondContact O-CB 3.29Å; I855-A859 PolarHBondContact O-N 3.36Å; A859-I863 WeakPolarHBondContact O-CB 3.39Å; A859-I863 WeakPolarHBondContact O-CD1 3.49Å; A859-I863 WeakPolarHBondContact O-CG1 3.47Å; A859-I863 PolarHBondContact O-N 2.82Å
860	R	58.7	Low	54.8	Low	162 Å²	162	96.8 Å²	96.8	61%	0.611	55%	0.546	S	S	*	.	H	α-helix	trans	-62.2	-48.6	169.6	-91.8	-176.5	169.3	172.9	-5.2	111.9	R856 K858 S862 I863 T864	R856-R860 PolarHBondContact O-N 3.39Å; R856-R860 VanDerWaalsContact O-N 3.15Å; K858-R860 VanDerWaalsContact C-N 3.3Å; R860-S862 VanDerWaalsContact C-N 3.31Å; R860-S862 PolarHBondContact O-N 3.31Å; R860-I863 PolarHBondContact O-N 2.9Å; R860-I863 VanDerWaalsContact O-N 3.13Å; R860-T864 PolarHBondContact O-N 3.17Å; R860-T864 PolarHBondContact O-OG1 3.24Å
861	L	60.3	Low	54	Low	95 Å²	95	96.4 Å²	96.4	50%	0.497	56%	0.56	S	S	.	*	H	α-helix	trans	-58.3	-39.7	178.4	-122.2	116.1	0	0	0	113.2	N857 K858 G865 V867	N857-L861 PolarHBondContact O-N 3.37Å; K858-L861 PolarHBondContact O-N 3.21Å; L861-G865 PolarHBondContact O-N 3.21Å; L861-G865 VanDerWaalsContact O-N 3.13Å; L861-V867 HydrophobicContact CD2-CG2 4.34Å
862	S	60.9	Low	52.8	Low	97 Å²	97	103.8 Å²	103.8	68%	0.678	59%	0.586	S	S	*	*	H	α-helix	trans	-71.7	-25.7	178.3	-173.7	0	0	0	0	113.6	K858 R860	K858-S862 WeakPolarHBondContact O-CB 3.24Å; K858-S862 PolarHBondContact O-N 3.48Å; R860-S862 VanDerWaalsContact C-N 3.31Å; R860-S862 PolarHBondContact O-N 3.31Å
863	I	59.9	Low	51.5	Low	143 Å²	143	106 Å²	106	73%	0.733	60%	0.595	S	S	*	*	H	α-helix	trans	-93.5	-35.2	-178.1	-66.7	168	0	0	0	111.3	A859 R860	A859-I863 WeakPolarHBondContact O-CB 3.39Å; A859-I863 WeakPolarHBondContact O-CD1 3.49Å; A859-I863 WeakPolarHBondContact O-CG1 3.47Å; A859-I863 PolarHBondContact O-N 2.82Å; R860-I863 PolarHBondContact O-N 2.9Å; R860-I863 VanDerWaalsContact O-N 3.13Å
864	T	56.1	Low	49.9	Very low	98 Å²	98	108.9 Å²	108.9	60%	0.601	61%	0.613	S	S	*	*	H	α-helix	trans	-104.2	-7.8	-173.2	63.4	0	0	0	0	114.5	R860 S866	R860-T864 PolarHBondContact O-N 3.17Å; R860-T864 PolarHBondContact O-OG1 3.24Å; T864-S866 PolarHBondContact O-N 3.04Å
865	G	47.3	Very low	49	Very low	72 Å²	72	114.3 Å²	114.3	74%	0.742	64%	0.644	S	S	*	*			trans	61.7	8.9	167.9	0	0	0	0	0	117.3	L861	L861-G865 PolarHBondContact O-N 3.21Å; L861-G865 VanDerWaalsContact O-N 3.13Å
866	S	37.4	Very low	47.6	Very low	83 Å²	83	117.7 Å²	117.7	58%	0.58	67%	0.67	S	S	*	*			trans	-110.6	118.9	-176.5	-179.2	0	0	0	0	111.4	T864	T864-S866 PolarHBondContact O-N 3.04Å
867	V	39.7	Very low	45.9	Very low	121 Å²	121	117.2 Å²	117.2	73%	0.733	68%	0.68	S	S	*	*			trans	-88.9	111.5	164	177.7	0	0	0	0	106.8	L861	L861-V867 HydrophobicContact CD2-CG2 4.34Å
868	G	37.3	Very low	44.3	Very low	59 Å²	59	118.3 Å²	118.3	61%	0.608	69%	0.694	S	S	*	*			trans	-79.8	120.3	167	0	0	0	0	0	109.8	N870	G868-N870 PolarHBondContact O-N 2.86Å
869	E	39.2	Very low	43.3	Very low	183 Å²	183	121.4 Å²	121.4	86%	0.855	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.2	132.8	165.8	-83	-178.5	121.3	0	0	109.5
870	N	35.9	Very low	41.7	Very low	151 Å²	151	129 Å²	129	81%	0.807	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	79.2	42.8	173.1	-52.3	-28.2	0	0	0	118.7	G868 R872	G868-N870 PolarHBondContact O-N 2.86Å; N870-R872 VanDerWaalsContact C-N 3.27Å; N870-R872 PolarHBondContact O-N 3.01Å
871	G	42.6	Very low	40.2	Very low	84 Å²	84	125.7 Å²	125.7	87%	0.866	75%	0.752	S	S	*	*	S	Bend	trans	55.1	21	133.6	0	0	0	0	0	119.9
872	R	33.1	Very low	38.8	Very low	231 Å²	231	127.6 Å²	127.6	87%	0.872	77%	0.768	S	S	*	*			trans	-137.7	122.1	171.3	-85.8	-175.8	171.8	164.8	-1.6	110.3	N870 L874	N870-R872 VanDerWaalsContact C-N 3.27Å; N870-R872 PolarHBondContact O-N 3.01Å; R872-L874 PolarHBondContact O-N 3.43Å
873	V	32.5	Very low	37.3	Very low	141 Å²	141	131.8 Å²	131.8	86%	0.855	78%	0.776	S	S	*	*			trans	-79.3	109.5	172.5	179.3	0	0	0	0	108.4
874	L	29.2	Very low	35.8	Very low	158 Å²	158	130 Å²	130	83%	0.827	78%	0.783	S	S	*	*			trans	-79.8	124.6	163.1	-93.7	131.7	0	0	0	109.1	R872	R872-L874 PolarHBondContact O-N 3.43Å
875	T	41.8	Very low	34.4	Very low	125 Å²	125	129 Å²	129	77%	0.767	79%	0.792	S	S	*	*			trans	-76.9	142.6	156.6	48.1	0	0	0	0	109.1
876	P	36.3	Very low	33.6	Very low	121 Å²	121	132.8 Å²	132.8	79%	0.786	80%	0.801	S	S	*	*			trans	-133.1	146.9	140.5	20.6	-0.6	0	0	0	114.1
877	D	29.2	Very low	33.1	Very low	162 Å²	162	133 Å²	133	87%	0.866	81%	0.807	S	S	*	*			trans	-63.1	160.3	174.5	-77	-59.6	0	0	0	114.7
878	C	30.1	Very low	32.7	Very low	115 Å²	115	134.9 Å²	134.9	78%	0.777	81%	0.812	S	S	*	*			trans	-57.1	160.6	177.8	-156.3	0	0	0	0	113.9
879	P	39.5	Very low	32.4	Very low	113 Å²	113	143.5 Å²	143.5	73%	0.734	83%	0.826	S	S	*	*				-153.2	145	97.5	35.7	-15.7	0	0	0	118.7
880	K	28.5	Very low	32	Very low	194 Å²	194	143.6 Å²	143.6	84%	0.843	83%	0.826	S	S	*	*			trans	57.4	128.8	132.4	-68.7	-177.1	176.5	175.6	0	124.6
881	A	27.9	Very low	31.7	Very low	93 Å²	93	141.6 Å²	141.6	77%	0.769	82%	0.824	S	S	*	*			trans	76.9	144	138.8	0	0	0	0	0	117.2
882	V	30.6	Very low	31.1	Very low	136 Å²	136	143.4 Å²	143.4	82%	0.824	82%	0.823	S	S	*	*			cis	-157.2	155.7	37.9	169	0	0	0	0	110.5
883	H	30	Very low	30.8	Very low	184 Å²	184	136 Å²	136	85%	0.852	82%	0.819	S	S	*	*			trans	-43.6	150	169.4	-74.6	-75.8	0	0	0	118.9
884	A	27.6	Very low	30.7	Very low	106 Å²	106	137.6 Å²	137.6	88%	0.876	82%	0.822	S	S	*	*			trans	149.3	138	133.9	0	0	0	0	0	108.8
885	G	27	Very low	30.7	Very low	76 Å²	76	134 Å²	134	78%	0.784	82%	0.815	S	S	*	*			cis	-176.4	150.5	0.9	0	0	0	0	0	107
886	T	30.3	Very low	30.2	Very low	153 Å²	153	134.3 Å²	134.3	94%	0.939	82%	0.816	S	S	*	*			trans	-73.9	134.2	175.2	5.6	0	0	0	0	111.7
887	A	27.8	Very low	29.9	Very low	86 Å²	86	136.9 Å²	136.9	71%	0.711	82%	0.821	S	S	*	*			trans	-158.5	108.5	155.2	0	0	0	0	0	109.4
888	I	31.2	Very low	30	Very low	161 Å²	161	132.9 Å²	132.9	83%	0.826	81%	0.811	S	S	*	*				85.4	113.9	100	-67.5	166.1	0	0	0	113.9
889	R	29.9	Very low	30.1	Very low	241 Å²	241	132.1 Å²	132.1	91%	0.909	81%	0.807	S	S	*	*			trans	-55	129.7	164	-170.5	-176.2	-165.6	-176.8	3.7	111.4
890	Q	30.3	Very low	29.7	Very low	185 Å²	185	133.9 Å²	133.9	86%	0.864	81%	0.81	S	S	*	*			trans	-145.5	129.2	154	-116.3	176.3	-1.3	0	0	111.9
891	S	29.7	Very low	29.9	Very low	109 Å²	109	132 Å²	132	76%	0.762	81%	0.809	S	S	*	*			trans	-68.6	152.7	173.5	50.9	0	0	0	0	112.7
892	S	30.5	Very low	31	Very low	121 Å²	121	136.4 Å²	136.4	85%	0.846	83%	0.83	S	S	*	*			trans	-153	110.2	144.2	-3.2	0	0	0	0	108.5
893	G	28	Very low	31	Very low	75 Å²	75	136.5 Å²	136.5	77%	0.773	83%	0.83	S	S	*	*			trans	-79.7	153.9	161.2	0	0	0	0	0	109.7
894	L	28.8	Very low	31	Very low	176 Å²	176	133.9 Å²	133.9	92%	0.921	83%	0.829	S	S	*	*			trans	-142.7	124.9	163.6	-118.6	147.2	0	0	0	108.5
895	A	29.8	Very low	31.2	Very low	83 Å²	83	135.5 Å²	135.5	69%	0.686	83%	0.826	S	S	*	*			trans	-88.8	143.5	-177.3	0	0	0	0	0	111.3
896	V	30.4	Very low	31.5	Very low	130 Å²	130	139 Å²	139	79%	0.788	83%	0.829	S	S	*	*			trans	35.8	120.4	135.3	-170.3	0	0	0	0	119
897	I	30.6	Very low	31.5	Very low	175 Å²	175	138.1 Å²	138.1	90%	0.897	82%	0.822	S	S	*	*			trans	-128.4	128.5	139.1	-64.3	179.5	0	0	0	107.6
898	A	32.5	Very low	31.8	Very low	79 Å²	79	141.6 Å²	141.6	65%	0.653	83%	0.829	S	S	*	*			trans	-88.7	153.7	173.8	0	0	0	0	0	110.7
899	S	31.9	Very low	31.8	Very low	99 Å²	99	140.2 Å²	140.2	69%	0.692	83%	0.829	S	S	*	*				180	151.7	116.6	68.1	0	0	0	0	113.4
900	D	30	Very low	32	Very low	150 Å²	150	132.5 Å²	132.5	80%	0.802	82%	0.823	S	S	*	*			trans	88.2	98.1	149.5	-52.3	-34.2	0	0	0	121.6
901	L	33.2	Very low	32.1	Very low	154 Å²	154	128.1 Å²	128.1	81%	0.806	82%	0.82	S	S	*	*			trans	-49.6	160.7	142.1	-94.4	137.4	0	0	0	111.9
902	P	50.1	Low	32.3	Very low	186 Å²	186	129.8 Å²	129.8	100%	1.208	83%	0.825	S	S	*	*			cis	-111.3	0	39.9	5.3	17.6	0	0	0	116.9

Retrieved 902 of 902 residues in 3569.8 ms (Link to these results)

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