Q9ARU4_ORYSJ Loading...

Os01g0121700 protein

AlphaFold DB , UniProt , Accession Q9ARU4, Species ORYSJ (Oryza sativa subsp. japonica, Rice), Gene n/a, Length 668 aa.

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(Predicted Aligned Error values between residue pairs)

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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	40.7	Very low	47.1	Very low	236 Å²	236	121.9 Å²	121.9	100%	1.163	64%	0.638	S	S	*	*				0	-12.2	0	-96.3	174.1	179.7	0	0	113.6
2	E	43.2	Very low	47.3	Very low	177 Å²	177	117 Å²	117	83%	0.827	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-26.1	-172.8	-68.2	174.6	144.4	0	0	115.8	R4 G5 L6	E2-R4 VanDerWaalsContact C-N 3.3Å; E2-R4 PolarHBondContact O-N 3.16Å; E2-G5 PolarHBondContact O-N 3.03Å; E2-L6 PolarHBondContact O-N 3.5Å
3	V	45.4	Very low	47.1	Very low	123 Å²	123	114.9 Å²	114.9	75%	0.745	62%	0.616	S	S	*	*	H	α-helix	trans	-69.9	-23.4	-176.3	-174.6	0	0	0	0	113.3
4	R	43.9	Very low	47.2	Very low	225 Å²	225	110.4 Å²	110.4	85%	0.849	60%	0.602	S	S	*	*	H	α-helix	trans	-74.8	-30.6	177.1	-82.1	-175.3	176.4	177.6	-0.7	113	E2	E2-R4 VanDerWaalsContact C-N 3.3Å; E2-R4 PolarHBondContact O-N 3.16Å
5	G	48.4	Very low	47	Very low	42 Å²	42	106.5 Å²	106.5	43%	0.433	59%	0.591	S	S	.	*	H	α-helix	trans	-74	-39.9	178.1	0	0	0	0	0	112.3	E2 G7 Q8 L9	E2-G5 PolarHBondContact O-N 3.03Å; G5-G7 PolarHBondContact O-N 3.4Å; G5-Q8 PolarHBondContact O-N 2.85Å; G5-L9 WeakPolarHBondContact O-CB 3.47Å; G5-L9 PolarHBondContact O-N 3.29Å
6	L	48	Very low	46.9	Very low	109 Å²	109	103.5 Å²	103.5	57%	0.571	58%	0.584	S	S	*	*	H	α-helix	trans	-64	-39.3	-177.2	-159.2	77.3	0	0	0	112.8	E2 L9 L10	E2-L6 PolarHBondContact O-N 3.5Å; L6-L9 PolarHBondContact O-N 3.31Å; L6-L10 HydrophobicContact CD2-CD1 4.38Å; L6-L10 HydrophobicContact CG-CD1 4.11Å; L6-L10 WeakPolarHBondContact O-CB 3.26Å; L6-L10 WeakPolarHBondContact O-CG 3.03Å; L6-L10 PolarHBondContact O-N 2.95Å
7	G	46.6	Very low	46.7	Very low	35 Å²	35	103.5 Å²	103.5	36%	0.361	58%	0.582	S	S	.	*	H	α-helix	trans	-68.5	-34.8	178	0	0	0	0	0	113.7	G5 A11	G5-G7 PolarHBondContact O-N 3.4Å; G7-A11 WeakPolarHBondContact O-CB 3.41Å; G7-A11 PolarHBondContact O-N 2.74Å
8	Q	53.4	Low	46.7	Very low	153 Å²	153	103.7 Å²	103.7	72%	0.715	58%	0.576	S	S	*	*	H	α-helix	trans	-72.7	-39.1	173.9	-72.8	-179.6	-24	0	0	111.4	G5 A11 A12	G5-Q8 PolarHBondContact O-N 2.85Å; Q8-A11 PolarHBondContact O-N 3.12Å; Q8-A12 VanDerWaalsContact O-CB 3.31Å; Q8-A12 WeakPolarHBondContact O-CB 3.43Å; Q8-A12 PolarHBondContact O-N 2.87Å
9	L	49.6	Very low	46.5	Very low	108 Å²	108	100 Å²	100	57%	0.565	56%	0.556	S	S	*	*	H	α-helix	trans	-63.2	-46.3	175.4	-158.1	99.2	0	0	0	110.9	G5 L6 A12 L13	G5-L9 WeakPolarHBondContact O-CB 3.47Å; G5-L9 PolarHBondContact O-N 3.29Å; L6-L9 PolarHBondContact O-N 3.31Å; L9-A12 PolarHBondContact O-N 3.39Å; L9-L13 HydrophobicContact CD2-CD1 4.17Å; L9-L13 HydrophobicContact CG-CD1 4.42Å; L9-L13 WeakPolarHBondContact O-CB 3.3Å; L9-L13 PolarHBondContact O-N 3.16Å
10	L	49.3	Very low	46.3	Very low	103 Å²	103	105.1 Å²	105.1	54%	0.539	57%	0.566	S	S	.	*	H	α-helix	trans	-64.5	-40.4	177.6	-82.2	162.2	0	0	0	112.6	L6 L13 A14	L6-L10 HydrophobicContact CD2-CD1 4.38Å; L6-L10 HydrophobicContact CG-CD1 4.11Å; L6-L10 WeakPolarHBondContact O-CB 3.26Å; L6-L10 WeakPolarHBondContact O-CG 3.03Å; L6-L10 PolarHBondContact O-N 2.95Å; L10-L13 PolarHBondContact O-N 3.48Å; L10-A14 VanDerWaalsContact O-CB 3.25Å; L10-A14 WeakPolarHBondContact O-CB 3.41Å; L10-A14 PolarHBondContact O-N 3.12Å
11	A	49.5	Very low	46.3	Very low	30 Å²	30	104.3 Å²	104.3	25%	0.248	57%	0.574	C	S	.	*	H	α-helix	trans	-65.9	-39.9	174.7	0	0	0	0	0	111.7	G7 Q8 A15	G7-A11 WeakPolarHBondContact O-CB 3.41Å; G7-A11 PolarHBondContact O-N 2.74Å; Q8-A11 PolarHBondContact O-N 3.12Å; A11-A15 WeakPolarHBondContact O-CB 3.45Å; A11-A15 PolarHBondContact O-N 3.36Å
12	A	50	Low	46.4	Very low	63 Å²	63	96.1 Å²	96.1	52%	0.521	54%	0.537	S	S	.	.	H	α-helix	trans	-66.9	-39.4	174.5	0	0	0	0	0	112.1	Q8 L9 A15 A16	Q8-A12 VanDerWaalsContact O-CB 3.31Å; Q8-A12 WeakPolarHBondContact O-CB 3.43Å; Q8-A12 PolarHBondContact O-N 2.87Å; L9-A12 PolarHBondContact O-N 3.39Å; A12-A15 PolarHBondContact O-N 2.84Å; A12-A16 VanDerWaalsContact O-CB 3.22Å; A12-A16 WeakPolarHBondContact O-CB 3.46Å; A12-A16 PolarHBondContact O-N 2.91Å
13	L	44.2	Very low	45.9	Very low	90 Å²	90	88.9 Å²	88.9	47%	0.471	51%	0.507	S	S	.	.	H	α-helix	trans	-68.1	-41.4	176.2	-118.5	136.6	0	0	0	111.8	L9 L10 A16 L17	L9-L13 HydrophobicContact CD2-CD1 4.17Å; L9-L13 HydrophobicContact CG-CD1 4.42Å; L9-L13 WeakPolarHBondContact O-CB 3.3Å; L9-L13 PolarHBondContact O-N 3.16Å; L10-L13 PolarHBondContact O-N 3.48Å; L13-A16 PolarHBondContact O-N 2.92Å; L13-L17 HydrophobicContact CD2-CD1 3.88Å; L13-L17 HydrophobicContact CD2-CG 4.39Å; L13-L17 VanDerWaalsContact O-CB 3.26Å; L13-L17 WeakPolarHBondContact O-CB 3.16Å; L13-L17 WeakPolarHBondContact O-CG 3.25Å; L13-L17 PolarHBondContact O-N 2.7Å
14	A	48.4	Very low	45.6	Very low	51 Å²	51	85.9 Å²	85.9	42%	0.421	50%	0.501	S	S	.	.	H	α-helix	trans	-64.6	-44	175	0	0	0	0	0	111	L10 F18	L10-A14 VanDerWaalsContact O-CB 3.25Å; L10-A14 WeakPolarHBondContact O-CB 3.41Å; L10-A14 PolarHBondContact O-N 3.12Å; A14-F18 WeakPolarHBondContact O-CB 3.13Å; A14-F18 PolarHBondContact O-N 2.85Å
15	A	45.1	Very low	45	Very low	52 Å²	52	80.1 Å²	80.1	43%	0.43	49%	0.493	S	S	.	.	H	α-helix	trans	-62.2	-41.9	173.1	0	0	0	0	0	111.9	A11 A12 V19	A11-A15 WeakPolarHBondContact O-CB 3.45Å; A11-A15 PolarHBondContact O-N 3.36Å; A12-A15 PolarHBondContact O-N 2.84Å; A15-V19 VanDerWaalsContact O-CB 3.28Å; A15-V19 WeakPolarHBondContact O-CB 3.44Å; A15-V19 WeakPolarHBondContact O-CG2 3.29Å; A15-V19 PolarHBondContact O-N 2.84Å
16	A	44.7	Very low	44.3	Very low	59 Å²	59	81 Å²	81	49%	0.488	50%	0.502	S	S	.	.	H	α-helix	trans	-68.9	-42.2	178.8	0	0	0	0	0	112.7	A12 L13 V19 R20	A12-A16 VanDerWaalsContact O-CB 3.22Å; A12-A16 WeakPolarHBondContact O-CB 3.46Å; A12-A16 PolarHBondContact O-N 2.91Å; L13-A16 PolarHBondContact O-N 2.92Å; A16-V19 PolarHBondContact O-N 3.21Å; A16-R20 WeakPolarHBondContact O-CB 3.42Å; A16-R20 PolarHBondContact O-N 2.77Å
17	L	43.6	Very low	43.5	Very low	103 Å²	103	80.4 Å²	80.4	54%	0.539	51%	0.505	S	S	.	.	H	α-helix	trans	-67.1	-40.6	175.6	-79.8	167.1	0	0	0	111.3	L13 R20 A21	L13-L17 HydrophobicContact CD2-CD1 3.88Å; L13-L17 HydrophobicContact CD2-CG 4.39Å; L13-L17 VanDerWaalsContact O-CB 3.26Å; L13-L17 WeakPolarHBondContact O-CB 3.16Å; L13-L17 WeakPolarHBondContact O-CG 3.25Å; L13-L17 PolarHBondContact O-N 2.7Å; L17-R20 CarbonylContact O-C 3.51Å; L17-R20 PolarHBondContact O-N 2.83Å; L17-A21 VanDerWaalsContact O-CB 3.3Å; L17-A21 WeakPolarHBondContact O-CB 3.42Å; L17-A21 PolarHBondContact O-N 3.34Å
18	F	47	Very low	42.7	Very low	108 Å²	108	81 Å²	81	47%	0.474	51%	0.506	S	S	.	.	H	α-helix	trans	-66.1	-42.7	175.6	-164.7	-100.2	0	0	0	111.3	A14 R20 A21 V22 M533	A14-F18 WeakPolarHBondContact O-CB 3.13Å; A14-F18 PolarHBondContact O-N 2.85Å; F18-R20 VanDerWaalsContact C-N 3.26Å; F18-R20 PolarHBondContact O-N 2.98Å; F18-A21 PolarHBondContact O-N 2.89Å; F18-V22 HydrophobicContact CD1-CG2 4.49Å; F18-V22 HydrophobicContact CE1-CG2 4.31Å; F18-V22 HydrophobicContact CZ-CG2 4.42Å; F18-V22 WeakPolarHBondContact O-CB 3.5Å; F18-V22 VanDerWaalsContact O-CG2 3.31Å; F18-V22 WeakPolarHBondContact O-CG2 3.31Å; F18-V22 PolarHBondContact O-N 3.08Å; F18-M533 HydrophobicContact CD1-CE 3.8Å; F18-M533 HydrophobicContact CE1-CE 3.66Å
19	V	43	Very low	41.7	Very low	33 Å²	33	80.8 Å²	80.8	20%	0.2	51%	0.509	C	S	.	.	H	α-helix	trans	-63.6	-31.8	172.2	168.8	0	0	0	0	111.7	A15 A16 A23	A15-V19 VanDerWaalsContact O-CB 3.28Å; A15-V19 WeakPolarHBondContact O-CB 3.44Å; A15-V19 WeakPolarHBondContact O-CG2 3.29Å; A15-V19 PolarHBondContact O-N 2.84Å; A16-V19 PolarHBondContact O-N 3.21Å; V19-A23 WeakPolarHBondContact O-CB 3.43Å; V19-A23 PolarHBondContact O-N 3.33Å
20	R	42.9	Very low	40.5	Very low	201 Å²	201	82.1 Å²	82.1	76%	0.758	52%	0.516	S	S	*	.	H	α-helix	trans	-82	-28.6	179.1	-164.6	175.8	-174.8	172.4	1	113.4	A16 L17 F18 A23	A16-R20 WeakPolarHBondContact O-CB 3.42Å; A16-R20 PolarHBondContact O-N 2.77Å; L17-R20 CarbonylContact O-C 3.51Å; L17-R20 PolarHBondContact O-N 2.83Å; F18-R20 VanDerWaalsContact C-N 3.26Å; F18-R20 PolarHBondContact O-N 2.98Å; R20-A23 VanDerWaalsContact O-O 3.12Å
21	A	45.9	Very low	39.5	Very low	89 Å²	89	81.7 Å²	81.7	74%	0.736	52%	0.519	S	S	*	.	H	α-helix	trans	-77.7	-29.4	175.2	0	0	0	0	0	112.1	L17 F18	L17-A21 VanDerWaalsContact O-CB 3.3Å; L17-A21 WeakPolarHBondContact O-CB 3.42Å; L17-A21 PolarHBondContact O-N 3.34Å; F18-A21 PolarHBondContact O-N 2.89Å
22	V	41.4	Very low	38.4	Very low	65 Å²	65	85.7 Å²	85.7	39%	0.394	54%	0.543	S	S	.	.	H	α-helix	trans	-96.8	-29.5	-179.7	-179	0	0	0	0	112.4	F18 G24 M533	F18-V22 HydrophobicContact CD1-CG2 4.49Å; F18-V22 HydrophobicContact CE1-CG2 4.31Å; F18-V22 HydrophobicContact CZ-CG2 4.42Å; F18-V22 WeakPolarHBondContact O-CB 3.5Å; F18-V22 VanDerWaalsContact O-CG2 3.31Å; F18-V22 WeakPolarHBondContact O-CG2 3.31Å; F18-V22 PolarHBondContact O-N 3.08Å; V22-G24 PolarHBondContact O-N 3.42Å; V22-M533 HydrophobicContact CB-CE 4.19Å; V22-M533 HydrophobicContact CG1-CB 4.47Å; V22-M533 HydrophobicContact CG1-CE 4.07Å; V22-M533 HydrophobicContact CG2-CE 4.38Å
23	A	34.7	Very low	37.4	Very low	24 Å²	24	87.1 Å²	87.1	20%	0.198	56%	0.555	C	S	.	*	S	Bend	trans	-75	119.8	168.1	0	0	0	0	0	108.7	V19 R20	V19-A23 WeakPolarHBondContact O-CB 3.43Å; V19-A23 PolarHBondContact O-N 3.33Å; R20-A23 VanDerWaalsContact O-O 3.12Å
24	G	38	Very low	36.9	Very low	60 Å²	60	88.7 Å²	88.7	62%	0.619	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-50.8	169.9	170.6	0	0	0	0	0	113.2	V22	V22-G24 PolarHBondContact O-N 3.42Å
25	P	32.2	Very low	35.9	Very low	105 Å²	105	93.6 Å²	93.6	68%	0.682	58%	0.583	S	S	*	*	S	Bend	trans	-54.8	142.9	-166.8	22.1	-31.6	0	0	0	112.3	P115	P25-P115 HydrophobicContact CB-CG 4.21Å; P25-P115 HydrophobicContact CG-CG 3.91Å
26	G	31.9	Very low	35.1	Very low	59 Å²	59	99.2 Å²	99.2	61%	0.608	60%	0.6	S	S	*	*			trans	-57.3	175.5	-175.5	0	0	0	0	0	115.1
27	P	32.7	Very low	34.3	Very low	98 Å²	98	103.9 Å²	103.9	64%	0.636	62%	0.617	S	S	*	*			trans	-77.9	135.8	-141.4	31.7	-36	0	0	0	114.1	L29	P27-L29 PolarHBondContact O-N 2.91Å
28	A	29.7	Very low	33.5	Very low	46 Å²	46	103 Å²	103	38%	0.38	62%	0.619	S	S	.	*	S	Bend	trans	-54.4	131	137.6	0	0	0	0	0	107.8	L30 A113 K647	A28-L30 PolarHBondContact O-N 3.34Å; A28-A113 HydrophobicContact CB-CB 3.96Å; A28-K647 HydrophobicContact CB-CD 4.49Å; A28-K647 PolarHBondContact O-NZ 2.9Å
29	L	31	Very low	32.5	Very low	150 Å²	150	106.7 Å²	106.7	79%	0.785	64%	0.644	S	S	*	*			trans	-39.5	134.3	-174.2	-77.7	155	0	0	0	111.5	P27	P27-L29 PolarHBondContact O-N 2.91Å
30	L	25.4	Very low	31.8	Very low	136 Å²	136	108.7 Å²	108.7	71%	0.712	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-54.3	139.2	169.7	-70.7	162.9	0	0	0	107.6	A28	A28-L30 PolarHBondContact O-N 3.34Å
31	P	29.2	Very low	31.1	Very low	93 Å²	93	105.4 Å²	105.4	60%	0.604	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-54.2	143	159.5	25.5	-30.2	0	0	0	107.5
32	P	26.3	Very low	30.4	Very low	114 Å²	114	104.5 Å²	104.5	74%	0.74	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-51.3	146.6	-179	20.7	-31	0	0	0	110.2	D34	P32-D34 PolarHBondContact O-N 3.05Å; P32-D34 VanDerWaalsContact O-N 3.17Å
33	A	27.4	Very low	29.9	Very low	93 Å²	93	110 Å²	110	77%	0.769	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-57	121.3	-179.4	0	0	0	0	0	109.3	D35	A33-D35 PolarHBondContact O-N 3.16Å
34	D	34.4	Very low	29.6	Very low	124 Å²	124	113.1 Å²	113.1	66%	0.663	70%	0.695	S	S	*	*			trans	-71.3	108.6	174.1	-61.8	-39.1	0	0	0	107.5	P32	P32-D34 PolarHBondContact O-N 3.05Å; P32-D34 VanDerWaalsContact O-N 3.17Å
35	D	28.1	Very low	29.3	Very low	154 Å²	154	113.8 Å²	113.8	82%	0.824	70%	0.703	S	S	*	*			trans	-62.4	134.3	166.5	-73.2	-41.7	0	0	0	109.3	A33	A33-D35 PolarHBondContact O-N 3.16Å
36	E	27.5	Very low	29	Very low	170 Å²	170	111.4 Å²	111.4	79%	0.794	70%	0.697	S	S	*	*	S	Bend	trans	-63.1	145.6	165.7	-65.5	179.9	157.4	0	0	107.8
37	D	27.4	Very low	28.9	Very low	156 Å²	156	118.2 Å²	118.2	83%	0.834	71%	0.713	S	S	*	*			trans	93.7	88.5	174.4	-49.5	-31	0	0	0	117.4
38	S	27.2	Very low	28.9	Very low	85 Å²	85	116.6 Å²	116.6	59%	0.594	71%	0.714	S	S	*	*				-169.6	104	128.8	36.4	0	0	0	0	109.9	A40	S38-A40 PolarHBondContact O-N 3.21Å
39	D	26.9	Very low	29.9	Very low	186 Å²	186	119 Å²	119	100%	0.995	74%	0.743	S	S	*	*			trans	-71.6	81.4	164.2	-79.2	-38.4	0	0	0	108.6
40	A	27.3	Very low	31.6	Very low	74 Å²	74	114.8 Å²	114.8	61%	0.612	74%	0.736	S	S	*	*			trans	-108.2	101.6	164.5	0	0	0	0	0	108.2	S38 P42	S38-A40 PolarHBondContact O-N 3.21Å; A40-P42 VanDerWaalsContact O-CD 3.3Å; A40-P42 WeakPolarHBondContact O-CD 3.29Å
41	D	28.4	Very low	34.1	Very low	132 Å²	132	110 Å²	110	71%	0.706	71%	0.713	S	S	*	*			trans	-61.2	116.2	170.1	-95.9	-38	0	0	0	109.2	E43	D41-E43 PolarHBondContact O-N 3.29Å
42	P	31.2	Very low	36.6	Very low	71 Å²	71	109.4 Å²	109.4	46%	0.461	71%	0.709	S	S	.	*			trans	-75.1	119.5	161.8	24.5	-13.9	0	0	0	106.8	A40	A40-P42 VanDerWaalsContact O-CD 3.3Å; A40-P42 WeakPolarHBondContact O-CD 3.29Å
43	E	30.9	Very low	39.6	Very low	179 Å²	179	108.2 Å²	108.2	84%	0.836	70%	0.701	S	S	*	*			trans	-12	137.9	176.5	-66.4	178	155.4	0	0	116.8	D41 G45	D41-E43 PolarHBondContact O-N 3.29Å; E43-G45 PolarHBondContact O-N 2.85Å
44	A	28.5	Very low	42.6	Very low	90 Å²	90	103.8 Å²	103.8	74%	0.744	66%	0.664	S	S	*	*			trans	-49.6	101.7	163.1	0	0	0	0	0	110.2	G46	A44-G46 PolarHBondContact O-N 3.12Å
45	G	30.6	Very low	45.4	Very low	75 Å²	75	99.7 Å²	99.7	77%	0.773	64%	0.644	S	S	*	*			trans	-56.6	108.2	151.1	0	0	0	0	0	106.3	E43	E43-G45 PolarHBondContact O-N 2.85Å
46	G	27.5	Very low	48.4	Very low	55 Å²	55	92.6 Å²	92.6	57%	0.567	61%	0.606	S	S	*	*			trans	-57	167	-169.6	0	0	0	0	0	113.5	A44 G48	A44-G46 PolarHBondContact O-N 3.12Å; G46-G48 PolarHBondContact O-N 3.2Å
47	E	29.5	Very low	51.6	Low	202 Å²	202	90.5 Å²	90.5	94%	0.944	59%	0.59	S	S	*	*	S	Bend	trans	-65.3	37.2	177.1	-65.5	179.7	135.7	0	0	114
48	G	32.5	Very low	54.8	Low	63 Å²	63	83.1 Å²	83.1	65%	0.649	55%	0.551	S	S	*	*			trans	-109.4	105.1	163.9	0	0	0	0	0	109.2	G46 G50	G46-G48 PolarHBondContact O-N 3.2Å; G48-G50 PolarHBondContact O-N 3.11Å
49	G	50.8	Low	57.9	Low	97 Å²	97	80 Å²	80	100%	1	53%	0.531	S	S	*	.			trans	-70.9	39.3	-166.4	0	0	0	0	0	117.9
50	G	66.1	Low	60.9	Low	62 Å²	62	77.5 Å²	77.5	64%	0.639	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-96	146.8	176.7	0	0	0	0	0	113.5	G48	G48-G50 PolarHBondContact O-N 3.11Å
51	V	79.1	Confident	64.1	Low	36 Å²	36	74 Å²	74	22%	0.218	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-71.5	125.9	170.3	-178.2	0	0	0	0	108.3	H252	V51-H252 VanDerWaalsContact CG2-CE1 3.44Å; V51-H252 WeakPolarHBondContact CG2-CE1 3.3Å; V51-H252 WeakPolarHBondContact CG2-NE2 3.29Å
52	P	81.6	Confident	67.2	Low	80 Å²	80	68.7 Å²	68.7	52%	0.519	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-65.7	129.9	178.1	23.4	-28.5	0	0	0	109.3	V54 S221	P52-V54 PolarHBondContact O-N 2.99Å; P52-S221 WeakPolarHBondContact CG-OG 3.45Å; P52-S221 PolarHBondContact O-OG 2.93Å
53	P	88.5	Confident	70.1	Confident	88 Å²	88	65.3 Å²	65.3	57%	0.571	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-69.5	130.5	-174.7	27.3	-34.3	0	0	0	110.9	S86 N126	P53-S86 VanDerWaalsContact CA-OG 3.31Å; P53-S86 WeakPolarHBondContact CA-OG 3.46Å; P53-S86 VanDerWaalsContact CB-OG 3.31Å; P53-S86 WeakPolarHBondContact CB-OG 3.35Å; P53-N126 PolarHBondContact O-ND2 3.39Å; P53-N126 VanDerWaalsContact O-ND2 3.1Å
54	V	90.4	Very high	73	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.006	39%	0.39	C	S	.	.			trans	-132.4	110	-177.2	177.9	0	0	0	0	111.7	P52 I125 N126 Y135 S221 I222 T253	P52-V54 PolarHBondContact O-N 2.99Å; V54-I125 HydrophobicContact CG1-CG2 3.32Å; V54-N126 WeakPolarHBondContact CA-OD1 3.44Å; V54-Y135 HydrophobicContact CG2-CD1 3.82Å; V54-Y135 HydrophobicContact CG2-CE1 3.96Å; V54-S221 VanDerWaalsContact CG2-CB 3.47Å; V54-I222 HydrophobicContact CB-CG1 4.19Å; V54-I222 HydrophobicContact CG1-CD1 3.62Å; V54-I222 HydrophobicContact CG1-CG1 3.75Å; V54-T253 WeakPolarHBondContact O-CB 3.42Å; V54-T253 PolarHBondContact O-OG1 3.03Å
55	T	92.7	Very high	75.9	Confident	38 Å²	38	55.7 Å²	55.7	23%	0.233	37%	0.371	C	S	.	.			trans	-91	131.4	171.1	-63.3	0	0	0	0	110.2	E83 A84 K85 I125 N126	T55-E83 HydrophobicContact CG2-CG 3.72Å; T55-E83 WeakPolarHBondContact CG2-OE1 3.15Å; T55-A84 CarbonylContact C-O 3.48Å; T55-A84 WeakPolarHBondContact CA-O 3.37Å; T55-K85 HydrophobicContact CG2-CG 4.14Å; T55-I125 CarbonylContact O-C 3.56Å; T55-I125 WeakPolarHBondContact O-CA 3.3Å; T55-N126 PolarHBondContact N-OD1 3.39Å; T55-N126 PolarHBondContact O-N 3.42Å
56	I	92.7	Very high	78.6	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	129.2	173.5	-58.7	176.5	0	0	0	108.3	W58 E83 A84 L123 Y124 I222 F224 I255	I56-W58 HydrophobicContact CG2-CE3 4.25Å; I56-E83 CarbonylContact O-C 3.57Å; I56-E83 VanDerWaalsContact O-CA 3.26Å; I56-E83 WeakPolarHBondContact O-CA 3.48Å; I56-A84 PolarHBondContact N-O 2.9Å; I56-A84 PolarHBondContact O-N 3.35Å; I56-L123 HydrophobicContact CG2-CD1 3.59Å; I56-Y124 WeakPolarHBondContact CA-O 3.27Å; I56-I222 HydrophobicContact CD1-CB 4.27Å; I56-I222 HydrophobicContact CD1-CD1 3.55Å; I56-I222 HydrophobicContact CD1-CG1 3.8Å; I56-I222 HydrophobicContact CD1-CG2 3.47Å; I56-I222 VanDerWaalsContact CD1-CG2 3.47Å; I56-I222 HydrophobicContact CG1-CD1 3.91Å; I56-I222 HydrophobicContact CG1-CG1 4.27Å; I56-F224 HydrophobicContact CD1-CZ 3.87Å; I56-I255 HydrophobicContact CD1-CD1 4.21Å
57	R	94.1	Very high	81.3	Confident	126 Å²	126	57.5 Å²	57.5	48%	0.475	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	129.7	170.2	-175.8	177.7	-180	158.6	-0.2	109.3	G82 E83 Y124 E347	R57-G82 CarbonylContact C-O 3.56Å; R57-G82 WeakPolarHBondContact CA-O 3.33Å; R57-G82 WeakPolarHBondContact CG-O 3.33Å; R57-E83 HydrophobicContact CB-CG 4.43Å; R57-Y124 PolarHBondContact N-O 3.3Å; R57-Y124 PolarHBondContact O-N 3.22Å; R57-E347 IonicContact NH2-OE1 3.64Å
58	W	93.9	Very high	83.7	Confident	1 Å²	1	58.7 Å²	58.7	0%	0.004	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	143.2	171.7	62.3	95.2	0	0	0	109.7	I56 I61 S81 G82 A84 L90 L107 F122 L123 V273	I56-W58 HydrophobicContact CG2-CE3 4.25Å; W58-I61 HydrophobicContact CB-CD1 4.28Å; W58-I61 HydrophobicContact CB-CG1 3.78Å; W58-I61 HydrophobicContact CG-CG1 4.19Å; W58-S81 CarbonylContact O-C 3.29Å; W58-S81 WeakPolarHBondContact O-CA 3.29Å; W58-G82 VanDerWaalsContact CE2-CA 3.44Å; W58-G82 PolarHBondContact N-O 2.61Å; W58-G82 VanDerWaalsContact NE1-N 3.19Å; W58-G82 PolarHBondContact O-N 3.29Å; W58-G82 VanDerWaalsContact O-O 3.11Å; W58-A84 HydrophobicContact CZ3-CB 4.11Å; W58-L90 HydrophobicContact CH2-CD2 3.72Å; W58-L90 HydrophobicContact CZ3-CD2 4.43Å; W58-L107 HydrophobicContact CB-CD2 3.64Å; W58-L107 HydrophobicContact CD2-CD1 4.1Å; W58-L107 HydrophobicContact CD2-CD2 3.72Å; W58-L107 HydrophobicContact CE3-CD1 3.87Å; W58-L107 HydrophobicContact CE3-CD2 3.77Å; W58-L107 HydrophobicContact CE3-CG 4.49Å; W58-L107 HydrophobicContact CG-CD2 3.68Å; W58-L107 HydrophobicContact CH2-CD1 4.37Å; W58-L107 HydrophobicContact CZ3-CD1 4.01Å; W58-F122 CarbonylContact C-O 3.58Å; W58-F122 WeakPolarHBondContact CA-O 3.22Å; W58-L123 HydrophobicContact CB-CD1 3.91Å; W58-V273 HydrophobicContact CZ2-CG2 4.35Å
59	A	91.9	Very high	85.7	Confident	21 Å²	21	66.4 Å²	66.4	17%	0.174	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	133.1	-179.4	0	0	0	0	0	110	I61 F122	A59-I61 VanDerWaalsContact C-N 3.27Å; A59-I61 PolarHBondContact O-N 3.47Å; A59-F122 HydrophobicContact CB-CB 4.4Å; A59-F122 PolarHBondContact N-O 2.75Å; A59-F122 PolarHBondContact O-N 3.34Å
60	R	91.3	Very high	86.9	Confident	133 Å²	133	63.7 Å²	63.7	50%	0.502	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.8	38.5	174.9	-47.2	-171.4	-174.7	149.7	3	114	T62 N79 A80 S81 G121	R60-T62 PolarHBondContact O-N 3.11Å; R60-N79 WeakPolarHBondContact CA-OD1 3.39Å; R60-N79 WeakPolarHBondContact CB-OD1 3.47Å; R60-N79 VanDerWaalsContact CG-OD1 3.25Å; R60-N79 WeakPolarHBondContact CG-OD1 3.38Å; R60-A80 PolarHBondContact N-O 2.94Å; R60-S81 PolarHBondContact N-OG 3.16Å; R60-G121 WeakPolarHBondContact O-CA 3.35Å
61	I	93.2	Very high	87.4	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	116.4	177.6	-61.1	-63.9	0	0	0	109.4	W58 A59 L77 N79 A80 L103 V106 L119 S120 L651	W58-I61 HydrophobicContact CB-CD1 4.28Å; W58-I61 HydrophobicContact CB-CG1 3.78Å; W58-I61 HydrophobicContact CG-CG1 4.19Å; A59-I61 VanDerWaalsContact C-N 3.27Å; A59-I61 PolarHBondContact O-N 3.47Å; I61-L77 HydrophobicContact CG2-CD1 4Å; I61-N79 PolarHBondContact O-N 3.35Å; I61-A80 HydrophobicContact CB-CB 4.32Å; I61-A80 WeakPolarHBondContact CB-O 3.49Å; I61-A80 PolarHBondContact N-O 3.1Å; I61-A80 PolarHBondContact O-N 2.67Å; I61-L103 HydrophobicContact CG2-CD1 4.29Å; I61-V106 HydrophobicContact CD1-CG1 4.35Å; I61-V106 HydrophobicContact CG2-CG1 3.84Å; I61-L119 HydrophobicContact CG2-CD1 4.41Å; I61-S120 WeakPolarHBondContact CA-O 3.12Å; I61-L651 HydrophobicContact CD1-CD1 3.89Å; I61-L651 HydrophobicContact CD1-CD2 4.11Å
62	T	94.2	Very high	87.4	Confident	20 Å²	20	67.1 Å²	67.1	12%	0.123	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127.8	177.5	-60.6	0	0	0	0	109.3	R60 F75 L77 N79 L119 S120	R60-T62 PolarHBondContact O-N 3.11Å; T62-F75 HydrophobicContact CG2-CD1 3.78Å; T62-F75 HydrophobicContact CG2-CE1 3.76Å; T62-L77 WeakPolarHBondContact CA-O 3.31Å; T62-N79 PolarHBondContact OG1-N 2.89Å; T62-L119 WeakPolarHBondContact O-CA 3.49Å; T62-S120 PolarHBondContact N-O 2.97Å; T62-S120 PolarHBondContact O-N 3.22Å
63	C	93	Very high	87.4	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	109.4	178.9	-177.9	0	0	0	0	108.8	L76 L77 T102 H118 L119	C63-L76 HydrophobicContact CB-CB 4.3Å; C63-L76 PolarHBondContact O-N 3.2Å; C63-L77 HydrophobicContact CB-CB 3.96Å; C63-L77 HydrophobicContact CB-CD1 4.16Å; C63-L77 HydrophobicContact CB-CG 4.26Å; C63-L77 PolarHBondContact N-O 3.39Å; C63-L77 PolarHBondContact O-N 3.46Å; C63-T102 HydrophobicContact CB-CG2 4.27Å; C63-H118 CarbonylContact C-O 3.59Å; C63-H118 WeakPolarHBondContact CA-O 3.17Å; C63-L119 HydrophobicContact CB-CD1 4.14Å
64	A	91.5	Very high	87.3	Confident	3 Å²	3	67.5 Å²	67.5	3%	0.025	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134.3	-175.2	0	0	0	0	0	111.6	V72 F75 H118	A64-V72 HydrophobicContact CB-CG1 3.89Å; A64-V72 HydrophobicContact CB-CG2 4.25Å; A64-F75 HydrophobicContact CB-CD1 3.93Å; A64-F75 HydrophobicContact CB-CE1 3.93Å; A64-H118 PolarHBondContact N-O 3.41Å; A64-H118 PolarHBondContact O-N 3.24Å
65	L	89.6	Confident	87.2	Confident	65 Å²	65	72.3 Å²	72.3	34%	0.34	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.4	169.6	-156.8	89.9	0	0	0	108.9	A73 R74 S116	L65-A73 WeakPolarHBondContact O-CA 3.46Å; L65-A73 WeakPolarHBondContact O-CB 3.18Å; L65-A73 PolarHBondContact O-N 3.35Å; L65-R74 PolarHBondContact N-O 3.5Å; L65-R74 PolarHBondContact O-N 3.44Å; L65-S116 CarbonylContact C-O 3.47Å; L65-S116 WeakPolarHBondContact CA-O 3.35Å
66	K	86.3	Confident	87.2	Confident	74 Å²	74	72.6 Å²	72.6	32%	0.322	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	139.6	176.1	-66.7	-177.3	173.7	-174	0	111	G70 D71 S116	K66-G70 WeakPolarHBondContact CD-O 3.49Å; K66-D71 CarbonylContact C-O 3.55Å; K66-D71 VanDerWaalsContact CA-O 3.27Å; K66-D71 WeakPolarHBondContact CA-O 3.4Å; K66-S116 PolarHBondContact N-O 2.98Å; K66-S116 WeakPolarHBondContact O-CB 3.3Å
67	N	84.7	Confident	87.3	Confident	94 Å²	94	72.4 Å²	72.4	50%	0.503	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-73.9	170.1	170.6	-81.7	-25.9	0	0	0	111.2	R69 G70 D71 A73	N67-R69 PolarHBondContact O-N 3.21Å; N67-G70 PolarHBondContact O-N 3.45Å; N67-D71 PolarHBondContact N-O 2.92Å; N67-A73 HydrophobicContact CB-CB 4.33Å; N67-A73 WeakPolarHBondContact ND2-CB 3.49Å; N67-A73 WeakPolarHBondContact OD1-CB 3.31Å
68	K	78.8	Confident	87.2	Confident	226 Å²	226	67.6 Å²	67.6	98%	0.983	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-21.4	176.1	-66.5	-175.9	-179.6	178.1	0	114
69	R	75.6	Confident	87.1	Confident	225 Å²	225	70.9 Å²	70.9	85%	0.849	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-8.9	176.9	-64.3	-176.8	-177.8	177.9	0.3	113.8	N67	N67-R69 PolarHBondContact O-N 3.21Å
70	G	74.8	Confident	87.1	Confident	40 Å²	40	70 Å²	70	41%	0.412	34%	0.339	S	S	.	.	S	Bend	trans	94.5	-16.7	-175.8	0	0	0	0	0	114.5	K66 N67	K66-G70 WeakPolarHBondContact CD-O 3.49Å; N67-G70 PolarHBondContact O-N 3.45Å
71	D	77.9	Confident	87.2	Confident	101 Å²	101	65.9 Å²	65.9	54%	0.54	33%	0.331	S	S	.	.	S	Bend	trans	-67.7	144.8	178.4	-54.8	-43.1	0	0	0	112.1	K66 N67 A73	K66-D71 CarbonylContact C-O 3.55Å; K66-D71 VanDerWaalsContact CA-O 3.27Å; K66-D71 WeakPolarHBondContact CA-O 3.4Å; N67-D71 PolarHBondContact N-O 2.92Å; D71-A73 PolarHBondContact O-N 3.27Å; D71-A73 VanDerWaalsContact O-N 3.17Å
72	V	79.5	Confident	87.3	Confident	69 Å²	69	66.3 Å²	66.3	42%	0.418	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	115.1	173.7	178.6	0	0	0	0	109.1	A64 F75	A64-V72 HydrophobicContact CB-CG1 3.89Å; A64-V72 HydrophobicContact CB-CG2 4.25Å; V72-F75 HydrophobicContact CG1-CD2 4.07Å; V72-F75 HydrophobicContact CG1-CE1 4.22Å; V72-F75 HydrophobicContact CG1-CE2 3.68Å; V72-F75 HydrophobicContact CG1-CZ 3.77Å
73	A	80.2	Confident	87.3	Confident	45 Å²	45	68.2 Å²	68.2	37%	0.372	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-41.8	178.9	0	0	0	0	0	111.9	L65 N67 D71	L65-A73 WeakPolarHBondContact O-CA 3.46Å; L65-A73 WeakPolarHBondContact O-CB 3.18Å; L65-A73 PolarHBondContact O-N 3.35Å; N67-A73 HydrophobicContact CB-CB 4.33Å; N67-A73 WeakPolarHBondContact ND2-CB 3.49Å; N67-A73 WeakPolarHBondContact OD1-CB 3.31Å; D71-A73 PolarHBondContact O-N 3.27Å; D71-A73 VanDerWaalsContact O-N 3.17Å
74	R	86.7	Confident	87.5	Confident	132 Å²	132	68.3 Å²	68.3	50%	0.498	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	138.9	-173.5	-175	175.7	-177.9	-176.1	4.2	110.2	L65	L65-R74 PolarHBondContact N-O 3.5Å; L65-R74 PolarHBondContact O-N 3.44Å
75	F	88.7	Confident	87.6	Confident	102 Å²	102	72.9 Å²	72.9	45%	0.447	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	127.6	164.7	-68.5	-86.1	0	0	0	109.3	T62 A64 V72	T62-F75 HydrophobicContact CG2-CD1 3.78Å; T62-F75 HydrophobicContact CG2-CE1 3.76Å; A64-F75 HydrophobicContact CB-CD1 3.93Å; A64-F75 HydrophobicContact CB-CE1 3.93Å; V72-F75 HydrophobicContact CG1-CD2 4.07Å; V72-F75 HydrophobicContact CG1-CE1 4.22Å; V72-F75 HydrophobicContact CG1-CE2 3.68Å; V72-F75 HydrophobicContact CG1-CZ 3.77Å
76	L	92.2	Very high	87.9	Confident	44 Å²	44	71.2 Å²	71.2	23%	0.23	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-29.1	170.3	-58.6	179.4	0	0	0	111.1	C63 T102 L117 G278	C63-L76 HydrophobicContact CB-CB 4.3Å; C63-L76 PolarHBondContact O-N 3.2Å; L76-T102 HydrophobicContact CB-CG2 4.11Å; L76-T102 HydrophobicContact CD1-CG2 4.43Å; L76-L117 HydrophobicContact CD1-CD1 4.34Å; L76-G278 WeakPolarHBondContact O-CA 3.11Å
77	L	94.4	Very high	88.3	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	139.7	169.8	-64.9	169.5	0	0	0	108.3	I61 T62 C63 T102 L103 V106 G278	I61-L77 HydrophobicContact CG2-CD1 4Å; T62-L77 WeakPolarHBondContact CA-O 3.31Å; C63-L77 HydrophobicContact CB-CB 3.96Å; C63-L77 HydrophobicContact CB-CD1 4.16Å; C63-L77 HydrophobicContact CB-CG 4.26Å; C63-L77 PolarHBondContact N-O 3.39Å; C63-L77 PolarHBondContact O-N 3.46Å; L77-T102 HydrophobicContact CD1-CG2 3.9Å; L77-T102 HydrophobicContact CG-CG2 4.12Å; L77-L103 HydrophobicContact CD1-CB 3.94Å; L77-L103 HydrophobicContact CD1-CD1 4.08Å; L77-L103 HydrophobicContact CD2-CB 4.06Å; L77-V106 HydrophobicContact CD1-CG2 4.43Å; L77-G278 CarbonylContact C-O 3.56Å; L77-G278 VanDerWaalsContact CA-O 3.3Å; L77-G278 WeakPolarHBondContact CA-O 3.25Å
78	S	93.3	Very high	88.8	Confident	24 Å²	24	68.5 Å²	68.5	17%	0.168	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	114.1	178.1	170.8	0	0	0	0	108.9	A80 G278 E279	S78-A80 PolarHBondContact O-N 2.96Å; S78-G278 PolarHBondContact N-O 3.31Å; S78-E279 PolarHBondContact OG-OE1 3.36Å
79	N	90.9	Very high	89.7	Confident	71 Å²	71	57.7 Å²	57.7	38%	0.38	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50	31.6	174.3	-159.4	26.7	0	0	0	116	R60 I61 T62 S81	R60-N79 WeakPolarHBondContact CA-OD1 3.39Å; R60-N79 WeakPolarHBondContact CB-OD1 3.47Å; R60-N79 VanDerWaalsContact CG-OD1 3.25Å; R60-N79 WeakPolarHBondContact CG-OD1 3.38Å; I61-N79 PolarHBondContact O-N 3.35Å; T62-N79 PolarHBondContact OG1-N 2.89Å; N79-S81 PolarHBondContact O-N 3.29Å; N79-S81 PolarHBondContact O-OG 3.14Å
80	A	93.2	Very high	90.8	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.008	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	125.5	-175.9	0	0	0	0	0	110.5	R60 I61 S78 L103 V280	R60-A80 PolarHBondContact N-O 2.94Å; I61-A80 HydrophobicContact CB-CB 4.32Å; I61-A80 WeakPolarHBondContact CB-O 3.49Å; I61-A80 PolarHBondContact N-O 3.1Å; I61-A80 PolarHBondContact O-N 2.67Å; S78-A80 PolarHBondContact O-N 2.96Å; A80-L103 HydrophobicContact CB-CD1 4.41Å; A80-V280 HydrophobicContact CB-CG2 4Å
81	S	93.3	Very high	91.9	Very high	48 Å²	48	45.2 Å²	45.2	34%	0.336	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	151	179.6	-58.3	0	0	0	0	110.2	W58 R60 N79	W58-S81 CarbonylContact O-C 3.29Å; W58-S81 WeakPolarHBondContact O-CA 3.29Å; R60-S81 PolarHBondContact N-OG 3.16Å; N79-S81 PolarHBondContact O-N 3.29Å; N79-S81 PolarHBondContact O-OG 3.14Å
82	G	93.8	Very high	92.8	Very high	9 Å²	9	40.4 Å²	40.4	9%	0.093	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168	-173	176.8	0	0	0	0	0	115.8	R57 W58 M283	R57-G82 CarbonylContact C-O 3.56Å; R57-G82 WeakPolarHBondContact CA-O 3.33Å; R57-G82 WeakPolarHBondContact CG-O 3.33Å; W58-G82 VanDerWaalsContact CE2-CA 3.44Å; W58-G82 PolarHBondContact N-O 2.61Å; W58-G82 VanDerWaalsContact NE1-N 3.19Å; W58-G82 PolarHBondContact O-N 3.29Å; W58-G82 VanDerWaalsContact O-O 3.11Å; G82-M283 WeakPolarHBondContact CA-SD 3.29Å
83	E	94.9	Very high	93.6	Very high	60 Å²	60	37.2 Å²	37.2	28%	0.28	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	140.8	-170.6	-169.6	-173.4	-171.4	0	0	110.3	T55 I56 R57 K85 M283	T55-E83 HydrophobicContact CG2-CG 3.72Å; T55-E83 WeakPolarHBondContact CG2-OE1 3.15Å; I56-E83 CarbonylContact O-C 3.57Å; I56-E83 VanDerWaalsContact O-CA 3.26Å; I56-E83 WeakPolarHBondContact O-CA 3.48Å; R57-E83 HydrophobicContact CB-CG 4.43Å; E83-K85 HydrophobicContact CG-CG 4.23Å; E83-K85 WeakPolarHBondContact OE1-CE 3.4Å; E83-K85 WeakPolarHBondContact OE2-CE 3.22Å; E83-K85 IonicContact OE2-NZ 2.82Å; E83-M283 HydrophobicContact CB-CE 3.75Å
84	A	96.3	Very high	94.2	Very high	2 Å²	2	35.2 Å²	35.2	2%	0.017	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	122.7	170.4	0	0	0	0	0	108.7	T55 I56 W58 L90 T253 I255	T55-A84 CarbonylContact C-O 3.48Å; T55-A84 WeakPolarHBondContact CA-O 3.37Å; I56-A84 PolarHBondContact N-O 2.9Å; I56-A84 PolarHBondContact O-N 3.35Å; W58-A84 HydrophobicContact CZ3-CB 4.11Å; A84-L90 HydrophobicContact CB-CD2 3.78Å; A84-T253 HydrophobicContact CB-CG2 3.86Å; A84-I255 HydrophobicContact CB-CD1 3.54Å; A84-I255 HydrophobicContact CB-CG1 3.73Å
85	K	95.2	Very high	94.4	Very high	98 Å²	98	30 Å²	30	43%	0.426	16%	0.164	S	C	.	.			trans	-101	153.2	-173.4	-59.9	173.2	-178.6	176	0	111.1	T55 E83 R88	T55-K85 HydrophobicContact CG2-CG 4.14Å; E83-K85 HydrophobicContact CG-CG 4.23Å; E83-K85 WeakPolarHBondContact OE1-CE 3.4Å; E83-K85 WeakPolarHBondContact OE2-CE 3.22Å; E83-K85 IonicContact OE2-NZ 2.82Å; K85-R88 PolarHBondContact O-N 2.92Å
86	S	94.4	Very high	94.5	Very high	31 Å²	31	29.9 Å²	29.9	22%	0.217	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	145.7	171.6	171.1	0	0	0	0	111.5	P53 R88 G251 T253	P53-S86 VanDerWaalsContact CA-OG 3.31Å; P53-S86 WeakPolarHBondContact CA-OG 3.46Å; P53-S86 VanDerWaalsContact CB-OG 3.31Å; P53-S86 WeakPolarHBondContact CB-OG 3.35Å; S86-R88 VanDerWaalsContact C-N 3.28Å; S86-R88 PolarHBondContact O-N 2.95Å; S86-G251 PolarHBondContact OG-O 2.89Å; S86-T253 WeakPolarHBondContact CA-OG1 3.28Å; S86-T253 PolarHBondContact N-OG1 3.45Å
87	G	95.1	Very high	94.3	Very high	32 Å²	32	30.6 Å²	30.6	33%	0.33	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	84	0.6	-178.8	0	0	0	0	0	114.2	A248 H252	G87-A248 CarbonylContact C-O 3.54Å; G87-A248 WeakPolarHBondContact CA-O 3.47Å; G87-H252 PolarHBondContact N-O 3.32Å
88	R	96.6	Very high	94.2	Very high	78 Å²	78	30.7 Å²	30.7	29%	0.294	19%	0.194	S	C	.	.			trans	-129.4	143.1	-168.9	-60.9	-177.5	69.3	79.6	-6.5	112.5	K85 S86 V254 D270 D271	K85-R88 PolarHBondContact O-N 2.92Å; S86-R88 VanDerWaalsContact C-N 3.28Å; S86-R88 PolarHBondContact O-N 2.95Å; R88-V254 PolarHBondContact O-N 3.32Å; R88-D270 WeakPolarHBondContact CA-OD2 3.35Å; R88-D270 HydrophobicContact CB-CB 4.05Å; R88-D270 HydrophobicContact CG-CB 4.37Å; R88-D270 PolarHBondContact NH2-O 2.93Å; R88-D270 VanDerWaalsContact NH2-O 3.09Å; R88-D271 IonicContact CZ-OD1 3.49Å; R88-D271 IonicContact CZ-OD2 3.39Å; R88-D271 IonicContact NE-OD1 3.21Å; R88-D271 PolarHBondContact NE-OD1 3.49Å; R88-D271 IonicContact NE-OD2 3.59Å; R88-D271 PolarHBondContact NE-OD2 3.06Å; R88-D271 IonicContact NH2-OD1 2.73Å; R88-D271 PolarHBondContact NH2-OD1 3.29Å; R88-D271 IonicContact NH2-OD2 3.72Å
89	L	97.5	Very high	94.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	110.1	173.4	-179.8	64.5	0	0	0	110.5	M241 L244 R245 A248 V254 F269 D270 D271	L89-M241 HydrophobicContact CD2-CE 4.03Å; L89-L244 HydrophobicContact CD1-CB 4.27Å; L89-R245 HydrophobicContact CD2-CB 4.26Å; L89-A248 HydrophobicContact CB-CB 4.18Å; L89-V254 HydrophobicContact CD1-CB 3.67Å; L89-V254 HydrophobicContact CD1-CG1 3.38Å; L89-F269 HydrophobicContact CD2-CD1 3.77Å; L89-F269 HydrophobicContact CD2-CE1 3.98Å; L89-F269 HydrophobicContact CG-CD1 3.87Å; L89-F269 HydrophobicContact CG-CE1 4.24Å; L89-D270 PolarHBondContact N-OD2 2.94Å; L89-D270 PolarHBondContact O-N 3.46Å; L89-D271 PolarHBondContact O-N 3.24Å
90	L	98	Very high	94.4	Very high	3 Å²	3	27 Å²	27	2%	0.016	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	127	177.2	175.1	67.2	0	0	0	111.6	W58 A84 L92 V254 I255 C256 D271 V273	W58-L90 HydrophobicContact CH2-CD2 3.72Å; W58-L90 HydrophobicContact CZ3-CD2 4.43Å; A84-L90 HydrophobicContact CB-CD2 3.78Å; L90-L92 HydrophobicContact CD2-CD2 4.36Å; L90-V254 PolarHBondContact N-O 3.33Å; L90-I255 HydrophobicContact CB-CG1 4.34Å; L90-I255 HydrophobicContact CD2-CG1 4.24Å; L90-I255 HydrophobicContact CD2-CG2 4.14Å; L90-I255 HydrophobicContact CG-CG2 4.44Å; L90-I255 WeakPolarHBondContact O-CA 3.37Å; L90-C256 PolarHBondContact O-N 3.37Å; L90-D271 WeakPolarHBondContact CA-O 3.49Å; L90-D271 HydrophobicContact CB-CB 4.43Å; L90-D271 HydrophobicContact CD1-CB 3.49Å; L90-D271 VanDerWaalsContact CD1-CB 3.49Å; L90-V273 HydrophobicContact CD1-CG2 3.93Å; L90-V273 HydrophobicContact CD2-CG2 4.44Å
91	A	97.5	Very high	94.4	Very high	0 Å²	0	29 Å²	29	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	128.4	170.4	0	0	0	0	0	112.6	C256 I258 F269 D271 I272 V273	A91-C256 CarbonylContact C-O 3.44Å; A91-C256 WeakPolarHBondContact CA-O 3.17Å; A91-I258 HydrophobicContact CB-CG2 4.33Å; A91-F269 HydrophobicContact CB-CB 4.44Å; A91-F269 HydrophobicContact CB-CD1 3.6Å; A91-F269 HydrophobicContact CB-CD2 3.88Å; A91-F269 HydrophobicContact CB-CE1 3.71Å; A91-F269 HydrophobicContact CB-CE2 3.98Å; A91-F269 HydrophobicContact CB-CG 3.7Å; A91-F269 HydrophobicContact CB-CZ 3.9Å; A91-D271 PolarHBondContact N-O 3.48Å; A91-I272 HydrophobicContact CB-CG1 4.19Å; A91-I272 CarbonylContact O-C 3.46Å; A91-I272 WeakPolarHBondContact O-CA 3.21Å; A91-V273 PolarHBondContact O-N 2.89Å
92	L	97.4	Very high	94.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	109.7	161.7	-53.5	-177.8	0	0	0	108.5	L90 K100 L103 L104 I255 C256 S257 I258 V273	L90-L92 HydrophobicContact CD2-CD2 4.36Å; L92-K100 HydrophobicContact CB-CB 4.45Å; L92-L103 HydrophobicContact CD1-CB 4.41Å; L92-L103 HydrophobicContact CD1-CD2 4.22Å; L92-L103 HydrophobicContact CD1-CG 4.31Å; L92-L103 HydrophobicContact CD2-CD2 4.19Å; L92-L104 HydrophobicContact CD1-CB 4.07Å; L92-L104 HydrophobicContact CD1-CD1 3.85Å; L92-I255 HydrophobicContact CD1-CG2 4.18Å; L92-I255 HydrophobicContact CD2-CG2 4.45Å; L92-I255 HydrophobicContact CG-CG2 4.05Å; L92-C256 PolarHBondContact N-O 3.13Å; L92-S257 WeakPolarHBondContact O-CA 3.42Å; L92-I258 PolarHBondContact O-N 3.35Å; L92-V273 HydrophobicContact CD2-CB 3.74Å; L92-V273 HydrophobicContact CD2-CG1 4.11Å; L92-V273 HydrophobicContact CD2-CG2 4.19Å
93	M	95.9	Very high	94.5	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	149.9	-174.9	-163.6	175.9	84	0	0	111.4	I258 P261 I272 V273 L274 L275 A308 L311	M93-I258 HydrophobicContact CB-CG2 4.42Å; M93-I258 HydrophobicContact CG-CG2 4.33Å; M93-P261 HydrophobicContact SD-CG 4.22Å; M93-I272 HydrophobicContact CB-CD1 4.11Å; M93-I272 HydrophobicContact CB-CG1 4.34Å; M93-I272 HydrophobicContact CE-CD1 3.89Å; M93-I272 HydrophobicContact SD-CD1 4.04Å; M93-V273 PolarHBondContact N-O 3.03Å; M93-L274 HydrophobicContact CB-CD2 3.94Å; M93-L274 HydrophobicContact CE-CD2 3.56Å; M93-L274 CarbonylContact O-C 3.3Å; M93-L274 WeakPolarHBondContact O-CA 3.46Å; M93-L275 PolarHBondContact O-N 3.4Å; M93-A308 HydrophobicContact CE-CB 4.42Å; M93-A308 HydrophobicContact SD-CB 4.12Å; M93-L311 HydrophobicContact CE-CB 3.64Å; M93-L311 HydrophobicContact CE-CD1 4.14Å
94	G	93.6	Very high	94.5	Very high	4 Å²	4	24.8 Å²	24.8	4%	0.041	16%	0.161	C	C	.	.			trans	161.7	163.9	-173.8	0	0	0	0	0	112.6	K100 L275	G94-K100 WeakPolarHBondContact O-CD 3.33Å; G94-K100 WeakPolarHBondContact O-CE 3.46Å; G94-K100 PolarHBondContact O-NZ 3.49Å; G94-L275 VanDerWaalsContact CA-O 3.3Å; G94-L275 WeakPolarHBondContact CA-O 3.47Å
95	P	91.3	Very high	94.3	Very high	23 Å²	23	26.1 Å²	26.1	15%	0.149	17%	0.167	C	C	.	.	S	Bend	trans	-61.8	167.4	178.1	22.3	-32.8	0	0	0	112.3	G97 S98 K100 L275 S316	P95-G97 PolarHBondContact O-N 2.84Å; P95-S98 WeakPolarHBondContact O-CB 3.5Å; P95-S98 PolarHBondContact O-N 3.15Å; P95-S98 PolarHBondContact O-OG 3.32Å; P95-K100 PolarHBondContact O-NZ 2.87Å; P95-L275 WeakPolarHBondContact CD-O 3.49Å; P95-S316 WeakPolarHBondContact CB-OG 3.2Å
96	S	90.2	Very high	94.1	Very high	98 Å²	98	21.9 Å²	21.9	69%	0.685	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	130.4	170.2	-72.5	0	0	0	0	110.4	H259	S96-H259 PolarHBondContact OG-NE2 3.11Å
97	G	87.9	Confident	93.9	Very high	59 Å²	59	20.5 Å²	20.5	61%	0.608	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.4	-0.2	-177.5	0	0	0	0	0	116.4	P95 G99	P95-G97 PolarHBondContact O-N 2.84Å; G97-G99 PolarHBondContact O-N 2.91Å
98	S	92.3	Very high	93.7	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.014	13%	0.128	C	C	.	.	S	Bend	trans	-66.6	-12.4	177.3	50.3	0	0	0	0	115.9	P95 K100 L275 G278	P95-S98 WeakPolarHBondContact O-CB 3.5Å; P95-S98 PolarHBondContact O-N 3.15Å; P95-S98 PolarHBondContact O-OG 3.32Å; S98-K100 VanDerWaalsContact OG-CG 3.25Å; S98-K100 WeakPolarHBondContact OG-CG 3.44Å; S98-L275 WeakPolarHBondContact CB-O 3.42Å; S98-G278 WeakPolarHBondContact O-CA 3.28Å; S98-G278 PolarHBondContact O-N 2.99Å
99	G	92.8	Very high	93.2	Very high	8 Å²	8	17.7 Å²	17.7	8%	0.082	13%	0.134	C	C	.	.	S	Bend	trans	101.1	3.3	-179.5	0	0	0	0	0	115.8	G97 T101 T102 L103	G97-G99 PolarHBondContact O-N 2.91Å; G99-T101 PolarHBondContact O-N 3.37Å; G99-T102 CarbonylContact O-C 3.56Å; G99-T102 WeakPolarHBondContact O-CA 3.33Å; G99-T102 WeakPolarHBondContact O-CB 3.39Å; G99-T102 PolarHBondContact O-N 2.98Å; G99-L103 PolarHBondContact O-N 3.35Å
100	K	94.6	Very high	92.5	Very high	9 Å²	9	19.7 Å²	19.7	4%	0.039	14%	0.143	C	C	.	.	H	α-helix	trans	-48.4	-57.9	179.5	-39.2	179.6	-75	-81.3	0	113.6	L92 G94 P95 S98 T102 L103 L104	L92-K100 HydrophobicContact CB-CB 4.45Å; G94-K100 WeakPolarHBondContact O-CD 3.33Å; G94-K100 WeakPolarHBondContact O-CE 3.46Å; G94-K100 PolarHBondContact O-NZ 3.49Å; P95-K100 PolarHBondContact O-NZ 2.87Å; S98-K100 VanDerWaalsContact OG-CG 3.25Å; S98-K100 WeakPolarHBondContact OG-CG 3.44Å; K100-T102 VanDerWaalsContact C-N 3.28Å; K100-T102 PolarHBondContact O-N 3.39Å; K100-L103 PolarHBondContact O-N 2.99Å; K100-L104 WeakPolarHBondContact O-CB 3.38Å; K100-L104 PolarHBondContact O-N 3.33Å
101	T	93.2	Very high	92	Very high	44 Å²	44	20.5 Å²	20.5	27%	0.27	15%	0.148	S	C	.	.	H	α-helix	trans	-66.1	-33.1	-179.9	-59.8	0	0	0	0	111.2	G99 N105 D226	G99-T101 PolarHBondContact O-N 3.37Å; T101-N105 VanDerWaalsContact CG2-ND2 3.31Å; T101-N105 WeakPolarHBondContact CG2-ND2 3.49Å; T101-N105 VanDerWaalsContact O-CB 3.27Å; T101-N105 WeakPolarHBondContact O-CB 3.44Å; T101-N105 PolarHBondContact O-N 2.86Å; T101-N105 PolarHBondContact O-ND2 3.5Å; T101-D226 VanDerWaalsContact CG2-OD2 3.27Å; T101-D226 WeakPolarHBondContact CG2-OD2 3.46Å; T101-D226 PolarHBondContact OG1-OD1 3.07Å; T101-D226 VanDerWaalsContact OG1-OD1 3.14Å
102	T	94.1	Very high	91.3	Very high	29 Å²	29	25.4 Å²	25.4	18%	0.178	18%	0.178	C	C	.	.	H	α-helix	trans	-63.6	-49.1	173.9	-51.1	0	0	0	0	110.5	C63 L76 L77 G99 K100 N105 V106 L111	C63-T102 HydrophobicContact CB-CG2 4.27Å; L76-T102 HydrophobicContact CB-CG2 4.11Å; L76-T102 HydrophobicContact CD1-CG2 4.43Å; L77-T102 HydrophobicContact CD1-CG2 3.9Å; L77-T102 HydrophobicContact CG-CG2 4.12Å; G99-T102 CarbonylContact O-C 3.56Å; G99-T102 WeakPolarHBondContact O-CA 3.33Å; G99-T102 WeakPolarHBondContact O-CB 3.39Å; G99-T102 PolarHBondContact O-N 2.98Å; K100-T102 VanDerWaalsContact C-N 3.28Å; K100-T102 PolarHBondContact O-N 3.39Å; T102-N105 PolarHBondContact O-N 3.44Å; T102-V106 VanDerWaalsContact O-CG2 3.31Å; T102-V106 WeakPolarHBondContact O-CG2 3.49Å; T102-V106 PolarHBondContact O-N 3.14Å; T102-L111 HydrophobicContact CG2-CD1 4.34Å
103	L	95.5	Very high	90.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.5	-47.4	178.9	-178.5	61.3	0	0	0	110.6	I61 L77 A80 L92 G99 K100 N105 V106 L107 L275	I61-L103 HydrophobicContact CG2-CD1 4.29Å; L77-L103 HydrophobicContact CD1-CB 3.94Å; L77-L103 HydrophobicContact CD1-CD1 4.08Å; L77-L103 HydrophobicContact CD2-CB 4.06Å; A80-L103 HydrophobicContact CB-CD1 4.41Å; L92-L103 HydrophobicContact CD1-CB 4.41Å; L92-L103 HydrophobicContact CD1-CD2 4.22Å; L92-L103 HydrophobicContact CD1-CG 4.31Å; L92-L103 HydrophobicContact CD2-CD2 4.19Å; G99-L103 PolarHBondContact O-N 3.35Å; K100-L103 PolarHBondContact O-N 2.99Å; L103-N105 VanDerWaalsContact C-N 3.31Å; L103-N105 PolarHBondContact O-N 3.28Å; L103-V106 WeakPolarHBondContact O-CB 3.46Å; L103-V106 PolarHBondContact O-N 3.02Å; L103-V106 VanDerWaalsContact O-N 3.09Å; L103-L107 HydrophobicContact CD1-CD1 4.35Å; L103-L107 HydrophobicContact CD1-CD2 4.42Å; L103-L107 HydrophobicContact CD1-CG 4.18Å; L103-L107 HydrophobicContact CG-CD1 4.15Å; L103-L107 HydrophobicContact CG-CG 4.37Å; L103-L107 WeakPolarHBondContact O-CG 2.96Å; L103-L107 PolarHBondContact O-N 2.8Å; L103-L275 HydrophobicContact CB-CD1 4.42Å; L103-L275 HydrophobicContact CD2-CD1 3.89Å
104	L	94.9	Very high	90.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-56.4	-45.4	177	-163.2	79.2	0	0	0	111.9	L92 K100 L107 A108 Y139 F224 D226 I255	L92-L104 HydrophobicContact CD1-CB 4.07Å; L92-L104 HydrophobicContact CD1-CD1 3.85Å; K100-L104 WeakPolarHBondContact O-CB 3.38Å; K100-L104 PolarHBondContact O-N 3.33Å; L104-L107 PolarHBondContact O-N 2.87Å; L104-A108 WeakPolarHBondContact O-CB 3.27Å; L104-A108 PolarHBondContact O-N 3.14Å; L104-Y139 HydrophobicContact CD2-CE2 4.1Å; L104-Y139 HydrophobicContact CG-CE2 4.16Å; L104-F224 HydrophobicContact CD1-CB 4.31Å; L104-F224 HydrophobicContact CD1-CD1 3.71Å; L104-F224 HydrophobicContact CD1-CG 4.5Å; L104-F224 HydrophobicContact CG-CB 4.38Å; L104-F224 HydrophobicContact CG-CD1 4.21Å; L104-D226 VanDerWaalsContact CD2-CA 3.5Å; L104-D226 HydrophobicContact CD2-CB 3.61Å; L104-I255 HydrophobicContact CD1-CB 4.3Å; L104-I255 HydrophobicContact CD1-CG2 3.66Å
105	N	91.6	Very high	89.5	Confident	29 Å²	29	33 Å²	33	16%	0.155	23%	0.229	C	C	.	.	H	α-helix	trans	-65.9	-35.6	176.8	-82.5	-59.1	0	0	0	112.8	T101 T102 L103 G109 Q110 L111 Y139	T101-N105 VanDerWaalsContact CG2-ND2 3.31Å; T101-N105 WeakPolarHBondContact CG2-ND2 3.49Å; T101-N105 VanDerWaalsContact O-CB 3.27Å; T101-N105 WeakPolarHBondContact O-CB 3.44Å; T101-N105 PolarHBondContact O-N 2.86Å; T101-N105 PolarHBondContact O-ND2 3.5Å; T102-N105 PolarHBondContact O-N 3.44Å; L103-N105 VanDerWaalsContact C-N 3.31Å; L103-N105 PolarHBondContact O-N 3.28Å; N105-G109 PolarHBondContact O-N 3.3Å; N105-G109 VanDerWaalsContact O-N 3.16Å; N105-Q110 PolarHBondContact O-N 3.47Å; N105-Q110 WeakPolarHBondContact OD1-CB 3.25Å; N105-L111 HydrophobicContact CB-CB 4.32Å; N105-L111 HydrophobicContact CB-CD1 4.29Å; N105-L111 PolarHBondContact O-N 2.86Å; N105-L111 VanDerWaalsContact O-N 3.16Å; N105-Y139 PolarHBondContact OD1-OH 3.36Å
106	V	91.7	Very high	89.2	Confident	9 Å²	9	33.8 Å²	33.8	6%	0.055	24%	0.236	C	C	.	.	H	α-helix	trans	-64.2	-51.1	174.6	167.9	0	0	0	0	110.2	I61 L77 T102 L103 A108 G109 L111 L119	I61-V106 HydrophobicContact CD1-CG1 4.35Å; I61-V106 HydrophobicContact CG2-CG1 3.84Å; L77-V106 HydrophobicContact CD1-CG2 4.43Å; T102-V106 VanDerWaalsContact O-CG2 3.31Å; T102-V106 WeakPolarHBondContact O-CG2 3.49Å; T102-V106 PolarHBondContact O-N 3.14Å; L103-V106 WeakPolarHBondContact O-CB 3.46Å; L103-V106 PolarHBondContact O-N 3.02Å; L103-V106 VanDerWaalsContact O-N 3.09Å; V106-A108 VanDerWaalsContact C-N 3.26Å; V106-A108 PolarHBondContact O-N 2.92Å; V106-G109 PolarHBondContact O-N 2.93Å; V106-L111 HydrophobicContact CG2-CB 4.42Å; V106-L111 HydrophobicContact CG2-CD2 3.85Å; V106-L119 HydrophobicContact CB-CD1 4.46Å; V106-L119 HydrophobicContact CG1-CD1 3.93Å; V106-L119 HydrophobicContact CG1-CD2 4.25Å; V106-L119 HydrophobicContact CG2-CD1 3.59Å; V106-L119 HydrophobicContact CG2-CD2 4.14Å
107	L	91.6	Very high	89.1	Confident	3 Å²	3	30 Å²	30	2%	0.016	21%	0.208	C	C	.	.	H	α-helix	trans	-61.9	-35.2	-178.8	-62.8	179.1	0	0	0	112.2	W58 L103 L104 G109 L123 F224	W58-L107 HydrophobicContact CB-CD2 3.64Å; W58-L107 HydrophobicContact CD2-CD1 4.1Å; W58-L107 HydrophobicContact CD2-CD2 3.72Å; W58-L107 HydrophobicContact CE3-CD1 3.87Å; W58-L107 HydrophobicContact CE3-CD2 3.77Å; W58-L107 HydrophobicContact CE3-CG 4.49Å; W58-L107 HydrophobicContact CG-CD2 3.68Å; W58-L107 HydrophobicContact CH2-CD1 4.37Å; W58-L107 HydrophobicContact CZ3-CD1 4.01Å; L103-L107 HydrophobicContact CD1-CD1 4.35Å; L103-L107 HydrophobicContact CD1-CD2 4.42Å; L103-L107 HydrophobicContact CD1-CG 4.18Å; L103-L107 HydrophobicContact CG-CD1 4.15Å; L103-L107 HydrophobicContact CG-CG 4.37Å; L103-L107 WeakPolarHBondContact O-CG 2.96Å; L103-L107 PolarHBondContact O-N 2.8Å; L104-L107 PolarHBondContact O-N 2.87Å; L107-G109 VanDerWaalsContact C-N 3.32Å; L107-L123 HydrophobicContact CD2-CD1 3.73Å; L107-F224 HydrophobicContact CB-CD1 4.47Å; L107-F224 HydrophobicContact CB-CE1 3.48Å; L107-F224 VanDerWaalsContact CB-CE1 3.48Å; L107-F224 HydrophobicContact CB-CZ 3.8Å; L107-F224 HydrophobicContact CD1-CE1 4.36Å
108	A	88.8	Confident	89.2	Confident	10 Å²	10	29.5 Å²	29.5	8%	0.083	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-4.3	176.7	0	0	0	0	0	114.6	L104 V106 Q110 Y139 F224	L104-A108 WeakPolarHBondContact O-CB 3.27Å; L104-A108 PolarHBondContact O-N 3.14Å; V106-A108 VanDerWaalsContact C-N 3.26Å; V106-A108 PolarHBondContact O-N 2.92Å; A108-Q110 HydrophobicContact CB-CB 4.31Å; A108-Q110 HydrophobicContact CB-CG 3.93Å; A108-Q110 PolarHBondContact O-N 2.92Å; A108-Y139 HydrophobicContact CB-CD2 3.25Å; A108-Y139 HydrophobicContact CB-CE2 3.61Å; A108-Y139 HydrophobicContact CB-CG 4.26Å; A108-F224 HydrophobicContact CB-CB 4.35Å; A108-F224 HydrophobicContact CB-CD1 4.33Å; A108-F224 HydrophobicContact CB-CD2 3.65Å; A108-F224 HydrophobicContact CB-CE2 3.93Å; A108-F224 HydrophobicContact CB-CG 3.87Å; A108-F224 HydrophobicContact CB-CZ 4.38Å
109	G	86.6	Confident	89.2	Confident	41 Å²	41	29.6 Å²	29.6	42%	0.423	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	26.7	-172.2	0	0	0	0	0	113.6	N105 V106 L107 Y648	N105-G109 PolarHBondContact O-N 3.3Å; N105-G109 VanDerWaalsContact O-N 3.16Å; V106-G109 PolarHBondContact O-N 2.93Å; L107-G109 VanDerWaalsContact C-N 3.32Å; G109-Y648 WeakPolarHBondContact O-CB 3.48Å
110	Q	84.2	Confident	89.1	Confident	41 Å²	41	29.3 Å²	29.3	19%	0.192	19%	0.187	C	C	.	.			trans	-102.8	1.6	-178.2	-68.6	-65.3	-41.6	0	0	113.6	N105 A108 T112 Y139 Y648	N105-Q110 PolarHBondContact O-N 3.47Å; N105-Q110 WeakPolarHBondContact OD1-CB 3.25Å; A108-Q110 HydrophobicContact CB-CB 4.31Å; A108-Q110 HydrophobicContact CB-CG 3.93Å; A108-Q110 PolarHBondContact O-N 2.92Å; Q110-T112 PolarHBondContact O-N 3.19Å; Q110-Y139 HydrophobicContact CB-CE2 4.44Å; Q110-Y139 HydrophobicContact CG-CD1 4.02Å; Q110-Y139 HydrophobicContact CG-CD2 3.97Å; Q110-Y139 HydrophobicContact CG-CE1 4.41Å; Q110-Y139 HydrophobicContact CG-CE2 4.36Å; Q110-Y139 HydrophobicContact CG-CG 3.8Å; Q110-Y648 VanDerWaalsContact C-CD1 3.48Å; Q110-Y648 HydrophobicContact CB-CE1 4.35Å; Q110-Y648 WeakPolarHBondContact O-CD1 3.36Å; Q110-Y648 VanDerWaalsContact OE1-CZ 3.26Å; Q110-Y648 PolarHBondContact OE1-OH 2.75Å
111	L	85.8	Confident	89	Confident	20 Å²	20	29 Å²	29	11%	0.105	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-63.9	119.3	177.1	-169.7	68.4	0	0	0	110.5	T102 N105 V106 A113 L117 L119 Y648 Q649	T102-L111 HydrophobicContact CG2-CD1 4.34Å; N105-L111 HydrophobicContact CB-CB 4.32Å; N105-L111 HydrophobicContact CB-CD1 4.29Å; N105-L111 PolarHBondContact O-N 2.86Å; N105-L111 VanDerWaalsContact O-N 3.16Å; V106-L111 HydrophobicContact CG2-CB 4.42Å; V106-L111 HydrophobicContact CG2-CD2 3.85Å; L111-A113 PolarHBondContact O-N 3.35Å; L111-L117 HydrophobicContact CD2-CD1 4.16Å; L111-L117 HydrophobicContact CD2-CD2 3.5Å; L111-L117 VanDerWaalsContact CD2-CD2 3.5Å; L111-L117 HydrophobicContact CD2-CG 4.48Å; L111-L117 HydrophobicContact CG-CD2 4.44Å; L111-L119 HydrophobicContact CD2-CD2 4.13Å; L111-Y648 CarbonylContact O-C 3.56Å; L111-Y648 VanDerWaalsContact O-CA 3.24Å; L111-Y648 WeakPolarHBondContact O-CA 3.48Å; L111-Q649 HydrophobicContact CB-CB 4.42Å; L111-Q649 HydrophobicContact CD2-CB 4.21Å; L111-Q649 HydrophobicContact CG-CB 4.43Å; L111-Q649 PolarHBondContact O-N 2.81Å
112	T	83	Confident	88.8	Confident	104 Å²	104	30.2 Å²	30.2	64%	0.638	19%	0.188	S	C	*	.	B	Isolated β-bridge	trans	-64.7	131.2	-177	-60.6	0	0	0	0	110.3	Q110 S114	Q110-T112 PolarHBondContact O-N 3.19Å; T112-S114 PolarHBondContact O-N 3.38Å
113	A	82.4	Confident	88.7	Confident	24 Å²	24	29.5 Å²	29.5	20%	0.198	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-65.4	131.8	-179.5	0	0	0	0	0	111	A28 L111 K647	A28-A113 HydrophobicContact CB-CB 3.96Å; L111-A113 PolarHBondContact O-N 3.35Å; A113-K647 HydrophobicContact CB-CB 3.74Å; A113-K647 WeakPolarHBondContact CB-O 3.39Å; A113-K647 PolarHBondContact N-O 3.44Å
114	S	85.3	Confident	88.4	Confident	39 Å²	39	33 Å²	33	27%	0.273	20%	0.196	S	C	.	.			trans	-139.3	137.8	171.5	179.6	0	0	0	0	109.5	T112 S116 L117	T112-S114 PolarHBondContact O-N 3.38Å; S114-S116 PolarHBondContact O-N 3.31Å; S114-S116 PolarHBondContact OG-N 3.26Å; S114-S116 PolarHBondContact OG-OG 3.21Å; S114-L117 PolarHBondContact O-N 3.46Å
115	P	82	Confident	88.1	Confident	100 Å²	100	33.2 Å²	33.2	65%	0.649	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-23	173.8	26.4	-34.7	0	0	0	112.6	P25 L117	P25-P115 HydrophobicContact CB-CG 4.21Å; P25-P115 HydrophobicContact CG-CG 3.91Å; P115-L117 VanDerWaalsContact C-N 3.28Å
116	S	85.3	Confident	87.9	Confident	41 Å²	41	35.3 Å²	35.3	29%	0.287	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	2.3	175.2	66.5	0	0	0	0	113.4	L65 K66 S114	L65-S116 CarbonylContact C-O 3.47Å; L65-S116 WeakPolarHBondContact CA-O 3.35Å; K66-S116 PolarHBondContact N-O 2.98Å; K66-S116 WeakPolarHBondContact O-CB 3.3Å; S114-S116 PolarHBondContact O-N 3.31Å; S114-S116 PolarHBondContact OG-N 3.26Å; S114-S116 PolarHBondContact OG-OG 3.21Å
117	L	87.8	Confident	87.5	Confident	19 Å²	19	38.1 Å²	38.1	10%	0.099	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.5	-175	-165.1	144.6	0	0	0	110.2	L76 L111 S114 P115 L119 Q649	L76-L117 HydrophobicContact CD1-CD1 4.34Å; L111-L117 HydrophobicContact CD2-CD1 4.16Å; L111-L117 HydrophobicContact CD2-CD2 3.5Å; L111-L117 VanDerWaalsContact CD2-CD2 3.5Å; L111-L117 HydrophobicContact CD2-CG 4.48Å; L111-L117 HydrophobicContact CG-CD2 4.44Å; S114-L117 PolarHBondContact O-N 3.46Å; P115-L117 VanDerWaalsContact C-N 3.28Å; L117-L119 HydrophobicContact CD2-CB 4.19Å; L117-Q649 HydrophobicContact CD2-CB 4.37Å; L117-Q649 HydrophobicContact CD2-CG 3.74Å; L117-Q649 PolarHBondContact O-NE2 3.02Å
118	H	89.7	Confident	87.1	Confident	47 Å²	47	45.7 Å²	45.7	22%	0.218	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.4	173.9	-173.6	65.9	0	0	0	109	C63 A64	C63-H118 CarbonylContact C-O 3.59Å; C63-H118 WeakPolarHBondContact CA-O 3.17Å; A64-H118 PolarHBondContact N-O 3.41Å; A64-H118 PolarHBondContact O-N 3.24Å
119	L	91.5	Very high	86.7	Confident	4 Å²	4	47.8 Å²	47.8	2%	0.021	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	119.9	-177.3	176.6	65.1	0	0	0	108.4	I61 T62 C63 V106 L111 L117 Q649 L651 L652	I61-L119 HydrophobicContact CG2-CD1 4.41Å; T62-L119 WeakPolarHBondContact O-CA 3.49Å; C63-L119 HydrophobicContact CB-CD1 4.14Å; V106-L119 HydrophobicContact CB-CD1 4.46Å; V106-L119 HydrophobicContact CG1-CD1 3.93Å; V106-L119 HydrophobicContact CG1-CD2 4.25Å; V106-L119 HydrophobicContact CG2-CD1 3.59Å; V106-L119 HydrophobicContact CG2-CD2 4.14Å; L111-L119 HydrophobicContact CD2-CD2 4.13Å; L117-L119 HydrophobicContact CD2-CB 4.19Å; L119-Q649 HydrophobicContact CB-CG 3.76Å; L119-Q649 HydrophobicContact CD2-CB 4.28Å; L119-Q649 HydrophobicContact CD2-CG 4.15Å; L119-L651 HydrophobicContact CD1-CD1 4.1Å; L119-L651 HydrophobicContact CD2-CB 4.24Å; L119-L651 HydrophobicContact CD2-CD1 4.14Å; L119-L651 HydrophobicContact CG-CD1 3.7Å; L119-L652 PolarHBondContact O-N 3.39Å; L119-L652 VanDerWaalsContact O-N 3.12Å
120	S	92.1	Very high	86	Confident	3 Å²	3	49.2 Å²	49.2	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	157.5	178.8	59.3	0	0	0	0	112.3	I61 T62 L652	I61-S120 WeakPolarHBondContact CA-O 3.12Å; T62-S120 PolarHBondContact N-O 2.97Å; T62-S120 PolarHBondContact O-N 3.22Å; S120-L652 CarbonylContact C-O 3.59Å; S120-L652 WeakPolarHBondContact CA-O 3.45Å
121	G	91.2	Very high	84.9	Confident	3 Å²	3	51.2 Å²	51.2	3%	0.031	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	134.9	-170.1	176.4	0	0	0	0	0	112.7	R60 L652	R60-G121 WeakPolarHBondContact O-CA 3.35Å; G121-L652 PolarHBondContact N-O 3.31Å
122	F	90.5	Very high	83.1	Confident	69 Å²	69	56.1 Å²	56.1	30%	0.303	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	141.2	-177.2	-57.2	-81	0	0	0	111.4	W58 A59 Y124 P653 P654	W58-F122 CarbonylContact C-O 3.58Å; W58-F122 WeakPolarHBondContact CA-O 3.22Å; A59-F122 HydrophobicContact CB-CB 4.4Å; A59-F122 PolarHBondContact N-O 2.75Å; A59-F122 PolarHBondContact O-N 3.34Å; F122-Y124 HydrophobicContact CB-CD2 4.36Å; F122-Y124 HydrophobicContact CB-CE2 3.51Å; F122-Y124 HydrophobicContact CG-CE2 4.41Å; F122-P653 HydrophobicContact CE1-CB 4.27Å; F122-P654 HydrophobicContact CD2-CG 4.35Å; F122-P654 VanDerWaalsContact CE2-CD 3.48Å; F122-P654 HydrophobicContact CE2-CG 3.5Å; F122-P654 VanDerWaalsContact CZ-CD 3.46Å; F122-P654 HydrophobicContact CZ-CG 3.82Å
123	L	90.4	Very high	81.4	Confident	14 Å²	14	52.6 Å²	52.6	7%	0.073	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	119.2	176.1	-174	64.3	0	0	0	109.5	I56 W58 L107 I130 L651	I56-L123 HydrophobicContact CG2-CD1 3.59Å; W58-L123 HydrophobicContact CB-CD1 3.91Å; L107-L123 HydrophobicContact CD2-CD1 3.73Å; L123-I130 HydrophobicContact CD2-CB 4.44Å; L123-I130 HydrophobicContact CD2-CD1 3.5Å; L123-I130 HydrophobicContact CG-CD1 4.3Å; L123-I130 PolarHBondContact O-N 3.37Å; L123-I130 VanDerWaalsContact O-N 3.11Å; L123-L651 HydrophobicContact CB-CD2 3.68Å
124	Y	90.1	Very high	80.4	Confident	73 Å²	73	54.4 Å²	54.4	29%	0.286	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	139	-178.6	-54.9	-85.2	0	0	0	110.2	I56 R57 F122 R128	I56-Y124 WeakPolarHBondContact CA-O 3.27Å; R57-Y124 PolarHBondContact N-O 3.3Å; R57-Y124 PolarHBondContact O-N 3.22Å; F122-Y124 HydrophobicContact CB-CD2 4.36Å; F122-Y124 HydrophobicContact CB-CE2 3.51Å; F122-Y124 HydrophobicContact CG-CE2 4.41Å; Y124-R128 CarbonylContact C-O 3.2Å; Y124-R128 VanDerWaalsContact CA-O 3.22Å; Y124-R128 WeakPolarHBondContact CA-O 3.42Å
125	I	87.9	Confident	79.5	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.021	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	118.4	171.4	-56.7	-175	0	0	0	107.4	V54 T55 G127 R128 I130 Y135 I222	V54-I125 HydrophobicContact CG1-CG2 3.32Å; T55-I125 CarbonylContact O-C 3.56Å; T55-I125 WeakPolarHBondContact O-CA 3.3Å; I125-G127 PolarHBondContact O-N 3.27Å; I125-R128 PolarHBondContact N-O 3.41Å; I125-R128 PolarHBondContact O-N 3.49Å; I125-I130 HydrophobicContact CD1-CB 4.36Å; I125-I130 HydrophobicContact CD1-CD1 3.87Å; I125-I130 HydrophobicContact CD1-CG1 3.71Å; I125-I130 HydrophobicContact CG1-CG1 4.39Å; I125-Y135 HydrophobicContact CB-CD2 4.17Å; I125-Y135 HydrophobicContact CB-CE2 3.96Å; I125-Y135 HydrophobicContact CD1-CD2 3.85Å; I125-Y135 HydrophobicContact CD1-CE2 4.48Å; I125-Y135 HydrophobicContact CG2-CD1 4.46Å; I125-Y135 HydrophobicContact CG2-CD2 3.6Å; I125-Y135 HydrophobicContact CG2-CE1 4.36Å; I125-Y135 HydrophobicContact CG2-CE2 3.45Å; I125-Y135 VanDerWaalsContact CG2-CE2 3.45Å; I125-Y135 HydrophobicContact CG2-CG 4.1Å; I125-I222 HydrophobicContact CD1-CD1 4.49Å
126	N	88.1	Confident	79.2	Confident	74 Å²	74	56.8 Å²	56.8	40%	0.396	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	41.7	-173.8	-70.2	-17	0	0	0	112.5	P53 V54 T55 R128	P53-N126 PolarHBondContact O-ND2 3.39Å; P53-N126 VanDerWaalsContact O-ND2 3.1Å; V54-N126 WeakPolarHBondContact CA-OD1 3.44Å; T55-N126 PolarHBondContact N-OD1 3.39Å; T55-N126 PolarHBondContact O-N 3.42Å; N126-R128 VanDerWaalsContact C-N 3.27Å; N126-R128 PolarHBondContact O-N 3.3Å
127	G	83.1	Confident	79.2	Confident	67 Å²	67	57.8 Å²	57.8	69%	0.691	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	-2.5	180	0	0	0	0	0	115.7	I125	I125-G127 PolarHBondContact O-N 3.27Å
128	R	84	Confident	79.2	Confident	163 Å²	163	56.9 Å²	56.9	62%	0.615	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	146.1	178.5	-60.2	-174.9	-172.8	176.3	0.9	111.9	Y124 I125 N126	Y124-R128 CarbonylContact C-O 3.2Å; Y124-R128 VanDerWaalsContact CA-O 3.22Å; Y124-R128 WeakPolarHBondContact CA-O 3.42Å; I125-R128 PolarHBondContact N-O 3.41Å; I125-R128 PolarHBondContact O-N 3.49Å; N126-R128 VanDerWaalsContact C-N 3.27Å; N126-R128 PolarHBondContact O-N 3.3Å
129	P	80.1	Confident	79.2	Confident	53 Å²	53	55.4 Å²	55.4	34%	0.344	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	141.8	174.3	-21.5	32	0	0	0	112	S131 E132	P129-S131 PolarHBondContact O-N 2.99Å; P129-E132 PolarHBondContact O-N 3.4Å
130	I	72.4	Confident	79.2	Confident	71 Å²	71	55.4 Å²	55.4	36%	0.364	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-55.9	-22.8	-178	-166.4	160.6	0	0	0	114.2	L123 I125 E132	L123-I130 HydrophobicContact CD2-CB 4.44Å; L123-I130 HydrophobicContact CD2-CD1 3.5Å; L123-I130 HydrophobicContact CG-CD1 4.3Å; L123-I130 PolarHBondContact O-N 3.37Å; L123-I130 VanDerWaalsContact O-N 3.11Å; I125-I130 HydrophobicContact CD1-CB 4.36Å; I125-I130 HydrophobicContact CD1-CD1 3.87Å; I125-I130 HydrophobicContact CD1-CG1 3.71Å; I125-I130 HydrophobicContact CG1-CG1 4.39Å; I130-E132 PolarHBondContact O-N 3.24Å; I130-E132 VanDerWaalsContact O-N 3.13Å
131	S	61	Low	78.9	Confident	84 Å²	84	59.5 Å²	59.5	59%	0.587	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-61.9	-16.4	177	46.3	0	0	0	0	114.1	P129	P129-S131 PolarHBondContact O-N 2.99Å
132	E	48	Very low	78.6	Confident	123 Å²	123	63.4 Å²	63.4	58%	0.575	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-105.2	-0.2	-170.9	-61.5	-178.4	170.6	0	0	114.4	P129 I130	P129-E132 PolarHBondContact O-N 3.4Å; I130-E132 PolarHBondContact O-N 3.24Å; I130-E132 VanDerWaalsContact O-N 3.13Å
133	G	47.7	Very low	78.2	Confident	29 Å²	29	66.5 Å²	66.5	30%	0.299	35%	0.354	S	S	.	.			trans	-126.6	126	-169.9	0	0	0	0	0	115.9	Y135	G133-Y135 PolarHBondContact O-N 3.29Å
134	G	60.2	Low	77.8	Confident	62 Å²	62	67 Å²	67	64%	0.639	36%	0.357	S	S	*	.			trans	-79.2	41.7	172.6	0	0	0	0	0	114.3
135	Y	67.1	Low	77.6	Confident	82 Å²	82	66.6 Å²	66.6	32%	0.322	36%	0.36	S	S	.	.			trans	-76.7	138.3	-176.7	-58.3	-79.1	0	0	0	111.6	V54 I125 G133	V54-Y135 HydrophobicContact CG2-CD1 3.82Å; V54-Y135 HydrophobicContact CG2-CE1 3.96Å; I125-Y135 HydrophobicContact CB-CD2 4.17Å; I125-Y135 HydrophobicContact CB-CE2 3.96Å; I125-Y135 HydrophobicContact CD1-CD2 3.85Å; I125-Y135 HydrophobicContact CD1-CE2 4.48Å; I125-Y135 HydrophobicContact CG2-CD1 4.46Å; I125-Y135 HydrophobicContact CG2-CD2 3.6Å; I125-Y135 HydrophobicContact CG2-CE1 4.36Å; I125-Y135 HydrophobicContact CG2-CE2 3.45Å; I125-Y135 VanDerWaalsContact CG2-CE2 3.45Å; I125-Y135 HydrophobicContact CG2-CG 4.1Å; G133-Y135 PolarHBondContact O-N 3.29Å
136	K	76.2	Confident	77.8	Confident	107 Å²	107	67.3 Å²	67.3	47%	0.465	36%	0.363	S	S	.	.			trans	-88.6	124.2	177.3	-66.1	-178.3	-175.3	169.9	0	110.1	A218 P220 S221	K136-A218 HydrophobicContact CD-CB 4.45Å; K136-A218 WeakPolarHBondContact CD-O 3.31Å; K136-A218 PolarHBondContact NZ-O 2.87Å; K136-P220 HydrophobicContact CB-CB 4.46Å; K136-P220 VanDerWaalsContact O-CA 3.31Å; K136-P220 WeakPolarHBondContact O-CA 3.1Å; K136-P220 WeakPolarHBondContact O-CB 3.46Å; K136-S221 PolarHBondContact O-N 2.52Å
137	I	85.2	Confident	77.9	Confident	63 Å²	63	64.6 Å²	64.6	32%	0.323	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	137	179.8	-61.8	173.3	0	0	0	109.2	I222 F224	I137-I222 HydrophobicContact CD1-CD1 4.49Å; I137-I222 HydrophobicContact CG1-CB 4.29Å; I137-I222 HydrophobicContact CG1-CD1 4.01Å; I137-F224 HydrophobicContact CD1-CE2 4.45Å; I137-F224 HydrophobicContact CG2-CD2 3.39Å; I137-F224 HydrophobicContact CG2-CE2 3.43Å; I137-F224 VanDerWaalsContact CG2-CE2 3.43Å
138	A	88.1	Confident	78.2	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	136.6	166	0	0	0	0	0	110.4	E215 P220 I222 I223 F224	A138-E215 HydrophobicContact CB-CB 3.56Å; A138-E215 HydrophobicContact CB-CG 4.44Å; A138-P220 HydrophobicContact CB-CB 3.82Å; A138-P220 HydrophobicContact CB-CG 3.59Å; A138-I222 PolarHBondContact N-O 3.43Å; A138-I223 HydrophobicContact CB-CB 4.45Å; A138-I223 HydrophobicContact CB-CG1 4.2Å; A138-I223 HydrophobicContact CB-CG2 4.34Å; A138-F224 PolarHBondContact O-N 2.94Å
139	Y	89.4	Confident	78.6	Confident	15 Å²	15	55.8 Å²	55.8	6%	0.059	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	102	174.2	-169.7	-93.1	0	0	0	110.7	L104 N105 A108 Q110 R141 F224 D226	L104-Y139 HydrophobicContact CD2-CE2 4.1Å; L104-Y139 HydrophobicContact CG-CE2 4.16Å; N105-Y139 PolarHBondContact OD1-OH 3.36Å; A108-Y139 HydrophobicContact CB-CD2 3.25Å; A108-Y139 HydrophobicContact CB-CE2 3.61Å; A108-Y139 HydrophobicContact CB-CG 4.26Å; Q110-Y139 HydrophobicContact CB-CE2 4.44Å; Q110-Y139 HydrophobicContact CG-CD1 4.02Å; Q110-Y139 HydrophobicContact CG-CD2 3.97Å; Q110-Y139 HydrophobicContact CG-CE1 4.41Å; Q110-Y139 HydrophobicContact CG-CE2 4.36Å; Q110-Y139 HydrophobicContact CG-CG 3.8Å; Y139-R141 HydrophobicContact CD1-CG 3.7Å; Y139-R141 HydrophobicContact CE1-CG 3.75Å; Y139-R141 PolarHBondContact O-N 3.14Å; Y139-F224 WeakPolarHBondContact CA-O 3.36Å; Y139-F224 HydrophobicContact CD2-CB 3.53Å; Y139-F224 HydrophobicContact CD2-CG 4.26Å; Y139-F224 HydrophobicContact CE2-CB 4Å; Y139-F224 HydrophobicContact CG-CB 4.49Å; Y139-D226 PolarHBondContact OH-OD2 2.81Å; Y139-D226 VanDerWaalsContact OH-OD2 3.1Å
140	V	90.1	Very high	79.3	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.024	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	112.3	174.4	-175	0	0	0	0	108.2	K208 L212 E215 F224 A225 D226	V140-K208 HydrophobicContact CG1-CD 4.2Å; V140-L212 HydrophobicContact CG2-CB 4.33Å; V140-L212 HydrophobicContact CG2-CD1 3.75Å; V140-E215 HydrophobicContact CG2-CB 4.37Å; V140-E215 HydrophobicContact CG2-CG 3.76Å; V140-F224 PolarHBondContact N-O 3.43Å; V140-A225 HydrophobicContact CB-CB 4.28Å; V140-D226 PolarHBondContact O-N 2.78Å
141	R	86.5	Confident	80.4	Confident	90 Å²	90	50.8 Å²	50.8	34%	0.34	27%	0.267	S	S	.	.			trans	-74.6	160	178.6	-61.4	-164.2	168.9	-176.1	-4.3	111.4	Y139 E143 K208	Y139-R141 HydrophobicContact CD1-CG 3.7Å; Y139-R141 HydrophobicContact CE1-CG 3.75Å; Y139-R141 PolarHBondContact O-N 3.14Å; R141-E143 VanDerWaalsContact C-N 3.34Å; R141-E143 PolarHBondContact O-N 3.4Å; R141-K208 PolarHBondContact O-NZ 3.45Å
142	Q	85.1	Confident	82.2	Confident	85 Å²	85	46.8 Å²	46.8	40%	0.397	24%	0.239	S	C	.	.	S	Bend	trans	-59.2	-44.9	171.4	-167.5	-178.4	20.2	0	0	111.6	K208 D226 E227	Q142-K208 PolarHBondContact O-NZ 3.3Å; Q142-D226 WeakPolarHBondContact CA-O 3.21Å; Q142-D226 PolarHBondContact N-O 2.91Å; Q142-E227 HydrophobicContact CG-CB 4.23Å; Q142-E227 PolarHBondContact NE2-OE2 2.86Å
143	E	81.7	Confident	84.5	Confident	133 Å²	133	43.7 Å²	43.7	62%	0.621	22%	0.223	S	C	*	.	S	Bend	trans	-86.7	119.1	177.8	-68.3	-171.8	176.9	0	0	113.5	R141 L145	R141-E143 VanDerWaalsContact C-N 3.34Å; R141-E143 PolarHBondContact O-N 3.4Å; E143-L145 HydrophobicContact CB-CG 4.35Å; E143-L145 PolarHBondContact O-N 3.39Å
144	D	82.8	Confident	86.8	Confident	26 Å²	26	44.4 Å²	44.4	14%	0.139	22%	0.218	C	C	.	.			trans	-88.9	80.7	176.4	-59.3	-55.3	0	0	0	111.3	F146 K207 K208 S211	D144-F146 HydrophobicContact CB-CE2 4.1Å; D144-K207 HydrophobicContact CB-CD 4.1Å; D144-K207 HydrophobicContact CB-CG 3.99Å; D144-K207 WeakPolarHBondContact O-CE 3.34Å; D144-K207 PolarHBondContact O-NZ 3.26Å; D144-K208 IonicContact OD1-NZ 3.41Å; D144-K208 PolarHBondContact OD1-NZ 2.84Å; D144-K208 WeakPolarHBondContact OD2-CE 3.37Å; D144-K208 IonicContact OD2-NZ 3.37Å; D144-K208 PolarHBondContact OD2-NZ 2.91Å; D144-S211 WeakPolarHBondContact OD1-CB 3.35Å; D144-S211 PolarHBondContact OD1-OG 2.93Å
145	L	85.3	Confident	88.4	Confident	63 Å²	63	42.2 Å²	42.2	33%	0.33	19%	0.193	S	C	.	.			trans	-88.9	124.4	176.7	-61.9	176	0	0	0	111.3	E143 A457 I458 R461	E143-L145 HydrophobicContact CB-CG 4.35Å; E143-L145 PolarHBondContact O-N 3.39Å; L145-A457 HydrophobicContact CD1-CB 3.78Å; L145-I458 HydrophobicContact CB-CD1 4.49Å; L145-I458 HydrophobicContact CB-CG1 3.81Å; L145-R461 PolarHBondContact O-NH1 3.46Å; L145-R461 PolarHBondContact O-NH2 2.79Å
146	F	91.1	Very high	89.7	Confident	20 Å²	20	38.3 Å²	38.3	9%	0.088	18%	0.177	C	C	.	.			trans	-140.2	162.1	177.6	-69	-75.8	0	0	0	110.8	D144 S148 T155 V194 K207 L210 I458	D144-F146 HydrophobicContact CB-CE2 4.1Å; F146-S148 PolarHBondContact O-N 2.87Å; F146-T155 HydrophobicContact CD1-CG2 3.91Å; F146-T155 HydrophobicContact CE1-CG2 4.09Å; F146-V194 HydrophobicContact CB-CG1 3.74Å; F146-V194 HydrophobicContact CD2-CG1 4.02Å; F146-V194 HydrophobicContact CG-CG1 4.07Å; F146-K207 HydrophobicContact CD2-CD 4.5Å; F146-K207 HydrophobicContact CD2-CG 3.96Å; F146-K207 HydrophobicContact CE2-CG 3.99Å; F146-L210 HydrophobicContact CD1-CD2 4.31Å; F146-L210 HydrophobicContact CD2-CD2 4.32Å; F146-L210 HydrophobicContact CE1-CD2 4.12Å; F146-L210 HydrophobicContact CE1-CG 3.99Å; F146-L210 HydrophobicContact CE2-CD2 4.11Å; F146-L210 HydrophobicContact CE2-CG 4.18Å; F146-L210 HydrophobicContact CG-CD2 4.4Å; F146-L210 HydrophobicContact CZ-CB 4.36Å; F146-L210 HydrophobicContact CZ-CD2 4Å; F146-L210 HydrophobicContact CZ-CG 3.71Å; F146-I458 VanDerWaalsContact C-CD1 3.4Å; F146-I458 WeakPolarHBondContact O-CD1 3.32Å
147	F	91	Very high	90.5	Very high	16 Å²	16	35 Å²	35	7%	0.07	17%	0.167	C	C	.	.			trans	-73	110	167.8	-66.8	-78.3	0	0	0	109.4	Q149 L150 Q390 E455 I458 V459	F147-Q149 PolarHBondContact O-N 2.99Å; F147-Q149 VanDerWaalsContact O-N 3.15Å; F147-L150 HydrophobicContact CB-CD1 3.96Å; F147-L150 HydrophobicContact CB-CG 4.09Å; F147-L150 PolarHBondContact O-N 3.49Å; F147-Q390 HydrophobicContact CD1-CG 4.49Å; F147-Q390 VanDerWaalsContact CE1-NE2 3.25Å; F147-E455 HydrophobicContact CE1-CB 4.24Å; F147-E455 HydrophobicContact CE1-CG 3.63Å; F147-E455 HydrophobicContact CZ-CG 4.06Å; F147-I458 HydrophobicContact CD1-CD1 4.26Å; F147-I458 HydrophobicContact CD2-CD1 4.37Å; F147-I458 HydrophobicContact CD2-CG2 4.05Å; F147-I458 HydrophobicContact CE1-CD1 4.43Å; F147-I458 HydrophobicContact CE2-CB 4.32Å; F147-I458 HydrophobicContact CE2-CD1 4.47Å; F147-I458 HydrophobicContact CE2-CG2 3.57Å; F147-I458 HydrophobicContact CG-CD1 4.27Å; F147-I458 HydrophobicContact CZ-CB 4.42Å; F147-I458 HydrophobicContact CZ-CG2 4.13Å; F147-V459 HydrophobicContact CZ-CG2 4.29Å
148	S	90.3	Very high	90.8	Very high	7 Å²	7	33 Å²	33	5%	0.049	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-19.3	-170.6	47	0	0	0	0	114.6	F146 G195 D196	F146-S148 PolarHBondContact O-N 2.87Å; S148-G195 WeakPolarHBondContact CB-O 3.49Å; S148-G195 PolarHBondContact O-N 2.98Å; S148-G195 VanDerWaalsContact O-N 3.14Å; S148-D196 VanDerWaalsContact CB-OD2 3.22Å; S148-D196 WeakPolarHBondContact CB-OD2 3.47Å; S148-D196 PolarHBondContact OG-OD2 3.45Å
149	Q	91.5	Very high	90.9	Very high	39 Å²	39	33.7 Å²	33.7	18%	0.182	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-8.9	-178.4	-54	80.5	10.4	0	0	114.4	F147 R393 D394	F147-Q149 PolarHBondContact O-N 2.99Å; F147-Q149 VanDerWaalsContact O-N 3.15Å; Q149-R393 HydrophobicContact CB-CB 4.07Å; Q149-R393 WeakPolarHBondContact O-CD 3.15Å; Q149-R393 PolarHBondContact O-NH1 3.37Å; Q149-D394 HydrophobicContact CG-CB 4.39Å
150	L	94.6	Very high	90.8	Very high	4 Å²	4	33 Å²	33	2%	0.021	16%	0.16	C	C	.	.	S	Bend	trans	-94.6	154.1	-179.6	-59.6	-178	0	0	0	110.8	F147 E154 I193 V194 R386 M389 Q390	F147-L150 HydrophobicContact CB-CD1 3.96Å; F147-L150 HydrophobicContact CB-CG 4.09Å; F147-L150 PolarHBondContact O-N 3.49Å; L150-E154 WeakPolarHBondContact CA-OE2 3.49Å; L150-E154 HydrophobicContact CB-CB 4.42Å; L150-I193 WeakPolarHBondContact O-CA 3.4Å; L150-V194 WeakPolarHBondContact O-CG2 3.14Å; L150-V194 PolarHBondContact O-N 2.7Å; L150-R386 HydrophobicContact CD1-CG 4.02Å; L150-M389 HydrophobicContact CD2-CB 4.12Å; L150-M389 HydrophobicContact CD2-CE 4.04Å; L150-Q390 HydrophobicContact CD2-CG 4.34Å
151	T	96.5	Very high	90.8	Very high	14 Å²	14	35.7 Å²	35.7	9%	0.086	17%	0.173	C	C	.	.	B	Isolated β-bridge	trans	-79.9	164.3	169.3	71.3	0	0	0	0	111.8	R153 E154 T155 D191 S192 I193	T151-R153 VanDerWaalsContact C-N 3.32Å; T151-R153 PolarHBondContact O-N 3.23Å; T151-E154 PolarHBondContact N-OE2 3.46Å; T151-E154 PolarHBondContact O-N 3.19Å; T151-E154 WeakPolarHBondContact OG1-CB 3.41Å; T151-E154 VanDerWaalsContact OG1-CG 3.22Å; T151-E154 WeakPolarHBondContact OG1-CG 3.28Å; T151-E154 PolarHBondContact OG1-N 3.09Å; T151-E154 VanDerWaalsContact OG1-N 3.11Å; T151-T155 WeakPolarHBondContact O-CB 3.46Å; T151-T155 PolarHBondContact O-N 3.45Å; T151-T155 PolarHBondContact O-OG1 2.92Å; T151-D191 WeakPolarHBondContact CG2-O 3.33Å; T151-S192 WeakPolarHBondContact CA-O 3.3Å; T151-S192 WeakPolarHBondContact CB-O 3.36Å; T151-I193 HydrophobicContact CG2-CG2 4.43Å
152	V	97	Very high	90.6	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-55	-49.8	173.6	176.2	0	0	0	0	110	T155 L156 L181 L186 C189 A190 S192 V194 I202 L210	V152-T155 WeakPolarHBondContact O-CB 3.24Å; V152-T155 PolarHBondContact O-N 3.03Å; V152-L156 HydrophobicContact CG1-CD1 4.41Å; V152-L156 WeakPolarHBondContact O-CG 3.13Å; V152-L156 PolarHBondContact O-N 3.38Å; V152-L181 HydrophobicContact CG1-CD2 3.72Å; V152-L186 HydrophobicContact CG1-CB 4.34Å; V152-L186 HydrophobicContact CG1-CD1 4.26Å; V152-C189 VanDerWaalsContact CG2-O 3.28Å; V152-C189 WeakPolarHBondContact CG2-O 3.45Å; V152-A190 WeakPolarHBondContact CB-O 3.34Å; V152-A190 PolarHBondContact N-O 3.42Å; V152-S192 PolarHBondContact N-O 2.99Å; V152-V194 HydrophobicContact CG2-CG2 4.31Å; V152-I202 HydrophobicContact CG2-CD1 3.88Å; V152-I202 HydrophobicContact CG2-CG2 3.88Å; V152-L210 HydrophobicContact CG1-CD1 3.88Å; V152-L210 HydrophobicContact CG2-CD2 4.35Å
153	R	96.7	Very high	90.4	Very high	59 Å²	59	30.5 Å²	30.5	22%	0.223	15%	0.153	C	C	.	.	H	α-helix	trans	-61.1	-45.5	178.1	-179.9	-177.2	-59.9	-73.7	-1.3	112.3	T151 T155 L156 S157 N178 A190 D191	T151-R153 VanDerWaalsContact C-N 3.32Å; T151-R153 PolarHBondContact O-N 3.23Å; R153-T155 VanDerWaalsContact C-N 3.31Å; R153-T155 PolarHBondContact O-N 3.27Å; R153-L156 PolarHBondContact O-N 3.47Å; R153-S157 WeakPolarHBondContact O-CB 3.23Å; R153-S157 PolarHBondContact O-N 3.33Å; R153-S157 PolarHBondContact O-OG 3.45Å; R153-N178 PolarHBondContact NH1-OD1 3.06Å; R153-A190 HydrophobicContact CB-CB 4.45Å; R153-A190 VanDerWaalsContact CB-O 3.23Å; R153-A190 WeakPolarHBondContact CB-O 3.49Å; R153-A190 PolarHBondContact N-O 3.32Å; R153-D191 WeakPolarHBondContact CD-OD1 3.39Å; R153-D191 IonicContact CZ-OD1 3.72Å; R153-D191 IonicContact NE-OD1 2.61Å; R153-D191 PolarHBondContact NE-OD1 3.37Å
154	E	96	Very high	90.3	Very high	43 Å²	43	25.2 Å²	25.2	20%	0.201	13%	0.128	C	C	.	.	H	α-helix	trans	-63.1	-39.8	178.8	-75.7	166.6	172	0	0	111.8	L150 T151 L158 R393	L150-E154 WeakPolarHBondContact CA-OE2 3.49Å; L150-E154 HydrophobicContact CB-CB 4.42Å; T151-E154 PolarHBondContact N-OE2 3.46Å; T151-E154 PolarHBondContact O-N 3.19Å; T151-E154 WeakPolarHBondContact OG1-CB 3.41Å; T151-E154 VanDerWaalsContact OG1-CG 3.22Å; T151-E154 WeakPolarHBondContact OG1-CG 3.28Å; T151-E154 PolarHBondContact OG1-N 3.09Å; T151-E154 VanDerWaalsContact OG1-N 3.11Å; E154-L158 VanDerWaalsContact O-CB 3.29Å; E154-L158 WeakPolarHBondContact O-CB 3.41Å; E154-L158 PolarHBondContact O-N 3.48Å; E154-R393 IonicContact OE1-CZ 3.25Å; E154-R393 VanDerWaalsContact OE1-CZ 3.25Å; E154-R393 IonicContact OE1-NH1 3.94Å; E154-R393 PolarHBondContact OE1-NH1 3.16Å; E154-R393 IonicContact OE1-NH2 3.25Å; E154-R393 PolarHBondContact OE1-NH2 3.39Å; E154-R393 IonicContact OE2-CZ 3.97Å; E154-R393 IonicContact OE2-NH1 2.77Å; E154-R393 PolarHBondContact OE2-NH1 2.9Å; E154-R393 IonicContact OE2-NH2 2.9Å
155	T	95.1	Very high	89.7	Confident	17 Å²	17	29.2 Å²	29.2	10%	0.104	14%	0.142	C	C	.	.	H	α-helix	trans	-62	-48.7	177.5	-58	0	0	0	0	110.6	F146 T151 V152 R153 A159 L210	F146-T155 HydrophobicContact CD1-CG2 3.91Å; F146-T155 HydrophobicContact CE1-CG2 4.09Å; T151-T155 WeakPolarHBondContact O-CB 3.46Å; T151-T155 PolarHBondContact O-N 3.45Å; T151-T155 PolarHBondContact O-OG1 2.92Å; V152-T155 WeakPolarHBondContact O-CB 3.24Å; V152-T155 PolarHBondContact O-N 3.03Å; R153-T155 VanDerWaalsContact C-N 3.31Å; R153-T155 PolarHBondContact O-N 3.27Å; T155-A159 WeakPolarHBondContact O-CB 3.23Å; T155-A159 PolarHBondContact O-N 3.48Å; T155-L210 HydrophobicContact CG2-CD1 4.38Å
156	L	94.1	Very high	88.7	Confident	0 Å²	0	33 Å²	33	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-68.6	-42.9	178.4	-67.1	177.1	0	0	0	112.8	V152 R153 L158 A159 A160 V177 L180 L181 L210 A213 I217	V152-L156 HydrophobicContact CG1-CD1 4.41Å; V152-L156 WeakPolarHBondContact O-CG 3.13Å; V152-L156 PolarHBondContact O-N 3.38Å; R153-L156 PolarHBondContact O-N 3.47Å; L156-L158 VanDerWaalsContact C-N 3.29Å; L156-L158 PolarHBondContact O-N 3.37Å; L156-A159 PolarHBondContact O-N 3.38Å; L156-A160 WeakPolarHBondContact O-CB 3.4Å; L156-A160 PolarHBondContact O-N 2.98Å; L156-V177 HydrophobicContact CB-CG1 3.86Å; L156-L180 HydrophobicContact CD2-CD2 4.42Å; L156-L181 HydrophobicContact CD1-CD2 3.58Å; L156-L181 HydrophobicContact CD1-CG 3.9Å; L156-L210 HydrophobicContact CD1-CD1 4.19Å; L156-L210 HydrophobicContact CD2-CD1 3.79Å; L156-L210 HydrophobicContact CG-CD1 3.74Å; L156-A213 HydrophobicContact CD1-CB 4.11Å; L156-A213 HydrophobicContact CD2-CB 3.48Å; L156-A213 VanDerWaalsContact CD2-CB 3.48Å; L156-A213 HydrophobicContact CG-CB 4.42Å; L156-I217 HydrophobicContact CB-CD1 4.45Å; L156-I217 HydrophobicContact CD2-CD1 3.84Å; L156-I217 WeakPolarHBondContact O-CD1 3.42Å
157	S	93.5	Very high	87.4	Confident	36 Å²	36	38 Å²	38	25%	0.252	18%	0.184	S	C	.	.	H	α-helix	trans	-59.8	-43.6	178.1	-58.7	0	0	0	0	110.5	R153 A160 E161	R153-S157 WeakPolarHBondContact O-CB 3.23Å; R153-S157 PolarHBondContact O-N 3.33Å; R153-S157 PolarHBondContact O-OG 3.45Å; S157-A160 PolarHBondContact O-N 3.48Å; S157-E161 WeakPolarHBondContact O-CB 3.26Å; S157-E161 WeakPolarHBondContact O-CG 3.44Å; S157-E161 PolarHBondContact O-N 3.35Å
158	L	91.1	Very high	86.6	Confident	21 Å²	21	39.9 Å²	39.9	11%	0.11	19%	0.194	C	C	.	.	H	α-helix	trans	-65.7	-43	176.8	-174.3	73	0	0	0	112	E154 L156 E161 L162 L382 R386	E154-L158 VanDerWaalsContact O-CB 3.29Å; E154-L158 WeakPolarHBondContact O-CB 3.41Å; E154-L158 PolarHBondContact O-N 3.48Å; L156-L158 VanDerWaalsContact C-N 3.29Å; L156-L158 PolarHBondContact O-N 3.37Å; L158-E161 CarbonylContact O-C 3.53Å; L158-E161 WeakPolarHBondContact O-CA 3.23Å; L158-E161 WeakPolarHBondContact O-CB 3.4Å; L158-E161 PolarHBondContact O-N 3.48Å; L158-L162 HydrophobicContact CD1-CD1 4.37Å; L158-L162 HydrophobicContact CD2-CD1 4.44Å; L158-L162 HydrophobicContact CG-CD1 3.95Å; L158-L162 VanDerWaalsContact O-CG 3.31Å; L158-L162 WeakPolarHBondContact O-CG 3.45Å; L158-L162 PolarHBondContact O-N 2.77Å; L158-L382 HydrophobicContact CD1-CB 3.95Å; L158-R386 HydrophobicContact CD2-CB 3.86Å; L158-R386 HydrophobicContact CD2-CG 4Å
159	A	89.2	Confident	86.3	Confident	15 Å²	15	42.5 Å²	42.5	12%	0.124	21%	0.21	C	C	.	.	H	α-helix	trans	-63.5	-42	177.3	0	0	0	0	0	111.5	T155 L156 E161 L162 Q163 I217	T155-A159 WeakPolarHBondContact O-CB 3.23Å; T155-A159 PolarHBondContact O-N 3.48Å; L156-A159 PolarHBondContact O-N 3.38Å; A159-E161 VanDerWaalsContact C-N 3.31Å; A159-E161 PolarHBondContact O-N 2.9Å; A159-L162 PolarHBondContact O-N 3.43Å; A159-Q163 WeakPolarHBondContact O-CB 3.36Å; A159-Q163 WeakPolarHBondContact O-CG 3.44Å; A159-Q163 PolarHBondContact O-N 3.25Å; A159-I217 HydrophobicContact CB-CD1 3.35Å
160	A	88.8	Confident	85.9	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-60.9	-41.5	171.8	0	0	0	0	0	111.3	L156 S157 L162 L164 V177 I217 R374	L156-A160 WeakPolarHBondContact O-CB 3.4Å; L156-A160 PolarHBondContact O-N 2.98Å; S157-A160 PolarHBondContact O-N 3.48Å; A160-L162 PolarHBondContact O-N 3.42Å; A160-L164 HydrophobicContact CB-CD1 3.81Å; A160-L164 HydrophobicContact CB-CG 4.37Å; A160-L164 WeakPolarHBondContact O-CB 3.45Å; A160-L164 PolarHBondContact O-N 3.43Å; A160-L164 VanDerWaalsContact O-N 3.07Å; A160-V177 HydrophobicContact CB-CG2 3.65Å; A160-I217 HydrophobicContact CB-CG2 4.19Å; A160-R374 PolarHBondContact O-NH2 3.04Å
161	E	88.1	Confident	85.6	Confident	60 Å²	60	50.7 Å²	50.7	28%	0.28	26%	0.256	S	S	.	.	H	α-helix	trans	-72.3	5	171.1	-80.5	-140.3	-111.9	0	0	114.7	S157 L158 A159 R374 L382	S157-E161 WeakPolarHBondContact O-CB 3.26Å; S157-E161 WeakPolarHBondContact O-CG 3.44Å; S157-E161 PolarHBondContact O-N 3.35Å; L158-E161 CarbonylContact O-C 3.53Å; L158-E161 WeakPolarHBondContact O-CA 3.23Å; L158-E161 WeakPolarHBondContact O-CB 3.4Å; L158-E161 PolarHBondContact O-N 3.48Å; A159-E161 VanDerWaalsContact C-N 3.31Å; A159-E161 PolarHBondContact O-N 2.9Å; E161-R374 PolarHBondContact O-NE 3.22Å; E161-R374 PolarHBondContact O-NH1 2.85Å; E161-R374 PolarHBondContact O-NH2 3.39Å; E161-L382 HydrophobicContact CB-CD1 4.06Å; E161-L382 HydrophobicContact CB-CD2 4.21Å; E161-L382 VanDerWaalsContact CD-CD2 3.49Å; E161-L382 WeakPolarHBondContact O-CD1 3.48Å; E161-L382 WeakPolarHBondContact OE2-CD2 3.43Å
162	L	83.9	Confident	85.1	Confident	11 Å²	11	57.8 Å²	57.8	6%	0.058	28%	0.281	C	S	.	.	H	α-helix	trans	-118.9	-33.6	169.3	-71.2	166	0	0	0	111.4	L158 A159 A160 R374 L382 L383 Y468	L158-L162 HydrophobicContact CD1-CD1 4.37Å; L158-L162 HydrophobicContact CD2-CD1 4.44Å; L158-L162 HydrophobicContact CG-CD1 3.95Å; L158-L162 VanDerWaalsContact O-CG 3.31Å; L158-L162 WeakPolarHBondContact O-CG 3.45Å; L158-L162 PolarHBondContact O-N 2.77Å; A159-L162 PolarHBondContact O-N 3.43Å; A160-L162 PolarHBondContact O-N 3.42Å; L162-R374 VanDerWaalsContact C-CZ 3.48Å; L162-R374 VanDerWaalsContact C-NE 3.28Å; L162-R374 PolarHBondContact O-NE 3.32Å; L162-R374 PolarHBondContact O-NH2 2.8Å; L162-L382 HydrophobicContact CD2-CD1 4.16Å; L162-L383 HydrophobicContact CD1-CD2 4.45Å; L162-Y468 HydrophobicContact CD1-CD1 3.92Å; L162-Y468 HydrophobicContact CD1-CE1 4.32Å; L162-Y468 HydrophobicContact CD2-CD1 4.46Å
163	Q	80.5	Confident	84.6	Confident	56 Å²	56	58.2 Å²	58.2	26%	0.262	28%	0.283	S	S	.	.	H	α-helix	trans	-102.2	-34.2	-169.6	-62.4	176.1	6	0	0	114.6	A159 I217	A159-Q163 WeakPolarHBondContact O-CB 3.36Å; A159-Q163 WeakPolarHBondContact O-CG 3.44Å; A159-Q163 PolarHBondContact O-N 3.25Å; Q163-I217 HydrophobicContact CB-CG2 3.98Å
164	L	80.3	Confident	84.3	Confident	21 Å²	21	60.9 Å²	60.9	11%	0.11	30%	0.298	C	S	.	.	S	Bend	trans	-70	158.1	-178.9	-66.9	176	0	0	0	113	A160 L168 K173 Y176 I217 R374	A160-L164 HydrophobicContact CB-CD1 3.81Å; A160-L164 HydrophobicContact CB-CG 4.37Å; A160-L164 WeakPolarHBondContact O-CB 3.45Å; A160-L164 PolarHBondContact O-N 3.43Å; A160-L164 VanDerWaalsContact O-N 3.07Å; L164-L168 HydrophobicContact CB-CD1 4.12Å; L164-K173 HydrophobicContact CD1-CB 4.46Å; L164-K173 HydrophobicContact CD1-CG 4.03Å; L164-Y176 HydrophobicContact CD1-CD1 3.99Å; L164-Y176 HydrophobicContact CD1-CE1 4.47Å; L164-Y176 HydrophobicContact CD1-CG 4.38Å; L164-I217 HydrophobicContact CD2-CG2 4.43Å; L164-I217 VanDerWaalsContact CD2-O 3.22Å; L164-I217 WeakPolarHBondContact CD2-O 3.41Å; L164-I217 HydrophobicContact CG-CG2 4.15Å; L164-R374 VanDerWaalsContact N-NH2 3.19Å; L164-R374 PolarHBondContact O-NH2 3.21Å
165	R	70.2	Confident	84	Confident	111 Å²	111	62.4 Å²	62.4	42%	0.419	31%	0.314	S	S	.	.			trans	-59.2	154.3	-179.1	-66	-172.8	-179.2	-155.8	2.5	112.5	L168 K173	R165-L168 HydrophobicContact CB-CD1 4.25Å; R165-K173 VanDerWaalsContact O-CE 3.3Å; R165-K173 WeakPolarHBondContact O-CE 3.33Å; R165-K173 PolarHBondContact O-NZ 3.5Å
166	R	62.6	Low	83.8	Confident	141 Å²	141	64.9 Å²	64.9	53%	0.532	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-31.1	-177.8	-70.6	-179.2	77.8	152.2	-2.3	113	L168	R166-L168 VanDerWaalsContact C-N 3.3Å; R166-L168 PolarHBondContact O-N 3.42Å
167	T	63.7	Low	83.7	Confident	126 Å²	126	64.9 Å²	64.9	77%	0.773	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-20.7	-176.2	48.5	0	0	0	0	113.8	T169	T167-T169 PolarHBondContact O-N 2.8Å
168	L	75.3	Confident	83.7	Confident	55 Å²	55	66.3 Å²	66.3	29%	0.288	33%	0.326	S	S	.	.	S	Bend	trans	-67.3	124.8	173.7	-78.8	151.7	0	0	0	110.4	L164 R165 R166 R172 K173	L164-L168 HydrophobicContact CB-CD1 4.12Å; R165-L168 HydrophobicContact CB-CD1 4.25Å; R166-L168 VanDerWaalsContact C-N 3.3Å; R166-L168 PolarHBondContact O-N 3.42Å; L168-R172 HydrophobicContact CD2-CB 3.98Å; L168-K173 HydrophobicContact CB-CD 4.45Å; L168-K173 VanDerWaalsContact CB-CE 3.46Å; L168-K173 HydrophobicContact CB-CG 4.04Å; L168-K173 VanDerWaalsContact O-CE 3.27Å; L168-K173 WeakPolarHBondContact O-CE 3.31Å; L168-K173 PolarHBondContact O-NZ 2.97Å
169	T	83.5	Confident	83.7	Confident	62 Å²	62	68.2 Å²	68.2	38%	0.38	34%	0.337	S	S	.	.			trans	-61.3	153.5	174.5	66.2	0	0	0	0	111.1	T167 E171 R172 K173	T167-T169 PolarHBondContact O-N 2.8Å; T169-E171 VanDerWaalsContact CB-OE2 3.27Å; T169-E171 WeakPolarHBondContact CB-OE2 3.48Å; T169-E171 PolarHBondContact O-N 3.07Å; T169-E171 PolarHBondContact OG1-OE2 3.4Å; T169-R172 PolarHBondContact O-N 2.99Å; T169-R172 WeakPolarHBondContact OG1-CG 3.2Å; T169-R172 PolarHBondContact OG1-N 2.74Å; T169-K173 PolarHBondContact O-N 3.13Å; T169-K173 VanDerWaalsContact O-N 3.11Å
170	P	83.7	Confident	83.7	Confident	90 Å²	90	68.1 Å²	68.1	58%	0.584	33%	0.334	S	S	*	.	H	α-helix	trans	-52.3	-41.6	176.2	-23.9	33.8	0	0	0	112.7	R172 K173 E174	P170-R172 PolarHBondContact O-N 3.31Å; P170-K173 WeakPolarHBondContact O-CB 3.39Å; P170-K173 PolarHBondContact O-N 3.3Å; P170-E174 PolarHBondContact O-N 3.43Å
171	E	87.2	Confident	84	Confident	126 Å²	126	68.1 Å²	68.1	59%	0.589	33%	0.334	S	S	*	.	H	α-helix	trans	-66.6	-40.3	-177.8	-55.7	71	-150.1	0	0	111.1	T169 K173 E174 S175	T169-E171 VanDerWaalsContact CB-OE2 3.27Å; T169-E171 WeakPolarHBondContact CB-OE2 3.48Å; T169-E171 PolarHBondContact O-N 3.07Å; T169-E171 PolarHBondContact OG1-OE2 3.4Å; E171-K173 VanDerWaalsContact C-N 3.32Å; E171-K173 PolarHBondContact O-N 2.9Å; E171-E174 PolarHBondContact O-N 3.17Å; E171-S175 WeakPolarHBondContact O-CB 3.29Å; E171-S175 PolarHBondContact O-N 2.7Å
172	R	86.5	Confident	84.2	Confident	162 Å²	162	72.5 Å²	72.5	61%	0.611	35%	0.353	S	S	*	.	H	α-helix	trans	-66	-36.3	175	-78.5	-173.8	179	-173.7	-0	111.8	L168 T169 P170 Y176	L168-R172 HydrophobicContact CD2-CB 3.98Å; T169-R172 PolarHBondContact O-N 2.99Å; T169-R172 WeakPolarHBondContact OG1-CG 3.2Å; T169-R172 PolarHBondContact OG1-N 2.74Å; P170-R172 PolarHBondContact O-N 3.31Å; R172-Y176 WeakPolarHBondContact O-CB 3.5Å; R172-Y176 PolarHBondContact O-N 3.39Å
173	K	87	Confident	84.3	Confident	10 Å²	10	78.1 Å²	78.1	4%	0.043	37%	0.373	C	S	.	.	H	α-helix	trans	-66.6	-42.2	175.7	-69.3	178.8	179	166.4	0	111.5	L164 R165 L168 T169 P170 E171 Y176 V177	L164-K173 HydrophobicContact CD1-CB 4.46Å; L164-K173 HydrophobicContact CD1-CG 4.03Å; R165-K173 VanDerWaalsContact O-CE 3.3Å; R165-K173 WeakPolarHBondContact O-CE 3.33Å; R165-K173 PolarHBondContact O-NZ 3.5Å; L168-K173 HydrophobicContact CB-CD 4.45Å; L168-K173 VanDerWaalsContact CB-CE 3.46Å; L168-K173 HydrophobicContact CB-CG 4.04Å; L168-K173 VanDerWaalsContact O-CE 3.27Å; L168-K173 WeakPolarHBondContact O-CE 3.31Å; L168-K173 PolarHBondContact O-NZ 2.97Å; T169-K173 PolarHBondContact O-N 3.13Å; T169-K173 VanDerWaalsContact O-N 3.11Å; P170-K173 WeakPolarHBondContact O-CB 3.39Å; P170-K173 PolarHBondContact O-N 3.3Å; E171-K173 VanDerWaalsContact C-N 3.32Å; E171-K173 PolarHBondContact O-N 2.9Å; K173-Y176 WeakPolarHBondContact O-CB 3.34Å; K173-Y176 PolarHBondContact O-N 3.49Å; K173-V177 WeakPolarHBondContact O-CG2 3.44Å; K173-V177 PolarHBondContact O-N 3.47Å
174	E	90.1	Very high	84.7	Confident	115 Å²	115	75.6 Å²	75.6	54%	0.537	36%	0.361	S	S	.	.	H	α-helix	trans	-65.8	-43.7	176.4	-175.6	165.6	-162.5	0	0	111.7	P170 E171 Y176 V177 N178	P170-E174 PolarHBondContact O-N 3.43Å; E171-E174 PolarHBondContact O-N 3.17Å; E174-Y176 VanDerWaalsContact C-N 3.29Å; E174-Y176 PolarHBondContact O-N 3.38Å; E174-V177 PolarHBondContact O-N 2.97Å; E174-V177 VanDerWaalsContact O-N 3.15Å; E174-N178 PolarHBondContact O-N 3.05Å; E174-N178 PolarHBondContact O-ND2 3.49Å
175	S	90.8	Very high	85.2	Confident	75 Å²	75	76.6 Å²	76.6	52%	0.524	38%	0.376	S	S	.	.	H	α-helix	trans	-58.5	-41.3	173.1	-169.5	0	0	0	0	112	E171 N178 D179	E171-S175 WeakPolarHBondContact O-CB 3.29Å; E171-S175 PolarHBondContact O-N 2.7Å; S175-N178 PolarHBondContact O-N 3.48Å; S175-D179 PolarHBondContact O-N 3.29Å
176	Y	88.9	Confident	86.3	Confident	68 Å²	68	71.3 Å²	71.3	27%	0.267	36%	0.356	S	S	.	.	H	α-helix	trans	-62.6	-42.7	175.2	-177.7	-89.8	0	0	0	112.1	L164 R172 K173 E174 N178 D179 L180 L216 S219	L164-Y176 HydrophobicContact CD1-CD1 3.99Å; L164-Y176 HydrophobicContact CD1-CE1 4.47Å; L164-Y176 HydrophobicContact CD1-CG 4.38Å; R172-Y176 WeakPolarHBondContact O-CB 3.5Å; R172-Y176 PolarHBondContact O-N 3.39Å; K173-Y176 WeakPolarHBondContact O-CB 3.34Å; K173-Y176 PolarHBondContact O-N 3.49Å; E174-Y176 VanDerWaalsContact C-N 3.29Å; E174-Y176 PolarHBondContact O-N 3.38Å; Y176-N178 VanDerWaalsContact C-N 3.33Å; Y176-N178 PolarHBondContact O-N 3.27Å; Y176-D179 PolarHBondContact O-N 3.06Å; Y176-L180 WeakPolarHBondContact O-CB 3.39Å; Y176-L180 PolarHBondContact O-N 3.37Å; Y176-L216 PolarHBondContact OH-O 3.07Å; Y176-L216 VanDerWaalsContact OH-O 3.09Å; Y176-S219 PolarHBondContact OH-OG 3.44Å
177	V	92.2	Very high	87.9	Confident	1 Å²	1	68 Å²	68	1%	0.006	35%	0.351	C	S	.	.	H	α-helix	trans	-64.5	-39.2	176.1	170.9	0	0	0	0	111.2	L156 A160 K173 E174 L180 L181	L156-V177 HydrophobicContact CB-CG1 3.86Å; A160-V177 HydrophobicContact CB-CG2 3.65Å; K173-V177 WeakPolarHBondContact O-CG2 3.44Å; K173-V177 PolarHBondContact O-N 3.47Å; E174-V177 PolarHBondContact O-N 2.97Å; E174-V177 VanDerWaalsContact O-N 3.15Å; V177-L180 PolarHBondContact O-N 3.45Å; V177-L181 HydrophobicContact CG1-CD1 4.12Å; V177-L181 HydrophobicContact CG1-CG 4.49Å; V177-L181 WeakPolarHBondContact O-CB 3.41Å; V177-L181 WeakPolarHBondContact O-CG 3.46Å; V177-L181 PolarHBondContact O-N 2.86Å
178	N	94.2	Very high	89.3	Confident	65 Å²	65	69.7 Å²	69.7	35%	0.348	36%	0.356	S	S	.	.	H	α-helix	trans	-64.6	-44	176.5	-74.1	-30.2	0	0	0	112.3	R153 E174 S175 Y176 L180 L181 F182	R153-N178 PolarHBondContact NH1-OD1 3.06Å; E174-N178 PolarHBondContact O-N 3.05Å; E174-N178 PolarHBondContact O-ND2 3.49Å; S175-N178 PolarHBondContact O-N 3.48Å; Y176-N178 VanDerWaalsContact C-N 3.33Å; Y176-N178 PolarHBondContact O-N 3.27Å; N178-L180 VanDerWaalsContact C-N 3.34Å; N178-L181 PolarHBondContact O-N 3.46Å; N178-F182 PolarHBondContact O-N 3.02Å
179	D	90.3	Very high	90.3	Very high	62 Å²	62	67.3 Å²	67.3	33%	0.332	34%	0.344	S	S	.	.	H	α-helix	trans	-61.5	-44.1	175	-174.3	34.3	0	0	0	110.9	S175 Y176 L181 F182 R183	S175-D179 PolarHBondContact O-N 3.29Å; Y176-D179 PolarHBondContact O-N 3.06Å; D179-L181 PolarHBondContact O-N 3.15Å; D179-F182 WeakPolarHBondContact O-CB 3.31Å; D179-F182 PolarHBondContact O-N 3.24Å; D179-F182 VanDerWaalsContact O-N 3.12Å; D179-R183 WeakPolarHBondContact O-CG 3.35Å; D179-R183 PolarHBondContact O-N 3.31Å; D179-R183 IonicContact OD1-NE 2.54Å; D179-R183 PolarHBondContact OD1-NE 3.37Å; D179-R183 IonicContact OD1-NH2 2.66Å; D179-R183 IonicContact OD2-CZ 3.46Å; D179-R183 VanDerWaalsContact OD2-CZ 3.25Å; D179-R183 IonicContact OD2-NE 3.79Å; D179-R183 PolarHBondContact OD2-NE 3.27Å; D179-R183 IonicContact OD2-NH2 2.83Å; D179-R183 PolarHBondContact OD2-NH2 2.81Å
180	L	90.2	Very high	90.9	Very high	12 Å²	12	64.3 Å²	64.3	6%	0.063	33%	0.326	C	S	.	.	H	α-helix	trans	-63.1	-40.1	177.1	-169.7	65.5	0	0	0	112.8	L156 Y176 V177 N178 F182 L184 A213 L216 I217	L156-L180 HydrophobicContact CD2-CD2 4.42Å; Y176-L180 WeakPolarHBondContact O-CB 3.39Å; Y176-L180 PolarHBondContact O-N 3.37Å; V177-L180 PolarHBondContact O-N 3.45Å; N178-L180 VanDerWaalsContact C-N 3.34Å; L180-F182 VanDerWaalsContact C-N 3.31Å; L180-F182 PolarHBondContact O-N 3.45Å; L180-L184 HydrophobicContact CD1-CD1 3.75Å; L180-L184 HydrophobicContact CD1-CG 4.29Å; L180-L184 HydrophobicContact CG-CD1 3.89Å; L180-L184 WeakPolarHBondContact O-CB 3.15Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.4Å; L180-L184 PolarHBondContact O-N 3.3Å; L180-L184 VanDerWaalsContact O-N 3.15Å; L180-A213 HydrophobicContact CD2-CB 4.1Å; L180-A213 WeakPolarHBondContact CD2-O 2.97Å; L180-A213 HydrophobicContact CG-CB 4.31Å; L180-L216 HydrophobicContact CD1-CB 3.97Å; L180-L216 HydrophobicContact CD1-CD1 4.09Å; L180-I217 HydrophobicContact CD2-CG1 3.78Å
181	L	94.2	Very high	91.5	Very high	2 Å²	2	65.2 Å²	65.2	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-62.2	-39.6	173.5	-78.4	168	0	0	0	111.7	V152 L156 V177 N178 D179 G185 L186 V187 A190	V152-L181 HydrophobicContact CG1-CD2 3.72Å; L156-L181 HydrophobicContact CD1-CD2 3.58Å; L156-L181 HydrophobicContact CD1-CG 3.9Å; V177-L181 HydrophobicContact CG1-CD1 4.12Å; V177-L181 HydrophobicContact CG1-CG 4.49Å; V177-L181 WeakPolarHBondContact O-CB 3.41Å; V177-L181 WeakPolarHBondContact O-CG 3.46Å; V177-L181 PolarHBondContact O-N 2.86Å; N178-L181 PolarHBondContact O-N 3.46Å; D179-L181 PolarHBondContact O-N 3.15Å; L181-G185 PolarHBondContact O-N 3.24Å; L181-L186 HydrophobicContact CD2-CB 3.65Å; L181-L186 HydrophobicContact CD2-CD1 4.48Å; L181-L186 PolarHBondContact O-N 3.17Å; L181-V187 HydrophobicContact CB-CG2 4.47Å; L181-V187 PolarHBondContact O-N 2.88Å; L181-A190 HydrophobicContact CD1-CB 3.93Å; L181-A190 HydrophobicContact CD2-CB 4.14Å
182	F	92.1	Very high	92	Very high	152 Å²	152	61.9 Å²	61.9	67%	0.667	32%	0.316	S	S	*	.	H	α-helix	trans	-66.5	-54.5	177.3	-179.6	-99.8	0	0	0	111.6	N178 D179 L180 L184 G185 V187	N178-F182 PolarHBondContact O-N 3.02Å; D179-F182 WeakPolarHBondContact O-CB 3.31Å; D179-F182 PolarHBondContact O-N 3.24Å; D179-F182 VanDerWaalsContact O-N 3.12Å; L180-F182 VanDerWaalsContact C-N 3.31Å; L180-F182 PolarHBondContact O-N 3.45Å; F182-L184 PolarHBondContact O-N 2.84Å; F182-G185 PolarHBondContact O-N 3.48Å; F182-V187 HydrophobicContact CB-CG2 4.12Å; F182-V187 HydrophobicContact CD2-CG2 4.24Å
183	R	86.2	Confident	92.4	Very high	128 Å²	128	57.3 Å²	57.3	48%	0.483	30%	0.303	S	S	.	.	H	α-helix	trans	-56.4	-37.8	-179.3	-69.9	-175.7	-166	-154.5	7.7	113	D179 G185 D250	D179-R183 WeakPolarHBondContact O-CG 3.35Å; D179-R183 PolarHBondContact O-N 3.31Å; D179-R183 IonicContact OD1-NE 2.54Å; D179-R183 PolarHBondContact OD1-NE 3.37Å; D179-R183 IonicContact OD1-NH2 2.66Å; D179-R183 IonicContact OD2-CZ 3.46Å; D179-R183 VanDerWaalsContact OD2-CZ 3.25Å; D179-R183 IonicContact OD2-NE 3.79Å; D179-R183 PolarHBondContact OD2-NE 3.27Å; D179-R183 IonicContact OD2-NH2 2.83Å; D179-R183 PolarHBondContact OD2-NH2 2.81Å; R183-G185 VanDerWaalsContact C-N 3.31Å; R183-D250 IonicContact NH1-OD2 3.38Å
184	L	89.7	Confident	92.8	Very high	4 Å²	4	57 Å²	57	2%	0.021	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	4.8	-178.7	-56.9	174.5	0	0	0	113	L180 F182 L186 R209 L212 A213 L216 T243	L180-L184 HydrophobicContact CD1-CD1 3.75Å; L180-L184 HydrophobicContact CD1-CG 4.29Å; L180-L184 HydrophobicContact CG-CD1 3.89Å; L180-L184 WeakPolarHBondContact O-CB 3.15Å; L180-L184 VanDerWaalsContact O-CG 3.3Å; L180-L184 WeakPolarHBondContact O-CG 3.4Å; L180-L184 PolarHBondContact O-N 3.3Å; L180-L184 VanDerWaalsContact O-N 3.15Å; F182-L184 PolarHBondContact O-N 2.84Å; L184-L186 VanDerWaalsContact C-N 3.32Å; L184-L186 HydrophobicContact CB-CD1 4.09Å; L184-L186 HydrophobicContact CB-CG 4.17Å; L184-L186 PolarHBondContact O-N 3.48Å; L184-R209 WeakPolarHBondContact O-CD 3.42Å; L184-R209 PolarHBondContact O-NH1 2.82Å; L184-L212 HydrophobicContact CD2-CD2 4.16Å; L184-A213 HydrophobicContact CD1-CB 3.19Å; L184-L216 HydrophobicContact CD1-CD1 4.16Å; L184-L216 HydrophobicContact CD2-CD1 4.02Å; L184-T243 HydrophobicContact CD2-CG2 3.22Å
185	G	90.3	Very high	92.8	Very high	41 Å²	41	51.6 Å²	51.6	42%	0.423	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	38.1	179.1	0	0	0	0	0	113.5	L181 F182 R183 R209	L181-G185 PolarHBondContact O-N 3.24Å; F182-G185 PolarHBondContact O-N 3.48Å; R183-G185 VanDerWaalsContact C-N 3.31Å; G185-R209 PolarHBondContact O-NH1 3.33Å
186	L	94.6	Very high	92.6	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.268	C	S	.	.			trans	-105.4	2.6	-179.1	-67.4	175	0	0	0	113.1	V152 L181 L184 N188 C189 A190 E206 R209 L210 A213	V152-L186 HydrophobicContact CG1-CB 4.34Å; V152-L186 HydrophobicContact CG1-CD1 4.26Å; L181-L186 HydrophobicContact CD2-CB 3.65Å; L181-L186 HydrophobicContact CD2-CD1 4.48Å; L181-L186 PolarHBondContact O-N 3.17Å; L184-L186 VanDerWaalsContact C-N 3.32Å; L184-L186 HydrophobicContact CB-CD1 4.09Å; L184-L186 HydrophobicContact CB-CG 4.17Å; L184-L186 PolarHBondContact O-N 3.48Å; L186-N188 VanDerWaalsContact C-N 3.32Å; L186-N188 PolarHBondContact O-N 3.3Å; L186-C189 CarbonylContact O-C 3.59Å; L186-C189 PolarHBondContact O-N 2.9Å; L186-C189 PolarHBondContact O-SG 2.9Å; L186-C189 VanDerWaalsContact O-SG 3.38Å; L186-A190 PolarHBondContact O-N 3.48Å; L186-E206 HydrophobicContact CD2-CB 4.11Å; L186-E206 HydrophobicContact CD2-CG 4.41Å; L186-R209 HydrophobicContact CD1-CB 4.35Å; L186-R209 HydrophobicContact CD2-CB 4Å; L186-R209 HydrophobicContact CG-CB 4.31Å; L186-L210 HydrophobicContact CD1-CB 4.3Å; L186-A213 HydrophobicContact CD1-CB 4.3Å
187	V	95.1	Very high	92.2	Very high	71 Å²	71	53.3 Å²	53.3	43%	0.43	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-55.4	-46.2	-177.4	-177	0	0	0	0	111.8	L181 F182 C189 A190	L181-V187 HydrophobicContact CB-CG2 4.47Å; L181-V187 PolarHBondContact O-N 2.88Å; F182-V187 HydrophobicContact CB-CG2 4.12Å; F182-V187 HydrophobicContact CD2-CG2 4.24Å; V187-C189 PolarHBondContact O-N 3.42Å; V187-A190 VanDerWaalsContact O-CB 3.28Å; V187-A190 WeakPolarHBondContact O-CB 3.18Å; V187-A190 PolarHBondContact O-N 3.37Å
188	N	94.3	Very high	91.5	Very high	162 Å²	162	61.7 Å²	61.7	87%	0.866	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-65.2	-26.7	-176.4	-64.9	-14.1	0	0	0	113.2	L186	L186-N188 VanDerWaalsContact C-N 3.32Å; L186-N188 PolarHBondContact O-N 3.3Å
189	C	95.7	Very high	90.9	Very high	5 Å²	5	60.7 Å²	60.7	3%	0.034	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-108.3	8.9	179.3	64.9	0	0	0	0	113	V152 L186 V187 D191 S192 I202	V152-C189 VanDerWaalsContact CG2-O 3.28Å; V152-C189 WeakPolarHBondContact CG2-O 3.45Å; L186-C189 CarbonylContact O-C 3.59Å; L186-C189 PolarHBondContact O-N 2.9Å; L186-C189 PolarHBondContact O-SG 2.9Å; L186-C189 VanDerWaalsContact O-SG 3.38Å; V187-C189 PolarHBondContact O-N 3.42Å; C189-D191 VanDerWaalsContact C-N 3.27Å; C189-D191 PolarHBondContact O-N 2.99Å; C189-S192 WeakPolarHBondContact O-CB 3.27Å; C189-S192 PolarHBondContact O-N 3.47Å; C189-I202 HydrophobicContact CB-CG2 3.94Å
190	A	96	Very high	90.8	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-41.7	-174.2	0	0	0	0	0	112.7	V152 R153 L181 L186 V187	V152-A190 WeakPolarHBondContact CB-O 3.34Å; V152-A190 PolarHBondContact N-O 3.42Å; R153-A190 HydrophobicContact CB-CB 4.45Å; R153-A190 VanDerWaalsContact CB-O 3.23Å; R153-A190 WeakPolarHBondContact CB-O 3.49Å; R153-A190 PolarHBondContact N-O 3.32Å; L181-A190 HydrophobicContact CD1-CB 3.93Å; L181-A190 HydrophobicContact CD2-CB 4.14Å; L186-A190 PolarHBondContact O-N 3.48Å; V187-A190 VanDerWaalsContact O-CB 3.28Å; V187-A190 WeakPolarHBondContact O-CB 3.18Å; V187-A190 PolarHBondContact O-N 3.37Å
191	D	96.6	Very high	90.9	Very high	109 Å²	109	70.1 Å²	70.1	58%	0.583	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	7.5	-178	-54.7	-51.8	0	0	0	112.9	T151 R153 C189	T151-D191 WeakPolarHBondContact CG2-O 3.33Å; R153-D191 WeakPolarHBondContact CD-OD1 3.39Å; R153-D191 IonicContact CZ-OD1 3.72Å; R153-D191 IonicContact NE-OD1 2.61Å; R153-D191 PolarHBondContact NE-OD1 3.37Å; C189-D191 VanDerWaalsContact C-N 3.27Å; C189-D191 PolarHBondContact O-N 2.99Å
192	S	96.4	Very high	91	Very high	56 Å²	56	71 Å²	71	39%	0.392	38%	0.378	S	S	.	.	S	Bend	trans	-83.3	145.2	172.1	-65.2	0	0	0	0	111	T151 V152 C189	T151-S192 WeakPolarHBondContact CA-O 3.3Å; T151-S192 WeakPolarHBondContact CB-O 3.36Å; V152-S192 PolarHBondContact N-O 2.99Å; C189-S192 WeakPolarHBondContact O-CB 3.27Å; C189-S192 PolarHBondContact O-N 3.47Å
193	I	95	Very high	90.9	Very high	66 Å²	66	66 Å²	66	34%	0.338	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-65.5	140.9	173.4	59.7	171.4	0	0	0	110.7	L150 T151 G195 V199 G201 I202	L150-I193 WeakPolarHBondContact O-CA 3.4Å; T151-I193 HydrophobicContact CG2-CG2 4.43Å; I193-G195 VanDerWaalsContact C-N 3.31Å; I193-G195 PolarHBondContact O-N 3.22Å; I193-V199 HydrophobicContact CD1-CG1 3.79Å; I193-G201 VanDerWaalsContact O-CA 3.25Å; I193-G201 WeakPolarHBondContact O-CA 3.35Å; I193-I202 PolarHBondContact O-N 2.87Å
194	V	95.3	Very high	91	Very high	2 Å²	2	62 Å²	62	1%	0.012	36%	0.36	C	S	.	.			trans	-64.9	-39.8	179.6	178.5	0	0	0	0	110.9	F146 L150 V152 I202 K207 L210	F146-V194 HydrophobicContact CB-CG1 3.74Å; F146-V194 HydrophobicContact CD2-CG1 4.02Å; F146-V194 HydrophobicContact CG-CG1 4.07Å; L150-V194 WeakPolarHBondContact O-CG2 3.14Å; L150-V194 PolarHBondContact O-N 2.7Å; V152-V194 HydrophobicContact CG2-CG2 4.31Å; V194-I202 HydrophobicContact CG1-CD1 4.14Å; V194-I202 HydrophobicContact CG1-CG1 4.43Å; V194-I202 PolarHBondContact O-N 3.47Å; V194-K207 HydrophobicContact CG1-CG 4.33Å; V194-L210 HydrophobicContact CB-CD2 4.47Å; V194-L210 HydrophobicContact CG1-CD2 4.08Å; V194-L210 HydrophobicContact CG2-CD2 3.51Å
195	G	91.3	Very high	91	Very high	2 Å²	2	61.8 Å²	61.8	2%	0.021	36%	0.36	C	S	.	.			trans	68.7	179.5	-179.5	0	0	0	0	0	114.2	S148 I193 V199	S148-G195 WeakPolarHBondContact CB-O 3.49Å; S148-G195 PolarHBondContact O-N 2.98Å; S148-G195 VanDerWaalsContact O-N 3.14Å; I193-G195 VanDerWaalsContact C-N 3.31Å; I193-G195 PolarHBondContact O-N 3.22Å; G195-V199 CarbonylContact C-O 3.45Å; G195-V199 WeakPolarHBondContact CA-O 3.13Å
196	D	86.4	Confident	91.1	Very high	64 Å²	64	62 Å²	62	34%	0.342	35%	0.35	S	S	.	.			trans	-148.7	-168.6	175.2	60.1	33.7	0	0	0	110	S148 K198 V199	S148-D196 VanDerWaalsContact CB-OD2 3.22Å; S148-D196 WeakPolarHBondContact CB-OD2 3.47Å; S148-D196 PolarHBondContact OG-OD2 3.45Å; D196-K198 PolarHBondContact O-N 3.3Å; D196-K198 WeakPolarHBondContact OD1-CA 3.18Å; D196-K198 WeakPolarHBondContact OD1-CB 3.22Å; D196-K198 PolarHBondContact OD1-N 3.47Å; D196-V199 PolarHBondContact N-O 2.86Å; D196-V199 CarbonylContact O-C 3.59Å; D196-V199 PolarHBondContact O-N 3.29Å; D196-V199 PolarHBondContact OD1-N 3.48Å
197	A	80.3	Confident	91	Very high	115 Å²	115	64 Å²	64	95%	0.95	36%	0.359	S	S	*	.	S	Bend	trans	-62.2	-21.1	178.7	0	0	0	0	0	114
198	K	77.8	Confident	90.8	Very high	178 Å²	178	60.9 Å²	60.9	77%	0.774	34%	0.339	S	S	*	.	S	Bend	trans	-98.6	-33.8	-179.8	-61.7	-175.4	177.7	-172	0	112.3	D196	D196-K198 PolarHBondContact O-N 3.3Å; D196-K198 WeakPolarHBondContact OD1-CA 3.18Å; D196-K198 WeakPolarHBondContact OD1-CB 3.22Å; D196-K198 PolarHBondContact OD1-N 3.47Å
199	V	81.5	Confident	90.7	Very high	44 Å²	44	54.2 Å²	54.2	27%	0.267	30%	0.302	S	S	.	.	S	Bend	trans	-113.2	110	-179.9	-178.2	0	0	0	0	108.4	I193 G195 D196 G201	I193-V199 HydrophobicContact CD1-CG1 3.79Å; G195-V199 CarbonylContact C-O 3.45Å; G195-V199 WeakPolarHBondContact CA-O 3.13Å; D196-V199 PolarHBondContact N-O 2.86Å; D196-V199 CarbonylContact O-C 3.59Å; D196-V199 PolarHBondContact O-N 3.29Å; D196-V199 PolarHBondContact OD1-N 3.48Å; V199-G201 PolarHBondContact O-N 3.35Å
200	R	88.5	Confident	90.6	Very high	239 Å²	239	54 Å²	54	90%	0.902	30%	0.3	S	S	*	.			trans	-54.9	129.7	175.8	-175	177.3	178.4	171.2	0.2	110.1
201	G	92.5	Very high	90.4	Very high	32 Å²	32	54 Å²	54	33%	0.33	30%	0.3	S	S	.	.			trans	-138.4	-139.4	174.1	0	0	0	0	0	110.9	I193 V199	I193-G201 VanDerWaalsContact O-CA 3.25Å; I193-G201 WeakPolarHBondContact O-CA 3.35Å; V199-G201 PolarHBondContact O-N 3.35Å
202	I	94.7	Very high	90.1	Very high	21 Å²	21	49 Å²	49	11%	0.108	27%	0.274	C	S	.	.	S	Bend	trans	-65.8	160.6	177.3	67.2	-177.5	0	0	0	112.2	V152 C189 I193 V194 E206 K207 L210	V152-I202 HydrophobicContact CG2-CD1 3.88Å; V152-I202 HydrophobicContact CG2-CG2 3.88Å; C189-I202 HydrophobicContact CB-CG2 3.94Å; I193-I202 PolarHBondContact O-N 2.87Å; V194-I202 HydrophobicContact CG1-CD1 4.14Å; V194-I202 HydrophobicContact CG1-CG1 4.43Å; V194-I202 PolarHBondContact O-N 3.47Å; I202-E206 HydrophobicContact CB-CB 4.03Å; I202-E206 HydrophobicContact CD1-CB 4.16Å; I202-E206 HydrophobicContact CG1-CB 4.28Å; I202-K207 HydrophobicContact CD1-CB 4.06Å; I202-K207 HydrophobicContact CD1-CG 4.37Å; I202-K207 HydrophobicContact CG1-CB 4.14Å; I202-L210 HydrophobicContact CD1-CD2 4.13Å
203	S	91.5	Very high	89.9	Confident	46 Å²	46	46.3 Å²	46.3	32%	0.322	26%	0.255	S	S	.	.			trans	-66.8	161.7	176.6	66.7	0	0	0	0	112.5	G205 E206 K207	S203-G205 VanDerWaalsContact C-N 3.31Å; S203-G205 PolarHBondContact O-N 3.19Å; S203-E206 WeakPolarHBondContact CB-OE2 3.2Å; S203-E206 PolarHBondContact N-OE2 3.24Å; S203-E206 PolarHBondContact O-N 3.49Å; S203-E206 WeakPolarHBondContact OG-CB 3.33Å; S203-E206 WeakPolarHBondContact OG-CG 3.2Å; S203-E206 PolarHBondContact OG-N 3.11Å; S203-E206 PolarHBondContact OG-OE2 3.29Å; S203-K207 WeakPolarHBondContact O-CB 3.44Å; S203-K207 PolarHBondContact O-N 2.95Å
204	G	88.8	Confident	89.7	Confident	44 Å²	44	43.9 Å²	43.9	45%	0.454	24%	0.243	S	C	.	.	H	α-helix	trans	-57.7	-41.7	177.5	0	0	0	0	0	113.2	K207 K208	G204-K207 WeakPolarHBondContact O-CB 3.28Å; G204-K207 PolarHBondContact O-N 3.42Å; G204-K208 PolarHBondContact O-N 2.94Å
205	G	87.7	Confident	89.3	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-67.3	-38.8	178.8	0	0	0	0	0	113	S203 K207 K208 R209 L232	S203-G205 VanDerWaalsContact C-N 3.31Å; S203-G205 PolarHBondContact O-N 3.19Å; G205-K207 VanDerWaalsContact C-N 3.35Å; G205-K208 PolarHBondContact O-N 3.27Å; G205-R209 WeakPolarHBondContact O-CG 3.37Å; G205-R209 PolarHBondContact O-N 3.47Å; G205-R209 VanDerWaalsContact O-N 3.09Å; G205-R209 PolarHBondContact O-NE 3.19Å; G205-L232 VanDerWaalsContact N-CD2 3.33Å
206	E	92.5	Very high	89	Confident	45 Å²	45	44.7 Å²	44.7	21%	0.21	25%	0.247	C	C	.	.	H	α-helix	trans	-65.9	-38.9	172	-70.5	164.8	146.3	0	0	111.5	L186 I202 S203 K208 R209 L210	L186-E206 HydrophobicContact CD2-CB 4.11Å; L186-E206 HydrophobicContact CD2-CG 4.41Å; I202-E206 HydrophobicContact CB-CB 4.03Å; I202-E206 HydrophobicContact CD1-CB 4.16Å; I202-E206 HydrophobicContact CG1-CB 4.28Å; S203-E206 WeakPolarHBondContact CB-OE2 3.2Å; S203-E206 PolarHBondContact N-OE2 3.24Å; S203-E206 PolarHBondContact O-N 3.49Å; S203-E206 WeakPolarHBondContact OG-CB 3.33Å; S203-E206 WeakPolarHBondContact OG-CG 3.2Å; S203-E206 PolarHBondContact OG-N 3.11Å; S203-E206 PolarHBondContact OG-OE2 3.29Å; E206-K208 PolarHBondContact O-N 2.94Å; E206-R209 PolarHBondContact O-N 2.98Å; E206-L210 WeakPolarHBondContact O-CB 3.33Å; E206-L210 PolarHBondContact O-N 3.27Å
207	K	93.2	Very high	89	Confident	43 Å²	43	41.6 Å²	41.6	19%	0.187	23%	0.23	C	C	.	.	H	α-helix	trans	-64	-40	177	-159.8	-179.6	-171.6	-172	0	112.2	D144 F146 V194 I202 S203 G204 G205 L210 S211	D144-K207 HydrophobicContact CB-CD 4.1Å; D144-K207 HydrophobicContact CB-CG 3.99Å; D144-K207 WeakPolarHBondContact O-CE 3.34Å; D144-K207 PolarHBondContact O-NZ 3.26Å; F146-K207 HydrophobicContact CD2-CD 4.5Å; F146-K207 HydrophobicContact CD2-CG 3.96Å; F146-K207 HydrophobicContact CE2-CG 3.99Å; V194-K207 HydrophobicContact CG1-CG 4.33Å; I202-K207 HydrophobicContact CD1-CB 4.06Å; I202-K207 HydrophobicContact CD1-CG 4.37Å; I202-K207 HydrophobicContact CG1-CB 4.14Å; S203-K207 WeakPolarHBondContact O-CB 3.44Å; S203-K207 PolarHBondContact O-N 2.95Å; G204-K207 WeakPolarHBondContact O-CB 3.28Å; G204-K207 PolarHBondContact O-N 3.42Å; G205-K207 VanDerWaalsContact C-N 3.35Å; K207-L210 WeakPolarHBondContact O-CB 3.06Å; K207-L210 PolarHBondContact O-N 2.81Å; K207-S211 PolarHBondContact O-N 3.38Å
208	K	91	Very high	88.9	Confident	5 Å²	5	37.6 Å²	37.6	2%	0.022	20%	0.197	C	C	.	.	H	α-helix	trans	-64.6	-43	174	-175.2	67	76.8	-161.9	0	111.5	V140 R141 Q142 D144 G204 G205 E206 L210 S211 L212 P228 V240	V140-K208 HydrophobicContact CG1-CD 4.2Å; R141-K208 PolarHBondContact O-NZ 3.45Å; Q142-K208 PolarHBondContact O-NZ 3.3Å; D144-K208 IonicContact OD1-NZ 3.41Å; D144-K208 PolarHBondContact OD1-NZ 2.84Å; D144-K208 WeakPolarHBondContact OD2-CE 3.37Å; D144-K208 IonicContact OD2-NZ 3.37Å; D144-K208 PolarHBondContact OD2-NZ 2.91Å; G204-K208 PolarHBondContact O-N 2.94Å; G205-K208 PolarHBondContact O-N 3.27Å; E206-K208 PolarHBondContact O-N 2.94Å; K208-L210 VanDerWaalsContact C-N 3.33Å; K208-L210 PolarHBondContact O-N 3.38Å; K208-S211 WeakPolarHBondContact O-CA 3.18Å; K208-S211 WeakPolarHBondContact O-CB 3.24Å; K208-S211 PolarHBondContact O-N 3.31Å; K208-S211 VanDerWaalsContact O-N 3.11Å; K208-L212 PolarHBondContact O-N 3.44Å; K208-P228 VanDerWaalsContact CE-O 3.27Å; K208-P228 WeakPolarHBondContact CE-O 3.27Å; K208-P228 WeakPolarHBondContact CG-O 3.31Å; K208-V240 HydrophobicContact CB-CG2 4.23Å; K208-V240 HydrophobicContact CG-CG1 3.93Å; K208-V240 HydrophobicContact CG-CG2 4.12Å
209	R	91.8	Very high	88.9	Confident	21 Å²	21	32.2 Å²	32.2	8%	0.079	18%	0.182	C	C	.	.	H	α-helix	trans	-64.6	-34.8	174.3	-71.9	-177.5	-69.7	147.2	-4.2	112.6	L184 G185 L186 G205 E206 S211 L212 A213 V240	L184-R209 WeakPolarHBondContact O-CD 3.42Å; L184-R209 PolarHBondContact O-NH1 2.82Å; G185-R209 PolarHBondContact O-NH1 3.33Å; L186-R209 HydrophobicContact CD1-CB 4.35Å; L186-R209 HydrophobicContact CD2-CB 4Å; L186-R209 HydrophobicContact CG-CB 4.31Å; G205-R209 WeakPolarHBondContact O-CG 3.37Å; G205-R209 PolarHBondContact O-N 3.47Å; G205-R209 VanDerWaalsContact O-N 3.09Å; G205-R209 PolarHBondContact O-NE 3.19Å; E206-R209 PolarHBondContact O-N 2.98Å; R209-S211 VanDerWaalsContact C-N 3.34Å; R209-L212 PolarHBondContact O-N 3.33Å; R209-A213 WeakPolarHBondContact O-CB 3.47Å; R209-A213 PolarHBondContact O-N 3.05Å; R209-V240 HydrophobicContact CG-CG2 4.06Å
210	L	94.8	Very high	89.1	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.5	-35.9	170.8	172.4	63.4	0	0	0	112.2	F146 V152 T155 L156 L186 V194 I202 E206 K207 K208 A213 C214	F146-L210 HydrophobicContact CD1-CD2 4.31Å; F146-L210 HydrophobicContact CD2-CD2 4.32Å; F146-L210 HydrophobicContact CE1-CD2 4.12Å; F146-L210 HydrophobicContact CE1-CG 3.99Å; F146-L210 HydrophobicContact CE2-CD2 4.11Å; F146-L210 HydrophobicContact CE2-CG 4.18Å; F146-L210 HydrophobicContact CG-CD2 4.4Å; F146-L210 HydrophobicContact CZ-CB 4.36Å; F146-L210 HydrophobicContact CZ-CD2 4Å; F146-L210 HydrophobicContact CZ-CG 3.71Å; V152-L210 HydrophobicContact CG1-CD1 3.88Å; V152-L210 HydrophobicContact CG2-CD2 4.35Å; T155-L210 HydrophobicContact CG2-CD1 4.38Å; L156-L210 HydrophobicContact CD1-CD1 4.19Å; L156-L210 HydrophobicContact CD2-CD1 3.79Å; L156-L210 HydrophobicContact CG-CD1 3.74Å; L186-L210 HydrophobicContact CD1-CB 4.3Å; V194-L210 HydrophobicContact CB-CD2 4.47Å; V194-L210 HydrophobicContact CG1-CD2 4.08Å; V194-L210 HydrophobicContact CG2-CD2 3.51Å; I202-L210 HydrophobicContact CD1-CD2 4.13Å; E206-L210 WeakPolarHBondContact O-CB 3.33Å; E206-L210 PolarHBondContact O-N 3.27Å; K207-L210 WeakPolarHBondContact O-CB 3.06Å; K207-L210 PolarHBondContact O-N 2.81Å; K208-L210 VanDerWaalsContact C-N 3.33Å; K208-L210 PolarHBondContact O-N 3.38Å; L210-A213 WeakPolarHBondContact O-CB 3.25Å; L210-A213 PolarHBondContact O-N 3.4Å; L210-C214 PolarHBondContact O-N 3.01Å; L210-C214 PolarHBondContact O-SG 3.22Å
211	S	91.9	Very high	89	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.2	-51	172.8	-150.8	0	0	0	0	111	D144 K207 K208 R209 A213 C214 E215	D144-S211 WeakPolarHBondContact OD1-CB 3.35Å; D144-S211 PolarHBondContact OD1-OG 2.93Å; K207-S211 PolarHBondContact O-N 3.38Å; K208-S211 WeakPolarHBondContact O-CA 3.18Å; K208-S211 WeakPolarHBondContact O-CB 3.24Å; K208-S211 PolarHBondContact O-N 3.31Å; K208-S211 VanDerWaalsContact O-N 3.11Å; R209-S211 VanDerWaalsContact C-N 3.34Å; S211-A213 VanDerWaalsContact C-N 3.34Å; S211-A213 PolarHBondContact O-N 3.46Å; S211-C214 PolarHBondContact O-N 2.82Å; S211-E215 PolarHBondContact O-N 3.39Å
212	L	90.3	Very high	89	Confident	5 Å²	5	17.7 Å²	17.7	3%	0.026	11%	0.114	C	C	.	.	H	α-helix	trans	-56.9	-46.9	173.6	-176	62.1	0	0	0	111.6	V140 L184 K208 R209 C214 E215 L216 I223 T243 L244 L247	V140-L212 HydrophobicContact CG2-CB 4.33Å; V140-L212 HydrophobicContact CG2-CD1 3.75Å; L184-L212 HydrophobicContact CD2-CD2 4.16Å; K208-L212 PolarHBondContact O-N 3.44Å; R209-L212 PolarHBondContact O-N 3.33Å; L212-C214 VanDerWaalsContact C-N 3.32Å; L212-C214 PolarHBondContact O-N 3.41Å; L212-E215 PolarHBondContact O-N 2.78Å; L212-E215 VanDerWaalsContact O-N 3.07Å; L212-L216 HydrophobicContact CD1-CD1 4.36Å; L212-L216 HydrophobicContact CD1-CG 4.42Å; L212-L216 HydrophobicContact CG-CD1 3.94Å; L212-L216 HydrophobicContact CG-CG 4.43Å; L212-L216 WeakPolarHBondContact O-CG 3.3Å; L212-L216 PolarHBondContact O-N 3.4Å; L212-I223 HydrophobicContact CD1-CG2 4Å; L212-T243 HydrophobicContact CD2-CG2 3.72Å; L212-L244 HydrophobicContact CD1-CD2 3.83Å; L212-L244 HydrophobicContact CD2-CD2 3.89Å; L212-L247 HydrophobicContact CD1-CD1 4Å; L212-L247 HydrophobicContact CD2-CD1 3.7Å; L212-L247 HydrophobicContact CG-CD1 4.05Å
213	A	92.2	Very high	88.9	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-53.8	-46.9	175.8	0	0	0	0	0	112.4	L156 L180 L184 L186 R209 L210 S211 E215 L216 I217	L156-A213 HydrophobicContact CD1-CB 4.11Å; L156-A213 HydrophobicContact CD2-CB 3.48Å; L156-A213 VanDerWaalsContact CD2-CB 3.48Å; L156-A213 HydrophobicContact CG-CB 4.42Å; L180-A213 HydrophobicContact CD2-CB 4.1Å; L180-A213 WeakPolarHBondContact CD2-O 2.97Å; L180-A213 HydrophobicContact CG-CB 4.31Å; L184-A213 HydrophobicContact CD1-CB 3.19Å; L186-A213 HydrophobicContact CD1-CB 4.3Å; R209-A213 WeakPolarHBondContact O-CB 3.47Å; R209-A213 PolarHBondContact O-N 3.05Å; L210-A213 WeakPolarHBondContact O-CB 3.25Å; L210-A213 PolarHBondContact O-N 3.4Å; S211-A213 VanDerWaalsContact C-N 3.34Å; S211-A213 PolarHBondContact O-N 3.46Å; A213-E215 PolarHBondContact O-N 2.99Å; A213-L216 PolarHBondContact O-N 3Å; A213-L216 VanDerWaalsContact O-N 3.16Å; A213-I217 WeakPolarHBondContact O-CG1 3.41Å; A213-I217 PolarHBondContact O-N 3.45Å
214	C	89.8	Confident	89.1	Confident	14 Å²	14	14.5 Å²	14.5	10%	0.095	9%	0.094	C	C	.	.	H	α-helix	trans	-63.8	-29.2	-179.8	-69.9	0	0	0	0	113.2	L210 S211 L212	L210-C214 PolarHBondContact O-N 3.01Å; L210-C214 PolarHBondContact O-SG 3.22Å; S211-C214 PolarHBondContact O-N 2.82Å; L212-C214 VanDerWaalsContact C-N 3.32Å; L212-C214 PolarHBondContact O-N 3.41Å
215	E	86.6	Confident	89.4	Confident	13 Å²	13	12.5 Å²	12.5	6%	0.061	7%	0.072	C	C	.	.	H	α-helix	trans	-79.2	-33.7	174.5	-56.5	-52.8	145.5	0	0	112.4	A138 V140 S211 L212 A213 I217 K465	A138-E215 HydrophobicContact CB-CB 3.56Å; A138-E215 HydrophobicContact CB-CG 4.44Å; V140-E215 HydrophobicContact CG2-CB 4.37Å; V140-E215 HydrophobicContact CG2-CG 3.76Å; S211-E215 PolarHBondContact O-N 3.39Å; L212-E215 PolarHBondContact O-N 2.78Å; L212-E215 VanDerWaalsContact O-N 3.07Å; A213-E215 PolarHBondContact O-N 2.99Å; E215-I217 VanDerWaalsContact C-N 3.29Å; E215-I217 PolarHBondContact O-N 3.02Å; E215-K465 IonicContact OE1-NZ 2.73Å; E215-K465 PolarHBondContact OE1-NZ 3.28Å; E215-K465 VanDerWaalsContact OE2-CE 3.23Å; E215-K465 WeakPolarHBondContact OE2-CE 3.1Å; E215-K465 IonicContact OE2-NZ 3.59Å; E215-K465 PolarHBondContact OE2-NZ 3.26Å
216	L	86.3	Confident	89.7	Confident	8 Å²	8	13 Å²	13	4%	0.042	8%	0.075	C	C	.	.	H	α-helix	trans	-72.9	-16.5	-179.1	-71.4	173.2	0	0	0	114.2	Y176 L180 L184 L212 A213 A218 S219 P220 I223 L247	Y176-L216 PolarHBondContact OH-O 3.07Å; Y176-L216 VanDerWaalsContact OH-O 3.09Å; L180-L216 HydrophobicContact CD1-CB 3.97Å; L180-L216 HydrophobicContact CD1-CD1 4.09Å; L184-L216 HydrophobicContact CD1-CD1 4.16Å; L184-L216 HydrophobicContact CD2-CD1 4.02Å; L212-L216 HydrophobicContact CD1-CD1 4.36Å; L212-L216 HydrophobicContact CD1-CG 4.42Å; L212-L216 HydrophobicContact CG-CD1 3.94Å; L212-L216 HydrophobicContact CG-CG 4.43Å; L212-L216 WeakPolarHBondContact O-CG 3.3Å; L212-L216 PolarHBondContact O-N 3.4Å; A213-L216 PolarHBondContact O-N 3Å; A213-L216 VanDerWaalsContact O-N 3.16Å; L216-A218 PolarHBondContact O-N 3.4Å; L216-A218 VanDerWaalsContact O-N 3.15Å; L216-S219 PolarHBondContact O-N 3.48Å; L216-P220 HydrophobicContact CD2-CG 4Å; L216-I223 HydrophobicContact CD2-CD1 3.56Å; L216-I223 HydrophobicContact CD2-CG1 4.27Å; L216-L247 HydrophobicContact CD1-CD1 3.76Å; L216-L247 HydrophobicContact CD1-CD2 3.77Å; L216-L247 HydrophobicContact CD1-CG 4.43Å; L216-L247 HydrophobicContact CD2-CD1 4.27Å; L216-L247 HydrophobicContact CD2-CD2 4.03Å
217	I	85.2	Confident	89.7	Confident	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-31.6	178.8	-73.8	168.9	0	0	0	112.5	L156 A159 A160 Q163 L164 L180 A213 E215 S219	L156-I217 HydrophobicContact CB-CD1 4.45Å; L156-I217 HydrophobicContact CD2-CD1 3.84Å; L156-I217 WeakPolarHBondContact O-CD1 3.42Å; A159-I217 HydrophobicContact CB-CD1 3.35Å; A160-I217 HydrophobicContact CB-CG2 4.19Å; Q163-I217 HydrophobicContact CB-CG2 3.98Å; L164-I217 HydrophobicContact CD2-CG2 4.43Å; L164-I217 VanDerWaalsContact CD2-O 3.22Å; L164-I217 WeakPolarHBondContact CD2-O 3.41Å; L164-I217 HydrophobicContact CG-CG2 4.15Å; L180-I217 HydrophobicContact CD2-CG1 3.78Å; A213-I217 WeakPolarHBondContact O-CG1 3.41Å; A213-I217 PolarHBondContact O-N 3.45Å; E215-I217 VanDerWaalsContact C-N 3.29Å; E215-I217 PolarHBondContact O-N 3.02Å; I217-S219 PolarHBondContact O-N 2.68Å
218	A	77.8	Confident	89.7	Confident	30 Å²	30	10.1 Å²	10.1	25%	0.248	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-5.6	178.4	0	0	0	0	0	113.6	K136 L216	K136-A218 HydrophobicContact CD-CB 4.45Å; K136-A218 WeakPolarHBondContact CD-O 3.31Å; K136-A218 PolarHBondContact NZ-O 2.87Å; L216-A218 PolarHBondContact O-N 3.4Å; L216-A218 VanDerWaalsContact O-N 3.15Å
219	S	78.8	Confident	89.7	Confident	65 Å²	65	11 Å²	11	46%	0.455	7%	0.068	S	C	.	.			trans	52.8	64.1	-168.8	-46	0	0	0	0	111.1	Y176 L216 I217	Y176-S219 PolarHBondContact OH-OG 3.44Å; L216-S219 PolarHBondContact O-N 3.48Å; I217-S219 PolarHBondContact O-N 2.68Å
220	P	84.8	Confident	89.5	Confident	2 Å²	2	13 Å²	13	1%	0.013	8%	0.083	C	C	.	.			trans	-71.8	149.9	-179.2	34.1	-38.2	0	0	0	111.1	K136 A138 L216 I223 H252	K136-P220 HydrophobicContact CB-CB 4.46Å; K136-P220 VanDerWaalsContact O-CA 3.31Å; K136-P220 WeakPolarHBondContact O-CA 3.1Å; K136-P220 WeakPolarHBondContact O-CB 3.46Å; A138-P220 HydrophobicContact CB-CB 3.82Å; A138-P220 HydrophobicContact CB-CG 3.59Å; L216-P220 HydrophobicContact CD2-CG 4Å; P220-I223 HydrophobicContact CG-CG1 4.19Å; P220-H252 PolarHBondContact O-CE1 3.03Å; P220-H252 PolarHBondContact O-ND1 3.47Å
221	S	86.9	Confident	89.1	Confident	9 Å²	9	17 Å²	17	6%	0.063	12%	0.123	C	C	.	.	S	Bend	trans	-85.3	-27.5	169.1	-60.6	0	0	0	0	111.9	P52 V54 K136 H252 T253	P52-S221 WeakPolarHBondContact CG-OG 3.45Å; P52-S221 PolarHBondContact O-OG 2.93Å; V54-S221 VanDerWaalsContact CG2-CB 3.47Å; K136-S221 PolarHBondContact O-N 2.52Å; S221-H252 WeakPolarHBondContact O-CA 3.23Å; S221-T253 PolarHBondContact O-N 2.88Å
222	I	92.1	Very high	88.9	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.6	-175.4	-57.7	155.1	0	0	0	108.9	V54 I56 I125 I137 A138 F224 T253	V54-I222 HydrophobicContact CB-CG1 4.19Å; V54-I222 HydrophobicContact CG1-CD1 3.62Å; V54-I222 HydrophobicContact CG1-CG1 3.75Å; I56-I222 HydrophobicContact CD1-CB 4.27Å; I56-I222 HydrophobicContact CD1-CD1 3.55Å; I56-I222 HydrophobicContact CD1-CG1 3.8Å; I56-I222 HydrophobicContact CD1-CG2 3.47Å; I56-I222 VanDerWaalsContact CD1-CG2 3.47Å; I56-I222 HydrophobicContact CG1-CD1 3.91Å; I56-I222 HydrophobicContact CG1-CG1 4.27Å; I125-I222 HydrophobicContact CD1-CD1 4.49Å; I137-I222 HydrophobicContact CD1-CD1 4.49Å; I137-I222 HydrophobicContact CG1-CB 4.29Å; I137-I222 HydrophobicContact CG1-CD1 4.01Å; A138-I222 PolarHBondContact N-O 3.43Å; I222-F224 HydrophobicContact CB-CE2 4.48Å; I222-F224 HydrophobicContact CG2-CD2 3.86Å; I222-F224 HydrophobicContact CG2-CE2 3.32Å; I222-F224 HydrophobicContact CG2-CZ 3.72Å; I222-T253 CarbonylContact C-O 3.52Å; I222-T253 WeakPolarHBondContact CA-O 3.49Å
223	I	93.6	Very high	88.9	Confident	0 Å²	0	23 Å²	23	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	119	178.7	-55.4	170.2	0	0	0	108.9	A138 L212 L216 P220 L244 L247 H252 T253 V254 I255	A138-I223 HydrophobicContact CB-CB 4.45Å; A138-I223 HydrophobicContact CB-CG1 4.2Å; A138-I223 HydrophobicContact CB-CG2 4.34Å; L212-I223 HydrophobicContact CD1-CG2 4Å; L216-I223 HydrophobicContact CD2-CD1 3.56Å; L216-I223 HydrophobicContact CD2-CG1 4.27Å; P220-I223 HydrophobicContact CG-CG1 4.19Å; I223-L244 HydrophobicContact CG2-CD2 4.49Å; I223-L247 HydrophobicContact CD1-CB 4Å; I223-L247 HydrophobicContact CD1-CD1 3.99Å; I223-L247 HydrophobicContact CD1-CG 4.41Å; I223-H252 HydrophobicContact CD1-CB 3.88Å; I223-H252 HydrophobicContact CG1-CB 4.42Å; I223-T253 PolarHBondContact N-O 2.83Å; I223-V254 HydrophobicContact CB-CG1 4.33Å; I223-V254 HydrophobicContact CB-CG2 4.32Å; I223-V254 HydrophobicContact CD1-CG2 4.23Å; I223-V254 HydrophobicContact CG2-CG1 4.44Å; I223-V254 WeakPolarHBondContact O-CA 3.49Å; I223-I255 PolarHBondContact O-N 3.01Å
224	F	95.1	Very high	88.6	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	131.9	169.1	-63.5	-85.2	0	0	0	109.7	I56 L104 L107 A108 I137 A138 Y139 V140 I222 I255	I56-F224 HydrophobicContact CD1-CZ 3.87Å; L104-F224 HydrophobicContact CD1-CB 4.31Å; L104-F224 HydrophobicContact CD1-CD1 3.71Å; L104-F224 HydrophobicContact CD1-CG 4.5Å; L104-F224 HydrophobicContact CG-CB 4.38Å; L104-F224 HydrophobicContact CG-CD1 4.21Å; L107-F224 HydrophobicContact CB-CD1 4.47Å; L107-F224 HydrophobicContact CB-CE1 3.48Å; L107-F224 VanDerWaalsContact CB-CE1 3.48Å; L107-F224 HydrophobicContact CB-CZ 3.8Å; L107-F224 HydrophobicContact CD1-CE1 4.36Å; A108-F224 HydrophobicContact CB-CB 4.35Å; A108-F224 HydrophobicContact CB-CD1 4.33Å; A108-F224 HydrophobicContact CB-CD2 3.65Å; A108-F224 HydrophobicContact CB-CE2 3.93Å; A108-F224 HydrophobicContact CB-CG 3.87Å; A108-F224 HydrophobicContact CB-CZ 4.38Å; I137-F224 HydrophobicContact CD1-CE2 4.45Å; I137-F224 HydrophobicContact CG2-CD2 3.39Å; I137-F224 HydrophobicContact CG2-CE2 3.43Å; I137-F224 VanDerWaalsContact CG2-CE2 3.43Å; A138-F224 PolarHBondContact O-N 2.94Å; Y139-F224 WeakPolarHBondContact CA-O 3.36Å; Y139-F224 HydrophobicContact CD2-CB 3.53Å; Y139-F224 HydrophobicContact CD2-CG 4.26Å; Y139-F224 HydrophobicContact CE2-CB 4Å; Y139-F224 HydrophobicContact CG-CB 4.49Å; V140-F224 PolarHBondContact N-O 3.43Å; I222-F224 HydrophobicContact CB-CE2 4.48Å; I222-F224 HydrophobicContact CG2-CD2 3.86Å; I222-F224 HydrophobicContact CG2-CE2 3.32Å; I222-F224 HydrophobicContact CG2-CZ 3.72Å; F224-I255 CarbonylContact C-O 3.52Å; F224-I255 VanDerWaalsContact CA-O 3.26Å; F224-I255 WeakPolarHBondContact CA-O 3.28Å; F224-I255 HydrophobicContact CD1-CB 3.93Å; F224-I255 HydrophobicContact CD1-CD1 4.03Å; F224-I255 HydrophobicContact CD1-CG2 4.36Å; F224-I255 HydrophobicContact CE1-CB 4.22Å; F224-I255 HydrophobicContact CE1-CD1 3.42Å; F224-I255 VanDerWaalsContact CE1-CD1 3.42Å; F224-I255 HydrophobicContact CE1-CG1 4.36Å; F224-I255 HydrophobicContact CZ-CD1 4.07Å
225	A	94.8	Very high	88.6	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	114.6	176.5	0	0	0	0	0	111.5	V140 E227 P228 L244 I255 C256 S257	V140-A225 HydrophobicContact CB-CB 4.28Å; A225-E227 PolarHBondContact O-N 3.01Å; A225-P228 HydrophobicContact CB-CB 4.2Å; A225-P228 HydrophobicContact CB-CG 4.13Å; A225-L244 HydrophobicContact CB-CD1 4.11Å; A225-L244 HydrophobicContact CB-CD2 4.41Å; A225-I255 PolarHBondContact N-O 3.24Å; A225-C256 HydrophobicContact CB-CB 3.96Å; A225-C256 CarbonylContact O-C 3.58Å; A225-C256 WeakPolarHBondContact O-CA 3.32Å; A225-C256 WeakPolarHBondContact O-CB 3.28Å; A225-S257 PolarHBondContact O-N 3.21Å
226	D	93.5	Very high	88.7	Confident	11 Å²	11	30.5 Å²	30.5	6%	0.059	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	108.5	-178.3	-160.1	9.7	0	0	0	110.3	T101 L104 Y139 V140 Q142 S257	T101-D226 VanDerWaalsContact CG2-OD2 3.27Å; T101-D226 WeakPolarHBondContact CG2-OD2 3.46Å; T101-D226 PolarHBondContact OG1-OD1 3.07Å; T101-D226 VanDerWaalsContact OG1-OD1 3.14Å; L104-D226 VanDerWaalsContact CD2-CA 3.5Å; L104-D226 HydrophobicContact CD2-CB 3.61Å; Y139-D226 PolarHBondContact OH-OD2 2.81Å; Y139-D226 VanDerWaalsContact OH-OD2 3.1Å; V140-D226 PolarHBondContact O-N 2.78Å; Q142-D226 WeakPolarHBondContact CA-O 3.21Å; Q142-D226 PolarHBondContact N-O 2.91Å; D226-S257 VanDerWaalsContact CA-OG 3.32Å; D226-S257 WeakPolarHBondContact CA-OG 3.45Å; D226-S257 PolarHBondContact OD1-OG 3.34Å
227	E	92.5	Very high	88.9	Confident	27 Å²	27	30.6 Å²	30.6	13%	0.126	19%	0.194	C	C	.	.	S	Bend	trans	45.4	60.8	-178.3	-64.6	-164.8	177.2	0	0	113.8	Q142 A225 T229 T230 S257	Q142-E227 HydrophobicContact CG-CB 4.23Å; Q142-E227 PolarHBondContact NE2-OE2 2.86Å; A225-E227 PolarHBondContact O-N 3.01Å; E227-T229 PolarHBondContact O-N 3.48Å; E227-T229 VanDerWaalsContact O-N 3.1Å; E227-T230 WeakPolarHBondContact CB-OG1 3.3Å; E227-T230 PolarHBondContact O-N 3.37Å; E227-T230 PolarHBondContact OE2-OG1 3.3Å; E227-S257 VanDerWaalsContact CA-O 3.26Å; E227-S257 WeakPolarHBondContact CA-O 3.42Å; E227-S257 PolarHBondContact N-O 3.2Å; E227-S257 PolarHBondContact N-OG 2.8Å
228	P	92.9	Very high	89.2	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.013	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-19.4	-172.8	26.8	-34.2	0	0	0	113.6	K208 A225 V240 M241 L244 C256 S257	K208-P228 VanDerWaalsContact CE-O 3.27Å; K208-P228 WeakPolarHBondContact CE-O 3.27Å; K208-P228 WeakPolarHBondContact CG-O 3.31Å; A225-P228 HydrophobicContact CB-CB 4.2Å; A225-P228 HydrophobicContact CB-CG 4.13Å; P228-V240 HydrophobicContact CB-CG1 3.95Å; P228-M241 HydrophobicContact CG-SD 3.81Å; P228-L244 HydrophobicContact CB-CD1 4.08Å; P228-L244 HydrophobicContact CG-CD1 3.86Å; P228-C256 HydrophobicContact CG-CB 4.13Å; P228-S257 VanDerWaalsContact CD-O 3.3Å; P228-S257 WeakPolarHBondContact CD-O 3.31Å
229	T	92	Very high	89.8	Confident	23 Å²	23	35.7 Å²	35.7	14%	0.141	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-7.5	-178.6	57	0	0	0	0	114	E227 G231 L232 A237 M241 I258	E227-T229 PolarHBondContact O-N 3.48Å; E227-T229 VanDerWaalsContact O-N 3.1Å; T229-G231 PolarHBondContact O-N 3.33Å; T229-L232 PolarHBondContact O-N 2.96Å; T229-A237 HydrophobicContact CG2-CB 3.83Å; T229-M241 HydrophobicContact CG2-CG 3.59Å; T229-M241 HydrophobicContact CG2-SD 3.72Å; T229-I258 HydrophobicContact CG2-CD1 3.98Å
230	T	88.7	Confident	90.4	Very high	64 Å²	64	32.7 Å²	32.7	39%	0.393	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	133.3	-175.1	-71.7	0	0	0	0	111.4	E227 L232	E227-T230 WeakPolarHBondContact CB-OG1 3.3Å; E227-T230 PolarHBondContact O-N 3.37Å; E227-T230 PolarHBondContact OE2-OG1 3.3Å; T230-L232 VanDerWaalsContact C-N 3.26Å; T230-L232 PolarHBondContact O-N 3.42Å
231	G	85.5	Confident	90.9	Very high	82 Å²	82	32.6 Å²	32.6	85%	0.845	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	76	7.5	-180	0	0	0	0	0	115	T229	T229-G231 PolarHBondContact O-N 3.33Å
232	L	88.2	Confident	91.2	Very high	35 Å²	35	36.3 Å²	36.3	18%	0.183	21%	0.206	C	C	.	.			trans	-100.4	149.3	176.3	-59	-175.9	0	0	0	111.2	G205 T229 T230 Q236 A237 V240	G205-L232 VanDerWaalsContact N-CD2 3.33Å; T229-L232 PolarHBondContact O-N 2.96Å; T230-L232 VanDerWaalsContact C-N 3.26Å; T230-L232 PolarHBondContact O-N 3.42Å; L232-Q236 HydrophobicContact CB-CB 4.25Å; L232-Q236 HydrophobicContact CD1-CB 4.48Å; L232-A237 HydrophobicContact CB-CB 4.2Å; L232-V240 HydrophobicContact CD1-CG2 3.84Å
233	D	88.7	Confident	91.1	Very high	97 Å²	97	36.9 Å²	36.9	52%	0.519	21%	0.21	S	C	.	.			trans	-64.9	163.1	160.8	72.2	48.5	0	0	0	110	F235 Q236 A237	D233-F235 VanDerWaalsContact C-N 3.29Å; D233-F235 PolarHBondContact O-N 2.95Å; D233-F235 PolarHBondContact OD1-N 3.04Å; D233-Q236 PolarHBondContact O-N 3.46Å; D233-Q236 WeakPolarHBondContact OD1-CB 3.47Å; D233-Q236 WeakPolarHBondContact OD1-CG 3.36Å; D233-Q236 PolarHBondContact OD1-N 3.04Å; D233-A237 WeakPolarHBondContact O-CB 3.42Å; D233-A237 PolarHBondContact O-N 3.34Å
234	A	87	Confident	91.2	Very high	27 Å²	27	37 Å²	37	22%	0.223	21%	0.21	C	C	.	.	H	α-helix	trans	-62.1	-35	-174	0	0	0	0	0	114.7	E238 R262	A234-E238 WeakPolarHBondContact O-CB 3.21Å; A234-E238 PolarHBondContact O-N 3.36Å; A234-R262 VanDerWaalsContact CB-NE 3.3Å
235	F	88.7	Confident	91.1	Very high	123 Å²	123	41.2 Å²	41.2	54%	0.539	23%	0.226	S	C	.	.	H	α-helix	trans	-72.3	-42	-178.3	175.4	-109	0	0	0	111	D233 E238 K239	D233-F235 VanDerWaalsContact C-N 3.29Å; D233-F235 PolarHBondContact O-N 2.95Å; D233-F235 PolarHBondContact OD1-N 3.04Å; F235-E238 PolarHBondContact O-N 3.03Å; F235-K239 HydrophobicContact CE1-CD 4.13Å; F235-K239 HydrophobicContact CZ-CD 4.3Å; F235-K239 PolarHBondContact O-N 3.33Å
236	Q	89.2	Confident	91	Very high	34 Å²	34	45.1 Å²	45.1	16%	0.159	24%	0.244	C	C	.	.	H	α-helix	trans	-67.9	-39.8	174.6	-63.9	-59.2	-32.6	0	0	111.5	L232 D233 E238 K239 V240	L232-Q236 HydrophobicContact CB-CB 4.25Å; L232-Q236 HydrophobicContact CD1-CB 4.48Å; D233-Q236 PolarHBondContact O-N 3.46Å; D233-Q236 WeakPolarHBondContact OD1-CB 3.47Å; D233-Q236 WeakPolarHBondContact OD1-CG 3.36Å; D233-Q236 PolarHBondContact OD1-N 3.04Å; Q236-E238 VanDerWaalsContact C-N 3.33Å; Q236-E238 PolarHBondContact O-N 2.9Å; Q236-K239 PolarHBondContact O-N 2.92Å; Q236-V240 WeakPolarHBondContact O-CG2 3.23Å; Q236-V240 PolarHBondContact O-N 3.47Å
237	A	91.1	Very high	90.9	Very high	10 Å²	10	45.2 Å²	45.2	8%	0.083	25%	0.245	C	C	.	.	H	α-helix	trans	-58.1	-46.4	174	0	0	0	0	0	111.2	T229 L232 D233 K239 V240 M241	T229-A237 HydrophobicContact CG2-CB 3.83Å; L232-A237 HydrophobicContact CB-CB 4.2Å; D233-A237 WeakPolarHBondContact O-CB 3.42Å; D233-A237 PolarHBondContact O-N 3.34Å; A237-K239 PolarHBondContact O-N 3.37Å; A237-V240 PolarHBondContact O-N 2.99Å; A237-M241 VanDerWaalsContact O-CG 3.32Å; A237-M241 WeakPolarHBondContact O-CG 3.5Å; A237-M241 PolarHBondContact O-N 2.96Å
238	E	92.2	Very high	91	Very high	64 Å²	64	44 Å²	44	30%	0.299	24%	0.239	S	C	.	.	H	α-helix	trans	-61.4	-42.8	178.7	-174.2	167.2	175.7	0	0	112.7	A234 F235 Q236 V240 M241 E242 S264 V265 K268	A234-E238 WeakPolarHBondContact O-CB 3.21Å; A234-E238 PolarHBondContact O-N 3.36Å; F235-E238 PolarHBondContact O-N 3.03Å; Q236-E238 VanDerWaalsContact C-N 3.33Å; Q236-E238 PolarHBondContact O-N 2.9Å; E238-V240 PolarHBondContact O-N 3.45Å; E238-M241 PolarHBondContact O-N 3.23Å; E238-E242 WeakPolarHBondContact O-CB 3.28Å; E238-E242 PolarHBondContact O-N 3.1Å; E238-S264 PolarHBondContact OE2-OG 3.04Å; E238-V265 HydrophobicContact CB-CG2 4.49Å; E238-K268 IonicContact OE1-NZ 2.98Å
239	K	89.9	Confident	91	Very high	73 Å²	73	49.5 Å²	49.5	32%	0.317	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-40.5	175.7	-75.8	-179.5	174.7	-178.2	0	113.4	F235 Q236 A237 M241 E242 T243	F235-K239 HydrophobicContact CE1-CD 4.13Å; F235-K239 HydrophobicContact CZ-CD 4.3Å; F235-K239 PolarHBondContact O-N 3.33Å; Q236-K239 PolarHBondContact O-N 2.92Å; A237-K239 PolarHBondContact O-N 3.37Å; K239-M241 VanDerWaalsContact C-N 3.3Å; K239-E242 PolarHBondContact O-N 2.88Å; K239-T243 PolarHBondContact O-N 3.38Å; K239-T243 PolarHBondContact O-OG1 2.95Å
240	V	92.1	Very high	90.9	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-62.4	-43.1	175.4	171.3	0	0	0	0	110	K208 R209 P228 L232 Q236 A237 E238 T243 L244	K208-V240 HydrophobicContact CB-CG2 4.23Å; K208-V240 HydrophobicContact CG-CG1 3.93Å; K208-V240 HydrophobicContact CG-CG2 4.12Å; R209-V240 HydrophobicContact CG-CG2 4.06Å; P228-V240 HydrophobicContact CB-CG1 3.95Å; L232-V240 HydrophobicContact CD1-CG2 3.84Å; Q236-V240 WeakPolarHBondContact O-CG2 3.23Å; Q236-V240 PolarHBondContact O-N 3.47Å; A237-V240 PolarHBondContact O-N 2.99Å; E238-V240 PolarHBondContact O-N 3.45Å; V240-T243 WeakPolarHBondContact O-CB 3.21Å; V240-T243 PolarHBondContact O-N 2.9Å; V240-L244 PolarHBondContact O-N 3.39Å
241	M	94.2	Very high	91.1	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-69.9	-35.2	179.6	-65.9	-54.8	-50.2	0	0	113	L89 P228 T229 A237 E238 K239 T243 L244 R245 I258 V265 K268 F269	L89-M241 HydrophobicContact CD2-CE 4.03Å; P228-M241 HydrophobicContact CG-SD 3.81Å; T229-M241 HydrophobicContact CG2-CG 3.59Å; T229-M241 HydrophobicContact CG2-SD 3.72Å; A237-M241 VanDerWaalsContact O-CG 3.32Å; A237-M241 WeakPolarHBondContact O-CG 3.5Å; A237-M241 PolarHBondContact O-N 2.96Å; E238-M241 PolarHBondContact O-N 3.23Å; K239-M241 VanDerWaalsContact C-N 3.3Å; M241-T243 VanDerWaalsContact C-N 3.3Å; M241-T243 PolarHBondContact O-N 3.48Å; M241-L244 HydrophobicContact CE-CD1 4.14Å; M241-L244 PolarHBondContact O-N 2.94Å; M241-L244 HydrophobicContact SD-CD1 3.9Å; M241-R245 WeakPolarHBondContact O-CB 3.46Å; M241-R245 PolarHBondContact O-N 3.44Å; M241-I258 HydrophobicContact SD-CD1 4.39Å; M241-V265 HydrophobicContact CB-CG1 4.26Å; M241-V265 HydrophobicContact CB-CG2 4.44Å; M241-V265 HydrophobicContact CE-CG1 4.4Å; M241-V265 HydrophobicContact CG-CG1 3.69Å; M241-V265 HydrophobicContact CG-CG2 4.15Å; M241-K268 HydrophobicContact CB-CD 4.2Å; M241-F269 HydrophobicContact CE-CE1 3.45Å; M241-F269 VanDerWaalsContact CE-CE1 3.45Å; M241-F269 HydrophobicContact CE-CZ 3.75Å
242	E	92.9	Very high	91.4	Very high	87 Å²	87	46.8 Å²	46.8	41%	0.407	23%	0.231	S	C	.	.	H	α-helix	trans	-61.5	-40.4	170.7	-176.5	170.4	-145.7	0	0	111.6	E238 K239 R245 Q246	E238-E242 WeakPolarHBondContact O-CB 3.28Å; E238-E242 PolarHBondContact O-N 3.1Å; K239-E242 PolarHBondContact O-N 2.88Å; E242-R245 PolarHBondContact O-N 2.95Å; E242-Q246 WeakPolarHBondContact O-CG 3.46Å; E242-Q246 PolarHBondContact O-N 3.43Å
243	T	91.3	Very high	91.8	Very high	11 Å²	11	45.1 Å²	45.1	7%	0.067	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-43.9	175.2	-51	0	0	0	0	111.6	L184 L212 K239 V240 M241 R245 Q246 L247	L184-T243 HydrophobicContact CD2-CG2 3.22Å; L212-T243 HydrophobicContact CD2-CG2 3.72Å; K239-T243 PolarHBondContact O-N 3.38Å; K239-T243 PolarHBondContact O-OG1 2.95Å; V240-T243 WeakPolarHBondContact O-CB 3.21Å; V240-T243 PolarHBondContact O-N 2.9Å; M241-T243 VanDerWaalsContact C-N 3.3Å; M241-T243 PolarHBondContact O-N 3.48Å; T243-R245 VanDerWaalsContact C-N 3.32Å; T243-R245 PolarHBondContact O-N 3.29Å; T243-Q246 PolarHBondContact O-N 3.08Å; T243-L247 HydrophobicContact CG2-CD1 4.48Å; T243-L247 WeakPolarHBondContact O-CG 3.29Å; T243-L247 PolarHBondContact O-N 3.31Å; T243-L247 VanDerWaalsContact O-N 3.07Å
244	L	94	Very high	92.2	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-64	-38.2	176.5	-72.1	177.3	0	0	0	112.3	L89 L212 I223 A225 P228 V240 M241 L247 A248 V254	L89-L244 HydrophobicContact CD1-CB 4.27Å; L212-L244 HydrophobicContact CD1-CD2 3.83Å; L212-L244 HydrophobicContact CD2-CD2 3.89Å; I223-L244 HydrophobicContact CG2-CD2 4.49Å; A225-L244 HydrophobicContact CB-CD1 4.11Å; A225-L244 HydrophobicContact CB-CD2 4.41Å; P228-L244 HydrophobicContact CB-CD1 4.08Å; P228-L244 HydrophobicContact CG-CD1 3.86Å; V240-L244 PolarHBondContact O-N 3.39Å; M241-L244 HydrophobicContact CE-CD1 4.14Å; M241-L244 PolarHBondContact O-N 2.94Å; M241-L244 HydrophobicContact SD-CD1 3.9Å; L244-L247 PolarHBondContact O-N 3Å; L244-A248 PolarHBondContact O-N 3.45Å; L244-V254 HydrophobicContact CB-CG1 4.25Å; L244-V254 HydrophobicContact CD2-CG1 4.04Å
245	R	94.8	Very high	92.7	Very high	90 Å²	90	39.2 Å²	39.2	34%	0.34	19%	0.187	S	C	.	.	H	α-helix	trans	-65.3	-44.9	174.9	177.3	176.1	165.6	169.4	0.7	112	L89 M241 E242 T243 L247 A248 E249	L89-R245 HydrophobicContact CD2-CB 4.26Å; M241-R245 WeakPolarHBondContact O-CB 3.46Å; M241-R245 PolarHBondContact O-N 3.44Å; E242-R245 PolarHBondContact O-N 2.95Å; T243-R245 VanDerWaalsContact C-N 3.32Å; T243-R245 PolarHBondContact O-N 3.29Å; R245-L247 VanDerWaalsContact C-N 3.27Å; R245-L247 PolarHBondContact O-N 3.42Å; R245-A248 WeakPolarHBondContact O-CA 3.25Å; R245-A248 WeakPolarHBondContact O-CB 3.33Å; R245-A248 PolarHBondContact O-N 2.87Å; R245-E249 IonicContact CZ-OE1 2.86Å; R245-E249 IonicContact NE-OE1 3.59Å; R245-E249 PolarHBondContact NE-OE1 3Å; R245-E249 IonicContact NH2-OE1 2.74Å; R245-E249 PolarHBondContact NH2-OE1 3.45Å; R245-E249 WeakPolarHBondContact O-CG 3.3Å; R245-E249 PolarHBondContact O-N 2.66Å
246	Q	92.1	Very high	93	Very high	82 Å²	82	33.4 Å²	33.4	38%	0.383	16%	0.161	S	C	.	.	H	α-helix	trans	-59.3	-39.5	175.7	-74.5	171.1	-0.8	0	0	111.7	E242 T243 A248 E249 D250	E242-Q246 WeakPolarHBondContact O-CG 3.46Å; E242-Q246 PolarHBondContact O-N 3.43Å; T243-Q246 PolarHBondContact O-N 3.08Å; Q246-A248 VanDerWaalsContact C-N 3.34Å; Q246-A248 PolarHBondContact O-N 3.35Å; Q246-E249 PolarHBondContact O-N 3.45Å; Q246-D250 PolarHBondContact O-N 2.86Å
247	L	91.3	Very high	93.4	Very high	14 Å²	14	31.8 Å²	31.8	7%	0.073	15%	0.154	C	C	.	.	H	α-helix	trans	-64.3	-38.9	173.7	-67.1	164.1	0	0	0	111.8	L212 L216 I223 T243 L244 R245 E249 D250 H252 V254	L212-L247 HydrophobicContact CD1-CD1 4Å; L212-L247 HydrophobicContact CD2-CD1 3.7Å; L212-L247 HydrophobicContact CG-CD1 4.05Å; L216-L247 HydrophobicContact CD1-CD1 3.76Å; L216-L247 HydrophobicContact CD1-CD2 3.77Å; L216-L247 HydrophobicContact CD1-CG 4.43Å; L216-L247 HydrophobicContact CD2-CD1 4.27Å; L216-L247 HydrophobicContact CD2-CD2 4.03Å; I223-L247 HydrophobicContact CD1-CB 4Å; I223-L247 HydrophobicContact CD1-CD1 3.99Å; I223-L247 HydrophobicContact CD1-CG 4.41Å; T243-L247 HydrophobicContact CG2-CD1 4.48Å; T243-L247 WeakPolarHBondContact O-CG 3.29Å; T243-L247 PolarHBondContact O-N 3.31Å; T243-L247 VanDerWaalsContact O-N 3.07Å; L244-L247 PolarHBondContact O-N 3Å; R245-L247 VanDerWaalsContact C-N 3.27Å; R245-L247 PolarHBondContact O-N 3.42Å; L247-E249 VanDerWaalsContact C-N 3.34Å; L247-D250 PolarHBondContact O-N 2.9Å; L247-H252 WeakPolarHBondContact O-CB 3.43Å; L247-H252 PolarHBondContact O-CD2 3.47Å; L247-H252 PolarHBondContact O-N 3.35Å; L247-H252 VanDerWaalsContact O-N 3.17Å; L247-V254 HydrophobicContact CB-CG2 4.39Å
248	A	94.4	Very high	93.5	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-60.5	-46.6	172	0	0	0	0	0	110.8	G87 L89 L244 R245 Q246 D250 G251 V254	G87-A248 CarbonylContact C-O 3.54Å; G87-A248 WeakPolarHBondContact CA-O 3.47Å; L89-A248 HydrophobicContact CB-CB 4.18Å; L244-A248 PolarHBondContact O-N 3.45Å; R245-A248 WeakPolarHBondContact O-CA 3.25Å; R245-A248 WeakPolarHBondContact O-CB 3.33Å; R245-A248 PolarHBondContact O-N 2.87Å; Q246-A248 VanDerWaalsContact C-N 3.34Å; Q246-A248 PolarHBondContact O-N 3.35Å; A248-D250 VanDerWaalsContact C-N 3.27Å; A248-D250 PolarHBondContact O-N 3.2Å; A248-G251 WeakPolarHBondContact O-CA 3.41Å; A248-G251 PolarHBondContact O-N 3.28Å; A248-V254 HydrophobicContact CB-CB 4.32Å; A248-V254 HydrophobicContact CB-CG2 3.83Å
249	E	93.8	Very high	93.1	Very high	118 Å²	118	31.2 Å²	31.2	55%	0.551	15%	0.149	S	C	*	.	H	α-helix	trans	-60.3	-32	177.7	-68.9	169.5	-178.4	0	0	113	R245 Q246 L247 G251	R245-E249 IonicContact CZ-OE1 2.86Å; R245-E249 IonicContact NE-OE1 3.59Å; R245-E249 PolarHBondContact NE-OE1 3Å; R245-E249 IonicContact NH2-OE1 2.74Å; R245-E249 PolarHBondContact NH2-OE1 3.45Å; R245-E249 WeakPolarHBondContact O-CG 3.3Å; R245-E249 PolarHBondContact O-N 2.66Å; Q246-E249 PolarHBondContact O-N 3.45Å; L247-E249 VanDerWaalsContact C-N 3.34Å; E249-G251 PolarHBondContact O-N 3.43Å; E249-G251 VanDerWaalsContact O-N 3.17Å
250	D	89.7	Confident	92.9	Very high	79 Å²	79	32.2 Å²	32.2	42%	0.422	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-3.5	172.3	-77.5	-7.1	0	0	0	113.7	R183 Q246 L247 A248	R183-D250 IonicContact NH1-OD2 3.38Å; Q246-D250 PolarHBondContact O-N 2.86Å; L247-D250 PolarHBondContact O-N 2.9Å; A248-D250 VanDerWaalsContact C-N 3.27Å; A248-D250 PolarHBondContact O-N 3.2Å
251	G	91.7	Very high	92.8	Very high	16 Å²	16	32.4 Å²	32.4	17%	0.165	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	104	-0.8	177.1	0	0	0	0	0	114.7	S86 A248 E249	S86-G251 PolarHBondContact OG-O 2.89Å; A248-G251 WeakPolarHBondContact O-CA 3.41Å; A248-G251 PolarHBondContact O-N 3.28Å; E249-G251 PolarHBondContact O-N 3.43Å; E249-G251 VanDerWaalsContact O-N 3.17Å
252	H	93	Very high	92.6	Very high	17 Å²	17	40.2 Å²	40.2	8%	0.079	19%	0.186	C	C	.	.			trans	-68.6	152.4	175.2	-60.7	-83.5	0	0	0	111.3	V51 G87 P220 S221 I223 L247 V254	V51-H252 VanDerWaalsContact CG2-CE1 3.44Å; V51-H252 WeakPolarHBondContact CG2-CE1 3.3Å; V51-H252 WeakPolarHBondContact CG2-NE2 3.29Å; G87-H252 PolarHBondContact N-O 3.32Å; P220-H252 PolarHBondContact O-CE1 3.03Å; P220-H252 PolarHBondContact O-ND1 3.47Å; S221-H252 WeakPolarHBondContact O-CA 3.23Å; I223-H252 HydrophobicContact CD1-CB 3.88Å; I223-H252 HydrophobicContact CG1-CB 4.42Å; L247-H252 WeakPolarHBondContact O-CB 3.43Å; L247-H252 PolarHBondContact O-CD2 3.47Å; L247-H252 PolarHBondContact O-N 3.35Å; L247-H252 VanDerWaalsContact O-N 3.17Å; H252-V254 HydrophobicContact CB-CG2 4.05Å
253	T	95.3	Very high	92.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	113.7	167.3	-57.6	0	0	0	0	108.1	V54 A84 S86 S221 I222 I223	V54-T253 WeakPolarHBondContact O-CB 3.42Å; V54-T253 PolarHBondContact O-OG1 3.03Å; A84-T253 HydrophobicContact CB-CG2 3.86Å; S86-T253 WeakPolarHBondContact CA-OG1 3.28Å; S86-T253 PolarHBondContact N-OG1 3.45Å; S221-T253 PolarHBondContact O-N 2.88Å; I222-T253 CarbonylContact C-O 3.52Å; I222-T253 WeakPolarHBondContact CA-O 3.49Å; I223-T253 PolarHBondContact N-O 2.83Å
254	V	96.9	Very high	92.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	123.5	-172.6	-169.5	0	0	0	0	110	R88 L89 L90 I223 L244 L247 A248 H252	R88-V254 PolarHBondContact O-N 3.32Å; L89-V254 HydrophobicContact CD1-CB 3.67Å; L89-V254 HydrophobicContact CD1-CG1 3.38Å; L90-V254 PolarHBondContact N-O 3.33Å; I223-V254 HydrophobicContact CB-CG1 4.33Å; I223-V254 HydrophobicContact CB-CG2 4.32Å; I223-V254 HydrophobicContact CD1-CG2 4.23Å; I223-V254 HydrophobicContact CG2-CG1 4.44Å; I223-V254 WeakPolarHBondContact O-CA 3.49Å; L244-V254 HydrophobicContact CB-CG1 4.25Å; L244-V254 HydrophobicContact CD2-CG1 4.04Å; L247-V254 HydrophobicContact CB-CG2 4.39Å; A248-V254 HydrophobicContact CB-CB 4.32Å; A248-V254 HydrophobicContact CB-CG2 3.83Å; H252-V254 HydrophobicContact CB-CG2 4.05Å
255	I	97.5	Very high	92.5	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.9	179.4	-53.9	166	0	0	0	107.6	I56 A84 L90 L92 L104 I223 F224 A225	I56-I255 HydrophobicContact CD1-CD1 4.21Å; A84-I255 HydrophobicContact CB-CD1 3.54Å; A84-I255 HydrophobicContact CB-CG1 3.73Å; L90-I255 HydrophobicContact CB-CG1 4.34Å; L90-I255 HydrophobicContact CD2-CG1 4.24Å; L90-I255 HydrophobicContact CD2-CG2 4.14Å; L90-I255 HydrophobicContact CG-CG2 4.44Å; L90-I255 WeakPolarHBondContact O-CA 3.37Å; L92-I255 HydrophobicContact CD1-CG2 4.18Å; L92-I255 HydrophobicContact CD2-CG2 4.45Å; L92-I255 HydrophobicContact CG-CG2 4.05Å; L104-I255 HydrophobicContact CD1-CB 4.3Å; L104-I255 HydrophobicContact CD1-CG2 3.66Å; I223-I255 PolarHBondContact O-N 3.01Å; F224-I255 CarbonylContact C-O 3.52Å; F224-I255 VanDerWaalsContact CA-O 3.26Å; F224-I255 WeakPolarHBondContact CA-O 3.28Å; F224-I255 HydrophobicContact CD1-CB 3.93Å; F224-I255 HydrophobicContact CD1-CD1 4.03Å; F224-I255 HydrophobicContact CD1-CG2 4.36Å; F224-I255 HydrophobicContact CE1-CB 4.22Å; F224-I255 HydrophobicContact CE1-CD1 3.42Å; F224-I255 VanDerWaalsContact CE1-CD1 3.42Å; F224-I255 HydrophobicContact CE1-CG1 4.36Å; F224-I255 HydrophobicContact CZ-CD1 4.07Å; A225-I255 PolarHBondContact N-O 3.24Å
256	C	96.8	Very high	92.5	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	142.5	175.7	66.2	0	0	0	0	112.8	L90 A91 L92 A225 P228	L90-C256 PolarHBondContact O-N 3.37Å; A91-C256 CarbonylContact C-O 3.44Å; A91-C256 WeakPolarHBondContact CA-O 3.17Å; L92-C256 PolarHBondContact N-O 3.13Å; A225-C256 HydrophobicContact CB-CB 3.96Å; A225-C256 CarbonylContact O-C 3.58Å; A225-C256 WeakPolarHBondContact O-CA 3.32Å; A225-C256 WeakPolarHBondContact O-CB 3.28Å; P228-C256 HydrophobicContact CG-CB 4.13Å
257	S	96.1	Very high	92.6	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	136.4	164.4	58.9	0	0	0	0	109.3	L92 A225 D226 E227 P228	L92-S257 WeakPolarHBondContact O-CA 3.42Å; A225-S257 PolarHBondContact O-N 3.21Å; D226-S257 VanDerWaalsContact CA-OG 3.32Å; D226-S257 WeakPolarHBondContact CA-OG 3.45Å; D226-S257 PolarHBondContact OD1-OG 3.34Å; E227-S257 VanDerWaalsContact CA-O 3.26Å; E227-S257 WeakPolarHBondContact CA-O 3.42Å; E227-S257 PolarHBondContact N-O 3.2Å; E227-S257 PolarHBondContact N-OG 2.8Å; P228-S257 VanDerWaalsContact CD-O 3.3Å; P228-S257 WeakPolarHBondContact CD-O 3.31Å
258	I	93	Very high	92.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	144.1	176.6	-159	157.5	0	0	0	111.8	A91 L92 M93 T229 M241 P261 V265 F269	A91-I258 HydrophobicContact CB-CG2 4.33Å; L92-I258 PolarHBondContact O-N 3.35Å; M93-I258 HydrophobicContact CB-CG2 4.42Å; M93-I258 HydrophobicContact CG-CG2 4.33Å; T229-I258 HydrophobicContact CG2-CD1 3.98Å; M241-I258 HydrophobicContact SD-CD1 4.39Å; I258-P261 HydrophobicContact CD1-CB 3.72Å; I258-P261 HydrophobicContact CD1-CG 4.26Å; I258-P261 HydrophobicContact CG1-CB 4.17Å; I258-P261 HydrophobicContact CG1-CG 4.39Å; I258-P261 HydrophobicContact CG2-CG 4.14Å; I258-V265 HydrophobicContact CD1-CG1 3.73Å; I258-F269 HydrophobicContact CD1-CE2 4.45Å; I258-F269 HydrophobicContact CD1-CZ 3.85Å; I258-F269 HydrophobicContact CG2-CE2 4.23Å; I258-F269 HydrophobicContact CG2-CZ 4.03Å
259	H	84.2	Confident	92.8	Very high	62 Å²	62	34.5 Å²	34.5	29%	0.287	19%	0.187	S	C	.	.	S	Bend	trans	-114.2	113.6	177.5	-173.1	-78.8	0	0	0	109.2	S96	S96-H259 PolarHBondContact OG-NE2 3.11Å
260	Q	85.1	Confident	93	Very high	94 Å²	94	30.7 Å²	30.7	44%	0.439	17%	0.17	S	C	.	.	S	Bend	trans	44.4	66.5	175.8	-68	175	-28.4	0	0	114.7	A312	Q260-A312 HydrophobicContact CG-CB 3.82Å
261	P	90.8	Very high	93.4	Very high	7 Å²	7	27.9 Å²	27.9	5%	0.045	16%	0.155	C	C	.	.			trans	-66.2	152.1	177.4	25.7	-31.9	0	0	0	112.5	M93 I258 V265 F269 N306 A308	M93-P261 HydrophobicContact SD-CG 4.22Å; I258-P261 HydrophobicContact CD1-CB 3.72Å; I258-P261 HydrophobicContact CD1-CG 4.26Å; I258-P261 HydrophobicContact CG1-CB 4.17Å; I258-P261 HydrophobicContact CG1-CG 4.39Å; I258-P261 HydrophobicContact CG2-CG 4.14Å; P261-V265 HydrophobicContact CB-CB 3.89Å; P261-V265 HydrophobicContact CB-CG1 3.63Å; P261-F269 HydrophobicContact CG-CE2 4.17Å; P261-N306 PolarHBondContact O-ND2 3.4Å; P261-A308 HydrophobicContact CG-CB 3.71Å
262	R	90.2	Very high	93.6	Very high	164 Å²	164	27.1 Å²	27.1	62%	0.619	15%	0.147	S	C	*	.			trans	-62.2	155.9	165.2	-69.9	-167.9	173.2	-165.5	-0.8	111	A234 S264 V265 Y266	A234-R262 VanDerWaalsContact CB-NE 3.3Å; R262-S264 VanDerWaalsContact C-N 3.25Å; R262-S264 PolarHBondContact O-N 3.1Å; R262-V265 WeakPolarHBondContact O-CA 3.41Å; R262-V265 WeakPolarHBondContact O-CB 3.39Å; R262-V265 PolarHBondContact O-N 3.38Å; R262-Y266 PolarHBondContact O-N 3.1Å
263	G	90.8	Very high	93.8	Very high	38 Å²	38	26.3 Å²	26.3	39%	0.392	14%	0.143	S	C	.	.	H	α-helix	trans	-52.1	-39.3	177.1	0	0	0	0	0	114	V265 Y266 G267 N306	G263-V265 VanDerWaalsContact C-N 3.28Å; G263-V265 PolarHBondContact O-N 3.41Å; G263-Y266 PolarHBondContact O-N 3.23Å; G263-G267 PolarHBondContact O-N 3Å; G263-N306 PolarHBondContact N-ND2 3.17Å
264	S	91.8	Very high	93.8	Very high	54 Å²	54	26.3 Å²	26.3	38%	0.378	14%	0.143	S	C	.	.	H	α-helix	trans	-63.6	-30.9	176.9	62.6	0	0	0	0	113.7	E238 R262	E238-S264 PolarHBondContact OE2-OG 3.04Å; R262-S264 VanDerWaalsContact C-N 3.25Å; R262-S264 PolarHBondContact O-N 3.1Å
265	V	93.8	Very high	93.8	Very high	5 Å²	5	26.3 Å²	26.3	3%	0.03	14%	0.143	C	C	.	.	H	α-helix	trans	-80.5	-42.1	174.3	170.3	0	0	0	0	110.5	E238 M241 I258 P261 R262 G263 G267 K268 F269	E238-V265 HydrophobicContact CB-CG2 4.49Å; M241-V265 HydrophobicContact CB-CG1 4.26Å; M241-V265 HydrophobicContact CB-CG2 4.44Å; M241-V265 HydrophobicContact CE-CG1 4.4Å; M241-V265 HydrophobicContact CG-CG1 3.69Å; M241-V265 HydrophobicContact CG-CG2 4.15Å; I258-V265 HydrophobicContact CD1-CG1 3.73Å; P261-V265 HydrophobicContact CB-CB 3.89Å; P261-V265 HydrophobicContact CB-CG1 3.63Å; R262-V265 WeakPolarHBondContact O-CA 3.41Å; R262-V265 WeakPolarHBondContact O-CB 3.39Å; R262-V265 PolarHBondContact O-N 3.38Å; G263-V265 VanDerWaalsContact C-N 3.28Å; G263-V265 PolarHBondContact O-N 3.41Å; V265-G267 VanDerWaalsContact C-N 3.26Å; V265-G267 PolarHBondContact O-N 3.04Å; V265-K268 WeakPolarHBondContact O-CB 3.41Å; V265-K268 PolarHBondContact O-N 3.35Å; V265-F269 HydrophobicContact CG1-CE2 4.07Å; V265-F269 HydrophobicContact CG1-CZ 3.96Å
266	Y	94.3	Very high	93.6	Very high	9 Å²	9	26.4 Å²	26.4	4%	0.035	14%	0.144	C	C	.	.	H	α-helix	trans	-55.8	-41.9	178.3	-179.8	-103	0	0	0	112.1	R262 G263 K268 F269 I272 K287 P290 P307 A308 L311	R262-Y266 PolarHBondContact O-N 3.1Å; G263-Y266 PolarHBondContact O-N 3.23Å; Y266-K268 PolarHBondContact O-N 3.29Å; Y266-K268 VanDerWaalsContact O-N 3.08Å; Y266-F269 HydrophobicContact CD2-CD2 4.38Å; Y266-F269 WeakPolarHBondContact O-CD2 3.48Å; Y266-F269 PolarHBondContact O-N 3.49Å; Y266-I272 HydrophobicContact CE2-CD1 3.96Å; Y266-K287 WeakPolarHBondContact CE1-O 3.42Å; Y266-K287 PolarHBondContact OH-N 2.72Å; Y266-K287 PolarHBondContact OH-O 2.94Å; Y266-P290 VanDerWaalsContact OH-CG 3.26Å; Y266-P290 WeakPolarHBondContact OH-CG 3.2Å; Y266-P307 HydrophobicContact CD1-CB 3.95Å; Y266-P307 HydrophobicContact CD1-CG 4.37Å; Y266-P307 HydrophobicContact CE1-CB 3.56Å; Y266-P307 HydrophobicContact CE1-CG 4.2Å; Y266-A308 HydrophobicContact CD2-CB 3.67Å; Y266-A308 HydrophobicContact CE2-CB 4.35Å; Y266-A308 HydrophobicContact CG-CB 4.04Å; Y266-L311 HydrophobicContact CE2-CD1 4.21Å
267	G	93.5	Very high	93.4	Very high	35 Å²	35	29.7 Å²	29.7	36%	0.361	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-8.4	177.7	0	0	0	0	0	115.6	G263 V265	G263-G267 PolarHBondContact O-N 3Å; V265-G267 VanDerWaalsContact C-N 3.26Å; V265-G267 PolarHBondContact O-N 3.04Å
268	K	94.4	Very high	93.2	Very high	26 Å²	26	29.8 Å²	29.8	11%	0.113	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-11.5	177.6	-63.4	-176.3	-166.8	-68.4	0	113.6	E238 M241 V265 Y266	E238-K268 IonicContact OE1-NZ 2.98Å; M241-K268 HydrophobicContact CB-CD 4.2Å; V265-K268 WeakPolarHBondContact O-CB 3.41Å; V265-K268 PolarHBondContact O-N 3.35Å; Y266-K268 PolarHBondContact O-N 3.29Å; Y266-K268 VanDerWaalsContact O-N 3.08Å
269	F	96.5	Very high	93.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.175	C	C	.	.			trans	-77.9	140.9	178.7	-61	-54.9	0	0	0	111.5	L89 A91 M241 I258 P261 V265 Y266 A286	L89-F269 HydrophobicContact CD2-CD1 3.77Å; L89-F269 HydrophobicContact CD2-CE1 3.98Å; L89-F269 HydrophobicContact CG-CD1 3.87Å; L89-F269 HydrophobicContact CG-CE1 4.24Å; A91-F269 HydrophobicContact CB-CB 4.44Å; A91-F269 HydrophobicContact CB-CD1 3.6Å; A91-F269 HydrophobicContact CB-CD2 3.88Å; A91-F269 HydrophobicContact CB-CE1 3.71Å; A91-F269 HydrophobicContact CB-CE2 3.98Å; A91-F269 HydrophobicContact CB-CG 3.7Å; A91-F269 HydrophobicContact CB-CZ 3.9Å; M241-F269 HydrophobicContact CE-CE1 3.45Å; M241-F269 VanDerWaalsContact CE-CE1 3.45Å; M241-F269 HydrophobicContact CE-CZ 3.75Å; I258-F269 HydrophobicContact CD1-CE2 4.45Å; I258-F269 HydrophobicContact CD1-CZ 3.85Å; I258-F269 HydrophobicContact CG2-CE2 4.23Å; I258-F269 HydrophobicContact CG2-CZ 4.03Å; P261-F269 HydrophobicContact CG-CE2 4.17Å; V265-F269 HydrophobicContact CG1-CE2 4.07Å; V265-F269 HydrophobicContact CG1-CZ 3.96Å; Y266-F269 HydrophobicContact CD2-CD2 4.38Å; Y266-F269 WeakPolarHBondContact O-CD2 3.48Å; Y266-F269 PolarHBondContact O-N 3.49Å; F269-A286 HydrophobicContact CB-CB 3.67Å
270	D	97.5	Very high	93.8	Very high	38 Å²	38	30.7 Å²	30.7	20%	0.203	17%	0.166	C	C	.	.	S	Bend	trans	-91.9	-41.9	173.3	-63.7	-58.9	0	0	0	110.6	R88 L89 P285 A286	R88-D270 WeakPolarHBondContact CA-OD2 3.35Å; R88-D270 HydrophobicContact CB-CB 4.05Å; R88-D270 HydrophobicContact CG-CB 4.37Å; R88-D270 PolarHBondContact NH2-O 2.93Å; R88-D270 VanDerWaalsContact NH2-O 3.09Å; L89-D270 PolarHBondContact N-OD2 2.94Å; L89-D270 PolarHBondContact O-N 3.46Å; D270-P285 WeakPolarHBondContact O-CA 3.39Å; D270-A286 PolarHBondContact O-N 3.4Å
271	D	97.4	Very high	94.3	Very high	20 Å²	20	26.2 Å²	26.2	11%	0.107	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	154.1	178.9	-60.6	-46.1	0	0	0	110.4	R88 L89 L90 A91 G284	R88-D271 IonicContact CZ-OD1 3.49Å; R88-D271 IonicContact CZ-OD2 3.39Å; R88-D271 IonicContact NE-OD1 3.21Å; R88-D271 PolarHBondContact NE-OD1 3.49Å; R88-D271 IonicContact NE-OD2 3.59Å; R88-D271 PolarHBondContact NE-OD2 3.06Å; R88-D271 IonicContact NH2-OD1 2.73Å; R88-D271 PolarHBondContact NH2-OD1 3.29Å; R88-D271 IonicContact NH2-OD2 3.72Å; L89-D271 PolarHBondContact O-N 3.24Å; L90-D271 WeakPolarHBondContact CA-O 3.49Å; L90-D271 HydrophobicContact CB-CB 4.43Å; L90-D271 HydrophobicContact CD1-CB 3.49Å; L90-D271 VanDerWaalsContact CD1-CB 3.49Å; A91-D271 PolarHBondContact N-O 3.48Å; D271-G284 CarbonylContact C-O 3.52Å; D271-G284 VanDerWaalsContact CA-O 3.29Å; D271-G284 WeakPolarHBondContact CA-O 3.5Å
272	I	96.8	Very high	94.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	139.9	175.9	-167.1	166.2	0	0	0	111.2	A91 M93 Y266 L274 Y282 M283 G284 A286 P290	A91-I272 HydrophobicContact CB-CG1 4.19Å; A91-I272 CarbonylContact O-C 3.46Å; A91-I272 WeakPolarHBondContact O-CA 3.21Å; M93-I272 HydrophobicContact CB-CD1 4.11Å; M93-I272 HydrophobicContact CB-CG1 4.34Å; M93-I272 HydrophobicContact CE-CD1 3.89Å; M93-I272 HydrophobicContact SD-CD1 4.04Å; Y266-I272 HydrophobicContact CE2-CD1 3.96Å; I272-L274 HydrophobicContact CD1-CD2 3.7Å; I272-L274 HydrophobicContact CG1-CD2 3.9Å; I272-Y282 HydrophobicContact CG2-CD1 3.91Å; I272-Y282 HydrophobicContact CG2-CE1 3.69Å; I272-M283 WeakPolarHBondContact O-CA 3.18Å; I272-G284 PolarHBondContact N-O 2.9Å; I272-G284 PolarHBondContact O-N 3.38Å; I272-G284 VanDerWaalsContact O-N 3.17Å; I272-A286 HydrophobicContact CB-CB 4.07Å; I272-A286 HydrophobicContact CG2-CB 4.16Å; I272-P290 HydrophobicContact CG2-CG 4.37Å
273	V	96.9	Very high	94.8	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	120	167.9	171.1	0	0	0	0	107.6	W58 L90 A91 L92 M93 L275 V280 Y282 M283	W58-V273 HydrophobicContact CZ2-CG2 4.35Å; L90-V273 HydrophobicContact CD1-CG2 3.93Å; L90-V273 HydrophobicContact CD2-CG2 4.44Å; A91-V273 PolarHBondContact O-N 2.89Å; L92-V273 HydrophobicContact CD2-CB 3.74Å; L92-V273 HydrophobicContact CD2-CG1 4.11Å; L92-V273 HydrophobicContact CD2-CG2 4.19Å; M93-V273 PolarHBondContact N-O 3.03Å; V273-L275 HydrophobicContact CG1-CG 4.18Å; V273-V280 HydrophobicContact CG1-CG1 4.24Å; V273-V280 HydrophobicContact CG1-CG2 4.4Å; V273-Y282 CarbonylContact C-O 3.5Å; V273-Y282 WeakPolarHBondContact CA-O 3.29Å; V273-M283 HydrophobicContact CG2-CB 4.07Å; V273-M283 HydrophobicContact CG2-CG 3.74Å; V273-M283 HydrophobicContact CG2-SD 4.41Å
274	L	96.7	Very high	94.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	124.3	174.9	-60	-175.4	0	0	0	109.8	M93 I272 I281 Y282 F294 L311 I315	M93-L274 HydrophobicContact CB-CD2 3.94Å; M93-L274 HydrophobicContact CE-CD2 3.56Å; M93-L274 CarbonylContact O-C 3.3Å; M93-L274 WeakPolarHBondContact O-CA 3.46Å; I272-L274 HydrophobicContact CD1-CD2 3.7Å; I272-L274 HydrophobicContact CG1-CD2 3.9Å; L274-I281 HydrophobicContact CB-CB 4.4Å; L274-I281 PolarHBondContact O-N 2.88Å; L274-Y282 HydrophobicContact CG-CD1 4.48Å; L274-Y282 PolarHBondContact N-O 3.15Å; L274-F294 HydrophobicContact CD1-CE2 3.55Å; L274-F294 HydrophobicContact CD1-CZ 3.8Å; L274-L311 HydrophobicContact CD1-CB 4.37Å; L274-L311 HydrophobicContact CD1-CD1 4.42Å; L274-L311 HydrophobicContact CD1-CD2 4.09Å; L274-I315 HydrophobicContact CB-CD1 4.04Å; L274-I315 HydrophobicContact CD2-CD1 4.21Å; L274-I315 HydrophobicContact CG-CD1 4.49Å
275	L	95.4	Very high	95.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.4	178.4	-72.8	161.1	0	0	0	110.6	M93 G94 P95 S98 L103 V273 E279 V280	M93-L275 PolarHBondContact O-N 3.4Å; G94-L275 VanDerWaalsContact CA-O 3.3Å; G94-L275 WeakPolarHBondContact CA-O 3.47Å; P95-L275 WeakPolarHBondContact CD-O 3.49Å; S98-L275 WeakPolarHBondContact CB-O 3.42Å; L103-L275 HydrophobicContact CB-CD1 4.42Å; L103-L275 HydrophobicContact CD2-CD1 3.89Å; V273-L275 HydrophobicContact CG1-CG 4.18Å; L275-E279 WeakPolarHBondContact CA-O 3.28Å; L275-V280 HydrophobicContact CD2-CG2 3.8Å
276	S	94.6	Very high	95.2	Very high	2 Å²	2	20.2 Å²	20.2	1%	0.014	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	142.2	162.6	-157.9	0	0	0	0	110.7	G278 E279 I315	S276-G278 PolarHBondContact O-N 2.95Å; S276-E279 PolarHBondContact N-O 2.69Å; S276-E279 PolarHBondContact O-N 3.31Å; S276-I315 VanDerWaalsContact CB-O 3.28Å; S276-I315 WeakPolarHBondContact CB-O 3.23Å; S276-I315 PolarHBondContact OG-O 3.11Å
277	E	91.4	Very high	95.1	Very high	70 Å²	70	24.5 Å²	24.5	33%	0.327	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	29.7	-179.1	-64.9	-73.4	-177.2	0	0	114.8	V317	E277-V317 HydrophobicContact CG-CG2 4.39Å
278	G	92.1	Very high	95.1	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.01	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	0.8	179.9	0	0	0	0	0	115.5	L76 L77 S78 S98 S276	L76-G278 WeakPolarHBondContact O-CA 3.11Å; L77-G278 CarbonylContact C-O 3.56Å; L77-G278 VanDerWaalsContact CA-O 3.3Å; L77-G278 WeakPolarHBondContact CA-O 3.25Å; S78-G278 PolarHBondContact N-O 3.31Å; S98-G278 WeakPolarHBondContact O-CA 3.28Å; S98-G278 PolarHBondContact O-N 2.99Å; S276-G278 PolarHBondContact O-N 2.95Å
279	E	94.7	Very high	95.1	Very high	66 Å²	66	32.3 Å²	32.3	31%	0.308	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	149.7	-176.5	-66.1	-170.2	121.2	0	0	111.8	S78 L275 S276 I336	S78-E279 PolarHBondContact OG-OE1 3.36Å; L275-E279 WeakPolarHBondContact CA-O 3.28Å; S276-E279 PolarHBondContact N-O 2.69Å; S276-E279 PolarHBondContact O-N 3.31Å; E279-I336 HydrophobicContact CB-CD1 3.73Å; E279-I336 HydrophobicContact CB-CG1 4.21Å; E279-I336 HydrophobicContact CB-CG2 4.4Å; E279-I336 HydrophobicContact CG-CD1 4.46Å
280	V	95.1	Very high	95.1	Very high	16 Å²	16	32.3 Å²	32.3	10%	0.097	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	120.6	179.6	179.6	0	0	0	0	109	A80 V273 L275 M283 F339	A80-V280 HydrophobicContact CB-CG2 4Å; V273-V280 HydrophobicContact CG1-CG1 4.24Å; V273-V280 HydrophobicContact CG1-CG2 4.4Å; L275-V280 HydrophobicContact CD2-CG2 3.8Å; V280-M283 HydrophobicContact CG1-CB 4.27Å; V280-F339 HydrophobicContact CG1-CD1 4.25Å; V280-F339 HydrophobicContact CG1-CE1 3.7Å; V280-F339 HydrophobicContact CG1-CZ 4.47Å
281	I	95.1	Very high	95	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-29.8	179	-64.6	173.9	0	0	0	111.4	L274 F294 I315 I332 L335 I336 F339	L274-I281 HydrophobicContact CB-CB 4.4Å; L274-I281 PolarHBondContact O-N 2.88Å; I281-F294 HydrophobicContact CG2-CE1 3.91Å; I281-F294 HydrophobicContact CG2-CZ 3.87Å; I281-I315 HydrophobicContact CB-CG2 4.47Å; I281-I315 HydrophobicContact CD1-CB 3.65Å; I281-I315 HydrophobicContact CD1-CG2 3.64Å; I281-I315 HydrophobicContact CG2-CG2 4.04Å; I281-I332 HydrophobicContact CD1-CG2 4.14Å; I281-L335 HydrophobicContact CG2-CB 3.88Å; I281-L335 HydrophobicContact CG2-CD1 4.34Å; I281-I336 HydrophobicContact CG1-CG1 3.82Å; I281-F339 WeakPolarHBondContact O-CB 3.32Å; I281-F339 WeakPolarHBondContact O-CD2 3.34Å; I281-F339 WeakPolarHBondContact O-CG 3.22Å
282	Y	96.2	Very high	94.9	Very high	10 Å²	10	37 Å²	37	4%	0.039	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	143.8	176.6	177	-92.4	0	0	0	109.4	I272 V273 L274 P285 P290 Y293 F339	I272-Y282 HydrophobicContact CG2-CD1 3.91Å; I272-Y282 HydrophobicContact CG2-CE1 3.69Å; V273-Y282 CarbonylContact C-O 3.5Å; V273-Y282 WeakPolarHBondContact CA-O 3.29Å; L274-Y282 HydrophobicContact CG-CD1 4.48Å; L274-Y282 PolarHBondContact N-O 3.15Å; Y282-P285 PolarHBondContact OH-O 2.9Å; Y282-P290 HydrophobicContact CD1-CB 4.17Å; Y282-P290 HydrophobicContact CE1-CB 3.88Å; Y282-P290 HydrophobicContact CE1-CG 4.49Å; Y282-P290 HydrophobicContact CE2-CB 4.42Å; Y282-Y293 AromaticContact CD2-CD1 3.49Å; Y282-Y293 HydrophobicContact CD2-CD1 3.49Å; Y282-Y293 VanDerWaalsContact CD2-CD1 3.49Å; Y282-Y293 AromaticContact CD2-CE1 3.97Å; Y282-Y293 HydrophobicContact CD2-CE1 3.97Å; Y282-Y293 AromaticContact CD2-CG 3.96Å; Y282-Y293 HydrophobicContact CD2-CG 3.96Å; Y282-Y293 HydrophobicContact CE2-CD1 4.04Å; Y282-Y293 HydrophobicContact CE2-CG 4.04Å; Y282-Y293 HydrophobicContact CG-CD1 4.48Å; Y282-F339 HydrophobicContact CD2-CE2 4.34Å
283	M	95	Very high	94.8	Very high	59 Å²	59	37.7 Å²	37.7	29%	0.291	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	133.8	165.9	174	-171.1	158	0	0	108.7	G82 E83 I272 V273 V280 F339	G82-M283 WeakPolarHBondContact CA-SD 3.29Å; E83-M283 HydrophobicContact CB-CE 3.75Å; I272-M283 WeakPolarHBondContact O-CA 3.18Å; V273-M283 HydrophobicContact CG2-CB 4.07Å; V273-M283 HydrophobicContact CG2-CG 3.74Å; V273-M283 HydrophobicContact CG2-SD 4.41Å; V280-M283 HydrophobicContact CG1-CB 4.27Å; M283-F339 HydrophobicContact CB-CE1 4.48Å; M283-F339 HydrophobicContact CB-CZ 3.87Å
284	G	94.6	Very high	94.8	Very high	14 Å²	14	37.7 Å²	37.7	14%	0.144	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.8	-162.4	176	0	0	0	0	0	112.1	D271 I272	D271-G284 CarbonylContact C-O 3.52Å; D271-G284 VanDerWaalsContact CA-O 3.29Å; D271-G284 WeakPolarHBondContact CA-O 3.5Å; I272-G284 PolarHBondContact N-O 2.9Å; I272-G284 PolarHBondContact O-N 3.38Å; I272-G284 VanDerWaalsContact O-N 3.17Å
285	P	96.1	Very high	94.8	Very high	58 Å²	58	38.9 Å²	38.9	38%	0.377	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.9	142.4	171.3	-23.4	34.1	0	0	0	111.4	D270 Y282 E289 P290	D270-P285 WeakPolarHBondContact O-CA 3.39Å; Y282-P285 PolarHBondContact OH-O 2.9Å; P285-E289 HydrophobicContact CB-CB 4.22Å; P285-E289 HydrophobicContact CB-CG 3.97Å; P285-E289 HydrophobicContact CG-CG 4.44Å; P285-P290 WeakPolarHBondContact O-CD 3.38Å
286	A	94.3	Very high	94.7	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.008	23%	0.23	C	C	.	.			trans	-78.8	-166.8	171.7	0	0	0	0	0	110.9	F269 D270 I272	F269-A286 HydrophobicContact CB-CB 3.67Å; D270-A286 PolarHBondContact O-N 3.4Å; I272-A286 HydrophobicContact CB-CB 4.07Å; I272-A286 HydrophobicContact CG2-CB 4.16Å
287	K	92.7	Very high	94.7	Very high	99 Å²	99	45.6 Å²	45.6	43%	0.43	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	76	-115.8	178.2	-51.4	171	-173.8	167.3	0	113.3	Y266	Y266-K287 WeakPolarHBondContact CE1-O 3.42Å; Y266-K287 PolarHBondContact OH-N 2.72Å; Y266-K287 PolarHBondContact OH-O 2.94Å
288	E	93.2	Very high	94.9	Very high	139 Å²	139	44.8 Å²	44.8	65%	0.65	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-27.1	-169.6	-66.1	-175.9	-177.5	0	0	112.1	L291 L292	E288-L291 WeakPolarHBondContact O-CA 3.29Å; E288-L291 VanDerWaalsContact O-CB 3.29Å; E288-L291 WeakPolarHBondContact O-CB 3.27Å; E288-L291 PolarHBondContact O-N 2.99Å; E288-L292 PolarHBondContact O-N 3.35Å
289	E	95.4	Very high	95.1	Very high	86 Å²	86	48.3 Å²	48.3	40%	0.402	27%	0.266	S	S	.	.	H	α-helix	trans	-54.3	-45.6	-177.3	-71	83.5	160	0	0	114.3	P285 L291 L292 Y293	P285-E289 HydrophobicContact CB-CB 4.22Å; P285-E289 HydrophobicContact CB-CG 3.97Å; P285-E289 HydrophobicContact CG-CG 4.44Å; E289-L291 VanDerWaalsContact C-N 3.31Å; E289-L291 PolarHBondContact O-N 2.95Å; E289-L292 PolarHBondContact O-N 2.69Å; E289-Y293 PolarHBondContact O-N 2.79Å
290	P	95.3	Very high	95.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.4	-36.3	173	23.6	-33.5	0	0	0	111.8	Y266 I272 Y282 P285 Y293 F294 L311	Y266-P290 VanDerWaalsContact OH-CG 3.26Å; Y266-P290 WeakPolarHBondContact OH-CG 3.2Å; I272-P290 HydrophobicContact CG2-CG 4.37Å; Y282-P290 HydrophobicContact CD1-CB 4.17Å; Y282-P290 HydrophobicContact CE1-CB 3.88Å; Y282-P290 HydrophobicContact CE1-CG 4.49Å; Y282-P290 HydrophobicContact CE2-CB 4.42Å; P285-P290 WeakPolarHBondContact O-CD 3.38Å; P290-Y293 WeakPolarHBondContact O-CB 3.25Å; P290-Y293 PolarHBondContact O-N 2.95Å; P290-F294 HydrophobicContact CB-CE2 4.36Å; P290-F294 WeakPolarHBondContact O-CD2 3.22Å; P290-F294 PolarHBondContact O-N 3.35Å; P290-L311 HydrophobicContact CB-CD1 4.06Å; P290-L311 HydrophobicContact CB-CD2 4.24Å; P290-L311 HydrophobicContact CG-CD1 4.03Å
291	L	95.5	Very high	95.1	Very high	36 Å²	36	52.5 Å²	52.5	19%	0.188	29%	0.287	C	S	.	.	H	α-helix	trans	-65.7	-42.4	178.7	-54.9	-180	0	0	0	111.3	E288 E289 Y293 F294 A295 C301 P307 F310 L311	E288-L291 WeakPolarHBondContact O-CA 3.29Å; E288-L291 VanDerWaalsContact O-CB 3.29Å; E288-L291 WeakPolarHBondContact O-CB 3.27Å; E288-L291 PolarHBondContact O-N 2.99Å; E289-L291 VanDerWaalsContact C-N 3.31Å; E289-L291 PolarHBondContact O-N 2.95Å; L291-Y293 VanDerWaalsContact C-N 3.34Å; L291-F294 PolarHBondContact O-N 3.39Å; L291-A295 WeakPolarHBondContact O-CB 3.33Å; L291-A295 PolarHBondContact O-N 3.05Å; L291-C301 HydrophobicContact CD2-CB 4.02Å; L291-P307 HydrophobicContact CD1-CB 4.03Å; L291-P307 HydrophobicContact CD1-CG 4.08Å; L291-P307 HydrophobicContact CD2-CB 4.14Å; L291-P307 HydrophobicContact CG-CB 4.47Å; L291-F310 HydrophobicContact CD2-CD1 3.85Å; L291-F310 HydrophobicContact CD2-CE1 4.22Å; L291-L311 HydrophobicContact CD2-CD2 4.19Å; L291-L311 HydrophobicContact CD2-CG 4.21Å
292	L	95.4	Very high	95	Very high	119 Å²	119	56 Å²	56	62%	0.623	31%	0.31	S	S	*	.	H	α-helix	trans	-63.1	-40.7	174.8	-66.5	174	0	0	0	111.7	E288 E289 A295 S296	E288-L292 PolarHBondContact O-N 3.35Å; E289-L292 PolarHBondContact O-N 2.69Å; L292-A295 PolarHBondContact O-N 3.46Å; L292-S296 PolarHBondContact O-N 2.91Å
293	Y	95.8	Very high	94.6	Very high	16 Å²	16	62.4 Å²	62.4	6%	0.063	35%	0.345	C	S	.	.	H	α-helix	trans	-60.9	-52.7	175.5	172.4	-110.5	0	0	0	111.6	Y282 E289 P290 L291 A295 S296 L297 F339 K342	Y282-Y293 AromaticContact CD2-CD1 3.49Å; Y282-Y293 HydrophobicContact CD2-CD1 3.49Å; Y282-Y293 VanDerWaalsContact CD2-CD1 3.49Å; Y282-Y293 AromaticContact CD2-CE1 3.97Å; Y282-Y293 HydrophobicContact CD2-CE1 3.97Å; Y282-Y293 AromaticContact CD2-CG 3.96Å; Y282-Y293 HydrophobicContact CD2-CG 3.96Å; Y282-Y293 HydrophobicContact CE2-CD1 4.04Å; Y282-Y293 HydrophobicContact CE2-CG 4.04Å; Y282-Y293 HydrophobicContact CG-CD1 4.48Å; E289-Y293 PolarHBondContact O-N 2.79Å; P290-Y293 WeakPolarHBondContact O-CB 3.25Å; P290-Y293 PolarHBondContact O-N 2.95Å; L291-Y293 VanDerWaalsContact C-N 3.34Å; Y293-A295 VanDerWaalsContact C-N 3.33Å; Y293-A295 PolarHBondContact O-N 2.76Å; Y293-S296 WeakPolarHBondContact O-CB 3.33Å; Y293-S296 PolarHBondContact O-N 2.69Å; Y293-S296 VanDerWaalsContact O-N 3.17Å; Y293-S296 PolarHBondContact O-OG 3.49Å; Y293-L297 HydrophobicContact CE1-CD1 4.04Å; Y293-L297 HydrophobicContact CE2-CD1 4.32Å; Y293-F339 HydrophobicContact CE1-CD2 4.42Å; Y293-F339 VanDerWaalsContact OH-CA 3.26Å; Y293-F339 WeakPolarHBondContact OH-CA 3.45Å; Y293-F339 WeakPolarHBondContact OH-CB 3.35Å; Y293-F339 PolarHBondContact OH-N 2.89Å; Y293-K342 HydrophobicContact CD2-CD 4.11Å; Y293-K342 HydrophobicContact CE2-CD 3.66Å
294	F	96.5	Very high	94.3	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-69.1	-30.5	-179.8	-69	-64.2	0	0	0	113	L274 I281 P290 L291 S296 L297 G298 Y299 L311 L314 L335	L274-F294 HydrophobicContact CD1-CE2 3.55Å; L274-F294 HydrophobicContact CD1-CZ 3.8Å; I281-F294 HydrophobicContact CG2-CE1 3.91Å; I281-F294 HydrophobicContact CG2-CZ 3.87Å; P290-F294 HydrophobicContact CB-CE2 4.36Å; P290-F294 WeakPolarHBondContact O-CD2 3.22Å; P290-F294 PolarHBondContact O-N 3.35Å; L291-F294 PolarHBondContact O-N 3.39Å; F294-S296 VanDerWaalsContact C-N 3.3Å; F294-S296 PolarHBondContact O-N 2.94Å; F294-L297 HydrophobicContact CD1-CD1 4.41Å; F294-L297 CarbonylContact O-C 3.51Å; F294-L297 WeakPolarHBondContact O-CA 3.32Å; F294-L297 WeakPolarHBondContact O-CB 3.39Å; F294-L297 PolarHBondContact O-N 2.98Å; F294-L297 VanDerWaalsContact O-N 3.07Å; F294-G298 PolarHBondContact O-N 3.42Å; F294-Y299 CarbonylContact C-O 3.55Å; F294-Y299 VanDerWaalsContact C-O 3.3Å; F294-Y299 WeakPolarHBondContact O-CB 3.31Å; F294-Y299 PolarHBondContact O-N 3.46Å; F294-L311 HydrophobicContact CD2-CD2 3.4Å; F294-L311 HydrophobicContact CE2-CD2 3.52Å; F294-L314 HydrophobicContact CB-CD2 3.89Å; F294-L314 HydrophobicContact CD1-CD2 3.55Å; F294-L314 HydrophobicContact CD2-CD2 4.11Å; F294-L314 HydrophobicContact CE1-CD2 4.09Å; F294-L314 HydrophobicContact CG-CD2 3.58Å; F294-L335 HydrophobicContact CD1-CD2 3.99Å; F294-L335 HydrophobicContact CE1-CD1 4.26Å; F294-L335 HydrophobicContact CE1-CD2 4.01Å
295	A	95.9	Very high	94.1	Very high	25 Å²	25	71.2 Å²	71.2	21%	0.207	39%	0.385	C	S	.	.	H	α-helix	trans	-62.1	-37.4	171.6	0	0	0	0	0	111.8	L291 L292 Y293 L297 G298 Y299	L291-A295 WeakPolarHBondContact O-CB 3.33Å; L291-A295 PolarHBondContact O-N 3.05Å; L292-A295 PolarHBondContact O-N 3.46Å; Y293-A295 VanDerWaalsContact C-N 3.33Å; Y293-A295 PolarHBondContact O-N 2.76Å; A295-L297 PolarHBondContact O-N 3.45Å; A295-G298 PolarHBondContact O-N 3.18Å; A295-Y299 WeakPolarHBondContact CA-O 3.49Å; A295-Y299 PolarHBondContact N-O 2.9Å
296	S	95	Very high	94	Very high	94 Å²	94	70 Å²	70	66%	0.657	38%	0.375	S	S	*	.	H	α-helix	trans	-63.8	-22.2	174.5	77	0	0	0	0	113.5	L292 Y293 F294	L292-S296 PolarHBondContact O-N 2.91Å; Y293-S296 WeakPolarHBondContact O-CB 3.33Å; Y293-S296 PolarHBondContact O-N 2.69Å; Y293-S296 VanDerWaalsContact O-N 3.17Å; Y293-S296 PolarHBondContact O-OG 3.49Å; F294-S296 VanDerWaalsContact C-N 3.3Å; F294-S296 PolarHBondContact O-N 2.94Å
297	L	94.6	Very high	94	Very high	49 Å²	49	71.5 Å²	71.5	26%	0.257	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	6.6	173.8	-58.1	176.8	0	0	0	112.8	Y293 F294 A295 Y299 L335 E338	Y293-L297 HydrophobicContact CE1-CD1 4.04Å; Y293-L297 HydrophobicContact CE2-CD1 4.32Å; F294-L297 HydrophobicContact CD1-CD1 4.41Å; F294-L297 CarbonylContact O-C 3.51Å; F294-L297 WeakPolarHBondContact O-CA 3.32Å; F294-L297 WeakPolarHBondContact O-CB 3.39Å; F294-L297 PolarHBondContact O-N 2.98Å; F294-L297 VanDerWaalsContact O-N 3.07Å; A295-L297 PolarHBondContact O-N 3.45Å; L297-Y299 HydrophobicContact CB-CD2 4.07Å; L297-Y299 HydrophobicContact CB-CE2 4.33Å; L297-L335 HydrophobicContact CD1-CD2 3.66Å; L297-E338 HydrophobicContact CD1-CB 4.27Å; L297-E338 HydrophobicContact CD2-CB 4.25Å; L297-E338 HydrophobicContact CD2-CG 3.99Å
298	G	95.2	Very high	94	Very high	53 Å²	53	66.8 Å²	66.8	55%	0.546	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.2	6.6	178.5	0	0	0	0	0	115.6	F294 A295	F294-G298 PolarHBondContact O-N 3.42Å; A295-G298 PolarHBondContact O-N 3.18Å
299	Y	95.8	Very high	94	Very high	75 Å²	75	64.8 Å²	64.8	29%	0.294	36%	0.355	S	S	.	.			trans	-103	94.8	179	-58.1	-75	0	0	0	111.2	F294 A295 L297 L314 R331 L335	F294-Y299 CarbonylContact C-O 3.55Å; F294-Y299 VanDerWaalsContact C-O 3.3Å; F294-Y299 WeakPolarHBondContact O-CB 3.31Å; F294-Y299 PolarHBondContact O-N 3.46Å; A295-Y299 WeakPolarHBondContact CA-O 3.49Å; A295-Y299 PolarHBondContact N-O 2.9Å; L297-Y299 HydrophobicContact CB-CD2 4.07Å; L297-Y299 HydrophobicContact CB-CE2 4.33Å; Y299-L314 HydrophobicContact CD1-CD1 3.45Å; Y299-L314 VanDerWaalsContact CD1-CD1 3.45Å; Y299-L314 HydrophobicContact CD2-CD1 4.1Å; Y299-L314 HydrophobicContact CD2-CD2 4.45Å; Y299-L314 HydrophobicContact CE1-CD1 3.82Å; Y299-L314 HydrophobicContact CE2-CD1 4.41Å; Y299-L314 HydrophobicContact CG-CD1 3.62Å; Y299-L314 HydrophobicContact CG-CD2 4.19Å; Y299-R331 HydrophobicContact CE1-CG 4.47Å; Y299-R331 WeakPolarHBondContact OH-CG 3.42Å; Y299-L335 HydrophobicContact CD2-CD2 4.19Å; Y299-L335 HydrophobicContact CE2-CD2 3.8Å
300	H	95.5	Very high	94	Very high	137 Å²	137	62 Å²	62	63%	0.634	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-88.3	131.1	177.1	-64.3	-80.8	0	0	0	111.6	P302 F310	H300-P302 WeakPolarHBondContact O-CD 3.41Å; H300-F310 WeakPolarHBondContact O-CE2 3.15Å
301	C	93.9	Very high	94	Very high	32 Å²	32	62 Å²	62	22%	0.216	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-72.4	124.2	170.8	-175.2	0	0	0	0	109.3	L291 F310	L291-C301 HydrophobicContact CD2-CB 4.02Å; C301-F310 HydrophobicContact CB-CB 4.48Å; C301-F310 HydrophobicContact CB-CD1 3.67Å; C301-F310 HydrophobicContact CB-CD2 4.25Å; C301-F310 HydrophobicContact CB-CE1 3.87Å; C301-F310 HydrophobicContact CB-CE2 4.42Å; C301-F310 HydrophobicContact CB-CG 3.86Å; C301-F310 HydrophobicContact CB-CZ 4.24Å
302	P	93.3	Very high	93.9	Very high	75 Å²	75	60.5 Å²	60.5	49%	0.487	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-63.8	152.8	176.5	-19.1	31.1	0	0	0	112.3	H300 V305	H300-P302 WeakPolarHBondContact O-CD 3.41Å; P302-V305 HydrophobicContact CB-CG2 3.82Å; P302-V305 HydrophobicContact CG-CG2 4.12Å; P302-V305 PolarHBondContact O-N 3.42Å
303	D	87.4	Confident	93.7	Very high	144 Å²	144	59.1 Å²	59.1	77%	0.77	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	141.9	173	-63.7	-38.5	0	0	0	110.6	V305	D303-V305 PolarHBondContact O-N 2.84Å
304	H	88.2	Confident	93.7	Very high	200 Å²	200	58.8 Å²	58.8	93%	0.926	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	3.7	-179	-45.6	-66.3	0	0	0	116.6
305	V	92.1	Very high	93.6	Very high	57 Å²	57	58.8 Å²	58.8	35%	0.345	33%	0.327	S	S	.	.	S	Bend	trans	-85.6	139.5	170.4	178	0	0	0	0	109.6	P302 D303 P307 F310	P302-V305 HydrophobicContact CB-CG2 3.82Å; P302-V305 HydrophobicContact CG-CG2 4.12Å; P302-V305 PolarHBondContact O-N 3.42Å; D303-V305 PolarHBondContact O-N 2.84Å; V305-P307 WeakPolarHBondContact O-CD 3.39Å; V305-F310 HydrophobicContact CG1-CB 4.11Å
306	N	92.5	Very high	93.5	Very high	32 Å²	32	59 Å²	59	17%	0.171	33%	0.327	C	S	.	.			trans	-64.4	122.3	174.4	176.3	9.1	0	0	0	109.6	P261 G263 A308 E309 F310	P261-N306 PolarHBondContact O-ND2 3.4Å; G263-N306 PolarHBondContact N-ND2 3.17Å; N306-A308 PolarHBondContact O-N 3.47Å; N306-A308 VanDerWaalsContact O-N 3.13Å; N306-A308 PolarHBondContact OD1-N 2.88Å; N306-E309 HydrophobicContact CB-CB 3.97Å; N306-E309 WeakPolarHBondContact O-CB 3.39Å; N306-E309 PolarHBondContact O-N 3.33Å; N306-F310 PolarHBondContact O-N 2.96Å
307	P	93.9	Very high	93.4	Very high	34 Å²	34	55.3 Å²	55.3	22%	0.221	30%	0.3	C	S	.	.	H	α-helix	trans	-51.4	-40.4	179.5	-32.6	38.7	0	0	0	113.8	Y266 L291 V305 E309 F310 L311	Y266-P307 HydrophobicContact CD1-CB 3.95Å; Y266-P307 HydrophobicContact CD1-CG 4.37Å; Y266-P307 HydrophobicContact CE1-CB 3.56Å; Y266-P307 HydrophobicContact CE1-CG 4.2Å; L291-P307 HydrophobicContact CD1-CB 4.03Å; L291-P307 HydrophobicContact CD1-CG 4.08Å; L291-P307 HydrophobicContact CD2-CB 4.14Å; L291-P307 HydrophobicContact CG-CB 4.47Å; V305-P307 WeakPolarHBondContact O-CD 3.39Å; P307-E309 VanDerWaalsContact C-N 3.29Å; P307-E309 PolarHBondContact O-N 3.43Å; P307-F310 PolarHBondContact O-N 3.22Å; P307-L311 WeakPolarHBondContact O-CB 3.31Å; P307-L311 WeakPolarHBondContact O-CG 3.48Å; P307-L311 PolarHBondContact O-N 3.27Å
308	A	93.3	Very high	93.3	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-66.3	-32.3	-180	0	0	0	0	0	113.1	M93 P261 Y266 N306 A312	M93-A308 HydrophobicContact CE-CB 4.42Å; M93-A308 HydrophobicContact SD-CB 4.12Å; P261-A308 HydrophobicContact CG-CB 3.71Å; Y266-A308 HydrophobicContact CD2-CB 3.67Å; Y266-A308 HydrophobicContact CE2-CB 4.35Å; Y266-A308 HydrophobicContact CG-CB 4.04Å; N306-A308 PolarHBondContact O-N 3.47Å; N306-A308 VanDerWaalsContact O-N 3.13Å; N306-A308 PolarHBondContact OD1-N 2.88Å; A308-A312 VanDerWaalsContact O-CB 3.29Å; A308-A312 WeakPolarHBondContact O-CB 3.24Å; A308-A312 PolarHBondContact O-N 3.43Å; A308-A312 VanDerWaalsContact O-N 3.09Å
309	E	93.3	Very high	93.1	Very high	97 Å²	97	61.3 Å²	61.3	45%	0.453	31%	0.31	S	S	.	.	H	α-helix	trans	-73.6	-48.1	177.8	-170.7	170.6	-173	0	0	110.1	N306 P307 L311 A312 D313	N306-E309 HydrophobicContact CB-CB 3.97Å; N306-E309 WeakPolarHBondContact O-CB 3.39Å; N306-E309 PolarHBondContact O-N 3.33Å; P307-E309 VanDerWaalsContact C-N 3.29Å; P307-E309 PolarHBondContact O-N 3.43Å; E309-L311 VanDerWaalsContact C-N 3.35Å; E309-L311 PolarHBondContact O-N 2.88Å; E309-A312 PolarHBondContact O-N 3.48Å; E309-A312 VanDerWaalsContact O-N 3.11Å; E309-D313 PolarHBondContact O-N 3.32Å
310	F	95.1	Very high	92.9	Very high	28 Å²	28	62 Å²	62	12%	0.123	33%	0.325	C	S	.	.	H	α-helix	trans	-54.3	-49.2	173.2	169.6	-103.2	0	0	0	112.3	L291 H300 C301 V305 N306 P307 A312 D313 L314	L291-F310 HydrophobicContact CD2-CD1 3.85Å; L291-F310 HydrophobicContact CD2-CE1 4.22Å; H300-F310 WeakPolarHBondContact O-CE2 3.15Å; C301-F310 HydrophobicContact CB-CB 4.48Å; C301-F310 HydrophobicContact CB-CD1 3.67Å; C301-F310 HydrophobicContact CB-CD2 4.25Å; C301-F310 HydrophobicContact CB-CE1 3.87Å; C301-F310 HydrophobicContact CB-CE2 4.42Å; C301-F310 HydrophobicContact CB-CG 3.86Å; C301-F310 HydrophobicContact CB-CZ 4.24Å; V305-F310 HydrophobicContact CG1-CB 4.11Å; N306-F310 PolarHBondContact O-N 2.96Å; P307-F310 PolarHBondContact O-N 3.22Å; F310-A312 VanDerWaalsContact C-N 3.32Å; F310-A312 PolarHBondContact O-N 2.88Å; F310-D313 PolarHBondContact O-N 3.42Å; F310-L314 HydrophobicContact CE1-CD2 4.35Å; F310-L314 HydrophobicContact CZ-CD2 4.34Å; F310-L314 WeakPolarHBondContact O-CB 3.43Å; F310-L314 PolarHBondContact O-N 3.47Å
311	L	95.3	Very high	92.9	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.4	-39.6	178.5	-70.4	175.1	0	0	0	111.8	M93 Y266 L274 P290 L291 F294 P307 E309 I315	M93-L311 HydrophobicContact CE-CB 3.64Å; M93-L311 HydrophobicContact CE-CD1 4.14Å; Y266-L311 HydrophobicContact CE2-CD1 4.21Å; L274-L311 HydrophobicContact CD1-CB 4.37Å; L274-L311 HydrophobicContact CD1-CD1 4.42Å; L274-L311 HydrophobicContact CD1-CD2 4.09Å; P290-L311 HydrophobicContact CB-CD1 4.06Å; P290-L311 HydrophobicContact CB-CD2 4.24Å; P290-L311 HydrophobicContact CG-CD1 4.03Å; L291-L311 HydrophobicContact CD2-CD2 4.19Å; L291-L311 HydrophobicContact CD2-CG 4.21Å; F294-L311 HydrophobicContact CD2-CD2 3.4Å; F294-L311 HydrophobicContact CE2-CD2 3.52Å; P307-L311 WeakPolarHBondContact O-CB 3.31Å; P307-L311 WeakPolarHBondContact O-CG 3.48Å; P307-L311 PolarHBondContact O-N 3.27Å; E309-L311 VanDerWaalsContact C-N 3.35Å; E309-L311 PolarHBondContact O-N 2.88Å; L311-I315 VanDerWaalsContact O-CG1 3.24Å; L311-I315 WeakPolarHBondContact O-CG1 3.32Å; L311-I315 PolarHBondContact O-N 3.35Å
312	A	93	Very high	92.9	Very high	3 Å²	3	60.4 Å²	60.4	3%	0.025	34%	0.335	C	S	.	.	H	α-helix	trans	-66.1	-41.9	177.6	0	0	0	0	0	112	Q260 A308 E309 F310 S316	Q260-A312 HydrophobicContact CG-CB 3.82Å; A308-A312 VanDerWaalsContact O-CB 3.29Å; A308-A312 WeakPolarHBondContact O-CB 3.24Å; A308-A312 PolarHBondContact O-N 3.43Å; A308-A312 VanDerWaalsContact O-N 3.09Å; E309-A312 PolarHBondContact O-N 3.48Å; E309-A312 VanDerWaalsContact O-N 3.11Å; F310-A312 VanDerWaalsContact C-N 3.32Å; F310-A312 PolarHBondContact O-N 2.88Å; A312-S316 WeakPolarHBondContact O-CB 3.44Å; A312-S316 PolarHBondContact O-N 2.73Å; A312-S316 PolarHBondContact O-OG 3.42Å
313	D	92.3	Very high	92.9	Very high	90 Å²	90	64.7 Å²	64.7	48%	0.481	35%	0.349	S	S	.	.	H	α-helix	trans	-67.8	-40.4	178.8	-69.9	-13.8	0	0	0	111.7	E309 F310 I315 S316 R331	E309-D313 PolarHBondContact O-N 3.32Å; F310-D313 PolarHBondContact O-N 3.42Å; D313-I315 VanDerWaalsContact C-N 3.3Å; D313-I315 PolarHBondContact O-N 3.26Å; D313-S316 PolarHBondContact O-N 2.83Å; D313-R331 PolarHBondContact O-NH2 3.21Å
314	L	94.8	Very high	93.2	Very high	10 Å²	10	59 Å²	59	5%	0.052	32%	0.32	C	S	.	.	H	α-helix	trans	-58.9	-42.2	178.5	-179.4	59.9	0	0	0	111.9	F294 Y299 F310 R331 L335	F294-L314 HydrophobicContact CB-CD2 3.89Å; F294-L314 HydrophobicContact CD1-CD2 3.55Å; F294-L314 HydrophobicContact CD2-CD2 4.11Å; F294-L314 HydrophobicContact CE1-CD2 4.09Å; F294-L314 HydrophobicContact CG-CD2 3.58Å; Y299-L314 HydrophobicContact CD1-CD1 3.45Å; Y299-L314 VanDerWaalsContact CD1-CD1 3.45Å; Y299-L314 HydrophobicContact CD2-CD1 4.1Å; Y299-L314 HydrophobicContact CD2-CD2 4.45Å; Y299-L314 HydrophobicContact CE1-CD1 3.82Å; Y299-L314 HydrophobicContact CE2-CD1 4.41Å; Y299-L314 HydrophobicContact CG-CD1 3.62Å; Y299-L314 HydrophobicContact CG-CD2 4.19Å; F310-L314 HydrophobicContact CE1-CD2 4.35Å; F310-L314 HydrophobicContact CZ-CD2 4.34Å; F310-L314 WeakPolarHBondContact O-CB 3.43Å; F310-L314 PolarHBondContact O-N 3.47Å; L314-R331 VanDerWaalsContact O-CZ 3.31Å; L314-R331 PolarHBondContact O-NE 2.98Å; L314-R331 PolarHBondContact O-NH2 2.91Å; L314-R331 VanDerWaalsContact O-NH2 3.13Å; L314-L335 HydrophobicContact CD1-CD1 4.38Å; L314-L335 HydrophobicContact CG-CD1 4.13Å
315	I	94.6	Very high	93.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	6.2	-176.9	72.2	-171.9	0	0	0	113.7	L274 S276 I281 L311 D313 I332	L274-I315 HydrophobicContact CB-CD1 4.04Å; L274-I315 HydrophobicContact CD2-CD1 4.21Å; L274-I315 HydrophobicContact CG-CD1 4.49Å; S276-I315 VanDerWaalsContact CB-O 3.28Å; S276-I315 WeakPolarHBondContact CB-O 3.23Å; S276-I315 PolarHBondContact OG-O 3.11Å; I281-I315 HydrophobicContact CB-CG2 4.47Å; I281-I315 HydrophobicContact CD1-CB 3.65Å; I281-I315 HydrophobicContact CD1-CG2 3.64Å; I281-I315 HydrophobicContact CG2-CG2 4.04Å; L311-I315 VanDerWaalsContact O-CG1 3.24Å; L311-I315 WeakPolarHBondContact O-CG1 3.32Å; L311-I315 PolarHBondContact O-N 3.35Å; D313-I315 VanDerWaalsContact C-N 3.3Å; D313-I315 PolarHBondContact O-N 3.26Å; I315-I332 WeakPolarHBondContact O-CD1 3.25Å
316	S	94.1	Very high	93.6	Very high	29 Å²	29	54 Å²	54	20%	0.203	30%	0.295	C	S	.	.	S	Bend	trans	-92.9	146.2	178.4	-68.7	0	0	0	0	112.8	P95 A312 D313 R331	P95-S316 WeakPolarHBondContact CB-OG 3.2Å; A312-S316 WeakPolarHBondContact O-CB 3.44Å; A312-S316 PolarHBondContact O-N 2.73Å; A312-S316 PolarHBondContact O-OG 3.42Å; D313-S316 PolarHBondContact O-N 2.83Å; S316-R331 PolarHBondContact O-NH2 2.82Å; S316-R331 VanDerWaalsContact O-NH2 3.1Å
317	V	93.2	Very high	93.7	Very high	17 Å²	17	56 Å²	56	10%	0.103	31%	0.311	C	S	.	.			trans	-84.5	127.7	170.2	-180	0	0	0	0	108.8	E277 Y319 V325 R329 I332	E277-V317 HydrophobicContact CG-CG2 4.39Å; V317-Y319 HydrophobicContact CB-CE2 3.91Å; V317-Y319 HydrophobicContact CG1-CD1 4.34Å; V317-Y319 HydrophobicContact CG1-CD2 4.39Å; V317-Y319 HydrophobicContact CG1-CE1 3.89Å; V317-Y319 HydrophobicContact CG1-CE2 3.96Å; V317-Y319 WeakPolarHBondContact O-CD2 3.36Å; V317-V325 HydrophobicContact CG1-CG1 4.2Å; V317-R329 HydrophobicContact CG1-CG 4.28Å; V317-R329 HydrophobicContact CG2-CG 4.24Å; V317-I332 HydrophobicContact CG2-CD1 3.57Å
318	D	92.3	Very high	93.7	Very high	75 Å²	75	54.5 Å²	54.5	40%	0.401	30%	0.302	S	S	.	.			trans	-89.2	112	176.1	179.6	10.5	0	0	0	110.4	S320 S324 V325 S328	D318-S320 WeakPolarHBondContact OD1-CB 3.41Å; D318-S320 PolarHBondContact OD1-N 3.44Å; D318-S320 PolarHBondContact OD1-OG 3.2Å; D318-S320 PolarHBondContact OD2-OG 2.85Å; D318-S324 CarbonylContact O-C 3.58Å; D318-S324 VanDerWaalsContact O-C 3.29Å; D318-S324 VanDerWaalsContact OD2-CB 3.27Å; D318-S324 WeakPolarHBondContact OD2-CB 3.26Å; D318-S324 PolarHBondContact OD2-OG 2.81Å; D318-V325 VanDerWaalsContact O-CA 3.29Å; D318-V325 WeakPolarHBondContact O-CA 3.41Å; D318-V325 WeakPolarHBondContact O-CG2 3.45Å; D318-V325 PolarHBondContact O-N 2.75Å; D318-S328 PolarHBondContact N-OG 3.01Å
319	Y	91.3	Very high	93.8	Very high	153 Å²	153	59.7 Å²	59.7	60%	0.6	32%	0.322	S	S	*	.			trans	-90.9	11.6	179.1	-62.9	-80.8	0	0	0	114.1	V317 S321 V325	V317-Y319 HydrophobicContact CB-CE2 3.91Å; V317-Y319 HydrophobicContact CG1-CD1 4.34Å; V317-Y319 HydrophobicContact CG1-CD2 4.39Å; V317-Y319 HydrophobicContact CG1-CE1 3.89Å; V317-Y319 HydrophobicContact CG1-CE2 3.96Å; V317-Y319 WeakPolarHBondContact O-CD2 3.36Å; Y319-S321 VanDerWaalsContact C-N 3.32Å; Y319-S321 PolarHBondContact O-N 3.21Å; Y319-V325 HydrophobicContact CD1-CG2 3.75Å; Y319-V325 HydrophobicContact CE1-CG2 4.43Å; Y319-V325 HydrophobicContact CG-CG2 4.35Å
320	S	92.2	Very high	93.9	Very high	88 Å²	88	61.1 Å²	61.1	62%	0.615	33%	0.327	S	S	*	.	S	Bend	trans	-64.1	-33.2	-179.5	63.3	0	0	0	0	113.7	D318 S324	D318-S320 WeakPolarHBondContact OD1-CB 3.41Å; D318-S320 PolarHBondContact OD1-N 3.44Å; D318-S320 PolarHBondContact OD1-OG 3.2Å; D318-S320 PolarHBondContact OD2-OG 2.85Å; S320-S324 WeakPolarHBondContact OG-CB 3.37Å; S320-S324 PolarHBondContact OG-OG 3.07Å
321	S	94.5	Very high	93.9	Very high	49 Å²	49	63.2 Å²	63.2	34%	0.343	33%	0.334	S	S	.	.	S	Bend	trans	-151.5	160.7	177.3	80.3	0	0	0	0	111.3	Y319 E323 S324 V325	Y319-S321 VanDerWaalsContact C-N 3.32Å; Y319-S321 PolarHBondContact O-N 3.21Å; S321-E323 VanDerWaalsContact C-N 3.25Å; S321-E323 PolarHBondContact O-N 3.43Å; S321-S324 WeakPolarHBondContact O-CB 3.31Å; S321-S324 PolarHBondContact O-N 3.05Å; S321-S324 WeakPolarHBondContact OG-CB 3.47Å; S321-S324 PolarHBondContact OG-N 2.96Å; S321-S324 PolarHBondContact OG-OG 3.38Å; S321-V325 WeakPolarHBondContact O-CG2 3.4Å; S321-V325 PolarHBondContact O-N 2.95Å
322	A	93.7	Very high	93.9	Very high	87 Å²	87	63.5 Å²	63.5	72%	0.719	34%	0.335	S	S	*	.	H	α-helix	trans	-60.8	-35.9	176.8	0	0	0	0	0	112.4	V325 Q326	A322-V325 PolarHBondContact O-N 3.1Å; A322-Q326 PolarHBondContact O-N 2.84Å
323	E	94.1	Very high	94	Very high	165 Å²	165	69.1 Å²	69.1	77%	0.771	36%	0.361	S	S	*	.	H	α-helix	trans	-67.6	-41.1	175	-65.2	-179.8	-178	0	0	111.5	S321 Q326 S327	S321-E323 VanDerWaalsContact C-N 3.25Å; S321-E323 PolarHBondContact O-N 3.43Å; E323-Q326 PolarHBondContact O-N 2.82Å; E323-S327 WeakPolarHBondContact O-CB 3.42Å; E323-S327 PolarHBondContact O-N 3.2Å; E323-S327 PolarHBondContact O-OG 3.47Å
324	S	93.7	Very high	94.2	Very high	25 Å²	25	68.6 Å²	68.6	18%	0.175	36%	0.358	C	S	.	.	H	α-helix	trans	-62.5	-41.3	174.5	-56.1	0	0	0	0	111.9	D318 S320 S321 S327 S328	D318-S324 CarbonylContact O-C 3.58Å; D318-S324 VanDerWaalsContact O-C 3.29Å; D318-S324 VanDerWaalsContact OD2-CB 3.27Å; D318-S324 WeakPolarHBondContact OD2-CB 3.26Å; D318-S324 PolarHBondContact OD2-OG 2.81Å; S320-S324 WeakPolarHBondContact OG-CB 3.37Å; S320-S324 PolarHBondContact OG-OG 3.07Å; S321-S324 WeakPolarHBondContact O-CB 3.31Å; S321-S324 PolarHBondContact O-N 3.05Å; S321-S324 WeakPolarHBondContact OG-CB 3.47Å; S321-S324 PolarHBondContact OG-N 2.96Å; S321-S324 PolarHBondContact OG-OG 3.38Å; S324-S327 WeakPolarHBondContact CA-OG 3.47Å; S324-S327 PolarHBondContact O-OG 2.86Å; S324-S328 VanDerWaalsContact O-CB 3.26Å; S324-S328 WeakPolarHBondContact O-CB 3.36Å; S324-S328 PolarHBondContact O-N 2.93Å; S324-S328 PolarHBondContact O-OG 2.88Å
325	V	93.6	Very high	94.2	Very high	24 Å²	24	68.3 Å²	68.3	15%	0.145	36%	0.356	C	S	.	.	H	α-helix	trans	-62.3	-47.2	175.8	173	0	0	0	0	110.3	V317 D318 Y319 S321 A322 S328 R329	V317-V325 HydrophobicContact CG1-CG1 4.2Å; D318-V325 VanDerWaalsContact O-CA 3.29Å; D318-V325 WeakPolarHBondContact O-CA 3.41Å; D318-V325 WeakPolarHBondContact O-CG2 3.45Å; D318-V325 PolarHBondContact O-N 2.75Å; Y319-V325 HydrophobicContact CD1-CG2 3.75Å; Y319-V325 HydrophobicContact CE1-CG2 4.43Å; Y319-V325 HydrophobicContact CG-CG2 4.35Å; S321-V325 WeakPolarHBondContact O-CG2 3.4Å; S321-V325 PolarHBondContact O-N 2.95Å; A322-V325 PolarHBondContact O-N 3.1Å; V325-S328 PolarHBondContact O-OG 2.85Å; V325-R329 HydrophobicContact CG1-CG 4.48Å; V325-R329 WeakPolarHBondContact O-CB 3.33Å; V325-R329 VanDerWaalsContact O-CG 3.32Å; V325-R329 WeakPolarHBondContact O-CG 3.25Å; V325-R329 PolarHBondContact O-N 2.96Å
326	Q	94.1	Very high	94.1	Very high	127 Å²	127	69.1 Å²	69.1	59%	0.593	36%	0.361	S	S	*	.	H	α-helix	trans	-65.2	-44.8	-177.9	-169.7	64.4	21.9	0	0	111.9	A322 E323 K330	A322-Q326 PolarHBondContact O-N 2.84Å; E323-Q326 PolarHBondContact O-N 2.82Å; Q326-K330 WeakPolarHBondContact O-CB 3.44Å; Q326-K330 PolarHBondContact O-N 3.38Å
327	S	95	Very high	94.1	Very high	74 Å²	74	73.4 Å²	73.4	52%	0.517	38%	0.378	S	S	.	.	H	α-helix	trans	-67	-42.9	179.2	56	0	0	0	0	112.6	E323 S324 K330 R331	E323-S327 WeakPolarHBondContact O-CB 3.42Å; E323-S327 PolarHBondContact O-N 3.2Å; E323-S327 PolarHBondContact O-OG 3.47Å; S324-S327 WeakPolarHBondContact CA-OG 3.47Å; S324-S327 PolarHBondContact O-OG 2.86Å; S327-K330 PolarHBondContact O-N 3.18Å; S327-R331 PolarHBondContact O-N 3.07Å
328	S	95.1	Very high	94.2	Very high	4 Å²	4	77.1 Å²	77.1	3%	0.028	39%	0.394	C	S	.	.	H	α-helix	trans	-68.4	-37.9	177.3	57.2	0	0	0	0	112.8	D318 S324 V325 R331 I332	D318-S328 PolarHBondContact N-OG 3.01Å; S324-S328 VanDerWaalsContact O-CB 3.26Å; S324-S328 WeakPolarHBondContact O-CB 3.36Å; S324-S328 PolarHBondContact O-N 2.93Å; S324-S328 PolarHBondContact O-OG 2.88Å; V325-S328 PolarHBondContact O-OG 2.85Å; S328-R331 WeakPolarHBondContact O-CB 3.47Å; S328-R331 PolarHBondContact O-N 3.43Å; S328-I332 WeakPolarHBondContact O-CG1 3.28Å; S328-I332 PolarHBondContact O-N 2.6Å
329	R	94.6	Very high	94.2	Very high	108 Å²	108	74.4 Å²	74.4	41%	0.408	38%	0.379	S	S	.	.	H	α-helix	trans	-63	-45.8	171.7	-78.8	-178.9	173.2	175.9	-1.9	112.4	V317 V325 R331 I332 E333	V317-R329 HydrophobicContact CG1-CG 4.28Å; V317-R329 HydrophobicContact CG2-CG 4.24Å; V325-R329 HydrophobicContact CG1-CG 4.48Å; V325-R329 WeakPolarHBondContact O-CB 3.33Å; V325-R329 VanDerWaalsContact O-CG 3.32Å; V325-R329 WeakPolarHBondContact O-CG 3.25Å; V325-R329 PolarHBondContact O-N 2.96Å; R329-R331 VanDerWaalsContact C-N 3.28Å; R329-R331 PolarHBondContact O-N 2.73Å; R329-I332 PolarHBondContact O-N 3.02Å; R329-I332 VanDerWaalsContact O-N 3.09Å; R329-E333 WeakPolarHBondContact O-CG 3.46Å; R329-E333 PolarHBondContact O-N 2.74Å
330	K	95.3	Very high	94.1	Very high	128 Å²	128	70.1 Å²	70.1	56%	0.557	37%	0.371	S	S	*	.	H	α-helix	trans	-59.4	-40.9	176.1	-171.7	178.2	-177.5	-179.3	0	111.6	Q326 S327 N334	Q326-K330 WeakPolarHBondContact O-CB 3.44Å; Q326-K330 PolarHBondContact O-N 3.38Å; S327-K330 PolarHBondContact O-N 3.18Å; K330-N334 VanDerWaalsContact O-CG 3.22Å; K330-N334 PolarHBondContact O-N 3.33Å; K330-N334 PolarHBondContact O-OD1 3.13Å
331	R	96.2	Very high	94	Very high	71 Å²	71	69.6 Å²	69.6	27%	0.268	36%	0.361	S	S	.	.	H	α-helix	trans	-58	-49	172.5	175.5	177	73.6	-155.7	-0.2	111.4	Y299 D313 L314 S316 S327 S328 R329 N334 L335	Y299-R331 HydrophobicContact CE1-CG 4.47Å; Y299-R331 WeakPolarHBondContact OH-CG 3.42Å; D313-R331 PolarHBondContact O-NH2 3.21Å; L314-R331 VanDerWaalsContact O-CZ 3.31Å; L314-R331 PolarHBondContact O-NE 2.98Å; L314-R331 PolarHBondContact O-NH2 2.91Å; L314-R331 VanDerWaalsContact O-NH2 3.13Å; S316-R331 PolarHBondContact O-NH2 2.82Å; S316-R331 VanDerWaalsContact O-NH2 3.1Å; S327-R331 PolarHBondContact O-N 3.07Å; S328-R331 WeakPolarHBondContact O-CB 3.47Å; S328-R331 PolarHBondContact O-N 3.43Å; R329-R331 VanDerWaalsContact C-N 3.28Å; R329-R331 PolarHBondContact O-N 2.73Å; R331-N334 PolarHBondContact O-N 3.37Å; R331-L335 HydrophobicContact CG-CD1 4.28Å; R331-L335 WeakPolarHBondContact O-CG 3.29Å; R331-L335 PolarHBondContact O-N 3.46Å
332	I	95.2	Very high	93.7	Very high	6 Å²	6	71.7 Å²	71.7	3%	0.031	36%	0.364	C	S	.	.	H	α-helix	trans	-64.4	-44.3	-179.1	-70.5	163.9	0	0	0	111.4	I281 I315 V317 S328 R329 N334 L335 I336	I281-I332 HydrophobicContact CD1-CG2 4.14Å; I315-I332 WeakPolarHBondContact O-CD1 3.25Å; V317-I332 HydrophobicContact CG2-CD1 3.57Å; S328-I332 WeakPolarHBondContact O-CG1 3.28Å; S328-I332 PolarHBondContact O-N 2.6Å; R329-I332 PolarHBondContact O-N 3.02Å; R329-I332 VanDerWaalsContact O-N 3.09Å; I332-N334 VanDerWaalsContact C-N 3.34Å; I332-N334 PolarHBondContact O-N 3.42Å; I332-L335 PolarHBondContact O-N 3.43Å; I332-L335 VanDerWaalsContact O-N 3.15Å; I332-I336 HydrophobicContact CG2-CD1 3.65Å; I332-I336 HydrophobicContact CG2-CG1 4.33Å; I332-I336 VanDerWaalsContact O-CG1 3.29Å; I332-I336 WeakPolarHBondContact O-CG1 3.48Å; I332-I336 PolarHBondContact O-N 3.41Å
333	E	94.9	Very high	93.2	Very high	122 Å²	122	70 Å²	70	57%	0.57	35%	0.345	S	S	*	.	H	α-helix	trans	-55.8	-48.4	175.6	-75.9	172.5	179.4	0	0	111.2	R329 L335 I336 E337	R329-E333 WeakPolarHBondContact O-CG 3.46Å; R329-E333 PolarHBondContact O-N 2.74Å; E333-L335 VanDerWaalsContact C-N 3.34Å; E333-L335 PolarHBondContact O-N 2.97Å; E333-I336 PolarHBondContact O-N 3.39Å; E333-E337 PolarHBondContact O-N 3.31Å
334	N	95.3	Very high	92.6	Very high	78 Å²	78	64.8 Å²	64.8	42%	0.417	33%	0.33	S	S	.	.	H	α-helix	trans	-59.4	-43.2	176	-69	3.2	0	0	0	112.2	K330 R331 I332 I336 E337 E338	K330-N334 VanDerWaalsContact O-CG 3.22Å; K330-N334 PolarHBondContact O-N 3.33Å; K330-N334 PolarHBondContact O-OD1 3.13Å; R331-N334 PolarHBondContact O-N 3.37Å; I332-N334 VanDerWaalsContact C-N 3.34Å; I332-N334 PolarHBondContact O-N 3.42Å; N334-I336 VanDerWaalsContact C-N 3.32Å; N334-I336 PolarHBondContact O-N 3.08Å; N334-E337 PolarHBondContact O-N 3.28Å; N334-E338 WeakPolarHBondContact O-CG 3.3Å; N334-E338 PolarHBondContact O-N 3.15Å
335	L	95.5	Very high	91.8	Very high	4 Å²	4	68.4 Å²	68.4	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-64.9	-36.3	179.1	-69.5	176.5	0	0	0	112.4	I281 F294 L297 Y299 L314 R331 I332 E333 F339	I281-L335 HydrophobicContact CG2-CB 3.88Å; I281-L335 HydrophobicContact CG2-CD1 4.34Å; F294-L335 HydrophobicContact CD1-CD2 3.99Å; F294-L335 HydrophobicContact CE1-CD1 4.26Å; F294-L335 HydrophobicContact CE1-CD2 4.01Å; L297-L335 HydrophobicContact CD1-CD2 3.66Å; Y299-L335 HydrophobicContact CD2-CD2 4.19Å; Y299-L335 HydrophobicContact CE2-CD2 3.8Å; L314-L335 HydrophobicContact CD1-CD1 4.38Å; L314-L335 HydrophobicContact CG-CD1 4.13Å; R331-L335 HydrophobicContact CG-CD1 4.28Å; R331-L335 WeakPolarHBondContact O-CG 3.29Å; R331-L335 PolarHBondContact O-N 3.46Å; I332-L335 PolarHBondContact O-N 3.43Å; I332-L335 VanDerWaalsContact O-N 3.15Å; E333-L335 VanDerWaalsContact C-N 3.34Å; E333-L335 PolarHBondContact O-N 2.97Å; L335-F339 WeakPolarHBondContact O-CB 3.39Å; L335-F339 PolarHBondContact O-N 3.04Å; L335-F339 VanDerWaalsContact O-N 3.09Å
336	I	93.2	Very high	90.9	Very high	18 Å²	18	71.2 Å²	71.2	9%	0.092	36%	0.364	C	S	.	.	H	α-helix	trans	-67	-43.6	176.3	-68.1	163.9	0	0	0	110.4	E279 I281 I332 E333 N334 F339 S340	E279-I336 HydrophobicContact CB-CD1 3.73Å; E279-I336 HydrophobicContact CB-CG1 4.21Å; E279-I336 HydrophobicContact CB-CG2 4.4Å; E279-I336 HydrophobicContact CG-CD1 4.46Å; I281-I336 HydrophobicContact CG1-CG1 3.82Å; I332-I336 HydrophobicContact CG2-CD1 3.65Å; I332-I336 HydrophobicContact CG2-CG1 4.33Å; I332-I336 VanDerWaalsContact O-CG1 3.29Å; I332-I336 WeakPolarHBondContact O-CG1 3.48Å; I332-I336 PolarHBondContact O-N 3.41Å; E333-I336 PolarHBondContact O-N 3.39Å; N334-I336 VanDerWaalsContact C-N 3.32Å; N334-I336 PolarHBondContact O-N 3.08Å; I336-F339 PolarHBondContact O-N 3.4Å; I336-S340 WeakPolarHBondContact O-CB 3.32Å; I336-S340 PolarHBondContact O-N 3.46Å; I336-S340 PolarHBondContact O-OG 3.26Å
337	E	93.7	Very high	89.6	Confident	119 Å²	119	70.4 Å²	70.4	56%	0.556	36%	0.36	S	S	*	.	H	α-helix	trans	-62.7	-49.4	178.2	-170.1	179.4	177	0	0	111.3	E333 N334 F339 S340 N341	E333-E337 PolarHBondContact O-N 3.31Å; N334-E337 PolarHBondContact O-N 3.28Å; E337-F339 VanDerWaalsContact C-N 3.32Å; E337-F339 PolarHBondContact O-N 3.18Å; E337-S340 PolarHBondContact O-N 2.78Å; E337-N341 WeakPolarHBondContact O-CB 3.47Å; E337-N341 VanDerWaalsContact O-CG 3.29Å; E337-N341 PolarHBondContact O-N 2.98Å; E337-N341 PolarHBondContact O-ND2 2.87Å
338	E	94	Very high	87.9	Confident	95 Å²	95	70.1 Å²	70.1	44%	0.444	36%	0.358	S	S	.	.	H	α-helix	trans	-58.6	-42.5	177.1	-74	-65.5	168.7	0	0	112.3	L297 N334 N341 K342	L297-E338 HydrophobicContact CD1-CB 4.27Å; L297-E338 HydrophobicContact CD2-CB 4.25Å; L297-E338 HydrophobicContact CD2-CG 3.99Å; N334-E338 WeakPolarHBondContact O-CG 3.3Å; N334-E338 PolarHBondContact O-N 3.15Å; E338-N341 PolarHBondContact O-N 2.9Å; E338-K342 WeakPolarHBondContact O-CB 3.38Å; E338-K342 PolarHBondContact O-N 2.79Å
339	F	92.7	Very high	85.9	Confident	18 Å²	18	76.3 Å²	76.3	8%	0.079	39%	0.391	C	S	.	.	H	α-helix	trans	-67.6	-42.4	177.8	-174.2	-108.2	0	0	0	112	V280 I281 Y282 M283 Y293 L335 I336 E337 N341 K342 V343	V280-F339 HydrophobicContact CG1-CD1 4.25Å; V280-F339 HydrophobicContact CG1-CE1 3.7Å; V280-F339 HydrophobicContact CG1-CZ 4.47Å; I281-F339 WeakPolarHBondContact O-CB 3.32Å; I281-F339 WeakPolarHBondContact O-CD2 3.34Å; I281-F339 WeakPolarHBondContact O-CG 3.22Å; Y282-F339 HydrophobicContact CD2-CE2 4.34Å; M283-F339 HydrophobicContact CB-CE1 4.48Å; M283-F339 HydrophobicContact CB-CZ 3.87Å; Y293-F339 HydrophobicContact CE1-CD2 4.42Å; Y293-F339 VanDerWaalsContact OH-CA 3.26Å; Y293-F339 WeakPolarHBondContact OH-CA 3.45Å; Y293-F339 WeakPolarHBondContact OH-CB 3.35Å; Y293-F339 PolarHBondContact OH-N 2.89Å; L335-F339 WeakPolarHBondContact O-CB 3.39Å; L335-F339 PolarHBondContact O-N 3.04Å; L335-F339 VanDerWaalsContact O-N 3.09Å; I336-F339 PolarHBondContact O-N 3.4Å; E337-F339 VanDerWaalsContact C-N 3.32Å; E337-F339 PolarHBondContact O-N 3.18Å; F339-N341 VanDerWaalsContact C-N 3.33Å; F339-N341 PolarHBondContact O-N 3.42Å; F339-K342 PolarHBondContact O-N 2.65Å; F339-V343 HydrophobicContact CD1-CG2 4.18Å; F339-V343 HydrophobicContact CE1-CG2 3.66Å; F339-V343 HydrophobicContact CE2-CG2 4.08Å; F339-V343 HydrophobicContact CZ-CG2 3.58Å; F339-V343 WeakPolarHBondContact O-CG2 3.19Å; F339-V343 PolarHBondContact O-N 3.28Å
340	S	89.5	Confident	83.8	Confident	62 Å²	62	74.5 Å²	74.5	43%	0.434	39%	0.394	S	S	.	.	H	α-helix	trans	-60.9	-43.4	177.6	-59.4	0	0	0	0	111.2	I336 E337 V343 A344	I336-S340 WeakPolarHBondContact O-CB 3.32Å; I336-S340 PolarHBondContact O-N 3.46Å; I336-S340 PolarHBondContact O-OG 3.26Å; E337-S340 PolarHBondContact O-N 2.78Å; S340-V343 PolarHBondContact O-N 2.86Å; S340-A344 WeakPolarHBondContact O-CB 3.32Å; S340-A344 PolarHBondContact O-N 3.33Å
341	N	89.6	Confident	80.9	Confident	77 Å²	77	72.3 Å²	72.3	41%	0.412	40%	0.395	S	S	.	.	H	α-helix	trans	-61.6	-45.6	175	-72.1	-23.1	0	0	0	111.7	E337 E338 F339 V343 A344 I345	E337-N341 WeakPolarHBondContact O-CB 3.47Å; E337-N341 VanDerWaalsContact O-CG 3.29Å; E337-N341 PolarHBondContact O-N 2.98Å; E337-N341 PolarHBondContact O-ND2 2.87Å; E338-N341 PolarHBondContact O-N 2.9Å; F339-N341 VanDerWaalsContact C-N 3.33Å; F339-N341 PolarHBondContact O-N 3.42Å; N341-V343 VanDerWaalsContact C-N 3.34Å; N341-V343 PolarHBondContact O-N 2.82Å; N341-A344 PolarHBondContact O-N 3.42Å; N341-I345 WeakPolarHBondContact O-CD1 3.23Å; N341-I345 VanDerWaalsContact O-CG1 3.25Å; N341-I345 WeakPolarHBondContact O-CG1 3.48Å; N341-I345 PolarHBondContact O-N 3.04Å
342	K	88.2	Confident	78	Confident	93 Å²	93	77.1 Å²	77.1	40%	0.404	43%	0.425	S	S	.	.	H	α-helix	trans	-60.1	-42.8	176.8	-178.6	179.3	175.8	-177.9	0	112.3	Y293 E338 F339 T346	Y293-K342 HydrophobicContact CD2-CD 4.11Å; Y293-K342 HydrophobicContact CE2-CD 3.66Å; E338-K342 WeakPolarHBondContact O-CB 3.38Å; E338-K342 PolarHBondContact O-N 2.79Å; F339-K342 PolarHBondContact O-N 2.65Å; K342-T346 WeakPolarHBondContact O-CB 3.22Å; K342-T346 PolarHBondContact O-N 3Å; K342-T346 PolarHBondContact O-OG1 2.92Å
343	V	84.5	Confident	74.9	Confident	53 Å²	53	82.7 Å²	82.7	32%	0.321	46%	0.46	S	S	.	.	H	α-helix	trans	-64.8	-46.3	177.1	172.9	0	0	0	0	110.4	F339 S340 N341 I345 T346 E347	F339-V343 HydrophobicContact CD1-CG2 4.18Å; F339-V343 HydrophobicContact CE1-CG2 3.66Å; F339-V343 HydrophobicContact CE2-CG2 4.08Å; F339-V343 HydrophobicContact CZ-CG2 3.58Å; F339-V343 WeakPolarHBondContact O-CG2 3.19Å; F339-V343 PolarHBondContact O-N 3.28Å; S340-V343 PolarHBondContact O-N 2.86Å; N341-V343 VanDerWaalsContact C-N 3.34Å; N341-V343 PolarHBondContact O-N 2.82Å; V343-I345 VanDerWaalsContact C-N 3.32Å; V343-I345 PolarHBondContact O-N 3.09Å; V343-T346 PolarHBondContact O-N 3.1Å; V343-E347 HydrophobicContact CG1-CG 4.29Å; V343-E347 PolarHBondContact O-N 2.91Å
344	A	80.4	Confident	72	Confident	55 Å²	55	82.7 Å²	82.7	46%	0.455	46%	0.464	S	S	.	.	H	α-helix	trans	-59.3	-40.6	178.1	0	0	0	0	0	112.7	S340 N341 T346 S348	S340-A344 WeakPolarHBondContact O-CB 3.32Å; S340-A344 PolarHBondContact O-N 3.33Å; N341-A344 PolarHBondContact O-N 3.42Å; A344-T346 VanDerWaalsContact C-N 3.35Å; A344-S348 WeakPolarHBondContact O-CB 3.36Å; A344-S348 PolarHBondContact O-N 3.37Å; A344-S348 PolarHBondContact O-OG 2.9Å; A344-S348 VanDerWaalsContact O-OG 3.12Å
345	I	77.8	Confident	69.1	Low	101 Å²	101	85 Å²	85	52%	0.518	48%	0.483	S	S	.	.	H	α-helix	trans	-66.3	-37.5	175	-65.6	164	0	0	0	111.3	N341 V343 S348 N349	N341-I345 WeakPolarHBondContact O-CD1 3.23Å; N341-I345 VanDerWaalsContact O-CG1 3.25Å; N341-I345 WeakPolarHBondContact O-CG1 3.48Å; N341-I345 PolarHBondContact O-N 3.04Å; V343-I345 VanDerWaalsContact C-N 3.32Å; V343-I345 PolarHBondContact O-N 3.09Å; I345-S348 WeakPolarHBondContact CA-OG 3.42Å; I345-S348 PolarHBondContact O-OG 3.38Å; I345-N349 WeakPolarHBondContact O-CB 3.44Å; I345-N349 PolarHBondContact O-N 3.24Å; I345-N349 VanDerWaalsContact O-N 3.13Å; I345-N349 PolarHBondContact O-ND2 3.35Å; I345-N349 VanDerWaalsContact O-ND2 3.15Å
346	T	75.3	Confident	66	Low	83 Å²	83	93.2 Å²	93.2	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-72.4	-39	179.3	-51.9	0	0	0	0	111.5	K342 V343 A344 S350	K342-T346 WeakPolarHBondContact O-CB 3.22Å; K342-T346 PolarHBondContact O-N 3Å; K342-T346 PolarHBondContact O-OG1 2.92Å; V343-T346 PolarHBondContact O-N 3.1Å; A344-T346 VanDerWaalsContact C-N 3.35Å; T346-S350 WeakPolarHBondContact O-CB 3.26Å; T346-S350 PolarHBondContact O-N 2.91Å; T346-S350 VanDerWaalsContact O-N 3.16Å; T346-S350 PolarHBondContact O-OG 3.44Å
347	E	66.9	Low	63	Low	109 Å²	109	95.9 Å²	95.9	51%	0.509	55%	0.553	S	S	.	*	H	α-helix	trans	-68.5	-40.7	175.4	-72.4	-165.8	153.1	0	0	111.8	R57 V343 N349 S350 S351	R57-E347 IonicContact NH2-OE1 3.64Å; V343-E347 HydrophobicContact CG1-CG 4.29Å; V343-E347 PolarHBondContact O-N 2.91Å; E347-N349 VanDerWaalsContact C-N 3.33Å; E347-N349 PolarHBondContact O-N 3.48Å; E347-S350 WeakPolarHBondContact CA-OG 3.41Å; E347-S350 PolarHBondContact O-N 3.47Å; E347-S350 PolarHBondContact O-OG 2.97Å; E347-S351 PolarHBondContact O-N 3.41Å
348	S	58.3	Low	59.9	Low	69 Å²	69	95.4 Å²	95.4	48%	0.483	56%	0.563	S	S	.	*	H	α-helix	trans	-64.6	-36.9	175.9	64.2	0	0	0	0	112.4	A344 I345 S350 S351	A344-S348 WeakPolarHBondContact O-CB 3.36Å; A344-S348 PolarHBondContact O-N 3.37Å; A344-S348 PolarHBondContact O-OG 2.9Å; A344-S348 VanDerWaalsContact O-OG 3.12Å; I345-S348 WeakPolarHBondContact CA-OG 3.42Å; I345-S348 PolarHBondContact O-OG 3.38Å; S348-S350 VanDerWaalsContact C-N 3.34Å; S348-S350 PolarHBondContact O-N 3.27Å; S348-S351 PolarHBondContact O-OG 2.89Å
349	N	52.7	Low	56.8	Low	134 Å²	134	99.9 Å²	99.9	72%	0.717	58%	0.584	S	S	*	*	H	α-helix	trans	-74.9	-18.5	176.3	-72	-22.9	0	0	0	114.3	I345 E347	I345-N349 WeakPolarHBondContact O-CB 3.44Å; I345-N349 PolarHBondContact O-N 3.24Å; I345-N349 VanDerWaalsContact O-N 3.13Å; I345-N349 PolarHBondContact O-ND2 3.35Å; I345-N349 VanDerWaalsContact O-ND2 3.15Å; E347-N349 VanDerWaalsContact C-N 3.33Å; E347-N349 PolarHBondContact O-N 3.48Å
350	S	51.5	Low	53.8	Low	69 Å²	69	109.1 Å²	109.1	48%	0.483	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.1	8.9	180	53.2	0	0	0	0	114.1	T346 E347 S348 L352	T346-S350 WeakPolarHBondContact O-CB 3.26Å; T346-S350 PolarHBondContact O-N 2.91Å; T346-S350 VanDerWaalsContact O-N 3.16Å; T346-S350 PolarHBondContact O-OG 3.44Å; E347-S350 WeakPolarHBondContact CA-OG 3.41Å; E347-S350 PolarHBondContact O-N 3.47Å; E347-S350 PolarHBondContact O-OG 2.97Å; S348-S350 VanDerWaalsContact C-N 3.34Å; S348-S350 PolarHBondContact O-N 3.27Å; S350-L352 PolarHBondContact O-N 3.25Å
351	S	33.8	Very low	50.9	Low	82 Å²	82	110.5 Å²	110.5	57%	0.573	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	44.1	-177.7	59.4	0	0	0	0	115.8	E347 S348	E347-S351 PolarHBondContact O-N 3.41Å; S348-S351 PolarHBondContact O-OG 2.89Å
352	L	34.5	Very low	48	Very low	173 Å²	173	113 Å²	113	91%	0.906	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	2.7	164.1	-90.6	162.8	0	0	0	113.9	S350	S350-L352 PolarHBondContact O-N 3.25Å
353	T	31.3	Very low	45	Very low	123 Å²	123	116.7 Å²	116.7	76%	0.755	67%	0.67	S	S	*	*			trans	-142.8	82	170.7	39.4	0	0	0	0	111.2	P355	T353-P355 WeakPolarHBondContact O-CD 3.44Å
354	N	33.9	Very low	42.3	Very low	121 Å²	121	122.8 Å²	122.8	65%	0.647	70%	0.7	S	S	*	*			trans	-74.1	123.2	158.1	-85.7	-3.6	0	0	0	108.9	E356	N354-E356 HydrophobicContact CB-CB 4.41Å; N354-E356 PolarHBondContact O-N 3.03Å
355	P	34.7	Very low	39.9	Very low	128 Å²	128	126.5 Å²	126.5	83%	0.831	71%	0.711	S	S	*	*			trans	-92.6	52.4	154	37.3	-27.4	0	0	0	108.7	T353	T353-P355 WeakPolarHBondContact O-CD 3.44Å
356	E	30.2	Very low	37.5	Very low	175 Å²	175	129 Å²	129	82%	0.818	72%	0.721	S	S	*	*			trans	-98.8	78.6	166.8	-72.3	-167.6	159.8	0	0	107.4	N354	N354-E356 HydrophobicContact CB-CB 4.41Å; N354-E356 PolarHBondContact O-N 3.03Å
357	G	29.2	Very low	35.3	Very low	74 Å²	74	133 Å²	133	76%	0.763	73%	0.731	S	S	*	*			trans	-176.9	57.3	-173.2	0	0	0	0	0	113.1
358	S	29.2	Very low	33.5	Very low	109 Å²	109	131.3 Å²	131.3	76%	0.762	73%	0.732	S	S	*	*			trans	-145.3	115	157.5	64.5	0	0	0	0	109.8	F360	S358-F360 PolarHBondContact O-N 3.47Å
359	E	28.8	Very low	32.4	Very low	189 Å²	189	132.5 Å²	132.5	88%	0.883	74%	0.736	S	S	*	*			trans	-51.7	126.3	177.8	-68.1	179.8	143.6	0	0	111.9	S361	E359-S361 PolarHBondContact O-N 3.39Å; E359-S361 VanDerWaalsContact O-N 3.13Å
360	F	30.4	Very low	31.6	Very low	213 Å²	213	129.5 Å²	129.5	93%	0.934	72%	0.723	S	S	*	*			trans	-60.9	109.9	167.1	-99.7	-99.5	0	0	0	109.6	S358	S358-F360 PolarHBondContact O-N 3.47Å
361	S	28.5	Very low	31.3	Very low	90 Å²	90	131 Å²	131	63%	0.629	72%	0.72	S	S	*	*			trans	-105.7	126.8	161.7	8.2	0	0	0	0	109.3	E359 K363	E359-S361 PolarHBondContact O-N 3.39Å; E359-S361 VanDerWaalsContact O-N 3.13Å; S361-K363 VanDerWaalsContact C-N 3.25Å; S361-K363 PolarHBondContact O-N 3.12Å
362	P	27.9	Very low	32.1	Very low	130 Å²	130	131.7 Å²	131.7	84%	0.844	71%	0.714	S	S	*	*			trans	-81.1	77.2	178.8	34.3	-31.7	0	0	0	108.3
363	K	25.4	Very low	33	Very low	170 Å²	170	130.9 Å²	130.9	74%	0.739	70%	0.699	S	S	*	*			trans	-101.6	115.8	165.6	-75.3	-175	178	176.2	0	108.2	S361 I365	S361-K363 VanDerWaalsContact C-N 3.25Å; S361-K363 PolarHBondContact O-N 3.12Å; K363-I365 PolarHBondContact O-N 3.36Å
364	L	28.2	Very low	34.5	Very low	182 Å²	182	125.3 Å²	125.3	95%	0.953	67%	0.665	S	S	*	*			trans	-53.1	105.9	168.3	-77.8	100.2	0	0	0	108.5
365	I	30.2	Very low	36.6	Very low	132 Å²	132	121 Å²	121	68%	0.677	65%	0.648	S	S	*	*			trans	-110.3	118.7	174.9	-67.1	171.1	0	0	0	108.1	K363	K363-I365 PolarHBondContact O-N 3.36Å
366	Q	26.9	Very low	39.1	Very low	155 Å²	155	120.3 Å²	120.3	72%	0.724	63%	0.629	S	S	*	*			trans	-55	131.4	-179.2	-75.1	165.3	-40.4	0	0	111.2	S368	Q366-S368 VanDerWaalsContact C-N 3.34Å; Q366-S368 PolarHBondContact O-N 3.03Å
367	K	28.4	Very low	41.9	Very low	165 Å²	165	121 Å²	121	72%	0.717	63%	0.625	S	S	*	*			trans	-63.5	94.3	165.3	-81.8	179.5	174.3	175.3	0	109.1	T369	K367-T369 PolarHBondContact O-N 3.4Å
368	S	29	Very low	44.7	Very low	75 Å²	75	121.5 Å²	121.5	52%	0.524	60%	0.604	S	S	.	*			trans	-76.2	59.1	165.9	62.7	0	0	0	0	110.6	Q366 T370	Q366-S368 VanDerWaalsContact C-N 3.34Å; Q366-S368 PolarHBondContact O-N 3.03Å; S368-T370 PolarHBondContact O-N 3.38Å
369	T	35.8	Very low	47.6	Very low	93 Å²	93	116.6 Å²	116.6	57%	0.571	57%	0.569	S	S	*	*			trans	-71.3	90.6	143.9	57.2	0	0	0	0	104.6	K367 K371	K367-T369 PolarHBondContact O-N 3.4Å; T369-K371 PolarHBondContact O-N 3.05Å
370	T	36.2	Very low	50.6	Low	72 Å²	72	109 Å²	109	44%	0.442	53%	0.533	S	S	.	.			trans	-61.4	79.5	167	44.6	0	0	0	0	107.1	S368 H372	S368-T370 PolarHBondContact O-N 3.38Å; T370-H372 PolarHBondContact O-N 2.82Å
371	K	45.2	Very low	53.7	Low	99 Å²	99	108.3 Å²	108.3	43%	0.43	52%	0.524	S	S	.	.			trans	-69.1	85.6	166.8	-85.5	179.4	-179.5	162.3	0	104.5	T369 R373	T369-K371 PolarHBondContact O-N 3.05Å; K371-R373 PolarHBondContact O-N 3.17Å
372	H	49.9	Very low	56.7	Low	98 Å²	98	104.7 Å²	104.7	45%	0.454	50%	0.497	S	S	.	.			trans	-58.5	80.1	166.2	-78.8	0.4	0	0	0	108.2	T370 R374	T370-H372 PolarHBondContact O-N 2.82Å; H372-R374 VanDerWaalsContact C-N 3.3Å; H372-R374 PolarHBondContact O-N 2.94Å
373	R	53.4	Low	59.9	Low	155 Å²	155	98.5 Å²	98.5	59%	0.585	46%	0.457	S	S	*	.			trans	-69	97	174.3	-76.4	-173.9	-179.8	170.7	9.8	105.6	K371 G375	K371-R373 PolarHBondContact O-N 3.17Å; R373-G375 PolarHBondContact O-N 3.29Å
374	R	63.6	Low	63.2	Low	7 Å²	7	93.6 Å²	93.6	3%	0.026	44%	0.436	C	S	.	.			trans	-46.9	139.8	167.1	-65.7	-176.7	-176.6	-142	8.5	108	A160 E161 L162 L164 H372 W376 Q379	A160-R374 PolarHBondContact O-NH2 3.04Å; E161-R374 PolarHBondContact O-NE 3.22Å; E161-R374 PolarHBondContact O-NH1 2.85Å; E161-R374 PolarHBondContact O-NH2 3.39Å; L162-R374 VanDerWaalsContact C-CZ 3.48Å; L162-R374 VanDerWaalsContact C-NE 3.28Å; L162-R374 PolarHBondContact O-NE 3.32Å; L162-R374 PolarHBondContact O-NH2 2.8Å; L164-R374 VanDerWaalsContact N-NH2 3.19Å; L164-R374 PolarHBondContact O-NH2 3.21Å; H372-R374 VanDerWaalsContact C-N 3.3Å; H372-R374 PolarHBondContact O-N 2.94Å; R374-W376 PolarHBondContact O-N 2.96Å; R374-Q379 HydrophobicContact CB-CG 3.91Å; R374-Q379 WeakPolarHBondContact O-CG 3.49Å; R374-Q379 PolarHBondContact O-NE2 3.42Å
375	G	78.3	Confident	66.4	Low	30 Å²	30	91 Å²	91	31%	0.309	42%	0.417	S	S	.	.			trans	-49.9	140.9	-178	0	0	0	0	0	111.9	R373 W377 R378 Q379	R373-G375 PolarHBondContact O-N 3.29Å; G375-W377 PolarHBondContact O-N 2.86Å; G375-W377 VanDerWaalsContact O-N 3.07Å; G375-R378 PolarHBondContact O-N 3.42Å; G375-Q379 PolarHBondContact O-N 2.79Å
376	W	87.4	Confident	69.4	Low	114 Å²	114	85 Å²	85	43%	0.432	39%	0.386	S	S	.	.	H	α-helix	trans	-45.9	-44.6	-173.5	-175.2	100.8	0	0	0	112.7	R374 R378 Q379 F380 P472	R374-W376 PolarHBondContact O-N 2.96Å; W376-R378 PolarHBondContact O-N 2.98Å; W376-Q379 PolarHBondContact O-N 3.17Å; W376-F380 HydrophobicContact CE3-CB 4.35Å; W376-F380 HydrophobicContact CH2-CD2 4.14Å; W376-F380 HydrophobicContact CH2-CG 4.37Å; W376-F380 HydrophobicContact CZ3-CB 4.18Å; W376-F380 HydrophobicContact CZ3-CD2 4.49Å; W376-F380 HydrophobicContact CZ3-CG 4.27Å; W376-F380 WeakPolarHBondContact O-CB 3.5Å; W376-F380 PolarHBondContact O-N 2.82Å; W376-P472 VanDerWaalsContact CD1-CG 3.47Å; W376-P472 HydrophobicContact CD2-CG 4.21Å; W376-P472 HydrophobicContact CG-CG 3.87Å
377	W	88.7	Confident	72.6	Confident	189 Å²	189	77.9 Å²	77.9	72%	0.716	35%	0.354	S	S	*	.	H	α-helix	trans	-64.3	-36.8	179.2	-71.8	109.7	0	0	0	114.7	G375 F380 R381	G375-W377 PolarHBondContact O-N 2.86Å; G375-W377 VanDerWaalsContact O-N 3.07Å; W377-F380 HydrophobicContact CE3-CD1 4.44Å; W377-F380 PolarHBondContact O-N 3.05Å; W377-R381 WeakPolarHBondContact O-CB 3.41Å; W377-R381 PolarHBondContact O-N 3.25Å
378	R	86.5	Confident	75.8	Confident	85 Å²	85	74.9 Å²	74.9	32%	0.321	34%	0.338	S	S	.	.	H	α-helix	trans	-70.8	-43	178	-170.5	173.1	-178.6	170.2	4	110.4	G375 W376 F380 R381 L382	G375-R378 PolarHBondContact O-N 3.42Å; W376-R378 PolarHBondContact O-N 2.98Å; R378-F380 VanDerWaalsContact C-N 3.31Å; R378-F380 PolarHBondContact O-N 3.33Å; R378-R381 PolarHBondContact O-N 3.5Å; R378-L382 HydrophobicContact CG-CD1 4.29Å; R378-L382 WeakPolarHBondContact O-CG 3.48Å; R378-L382 PolarHBondContact O-N 3.47Å; R378-L382 VanDerWaalsContact O-N 3.16Å
379	Q	90.4	Very high	78.8	Confident	6 Å²	6	73 Å²	73	3%	0.028	32%	0.321	C	S	.	.	H	α-helix	trans	-58.5	-47.6	172.9	-61.6	-176.1	14.1	0	0	110.3	R374 G375 W376 R381 L382 L383 P472	R374-Q379 HydrophobicContact CB-CG 3.91Å; R374-Q379 WeakPolarHBondContact O-CG 3.49Å; R374-Q379 PolarHBondContact O-NE2 3.42Å; G375-Q379 PolarHBondContact O-N 2.79Å; W376-Q379 PolarHBondContact O-N 3.17Å; Q379-R381 PolarHBondContact O-N 3.39Å; Q379-L382 PolarHBondContact O-N 3.19Å; Q379-L383 HydrophobicContact CB-CD1 4.44Å; Q379-L383 WeakPolarHBondContact O-CB 3.46Å; Q379-L383 WeakPolarHBondContact O-CD1 3.22Å; Q379-L383 WeakPolarHBondContact O-CG 3.47Å; Q379-L383 PolarHBondContact O-N 3.05Å; Q379-P472 HydrophobicContact CB-CB 3.81Å; Q379-P472 HydrophobicContact CB-CG 4.07Å
380	F	93.4	Very high	81.5	Confident	30 Å²	30	69.3 Å²	69.3	13%	0.132	30%	0.298	C	S	.	.	H	α-helix	trans	-57.2	-49.3	178.5	174.2	-91.4	0	0	0	111.9	W376 W377 R378 L382 L383 F384 P472 S475 S476 L479	W376-F380 HydrophobicContact CE3-CB 4.35Å; W376-F380 HydrophobicContact CH2-CD2 4.14Å; W376-F380 HydrophobicContact CH2-CG 4.37Å; W376-F380 HydrophobicContact CZ3-CB 4.18Å; W376-F380 HydrophobicContact CZ3-CD2 4.49Å; W376-F380 HydrophobicContact CZ3-CG 4.27Å; W376-F380 WeakPolarHBondContact O-CB 3.5Å; W376-F380 PolarHBondContact O-N 2.82Å; W377-F380 HydrophobicContact CE3-CD1 4.44Å; W377-F380 PolarHBondContact O-N 3.05Å; R378-F380 VanDerWaalsContact C-N 3.31Å; R378-F380 PolarHBondContact O-N 3.33Å; F380-L382 VanDerWaalsContact C-N 3.34Å; F380-L382 PolarHBondContact O-N 2.77Å; F380-L383 PolarHBondContact O-N 3Å; F380-F384 HydrophobicContact CE1-CB 4.34Å; F380-F384 HydrophobicContact CZ-CB 4.43Å; F380-F384 HydrophobicContact CZ-CD2 4.19Å; F380-F384 WeakPolarHBondContact O-CB 3.34Å; F380-F384 PolarHBondContact O-N 3.19Å; F380-P472 HydrophobicContact CB-CB 4.26Å; F380-S475 WeakPolarHBondContact CD2-OG 3.43Å; F380-S476 VanDerWaalsContact CE2-CA 3.5Å; F380-L479 HydrophobicContact CE2-CD1 3.82Å; F380-L479 HydrophobicContact CZ-CD1 3.49Å; F380-L479 VanDerWaalsContact CZ-CD1 3.49Å
381	R	93.9	Very high	84	Confident	197 Å²	197	66.7 Å²	66.7	74%	0.743	28%	0.283	S	S	*	.	H	α-helix	trans	-59.9	-42.5	-179.5	180	175.6	169.6	152.3	-2.6	112.4	W377 R378 Q379 K385	W377-R381 WeakPolarHBondContact O-CB 3.41Å; W377-R381 PolarHBondContact O-N 3.25Å; R378-R381 PolarHBondContact O-N 3.5Å; Q379-R381 PolarHBondContact O-N 3.39Å; R381-K385 PolarHBondContact O-N 3.11Å
382	L	92.6	Very high	86.2	Confident	14 Å²	14	68.9 Å²	68.9	7%	0.073	29%	0.293	C	S	.	.	H	α-helix	trans	-68.6	-45.8	179.9	-68.5	171	0	0	0	112	L158 E161 L162 R378 Q379 F380 F384 K385 R386	L158-L382 HydrophobicContact CD1-CB 3.95Å; E161-L382 HydrophobicContact CB-CD1 4.06Å; E161-L382 HydrophobicContact CB-CD2 4.21Å; E161-L382 VanDerWaalsContact CD-CD2 3.49Å; E161-L382 WeakPolarHBondContact O-CD1 3.48Å; E161-L382 WeakPolarHBondContact OE2-CD2 3.43Å; L162-L382 HydrophobicContact CD2-CD1 4.16Å; R378-L382 HydrophobicContact CG-CD1 4.29Å; R378-L382 WeakPolarHBondContact O-CG 3.48Å; R378-L382 PolarHBondContact O-N 3.47Å; R378-L382 VanDerWaalsContact O-N 3.16Å; Q379-L382 PolarHBondContact O-N 3.19Å; F380-L382 VanDerWaalsContact C-N 3.34Å; F380-L382 PolarHBondContact O-N 2.77Å; L382-F384 VanDerWaalsContact C-N 3.29Å; L382-F384 PolarHBondContact O-N 3Å; L382-K385 PolarHBondContact O-N 2.98Å; L382-R386 PolarHBondContact O-N 3.4Å
383	L	94.3	Very high	88.1	Confident	1 Å²	1	69 Å²	69	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-68.7	-32.2	178.4	-64.2	169.1	0	0	0	111.5	L162 Q379 F380 R386 A387 Y468 P472 S476	L162-L383 HydrophobicContact CD1-CD2 4.45Å; Q379-L383 HydrophobicContact CB-CD1 4.44Å; Q379-L383 WeakPolarHBondContact O-CB 3.46Å; Q379-L383 WeakPolarHBondContact O-CD1 3.22Å; Q379-L383 WeakPolarHBondContact O-CG 3.47Å; Q379-L383 PolarHBondContact O-N 3.05Å; F380-L383 PolarHBondContact O-N 3Å; L383-R386 PolarHBondContact O-N 3.3Å; L383-A387 VanDerWaalsContact O-CB 3.3Å; L383-A387 WeakPolarHBondContact O-CB 3.2Å; L383-A387 PolarHBondContact O-N 3.14Å; L383-Y468 HydrophobicContact CD1-CD1 4.31Å; L383-Y468 HydrophobicContact CD1-CD2 3.91Å; L383-Y468 HydrophobicContact CD1-CE2 4.46Å; L383-Y468 HydrophobicContact CD1-CG 3.82Å; L383-Y468 HydrophobicContact CD2-CD1 3.91Å; L383-Y468 HydrophobicContact CD2-CE1 3.86Å; L383-Y468 HydrophobicContact CD2-CG 4.25Å; L383-P472 HydrophobicContact CD1-CB 4.05Å; L383-S476 VanDerWaalsContact CB-OG 3.24Å; L383-S476 WeakPolarHBondContact CB-OG 3.46Å
384	F	95.2	Very high	89.7	Confident	66 Å²	66	62.7 Å²	62.7	29%	0.289	27%	0.268	S	S	.	.	H	α-helix	trans	-66.7	-46.3	173.7	-179.7	-92.1	0	0	0	110.8	F380 L382 R386 A387 W388 L479 A480	F380-F384 HydrophobicContact CE1-CB 4.34Å; F380-F384 HydrophobicContact CZ-CB 4.43Å; F380-F384 HydrophobicContact CZ-CD2 4.19Å; F380-F384 WeakPolarHBondContact O-CB 3.34Å; F380-F384 PolarHBondContact O-N 3.19Å; L382-F384 VanDerWaalsContact C-N 3.29Å; L382-F384 PolarHBondContact O-N 3Å; F384-R386 VanDerWaalsContact C-N 3.29Å; F384-R386 PolarHBondContact O-N 2.8Å; F384-A387 PolarHBondContact O-N 2.73Å; F384-W388 HydrophobicContact CZ-CE3 4.21Å; F384-W388 VanDerWaalsContact O-CB 3.22Å; F384-W388 WeakPolarHBondContact O-CB 3.06Å; F384-W388 PolarHBondContact O-N 2.94Å; F384-L479 HydrophobicContact CD2-CB 4.13Å; F384-L479 HydrophobicContact CE2-CB 3.8Å; F384-A480 HydrophobicContact CD2-CB 4.05Å; F384-A480 HydrophobicContact CE2-CB 3.94Å
385	K	94.8	Very high	90.8	Very high	128 Å²	128	63.5 Å²	63.5	56%	0.557	28%	0.278	S	S	*	.	H	α-helix	trans	-56.2	-45.8	173.4	-173.3	-175.9	175.2	-174.7	0	110.6	R381 L382 M389	R381-K385 PolarHBondContact O-N 3.11Å; L382-K385 PolarHBondContact O-N 2.98Å; K385-M389 HydrophobicContact CG-CE 4.11Å; K385-M389 HydrophobicContact CG-SD 4.47Å; K385-M389 VanDerWaalsContact O-CG 3.31Å; K385-M389 WeakPolarHBondContact O-CG 3.14Å; K385-M389 PolarHBondContact O-N 3.28Å
386	R	94.5	Very high	91.2	Very high	5 Å²	5	65.8 Å²	65.8	2%	0.019	29%	0.287	C	S	.	.	H	α-helix	trans	-58.5	-55.5	174.8	174.5	175.2	66	-174.5	14.9	111.8	L150 L158 L382 L383 F384 W388 M389 Q390 E462 Y468	L150-R386 HydrophobicContact CD1-CG 4.02Å; L158-R386 HydrophobicContact CD2-CB 3.86Å; L158-R386 HydrophobicContact CD2-CG 4Å; L382-R386 PolarHBondContact O-N 3.4Å; L383-R386 PolarHBondContact O-N 3.3Å; F384-R386 VanDerWaalsContact C-N 3.29Å; F384-R386 PolarHBondContact O-N 2.8Å; R386-W388 PolarHBondContact O-N 3.48Å; R386-M389 PolarHBondContact O-N 3.09Å; R386-Q390 VanDerWaalsContact CD-NE2 3.33Å; R386-Q390 HydrophobicContact CG-CG 4.37Å; R386-Q390 WeakPolarHBondContact O-CG 3.41Å; R386-Q390 PolarHBondContact O-N 3.28Å; R386-E462 IonicContact CZ-OE2 2.9Å; R386-E462 IonicContact NH1-OE1 3.75Å; R386-E462 PolarHBondContact NH1-OE1 2.96Å; R386-E462 IonicContact NH1-OE2 2.72Å; R386-E462 PolarHBondContact NH1-OE2 2.91Å; R386-E462 IonicContact NH2-OE2 3.25Å; R386-E462 PolarHBondContact NH2-OE2 3.26Å; R386-Y468 PolarHBondContact NH2-OH 3.15Å; R386-Y468 VanDerWaalsContact NH2-OH 3.07Å
387	A	94	Very high	91.2	Very high	7 Å²	7	62.6 Å²	62.6	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-61.6	-36.3	-176.1	0	0	0	0	0	111.6	L383 F384 Q390 A391 A480	L383-A387 VanDerWaalsContact O-CB 3.3Å; L383-A387 WeakPolarHBondContact O-CB 3.2Å; L383-A387 PolarHBondContact O-N 3.14Å; F384-A387 PolarHBondContact O-N 2.73Å; A387-Q390 PolarHBondContact O-N 3.24Å; A387-A391 WeakPolarHBondContact O-CB 3.4Å; A387-A391 PolarHBondContact O-N 3.1Å; A387-A480 HydrophobicContact CB-CB 3.57Å
388	W	93.8	Very high	91.3	Very high	101 Å²	101	55 Å²	55	38%	0.383	25%	0.254	S	S	.	.	H	α-helix	trans	-62.3	-50.4	173.9	-176.5	-94.8	0	0	0	112	F384 R386 Q390 A391 F392 A480 P483	F384-W388 HydrophobicContact CZ-CE3 4.21Å; F384-W388 VanDerWaalsContact O-CB 3.22Å; F384-W388 WeakPolarHBondContact O-CB 3.06Å; F384-W388 PolarHBondContact O-N 2.94Å; R386-W388 PolarHBondContact O-N 3.48Å; W388-Q390 VanDerWaalsContact C-N 3.29Å; W388-Q390 PolarHBondContact O-N 2.82Å; W388-A391 PolarHBondContact O-N 3.16Å; W388-F392 WeakPolarHBondContact O-CB 3.33Å; W388-F392 PolarHBondContact O-N 3.38Å; W388-A480 HydrophobicContact CB-CB 4.41Å; W388-A480 HydrophobicContact CE3-CB 4.49Å; W388-P483 HydrophobicContact CH2-CB 4.23Å; W388-P483 HydrophobicContact CH2-CG 4Å; W388-P483 HydrophobicContact CZ3-CB 4.33Å; W388-P483 HydrophobicContact CZ3-CG 3.75Å
389	M	92.9	Very high	91.5	Very high	35 Å²	35	57.8 Å²	57.8	17%	0.172	27%	0.268	C	S	.	.	H	α-helix	trans	-59.4	-42.4	177.5	-70.7	-177.7	-58.3	0	0	111.2	L150 K385 R386 R393	L150-M389 HydrophobicContact CD2-CB 4.12Å; L150-M389 HydrophobicContact CD2-CE 4.04Å; K385-M389 HydrophobicContact CG-CE 4.11Å; K385-M389 HydrophobicContact CG-SD 4.47Å; K385-M389 VanDerWaalsContact O-CG 3.31Å; K385-M389 WeakPolarHBondContact O-CG 3.14Å; K385-M389 PolarHBondContact O-N 3.28Å; R386-M389 PolarHBondContact O-N 3.09Å; M389-R393 WeakPolarHBondContact O-CB 3.47Å; M389-R393 VanDerWaalsContact O-CG 3.28Å; M389-R393 WeakPolarHBondContact O-CG 3.22Å; M389-R393 PolarHBondContact O-N 3.17Å
390	Q	91.8	Very high	91.6	Very high	16 Å²	16	60.5 Å²	60.5	8%	0.075	29%	0.285	C	S	.	.	H	α-helix	trans	-61.3	-51.1	176.6	-71.1	167.4	-7.4	0	0	111.9	F147 L150 R386 A387 W388 F392 R393 D394	F147-Q390 HydrophobicContact CD1-CG 4.49Å; F147-Q390 VanDerWaalsContact CE1-NE2 3.25Å; L150-Q390 HydrophobicContact CD2-CG 4.34Å; R386-Q390 VanDerWaalsContact CD-NE2 3.33Å; R386-Q390 HydrophobicContact CG-CG 4.37Å; R386-Q390 WeakPolarHBondContact O-CG 3.41Å; R386-Q390 PolarHBondContact O-N 3.28Å; A387-Q390 PolarHBondContact O-N 3.24Å; W388-Q390 VanDerWaalsContact C-N 3.29Å; W388-Q390 PolarHBondContact O-N 2.82Å; Q390-F392 VanDerWaalsContact C-N 3.32Å; Q390-F392 PolarHBondContact O-N 3.27Å; Q390-R393 PolarHBondContact O-N 2.86Å; Q390-D394 WeakPolarHBondContact O-CB 3.45Å; Q390-D394 PolarHBondContact O-N 3.28Å
391	A	89.7	Confident	91.5	Very high	17 Å²	17	60.6 Å²	60.6	14%	0.14	28%	0.284	C	S	.	.	H	α-helix	trans	-63.8	-40.1	-177.2	0	0	0	0	0	111.6	A387 W388 N398 I484	A387-A391 WeakPolarHBondContact O-CB 3.4Å; A387-A391 PolarHBondContact O-N 3.1Å; W388-A391 PolarHBondContact O-N 3.16Å; A391-N398 PolarHBondContact O-ND2 2.87Å; A391-I484 HydrophobicContact CB-CD1 3.74Å; A391-I484 WeakPolarHBondContact O-CD1 3.34Å
392	F	90.2	Very high	91.6	Very high	146 Å²	146	52.7 Å²	52.7	64%	0.64	26%	0.262	S	S	*	.	H	α-helix	trans	-73.6	-39.5	-179.9	-169.5	-99.3	0	0	0	112.9	W388 Q390 I484	W388-F392 WeakPolarHBondContact O-CB 3.33Å; W388-F392 PolarHBondContact O-N 3.38Å; Q390-F392 VanDerWaalsContact C-N 3.32Å; Q390-F392 PolarHBondContact O-N 3.27Å; F392-I484 HydrophobicContact CB-CD1 4.13Å; F392-I484 HydrophobicContact CD2-CD1 4.37Å
393	R	91.7	Very high	91.7	Very high	101 Å²	101	60.2 Å²	60.2	38%	0.381	29%	0.289	S	S	.	.	H	α-helix	trans	-85.4	-5.2	-177.8	-66.3	-179.6	179.1	170.3	3.1	114.4	Q149 E154 M389 Q390 G395	Q149-R393 HydrophobicContact CB-CB 4.07Å; Q149-R393 WeakPolarHBondContact O-CD 3.15Å; Q149-R393 PolarHBondContact O-NH1 3.37Å; E154-R393 IonicContact OE1-CZ 3.25Å; E154-R393 VanDerWaalsContact OE1-CZ 3.25Å; E154-R393 IonicContact OE1-NH1 3.94Å; E154-R393 PolarHBondContact OE1-NH1 3.16Å; E154-R393 IonicContact OE1-NH2 3.25Å; E154-R393 PolarHBondContact OE1-NH2 3.39Å; E154-R393 IonicContact OE2-CZ 3.97Å; E154-R393 IonicContact OE2-NH1 2.77Å; E154-R393 PolarHBondContact OE2-NH1 2.9Å; E154-R393 IonicContact OE2-NH2 2.9Å; M389-R393 WeakPolarHBondContact O-CB 3.47Å; M389-R393 VanDerWaalsContact O-CG 3.28Å; M389-R393 WeakPolarHBondContact O-CG 3.22Å; M389-R393 PolarHBondContact O-N 3.17Å; Q390-R393 PolarHBondContact O-N 2.86Å; R393-G395 PolarHBondContact O-N 2.81Å
394	D	86.9	Confident	91.7	Very high	22 Å²	22	65.9 Å²	65.9	12%	0.118	32%	0.317	C	S	.	.			trans	-72.7	54.9	170.7	-168.6	13.6	0	0	0	112.1	Q149 Q390 T397 N398	Q149-D394 HydrophobicContact CG-CB 4.39Å; Q390-D394 WeakPolarHBondContact O-CB 3.45Å; Q390-D394 PolarHBondContact O-N 3.28Å; D394-T397 VanDerWaalsContact CG-CB 3.44Å; D394-T397 VanDerWaalsContact CG-OG1 3.29Å; D394-T397 PolarHBondContact O-N 3.4Å; D394-T397 WeakPolarHBondContact OD1-CB 3.25Å; D394-T397 PolarHBondContact OD1-OG1 3.43Å; D394-T397 WeakPolarHBondContact OD2-CB 3.42Å; D394-T397 PolarHBondContact OD2-OG1 3.33Å; D394-N398 VanDerWaalsContact O-CB 3.29Å; D394-N398 WeakPolarHBondContact O-CB 3.42Å; D394-N398 PolarHBondContact O-N 3.36Å; D394-N398 PolarHBondContact O-ND2 3.37Å
395	G	86	Confident	91.7	Very high	23 Å²	23	63.3 Å²	63.3	24%	0.237	31%	0.307	C	S	.	.	H	α-helix	trans	-59.3	-46.9	-175	0	0	0	0	0	113.8	R393 T397 N398 K399	R393-G395 PolarHBondContact O-N 2.81Å; G395-T397 PolarHBondContact O-N 3.01Å; G395-N398 PolarHBondContact O-N 3.22Å; G395-K399 VanDerWaalsContact O-CB 3.26Å; G395-K399 WeakPolarHBondContact O-CB 3.28Å; G395-K399 WeakPolarHBondContact O-CG 3.35Å; G395-K399 PolarHBondContact O-N 2.92Å
396	P	85.6	Confident	91.8	Very high	78 Å²	78	59.9 Å²	59.9	51%	0.506	30%	0.297	S	S	.	.	H	α-helix	trans	-58.2	-48.8	178.9	-25.9	35.5	0	0	0	112.7	K399 V400	P396-K399 PolarHBondContact O-N 3.5Å; P396-V400 WeakPolarHBondContact O-CG2 3.41Å; P396-V400 PolarHBondContact O-N 3.49Å; P396-V400 VanDerWaalsContact O-N 3.1Å
397	T	87.7	Confident	92	Very high	48 Å²	48	61.8 Å²	61.8	29%	0.294	31%	0.313	S	S	.	.	H	α-helix	trans	-65.2	-46.4	179.6	-51	0	0	0	0	110.8	D394 G395 K399 V400 R401	D394-T397 VanDerWaalsContact CG-CB 3.44Å; D394-T397 VanDerWaalsContact CG-OG1 3.29Å; D394-T397 PolarHBondContact O-N 3.4Å; D394-T397 WeakPolarHBondContact OD1-CB 3.25Å; D394-T397 PolarHBondContact OD1-OG1 3.43Å; D394-T397 WeakPolarHBondContact OD2-CB 3.42Å; D394-T397 PolarHBondContact OD2-OG1 3.33Å; G395-T397 PolarHBondContact O-N 3.01Å; T397-K399 VanDerWaalsContact C-N 3.35Å; T397-K399 PolarHBondContact O-N 2.79Å; T397-V400 PolarHBondContact O-N 3.25Å; T397-R401 WeakPolarHBondContact O-CG 3.47Å; T397-R401 PolarHBondContact O-N 3.34Å
398	N	91.1	Very high	92.1	Very high	29 Å²	29	62.7 Å²	62.7	16%	0.155	32%	0.32	C	S	.	.	H	α-helix	trans	-63.7	-37.9	179.3	-69.7	-23.4	0	0	0	112.2	A391 D394 G395 R401 A402 F488	A391-N398 PolarHBondContact O-ND2 2.87Å; D394-N398 VanDerWaalsContact O-CB 3.29Å; D394-N398 WeakPolarHBondContact O-CB 3.42Å; D394-N398 PolarHBondContact O-N 3.36Å; D394-N398 PolarHBondContact O-ND2 3.37Å; G395-N398 PolarHBondContact O-N 3.22Å; N398-R401 PolarHBondContact O-N 2.83Å; N398-A402 WeakPolarHBondContact O-CB 3.24Å; N398-A402 PolarHBondContact O-N 3.38Å; N398-F488 HydrophobicContact CB-CZ 4.05Å; N398-F488 WeakPolarHBondContact O-CE1 3.38Å
399	K	91.9	Very high	92.2	Very high	143 Å²	143	57.9 Å²	57.9	62%	0.622	30%	0.301	S	S	*	.	H	α-helix	trans	-64.4	-39.5	174.5	-78	175.7	-176	-179.2	0	112.7	G395 P396 T397 R403	G395-K399 VanDerWaalsContact O-CB 3.26Å; G395-K399 WeakPolarHBondContact O-CB 3.28Å; G395-K399 WeakPolarHBondContact O-CG 3.35Å; G395-K399 PolarHBondContact O-N 2.92Å; P396-K399 PolarHBondContact O-N 3.5Å; T397-K399 VanDerWaalsContact C-N 3.35Å; T397-K399 PolarHBondContact O-N 2.79Å; K399-R403 WeakPolarHBondContact O-CG 3.35Å; K399-R403 PolarHBondContact O-N 3.11Å; K399-R403 PolarHBondContact O-NE 2.94Å
400	V	91.6	Very high	92.4	Very high	63 Å²	63	60.3 Å²	60.3	38%	0.382	31%	0.314	S	S	.	.	H	α-helix	trans	-68	-45.4	175.9	172	0	0	0	0	110.1	P396 T397 A402 R403 M404	P396-V400 WeakPolarHBondContact O-CG2 3.41Å; P396-V400 PolarHBondContact O-N 3.49Å; P396-V400 VanDerWaalsContact O-N 3.1Å; T397-V400 PolarHBondContact O-N 3.25Å; V400-A402 PolarHBondContact O-N 2.93Å; V400-R403 PolarHBondContact O-N 3.32Å; V400-M404 HydrophobicContact CG1-CE 4Å; V400-M404 HydrophobicContact CG1-CG 4.38Å; V400-M404 HydrophobicContact CG1-SD 4.02Å; V400-M404 WeakPolarHBondContact O-CG 3.45Å; V400-M404 PolarHBondContact O-N 3.45Å
401	R	92.3	Very high	92.7	Very high	32 Å²	32	64.1 Å²	64.1	12%	0.121	33%	0.334	C	S	.	.	H	α-helix	trans	-61.3	-44.5	178.3	-70.9	-178.6	74	-164.8	2.7	112.4	T397 N398 R403 M404 S405 F488	T397-R401 WeakPolarHBondContact O-CG 3.47Å; T397-R401 PolarHBondContact O-N 3.34Å; N398-R401 PolarHBondContact O-N 2.83Å; R401-R403 PolarHBondContact O-N 3.26Å; R401-M404 PolarHBondContact O-N 2.95Å; R401-S405 WeakPolarHBondContact O-CB 3.28Å; R401-S405 PolarHBondContact O-N 3.16Å; R401-S405 PolarHBondContact O-OG 3.36Å; R401-S405 VanDerWaalsContact O-OG 3.1Å; R401-F488 HydrophobicContact CB-CD1 3.78Å; R401-F488 HydrophobicContact CB-CE1 3.49Å; R401-F488 VanDerWaalsContact CB-CE1 3.49Å; R401-F488 HydrophobicContact CB-CE2 4.49Å; R401-F488 HydrophobicContact CB-CG 4.41Å; R401-F488 HydrophobicContact CB-CZ 3.88Å; R401-F488 VanDerWaalsContact CZ-CD2 3.48Å; R401-F488 VanDerWaalsContact NH1-CE2 3.3Å
402	A	94.6	Very high	93	Very high	32 Å²	32	65.5 Å²	65.5	26%	0.264	34%	0.337	S	S	.	.	H	α-helix	trans	-59.5	-46.5	176.3	0	0	0	0	0	111.5	N398 V400 S405 V406 F488	N398-A402 WeakPolarHBondContact O-CB 3.24Å; N398-A402 PolarHBondContact O-N 3.38Å; V400-A402 PolarHBondContact O-N 2.93Å; A402-S405 PolarHBondContact O-N 3.35Å; A402-V406 WeakPolarHBondContact O-CG2 3.4Å; A402-V406 PolarHBondContact O-N 2.81Å; A402-F488 HydrophobicContact CB-CE1 4.2Å
403	R	95.5	Very high	93.2	Very high	171 Å²	171	58.5 Å²	58.5	65%	0.645	31%	0.306	S	S	*	.	H	α-helix	trans	-61.9	-44.1	176.7	-77	-177.1	-78.3	172.2	-4.7	112.4	K399 V400 R401 V406 A407	K399-R403 WeakPolarHBondContact O-CG 3.35Å; K399-R403 PolarHBondContact O-N 3.11Å; K399-R403 PolarHBondContact O-NE 2.94Å; V400-R403 PolarHBondContact O-N 3.32Å; R401-R403 PolarHBondContact O-N 3.26Å; R403-V406 PolarHBondContact O-N 2.93Å; R403-A407 VanDerWaalsContact O-CB 3.29Å; R403-A407 WeakPolarHBondContact O-CB 3.45Å; R403-A407 PolarHBondContact O-N 3.09Å
404	M	94.3	Very high	93.4	Very high	120 Å²	120	56.9 Å²	56.9	59%	0.591	31%	0.31	S	S	*	.	H	α-helix	trans	-63.2	-43.7	175.8	-76.1	-178.4	168.8	0	0	111.8	V400 R401 V406 A407 S408	V400-M404 HydrophobicContact CG1-CE 4Å; V400-M404 HydrophobicContact CG1-CG 4.38Å; V400-M404 HydrophobicContact CG1-SD 4.02Å; V400-M404 WeakPolarHBondContact O-CG 3.45Å; V400-M404 PolarHBondContact O-N 3.45Å; R401-M404 PolarHBondContact O-N 2.95Å; M404-V406 PolarHBondContact O-N 3.34Å; M404-A407 PolarHBondContact O-N 3.09Å; M404-S408 WeakPolarHBondContact O-CB 3.45Å; M404-S408 PolarHBondContact O-N 2.9Å; M404-S408 PolarHBondContact O-OG 3.4Å
405	S	95.2	Very high	93.8	Very high	13 Å²	13	60.6 Å²	60.6	9%	0.091	33%	0.334	C	S	.	.	H	α-helix	trans	-61.5	-43.3	176.8	-66.7	0	0	0	0	112.2	R401 A402 A409	R401-S405 WeakPolarHBondContact O-CB 3.28Å; R401-S405 PolarHBondContact O-N 3.16Å; R401-S405 PolarHBondContact O-OG 3.36Å; R401-S405 VanDerWaalsContact O-OG 3.1Å; A402-S405 PolarHBondContact O-N 3.35Å; S405-A409 VanDerWaalsContact O-CB 3.28Å; S405-A409 WeakPolarHBondContact O-CB 3.45Å; S405-A409 PolarHBondContact O-N 3.1Å
406	V	97.6	Very high	94.2	Very high	55 Å²	55	61.2 Å²	61.2	33%	0.333	33%	0.33	S	S	.	.	H	α-helix	trans	-65.2	-47.1	175.6	172.5	0	0	0	0	110.9	A402 R403 M404 A409 I410 I491 I495	A402-V406 WeakPolarHBondContact O-CG2 3.4Å; A402-V406 PolarHBondContact O-N 2.81Å; R403-V406 PolarHBondContact O-N 2.93Å; M404-V406 PolarHBondContact O-N 3.34Å; V406-A409 PolarHBondContact O-N 2.85Å; V406-I410 HydrophobicContact CG1-CD1 3.74Å; V406-I410 HydrophobicContact CG1-CG1 4.44Å; V406-I410 WeakPolarHBondContact O-CG1 3.2Å; V406-I410 PolarHBondContact O-N 3.48Å; V406-I491 HydrophobicContact CG2-CG2 3.82Å; V406-I495 HydrophobicContact CB-CD1 4.4Å; V406-I495 HydrophobicContact CG1-CD1 4.26Å; V406-I495 HydrophobicContact CG2-CD1 3.97Å
407	A	96.9	Very high	94.6	Very high	45 Å²	45	64.4 Å²	64.4	37%	0.372	33%	0.332	S	S	.	.	H	α-helix	trans	-60.7	-48.5	179.6	0	0	0	0	0	111.9	R403 M404 A409 I410 I411	R403-A407 VanDerWaalsContact O-CB 3.29Å; R403-A407 WeakPolarHBondContact O-CB 3.45Å; R403-A407 PolarHBondContact O-N 3.09Å; M404-A407 PolarHBondContact O-N 3.09Å; A407-A409 VanDerWaalsContact C-N 3.32Å; A407-A409 PolarHBondContact O-N 3.43Å; A407-I410 PolarHBondContact O-N 3.03Å; A407-I411 VanDerWaalsContact O-CG1 3.27Å; A407-I411 WeakPolarHBondContact O-CG1 3.24Å; A407-I411 PolarHBondContact O-N 2.79Å
408	S	96	Very high	94.8	Very high	27 Å²	27	70.1 Å²	70.1	19%	0.189	35%	0.348	C	S	.	.	H	α-helix	trans	-61.2	-40.5	176.2	-65.6	0	0	0	0	111.9	M404 I411 F412 N439	M404-S408 WeakPolarHBondContact O-CB 3.45Å; M404-S408 PolarHBondContact O-N 2.9Å; M404-S408 PolarHBondContact O-OG 3.4Å; S408-I411 PolarHBondContact O-N 3.39Å; S408-F412 WeakPolarHBondContact O-CB 3.32Å; S408-F412 WeakPolarHBondContact O-CD2 3.14Å; S408-F412 VanDerWaalsContact O-CG 3.31Å; S408-F412 WeakPolarHBondContact O-CG 3.42Å; S408-F412 PolarHBondContact O-N 2.87Å; S408-N439 PolarHBondContact OG-OD1 2.89Å
409	A	97.2	Very high	94.8	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-64.2	-40.8	177.6	0	0	0	0	0	112.2	S405 V406 A407 G413 F492 I495 L496	S405-A409 VanDerWaalsContact O-CB 3.28Å; S405-A409 WeakPolarHBondContact O-CB 3.45Å; S405-A409 PolarHBondContact O-N 3.1Å; V406-A409 PolarHBondContact O-N 2.85Å; A407-A409 VanDerWaalsContact C-N 3.32Å; A407-A409 PolarHBondContact O-N 3.43Å; A409-G413 WeakPolarHBondContact O-CA 3.28Å; A409-G413 PolarHBondContact O-N 3.22Å; A409-F492 HydrophobicContact CB-CD2 3.69Å; A409-F492 HydrophobicContact CB-CE2 4.09Å; A409-F492 HydrophobicContact CB-CG 4.37Å; A409-I495 HydrophobicContact CB-CB 3.8Å; A409-I495 HydrophobicContact CB-CD1 4.43Å; A409-I495 HydrophobicContact CB-CG2 3.73Å; A409-L496 HydrophobicContact CB-CB 4.48Å
410	I	97.4	Very high	94.7	Very high	86 Å²	86	64.3 Å²	64.3	44%	0.441	33%	0.333	S	S	.	.	H	α-helix	trans	-66.8	-45.6	176.2	-68	168.6	0	0	0	110.6	V406 A407 G413 S414 I495	V406-I410 HydrophobicContact CG1-CD1 3.74Å; V406-I410 HydrophobicContact CG1-CG1 4.44Å; V406-I410 WeakPolarHBondContact O-CG1 3.2Å; V406-I410 PolarHBondContact O-N 3.48Å; A407-I410 PolarHBondContact O-N 3.03Å; I410-G413 PolarHBondContact O-N 3.13Å; I410-S414 VanDerWaalsContact O-CB 3.25Å; I410-S414 WeakPolarHBondContact O-CB 3.26Å; I410-S414 PolarHBondContact O-N 3.36Å; I410-S414 PolarHBondContact O-OG 2.85Å; I410-S414 VanDerWaalsContact O-OG 3.11Å; I410-I495 HydrophobicContact CG1-CG2 4.42Å
411	I	97.1	Very high	94.6	Very high	96 Å²	96	66.2 Å²	66.2	49%	0.492	34%	0.336	S	S	.	.	H	α-helix	trans	-60.3	-56.5	179.3	-68.8	165.1	0	0	0	109.8	A407 S408 G413 S414 V415	A407-I411 VanDerWaalsContact O-CG1 3.27Å; A407-I411 WeakPolarHBondContact O-CG1 3.24Å; A407-I411 PolarHBondContact O-N 2.79Å; S408-I411 PolarHBondContact O-N 3.39Å; I411-G413 VanDerWaalsContact C-N 3.32Å; I411-G413 PolarHBondContact O-N 2.87Å; I411-S414 PolarHBondContact O-N 3.48Å; I411-S414 PolarHBondContact O-OG 2.97Å; I411-V415 WeakPolarHBondContact O-CG2 3.13Å; I411-V415 PolarHBondContact O-N 3.43Å
412	F	96.1	Very high	94.5	Very high	45 Å²	45	67 Å²	67	20%	0.197	34%	0.344	C	S	.	.	H	α-helix	trans	-65.5	-36.8	-179.9	-57.3	-35.7	0	0	0	112.2	S408 S414 V415 F416 L432 V435 N439 F492 L496	S408-F412 WeakPolarHBondContact O-CB 3.32Å; S408-F412 WeakPolarHBondContact O-CD2 3.14Å; S408-F412 VanDerWaalsContact O-CG 3.31Å; S408-F412 WeakPolarHBondContact O-CG 3.42Å; S408-F412 PolarHBondContact O-N 2.87Å; F412-S414 VanDerWaalsContact C-N 3.3Å; F412-S414 PolarHBondContact O-N 3.26Å; F412-V415 PolarHBondContact O-N 3.21Å; F412-F416 WeakPolarHBondContact O-CD2 3.25Å; F412-F416 PolarHBondContact O-N 3.02Å; F412-L432 HydrophobicContact CB-CD1 4.39Å; F412-V435 HydrophobicContact CD1-CG1 3.78Å; F412-V435 HydrophobicContact CD2-CG1 3.84Å; F412-V435 HydrophobicContact CE1-CG1 3.51Å; F412-V435 HydrophobicContact CE2-CG1 3.58Å; F412-V435 HydrophobicContact CG-CG1 3.95Å; F412-V435 HydrophobicContact CZ-CG1 3.4Å; F412-V435 VanDerWaalsContact CZ-CG1 3.4Å; F412-N439 HydrophobicContact CE2-CB 3.88Å; F412-F492 AromaticContact CD2-CE2 3.89Å; F412-F492 HydrophobicContact CD2-CE2 3.89Å; F412-F492 AromaticContact CD2-CZ 3.9Å; F412-F492 HydrophobicContact CD2-CZ 3.9Å; F412-F492 HydrophobicContact CE2-CE2 4.3Å; F412-F492 HydrophobicContact CE2-CZ 4.42Å; F412-L496 HydrophobicContact CB-CD1 3.78Å
413	G	95.5	Very high	94.2	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-64.4	-33	176.1	0	0	0	0	0	113.4	A409 I410 I411 F416 W417 L496	A409-G413 WeakPolarHBondContact O-CA 3.28Å; A409-G413 PolarHBondContact O-N 3.22Å; I410-G413 PolarHBondContact O-N 3.13Å; I411-G413 VanDerWaalsContact C-N 3.32Å; I411-G413 PolarHBondContact O-N 2.87Å; G413-F416 CarbonylContact O-C 3.55Å; G413-W417 VanDerWaalsContact O-CA 3.27Å; G413-W417 WeakPolarHBondContact O-CA 3.37Å; G413-W417 PolarHBondContact O-N 3.42Å; G413-L496 VanDerWaalsContact N-CD1 3.29Å
414	S	95.8	Very high	93.9	Very high	66 Å²	66	64.3 Å²	64.3	46%	0.462	34%	0.34	S	S	.	.	H	α-helix	trans	-76.1	-39.5	175.6	68.3	0	0	0	0	112.9	I410 I411 F412 W417	I410-S414 VanDerWaalsContact O-CB 3.25Å; I410-S414 WeakPolarHBondContact O-CB 3.26Å; I410-S414 PolarHBondContact O-N 3.36Å; I410-S414 PolarHBondContact O-OG 2.85Å; I410-S414 VanDerWaalsContact O-OG 3.11Å; I411-S414 PolarHBondContact O-N 3.48Å; I411-S414 PolarHBondContact O-OG 2.97Å; F412-S414 VanDerWaalsContact C-N 3.3Å; F412-S414 PolarHBondContact O-N 3.26Å; S414-W417 WeakPolarHBondContact O-CB 3.39Å; S414-W417 PolarHBondContact O-N 2.89Å
415	V	95.4	Very high	93.8	Very high	101 Å²	101	58.8 Å²	58.8	61%	0.612	31%	0.313	S	S	*	.	H	α-helix	trans	-65.3	-44	176.8	171.8	0	0	0	0	110.7	I411 F412 W417	I411-V415 WeakPolarHBondContact O-CG2 3.13Å; I411-V415 PolarHBondContact O-N 3.43Å; F412-V415 PolarHBondContact O-N 3.21Å; V415-W417 VanDerWaalsContact C-N 3.34Å; V415-W417 PolarHBondContact O-N 3.1Å
416	F	94.3	Very high	93.6	Very high	35 Å²	35	58.5 Å²	58.5	15%	0.154	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	40.1	178.8	-61.6	-80	0	0	0	111.5	F412 G413 R418 M419 D428 L432 S500	F412-F416 WeakPolarHBondContact O-CD2 3.25Å; F412-F416 PolarHBondContact O-N 3.02Å; G413-F416 CarbonylContact O-C 3.55Å; F416-R418 PolarHBondContact O-N 2.8Å; F416-M419 HydrophobicContact CB-CG 4.3Å; F416-M419 HydrophobicContact CB-SD 4.11Å; F416-M419 HydrophobicContact CD1-SD 4.09Å; F416-D428 HydrophobicContact CD1-CB 4.1Å; F416-D428 HydrophobicContact CE1-CB 4.29Å; F416-D428 WeakPolarHBondContact CE1-O 3.28Å; F416-L432 HydrophobicContact CB-CB 4.42Å; F416-L432 HydrophobicContact CB-CD1 4.11Å; F416-L432 HydrophobicContact CB-CD2 4.2Å; F416-L432 HydrophobicContact CB-CG 4.48Å; F416-L432 HydrophobicContact CD1-CB 4.14Å; F416-L432 HydrophobicContact CD2-CB 4.04Å; F416-L432 HydrophobicContact CD2-CD1 3.64Å; F416-L432 HydrophobicContact CD2-CG 4.4Å; F416-L432 HydrophobicContact CE1-CB 4.43Å; F416-L432 HydrophobicContact CE2-CB 4.33Å; F416-L432 HydrophobicContact CE2-CD1 4.33Å; F416-L432 HydrophobicContact CG-CB 3.94Å; F416-L432 HydrophobicContact CG-CD1 4.02Å; F416-L432 HydrophobicContact CG-CG 4.4Å; F416-S500 WeakPolarHBondContact O-CA 3.49Å
417	W	94.4	Very high	93.3	Very high	146 Å²	146	61.7 Å²	61.7	55%	0.553	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	121.7	-174.1	-177.3	-97.4	0	0	0	111.8	G413 S414 V415 M419 M499	G413-W417 VanDerWaalsContact O-CA 3.27Å; G413-W417 WeakPolarHBondContact O-CA 3.37Å; G413-W417 PolarHBondContact O-N 3.42Å; S414-W417 WeakPolarHBondContact O-CB 3.39Å; S414-W417 PolarHBondContact O-N 2.89Å; V415-W417 VanDerWaalsContact C-N 3.34Å; V415-W417 PolarHBondContact O-N 3.1Å; W417-M419 PolarHBondContact O-N 2.94Å; W417-M499 HydrophobicContact CE3-CB 4.37Å; W417-M499 HydrophobicContact CE3-CE 3.94Å; W417-M499 HydrophobicContact CZ3-CB 4.28Å; W417-M499 HydrophobicContact CZ3-CE 3.62Å; W417-M499 HydrophobicContact CZ3-CG 4.06Å
418	R	91.1	Very high	93.1	Very high	168 Å²	168	62.6 Å²	62.6	63%	0.634	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.8	59.5	174.4	-65.4	-173.4	171	-166.9	-2.3	114.3	F416 G420 M499 K501	F416-R418 PolarHBondContact O-N 2.8Å; R418-G420 PolarHBondContact O-N 3.25Å; R418-M499 PolarHBondContact N-O 2.94Å; R418-K501 HydrophobicContact CB-CB 4.39Å; R418-K501 HydrophobicContact CB-CD 4.39Å; R418-K501 HydrophobicContact CG-CB 4.49Å
419	M	91	Very high	93	Very high	12 Å²	12	61.7 Å²	61.7	6%	0.059	31%	0.312	C	S	.	.			trans	-54.4	138.1	-179.2	-65.3	180	-66.3	0	0	112.8	F416 W417 D428 R429 L432 S500 L502	F416-M419 HydrophobicContact CB-CG 4.3Å; F416-M419 HydrophobicContact CB-SD 4.11Å; F416-M419 HydrophobicContact CD1-SD 4.09Å; W417-M419 PolarHBondContact O-N 2.94Å; M419-D428 HydrophobicContact CG-CB 4.28Å; M419-D428 VanDerWaalsContact SD-C 3.58Å; M419-D428 HydrophobicContact SD-CB 3.63Å; M419-R429 HydrophobicContact CE-CB 4.36Å; M419-R429 HydrophobicContact CE-CG 3.51Å; M419-R429 PolarHBondContact O-NH2 3.21Å; M419-R429 HydrophobicContact SD-CB 4.44Å; M419-R429 HydrophobicContact SD-CG 3.79Å; M419-L432 HydrophobicContact CE-CD2 3.54Å; M419-L432 HydrophobicContact SD-CD2 4.47Å; M419-S500 PolarHBondContact N-O 3.04Å; M419-L502 HydrophobicContact CE-CD2 3.88Å
420	G	89.5	Confident	92.8	Very high	38 Å²	38	62.3 Å²	62.3	39%	0.392	32%	0.316	S	S	.	.			trans	-76.9	-156.7	177.4	0	0	0	0	0	113.6	R418 S425 R429	R418-G420 PolarHBondContact O-N 3.25Å; G420-S425 WeakPolarHBondContact CA-OG 3.45Å; G420-S425 WeakPolarHBondContact O-CB 3.36Å; G420-S425 PolarHBondContact O-OG 3.3Å; G420-R429 PolarHBondContact O-NH2 2.96Å
421	K	88.9	Confident	92.7	Very high	103 Å²	103	58.7 Å²	58.7	45%	0.448	30%	0.3	S	S	.	.	S	Bend	trans	-125.1	20.8	176.3	-70	179.7	168.4	-170.2	0	112.3	S425 Q593 F594 E595	K421-S425 PolarHBondContact N-OG 3.06Å; K421-Q593 WeakPolarHBondContact CD-O 3.28Å; K421-F594 HydrophobicContact CB-CD1 4.48Å; K421-F594 CarbonylContact O-C 3.48Å; K421-F594 VanDerWaalsContact O-CA 3.29Å; K421-F594 WeakPolarHBondContact O-CA 3.01Å; K421-F594 WeakPolarHBondContact O-CB 3.29Å; K421-F594 WeakPolarHBondContact O-CD1 3.24Å; K421-E595 PolarHBondContact O-N 3.25Å
422	T	90.8	Very high	92.6	Very high	49 Å²	49	54.1 Å²	54.1	30%	0.301	28%	0.276	S	S	.	.	S	Bend	trans	-72.1	168.4	174.7	59.2	0	0	0	0	111.3	T424 S425	T422-T424 VanDerWaalsContact C-N 3.26Å; T422-T424 PolarHBondContact O-N 2.99Å; T422-T424 PolarHBondContact OG1-OG1 3.47Å; T422-S425 PolarHBondContact N-OG 2.86Å; T422-S425 WeakPolarHBondContact O-CA 3.25Å; T422-S425 WeakPolarHBondContact O-CB 3.38Å; T422-S425 PolarHBondContact O-N 2.91Å; T422-S425 PolarHBondContact OG1-N 3.48Å; T422-S425 PolarHBondContact OG1-OG 2.78Å
423	Q	88.9	Confident	92.6	Very high	55 Å²	55	52 Å²	52	26%	0.257	27%	0.267	S	S	.	.	H	α-helix	trans	-58.2	-37.3	173	-66.6	-56.8	-49.8	0	0	112.6	S425 I426 E595 D601 I602	Q423-S425 VanDerWaalsContact C-N 3.26Å; Q423-S425 PolarHBondContact O-N 2.89Å; Q423-I426 WeakPolarHBondContact O-CB 3.38Å; Q423-I426 PolarHBondContact O-N 2.87Å; Q423-E595 PolarHBondContact NE2-O 2.83Å; Q423-D601 HydrophobicContact CG-CB 4.16Å; Q423-I602 PolarHBondContact NE2-O 2.94Å
424	T	89.3	Confident	92.6	Very high	91 Å²	91	52.2 Å²	52.2	56%	0.558	27%	0.268	S	S	*	.	H	α-helix	trans	-63.6	-32.4	174	55	0	0	0	0	112.5	T422 I426 Q427 D428	T422-T424 VanDerWaalsContact C-N 3.26Å; T422-T424 PolarHBondContact O-N 2.99Å; T422-T424 PolarHBondContact OG1-OG1 3.47Å; T424-I426 PolarHBondContact O-N 3.32Å; T424-I426 VanDerWaalsContact O-N 3.15Å; T424-Q427 PolarHBondContact O-N 2.84Å; T424-D428 PolarHBondContact O-N 3.49Å
425	S	91.4	Very high	92.5	Very high	4 Å²	4	51.1 Å²	51.1	3%	0.028	26%	0.258	C	S	.	.	H	α-helix	trans	-64	-21.6	179	-56.5	0	0	0	0	112.9	G420 K421 T422 Q423 R429	G420-S425 WeakPolarHBondContact CA-OG 3.45Å; G420-S425 WeakPolarHBondContact O-CB 3.36Å; G420-S425 PolarHBondContact O-OG 3.3Å; K421-S425 PolarHBondContact N-OG 3.06Å; T422-S425 PolarHBondContact N-OG 2.86Å; T422-S425 WeakPolarHBondContact O-CA 3.25Å; T422-S425 WeakPolarHBondContact O-CB 3.38Å; T422-S425 PolarHBondContact O-N 2.91Å; T422-S425 PolarHBondContact OG1-N 3.48Å; T422-S425 PolarHBondContact OG1-OG 2.78Å; Q423-S425 VanDerWaalsContact C-N 3.26Å; Q423-S425 PolarHBondContact O-N 2.89Å; S425-R429 WeakPolarHBondContact O-CB 3.43Å; S425-R429 VanDerWaalsContact O-CG 3.26Å; S425-R429 WeakPolarHBondContact O-CG 3.49Å; S425-R429 PolarHBondContact O-N 3.24Å
426	I	91.4	Very high	92.6	Very high	6 Å²	6	46.3 Å²	46.3	3%	0.031	23%	0.229	C	C	.	.	H	α-helix	trans	-65.9	-48.1	173.3	-61.4	174.4	0	0	0	109.7	Q423 T424 R429 M430 F589 F594 I602 A608 F612	Q423-I426 WeakPolarHBondContact O-CB 3.38Å; Q423-I426 PolarHBondContact O-N 2.87Å; T424-I426 PolarHBondContact O-N 3.32Å; T424-I426 VanDerWaalsContact O-N 3.15Å; I426-R429 PolarHBondContact O-N 3.17Å; I426-M430 WeakPolarHBondContact O-CG 3.3Å; I426-M430 PolarHBondContact O-N 3.12Å; I426-F589 HydrophobicContact CB-CE1 4.43Å; I426-F589 HydrophobicContact CG2-CE1 3.88Å; I426-F589 HydrophobicContact CG2-CZ 4.11Å; I426-F594 HydrophobicContact CD1-CD1 4.19Å; I426-F594 HydrophobicContact CD1-CD2 4.06Å; I426-F594 HydrophobicContact CD1-CE1 4.47Å; I426-F594 HydrophobicContact CD1-CE2 4.35Å; I426-F594 HydrophobicContact CD1-CG 3.99Å; I426-F594 HydrophobicContact CG1-CD1 3.65Å; I426-F594 HydrophobicContact CG1-CD2 4.15Å; I426-F594 HydrophobicContact CG1-CE1 3.57Å; I426-F594 HydrophobicContact CG1-CE2 4.08Å; I426-F594 HydrophobicContact CG1-CG 3.96Å; I426-F594 HydrophobicContact CG1-CZ 3.81Å; I426-I602 HydrophobicContact CD1-CB 3.86Å; I426-I602 HydrophobicContact CD1-CD1 4.03Å; I426-I602 HydrophobicContact CD1-CG2 3.99Å; I426-A608 HydrophobicContact CG2-CB 4.33Å; I426-F612 HydrophobicContact CG2-CE2 4.08Å
427	Q	90.9	Very high	92.7	Very high	122 Å²	122	44.6 Å²	44.6	57%	0.57	22%	0.222	S	C	*	.	H	α-helix	trans	-65.8	-41.2	178.3	-175	176	-13.5	0	0	111.2	T424 R429 M430 G431	T424-Q427 PolarHBondContact O-N 2.84Å; Q427-R429 PolarHBondContact O-N 3.33Å; Q427-M430 PolarHBondContact O-N 3.41Å; Q427-G431 PolarHBondContact O-N 2.83Å
428	D	92.8	Very high	92.8	Very high	65 Å²	65	39.1 Å²	39.1	35%	0.348	20%	0.203	S	C	.	.	H	α-helix	trans	-60.7	-45.9	177	-64.5	-26.5	0	0	0	111.7	F416 M419 T424 M430 G431 L432	F416-D428 HydrophobicContact CD1-CB 4.1Å; F416-D428 HydrophobicContact CE1-CB 4.29Å; F416-D428 WeakPolarHBondContact CE1-O 3.28Å; M419-D428 HydrophobicContact CG-CB 4.28Å; M419-D428 VanDerWaalsContact SD-C 3.58Å; M419-D428 HydrophobicContact SD-CB 3.63Å; T424-D428 PolarHBondContact O-N 3.49Å; D428-M430 PolarHBondContact O-N 3.44Å; D428-G431 PolarHBondContact O-N 3.37Å; D428-L432 WeakPolarHBondContact O-CB 3.22Å; D428-L432 PolarHBondContact O-N 3.5Å
429	R	94.9	Very high	93	Very high	7 Å²	7	32.8 Å²	32.8	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-59.8	-46.5	175.6	-76.1	176.2	-163.1	-86.3	-11.6	111	M419 G420 S425 I426 Q427 G431 L432 L433 K501 E588 F589	M419-R429 HydrophobicContact CE-CB 4.36Å; M419-R429 HydrophobicContact CE-CG 3.51Å; M419-R429 PolarHBondContact O-NH2 3.21Å; M419-R429 HydrophobicContact SD-CB 4.44Å; M419-R429 HydrophobicContact SD-CG 3.79Å; G420-R429 PolarHBondContact O-NH2 2.96Å; S425-R429 WeakPolarHBondContact O-CB 3.43Å; S425-R429 VanDerWaalsContact O-CG 3.26Å; S425-R429 WeakPolarHBondContact O-CG 3.49Å; S425-R429 PolarHBondContact O-N 3.24Å; I426-R429 PolarHBondContact O-N 3.17Å; Q427-R429 PolarHBondContact O-N 3.33Å; R429-G431 PolarHBondContact O-N 3.18Å; R429-L432 PolarHBondContact O-N 2.86Å; R429-L433 VanDerWaalsContact O-CG 3.23Å; R429-L433 WeakPolarHBondContact O-CG 3.44Å; R429-L433 PolarHBondContact O-N 2.92Å; R429-K501 PolarHBondContact NH1-O 3.04Å; R429-E588 IonicContact CZ-OE1 2.6Å; R429-E588 IonicContact NH1-OE1 2.74Å; R429-E588 PolarHBondContact NH1-OE1 3.13Å; R429-F589 HydrophobicContact CB-CE1 4.4Å; R429-F589 HydrophobicContact CB-CZ 3.85Å
430	M	92.7	Very high	93.2	Very high	13 Å²	13	32.6 Å²	32.6	6%	0.064	18%	0.181	C	C	.	.	H	α-helix	trans	-61.9	-44.4	177.2	-72.7	-153	-58.2	0	0	112.6	I426 Q427 D428 L432 L433 Q434 Y557 F581 F589 F612	I426-M430 WeakPolarHBondContact O-CG 3.3Å; I426-M430 PolarHBondContact O-N 3.12Å; Q427-M430 PolarHBondContact O-N 3.41Å; D428-M430 PolarHBondContact O-N 3.44Å; M430-L432 VanDerWaalsContact C-N 3.34Å; M430-L432 PolarHBondContact O-N 3.31Å; M430-L433 PolarHBondContact O-N 2.96Å; M430-Q434 WeakPolarHBondContact O-CB 3.5Å; M430-Q434 PolarHBondContact O-N 3.28Å; M430-Y557 HydrophobicContact CB-CD2 4.29Å; M430-Y557 HydrophobicContact CB-CE2 4.01Å; M430-Y557 HydrophobicContact CE-CD2 4.45Å; M430-Y557 HydrophobicContact CE-CE2 4.09Å; M430-F581 HydrophobicContact CB-CZ 4.42Å; M430-F581 WeakPolarHBondContact O-CE2 3.48Å; M430-F581 HydrophobicContact SD-CZ 4.31Å; M430-F589 HydrophobicContact CG-CE2 3.85Å; M430-F589 HydrophobicContact CG-CZ 3.82Å; M430-F612 HydrophobicContact CE-CD1 4Å; M430-F612 HydrophobicContact CE-CD2 4.15Å; M430-F612 HydrophobicContact CE-CE1 3.35Å; M430-F612 HydrophobicContact CE-CE2 3.56Å; M430-F612 HydrophobicContact CE-CG 4.38Å; M430-F612 HydrophobicContact CE-CZ 3.12Å; M430-F612 HydrophobicContact SD-CD1 4Å; M430-F612 HydrophobicContact SD-CD2 3.5Å; M430-F612 VanDerWaalsContact SD-CD2 3.5Å; M430-F612 HydrophobicContact SD-CE1 3.92Å; M430-F612 HydrophobicContact SD-CE2 3.44Å; M430-F612 WeakPolarHBondContact SD-CE2 3.16Å; M430-F612 HydrophobicContact SD-CG 3.83Å; M430-F612 HydrophobicContact SD-CZ 3.67Å
431	G	93.8	Very high	93.5	Very high	11 Å²	11	30.8 Å²	30.8	11%	0.113	16%	0.163	C	C	.	.	H	α-helix	trans	-57.4	-47.1	177.2	0	0	0	0	0	111.9	Q427 D428 R429 L433 Q434 V435	Q427-G431 PolarHBondContact O-N 2.83Å; D428-G431 PolarHBondContact O-N 3.37Å; R429-G431 PolarHBondContact O-N 3.18Å; G431-L433 PolarHBondContact O-N 3.38Å; G431-Q434 PolarHBondContact O-N 3.45Å; G431-V435 WeakPolarHBondContact O-CB 3.4Å; G431-V435 WeakPolarHBondContact O-CG2 3.36Å; G431-V435 PolarHBondContact O-N 2.83Å
432	L	96.3	Very high	93.8	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.8	-46.1	176.9	176.8	64.9	0	0	0	112.7	F412 F416 M419 D428 R429 M430 V435 T436 L496 L502	F412-L432 HydrophobicContact CB-CD1 4.39Å; F416-L432 HydrophobicContact CB-CB 4.42Å; F416-L432 HydrophobicContact CB-CD1 4.11Å; F416-L432 HydrophobicContact CB-CD2 4.2Å; F416-L432 HydrophobicContact CB-CG 4.48Å; F416-L432 HydrophobicContact CD1-CB 4.14Å; F416-L432 HydrophobicContact CD2-CB 4.04Å; F416-L432 HydrophobicContact CD2-CD1 3.64Å; F416-L432 HydrophobicContact CD2-CG 4.4Å; F416-L432 HydrophobicContact CE1-CB 4.43Å; F416-L432 HydrophobicContact CE2-CB 4.33Å; F416-L432 HydrophobicContact CE2-CD1 4.33Å; F416-L432 HydrophobicContact CG-CB 3.94Å; F416-L432 HydrophobicContact CG-CD1 4.02Å; F416-L432 HydrophobicContact CG-CG 4.4Å; M419-L432 HydrophobicContact CE-CD2 3.54Å; M419-L432 HydrophobicContact SD-CD2 4.47Å; D428-L432 WeakPolarHBondContact O-CB 3.22Å; D428-L432 PolarHBondContact O-N 3.5Å; R429-L432 PolarHBondContact O-N 2.86Å; M430-L432 VanDerWaalsContact C-N 3.34Å; M430-L432 PolarHBondContact O-N 3.31Å; L432-V435 PolarHBondContact O-N 2.81Å; L432-T436 VanDerWaalsContact O-CB 3.3Å; L432-T436 WeakPolarHBondContact O-CB 3.33Å; L432-T436 PolarHBondContact O-N 3.46Å; L432-T436 PolarHBondContact O-OG1 2.96Å; L432-L496 HydrophobicContact CD1-CD1 3.84Å; L432-L496 HydrophobicContact CD1-CD2 3.92Å; L432-L496 HydrophobicContact CD1-CG 4.14Å; L432-L502 HydrophobicContact CD2-CD1 4.25Å; L432-L502 HydrophobicContact CD2-CD2 4.27Å; L432-L502 HydrophobicContact CD2-CG 4.4Å
433	L	95.8	Very high	93.9	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-67.8	-37.6	-178.6	-64.4	178.2	0	0	0	111.7	R429 M430 G431 T436 A437 L502 F512 F581 L584 E588	R429-L433 VanDerWaalsContact O-CG 3.23Å; R429-L433 WeakPolarHBondContact O-CG 3.44Å; R429-L433 PolarHBondContact O-N 2.92Å; M430-L433 PolarHBondContact O-N 2.96Å; G431-L433 PolarHBondContact O-N 3.38Å; L433-T436 WeakPolarHBondContact O-CB 3.48Å; L433-A437 PolarHBondContact O-N 2.91Å; L433-A437 VanDerWaalsContact O-N 3.1Å; L433-L502 HydrophobicContact CD2-CD1 4.46Å; L433-F512 HydrophobicContact CD2-CD2 4.38Å; L433-F512 HydrophobicContact CD2-CE2 3.93Å; L433-F581 HydrophobicContact CB-CD2 4.2Å; L433-F581 HydrophobicContact CB-CE2 4.24Å; L433-L584 HydrophobicContact CB-CB 4.17Å; L433-L584 HydrophobicContact CB-CD1 4.46Å; L433-L584 HydrophobicContact CD1-CB 4.18Å; L433-L584 HydrophobicContact CD2-CB 4.06Å; L433-L584 HydrophobicContact CG-CB 4.34Å; L433-E588 HydrophobicContact CD1-CB 3.9Å; L433-E588 HydrophobicContact CD1-CG 4.36Å
434	Q	94.7	Very high	94.2	Very high	3 Å²	3	25.2 Å²	25.2	1%	0.014	14%	0.143	C	C	.	.	H	α-helix	trans	-66	-48.3	175.2	-176.4	63.7	38.6	0	0	111.1	M430 G431 T436 A437 I438 Y557 I577 F581	M430-Q434 WeakPolarHBondContact O-CB 3.5Å; M430-Q434 PolarHBondContact O-N 3.28Å; G431-Q434 PolarHBondContact O-N 3.45Å; Q434-T436 VanDerWaalsContact C-N 3.27Å; Q434-T436 PolarHBondContact O-N 2.78Å; Q434-A437 PolarHBondContact O-N 3.15Å; Q434-I438 HydrophobicContact CG-CD1 3.9Å; Q434-I438 VanDerWaalsContact O-CG1 3.25Å; Q434-I438 WeakPolarHBondContact O-CG1 3.44Å; Q434-I438 PolarHBondContact O-N 3.33Å; Q434-Y557 HydrophobicContact CB-CG 4.32Å; Q434-Y557 HydrophobicContact CG-CD1 4.27Å; Q434-Y557 HydrophobicContact CG-CG 4.06Å; Q434-I577 VanDerWaalsContact NE2-CG2 3.28Å; Q434-F581 HydrophobicContact CB-CD2 3.86Å; Q434-F581 HydrophobicContact CB-CE2 3.86Å
435	V	95.1	Very high	94.5	Very high	43 Å²	43	20.9 Å²	20.9	26%	0.261	12%	0.116	S	C	.	.	H	α-helix	trans	-63	-36.5	178.4	169.8	0	0	0	0	111.3	F412 G431 L432 I438 N439	F412-V435 HydrophobicContact CD1-CG1 3.78Å; F412-V435 HydrophobicContact CD2-CG1 3.84Å; F412-V435 HydrophobicContact CE1-CG1 3.51Å; F412-V435 HydrophobicContact CE2-CG1 3.58Å; F412-V435 HydrophobicContact CG-CG1 3.95Å; F412-V435 HydrophobicContact CZ-CG1 3.4Å; F412-V435 VanDerWaalsContact CZ-CG1 3.4Å; G431-V435 WeakPolarHBondContact O-CB 3.4Å; G431-V435 WeakPolarHBondContact O-CG2 3.36Å; G431-V435 PolarHBondContact O-N 2.83Å; L432-V435 PolarHBondContact O-N 2.81Å; V435-I438 PolarHBondContact O-N 3.19Å; V435-N439 VanDerWaalsContact O-CB 3.23Å; V435-N439 WeakPolarHBondContact O-CB 3.23Å; V435-N439 PolarHBondContact O-N 2.96Å
436	T	96.5	Very high	94.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.2	-49.9	173.1	-68.6	0	0	0	0	112.1	L432 L433 Q434 T440 F492 L496 F512 V516 L584	L432-T436 VanDerWaalsContact O-CB 3.3Å; L432-T436 WeakPolarHBondContact O-CB 3.33Å; L432-T436 PolarHBondContact O-N 3.46Å; L432-T436 PolarHBondContact O-OG1 2.96Å; L433-T436 WeakPolarHBondContact O-CB 3.48Å; Q434-T436 VanDerWaalsContact C-N 3.27Å; Q434-T436 PolarHBondContact O-N 2.78Å; T436-T440 WeakPolarHBondContact O-CB 3.48Å; T436-T440 PolarHBondContact O-N 3.28Å; T436-T440 VanDerWaalsContact O-N 3.08Å; T436-T440 PolarHBondContact O-OG1 3.07Å; T436-F492 HydrophobicContact CG2-CE1 3.79Å; T436-L496 WeakPolarHBondContact OG1-CD2 3.42Å; T436-F512 HydrophobicContact CG2-CE2 4.19Å; T436-F512 HydrophobicContact CG2-CZ 3.76Å; T436-V516 HydrophobicContact CG2-CG2 3.81Å; T436-L584 HydrophobicContact CG2-CD1 4.18Å
437	A	96.2	Very high	94.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-61.3	-49.2	179.2	0	0	0	0	0	110.9	L433 Q434 N439 T440 A441 E519 I577 A580 L584	L433-A437 PolarHBondContact O-N 2.91Å; L433-A437 VanDerWaalsContact O-N 3.1Å; Q434-A437 PolarHBondContact O-N 3.15Å; A437-N439 PolarHBondContact O-N 3.16Å; A437-T440 PolarHBondContact O-N 3.42Å; A437-A441 VanDerWaalsContact O-CB 3.29Å; A437-A441 WeakPolarHBondContact O-CB 3.39Å; A437-A441 PolarHBondContact O-N 2.98Å; A437-E519 VanDerWaalsContact CA-OE2 3.28Å; A437-E519 WeakPolarHBondContact CA-OE2 3.47Å; A437-E519 WeakPolarHBondContact CB-OE1 3.49Å; A437-I577 HydrophobicContact CB-CG2 4.29Å; A437-A580 HydrophobicContact CB-CB 4.1Å; A437-L584 HydrophobicContact CB-CD1 4.41Å
438	I	95.9	Very high	94.7	Very high	30 Å²	30	20.1 Å²	20.1	15%	0.154	12%	0.117	C	C	.	.	H	α-helix	trans	-57.9	-51.6	178.2	-64.1	169.3	0	0	0	111.6	Q434 V435 T440 A441 M442 I552 I577	Q434-I438 HydrophobicContact CG-CD1 3.9Å; Q434-I438 VanDerWaalsContact O-CG1 3.25Å; Q434-I438 WeakPolarHBondContact O-CG1 3.44Å; Q434-I438 PolarHBondContact O-N 3.33Å; V435-I438 PolarHBondContact O-N 3.19Å; I438-T440 VanDerWaalsContact C-N 3.32Å; I438-T440 PolarHBondContact O-N 3.37Å; I438-A441 PolarHBondContact O-N 3.2Å; I438-M442 WeakPolarHBondContact O-CB 3.31Å; I438-M442 PolarHBondContact O-N 3.25Å; I438-I552 HydrophobicContact CD1-CG1 4.5Å; I438-I552 HydrophobicContact CD1-CG2 3.83Å; I438-I552 HydrophobicContact CG1-CG1 4.16Å; I438-I552 HydrophobicContact CG1-CG2 4.36Å; I438-I552 HydrophobicContact CG2-CD1 3.86Å; I438-I552 HydrophobicContact CG2-CG1 4.21Å; I438-I577 HydrophobicContact CG1-CD1 4.25Å; I438-I577 HydrophobicContact CG1-CG2 4.34Å
439	N	95.6	Very high	94.7	Very high	36 Å²	36	17.2 Å²	17.2	19%	0.193	10%	0.102	C	C	.	.	H	α-helix	trans	-60.9	-43.8	-176.3	178.5	71.4	0	0	0	111.3	S408 F412 V435 A437 A443 F492	S408-N439 PolarHBondContact OG-OD1 2.89Å; F412-N439 HydrophobicContact CE2-CB 3.88Å; V435-N439 VanDerWaalsContact O-CB 3.23Å; V435-N439 WeakPolarHBondContact O-CB 3.23Å; V435-N439 PolarHBondContact O-N 2.96Å; A437-N439 PolarHBondContact O-N 3.16Å; N439-A443 VanDerWaalsContact O-CB 3.24Å; N439-A443 WeakPolarHBondContact O-CB 3.49Å; N439-A443 PolarHBondContact O-N 2.76Å; N439-F492 VanDerWaalsContact ND2-CE2 3.31Å; N439-F492 WeakPolarHBondContact ND2-CE2 3.37Å
440	T	95	Very high	94.5	Very high	8 Å²	8	18 Å²	18	5%	0.049	11%	0.112	C	C	.	.	H	α-helix	trans	-67.6	-46.9	-179	-51.4	0	0	0	0	111.3	T436 A437 I438 A443 A444 P489 V516	T436-T440 WeakPolarHBondContact O-CB 3.48Å; T436-T440 PolarHBondContact O-N 3.28Å; T436-T440 VanDerWaalsContact O-N 3.08Å; T436-T440 PolarHBondContact O-OG1 3.07Å; A437-T440 PolarHBondContact O-N 3.42Å; I438-T440 VanDerWaalsContact C-N 3.32Å; I438-T440 PolarHBondContact O-N 3.37Å; T440-A443 PolarHBondContact O-N 3.02Å; T440-A444 PolarHBondContact O-N 2.66Å; T440-A444 VanDerWaalsContact O-N 3.13Å; T440-P489 HydrophobicContact CG2-CB 3.91Å; T440-V516 HydrophobicContact CG2-CG1 3.46Å; T440-V516 VanDerWaalsContact CG2-CG1 3.46Å; T440-V516 VanDerWaalsContact OG1-CG1 3.24Å; T440-V516 WeakPolarHBondContact OG1-CG1 3.26Å
441	A	95.9	Very high	94.3	Very high	0 Å²	0	20 Å²	20	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61	-47	178.1	0	0	0	0	0	112.1	A437 I438 A444 L445 E519 A523 M548 L576 I577	A437-A441 VanDerWaalsContact O-CB 3.29Å; A437-A441 WeakPolarHBondContact O-CB 3.39Å; A437-A441 PolarHBondContact O-N 2.98Å; I438-A441 PolarHBondContact O-N 3.2Å; A441-A444 PolarHBondContact O-N 2.54Å; A441-L445 WeakPolarHBondContact O-CB 3.11Å; A441-L445 PolarHBondContact O-N 3.46Å; A441-E519 HydrophobicContact CB-CG 4.25Å; A441-A523 HydrophobicContact CB-CB 4.03Å; A441-A523 VanDerWaalsContact O-CB 3.26Å; A441-A523 WeakPolarHBondContact O-CB 3.38Å; A441-M548 HydrophobicContact CB-CE 3.69Å; A441-M548 HydrophobicContact CB-SD 4.25Å; A441-L576 HydrophobicContact CB-CD1 3.56Å; A441-I577 HydrophobicContact CB-CG1 4.24Å
442	M	95	Very high	94.2	Very high	45 Å²	45	19.5 Å²	19.5	22%	0.222	12%	0.12	C	C	.	.	H	α-helix	trans	-63.6	-44.4	178.1	-86.8	-64.9	-159.4	0	0	112.2	I438 A444 L445 T446 P545 M548 I552	I438-M442 WeakPolarHBondContact O-CB 3.31Å; I438-M442 PolarHBondContact O-N 3.25Å; M442-A444 VanDerWaalsContact C-N 3.29Å; M442-A444 PolarHBondContact O-N 2.74Å; M442-L445 PolarHBondContact O-N 3.29Å; M442-L445 HydrophobicContact SD-CD2 4.15Å; M442-T446 WeakPolarHBondContact O-CB 3.36Å; M442-T446 PolarHBondContact O-N 3.46Å; M442-T446 PolarHBondContact O-OG1 3.43Å; M442-T446 VanDerWaalsContact O-OG1 3.1Å; M442-P545 HydrophobicContact CE-CB 4.3Å; M442-M548 HydrophobicContact CE-CB 3.58Å; M442-M548 HydrophobicContact CE-CG 3.54Å; M442-M548 HydrophobicContact CG-CG 3.98Å; M442-M548 HydrophobicContact SD-CB 3.88Å; M442-M548 HydrophobicContact SD-CG 3.61Å; M442-I552 HydrophobicContact CE-CD1 4.09Å
443	A	94.1	Very high	93.9	Very high	44 Å²	44	20 Å²	20	36%	0.364	12%	0.122	S	C	.	.	H	α-helix	trans	-60.3	-39.4	179.4	0	0	0	0	0	112.5	N439 T440 K447	N439-A443 VanDerWaalsContact O-CB 3.24Å; N439-A443 WeakPolarHBondContact O-CB 3.49Å; N439-A443 PolarHBondContact O-N 2.76Å; T440-A443 PolarHBondContact O-N 3.02Å; A443-K447 PolarHBondContact O-N 2.75Å
444	A	94.8	Very high	93.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-70.7	-41.6	176.8	0	0	0	0	0	112.7	T440 A441 M442 T448 S520 A523 S524	T440-A444 PolarHBondContact O-N 2.66Å; T440-A444 VanDerWaalsContact O-N 3.13Å; A441-A444 PolarHBondContact O-N 2.54Å; M442-A444 VanDerWaalsContact C-N 3.29Å; M442-A444 PolarHBondContact O-N 2.74Å; A444-T448 PolarHBondContact O-N 3.24Å; A444-T448 PolarHBondContact O-OG1 3.07Å; A444-S520 VanDerWaalsContact CB-O 3.23Å; A444-S520 WeakPolarHBondContact CB-O 3.39Å; A444-A523 HydrophobicContact CB-CB 4.04Å; A444-S524 PolarHBondContact O-OG 3Å
445	L	95.2	Very high	93.3	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-60.9	-52.9	176.3	176.7	68.8	0	0	0	111.4	A441 M442 K447 T448 V449 M526 G527 G544 M548	A441-L445 WeakPolarHBondContact O-CB 3.11Å; A441-L445 PolarHBondContact O-N 3.46Å; M442-L445 PolarHBondContact O-N 3.29Å; M442-L445 HydrophobicContact SD-CD2 4.15Å; L445-K447 VanDerWaalsContact C-N 3.33Å; L445-K447 PolarHBondContact O-N 3.34Å; L445-T448 PolarHBondContact O-N 3.46Å; L445-V449 HydrophobicContact CD1-CG2 3.63Å; L445-V449 HydrophobicContact CG-CG2 4.09Å; L445-V449 WeakPolarHBondContact O-CG2 3.08Å; L445-V449 PolarHBondContact O-N 2.78Å; L445-M526 HydrophobicContact CD1-CE 3.56Å; L445-M526 HydrophobicContact CD2-CE 3.77Å; L445-M526 HydrophobicContact CG-CE 4.19Å; L445-G527 VanDerWaalsContact CD1-CA 3.5Å; L445-G544 WeakPolarHBondContact CD2-O 3.29Å; L445-M548 HydrophobicContact CB-CE 4.13Å; L445-M548 HydrophobicContact CD2-CB 3.89Å; L445-M548 HydrophobicContact CD2-CE 3.92Å; L445-M548 HydrophobicContact CD2-CG 4.47Å
446	T	93.2	Very high	93	Very high	77 Å²	77	25.4 Å²	25.4	47%	0.472	14%	0.142	S	C	.	.	H	α-helix	trans	-59.9	-41.1	-174.6	-62.2	0	0	0	0	112.1	M442 T448 G450	M442-T446 WeakPolarHBondContact O-CB 3.36Å; M442-T446 PolarHBondContact O-N 3.46Å; M442-T446 PolarHBondContact O-OG1 3.43Å; M442-T446 VanDerWaalsContact O-OG1 3.1Å; T446-T448 VanDerWaalsContact C-N 3.32Å; T446-T448 PolarHBondContact O-N 3.16Å; T446-G450 PolarHBondContact O-N 3.25Å
447	K	91.7	Very high	92.5	Very high	36 Å²	36	27.4 Å²	27.4	16%	0.157	16%	0.158	C	C	.	.	H	α-helix	trans	-57.5	-47.3	173.3	173.9	-99.7	-179.5	-174.7	0	111.2	A443 L445 V451 E481	A443-K447 PolarHBondContact O-N 2.75Å; L445-K447 VanDerWaalsContact C-N 3.33Å; L445-K447 PolarHBondContact O-N 3.34Å; K447-V451 WeakPolarHBondContact O-CG2 3.34Å; K447-V451 PolarHBondContact O-N 2.96Å; K447-E481 IonicContact NZ-OE1 3.58Å; K447-E481 PolarHBondContact NZ-OE1 3.19Å; K447-E481 IonicContact NZ-OE2 3.59Å; K447-E481 PolarHBondContact NZ-OE2 3.1Å
448	T	93	Very high	92.1	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.018	16%	0.16	C	C	.	.	H	α-helix	trans	-73.7	-42.5	-169.3	-48.5	0	0	0	0	111.5	A444 L445 T446 G450 V451 F452 S524 L528	A444-T448 PolarHBondContact O-N 3.24Å; A444-T448 PolarHBondContact O-OG1 3.07Å; L445-T448 PolarHBondContact O-N 3.46Å; T446-T448 VanDerWaalsContact C-N 3.32Å; T446-T448 PolarHBondContact O-N 3.16Å; T448-G450 VanDerWaalsContact C-N 3.33Å; T448-G450 PolarHBondContact O-N 2.9Å; T448-V451 PolarHBondContact O-N 2.82Å; T448-F452 HydrophobicContact CG2-CB 4.49Å; T448-F452 VanDerWaalsContact O-CB 3.24Å; T448-F452 WeakPolarHBondContact O-CB 3.03Å; T448-F452 PolarHBondContact O-N 2.84Å; T448-S524 WeakPolarHBondContact CG2-O 3.35Å; T448-S524 PolarHBondContact OG1-OG 3.41Å; T448-L528 HydrophobicContact CG2-CB 4.4Å; T448-L528 HydrophobicContact CG2-CD2 3.5Å; T448-L528 HydrophobicContact CG2-CG 3.63Å
449	V	93.6	Very high	91.8	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.018	15%	0.154	C	C	.	.	H	α-helix	trans	-65.9	-34	179.1	171.1	0	0	0	0	112.3	L445 P453 V530 A540 M541	L445-V449 HydrophobicContact CD1-CG2 3.63Å; L445-V449 HydrophobicContact CG-CG2 4.09Å; L445-V449 WeakPolarHBondContact O-CG2 3.08Å; L445-V449 PolarHBondContact O-N 2.78Å; V449-P453 WeakPolarHBondContact O-CD 3.44Å; V449-P453 WeakPolarHBondContact O-CG 3.31Å; V449-V530 HydrophobicContact CG2-CB 4.32Å; V449-V530 HydrophobicContact CG2-CG1 4.12Å; V449-A540 HydrophobicContact CG1-CB 3.6Å; V449-A540 WeakPolarHBondContact CG1-O 3.34Å; V449-M541 HydrophobicContact CG1-CB 4.43Å; V449-M541 HydrophobicContact CG1-CG 3.99Å
450	G	89.9	Confident	91.2	Very high	23 Å²	23	26.1 Å²	26.1	24%	0.237	15%	0.151	C	C	.	.	H	α-helix	trans	-77	-21.9	178.6	0	0	0	0	0	115	T446 T448	T446-G450 PolarHBondContact O-N 3.25Å; T448-G450 VanDerWaalsContact C-N 3.33Å; T448-G450 PolarHBondContact O-N 2.9Å
451	V	89.1	Confident	90.5	Very high	55 Å²	55	26.7 Å²	26.7	33%	0.333	15%	0.153	S	C	.	.	H	α-helix	trans	-105.6	-45.3	-173.5	176.7	0	0	0	0	111.9	K447 T448 K454 E455	K447-V451 WeakPolarHBondContact O-CG2 3.34Å; K447-V451 PolarHBondContact O-N 2.96Å; T448-V451 PolarHBondContact O-N 2.82Å; V451-K454 PolarHBondContact O-N 3.26Å; V451-E455 PolarHBondContact O-N 3.45Å
452	F	91.5	Very high	89.9	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.009	16%	0.16	C	C	.	.	H	α-helix	trans	-63.6	-38.2	-168.3	-171.3	-114	0	0	0	115.3	T448 K454 E455 R456 K477 L528 A532 L641	T448-F452 HydrophobicContact CG2-CB 4.49Å; T448-F452 VanDerWaalsContact O-CB 3.24Å; T448-F452 WeakPolarHBondContact O-CB 3.03Å; T448-F452 PolarHBondContact O-N 2.84Å; F452-K454 VanDerWaalsContact C-N 3.26Å; F452-K454 PolarHBondContact O-N 3.07Å; F452-E455 PolarHBondContact O-N 3.49Å; F452-R456 WeakPolarHBondContact O-CB 3.35Å; F452-R456 PolarHBondContact O-N 3.4Å; F452-K477 HydrophobicContact CE2-CD 4.34Å; F452-L528 HydrophobicContact CB-CD2 4.01Å; F452-L528 HydrophobicContact CD1-CB 4.49Å; F452-L528 HydrophobicContact CD1-CD2 3.96Å; F452-L528 WeakPolarHBondContact CD1-O 3.36Å; F452-L528 HydrophobicContact CD2-CD2 3.38Å; F452-L528 HydrophobicContact CE1-CD2 4.27Å; F452-L528 WeakPolarHBondContact CE1-O 2.98Å; F452-L528 HydrophobicContact CE2-CD2 3.72Å; F452-L528 HydrophobicContact CG-CD2 3.5Å; F452-L528 HydrophobicContact CZ-CD2 4.16Å; F452-A532 HydrophobicContact CE1-CB 4.11Å; F452-L641 HydrophobicContact CZ-CD1 3.95Å
453	P	90.2	Very high	89.3	Confident	9 Å²	9	27.2 Å²	27.2	6%	0.058	15%	0.154	C	C	.	.	H	α-helix	trans	-58.9	-35	178.3	-27.1	36.3	0	0	0	113.8	V449 A457 A540	V449-P453 WeakPolarHBondContact O-CD 3.44Å; V449-P453 WeakPolarHBondContact O-CG 3.31Å; P453-A457 PolarHBondContact O-N 3.13Å; P453-A540 HydrophobicContact CG-CB 3.84Å
454	K	87	Confident	88.5	Confident	112 Å²	112	26.8 Å²	26.8	49%	0.487	15%	0.15	S	C	.	.	H	α-helix	trans	-72	-44.5	177.8	-62.6	-176.9	177.7	-171.6	0	111.6	V451 F452 R456 A457	V451-K454 PolarHBondContact O-N 3.26Å; F452-K454 VanDerWaalsContact C-N 3.26Å; F452-K454 PolarHBondContact O-N 3.07Å; K454-R456 VanDerWaalsContact C-N 3.3Å; K454-R456 PolarHBondContact O-N 3.36Å; K454-A457 WeakPolarHBondContact O-CB 3.3Å; K454-A457 PolarHBondContact O-N 2.93Å
455	E	90.2	Very high	87.5	Confident	13 Å²	13	30.7 Å²	30.7	6%	0.061	17%	0.167	C	C	.	.	H	α-helix	trans	-62.5	-38.1	174.9	167.6	171.2	-166.9	0	0	111.9	F147 V451 F452 A457 I458 V459 Y473 K477	F147-E455 HydrophobicContact CE1-CB 4.24Å; F147-E455 HydrophobicContact CE1-CG 3.63Å; F147-E455 HydrophobicContact CZ-CG 4.06Å; V451-E455 PolarHBondContact O-N 3.45Å; F452-E455 PolarHBondContact O-N 3.49Å; E455-A457 VanDerWaalsContact C-N 3.28Å; E455-A457 PolarHBondContact O-N 3.23Å; E455-I458 WeakPolarHBondContact O-CB 3.41Å; E455-I458 PolarHBondContact O-N 2.96Å; E455-I458 VanDerWaalsContact O-N 3.11Å; E455-V459 HydrophobicContact CG-CG2 4.06Å; E455-V459 VanDerWaalsContact O-CG2 3.25Å; E455-V459 WeakPolarHBondContact O-CG2 3.16Å; E455-V459 PolarHBondContact O-N 2.97Å; E455-Y473 WeakPolarHBondContact CG-OH 3.39Å; E455-Y473 PolarHBondContact OE1-OH 3.37Å; E455-K477 IonicContact OE1-NZ 3.97Å; E455-K477 PolarHBondContact OE1-NZ 3.01Å; E455-K477 WeakPolarHBondContact OE2-CE 3.19Å; E455-K477 IonicContact OE2-NZ 2.69Å; E455-K477 PolarHBondContact OE2-NZ 2.73Å
456	R	89	Confident	86.5	Confident	37 Å²	37	31.8 Å²	31.8	14%	0.14	18%	0.179	C	C	.	.	H	α-helix	trans	-54.7	-44.2	175.4	-174.6	-171.3	73.5	-169.1	-8.2	111.3	F452 K454 I458 V459 D460 G531 A532 A534 P535 L641	F452-R456 WeakPolarHBondContact O-CB 3.35Å; F452-R456 PolarHBondContact O-N 3.4Å; K454-R456 VanDerWaalsContact C-N 3.3Å; K454-R456 PolarHBondContact O-N 3.36Å; R456-I458 VanDerWaalsContact C-N 3.29Å; R456-I458 PolarHBondContact O-N 2.98Å; R456-V459 PolarHBondContact O-N 3.26Å; R456-V459 VanDerWaalsContact O-N 3.16Å; R456-D460 WeakPolarHBondContact CG-OD2 3.47Å; R456-D460 WeakPolarHBondContact O-CB 3.46Å; R456-D460 PolarHBondContact O-N 2.92Å; R456-G531 PolarHBondContact NH1-O 3.28Å; R456-A532 PolarHBondContact NH1-O 3.45Å; R456-A534 VanDerWaalsContact CZ-O 3.32Å; R456-A534 PolarHBondContact NH1-O 3.48Å; R456-A534 PolarHBondContact NH2-O 2.87Å; R456-P535 PolarHBondContact NH2-O 3.04Å; R456-L641 HydrophobicContact CG-CD2 4Å
457	A	85.7	Confident	85.9	Confident	42 Å²	42	28.6 Å²	28.6	35%	0.347	16%	0.159	S	C	.	.	H	α-helix	trans	-59.3	-40.3	179.2	0	0	0	0	0	112.4	L145 P453 K454 E455 R461	L145-A457 HydrophobicContact CD1-CB 3.78Å; P453-A457 PolarHBondContact O-N 3.13Å; K454-A457 WeakPolarHBondContact O-CB 3.3Å; K454-A457 PolarHBondContact O-N 2.93Å; E455-A457 VanDerWaalsContact C-N 3.28Å; E455-A457 PolarHBondContact O-N 3.23Å; A457-R461 PolarHBondContact O-N 3.06Å
458	I	88.6	Confident	85.7	Confident	9 Å²	9	27.4 Å²	27.4	5%	0.046	15%	0.154	C	C	.	.	H	α-helix	trans	-66.8	-46.7	175.5	-57.5	166.2	0	0	0	110.3	L145 F146 F147 E455 R456 D460 R461 E462	L145-I458 HydrophobicContact CB-CD1 4.49Å; L145-I458 HydrophobicContact CB-CG1 3.81Å; F146-I458 VanDerWaalsContact C-CD1 3.4Å; F146-I458 WeakPolarHBondContact O-CD1 3.32Å; F147-I458 HydrophobicContact CD1-CD1 4.26Å; F147-I458 HydrophobicContact CD2-CD1 4.37Å; F147-I458 HydrophobicContact CD2-CG2 4.05Å; F147-I458 HydrophobicContact CE1-CD1 4.43Å; F147-I458 HydrophobicContact CE2-CB 4.32Å; F147-I458 HydrophobicContact CE2-CD1 4.47Å; F147-I458 HydrophobicContact CE2-CG2 3.57Å; F147-I458 HydrophobicContact CG-CD1 4.27Å; F147-I458 HydrophobicContact CZ-CB 4.42Å; F147-I458 HydrophobicContact CZ-CG2 4.13Å; E455-I458 WeakPolarHBondContact O-CB 3.41Å; E455-I458 PolarHBondContact O-N 2.96Å; E455-I458 VanDerWaalsContact O-N 3.11Å; R456-I458 VanDerWaalsContact C-N 3.29Å; R456-I458 PolarHBondContact O-N 2.98Å; I458-D460 PolarHBondContact O-N 3.37Å; I458-R461 WeakPolarHBondContact O-CB 3.44Å; I458-R461 PolarHBondContact O-N 3.04Å; I458-E462 HydrophobicContact CG2-CG 4.43Å; I458-E462 WeakPolarHBondContact O-CG 3.48Å; I458-E462 PolarHBondContact O-N 3.18Å
459	V	88.7	Confident	85.4	Confident	3 Å²	3	28.8 Å²	28.8	2%	0.018	17%	0.166	C	C	.	.	H	α-helix	trans	-65.7	-40.9	-176.6	169.7	0	0	0	0	111.6	F147 E455 R456 R461 E462 R463 Y468 Y473	F147-V459 HydrophobicContact CZ-CG2 4.29Å; E455-V459 HydrophobicContact CG-CG2 4.06Å; E455-V459 VanDerWaalsContact O-CG2 3.25Å; E455-V459 WeakPolarHBondContact O-CG2 3.16Å; E455-V459 PolarHBondContact O-N 2.97Å; R456-V459 PolarHBondContact O-N 3.26Å; R456-V459 VanDerWaalsContact O-N 3.16Å; V459-R461 VanDerWaalsContact C-N 3.31Å; V459-R461 PolarHBondContact O-N 2.85Å; V459-E462 PolarHBondContact O-N 3.15Å; V459-R463 HydrophobicContact CG1-CG 4.19Å; V459-R463 WeakPolarHBondContact O-CB 3.44Å; V459-R463 WeakPolarHBondContact O-CG 3.2Å; V459-R463 PolarHBondContact O-N 2.82Å; V459-Y468 HydrophobicContact CG1-CE2 4.32Å; V459-Y473 HydrophobicContact CG1-CD1 3.96Å; V459-Y473 HydrophobicContact CG1-CD2 4.43Å; V459-Y473 HydrophobicContact CG1-CE1 3.78Å; V459-Y473 HydrophobicContact CG1-CE2 4.29Å; V459-Y473 HydrophobicContact CG1-CG 4.28Å; V459-Y473 HydrophobicContact CG2-CD2 4.2Å; V459-Y473 HydrophobicContact CG2-CE1 4.13Å; V459-Y473 HydrophobicContact CG2-CE2 3.46Å; V459-Y473 VanDerWaalsContact CG2-CE2 3.46Å; V459-Y473 VanDerWaalsContact CG2-CZ 3.41Å; V459-Y473 WeakPolarHBondContact CG2-OH 3.5Å
460	D	83.6	Confident	85.2	Confident	26 Å²	26	28.7 Å²	28.7	14%	0.139	17%	0.165	C	C	.	.	H	α-helix	trans	-65.3	-38.3	177.1	-73.8	-22.7	0	0	0	110.9	R456 I458 R463 A464	R456-D460 WeakPolarHBondContact CG-OD2 3.47Å; R456-D460 WeakPolarHBondContact O-CB 3.46Å; R456-D460 PolarHBondContact O-N 2.92Å; I458-D460 PolarHBondContact O-N 3.37Å; D460-R463 IonicContact OD1-NH1 3.53Å; D460-A464 VanDerWaalsContact O-CB 3.28Å; D460-A464 WeakPolarHBondContact O-CB 2.98Å; D460-A464 PolarHBondContact O-N 2.69Å
461	R	80	Confident	85.3	Confident	21 Å²	21	28.7 Å²	28.7	8%	0.079	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-50.8	172	-175.4	-176.4	68	-179.3	-0.9	111.9	L145 A457 I458 V459 R463 A464 K465	L145-R461 PolarHBondContact O-NH1 3.46Å; L145-R461 PolarHBondContact O-NH2 2.79Å; A457-R461 PolarHBondContact O-N 3.06Å; I458-R461 WeakPolarHBondContact O-CB 3.44Å; I458-R461 PolarHBondContact O-N 3.04Å; V459-R461 VanDerWaalsContact C-N 3.31Å; V459-R461 PolarHBondContact O-N 2.85Å; R461-R463 VanDerWaalsContact C-N 3.29Å; R461-R463 PolarHBondContact O-N 3.47Å; R461-A464 PolarHBondContact O-N 3.39Å; R461-K465 PolarHBondContact O-N 3.37Å
462	E	83.6	Confident	85.4	Confident	33 Å²	33	26.1 Å²	26.1	15%	0.154	15%	0.149	C	C	.	.	H	α-helix	trans	-62.5	-37	-179.9	-72.1	178.1	177.1	0	0	112.1	R386 I458 V459 S467 Y468	R386-E462 IonicContact CZ-OE2 2.9Å; R386-E462 IonicContact NH1-OE1 3.75Å; R386-E462 PolarHBondContact NH1-OE1 2.96Å; R386-E462 IonicContact NH1-OE2 2.72Å; R386-E462 PolarHBondContact NH1-OE2 2.91Å; R386-E462 IonicContact NH2-OE2 3.25Å; R386-E462 PolarHBondContact NH2-OE2 3.26Å; I458-E462 HydrophobicContact CG2-CG 4.43Å; I458-E462 WeakPolarHBondContact O-CG 3.48Å; I458-E462 PolarHBondContact O-N 3.18Å; V459-E462 PolarHBondContact O-N 3.15Å; E462-S467 VanDerWaalsContact O-CB 3.25Å; E462-S467 WeakPolarHBondContact O-CB 3.31Å; E462-S467 PolarHBondContact O-N 2.86Å; E462-S467 VanDerWaalsContact O-N 3.15Å; E462-S467 PolarHBondContact O-OG 3.41Å; E462-Y468 HydrophobicContact CB-CE1 3.78Å; E462-Y468 WeakPolarHBondContact OE2-CE1 3Å; E462-Y468 PolarHBondContact OE2-OH 2.84Å
463	R	83.7	Confident	85.5	Confident	23 Å²	23	26.3 Å²	26.3	9%	0.087	15%	0.15	C	C	.	.	H	α-helix	trans	-75.5	-33.8	178	-73.1	176.8	63.6	-137.5	-3.7	113.3	V459 D460 R461 K465 G466 Y468 L641	V459-R463 HydrophobicContact CG1-CG 4.19Å; V459-R463 WeakPolarHBondContact O-CB 3.44Å; V459-R463 WeakPolarHBondContact O-CG 3.2Å; V459-R463 PolarHBondContact O-N 2.82Å; D460-R463 IonicContact OD1-NH1 3.53Å; R461-R463 VanDerWaalsContact C-N 3.29Å; R461-R463 PolarHBondContact O-N 3.47Å; R463-K465 PolarHBondContact O-N 3.28Å; R463-G466 PolarHBondContact O-N 3.28Å; R463-Y468 HydrophobicContact CG-CD2 3.99Å; R463-Y468 HydrophobicContact CG-CE2 3.6Å; R463-L641 PolarHBondContact NH1-O 2.81Å; R463-L641 VanDerWaalsContact NH1-O 3.09Å
464	A	75.9	Confident	85.6	Confident	35 Å²	35	26.5 Å²	26.5	29%	0.289	15%	0.151	S	C	.	.	H	α-helix	trans	-58.2	-36.9	174.5	0	0	0	0	0	111	D460 R461 G466 P646 Y648	D460-A464 VanDerWaalsContact O-CB 3.28Å; D460-A464 WeakPolarHBondContact O-CB 2.98Å; D460-A464 PolarHBondContact O-N 2.69Å; R461-A464 PolarHBondContact O-N 3.39Å; A464-G466 PolarHBondContact O-N 2.91Å; A464-P646 HydrophobicContact CB-CG 3.93Å; A464-Y648 HydrophobicContact CB-CE2 4.48Å
465	K	73.5	Confident	85.8	Confident	81 Å²	81	22.7 Å²	22.7	35%	0.352	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-9.2	173.7	-58.4	179.3	-168	-178.3	0	114.8	E215 R461 R463	E215-K465 IonicContact OE1-NZ 2.73Å; E215-K465 PolarHBondContact OE1-NZ 3.28Å; E215-K465 VanDerWaalsContact OE2-CE 3.23Å; E215-K465 WeakPolarHBondContact OE2-CE 3.1Å; E215-K465 IonicContact OE2-NZ 3.59Å; E215-K465 PolarHBondContact OE2-NZ 3.26Å; R461-K465 PolarHBondContact O-N 3.37Å; R463-K465 PolarHBondContact O-N 3.28Å
466	G	75.5	Confident	86	Confident	24 Å²	24	22.1 Å²	22.1	25%	0.247	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	19.1	-176.5	0	0	0	0	0	115.1	R463 A464 Y468	R463-G466 PolarHBondContact O-N 3.28Å; A464-G466 PolarHBondContact O-N 2.91Å; G466-Y468 VanDerWaalsContact C-N 3.28Å; G466-Y468 PolarHBondContact O-N 3.34Å
467	S	80	Confident	86.2	Confident	10 Å²	10	21 Å²	21	7%	0.07	13%	0.131	C	C	.	.	S	Bend	trans	-60.6	-35	-177.2	-49.5	0	0	0	0	113.3	E462	E462-S467 VanDerWaalsContact O-CB 3.25Å; E462-S467 WeakPolarHBondContact O-CB 3.31Å; E462-S467 PolarHBondContact O-N 2.86Å; E462-S467 VanDerWaalsContact O-N 3.15Å; E462-S467 PolarHBondContact O-OG 3.41Å
468	Y	86.7	Confident	86.4	Confident	11 Å²	11	21.3 Å²	21.3	4%	0.043	13%	0.127	C	C	.	.	S	Bend	trans	-161.1	164.6	177.3	52.8	-98.7	0	0	0	112.7	L162 L383 R386 V459 E462 R463 G466 Y473	L162-Y468 HydrophobicContact CD1-CD1 3.92Å; L162-Y468 HydrophobicContact CD1-CE1 4.32Å; L162-Y468 HydrophobicContact CD2-CD1 4.46Å; L383-Y468 HydrophobicContact CD1-CD1 4.31Å; L383-Y468 HydrophobicContact CD1-CD2 3.91Å; L383-Y468 HydrophobicContact CD1-CE2 4.46Å; L383-Y468 HydrophobicContact CD1-CG 3.82Å; L383-Y468 HydrophobicContact CD2-CD1 3.91Å; L383-Y468 HydrophobicContact CD2-CE1 3.86Å; L383-Y468 HydrophobicContact CD2-CG 4.25Å; R386-Y468 PolarHBondContact NH2-OH 3.15Å; R386-Y468 VanDerWaalsContact NH2-OH 3.07Å; V459-Y468 HydrophobicContact CG1-CE2 4.32Å; E462-Y468 HydrophobicContact CB-CE1 3.78Å; E462-Y468 WeakPolarHBondContact OE2-CE1 3Å; E462-Y468 PolarHBondContact OE2-OH 2.84Å; R463-Y468 HydrophobicContact CG-CD2 3.99Å; R463-Y468 HydrophobicContact CG-CE2 3.6Å; G466-Y468 VanDerWaalsContact C-N 3.28Å; G466-Y468 PolarHBondContact O-N 3.34Å; Y468-Y473 HydrophobicContact CE2-CD2 4.16Å; Y468-Y473 AromaticContact CE2-CG 3.98Å; Y468-Y473 HydrophobicContact CE2-CG 3.98Å
469	A	87.6	Confident	86.6	Confident	32 Å²	32	24.9 Å²	24.9	26%	0.264	15%	0.146	S	C	.	.			trans	-83.1	155.6	175	0	0	0	0	0	112.5	G471 P472 Y473	A469-G471 VanDerWaalsContact C-N 3.35Å; A469-G471 PolarHBondContact O-N 2.83Å; A469-P472 HydrophobicContact CB-CG 4.23Å; A469-P472 WeakPolarHBondContact O-CD 3.31Å; A469-Y473 PolarHBondContact O-N 3.46Å
470	L	89.4	Confident	86.8	Confident	2 Å²	2	24.7 Å²	24.7	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-64.9	-37	-179	-178.8	61	0	0	0	113	Y473 L474 Y638 L641 K642	L470-Y473 HydrophobicContact CD1-CD1 4.13Å; L470-Y473 PolarHBondContact O-N 3.32Å; L470-L474 PolarHBondContact O-N 3.09Å; L470-Y638 HydrophobicContact CB-CE2 4.1Å; L470-Y638 HydrophobicContact CD2-CD2 3.64Å; L470-Y638 HydrophobicContact CD2-CE2 3.7Å; L470-Y638 HydrophobicContact CD2-CG 4.32Å; L470-Y638 WeakPolarHBondContact CD2-O 3.49Å; L470-Y638 HydrophobicContact CG-CD2 3.81Å; L470-Y638 HydrophobicContact CG-CE2 3.79Å; L470-L641 HydrophobicContact CD1-CB 3.86Å; L470-L641 HydrophobicContact CD1-CD1 3.95Å; L470-L641 HydrophobicContact CD2-CB 3.71Å; L470-L641 HydrophobicContact CG-CB 4.44Å; L470-K642 HydrophobicContact CD2-CB 4.07Å
471	G	90.8	Very high	87.1	Confident	22 Å²	22	25 Å²	25	23%	0.227	15%	0.146	C	C	.	.	H	α-helix	trans	-59.4	-56.6	-178.6	0	0	0	0	0	113	A469 Y473 L474 S475	A469-G471 VanDerWaalsContact C-N 3.35Å; A469-G471 PolarHBondContact O-N 2.83Å; G471-Y473 VanDerWaalsContact C-N 3.29Å; G471-Y473 PolarHBondContact O-N 3.28Å; G471-L474 PolarHBondContact O-N 3.49Å; G471-S475 WeakPolarHBondContact O-CB 3.46Å; G471-S475 PolarHBondContact O-N 3.48Å; G471-S475 PolarHBondContact O-OG 2.89Å
472	P	92.3	Very high	87.7	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.006	16%	0.158	C	C	.	.	H	α-helix	trans	-54	-42.6	174.3	-29.1	35.8	0	0	0	113.3	W376 Q379 F380 L383 A469 S475 S476	W376-P472 VanDerWaalsContact CD1-CG 3.47Å; W376-P472 HydrophobicContact CD2-CG 4.21Å; W376-P472 HydrophobicContact CG-CG 3.87Å; Q379-P472 HydrophobicContact CB-CB 3.81Å; Q379-P472 HydrophobicContact CB-CG 4.07Å; F380-P472 HydrophobicContact CB-CB 4.26Å; L383-P472 HydrophobicContact CD1-CB 4.05Å; A469-P472 HydrophobicContact CB-CG 4.23Å; A469-P472 WeakPolarHBondContact O-CD 3.31Å; P472-S475 PolarHBondContact O-OG 3.24Å; P472-S476 WeakPolarHBondContact O-CB 3.33Å; P472-S476 PolarHBondContact O-N 3.36Å; P472-S476 PolarHBondContact O-OG 2.9Å
473	Y	93	Very high	88.1	Confident	6 Å²	6	28.8 Å²	28.8	2%	0.024	17%	0.171	C	C	.	.	H	α-helix	trans	-61.3	-55.9	177.8	165.9	-102.5	0	0	0	112.3	E455 V459 Y468 A469 L470 G471 S475 S476 K477	E455-Y473 WeakPolarHBondContact CG-OH 3.39Å; E455-Y473 PolarHBondContact OE1-OH 3.37Å; V459-Y473 HydrophobicContact CG1-CD1 3.96Å; V459-Y473 HydrophobicContact CG1-CD2 4.43Å; V459-Y473 HydrophobicContact CG1-CE1 3.78Å; V459-Y473 HydrophobicContact CG1-CE2 4.29Å; V459-Y473 HydrophobicContact CG1-CG 4.28Å; V459-Y473 HydrophobicContact CG2-CD2 4.2Å; V459-Y473 HydrophobicContact CG2-CE1 4.13Å; V459-Y473 HydrophobicContact CG2-CE2 3.46Å; V459-Y473 VanDerWaalsContact CG2-CE2 3.46Å; V459-Y473 VanDerWaalsContact CG2-CZ 3.41Å; V459-Y473 WeakPolarHBondContact CG2-OH 3.5Å; Y468-Y473 HydrophobicContact CE2-CD2 4.16Å; Y468-Y473 AromaticContact CE2-CG 3.98Å; Y468-Y473 HydrophobicContact CE2-CG 3.98Å; A469-Y473 PolarHBondContact O-N 3.46Å; L470-Y473 HydrophobicContact CD1-CD1 4.13Å; L470-Y473 PolarHBondContact O-N 3.32Å; G471-Y473 VanDerWaalsContact C-N 3.29Å; G471-Y473 PolarHBondContact O-N 3.28Å; Y473-S475 PolarHBondContact O-N 2.94Å; Y473-S476 PolarHBondContact O-N 3.18Å; Y473-S476 PolarHBondContact O-OG 3.07Å; Y473-K477 PolarHBondContact O-N 3.17Å
474	L	92.3	Very high	88.5	Confident	14 Å²	14	29.1 Å²	29.1	7%	0.073	17%	0.174	C	C	.	.	H	α-helix	trans	-66.5	-40.4	-173.4	-171.5	64.4	0	0	0	111.6	L470 G471 L478 T637 Y638	L470-L474 PolarHBondContact O-N 3.09Å; G471-L474 PolarHBondContact O-N 3.49Å; L474-L478 WeakPolarHBondContact O-CB 3.37Å; L474-L478 PolarHBondContact O-N 3.11Å; L474-T637 HydrophobicContact CD1-CG2 4.24Å; L474-Y638 HydrophobicContact CD2-CD2 4.28Å
475	S	92.4	Very high	89.2	Confident	32 Å²	32	28 Å²	28	22%	0.224	17%	0.167	C	C	.	.	H	α-helix	trans	-66.1	-41.1	176.4	53.9	0	0	0	0	112.5	F380 G471 P472 Y473 L478 L479	F380-S475 WeakPolarHBondContact CD2-OG 3.43Å; G471-S475 WeakPolarHBondContact O-CB 3.46Å; G471-S475 PolarHBondContact O-N 3.48Å; G471-S475 PolarHBondContact O-OG 2.89Å; P472-S475 PolarHBondContact O-OG 3.24Å; Y473-S475 PolarHBondContact O-N 2.94Å; S475-L478 PolarHBondContact O-N 3.27Å; S475-L479 WeakPolarHBondContact O-CG 3.4Å; S475-L479 PolarHBondContact O-N 2.98Å
476	S	94.3	Very high	90.3	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.007	16%	0.156	C	C	.	.	H	α-helix	trans	-65.2	-41.1	178.3	68.4	0	0	0	0	112.3	F380 L383 P472 Y473 A480	F380-S476 VanDerWaalsContact CE2-CA 3.5Å; L383-S476 VanDerWaalsContact CB-OG 3.24Å; L383-S476 WeakPolarHBondContact CB-OG 3.46Å; P472-S476 WeakPolarHBondContact O-CB 3.33Å; P472-S476 PolarHBondContact O-N 3.36Å; P472-S476 PolarHBondContact O-OG 2.9Å; Y473-S476 PolarHBondContact O-N 3.18Å; Y473-S476 PolarHBondContact O-OG 3.07Å; S476-A480 VanDerWaalsContact O-CB 3.25Å; S476-A480 WeakPolarHBondContact O-CB 3.43Å; S476-A480 PolarHBondContact O-N 2.95Å
477	K	91.7	Very high	91.2	Very high	12 Å²	12	25.5 Å²	25.5	5%	0.052	16%	0.159	C	C	.	.	H	α-helix	trans	-61.3	-48.8	174.4	-176.2	177	-176.7	65.2	0	111.3	F452 E455 Y473 L479 A480 E481	F452-K477 HydrophobicContact CE2-CD 4.34Å; E455-K477 IonicContact OE1-NZ 3.97Å; E455-K477 PolarHBondContact OE1-NZ 3.01Å; E455-K477 WeakPolarHBondContact OE2-CE 3.19Å; E455-K477 IonicContact OE2-NZ 2.69Å; E455-K477 PolarHBondContact OE2-NZ 2.73Å; Y473-K477 PolarHBondContact O-N 3.17Å; K477-L479 PolarHBondContact O-N 2.71Å; K477-A480 PolarHBondContact O-N 2.83Å; K477-E481 WeakPolarHBondContact CE-OE1 3.46Å; K477-E481 IonicContact NZ-OE1 3Å; K477-E481 PolarHBondContact NZ-OE1 2.76Å; K477-E481 WeakPolarHBondContact O-CG 3.43Å; K477-E481 PolarHBondContact O-N 3.48Å; K477-E481 VanDerWaalsContact O-N 3.07Å
478	L	90.5	Very high	91.9	Very high	50 Å²	50	25.6 Å²	25.6	26%	0.262	16%	0.158	S	C	.	.	H	α-helix	trans	-54.4	-53.4	178.4	171.5	53.1	0	0	0	111	L474 S475 A480 E481 I482 Y634	L474-L478 WeakPolarHBondContact O-CB 3.37Å; L474-L478 PolarHBondContact O-N 3.11Å; S475-L478 PolarHBondContact O-N 3.27Å; L478-A480 PolarHBondContact O-N 2.8Å; L478-E481 PolarHBondContact O-N 2.97Å; L478-I482 WeakPolarHBondContact O-CG1 3.22Å; L478-I482 PolarHBondContact O-N 3.46Å; L478-Y634 HydrophobicContact CB-CE1 4.44Å; L478-Y634 HydrophobicContact CD1-CE1 3.96Å; L478-Y634 HydrophobicContact CD1-CE2 3.65Å; L478-Y634 WeakPolarHBondContact CD1-OH 3.47Å; L478-Y634 HydrophobicContact CD2-CD1 4.49Å; L478-Y634 HydrophobicContact CD2-CD2 4.21Å; L478-Y634 HydrophobicContact CD2-CE1 4.28Å; L478-Y634 HydrophobicContact CD2-CE2 3.97Å; L478-Y634 HydrophobicContact CG-CE1 4.45Å; L478-Y634 HydrophobicContact CG-CE2 4.43Å
479	L	92.7	Very high	92.3	Very high	83 Å²	83	25.3 Å²	25.3	44%	0.435	16%	0.157	S	C	.	.	H	α-helix	trans	-68.3	-36.7	-175.5	-71.7	170.1	0	0	0	112.6	F380 F384 S475 K477 E481 I482	F380-L479 HydrophobicContact CE2-CD1 3.82Å; F380-L479 HydrophobicContact CZ-CD1 3.49Å; F380-L479 VanDerWaalsContact CZ-CD1 3.49Å; F384-L479 HydrophobicContact CD2-CB 4.13Å; F384-L479 HydrophobicContact CE2-CB 3.8Å; S475-L479 WeakPolarHBondContact O-CG 3.4Å; S475-L479 PolarHBondContact O-N 2.98Å; K477-L479 PolarHBondContact O-N 2.71Å; L479-E481 VanDerWaalsContact C-N 3.31Å; L479-E481 PolarHBondContact O-N 3.46Å; L479-I482 HydrophobicContact CD2-CD1 3.9Å; L479-I482 PolarHBondContact O-N 3.45Å
480	A	92.6	Very high	92.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-68.7	-31.1	178.7	0	0	0	0	0	112.6	F384 A387 W388 S476 K477 L478	F384-A480 HydrophobicContact CD2-CB 4.05Å; F384-A480 HydrophobicContact CE2-CB 3.94Å; A387-A480 HydrophobicContact CB-CB 3.57Å; W388-A480 HydrophobicContact CB-CB 4.41Å; W388-A480 HydrophobicContact CE3-CB 4.49Å; S476-A480 VanDerWaalsContact O-CB 3.25Å; S476-A480 WeakPolarHBondContact O-CB 3.43Å; S476-A480 PolarHBondContact O-N 2.95Å; K477-A480 PolarHBondContact O-N 2.83Å; L478-A480 PolarHBondContact O-N 2.8Å
481	E	90.5	Very high	93.1	Very high	33 Å²	33	30 Å²	30	15%	0.154	18%	0.177	C	C	.	.	H	α-helix	trans	-79.5	-13.7	179.7	-72	-168.8	-168.9	0	0	113.6	K447 K477 L478 L479 G485	K447-E481 IonicContact NZ-OE1 3.58Å; K447-E481 PolarHBondContact NZ-OE1 3.19Å; K447-E481 IonicContact NZ-OE2 3.59Å; K447-E481 PolarHBondContact NZ-OE2 3.1Å; K477-E481 WeakPolarHBondContact CE-OE1 3.46Å; K477-E481 IonicContact NZ-OE1 3Å; K477-E481 PolarHBondContact NZ-OE1 2.76Å; K477-E481 WeakPolarHBondContact O-CG 3.43Å; K477-E481 PolarHBondContact O-N 3.48Å; K477-E481 VanDerWaalsContact O-N 3.07Å; L478-E481 PolarHBondContact O-N 2.97Å; L479-E481 VanDerWaalsContact C-N 3.31Å; L479-E481 PolarHBondContact O-N 3.46Å; E481-G485 VanDerWaalsContact O-CA 3.31Å; E481-G485 WeakPolarHBondContact O-CA 3.24Å; E481-G485 PolarHBondContact O-N 3.33Å
482	I	92.5	Very high	93.4	Very high	64 Å²	64	29 Å²	29	33%	0.328	17%	0.166	S	C	.	.	H	α-helix	trans	-58.6	-54	-175.7	-72.5	169.5	0	0	0	112.6	L478 L479 I484 G485 A486 F521	L478-I482 WeakPolarHBondContact O-CG1 3.22Å; L478-I482 PolarHBondContact O-N 3.46Å; L479-I482 HydrophobicContact CD2-CD1 3.9Å; L479-I482 PolarHBondContact O-N 3.45Å; I482-I484 PolarHBondContact O-N 3.48Å; I482-G485 PolarHBondContact O-N 2.83Å; I482-A486 VanDerWaalsContact O-CB 3.28Å; I482-A486 WeakPolarHBondContact O-CB 3.45Å; I482-A486 PolarHBondContact O-N 2.84Å; I482-F521 HydrophobicContact CB-CZ 4.15Å; I482-F521 HydrophobicContact CG1-CE1 4.32Å; I482-F521 HydrophobicContact CG1-CZ 4.15Å; I482-F521 HydrophobicContact CG2-CE2 4.43Å; I482-F521 HydrophobicContact CG2-CZ 3.96Å; I482-F521 WeakPolarHBondContact O-CZ 3.35Å
483	P	92.7	Very high	93.6	Very high	68 Å²	68	29 Å²	29	44%	0.442	17%	0.166	S	C	.	.	H	α-helix	trans	-65.6	-41.8	-172.5	-27.6	41	0	0	0	113	W388 A487	W388-P483 HydrophobicContact CH2-CB 4.23Å; W388-P483 HydrophobicContact CH2-CG 4Å; W388-P483 HydrophobicContact CZ3-CB 4.33Å; W388-P483 HydrophobicContact CZ3-CG 3.75Å; P483-A487 PolarHBondContact O-N 3.22Å
484	I	90.7	Very high	93.8	Very high	30 Å²	30	31.4 Å²	31.4	15%	0.154	18%	0.184	C	C	.	.	H	α-helix	trans	-75.8	-38.5	-179.8	-62	174.9	0	0	0	110.5	A391 F392 I482 A486 A487 F488	A391-I484 HydrophobicContact CB-CD1 3.74Å; A391-I484 WeakPolarHBondContact O-CD1 3.34Å; F392-I484 HydrophobicContact CB-CD1 4.13Å; F392-I484 HydrophobicContact CD2-CD1 4.37Å; I482-I484 PolarHBondContact O-N 3.48Å; I484-A486 VanDerWaalsContact C-N 3.33Å; I484-A486 PolarHBondContact O-N 3.25Å; I484-A487 WeakPolarHBondContact O-CB 3.38Å; I484-A487 PolarHBondContact O-N 2.76Å; I484-F488 HydrophobicContact CG2-CE2 3.95Å; I484-F488 HydrophobicContact CG2-CZ 4.34Å; I484-F488 WeakPolarHBondContact O-CD2 3.27Å; I484-F488 WeakPolarHBondContact O-CE2 3.21Å
485	G	91.9	Very high	94	Very high	13 Å²	13	33 Å²	33	13%	0.134	19%	0.192	C	C	.	.	H	α-helix	trans	-63.5	-36.1	176.1	0	0	0	0	0	113.1	E481 I482 P489	E481-G485 VanDerWaalsContact O-CA 3.31Å; E481-G485 WeakPolarHBondContact O-CA 3.24Å; E481-G485 PolarHBondContact O-N 3.33Å; I482-G485 PolarHBondContact O-N 2.83Å; G485-P489 WeakPolarHBondContact O-CD 3.45Å
486	A	95.2	Very high	94.2	Very high	14 Å²	14	31.4 Å²	31.4	12%	0.116	18%	0.181	C	C	.	.	H	α-helix	trans	-74.4	-29.2	175.5	0	0	0	0	0	113.1	I482 I484 F488 P489 L490 T517 F521	I482-A486 VanDerWaalsContact O-CB 3.28Å; I482-A486 WeakPolarHBondContact O-CB 3.45Å; I482-A486 PolarHBondContact O-N 2.84Å; I484-A486 VanDerWaalsContact C-N 3.33Å; I484-A486 PolarHBondContact O-N 3.25Å; A486-F488 VanDerWaalsContact C-N 3.3Å; A486-F488 PolarHBondContact O-N 3.01Å; A486-P489 WeakPolarHBondContact O-CD 3.35Å; A486-P489 VanDerWaalsContact O-CG 3.27Å; A486-P489 WeakPolarHBondContact O-CG 3.33Å; A486-L490 HydrophobicContact CB-CD1 4.25Å; A486-L490 WeakPolarHBondContact O-CB 3.49Å; A486-L490 WeakPolarHBondContact O-CD1 3.41Å; A486-L490 WeakPolarHBondContact O-CG 3.16Å; A486-L490 PolarHBondContact O-N 2.76Å; A486-L490 VanDerWaalsContact O-N 3.14Å; A486-T517 HydrophobicContact CB-CG2 3.75Å; A486-F521 HydrophobicContact CB-CZ 4.02Å
487	A	95.4	Very high	94.3	Very high	37 Å²	37	32 Å²	32	31%	0.306	18%	0.184	S	C	.	.	H	α-helix	trans	-57.3	-41.2	-177.5	0	0	0	0	0	112.9	P483 I484 L490 I491	P483-A487 PolarHBondContact O-N 3.22Å; I484-A487 WeakPolarHBondContact O-CB 3.38Å; I484-A487 PolarHBondContact O-N 2.76Å; A487-L490 PolarHBondContact O-N 3.16Å; A487-I491 WeakPolarHBondContact O-CB 3.43Å; A487-I491 WeakPolarHBondContact O-CD1 3.4Å; A487-I491 WeakPolarHBondContact O-CG1 3.26Å; A487-I491 PolarHBondContact O-N 3.18Å
488	F	94.7	Very high	94.4	Very high	13 Å²	13	35.4 Å²	35.4	6%	0.057	21%	0.207	C	C	.	.	H	α-helix	trans	-66.2	-52.4	-177.8	-54.7	-70.5	0	0	0	114.8	N398 R401 A402 I484 A486 L490 I491 F492	N398-F488 HydrophobicContact CB-CZ 4.05Å; N398-F488 WeakPolarHBondContact O-CE1 3.38Å; R401-F488 HydrophobicContact CB-CD1 3.78Å; R401-F488 HydrophobicContact CB-CE1 3.49Å; R401-F488 VanDerWaalsContact CB-CE1 3.49Å; R401-F488 HydrophobicContact CB-CE2 4.49Å; R401-F488 HydrophobicContact CB-CG 4.41Å; R401-F488 HydrophobicContact CB-CZ 3.88Å; R401-F488 VanDerWaalsContact CZ-CD2 3.48Å; R401-F488 VanDerWaalsContact NH1-CE2 3.3Å; A402-F488 HydrophobicContact CB-CE1 4.2Å; I484-F488 HydrophobicContact CG2-CE2 3.95Å; I484-F488 HydrophobicContact CG2-CZ 4.34Å; I484-F488 WeakPolarHBondContact O-CD2 3.27Å; I484-F488 WeakPolarHBondContact O-CE2 3.21Å; A486-F488 VanDerWaalsContact C-N 3.3Å; A486-F488 PolarHBondContact O-N 3.01Å; F488-L490 VanDerWaalsContact C-N 3.26Å; F488-L490 PolarHBondContact O-N 3.02Å; F488-I491 PolarHBondContact O-N 3.13Å; F488-F492 WeakPolarHBondContact O-CB 3.15Å; F488-F492 PolarHBondContact O-N 3.31Å
489	P	95.5	Very high	94.7	Very high	4 Å²	4	34.8 Å²	34.8	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-62.8	-32.5	174.1	22	-31.4	0	0	0	112.5	T440 G485 A486 G493 V516 T517	T440-P489 HydrophobicContact CG2-CB 3.91Å; G485-P489 WeakPolarHBondContact O-CD 3.45Å; A486-P489 WeakPolarHBondContact O-CD 3.35Å; A486-P489 VanDerWaalsContact O-CG 3.27Å; A486-P489 WeakPolarHBondContact O-CG 3.33Å; P489-G493 PolarHBondContact O-N 2.84Å; P489-V516 HydrophobicContact CB-CG1 3.78Å; P489-T517 HydrophobicContact CG-CG2 4.46Å
490	L	96.8	Very high	94.8	Very high	74 Å²	74	30.9 Å²	30.9	39%	0.387	18%	0.182	S	C	.	.	H	α-helix	trans	-67.2	-45.3	175.5	-68.8	175.1	0	0	0	112.1	A486 A487 F488 G493 S494 C513	A486-L490 HydrophobicContact CB-CD1 4.25Å; A486-L490 WeakPolarHBondContact O-CB 3.49Å; A486-L490 WeakPolarHBondContact O-CD1 3.41Å; A486-L490 WeakPolarHBondContact O-CG 3.16Å; A486-L490 PolarHBondContact O-N 2.76Å; A486-L490 VanDerWaalsContact O-N 3.14Å; A487-L490 PolarHBondContact O-N 3.16Å; F488-L490 VanDerWaalsContact C-N 3.26Å; F488-L490 PolarHBondContact O-N 3.02Å; L490-G493 PolarHBondContact O-N 3.13Å; L490-S494 VanDerWaalsContact O-CB 3.25Å; L490-S494 WeakPolarHBondContact O-CB 3.32Å; L490-S494 PolarHBondContact O-N 3.39Å; L490-S494 PolarHBondContact O-OG 3.35Å; L490-C513 HydrophobicContact CD2-CB 3.66Å
491	I	96.9	Very high	94.9	Very high	59 Å²	59	37.2 Å²	37.2	30%	0.303	21%	0.21	S	C	.	.	H	α-helix	trans	-58.3	-51	174.1	-71.4	162.6	0	0	0	109.8	V406 A487 F488 G493 S494 I495	V406-I491 HydrophobicContact CG2-CG2 3.82Å; A487-I491 WeakPolarHBondContact O-CB 3.43Å; A487-I491 WeakPolarHBondContact O-CD1 3.4Å; A487-I491 WeakPolarHBondContact O-CG1 3.26Å; A487-I491 PolarHBondContact O-N 3.18Å; F488-I491 PolarHBondContact O-N 3.13Å; I491-G493 PolarHBondContact O-N 3.46Å; I491-S494 PolarHBondContact O-N 3.11Å; I491-S494 PolarHBondContact O-OG 3.17Å; I491-I495 HydrophobicContact CG2-CD1 4.11Å; I491-I495 PolarHBondContact O-N 2.86Å
492	F	97.3	Very high	95	Very high	1 Å²	1	36 Å²	36	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-55.6	-50.4	178.5	174.9	-93.5	0	0	0	111.8	A409 F412 T436 N439 F488 I495 L496	A409-F492 HydrophobicContact CB-CD2 3.69Å; A409-F492 HydrophobicContact CB-CE2 4.09Å; A409-F492 HydrophobicContact CB-CG 4.37Å; F412-F492 AromaticContact CD2-CE2 3.89Å; F412-F492 HydrophobicContact CD2-CE2 3.89Å; F412-F492 AromaticContact CD2-CZ 3.9Å; F412-F492 HydrophobicContact CD2-CZ 3.9Å; F412-F492 HydrophobicContact CE2-CE2 4.3Å; F412-F492 HydrophobicContact CE2-CZ 4.42Å; T436-F492 HydrophobicContact CG2-CE1 3.79Å; N439-F492 VanDerWaalsContact ND2-CE2 3.31Å; N439-F492 WeakPolarHBondContact ND2-CE2 3.37Å; F488-F492 WeakPolarHBondContact O-CB 3.15Å; F488-F492 PolarHBondContact O-N 3.31Å; F492-I495 PolarHBondContact O-N 3.36Å; F492-L496 HydrophobicContact CD1-CD2 4.39Å; F492-L496 HydrophobicContact CE1-CB 4.48Å; F492-L496 HydrophobicContact CE1-CD2 3.44Å; F492-L496 VanDerWaalsContact CE1-CD2 3.44Å; F492-L496 HydrophobicContact CE2-CD2 4.41Å; F492-L496 HydrophobicContact CZ-CD2 3.47Å; F492-L496 VanDerWaalsContact CZ-CD2 3.47Å; F492-L496 VanDerWaalsContact O-CB 3.3Å; F492-L496 WeakPolarHBondContact O-CB 3.47Å; F492-L496 PolarHBondContact O-N 3.41Å
493	G	96.1	Very high	94.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.6	-37.5	-179.7	0	0	0	0	0	113.7	P489 L490 I491 I495 L496 Y497	P489-G493 PolarHBondContact O-N 2.84Å; L490-G493 PolarHBondContact O-N 3.13Å; I491-G493 PolarHBondContact O-N 3.46Å; G493-I495 PolarHBondContact O-N 3.42Å; G493-L496 PolarHBondContact O-N 3.48Å; G493-Y497 WeakPolarHBondContact O-CB 3.27Å; G493-Y497 PolarHBondContact O-N 3.38Å
494	S	96.1	Very high	94.5	Very high	57 Å²	57	37.2 Å²	37.2	40%	0.399	21%	0.213	S	C	.	.	H	α-helix	trans	-63.8	-27.9	178.9	69.8	0	0	0	0	113.7	L490 I491 P498	L490-S494 VanDerWaalsContact O-CB 3.25Å; L490-S494 WeakPolarHBondContact O-CB 3.32Å; L490-S494 PolarHBondContact O-N 3.39Å; L490-S494 PolarHBondContact O-OG 3.35Å; I491-S494 PolarHBondContact O-N 3.11Å; I491-S494 PolarHBondContact O-OG 3.17Å; S494-P498 WeakPolarHBondContact O-CD 3.35Å; S494-P498 WeakPolarHBondContact O-CG 3.46Å
495	I	96.9	Very high	94.6	Very high	47 Å²	47	38.8 Å²	38.8	24%	0.241	23%	0.225	C	C	.	.	H	α-helix	trans	-88.3	-49.9	176.2	-66.4	161.7	0	0	0	110.3	V406 A409 I410 I491 F492 G493 Y497 P498 M499	V406-I495 HydrophobicContact CB-CD1 4.4Å; V406-I495 HydrophobicContact CG1-CD1 4.26Å; V406-I495 HydrophobicContact CG2-CD1 3.97Å; A409-I495 HydrophobicContact CB-CB 3.8Å; A409-I495 HydrophobicContact CB-CD1 4.43Å; A409-I495 HydrophobicContact CB-CG2 3.73Å; I410-I495 HydrophobicContact CG1-CG2 4.42Å; I491-I495 HydrophobicContact CG2-CD1 4.11Å; I491-I495 PolarHBondContact O-N 2.86Å; F492-I495 PolarHBondContact O-N 3.36Å; G493-I495 PolarHBondContact O-N 3.42Å; I495-Y497 PolarHBondContact O-N 3.07Å; I495-P498 WeakPolarHBondContact O-CD 3.15Å; I495-P498 WeakPolarHBondContact O-CG 3.34Å; I495-M499 HydrophobicContact CG2-SD 3.57Å; I495-M499 VanDerWaalsContact CG2-SD 3.57Å; I495-M499 VanDerWaalsContact O-CG 3.3Å; I495-M499 WeakPolarHBondContact O-CG 3.27Å; I495-M499 PolarHBondContact O-N 3.2Å
496	L	97	Very high	94.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.4	-43.4	-173.1	-175.1	65	0	0	0	112.9	A409 F412 G413 L432 T436 F492 G493 M499 S500	A409-L496 HydrophobicContact CB-CB 4.48Å; F412-L496 HydrophobicContact CB-CD1 3.78Å; G413-L496 VanDerWaalsContact N-CD1 3.29Å; L432-L496 HydrophobicContact CD1-CD1 3.84Å; L432-L496 HydrophobicContact CD1-CD2 3.92Å; L432-L496 HydrophobicContact CD1-CG 4.14Å; T436-L496 WeakPolarHBondContact OG1-CD2 3.42Å; F492-L496 HydrophobicContact CD1-CD2 4.39Å; F492-L496 HydrophobicContact CE1-CB 4.48Å; F492-L496 HydrophobicContact CE1-CD2 3.44Å; F492-L496 VanDerWaalsContact CE1-CD2 3.44Å; F492-L496 HydrophobicContact CE2-CD2 4.41Å; F492-L496 HydrophobicContact CZ-CD2 3.47Å; F492-L496 VanDerWaalsContact CZ-CD2 3.47Å; F492-L496 VanDerWaalsContact O-CB 3.3Å; F492-L496 WeakPolarHBondContact O-CB 3.47Å; F492-L496 PolarHBondContact O-N 3.41Å; G493-L496 PolarHBondContact O-N 3.48Å; L496-M499 PolarHBondContact O-N 3.3Å; L496-S500 WeakPolarHBondContact O-CB 3.45Å; L496-S500 PolarHBondContact O-N 3.33Å; L496-S500 VanDerWaalsContact O-N 3.09Å; L496-S500 PolarHBondContact O-OG 3.5Å
497	Y	96.4	Very high	94.6	Very high	14 Å²	14	48.3 Å²	48.3	6%	0.055	27%	0.268	C	S	.	.	H	α-helix	trans	-60.6	-49.7	-172.9	-164.6	-89.5	0	0	0	113.4	G493 I495 S500 K501 L502 H503 R508 F509 F512	G493-Y497 WeakPolarHBondContact O-CB 3.27Å; G493-Y497 PolarHBondContact O-N 3.38Å; I495-Y497 PolarHBondContact O-N 3.07Å; Y497-S500 PolarHBondContact O-OG 2.9Å; Y497-K501 PolarHBondContact O-N 3.25Å; Y497-L502 HydrophobicContact CD1-CB 4.35Å; Y497-L502 HydrophobicContact CD2-CB 3.93Å; Y497-L502 HydrophobicContact CD2-CD1 3.46Å; Y497-L502 VanDerWaalsContact CD2-CD1 3.46Å; Y497-L502 HydrophobicContact CD2-CG 4.33Å; Y497-L502 HydrophobicContact CE1-CB 4.09Å; Y497-L502 HydrophobicContact CE2-CB 3.61Å; Y497-L502 HydrophobicContact CE2-CD1 3.7Å; Y497-L502 HydrophobicContact CE2-CG 4.31Å; Y497-L502 HydrophobicContact CG-CB 4.27Å; Y497-L502 HydrophobicContact CG-CD1 4.2Å; Y497-H503 VanDerWaalsContact CE1-O 3.31Å; Y497-H503 WeakPolarHBondContact CE1-O 3.46Å; Y497-H503 PolarHBondContact OH-O 2.89Å; Y497-R508 VanDerWaalsContact OH-CB 3.3Å; Y497-R508 WeakPolarHBondContact OH-CB 3.3Å; Y497-F509 HydrophobicContact CD1-CB 4.09Å; Y497-F509 AromaticContact CD1-CD2 3.63Å; Y497-F509 HydrophobicContact CD1-CD2 3.63Å; Y497-F509 HydrophobicContact CD1-CG 4.3Å; Y497-F509 HydrophobicContact CD2-CD2 4.26Å; Y497-F509 HydrophobicContact CE1-CB 3.79Å; Y497-F509 HydrophobicContact CE1-CD2 4.2Å; Y497-F509 HydrophobicContact CE1-CG 4.48Å; Y497-F509 AromaticContact CG-CD2 3.67Å; Y497-F509 HydrophobicContact CG-CD2 3.67Å; Y497-F509 HydrophobicContact CG-CE2 4.37Å; Y497-F509 PolarHBondContact OH-N 3.25Å; Y497-F512 HydrophobicContact CD2-CB 3.98Å; Y497-F512 AromaticContact CD2-CD1 3.77Å; Y497-F512 HydrophobicContact CD2-CD1 3.77Å; Y497-F512 AromaticContact CD2-CD2 3.84Å; Y497-F512 HydrophobicContact CD2-CD2 3.84Å; Y497-F512 HydrophobicContact CD2-CE1 4.2Å; Y497-F512 HydrophobicContact CD2-CE2 4.25Å; Y497-F512 AromaticContact CD2-CG 3.59Å; Y497-F512 HydrophobicContact CD2-CG 3.59Å; Y497-F512 HydrophobicContact CD2-CZ 4.41Å; Y497-F512 HydrophobicContact CE2-CB 3.76Å; Y497-F512 HydrophobicContact CE2-CD1 4.42Å; Y497-F512 AromaticContact CE2-CD2 3.96Å; Y497-F512 HydrophobicContact CE2-CD2 3.96Å; Y497-F512 AromaticContact CE2-CG 3.81Å; Y497-F512 HydrophobicContact CE2-CG 3.81Å
498	P	95	Very high	94.6	Very high	83 Å²	83	48.4 Å²	48.4	54%	0.539	26%	0.26	S	S	.	.	H	α-helix	trans	-70.9	-36.8	175.9	26.6	-34.5	0	0	0	113.5	S494 I495 S500 K501	S494-P498 WeakPolarHBondContact O-CD 3.35Å; S494-P498 WeakPolarHBondContact O-CG 3.46Å; I495-P498 WeakPolarHBondContact O-CD 3.15Å; I495-P498 WeakPolarHBondContact O-CG 3.34Å; P498-S500 VanDerWaalsContact C-N 3.27Å; P498-S500 PolarHBondContact O-N 3.04Å; P498-K501 PolarHBondContact O-N 3.48Å
499	M	95.8	Very high	94.7	Very high	37 Å²	37	50.3 Å²	50.3	18%	0.182	27%	0.269	C	S	.	.	H	α-helix	trans	-60.2	-39	179.1	-75.7	178.5	75.5	0	0	112.3	W417 R418 I495 L496	W417-M499 HydrophobicContact CE3-CB 4.37Å; W417-M499 HydrophobicContact CE3-CE 3.94Å; W417-M499 HydrophobicContact CZ3-CB 4.28Å; W417-M499 HydrophobicContact CZ3-CE 3.62Å; W417-M499 HydrophobicContact CZ3-CG 4.06Å; R418-M499 PolarHBondContact N-O 2.94Å; I495-M499 HydrophobicContact CG2-SD 3.57Å; I495-M499 VanDerWaalsContact CG2-SD 3.57Å; I495-M499 VanDerWaalsContact O-CG 3.3Å; I495-M499 WeakPolarHBondContact O-CG 3.27Å; I495-M499 PolarHBondContact O-N 3.2Å; L496-M499 PolarHBondContact O-N 3.3Å
500	S	94.8	Very high	94.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-7.1	-176.9	55.3	0	0	0	0	114.6	F416 M419 L496 Y497 P498 L502	F416-S500 WeakPolarHBondContact O-CA 3.49Å; M419-S500 PolarHBondContact N-O 3.04Å; L496-S500 WeakPolarHBondContact O-CB 3.45Å; L496-S500 PolarHBondContact O-N 3.33Å; L496-S500 VanDerWaalsContact O-N 3.09Å; L496-S500 PolarHBondContact O-OG 3.5Å; Y497-S500 PolarHBondContact O-OG 2.9Å; P498-S500 VanDerWaalsContact C-N 3.27Å; P498-S500 PolarHBondContact O-N 3.04Å; S500-L502 VanDerWaalsContact C-N 3.31Å; S500-L502 PolarHBondContact O-N 2.81Å; S500-L502 WeakPolarHBondContact OG-CG 3.32Å
501	K	93.8	Very high	94.6	Very high	133 Å²	133	52.9 Å²	52.9	58%	0.578	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	45.6	-178.1	-160.7	-176.1	179.1	-176.2	0	112.4	R418 R429 Y497 P498	R418-K501 HydrophobicContact CB-CB 4.39Å; R418-K501 HydrophobicContact CB-CD 4.39Å; R418-K501 HydrophobicContact CG-CB 4.49Å; R429-K501 PolarHBondContact NH1-O 3.04Å; Y497-K501 PolarHBondContact O-N 3.25Å; P498-K501 PolarHBondContact O-N 3.48Å
502	L	92.7	Very high	94.6	Very high	7 Å²	7	50.1 Å²	50.1	4%	0.037	27%	0.271	C	S	.	.			trans	-65.3	176.2	166.4	-68.2	173.3	0	0	0	110.8	M419 L432 L433 Y497 S500 F512 E588	M419-L502 HydrophobicContact CE-CD2 3.88Å; L432-L502 HydrophobicContact CD2-CD1 4.25Å; L432-L502 HydrophobicContact CD2-CD2 4.27Å; L432-L502 HydrophobicContact CD2-CG 4.4Å; L433-L502 HydrophobicContact CD2-CD1 4.46Å; Y497-L502 HydrophobicContact CD1-CB 4.35Å; Y497-L502 HydrophobicContact CD2-CB 3.93Å; Y497-L502 HydrophobicContact CD2-CD1 3.46Å; Y497-L502 VanDerWaalsContact CD2-CD1 3.46Å; Y497-L502 HydrophobicContact CD2-CG 4.33Å; Y497-L502 HydrophobicContact CE1-CB 4.09Å; Y497-L502 HydrophobicContact CE2-CB 3.61Å; Y497-L502 HydrophobicContact CE2-CD1 3.7Å; Y497-L502 HydrophobicContact CE2-CG 4.31Å; Y497-L502 HydrophobicContact CG-CB 4.27Å; Y497-L502 HydrophobicContact CG-CD1 4.2Å; S500-L502 VanDerWaalsContact C-N 3.31Å; S500-L502 PolarHBondContact O-N 2.81Å; S500-L502 WeakPolarHBondContact OG-CG 3.32Å; L502-F512 HydrophobicContact CD1-CD2 4.44Å; L502-F512 HydrophobicContact CD1-CE2 4.15Å; L502-E588 WeakPolarHBondContact CB-OE2 3.41Å; L502-E588 HydrophobicContact CD2-CG 3.83Å; L502-E588 WeakPolarHBondContact CD2-OE1 3.29Å
503	H	90.1	Very high	94.6	Very high	35 Å²	35	50.4 Å²	50.4	16%	0.162	27%	0.273	C	S	.	.			trans	-50.8	122.5	-172.9	-162.9	-65.1	0	0	0	112.9	Y497 T505 R508 E588	Y497-H503 VanDerWaalsContact CE1-O 3.31Å; Y497-H503 WeakPolarHBondContact CE1-O 3.46Å; Y497-H503 PolarHBondContact OH-O 2.89Å; H503-T505 PolarHBondContact CE1-OG1 3.07Å; H503-T505 PolarHBondContact ND1-OG1 3.27Å; H503-T505 PolarHBondContact O-N 3.47Å; H503-R508 HydrophobicContact CB-CB 4.16Å; H503-R508 HydrophobicContact CB-CG 4.16Å; H503-E588 PolarHBondContact N-OE1 2.68Å; H503-E588 PolarHBondContact N-OE2 2.94Å; H503-E588 VanDerWaalsContact N-OE2 3.14Å
504	P	85.9	Confident	94.6	Very high	123 Å²	123	51.9 Å²	51.9	80%	0.799	29%	0.288	S	S	*	.			trans	-73.5	-2	-162.5	27.4	-36.7	0	0	0	115.9
505	T	92.7	Very high	94.6	Very high	64 Å²	64	49.2 Å²	49.2	39%	0.393	27%	0.269	S	S	.	.			trans	-86.3	136.7	-171.9	52.9	0	0	0	0	111.5	H503 S507 R508 F509	H503-T505 PolarHBondContact CE1-OG1 3.07Å; H503-T505 PolarHBondContact ND1-OG1 3.27Å; H503-T505 PolarHBondContact O-N 3.47Å; T505-S507 PolarHBondContact O-N 2.88Å; T505-S507 VanDerWaalsContact O-N 3.16Å; T505-R508 WeakPolarHBondContact O-CB 3.26Å; T505-R508 PolarHBondContact O-N 3.49Å; T505-R508 WeakPolarHBondContact OG1-CG 3.32Å; T505-F509 PolarHBondContact O-N 2.5Å; T505-F509 VanDerWaalsContact O-N 3.16Å
506	F	92.7	Very high	94.6	Very high	162 Å²	162	47 Å²	47	71%	0.711	26%	0.258	S	S	*	.	H	α-helix	trans	-55.8	-36.7	-179.3	-178.9	-102.3	0	0	0	113.1	R508 F509 A510	F506-R508 VanDerWaalsContact C-N 3.27Å; F506-R508 PolarHBondContact O-N 3.46Å; F506-F509 HydrophobicContact CD2-CD1 4.16Å; F506-F509 HydrophobicContact CE2-CD1 4.1Å; F506-F509 PolarHBondContact O-N 3.04Å; F506-A510 HydrophobicContact CE1-CB 4.49Å; F506-A510 WeakPolarHBondContact O-CB 3.47Å; F506-A510 PolarHBondContact O-N 3.33Å
507	S	94.4	Very high	94.5	Very high	65 Å²	65	47.8 Å²	47.8	46%	0.455	26%	0.263	S	S	.	.	H	α-helix	trans	-59.1	-37.1	175.8	-175	0	0	0	0	112.7	T505 K511	T505-S507 PolarHBondContact O-N 2.88Å; T505-S507 VanDerWaalsContact O-N 3.16Å; S507-K511 WeakPolarHBondContact O-CD 3.43Å; S507-K511 VanDerWaalsContact O-CG 3.26Å; S507-K511 WeakPolarHBondContact O-CG 3.46Å; S507-K511 PolarHBondContact O-N 2.86Å; S507-K511 VanDerWaalsContact O-N 3.12Å; S507-K511 PolarHBondContact OG-NZ 2.83Å
508	R	94.4	Very high	94.5	Very high	38 Å²	38	49 Å²	49	14%	0.143	27%	0.272	C	S	.	.	H	α-helix	trans	-75.6	-39.7	179.5	-62.5	-71.5	-165.7	160.5	5.4	111.1	Y497 H503 T505 F506 K511 F512 N587 K590	Y497-R508 VanDerWaalsContact OH-CB 3.3Å; Y497-R508 WeakPolarHBondContact OH-CB 3.3Å; H503-R508 HydrophobicContact CB-CB 4.16Å; H503-R508 HydrophobicContact CB-CG 4.16Å; T505-R508 WeakPolarHBondContact O-CB 3.26Å; T505-R508 PolarHBondContact O-N 3.49Å; T505-R508 WeakPolarHBondContact OG1-CG 3.32Å; F506-R508 VanDerWaalsContact C-N 3.27Å; F506-R508 PolarHBondContact O-N 3.46Å; R508-K511 PolarHBondContact O-N 2.86Å; R508-F512 WeakPolarHBondContact O-CB 3.44Å; R508-F512 PolarHBondContact O-N 3.48Å; R508-N587 VanDerWaalsContact CD-O 3.25Å; R508-N587 WeakPolarHBondContact CD-O 3.17Å; R508-N587 WeakPolarHBondContact CD-OD1 3.34Å; R508-N587 PolarHBondContact NH1-O 3.16Å; R508-N587 PolarHBondContact O-ND2 3.18Å; R508-K590 PolarHBondContact NH2-O 3.35Å
509	F	96.2	Very high	94.5	Very high	53 Å²	53	45.1 Å²	45.1	23%	0.232	25%	0.246	C	C	.	.	H	α-helix	trans	-58.4	-49.7	171	172	-109.8	0	0	0	112	Y497 T505 F506 K511 F512 C513	Y497-F509 HydrophobicContact CD1-CB 4.09Å; Y497-F509 AromaticContact CD1-CD2 3.63Å; Y497-F509 HydrophobicContact CD1-CD2 3.63Å; Y497-F509 HydrophobicContact CD1-CG 4.3Å; Y497-F509 HydrophobicContact CD2-CD2 4.26Å; Y497-F509 HydrophobicContact CE1-CB 3.79Å; Y497-F509 HydrophobicContact CE1-CD2 4.2Å; Y497-F509 HydrophobicContact CE1-CG 4.48Å; Y497-F509 AromaticContact CG-CD2 3.67Å; Y497-F509 HydrophobicContact CG-CD2 3.67Å; Y497-F509 HydrophobicContact CG-CE2 4.37Å; Y497-F509 PolarHBondContact OH-N 3.25Å; T505-F509 PolarHBondContact O-N 2.5Å; T505-F509 VanDerWaalsContact O-N 3.16Å; F506-F509 HydrophobicContact CD2-CD1 4.16Å; F506-F509 HydrophobicContact CE2-CD1 4.1Å; F506-F509 PolarHBondContact O-N 3.04Å; F509-K511 VanDerWaalsContact C-N 3.32Å; F509-K511 PolarHBondContact O-N 2.84Å; F509-F512 WeakPolarHBondContact O-CB 3.13Å; F509-F512 PolarHBondContact O-N 2.89Å; F509-F512 VanDerWaalsContact O-N 3.16Å; F509-C513 WeakPolarHBondContact CE2-SG 3.34Å; F509-C513 VanDerWaalsContact CZ-SG 3.58Å; F509-C513 PolarHBondContact O-N 2.84Å
510	A	95.9	Very high	94.6	Very high	46 Å²	46	43.5 Å²	43.5	38%	0.38	24%	0.238	S	C	.	.	H	α-helix	trans	-60.6	-40.9	179.2	0	0	0	0	0	112.1	F506 G514	F506-A510 HydrophobicContact CE1-CB 4.49Å; F506-A510 WeakPolarHBondContact O-CB 3.47Å; F506-A510 PolarHBondContact O-N 3.33Å; A510-G514 PolarHBondContact O-N 2.87Å
511	K	95.7	Very high	94.6	Very high	86 Å²	86	44.9 Å²	44.9	37%	0.374	25%	0.245	S	C	.	.	H	α-helix	trans	-65.1	-42.7	174.6	-74.2	168.3	-174.7	167.9	0	112.3	S507 R508 F509 G514 I515 N587 I619	S507-K511 WeakPolarHBondContact O-CD 3.43Å; S507-K511 VanDerWaalsContact O-CG 3.26Å; S507-K511 WeakPolarHBondContact O-CG 3.46Å; S507-K511 PolarHBondContact O-N 2.86Å; S507-K511 VanDerWaalsContact O-N 3.12Å; S507-K511 PolarHBondContact OG-NZ 2.83Å; R508-K511 PolarHBondContact O-N 2.86Å; F509-K511 VanDerWaalsContact C-N 3.32Å; F509-K511 PolarHBondContact O-N 2.84Å; K511-G514 PolarHBondContact O-N 2.92Å; K511-I515 WeakPolarHBondContact O-CD1 3.31Å; K511-I515 WeakPolarHBondContact O-CG1 3.44Å; K511-I515 PolarHBondContact O-N 3.09Å; K511-N587 WeakPolarHBondContact CB-OD1 3.48Å; K511-N587 WeakPolarHBondContact CD-OD1 3.39Å; K511-I619 HydrophobicContact CD-CD1 4.09Å
512	F	97.1	Very high	94.7	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.009	22%	0.218	C	C	.	.	H	α-helix	trans	-56.8	-54.4	175.1	174	-84.6	0	0	0	110.6	L433 T436 Y497 L502 R508 F509 G514 I515 V516 L584	L433-F512 HydrophobicContact CD2-CD2 4.38Å; L433-F512 HydrophobicContact CD2-CE2 3.93Å; T436-F512 HydrophobicContact CG2-CE2 4.19Å; T436-F512 HydrophobicContact CG2-CZ 3.76Å; Y497-F512 HydrophobicContact CD2-CB 3.98Å; Y497-F512 AromaticContact CD2-CD1 3.77Å; Y497-F512 HydrophobicContact CD2-CD1 3.77Å; Y497-F512 AromaticContact CD2-CD2 3.84Å; Y497-F512 HydrophobicContact CD2-CD2 3.84Å; Y497-F512 HydrophobicContact CD2-CE1 4.2Å; Y497-F512 HydrophobicContact CD2-CE2 4.25Å; Y497-F512 AromaticContact CD2-CG 3.59Å; Y497-F512 HydrophobicContact CD2-CG 3.59Å; Y497-F512 HydrophobicContact CD2-CZ 4.41Å; Y497-F512 HydrophobicContact CE2-CB 3.76Å; Y497-F512 HydrophobicContact CE2-CD1 4.42Å; Y497-F512 AromaticContact CE2-CD2 3.96Å; Y497-F512 HydrophobicContact CE2-CD2 3.96Å; Y497-F512 AromaticContact CE2-CG 3.81Å; Y497-F512 HydrophobicContact CE2-CG 3.81Å; L502-F512 HydrophobicContact CD1-CD2 4.44Å; L502-F512 HydrophobicContact CD1-CE2 4.15Å; R508-F512 WeakPolarHBondContact O-CB 3.44Å; R508-F512 PolarHBondContact O-N 3.48Å; F509-F512 WeakPolarHBondContact O-CB 3.13Å; F509-F512 PolarHBondContact O-N 2.89Å; F509-F512 VanDerWaalsContact O-N 3.16Å; F512-G514 VanDerWaalsContact C-N 3.31Å; F512-G514 PolarHBondContact O-N 3.43Å; F512-I515 PolarHBondContact O-N 3.49Å; F512-V516 HydrophobicContact CD1-CG2 4.48Å; F512-V516 HydrophobicContact CE1-CG2 4.24Å; F512-V516 HydrophobicContact CZ-CG2 4.33Å; F512-V516 VanDerWaalsContact O-CG2 3.31Å; F512-V516 WeakPolarHBondContact O-CG2 3.45Å; F512-V516 PolarHBondContact O-N 3.49Å; F512-V516 VanDerWaalsContact O-N 3.1Å; F512-L584 HydrophobicContact CB-CD2 4.48Å; F512-L584 HydrophobicContact CD2-CD2 3.39Å; F512-L584 HydrophobicContact CE2-CD2 3.79Å; F512-L584 HydrophobicContact CG-CD2 4.08Å
513	C	96.6	Very high	94.8	Very high	7 Å²	7	38.3 Å²	38.3	5%	0.047	22%	0.216	C	C	.	.	H	α-helix	trans	-59	-40.8	177.5	-79.5	0	0	0	0	112.5	L490 F509 T517	L490-C513 HydrophobicContact CD2-CB 3.66Å; F509-C513 WeakPolarHBondContact CE2-SG 3.34Å; F509-C513 VanDerWaalsContact CZ-SG 3.58Å; F509-C513 PolarHBondContact O-N 2.84Å; C513-T517 VanDerWaalsContact O-CB 3.25Å; C513-T517 WeakPolarHBondContact O-CB 3.07Å; C513-T517 PolarHBondContact O-N 3.1Å; C513-T517 PolarHBondContact O-OG1 2.89Å
514	G	95.9	Very high	95.1	Very high	30 Å²	30	37.2 Å²	37.2	31%	0.309	21%	0.212	S	C	.	.	H	α-helix	trans	-61.5	-49	176.5	0	0	0	0	0	113	A510 K511 F512 V516 T517 V518	A510-G514 PolarHBondContact O-N 2.87Å; K511-G514 PolarHBondContact O-N 2.92Å; F512-G514 VanDerWaalsContact C-N 3.31Å; F512-G514 PolarHBondContact O-N 3.43Å; G514-V516 PolarHBondContact O-N 3Å; G514-T517 PolarHBondContact O-N 3.16Å; G514-V518 WeakPolarHBondContact O-CG2 3.34Å; G514-V518 PolarHBondContact O-N 3.32Å
515	I	96.5	Very high	95.5	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-61.2	-47.1	-179.8	-67.4	160.8	0	0	0	110.9	K511 F512 T517 V518 E519 A580 L584 N587 I619 L623	K511-I515 WeakPolarHBondContact O-CD1 3.31Å; K511-I515 WeakPolarHBondContact O-CG1 3.44Å; K511-I515 PolarHBondContact O-N 3.09Å; F512-I515 PolarHBondContact O-N 3.49Å; I515-T517 VanDerWaalsContact C-N 3.29Å; I515-T517 PolarHBondContact O-N 3.35Å; I515-V518 PolarHBondContact O-N 2.77Å; I515-E519 WeakPolarHBondContact O-CB 3.45Å; I515-E519 PolarHBondContact O-N 3.12Å; I515-A580 HydrophobicContact CG2-CB 4.37Å; I515-L584 HydrophobicContact CB-CD2 4.29Å; I515-L584 HydrophobicContact CD1-CD2 4.46Å; I515-L584 HydrophobicContact CG2-CD2 4.17Å; I515-L584 HydrophobicContact CG2-CG 4.03Å; I515-N587 HydrophobicContact CD1-CB 4.44Å; I515-I619 HydrophobicContact CD1-CG2 4.1Å; I515-L623 HydrophobicContact CG1-CD2 3.96Å
516	V	96.4	Very high	95.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65.2	-35.8	179.5	177.5	0	0	0	0	110.9	T436 T440 P489 F512 G514 S520 L584	T436-V516 HydrophobicContact CG2-CG2 3.81Å; T440-V516 HydrophobicContact CG2-CG1 3.46Å; T440-V516 VanDerWaalsContact CG2-CG1 3.46Å; T440-V516 VanDerWaalsContact OG1-CG1 3.24Å; T440-V516 WeakPolarHBondContact OG1-CG1 3.26Å; P489-V516 HydrophobicContact CB-CG1 3.78Å; F512-V516 HydrophobicContact CD1-CG2 4.48Å; F512-V516 HydrophobicContact CE1-CG2 4.24Å; F512-V516 HydrophobicContact CZ-CG2 4.33Å; F512-V516 VanDerWaalsContact O-CG2 3.31Å; F512-V516 WeakPolarHBondContact O-CG2 3.45Å; F512-V516 PolarHBondContact O-N 3.49Å; F512-V516 VanDerWaalsContact O-N 3.1Å; G514-V516 PolarHBondContact O-N 3Å; V516-S520 WeakPolarHBondContact O-CB 3.34Å; V516-S520 PolarHBondContact O-N 2.92Å; V516-L584 HydrophobicContact CG2-CD1 4.3Å; V516-L584 HydrophobicContact CG2-CD2 4.03Å
517	T	96.2	Very high	95.8	Very high	17 Å²	17	20.6 Å²	20.6	10%	0.104	12%	0.122	C	C	.	.	H	α-helix	trans	-68.9	-44.1	176.9	-59.9	0	0	0	0	112.1	A486 P489 C513 G514 I515 E519 S520 F521	A486-T517 HydrophobicContact CB-CG2 3.75Å; P489-T517 HydrophobicContact CG-CG2 4.46Å; C513-T517 VanDerWaalsContact O-CB 3.25Å; C513-T517 WeakPolarHBondContact O-CB 3.07Å; C513-T517 PolarHBondContact O-N 3.1Å; C513-T517 PolarHBondContact O-OG1 2.89Å; G514-T517 PolarHBondContact O-N 3.16Å; I515-T517 VanDerWaalsContact C-N 3.29Å; I515-T517 PolarHBondContact O-N 3.35Å; T517-E519 VanDerWaalsContact C-N 3.33Å; T517-E519 PolarHBondContact O-N 3.32Å; T517-S520 WeakPolarHBondContact O-CB 3.46Å; T517-S520 PolarHBondContact O-N 2.95Å; T517-F521 HydrophobicContact CG2-CD2 4.09Å; T517-F521 HydrophobicContact CG2-CE2 3.52Å; T517-F521 HydrophobicContact CG2-CZ 4.17Å; T517-F521 VanDerWaalsContact O-CD2 3.23Å; T517-F521 WeakPolarHBondContact O-CD2 3.36Å; T517-F521 PolarHBondContact O-N 2.8Å; T517-F521 VanDerWaalsContact O-N 3.13Å
518	V	95.8	Very high	95.8	Very high	41 Å²	41	17.7 Å²	17.7	25%	0.248	10%	0.101	C	C	.	.	H	α-helix	trans	-65.3	-39	176.8	177	0	0	0	0	110.9	G514 I515 F521 A522 L623 Q626	G514-V518 WeakPolarHBondContact O-CG2 3.34Å; G514-V518 PolarHBondContact O-N 3.32Å; I515-V518 PolarHBondContact O-N 2.77Å; V518-F521 PolarHBondContact O-N 3.42Å; V518-A522 PolarHBondContact O-N 3.5Å; V518-L623 HydrophobicContact CG2-CD2 4.37Å; V518-Q626 HydrophobicContact CG1-CB 3.69Å
519	E	95.8	Very high	95.8	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-59.6	-47	172.8	-179.5	-179.9	-150.4	0	0	112.1	A437 A441 I515 T517 F521 A522 A523 L576 A580	A437-E519 VanDerWaalsContact CA-OE2 3.28Å; A437-E519 WeakPolarHBondContact CA-OE2 3.47Å; A437-E519 WeakPolarHBondContact CB-OE1 3.49Å; A441-E519 HydrophobicContact CB-CG 4.25Å; I515-E519 WeakPolarHBondContact O-CB 3.45Å; I515-E519 PolarHBondContact O-N 3.12Å; T517-E519 VanDerWaalsContact C-N 3.33Å; T517-E519 PolarHBondContact O-N 3.32Å; E519-F521 VanDerWaalsContact C-N 3.27Å; E519-F521 PolarHBondContact O-N 3.48Å; E519-A522 WeakPolarHBondContact O-CB 3.32Å; E519-A522 PolarHBondContact O-N 3.44Å; E519-A523 PolarHBondContact O-N 3.06Å; E519-L576 HydrophobicContact CG-CD1 3.98Å; E519-A580 HydrophobicContact CB-CB 3.98Å; E519-A580 HydrophobicContact CG-CB 3.84Å; E519-A580 WeakPolarHBondContact OE1-CB 3.49Å; E519-A580 WeakPolarHBondContact OE2-CB 3.31Å
520	S	96.1	Very high	95.7	Very high	3 Å²	3	13.6 Å²	13.6	2%	0.021	8%	0.084	C	C	.	.	H	α-helix	trans	-53	-47.1	175.9	-177.5	0	0	0	0	111	A444 V516 T517 A522 A523 S524	A444-S520 VanDerWaalsContact CB-O 3.23Å; A444-S520 WeakPolarHBondContact CB-O 3.39Å; V516-S520 WeakPolarHBondContact O-CB 3.34Å; V516-S520 PolarHBondContact O-N 2.92Å; T517-S520 WeakPolarHBondContact O-CB 3.46Å; T517-S520 PolarHBondContact O-N 2.95Å; S520-A522 PolarHBondContact O-N 3.36Å; S520-A523 PolarHBondContact O-N 2.81Å; S520-S524 PolarHBondContact O-N 3.29Å
521	F	95.8	Very high	95.6	Very high	30 Å²	30	11.4 Å²	11.4	13%	0.132	7%	0.066	C	C	.	.	H	α-helix	trans	-65.2	-37.8	176.8	-66.7	-49.1	0	0	0	113.1	I482 A486 T517 V518 E519 S524 A525 L630	I482-F521 HydrophobicContact CB-CZ 4.15Å; I482-F521 HydrophobicContact CG1-CE1 4.32Å; I482-F521 HydrophobicContact CG1-CZ 4.15Å; I482-F521 HydrophobicContact CG2-CE2 4.43Å; I482-F521 HydrophobicContact CG2-CZ 3.96Å; I482-F521 WeakPolarHBondContact O-CZ 3.35Å; A486-F521 HydrophobicContact CB-CZ 4.02Å; T517-F521 HydrophobicContact CG2-CD2 4.09Å; T517-F521 HydrophobicContact CG2-CE2 3.52Å; T517-F521 HydrophobicContact CG2-CZ 4.17Å; T517-F521 VanDerWaalsContact O-CD2 3.23Å; T517-F521 WeakPolarHBondContact O-CD2 3.36Å; T517-F521 PolarHBondContact O-N 2.8Å; T517-F521 VanDerWaalsContact O-N 3.13Å; V518-F521 PolarHBondContact O-N 3.42Å; E519-F521 VanDerWaalsContact C-N 3.27Å; E519-F521 PolarHBondContact O-N 3.48Å; F521-S524 PolarHBondContact O-N 2.98Å; F521-A525 PolarHBondContact O-N 3.19Å; F521-L630 HydrophobicContact CB-CD1 3.78Å; F521-L630 WeakPolarHBondContact O-CD1 3.32Å
522	A	95.4	Very high	95.4	Very high	1 Å²	1	7.3 Å²	7.3	1%	0.008	5%	0.048	C	C	.	.	H	α-helix	trans	-65.6	-40.8	177.7	0	0	0	0	0	111.5	V518 E519 S520 A525 M526 L576 L630	V518-A522 PolarHBondContact O-N 3.5Å; E519-A522 WeakPolarHBondContact O-CB 3.32Å; E519-A522 PolarHBondContact O-N 3.44Å; S520-A522 PolarHBondContact O-N 3.36Å; A522-A525 PolarHBondContact O-N 2.86Å; A522-M526 PolarHBondContact O-N 3.18Å; A522-L576 HydrophobicContact CB-CB 4.47Å; A522-L630 VanDerWaalsContact CA-CD1 3.5Å; A522-L630 HydrophobicContact CB-CB 4.35Å; A522-L630 HydrophobicContact CB-CD1 4.24Å
523	A	96	Very high	95.1	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-67.5	-37.7	174.6	0	0	0	0	0	112.5	A441 A444 E519 S520 M526 G527 M548 L576	A441-A523 HydrophobicContact CB-CB 4.03Å; A441-A523 VanDerWaalsContact O-CB 3.26Å; A441-A523 WeakPolarHBondContact O-CB 3.38Å; A444-A523 HydrophobicContact CB-CB 4.04Å; E519-A523 PolarHBondContact O-N 3.06Å; S520-A523 PolarHBondContact O-N 2.81Å; A523-M526 WeakPolarHBondContact O-CB 3.15Å; A523-M526 PolarHBondContact O-N 3.2Å; A523-G527 PolarHBondContact O-N 3.49Å; A523-M548 HydrophobicContact CB-CE 4.2Å; A523-L576 HydrophobicContact CB-CD1 4.21Å; A523-L576 HydrophobicContact CB-CD2 4.44Å
524	S	95.2	Very high	94.7	Very high	12 Å²	12	8.3 Å²	8.3	8%	0.084	5%	0.053	C	C	.	.	H	α-helix	trans	-61.4	-44	169.9	-80.7	0	0	0	0	112	A444 T448 S520 F521 M526 G527 L528	A444-S524 PolarHBondContact O-OG 3Å; T448-S524 WeakPolarHBondContact CG2-O 3.35Å; T448-S524 PolarHBondContact OG1-OG 3.41Å; S520-S524 PolarHBondContact O-N 3.29Å; F521-S524 PolarHBondContact O-N 2.98Å; S524-M526 VanDerWaalsContact C-N 3.31Å; S524-M526 PolarHBondContact O-N 3.35Å; S524-G527 CarbonylContact O-C 3.56Å; S524-G527 WeakPolarHBondContact O-CA 3.39Å; S524-G527 PolarHBondContact O-N 2.8Å; S524-L528 PolarHBondContact O-N 3.45Å
525	A	95.4	Very high	94.3	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-62	-39	176.8	0	0	0	0	0	112.3	F521 A522 G527 L528 T529 L630 W633 Y634	F521-A525 PolarHBondContact O-N 3.19Å; A522-A525 PolarHBondContact O-N 2.86Å; A525-G527 VanDerWaalsContact C-N 3.33Å; A525-L528 PolarHBondContact O-N 2.89Å; A525-T529 PolarHBondContact O-N 3.31Å; A525-T529 VanDerWaalsContact O-N 3.09Å; A525-T529 PolarHBondContact O-OG1 2.84Å; A525-L630 HydrophobicContact CB-CD1 3.98Å; A525-W633 HydrophobicContact CB-CB 3.62Å; A525-Y634 HydrophobicContact CB-CD1 4.4Å; A525-Y634 HydrophobicContact CB-CD2 3.91Å; A525-Y634 HydrophobicContact CB-CE1 4.15Å; A525-Y634 HydrophobicContact CB-CE2 3.63Å; A525-Y634 HydrophobicContact CB-CG 4.24Å
526	M	95.3	Very high	94	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-60.6	-44.2	170.7	-174.8	-179.9	79.7	0	0	111.2	L445 A522 A523 S524 L528 T529 V530 L547 M548 F551 L576 W633	L445-M526 HydrophobicContact CD1-CE 3.56Å; L445-M526 HydrophobicContact CD2-CE 3.77Å; L445-M526 HydrophobicContact CG-CE 4.19Å; A522-M526 PolarHBondContact O-N 3.18Å; A523-M526 WeakPolarHBondContact O-CB 3.15Å; A523-M526 PolarHBondContact O-N 3.2Å; S524-M526 VanDerWaalsContact C-N 3.31Å; S524-M526 PolarHBondContact O-N 3.35Å; M526-L528 VanDerWaalsContact C-N 3.34Å; M526-L528 PolarHBondContact O-N 3.41Å; M526-T529 WeakPolarHBondContact O-CB 3.46Å; M526-T529 PolarHBondContact O-N 2.85Å; M526-T529 VanDerWaalsContact O-N 3.1Å; M526-V530 WeakPolarHBondContact O-CG2 3.43Å; M526-V530 PolarHBondContact O-N 3.04Å; M526-L547 HydrophobicContact CG-CD2 3.97Å; M526-L547 HydrophobicContact SD-CD2 3.66Å; M526-L547 HydrophobicContact SD-CG 4.06Å; M526-M548 HydrophobicContact CE-CB 4.42Å; M526-M548 HydrophobicContact CE-CE 3.48Å; M526-M548 VanDerWaalsContact CE-CE 3.48Å; M526-M548 HydrophobicContact CE-SD 4.18Å; M526-F551 HydrophobicContact SD-CD2 3.92Å; M526-F551 HydrophobicContact SD-CE2 3.54Å; M526-F551 VanDerWaalsContact SD-CE2 3.54Å; M526-L576 HydrophobicContact CE-CD2 4.34Å; M526-L576 HydrophobicContact SD-CD2 3.93Å; M526-W633 HydrophobicContact CB-CD2 4.04Å; M526-W633 HydrophobicContact CB-CG 4.19Å; M526-W633 HydrophobicContact CB-CZ2 4.46Å; M526-W633 HydrophobicContact CG-CD2 4.18Å; M526-W633 HydrophobicContact CG-CE3 4.42Å; M526-W633 HydrophobicContact CG-CH2 4.12Å; M526-W633 HydrophobicContact CG-CZ2 3.86Å; M526-W633 HydrophobicContact CG-CZ3 4.39Å; M526-W633 HydrophobicContact SD-CZ2 4.1Å
527	G	95.6	Very high	93.6	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.9	-37.7	175.9	0	0	0	0	0	113.9	L445 A523 S524 A525 T529 V530 G531	L445-G527 VanDerWaalsContact CD1-CA 3.5Å; A523-G527 PolarHBondContact O-N 3.49Å; S524-G527 CarbonylContact O-C 3.56Å; S524-G527 WeakPolarHBondContact O-CA 3.39Å; S524-G527 PolarHBondContact O-N 2.8Å; A525-G527 VanDerWaalsContact C-N 3.33Å; G527-T529 VanDerWaalsContact C-N 3.32Å; G527-V530 PolarHBondContact O-N 3.19Å; G527-G531 PolarHBondContact O-N 2.74Å
528	L	94.4	Very high	93.5	Very high	5 Å²	5	23.1 Å²	23.1	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-63.4	-40.5	172.4	-67.6	174.5	0	0	0	111.4	T448 F452 S524 A525 M526 G531 A532 Y634 T637	T448-L528 HydrophobicContact CG2-CB 4.4Å; T448-L528 HydrophobicContact CG2-CD2 3.5Å; T448-L528 HydrophobicContact CG2-CG 3.63Å; F452-L528 HydrophobicContact CB-CD2 4.01Å; F452-L528 HydrophobicContact CD1-CB 4.49Å; F452-L528 HydrophobicContact CD1-CD2 3.96Å; F452-L528 WeakPolarHBondContact CD1-O 3.36Å; F452-L528 HydrophobicContact CD2-CD2 3.38Å; F452-L528 HydrophobicContact CE1-CD2 4.27Å; F452-L528 WeakPolarHBondContact CE1-O 2.98Å; F452-L528 HydrophobicContact CE2-CD2 3.72Å; F452-L528 HydrophobicContact CG-CD2 3.5Å; F452-L528 HydrophobicContact CZ-CD2 4.16Å; S524-L528 PolarHBondContact O-N 3.45Å; A525-L528 PolarHBondContact O-N 2.89Å; M526-L528 VanDerWaalsContact C-N 3.34Å; M526-L528 PolarHBondContact O-N 3.41Å; L528-G531 PolarHBondContact O-N 3.39Å; L528-A532 VanDerWaalsContact O-CB 3.28Å; L528-A532 WeakPolarHBondContact O-CB 3.43Å; L528-A532 PolarHBondContact O-N 2.93Å; L528-Y634 HydrophobicContact CD1-CD1 4.19Å; L528-Y634 HydrophobicContact CD1-CE1 3.46Å; L528-Y634 VanDerWaalsContact CD1-CE1 3.46Å; L528-T637 HydrophobicContact CB-CG2 3.99Å
529	T	94.9	Very high	93.4	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.1	-49.4	177.8	-53.9	0	0	0	0	110.6	A525 M526 G527 G531 A532 M533 W633 L636 T637 L640	A525-T529 PolarHBondContact O-N 3.31Å; A525-T529 VanDerWaalsContact O-N 3.09Å; A525-T529 PolarHBondContact O-OG1 2.84Å; M526-T529 WeakPolarHBondContact O-CB 3.46Å; M526-T529 PolarHBondContact O-N 2.85Å; M526-T529 VanDerWaalsContact O-N 3.1Å; G527-T529 VanDerWaalsContact C-N 3.32Å; T529-G531 VanDerWaalsContact C-N 3.31Å; T529-G531 PolarHBondContact O-N 2.85Å; T529-A532 WeakPolarHBondContact O-CB 3.27Å; T529-A532 PolarHBondContact O-N 3.23Å; T529-A532 VanDerWaalsContact O-N 3.09Å; T529-M533 HydrophobicContact CG2-SD 4.19Å; T529-M533 VanDerWaalsContact O-CG 3.32Å; T529-M533 WeakPolarHBondContact O-CG 3.41Å; T529-M533 PolarHBondContact O-N 2.8Å; T529-W633 HydrophobicContact CG2-CE3 3.8Å; T529-W633 HydrophobicContact CG2-CZ3 3.87Å; T529-W633 PolarHBondContact OG1-O 3.1Å; T529-L636 HydrophobicContact CG2-CB 4.34Å; T529-L636 HydrophobicContact CG2-CD2 3.67Å; T529-L636 HydrophobicContact CG2-CG 3.77Å; T529-T637 WeakPolarHBondContact CA-OG1 3.47Å; T529-T637 PolarHBondContact N-OG1 2.96Å; T529-T637 PolarHBondContact OG1-OG1 2.66Å; T529-L640 HydrophobicContact CG2-CD1 3.67Å
530	V	94.8	Very high	93.3	Very high	4 Å²	4	23 Å²	23	2%	0.024	13%	0.132	C	C	.	.	H	α-helix	trans	-57.5	-45.7	176	168.6	0	0	0	0	110.6	V449 M526 G527 A532 M533 A534 A540 L543 L547	V449-V530 HydrophobicContact CG2-CB 4.32Å; V449-V530 HydrophobicContact CG2-CG1 4.12Å; M526-V530 WeakPolarHBondContact O-CG2 3.43Å; M526-V530 PolarHBondContact O-N 3.04Å; G527-V530 PolarHBondContact O-N 3.19Å; V530-A532 VanDerWaalsContact C-N 3.32Å; V530-A532 PolarHBondContact O-N 3Å; V530-M533 PolarHBondContact O-N 3.47Å; V530-A534 WeakPolarHBondContact O-CB 3.42Å; V530-A534 PolarHBondContact O-N 3.1Å; V530-A540 HydrophobicContact CG1-CB 4.32Å; V530-L543 HydrophobicContact CG1-CB 4.11Å; V530-L543 HydrophobicContact CG1-CD2 4.19Å; V530-L543 HydrophobicContact CG1-CG 4.31Å; V530-L547 HydrophobicContact CG2-CD2 4.3Å
531	G	92.6	Very high	93.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67.6	-28.9	177	0	0	0	0	0	113.9	R456 G527 L528 T529	R456-G531 PolarHBondContact NH1-O 3.28Å; G527-G531 PolarHBondContact O-N 2.74Å; L528-G531 PolarHBondContact O-N 3.39Å; T529-G531 VanDerWaalsContact C-N 3.31Å; T529-G531 PolarHBondContact O-N 2.85Å
532	A	91.2	Very high	93.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-73.2	-31	173.4	0	0	0	0	0	112.3	F452 R456 L528 T529 V530 T637 L640 L641	F452-A532 HydrophobicContact CE1-CB 4.11Å; R456-A532 PolarHBondContact NH1-O 3.45Å; L528-A532 VanDerWaalsContact O-CB 3.28Å; L528-A532 WeakPolarHBondContact O-CB 3.43Å; L528-A532 PolarHBondContact O-N 2.93Å; T529-A532 WeakPolarHBondContact O-CB 3.27Å; T529-A532 PolarHBondContact O-N 3.23Å; T529-A532 VanDerWaalsContact O-N 3.09Å; V530-A532 VanDerWaalsContact C-N 3.32Å; V530-A532 PolarHBondContact O-N 3Å; A532-T637 HydrophobicContact CB-CG2 4.35Å; A532-L640 HydrophobicContact CB-CB 4.21Å; A532-L640 HydrophobicContact CB-CD1 4.38Å; A532-L641 HydrophobicContact CB-CD2 4.02Å; A532-L641 HydrophobicContact CB-CG 4.17Å
533	M	90.6	Very high	93	Very high	27 Å²	27	32 Å²	32	13%	0.133	19%	0.187	C	C	.	.	H	α-helix	trans	-81.5	-41.9	178.4	-68.5	-180	61.9	0	0	112.8	F18 V22 T529 V530 L640	F18-M533 HydrophobicContact CD1-CE 3.8Å; F18-M533 HydrophobicContact CE1-CE 3.66Å; V22-M533 HydrophobicContact CB-CE 4.19Å; V22-M533 HydrophobicContact CG1-CB 4.47Å; V22-M533 HydrophobicContact CG1-CE 4.07Å; V22-M533 HydrophobicContact CG2-CE 4.38Å; T529-M533 HydrophobicContact CG2-SD 4.19Å; T529-M533 VanDerWaalsContact O-CG 3.32Å; T529-M533 WeakPolarHBondContact O-CG 3.41Å; T529-M533 PolarHBondContact O-N 2.8Å; V530-M533 PolarHBondContact O-N 3.47Å; M533-L640 HydrophobicContact CG-CD1 3.37Å; M533-L640 HydrophobicContact CG-CD2 4.11Å; M533-L640 HydrophobicContact CG-CG 4.36Å; M533-L640 HydrophobicContact SD-CD1 4.03Å
534	A	89.9	Confident	92.9	Very high	3 Å²	3	32 Å²	32	3%	0.025	19%	0.187	C	C	.	.			trans	-67.9	142.1	-171.8	0	0	0	0	0	112.2	R456 V530 A539 A540	R456-A534 VanDerWaalsContact CZ-O 3.32Å; R456-A534 PolarHBondContact NH1-O 3.48Å; R456-A534 PolarHBondContact NH2-O 2.87Å; V530-A534 WeakPolarHBondContact O-CB 3.42Å; V530-A534 PolarHBondContact O-N 3.1Å; A534-A539 HydrophobicContact CB-CB 4.32Å; A534-A540 HydrophobicContact CB-CB 3.51Å
535	P	86.7	Confident	92.8	Very high	100 Å²	100	33.6 Å²	33.6	65%	0.649	20%	0.198	S	C	*	.	S	Bend	trans	-72.3	-37.5	176.1	27.7	-33.2	0	0	0	111.6	R456 A539	R456-P535 PolarHBondContact NH2-O 3.04Å; P535-A539 HydrophobicContact CG-CB 4.13Å
536	T	89.3	Confident	92.7	Very high	69 Å²	69	37.1 Å²	37.1	42%	0.423	22%	0.222	S	C	.	.	S	Bend	trans	-128	163.8	-176.4	67.1	0	0	0	0	111.4	E538 A539 A540	T536-E538 VanDerWaalsContact C-N 3.29Å; T536-E538 PolarHBondContact O-N 2.78Å; T536-A539 PolarHBondContact O-N 2.79Å; T536-A539 WeakPolarHBondContact OG1-CB 3.5Å; T536-A539 PolarHBondContact OG1-N 2.79Å; T536-A539 VanDerWaalsContact OG1-N 3.13Å; T536-A540 PolarHBondContact O-N 3.14Å; T536-A540 VanDerWaalsContact O-N 3.07Å
537	T	89.8	Confident	92.6	Very high	31 Å²	31	39.6 Å²	39.6	19%	0.19	24%	0.235	C	C	.	.	H	α-helix	trans	-63.8	-38.2	175.5	-52.9	0	0	0	0	111	A540 M541	T537-A540 WeakPolarHBondContact O-CB 3.43Å; T537-A540 PolarHBondContact O-N 2.83Å; T537-M541 HydrophobicContact CG2-CG 4.46Å; T537-M541 HydrophobicContact CG2-SD 4.32Å; T537-M541 WeakPolarHBondContact O-CG 3.44Å; T537-M541 PolarHBondContact O-N 2.91Å
538	E	93	Very high	92.6	Very high	160 Å²	160	39.6 Å²	39.6	75%	0.748	24%	0.235	S	C	*	.	H	α-helix	trans	-63.9	-46	178.1	-67.5	167.1	-172.3	0	0	111.8	T536 A540 M541 A542	T536-E538 VanDerWaalsContact C-N 3.29Å; T536-E538 PolarHBondContact O-N 2.78Å; E538-A540 VanDerWaalsContact C-N 3.27Å; E538-A540 PolarHBondContact O-N 2.83Å; E538-M541 PolarHBondContact O-N 3.28Å; E538-M541 VanDerWaalsContact O-N 3.16Å; E538-A542 PolarHBondContact O-N 2.82Å
539	A	93.4	Very high	92.5	Very high	37 Å²	37	43 Å²	43	31%	0.306	26%	0.256	S	S	.	.	H	α-helix	trans	-60.9	-38.9	174.9	0	0	0	0	0	111.5	A534 P535 T536 A542 L543	A534-A539 HydrophobicContact CB-CB 4.32Å; P535-A539 HydrophobicContact CG-CB 4.13Å; T536-A539 PolarHBondContact O-N 2.79Å; T536-A539 WeakPolarHBondContact OG1-CB 3.5Å; T536-A539 PolarHBondContact OG1-N 2.79Å; T536-A539 VanDerWaalsContact OG1-N 3.13Å; A539-A542 PolarHBondContact O-N 3.42Å; A539-L543 WeakPolarHBondContact O-CB 3.49Å; A539-L543 PolarHBondContact O-N 2.89Å
540	A	93.4	Very high	92.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.2	-45.7	175.6	0	0	0	0	0	111	V449 P453 V530 A534 T536 T537 E538 A542 L543 G544	V449-A540 HydrophobicContact CG1-CB 3.6Å; V449-A540 WeakPolarHBondContact CG1-O 3.34Å; P453-A540 HydrophobicContact CG-CB 3.84Å; V530-A540 HydrophobicContact CG1-CB 4.32Å; A534-A540 HydrophobicContact CB-CB 3.51Å; T536-A540 PolarHBondContact O-N 3.14Å; T536-A540 VanDerWaalsContact O-N 3.07Å; T537-A540 WeakPolarHBondContact O-CB 3.43Å; T537-A540 PolarHBondContact O-N 2.83Å; E538-A540 VanDerWaalsContact C-N 3.27Å; E538-A540 PolarHBondContact O-N 2.83Å; A540-A542 VanDerWaalsContact C-N 3.26Å; A540-A542 PolarHBondContact O-N 3.05Å; A540-L543 PolarHBondContact O-N 3.46Å; A540-G544 PolarHBondContact O-N 2.86Å
541	M	93.1	Very high	92.3	Very high	105 Å²	105	46.2 Å²	46.2	52%	0.517	28%	0.275	S	S	.	.	H	α-helix	trans	-66.3	-24.8	179.6	-73.6	-173.8	68.4	0	0	113.4	V449 T537 E538 P545	V449-M541 HydrophobicContact CG1-CB 4.43Å; V449-M541 HydrophobicContact CG1-CG 3.99Å; T537-M541 HydrophobicContact CG2-CG 4.46Å; T537-M541 HydrophobicContact CG2-SD 4.32Å; T537-M541 WeakPolarHBondContact O-CG 3.44Å; T537-M541 PolarHBondContact O-N 2.91Å; E538-M541 PolarHBondContact O-N 3.28Å; E538-M541 VanDerWaalsContact O-N 3.16Å; M541-P545 WeakPolarHBondContact O-CD 3.42Å; M541-P545 WeakPolarHBondContact O-CG 3.41Å
542	A	94.2	Very high	92.3	Very high	61 Å²	61	47.6 Å²	47.6	50%	0.504	28%	0.282	S	S	.	.	H	α-helix	trans	-77.5	-48.6	168.7	0	0	0	0	0	111.7	E538 A539 A540 G544 S546	E538-A542 PolarHBondContact O-N 2.82Å; A539-A542 PolarHBondContact O-N 3.42Å; A540-A542 VanDerWaalsContact C-N 3.26Å; A540-A542 PolarHBondContact O-N 3.05Å; A542-G544 PolarHBondContact O-N 3.27Å; A542-S546 PolarHBondContact O-OG 3.38Å; A542-S546 VanDerWaalsContact O-OG 3.04Å
543	L	94.2	Very high	92.3	Very high	57 Å²	57	50.5 Å²	50.5	30%	0.298	30%	0.3	S	S	.	.	H	α-helix	trans	-67.9	-39.5	-173.1	-173.2	65.7	0	0	0	113.3	V530 A539 A540 S546 L547	V530-L543 HydrophobicContact CG1-CB 4.11Å; V530-L543 HydrophobicContact CG1-CD2 4.19Å; V530-L543 HydrophobicContact CG1-CG 4.31Å; A539-L543 WeakPolarHBondContact O-CB 3.49Å; A539-L543 PolarHBondContact O-N 2.89Å; A540-L543 PolarHBondContact O-N 3.46Å; L543-S546 PolarHBondContact O-N 2.92Å; L543-L547 PolarHBondContact O-N 2.85Å
544	G	93.9	Very high	92.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-58.1	-61.2	-176.5	0	0	0	0	0	112.9	L445 A540 A542 S546 L547 M548	L445-G544 WeakPolarHBondContact CD2-O 3.29Å; A540-G544 PolarHBondContact O-N 2.86Å; A542-G544 PolarHBondContact O-N 3.27Å; G544-S546 VanDerWaalsContact C-N 3.3Å; G544-S546 PolarHBondContact O-N 2.88Å; G544-L547 PolarHBondContact O-N 2.85Å; G544-M548 PolarHBondContact O-N 2.87Å
545	P	93.2	Very high	92.1	Very high	47 Å²	47	50.5 Å²	50.5	31%	0.305	30%	0.298	S	S	.	.	H	α-helix	trans	-57.8	-39	178.2	-27.2	36.8	0	0	0	113.2	M442 M541 L547 M548 T549	M442-P545 HydrophobicContact CE-CB 4.3Å; M541-P545 WeakPolarHBondContact O-CD 3.42Å; M541-P545 WeakPolarHBondContact O-CG 3.41Å; P545-L547 VanDerWaalsContact C-N 3.35Å; P545-L547 PolarHBondContact O-N 3.21Å; P545-M548 PolarHBondContact O-N 2.71Å; P545-M548 VanDerWaalsContact O-N 3.13Å; P545-T549 PolarHBondContact O-N 3.06Å; P545-T549 PolarHBondContact O-OG1 3.01Å
546	S	93.8	Very high	91.8	Very high	74 Å²	74	47 Å²	47	52%	0.517	28%	0.28	S	S	.	.	H	α-helix	trans	-60	-43.1	176.5	-59.7	0	0	0	0	112.6	A542 L543 G544 M548 T549	A542-S546 PolarHBondContact O-OG 3.38Å; A542-S546 VanDerWaalsContact O-OG 3.04Å; L543-S546 PolarHBondContact O-N 2.92Å; G544-S546 VanDerWaalsContact C-N 3.3Å; G544-S546 PolarHBondContact O-N 2.88Å; S546-M548 VanDerWaalsContact C-N 3.34Å; S546-T549 PolarHBondContact O-N 3.21Å
547	L	93.3	Very high	91.6	Very high	52 Å²	52	47.3 Å²	47.3	27%	0.272	27%	0.274	S	S	.	.	H	α-helix	trans	-65.1	-39.8	174.6	-178.3	60.8	0	0	0	111.3	M526 V530 L543 G544 P545 T549 V550 F551 W633	M526-L547 HydrophobicContact CG-CD2 3.97Å; M526-L547 HydrophobicContact SD-CD2 3.66Å; M526-L547 HydrophobicContact SD-CG 4.06Å; V530-L547 HydrophobicContact CG2-CD2 4.3Å; L543-L547 PolarHBondContact O-N 2.85Å; G544-L547 PolarHBondContact O-N 2.85Å; P545-L547 VanDerWaalsContact C-N 3.35Å; P545-L547 PolarHBondContact O-N 3.21Å; L547-T549 PolarHBondContact O-N 2.89Å; L547-V550 PolarHBondContact O-N 2.96Å; L547-F551 HydrophobicContact CD1-CE2 4.48Å; L547-F551 HydrophobicContact CD1-CZ 4.36Å; L547-F551 HydrophobicContact CG-CE2 4.28Å; L547-F551 PolarHBondContact O-N 3Å; L547-W633 HydrophobicContact CD2-CH2 4.1Å
548	M	93.8	Very high	91.4	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.8	-38.1	177.7	-169.2	63	85.2	0	0	112.2	A441 M442 L445 A523 M526 G544 P545 S546 V550 F551 I552 L576 I577	A441-M548 HydrophobicContact CB-CE 3.69Å; A441-M548 HydrophobicContact CB-SD 4.25Å; M442-M548 HydrophobicContact CE-CB 3.58Å; M442-M548 HydrophobicContact CE-CG 3.54Å; M442-M548 HydrophobicContact CG-CG 3.98Å; M442-M548 HydrophobicContact SD-CB 3.88Å; M442-M548 HydrophobicContact SD-CG 3.61Å; L445-M548 HydrophobicContact CB-CE 4.13Å; L445-M548 HydrophobicContact CD2-CB 3.89Å; L445-M548 HydrophobicContact CD2-CE 3.92Å; L445-M548 HydrophobicContact CD2-CG 4.47Å; A523-M548 HydrophobicContact CB-CE 4.2Å; M526-M548 HydrophobicContact CE-CB 4.42Å; M526-M548 HydrophobicContact CE-CE 3.48Å; M526-M548 VanDerWaalsContact CE-CE 3.48Å; M526-M548 HydrophobicContact CE-SD 4.18Å; G544-M548 PolarHBondContact O-N 2.87Å; P545-M548 PolarHBondContact O-N 2.71Å; P545-M548 VanDerWaalsContact O-N 3.13Å; S546-M548 VanDerWaalsContact C-N 3.34Å; M548-V550 PolarHBondContact O-N 2.73Å; M548-F551 CarbonylContact O-C 3.52Å; M548-F551 WeakPolarHBondContact O-CA 3.34Å; M548-F551 PolarHBondContact O-N 3.31Å; M548-F551 HydrophobicContact SD-CB 4.37Å; M548-I552 HydrophobicContact CG-CD1 4.14Å; M548-I552 HydrophobicContact CG-CG1 4.27Å; M548-I552 WeakPolarHBondContact O-CG1 3.42Å; M548-I552 PolarHBondContact O-N 3.38Å; M548-L576 HydrophobicContact CE-CD1 4.28Å; M548-L576 HydrophobicContact CE-CD2 4.39Å; M548-L576 HydrophobicContact SD-CD1 4.39Å; M548-I577 HydrophobicContact CG-CD1 4.34Å; M548-I577 HydrophobicContact SD-CD1 3.59Å; M548-I577 VanDerWaalsContact SD-CD1 3.59Å; M548-I577 HydrophobicContact SD-CG1 4.16Å
549	T	93.2	Very high	90.9	Very high	76 Å²	76	46.8 Å²	46.8	47%	0.466	27%	0.267	S	S	.	.	H	α-helix	trans	-54.6	-41.5	175.7	-57.6	0	0	0	0	111.8	P545 S546 L547 F551 I552 V553	P545-T549 PolarHBondContact O-N 3.06Å; P545-T549 PolarHBondContact O-OG1 3.01Å; S546-T549 PolarHBondContact O-N 3.21Å; L547-T549 PolarHBondContact O-N 2.89Å; T549-F551 VanDerWaalsContact C-N 3.35Å; T549-F551 PolarHBondContact O-N 3Å; T549-I552 PolarHBondContact O-N 3.25Å; T549-V553 WeakPolarHBondContact O-CG2 3.25Å; T549-V553 PolarHBondContact O-N 3.3Å
550	V	92.1	Very high	90.1	Very high	60 Å²	60	48.1 Å²	48.1	36%	0.364	27%	0.269	S	S	.	.	H	α-helix	trans	-61	-45.7	175.1	179.4	0	0	0	0	110.5	L547 M548 I552 V553 F554 I571	L547-V550 PolarHBondContact O-N 2.96Å; M548-V550 PolarHBondContact O-N 2.73Å; V550-I552 VanDerWaalsContact C-N 3.31Å; V550-I552 PolarHBondContact O-N 2.92Å; V550-V553 PolarHBondContact O-N 2.99Å; V550-F554 HydrophobicContact CG1-CD2 4.01Å; V550-F554 HydrophobicContact CG1-CE2 4.28Å; V550-F554 VanDerWaalsContact O-CD2 3.29Å; V550-F554 WeakPolarHBondContact O-CD2 3.49Å; V550-F554 PolarHBondContact O-N 3.29Å; V550-F554 VanDerWaalsContact O-N 3.12Å; V550-I571 HydrophobicContact CG1-CD1 4.32Å; V550-I571 HydrophobicContact CG1-CG2 3.86Å
551	F	93	Very high	89.1	Confident	11 Å²	11	49.7 Å²	49.7	5%	0.048	28%	0.279	C	S	.	.	H	α-helix	trans	-68.1	-27.5	177.8	-67	-24.6	0	0	0	114.3	M526 L547 M548 T549 F554 G555 I571 V574 S575 L576 I577 W633	M526-F551 HydrophobicContact SD-CD2 3.92Å; M526-F551 HydrophobicContact SD-CE2 3.54Å; M526-F551 VanDerWaalsContact SD-CE2 3.54Å; L547-F551 HydrophobicContact CD1-CE2 4.48Å; L547-F551 HydrophobicContact CD1-CZ 4.36Å; L547-F551 HydrophobicContact CG-CE2 4.28Å; L547-F551 PolarHBondContact O-N 3Å; M548-F551 CarbonylContact O-C 3.52Å; M548-F551 WeakPolarHBondContact O-CA 3.34Å; M548-F551 PolarHBondContact O-N 3.31Å; M548-F551 HydrophobicContact SD-CB 4.37Å; T549-F551 VanDerWaalsContact C-N 3.35Å; T549-F551 PolarHBondContact O-N 3Å; F551-F554 CarbonylContact O-C 3.58Å; F551-G555 VanDerWaalsContact O-CA 3.32Å; F551-G555 WeakPolarHBondContact O-CA 3.41Å; F551-G555 PolarHBondContact O-N 3.08Å; F551-I571 HydrophobicContact CD1-CG2 4.29Å; F551-I571 HydrophobicContact CE1-CG2 4.4Å; F551-V574 HydrophobicContact CE1-CG2 4.14Å; F551-S575 PolarHBondContact O-OG 3.31Å; F551-S575 VanDerWaalsContact O-OG 3.13Å; F551-L576 HydrophobicContact CD2-CD2 4.08Å; F551-L576 HydrophobicContact CD2-CG 4.38Å; F551-L576 HydrophobicContact CE2-CD2 4.33Å; F551-I577 HydrophobicContact CB-CD1 4.35Å; F551-W633 HydrophobicContact CE2-CZ2 4.15Å; F551-W633 HydrophobicContact CZ-CZ2 4.23Å
552	I	92.9	Very high	88.2	Confident	30 Å²	30	49.6 Å²	49.6	15%	0.154	28%	0.281	C	S	.	.	H	α-helix	trans	-66.4	-50.7	172.6	-67.4	169.5	0	0	0	110	I438 M442 M548 T549 V550 F554 G555 Y558 I577	I438-I552 HydrophobicContact CD1-CG1 4.5Å; I438-I552 HydrophobicContact CD1-CG2 3.83Å; I438-I552 HydrophobicContact CG1-CG1 4.16Å; I438-I552 HydrophobicContact CG1-CG2 4.36Å; I438-I552 HydrophobicContact CG2-CD1 3.86Å; I438-I552 HydrophobicContact CG2-CG1 4.21Å; M442-I552 HydrophobicContact CE-CD1 4.09Å; M548-I552 HydrophobicContact CG-CD1 4.14Å; M548-I552 HydrophobicContact CG-CG1 4.27Å; M548-I552 WeakPolarHBondContact O-CG1 3.42Å; M548-I552 PolarHBondContact O-N 3.38Å; T549-I552 PolarHBondContact O-N 3.25Å; V550-I552 VanDerWaalsContact C-N 3.31Å; V550-I552 PolarHBondContact O-N 2.92Å; I552-F554 VanDerWaalsContact C-N 3.31Å; I552-F554 PolarHBondContact O-N 2.93Å; I552-G555 PolarHBondContact O-N 3.33Å; I552-Y558 HydrophobicContact CG2-CD2 4.42Å; I552-Y558 HydrophobicContact CG2-CE2 3.96Å; I552-I577 HydrophobicContact CB-CD1 4.3Å; I552-I577 HydrophobicContact CG1-CD1 3.42Å; I552-I577 VanDerWaalsContact CG1-CD1 3.42Å
553	V	91.5	Very high	87.4	Confident	61 Å²	61	53 Å²	53	37%	0.37	29%	0.29	S	S	.	.	H	α-helix	trans	-59.4	-43.9	-179.5	172.9	0	0	0	0	111	T549 V550 G555 V559	T549-V553 WeakPolarHBondContact O-CG2 3.25Å; T549-V553 PolarHBondContact O-N 3.3Å; V550-V553 PolarHBondContact O-N 2.99Å; V553-G555 VanDerWaalsContact C-N 3.27Å; V553-G555 PolarHBondContact O-N 3Å; V553-V559 HydrophobicContact CG1-CG2 3.78Å; V553-V559 WeakPolarHBondContact O-CG2 3.16Å
554	F	88.8	Confident	86.7	Confident	30 Å²	30	50.4 Å²	50.4	13%	0.132	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	18.8	177.4	-66	-76.9	0	0	0	113.7	V550 F551 I552 G556 V559 T564 F568 I571 P572	V550-F554 HydrophobicContact CG1-CD2 4.01Å; V550-F554 HydrophobicContact CG1-CE2 4.28Å; V550-F554 VanDerWaalsContact O-CD2 3.29Å; V550-F554 WeakPolarHBondContact O-CD2 3.49Å; V550-F554 PolarHBondContact O-N 3.29Å; V550-F554 VanDerWaalsContact O-N 3.12Å; F551-F554 CarbonylContact O-C 3.58Å; I552-F554 VanDerWaalsContact C-N 3.31Å; I552-F554 PolarHBondContact O-N 2.93Å; F554-G556 PolarHBondContact O-N 3.24Å; F554-V559 HydrophobicContact CD1-CB 4.48Å; F554-V559 HydrophobicContact CD1-CG1 4.36Å; F554-V559 HydrophobicContact CE1-CG1 4.31Å; F554-T564 HydrophobicContact CD1-CG2 4.34Å; F554-T564 HydrophobicContact CE1-CG2 3.87Å; F554-F568 HydrophobicContact CE1-CB 4.2Å; F554-F568 HydrophobicContact CZ-CB 4.08Å; F554-F568 HydrophobicContact CZ-CG 4.38Å; F554-I571 HydrophobicContact CB-CG2 3.83Å; F554-I571 HydrophobicContact CD2-CB 4.18Å; F554-I571 HydrophobicContact CD2-CD1 4.24Å; F554-I571 HydrophobicContact CD2-CG2 3.54Å; F554-I571 HydrophobicContact CE2-CD1 3.91Å; F554-I571 HydrophobicContact CE2-CG2 4.28Å; F554-I571 HydrophobicContact CG-CB 4.2Å; F554-I571 HydrophobicContact CG-CG2 3.76Å; F554-I571 HydrophobicContact CZ-CD1 4.31Å; F554-P572 HydrophobicContact CB-CG 4.14Å; F554-P572 HydrophobicContact CD1-CG 3.97Å; F554-P572 HydrophobicContact CG-CG 4.42Å
555	G	86.4	Confident	86.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.3	C	S	.	.	S	Bend	trans	-72.6	-1.8	-177.7	0	0	0	0	0	115.1	F551 I552 V553 R578	F551-G555 VanDerWaalsContact O-CA 3.32Å; F551-G555 WeakPolarHBondContact O-CA 3.41Å; F551-G555 PolarHBondContact O-N 3.08Å; I552-G555 PolarHBondContact O-N 3.33Å; V553-G555 VanDerWaalsContact C-N 3.27Å; V553-G555 PolarHBondContact O-N 3Å; G555-R578 VanDerWaalsContact O-CA 3.28Å; G555-R578 WeakPolarHBondContact O-CA 3.33Å
556	G	81.4	Confident	86	Confident	26 Å²	26	56.6 Å²	56.6	27%	0.268	32%	0.315	S	S	.	.	S	Bend	trans	96.8	-17.3	177.5	0	0	0	0	0	115	F554	F554-G556 PolarHBondContact O-N 3.24Å
557	Y	84.9	Confident	85.6	Confident	75 Å²	75	58.8 Å²	58.8	29%	0.294	32%	0.32	S	S	.	.	S	Bend	trans	-86.7	-48.2	175.8	-176	-105	0	0	0	113.3	M430 Q434 F581	M430-Y557 HydrophobicContact CB-CD2 4.29Å; M430-Y557 HydrophobicContact CB-CE2 4.01Å; M430-Y557 HydrophobicContact CE-CD2 4.45Å; M430-Y557 HydrophobicContact CE-CE2 4.09Å; Q434-Y557 HydrophobicContact CB-CG 4.32Å; Q434-Y557 HydrophobicContact CG-CD1 4.27Å; Q434-Y557 HydrophobicContact CG-CG 4.06Å; Y557-F581 HydrophobicContact CD2-CZ 4.21Å
558	Y	85.4	Confident	85.3	Confident	141 Å²	141	60.6 Å²	60.6	55%	0.553	33%	0.326	S	S	*	.	S	Bend	trans	-82.6	-39.8	-174.1	-63.6	-70.4	0	0	0	113.9	I552	I552-Y558 HydrophobicContact CG2-CD2 4.42Å; I552-Y558 HydrophobicContact CG2-CE2 3.96Å
559	V	82.7	Confident	84.9	Confident	40 Å²	40	66.6 Å²	66.6	24%	0.242	35%	0.348	C	S	.	.	S	Bend	trans	-114.2	118.3	-178.8	179.5	0	0	0	0	108.9	V553 F554	V553-V559 HydrophobicContact CG1-CG2 3.78Å; V553-V559 WeakPolarHBondContact O-CG2 3.16Å; F554-V559 HydrophobicContact CD1-CB 4.48Å; F554-V559 HydrophobicContact CD1-CG1 4.36Å; F554-V559 HydrophobicContact CE1-CG1 4.31Å
560	N	76.9	Confident	84.6	Confident	65 Å²	65	68.1 Å²	68.1	35%	0.348	35%	0.346	S	S	.	.			trans	-65.7	127.9	171.8	-174	-21.2	0	0	0	109	D562 N563 T564	N560-D562 PolarHBondContact O-N 2.73Å; N560-D562 VanDerWaalsContact O-N 3.1Å; N560-D562 PolarHBondContact OD1-N 2.95Å; N560-D562 PolarHBondContact OD1-OD2 2.81Å; N560-N563 PolarHBondContact O-N 3.09Å; N560-T564 PolarHBondContact O-N 2.94Å; N560-T564 PolarHBondContact O-OG1 2.87Å
561	P	71.5	Confident	84.4	Confident	33 Å²	33	65.9 Å²	65.9	21%	0.214	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-50.1	-32.3	175.4	15.1	-28.9	0	0	0	114.3	N563 T564	P561-N563 VanDerWaalsContact C-N 3.34Å; P561-N563 PolarHBondContact O-N 2.98Å; P561-T564 WeakPolarHBondContact O-CB 3.46Å; P561-T564 PolarHBondContact O-N 2.89Å; P561-T564 PolarHBondContact O-OG1 2.77Å
562	D	74.3	Confident	84	Confident	102 Å²	102	65.7 Å²	65.7	55%	0.545	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-69.6	-33.1	-179.1	-60.9	-37.9	0	0	0	112.4	N560 T564 S613	N560-D562 PolarHBondContact O-N 2.73Å; N560-D562 VanDerWaalsContact O-N 3.1Å; N560-D562 PolarHBondContact OD1-N 2.95Å; N560-D562 PolarHBondContact OD1-OD2 2.81Å; D562-T564 VanDerWaalsContact C-N 3.3Å; D562-T564 PolarHBondContact O-N 2.86Å; D562-S613 PolarHBondContact OD2-OG 3.44Å
563	N	77.4	Confident	83.7	Confident	132 Å²	132	71.2 Å²	71.2	71%	0.706	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-85.8	0.3	178.6	-67.1	-12.8	0	0	0	113.1	N560 P561 P565	N560-N563 PolarHBondContact O-N 3.09Å; P561-N563 VanDerWaalsContact C-N 3.34Å; P561-N563 PolarHBondContact O-N 2.98Å; N563-P565 WeakPolarHBondContact O-CD 3.3Å
564	T	81.1	Confident	83.6	Confident	3 Å²	3	71.2 Å²	71.2	2%	0.018	35%	0.354	C	S	.	.	S	Bend	trans	-76.2	123	-177.5	-54.9	0	0	0	0	110.3	F554 N560 P561 D562 F568 R569	F554-T564 HydrophobicContact CD1-CG2 4.34Å; F554-T564 HydrophobicContact CE1-CG2 3.87Å; N560-T564 PolarHBondContact O-N 2.94Å; N560-T564 PolarHBondContact O-OG1 2.87Å; P561-T564 WeakPolarHBondContact O-CB 3.46Å; P561-T564 PolarHBondContact O-N 2.89Å; P561-T564 PolarHBondContact O-OG1 2.77Å; D562-T564 VanDerWaalsContact C-N 3.3Å; D562-T564 PolarHBondContact O-N 2.86Å; T564-F568 HydrophobicContact CG2-CB 3.85Å; T564-R569 HydrophobicContact CG2-CG 4.1Å; T564-R569 WeakPolarHBondContact O-CG 3.41Å; T564-R569 PolarHBondContact O-NE 2.83Å
565	P	84.8	Confident	83.8	Confident	73 Å²	73	69.8 Å²	69.8	47%	0.474	35%	0.348	S	S	.	.			trans	-53.4	145.2	175.7	-26.3	34.5	0	0	0	111.6	N563 I567 F568 R569	N563-P565 WeakPolarHBondContact O-CD 3.3Å; P565-I567 HydrophobicContact CB-CG2 4.35Å; P565-I567 PolarHBondContact O-N 2.85Å; P565-F568 HydrophobicContact CB-CD2 4.14Å; P565-F568 HydrophobicContact CG-CD2 4.12Å; P565-F568 PolarHBondContact O-N 3.21Å; P565-R569 PolarHBondContact O-N 3.48Å
566	V	85.7	Confident	84	Confident	105 Å²	105	69.9 Å²	69.9	64%	0.636	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-52.6	-38.5	-172.7	-178.9	0	0	0	0	112.2	F568 R569	V566-F568 VanDerWaalsContact C-N 3.28Å; V566-F568 PolarHBondContact O-N 2.81Å; V566-R569 PolarHBondContact O-N 3.17Å
567	I	87.2	Confident	84.6	Confident	119 Å²	119	68.6 Å²	68.6	61%	0.61	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-64.7	-26.4	179.1	-164	163.6	0	0	0	113.9	P565 W570	P565-I567 HydrophobicContact CB-CG2 4.35Å; P565-I567 PolarHBondContact O-N 2.85Å; I567-W570 PolarHBondContact O-NE1 3.43Å
568	F	86.9	Confident	85	Confident	90 Å²	90	66.7 Å²	66.7	40%	0.395	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-104.1	-3.6	-177.5	-59.4	-43.8	0	0	0	113.8	F554 T564 P565 V566 W570 I571 P572	F554-F568 HydrophobicContact CE1-CB 4.2Å; F554-F568 HydrophobicContact CZ-CB 4.08Å; F554-F568 HydrophobicContact CZ-CG 4.38Å; T564-F568 HydrophobicContact CG2-CB 3.85Å; P565-F568 HydrophobicContact CB-CD2 4.14Å; P565-F568 HydrophobicContact CG-CD2 4.12Å; P565-F568 PolarHBondContact O-N 3.21Å; V566-F568 VanDerWaalsContact C-N 3.28Å; V566-F568 PolarHBondContact O-N 2.81Å; F568-W570 PolarHBondContact O-N 2.93Å; F568-I571 HydrophobicContact CB-CD1 4.05Å; F568-I571 HydrophobicContact CD1-CD1 3.8Å; F568-I571 HydrophobicContact CG-CD1 4.23Å; F568-I571 WeakPolarHBondContact O-CB 3.25Å; F568-I571 PolarHBondContact O-N 3.27Å; F568-P572 WeakPolarHBondContact O-CD 3.21Å
569	R	84.7	Confident	85.4	Confident	126 Å²	126	62.3 Å²	62.3	48%	0.475	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-15.1	-179	-75.4	-177.4	-179.9	178.8	-7.8	114.7	T564 P565 V566	T564-R569 HydrophobicContact CG2-CG 4.1Å; T564-R569 WeakPolarHBondContact O-CG 3.41Å; T564-R569 PolarHBondContact O-NE 2.83Å; P565-R569 PolarHBondContact O-N 3.48Å; V566-R569 PolarHBondContact O-N 3.17Å
570	W	86.8	Confident	86	Confident	109 Å²	109	60.4 Å²	60.4	41%	0.413	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-28	173.7	67.1	-91.2	0	0	0	112.7	I567 F568 K573 V574	I567-W570 PolarHBondContact O-NE1 3.43Å; F568-W570 PolarHBondContact O-N 2.93Å; W570-K573 WeakPolarHBondContact O-CB 3.19Å; W570-K573 PolarHBondContact O-N 2.85Å; W570-K573 VanDerWaalsContact O-N 3.1Å; W570-V574 HydrophobicContact CE3-CG2 3.8Å; W570-V574 HydrophobicContact CZ3-CG2 3.81Å; W570-V574 PolarHBondContact O-N 3.01Å
571	I	87.9	Confident	86.9	Confident	12 Å²	12	57.6 Å²	57.6	6%	0.062	28%	0.283	C	S	.	.	H	α-helix	trans	-61	-49.6	-176	-58.3	175.1	0	0	0	111.5	V550 F551 F554 F568 K573 V574 S575	V550-I571 HydrophobicContact CG1-CD1 4.32Å; V550-I571 HydrophobicContact CG1-CG2 3.86Å; F551-I571 HydrophobicContact CD1-CG2 4.29Å; F551-I571 HydrophobicContact CE1-CG2 4.4Å; F554-I571 HydrophobicContact CB-CG2 3.83Å; F554-I571 HydrophobicContact CD2-CB 4.18Å; F554-I571 HydrophobicContact CD2-CD1 4.24Å; F554-I571 HydrophobicContact CD2-CG2 3.54Å; F554-I571 HydrophobicContact CE2-CD1 3.91Å; F554-I571 HydrophobicContact CE2-CG2 4.28Å; F554-I571 HydrophobicContact CG-CB 4.2Å; F554-I571 HydrophobicContact CG-CG2 3.76Å; F554-I571 HydrophobicContact CZ-CD1 4.31Å; F568-I571 HydrophobicContact CB-CD1 4.05Å; F568-I571 HydrophobicContact CD1-CD1 3.8Å; F568-I571 HydrophobicContact CG-CD1 4.23Å; F568-I571 WeakPolarHBondContact O-CB 3.25Å; F568-I571 PolarHBondContact O-N 3.27Å; I571-K573 PolarHBondContact O-N 3.4Å; I571-V574 VanDerWaalsContact O-CG2 3.28Å; I571-V574 WeakPolarHBondContact O-CG2 3.46Å; I571-V574 PolarHBondContact O-N 2.9Å; I571-V574 VanDerWaalsContact O-N 3.11Å; I571-S575 PolarHBondContact O-N 3.24Å
572	P	85.3	Confident	87.9	Confident	7 Å²	7	56.1 Å²	56.1	5%	0.045	27%	0.273	C	S	.	.	H	α-helix	trans	-57.3	-34.3	176.4	-22.2	30.9	0	0	0	112.5	F554 F568 V574 S575 R578	F554-P572 HydrophobicContact CB-CG 4.14Å; F554-P572 HydrophobicContact CD1-CG 3.97Å; F554-P572 HydrophobicContact CG-CG 4.42Å; F568-P572 WeakPolarHBondContact O-CD 3.21Å; P572-V574 VanDerWaalsContact C-N 3.28Å; P572-V574 PolarHBondContact O-N 2.87Å; P572-S575 PolarHBondContact O-N 3.21Å; P572-R578 WeakPolarHBondContact O-CD 3.42Å
573	K	86.3	Confident	88.9	Confident	147 Å²	147	51.2 Å²	51.2	64%	0.639	25%	0.247	S	C	*	.	H	α-helix	trans	-68.6	-26.3	-178.5	-61.6	-178.4	-179.5	179.3	0	113.2	W570 I571 W579	W570-K573 WeakPolarHBondContact O-CB 3.19Å; W570-K573 PolarHBondContact O-N 2.85Å; W570-K573 VanDerWaalsContact O-N 3.1Å; I571-K573 PolarHBondContact O-N 3.4Å; K573-W579 PolarHBondContact O-NE1 3.37Å
574	V	89.3	Confident	89.8	Confident	60 Å²	60	45 Å²	45	36%	0.364	21%	0.214	S	C	.	.	H	α-helix	trans	-102.7	-5	178.2	-59.9	0	0	0	0	113.1	F551 W570 I571 P572 L576	F551-V574 HydrophobicContact CE1-CG2 4.14Å; W570-V574 HydrophobicContact CE3-CG2 3.8Å; W570-V574 HydrophobicContact CZ3-CG2 3.81Å; W570-V574 PolarHBondContact O-N 3.01Å; I571-V574 VanDerWaalsContact O-CG2 3.28Å; I571-V574 WeakPolarHBondContact O-CG2 3.46Å; I571-V574 PolarHBondContact O-N 2.9Å; I571-V574 VanDerWaalsContact O-N 3.11Å; P572-V574 VanDerWaalsContact C-N 3.28Å; P572-V574 PolarHBondContact O-N 2.87Å; V574-L576 PolarHBondContact O-N 2.75Å
575	S	91.9	Very high	90.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.214	C	C	.	.			trans	-70.5	117.4	179.5	174.6	0	0	0	0	111.1	F551 I571 P572 I577 R578 W579	F551-S575 PolarHBondContact O-OG 3.31Å; F551-S575 VanDerWaalsContact O-OG 3.13Å; I571-S575 PolarHBondContact O-N 3.24Å; P572-S575 PolarHBondContact O-N 3.21Å; S575-I577 VanDerWaalsContact C-N 3.28Å; S575-I577 PolarHBondContact O-N 2.81Å; S575-I577 PolarHBondContact OG-N 3.33Å; S575-R578 PolarHBondContact O-N 3.17Å; S575-R578 PolarHBondContact OG-N 2.82Å; S575-W579 PolarHBondContact O-N 3.32Å
576	L	92.5	Very high	90.8	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-36.6	174.3	63.1	96.6	0	0	0	112.2	A441 E519 A522 A523 M526 M548 F551 V574 A580 I629	A441-L576 HydrophobicContact CB-CD1 3.56Å; E519-L576 HydrophobicContact CG-CD1 3.98Å; A522-L576 HydrophobicContact CB-CB 4.47Å; A523-L576 HydrophobicContact CB-CD1 4.21Å; A523-L576 HydrophobicContact CB-CD2 4.44Å; M526-L576 HydrophobicContact CE-CD2 4.34Å; M526-L576 HydrophobicContact SD-CD2 3.93Å; M548-L576 HydrophobicContact CE-CD1 4.28Å; M548-L576 HydrophobicContact CE-CD2 4.39Å; M548-L576 HydrophobicContact SD-CD1 4.39Å; F551-L576 HydrophobicContact CD2-CD2 4.08Å; F551-L576 HydrophobicContact CD2-CG 4.38Å; F551-L576 HydrophobicContact CE2-CD2 4.33Å; V574-L576 PolarHBondContact O-N 2.75Å; L576-A580 PolarHBondContact O-N 3.26Å; L576-I629 HydrophobicContact CB-CG2 4.31Å
577	I	93.8	Very high	91.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.8	-41.9	179.6	-66.1	179.3	0	0	0	110.4	Q434 A437 I438 A441 M548 F551 I552 S575 W579 A580 F581	Q434-I577 VanDerWaalsContact NE2-CG2 3.28Å; A437-I577 HydrophobicContact CB-CG2 4.29Å; I438-I577 HydrophobicContact CG1-CD1 4.25Å; I438-I577 HydrophobicContact CG1-CG2 4.34Å; A441-I577 HydrophobicContact CB-CG1 4.24Å; M548-I577 HydrophobicContact CG-CD1 4.34Å; M548-I577 HydrophobicContact SD-CD1 3.59Å; M548-I577 VanDerWaalsContact SD-CD1 3.59Å; M548-I577 HydrophobicContact SD-CG1 4.16Å; F551-I577 HydrophobicContact CB-CD1 4.35Å; I552-I577 HydrophobicContact CB-CD1 4.3Å; I552-I577 HydrophobicContact CG1-CD1 3.42Å; I552-I577 VanDerWaalsContact CG1-CD1 3.42Å; S575-I577 VanDerWaalsContact C-N 3.28Å; S575-I577 PolarHBondContact O-N 2.81Å; S575-I577 PolarHBondContact OG-N 3.33Å; I577-W579 PolarHBondContact O-N 2.74Å; I577-A580 PolarHBondContact O-N 3.04Å; I577-F581 VanDerWaalsContact O-CB 3.29Å; I577-F581 WeakPolarHBondContact O-CB 3.26Å; I577-F581 PolarHBondContact O-N 3.41Å
578	R	92.7	Very high	91.7	Very high	35 Å²	35	31.3 Å²	31.3	13%	0.132	13%	0.134	C	C	.	.	H	α-helix	trans	-58.6	-49.1	180	-175.7	-157.8	168.8	85.1	0.3	111.7	G555 P572 S575 A580 F581 Q582	G555-R578 VanDerWaalsContact O-CA 3.28Å; G555-R578 WeakPolarHBondContact O-CA 3.33Å; P572-R578 WeakPolarHBondContact O-CD 3.42Å; S575-R578 PolarHBondContact O-N 3.17Å; S575-R578 PolarHBondContact OG-N 2.82Å; R578-A580 VanDerWaalsContact C-N 3.32Å; R578-A580 PolarHBondContact O-N 3.18Å; R578-F581 PolarHBondContact O-N 2.74Å; R578-Q582 WeakPolarHBondContact O-CB 3.1Å; R578-Q582 PolarHBondContact O-N 3.45Å
579	W	93.6	Very high	92	Very high	49 Å²	49	27.1 Å²	27.1	19%	0.186	12%	0.116	C	C	.	.	H	α-helix	trans	-68.5	-33.9	-177.7	-67.2	110.9	0	0	0	112.4	K573 S575 I577 G583 T622 A625 Q626 I629	K573-W579 PolarHBondContact O-NE1 3.37Å; S575-W579 PolarHBondContact O-N 3.32Å; I577-W579 PolarHBondContact O-N 2.74Å; W579-G583 PolarHBondContact O-N 3.17Å; W579-T622 HydrophobicContact CE3-CG2 4.23Å; W579-A625 HydrophobicContact CB-CB 4.49Å; W579-A625 HydrophobicContact CD2-CB 3.45Å; W579-A625 VanDerWaalsContact CD2-CB 3.45Å; W579-A625 HydrophobicContact CE3-CB 3.74Å; W579-A625 HydrophobicContact CG-CB 3.8Å; W579-A625 HydrophobicContact CH2-CB 4.31Å; W579-A625 HydrophobicContact CZ2-CB 4.07Å; W579-A625 HydrophobicContact CZ3-CB 4.16Å; W579-Q626 HydrophobicContact CB-CG 3.86Å; W579-I629 HydrophobicContact CG-CD1 4.42Å
580	A	95.4	Very high	92.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.1	-55.5	172.3	0	0	0	0	0	111.6	A437 I515 E519 L576 I577 R578 Q582 G583 L584 Q626	A437-A580 HydrophobicContact CB-CB 4.1Å; I515-A580 HydrophobicContact CG2-CB 4.37Å; E519-A580 HydrophobicContact CB-CB 3.98Å; E519-A580 HydrophobicContact CG-CB 3.84Å; E519-A580 WeakPolarHBondContact OE1-CB 3.49Å; E519-A580 WeakPolarHBondContact OE2-CB 3.31Å; L576-A580 PolarHBondContact O-N 3.26Å; I577-A580 PolarHBondContact O-N 3.04Å; R578-A580 VanDerWaalsContact C-N 3.32Å; R578-A580 PolarHBondContact O-N 3.18Å; A580-Q582 VanDerWaalsContact C-N 3.29Å; A580-Q582 PolarHBondContact O-N 3.47Å; A580-G583 PolarHBondContact O-N 2.84Å; A580-G583 VanDerWaalsContact O-N 3.14Å; A580-L584 WeakPolarHBondContact O-CB 3.48Å; A580-L584 VanDerWaalsContact O-CG 3.23Å; A580-L584 WeakPolarHBondContact O-CG 3.3Å; A580-L584 PolarHBondContact O-N 2.61Å; A580-Q626 VanDerWaalsContact CB-NE2 3.26Å
581	F	95.2	Very high	92.3	Very high	6 Å²	6	24 Å²	24	3%	0.026	12%	0.124	C	C	.	.	H	α-helix	trans	-53.7	-47.3	178	173	-113.5	0	0	0	111.7	M430 L433 Q434 Y557 I577 R578 G583 L584 C585	M430-F581 HydrophobicContact CB-CZ 4.42Å; M430-F581 WeakPolarHBondContact O-CE2 3.48Å; M430-F581 HydrophobicContact SD-CZ 4.31Å; L433-F581 HydrophobicContact CB-CD2 4.2Å; L433-F581 HydrophobicContact CB-CE2 4.24Å; Q434-F581 HydrophobicContact CB-CD2 3.86Å; Q434-F581 HydrophobicContact CB-CE2 3.86Å; Y557-F581 HydrophobicContact CD2-CZ 4.21Å; I577-F581 VanDerWaalsContact O-CB 3.29Å; I577-F581 WeakPolarHBondContact O-CB 3.26Å; I577-F581 PolarHBondContact O-N 3.41Å; R578-F581 PolarHBondContact O-N 2.74Å; F581-G583 PolarHBondContact O-N 2.87Å; F581-L584 WeakPolarHBondContact O-CB 3.41Å; F581-L584 PolarHBondContact O-N 3.18Å; F581-C585 WeakPolarHBondContact CE2-SG 3.32Å; F581-C585 WeakPolarHBondContact CZ-SG 3.49Å; F581-C585 WeakPolarHBondContact O-CB 3.48Å; F581-C585 PolarHBondContact O-N 2.88Å; F581-C585 PolarHBondContact O-SG 3.14Å; F581-C585 VanDerWaalsContact O-SG 3.37Å
582	Q	93.3	Very high	92.4	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-62.1	-46	178.1	178.1	164.9	4.5	0	0	112.5	R578 A580 L584 C585 I586 L614 T622	R578-Q582 WeakPolarHBondContact O-CB 3.1Å; R578-Q582 PolarHBondContact O-N 3.45Å; A580-Q582 VanDerWaalsContact C-N 3.29Å; A580-Q582 PolarHBondContact O-N 3.47Å; Q582-L584 VanDerWaalsContact C-N 3.29Å; Q582-L584 PolarHBondContact O-N 3.34Å; Q582-C585 PolarHBondContact O-N 2.94Å; Q582-I586 HydrophobicContact CG-CD1 3.86Å; Q582-I586 WeakPolarHBondContact O-CD1 3.47Å; Q582-I586 VanDerWaalsContact O-CG1 3.28Å; Q582-I586 WeakPolarHBondContact O-CG1 3.38Å; Q582-I586 PolarHBondContact O-N 3.03Å; Q582-L614 HydrophobicContact CB-CD2 4.21Å; Q582-L614 HydrophobicContact CG-CD2 3.69Å; Q582-T622 HydrophobicContact CB-CG2 4.49Å; Q582-T622 HydrophobicContact CG-CG2 4.03Å
583	G	95.1	Very high	92.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.4	-40.1	176.5	0	0	0	0	0	112.1	W579 A580 F581 N587 T622	W579-G583 PolarHBondContact O-N 3.17Å; A580-G583 PolarHBondContact O-N 2.84Å; A580-G583 VanDerWaalsContact O-N 3.14Å; F581-G583 PolarHBondContact O-N 2.87Å; G583-N587 VanDerWaalsContact O-CB 3.28Å; G583-N587 WeakPolarHBondContact O-CB 3.32Å; G583-N587 PolarHBondContact O-N 3.48Å; G583-T622 WeakPolarHBondContact CA-OG1 3.34Å
584	L	95.7	Very high	92.9	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-63.4	-46.4	175.6	-72	176.6	0	0	0	111.7	L433 T436 A437 F512 I515 V516 A580 F581 Q582 N587 E588	L433-L584 HydrophobicContact CB-CB 4.17Å; L433-L584 HydrophobicContact CB-CD1 4.46Å; L433-L584 HydrophobicContact CD1-CB 4.18Å; L433-L584 HydrophobicContact CD2-CB 4.06Å; L433-L584 HydrophobicContact CG-CB 4.34Å; T436-L584 HydrophobicContact CG2-CD1 4.18Å; A437-L584 HydrophobicContact CB-CD1 4.41Å; F512-L584 HydrophobicContact CB-CD2 4.48Å; F512-L584 HydrophobicContact CD2-CD2 3.39Å; F512-L584 HydrophobicContact CE2-CD2 3.79Å; F512-L584 HydrophobicContact CG-CD2 4.08Å; I515-L584 HydrophobicContact CB-CD2 4.29Å; I515-L584 HydrophobicContact CD1-CD2 4.46Å; I515-L584 HydrophobicContact CG2-CD2 4.17Å; I515-L584 HydrophobicContact CG2-CG 4.03Å; V516-L584 HydrophobicContact CG2-CD1 4.3Å; V516-L584 HydrophobicContact CG2-CD2 4.03Å; A580-L584 WeakPolarHBondContact O-CB 3.48Å; A580-L584 VanDerWaalsContact O-CG 3.23Å; A580-L584 WeakPolarHBondContact O-CG 3.3Å; A580-L584 PolarHBondContact O-N 2.61Å; F581-L584 WeakPolarHBondContact O-CB 3.41Å; F581-L584 PolarHBondContact O-N 3.18Å; Q582-L584 VanDerWaalsContact C-N 3.29Å; Q582-L584 PolarHBondContact O-N 3.34Å; L584-N587 PolarHBondContact O-N 2.85Å; L584-E588 WeakPolarHBondContact O-CB 3.36Å; L584-E588 PolarHBondContact O-N 3.02Å
585	C	94.6	Very high	92.8	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.007	13%	0.133	C	C	.	.	H	α-helix	trans	-61.8	-46.9	177.4	-74.9	0	0	0	0	111.8	F581 Q582 N587 E588 F589 L609 L614	F581-C585 WeakPolarHBondContact CE2-SG 3.32Å; F581-C585 WeakPolarHBondContact CZ-SG 3.49Å; F581-C585 WeakPolarHBondContact O-CB 3.48Å; F581-C585 PolarHBondContact O-N 2.88Å; F581-C585 PolarHBondContact O-SG 3.14Å; F581-C585 VanDerWaalsContact O-SG 3.37Å; Q582-C585 PolarHBondContact O-N 2.94Å; C585-N587 VanDerWaalsContact C-N 3.25Å; C585-N587 PolarHBondContact O-N 3.23Å; C585-E588 PolarHBondContact O-N 3.43Å; C585-E588 VanDerWaalsContact O-N 3.15Å; C585-F589 HydrophobicContact CB-CD2 4.08Å; C585-F589 HydrophobicContact CB-CE2 4.38Å; C585-F589 WeakPolarHBondContact O-CB 3.2Å; C585-F589 WeakPolarHBondContact O-CD2 3.4Å; C585-F589 PolarHBondContact O-N 2.84Å; C585-L609 HydrophobicContact CB-CD2 4.16Å; C585-L614 HydrophobicContact CB-CD1 3.71Å
586	I	93.7	Very high	92.4	Very high	7 Å²	7	30.9 Å²	30.9	4%	0.036	15%	0.153	C	C	.	.	H	α-helix	trans	-62.2	-38.2	177.3	-63.3	159.6	0	0	0	110.6	Q582 E588 K590 L609 I617 I619 T622	Q582-I586 HydrophobicContact CG-CD1 3.86Å; Q582-I586 WeakPolarHBondContact O-CD1 3.47Å; Q582-I586 VanDerWaalsContact O-CG1 3.28Å; Q582-I586 WeakPolarHBondContact O-CG1 3.38Å; Q582-I586 PolarHBondContact O-N 3.03Å; I586-E588 VanDerWaalsContact C-N 3.34Å; I586-K590 VanDerWaalsContact O-CB 3.31Å; I586-K590 WeakPolarHBondContact O-CB 3.49Å; I586-L609 HydrophobicContact CG1-CD2 4.25Å; I586-I617 HydrophobicContact CD1-CB 4Å; I586-I617 HydrophobicContact CD1-CG2 3.92Å; I586-I617 WeakPolarHBondContact CD1-O 3.25Å; I586-I619 HydrophobicContact CB-CG1 4.15Å; I586-I619 HydrophobicContact CG2-CD1 4.29Å; I586-I619 HydrophobicContact CG2-CG1 3.64Å; I586-T622 HydrophobicContact CD1-CG2 4.17Å
587	N	95.3	Very high	91.7	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-67	-35.4	176.7	-172.9	53.7	0	0	0	112.2	R508 K511 I515 G583 L584 C585 I619	R508-N587 VanDerWaalsContact CD-O 3.25Å; R508-N587 WeakPolarHBondContact CD-O 3.17Å; R508-N587 WeakPolarHBondContact CD-OD1 3.34Å; R508-N587 PolarHBondContact NH1-O 3.16Å; R508-N587 PolarHBondContact O-ND2 3.18Å; K511-N587 WeakPolarHBondContact CB-OD1 3.48Å; K511-N587 WeakPolarHBondContact CD-OD1 3.39Å; I515-N587 HydrophobicContact CD1-CB 4.44Å; G583-N587 VanDerWaalsContact O-CB 3.28Å; G583-N587 WeakPolarHBondContact O-CB 3.32Å; G583-N587 PolarHBondContact O-N 3.48Å; L584-N587 PolarHBondContact O-N 2.85Å; C585-N587 VanDerWaalsContact C-N 3.25Å; C585-N587 PolarHBondContact O-N 3.23Å; N587-I619 HydrophobicContact CB-CD1 3.93Å
588	E	94.8	Very high	91.3	Very high	3 Å²	3	42.8 Å²	42.8	1%	0.014	21%	0.209	C	C	.	.	H	α-helix	trans	-84.8	-52.8	-177.6	-177.3	55.7	-160.9	0	0	113	R429 L433 L502 H503 L584 C585 I586 L592	R429-E588 IonicContact CZ-OE1 2.6Å; R429-E588 IonicContact NH1-OE1 2.74Å; R429-E588 PolarHBondContact NH1-OE1 3.13Å; L433-E588 HydrophobicContact CD1-CB 3.9Å; L433-E588 HydrophobicContact CD1-CG 4.36Å; L502-E588 WeakPolarHBondContact CB-OE2 3.41Å; L502-E588 HydrophobicContact CD2-CG 3.83Å; L502-E588 WeakPolarHBondContact CD2-OE1 3.29Å; H503-E588 PolarHBondContact N-OE1 2.68Å; H503-E588 PolarHBondContact N-OE2 2.94Å; H503-E588 VanDerWaalsContact N-OE2 3.14Å; L584-E588 WeakPolarHBondContact O-CB 3.36Å; L584-E588 PolarHBondContact O-N 3.02Å; C585-E588 PolarHBondContact O-N 3.43Å; C585-E588 VanDerWaalsContact O-N 3.15Å; I586-E588 VanDerWaalsContact C-N 3.34Å; E588-L592 HydrophobicContact CG-CD1 4.25Å; E588-L592 WeakPolarHBondContact O-CD1 3.34Å
589	F	93.8	Very high	90.6	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.009	24%	0.241	C	C	.	.	H	α-helix	trans	-72.7	-32.9	-169.5	-75	-75.3	0	0	0	114	I426 R429 M430 C585 G591 L592 F594 G605 A608 L609	I426-F589 HydrophobicContact CB-CE1 4.43Å; I426-F589 HydrophobicContact CG2-CE1 3.88Å; I426-F589 HydrophobicContact CG2-CZ 4.11Å; R429-F589 HydrophobicContact CB-CE1 4.4Å; R429-F589 HydrophobicContact CB-CZ 3.85Å; M430-F589 HydrophobicContact CG-CE2 3.85Å; M430-F589 HydrophobicContact CG-CZ 3.82Å; C585-F589 HydrophobicContact CB-CD2 4.08Å; C585-F589 HydrophobicContact CB-CE2 4.38Å; C585-F589 WeakPolarHBondContact O-CB 3.2Å; C585-F589 WeakPolarHBondContact O-CD2 3.4Å; C585-F589 PolarHBondContact O-N 2.84Å; F589-G591 PolarHBondContact O-N 3.06Å; F589-G591 VanDerWaalsContact O-N 3.12Å; F589-L592 WeakPolarHBondContact O-CB 3.37Å; F589-L592 PolarHBondContact O-N 3.37Å; F589-F594 AromaticContact CD1-CE2 3.99Å; F589-F594 HydrophobicContact CD1-CE2 3.99Å; F589-F594 AromaticContact CD1-CZ 3.74Å; F589-F594 HydrophobicContact CD1-CZ 3.74Å; F589-F594 HydrophobicContact CE1-CE2 4.29Å; F589-F594 AromaticContact CE1-CZ 3.72Å; F589-F594 HydrophobicContact CE1-CZ 3.72Å; F589-G605 VanDerWaalsContact O-CA 3.3Å; F589-G605 WeakPolarHBondContact O-CA 3.21Å; F589-A608 HydrophobicContact CD1-CB 4Å; F589-A608 HydrophobicContact CE1-CB 4.33Å; F589-L609 HydrophobicContact CB-CD1 4.03Å; F589-L609 HydrophobicContact CB-CD2 4.08Å; F589-L609 HydrophobicContact CB-CG 3.8Å; F589-L609 HydrophobicContact CD2-CD2 4.33Å
590	K	90.6	Very high	90.1	Very high	118 Å²	118	52.3 Å²	52.3	51%	0.513	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	119.8	-174.8	-174.1	173.2	-173.9	170.2	0	111.6	R508 I586	R508-K590 PolarHBondContact NH2-O 3.35Å; I586-K590 VanDerWaalsContact O-CB 3.31Å; I586-K590 WeakPolarHBondContact O-CB 3.49Å
591	G	87.9	Confident	89.7	Confident	53 Å²	53	53.5 Å²	53.5	55%	0.546	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	5.8	-177.5	0	0	0	0	0	115.7	F589 E606	F589-G591 PolarHBondContact O-N 3.06Å; F589-G591 VanDerWaalsContact O-N 3.12Å; G591-E606 PolarHBondContact N-OE1 3.43Å
592	L	90.7	Very high	89.3	Confident	13 Å²	13	54 Å²	54	7%	0.068	27%	0.272	C	S	.	.			trans	-82.1	146.2	170.5	-81.2	170.5	0	0	0	111.1	E588 F589 F594 G605	E588-L592 HydrophobicContact CG-CD1 4.25Å; E588-L592 WeakPolarHBondContact O-CD1 3.34Å; F589-L592 WeakPolarHBondContact O-CB 3.37Å; F589-L592 PolarHBondContact O-N 3.37Å; L592-F594 HydrophobicContact CB-CE2 4Å; L592-F594 HydrophobicContact CB-CZ 4.07Å; L592-F594 HydrophobicContact CD1-CZ 4.2Å; L592-G605 PolarHBondContact O-N 2.97Å
593	Q	91	Very high	89	Confident	139 Å²	139	57.9 Å²	57.9	65%	0.65	29%	0.291	S	S	*	.	B	Isolated β-bridge	trans	-117.8	138.8	169.4	-69.8	-175.8	-13	0	0	109.2	K421 Q603	K421-Q593 WeakPolarHBondContact CD-O 3.28Å; Q593-Q603 WeakPolarHBondContact CA-O 3.49Å
594	F	90.4	Very high	88.8	Confident	15 Å²	15	59.6 Å²	59.6	7%	0.066	30%	0.301	C	S	.	.			trans	-114.3	153.6	-179.4	-63	-82.1	0	0	0	110.5	K421 I426 F589 L592 Q603	K421-F594 HydrophobicContact CB-CD1 4.48Å; K421-F594 CarbonylContact O-C 3.48Å; K421-F594 VanDerWaalsContact O-CA 3.29Å; K421-F594 WeakPolarHBondContact O-CA 3.01Å; K421-F594 WeakPolarHBondContact O-CB 3.29Å; K421-F594 WeakPolarHBondContact O-CD1 3.24Å; I426-F594 HydrophobicContact CD1-CD1 4.19Å; I426-F594 HydrophobicContact CD1-CD2 4.06Å; I426-F594 HydrophobicContact CD1-CE1 4.47Å; I426-F594 HydrophobicContact CD1-CE2 4.35Å; I426-F594 HydrophobicContact CD1-CG 3.99Å; I426-F594 HydrophobicContact CG1-CD1 3.65Å; I426-F594 HydrophobicContact CG1-CD2 4.15Å; I426-F594 HydrophobicContact CG1-CE1 3.57Å; I426-F594 HydrophobicContact CG1-CE2 4.08Å; I426-F594 HydrophobicContact CG1-CG 3.96Å; I426-F594 HydrophobicContact CG1-CZ 3.81Å; F589-F594 AromaticContact CD1-CE2 3.99Å; F589-F594 HydrophobicContact CD1-CE2 3.99Å; F589-F594 AromaticContact CD1-CZ 3.74Å; F589-F594 HydrophobicContact CD1-CZ 3.74Å; F589-F594 HydrophobicContact CE1-CE2 4.29Å; F589-F594 AromaticContact CE1-CZ 3.72Å; F589-F594 HydrophobicContact CE1-CZ 3.72Å; L592-F594 HydrophobicContact CB-CE2 4Å; L592-F594 HydrophobicContact CB-CZ 4.07Å; L592-F594 HydrophobicContact CD1-CZ 4.2Å; F594-Q603 PolarHBondContact N-O 3.43Å
595	E	87.8	Confident	88.6	Confident	110 Å²	110	59.5 Å²	59.5	51%	0.514	30%	0.301	S	S	.	.			trans	-68.2	132.5	177.3	-68.4	168.6	-161.9	0	0	110.1	K421 Q423	K421-E595 PolarHBondContact O-N 3.25Å; Q423-E595 PolarHBondContact NE2-O 2.83Å
596	Q	82.1	Confident	88.4	Confident	92 Å²	92	63.2 Å²	63.2	43%	0.43	32%	0.318	S	S	.	.			trans	-105.3	120.5	178.5	-169.3	-172	12.5	0	0	109.3	H598 D601 Q603	Q596-H598 WeakPolarHBondContact CG-O 3.38Å; Q596-H598 PolarHBondContact NE2-O 2.94Å; Q596-H598 VanDerWaalsContact NE2-O 3.12Å; Q596-D601 HydrophobicContact CG-CB 4.02Å; Q596-Q603 HydrophobicContact CB-CG 4.26Å; Q596-Q603 HydrophobicContact CG-CG 4.2Å
597	Q	78.8	Confident	88.2	Confident	160 Å²	160	66.7 Å²	66.7	75%	0.748	33%	0.334	S	S	*	.	S	Bend	trans	-105.2	-31.5	170.6	-70.5	-174.9	-11.3	0	0	111.5	D601	Q597-D601 PolarHBondContact N-OD2 3.39Å
598	H	84	Confident	87.9	Confident	93 Å²	93	66.7 Å²	66.7	43%	0.431	33%	0.334	S	S	.	.	S	Bend	trans	-125.3	157.4	179.9	-61.5	-43.6	0	0	0	112.3	Q596 Y600 D601	Q596-H598 WeakPolarHBondContact CG-O 3.38Å; Q596-H598 PolarHBondContact NE2-O 2.94Å; Q596-H598 VanDerWaalsContact NE2-O 3.12Å; H598-Y600 HydrophobicContact CB-CD1 4.01Å; H598-Y600 HydrophobicContact CB-CD2 4.32Å; H598-Y600 HydrophobicContact CB-CE1 3.59Å; H598-Y600 HydrophobicContact CB-CE2 3.93Å; H598-Y600 HydrophobicContact CB-CG 4.36Å; H598-Y600 AromaticContact CD2-CZ 3.7Å; H598-Y600 PolarHBondContact CD2-OH 3.45Å; H598-Y600 AromaticContact CG-CZ 3.78Å; H598-Y600 PolarHBondContact O-N 2.94Å; H598-D601 PolarHBondContact N-OD2 3.05Å; H598-D601 WeakPolarHBondContact O-CB 3.45Å; H598-D601 PolarHBondContact O-N 2.94Å; H598-D601 VanDerWaalsContact O-N 3.11Å
599	S	79.9	Confident	87.6	Confident	114 Å²	114	67.1 Å²	67.1	80%	0.797	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.8	-177.9	54.9	0	0	0	0	113.6
600	Y	82.8	Confident	87.3	Confident	170 Å²	170	73.4 Å²	73.4	67%	0.667	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	2.7	179.3	54.9	-99.3	0	0	0	114	H598	H598-Y600 HydrophobicContact CB-CD1 4.01Å; H598-Y600 HydrophobicContact CB-CD2 4.32Å; H598-Y600 HydrophobicContact CB-CE1 3.59Å; H598-Y600 HydrophobicContact CB-CE2 3.93Å; H598-Y600 HydrophobicContact CB-CG 4.36Å; H598-Y600 AromaticContact CD2-CZ 3.7Å; H598-Y600 PolarHBondContact CD2-OH 3.45Å; H598-Y600 AromaticContact CG-CZ 3.78Å; H598-Y600 PolarHBondContact O-N 2.94Å
601	D	86.3	Confident	87	Confident	25 Å²	25	75.9 Å²	75.9	13%	0.134	37%	0.372	C	S	.	.	S	Bend	trans	-73.8	148.4	178.3	-73.4	-15.2	0	0	0	111.6	Q423 Q596 Q597 H598 Q603	Q423-D601 HydrophobicContact CG-CB 4.16Å; Q596-D601 HydrophobicContact CG-CB 4.02Å; Q597-D601 PolarHBondContact N-OD2 3.39Å; H598-D601 PolarHBondContact N-OD2 3.05Å; H598-D601 WeakPolarHBondContact O-CB 3.45Å; H598-D601 PolarHBondContact O-N 2.94Å; H598-D601 VanDerWaalsContact O-N 3.11Å; D601-Q603 PolarHBondContact O-N 3.13Å
602	I	86.3	Confident	86.6	Confident	15 Å²	15	76.7 Å²	76.7	8%	0.077	36%	0.361	C	S	.	.			trans	-73.9	116.3	177.8	-59.7	172.5	0	0	0	108.1	Q423 I426 T604 Q607 A608	Q423-I602 PolarHBondContact NE2-O 2.94Å; I426-I602 HydrophobicContact CD1-CB 3.86Å; I426-I602 HydrophobicContact CD1-CD1 4.03Å; I426-I602 HydrophobicContact CD1-CG2 3.99Å; I602-T604 VanDerWaalsContact CG2-O 3.29Å; I602-T604 WeakPolarHBondContact CG2-O 3.41Å; I602-Q607 HydrophobicContact CG2-CB 3.82Å; I602-A608 HydrophobicContact CG2-CB 3.95Å
603	Q	87.5	Confident	86.2	Confident	83 Å²	83	78.4 Å²	78.4	39%	0.388	37%	0.374	S	S	.	.			trans	-88.3	-37.2	-179.5	-72.6	179.1	-5.5	0	0	112.5	Q593 F594 Q596 D601	Q593-Q603 WeakPolarHBondContact CA-O 3.49Å; F594-Q603 PolarHBondContact N-O 3.43Å; Q596-Q603 HydrophobicContact CB-CG 4.26Å; Q596-Q603 HydrophobicContact CG-CG 4.2Å; D601-Q603 PolarHBondContact O-N 3.13Å
604	T	91.4	Very high	85.7	Confident	36 Å²	36	72.4 Å²	72.4	22%	0.221	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-119.2	150.7	-172.5	67.2	0	0	0	0	111.6	I602 E606 Q607 A608	I602-T604 VanDerWaalsContact CG2-O 3.29Å; I602-T604 WeakPolarHBondContact CG2-O 3.41Å; T604-E606 PolarHBondContact O-N 2.9Å; T604-Q607 WeakPolarHBondContact O-CB 3.14Å; T604-Q607 PolarHBondContact O-N 3.02Å; T604-Q607 VanDerWaalsContact O-N 3.16Å; T604-Q607 WeakPolarHBondContact OG1-CG 3.43Å; T604-Q607 PolarHBondContact OG1-N 3.48Å; T604-A608 PolarHBondContact O-N 3.46Å
605	G	90.1	Very high	84.9	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-66	-23.3	173.7	0	0	0	0	0	113.1	F589 L592 A608 L609	F589-G605 VanDerWaalsContact O-CA 3.3Å; F589-G605 WeakPolarHBondContact O-CA 3.21Å; L592-G605 PolarHBondContact O-N 2.97Å; G605-A608 WeakPolarHBondContact O-CB 3.41Å; G605-A608 PolarHBondContact O-N 2.95Å; G605-L609 VanDerWaalsContact O-CG 3.29Å; G605-L609 WeakPolarHBondContact O-CG 3.26Å; G605-L609 PolarHBondContact O-N 3.29Å
606	E	90.8	Very high	84.4	Confident	78 Å²	78	72.1 Å²	72.1	36%	0.364	38%	0.377	S	S	.	.	H	α-helix	trans	-63.5	-45.3	169.4	-69	70.5	-156	0	0	111.5	G591 T604 A608 L609 E610	G591-E606 PolarHBondContact N-OE1 3.43Å; T604-E606 PolarHBondContact O-N 2.9Å; E606-A608 VanDerWaalsContact C-N 3.3Å; E606-A608 PolarHBondContact O-N 3.32Å; E606-L609 PolarHBondContact O-N 3.11Å; E606-E610 PolarHBondContact O-N 3.09Å
607	Q	89.5	Confident	84.4	Confident	81 Å²	81	70.7 Å²	70.7	38%	0.379	37%	0.372	S	S	.	.	H	α-helix	trans	-62.8	-38.2	173.2	-75	172.5	-7.2	0	0	111.5	I602 T604 E610 R611	I602-Q607 HydrophobicContact CG2-CB 3.82Å; T604-Q607 WeakPolarHBondContact O-CB 3.14Å; T604-Q607 PolarHBondContact O-N 3.02Å; T604-Q607 VanDerWaalsContact O-N 3.16Å; T604-Q607 WeakPolarHBondContact OG1-CG 3.43Å; T604-Q607 PolarHBondContact OG1-N 3.48Å; Q607-E610 PolarHBondContact O-N 2.62Å; Q607-R611 WeakPolarHBondContact O-CB 3.42Å; Q607-R611 PolarHBondContact O-N 3.25Å
608	A	89.4	Confident	84.8	Confident	0 Å²	0	72 Å²	72	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-59.5	-48.2	173.4	0	0	0	0	0	110.9	I426 F589 I602 T604 G605 E606 E610 R611 F612	I426-A608 HydrophobicContact CG2-CB 4.33Å; F589-A608 HydrophobicContact CD1-CB 4Å; F589-A608 HydrophobicContact CE1-CB 4.33Å; I602-A608 HydrophobicContact CG2-CB 3.95Å; T604-A608 PolarHBondContact O-N 3.46Å; G605-A608 WeakPolarHBondContact O-CB 3.41Å; G605-A608 PolarHBondContact O-N 2.95Å; E606-A608 VanDerWaalsContact C-N 3.3Å; E606-A608 PolarHBondContact O-N 3.32Å; A608-E610 PolarHBondContact O-N 3.23Å; A608-R611 PolarHBondContact O-N 2.76Å; A608-F612 WeakPolarHBondContact O-CD2 3.28Å; A608-F612 PolarHBondContact O-N 3.04Å
609	L	89.9	Confident	85	Confident	12 Å²	12	68.9 Å²	68.9	6%	0.063	36%	0.356	C	S	.	.	H	α-helix	trans	-62.6	-41.2	178.6	-71.4	168.9	0	0	0	112.5	C585 I586 F589 G605 E606 F612 S613 L614 G615	C585-L609 HydrophobicContact CB-CD2 4.16Å; I586-L609 HydrophobicContact CG1-CD2 4.25Å; F589-L609 HydrophobicContact CB-CD1 4.03Å; F589-L609 HydrophobicContact CB-CD2 4.08Å; F589-L609 HydrophobicContact CB-CG 3.8Å; F589-L609 HydrophobicContact CD2-CD2 4.33Å; G605-L609 VanDerWaalsContact O-CG 3.29Å; G605-L609 WeakPolarHBondContact O-CG 3.26Å; G605-L609 PolarHBondContact O-N 3.29Å; E606-L609 PolarHBondContact O-N 3.11Å; L609-F612 PolarHBondContact O-N 3.3Å; L609-S613 PolarHBondContact O-N 3.37Å; L609-L614 HydrophobicContact CB-CB 4.36Å; L609-L614 HydrophobicContact CD2-CB 3.88Å; L609-L614 HydrophobicContact CD2-CD1 4.18Å; L609-L614 CarbonylContact O-C 3.53Å; L609-L614 WeakPolarHBondContact O-CA 3.45Å; L609-L614 WeakPolarHBondContact O-CB 3.37Å; L609-L614 PolarHBondContact O-N 3.37Å; L609-G615 PolarHBondContact O-N 2.65Å
610	E	86.4	Confident	85.6	Confident	134 Å²	134	66.2 Å²	66.2	63%	0.626	34%	0.341	S	S	*	.	H	α-helix	trans	-62.7	-43.7	175.8	-77.2	-177.2	175	0	0	112.1	E606 Q607 A608 F612 S613	E606-E610 PolarHBondContact O-N 3.09Å; Q607-E610 PolarHBondContact O-N 2.62Å; A608-E610 PolarHBondContact O-N 3.23Å; E610-F612 PolarHBondContact O-N 3.27Å; E610-S613 PolarHBondContact O-N 3.36Å
611	R	84	Confident	86	Confident	170 Å²	170	62.1 Å²	62.1	64%	0.642	33%	0.33	S	S	*	.	H	α-helix	trans	-58.3	-33.2	177.7	-176.6	176.8	179.4	150.1	-1.5	112.9	Q607 A608 S613	Q607-R611 WeakPolarHBondContact O-CB 3.42Å; Q607-R611 PolarHBondContact O-N 3.25Å; A608-R611 PolarHBondContact O-N 2.76Å; R611-S613 VanDerWaalsContact C-N 3.33Å
612	F	79.9	Confident	86.2	Confident	71 Å²	71	60.9 Å²	60.9	31%	0.311	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	13.2	178.4	-61.8	-61.2	0	0	0	113.6	I426 M430 A608 L609 E610 L614	I426-F612 HydrophobicContact CG2-CE2 4.08Å; M430-F612 HydrophobicContact CE-CD1 4Å; M430-F612 HydrophobicContact CE-CD2 4.15Å; M430-F612 HydrophobicContact CE-CE1 3.35Å; M430-F612 HydrophobicContact CE-CE2 3.56Å; M430-F612 HydrophobicContact CE-CG 4.38Å; M430-F612 HydrophobicContact CE-CZ 3.12Å; M430-F612 HydrophobicContact SD-CD1 4Å; M430-F612 HydrophobicContact SD-CD2 3.5Å; M430-F612 VanDerWaalsContact SD-CD2 3.5Å; M430-F612 HydrophobicContact SD-CE1 3.92Å; M430-F612 HydrophobicContact SD-CE2 3.44Å; M430-F612 WeakPolarHBondContact SD-CE2 3.16Å; M430-F612 HydrophobicContact SD-CG 3.83Å; M430-F612 HydrophobicContact SD-CZ 3.67Å; A608-F612 WeakPolarHBondContact O-CD2 3.28Å; A608-F612 PolarHBondContact O-N 3.04Å; L609-F612 PolarHBondContact O-N 3.3Å; E610-F612 PolarHBondContact O-N 3.27Å; F612-L614 HydrophobicContact CB-CD1 4.26Å; F612-L614 HydrophobicContact CB-CG 4.13Å; F612-L614 WeakPolarHBondContact O-CG 3.45Å; F612-L614 PolarHBondContact O-N 3.09Å
613	S	81.8	Confident	86.5	Confident	49 Å²	49	63.3 Å²	63.3	34%	0.343	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	31.1	-177.8	-52.6	0	0	0	0	112.8	D562 L609 E610 R611	D562-S613 PolarHBondContact OD2-OG 3.44Å; L609-S613 PolarHBondContact O-N 3.37Å; E610-S613 PolarHBondContact O-N 3.36Å; R611-S613 VanDerWaalsContact C-N 3.33Å
614	L	81.3	Confident	86.8	Confident	13 Å²	13	63 Å²	63	7%	0.068	34%	0.34	C	S	.	.			trans	-107.2	-1.1	177.2	-58.4	-176.6	0	0	0	112.8	Q582 C585 L609 F612	Q582-L614 HydrophobicContact CB-CD2 4.21Å; Q582-L614 HydrophobicContact CG-CD2 3.69Å; C585-L614 HydrophobicContact CB-CD1 3.71Å; L609-L614 HydrophobicContact CB-CB 4.36Å; L609-L614 HydrophobicContact CD2-CB 3.88Å; L609-L614 HydrophobicContact CD2-CD1 4.18Å; L609-L614 CarbonylContact O-C 3.53Å; L609-L614 WeakPolarHBondContact O-CA 3.45Å; L609-L614 WeakPolarHBondContact O-CB 3.37Å; L609-L614 PolarHBondContact O-N 3.37Å; F612-L614 HydrophobicContact CB-CD1 4.26Å; F612-L614 HydrophobicContact CB-CG 4.13Å; F612-L614 WeakPolarHBondContact O-CG 3.45Å; F612-L614 PolarHBondContact O-N 3.09Å
615	G	74.2	Confident	86.9	Confident	31 Å²	31	61.9 Å²	61.9	32%	0.32	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	147.2	178.5	0	0	0	0	0	113.4	L609 I617	L609-G615 PolarHBondContact O-N 2.65Å; G615-I617 VanDerWaalsContact C-N 3.27Å; G615-I617 PolarHBondContact O-N 3.15Å
616	G	76.7	Confident	87.1	Confident	88 Å²	88	61.9 Å²	61.9	91%	0.907	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	-5.3	174.3	0	0	0	0	0	116.7
617	I	81.7	Confident	87.3	Confident	62 Å²	62	59.4 Å²	59.4	32%	0.318	33%	0.33	S	S	.	.			trans	-94.4	138.7	-174.9	-62.3	167.7	0	0	0	110.3	I586 G615 D621 T622	I586-I617 HydrophobicContact CD1-CB 4Å; I586-I617 HydrophobicContact CD1-CG2 3.92Å; I586-I617 WeakPolarHBondContact CD1-O 3.25Å; G615-I617 VanDerWaalsContact C-N 3.27Å; G615-I617 PolarHBondContact O-N 3.15Å; I617-D621 HydrophobicContact CG2-CB 4.33Å; I617-T622 HydrophobicContact CG2-CG2 4.28Å
618	R	87.8	Confident	87.6	Confident	187 Å²	187	64.2 Å²	64.2	71%	0.706	34%	0.344	S	S	*	.			trans	-93.9	149.6	-179.7	-57.4	178	178	-180	-0.5	110.6	A620 D621 T622	R618-A620 PolarHBondContact O-N 3.42Å; R618-D621 WeakPolarHBondContact CB-OD2 3.45Å; R618-D621 PolarHBondContact N-OD2 2.99Å; R618-D621 VanDerWaalsContact N-OD2 3.11Å; R618-D621 WeakPolarHBondContact O-CB 3.49Å; R618-D621 PolarHBondContact O-N 3.25Å; R618-T622 PolarHBondContact O-N 2.99Å
619	I	88.9	Confident	87.8	Confident	27 Å²	27	65 Å²	65	14%	0.138	35%	0.348	C	S	.	.	H	α-helix	trans	-58.4	-31.8	172.7	-59.2	172.7	0	0	0	111.2	K511 I515 I586 N587 D621 T622 L623	K511-I619 HydrophobicContact CD-CD1 4.09Å; I515-I619 HydrophobicContact CD1-CG2 4.1Å; I586-I619 HydrophobicContact CB-CG1 4.15Å; I586-I619 HydrophobicContact CG2-CD1 4.29Å; I586-I619 HydrophobicContact CG2-CG1 3.64Å; N587-I619 HydrophobicContact CB-CD1 3.93Å; I619-D621 VanDerWaalsContact C-N 3.29Å; I619-D621 PolarHBondContact O-N 3.12Å; I619-T622 PolarHBondContact O-N 2.97Å; I619-T622 PolarHBondContact O-OG1 3.29Å; I619-L623 HydrophobicContact CG2-CD1 4.29Å; I619-L623 WeakPolarHBondContact O-CG 3.39Å; I619-L623 PolarHBondContact O-N 2.94Å; I619-L623 VanDerWaalsContact O-N 3.08Å
620	A	90.6	Very high	88	Confident	59 Å²	59	66 Å²	66	49%	0.488	35%	0.354	S	S	.	.	H	α-helix	trans	-61.1	-39.2	175.1	0	0	0	0	0	111.9	R618 T622 L623 V624	R618-A620 PolarHBondContact O-N 3.42Å; A620-T622 VanDerWaalsContact C-N 3.33Å; A620-T622 PolarHBondContact O-N 3.33Å; A620-L623 PolarHBondContact O-N 3.49Å; A620-V624 WeakPolarHBondContact O-CB 3.29Å; A620-V624 VanDerWaalsContact O-CG2 3.29Å; A620-V624 WeakPolarHBondContact O-CG2 3.34Å; A620-V624 PolarHBondContact O-N 2.95Å
621	D	91.4	Very high	88.3	Confident	83 Å²	83	65.6 Å²	65.6	44%	0.444	35%	0.353	S	S	.	.	H	α-helix	trans	-67.4	-37.6	-179.4	-54.5	-38.8	0	0	0	110.9	I617 R618 I619 V624 A625	I617-D621 HydrophobicContact CG2-CB 4.33Å; R618-D621 WeakPolarHBondContact CB-OD2 3.45Å; R618-D621 PolarHBondContact N-OD2 2.99Å; R618-D621 VanDerWaalsContact N-OD2 3.11Å; R618-D621 WeakPolarHBondContact O-CB 3.49Å; R618-D621 PolarHBondContact O-N 3.25Å; I619-D621 VanDerWaalsContact C-N 3.29Å; I619-D621 PolarHBondContact O-N 3.12Å; D621-V624 PolarHBondContact O-N 3.2Å; D621-A625 WeakPolarHBondContact O-CB 3.16Å; D621-A625 PolarHBondContact O-N 3.22Å
622	T	91.5	Very high	88.8	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-68.4	-41.4	177.2	65.5	0	0	0	0	111.5	W579 Q582 G583 I586 I617 R618 I619 A620 A625 Q626	W579-T622 HydrophobicContact CE3-CG2 4.23Å; Q582-T622 HydrophobicContact CB-CG2 4.49Å; Q582-T622 HydrophobicContact CG-CG2 4.03Å; G583-T622 WeakPolarHBondContact CA-OG1 3.34Å; I586-T622 HydrophobicContact CD1-CG2 4.17Å; I617-T622 HydrophobicContact CG2-CG2 4.28Å; R618-T622 PolarHBondContact O-N 2.99Å; I619-T622 PolarHBondContact O-N 2.97Å; I619-T622 PolarHBondContact O-OG1 3.29Å; A620-T622 VanDerWaalsContact C-N 3.33Å; A620-T622 PolarHBondContact O-N 3.33Å; T622-A625 PolarHBondContact O-N 2.96Å; T622-Q626 WeakPolarHBondContact O-CG 3.36Å; T622-Q626 PolarHBondContact O-N 3.46Å
623	L	92.7	Very high	89.6	Confident	66 Å²	66	60.3 Å²	60.3	35%	0.346	33%	0.334	S	S	.	.	H	α-helix	trans	-65.3	-41	175.3	-72.7	173.5	0	0	0	112.1	I515 V518 I619 A620 A625 Q626 G627	I515-L623 HydrophobicContact CG1-CD2 3.96Å; V518-L623 HydrophobicContact CG2-CD2 4.37Å; I619-L623 HydrophobicContact CG2-CD1 4.29Å; I619-L623 WeakPolarHBondContact O-CG 3.39Å; I619-L623 PolarHBondContact O-N 2.94Å; I619-L623 VanDerWaalsContact O-N 3.08Å; A620-L623 PolarHBondContact O-N 3.49Å; L623-A625 VanDerWaalsContact C-N 3.33Å; L623-A625 PolarHBondContact O-N 2.91Å; L623-Q626 PolarHBondContact O-N 2.76Å; L623-G627 PolarHBondContact O-N 2.93Å
624	V	93.9	Very high	90.1	Very high	75 Å²	75	59 Å²	59	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-41.6	174.1	169.2	0	0	0	0	110.8	A620 D621 G627 R628	A620-V624 WeakPolarHBondContact O-CB 3.29Å; A620-V624 VanDerWaalsContact O-CG2 3.29Å; A620-V624 WeakPolarHBondContact O-CG2 3.34Å; A620-V624 PolarHBondContact O-N 2.95Å; D621-V624 PolarHBondContact O-N 3.2Å; V624-G627 PolarHBondContact O-N 3.19Å; V624-R628 WeakPolarHBondContact O-CG 3.12Å; V624-R628 PolarHBondContact O-N 3.46Å
625	A	93.3	Very high	90.7	Very high	13 Å²	13	65.6 Å²	65.6	11%	0.107	35%	0.346	C	S	.	.	H	α-helix	trans	-63.5	-46.3	176.3	0	0	0	0	0	112	W579 D621 T622 L623 G627 R628 I629	W579-A625 HydrophobicContact CB-CB 4.49Å; W579-A625 HydrophobicContact CD2-CB 3.45Å; W579-A625 VanDerWaalsContact CD2-CB 3.45Å; W579-A625 HydrophobicContact CE3-CB 3.74Å; W579-A625 HydrophobicContact CG-CB 3.8Å; W579-A625 HydrophobicContact CH2-CB 4.31Å; W579-A625 HydrophobicContact CZ2-CB 4.07Å; W579-A625 HydrophobicContact CZ3-CB 4.16Å; D621-A625 WeakPolarHBondContact O-CB 3.16Å; D621-A625 PolarHBondContact O-N 3.22Å; T622-A625 PolarHBondContact O-N 2.96Å; L623-A625 VanDerWaalsContact C-N 3.33Å; L623-A625 PolarHBondContact O-N 2.91Å; A625-G627 VanDerWaalsContact C-N 3.33Å; A625-G627 PolarHBondContact O-N 3.32Å; A625-R628 PolarHBondContact O-N 3.41Å; A625-I629 WeakPolarHBondContact O-CG1 3.35Å; A625-I629 PolarHBondContact O-N 3.34Å
626	Q	94.8	Very high	91.6	Very high	1 Å²	1	65.7 Å²	65.7	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-60.5	-42.4	174.5	-71.6	-176.7	-30.3	0	0	111.9	V518 W579 A580 T622 L623 R628 I629 L630	V518-Q626 HydrophobicContact CG1-CB 3.69Å; W579-Q626 HydrophobicContact CB-CG 3.86Å; A580-Q626 VanDerWaalsContact CB-NE2 3.26Å; T622-Q626 WeakPolarHBondContact O-CG 3.36Å; T622-Q626 PolarHBondContact O-N 3.46Å; L623-Q626 PolarHBondContact O-N 2.76Å; Q626-R628 VanDerWaalsContact C-N 3.34Å; Q626-R628 PolarHBondContact O-N 3.33Å; Q626-I629 PolarHBondContact O-N 3.34Å; Q626-L630 WeakPolarHBondContact O-CB 3.33Å; Q626-L630 PolarHBondContact O-N 2.96Å
627	G	94.2	Very high	92.4	Very high	25 Å²	25	61.5 Å²	61.5	26%	0.258	30%	0.296	S	S	.	.	H	α-helix	trans	-61.7	-38.8	175.5	0	0	0	0	0	112.9	L623 V624 A625 L630 M631	L623-G627 PolarHBondContact O-N 2.93Å; V624-G627 PolarHBondContact O-N 3.19Å; A625-G627 VanDerWaalsContact C-N 3.33Å; A625-G627 PolarHBondContact O-N 3.32Å; G627-L630 WeakPolarHBondContact O-CB 3.37Å; G627-L630 PolarHBondContact O-N 3.19Å; G627-M631 WeakPolarHBondContact O-CB 3.44Å; G627-M631 WeakPolarHBondContact O-CG 3.16Å; G627-M631 PolarHBondContact O-N 3.43Å
628	R	94.8	Very high	93	Very high	182 Å²	182	62.2 Å²	62.2	69%	0.687	30%	0.295	S	S	*	.	H	α-helix	trans	-64.9	-42.8	173.7	-74.2	172.8	178.4	170.8	1	111.9	V624 A625 Q626 M631 F632	V624-R628 WeakPolarHBondContact O-CG 3.12Å; V624-R628 PolarHBondContact O-N 3.46Å; A625-R628 PolarHBondContact O-N 3.41Å; Q626-R628 VanDerWaalsContact C-N 3.34Å; Q626-R628 PolarHBondContact O-N 3.33Å; R628-M631 PolarHBondContact O-N 3.21Å; R628-F632 WeakPolarHBondContact O-CB 3.46Å; R628-F632 PolarHBondContact O-N 3.17Å
629	I	93.8	Very high	93.2	Very high	16 Å²	16	56.3 Å²	56.3	8%	0.082	28%	0.277	C	S	.	.	H	α-helix	trans	-63.8	-44.8	177	-68.9	167.4	0	0	0	110.6	L576 W579 A625 Q626 M631 F632 W633	L576-I629 HydrophobicContact CB-CG2 4.31Å; W579-I629 HydrophobicContact CG-CD1 4.42Å; A625-I629 WeakPolarHBondContact O-CG1 3.35Å; A625-I629 PolarHBondContact O-N 3.34Å; Q626-I629 PolarHBondContact O-N 3.34Å; I629-M631 PolarHBondContact O-N 3.46Å; I629-F632 PolarHBondContact O-N 2.98Å; I629-W633 PolarHBondContact O-N 3.13Å
630	L	94.4	Very high	93.3	Very high	34 Å²	34	55.6 Å²	55.6	18%	0.178	27%	0.274	C	S	.	.	H	α-helix	trans	-54.1	-53.3	174.5	-179.2	71.7	0	0	0	111.3	F521 A522 A525 Q626 G627 F632 W633 Y634	F521-L630 HydrophobicContact CB-CD1 3.78Å; F521-L630 WeakPolarHBondContact O-CD1 3.32Å; A522-L630 VanDerWaalsContact CA-CD1 3.5Å; A522-L630 HydrophobicContact CB-CB 4.35Å; A522-L630 HydrophobicContact CB-CD1 4.24Å; A525-L630 HydrophobicContact CB-CD1 3.98Å; Q626-L630 WeakPolarHBondContact O-CB 3.33Å; Q626-L630 PolarHBondContact O-N 2.96Å; G627-L630 WeakPolarHBondContact O-CB 3.37Å; G627-L630 PolarHBondContact O-N 3.19Å; L630-F632 VanDerWaalsContact C-N 3.34Å; L630-F632 PolarHBondContact O-N 3.07Å; L630-W633 PolarHBondContact O-N 3.49Å; L630-Y634 HydrophobicContact CD1-CD2 4.06Å; L630-Y634 HydrophobicContact CD1-CE2 3.46Å; L630-Y634 VanDerWaalsContact CD1-CE2 3.46Å; L630-Y634 HydrophobicContact CG-CD2 3.99Å; L630-Y634 HydrophobicContact CG-CE2 3.79Å; L630-Y634 VanDerWaalsContact O-CD2 3.23Å; L630-Y634 WeakPolarHBondContact O-CD2 3.29Å; L630-Y634 PolarHBondContact O-N 2.85Å; L630-Y634 VanDerWaalsContact O-N 3.08Å
631	M	93.5	Very high	93.2	Very high	125 Å²	125	53 Å²	53	62%	0.616	25%	0.252	S	S	*	.	H	α-helix	trans	-63.8	-38.7	-179.9	-72.6	-58.2	-62.9	0	0	112.5	G627 R628 I629 Y634 W635	G627-M631 WeakPolarHBondContact O-CB 3.44Å; G627-M631 WeakPolarHBondContact O-CG 3.16Å; G627-M631 PolarHBondContact O-N 3.43Å; R628-M631 PolarHBondContact O-N 3.21Å; I629-M631 PolarHBondContact O-N 3.46Å; M631-Y634 PolarHBondContact O-N 2.95Å; M631-W635 VanDerWaalsContact O-CB 3.31Å; M631-W635 WeakPolarHBondContact O-CB 3.26Å; M631-W635 PolarHBondContact O-N 2.61Å
632	F	94.9	Very high	93.1	Very high	103 Å²	103	54.3 Å²	54.3	45%	0.452	25%	0.253	S	S	.	.	H	α-helix	trans	-59.1	-49.6	175.6	169.7	-98.3	0	0	0	111.6	R628 I629 L630 Y634 W635 L636	R628-F632 WeakPolarHBondContact O-CB 3.46Å; R628-F632 PolarHBondContact O-N 3.17Å; I629-F632 PolarHBondContact O-N 2.98Å; L630-F632 VanDerWaalsContact C-N 3.34Å; L630-F632 PolarHBondContact O-N 3.07Å; F632-Y634 PolarHBondContact O-N 2.88Å; F632-W635 PolarHBondContact O-N 3.4Å; F632-L636 HydrophobicContact CE1-CD2 4.15Å; F632-L636 HydrophobicContact CZ-CD2 4.09Å; F632-L636 WeakPolarHBondContact O-CB 3.39Å; F632-L636 PolarHBondContact O-N 3Å
633	W	94.9	Very high	92.8	Very high	28 Å²	28	59.8 Å²	59.8	11%	0.106	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-38.7	179.5	-72.6	121.3	0	0	0	112.5	A525 M526 T529 L547 F551 I629 L630 L636 T637	A525-W633 HydrophobicContact CB-CB 3.62Å; M526-W633 HydrophobicContact CB-CD2 4.04Å; M526-W633 HydrophobicContact CB-CG 4.19Å; M526-W633 HydrophobicContact CB-CZ2 4.46Å; M526-W633 HydrophobicContact CG-CD2 4.18Å; M526-W633 HydrophobicContact CG-CE3 4.42Å; M526-W633 HydrophobicContact CG-CH2 4.12Å; M526-W633 HydrophobicContact CG-CZ2 3.86Å; M526-W633 HydrophobicContact CG-CZ3 4.39Å; M526-W633 HydrophobicContact SD-CZ2 4.1Å; T529-W633 HydrophobicContact CG2-CE3 3.8Å; T529-W633 HydrophobicContact CG2-CZ3 3.87Å; T529-W633 PolarHBondContact OG1-O 3.1Å; L547-W633 HydrophobicContact CD2-CH2 4.1Å; F551-W633 HydrophobicContact CE2-CZ2 4.15Å; F551-W633 HydrophobicContact CZ-CZ2 4.23Å; I629-W633 PolarHBondContact O-N 3.13Å; L630-W633 PolarHBondContact O-N 3.49Å; W633-L636 HydrophobicContact CE3-CD2 3.98Å; W633-L636 HydrophobicContact CZ3-CD2 3.85Å; W633-L636 PolarHBondContact O-N 3.09Å; W633-T637 WeakPolarHBondContact O-CB 3.34Å; W633-T637 PolarHBondContact O-N 3.33Å; W633-T637 PolarHBondContact O-OG1 3.14Å
634	Y	92.4	Very high	92.1	Very high	22 Å²	22	59.6 Å²	59.6	9%	0.086	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-43	173.7	-82.8	-60.6	0	0	0	112.8	L478 A525 L528 L630 M631 F632 T637 Y638	L478-Y634 HydrophobicContact CB-CE1 4.44Å; L478-Y634 HydrophobicContact CD1-CE1 3.96Å; L478-Y634 HydrophobicContact CD1-CE2 3.65Å; L478-Y634 WeakPolarHBondContact CD1-OH 3.47Å; L478-Y634 HydrophobicContact CD2-CD1 4.49Å; L478-Y634 HydrophobicContact CD2-CD2 4.21Å; L478-Y634 HydrophobicContact CD2-CE1 4.28Å; L478-Y634 HydrophobicContact CD2-CE2 3.97Å; L478-Y634 HydrophobicContact CG-CE1 4.45Å; L478-Y634 HydrophobicContact CG-CE2 4.43Å; A525-Y634 HydrophobicContact CB-CD1 4.4Å; A525-Y634 HydrophobicContact CB-CD2 3.91Å; A525-Y634 HydrophobicContact CB-CE1 4.15Å; A525-Y634 HydrophobicContact CB-CE2 3.63Å; A525-Y634 HydrophobicContact CB-CG 4.24Å; L528-Y634 HydrophobicContact CD1-CD1 4.19Å; L528-Y634 HydrophobicContact CD1-CE1 3.46Å; L528-Y634 VanDerWaalsContact CD1-CE1 3.46Å; L630-Y634 HydrophobicContact CD1-CD2 4.06Å; L630-Y634 HydrophobicContact CD1-CE2 3.46Å; L630-Y634 VanDerWaalsContact CD1-CE2 3.46Å; L630-Y634 HydrophobicContact CG-CD2 3.99Å; L630-Y634 HydrophobicContact CG-CE2 3.79Å; L630-Y634 VanDerWaalsContact O-CD2 3.23Å; L630-Y634 WeakPolarHBondContact O-CD2 3.29Å; L630-Y634 PolarHBondContact O-N 2.85Å; L630-Y634 VanDerWaalsContact O-N 3.08Å; M631-Y634 PolarHBondContact O-N 2.95Å; F632-Y634 PolarHBondContact O-N 2.88Å; Y634-T637 WeakPolarHBondContact O-CB 3.46Å; Y634-T637 PolarHBondContact O-N 2.86Å; Y634-Y638 WeakPolarHBondContact O-CB 3.36Å; Y634-Y638 PolarHBondContact O-N 3.05Å
635	W	93.8	Very high	91.1	Very high	150 Å²	150	61.5 Å²	61.5	57%	0.568	28%	0.275	S	S	*	.	H	α-helix	trans	-65.2	-41.9	177.8	-177.1	80.6	0	0	0	111.6	M631 F632 Y638 L639	M631-W635 VanDerWaalsContact O-CB 3.31Å; M631-W635 WeakPolarHBondContact O-CB 3.26Å; M631-W635 PolarHBondContact O-N 2.61Å; F632-W635 PolarHBondContact O-N 3.4Å; W635-Y638 WeakPolarHBondContact O-CB 3.5Å; W635-Y638 PolarHBondContact O-N 3.15Å; W635-L639 HydrophobicContact CD2-CD1 3.94Å; W635-L639 HydrophobicContact CD2-CG 4.18Å; W635-L639 HydrophobicContact CE3-CD1 3.72Å; W635-L639 HydrophobicContact CE3-CG 4.37Å; W635-L639 HydrophobicContact CH2-CD1 3.29Å; W635-L639 HydrophobicContact CH2-CG 4.37Å; W635-L639 HydrophobicContact CZ2-CD1 3.48Å; W635-L639 VanDerWaalsContact CZ2-CD1 3.48Å; W635-L639 HydrophobicContact CZ2-CD2 4.37Å; W635-L639 HydrophobicContact CZ2-CG 4.14Å; W635-L639 HydrophobicContact CZ3-CD1 3.39Å; W635-L639 HydrophobicContact CZ3-CG 4.46Å; W635-L639 WeakPolarHBondContact O-CG 3.47Å; W635-L639 PolarHBondContact O-N 3.42Å
636	L	94	Very high	89.9	Confident	33 Å²	33	63.6 Å²	63.6	17%	0.173	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-43.2	175	-174.5	57.6	0	0	0	111.4	T529 F632 W633 Y638 L639 L640	T529-L636 HydrophobicContact CG2-CB 4.34Å; T529-L636 HydrophobicContact CG2-CD2 3.67Å; T529-L636 HydrophobicContact CG2-CG 3.77Å; F632-L636 HydrophobicContact CE1-CD2 4.15Å; F632-L636 HydrophobicContact CZ-CD2 4.09Å; F632-L636 WeakPolarHBondContact O-CB 3.39Å; F632-L636 PolarHBondContact O-N 3Å; W633-L636 HydrophobicContact CE3-CD2 3.98Å; W633-L636 HydrophobicContact CZ3-CD2 3.85Å; W633-L636 PolarHBondContact O-N 3.09Å; L636-Y638 VanDerWaalsContact C-N 3.33Å; L636-Y638 PolarHBondContact O-N 3.05Å; L636-L639 PolarHBondContact O-N 3.43Å; L636-L640 HydrophobicContact CD1-CD1 4.43Å; L636-L640 HydrophobicContact CD1-CG 4.43Å; L636-L640 HydrophobicContact CG-CD1 4.11Å; L636-L640 WeakPolarHBondContact O-CB 3.46Å; L636-L640 VanDerWaalsContact O-CG 3.28Å; L636-L640 WeakPolarHBondContact O-CG 3.32Å; L636-L640 PolarHBondContact O-N 3.36Å
637	T	93.5	Very high	89	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-56.7	-47.1	172.3	-59.4	0	0	0	0	111	L474 L528 T529 A532 W633 Y634 L639 L640 L641	L474-T637 HydrophobicContact CD1-CG2 4.24Å; L528-T637 HydrophobicContact CB-CG2 3.99Å; T529-T637 WeakPolarHBondContact CA-OG1 3.47Å; T529-T637 PolarHBondContact N-OG1 2.96Å; T529-T637 PolarHBondContact OG1-OG1 2.66Å; A532-T637 HydrophobicContact CB-CG2 4.35Å; W633-T637 WeakPolarHBondContact O-CB 3.34Å; W633-T637 PolarHBondContact O-N 3.33Å; W633-T637 PolarHBondContact O-OG1 3.14Å; Y634-T637 WeakPolarHBondContact O-CB 3.46Å; Y634-T637 PolarHBondContact O-N 2.86Å; T637-L639 PolarHBondContact O-N 3.37Å; T637-L640 PolarHBondContact O-N 3Å; T637-L641 HydrophobicContact CG2-CD1 3.83Å; T637-L641 HydrophobicContact CG2-CG 4.38Å; T637-L641 WeakPolarHBondContact O-CB 3.43Å; T637-L641 VanDerWaalsContact O-CG 3.31Å; T637-L641 WeakPolarHBondContact O-CG 3.27Å; T637-L641 PolarHBondContact O-N 3.37Å
638	Y	93	Very high	88.3	Confident	77 Å²	77	68.2 Å²	68.2	30%	0.302	30%	0.3	S	S	.	.	H	α-helix	trans	-60	-45.8	177.9	177.7	-96.9	0	0	0	112	L470 L474 Y634 W635 L636 L641 K642	L470-Y638 HydrophobicContact CB-CE2 4.1Å; L470-Y638 HydrophobicContact CD2-CD2 3.64Å; L470-Y638 HydrophobicContact CD2-CE2 3.7Å; L470-Y638 HydrophobicContact CD2-CG 4.32Å; L470-Y638 WeakPolarHBondContact CD2-O 3.49Å; L470-Y638 HydrophobicContact CG-CD2 3.81Å; L470-Y638 HydrophobicContact CG-CE2 3.79Å; L474-Y638 HydrophobicContact CD2-CD2 4.28Å; Y634-Y638 WeakPolarHBondContact O-CB 3.36Å; Y634-Y638 PolarHBondContact O-N 3.05Å; W635-Y638 WeakPolarHBondContact O-CB 3.5Å; W635-Y638 PolarHBondContact O-N 3.15Å; L636-Y638 VanDerWaalsContact C-N 3.33Å; L636-Y638 PolarHBondContact O-N 3.05Å; Y638-L641 PolarHBondContact O-N 3.05Å; Y638-K642 HydrophobicContact CE1-CD 4.14Å; Y638-K642 VanDerWaalsContact O-CB 3.25Å; Y638-K642 WeakPolarHBondContact O-CB 3.47Å; Y638-K642 PolarHBondContact O-N 3.06Å
639	L	93.1	Very high	87.7	Confident	64 Å²	64	61.5 Å²	61.5	34%	0.335	28%	0.276	S	S	.	.	H	α-helix	trans	-62.7	-44.2	177.6	-74.3	-173.4	0	0	0	112.4	W635 L636 T637 K642 K643	W635-L639 HydrophobicContact CD2-CD1 3.94Å; W635-L639 HydrophobicContact CD2-CG 4.18Å; W635-L639 HydrophobicContact CE3-CD1 3.72Å; W635-L639 HydrophobicContact CE3-CG 4.37Å; W635-L639 HydrophobicContact CH2-CD1 3.29Å; W635-L639 HydrophobicContact CH2-CG 4.37Å; W635-L639 HydrophobicContact CZ2-CD1 3.48Å; W635-L639 VanDerWaalsContact CZ2-CD1 3.48Å; W635-L639 HydrophobicContact CZ2-CD2 4.37Å; W635-L639 HydrophobicContact CZ2-CG 4.14Å; W635-L639 HydrophobicContact CZ3-CD1 3.39Å; W635-L639 HydrophobicContact CZ3-CG 4.46Å; W635-L639 WeakPolarHBondContact O-CG 3.47Å; W635-L639 PolarHBondContact O-N 3.42Å; L636-L639 PolarHBondContact O-N 3.43Å; T637-L639 PolarHBondContact O-N 3.37Å; L639-K642 PolarHBondContact O-N 2.84Å; L639-K643 VanDerWaalsContact O-CB 3.3Å; L639-K643 WeakPolarHBondContact O-CB 3.49Å; L639-K643 PolarHBondContact O-N 2.99Å
640	L	91.4	Very high	87.1	Confident	11 Å²	11	66.1 Å²	66.1	6%	0.058	30%	0.297	C	S	.	.	H	α-helix	trans	-62.4	-46.6	178.5	-72.7	166.4	0	0	0	111.4	T529 A532 M533 L636 T637 K642 K643 N644	T529-L640 HydrophobicContact CG2-CD1 3.67Å; A532-L640 HydrophobicContact CB-CB 4.21Å; A532-L640 HydrophobicContact CB-CD1 4.38Å; M533-L640 HydrophobicContact CG-CD1 3.37Å; M533-L640 HydrophobicContact CG-CD2 4.11Å; M533-L640 HydrophobicContact CG-CG 4.36Å; M533-L640 HydrophobicContact SD-CD1 4.03Å; L636-L640 HydrophobicContact CD1-CD1 4.43Å; L636-L640 HydrophobicContact CD1-CG 4.43Å; L636-L640 HydrophobicContact CG-CD1 4.11Å; L636-L640 WeakPolarHBondContact O-CB 3.46Å; L636-L640 VanDerWaalsContact O-CG 3.28Å; L636-L640 WeakPolarHBondContact O-CG 3.32Å; L636-L640 PolarHBondContact O-N 3.36Å; T637-L640 PolarHBondContact O-N 3Å; L640-K642 VanDerWaalsContact C-N 3.27Å; L640-K642 PolarHBondContact O-N 2.94Å; L640-K643 PolarHBondContact O-N 3.44Å; L640-N644 VanDerWaalsContact O-CB 3.24Å; L640-N644 WeakPolarHBondContact O-CB 3.37Å; L640-N644 VanDerWaalsContact O-CG 3.31Å; L640-N644 PolarHBondContact O-N 3.23Å
641	L	88.8	Confident	86.6	Confident	5 Å²	5	67.2 Å²	67.2	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-69.9	-23.4	177.1	-66	173.7	0	0	0	113.3	F452 R456 R463 L470 A532 T637 Y638	F452-L641 HydrophobicContact CZ-CD1 3.95Å; R456-L641 HydrophobicContact CG-CD2 4Å; R463-L641 PolarHBondContact NH1-O 2.81Å; R463-L641 VanDerWaalsContact NH1-O 3.09Å; L470-L641 HydrophobicContact CD1-CB 3.86Å; L470-L641 HydrophobicContact CD1-CD1 3.95Å; L470-L641 HydrophobicContact CD2-CB 3.71Å; L470-L641 HydrophobicContact CG-CB 4.44Å; A532-L641 HydrophobicContact CB-CD2 4.02Å; A532-L641 HydrophobicContact CB-CG 4.17Å; T637-L641 HydrophobicContact CG2-CD1 3.83Å; T637-L641 HydrophobicContact CG2-CG 4.38Å; T637-L641 WeakPolarHBondContact O-CB 3.43Å; T637-L641 VanDerWaalsContact O-CG 3.31Å; T637-L641 WeakPolarHBondContact O-CG 3.27Å; T637-L641 PolarHBondContact O-N 3.37Å; Y638-L641 PolarHBondContact O-N 3.05Å
642	K	87.4	Confident	86.2	Confident	110 Å²	110	64.8 Å²	64.8	48%	0.478	29%	0.292	S	S	.	.	H	α-helix	trans	-76.8	-40.1	172	-171.9	178.2	178.1	-175.4	0	111	L470 Y638 L639 L640 R645	L470-K642 HydrophobicContact CD2-CB 4.07Å; Y638-K642 HydrophobicContact CE1-CD 4.14Å; Y638-K642 VanDerWaalsContact O-CB 3.25Å; Y638-K642 WeakPolarHBondContact O-CB 3.47Å; Y638-K642 PolarHBondContact O-N 3.06Å; L639-K642 PolarHBondContact O-N 2.84Å; L640-K642 VanDerWaalsContact C-N 3.27Å; L640-K642 PolarHBondContact O-N 2.94Å; K642-R645 WeakPolarHBondContact O-CG 3.38Å
643	K	85.3	Confident	85.6	Confident	116 Å²	116	64 Å²	64	50%	0.504	30%	0.298	S	S	.	.	H	α-helix	trans	-73.2	-42.7	179.4	-174.2	-177.9	176.1	-171.7	0	112	L639 L640 R645	L639-K643 VanDerWaalsContact O-CB 3.3Å; L639-K643 WeakPolarHBondContact O-CB 3.49Å; L639-K643 PolarHBondContact O-N 2.99Å; L640-K643 PolarHBondContact O-N 3.44Å; K643-R645 PolarHBondContact O-N 3.31Å; K643-R645 VanDerWaalsContact O-N 3.1Å
644	N	79.2	Confident	84.7	Confident	61 Å²	61	63.8 Å²	63.8	33%	0.326	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	27	-178.1	-65.3	-5.7	0	0	0	112.9	L640	L640-N644 VanDerWaalsContact O-CB 3.24Å; L640-N644 WeakPolarHBondContact O-CB 3.37Å; L640-N644 VanDerWaalsContact O-CG 3.31Å; L640-N644 PolarHBondContact O-N 3.23Å
645	R	72.2	Confident	83.5	Confident	116 Å²	116	65 Å²	65	44%	0.438	31%	0.312	S	S	.	.			trans	-60.5	134.9	171.9	-77.5	-177.5	-172.8	-156.9	-1	108.7	K642 K643 K647	K642-R645 WeakPolarHBondContact O-CG 3.38Å; K643-R645 PolarHBondContact O-N 3.31Å; K643-R645 VanDerWaalsContact O-N 3.1Å; R645-K647 PolarHBondContact O-N 3.07Å
646	P	69.1	Low	81.5	Confident	56 Å²	56	65.6 Å²	65.6	36%	0.364	32%	0.321	S	S	.	.			trans	-56.6	129.9	177.2	21.5	-30.8	0	0	0	109.3	A464 Y648	A464-P646 HydrophobicContact CB-CG 3.93Å; P646-Y648 HydrophobicContact CB-CE2 4.46Å
647	K	74.2	Confident	79.3	Confident	65 Å²	65	70.8 Å²	70.8	28%	0.283	34%	0.344	S	S	.	.			trans	-108.1	139.1	176.3	-64.7	-172.4	174.2	-157.6	0	108	A28 A113 R645	A28-K647 HydrophobicContact CB-CD 4.49Å; A28-K647 PolarHBondContact O-NZ 2.9Å; A113-K647 HydrophobicContact CB-CB 3.74Å; A113-K647 WeakPolarHBondContact CB-O 3.39Å; A113-K647 PolarHBondContact N-O 3.44Å; R645-K647 PolarHBondContact O-N 3.07Å
648	Y	80.5	Confident	77.2	Confident	59 Å²	59	73.5 Å²	73.5	23%	0.231	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-113.1	144.2	-179.8	-58.5	-73.2	0	0	0	109.9	G109 Q110 L111 A464 P646	G109-Y648 WeakPolarHBondContact O-CB 3.48Å; Q110-Y648 VanDerWaalsContact C-CD1 3.48Å; Q110-Y648 HydrophobicContact CB-CE1 4.35Å; Q110-Y648 WeakPolarHBondContact O-CD1 3.36Å; Q110-Y648 VanDerWaalsContact OE1-CZ 3.26Å; Q110-Y648 PolarHBondContact OE1-OH 2.75Å; L111-Y648 CarbonylContact O-C 3.56Å; L111-Y648 VanDerWaalsContact O-CA 3.24Å; L111-Y648 WeakPolarHBondContact O-CA 3.48Å; A464-Y648 HydrophobicContact CB-CE2 4.48Å; P646-Y648 HydrophobicContact CB-CE2 4.46Å
649	Q	82.6	Confident	74.8	Confident	40 Å²	40	74.4 Å²	74.4	19%	0.187	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-66.3	137.3	179.3	-165.5	69.2	21.6	0	0	109.6	L111 L117 L119	L111-Q649 HydrophobicContact CB-CB 4.42Å; L111-Q649 HydrophobicContact CD2-CB 4.21Å; L111-Q649 HydrophobicContact CG-CB 4.43Å; L111-Q649 PolarHBondContact O-N 2.81Å; L117-Q649 HydrophobicContact CD2-CB 4.37Å; L117-Q649 HydrophobicContact CD2-CG 3.74Å; L117-Q649 PolarHBondContact O-NE2 3.02Å; L119-Q649 HydrophobicContact CB-CG 3.76Å; L119-Q649 HydrophobicContact CD2-CB 4.28Å; L119-Q649 HydrophobicContact CD2-CG 4.15Å
650	Q	81.5	Confident	72.1	Confident	113 Å²	113	76.4 Å²	76.4	53%	0.528	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-83.4	135.5	172.9	-65.2	-176.9	2.7	0	0	109.5	L652	Q650-L652 PolarHBondContact O-N 3.37Å
651	L	83.2	Confident	69.8	Low	57 Å²	57	83 Å²	83	30%	0.298	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-76.9	117.5	169.9	-178.6	64.9	0	0	0	108.1	I61 L119 L123	I61-L651 HydrophobicContact CD1-CD1 3.89Å; I61-L651 HydrophobicContact CD1-CD2 4.11Å; L119-L651 HydrophobicContact CD1-CD1 4.1Å; L119-L651 HydrophobicContact CD2-CB 4.24Å; L119-L651 HydrophobicContact CD2-CD1 4.14Å; L119-L651 HydrophobicContact CG-CD1 3.7Å; L123-L651 HydrophobicContact CB-CD2 3.68Å
652	L	85.4	Confident	67.6	Low	74 Å²	74	86.8 Å²	86.8	39%	0.387	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-98.3	152.5	177.8	-64	171.1	0	0	0	110.3	L119 S120 G121 Q650	L119-L652 PolarHBondContact O-N 3.39Å; L119-L652 VanDerWaalsContact O-N 3.12Å; S120-L652 CarbonylContact C-O 3.59Å; S120-L652 WeakPolarHBondContact CA-O 3.45Å; G121-L652 PolarHBondContact N-O 3.31Å; Q650-L652 PolarHBondContact O-N 3.37Å
653	P	81.4	Confident	65	Low	88 Å²	88	87.2 Å²	87.2	57%	0.571	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-61.3	143.9	166.4	27.2	-32.7	0	0	0	109.6	F122 S655	F122-P653 HydrophobicContact CE1-CB 4.27Å; P653-S655 PolarHBondContact O-N 2.98Å
654	P	75.8	Confident	62.6	Low	23 Å²	23	86.3 Å²	86.3	15%	0.149	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-59.6	136.5	175.7	24.8	-31.7	0	0	0	110.7	F122	F122-P654 HydrophobicContact CD2-CG 4.35Å; F122-P654 VanDerWaalsContact CE2-CD 3.48Å; F122-P654 HydrophobicContact CE2-CG 3.5Å; F122-P654 VanDerWaalsContact CZ-CD 3.46Å; F122-P654 HydrophobicContact CZ-CG 3.82Å
655	S	67.3	Low	60.7	Low	48 Å²	48	91.7 Å²	91.7	34%	0.336	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-74.1	150.1	-179.4	71.3	0	0	0	0	111.3	P653 E657 D658 Q659	P653-S655 PolarHBondContact O-N 2.98Å; S655-E657 PolarHBondContact O-N 2.92Å; S655-D658 PolarHBondContact O-N 3.01Å; S655-D658 PolarHBondContact OG-N 3.42Å; S655-D658 PolarHBondContact OG-OD2 2.78Å; S655-Q659 PolarHBondContact O-N 2.86Å
656	E	52.4	Low	58.9	Low	162 Å²	162	94.3 Å²	94.3	76%	0.757	47%	0.467	S	S	*	.	H	α-helix	trans	-58.4	-29.1	175.1	-70.5	-175.6	167.4	0	0	112.1	Q659 N660	E656-Q659 PolarHBondContact O-N 2.93Å; E656-N660 PolarHBondContact O-N 2.98Å
657	E	47.1	Very low	57.3	Low	142 Å²	142	97.8 Å²	97.8	66%	0.664	49%	0.487	S	S	*	.	H	α-helix	trans	-69	-32.5	175.1	-73.9	-170.5	161.8	0	0	113.6	S655 Q659 K661	S655-E657 PolarHBondContact O-N 2.92Å; E657-Q659 VanDerWaalsContact C-N 3.33Å; E657-K661 PolarHBondContact O-N 3.46Å
658	D	50.5	Low	55.1	Low	57 Å²	57	106 Å²	106	31%	0.305	52%	0.523	S	S	.	.	H	α-helix	trans	-70.7	-32.6	175.6	-68.1	-44.7	0	0	0	111.1	S655	S655-D658 PolarHBondContact O-N 3.01Å; S655-D658 PolarHBondContact OG-N 3.42Å; S655-D658 PolarHBondContact OG-OD2 2.78Å
659	Q	42.1	Very low	53.8	Low	96 Å²	96	108.3 Å²	108.3	45%	0.449	54%	0.537	S	S	.	.	H	α-helix	trans	-65.3	-41	176	-62.5	-178.9	8.2	0	0	111.7	S655 E656 E657	S655-Q659 PolarHBondContact O-N 2.86Å; E656-Q659 PolarHBondContact O-N 2.93Å; E657-Q659 VanDerWaalsContact C-N 3.33Å
660	N	36.5	Very low	52.3	Low	106 Å²	106	111.9 Å²	111.9	57%	0.567	56%	0.556	S	S	*	*	H	α-helix	trans	-75.1	-31.3	-179.8	-84.5	-17.4	0	0	0	114.1	E656 Q662	E656-N660 PolarHBondContact O-N 2.98Å; N660-Q662 VanDerWaalsContact C-N 3.28Å; N660-Q662 PolarHBondContact O-N 3.18Å
661	K	43.7	Very low	50.7	Low	149 Å²	149	111.8 Å²	111.8	65%	0.648	56%	0.557	S	S	*	*	H	α-helix	trans	-71.8	-22.2	178.3	-78.2	178.6	-178	166.6	0	113.4	E657	E657-K661 PolarHBondContact O-N 3.46Å
662	Q	42.2	Very low	48.8	Very low	84 Å²	84	115.1 Å²	115.1	39%	0.393	57%	0.573	S	S	.	*	H	α-helix	trans	-82.4	-35.8	177.1	-79.4	174.9	-28.5	0	0	112.8	N660 V664 K665 E666	N660-Q662 VanDerWaalsContact C-N 3.28Å; N660-Q662 PolarHBondContact O-N 3.18Å; Q662-V664 PolarHBondContact O-N 3.32Å; Q662-K665 PolarHBondContact O-N 2.91Å; Q662-E666 PolarHBondContact O-N 3.01Å
663	Q	33.8	Very low	46.5	Very low	120 Å²	120	117.6 Å²	117.6	56%	0.561	58%	0.584	S	S	*	*	H	α-helix	trans	-59.4	-29.5	171.7	-81.8	-176.3	-10.7	0	0	112.9	K665 E666 V667	Q663-K665 VanDerWaalsContact C-N 3.28Å; Q663-K665 PolarHBondContact O-N 3.35Å; Q663-E666 PolarHBondContact O-N 3.06Å; Q663-V667 WeakPolarHBondContact O-CG2 3.4Å; Q663-V667 PolarHBondContact O-N 3.24Å
664	V	34.3	Very low	44.1	Very low	96 Å²	96	119.6 Å²	119.6	58%	0.582	59%	0.585	S	S	*	*	H	α-helix	trans	-72.7	-19.6	176.7	-179.3	0	0	0	0	112.7	Q662	Q662-V664 PolarHBondContact O-N 3.32Å
665	K	38	Very low	41.9	Very low	175 Å²	175	126.5 Å²	126.5	76%	0.761	62%	0.616	S	S	*	*	H	α-helix	trans	-82.7	-29.2	171.1	-100.2	-169.9	173.3	-166	0	112.9	Q662 Q663 V667 K668	Q662-K665 PolarHBondContact O-N 2.91Å; Q663-K665 VanDerWaalsContact C-N 3.28Å; Q663-K665 PolarHBondContact O-N 3.35Å; K665-V667 VanDerWaalsContact C-N 3.28Å; K665-K668 VanDerWaalsContact O-OXT 3.13Å
666	E	35.9	Very low	39.9	Very low	170 Å²	170	132.5 Å²	132.5	79%	0.794	64%	0.638	S	S	*	*	H	α-helix	trans	-77.4	-13.1	174.8	-74.8	178.2	159.4	0	0	113.2	Q662 Q663	Q662-E666 PolarHBondContact O-N 3.01Å; Q663-E666 PolarHBondContact O-N 3.06Å
667	V	34.7	Very low	38.9	Very low	129 Å²	129	130.1 Å²	130.1	78%	0.782	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	4.5	178.5	-178.9	0	0	0	0	112.4	Q663 K665	Q663-V667 WeakPolarHBondContact O-CG2 3.4Å; Q663-V667 PolarHBondContact O-N 3.24Å; K665-V667 VanDerWaalsContact C-N 3.28Å
668	K	27.9	Very low	38.1	Very low	237 Å²	237	129 Å²	129	100%	1.03	63%	0.625	S	S	*	*			trans	-122.3	0	174.6	-93.9	-172.9	170.4	-177.1	0	110.7	K665	K665-K668 VanDerWaalsContact O-OXT 3.13Å

Retrieved 668 of 668 residues in 2785.8 ms (Link to these results)

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