A0A087XFN9_POEFO Loading...

Anaphase-promoting complex subunit 2

Together with the RING-H2 protein ANAPC11, constitutes the catalytic component of the anaphase promoting complex/cyclosome (APC/C), a cell cycle-regulated E3 ubiquitin ligase that controls progression through mitosis and the G1 phase of the cell cycle. The APC/C complex acts by mediating ubiquitination and subsequent degradation of target proteins: it mainly mediates the formation of 'Lys-11'-linked polyubiquitin chains and, to a lower extent, the formation of 'Lys-48'- and 'Lys-63'-linked polyubiquitin chains. The APC/C complex catalyzes assembly of branched 'Lys-11'-/'Lys-48'-linked branched ubiquitin chains on target proteins. The CDC20-APC/C complex positively regulates the formation of synaptic vesicle clustering at active zone to the presynaptic membrane in postmitotic neurons. CDC20-APC/C-induced degradation of NEUROD2 drives presynaptic differentiation.

AlphaFold DB , UniProt , Accession A0A087XFN9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 789 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	29.2	Very low	32.3	Very low	235 Å²	235	143.4 Å²	143.4	100%	1.158	72%	0.715	S	S	*	*				0	49.8	0	-71.6	173.4	149.9	0	0	110.1
2	G	30.2	Very low	32.5	Very low	57 Å²	57	135.2 Å²	135.2	59%	0.588	68%	0.675	S	S	*	*			trans	-121	3.3	-168.1	0	0	0	0	0	115.2
3	S	29.9	Very low	32.5	Very low	97 Å²	97	138.2 Å²	138.2	68%	0.678	69%	0.685	S	S	*	*	S	Bend	trans	-109.4	-16.3	-174.5	41.6	0	0	0	0	113.8
4	E	29.3	Very low	32.6	Very low	170 Å²	170	130.6 Å²	130.6	79%	0.794	65%	0.651	S	S	*	*	S	Bend	trans	-95.5	-26.1	-178.7	-71.9	-176.9	156.9	0	0	113.6	F6 C7	E4-F6 PolarHBondContact O-N 3.46Å; E4-C7 PolarHBondContact O-N 2.72Å
5	E	32.6	Very low	32.2	Very low	154 Å²	154	126.9 Å²	126.9	72%	0.72	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-21	172.6	-70.8	-176.1	158.3	0	0	112.6	C7	E5-C7 VanDerWaalsContact C-N 3.29Å; E5-C7 PolarHBondContact O-N 3.37Å
6	F	36.4	Very low	31.8	Very low	123 Å²	123	127.6 Å²	127.6	54%	0.539	66%	0.658	S	S	.	*	H	α-helix	trans	-71	-20.4	176.5	-111.5	-88.2	0	0	0	113.7	E4 R10	E4-F6 PolarHBondContact O-N 3.46Å; F6-R10 PolarHBondContact O-N 3.26Å
7	C	30.7	Very low	31.9	Very low	83 Å²	83	125 Å²	125	56%	0.561	67%	0.67	S	S	*	*	H	α-helix	trans	-76.2	-27.3	-179.7	-83.5	0	0	0	0	113.2	E4 E5 H11	E4-C7 PolarHBondContact O-N 2.72Å; E5-C7 VanDerWaalsContact C-N 3.29Å; E5-C7 PolarHBondContact O-N 3.37Å; C7-H11 PolarHBondContact O-CD2 3.26Å
8	L	32.8	Very low	32	Very low	131 Å²	131	121 Å²	121	69%	0.686	65%	0.653	S	S	*	*	H	α-helix	trans	-71.6	-32	-178.3	-89.3	153.7	0	0	0	112.9
9	W	37.8	Very low	32.3	Very low	152 Å²	152	120 Å²	120	58%	0.576	66%	0.657	S	S	*	*	H	α-helix	trans	-100.5	-12	-179.2	-77	88.9	0	0	0	115.2	H11 L12	W9-H11 PolarHBondContact O-N 3.29Å; W9-L12 HydrophobicContact CD2-CB 4.1Å; W9-L12 HydrophobicContact CD2-CD1 3.37Å; W9-L12 HydrophobicContact CD2-CG 4.3Å; W9-L12 HydrophobicContact CE3-CB 3.36Å; W9-L12 HydrophobicContact CE3-CD1 3.31Å; W9-L12 HydrophobicContact CE3-CD2 4.36Å; W9-L12 HydrophobicContact CE3-CG 3.8Å; W9-L12 HydrophobicContact CG-CD1 4.05Å; W9-L12 HydrophobicContact CH2-CD1 3.73Å; W9-L12 HydrophobicContact CH2-CD2 4.38Å; W9-L12 HydrophobicContact CH2-CG 4.5Å; W9-L12 HydrophobicContact CZ2-CD1 3.8Å; W9-L12 HydrophobicContact CZ3-CB 3.77Å; W9-L12 HydrophobicContact CZ3-CD1 3.5Å; W9-L12 VanDerWaalsContact CZ3-CD1 3.5Å; W9-L12 HydrophobicContact CZ3-CD2 3.95Å; W9-L12 HydrophobicContact CZ3-CG 3.91Å; W9-L12 PolarHBondContact O-N 2.77Å; W9-L12 VanDerWaalsContact O-N 3.08Å
10	R	31.8	Very low	33.2	Very low	203 Å²	203	115.4 Å²	115.4	77%	0.766	63%	0.631	S	S	*	*	H	α-helix	trans	-63.6	-26.8	162	-116.9	-178.7	-175.2	-179.2	1.9	111.8	F6 L12	F6-R10 PolarHBondContact O-N 3.26Å; R10-L12 VanDerWaalsContact C-N 3.32Å
11	H	34.3	Very low	34.2	Very low	172 Å²	172	112.3 Å²	112.3	80%	0.796	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-10.4	172.1	-79.1	-61.9	0	0	0	114.2	C7 W9 Q13	C7-H11 PolarHBondContact O-CD2 3.26Å; W9-H11 PolarHBondContact O-N 3.29Å; H11-Q13 VanDerWaalsContact C-N 3.28Å; H11-Q13 PolarHBondContact O-N 2.99Å
12	L	35.2	Very low	35.3	Very low	45 Å²	45	109 Å²	109	24%	0.236	60%	0.6	C	S	.	*	T	Hydrogen-bonded Turn	trans	-94.7	33.3	170.4	-81.4	141.8	0	0	0	111.5	W9 R10 V14	W9-L12 HydrophobicContact CD2-CB 4.1Å; W9-L12 HydrophobicContact CD2-CD1 3.37Å; W9-L12 HydrophobicContact CD2-CG 4.3Å; W9-L12 HydrophobicContact CE3-CB 3.36Å; W9-L12 HydrophobicContact CE3-CD1 3.31Å; W9-L12 HydrophobicContact CE3-CD2 4.36Å; W9-L12 HydrophobicContact CE3-CG 3.8Å; W9-L12 HydrophobicContact CG-CD1 4.05Å; W9-L12 HydrophobicContact CH2-CD1 3.73Å; W9-L12 HydrophobicContact CH2-CD2 4.38Å; W9-L12 HydrophobicContact CH2-CG 4.5Å; W9-L12 HydrophobicContact CZ2-CD1 3.8Å; W9-L12 HydrophobicContact CZ3-CB 3.77Å; W9-L12 HydrophobicContact CZ3-CD1 3.5Å; W9-L12 VanDerWaalsContact CZ3-CD1 3.5Å; W9-L12 HydrophobicContact CZ3-CD2 3.95Å; W9-L12 HydrophobicContact CZ3-CG 3.91Å; W9-L12 PolarHBondContact O-N 2.77Å; W9-L12 VanDerWaalsContact O-N 3.08Å; R10-L12 VanDerWaalsContact C-N 3.32Å; L12-V14 HydrophobicContact CD2-CG2 4.12Å; L12-V14 PolarHBondContact O-N 2.94Å
13	Q	31.9	Very low	36.6	Very low	174 Å²	174	113.1 Å²	113.1	81%	0.813	60%	0.604	S	S	*	*			trans	-67.3	73.8	154.8	-84.8	-170.1	-31.8	0	0	108.6	H11 S15	H11-Q13 VanDerWaalsContact C-N 3.28Å; H11-Q13 PolarHBondContact O-N 2.99Å; Q13-S15 PolarHBondContact O-N 2.94Å
14	V	33.8	Very low	38.2	Very low	33 Å²	33	110.3 Å²	110.3	20%	0.2	58%	0.581	C	S	.	*			trans	-82.6	95.3	168.8	-177.9	0	0	0	0	105.7	L12 S18	L12-V14 HydrophobicContact CD2-CG2 4.12Å; L12-V14 PolarHBondContact O-N 2.94Å; V14-S18 WeakPolarHBondContact CG1-O 3.36Å; V14-S18 WeakPolarHBondContact CG1-OG 3.19Å
15	S	27.2	Very low	39.7	Very low	75 Å²	75	108.8 Å²	108.8	52%	0.524	57%	0.568	S	S	.	*			trans	-46.7	142.3	161.9	33.5	0	0	0	0	110.4	Q13 G17 S18	Q13-S15 PolarHBondContact O-N 2.94Å; S15-G17 PolarHBondContact O-N 2.91Å; S15-S18 PolarHBondContact O-N 3.02Å; S15-S18 VanDerWaalsContact O-N 3.14Å; S15-S18 PolarHBondContact O-OG 3.25Å; S15-S18 PolarHBondContact OG-OG 2.8Å
16	P	26.4	Very low	41	Very low	137 Å²	137	107 Å²	107	89%	0.89	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	108.7	180	25.6	-31.1	0	0	0	108.4
17	G	32.8	Very low	42.6	Very low	84 Å²	84	105.6 Å²	105.6	87%	0.866	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.2	-8	-178.9	0	0	0	0	0	116.7	S15 S19	S15-G17 PolarHBondContact O-N 2.91Å; G17-S19 PolarHBondContact O-N 3.22Å
18	S	33	Very low	44.4	Very low	53 Å²	53	103.1 Å²	103.1	37%	0.371	54%	0.542	S	S	.	.			trans	-84.6	117.4	173.1	49.3	0	0	0	0	111	V14 S15 L20	V14-S18 WeakPolarHBondContact CG1-O 3.36Å; V14-S18 WeakPolarHBondContact CG1-OG 3.19Å; S15-S18 PolarHBondContact O-N 3.02Å; S15-S18 VanDerWaalsContact O-N 3.14Å; S15-S18 PolarHBondContact O-OG 3.25Å; S15-S18 PolarHBondContact OG-OG 2.8Å; S18-L20 PolarHBondContact O-N 2.97Å
19	S	38.3	Very low	45.9	Very low	102 Å²	102	98.8 Å²	98.8	71%	0.713	53%	0.525	S	S	*	.			trans	-48.1	131.1	165.5	51.3	0	0	0	0	110	G17 S21	G17-S19 PolarHBondContact O-N 3.22Å; S19-S21 PolarHBondContact O-N 3.4Å
20	L	49.7	Very low	47.4	Very low	27 Å²	27	96.6 Å²	96.6	14%	0.141	52%	0.524	C	S	.	.			trans	-36.2	135.7	171.6	-83.4	145.8	0	0	0	111.7	S18 E22 D24 R25 L28 W104	S18-L20 PolarHBondContact O-N 2.97Å; L20-E22 PolarHBondContact O-N 3.41Å; L20-D24 HydrophobicContact CD2-CB 3.45Å; L20-D24 VanDerWaalsContact CD2-CB 3.45Å; L20-R25 HydrophobicContact CB-CG 3.83Å; L20-R25 HydrophobicContact CD1-CG 3.73Å; L20-R25 HydrophobicContact CG-CG 4.28Å; L20-L28 HydrophobicContact CD2-CD1 4.34Å; L20-W104 HydrophobicContact CD1-CH2 4.1Å; L20-W104 HydrophobicContact CD1-CZ2 3.34Å; L20-W104 HydrophobicContact CD2-CH2 3.7Å; L20-W104 HydrophobicContact CD2-CZ2 3.72Å; L20-W104 HydrophobicContact CG-CH2 4.25Å; L20-W104 HydrophobicContact CG-CZ2 3.73Å
21	S	54.4	Low	49.4	Very low	52 Å²	52	90 Å²	90	36%	0.364	50%	0.503	S	S	.	.			trans	-56.2	140.9	164.6	82.1	0	0	0	0	108.2	S19 Q23 D24 R25	S19-S21 PolarHBondContact O-N 3.4Å; S21-Q23 PolarHBondContact O-N 2.99Å; S21-D24 PolarHBondContact O-N 3.4Å; S21-D24 PolarHBondContact OG-N 2.75Å; S21-D24 PolarHBondContact OG-OD2 3.26Å; S21-R25 PolarHBondContact O-N 3.22Å
22	E	53.4	Low	51	Low	166 Å²	166	82.9 Å²	82.9	78%	0.776	47%	0.473	S	S	*	.	H	α-helix	trans	-54.7	-26.7	178.6	-73.6	-171.9	148.6	0	0	112.1	L20 L26	L20-E22 PolarHBondContact O-N 3.41Å; E22-L26 WeakPolarHBondContact O-CD1 3.41Å; E22-L26 VanDerWaalsContact O-CG 3.25Å; E22-L26 WeakPolarHBondContact O-CG 3.4Å; E22-L26 PolarHBondContact O-N 3.33Å; E22-L26 VanDerWaalsContact O-N 3.11Å
23	Q	57.9	Low	52.6	Low	142 Å²	142	84.7 Å²	84.7	66%	0.664	49%	0.489	S	S	*	.	H	α-helix	trans	-66.5	-41.2	175.3	-82.3	170.3	-37.5	0	0	113.4	S21 R25 L26 N27	S21-Q23 PolarHBondContact O-N 2.99Å; Q23-R25 VanDerWaalsContact C-N 3.33Å; Q23-R25 PolarHBondContact O-N 3.22Å; Q23-L26 PolarHBondContact O-N 3.04Å; Q23-N27 WeakPolarHBondContact O-CB 3.46Å; Q23-N27 PolarHBondContact O-N 3.08Å; Q23-N27 PolarHBondContact O-ND2 3.48Å
24	D	61.6	Low	54.6	Low	38 Å²	38	83 Å²	83	20%	0.203	48%	0.482	C	S	.	.	H	α-helix	trans	-68.2	-36.6	179.5	-61.7	-42.6	0	0	0	111.3	L20 S21 N27 L28	L20-D24 HydrophobicContact CD2-CB 3.45Å; L20-D24 VanDerWaalsContact CD2-CB 3.45Å; S21-D24 PolarHBondContact O-N 3.4Å; S21-D24 PolarHBondContact OG-N 2.75Å; S21-D24 PolarHBondContact OG-OD2 3.26Å; D24-N27 PolarHBondContact O-N 3.17Å; D24-L28 VanDerWaalsContact O-CB 3.32Å; D24-L28 WeakPolarHBondContact O-CB 3.37Å; D24-L28 WeakPolarHBondContact O-CD1 3.37Å; D24-L28 WeakPolarHBondContact O-CG 3.45Å; D24-L28 PolarHBondContact O-N 2.88Å
25	R	60.8	Low	56.3	Low	138 Å²	138	83.9 Å²	83.9	52%	0.521	50%	0.497	S	S	.	.	H	α-helix	trans	-63.3	-41.9	172.4	-77.3	-179.9	164.7	172.7	-3.8	112.4	L20 S21 Q23 A29	L20-R25 HydrophobicContact CB-CG 3.83Å; L20-R25 HydrophobicContact CD1-CG 3.73Å; L20-R25 HydrophobicContact CG-CG 4.28Å; S21-R25 PolarHBondContact O-N 3.22Å; Q23-R25 VanDerWaalsContact C-N 3.33Å; Q23-R25 PolarHBondContact O-N 3.22Å; R25-A29 VanDerWaalsContact O-CB 3.31Å; R25-A29 WeakPolarHBondContact O-CB 3.24Å; R25-A29 PolarHBondContact O-N 2.78Å
26	L	61.6	Low	58.5	Low	118 Å²	118	84.3 Å²	84.3	62%	0.618	49%	0.493	S	S	*	.	H	α-helix	trans	-67.6	-41	177.4	-72.6	167.1	0	0	0	111.9	E22 Q23 A29 L30	E22-L26 WeakPolarHBondContact O-CD1 3.41Å; E22-L26 VanDerWaalsContact O-CG 3.25Å; E22-L26 WeakPolarHBondContact O-CG 3.4Å; E22-L26 PolarHBondContact O-N 3.33Å; E22-L26 VanDerWaalsContact O-N 3.11Å; Q23-L26 PolarHBondContact O-N 3.04Å; L26-A29 PolarHBondContact O-N 3.45Å; L26-L30 WeakPolarHBondContact O-CB 3.37Å; L26-L30 PolarHBondContact O-N 2.92Å
27	N	69	Low	60.4	Low	92 Å²	92	78 Å²	78	49%	0.492	45%	0.452	S	S	.	.	H	α-helix	trans	-66.5	-41.2	176.8	-69.8	-26.8	0	0	0	111.8	Q23 D24 L30 L31	Q23-N27 WeakPolarHBondContact O-CB 3.46Å; Q23-N27 PolarHBondContact O-N 3.08Å; Q23-N27 PolarHBondContact O-ND2 3.48Å; D24-N27 PolarHBondContact O-N 3.17Å; N27-L30 WeakPolarHBondContact O-CB 3.07Å; N27-L30 PolarHBondContact O-N 3.36Å; N27-L31 WeakPolarHBondContact O-CG 3.42Å; N27-L31 PolarHBondContact O-N 3.26Å
28	L	67.8	Low	62.2	Low	32 Å²	32	82.5 Å²	82.5	17%	0.168	44%	0.443	C	S	.	.	H	α-helix	trans	-66	-41.4	174.5	-74.1	166	0	0	0	111.9	L20 D24 L30 L31 C32 L40 W104	L20-L28 HydrophobicContact CD2-CD1 4.34Å; D24-L28 VanDerWaalsContact O-CB 3.32Å; D24-L28 WeakPolarHBondContact O-CB 3.37Å; D24-L28 WeakPolarHBondContact O-CD1 3.37Å; D24-L28 WeakPolarHBondContact O-CG 3.45Å; D24-L28 PolarHBondContact O-N 2.88Å; L28-L30 VanDerWaalsContact C-N 3.31Å; L28-L30 PolarHBondContact O-N 3.29Å; L28-L31 PolarHBondContact O-N 3.23Å; L28-C32 WeakPolarHBondContact O-CB 3.44Å; L28-C32 PolarHBondContact O-N 3.23Å; L28-C32 PolarHBondContact O-SG 2.96Å; L28-L40 HydrophobicContact CD2-CD1 3.85Å; L28-W104 HydrophobicContact CD1-CE3 3.8Å; L28-W104 HydrophobicContact CD1-CH2 3.8Å; L28-W104 HydrophobicContact CD1-CZ3 3.28Å; L28-W104 HydrophobicContact CD2-CZ3 4.37Å; L28-W104 HydrophobicContact CG-CZ3 4.47Å
29	A	64.6	Low	64.3	Low	39 Å²	39	85 Å²	85	32%	0.322	45%	0.452	S	S	.	.	H	α-helix	trans	-61.5	-39.1	174.5	0	0	0	0	0	112	R25 L26 C32 S33	R25-A29 VanDerWaalsContact O-CB 3.31Å; R25-A29 WeakPolarHBondContact O-CB 3.24Å; R25-A29 PolarHBondContact O-N 2.78Å; L26-A29 PolarHBondContact O-N 3.45Å; A29-C32 PolarHBondContact O-N 3.11Å; A29-S33 WeakPolarHBondContact O-CB 3.39Å; A29-S33 PolarHBondContact O-N 3.29Å
30	L	70.9	Confident	66.1	Low	107 Å²	107	82 Å²	82	56%	0.56	43%	0.427	S	S	*	.	H	α-helix	trans	-64.2	-47.3	175	-171.5	75.2	0	0	0	111.4	L26 N27 L28 C32 S33 Q34	L26-L30 WeakPolarHBondContact O-CB 3.37Å; L26-L30 PolarHBondContact O-N 2.92Å; N27-L30 WeakPolarHBondContact O-CB 3.07Å; N27-L30 PolarHBondContact O-N 3.36Å; L28-L30 VanDerWaalsContact C-N 3.31Å; L28-L30 PolarHBondContact O-N 3.29Å; L30-C32 VanDerWaalsContact C-N 3.32Å; L30-C32 PolarHBondContact O-N 2.94Å; L30-S33 PolarHBondContact O-N 2.88Å; L30-S33 PolarHBondContact O-OG 3.27Å; L30-Q34 PolarHBondContact O-N 2.7Å
31	L	72.1	Confident	67.4	Low	63 Å²	63	80.9 Å²	80.9	33%	0.33	42%	0.422	S	S	.	.	H	α-helix	trans	-63.2	-37.4	178	-72.1	169.4	0	0	0	112.5	N27 L28 Q34 G35 L36 G37	N27-L31 WeakPolarHBondContact O-CG 3.42Å; N27-L31 PolarHBondContact O-N 3.26Å; L28-L31 PolarHBondContact O-N 3.23Å; L31-Q34 PolarHBondContact O-N 3.19Å; L31-G35 PolarHBondContact O-N 3.03Å; L31-L36 HydrophobicContact CD2-CB 4.41Å; L31-L36 HydrophobicContact CD2-CD1 4.21Å; L31-L36 PolarHBondContact O-N 3.02Å; L31-G37 PolarHBondContact O-N 3.44Å
32	C	69.7	Low	68.6	Low	23 Å²	23	81.1 Å²	81.1	16%	0.155	42%	0.422	C	S	.	.	H	α-helix	trans	-68.6	-37.4	175.4	-65.6	0	0	0	0	111.9	L28 A29 L30 Q34 G35 C110 M112	L28-C32 WeakPolarHBondContact O-CB 3.44Å; L28-C32 PolarHBondContact O-N 3.23Å; L28-C32 PolarHBondContact O-SG 2.96Å; A29-C32 PolarHBondContact O-N 3.11Å; L30-C32 VanDerWaalsContact C-N 3.32Å; L30-C32 PolarHBondContact O-N 2.94Å; C32-Q34 PolarHBondContact O-N 3.3Å; C32-G35 PolarHBondContact O-N 2.95Å; C32-C110 HydrophobicContact CB-CB 3.88Å; C32-C110 VanDerWaalsContact CB-O 3.23Å; C32-C110 WeakPolarHBondContact CB-O 3.26Å; C32-M112 WeakPolarHBondContact SG-CG 3.27Å
33	S	68	Low	70.1	Confident	83 Å²	83	79.5 Å²	79.5	58%	0.58	41%	0.409	S	S	*	.	H	α-helix	trans	-62.8	-25.2	176.1	77.9	0	0	0	0	113.4	A29 L30	A29-S33 WeakPolarHBondContact O-CB 3.39Å; A29-S33 PolarHBondContact O-N 3.29Å; L30-S33 PolarHBondContact O-N 2.88Å; L30-S33 PolarHBondContact O-OG 3.27Å
34	Q	74.2	Confident	71.2	Confident	140 Å²	140	74.2 Å²	74.2	65%	0.654	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	5.8	176.8	-59.8	-63.9	-25.8	0	0	113.4	L30 L31 C32 L36	L30-Q34 PolarHBondContact O-N 2.7Å; L31-Q34 PolarHBondContact O-N 3.19Å; C32-Q34 PolarHBondContact O-N 3.3Å; Q34-L36 HydrophobicContact CB-CD1 4.41Å; Q34-L36 HydrophobicContact CB-CG 4.45Å; Q34-L36 PolarHBondContact O-N 2.81Å
35	G	69.3	Low	72.2	Confident	51 Å²	51	72.9 Å²	72.9	53%	0.526	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	2.6	179.8	0	0	0	0	0	115.7	L31 C32	L31-G35 PolarHBondContact O-N 3.03Å; C32-G35 PolarHBondContact O-N 2.95Å
36	L	72.1	Confident	73.4	Confident	84 Å²	84	71.6 Å²	71.6	44%	0.44	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-11.6	-176.7	-65.6	172.9	0	0	0	113.8	L31 Q34 R38 L39	L31-L36 HydrophobicContact CD2-CB 4.41Å; L31-L36 HydrophobicContact CD2-CD1 4.21Å; L31-L36 PolarHBondContact O-N 3.02Å; Q34-L36 HydrophobicContact CB-CD1 4.41Å; Q34-L36 HydrophobicContact CB-CG 4.45Å; Q34-L36 PolarHBondContact O-N 2.81Å; L36-R38 PolarHBondContact O-N 2.98Å; L36-L39 HydrophobicContact CD2-CD1 3.91Å; L36-L39 PolarHBondContact O-N 3.26Å
37	G	68.2	Low	74.5	Confident	3 Å²	3	67.4 Å²	67.4	3%	0.031	36%	0.358	C	S	.	.	H	α-helix	trans	-55.6	-34.3	178.6	0	0	0	0	0	113.6	L31 L39 L40 M112	L31-G37 PolarHBondContact O-N 3.44Å; G37-L39 PolarHBondContact O-N 3.36Å; G37-L40 PolarHBondContact O-N 2.99Å; G37-M112 WeakPolarHBondContact O-CE 3.29Å
38	R	70.2	Confident	75.3	Confident	180 Å²	180	63.1 Å²	63.1	68%	0.679	34%	0.335	S	S	*	.	H	α-helix	trans	-67.4	-22.3	179.5	-62.8	-176.6	-178.2	-177.6	-0	113.7	L36	L36-R38 PolarHBondContact O-N 2.98Å
39	L	75.9	Confident	76.2	Confident	105 Å²	105	66.2 Å²	66.2	55%	0.55	35%	0.349	S	S	.	.	H	α-helix	trans	-86.5	-18.6	-178.3	-62.2	176.4	0	0	0	112.7	L36 G37 G41 V42 W43	L36-L39 HydrophobicContact CD2-CD1 3.91Å; L36-L39 PolarHBondContact O-N 3.26Å; G37-L39 PolarHBondContact O-N 3.36Å; L39-G41 VanDerWaalsContact C-N 3.34Å; L39-G41 PolarHBondContact O-N 3.43Å; L39-V42 PolarHBondContact O-N 3.47Å; L39-W43 WeakPolarHBondContact O-CB 3.48Å; L39-W43 PolarHBondContact O-N 2.88Å
40	L	77.6	Confident	77.4	Confident	38 Å²	38	68.7 Å²	68.7	20%	0.199	36%	0.36	C	S	.	.	H	α-helix	trans	-59.4	-41.5	-177.2	-70.6	170.8	0	0	0	112.8	L28 G37 W43 L44 L101	L28-L40 HydrophobicContact CD2-CD1 3.85Å; G37-L40 PolarHBondContact O-N 2.99Å; L40-W43 PolarHBondContact O-N 3.23Å; L40-L44 WeakPolarHBondContact O-CB 3.5Å; L40-L44 WeakPolarHBondContact O-CG 3.25Å; L40-L44 PolarHBondContact O-N 3.3Å; L40-L101 HydrophobicContact CB-CD1 4.47Å; L40-L101 HydrophobicContact CB-CD2 4.36Å
41	G	75.4	Confident	78.1	Confident	4 Å²	4	67.5 Å²	67.5	4%	0.041	35%	0.348	C	S	.	.	H	α-helix	trans	-67.4	-38.4	178.2	0	0	0	0	0	112.9	L39 L45	L39-G41 VanDerWaalsContact C-N 3.34Å; L39-G41 PolarHBondContact O-N 3.43Å; G41-L45 VanDerWaalsContact O-CG 3.27Å; G41-L45 WeakPolarHBondContact O-CG 3.35Å; G41-L45 PolarHBondContact O-N 3.49Å
42	V	81.3	Confident	78.7	Confident	58 Å²	58	64.5 Å²	64.5	35%	0.352	33%	0.332	S	S	.	.	H	α-helix	trans	-69.4	-45.1	176.4	-179.6	0	0	0	0	110.3	L39 L44 L45 E46	L39-V42 PolarHBondContact O-N 3.47Å; V42-L44 PolarHBondContact O-N 2.96Å; V42-L45 PolarHBondContact O-N 3.03Å; V42-E46 HydrophobicContact CG1-CG 4.4Å; V42-E46 WeakPolarHBondContact O-CG 3.39Å; V42-E46 PolarHBondContact O-N 3.45Å
43	W	83.9	Confident	79.6	Confident	132 Å²	132	66.6 Å²	66.6	50%	0.5	35%	0.347	S	S	.	.	H	α-helix	trans	-61.6	-41.6	178.3	178.2	82.5	0	0	0	112.7	L39 L40 E46 S47	L39-W43 WeakPolarHBondContact O-CB 3.48Å; L39-W43 PolarHBondContact O-N 2.88Å; L40-W43 PolarHBondContact O-N 3.23Å; W43-E46 PolarHBondContact O-N 3.14Å; W43-S47 VanDerWaalsContact O-CB 3.23Å; W43-S47 WeakPolarHBondContact O-CB 3.48Å; W43-S47 PolarHBondContact O-N 3.3Å; W43-S47 PolarHBondContact O-OG 3.37Å
44	L	81.2	Confident	80.5	Confident	30 Å²	30	66.3 Å²	66.3	16%	0.157	35%	0.345	C	S	.	.	H	α-helix	trans	-64.8	-41.1	175.4	-79.4	172.6	0	0	0	111.9	L40 V42 S47 L48 L98 L101	L40-L44 WeakPolarHBondContact O-CB 3.5Å; L40-L44 WeakPolarHBondContact O-CG 3.25Å; L40-L44 PolarHBondContact O-N 3.3Å; V42-L44 PolarHBondContact O-N 2.96Å; L44-S47 PolarHBondContact O-N 3.14Å; L44-L48 VanDerWaalsContact O-CB 3.27Å; L44-L48 WeakPolarHBondContact O-CB 3.21Å; L44-L48 PolarHBondContact O-N 3Å; L44-L98 HydrophobicContact CB-CD2 3.86Å; L44-L98 HydrophobicContact CD1-CD2 4.1Å; L44-L101 HydrophobicContact CD1-CD2 3.86Å
45	L	83.4	Confident	81	Confident	11 Å²	11	60.6 Å²	60.6	6%	0.058	32%	0.32	C	S	.	.	H	α-helix	trans	-66.4	-41.3	176.5	-72.4	171.6	0	0	0	112.1	G41 V42 L48 Q49 L98 L120 R123 A124	G41-L45 VanDerWaalsContact O-CG 3.27Å; G41-L45 WeakPolarHBondContact O-CG 3.35Å; G41-L45 PolarHBondContact O-N 3.49Å; V42-L45 PolarHBondContact O-N 3.03Å; L45-L48 PolarHBondContact O-N 3.48Å; L45-Q49 WeakPolarHBondContact O-CB 3.34Å; L45-Q49 PolarHBondContact O-N 3.29Å; L45-L98 HydrophobicContact CD2-CD1 4.07Å; L45-L98 HydrophobicContact CD2-CD2 4.45Å; L45-L98 HydrophobicContact CG-CD2 4.48Å; L45-L120 HydrophobicContact CD1-CD2 4.11Å; L45-R123 HydrophobicContact CD1-CB 4.03Å; L45-R123 HydrophobicContact CD2-CB 4.28Å; L45-A124 HydrophobicContact CD2-CB 3.84Å
46	E	85.1	Confident	81.8	Confident	110 Å²	110	58.6 Å²	58.6	51%	0.514	30%	0.298	S	S	.	.	H	α-helix	trans	-66.2	-41.9	174.9	-74.3	179.2	176.7	0	0	111.6	V42 W43 L48 Q49 V50	V42-E46 HydrophobicContact CG1-CG 4.4Å; V42-E46 WeakPolarHBondContact O-CG 3.39Å; V42-E46 PolarHBondContact O-N 3.45Å; W43-E46 PolarHBondContact O-N 3.14Å; E46-L48 VanDerWaalsContact C-N 3.34Å; E46-L48 PolarHBondContact O-N 3.29Å; E46-Q49 WeakPolarHBondContact O-CB 3.22Å; E46-Q49 PolarHBondContact O-N 3.1Å; E46-V50 WeakPolarHBondContact O-CG2 3.41Å; E46-V50 PolarHBondContact O-N 2.88Å
47	S	84.7	Confident	82.5	Confident	30 Å²	30	55.5 Å²	55.5	21%	0.21	28%	0.282	C	S	.	.	H	α-helix	trans	-63.3	-41.6	175.9	-61.8	0	0	0	0	111.6	W43 L44 V50 R51	W43-S47 VanDerWaalsContact O-CB 3.23Å; W43-S47 WeakPolarHBondContact O-CB 3.48Å; W43-S47 PolarHBondContact O-N 3.3Å; W43-S47 PolarHBondContact O-OG 3.37Å; L44-S47 PolarHBondContact O-N 3.14Å; S47-V50 PolarHBondContact O-N 3.36Å; S47-R51 WeakPolarHBondContact O-CB 3.32Å; S47-R51 WeakPolarHBondContact O-CG 3.46Å; S47-R51 PolarHBondContact O-N 3.13Å
48	L	85	Confident	83.4	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-60.1	-47	172.7	177.4	66.1	0	0	0	110.7	L44 L45 E46 V50 R51 L52 L91 F94 L98 A124	L44-L48 VanDerWaalsContact O-CB 3.27Å; L44-L48 WeakPolarHBondContact O-CB 3.21Å; L44-L48 PolarHBondContact O-N 3Å; L45-L48 PolarHBondContact O-N 3.48Å; E46-L48 VanDerWaalsContact C-N 3.34Å; E46-L48 PolarHBondContact O-N 3.29Å; L48-V50 PolarHBondContact O-N 3.45Å; L48-R51 PolarHBondContact O-N 2.98Å; L48-L52 HydrophobicContact CD1-CD1 4.06Å; L48-L52 HydrophobicContact CD1-CG 4.15Å; L48-L52 HydrophobicContact CD2-CD1 4.47Å; L48-L52 HydrophobicContact CG-CD1 3.82Å; L48-L52 HydrophobicContact CG-CG 4.33Å; L48-L52 VanDerWaalsContact O-CB 3.29Å; L48-L52 WeakPolarHBondContact O-CB 3.3Å; L48-L52 VanDerWaalsContact O-CG 3.24Å; L48-L52 WeakPolarHBondContact O-CG 3.43Å; L48-L52 PolarHBondContact O-N 3.47Å; L48-L91 HydrophobicContact CD1-CD2 3.9Å; L48-F94 HydrophobicContact CD1-CB 3.96Å; L48-F94 HydrophobicContact CD1-CD1 4.4Å; L48-F94 HydrophobicContact CD1-CD2 4.34Å; L48-F94 HydrophobicContact CD1-CG 3.99Å; L48-L98 HydrophobicContact CD2-CD1 4.49Å; L48-A124 HydrophobicContact CD2-CB 3.78Å
49	Q	88.4	Confident	84.2	Confident	98 Å²	98	55.6 Å²	55.6	46%	0.458	30%	0.295	S	S	.	.	H	α-helix	trans	-61.4	-43.6	179	-173	-179.5	-6.9	0	0	112.6	L45 E46 S53 T127 L131	L45-Q49 WeakPolarHBondContact O-CB 3.34Å; L45-Q49 PolarHBondContact O-N 3.29Å; E46-Q49 WeakPolarHBondContact O-CB 3.22Å; E46-Q49 PolarHBondContact O-N 3.1Å; Q49-S53 WeakPolarHBondContact O-CB 3.48Å; Q49-S53 PolarHBondContact O-N 3.38Å; Q49-S53 PolarHBondContact O-OG 3.46Å; Q49-T127 HydrophobicContact CB-CG2 4.11Å; Q49-T127 HydrophobicContact CG-CG2 4.03Å; Q49-L131 HydrophobicContact CG-CD1 4.24Å
50	V	88	Confident	84.8	Confident	91 Å²	91	51.1 Å²	51.1	55%	0.552	27%	0.272	S	S	*	.	H	α-helix	trans	-64.9	-43.4	176.9	172.7	0	0	0	0	111	E46 S47 L48 S53 S54	E46-V50 WeakPolarHBondContact O-CG2 3.41Å; E46-V50 PolarHBondContact O-N 2.88Å; S47-V50 PolarHBondContact O-N 3.36Å; L48-V50 PolarHBondContact O-N 3.45Å; V50-S53 PolarHBondContact O-OG 3.48Å; V50-S53 VanDerWaalsContact O-OG 3.09Å; V50-S54 VanDerWaalsContact O-CB 3.28Å; V50-S54 WeakPolarHBondContact O-CB 3.48Å; V50-S54 PolarHBondContact O-N 3.09Å; V50-S54 PolarHBondContact O-OG 3.38Å
51	R	85.5	Confident	85.3	Confident	82 Å²	82	50.7 Å²	50.7	31%	0.309	27%	0.267	S	S	.	.	H	α-helix	trans	-65.9	-42.9	177.6	-75.5	-74	-65.7	178.1	2.2	112.4	S47 L48 S55 V56 F94	S47-R51 WeakPolarHBondContact O-CB 3.32Å; S47-R51 WeakPolarHBondContact O-CG 3.46Å; S47-R51 PolarHBondContact O-N 3.13Å; L48-R51 PolarHBondContact O-N 2.98Å; R51-S55 PolarHBondContact O-N 2.85Å; R51-S55 VanDerWaalsContact O-N 3.08Å; R51-S55 PolarHBondContact O-OG 3.3Å; R51-V56 PolarHBondContact O-N 3.19Å; R51-F94 HydrophobicContact CG-CZ 4.38Å
52	L	86.4	Confident	85.8	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.291	C	S	.	.	I	π-helix	trans	-56.9	-52.8	175.5	-79.6	171.3	0	0	0	111	L48 V56 V57 L91 T127 I128 L131	L48-L52 HydrophobicContact CD1-CD1 4.06Å; L48-L52 HydrophobicContact CD1-CG 4.15Å; L48-L52 HydrophobicContact CD2-CD1 4.47Å; L48-L52 HydrophobicContact CG-CD1 3.82Å; L48-L52 HydrophobicContact CG-CG 4.33Å; L48-L52 VanDerWaalsContact O-CB 3.29Å; L48-L52 WeakPolarHBondContact O-CB 3.3Å; L48-L52 VanDerWaalsContact O-CG 3.24Å; L48-L52 WeakPolarHBondContact O-CG 3.43Å; L48-L52 PolarHBondContact O-N 3.47Å; L52-V56 HydrophobicContact CD2-CB 4.26Å; L52-V56 HydrophobicContact CD2-CG1 4.2Å; L52-V57 HydrophobicContact CB-CG2 4.34Å; L52-V57 HydrophobicContact CD2-CG2 4.35Å; L52-V57 VanDerWaalsContact O-CB 3.24Å; L52-V57 WeakPolarHBondContact O-CB 3.36Å; L52-V57 WeakPolarHBondContact O-CG2 3.18Å; L52-V57 PolarHBondContact O-N 3.3Å; L52-L91 HydrophobicContact CD2-CD2 3.66Å; L52-L91 HydrophobicContact CG-CD2 4.39Å; L52-T127 HydrophobicContact CD1-CG2 4.42Å; L52-I128 HydrophobicContact CD1-CG1 3.72Å; L52-I128 HydrophobicContact CD2-CG1 4.46Å; L52-L131 HydrophobicContact CB-CD1 3.61Å; L52-L131 HydrophobicContact CD1-CD1 4.06Å; L52-L131 HydrophobicContact CG-CD1 4.49Å
53	S	86.9	Confident	85.8	Confident	66 Å²	66	52.6 Å²	52.6	46%	0.462	29%	0.287	S	S	.	.	I	π-helix	trans	-69	-35.5	-177.5	53.9	0	0	0	0	114.4	Q49 V50	Q49-S53 WeakPolarHBondContact O-CB 3.48Å; Q49-S53 PolarHBondContact O-N 3.38Å; Q49-S53 PolarHBondContact O-OG 3.46Å; V50-S53 PolarHBondContact O-OG 3.48Å; V50-S53 VanDerWaalsContact O-OG 3.09Å
54	S	87.3	Confident	85.7	Confident	77 Å²	77	46.6 Å²	46.6	54%	0.538	27%	0.265	S	S	.	.	I	π-helix	trans	-89	-29	-173.3	58.6	0	0	0	0	115.2	V50	V50-S54 VanDerWaalsContact O-CB 3.28Å; V50-S54 WeakPolarHBondContact O-CB 3.48Å; V50-S54 PolarHBondContact O-N 3.09Å; V50-S54 PolarHBondContact O-OG 3.38Å
55	S	85.6	Confident	85.4	Confident	20 Å²	20	50.8 Å²	50.8	14%	0.14	28%	0.283	C	S	.	.	I	π-helix	trans	-135.8	-55.2	-170.4	53.5	0	0	0	0	113.3	R51 P58 E59	R51-S55 PolarHBondContact O-N 2.85Å; R51-S55 VanDerWaalsContact O-N 3.08Å; R51-S55 PolarHBondContact O-OG 3.3Å; S55-P58 WeakPolarHBondContact O-CD 3.27Å; S55-E59 VanDerWaalsContact O-CB 3.26Å; S55-E59 WeakPolarHBondContact O-CB 3.35Å; S55-E59 WeakPolarHBondContact O-CG 3.48Å; S55-E59 PolarHBondContact O-N 2.98Å
56	V	85.8	Confident	84.7	Confident	10 Å²	10	53.8 Å²	53.8	6%	0.061	30%	0.297	C	S	.	.	I	π-helix	trans	-68.7	-44.9	-168.3	-178	0	0	0	0	112.6	R51 L52 F60 L87 Q90	R51-V56 PolarHBondContact O-N 3.19Å; L52-V56 HydrophobicContact CD2-CB 4.26Å; L52-V56 HydrophobicContact CD2-CG1 4.2Å; V56-F60 WeakPolarHBondContact O-CB 3.22Å; V56-F60 PolarHBondContact O-N 3.19Å; V56-L87 HydrophobicContact CG1-CD1 3.52Å; V56-Q90 HydrophobicContact CG1-CB 4.42Å; V56-Q90 HydrophobicContact CG2-CB 4.46Å
57	V	87.3	Confident	83.7	Confident	18 Å²	18	53 Å²	53	11%	0.109	30%	0.302	C	S	.	.	H	α-helix	trans	-68.4	-48.7	-179.9	174.7	0	0	0	0	111.5	L52 E59 F60 W61 L131 L132	L52-V57 HydrophobicContact CB-CG2 4.34Å; L52-V57 HydrophobicContact CD2-CG2 4.35Å; L52-V57 VanDerWaalsContact O-CB 3.24Å; L52-V57 WeakPolarHBondContact O-CB 3.36Å; L52-V57 WeakPolarHBondContact O-CG2 3.18Å; L52-V57 PolarHBondContact O-N 3.3Å; V57-E59 PolarHBondContact O-N 3.47Å; V57-F60 PolarHBondContact O-N 2.98Å; V57-W61 VanDerWaalsContact CG1-NE1 3.32Å; V57-W61 PolarHBondContact O-N 3.31Å; V57-W61 VanDerWaalsContact O-N 3.12Å; V57-L131 HydrophobicContact CG2-CB 4.28Å; V57-L132 HydrophobicContact CB-CD2 4.3Å; V57-L132 HydrophobicContact CG1-CD2 4.1Å; V57-L132 HydrophobicContact CG2-CD2 3.72Å; V57-L132 HydrophobicContact CG2-CG 4.09Å
58	P	87.4	Confident	82.2	Confident	66 Å²	66	56.5 Å²	56.5	43%	0.429	31%	0.314	S	S	.	.	H	α-helix	trans	-59.2	-42.1	174.8	-25.6	34.7	0	0	0	114	S55 W61 S62	S55-P58 WeakPolarHBondContact O-CD 3.27Å; P58-W61 PolarHBondContact O-N 3.5Å; P58-S62 WeakPolarHBondContact O-CB 3.38Å; P58-S62 PolarHBondContact O-N 3.06Å; P58-S62 PolarHBondContact O-OG 3.07Å
59	E	86.9	Confident	80.8	Confident	119 Å²	119	64.3 Å²	64.3	56%	0.556	36%	0.356	S	S	*	.	H	α-helix	trans	-62.3	-44.6	177.4	-76.8	174.8	-171.2	0	0	111.3	S55 V57 W61 S62 G63	S55-E59 VanDerWaalsContact O-CB 3.26Å; S55-E59 WeakPolarHBondContact O-CB 3.35Å; S55-E59 WeakPolarHBondContact O-CG 3.48Å; S55-E59 PolarHBondContact O-N 2.98Å; V57-E59 PolarHBondContact O-N 3.47Å; E59-W61 PolarHBondContact O-N 3.09Å; E59-S62 WeakPolarHBondContact CA-OG 3.33Å; E59-S62 PolarHBondContact O-N 3.41Å; E59-S62 PolarHBondContact O-OG 3.18Å; E59-G63 PolarHBondContact O-N 3.22Å
60	F	88.7	Confident	79.4	Confident	11 Å²	11	67.6 Å²	67.6	5%	0.048	37%	0.372	C	S	.	.	H	α-helix	trans	-56.8	-49	176.1	174.3	-99	0	0	0	112.3	V56 V57 G63 L64 A83 F84 L87 L132	V56-F60 WeakPolarHBondContact O-CB 3.22Å; V56-F60 PolarHBondContact O-N 3.19Å; V57-F60 PolarHBondContact O-N 2.98Å; F60-G63 PolarHBondContact O-N 3.27Å; F60-L64 HydrophobicContact CD1-CD1 4.09Å; F60-L64 HydrophobicContact CE1-CD1 3.49Å; F60-L64 VanDerWaalsContact CE1-CD1 3.49Å; F60-L64 HydrophobicContact CE2-CD1 4.11Å; F60-L64 HydrophobicContact CZ-CD1 3.51Å; F60-L64 PolarHBondContact O-N 3.34Å; F60-A83 HydrophobicContact CD2-CB 4.13Å; F60-A83 HydrophobicContact CE2-CB 4Å; F60-F84 HydrophobicContact CE2-CD1 4.07Å; F60-F84 HydrophobicContact CE2-CD2 4.5Å; F60-F84 HydrophobicContact CE2-CE1 4.07Å; F60-F84 HydrophobicContact CE2-CG 4.29Å; F60-F84 HydrophobicContact CE2-CZ 4.29Å; F60-F84 HydrophobicContact CZ-CD1 4.32Å; F60-F84 AromaticContact CZ-CE1 3.85Å; F60-F84 HydrophobicContact CZ-CE1 3.85Å; F60-F84 HydrophobicContact CZ-CE2 4.23Å; F60-F84 AromaticContact CZ-CZ 3.8Å; F60-F84 HydrophobicContact CZ-CZ 3.8Å; F60-L87 HydrophobicContact CD2-CB 4.16Å; F60-L87 HydrophobicContact CD2-CD2 4.15Å; F60-L87 HydrophobicContact CE2-CD2 4.09Å; F60-L132 HydrophobicContact CD1-CD2 3.98Å; F60-L132 HydrophobicContact CE1-CD2 4.38Å; F60-L132 HydrophobicContact CG-CD2 4.49Å
61	W	87.9	Confident	78.4	Confident	30 Å²	30	65.9 Å²	65.9	11%	0.114	36%	0.359	C	S	.	.	H	α-helix	trans	-67.6	-42.2	179.6	-65.9	120.1	0	0	0	112.5	V57 P58 E59 G63 L64 E65 L132 P136 P137 L140	V57-W61 VanDerWaalsContact CG1-NE1 3.32Å; V57-W61 PolarHBondContact O-N 3.31Å; V57-W61 VanDerWaalsContact O-N 3.12Å; P58-W61 PolarHBondContact O-N 3.5Å; E59-W61 PolarHBondContact O-N 3.09Å; W61-G63 PolarHBondContact O-N 3.33Å; W61-L64 HydrophobicContact CE3-CD1 4.03Å; W61-L64 HydrophobicContact CZ3-CD1 4.05Å; W61-L64 PolarHBondContact O-N 3.49Å; W61-E65 WeakPolarHBondContact O-CG 3.19Å; W61-E65 PolarHBondContact O-N 2.72Å; W61-L132 WeakPolarHBondContact CZ2-O 3.32Å; W61-P136 HydrophobicContact CH2-CB 4.07Å; W61-P137 HydrophobicContact CD2-CG 3.93Å; W61-P137 HydrophobicContact CE3-CB 4.23Å; W61-P137 HydrophobicContact CE3-CG 3.63Å; W61-P137 VanDerWaalsContact CH2-CD 3.49Å; W61-P137 HydrophobicContact CH2-CG 4.3Å; W61-P137 HydrophobicContact CZ3-CB 4.15Å; W61-P137 VanDerWaalsContact CZ3-CD 3.47Å; W61-P137 HydrophobicContact CZ3-CG 3.79Å; W61-L140 HydrophobicContact CH2-CB 4.03Å; W61-L140 HydrophobicContact CH2-CD2 3.65Å; W61-L140 HydrophobicContact CH2-CG 4.43Å; W61-L140 HydrophobicContact CZ3-CB 3.66Å; W61-L140 HydrophobicContact CZ3-CD2 4.12Å; W61-L140 HydrophobicContact CZ3-CG 4.43Å
62	S	84.2	Confident	78.1	Confident	76 Å²	76	68.7 Å²	68.7	53%	0.531	38%	0.376	S	S	.	.	H	α-helix	trans	-61.2	-33.1	176	73.9	0	0	0	0	112.8	P58 E59 L64	P58-S62 WeakPolarHBondContact O-CB 3.38Å; P58-S62 PolarHBondContact O-N 3.06Å; P58-S62 PolarHBondContact O-OG 3.07Å; E59-S62 WeakPolarHBondContact CA-OG 3.33Å; E59-S62 PolarHBondContact O-N 3.41Å; E59-S62 PolarHBondContact O-OG 3.18Å; S62-L64 VanDerWaalsContact C-N 3.31Å; S62-L64 PolarHBondContact O-N 2.86Å
63	G	81.5	Confident	77.8	Confident	26 Å²	26	70.1 Å²	70.1	27%	0.268	38%	0.382	S	S	.	.	H	α-helix	trans	-68.4	-28.7	174.7	0	0	0	0	0	113.4	E59 F60 W61 Q66 V79	E59-G63 PolarHBondContact O-N 3.22Å; F60-G63 PolarHBondContact O-N 3.27Å; W61-G63 PolarHBondContact O-N 3.33Å; G63-Q66 PolarHBondContact O-NE2 3.15Å; G63-V79 VanDerWaalsContact O-CG1 3.27Å; G63-V79 WeakPolarHBondContact O-CG1 3.33Å
64	L	81.9	Confident	77.7	Confident	6 Å²	6	71.1 Å²	71.1	3%	0.031	38%	0.376	C	S	.	.	H	α-helix	trans	-88	-29.3	178.9	-70.2	174.3	0	0	0	113.6	F60 W61 S62 Q66 L80 A83 L140	F60-L64 HydrophobicContact CD1-CD1 4.09Å; F60-L64 HydrophobicContact CE1-CD1 3.49Å; F60-L64 VanDerWaalsContact CE1-CD1 3.49Å; F60-L64 HydrophobicContact CE2-CD1 4.11Å; F60-L64 HydrophobicContact CZ-CD1 3.51Å; F60-L64 PolarHBondContact O-N 3.34Å; W61-L64 HydrophobicContact CE3-CD1 4.03Å; W61-L64 HydrophobicContact CZ3-CD1 4.05Å; W61-L64 PolarHBondContact O-N 3.49Å; S62-L64 VanDerWaalsContact C-N 3.31Å; S62-L64 PolarHBondContact O-N 2.86Å; L64-Q66 PolarHBondContact O-N 2.94Å; L64-Q66 VanDerWaalsContact O-N 3.14Å; L64-L80 HydrophobicContact CD2-CD1 3.98Å; L64-A83 HydrophobicContact CD2-CB 3.82Å; L64-A83 HydrophobicContact CG-CB 4.11Å; L64-L140 HydrophobicContact CD1-CD1 4.09Å
65	E	75.4	Confident	77.6	Confident	118 Å²	118	69.6 Å²	69.6	55%	0.551	36%	0.362	S	S	*	.			trans	-78.8	20.6	-176.7	-73.1	-176.6	169.4	0	0	115	W61	W61-E65 WeakPolarHBondContact O-CG 3.19Å; W61-E65 PolarHBondContact O-N 2.72Å
66	Q	69.4	Low	77.6	Confident	74 Å²	74	71.1 Å²	71.1	35%	0.346	36%	0.364	S	S	.	.			trans	-55.5	144.4	177.4	-64	-177.1	11.2	0	0	112.1	G63 L64 Q68 L71	G63-Q66 PolarHBondContact O-NE2 3.15Å; L64-Q66 PolarHBondContact O-N 2.94Å; L64-Q66 VanDerWaalsContact O-N 3.14Å; Q66-Q68 PolarHBondContact O-N 3.43Å; Q66-Q68 VanDerWaalsContact O-N 3.16Å; Q66-L71 HydrophobicContact CB-CD1 4.31Å
67	P	64.1	Low	77.6	Confident	94 Å²	94	70.9 Å²	70.9	61%	0.61	36%	0.364	S	S	*	.			trans	-56.2	120.4	-172.6	19.8	-31.1	0	0	0	111.9	D69	P67-D69 PolarHBondContact O-N 3.49Å; P67-D69 VanDerWaalsContact O-N 3.11Å
68	Q	53.6	Low	77.6	Confident	102 Å²	102	75.4 Å²	75.4	48%	0.477	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.4	-163.5	-70.1	-177.8	-24.3	0	0	115.3	Q66	Q66-Q68 PolarHBondContact O-N 3.43Å; Q66-Q68 VanDerWaalsContact O-N 3.16Å
69	D	54.4	Low	77.7	Confident	166 Å²	166	73.5 Å²	73.5	89%	0.888	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-2.6	-168.2	-75.3	-26.7	0	0	0	115.8	P67	P67-D69 PolarHBondContact O-N 3.49Å; P67-D69 VanDerWaalsContact O-N 3.11Å
70	Q	58.4	Low	77.8	Confident	168 Å²	168	68 Å²	68	79%	0.785	34%	0.34	S	S	*	.	S	Bend	trans	-116.4	-12.6	-170.9	-66.6	-176.7	5.6	0	0	115.8
71	L	67.9	Low	77.8	Confident	54 Å²	54	68.1 Å²	68.1	28%	0.283	34%	0.341	S	S	.	.			trans	-107.2	127.3	-172.2	-69.6	165.6	0	0	0	112.1	Q66 D75 R76	Q66-L71 HydrophobicContact CB-CD1 4.31Å; L71-D75 HydrophobicContact CB-CB 4.37Å; L71-D75 HydrophobicContact CD2-CB 3.87Å; L71-R76 HydrophobicContact CB-CG 3.74Å; L71-R76 PolarHBondContact O-NE 3.5Å
72	E	79.1	Confident	77.9	Confident	141 Å²	141	69.1 Å²	69.1	66%	0.659	35%	0.353	S	S	*	.			trans	-60	155.3	168.5	-68	-171.7	175.5	0	0	110.6	R74 D75 R76	E72-R74 PolarHBondContact O-N 3.42Å; E72-D75 PolarHBondContact O-N 2.95Å; E72-R76 PolarHBondContact O-N 3.11Å
73	E	81	Confident	78.2	Confident	30 Å²	30	65.8 Å²	65.8	14%	0.14	33%	0.33	C	S	.	.	H	α-helix	trans	-54.4	-37.4	-179.6	-178.6	163	-149.6	0	0	113.7	D75 R76 A77 E146 R150 W187	E73-D75 VanDerWaalsContact C-N 3.3Å; E73-D75 PolarHBondContact O-N 3.44Å; E73-R76 PolarHBondContact O-N 3.46Å; E73-A77 PolarHBondContact O-N 3.48Å; E73-E146 HydrophobicContact CG-CG 4.39Å; E73-E146 VanDerWaalsContact OE1-CG 3.27Å; E73-E146 WeakPolarHBondContact OE1-CG 3.21Å; E73-R150 VanDerWaalsContact CD-CG 3.47Å; E73-R150 HydrophobicContact CG-CG 4.4Å; E73-R150 WeakPolarHBondContact OE1-CD 3.37Å; E73-R150 WeakPolarHBondContact OE1-CG 3.45Å; E73-R150 IonicContact OE1-CZ 3.46Å; E73-R150 IonicContact OE1-NE 3.87Å; E73-R150 PolarHBondContact OE1-NE 3.23Å; E73-R150 IonicContact OE1-NH2 2.79Å; E73-R150 IonicContact OE2-CZ 3.91Å; E73-R150 IonicContact OE2-NE 3.26Å; E73-R150 PolarHBondContact OE2-NE 2.86Å; E73-R150 IonicContact OE2-NH2 3.52Å; E73-R150 PolarHBondContact OE2-NH2 2.69Å; E73-W187 HydrophobicContact CG-CZ2 4.22Å
74	R	84.3	Confident	78.6	Confident	87 Å²	87	64.7 Å²	64.7	33%	0.328	32%	0.318	S	S	.	.	H	α-helix	trans	-61.4	-37.2	175.8	-176.2	-179.9	-179.7	-163.4	0.6	112.4	E72 R78 W187 E190 R194	E72-R74 PolarHBondContact O-N 3.42Å; R74-R78 PolarHBondContact O-N 3.2Å; R74-W187 HydrophobicContact CB-CD2 4.15Å; R74-W187 HydrophobicContact CB-CG 4.36Å; R74-W187 HydrophobicContact CB-CZ2 4.49Å; R74-W187 HydrophobicContact CG-CB 4.46Å; R74-W187 HydrophobicContact CG-CD2 3.95Å; R74-W187 HydrophobicContact CG-CE3 4.2Å; R74-W187 HydrophobicContact CG-CG 4.06Å; R74-E190 IonicContact CZ-OE2 3.6Å; R74-E190 IonicContact NE-OE2 3.96Å; R74-E190 PolarHBondContact NE-OE2 3.17Å; R74-E190 IonicContact NH2-OE1 2.71Å; R74-E190 IonicContact NH2-OE2 3.05Å; R74-E190 PolarHBondContact NH2-OE2 3.18Å; R74-R194 PolarHBondContact O-NH1 2.97Å
75	D	84.6	Confident	79	Confident	46 Å²	46	67.8 Å²	67.8	25%	0.246	33%	0.332	C	S	.	.	H	α-helix	trans	-77.9	-37.4	179.6	-65.3	-43.7	0	0	0	111.1	L71 E72 E73 A77 R78 V79	L71-D75 HydrophobicContact CB-CB 4.37Å; L71-D75 HydrophobicContact CD2-CB 3.87Å; E72-D75 PolarHBondContact O-N 2.95Å; E73-D75 VanDerWaalsContact C-N 3.3Å; E73-D75 PolarHBondContact O-N 3.44Å; D75-A77 VanDerWaalsContact C-N 3.32Å; D75-A77 PolarHBondContact O-N 3.08Å; D75-R78 WeakPolarHBondContact O-CA 3.39Å; D75-R78 VanDerWaalsContact O-CB 3.29Å; D75-R78 WeakPolarHBondContact O-CB 3.32Å; D75-R78 PolarHBondContact O-N 3.23Å; D75-R78 IonicContact OD1-CZ 3.88Å; D75-R78 IonicContact OD1-NH1 2.74Å; D75-R78 PolarHBondContact OD1-NH1 2.85Å; D75-R78 IonicContact OD1-NH2 2.82Å; D75-V79 WeakPolarHBondContact O-CG2 3.27Å; D75-V79 PolarHBondContact O-N 2.91Å
76	R	86.6	Confident	79.7	Confident	51 Å²	51	65.8 Å²	65.8	19%	0.192	33%	0.328	C	S	.	.	H	α-helix	trans	-60.3	-40.9	173.3	-66.8	-175.3	-84.4	152.3	3.9	112.4	L71 E72 E73 R78 V79 L80 R143 E146	L71-R76 HydrophobicContact CB-CG 3.74Å; L71-R76 PolarHBondContact O-NE 3.5Å; E72-R76 PolarHBondContact O-N 3.11Å; E73-R76 PolarHBondContact O-N 3.46Å; R76-R78 VanDerWaalsContact C-N 3.27Å; R76-R78 PolarHBondContact O-N 2.86Å; R76-V79 PolarHBondContact O-N 2.86Å; R76-L80 PolarHBondContact O-N 2.97Å; R76-R143 VanDerWaalsContact CD-CZ 3.46Å; R76-E146 IonicContact CZ-OE1 2.78Å; R76-E146 IonicContact CZ-OE2 3.69Å; R76-E146 IonicContact NH1-OE1 3.7Å; R76-E146 PolarHBondContact NH1-OE1 2.76Å; R76-E146 IonicContact NH1-OE2 3.74Å; R76-E146 PolarHBondContact NH1-OE2 2.9Å; R76-E146 IonicContact NH2-OE1 3.06Å; R76-E146 PolarHBondContact NH2-OE1 3.25Å; R76-E146 IonicContact NH2-OE2 2.96Å
77	A	86.1	Confident	80.6	Confident	6 Å²	6	62.4 Å²	62.4	5%	0.05	31%	0.312	C	S	.	.	H	α-helix	trans	-62.8	-32.2	172	0	0	0	0	0	112.8	E73 D75 L81 F147 W187	E73-A77 PolarHBondContact O-N 3.48Å; D75-A77 VanDerWaalsContact C-N 3.32Å; D75-A77 PolarHBondContact O-N 3.08Å; A77-L81 PolarHBondContact O-N 3.24Å; A77-F147 HydrophobicContact CB-CD2 3.69Å; A77-F147 HydrophobicContact CB-CE2 4.06Å; A77-W187 HydrophobicContact CB-CH2 4.09Å; A77-W187 HydrophobicContact CB-CZ3 4.29Å
78	R	87.2	Confident	81.8	Confident	112 Å²	112	58.3 Å²	58.3	42%	0.423	29%	0.286	S	S	.	.	H	α-helix	trans	-71.1	-44.9	176.7	-167.4	-175.1	-69.6	125.3	1.8	110.4	R74 D75 R76 L80 L81 S82 R194	R74-R78 PolarHBondContact O-N 3.2Å; D75-R78 WeakPolarHBondContact O-CA 3.39Å; D75-R78 VanDerWaalsContact O-CB 3.29Å; D75-R78 WeakPolarHBondContact O-CB 3.32Å; D75-R78 PolarHBondContact O-N 3.23Å; D75-R78 IonicContact OD1-CZ 3.88Å; D75-R78 IonicContact OD1-NH1 2.74Å; D75-R78 PolarHBondContact OD1-NH1 2.85Å; D75-R78 IonicContact OD1-NH2 2.82Å; R76-R78 VanDerWaalsContact C-N 3.27Å; R76-R78 PolarHBondContact O-N 2.86Å; R78-L80 VanDerWaalsContact C-N 3.34Å; R78-L80 PolarHBondContact O-N 3.26Å; R78-L81 PolarHBondContact O-N 3.29Å; R78-S82 WeakPolarHBondContact O-CB 3.38Å; R78-S82 PolarHBondContact O-N 3Å; R78-S82 PolarHBondContact O-OG 2.87Å; R78-R194 VanDerWaalsContact N-NH1 3.11Å
79	V	88.9	Confident	83.4	Confident	27 Å²	27	58.6 Å²	58.6	16%	0.164	29%	0.29	C	S	.	.	H	α-helix	trans	-58.6	-47.2	177.4	173.9	0	0	0	0	110.5	G63 D75 R76 L81 S82 A83	G63-V79 VanDerWaalsContact O-CG1 3.27Å; G63-V79 WeakPolarHBondContact O-CG1 3.33Å; D75-V79 WeakPolarHBondContact O-CG2 3.27Å; D75-V79 PolarHBondContact O-N 2.91Å; R76-V79 PolarHBondContact O-N 2.86Å; V79-L81 PolarHBondContact O-N 3.1Å; V79-S82 WeakPolarHBondContact CA-OG 3.37Å; V79-S82 PolarHBondContact O-N 2.81Å; V79-S82 PolarHBondContact O-OG 3.15Å; V79-A83 WeakPolarHBondContact O-CB 3.38Å; V79-A83 PolarHBondContact O-N 3.48Å
80	L	89.6	Confident	84.8	Confident	3 Å²	3	55 Å²	55	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-55.8	-50.8	177	-176.8	67.6	0	0	0	112.1	L64 R76 R78 A83 F84 L140 R143 V144 F147 L198	L64-L80 HydrophobicContact CD2-CD1 3.98Å; R76-L80 PolarHBondContact O-N 2.97Å; R78-L80 VanDerWaalsContact C-N 3.34Å; R78-L80 PolarHBondContact O-N 3.26Å; L80-A83 PolarHBondContact O-N 2.89Å; L80-F84 HydrophobicContact CD1-CD2 4.14Å; L80-F84 HydrophobicContact CD1-CE2 3.8Å; L80-F84 HydrophobicContact CG-CD2 4.39Å; L80-F84 HydrophobicContact CG-CE2 4.44Å; L80-F84 WeakPolarHBondContact O-CD2 3.39Å; L80-F84 PolarHBondContact O-N 3.08Å; L80-L140 HydrophobicContact CD1-CD1 4.1Å; L80-R143 HydrophobicContact CD1-CB 4.27Å; L80-V144 HydrophobicContact CD1-CG2 4.14Å; L80-V144 HydrophobicContact CD2-CG2 4.26Å; L80-F147 HydrophobicContact CD2-CB 3.92Å; L80-F147 HydrophobicContact CD2-CD1 4.44Å; L80-F147 HydrophobicContact CD2-CG 4.14Å; L80-L198 HydrophobicContact CD2-CD2 4.31Å
81	L	88.8	Confident	86.1	Confident	13 Å²	13	47 Å²	47	7%	0.068	23%	0.231	C	C	.	.	H	α-helix	trans	-63	-44.5	178.8	-180	65.6	0	0	0	111.6	A77 R78 V79 A83 F84 Q85 R194 Q197 L198	A77-L81 PolarHBondContact O-N 3.24Å; R78-L81 PolarHBondContact O-N 3.29Å; V79-L81 PolarHBondContact O-N 3.1Å; L81-A83 VanDerWaalsContact C-N 3.33Å; L81-A83 PolarHBondContact O-N 2.75Å; L81-F84 PolarHBondContact O-N 2.98Å; L81-Q85 HydrophobicContact CD1-CG 4.38Å; L81-Q85 HydrophobicContact CG-CG 4.41Å; L81-Q85 WeakPolarHBondContact O-CB 3.45Å; L81-Q85 WeakPolarHBondContact O-CG 3.43Å; L81-Q85 PolarHBondContact O-N 3.18Å; L81-R194 HydrophobicContact CD2-CB 4.37Å; L81-R194 HydrophobicContact CD2-CG 4.12Å; L81-Q197 HydrophobicContact CD1-CB 3.98Å; L81-Q197 HydrophobicContact CD2-CB 4.13Å; L81-Q197 VanDerWaalsContact CD2-OE1 3.27Å; L81-L198 HydrophobicContact CD1-CB 3.96Å; L81-L198 HydrophobicContact CD1-CD1 4.09Å
82	S	89.1	Confident	87	Confident	51 Å²	51	47.5 Å²	47.5	36%	0.357	23%	0.232	S	C	.	.	H	α-helix	trans	-63.1	-38.6	179.8	67.6	0	0	0	0	112.2	R78 V79 Q85 T86	R78-S82 WeakPolarHBondContact O-CB 3.38Å; R78-S82 PolarHBondContact O-N 3Å; R78-S82 PolarHBondContact O-OG 2.87Å; V79-S82 WeakPolarHBondContact CA-OG 3.37Å; V79-S82 PolarHBondContact O-N 2.81Å; V79-S82 PolarHBondContact O-OG 3.15Å; S82-Q85 PolarHBondContact O-N 2.96Å; S82-T86 WeakPolarHBondContact O-CG2 3.35Å; S82-T86 PolarHBondContact O-N 3.29Å; S82-T86 PolarHBondContact O-OG1 3.4Å; S82-T86 VanDerWaalsContact O-OG1 3.09Å
83	A	90.3	Very high	87.2	Confident	6 Å²	6	44.8 Å²	44.8	5%	0.05	23%	0.226	C	C	.	.	H	α-helix	trans	-62.2	-46.1	177.3	0	0	0	0	0	111.3	F60 L64 V79 L80 L81 T86 L87	F60-A83 HydrophobicContact CD2-CB 4.13Å; F60-A83 HydrophobicContact CE2-CB 4Å; L64-A83 HydrophobicContact CD2-CB 3.82Å; L64-A83 HydrophobicContact CG-CB 4.11Å; V79-A83 WeakPolarHBondContact O-CB 3.38Å; V79-A83 PolarHBondContact O-N 3.48Å; L80-A83 PolarHBondContact O-N 2.89Å; L81-A83 VanDerWaalsContact C-N 3.33Å; L81-A83 PolarHBondContact O-N 2.75Å; A83-T86 WeakPolarHBondContact CA-OG1 3.37Å; A83-T86 PolarHBondContact O-N 2.81Å; A83-T86 PolarHBondContact O-OG1 2.85Å; A83-L87 WeakPolarHBondContact O-CB 3.44Å; A83-L87 PolarHBondContact O-N 3.26Å
84	F	90.4	Very high	87.2	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.018	23%	0.232	C	C	.	.	H	α-helix	trans	-68.7	-34	176.2	-81.9	-70.5	0	0	0	113.3	F60 L80 L81 L87 L88 L140 L198 V201 L202 L205 V211	F60-F84 HydrophobicContact CE2-CD1 4.07Å; F60-F84 HydrophobicContact CE2-CD2 4.5Å; F60-F84 HydrophobicContact CE2-CE1 4.07Å; F60-F84 HydrophobicContact CE2-CG 4.29Å; F60-F84 HydrophobicContact CE2-CZ 4.29Å; F60-F84 HydrophobicContact CZ-CD1 4.32Å; F60-F84 AromaticContact CZ-CE1 3.85Å; F60-F84 HydrophobicContact CZ-CE1 3.85Å; F60-F84 HydrophobicContact CZ-CE2 4.23Å; F60-F84 AromaticContact CZ-CZ 3.8Å; F60-F84 HydrophobicContact CZ-CZ 3.8Å; L80-F84 HydrophobicContact CD1-CD2 4.14Å; L80-F84 HydrophobicContact CD1-CE2 3.8Å; L80-F84 HydrophobicContact CG-CD2 4.39Å; L80-F84 HydrophobicContact CG-CE2 4.44Å; L80-F84 WeakPolarHBondContact O-CD2 3.39Å; L80-F84 PolarHBondContact O-N 3.08Å; L81-F84 PolarHBondContact O-N 2.98Å; F84-L87 HydrophobicContact CD1-CD2 4.21Å; F84-L87 HydrophobicContact CE1-CD2 4.49Å; F84-L87 PolarHBondContact O-N 2.97Å; F84-L88 PolarHBondContact O-N 3.38Å; F84-L140 HydrophobicContact CE2-CD1 3.89Å; F84-L140 HydrophobicContact CZ-CD1 3.89Å; F84-L198 HydrophobicContact CB-CD1 4.23Å; F84-L198 HydrophobicContact CD2-CD1 3.86Å; F84-L198 HydrophobicContact CG-CD1 4.26Å; F84-V201 HydrophobicContact CB-CG1 3.85Å; F84-V201 WeakPolarHBondContact O-CG1 3.42Å; F84-L202 HydrophobicContact CD1-CD2 3.59Å; F84-L202 HydrophobicContact CD2-CD2 4.47Å; F84-L202 HydrophobicContact CE1-CD2 3.51Å; F84-L202 HydrophobicContact CE2-CD2 4.39Å; F84-L202 HydrophobicContact CG-CD2 4.09Å; F84-L202 HydrophobicContact CZ-CD2 3.94Å; F84-L205 HydrophobicContact CD1-CD1 4.26Å; F84-V211 HydrophobicContact CZ-CG1 4.07Å; F84-V211 HydrophobicContact CZ-CG2 4.41Å
85	Q	90.3	Very high	87.2	Confident	70 Å²	70	42.7 Å²	42.7	33%	0.327	22%	0.22	S	C	.	.	H	α-helix	trans	-65.3	-46.7	172.9	-75.6	172.8	-16.1	0	0	111.4	L81 S82 L87 L88 D89 V201	L81-Q85 HydrophobicContact CD1-CG 4.38Å; L81-Q85 HydrophobicContact CG-CG 4.41Å; L81-Q85 WeakPolarHBondContact O-CB 3.45Å; L81-Q85 WeakPolarHBondContact O-CG 3.43Å; L81-Q85 PolarHBondContact O-N 3.18Å; S82-Q85 PolarHBondContact O-N 2.96Å; Q85-L87 VanDerWaalsContact C-N 3.26Å; Q85-L87 PolarHBondContact O-N 3.37Å; Q85-L88 WeakPolarHBondContact O-CB 2.95Å; Q85-L88 PolarHBondContact O-N 3.21Å; Q85-L88 VanDerWaalsContact O-N 3.12Å; Q85-D89 PolarHBondContact O-N 3.24Å; Q85-V201 HydrophobicContact CG-CG2 3.92Å
86	T	89.1	Confident	87.1	Confident	76 Å²	76	42 Å²	42	47%	0.466	22%	0.219	S	C	.	.	H	α-helix	trans	-61.8	-36.4	175.7	53.4	0	0	0	0	112	S82 A83 D89 Q90	S82-T86 WeakPolarHBondContact O-CG2 3.35Å; S82-T86 PolarHBondContact O-N 3.29Å; S82-T86 PolarHBondContact O-OG1 3.4Å; S82-T86 VanDerWaalsContact O-OG1 3.09Å; A83-T86 WeakPolarHBondContact CA-OG1 3.37Å; A83-T86 PolarHBondContact O-N 2.81Å; A83-T86 PolarHBondContact O-OG1 2.85Å; T86-D89 PolarHBondContact O-N 3.1Å; T86-Q90 VanDerWaalsContact O-CG 3.24Å; T86-Q90 WeakPolarHBondContact O-CG 3.1Å; T86-Q90 PolarHBondContact O-N 3.21Å; T86-Q90 VanDerWaalsContact O-N 3.08Å
87	L	89.4	Confident	86.8	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-45.3	174.1	-179	65.3	0	0	0	111.2	V56 F60 A83 F84 Q85 Q90 L91 L132 L205	V56-L87 HydrophobicContact CG1-CD1 3.52Å; F60-L87 HydrophobicContact CD2-CB 4.16Å; F60-L87 HydrophobicContact CD2-CD2 4.15Å; F60-L87 HydrophobicContact CE2-CD2 4.09Å; A83-L87 WeakPolarHBondContact O-CB 3.44Å; A83-L87 PolarHBondContact O-N 3.26Å; F84-L87 HydrophobicContact CD1-CD2 4.21Å; F84-L87 HydrophobicContact CE1-CD2 4.49Å; F84-L87 PolarHBondContact O-N 2.97Å; Q85-L87 VanDerWaalsContact C-N 3.26Å; Q85-L87 PolarHBondContact O-N 3.37Å; L87-Q90 PolarHBondContact O-N 3.39Å; L87-L91 HydrophobicContact CD1-CD1 3.73Å; L87-L91 HydrophobicContact CD1-CG 4.3Å; L87-L91 HydrophobicContact CG-CD1 3.87Å; L87-L91 WeakPolarHBondContact O-CB 3.44Å; L87-L91 WeakPolarHBondContact O-CG 3.36Å; L87-L91 PolarHBondContact O-N 2.99Å; L87-L91 VanDerWaalsContact O-N 3.15Å; L87-L132 HydrophobicContact CD1-CD1 4.28Å; L87-L132 HydrophobicContact CD2-CD1 3.76Å; L87-L205 HydrophobicContact CD2-CD1 4Å; L87-L205 HydrophobicContact CG-CD1 4.3Å
88	L	88.3	Confident	86.5	Confident	9 Å²	9	40.4 Å²	40.4	5%	0.047	22%	0.218	C	C	.	.	H	α-helix	trans	-61.2	-48.2	175.5	-178.8	65.7	0	0	0	111.4	F84 Q85 Q90 L91 E92 V201 R204 L205	F84-L88 PolarHBondContact O-N 3.38Å; Q85-L88 WeakPolarHBondContact O-CB 2.95Å; Q85-L88 PolarHBondContact O-N 3.21Å; Q85-L88 VanDerWaalsContact O-N 3.12Å; L88-Q90 VanDerWaalsContact C-N 3.27Å; L88-Q90 PolarHBondContact O-N 2.87Å; L88-L91 PolarHBondContact O-N 2.98Å; L88-E92 WeakPolarHBondContact CD1-OE2 3.45Å; L88-E92 WeakPolarHBondContact O-CB 3.47Å; L88-E92 PolarHBondContact O-N 3.43Å; L88-V201 HydrophobicContact CB-CG1 4.17Å; L88-V201 HydrophobicContact CD2-CG1 4.17Å; L88-V201 HydrophobicContact CD2-CG2 4.27Å; L88-R204 HydrophobicContact CD1-CB 4.01Å; L88-R204 HydrophobicContact CD2-CB 4.4Å; L88-L205 HydrophobicContact CB-CD1 4.41Å; L88-L205 HydrophobicContact CB-CD2 4.25Å; L88-L205 HydrophobicContact CB-CG 4.38Å; L88-L205 HydrophobicContact CD1-CD2 3.65Å; L88-L205 HydrophobicContact CD1-CG 3.93Å
89	D	87.4	Confident	86.3	Confident	108 Å²	108	40.4 Å²	40.4	58%	0.578	22%	0.223	S	C	*	.	H	α-helix	trans	-60.9	-34.5	-179.1	-68.6	-24.6	0	0	0	112.9	Q85 T86 P93	Q85-D89 PolarHBondContact O-N 3.24Å; T86-D89 PolarHBondContact O-N 3.1Å; D89-P93 WeakPolarHBondContact O-CD 3.37Å
90	Q	85.3	Confident	85.8	Confident	89 Å²	89	41.8 Å²	41.8	42%	0.416	23%	0.227	S	C	.	.	H	α-helix	trans	-76.3	-26.5	176.4	-67.2	-63.3	-38.1	0	0	113.1	V56 T86 L87 L88 F94	V56-Q90 HydrophobicContact CG1-CB 4.42Å; V56-Q90 HydrophobicContact CG2-CB 4.46Å; T86-Q90 VanDerWaalsContact O-CG 3.24Å; T86-Q90 WeakPolarHBondContact O-CG 3.1Å; T86-Q90 PolarHBondContact O-N 3.21Å; T86-Q90 VanDerWaalsContact O-N 3.08Å; L87-Q90 PolarHBondContact O-N 3.39Å; L88-Q90 VanDerWaalsContact C-N 3.27Å; L88-Q90 PolarHBondContact O-N 2.87Å; Q90-F94 WeakPolarHBondContact O-CD2 3.48Å
91	L	85.6	Confident	85.3	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-95.2	-28.9	-177.4	-65.5	175.9	0	0	0	113.3	L48 L52 L87 L88 P93 F94 L95 I128 L205	L48-L91 HydrophobicContact CD1-CD2 3.9Å; L52-L91 HydrophobicContact CD2-CD2 3.66Å; L52-L91 HydrophobicContact CG-CD2 4.39Å; L87-L91 HydrophobicContact CD1-CD1 3.73Å; L87-L91 HydrophobicContact CD1-CG 4.3Å; L87-L91 HydrophobicContact CG-CD1 3.87Å; L87-L91 WeakPolarHBondContact O-CB 3.44Å; L87-L91 WeakPolarHBondContact O-CG 3.36Å; L87-L91 PolarHBondContact O-N 2.99Å; L87-L91 VanDerWaalsContact O-N 3.15Å; L88-L91 PolarHBondContact O-N 2.98Å; L91-P93 VanDerWaalsContact C-CD 3.45Å; L91-F94 PolarHBondContact O-N 2.96Å; L91-L95 HydrophobicContact CB-CD1 4.24Å; L91-L95 WeakPolarHBondContact O-CG 3.46Å; L91-L95 PolarHBondContact O-N 2.94Å; L91-I128 HydrophobicContact CD1-CD1 4.13Å; L91-I128 HydrophobicContact CD1-CG1 4.46Å; L91-I128 HydrophobicContact CD1-CG2 4.38Å; L91-L205 HydrophobicContact CD1-CD2 3.96Å
92	E	85.4	Confident	84.8	Confident	64 Å²	64	41.2 Å²	41.2	30%	0.299	23%	0.225	S	C	.	.	H	α-helix	trans	-52.3	-44.3	-177	-167.1	71.9	-164.9	0	0	113.3	L88 F94 L95 S96 R204	L88-E92 WeakPolarHBondContact CD1-OE2 3.45Å; L88-E92 WeakPolarHBondContact O-CB 3.47Å; L88-E92 PolarHBondContact O-N 3.43Å; E92-F94 VanDerWaalsContact C-N 3.28Å; E92-F94 PolarHBondContact O-N 3.15Å; E92-L95 PolarHBondContact O-N 3.45Å; E92-S96 WeakPolarHBondContact O-CB 3.4Å; E92-S96 PolarHBondContact O-N 2.8Å; E92-S96 PolarHBondContact O-OG 3.29Å; E92-S96 VanDerWaalsContact O-OG 3.07Å; E92-R204 IonicContact OE1-CZ 3.98Å; E92-R204 IonicContact OE1-NH2 3.22Å; E92-R204 PolarHBondContact OE1-NH2 3.47Å; E92-R204 IonicContact OE2-CZ 3.79Å; E92-R204 IonicContact OE2-NE 3.93Å; E92-R204 IonicContact OE2-NH2 3.7Å; E92-R204 PolarHBondContact OE2-NH2 3.16Å
93	P	84.4	Confident	84.4	Confident	84 Å²	84	40.4 Å²	40.4	55%	0.545	22%	0.221	S	C	.	.	H	α-helix	trans	-64.5	-31.6	178.8	-20.9	34.1	0	0	0	113.4	D89 L91 S96 G97	D89-P93 WeakPolarHBondContact O-CD 3.37Å; L91-P93 VanDerWaalsContact C-CD 3.45Å; P93-S96 PolarHBondContact O-OG 3.08Å; P93-G97 PolarHBondContact O-N 3.41Å; P93-G97 VanDerWaalsContact O-N 3.16Å
94	F	81.3	Confident	83.8	Confident	60 Å²	60	42.6 Å²	42.6	26%	0.263	23%	0.228	S	C	.	.	H	α-helix	trans	-77.4	-40.7	176.7	-69	-84.4	0	0	0	111.3	L48 R51 Q90 L91 E92 G97 L98	L48-F94 HydrophobicContact CD1-CB 3.96Å; L48-F94 HydrophobicContact CD1-CD1 4.4Å; L48-F94 HydrophobicContact CD1-CD2 4.34Å; L48-F94 HydrophobicContact CD1-CG 3.99Å; R51-F94 HydrophobicContact CG-CZ 4.38Å; Q90-F94 WeakPolarHBondContact O-CD2 3.48Å; L91-F94 PolarHBondContact O-N 2.96Å; E92-F94 VanDerWaalsContact C-N 3.28Å; E92-F94 PolarHBondContact O-N 3.15Å; F94-G97 PolarHBondContact O-N 2.92Å; F94-L98 WeakPolarHBondContact O-CB 3.28Å; F94-L98 VanDerWaalsContact O-CG 3.28Å; F94-L98 WeakPolarHBondContact O-CG 3.46Å; F94-L98 PolarHBondContact O-N 3.35Å
95	L	82.6	Confident	83.1	Confident	13 Å²	13	43.3 Å²	43.3	7%	0.068	23%	0.232	C	C	.	.	H	α-helix	trans	-66.4	-43.8	178.5	-65.8	176.6	0	0	0	111.4	L91 E92 L98 E99 A124 F125 I128	L91-L95 HydrophobicContact CB-CD1 4.24Å; L91-L95 WeakPolarHBondContact O-CG 3.46Å; L91-L95 PolarHBondContact O-N 2.94Å; E92-L95 PolarHBondContact O-N 3.45Å; L95-L98 PolarHBondContact O-N 2.92Å; L95-E99 WeakPolarHBondContact O-CB 3.44Å; L95-E99 PolarHBondContact O-N 3.15Å; L95-A124 HydrophobicContact CD2-CB 4.33Å; L95-F125 HydrophobicContact CD1-CE1 3.91Å; L95-F125 HydrophobicContact CD1-CZ 3.92Å; L95-F125 HydrophobicContact CD2-CE1 4.05Å; L95-F125 HydrophobicContact CD2-CE2 4.32Å; L95-F125 HydrophobicContact CD2-CZ 3.87Å; L95-I128 HydrophobicContact CD2-CD1 4.25Å
96	S	82.5	Confident	82.5	Confident	33 Å²	33	43.6 Å²	43.6	23%	0.231	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-38.6	175.4	68.8	0	0	0	0	111.9	E92 P93 E99 Q100	E92-S96 WeakPolarHBondContact O-CB 3.4Å; E92-S96 PolarHBondContact O-N 2.8Å; E92-S96 PolarHBondContact O-OG 3.29Å; E92-S96 VanDerWaalsContact O-OG 3.07Å; P93-S96 PolarHBondContact O-OG 3.08Å; S96-E99 PolarHBondContact O-N 3.26Å; S96-Q100 WeakPolarHBondContact O-CB 3.42Å; S96-Q100 VanDerWaalsContact O-CG 3.28Å; S96-Q100 WeakPolarHBondContact O-CG 3.48Å; S96-Q100 PolarHBondContact O-N 2.68Å
97	G	80.5	Confident	81.9	Confident	21 Å²	21	46 Å²	46	22%	0.216	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-40.1	173.3	0	0	0	0	0	113.4	P93 F94 L101	P93-G97 PolarHBondContact O-N 3.41Å; P93-G97 VanDerWaalsContact O-N 3.16Å; F94-G97 PolarHBondContact O-N 2.92Å; G97-L101 VanDerWaalsContact O-CB 3.32Å; G97-L101 WeakPolarHBondContact O-CB 3.38Å; G97-L101 PolarHBondContact O-N 2.91Å
98	L	80.3	Confident	80.8	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-70.3	-36.9	175.7	-73.4	172.1	0	0	0	112.5	L44 L45 L48 F94 L95 G102 L120 A124	L44-L98 HydrophobicContact CB-CD2 3.86Å; L44-L98 HydrophobicContact CD1-CD2 4.1Å; L45-L98 HydrophobicContact CD2-CD1 4.07Å; L45-L98 HydrophobicContact CD2-CD2 4.45Å; L45-L98 HydrophobicContact CG-CD2 4.48Å; L48-L98 HydrophobicContact CD2-CD1 4.49Å; F94-L98 WeakPolarHBondContact O-CB 3.28Å; F94-L98 VanDerWaalsContact O-CG 3.28Å; F94-L98 WeakPolarHBondContact O-CG 3.46Å; F94-L98 PolarHBondContact O-N 3.35Å; L95-L98 PolarHBondContact O-N 2.92Å; L98-G102 PolarHBondContact O-N 3.19Å; L98-L120 HydrophobicContact CD2-CB 4.48Å; L98-A124 HydrophobicContact CD1-CB 3.56Å
99	E	82.1	Confident	79.6	Confident	111 Å²	111	52 Å²	52	52%	0.519	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-48.7	174.2	-171.1	171.5	-169.3	0	0	111.5	L95 S96 G102 A103 Q121	L95-E99 WeakPolarHBondContact O-CB 3.44Å; L95-E99 PolarHBondContact O-N 3.15Å; S96-E99 PolarHBondContact O-N 3.26Å; E99-G102 PolarHBondContact O-N 3.16Å; E99-A103 PolarHBondContact O-N 2.96Å; E99-Q121 VanDerWaalsContact CB-NE2 3.28Å; E99-Q121 VanDerWaalsContact CG-NE2 3.33Å
100	Q	78.8	Confident	78.1	Confident	56 Å²	56	50.2 Å²	50.2	26%	0.262	29%	0.286	S	S	.	.	H	α-helix	trans	-62.8	-44.5	177.5	-71.8	178.2	9.4	0	0	111.9	S96 G102 A103 W104	S96-Q100 WeakPolarHBondContact O-CB 3.42Å; S96-Q100 VanDerWaalsContact O-CG 3.28Å; S96-Q100 WeakPolarHBondContact O-CG 3.48Å; S96-Q100 PolarHBondContact O-N 2.68Å; Q100-G102 VanDerWaalsContact C-N 3.28Å; Q100-G102 PolarHBondContact O-N 2.91Å; Q100-A103 PolarHBondContact O-N 3.33Å; Q100-W104 HydrophobicContact CB-CH2 4.43Å; Q100-W104 HydrophobicContact CB-CZ2 4.04Å; Q100-W104 VanDerWaalsContact O-CG 3.27Å; Q100-W104 PolarHBondContact O-N 3.25Å
101	L	78.6	Confident	76.9	Confident	5 Å²	5	49.3 Å²	49.3	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-60.7	-41	175.2	-179.3	67.2	0	0	0	111.4	L40 L44 G97 W104 Q105 M112 L120	L40-L101 HydrophobicContact CB-CD1 4.47Å; L40-L101 HydrophobicContact CB-CD2 4.36Å; L44-L101 HydrophobicContact CD1-CD2 3.86Å; G97-L101 VanDerWaalsContact O-CB 3.32Å; G97-L101 WeakPolarHBondContact O-CB 3.38Å; G97-L101 PolarHBondContact O-N 2.91Å; L101-W104 HydrophobicContact CD1-CE3 4.29Å; L101-W104 PolarHBondContact O-N 3.42Å; L101-Q105 WeakPolarHBondContact O-CG 3.44Å; L101-Q105 PolarHBondContact O-N 3.38Å; L101-M112 HydrophobicContact CD1-CE 4.29Å; L101-M112 HydrophobicContact CD1-SD 4.36Å; L101-L120 HydrophobicContact CD2-CD1 4.12Å; L101-L120 HydrophobicContact CG-CD1 4.34Å
102	G	79.9	Confident	75.8	Confident	0 Å²	0	50 Å²	50	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.3	-43.9	175.4	0	0	0	0	0	113.1	L98 E99 Q100 W104 Q105 A106 P117	L98-G102 PolarHBondContact O-N 3.19Å; E99-G102 PolarHBondContact O-N 3.16Å; Q100-G102 VanDerWaalsContact C-N 3.28Å; Q100-G102 PolarHBondContact O-N 2.91Å; G102-W104 VanDerWaalsContact C-N 3.33Å; G102-W104 PolarHBondContact O-N 3.19Å; G102-Q105 WeakPolarHBondContact O-CB 3.45Å; G102-Q105 PolarHBondContact O-N 3.39Å; G102-A106 PolarHBondContact O-N 3.44Å; G102-P117 WeakPolarHBondContact O-CD 3.42Å
103	A	80.7	Confident	74.8	Confident	34 Å²	34	50.6 Å²	50.6	28%	0.281	32%	0.315	S	S	.	.	H	α-helix	trans	-58.9	-44	174.5	0	0	0	0	0	111.3	E99 Q100 Q105 A106 E107	E99-A103 PolarHBondContact O-N 2.96Å; Q100-A103 PolarHBondContact O-N 3.33Å; A103-Q105 VanDerWaalsContact C-N 3.32Å; A103-Q105 PolarHBondContact O-N 3.41Å; A103-A106 PolarHBondContact O-N 3.21Å; A103-A106 VanDerWaalsContact O-N 3.11Å; A103-E107 WeakPolarHBondContact O-CB 3.41Å; A103-E107 WeakPolarHBondContact O-CG 3.42Å; A103-E107 PolarHBondContact O-N 2.87Å
104	W	76.6	Confident	74.1	Confident	51 Å²	51	48.4 Å²	48.4	19%	0.193	31%	0.308	C	S	.	.	H	α-helix	trans	-65.4	-33.2	176.6	-58.3	-21.2	0	0	0	113.6	L20 L28 Q100 L101 G102 G108 H109	L20-W104 HydrophobicContact CD1-CH2 4.1Å; L20-W104 HydrophobicContact CD1-CZ2 3.34Å; L20-W104 HydrophobicContact CD2-CH2 3.7Å; L20-W104 HydrophobicContact CD2-CZ2 3.72Å; L20-W104 HydrophobicContact CG-CH2 4.25Å; L20-W104 HydrophobicContact CG-CZ2 3.73Å; L28-W104 HydrophobicContact CD1-CE3 3.8Å; L28-W104 HydrophobicContact CD1-CH2 3.8Å; L28-W104 HydrophobicContact CD1-CZ3 3.28Å; L28-W104 HydrophobicContact CD2-CZ3 4.37Å; L28-W104 HydrophobicContact CG-CZ3 4.47Å; Q100-W104 HydrophobicContact CB-CH2 4.43Å; Q100-W104 HydrophobicContact CB-CZ2 4.04Å; Q100-W104 VanDerWaalsContact O-CG 3.27Å; Q100-W104 PolarHBondContact O-N 3.25Å; L101-W104 HydrophobicContact CD1-CE3 4.29Å; L101-W104 PolarHBondContact O-N 3.42Å; G102-W104 VanDerWaalsContact C-N 3.33Å; G102-W104 PolarHBondContact O-N 3.19Å; W104-G108 PolarHBondContact O-N 3.42Å; W104-H109 HydrophobicContact CB-CB 4.43Å; W104-H109 PolarHBondContact O-N 3.24Å
105	Q	77.2	Confident	73.5	Confident	20 Å²	20	49.4 Å²	49.4	9%	0.093	32%	0.32	C	S	.	.	H	α-helix	trans	-66.2	-38.1	172.2	-72.4	174.2	11.1	0	0	111.9	L101 G102 A103 M112 G116	L101-Q105 WeakPolarHBondContact O-CG 3.44Å; L101-Q105 PolarHBondContact O-N 3.38Å; G102-Q105 WeakPolarHBondContact O-CB 3.45Å; G102-Q105 PolarHBondContact O-N 3.39Å; A103-Q105 VanDerWaalsContact C-N 3.32Å; A103-Q105 PolarHBondContact O-N 3.41Å; Q105-M112 HydrophobicContact CG-CE 4.07Å; Q105-G116 VanDerWaalsContact OE1-N 3.08Å
106	A	76.8	Confident	73.2	Confident	75 Å²	75	49.3 Å²	49.3	62%	0.62	32%	0.323	S	S	*	.	H	α-helix	trans	-73	-37.2	179.1	0	0	0	0	0	112.5	G102 A103 G108	G102-A106 PolarHBondContact O-N 3.44Å; A103-A106 PolarHBondContact O-N 3.21Å; A103-A106 VanDerWaalsContact O-N 3.11Å; A106-G108 VanDerWaalsContact C-N 3.26Å; A106-G108 PolarHBondContact O-N 3.24Å
107	E	76.9	Confident	72.8	Confident	126 Å²	126	49.9 Å²	49.9	59%	0.589	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-7.4	178.5	-68.8	171.9	164.8	0	0	113.2	A103 H109	A103-E107 WeakPolarHBondContact O-CB 3.41Å; A103-E107 WeakPolarHBondContact O-CG 3.42Å; A103-E107 PolarHBondContact O-N 2.87Å; E107-H109 VanDerWaalsContact CB-CD2 3.46Å; E107-H109 WeakPolarHBondContact CB-CD2 3.5Å; E107-H109 PolarHBondContact O-N 2.88Å; E107-H109 IonicContact OE2-CD2 3.1Å; E107-H109 PolarHBondContact OE2-CD2 3.39Å; E107-H109 IonicContact OE2-NE2 3.15Å; E107-H109 PolarHBondContact OE2-NE2 2.96Å; E107-H109 VanDerWaalsContact OE2-NE2 3.15Å
108	G	66.6	Low	72.6	Confident	44 Å²	44	50.6 Å²	50.6	45%	0.454	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	19.9	178.7	0	0	0	0	0	113.9	W104 A106 C110 G111	W104-G108 PolarHBondContact O-N 3.42Å; A106-G108 VanDerWaalsContact C-N 3.26Å; A106-G108 PolarHBondContact O-N 3.24Å; G108-C110 PolarHBondContact O-N 2.6Å; G108-G111 PolarHBondContact O-N 2.89Å
109	H	62.3	Low	72.7	Confident	94 Å²	94	52.3 Å²	52.3	44%	0.435	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-58.9	132.1	179.5	-79.2	-59.4	0	0	0	111	W104 E107 G111 M112	W104-H109 HydrophobicContact CB-CB 4.43Å; W104-H109 PolarHBondContact O-N 3.24Å; E107-H109 VanDerWaalsContact CB-CD2 3.46Å; E107-H109 WeakPolarHBondContact CB-CD2 3.5Å; E107-H109 PolarHBondContact O-N 2.88Å; E107-H109 IonicContact OE2-CD2 3.1Å; E107-H109 PolarHBondContact OE2-CD2 3.39Å; E107-H109 IonicContact OE2-NE2 3.15Å; E107-H109 PolarHBondContact OE2-NE2 2.96Å; E107-H109 VanDerWaalsContact OE2-NE2 3.15Å; H109-G111 PolarHBondContact O-N 2.9Å; H109-G111 VanDerWaalsContact O-N 3.1Å; H109-M112 WeakPolarHBondContact O-CB 3.46Å; H109-M112 PolarHBondContact O-N 2.93Å
110	C	56.8	Low	72.7	Confident	71 Å²	71	47.1 Å²	47.1	48%	0.48	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	57.2	21.5	177.4	-59.1	0	0	0	0	116.1	C32 G108 M112	C32-C110 HydrophobicContact CB-CB 3.88Å; C32-C110 VanDerWaalsContact CB-O 3.23Å; C32-C110 WeakPolarHBondContact CB-O 3.26Å; G108-C110 PolarHBondContact O-N 2.6Å; C110-M112 VanDerWaalsContact C-N 3.29Å; C110-M112 PolarHBondContact O-N 3.27Å
111	G	59.3	Low	72.9	Confident	70 Å²	70	46.5 Å²	46.5	72%	0.722	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	75.6	17.3	179.9	0	0	0	0	0	114.1	G108 H109	G108-G111 PolarHBondContact O-N 2.89Å; H109-G111 PolarHBondContact O-N 2.9Å; H109-G111 VanDerWaalsContact O-N 3.1Å
112	M	63	Low	73.1	Confident	17 Å²	17	50.5 Å²	50.5	8%	0.084	34%	0.342	C	S	.	.			trans	-66.2	135.6	174.3	-74.6	-140.8	51.8	0	0	111.6	C32 G37 L101 Q105 H109 C110	C32-M112 WeakPolarHBondContact SG-CG 3.27Å; G37-M112 WeakPolarHBondContact O-CE 3.29Å; L101-M112 HydrophobicContact CD1-CE 4.29Å; L101-M112 HydrophobicContact CD1-SD 4.36Å; Q105-M112 HydrophobicContact CG-CE 4.07Å; H109-M112 WeakPolarHBondContact O-CB 3.46Å; H109-M112 PolarHBondContact O-N 2.93Å; C110-M112 VanDerWaalsContact C-N 3.29Å; C110-M112 PolarHBondContact O-N 3.27Å
113	S	62.9	Low	73.5	Confident	76 Å²	76	56.9 Å²	56.9	53%	0.531	37%	0.366	S	S	.	.			trans	-134.4	127.1	173.2	177.8	0	0	0	0	107.5
114	G	69.9	Low	73.7	Confident	38 Å²	38	55.3 Å²	55.3	39%	0.392	35%	0.353	S	S	.	.	S	Bend	trans	-164.8	179.9	-175.4	0	0	0	0	0	111.2	G116	G114-G116 PolarHBondContact O-N 2.95Å; G114-G116 VanDerWaalsContact O-N 3.15Å
115	P	70.1	Confident	74.3	Confident	80 Å²	80	53.4 Å²	53.4	52%	0.519	35%	0.346	S	S	.	.	S	Bend	trans	-73.4	-3.4	-171	33.3	-37.7	0	0	0	113.6	A119 L120	P115-A119 HydrophobicContact CB-CB 3.71Å; P115-A119 HydrophobicContact CG-CB 4.39Å; P115-A119 WeakPolarHBondContact O-CB 3.41Å; P115-L120 HydrophobicContact CG-CD2 3.86Å; P115-L120 HydrophobicContact CG-CG 4.08Å
116	G	75.5	Confident	74.8	Confident	12 Å²	12	56.2 Å²	56.2	12%	0.124	37%	0.365	C	S	.	.	H	α-helix	trans	86.4	176.2	177.5	0	0	0	0	0	113.4	Q105 G114 L120	Q105-G116 VanDerWaalsContact OE1-N 3.08Å; G114-G116 PolarHBondContact O-N 2.95Å; G114-G116 VanDerWaalsContact O-N 3.15Å; G116-L120 WeakPolarHBondContact O-CG 3.39Å; G116-L120 PolarHBondContact O-N 3.29Å
117	P	73.4	Confident	75.3	Confident	45 Å²	45	54.3 Å²	54.3	29%	0.292	35%	0.345	S	S	.	.	H	α-helix	trans	-66.6	-44.2	-173.2	23.6	-27.9	0	0	0	113	G102 A119 L120 Q121	G102-P117 WeakPolarHBondContact O-CD 3.42Å; P117-A119 PolarHBondContact O-N 3.26Å; P117-L120 PolarHBondContact O-N 2.87Å; P117-Q121 WeakPolarHBondContact O-CB 3.46Å; P117-Q121 WeakPolarHBondContact O-CG 3.41Å; P117-Q121 PolarHBondContact O-N 3.37Å
118	G	76.9	Confident	75.8	Confident	36 Å²	36	48.3 Å²	48.3	37%	0.371	32%	0.317	S	S	.	.	H	α-helix	trans	-60	-49.2	179.9	0	0	0	0	0	112.4	L120 Q121 D122	G118-L120 PolarHBondContact O-N 3.4Å; G118-Q121 PolarHBondContact O-N 2.87Å; G118-D122 WeakPolarHBondContact O-CB 3.47Å; G118-D122 PolarHBondContact O-N 2.88Å
119	A	81.9	Confident	76.8	Confident	37 Å²	37	49 Å²	49	31%	0.306	31%	0.306	S	S	.	.	H	α-helix	trans	-68.7	-31.4	-177.2	0	0	0	0	0	113.9	P115 P117 R123	P115-A119 HydrophobicContact CB-CB 3.71Å; P115-A119 HydrophobicContact CG-CB 4.39Å; P115-A119 WeakPolarHBondContact O-CB 3.41Å; P117-A119 PolarHBondContact O-N 3.26Å; A119-R123 WeakPolarHBondContact O-CB 3.31Å; A119-R123 VanDerWaalsContact O-CG 3.25Å; A119-R123 WeakPolarHBondContact O-CG 3.26Å; A119-R123 PolarHBondContact O-N 3.5Å
120	L	82.3	Confident	78	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.016	31%	0.307	C	S	.	.	H	α-helix	trans	-70.6	-43.4	174.1	-71.4	177.7	0	0	0	111.3	L45 L98 L101 P115 G116 P117 G118 R123 A124	L45-L120 HydrophobicContact CD1-CD2 4.11Å; L98-L120 HydrophobicContact CD2-CB 4.48Å; L101-L120 HydrophobicContact CD2-CD1 4.12Å; L101-L120 HydrophobicContact CG-CD1 4.34Å; P115-L120 HydrophobicContact CG-CD2 3.86Å; P115-L120 HydrophobicContact CG-CG 4.08Å; G116-L120 WeakPolarHBondContact O-CG 3.39Å; G116-L120 PolarHBondContact O-N 3.29Å; P117-L120 PolarHBondContact O-N 2.87Å; G118-L120 PolarHBondContact O-N 3.4Å; L120-R123 PolarHBondContact O-N 3.47Å; L120-A124 PolarHBondContact O-N 3.24Å
121	Q	82.4	Confident	79.4	Confident	43 Å²	43	46.8 Å²	46.8	20%	0.201	30%	0.3	C	S	.	.	H	α-helix	trans	-63.8	-45.2	175.1	-73.5	-179	-9.2	0	0	111.4	E99 P117 G118 R123 A124 F125	E99-Q121 VanDerWaalsContact CB-NE2 3.28Å; E99-Q121 VanDerWaalsContact CG-NE2 3.33Å; P117-Q121 WeakPolarHBondContact O-CB 3.46Å; P117-Q121 WeakPolarHBondContact O-CG 3.41Å; P117-Q121 PolarHBondContact O-N 3.37Å; G118-Q121 PolarHBondContact O-N 2.87Å; Q121-R123 VanDerWaalsContact C-N 3.3Å; Q121-R123 PolarHBondContact O-N 3.15Å; Q121-A124 WeakPolarHBondContact O-CB 3.26Å; Q121-A124 PolarHBondContact O-N 3.26Å; Q121-A124 VanDerWaalsContact O-N 3.09Å; Q121-F125 HydrophobicContact CB-CD2 4.26Å; Q121-F125 HydrophobicContact CB-CE2 4.18Å; Q121-F125 WeakPolarHBondContact O-CD2 3.48Å; Q121-F125 PolarHBondContact O-N 2.84Å
122	D	84.8	Confident	80.5	Confident	89 Å²	89	43.7 Å²	43.7	48%	0.476	27%	0.267	S	S	.	.	H	α-helix	trans	-58.3	-42	178.1	-71.7	-22.4	0	0	0	111.8	G118 T126	G118-D122 WeakPolarHBondContact O-CB 3.47Å; G118-D122 PolarHBondContact O-N 2.88Å; D122-T126 VanDerWaalsContact O-CB 3.26Å; D122-T126 WeakPolarHBondContact O-CB 3.06Å; D122-T126 PolarHBondContact O-N 3.23Å; D122-T126 PolarHBondContact O-OG1 3.31Å
123	R	86.3	Confident	81.4	Confident	134 Å²	134	44.7 Å²	44.7	51%	0.506	27%	0.272	S	S	.	.	H	α-helix	trans	-67	-39.5	175.6	-73.4	179.4	70.9	-177.3	0.5	112.3	L45 A119 L120 Q121 T127	L45-R123 HydrophobicContact CD1-CB 4.03Å; L45-R123 HydrophobicContact CD2-CB 4.28Å; A119-R123 WeakPolarHBondContact O-CB 3.31Å; A119-R123 VanDerWaalsContact O-CG 3.25Å; A119-R123 WeakPolarHBondContact O-CG 3.26Å; A119-R123 PolarHBondContact O-N 3.5Å; L120-R123 PolarHBondContact O-N 3.47Å; Q121-R123 VanDerWaalsContact C-N 3.3Å; Q121-R123 PolarHBondContact O-N 3.15Å; R123-T127 WeakPolarHBondContact O-CB 3.3Å; R123-T127 PolarHBondContact O-N 3.14Å; R123-T127 PolarHBondContact O-OG1 3.09Å
124	A	85.8	Confident	82.4	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.8	-50.8	175.4	0	0	0	0	0	111.3	L45 L48 L95 L98 L120 Q121 T126 T127 I128	L45-A124 HydrophobicContact CD2-CB 3.84Å; L48-A124 HydrophobicContact CD2-CB 3.78Å; L95-A124 HydrophobicContact CD2-CB 4.33Å; L98-A124 HydrophobicContact CD1-CB 3.56Å; L120-A124 PolarHBondContact O-N 3.24Å; Q121-A124 WeakPolarHBondContact O-CB 3.26Å; Q121-A124 PolarHBondContact O-N 3.26Å; Q121-A124 VanDerWaalsContact O-N 3.09Å; A124-T126 VanDerWaalsContact C-N 3.33Å; A124-T126 PolarHBondContact O-N 2.97Å; A124-T127 WeakPolarHBondContact O-CB 3.48Å; A124-T127 PolarHBondContact O-N 3.01Å; A124-T127 VanDerWaalsContact O-N 3.11Å; A124-I128 VanDerWaalsContact O-CG1 3.28Å; A124-I128 WeakPolarHBondContact O-CG1 3.36Å; A124-I128 PolarHBondContact O-N 3.36Å
125	F	88.4	Confident	82.8	Confident	11 Å²	11	52.9 Å²	52.9	5%	0.048	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-35.4	177.9	-72.2	-63.3	0	0	0	112.6	L95 Q121 T127 I128 R129 L205 Q206	L95-F125 HydrophobicContact CD1-CE1 3.91Å; L95-F125 HydrophobicContact CD1-CZ 3.92Å; L95-F125 HydrophobicContact CD2-CE1 4.05Å; L95-F125 HydrophobicContact CD2-CE2 4.32Å; L95-F125 HydrophobicContact CD2-CZ 3.87Å; Q121-F125 HydrophobicContact CB-CD2 4.26Å; Q121-F125 HydrophobicContact CB-CE2 4.18Å; Q121-F125 WeakPolarHBondContact O-CD2 3.48Å; Q121-F125 PolarHBondContact O-N 2.84Å; F125-T127 VanDerWaalsContact C-N 3.33Å; F125-T127 PolarHBondContact O-N 3.46Å; F125-I128 HydrophobicContact CD1-CD1 4.17Å; F125-I128 PolarHBondContact O-N 3.28Å; F125-R129 WeakPolarHBondContact O-CB 3.23Å; F125-R129 WeakPolarHBondContact O-CG 3.36Å; F125-R129 PolarHBondContact O-N 2.94Å; F125-L205 VanDerWaalsContact CD1-O 3.27Å; F125-L205 WeakPolarHBondContact CD1-O 3.47Å; F125-L205 VanDerWaalsContact CE1-O 3.29Å; F125-L205 WeakPolarHBondContact CE1-O 3.32Å; F125-Q206 HydrophobicContact CD1-CB 4.08Å; F125-Q206 HydrophobicContact CD1-CG 4.2Å; F125-Q206 VanDerWaalsContact CD2-CD 3.42Å; F125-Q206 HydrophobicContact CD2-CG 4.17Å; F125-Q206 VanDerWaalsContact CD2-OE1 3.25Å; F125-Q206 HydrophobicContact CE1-CB 4.23Å; F125-Q206 HydrophobicContact CE1-CG 4.01Å; F125-Q206 VanDerWaalsContact CE2-CD 3.49Å; F125-Q206 HydrophobicContact CE2-CG 3.98Å; F125-Q206 HydrophobicContact CG-CB 4.32Å; F125-Q206 HydrophobicContact CG-CG 4.29Å; F125-Q206 HydrophobicContact CZ-CG 3.89Å
126	T	88.1	Confident	83.2	Confident	80 Å²	80	51 Å²	51	49%	0.491	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-40.7	172.6	-57.7	0	0	0	0	111.4	D122 A124 R129 A130	D122-T126 VanDerWaalsContact O-CB 3.26Å; D122-T126 WeakPolarHBondContact O-CB 3.06Å; D122-T126 PolarHBondContact O-N 3.23Å; D122-T126 PolarHBondContact O-OG1 3.31Å; A124-T126 VanDerWaalsContact C-N 3.33Å; A124-T126 PolarHBondContact O-N 2.97Å; T126-R129 PolarHBondContact O-N 3.48Å; T126-A130 VanDerWaalsContact O-CB 3.29Å; T126-A130 WeakPolarHBondContact O-CB 3.3Å; T126-A130 PolarHBondContact O-N 3.46Å
127	T	87.3	Confident	83.5	Confident	34 Å²	34	52.3 Å²	52.3	21%	0.209	30%	0.295	C	S	.	.	H	α-helix	trans	-67.3	-42.5	176.8	-53.6	0	0	0	0	111.4	Q49 L52 R123 A124 F125 A130 L131	Q49-T127 HydrophobicContact CB-CG2 4.11Å; Q49-T127 HydrophobicContact CG-CG2 4.03Å; L52-T127 HydrophobicContact CD1-CG2 4.42Å; R123-T127 WeakPolarHBondContact O-CB 3.3Å; R123-T127 PolarHBondContact O-N 3.14Å; R123-T127 PolarHBondContact O-OG1 3.09Å; A124-T127 WeakPolarHBondContact O-CB 3.48Å; A124-T127 PolarHBondContact O-N 3.01Å; A124-T127 VanDerWaalsContact O-N 3.11Å; F125-T127 VanDerWaalsContact C-N 3.33Å; F125-T127 PolarHBondContact O-N 3.46Å; T127-A130 PolarHBondContact O-N 2.88Å; T127-L131 HydrophobicContact CG2-CD1 4.06Å; T127-L131 WeakPolarHBondContact O-CG 3.37Å; T127-L131 PolarHBondContact O-N 3.19Å
128	I	87.1	Confident	83.9	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-59.7	-49.3	174.7	-68.4	162.8	0	0	0	110.2	L52 L91 L95 A124 F125 A130 L131 L132	L52-I128 HydrophobicContact CD1-CG1 3.72Å; L52-I128 HydrophobicContact CD2-CG1 4.46Å; L91-I128 HydrophobicContact CD1-CD1 4.13Å; L91-I128 HydrophobicContact CD1-CG1 4.46Å; L91-I128 HydrophobicContact CD1-CG2 4.38Å; L95-I128 HydrophobicContact CD2-CD1 4.25Å; A124-I128 VanDerWaalsContact O-CG1 3.28Å; A124-I128 WeakPolarHBondContact O-CG1 3.36Å; A124-I128 PolarHBondContact O-N 3.36Å; F125-I128 HydrophobicContact CD1-CD1 4.17Å; F125-I128 PolarHBondContact O-N 3.28Å; I128-A130 PolarHBondContact O-N 3.43Å; I128-L131 PolarHBondContact O-N 2.81Å; I128-L132 HydrophobicContact CG2-CD1 3.64Å; I128-L132 WeakPolarHBondContact O-CB 3.42Å; I128-L132 PolarHBondContact O-N 3.28Å
129	R	88.4	Confident	84.3	Confident	58 Å²	58	53 Å²	53	22%	0.219	30%	0.298	C	S	.	.	H	α-helix	trans	-60.6	-44.2	176.9	-72	169.9	-167.9	133.6	4.7	111.9	F125 T126 L131 L133 Q206 L207	F125-R129 WeakPolarHBondContact O-CB 3.23Å; F125-R129 WeakPolarHBondContact O-CG 3.36Å; F125-R129 PolarHBondContact O-N 2.94Å; T126-R129 PolarHBondContact O-N 3.48Å; R129-L131 PolarHBondContact O-N 3.08Å; R129-L133 WeakPolarHBondContact O-CA 3.42Å; R129-L133 WeakPolarHBondContact O-CB 3.47Å; R129-L133 PolarHBondContact O-N 3.43Å; R129-Q206 PolarHBondContact NE-O 3.44Å; R129-Q206 PolarHBondContact NH2-O 2.79Å; R129-L207 HydrophobicContact CG-CD2 3.54Å
130	A	87	Confident	84.6	Confident	55 Å²	55	51.6 Å²	51.6	46%	0.455	29%	0.286	S	S	.	.	H	α-helix	trans	-65.4	-37.1	-179.6	0	0	0	0	0	112.7	T126 T127 I128 F134	T126-A130 VanDerWaalsContact O-CB 3.29Å; T126-A130 WeakPolarHBondContact O-CB 3.3Å; T126-A130 PolarHBondContact O-N 3.46Å; T127-A130 PolarHBondContact O-N 2.88Å; I128-A130 PolarHBondContact O-N 3.43Å; A130-F134 WeakPolarHBondContact O-CB 3.4Å
131	L	85.6	Confident	84.8	Confident	63 Å²	63	55.2 Å²	55.2	33%	0.33	30%	0.302	S	S	.	.	H	α-helix	trans	-83.2	-31.2	-179.3	-67	176.7	0	0	0	113.4	Q49 L52 V57 T127 I128 R129	Q49-L131 HydrophobicContact CG-CD1 4.24Å; L52-L131 HydrophobicContact CB-CD1 3.61Å; L52-L131 HydrophobicContact CD1-CD1 4.06Å; L52-L131 HydrophobicContact CG-CD1 4.49Å; V57-L131 HydrophobicContact CG2-CB 4.28Å; T127-L131 HydrophobicContact CG2-CD1 4.06Å; T127-L131 WeakPolarHBondContact O-CG 3.37Å; T127-L131 PolarHBondContact O-N 3.19Å; I128-L131 PolarHBondContact O-N 2.81Å; R129-L131 PolarHBondContact O-N 3.08Å
132	L	83.9	Confident	85	Confident	5 Å²	5	58 Å²	58	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-90.4	-43.5	179.1	-73.2	169.3	0	0	0	113.3	V57 F60 W61 L87 I128 L207	V57-L132 HydrophobicContact CB-CD2 4.3Å; V57-L132 HydrophobicContact CG1-CD2 4.1Å; V57-L132 HydrophobicContact CG2-CD2 3.72Å; V57-L132 HydrophobicContact CG2-CG 4.09Å; F60-L132 HydrophobicContact CD1-CD2 3.98Å; F60-L132 HydrophobicContact CE1-CD2 4.38Å; F60-L132 HydrophobicContact CG-CD2 4.49Å; W61-L132 WeakPolarHBondContact CZ2-O 3.32Å; L87-L132 HydrophobicContact CD1-CD1 4.28Å; L87-L132 HydrophobicContact CD2-CD1 3.76Å; I128-L132 HydrophobicContact CG2-CD1 3.64Å; I128-L132 WeakPolarHBondContact O-CB 3.42Å; I128-L132 PolarHBondContact O-N 3.28Å; L132-L207 HydrophobicContact CD1-CD1 4.28Å
133	L	82.5	Confident	85.2	Confident	38 Å²	38	54.7 Å²	54.7	20%	0.199	30%	0.296	C	S	.	.	H	α-helix	trans	-115.3	4	-163.3	-58	-179.7	0	0	0	114.6	R129 P136 L140 L207 W210 V211	R129-L133 WeakPolarHBondContact O-CA 3.42Å; R129-L133 WeakPolarHBondContact O-CB 3.47Å; R129-L133 PolarHBondContact O-N 3.43Å; L133-P136 WeakPolarHBondContact O-CD 3.42Å; L133-L140 HydrophobicContact CD2-CD2 4.23Å; L133-L207 HydrophobicContact CD1-CD2 3.87Å; L133-W210 HydrophobicContact CD1-CB 3.66Å; L133-W210 HydrophobicContact CD1-CG 4.43Å; L133-V211 HydrophobicContact CD1-CG2 4.02Å; L133-V211 HydrophobicContact CD2-CG2 4.09Å
134	F	82.5	Confident	85.3	Confident	184 Å²	184	48.5 Å²	48.5	81%	0.807	27%	0.273	S	S	*	.	S	Bend	trans	-68.9	-34.5	176	-176.5	-101.8	0	0	0	112.6	A130	A130-F134 WeakPolarHBondContact O-CB 3.4Å
135	S	78.8	Confident	85.5	Confident	102 Å²	102	51.6 Å²	51.6	71%	0.713	29%	0.289	S	S	*	.	S	Bend	trans	-146.4	74	173.1	-169	0	0	0	0	109.5
136	P	78.7	Confident	85.6	Confident	41 Å²	41	53 Å²	53	27%	0.266	30%	0.296	S	S	.	.			trans	-69.4	133.9	-178.3	28.9	-32.3	0	0	0	109.8	W61 L133 L140	W61-P136 HydrophobicContact CH2-CB 4.07Å; L133-P136 WeakPolarHBondContact O-CD 3.42Å; P136-L140 HydrophobicContact CB-CD2 4.43Å
137	P	80.6	Confident	85.7	Confident	40 Å²	40	49.6 Å²	49.6	26%	0.26	28%	0.275	S	S	.	.			trans	-50.2	139.8	165.7	-29	32.6	0	0	0	112.3	W61 V139 L140	W61-P137 HydrophobicContact CD2-CG 3.93Å; W61-P137 HydrophobicContact CE3-CB 4.23Å; W61-P137 HydrophobicContact CE3-CG 3.63Å; W61-P137 VanDerWaalsContact CH2-CD 3.49Å; W61-P137 HydrophobicContact CH2-CG 4.3Å; W61-P137 HydrophobicContact CZ3-CB 4.15Å; W61-P137 VanDerWaalsContact CZ3-CD 3.47Å; W61-P137 HydrophobicContact CZ3-CG 3.79Å; P137-V139 PolarHBondContact O-N 2.64Å; P137-L140 PolarHBondContact O-N 2.86Å
138	A	82.8	Confident	85.9	Confident	70 Å²	70	48 Å²	48	58%	0.579	27%	0.265	S	S	*	.	H	α-helix	trans	-55.6	-22.6	177.8	0	0	0	0	0	113.2	L140 Q141 Q142	A138-L140 VanDerWaalsContact C-N 3.33Å; A138-L140 PolarHBondContact O-N 3.48Å; A138-Q141 PolarHBondContact O-N 2.82Å; A138-Q142 WeakPolarHBondContact O-CB 3.46Å; A138-Q142 PolarHBondContact O-N 3.49Å
139	V	85.7	Confident	86.1	Confident	26 Å²	26	49.7 Å²	49.7	16%	0.158	28%	0.277	C	S	.	.	H	α-helix	trans	-57.6	-43	175.9	-176.6	0	0	0	0	111.5	P137 Q142 R143	P137-V139 PolarHBondContact O-N 2.64Å; V139-Q142 PolarHBondContact O-N 3.09Å; V139-R143 HydrophobicContact CG1-CG 4.22Å; V139-R143 WeakPolarHBondContact O-CB 3.15Å; V139-R143 WeakPolarHBondContact O-CG 3.43Å; V139-R143 PolarHBondContact O-N 2.7Å
140	L	87.3	Confident	86.1	Confident	7 Å²	7	51.2 Å²	51.2	4%	0.037	28%	0.283	C	S	.	.	H	α-helix	trans	-65.9	-47	179.1	174.1	68.9	0	0	0	111.2	W61 L64 L80 F84 L133 P136 P137 A138 Q142 R143 V144	W61-L140 HydrophobicContact CH2-CB 4.03Å; W61-L140 HydrophobicContact CH2-CD2 3.65Å; W61-L140 HydrophobicContact CH2-CG 4.43Å; W61-L140 HydrophobicContact CZ3-CB 3.66Å; W61-L140 HydrophobicContact CZ3-CD2 4.12Å; W61-L140 HydrophobicContact CZ3-CG 4.43Å; L64-L140 HydrophobicContact CD1-CD1 4.09Å; L80-L140 HydrophobicContact CD1-CD1 4.1Å; F84-L140 HydrophobicContact CE2-CD1 3.89Å; F84-L140 HydrophobicContact CZ-CD1 3.89Å; L133-L140 HydrophobicContact CD2-CD2 4.23Å; P136-L140 HydrophobicContact CB-CD2 4.43Å; P137-L140 PolarHBondContact O-N 2.86Å; A138-L140 VanDerWaalsContact C-N 3.33Å; A138-L140 PolarHBondContact O-N 3.48Å; L140-Q142 VanDerWaalsContact C-N 3.33Å; L140-Q142 PolarHBondContact O-N 3.32Å; L140-R143 PolarHBondContact O-N 2.95Å; L140-V144 HydrophobicContact CD1-CG2 3.66Å; L140-V144 HydrophobicContact CG-CG2 4.13Å; L140-V144 VanDerWaalsContact O-CB 3.29Å; L140-V144 WeakPolarHBondContact O-CB 3.23Å; L140-V144 WeakPolarHBondContact O-CG2 3.06Å; L140-V144 PolarHBondContact O-N 2.9Å
141	Q	86.7	Confident	86.1	Confident	79 Å²	79	48.6 Å²	48.6	37%	0.369	26%	0.261	S	S	.	.	H	α-helix	trans	-58.1	-45.5	178	-72.5	174	-31.6	0	0	111.3	A138 L145 E214	A138-Q141 PolarHBondContact O-N 2.82Å; Q141-L145 WeakPolarHBondContact O-CB 3.17Å; Q141-L145 PolarHBondContact O-N 3.48Å; Q141-E214 PolarHBondContact NE2-OE1 2.87Å; Q141-E214 PolarHBondContact NE2-OE2 3.42Å
142	Q	87.8	Confident	86.3	Confident	101 Å²	101	46 Å²	46	47%	0.472	25%	0.247	S	C	.	.	H	α-helix	trans	-63.5	-43.9	178.6	-171.4	-177.8	2.1	0	0	112.3	A138 V139 L140 E146	A138-Q142 WeakPolarHBondContact O-CB 3.46Å; A138-Q142 PolarHBondContact O-N 3.49Å; V139-Q142 PolarHBondContact O-N 3.09Å; L140-Q142 VanDerWaalsContact C-N 3.33Å; L140-Q142 PolarHBondContact O-N 3.32Å; Q142-E146 WeakPolarHBondContact O-CB 3.4Å; Q142-E146 PolarHBondContact O-N 3.25Å
143	R	87.3	Confident	86.4	Confident	20 Å²	20	48 Å²	48	8%	0.075	26%	0.261	C	S	.	.	H	α-helix	trans	-67.8	-41.5	-179.8	-69	-69.5	-177.9	-128.8	5.8	112.2	R76 L80 V139 L140 E146 F147	R76-R143 VanDerWaalsContact CD-CZ 3.46Å; L80-R143 HydrophobicContact CD1-CB 4.27Å; V139-R143 HydrophobicContact CG1-CG 4.22Å; V139-R143 WeakPolarHBondContact O-CB 3.15Å; V139-R143 WeakPolarHBondContact O-CG 3.43Å; V139-R143 PolarHBondContact O-N 2.7Å; L140-R143 PolarHBondContact O-N 2.95Å; R143-E146 IonicContact NH1-OE2 2.64Å; R143-E146 PolarHBondContact NH1-OE2 3.49Å; R143-F147 WeakPolarHBondContact O-CB 3.37Å; R143-F147 PolarHBondContact O-N 3.44Å
144	V	89.8	Confident	86.7	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.024	25%	0.252	C	S	.	.	H	α-helix	trans	-67.5	-42.9	177.4	173.2	0	0	0	0	110.5	L80 L140 F147 Y148 V211 A215	L80-V144 HydrophobicContact CD1-CG2 4.14Å; L80-V144 HydrophobicContact CD2-CG2 4.26Å; L140-V144 HydrophobicContact CD1-CG2 3.66Å; L140-V144 HydrophobicContact CG-CG2 4.13Å; L140-V144 VanDerWaalsContact O-CB 3.29Å; L140-V144 WeakPolarHBondContact O-CB 3.23Å; L140-V144 WeakPolarHBondContact O-CG2 3.06Å; L140-V144 PolarHBondContact O-N 2.9Å; V144-F147 PolarHBondContact O-N 3.32Å; V144-Y148 HydrophobicContact CG1-CD2 3.43Å; V144-Y148 VanDerWaalsContact CG1-CD2 3.43Å; V144-Y148 HydrophobicContact CG1-CE2 3.35Å; V144-Y148 VanDerWaalsContact O-CD2 3.24Å; V144-Y148 WeakPolarHBondContact O-CD2 3.41Å; V144-Y148 PolarHBondContact O-N 3.39Å; V144-V211 HydrophobicContact CG1-CG1 4.25Å; V144-V211 HydrophobicContact CG2-CG1 3.86Å; V144-A215 HydrophobicContact CG1-CB 3.8Å
145	L	90.1	Very high	87	Confident	64 Å²	64	38.2 Å²	38.2	34%	0.335	22%	0.217	S	C	.	.	H	α-helix	trans	-61	-47.2	174.9	-177.3	69.6	0	0	0	112	Q141 S149 A215 A218 I219	Q141-L145 WeakPolarHBondContact O-CB 3.17Å; Q141-L145 PolarHBondContact O-N 3.48Å; L145-S149 VanDerWaalsContact O-CB 3.24Å; L145-S149 WeakPolarHBondContact O-CB 3.42Å; L145-S149 PolarHBondContact O-N 2.85Å; L145-S149 PolarHBondContact O-OG 3.35Å; L145-A215 HydrophobicContact CB-CB 4.34Å; L145-A215 HydrophobicContact CD1-CB 4.22Å; L145-A218 HydrophobicContact CD1-CB 4.1Å; L145-I219 HydrophobicContact CD1-CD1 4.05Å; L145-I219 HydrophobicContact CD1-CG1 3.69Å
146	E	89.1	Confident	87.3	Confident	42 Å²	42	34.6 Å²	34.6	20%	0.196	19%	0.189	C	C	.	.	H	α-helix	trans	-59.3	-49	177	-178.4	173.8	-152.4	0	0	111.1	E73 R76 Q142 R143 S149 R150	E73-E146 HydrophobicContact CG-CG 4.39Å; E73-E146 VanDerWaalsContact OE1-CG 3.27Å; E73-E146 WeakPolarHBondContact OE1-CG 3.21Å; R76-E146 IonicContact CZ-OE1 2.78Å; R76-E146 IonicContact CZ-OE2 3.69Å; R76-E146 IonicContact NH1-OE1 3.7Å; R76-E146 PolarHBondContact NH1-OE1 2.76Å; R76-E146 IonicContact NH1-OE2 3.74Å; R76-E146 PolarHBondContact NH1-OE2 2.9Å; R76-E146 IonicContact NH2-OE1 3.06Å; R76-E146 PolarHBondContact NH2-OE1 3.25Å; R76-E146 IonicContact NH2-OE2 2.96Å; Q142-E146 WeakPolarHBondContact O-CB 3.4Å; Q142-E146 PolarHBondContact O-N 3.25Å; R143-E146 IonicContact NH1-OE2 2.64Å; R143-E146 PolarHBondContact NH1-OE2 3.49Å; E146-S149 PolarHBondContact O-N 3.42Å; E146-R150 PolarHBondContact O-N 2.89Å; E146-R150 VanDerWaalsContact O-N 3.1Å
147	F	90.6	Very high	87.5	Confident	8 Å²	8	35 Å²	35	4%	0.035	19%	0.192	C	C	.	.	H	α-helix	trans	-59.6	-52.4	178.4	178.7	-103.8	0	0	0	112.5	A77 L80 R143 V144 S149 R150 T151 R194 L195 L198	A77-F147 HydrophobicContact CB-CD2 3.69Å; A77-F147 HydrophobicContact CB-CE2 4.06Å; L80-F147 HydrophobicContact CD2-CB 3.92Å; L80-F147 HydrophobicContact CD2-CD1 4.44Å; L80-F147 HydrophobicContact CD2-CG 4.14Å; R143-F147 WeakPolarHBondContact O-CB 3.37Å; R143-F147 PolarHBondContact O-N 3.44Å; V144-F147 PolarHBondContact O-N 3.32Å; F147-S149 VanDerWaalsContact C-N 3.32Å; F147-S149 PolarHBondContact O-N 3.3Å; F147-R150 PolarHBondContact O-N 2.72Å; F147-T151 HydrophobicContact CD1-CG2 4.42Å; F147-T151 HydrophobicContact CD2-CG2 4.28Å; F147-T151 HydrophobicContact CE1-CG2 4.01Å; F147-T151 HydrophobicContact CE2-CG2 3.87Å; F147-T151 HydrophobicContact CZ-CG2 3.73Å; F147-T151 WeakPolarHBondContact O-CG2 3.33Å; F147-T151 PolarHBondContact O-N 3.34Å; F147-T151 PolarHBondContact O-OG1 3.04Å; F147-R194 HydrophobicContact CE2-CB 4.24Å; F147-R194 HydrophobicContact CZ-CB 4.21Å; F147-L195 HydrophobicContact CE1-CD1 3.82Å; F147-L195 HydrophobicContact CZ-CB 4.35Å; F147-L195 HydrophobicContact CZ-CD1 4.43Å; F147-L198 HydrophobicContact CD1-CD2 3.65Å; F147-L198 HydrophobicContact CE1-CB 4.36Å; F147-L198 HydrophobicContact CE1-CD2 3.41Å; F147-L198 VanDerWaalsContact CE1-CD2 3.41Å; F147-L198 HydrophobicContact CZ-CD2 4.24Å
148	Y	91.9	Very high	87.6	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-64.8	-36.5	179.6	-77.2	-57.7	0	0	0	112.1	V144 R150 T151 F152 L195 S212 A215 W254 V258	V144-Y148 HydrophobicContact CG1-CD2 3.43Å; V144-Y148 VanDerWaalsContact CG1-CD2 3.43Å; V144-Y148 HydrophobicContact CG1-CE2 3.35Å; V144-Y148 VanDerWaalsContact O-CD2 3.24Å; V144-Y148 WeakPolarHBondContact O-CD2 3.41Å; V144-Y148 PolarHBondContact O-N 3.39Å; Y148-R150 VanDerWaalsContact C-N 3.33Å; Y148-R150 PolarHBondContact O-N 2.94Å; Y148-T151 WeakPolarHBondContact CA-OG1 3.23Å; Y148-T151 PolarHBondContact O-N 3.13Å; Y148-T151 PolarHBondContact O-OG1 3.12Å; Y148-T151 VanDerWaalsContact O-OG1 3.13Å; Y148-F152 VanDerWaalsContact O-CB 3.23Å; Y148-F152 WeakPolarHBondContact O-CB 3.39Å; Y148-F152 PolarHBondContact O-N 3.24Å; Y148-L195 HydrophobicContact CD1-CD1 3.82Å; Y148-L195 HydrophobicContact CE1-CD1 3.56Å; Y148-S212 WeakPolarHBondContact OH-CB 3.24Å; Y148-A215 HydrophobicContact CD2-CB 4.02Å; Y148-W254 HydrophobicContact CD1-CH2 4.28Å; Y148-W254 AromaticContact CD1-CZ2 3.96Å; Y148-W254 HydrophobicContact CD1-CZ2 3.96Å; Y148-V258 HydrophobicContact CD1-CG2 4.41Å; Y148-V258 HydrophobicContact CE1-CG1 3.78Å; Y148-V258 HydrophobicContact CE1-CG2 4.22Å
149	S	90.1	Very high	87.1	Confident	37 Å²	37	42 Å²	42	26%	0.259	20%	0.203	S	C	.	.	H	α-helix	trans	-59.3	-44.7	176.6	-61.7	0	0	0	0	111.1	L145 E146 F147 S153 I219	L145-S149 VanDerWaalsContact O-CB 3.24Å; L145-S149 WeakPolarHBondContact O-CB 3.42Å; L145-S149 PolarHBondContact O-N 2.85Å; L145-S149 PolarHBondContact O-OG 3.35Å; E146-S149 PolarHBondContact O-N 3.42Å; F147-S149 VanDerWaalsContact C-N 3.32Å; F147-S149 PolarHBondContact O-N 3.3Å; S149-S153 PolarHBondContact O-N 3.25Å; S149-S153 PolarHBondContact O-OG 3.35Å; S149-S153 VanDerWaalsContact O-OG 3.11Å; S149-I219 VanDerWaalsContact N-CD1 3.35Å; S149-I219 WeakPolarHBondContact OG-CG1 3.36Å
150	R	88.4	Confident	85.8	Confident	90 Å²	90	42.1 Å²	42.1	34%	0.34	21%	0.209	S	C	.	.	H	α-helix	trans	-69.6	-45.4	177.3	-66.7	-49	-173.4	174.9	11.7	113.7	E73 E146 F147 Y148 F152 S153 V154	E73-R150 VanDerWaalsContact CD-CG 3.47Å; E73-R150 HydrophobicContact CG-CG 4.4Å; E73-R150 WeakPolarHBondContact OE1-CD 3.37Å; E73-R150 WeakPolarHBondContact OE1-CG 3.45Å; E73-R150 IonicContact OE1-CZ 3.46Å; E73-R150 IonicContact OE1-NE 3.87Å; E73-R150 PolarHBondContact OE1-NE 3.23Å; E73-R150 IonicContact OE1-NH2 2.79Å; E73-R150 IonicContact OE2-CZ 3.91Å; E73-R150 IonicContact OE2-NE 3.26Å; E73-R150 PolarHBondContact OE2-NE 2.86Å; E73-R150 IonicContact OE2-NH2 3.52Å; E73-R150 PolarHBondContact OE2-NH2 2.69Å; E146-R150 PolarHBondContact O-N 2.89Å; E146-R150 VanDerWaalsContact O-N 3.1Å; F147-R150 PolarHBondContact O-N 2.72Å; Y148-R150 VanDerWaalsContact C-N 3.33Å; Y148-R150 PolarHBondContact O-N 2.94Å; R150-F152 PolarHBondContact O-N 3.44Å; R150-S153 PolarHBondContact O-N 2.8Å; R150-V154 WeakPolarHBondContact O-CB 3.47Å; R150-V154 VanDerWaalsContact O-CG2 3.26Å; R150-V154 WeakPolarHBondContact O-CG2 3.49Å; R150-V154 PolarHBondContact O-N 3.14Å
151	T	89	Confident	84.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.9	-31.9	179.8	61.9	0	0	0	0	111.7	F147 Y148 Y155 A191 L195	F147-T151 HydrophobicContact CD1-CG2 4.42Å; F147-T151 HydrophobicContact CD2-CG2 4.28Å; F147-T151 HydrophobicContact CE1-CG2 4.01Å; F147-T151 HydrophobicContact CE2-CG2 3.87Å; F147-T151 HydrophobicContact CZ-CG2 3.73Å; F147-T151 WeakPolarHBondContact O-CG2 3.33Å; F147-T151 PolarHBondContact O-N 3.34Å; F147-T151 PolarHBondContact O-OG1 3.04Å; Y148-T151 WeakPolarHBondContact CA-OG1 3.23Å; Y148-T151 PolarHBondContact O-N 3.13Å; Y148-T151 PolarHBondContact O-OG1 3.12Å; Y148-T151 VanDerWaalsContact O-OG1 3.13Å; T151-Y155 WeakPolarHBondContact O-CB 3.33Å; T151-Y155 PolarHBondContact O-N 3.27Å; T151-A191 HydrophobicContact CG2-CB 4.34Å; T151-L195 HydrophobicContact CG2-CB 4.16Å; T151-L195 HydrophobicContact CG2-CD1 4.31Å
152	F	88.8	Confident	82.1	Confident	7 Å²	7	48.3 Å²	48.3	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-64.5	-53.9	169.1	179.9	-91.5	0	0	0	112.1	Y148 R150 V154 Y155 M156 I219 L223 V251 W254	Y148-F152 VanDerWaalsContact O-CB 3.23Å; Y148-F152 WeakPolarHBondContact O-CB 3.39Å; Y148-F152 PolarHBondContact O-N 3.24Å; R150-F152 PolarHBondContact O-N 3.44Å; F152-V154 VanDerWaalsContact C-N 3.26Å; F152-V154 PolarHBondContact O-N 3.41Å; F152-Y155 WeakPolarHBondContact O-CB 3.17Å; F152-Y155 PolarHBondContact O-N 3.03Å; F152-M156 HydrophobicContact CD1-CG 3.93Å; F152-M156 HydrophobicContact CD2-CG 4.3Å; F152-M156 HydrophobicContact CE1-CB 4.4Å; F152-M156 HydrophobicContact CE1-CG 3.29Å; F152-M156 HydrophobicContact CE1-SD 4.33Å; F152-M156 HydrophobicContact CE2-CG 3.74Å; F152-M156 HydrophobicContact CE2-SD 3.86Å; F152-M156 HydrophobicContact CG-CG 4.39Å; F152-M156 HydrophobicContact CZ-CE 4.39Å; F152-M156 HydrophobicContact CZ-CG 3.2Å; F152-M156 HydrophobicContact CZ-SD 3.62Å; F152-M156 WeakPolarHBondContact O-CG 3.42Å; F152-M156 PolarHBondContact O-N 2.9Å; F152-I219 HydrophobicContact CB-CG2 4.45Å; F152-I219 HydrophobicContact CD1-CG2 4.45Å; F152-I219 HydrophobicContact CG-CG2 4.25Å; F152-L223 HydrophobicContact CD1-CD1 3.49Å; F152-L223 VanDerWaalsContact CD1-CD1 3.49Å; F152-L223 HydrophobicContact CD1-CD2 4.27Å; F152-L223 HydrophobicContact CD1-CG 4.5Å; F152-L223 HydrophobicContact CD2-CD1 4.35Å; F152-L223 HydrophobicContact CE1-CD1 3.06Å; F152-L223 HydrophobicContact CE1-CD2 3.76Å; F152-L223 HydrophobicContact CE1-CG 4.01Å; F152-L223 HydrophobicContact CE2-CD1 4.01Å; F152-L223 HydrophobicContact CG-CD1 4.12Å; F152-L223 HydrophobicContact CZ-CD1 3.35Å; F152-V251 HydrophobicContact CE2-CG1 4.09Å; F152-V251 HydrophobicContact CE2-CG2 4.13Å; F152-V251 HydrophobicContact CZ-CG2 4.08Å; F152-W254 HydrophobicContact CB-CD2 4.35Å; F152-W254 HydrophobicContact CB-CH2 4.3Å; F152-W254 HydrophobicContact CB-CZ2 3.79Å; F152-W254 HydrophobicContact CD2-CB 4.42Å; F152-W254 AromaticContact CD2-CD2 3.59Å; F152-W254 HydrophobicContact CD2-CD2 3.59Å; F152-W254 AromaticContact CD2-CE2 3.95Å; F152-W254 AromaticContact CD2-CE3 3.69Å; F152-W254 HydrophobicContact CD2-CE3 3.69Å; F152-W254 AromaticContact CD2-CG 3.91Å; F152-W254 HydrophobicContact CD2-CG 3.91Å; F152-W254 HydrophobicContact CD2-CH2 4.43Å; F152-W254 HydrophobicContact CD2-CZ2 4.36Å; F152-W254 HydrophobicContact CD2-CZ3 4.11Å; F152-W254 HydrophobicContact CE2-CD2 4.44Å; F152-W254 HydrophobicContact CE2-CE3 4.34Å; F152-W254 HydrophobicContact CG-CD2 4.47Å
153	S	86.5	Confident	79.6	Confident	47 Å²	47	51.6 Å²	51.6	33%	0.329	28%	0.276	S	S	.	.	H	α-helix	trans	-56.1	-41.8	178.5	-62.7	0	0	0	0	112.2	S149 R150 M156 S157	S149-S153 PolarHBondContact O-N 3.25Å; S149-S153 PolarHBondContact O-OG 3.35Å; S149-S153 VanDerWaalsContact O-OG 3.11Å; R150-S153 PolarHBondContact O-N 2.8Å; S153-M156 PolarHBondContact O-N 3.05Å; S153-S157 WeakPolarHBondContact O-CB 3.43Å; S153-S157 PolarHBondContact O-N 3.43Å; S153-S157 PolarHBondContact O-OG 2.96Å
154	V	88.5	Confident	77.1	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.018	31%	0.312	C	S	.	.	H	α-helix	trans	-62.1	-45.3	175	170.7	0	0	0	0	111.5	R150 F152 S157 R158 C179 C188 L192	R150-V154 WeakPolarHBondContact O-CB 3.47Å; R150-V154 VanDerWaalsContact O-CG2 3.26Å; R150-V154 WeakPolarHBondContact O-CG2 3.49Å; R150-V154 PolarHBondContact O-N 3.14Å; F152-V154 VanDerWaalsContact C-N 3.26Å; F152-V154 PolarHBondContact O-N 3.41Å; V154-S157 PolarHBondContact O-OG 3.07Å; V154-R158 PolarHBondContact O-N 2.77Å; V154-C179 HydrophobicContact CG2-CB 4.22Å; V154-C188 HydrophobicContact CG1-CB 3.6Å; V154-C188 HydrophobicContact CG2-CB 4.24Å; V154-L192 HydrophobicContact CG1-CD1 4.12Å; V154-L192 HydrophobicContact CG1-CD2 4.3Å; V154-L192 HydrophobicContact CG1-CG 3.95Å
155	Y	88	Confident	74.3	Confident	14 Å²	14	58.8 Å²	58.8	6%	0.055	35%	0.348	C	S	.	.	H	α-helix	trans	-60.7	-49.6	176.9	177	-81.2	0	0	0	111.4	T151 F152 S157 R158 E159 L250 G253 W254 K257	T151-Y155 WeakPolarHBondContact O-CB 3.33Å; T151-Y155 PolarHBondContact O-N 3.27Å; F152-Y155 WeakPolarHBondContact O-CB 3.17Å; F152-Y155 PolarHBondContact O-N 3.03Å; Y155-S157 VanDerWaalsContact C-N 3.35Å; Y155-S157 PolarHBondContact O-N 3.06Å; Y155-R158 PolarHBondContact O-N 3.05Å; Y155-R158 VanDerWaalsContact O-N 3.09Å; Y155-E159 HydrophobicContact CD1-CB 4.47Å; Y155-E159 HydrophobicContact CD1-CG 4.38Å; Y155-E159 HydrophobicContact CD2-CG 4.31Å; Y155-E159 HydrophobicContact CE1-CB 4.06Å; Y155-E159 HydrophobicContact CE1-CG 4.05Å; Y155-E159 HydrophobicContact CE2-CG 4.02Å; Y155-E159 HydrophobicContact CG-CG 4.49Å; Y155-E159 PolarHBondContact O-N 2.82Å; Y155-L250 VanDerWaalsContact CE1-O 3.25Å; Y155-L250 WeakPolarHBondContact CE1-O 3.37Å; Y155-L250 PolarHBondContact OH-O 3.43Å; Y155-G253 VanDerWaalsContact OH-C 3.27Å; Y155-G253 WeakPolarHBondContact OH-CA 3.4Å; Y155-W254 HydrophobicContact CD1-CB 3.71Å; Y155-W254 HydrophobicContact CD1-CG 4.31Å; Y155-W254 HydrophobicContact CD2-CB 4.13Å; Y155-W254 AromaticContact CD2-CD1 3.92Å; Y155-W254 HydrophobicContact CD2-CG 4.45Å; Y155-W254 HydrophobicContact CE1-CB 3.76Å; Y155-W254 HydrophobicContact CE2-CB 4.11Å; Y155-W254 HydrophobicContact CG-CB 3.92Å; Y155-W254 AromaticContact CG-CD1 3.67Å; Y155-W254 HydrophobicContact CG-CG 4.16Å; Y155-W254 PolarHBondContact OH-N 3.37Å; Y155-K257 HydrophobicContact CD2-CD 3.96Å; Y155-K257 HydrophobicContact CE2-CD 3.67Å
156	M	85.4	Confident	71.5	Confident	27 Å²	27	64.7 Å²	64.7	13%	0.133	37%	0.374	C	S	.	.	H	α-helix	trans	-64.3	-38.4	-178.7	-66.3	-54.2	-67.8	0	0	112.2	F152 S153 R158 G160 W247 L250 V251	F152-M156 HydrophobicContact CD1-CG 3.93Å; F152-M156 HydrophobicContact CD2-CG 4.3Å; F152-M156 HydrophobicContact CE1-CB 4.4Å; F152-M156 HydrophobicContact CE1-CG 3.29Å; F152-M156 HydrophobicContact CE1-SD 4.33Å; F152-M156 HydrophobicContact CE2-CG 3.74Å; F152-M156 HydrophobicContact CE2-SD 3.86Å; F152-M156 HydrophobicContact CG-CG 4.39Å; F152-M156 HydrophobicContact CZ-CE 4.39Å; F152-M156 HydrophobicContact CZ-CG 3.2Å; F152-M156 HydrophobicContact CZ-SD 3.62Å; F152-M156 WeakPolarHBondContact O-CG 3.42Å; F152-M156 PolarHBondContact O-N 2.9Å; S153-M156 PolarHBondContact O-N 3.05Å; M156-R158 PolarHBondContact O-N 3.43Å; M156-G160 VanDerWaalsContact O-CA 3.26Å; M156-G160 WeakPolarHBondContact O-CA 3.29Å; M156-G160 PolarHBondContact O-N 2.81Å; M156-W247 VanDerWaalsContact CE-NE1 3.31Å; M156-L250 HydrophobicContact CE-CB 4.42Å; M156-V251 HydrophobicContact CE-CG2 4.3Å; M156-V251 HydrophobicContact SD-CG2 4.29Å
157	S	82.9	Confident	68.9	Low	48 Å²	48	66.3 Å²	66.3	34%	0.336	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-19.8	176	69.3	0	0	0	0	114	S153 V154 Y155 G178	S153-S157 WeakPolarHBondContact O-CB 3.43Å; S153-S157 PolarHBondContact O-N 3.43Å; S153-S157 PolarHBondContact O-OG 2.96Å; V154-S157 PolarHBondContact O-OG 3.07Å; Y155-S157 VanDerWaalsContact C-N 3.35Å; Y155-S157 PolarHBondContact O-N 3.06Å; S157-G178 WeakPolarHBondContact OG-CA 3.38Å
158	R	82.1	Confident	66.2	Low	166 Å²	166	72 Å²	72	63%	0.626	43%	0.432	S	S	*	.	H	α-helix	trans	-101.1	-38.7	-176.4	-176.6	176.8	172.9	175.9	-0.9	113.1	V154 Y155 M156	V154-R158 PolarHBondContact O-N 2.77Å; Y155-R158 PolarHBondContact O-N 3.05Å; Y155-R158 VanDerWaalsContact O-N 3.09Å; M156-R158 PolarHBondContact O-N 3.43Å
159	E	72.9	Confident	63.6	Low	92 Å²	92	81.6 Å²	81.6	43%	0.43	48%	0.477	S	S	.	.	H	α-helix	trans	-100.8	-24.3	-175.5	-59.8	-80.9	175.7	0	0	112.4	Y155 K257	Y155-E159 HydrophobicContact CD1-CB 4.47Å; Y155-E159 HydrophobicContact CD1-CG 4.38Å; Y155-E159 HydrophobicContact CD2-CG 4.31Å; Y155-E159 HydrophobicContact CE1-CB 4.06Å; Y155-E159 HydrophobicContact CE1-CG 4.05Å; Y155-E159 HydrophobicContact CE2-CG 4.02Å; Y155-E159 HydrophobicContact CG-CG 4.49Å; Y155-E159 PolarHBondContact O-N 2.82Å; E159-K257 IonicContact OE1-NZ 2.63Å
160	G	58.1	Low	61	Low	29 Å²	29	82 Å²	82	30%	0.299	49%	0.487	S	S	.	.			trans	-101	20.6	-177.1	0	0	0	0	0	114.5	M156 E162	M156-G160 VanDerWaalsContact O-CA 3.26Å; M156-G160 WeakPolarHBondContact O-CA 3.29Å; M156-G160 PolarHBondContact O-N 2.81Å; G160-E162 PolarHBondContact O-N 3.41Å
161	G	52.9	Low	58.7	Low	65 Å²	65	84.3 Å²	84.3	67%	0.67	51%	0.514	S	S	*	.			trans	-67.9	95.3	171.4	0	0	0	0	0	109.9
162	E	43.8	Very low	56.6	Low	150 Å²	150	91.4 Å²	91.4	70%	0.701	55%	0.552	S	S	*	*			trans	-53.8	139.3	160.7	-72.3	170.4	-172.1	0	0	108.7	G160 G164 R227	G160-E162 PolarHBondContact O-N 3.41Å; E162-G164 PolarHBondContact O-N 2.92Å; E162-R227 IonicContact OE1-NH2 3.55Å; E162-R227 PolarHBondContact OE1-NH2 3.4Å
163	D	36.3	Very low	54.8	Low	171 Å²	171	94.7 Å²	94.7	91%	0.914	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-39.7	121.6	-179.4	-75.7	-51.8	0	0	0	113.4	A165	D163-A165 PolarHBondContact O-N 2.86Å
164	G	34.8	Very low	53.4	Low	79 Å²	79	95 Å²	95	81%	0.814	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.9	31.4	144.2	0	0	0	0	0	119.5	E162 E166	E162-G164 PolarHBondContact O-N 2.92Å; G164-E166 PolarHBondContact O-N 2.9Å
165	A	29.6	Very low	52.6	Low	96 Å²	96	98 Å²	98	79%	0.793	62%	0.623	S	S	*	*			trans	-83.3	94.3	155.7	0	0	0	0	0	108.5	D163 A167	D163-A165 PolarHBondContact O-N 2.86Å; A165-A167 PolarHBondContact O-N 2.91Å
166	E	32.5	Very low	52.1	Low	187 Å²	187	98.7 Å²	98.7	87%	0.874	63%	0.63	S	S	*	*			trans	-46.5	114.5	165.1	-72.2	-179	161.3	0	0	108.2	G164	G164-E166 PolarHBondContact O-N 2.9Å
167	A	33.3	Very low	51.6	Low	76 Å²	76	102.7 Å²	102.7	63%	0.628	66%	0.66	S	S	*	*			trans	-52.3	135.3	162.7	0	0	0	0	0	106.6	A165 E169	A165-A167 PolarHBondContact O-N 2.91Å; A167-E169 PolarHBondContact O-N 3.09Å
168	P	34.3	Very low	51.4	Low	127 Å²	127	100.6 Å²	100.6	83%	0.825	65%	0.646	S	S	*	*			trans	-58.1	111.1	174.8	23.9	-30.3	0	0	0	106.5	G170	P168-G170 PolarHBondContact O-N 3.09Å
169	E	37.9	Very low	51.2	Low	202 Å²	202	92.9 Å²	92.9	94%	0.944	62%	0.618	S	S	*	*			trans	-67.1	73.6	168.9	-71.9	-164	156	0	0	107.5	A167	A167-E169 PolarHBondContact O-N 3.09Å
170	G	35.7	Very low	51.3	Low	45 Å²	45	90.9 Å²	90.9	46%	0.464	62%	0.622	S	S	.	*			trans	-75.9	143.1	163.5	0	0	0	0	0	108.8	P168 D172	P168-G170 PolarHBondContact O-N 3.09Å; G170-D172 PolarHBondContact O-N 3.32Å
171	P	40	Very low	52.3	Low	140 Å²	140	90.4 Å²	90.4	91%	0.909	62%	0.615	S	S	*	*	S	Bend	trans	-73.8	10.2	-172.2	30.2	-34.6	0	0	0	114.9
172	D	44.1	Very low	53.6	Low	149 Å²	149	90.5 Å²	90.5	80%	0.797	60%	0.604	S	S	*	*	S	Bend	trans	-100.7	121.9	174.3	-80.5	-24.8	0	0	0	109.7	G170 G174	G170-D172 PolarHBondContact O-N 3.32Å; D172-G174 PolarHBondContact O-N 3.01Å
173	G	51.4	Low	54.9	Low	76 Å²	76	86.5 Å²	86.5	78%	0.784	60%	0.596	S	S	*	*			trans	-51	93.6	-177.9	0	0	0	0	0	113.4
174	G	56.2	Low	56.6	Low	52 Å²	52	83.7 Å²	83.7	54%	0.536	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-62.8	145.7	-173.2	0	0	0	0	0	113.4	D172	D172-G174 PolarHBondContact O-N 3.01Å
175	A	72.1	Confident	58.7	Low	67 Å²	67	85.5 Å²	85.5	55%	0.554	58%	0.575	S	S	*	*	B	Isolated β-bridge	trans	-62.1	144.6	167.9	0	0	0	0	0	110.7	S177 A181	A175-S177 PolarHBondContact O-N 2.87Å; A175-A181 CarbonylContact C-O 3.59Å; A175-A181 WeakPolarHBondContact CA-O 3.3Å
176	C	78.9	Confident	61.2	Low	29 Å²	29	83.8 Å²	83.8	20%	0.196	56%	0.556	C	S	.	*	P	Polyproline II helix	trans	-61.3	129.2	177	177	0	0	0	0	110.8	G178 G180 A181 C186 C188	C176-G178 PolarHBondContact O-N 3.4Å; C176-G178 VanDerWaalsContact O-N 3.14Å; C176-G180 VanDerWaalsContact O-CA 3.25Å; C176-G180 WeakPolarHBondContact O-CA 3.28Å; C176-G180 PolarHBondContact O-N 3.44Å; C176-A181 WeakPolarHBondContact CB-O 3.33Å; C176-A181 PolarHBondContact N-O 3.33Å; C176-C186 HydrophobicContact CB-CB 4.36Å; C176-C188 PolarHBondContact SG-SG 3.12Å
177	S	73.3	Confident	63.9	Low	110 Å²	110	75.7 Å²	75.7	77%	0.769	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-23.6	179.3	54.2	0	0	0	0	114.5	A175	A175-S177 PolarHBondContact O-N 2.87Å
178	G	78.6	Confident	66.4	Low	4 Å²	4	73.1 Å²	73.1	4%	0.041	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-64.6	176.9	0	0	0	0	0	113.7	S157 C176	S157-G178 WeakPolarHBondContact OG-CA 3.38Å; C176-G178 PolarHBondContact O-N 3.4Å; C176-G178 VanDerWaalsContact O-N 3.14Å
179	C	78.6	Confident	68.9	Low	5 Å²	5	72.3 Å²	72.3	3%	0.034	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-5.1	-172.8	65.8	0	0	0	0	114.8	V154 A181	V154-C179 HydrophobicContact CG2-CB 4.22Å; C179-A181 PolarHBondContact O-N 3.34Å
180	G	74.7	Confident	71.2	Confident	50 Å²	50	64.9 Å²	64.9	52%	0.515	45%	0.448	S	S	.	.			trans	67.5	0.6	179.7	0	0	0	0	0	115.3	C176	C176-G180 VanDerWaalsContact O-CA 3.25Å; C176-G180 WeakPolarHBondContact O-CA 3.28Å; C176-G180 PolarHBondContact O-N 3.44Å
181	A	79.8	Confident	73.7	Confident	19 Å²	19	62.8 Å²	62.8	16%	0.157	43%	0.426	C	S	.	.	S	Bend	trans	-80.9	149.2	176.7	0	0	0	0	0	110.9	A175 C176 C179 H185	A175-A181 CarbonylContact C-O 3.59Å; A175-A181 WeakPolarHBondContact CA-O 3.3Å; C176-A181 WeakPolarHBondContact CB-O 3.33Å; C176-A181 PolarHBondContact N-O 3.33Å; C179-A181 PolarHBondContact O-N 3.34Å; A181-H185 HydrophobicContact CB-CB 4.42Å; A181-H185 WeakPolarHBondContact CB-O 3.29Å
182	P	79.3	Confident	75.9	Confident	67 Å²	67	57.2 Å²	57.2	44%	0.435	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-55.3	144.4	172.8	23.9	-32.9	0	0	0	110.3	P184 H185 C186	P182-P184 VanDerWaalsContact C-N 3.3Å; P182-P184 WeakPolarHBondContact O-CD 3.4Å; P182-H185 HydrophobicContact CG-CB 4.27Å; P182-H185 PolarHBondContact O-N 3.32Å; P182-C186 PolarHBondContact O-N 2.87Å
183	A	71.4	Confident	78	Confident	65 Å²	65	54.8 Å²	54.8	54%	0.537	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-39.3	-43.8	-175.6	0	0	0	0	0	116.2	H185 C186	A183-H185 VanDerWaalsContact C-N 3.29Å; A183-H185 PolarHBondContact O-N 2.85Å; A183-C186 PolarHBondContact O-N 3.31Å
184	P	73.3	Confident	79.9	Confident	113 Å²	113	51.7 Å²	51.7	73%	0.734	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-69.7	-17.2	178	25.3	-35	0	0	0	115.6	P182	P182-P184 VanDerWaalsContact C-N 3.3Å; P182-P184 WeakPolarHBondContact O-CD 3.4Å
185	H	77.8	Confident	81.4	Confident	117 Å²	117	49.3 Å²	49.3	54%	0.542	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-112.1	18.1	-178.3	-60.9	88.7	0	0	0	112.5	A181 P182 A183 W187	A181-H185 HydrophobicContact CB-CB 4.42Å; A181-H185 WeakPolarHBondContact CB-O 3.29Å; P182-H185 HydrophobicContact CG-CB 4.27Å; P182-H185 PolarHBondContact O-N 3.32Å; A183-H185 VanDerWaalsContact C-N 3.29Å; A183-H185 PolarHBondContact O-N 2.85Å; H185-W187 PolarHBondContact O-N 3.34Å
186	C	83.1	Confident	82.2	Confident	60 Å²	60	51.7 Å²	51.7	41%	0.405	31%	0.312	S	S	.	.			trans	-62.8	129.2	176.5	179.2	0	0	0	0	111.3	C176 P182 A183	C176-C186 HydrophobicContact CB-CB 4.36Å; P182-C186 PolarHBondContact O-N 2.87Å; A183-C186 PolarHBondContact O-N 3.31Å
187	W	87.9	Confident	82.7	Confident	17 Å²	17	54.7 Å²	54.7	6%	0.064	32%	0.323	C	S	.	.			trans	-124.6	23.8	179.4	67.3	-78	0	0	0	112.8	E73 R74 A77 H185 L189 E190 A191	E73-W187 HydrophobicContact CG-CZ2 4.22Å; R74-W187 HydrophobicContact CB-CD2 4.15Å; R74-W187 HydrophobicContact CB-CG 4.36Å; R74-W187 HydrophobicContact CB-CZ2 4.49Å; R74-W187 HydrophobicContact CG-CB 4.46Å; R74-W187 HydrophobicContact CG-CD2 3.95Å; R74-W187 HydrophobicContact CG-CE3 4.2Å; R74-W187 HydrophobicContact CG-CG 4.06Å; A77-W187 HydrophobicContact CB-CH2 4.09Å; A77-W187 HydrophobicContact CB-CZ3 4.29Å; H185-W187 PolarHBondContact O-N 3.34Å; W187-L189 PolarHBondContact O-N 2.85Å; W187-E190 HydrophobicContact CB-CB 4.38Å; W187-E190 PolarHBondContact O-N 3.01Å; W187-A191 HydrophobicContact CD2-CB 4.36Å; W187-A191 HydrophobicContact CE3-CB 3.57Å; W187-A191 HydrophobicContact CH2-CB 4.06Å; W187-A191 HydrophobicContact CZ3-CB 3.39Å; W187-A191 WeakPolarHBondContact O-CB 3.47Å; W187-A191 PolarHBondContact O-N 3.09Å
188	C	86.4	Confident	83.5	Confident	21 Å²	21	49.6 Å²	49.6	14%	0.142	29%	0.287	C	S	.	.	H	α-helix	trans	-55.2	-45	-178.6	-71.4	0	0	0	0	114	V154 C176 A191 L192	V154-C188 HydrophobicContact CG1-CB 3.6Å; V154-C188 HydrophobicContact CG2-CB 4.24Å; C176-C188 PolarHBondContact SG-SG 3.12Å; C188-A191 WeakPolarHBondContact O-CB 3.41Å; C188-A191 PolarHBondContact O-N 3.41Å; C188-L192 PolarHBondContact O-N 2.97Å
189	L	86.1	Confident	84	Confident	111 Å²	111	49.6 Å²	49.6	58%	0.581	29%	0.287	S	S	*	.	H	α-helix	trans	-66.9	-40.7	179	-170.6	123.3	0	0	0	111.4	W187 A191 L192 Q193	W187-L189 PolarHBondContact O-N 2.85Å; L189-A191 VanDerWaalsContact C-N 3.35Å; L189-L192 PolarHBondContact O-N 2.87Å; L189-Q193 WeakPolarHBondContact O-CG 3.5Å; L189-Q193 PolarHBondContact O-N 2.81Å; L189-Q193 VanDerWaalsContact O-N 3.12Å
190	E	87.3	Confident	84.5	Confident	46 Å²	46	52 Å²	52	22%	0.215	30%	0.299	C	S	.	.	H	α-helix	trans	-65.2	-38.1	175.6	-172.3	-179.7	-174.4	0	0	111.4	R74 W187 L192 Q193 R194	R74-E190 IonicContact CZ-OE2 3.6Å; R74-E190 IonicContact NE-OE2 3.96Å; R74-E190 PolarHBondContact NE-OE2 3.17Å; R74-E190 IonicContact NH2-OE1 2.71Å; R74-E190 IonicContact NH2-OE2 3.05Å; R74-E190 PolarHBondContact NH2-OE2 3.18Å; W187-E190 HydrophobicContact CB-CB 4.38Å; W187-E190 PolarHBondContact O-N 3.01Å; E190-L192 PolarHBondContact O-N 3.08Å; E190-Q193 PolarHBondContact O-N 2.88Å; E190-R194 HydrophobicContact CG-CG 4.38Å; E190-R194 WeakPolarHBondContact O-CB 3.25Å; E190-R194 VanDerWaalsContact O-CG 3.28Å; E190-R194 WeakPolarHBondContact O-CG 3.47Å; E190-R194 PolarHBondContact O-N 3.31Å; E190-R194 IonicContact OE1-CZ 2.74Å; E190-R194 VanDerWaalsContact OE1-CZ 3.26Å; E190-R194 IonicContact OE1-NE 2.91Å; E190-R194 PolarHBondContact OE1-NE 3.26Å; E190-R194 IonicContact OE1-NH2 3.64Å; E190-R194 PolarHBondContact OE1-NH2 3.39Å
191	A	87.3	Confident	85.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.4	-44.9	176.8	0	0	0	0	0	112.1	T151 W187 C188 L189 R194 L195	T151-A191 HydrophobicContact CG2-CB 4.34Å; W187-A191 HydrophobicContact CD2-CB 4.36Å; W187-A191 HydrophobicContact CE3-CB 3.57Å; W187-A191 HydrophobicContact CH2-CB 4.06Å; W187-A191 HydrophobicContact CZ3-CB 3.39Å; W187-A191 WeakPolarHBondContact O-CB 3.47Å; W187-A191 PolarHBondContact O-N 3.09Å; C188-A191 WeakPolarHBondContact O-CB 3.41Å; C188-A191 PolarHBondContact O-N 3.41Å; L189-A191 VanDerWaalsContact C-N 3.35Å; A191-R194 PolarHBondContact O-N 2.97Å; A191-L195 PolarHBondContact O-N 2.73Å
192	L	87.4	Confident	85.5	Confident	23 Å²	23	49.3 Å²	49.3	12%	0.12	27%	0.27	C	S	.	.	H	α-helix	trans	-69.8	-36.2	177.8	-66.5	175.6	0	0	0	112.5	V154 C188 L189 E190 L195 Q196	V154-L192 HydrophobicContact CG1-CD1 4.12Å; V154-L192 HydrophobicContact CG1-CD2 4.3Å; V154-L192 HydrophobicContact CG1-CG 3.95Å; C188-L192 PolarHBondContact O-N 2.97Å; L189-L192 PolarHBondContact O-N 2.87Å; E190-L192 PolarHBondContact O-N 3.08Å; L192-L195 WeakPolarHBondContact O-CB 3.46Å; L192-L195 PolarHBondContact O-N 2.77Å; L192-Q196 PolarHBondContact O-N 3.38Å
193	Q	88.4	Confident	85.9	Confident	98 Å²	98	47.3 Å²	47.3	46%	0.458	26%	0.258	S	S	.	.	H	α-helix	trans	-64.5	-44.4	173.1	-73.6	175.3	-13.3	0	0	111.4	L189 E190 L195 Q196 Q197	L189-Q193 WeakPolarHBondContact O-CG 3.5Å; L189-Q193 PolarHBondContact O-N 2.81Å; L189-Q193 VanDerWaalsContact O-N 3.12Å; E190-Q193 PolarHBondContact O-N 2.88Å; Q193-L195 VanDerWaalsContact C-N 3.27Å; Q193-L195 PolarHBondContact O-N 3.24Å; Q193-Q196 PolarHBondContact O-N 3.08Å; Q193-Q197 WeakPolarHBondContact O-CG 3.26Å; Q193-Q197 PolarHBondContact O-N 3.46Å
194	R	89.3	Confident	86.6	Confident	11 Å²	11	49.5 Å²	49.5	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-64.6	-32.6	175.6	-71.1	177.8	-178.6	-164.7	5.3	112.1	R74 R78 L81 F147 E190 A191 Q197 L198	R74-R194 PolarHBondContact O-NH1 2.97Å; R78-R194 VanDerWaalsContact N-NH1 3.11Å; L81-R194 HydrophobicContact CD2-CB 4.37Å; L81-R194 HydrophobicContact CD2-CG 4.12Å; F147-R194 HydrophobicContact CE2-CB 4.24Å; F147-R194 HydrophobicContact CZ-CB 4.21Å; E190-R194 HydrophobicContact CG-CG 4.38Å; E190-R194 WeakPolarHBondContact O-CB 3.25Å; E190-R194 VanDerWaalsContact O-CG 3.28Å; E190-R194 WeakPolarHBondContact O-CG 3.47Å; E190-R194 PolarHBondContact O-N 3.31Å; E190-R194 IonicContact OE1-CZ 2.74Å; E190-R194 VanDerWaalsContact OE1-CZ 3.26Å; E190-R194 IonicContact OE1-NE 2.91Å; E190-R194 PolarHBondContact OE1-NE 3.26Å; E190-R194 IonicContact OE1-NH2 3.64Å; E190-R194 PolarHBondContact OE1-NH2 3.39Å; A191-R194 PolarHBondContact O-N 2.97Å; R194-Q197 PolarHBondContact O-N 3.36Å; R194-L198 VanDerWaalsContact O-CB 3.31Å; R194-L198 WeakPolarHBondContact O-CB 3.49Å; R194-L198 PolarHBondContact O-N 3.05Å
195	L	89.6	Confident	87.1	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-59.9	-48.4	173.1	-177	64.8	0	0	0	111.1	F147 Y148 T151 A191 L192 Q193 Q197 L198 S199 V258	F147-L195 HydrophobicContact CE1-CD1 3.82Å; F147-L195 HydrophobicContact CZ-CB 4.35Å; F147-L195 HydrophobicContact CZ-CD1 4.43Å; Y148-L195 HydrophobicContact CD1-CD1 3.82Å; Y148-L195 HydrophobicContact CE1-CD1 3.56Å; T151-L195 HydrophobicContact CG2-CB 4.16Å; T151-L195 HydrophobicContact CG2-CD1 4.31Å; A191-L195 PolarHBondContact O-N 2.73Å; L192-L195 WeakPolarHBondContact O-CB 3.46Å; L192-L195 PolarHBondContact O-N 2.77Å; Q193-L195 VanDerWaalsContact C-N 3.27Å; Q193-L195 PolarHBondContact O-N 3.24Å; L195-Q197 VanDerWaalsContact C-N 3.35Å; L195-L198 PolarHBondContact O-N 2.65Å; L195-S199 PolarHBondContact O-N 3.19Å; L195-S199 PolarHBondContact O-OG 3.21Å; L195-V258 HydrophobicContact CD1-CG2 4.3Å; L195-V258 HydrophobicContact CD2-CG2 4.36Å
196	Q	88.3	Confident	87.5	Confident	117 Å²	117	42.1 Å²	42.1	55%	0.547	21%	0.208	S	C	.	.	H	α-helix	trans	-64.1	-39.4	177.9	-69.2	175.3	-19.4	0	0	112.1	L192 Q193 S199 L200	L192-Q196 PolarHBondContact O-N 3.38Å; Q193-Q196 PolarHBondContact O-N 3.08Å; Q196-S199 WeakPolarHBondContact CA-OG 3.18Å; Q196-S199 PolarHBondContact O-OG 2.91Å; Q196-L200 VanDerWaalsContact O-CB 3.31Å; Q196-L200 WeakPolarHBondContact O-CB 3.49Å; Q196-L200 PolarHBondContact O-N 3.38Å
197	Q	89	Confident	87.6	Confident	91 Å²	91	39.3 Å²	39.3	43%	0.425	19%	0.189	S	C	.	.	H	α-helix	trans	-65.8	-43.3	175.8	-70.3	172.3	-10	0	0	111.4	L81 Q193 R194 L195 L200 V201	L81-Q197 HydrophobicContact CD1-CB 3.98Å; L81-Q197 HydrophobicContact CD2-CB 4.13Å; L81-Q197 VanDerWaalsContact CD2-OE1 3.27Å; Q193-Q197 WeakPolarHBondContact O-CG 3.26Å; Q193-Q197 PolarHBondContact O-N 3.46Å; R194-Q197 PolarHBondContact O-N 3.36Å; L195-Q197 VanDerWaalsContact C-N 3.35Å; Q197-L200 PolarHBondContact O-N 3.1Å; Q197-V201 VanDerWaalsContact O-CG2 3.23Å; Q197-V201 WeakPolarHBondContact O-CG2 3.26Å; Q197-V201 PolarHBondContact O-N 3.41Å
198	L	89.9	Confident	87.5	Confident	3 Å²	3	39 Å²	39	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-66.3	-44.1	178.4	-173.5	66.8	0	0	0	111.2	L80 L81 F84 F147 R194 L195 L200 V201 L202	L80-L198 HydrophobicContact CD2-CD2 4.31Å; L81-L198 HydrophobicContact CD1-CB 3.96Å; L81-L198 HydrophobicContact CD1-CD1 4.09Å; F84-L198 HydrophobicContact CB-CD1 4.23Å; F84-L198 HydrophobicContact CD2-CD1 3.86Å; F84-L198 HydrophobicContact CG-CD1 4.26Å; F147-L198 HydrophobicContact CD1-CD2 3.65Å; F147-L198 HydrophobicContact CE1-CB 4.36Å; F147-L198 HydrophobicContact CE1-CD2 3.41Å; F147-L198 VanDerWaalsContact CE1-CD2 3.41Å; F147-L198 HydrophobicContact CZ-CD2 4.24Å; R194-L198 VanDerWaalsContact O-CB 3.31Å; R194-L198 WeakPolarHBondContact O-CB 3.49Å; R194-L198 PolarHBondContact O-N 3.05Å; L195-L198 PolarHBondContact O-N 2.65Å; L198-L200 VanDerWaalsContact C-N 3.33Å; L198-L200 PolarHBondContact O-N 2.91Å; L198-V201 PolarHBondContact O-N 3.42Å; L198-L202 HydrophobicContact CD1-CD1 4.21Å; L198-L202 HydrophobicContact CD1-CG 4.23Å; L198-L202 HydrophobicContact CD2-CD1 4.36Å; L198-L202 HydrophobicContact CG-CD1 3.85Å; L198-L202 HydrophobicContact CG-CG 4.26Å; L198-L202 WeakPolarHBondContact O-CB 3.44Å; L198-L202 VanDerWaalsContact O-CG 3.26Å; L198-L202 WeakPolarHBondContact O-CG 3.24Å; L198-L202 PolarHBondContact O-N 3.46Å
199	S	89.4	Confident	87.4	Confident	5 Å²	5	43.5 Å²	43.5	4%	0.035	21%	0.208	C	C	.	.	H	α-helix	trans	-62.3	-41.1	177.9	61.3	0	0	0	0	111.7	L195 Q196 L202 S203 V258	L195-S199 PolarHBondContact O-N 3.19Å; L195-S199 PolarHBondContact O-OG 3.21Å; Q196-S199 WeakPolarHBondContact CA-OG 3.18Å; Q196-S199 PolarHBondContact O-OG 2.91Å; S199-L202 PolarHBondContact O-N 2.94Å; S199-S203 VanDerWaalsContact O-CB 3.28Å; S199-S203 WeakPolarHBondContact O-CB 3.11Å; S199-S203 PolarHBondContact O-N 2.95Å; S199-S203 PolarHBondContact O-OG 3.31Å; S199-V258 VanDerWaalsContact CB-O 3.23Å; S199-V258 WeakPolarHBondContact CB-O 3.5Å
200	L	88.4	Confident	87.3	Confident	56 Å²	56	46.1 Å²	46.1	29%	0.293	21%	0.21	S	C	.	.	H	α-helix	trans	-60	-51.5	174.4	177.8	62.6	0	0	0	111.7	Q196 Q197 L198 L202 S203 R204 E262	Q196-L200 VanDerWaalsContact O-CB 3.31Å; Q196-L200 WeakPolarHBondContact O-CB 3.49Å; Q196-L200 PolarHBondContact O-N 3.38Å; Q197-L200 PolarHBondContact O-N 3.1Å; L198-L200 VanDerWaalsContact C-N 3.33Å; L198-L200 PolarHBondContact O-N 2.91Å; L200-L202 PolarHBondContact O-N 3.41Å; L200-S203 PolarHBondContact O-N 3.23Å; L200-S203 PolarHBondContact O-OG 3.37Å; L200-R204 PolarHBondContact O-N 3.44Å; L200-E262 HydrophobicContact CD1-CG 3.45Å; L200-E262 VanDerWaalsContact CD1-CG 3.45Å; L200-E262 WeakPolarHBondContact CD1-OE1 3.44Å
201	V	88.8	Confident	87.3	Confident	11 Å²	11	44.7 Å²	44.7	7%	0.067	20%	0.204	C	C	.	.	H	α-helix	trans	-60.5	-46.1	180	171.5	0	0	0	0	110.9	F84 Q85 L88 Q197 L198 S203 R204 L205	F84-V201 HydrophobicContact CB-CG1 3.85Å; F84-V201 WeakPolarHBondContact O-CG1 3.42Å; Q85-V201 HydrophobicContact CG-CG2 3.92Å; L88-V201 HydrophobicContact CB-CG1 4.17Å; L88-V201 HydrophobicContact CD2-CG1 4.17Å; L88-V201 HydrophobicContact CD2-CG2 4.27Å; Q197-V201 VanDerWaalsContact O-CG2 3.23Å; Q197-V201 WeakPolarHBondContact O-CG2 3.26Å; Q197-V201 PolarHBondContact O-N 3.41Å; L198-V201 PolarHBondContact O-N 3.42Å; V201-S203 VanDerWaalsContact C-N 3.34Å; V201-S203 PolarHBondContact O-N 3.23Å; V201-R204 PolarHBondContact O-N 3.35Å; V201-L205 HydrophobicContact CG1-CD1 4.19Å; V201-L205 WeakPolarHBondContact O-CG 3.37Å; V201-L205 PolarHBondContact O-N 2.76Å; V201-L205 VanDerWaalsContact O-N 3.07Å
202	L	88.2	Confident	87.2	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-66.9	-33.2	178.1	-70.7	177	0	0	0	113	F84 L198 S199 L200 Q206 L207 L208 V211	F84-L202 HydrophobicContact CD1-CD2 3.59Å; F84-L202 HydrophobicContact CD2-CD2 4.47Å; F84-L202 HydrophobicContact CE1-CD2 3.51Å; F84-L202 HydrophobicContact CE2-CD2 4.39Å; F84-L202 HydrophobicContact CG-CD2 4.09Å; F84-L202 HydrophobicContact CZ-CD2 3.94Å; L198-L202 HydrophobicContact CD1-CD1 4.21Å; L198-L202 HydrophobicContact CD1-CG 4.23Å; L198-L202 HydrophobicContact CD2-CD1 4.36Å; L198-L202 HydrophobicContact CG-CD1 3.85Å; L198-L202 HydrophobicContact CG-CG 4.26Å; L198-L202 WeakPolarHBondContact O-CB 3.44Å; L198-L202 VanDerWaalsContact O-CG 3.26Å; L198-L202 WeakPolarHBondContact O-CG 3.24Å; L198-L202 PolarHBondContact O-N 3.46Å; S199-L202 PolarHBondContact O-N 2.94Å; L200-L202 PolarHBondContact O-N 3.41Å; L202-Q206 PolarHBondContact O-N 3.06Å; L202-L207 HydrophobicContact CD2-CB 4.35Å; L202-L207 PolarHBondContact O-N 3.31Å; L202-L208 HydrophobicContact CB-CB 3.93Å; L202-L208 HydrophobicContact CB-CD1 3.87Å; L202-L208 HydrophobicContact CB-CG 4.5Å; L202-L208 HydrophobicContact CD1-CD1 3.99Å; L202-L208 PolarHBondContact O-N 2.96Å; L202-V211 HydrophobicContact CD2-CB 4.47Å; L202-V211 HydrophobicContact CD2-CG2 4.46Å
203	S	86.8	Confident	87.1	Confident	25 Å²	25	45 Å²	45	18%	0.175	21%	0.211	C	C	.	.	H	α-helix	trans	-68.3	-40.8	174.8	73.8	0	0	0	0	111.9	S199 L200 V201 L205 Q206	S199-S203 VanDerWaalsContact O-CB 3.28Å; S199-S203 WeakPolarHBondContact O-CB 3.11Å; S199-S203 PolarHBondContact O-N 2.95Å; S199-S203 PolarHBondContact O-OG 3.31Å; L200-S203 PolarHBondContact O-N 3.23Å; L200-S203 PolarHBondContact O-OG 3.37Å; V201-S203 VanDerWaalsContact C-N 3.34Å; V201-S203 PolarHBondContact O-N 3.23Å; S203-L205 VanDerWaalsContact C-N 3.3Å; S203-L205 PolarHBondContact O-N 2.87Å; S203-Q206 PolarHBondContact O-N 2.8Å
204	R	85.4	Confident	87.1	Confident	111 Å²	111	45.9 Å²	45.9	42%	0.419	22%	0.215	S	C	.	.	H	α-helix	trans	-64.9	-35.9	176.1	-73.9	-177.9	67.4	179.3	3.7	111.9	L88 E92 L200 V201 Q206	L88-R204 HydrophobicContact CD1-CB 4.01Å; L88-R204 HydrophobicContact CD2-CB 4.4Å; E92-R204 IonicContact OE1-CZ 3.98Å; E92-R204 IonicContact OE1-NH2 3.22Å; E92-R204 PolarHBondContact OE1-NH2 3.47Å; E92-R204 IonicContact OE2-CZ 3.79Å; E92-R204 IonicContact OE2-NE 3.93Å; E92-R204 IonicContact OE2-NH2 3.7Å; E92-R204 PolarHBondContact OE2-NH2 3.16Å; L200-R204 PolarHBondContact O-N 3.44Å; V201-R204 PolarHBondContact O-N 3.35Å; R204-Q206 PolarHBondContact O-N 3Å
205	L	84.6	Confident	87.1	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-5.9	174	-68.4	175.6	0	0	0	113.9	F84 L87 L88 L91 F125 V201 S203 L207	F84-L205 HydrophobicContact CD1-CD1 4.26Å; L87-L205 HydrophobicContact CD2-CD1 4Å; L87-L205 HydrophobicContact CG-CD1 4.3Å; L88-L205 HydrophobicContact CB-CD1 4.41Å; L88-L205 HydrophobicContact CB-CD2 4.25Å; L88-L205 HydrophobicContact CB-CG 4.38Å; L88-L205 HydrophobicContact CD1-CD2 3.65Å; L88-L205 HydrophobicContact CD1-CG 3.93Å; L91-L205 HydrophobicContact CD1-CD2 3.96Å; F125-L205 VanDerWaalsContact CD1-O 3.27Å; F125-L205 WeakPolarHBondContact CD1-O 3.47Å; F125-L205 VanDerWaalsContact CE1-O 3.29Å; F125-L205 WeakPolarHBondContact CE1-O 3.32Å; V201-L205 HydrophobicContact CG1-CD1 4.19Å; V201-L205 WeakPolarHBondContact O-CG 3.37Å; V201-L205 PolarHBondContact O-N 2.76Å; V201-L205 VanDerWaalsContact O-N 3.07Å; S203-L205 VanDerWaalsContact C-N 3.3Å; S203-L205 PolarHBondContact O-N 2.87Å; L205-L207 HydrophobicContact CB-CB 4.31Å; L205-L207 HydrophobicContact CB-CD1 4.11Å; L205-L207 HydrophobicContact CB-CG 3.94Å; L205-L207 HydrophobicContact CD1-CD1 4.42Å; L205-L207 WeakPolarHBondContact O-CG 3.48Å; L205-L207 PolarHBondContact O-N 2.56Å
206	Q	85.1	Confident	87.1	Confident	73 Å²	73	45.7 Å²	45.7	34%	0.341	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	35.8	-169.4	-52.9	-172.5	-6.4	0	0	113.8	F125 R129 L202 S203 R204	F125-Q206 HydrophobicContact CD1-CB 4.08Å; F125-Q206 HydrophobicContact CD1-CG 4.2Å; F125-Q206 VanDerWaalsContact CD2-CD 3.42Å; F125-Q206 HydrophobicContact CD2-CG 4.17Å; F125-Q206 VanDerWaalsContact CD2-OE1 3.25Å; F125-Q206 HydrophobicContact CE1-CB 4.23Å; F125-Q206 HydrophobicContact CE1-CG 4.01Å; F125-Q206 VanDerWaalsContact CE2-CD 3.49Å; F125-Q206 HydrophobicContact CE2-CG 3.98Å; F125-Q206 HydrophobicContact CG-CB 4.32Å; F125-Q206 HydrophobicContact CG-CG 4.29Å; F125-Q206 HydrophobicContact CZ-CG 3.89Å; R129-Q206 PolarHBondContact NE-O 3.44Å; R129-Q206 PolarHBondContact NH2-O 2.79Å; L202-Q206 PolarHBondContact O-N 3.06Å; S203-Q206 PolarHBondContact O-N 2.8Å; R204-Q206 PolarHBondContact O-N 3Å
207	L	86.3	Confident	87.2	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	20%	0.2	C	C	.	.			trans	-111.6	-5	178.7	-62.7	-176.9	0	0	0	113	R129 L132 L133 L202 L205 E209 W210 V211	R129-L207 HydrophobicContact CG-CD2 3.54Å; L132-L207 HydrophobicContact CD1-CD1 4.28Å; L133-L207 HydrophobicContact CD1-CD2 3.87Å; L202-L207 HydrophobicContact CD2-CB 4.35Å; L202-L207 PolarHBondContact O-N 3.31Å; L205-L207 HydrophobicContact CB-CB 4.31Å; L205-L207 HydrophobicContact CB-CD1 4.11Å; L205-L207 HydrophobicContact CB-CG 3.94Å; L205-L207 HydrophobicContact CD1-CD1 4.42Å; L205-L207 WeakPolarHBondContact O-CG 3.48Å; L205-L207 PolarHBondContact O-N 2.56Å; L207-E209 PolarHBondContact O-N 3.14Å; L207-W210 PolarHBondContact O-N 3.16Å; L207-W210 VanDerWaalsContact O-N 3.12Å; L207-V211 HydrophobicContact CB-CG2 4.14Å; L207-V211 WeakPolarHBondContact O-CG2 3.45Å; L207-V211 PolarHBondContact O-N 2.57Å
208	L	86.3	Confident	87.2	Confident	12 Å²	12	39.7 Å²	39.7	6%	0.063	20%	0.198	C	C	.	.	H	α-helix	trans	-52.5	-55.9	-174.6	-177.4	59.9	0	0	0	112.7	L202 W210 V211 S212 F259	L202-L208 HydrophobicContact CB-CB 3.93Å; L202-L208 HydrophobicContact CB-CD1 3.87Å; L202-L208 HydrophobicContact CB-CG 4.5Å; L202-L208 HydrophobicContact CD1-CD1 3.99Å; L202-L208 PolarHBondContact O-N 2.96Å; L208-W210 VanDerWaalsContact C-N 3.27Å; L208-W210 PolarHBondContact O-N 3.01Å; L208-V211 PolarHBondContact O-N 2.79Å; L208-S212 VanDerWaalsContact O-CB 3.26Å; L208-S212 WeakPolarHBondContact O-CB 3.47Å; L208-S212 PolarHBondContact O-N 3.48Å; L208-S212 PolarHBondContact O-OG 2.93Å; L208-F259 HydrophobicContact CD2-CD1 4.08Å; L208-F259 HydrophobicContact CG-CD1 4.08Å; L208-F259 HydrophobicContact CG-CE1 4.35Å
209	E	83.6	Confident	87.2	Confident	115 Å²	115	40 Å²	40	54%	0.537	20%	0.2	S	C	.	.	H	α-helix	trans	-60.5	-35.7	179.9	-64.4	-177.7	169.1	0	0	112.6	L207 A213	L207-E209 PolarHBondContact O-N 3.14Å; E209-A213 WeakPolarHBondContact O-CB 3.31Å; E209-A213 PolarHBondContact O-N 3.06Å
210	W	84.3	Confident	87.2	Confident	166 Å²	166	39.9 Å²	39.9	63%	0.629	20%	0.199	S	C	*	.	H	α-helix	trans	-76.7	-39.5	-175.7	-64.3	90.3	0	0	0	113.1	L133 L207 L208	L133-W210 HydrophobicContact CD1-CB 3.66Å; L133-W210 HydrophobicContact CD1-CG 4.43Å; L207-W210 PolarHBondContact O-N 3.16Å; L207-W210 VanDerWaalsContact O-N 3.12Å; L208-W210 VanDerWaalsContact C-N 3.27Å; L208-W210 PolarHBondContact O-N 3.01Å
211	V	86.6	Confident	87.4	Confident	15 Å²	15	39.3 Å²	39.3	9%	0.091	19%	0.194	C	C	.	.	H	α-helix	trans	-84.9	-36	-177.3	177.9	0	0	0	0	111.1	F84 L133 V144 L202 L207 L208	F84-V211 HydrophobicContact CZ-CG1 4.07Å; F84-V211 HydrophobicContact CZ-CG2 4.41Å; L133-V211 HydrophobicContact CD1-CG2 4.02Å; L133-V211 HydrophobicContact CD2-CG2 4.09Å; V144-V211 HydrophobicContact CG1-CG1 4.25Å; V144-V211 HydrophobicContact CG2-CG1 3.86Å; L202-V211 HydrophobicContact CD2-CB 4.47Å; L202-V211 HydrophobicContact CD2-CG2 4.46Å; L207-V211 HydrophobicContact CB-CG2 4.14Å; L207-V211 WeakPolarHBondContact O-CG2 3.45Å; L207-V211 PolarHBondContact O-N 2.57Å; L208-V211 PolarHBondContact O-N 2.79Å
212	S	86.6	Confident	87.5	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-89.9	-30.5	-174.3	78.6	0	0	0	0	114	Y148 L208 E214 A215 V216 F259	Y148-S212 WeakPolarHBondContact OH-CB 3.24Å; L208-S212 VanDerWaalsContact O-CB 3.26Å; L208-S212 WeakPolarHBondContact O-CB 3.47Å; L208-S212 PolarHBondContact O-N 3.48Å; L208-S212 PolarHBondContact O-OG 2.93Å; S212-E214 PolarHBondContact O-N 3.48Å; S212-A215 PolarHBondContact O-N 3.01Å; S212-V216 VanDerWaalsContact O-CB 3.26Å; S212-V216 WeakPolarHBondContact O-CB 3.45Å; S212-V216 WeakPolarHBondContact O-CG2 3.15Å; S212-V216 PolarHBondContact O-N 3.27Å; S212-F259 VanDerWaalsContact OG-CE1 3.3Å; S212-F259 WeakPolarHBondContact OG-CE1 3.34Å; S212-F259 WeakPolarHBondContact OG-CZ 3.3Å
213	A	85.4	Confident	87.4	Confident	31 Å²	31	47.7 Å²	47.7	26%	0.256	23%	0.227	S	C	.	.	H	α-helix	trans	-60.1	-43.3	-169.1	0	0	0	0	0	113.6	E209 T217	E209-A213 WeakPolarHBondContact O-CB 3.31Å; E209-A213 PolarHBondContact O-N 3.06Å; A213-T217 VanDerWaalsContact O-CB 3.22Å; A213-T217 WeakPolarHBondContact O-CB 3.38Å; A213-T217 PolarHBondContact O-N 2.85Å; A213-T217 PolarHBondContact O-OG1 3.39Å
214	E	87.3	Confident	87.5	Confident	116 Å²	116	46.6 Å²	46.6	54%	0.542	22%	0.219	S	C	.	.	H	α-helix	trans	-65.1	-48.5	-179.3	-173.7	178.4	-169.9	0	0	111.6	Q141 S212 T217 A218	Q141-E214 PolarHBondContact NE2-OE1 2.87Å; Q141-E214 PolarHBondContact NE2-OE2 3.42Å; S212-E214 PolarHBondContact O-N 3.48Å; E214-T217 PolarHBondContact O-N 2.82Å; E214-A218 WeakPolarHBondContact O-CB 3.36Å; E214-A218 PolarHBondContact O-N 3.15Å
215	A	88.6	Confident	87.8	Confident	9 Å²	9	45.9 Å²	45.9	7%	0.074	22%	0.221	C	C	.	.	H	α-helix	trans	-63.1	-46.4	178.5	0	0	0	0	0	111.9	V144 L145 Y148 S212 A218 I219	V144-A215 HydrophobicContact CG1-CB 3.8Å; L145-A215 HydrophobicContact CB-CB 4.34Å; L145-A215 HydrophobicContact CD1-CB 4.22Å; Y148-A215 HydrophobicContact CD2-CB 4.02Å; S212-A215 PolarHBondContact O-N 3.01Å; A215-A218 PolarHBondContact O-N 3.43Å; A215-I219 WeakPolarHBondContact O-CB 3.19Å; A215-I219 WeakPolarHBondContact O-CD1 3.49Å; A215-I219 WeakPolarHBondContact O-CG1 3.34Å; A215-I219 PolarHBondContact O-N 3.46Å
216	V	89.9	Confident	88	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.1	-46.6	176.5	168	0	0	0	0	110.6	S212 A218 I219 L220 W254 L255 V258 W290	S212-V216 VanDerWaalsContact O-CB 3.26Å; S212-V216 WeakPolarHBondContact O-CB 3.45Å; S212-V216 WeakPolarHBondContact O-CG2 3.15Å; S212-V216 PolarHBondContact O-N 3.27Å; V216-A218 PolarHBondContact O-N 3.04Å; V216-I219 PolarHBondContact O-N 3.43Å; V216-L220 HydrophobicContact CG1-CD1 3.78Å; V216-L220 HydrophobicContact CG1-CG 4.23Å; V216-L220 WeakPolarHBondContact O-CB 3.44Å; V216-L220 WeakPolarHBondContact O-CG 3.28Å; V216-L220 PolarHBondContact O-N 2.62Å; V216-W254 HydrophobicContact CG1-CZ3 4.13Å; V216-W254 HydrophobicContact CG2-CH2 4.02Å; V216-W254 HydrophobicContact CG2-CZ3 4.26Å; V216-L255 HydrophobicContact CG1-CD2 3.28Å; V216-V258 HydrophobicContact CG2-CG1 4.31Å; V216-W290 HydrophobicContact CG1-CH2 3.95Å; V216-W290 HydrophobicContact CG1-CZ2 4.34Å; V216-W290 HydrophobicContact CG1-CZ3 4.26Å
217	T	90	Very high	88.2	Confident	36 Å²	36	48.7 Å²	48.7	22%	0.221	23%	0.232	C	C	.	.	H	α-helix	trans	-59.8	-46.8	177.9	-57.9	0	0	0	0	111.3	A213 E214 I219 L220 H221 W290	A213-T217 VanDerWaalsContact O-CB 3.22Å; A213-T217 WeakPolarHBondContact O-CB 3.38Å; A213-T217 PolarHBondContact O-N 2.85Å; A213-T217 PolarHBondContact O-OG1 3.39Å; E214-T217 PolarHBondContact O-N 2.82Å; T217-I219 VanDerWaalsContact C-N 3.34Å; T217-I219 PolarHBondContact O-N 2.76Å; T217-L220 PolarHBondContact O-N 2.85Å; T217-H221 WeakPolarHBondContact CG2-CE1 3.27Å; T217-H221 WeakPolarHBondContact O-CB 3.45Å; T217-H221 PolarHBondContact O-CD2 3.48Å; T217-H221 PolarHBondContact O-N 2.62Å; T217-W290 WeakPolarHBondContact OG1-CH2 3.48Å
218	A	90.3	Very high	88.3	Confident	47 Å²	47	49 Å²	49	39%	0.388	23%	0.233	S	C	.	.	H	α-helix	trans	-62.1	-40.8	178.8	0	0	0	0	0	112.3	L145 E214 A215 V216 R222	L145-A218 HydrophobicContact CD1-CB 4.1Å; E214-A218 WeakPolarHBondContact O-CB 3.36Å; E214-A218 PolarHBondContact O-N 3.15Å; A215-A218 PolarHBondContact O-N 3.43Å; V216-A218 PolarHBondContact O-N 3.04Å; A218-R222 VanDerWaalsContact O-CB 3.31Å; A218-R222 WeakPolarHBondContact O-CB 3.42Å; A218-R222 PolarHBondContact O-N 2.98Å
219	I	89.4	Confident	88.4	Confident	10 Å²	10	52.8 Å²	52.8	5%	0.051	25%	0.25	C	S	.	.	H	α-helix	trans	-63.3	-53.7	175.9	-70	161.4	0	0	0	110.1	L145 S149 F152 A215 V216 T217 H221 R222 L223	L145-I219 HydrophobicContact CD1-CD1 4.05Å; L145-I219 HydrophobicContact CD1-CG1 3.69Å; S149-I219 VanDerWaalsContact N-CD1 3.35Å; S149-I219 WeakPolarHBondContact OG-CG1 3.36Å; F152-I219 HydrophobicContact CB-CG2 4.45Å; F152-I219 HydrophobicContact CD1-CG2 4.45Å; F152-I219 HydrophobicContact CG-CG2 4.25Å; A215-I219 WeakPolarHBondContact O-CB 3.19Å; A215-I219 WeakPolarHBondContact O-CD1 3.49Å; A215-I219 WeakPolarHBondContact O-CG1 3.34Å; A215-I219 PolarHBondContact O-N 3.46Å; V216-I219 PolarHBondContact O-N 3.43Å; T217-I219 VanDerWaalsContact C-N 3.34Å; T217-I219 PolarHBondContact O-N 2.76Å; I219-H221 VanDerWaalsContact C-N 3.29Å; I219-H221 PolarHBondContact O-N 3.03Å; I219-R222 PolarHBondContact O-N 2.71Å; I219-L223 HydrophobicContact CG2-CD1 3.37Å; I219-L223 HydrophobicContact CG2-CG 4.21Å; I219-L223 WeakPolarHBondContact O-CB 3.44Å; I219-L223 VanDerWaalsContact O-CD1 3.29Å; I219-L223 WeakPolarHBondContact O-CD1 3.44Å; I219-L223 WeakPolarHBondContact O-CG 3.39Å; I219-L223 PolarHBondContact O-N 3.19Å
220	L	89.7	Confident	88.6	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-55.5	-46.6	179.3	-69.5	172	0	0	0	111.4	V216 T217 L223 I224 V251 L255 W290 M294	V216-L220 HydrophobicContact CG1-CD1 3.78Å; V216-L220 HydrophobicContact CG1-CG 4.23Å; V216-L220 WeakPolarHBondContact O-CB 3.44Å; V216-L220 WeakPolarHBondContact O-CG 3.28Å; V216-L220 PolarHBondContact O-N 2.62Å; T217-L220 PolarHBondContact O-N 2.85Å; L220-L223 PolarHBondContact O-N 2.96Å; L220-I224 WeakPolarHBondContact O-CB 3.46Å; L220-I224 WeakPolarHBondContact O-CD1 3.49Å; L220-I224 VanDerWaalsContact O-CG1 3.25Å; L220-I224 WeakPolarHBondContact O-CG1 3.43Å; L220-I224 PolarHBondContact O-N 3.43Å; L220-V251 HydrophobicContact CD2-CG1 3.18Å; L220-L255 HydrophobicContact CD1-CD1 4.05Å; L220-L255 HydrophobicContact CD1-CD2 4.18Å; L220-L255 HydrophobicContact CD2-CD1 4.34Å; L220-W290 HydrophobicContact CD1-CE3 3.75Å; L220-W290 HydrophobicContact CD1-CH2 4.47Å; L220-W290 HydrophobicContact CD1-CZ3 3.53Å; L220-M294 HydrophobicContact CD1-CG 4.22Å; L220-M294 HydrophobicContact CD1-SD 4.21Å; L220-M294 HydrophobicContact CD2-CE 4.22Å; L220-M294 HydrophobicContact CD2-SD 4.17Å
221	H	91.6	Very high	88.7	Confident	44 Å²	44	50.2 Å²	50.2	20%	0.204	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-52.4	-179	-72.9	-178.4	0	0	0	111.8	T217 I219 L223 I224 E225 H293 F297	T217-H221 WeakPolarHBondContact CG2-CE1 3.27Å; T217-H221 WeakPolarHBondContact O-CB 3.45Å; T217-H221 PolarHBondContact O-CD2 3.48Å; T217-H221 PolarHBondContact O-N 2.62Å; I219-H221 VanDerWaalsContact C-N 3.29Å; I219-H221 PolarHBondContact O-N 3.03Å; H221-L223 VanDerWaalsContact C-N 3.28Å; H221-L223 PolarHBondContact O-N 3.03Å; H221-I224 PolarHBondContact O-N 2.9Å; H221-E225 WeakPolarHBondContact O-CG 3.43Å; H221-E225 PolarHBondContact O-N 3.5Å; H221-H293 AromaticContact NE2-CE1 3.36Å; H221-H293 PolarHBondContact NE2-CE1 3.09Å; H221-H293 AromaticContact NE2-NE2 3.94Å; H221-F297 HydrophobicContact CB-CE1 3.67Å; H221-F297 HydrophobicContact CB-CE2 4.19Å; H221-F297 HydrophobicContact CB-CZ 3.37Å; H221-F297 AromaticContact CD2-CD1 3.52Å; H221-F297 AromaticContact CD2-CD2 3.56Å; H221-F297 AromaticContact CD2-CE1 3.32Å; H221-F297 WeakPolarHBondContact CD2-CE1 3.41Å; H221-F297 AromaticContact CD2-CE2 3.37Å; H221-F297 WeakPolarHBondContact CD2-CE2 3.3Å; H221-F297 AromaticContact CD2-CG 3.63Å; H221-F297 AromaticContact CD2-CZ 3.24Å; H221-F297 WeakPolarHBondContact CD2-CZ 3.29Å; H221-F297 AromaticContact CE1-CD2 3.85Å; H221-F297 AromaticContact CE1-CE2 3.54Å; H221-F297 AromaticContact CG-CE1 3.58Å; H221-F297 AromaticContact CG-CE2 3.48Å; H221-F297 VanDerWaalsContact CG-CE2 3.48Å; H221-F297 AromaticContact CG-CZ 3.14Å; H221-F297 AromaticContact ND1-CE2 3.58Å; H221-F297 AromaticContact ND1-CZ 3.69Å; H221-F297 AromaticContact NE2-CD2 3.35Å; H221-F297 WeakPolarHBondContact NE2-CD2 3.29Å; H221-F297 AromaticContact NE2-CE2 3.42Å; H221-F297 WeakPolarHBondContact NE2-CE2 3.41Å; H221-F297 AromaticContact NE2-CG 3.73Å; H221-F297 AromaticContact NE2-CZ 3.84Å
222	R	90.9	Very high	88.8	Confident	152 Å²	152	49.5 Å²	49.5	57%	0.574	24%	0.241	S	C	*	.	H	α-helix	trans	-59.2	-39.1	178.8	-179.8	-179.5	175.2	175.2	2.5	112.3	A218 I219 Q226	A218-R222 VanDerWaalsContact O-CB 3.31Å; A218-R222 WeakPolarHBondContact O-CB 3.42Å; A218-R222 PolarHBondContact O-N 2.98Å; I219-R222 PolarHBondContact O-N 2.71Å; R222-Q226 HydrophobicContact CG-CG 4.37Å; R222-Q226 VanDerWaalsContact NE-NE2 3.18Å; R222-Q226 WeakPolarHBondContact O-CB 3.36Å; R222-Q226 WeakPolarHBondContact O-CG 3.4Å; R222-Q226 PolarHBondContact O-N 2.91Å
223	L	86.4	Confident	88.9	Confident	35 Å²	35	54.9 Å²	54.9	18%	0.183	26%	0.261	C	S	.	.	H	α-helix	trans	-72.3	-42.8	-177.7	-71	164.1	0	0	0	112.7	F152 I219 L220 H221 E225 Q226 R227 W247	F152-L223 HydrophobicContact CD1-CD1 3.49Å; F152-L223 VanDerWaalsContact CD1-CD1 3.49Å; F152-L223 HydrophobicContact CD1-CD2 4.27Å; F152-L223 HydrophobicContact CD1-CG 4.5Å; F152-L223 HydrophobicContact CD2-CD1 4.35Å; F152-L223 HydrophobicContact CE1-CD1 3.06Å; F152-L223 HydrophobicContact CE1-CD2 3.76Å; F152-L223 HydrophobicContact CE1-CG 4.01Å; F152-L223 HydrophobicContact CE2-CD1 4.01Å; F152-L223 HydrophobicContact CG-CD1 4.12Å; F152-L223 HydrophobicContact CZ-CD1 3.35Å; I219-L223 HydrophobicContact CG2-CD1 3.37Å; I219-L223 HydrophobicContact CG2-CG 4.21Å; I219-L223 WeakPolarHBondContact O-CB 3.44Å; I219-L223 VanDerWaalsContact O-CD1 3.29Å; I219-L223 WeakPolarHBondContact O-CD1 3.44Å; I219-L223 WeakPolarHBondContact O-CG 3.39Å; I219-L223 PolarHBondContact O-N 3.19Å; L220-L223 PolarHBondContact O-N 2.96Å; H221-L223 VanDerWaalsContact C-N 3.28Å; H221-L223 PolarHBondContact O-N 3.03Å; L223-E225 VanDerWaalsContact C-N 3.28Å; L223-E225 PolarHBondContact O-N 3.32Å; L223-Q226 PolarHBondContact O-N 3.46Å; L223-R227 WeakPolarHBondContact O-CB 3.47Å; L223-R227 PolarHBondContact O-N 3.11Å; L223-W247 HydrophobicContact CB-CH2 4.39Å
224	I	88.8	Confident	89	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-60.1	-45.4	175.5	-69.3	165.7	0	0	0	108.9	L220 H221 M228 W247 L248 F297 F298 I301	L220-I224 WeakPolarHBondContact O-CB 3.46Å; L220-I224 WeakPolarHBondContact O-CD1 3.49Å; L220-I224 VanDerWaalsContact O-CG1 3.25Å; L220-I224 WeakPolarHBondContact O-CG1 3.43Å; L220-I224 PolarHBondContact O-N 3.43Å; H221-I224 PolarHBondContact O-N 2.9Å; I224-M228 WeakPolarHBondContact O-CB 3.32Å; I224-M228 PolarHBondContact O-N 3.45Å; I224-W247 HydrophobicContact CG1-CH2 4.1Å; I224-W247 HydrophobicContact CG1-CZ3 3.89Å; I224-L248 HydrophobicContact CD1-CD2 4.19Å; I224-L248 HydrophobicContact CG1-CD2 4.35Å; I224-F297 HydrophobicContact CB-CD1 4.33Å; I224-F297 HydrophobicContact CB-CE1 4.22Å; I224-F297 HydrophobicContact CD1-CD1 3.77Å; I224-F297 HydrophobicContact CD1-CE1 4.34Å; I224-F297 HydrophobicContact CG2-CD1 4.24Å; I224-F297 HydrophobicContact CG2-CE1 4.35Å; I224-F298 HydrophobicContact CG2-CB 4.38Å; I224-F298 HydrophobicContact CG2-CD2 4.42Å; I224-I301 HydrophobicContact CG2-CD1 4.37Å
225	E	91.6	Very high	89.2	Confident	96 Å²	96	55.2 Å²	55.2	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-59.9	-50	175.4	-72.6	173.4	-178.2	0	0	112.1	H221 L223 M228 E229 I301	H221-E225 WeakPolarHBondContact O-CG 3.43Å; H221-E225 PolarHBondContact O-N 3.5Å; L223-E225 VanDerWaalsContact C-N 3.28Å; L223-E225 PolarHBondContact O-N 3.32Å; E225-M228 PolarHBondContact O-N 3.13Å; E225-E229 WeakPolarHBondContact O-CB 3.44Å; E225-E229 PolarHBondContact O-N 3.05Å; E225-I301 HydrophobicContact CG-CD1 3.61Å; E225-I301 HydrophobicContact CG-CG2 4.28Å
226	Q	90.5	Very high	89.4	Confident	80 Å²	80	56.1 Å²	56.1	37%	0.374	27%	0.272	S	S	.	.	H	α-helix	trans	-63.8	-44.7	-179	-76.7	178.5	-16.9	0	0	113	R222 L223 M228 E229 Q230	R222-Q226 HydrophobicContact CG-CG 4.37Å; R222-Q226 VanDerWaalsContact NE-NE2 3.18Å; R222-Q226 WeakPolarHBondContact O-CB 3.36Å; R222-Q226 WeakPolarHBondContact O-CG 3.4Å; R222-Q226 PolarHBondContact O-N 2.91Å; L223-Q226 PolarHBondContact O-N 3.46Å; Q226-M228 VanDerWaalsContact C-N 3.33Å; Q226-E229 PolarHBondContact O-N 2.81Å; Q226-Q230 WeakPolarHBondContact O-CB 3.49Å; Q226-Q230 VanDerWaalsContact O-CG 3.28Å; Q226-Q230 WeakPolarHBondContact O-CG 3.36Å; Q226-Q230 PolarHBondContact O-N 3.28Å; Q226-Q230 VanDerWaalsContact O-N 3.07Å
227	R	87.3	Confident	89.4	Confident	54 Å²	54	63.2 Å²	63.2	20%	0.204	31%	0.305	C	S	.	.	H	α-helix	trans	-65.2	-41.1	179	-172.9	173.5	179.7	91.4	-6.7	110.5	E162 L223 Q230 H231 F244 W247	E162-R227 IonicContact OE1-NH2 3.55Å; E162-R227 PolarHBondContact OE1-NH2 3.4Å; L223-R227 WeakPolarHBondContact O-CB 3.47Å; L223-R227 PolarHBondContact O-N 3.11Å; R227-Q230 PolarHBondContact O-N 3.19Å; R227-H231 WeakPolarHBondContact O-CB 3.33Å; R227-H231 PolarHBondContact O-CD2 3.23Å; R227-H231 PolarHBondContact O-N 2.78Å; R227-F244 HydrophobicContact CB-CE1 4.49Å; R227-F244 HydrophobicContact CG-CE1 4.2Å; R227-F244 HydrophobicContact CG-CZ 4.1Å; R227-W247 VanDerWaalsContact CZ-CD1 3.49Å
228	M	89.1	Confident	89.4	Confident	7 Å²	7	68.4 Å²	68.4	3%	0.034	32%	0.32	C	S	.	.	H	α-helix	trans	-66.3	-42.9	178.2	-165.6	-171.8	75.7	0	0	112	I224 E225 Q226 Q230 C232 R233 F244 I301 Y302 M305	I224-M228 WeakPolarHBondContact O-CB 3.32Å; I224-M228 PolarHBondContact O-N 3.45Å; E225-M228 PolarHBondContact O-N 3.13Å; Q226-M228 VanDerWaalsContact C-N 3.33Å; M228-Q230 VanDerWaalsContact C-N 3.29Å; M228-Q230 PolarHBondContact O-N 3.4Å; M228-C232 HydrophobicContact CG-CB 3.93Å; M228-C232 WeakPolarHBondContact O-CA 3.46Å; M228-C232 VanDerWaalsContact O-CB 3.23Å; M228-C232 WeakPolarHBondContact O-CB 3.43Å; M228-C232 PolarHBondContact O-N 3.19Å; M228-R233 PolarHBondContact O-N 3.13Å; M228-F244 HydrophobicContact CB-CZ 4.38Å; M228-I301 HydrophobicContact CE-CB 4.31Å; M228-I301 HydrophobicContact CE-CG2 3.14Å; M228-I301 HydrophobicContact SD-CB 4.32Å; M228-I301 HydrophobicContact SD-CG2 3.67Å; M228-Y302 HydrophobicContact CG-CD2 4.34Å; M228-Y302 WeakPolarHBondContact SD-CA 3.17Å; M228-Y302 HydrophobicContact SD-CD2 4.02Å; M228-M305 HydrophobicContact CE-CB 3.49Å; M228-M305 VanDerWaalsContact CE-CB 3.49Å; M228-M305 HydrophobicContact CE-CE 4.13Å; M228-M305 HydrophobicContact CE-CG 4.01Å; M228-M305 HydrophobicContact CE-SD 3.62Å; M228-M305 HydrophobicContact CG-CE 3.89Å; M228-M305 HydrophobicContact CG-SD 3.87Å; M228-M305 HydrophobicContact SD-CB 4.42Å; M228-M305 HydrophobicContact SD-CE 3.93Å; M228-M305 HydrophobicContact SD-SD 4.14Å
229	E	88.9	Confident	89.5	Confident	91 Å²	91	68.4 Å²	68.4	43%	0.425	32%	0.318	S	S	.	.	H	α-helix	trans	-61.8	-36.2	176.5	-172.9	65.6	-157.7	0	0	112.3	E225 Q226 R233	E225-E229 WeakPolarHBondContact O-CB 3.44Å; E225-E229 PolarHBondContact O-N 3.05Å; Q226-E229 PolarHBondContact O-N 2.81Å; E229-R233 VanDerWaalsContact CD-CD 3.49Å; E229-R233 VanDerWaalsContact CD-NH1 3.27Å; E229-R233 WeakPolarHBondContact O-CB 3.3Å; E229-R233 WeakPolarHBondContact OE1-CD 3.28Å; E229-R233 IonicContact OE1-CZ 2.78Å; E229-R233 IonicContact OE1-NE 3.11Å; E229-R233 IonicContact OE1-NH1 3.42Å; E229-R233 PolarHBondContact OE1-NH1 3.33Å; E229-R233 IonicContact OE2-CZ 2.71Å; E229-R233 IonicContact OE2-NH1 2.68Å; E229-R233 PolarHBondContact OE2-NH1 3.03Å
230	Q	88.3	Confident	89.6	Confident	148 Å²	148	68.5 Å²	68.5	69%	0.692	32%	0.318	S	S	*	.	H	α-helix	trans	-80.7	-37.9	-178.2	-73	174.7	-3.5	0	0	114.1	Q226 R227 M228	Q226-Q230 WeakPolarHBondContact O-CB 3.49Å; Q226-Q230 VanDerWaalsContact O-CG 3.28Å; Q226-Q230 WeakPolarHBondContact O-CG 3.36Å; Q226-Q230 PolarHBondContact O-N 3.28Å; Q226-Q230 VanDerWaalsContact O-N 3.07Å; R227-Q230 PolarHBondContact O-N 3.19Å; M228-Q230 VanDerWaalsContact C-N 3.29Å; M228-Q230 PolarHBondContact O-N 3.4Å
231	H	86.5	Confident	89.6	Confident	80 Å²	80	69.3 Å²	69.3	37%	0.37	32%	0.322	S	S	.	.	H	α-helix	trans	-107.4	-22.9	-170.7	-69.9	-85.1	0	0	0	114.3	R227 F240	R227-H231 WeakPolarHBondContact O-CB 3.33Å; R227-H231 PolarHBondContact O-CD2 3.23Å; R227-H231 PolarHBondContact O-N 2.78Å; H231-F240 WeakPolarHBondContact O-CE1 3.39Å; H231-F240 WeakPolarHBondContact O-CZ 3.35Å
232	C	87.2	Confident	89.4	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-24	-173.7	-58.5	0	0	0	0	113.6	M228 G234 E235 F240 F244 Y302 M305 R306	M228-C232 HydrophobicContact CG-CB 3.93Å; M228-C232 WeakPolarHBondContact O-CA 3.46Å; M228-C232 VanDerWaalsContact O-CB 3.23Å; M228-C232 WeakPolarHBondContact O-CB 3.43Å; M228-C232 PolarHBondContact O-N 3.19Å; C232-G234 PolarHBondContact O-N 3.05Å; C232-E235 PolarHBondContact O-N 2.72Å; C232-F240 HydrophobicContact CB-CD2 4.4Å; C232-F240 HydrophobicContact CB-CE2 4.45Å; C232-F244 WeakPolarHBondContact SG-CE2 3.3Å; C232-F244 VanDerWaalsContact SG-CZ 3.51Å; C232-Y302 HydrophobicContact CB-CE2 4.41Å; C232-M305 HydrophobicContact CB-CE 3.74Å; C232-M305 HydrophobicContact CB-SD 4.03Å; C232-R306 PolarHBondContact O-NH1 2.88Å; C232-R306 PolarHBondContact O-NH2 3.05Å
233	R	89.1	Confident	89.3	Confident	112 Å²	112	68.2 Å²	68.2	42%	0.423	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	127.8	-172.2	-162	172.9	-173.2	142.6	14	110.8	M228 E229 E235 M305 E308 E309	M228-R233 PolarHBondContact O-N 3.13Å; E229-R233 VanDerWaalsContact CD-CD 3.49Å; E229-R233 VanDerWaalsContact CD-NH1 3.27Å; E229-R233 WeakPolarHBondContact O-CB 3.3Å; E229-R233 WeakPolarHBondContact OE1-CD 3.28Å; E229-R233 IonicContact OE1-CZ 2.78Å; E229-R233 IonicContact OE1-NE 3.11Å; E229-R233 IonicContact OE1-NH1 3.42Å; E229-R233 PolarHBondContact OE1-NH1 3.33Å; E229-R233 IonicContact OE2-CZ 2.71Å; E229-R233 IonicContact OE2-NH1 2.68Å; E229-R233 PolarHBondContact OE2-NH1 3.03Å; R233-E235 PolarHBondContact O-N 2.73Å; R233-M305 HydrophobicContact CB-SD 4.35Å; R233-E308 IonicContact NH2-OE2 2.72Å; R233-E309 WeakPolarHBondContact CG-OE1 3.46Å
234	G	88.2	Confident	89.4	Confident	46 Å²	46	66.7 Å²	66.7	47%	0.474	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	-5.3	-178.9	0	0	0	0	0	116.6	C232 E309	C232-G234 PolarHBondContact O-N 3.05Å; G234-E309 PolarHBondContact N-OE1 3.09Å
235	E	91.3	Very high	89.4	Confident	108 Å²	108	70.4 Å²	70.4	51%	0.505	33%	0.334	S	S	.	.			trans	-103.5	122.9	175.8	-67.7	-174.9	-169.5	0	0	110.8	C232 R233 F240 R306	C232-E235 PolarHBondContact O-N 2.72Å; R233-E235 PolarHBondContact O-N 2.73Å; E235-F240 HydrophobicContact CB-CE2 4.25Å; E235-F240 HydrophobicContact CB-CZ 3.82Å; E235-R306 PolarHBondContact O-NH2 3.07Å
236	Y	91.9	Very high	89.3	Confident	29 Å²	29	71.1 Å²	71.1	11%	0.114	34%	0.338	C	S	.	.			trans	-123.3	-13.4	-174.1	-45.6	-48.5	0	0	0	115	E309 I313 A323	Y236-E309 HydrophobicContact CE1-CB 4.15Å; Y236-I313 HydrophobicContact CD1-CD1 4.1Å; Y236-I313 HydrophobicContact CD1-CG1 3.56Å; Y236-I313 HydrophobicContact CD2-CG1 4.32Å; Y236-I313 HydrophobicContact CE1-CD1 4.08Å; Y236-I313 HydrophobicContact CE1-CG1 3.55Å; Y236-I313 HydrophobicContact CE2-CG1 4.32Å; Y236-I313 HydrophobicContact CG-CG1 3.97Å; Y236-A323 HydrophobicContact CD1-CB 4.49Å; Y236-A323 PolarHBondContact O-N 2.7Å
237	E	90.8	Very high	89.3	Confident	149 Å²	149	68.3 Å²	68.3	70%	0.696	32%	0.324	S	S	*	.	S	Bend	trans	-81.1	-15.2	-172.7	-61.9	-180	-176.3	0	0	113.5	E319 P322	E237-E319 HydrophobicContact CG-CB 4.35Å; E237-P322 WeakPolarHBondContact O-CG 3.41Å
238	R	90.4	Very high	89.4	Confident	144 Å²	144	65.8 Å²	65.8	54%	0.543	31%	0.314	S	S	.	.	S	Bend	trans	-118.7	143.4	-178.9	-174.9	179.9	170.5	172.2	1.4	110.6	F240 D243	R238-F240 WeakPolarHBondContact O-CD2 3.37Å; R238-F240 WeakPolarHBondContact O-CE2 3.45Å; R238-D243 IonicContact CZ-OD2 3.96Å; R238-D243 IonicContact NE-OD2 3.53Å; R238-D243 PolarHBondContact NE-OD2 2.79Å; R238-D243 IonicContact NH2-OD1 2.72Å; R238-D243 PolarHBondContact NH2-OD1 3.06Å; R238-D243 IonicContact NH2-OD2 2.8Å; R238-D243 PolarHBondContact NH2-OD2 3.42Å
239	S	92.3	Very high	89.4	Confident	48 Å²	48	69.4 Å²	69.4	34%	0.336	33%	0.331	S	S	.	.			trans	-79.1	132.8	167.7	173.9	0	0	0	0	110.3	D326	S239-D326 WeakPolarHBondContact CA-OD2 3.39Å; S239-D326 WeakPolarHBondContact CB-OD1 3.34Å; S239-D326 VanDerWaalsContact OG-CG 3.31Å; S239-D326 PolarHBondContact OG-OD1 3.46Å; S239-D326 PolarHBondContact OG-OD2 2.96Å
240	F	90.7	Very high	89.4	Confident	11 Å²	11	68 Å²	68	5%	0.048	33%	0.326	C	S	.	.			trans	-102.5	-6.6	-179.2	-65	-77.4	0	0	0	112.9	H231 C232 E235 R238 Q242 D243 F244 D326	H231-F240 WeakPolarHBondContact O-CE1 3.39Å; H231-F240 WeakPolarHBondContact O-CZ 3.35Å; C232-F240 HydrophobicContact CB-CD2 4.4Å; C232-F240 HydrophobicContact CB-CE2 4.45Å; E235-F240 HydrophobicContact CB-CE2 4.25Å; E235-F240 HydrophobicContact CB-CZ 3.82Å; R238-F240 WeakPolarHBondContact O-CD2 3.37Å; R238-F240 WeakPolarHBondContact O-CE2 3.45Å; F240-Q242 PolarHBondContact O-N 3.11Å; F240-D243 PolarHBondContact O-N 2.89Å; F240-F244 HydrophobicContact CB-CD2 3.92Å; F240-F244 HydrophobicContact CB-CE2 4.09Å; F240-F244 WeakPolarHBondContact O-CB 3.39Å; F240-F244 VanDerWaalsContact O-CD2 3.27Å; F240-F244 WeakPolarHBondContact O-CD2 3.46Å; F240-F244 PolarHBondContact O-N 2.62Å; F240-D326 PolarHBondContact N-OD2 3.31Å
241	L	88.9	Confident	89.4	Confident	20 Å²	20	61 Å²	61	11%	0.105	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-43.2	-172	-71.3	179.2	0	0	0	113.2	Q245 F298 D326 F329	L241-Q245 WeakPolarHBondContact O-CB 3.38Å; L241-Q245 WeakPolarHBondContact O-CG 3.48Å; L241-Q245 PolarHBondContact O-N 3.41Å; L241-F298 HydrophobicContact CD2-CE1 3.8Å; L241-F298 HydrophobicContact CD2-CZ 4.11Å; L241-D326 HydrophobicContact CD1-CB 4.14Å; L241-D326 WeakPolarHBondContact CD1-OD1 3.15Å; L241-D326 HydrophobicContact CG-CB 4.08Å; L241-D326 WeakPolarHBondContact CG-OD1 3.39Å; L241-F329 HydrophobicContact CD1-CB 3.91Å; L241-F329 HydrophobicContact CD1-CD1 3.58Å; L241-F329 HydrophobicContact CD1-CE1 4.23Å; L241-F329 HydrophobicContact CD1-CG 3.79Å; L241-F329 HydrophobicContact CD2-CD1 4.08Å; L241-F329 HydrophobicContact CD2-CE1 4.42Å; L241-F329 HydrophobicContact CG-CD1 4.5Å
242	Q	88.8	Confident	89.5	Confident	123 Å²	123	58 Å²	58	58%	0.575	28%	0.28	S	S	*	.	H	α-helix	trans	-69.5	-47.9	-178.9	-174.5	173.1	-2.9	0	0	111.5	F240 F244 Q245 E246	F240-Q242 PolarHBondContact O-N 3.11Å; Q242-F244 VanDerWaalsContact C-N 3.26Å; Q242-F244 PolarHBondContact O-N 3.25Å; Q242-Q245 WeakPolarHBondContact O-CB 3.43Å; Q242-Q245 PolarHBondContact O-N 2.87Å; Q242-E246 PolarHBondContact NE2-OE1 3.14Å; Q242-E246 VanDerWaalsContact NE2-OE1 3.09Å; Q242-E246 PolarHBondContact O-N 3.12Å
243	D	88.4	Confident	89.5	Confident	49 Å²	49	59.3 Å²	59.3	26%	0.262	29%	0.294	S	S	.	.	H	α-helix	trans	-57	-41.2	178.5	-58.6	-26.9	0	0	0	111.4	R238 F240 W247	R238-D243 IonicContact CZ-OD2 3.96Å; R238-D243 IonicContact NE-OD2 3.53Å; R238-D243 PolarHBondContact NE-OD2 2.79Å; R238-D243 IonicContact NH2-OD1 2.72Å; R238-D243 PolarHBondContact NH2-OD1 3.06Å; R238-D243 IonicContact NH2-OD2 2.8Å; R238-D243 PolarHBondContact NH2-OD2 3.42Å; F240-D243 PolarHBondContact O-N 2.89Å; D243-W247 VanDerWaalsContact O-CB 3.31Å; D243-W247 WeakPolarHBondContact O-CB 3.38Å; D243-W247 PolarHBondContact O-N 3.43Å
244	F	89.1	Confident	89.6	Confident	4 Å²	4	54 Å²	54	2%	0.018	27%	0.274	C	S	.	.	H	α-helix	trans	-71.6	-37.3	175.8	-87.2	-98.2	0	0	0	112.6	R227 M228 C232 F240 Q242 W247 L248 F298	R227-F244 HydrophobicContact CB-CE1 4.49Å; R227-F244 HydrophobicContact CG-CE1 4.2Å; R227-F244 HydrophobicContact CG-CZ 4.1Å; M228-F244 HydrophobicContact CB-CZ 4.38Å; C232-F244 WeakPolarHBondContact SG-CE2 3.3Å; C232-F244 VanDerWaalsContact SG-CZ 3.51Å; F240-F244 HydrophobicContact CB-CD2 3.92Å; F240-F244 HydrophobicContact CB-CE2 4.09Å; F240-F244 WeakPolarHBondContact O-CB 3.39Å; F240-F244 VanDerWaalsContact O-CD2 3.27Å; F240-F244 WeakPolarHBondContact O-CD2 3.46Å; F240-F244 PolarHBondContact O-N 2.62Å; Q242-F244 VanDerWaalsContact C-N 3.26Å; Q242-F244 PolarHBondContact O-N 3.25Å; F244-W247 HydrophobicContact CD1-CE3 4.36Å; F244-W247 PolarHBondContact O-N 2.95Å; F244-L248 VanDerWaalsContact O-CB 3.31Å; F244-L248 WeakPolarHBondContact O-CB 3.43Å; F244-L248 WeakPolarHBondContact O-CG 3.48Å; F244-L248 PolarHBondContact O-N 3.47Å; F244-F298 HydrophobicContact CB-CD2 4.44Å; F244-F298 HydrophobicContact CB-CE2 3.81Å; F244-F298 HydrophobicContact CB-CZ 3.9Å; F244-F298 AromaticContact CD1-CD2 3.7Å; F244-F298 HydrophobicContact CD1-CD2 3.7Å; F244-F298 AromaticContact CD1-CE2 3.38Å; F244-F298 HydrophobicContact CD1-CE2 3.38Å; F244-F298 HydrophobicContact CD1-CZ 4.3Å; F244-F298 HydrophobicContact CD2-CE2 4.2Å; F244-F298 HydrophobicContact CE1-CD2 4.27Å; F244-F298 AromaticContact CE1-CE2 3.94Å; F244-F298 HydrophobicContact CE1-CE2 3.94Å; F244-F298 HydrophobicContact CG-CD2 4.22Å; F244-F298 AromaticContact CG-CE2 3.51Å; F244-F298 HydrophobicContact CG-CE2 3.51Å; F244-F298 HydrophobicContact CG-CZ 4.01Å
245	Q	88.1	Confident	89.6	Confident	79 Å²	79	51.8 Å²	51.8	37%	0.369	25%	0.251	S	S	.	.	H	α-helix	trans	-60.4	-47.5	175.4	-78.1	171.2	23.1	0	0	111.1	L241 Q242 W247 L248 E249	L241-Q245 WeakPolarHBondContact O-CB 3.38Å; L241-Q245 WeakPolarHBondContact O-CG 3.48Å; L241-Q245 PolarHBondContact O-N 3.41Å; Q242-Q245 WeakPolarHBondContact O-CB 3.43Å; Q242-Q245 PolarHBondContact O-N 2.87Å; Q245-W247 PolarHBondContact O-N 3.13Å; Q245-L248 PolarHBondContact O-N 2.88Å; Q245-E249 WeakPolarHBondContact O-CG 3.47Å; Q245-E249 PolarHBondContact O-N 2.91Å; Q245-E249 VanDerWaalsContact O-N 3.1Å
246	E	89.1	Confident	89.4	Confident	112 Å²	112	47.8 Å²	47.8	52%	0.523	24%	0.239	S	C	.	.	H	α-helix	trans	-62.5	-43	177.4	-68.2	177	-167.5	0	0	111.5	Q242 E249 L250	Q242-E246 PolarHBondContact NE2-OE1 3.14Å; Q242-E246 VanDerWaalsContact NE2-OE1 3.09Å; Q242-E246 PolarHBondContact O-N 3.12Å; E246-E249 WeakPolarHBondContact O-CB 3.4Å; E246-E249 PolarHBondContact O-N 3.19Å; E246-L250 PolarHBondContact O-N 2.9Å
247	W	90.3	Very high	89.1	Confident	21 Å²	21	50 Å²	50	8%	0.08	25%	0.249	C	C	.	.	H	α-helix	trans	-64.5	-40.1	175.2	178.7	82.7	0	0	0	113	M156 L223 I224 R227 D243 F244 Q245 E249 L250 V251	M156-W247 VanDerWaalsContact CE-NE1 3.31Å; L223-W247 HydrophobicContact CB-CH2 4.39Å; I224-W247 HydrophobicContact CG1-CH2 4.1Å; I224-W247 HydrophobicContact CG1-CZ3 3.89Å; R227-W247 VanDerWaalsContact CZ-CD1 3.49Å; D243-W247 VanDerWaalsContact O-CB 3.31Å; D243-W247 WeakPolarHBondContact O-CB 3.38Å; D243-W247 PolarHBondContact O-N 3.43Å; F244-W247 HydrophobicContact CD1-CE3 4.36Å; F244-W247 PolarHBondContact O-N 2.95Å; Q245-W247 PolarHBondContact O-N 3.13Å; W247-E249 PolarHBondContact O-N 3.45Å; W247-L250 WeakPolarHBondContact O-CB 3.42Å; W247-L250 PolarHBondContact O-N 3.15Å; W247-L250 VanDerWaalsContact O-N 3.13Å; W247-V251 HydrophobicContact CD2-CG2 4.15Å; W247-V251 HydrophobicContact CE3-CG2 4.28Å; W247-V251 HydrophobicContact CH2-CG2 3.98Å; W247-V251 HydrophobicContact CZ2-CG2 3.82Å; W247-V251 HydrophobicContact CZ3-CG2 4.21Å; W247-V251 WeakPolarHBondContact O-CG2 3.39Å; W247-V251 PolarHBondContact O-N 3.44Å; W247-V251 VanDerWaalsContact O-N 3.14Å
248	L	89.2	Confident	88.9	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.1	-29.9	176.3	-71.2	170.6	0	0	0	111.5	I224 F244 Q245 V251 L252 M294 F298	I224-L248 HydrophobicContact CD1-CD2 4.19Å; I224-L248 HydrophobicContact CG1-CD2 4.35Å; F244-L248 VanDerWaalsContact O-CB 3.31Å; F244-L248 WeakPolarHBondContact O-CB 3.43Å; F244-L248 WeakPolarHBondContact O-CG 3.48Å; F244-L248 PolarHBondContact O-N 3.47Å; Q245-L248 PolarHBondContact O-N 2.88Å; L248-V251 PolarHBondContact O-N 3.15Å; L248-L252 VanDerWaalsContact O-CG 3.31Å; L248-L252 WeakPolarHBondContact O-CG 3.18Å; L248-L252 PolarHBondContact O-N 3.25Å; L248-M294 HydrophobicContact CB-CE 4.24Å; L248-M294 HydrophobicContact CD2-CB 4.32Å; L248-M294 HydrophobicContact CD2-CE 3.49Å; L248-M294 VanDerWaalsContact CD2-CE 3.49Å; L248-M294 HydrophobicContact CG-CE 4.45Å; L248-F298 HydrophobicContact CD1-CB 4.37Å; L248-F298 HydrophobicContact CD1-CG 4.46Å
249	E	89.3	Confident	88.5	Confident	84 Å²	84	37 Å²	37	39%	0.393	19%	0.194	S	C	.	.	H	α-helix	trans	-65.4	-40.3	171.6	-63.8	-71.2	-170.3	0	0	112.4	Q245 E246 W247 V251 L252 G253 R291	Q245-E249 WeakPolarHBondContact O-CG 3.47Å; Q245-E249 PolarHBondContact O-N 2.91Å; Q245-E249 VanDerWaalsContact O-N 3.1Å; E246-E249 WeakPolarHBondContact O-CB 3.4Å; E246-E249 PolarHBondContact O-N 3.19Å; W247-E249 PolarHBondContact O-N 3.45Å; E249-V251 VanDerWaalsContact C-N 3.29Å; E249-V251 PolarHBondContact O-N 2.99Å; E249-L252 WeakPolarHBondContact O-CB 3.08Å; E249-L252 PolarHBondContact O-N 3.4Å; E249-G253 PolarHBondContact O-N 2.82Å; E249-R291 IonicContact OE1-CZ 3.91Å; E249-R291 IonicContact OE1-NH1 2.97Å; E249-R291 PolarHBondContact OE1-NH1 3.06Å; E249-R291 IonicContact OE1-NH2 2.74Å; E249-R291 PolarHBondContact OE1-NH2 3.34Å; E249-R291 IonicContact OE2-CZ 2.64Å; E249-R291 IonicContact OE2-NH1 3.69Å; E249-R291 PolarHBondContact OE2-NH1 3.19Å
250	L	89.3	Confident	87.8	Confident	60 Å²	60	37.2 Å²	37.2	31%	0.314	20%	0.199	S	C	.	.	H	α-helix	trans	-61.1	-42.7	175	-64.8	175	0	0	0	110.8	Y155 M156 E246 W247 G253 W254	Y155-L250 VanDerWaalsContact CE1-O 3.25Å; Y155-L250 WeakPolarHBondContact CE1-O 3.37Å; Y155-L250 PolarHBondContact OH-O 3.43Å; M156-L250 HydrophobicContact CE-CB 4.42Å; E246-L250 PolarHBondContact O-N 2.9Å; W247-L250 WeakPolarHBondContact O-CB 3.42Å; W247-L250 PolarHBondContact O-N 3.15Å; W247-L250 VanDerWaalsContact O-N 3.13Å; L250-G253 WeakPolarHBondContact O-CA 3.29Å; L250-G253 PolarHBondContact O-N 3.44Å; L250-G253 VanDerWaalsContact O-N 3.16Å; L250-W254 PolarHBondContact O-N 2.84Å
251	V	89.3	Confident	86.4	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-64.7	-40	175.8	177.4	0	0	0	0	111.3	F152 M156 L220 W247 L248 E249 G253 W254 L255 M294	F152-V251 HydrophobicContact CE2-CG1 4.09Å; F152-V251 HydrophobicContact CE2-CG2 4.13Å; F152-V251 HydrophobicContact CZ-CG2 4.08Å; M156-V251 HydrophobicContact CE-CG2 4.3Å; M156-V251 HydrophobicContact SD-CG2 4.29Å; L220-V251 HydrophobicContact CD2-CG1 3.18Å; W247-V251 HydrophobicContact CD2-CG2 4.15Å; W247-V251 HydrophobicContact CE3-CG2 4.28Å; W247-V251 HydrophobicContact CH2-CG2 3.98Å; W247-V251 HydrophobicContact CZ2-CG2 3.82Å; W247-V251 HydrophobicContact CZ3-CG2 4.21Å; W247-V251 WeakPolarHBondContact O-CG2 3.39Å; W247-V251 PolarHBondContact O-N 3.44Å; W247-V251 VanDerWaalsContact O-N 3.14Å; L248-V251 PolarHBondContact O-N 3.15Å; E249-V251 VanDerWaalsContact C-N 3.29Å; E249-V251 PolarHBondContact O-N 2.99Å; V251-G253 VanDerWaalsContact C-N 3.27Å; V251-G253 PolarHBondContact O-N 3.38Å; V251-W254 WeakPolarHBondContact O-CB 3.43Å; V251-W254 PolarHBondContact O-N 3.35Å; V251-W254 VanDerWaalsContact O-N 3.15Å; V251-L255 PolarHBondContact O-N 2.91Å; V251-M294 HydrophobicContact CB-CE 3.72Å; V251-M294 HydrophobicContact CG1-CE 3.38Å; V251-M294 HydrophobicContact CG1-SD 4.3Å
252	L	87.6	Confident	84.4	Confident	17 Å²	17	47.9 Å²	47.9	9%	0.089	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-34.4	172.3	-75.9	165.8	0	0	0	112.3	L248 E249 W254 L255 G256 W290 R291 M294	L248-L252 VanDerWaalsContact O-CG 3.31Å; L248-L252 WeakPolarHBondContact O-CG 3.18Å; L248-L252 PolarHBondContact O-N 3.25Å; E249-L252 WeakPolarHBondContact O-CB 3.08Å; E249-L252 PolarHBondContact O-N 3.4Å; L252-W254 VanDerWaalsContact C-N 3.34Å; L252-W254 PolarHBondContact O-N 3.28Å; L252-L255 HydrophobicContact CD2-CD1 4.06Å; L252-L255 PolarHBondContact O-N 3.18Å; L252-G256 PolarHBondContact O-N 3.46Å; L252-W290 HydrophobicContact CD2-CB 4.23Å; L252-R291 HydrophobicContact CD1-CB 3.79Å; L252-R291 HydrophobicContact CD1-CG 3.78Å; L252-R291 HydrophobicContact CD2-CB 4.03Å; L252-M294 HydrophobicContact CD2-SD 3.89Å; L252-M294 HydrophobicContact CG-CE 4.33Å; L252-M294 HydrophobicContact CG-SD 4.17Å
253	G	87.8	Confident	82.2	Confident	29 Å²	29	45.6 Å²	45.6	30%	0.299	27%	0.265	S	S	.	.	H	α-helix	trans	-60.6	-40.3	172	0	0	0	0	0	112.8	Y155 E249 L250 V251 G256 K257	Y155-G253 VanDerWaalsContact OH-C 3.27Å; Y155-G253 WeakPolarHBondContact OH-CA 3.4Å; E249-G253 PolarHBondContact O-N 2.82Å; L250-G253 WeakPolarHBondContact O-CA 3.29Å; L250-G253 PolarHBondContact O-N 3.44Å; L250-G253 VanDerWaalsContact O-N 3.16Å; V251-G253 VanDerWaalsContact C-N 3.27Å; V251-G253 PolarHBondContact O-N 3.38Å; G253-G256 PolarHBondContact O-N 3.08Å; G253-K257 PolarHBondContact O-N 3.38Å
254	W	89.9	Confident	79.5	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.7	-44.4	172.6	176.6	80.4	0	0	0	111.8	Y148 F152 Y155 V216 L250 V251 L252 G256 K257 V258	Y148-W254 HydrophobicContact CD1-CH2 4.28Å; Y148-W254 AromaticContact CD1-CZ2 3.96Å; Y148-W254 HydrophobicContact CD1-CZ2 3.96Å; F152-W254 HydrophobicContact CB-CD2 4.35Å; F152-W254 HydrophobicContact CB-CH2 4.3Å; F152-W254 HydrophobicContact CB-CZ2 3.79Å; F152-W254 HydrophobicContact CD2-CB 4.42Å; F152-W254 AromaticContact CD2-CD2 3.59Å; F152-W254 HydrophobicContact CD2-CD2 3.59Å; F152-W254 AromaticContact CD2-CE2 3.95Å; F152-W254 AromaticContact CD2-CE3 3.69Å; F152-W254 HydrophobicContact CD2-CE3 3.69Å; F152-W254 AromaticContact CD2-CG 3.91Å; F152-W254 HydrophobicContact CD2-CG 3.91Å; F152-W254 HydrophobicContact CD2-CH2 4.43Å; F152-W254 HydrophobicContact CD2-CZ2 4.36Å; F152-W254 HydrophobicContact CD2-CZ3 4.11Å; F152-W254 HydrophobicContact CE2-CD2 4.44Å; F152-W254 HydrophobicContact CE2-CE3 4.34Å; F152-W254 HydrophobicContact CG-CD2 4.47Å; Y155-W254 HydrophobicContact CD1-CB 3.71Å; Y155-W254 HydrophobicContact CD1-CG 4.31Å; Y155-W254 HydrophobicContact CD2-CB 4.13Å; Y155-W254 AromaticContact CD2-CD1 3.92Å; Y155-W254 HydrophobicContact CD2-CG 4.45Å; Y155-W254 HydrophobicContact CE1-CB 3.76Å; Y155-W254 HydrophobicContact CE2-CB 4.11Å; Y155-W254 HydrophobicContact CG-CB 3.92Å; Y155-W254 AromaticContact CG-CD1 3.67Å; Y155-W254 HydrophobicContact CG-CG 4.16Å; Y155-W254 PolarHBondContact OH-N 3.37Å; V216-W254 HydrophobicContact CG1-CZ3 4.13Å; V216-W254 HydrophobicContact CG2-CH2 4.02Å; V216-W254 HydrophobicContact CG2-CZ3 4.26Å; L250-W254 PolarHBondContact O-N 2.84Å; V251-W254 WeakPolarHBondContact O-CB 3.43Å; V251-W254 PolarHBondContact O-N 3.35Å; V251-W254 VanDerWaalsContact O-N 3.15Å; L252-W254 VanDerWaalsContact C-N 3.34Å; L252-W254 PolarHBondContact O-N 3.28Å; W254-G256 PolarHBondContact O-N 3.33Å; W254-K257 WeakPolarHBondContact O-CA 3.21Å; W254-K257 WeakPolarHBondContact O-CB 3.5Å; W254-K257 PolarHBondContact O-N 3.05Å; W254-V258 HydrophobicContact CD2-CG2 3.87Å; W254-V258 HydrophobicContact CE3-CG2 4.13Å; W254-V258 HydrophobicContact CH2-CG2 3.96Å; W254-V258 HydrophobicContact CZ2-CG2 3.65Å; W254-V258 HydrophobicContact CZ3-CG2 4.18Å; W254-V258 WeakPolarHBondContact O-CG2 3.27Å; W254-V258 PolarHBondContact O-N 3.46Å
255	L	88.8	Confident	76.7	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59	-37.5	175.2	-67.3	172.8	0	0	0	111.8	V216 L220 V251 L252 K257 V258 F259 L287 W290 M294	V216-L255 HydrophobicContact CG1-CD2 3.28Å; L220-L255 HydrophobicContact CD1-CD1 4.05Å; L220-L255 HydrophobicContact CD1-CD2 4.18Å; L220-L255 HydrophobicContact CD2-CD1 4.34Å; V251-L255 PolarHBondContact O-N 2.91Å; L252-L255 HydrophobicContact CD2-CD1 4.06Å; L252-L255 PolarHBondContact O-N 3.18Å; L255-K257 VanDerWaalsContact C-N 3.28Å; L255-K257 PolarHBondContact O-N 3.24Å; L255-V258 PolarHBondContact O-N 2.83Å; L255-V258 VanDerWaalsContact O-N 3.17Å; L255-F259 HydrophobicContact CB-CD2 4.48Å; L255-F259 HydrophobicContact CD2-CE2 4.16Å; L255-F259 WeakPolarHBondContact O-CD2 2.87Å; L255-F259 PolarHBondContact O-N 3.47Å; L255-L287 HydrophobicContact CB-CD2 4.31Å; L255-W290 HydrophobicContact CD1-CB 4.12Å; L255-W290 HydrophobicContact CD1-CD2 4.41Å; L255-W290 HydrophobicContact CD1-CE3 4.41Å; L255-W290 HydrophobicContact CD1-CG 4.31Å; L255-M294 HydrophobicContact CD1-SD 3.47Å; L255-M294 WeakPolarHBondContact CD1-SD 3.41Å
256	G	86.8	Confident	73.7	Confident	24 Å²	24	50.9 Å²	50.9	25%	0.247	34%	0.344	C	S	.	.	H	α-helix	trans	-57.6	-38.4	171.7	0	0	0	0	0	113.1	L252 G253 W254 A260	L252-G256 PolarHBondContact O-N 3.46Å; G253-G256 PolarHBondContact O-N 3.08Å; W254-G256 PolarHBondContact O-N 3.33Å; G256-A260 WeakPolarHBondContact O-CB 3.49Å; G256-A260 PolarHBondContact O-N 2.92Å; G256-A260 VanDerWaalsContact O-N 3.14Å
257	K	85.3	Confident	70.7	Confident	74 Å²	74	49.6 Å²	49.6	32%	0.322	35%	0.352	S	S	.	.	H	α-helix	trans	-73.5	-33.4	175.4	-65.7	-177.4	-175	170.6	0	112.5	Y155 E159 G253 W254 L255	Y155-K257 HydrophobicContact CD2-CD 3.96Å; Y155-K257 HydrophobicContact CE2-CD 3.67Å; E159-K257 IonicContact OE1-NZ 2.63Å; G253-K257 PolarHBondContact O-N 3.38Å; W254-K257 WeakPolarHBondContact O-CA 3.21Å; W254-K257 WeakPolarHBondContact O-CB 3.5Å; W254-K257 PolarHBondContact O-N 3.05Å; L255-K257 VanDerWaalsContact C-N 3.28Å; L255-K257 PolarHBondContact O-N 3.24Å
258	V	86.8	Confident	67.8	Low	0 Å²	0	53.6 Å²	53.6	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-70.6	-43.3	176.7	176.6	0	0	0	0	111.6	Y148 L195 S199 V216 W254 L255	Y148-V258 HydrophobicContact CD1-CG2 4.41Å; Y148-V258 HydrophobicContact CE1-CG1 3.78Å; Y148-V258 HydrophobicContact CE1-CG2 4.22Å; L195-V258 HydrophobicContact CD1-CG2 4.3Å; L195-V258 HydrophobicContact CD2-CG2 4.36Å; S199-V258 VanDerWaalsContact CB-O 3.23Å; S199-V258 WeakPolarHBondContact CB-O 3.5Å; V216-V258 HydrophobicContact CG2-CG1 4.31Å; W254-V258 HydrophobicContact CD2-CG2 3.87Å; W254-V258 HydrophobicContact CE3-CG2 4.13Å; W254-V258 HydrophobicContact CH2-CG2 3.96Å; W254-V258 HydrophobicContact CZ2-CG2 3.65Å; W254-V258 HydrophobicContact CZ3-CG2 4.18Å; W254-V258 WeakPolarHBondContact O-CG2 3.27Å; W254-V258 PolarHBondContact O-N 3.46Å; L255-V258 PolarHBondContact O-N 2.83Å; L255-V258 VanDerWaalsContact O-N 3.17Å
259	F	83.6	Confident	65	Low	21 Å²	21	59 Å²	59	9%	0.092	42%	0.423	C	S	.	.	S	Bend	trans	-96.7	16.9	-177.4	-65.4	-72.4	0	0	0	113.9	L208 S212 L255 T261 W290	L208-F259 HydrophobicContact CD2-CD1 4.08Å; L208-F259 HydrophobicContact CG-CD1 4.08Å; L208-F259 HydrophobicContact CG-CE1 4.35Å; S212-F259 VanDerWaalsContact OG-CE1 3.3Å; S212-F259 WeakPolarHBondContact OG-CE1 3.34Å; S212-F259 WeakPolarHBondContact OG-CZ 3.3Å; L255-F259 HydrophobicContact CB-CD2 4.48Å; L255-F259 HydrophobicContact CD2-CE2 4.16Å; L255-F259 WeakPolarHBondContact O-CD2 2.87Å; L255-F259 PolarHBondContact O-N 3.47Å; F259-T261 PolarHBondContact O-N 3.31Å; F259-W290 AromaticContact CE2-CE2 3.93Å; F259-W290 HydrophobicContact CE2-CZ2 4.16Å; F259-W290 AromaticContact CE2-NE1 3.58Å; F259-W290 HydrophobicContact CZ-CZ2 4.04Å; F259-W290 AromaticContact CZ-NE1 3.88Å
260	A	75.9	Confident	62.2	Low	53 Å²	53	60.9 Å²	60.9	44%	0.438	44%	0.442	S	S	.	.			trans	-63.1	123.9	175.8	0	0	0	0	0	110.6	G256	G256-A260 WeakPolarHBondContact O-CB 3.49Å; G256-A260 PolarHBondContact O-N 2.92Å; G256-A260 VanDerWaalsContact O-N 3.14Å
261	T	61.2	Low	59.5	Low	99 Å²	99	67.1 Å²	67.1	61%	0.607	47%	0.472	S	S	*	.			trans	-112	143	175.1	17.2	0	0	0	0	109.6	F259 G263	F259-T261 PolarHBondContact O-N 3.31Å; T261-G263 PolarHBondContact O-N 2.87Å
262	E	47.7	Very low	56.7	Low	156 Å²	156	73.3 Å²	73.3	73%	0.729	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-1.8	-177	-70.6	-162.3	144.6	0	0	115.3	L200	L200-E262 HydrophobicContact CD1-CG 3.45Å; L200-E262 VanDerWaalsContact CD1-CG 3.45Å; L200-E262 WeakPolarHBondContact CD1-OE1 3.44Å
263	G	42.8	Very low	54.2	Low	75 Å²	75	78.6 Å²	78.6	77%	0.773	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	6.9	-175	0	0	0	0	0	116.9	T261 G265	T261-G263 PolarHBondContact O-N 2.87Å; G263-G265 VanDerWaalsContact C-N 3.32Å; G263-G265 PolarHBondContact O-N 3.14Å
264	G	32.1	Very low	51.6	Low	74 Å²	74	81.8 Å²	81.8	76%	0.763	56%	0.558	S	S	*	*			trans	-86.2	11	-178.8	0	0	0	0	0	115.7	A266	G264-A266 VanDerWaalsContact C-N 3.29Å; G264-A266 PolarHBondContact O-N 3.32Å; G264-A266 VanDerWaalsContact O-N 3.12Å
265	G	29.5	Very low	48.9	Very low	74 Å²	74	87.5 Å²	87.5	76%	0.763	59%	0.593	S	S	*	*			trans	-83.2	62.2	176.7	0	0	0	0	0	112.5	G263 A267	G263-G265 VanDerWaalsContact C-N 3.32Å; G263-G265 PolarHBondContact O-N 3.14Å; G265-A267 PolarHBondContact O-N 3.45Å
266	A	26	Very low	46.2	Very low	95 Å²	95	93 Å²	93	79%	0.785	63%	0.628	S	S	*	*			trans	-68.9	113.7	159.2	0	0	0	0	0	106.9	G264 A268	G264-A266 VanDerWaalsContact C-N 3.29Å; G264-A266 PolarHBondContact O-N 3.32Å; G264-A266 VanDerWaalsContact O-N 3.12Å; A266-A268 PolarHBondContact O-N 3.44Å
267	A	26.6	Very low	43.3	Very low	85 Å²	85	97.6 Å²	97.6	70%	0.702	66%	0.657	S	S	*	*			trans	-35.9	123.4	-178.2	0	0	0	0	0	112.6	G265 V269	G265-A267 PolarHBondContact O-N 3.45Å; A267-V269 VanDerWaalsContact C-N 3.27Å; A267-V269 PolarHBondContact O-N 3.01Å
268	A	27.9	Very low	40.5	Very low	105 Å²	105	100 Å²	100	87%	0.868	68%	0.678	S	S	*	*			trans	-60.5	94.3	162.7	0	0	0	0	0	108.1	A266	A266-A268 PolarHBondContact O-N 3.44Å
269	V	30.8	Very low	38	Very low	114 Å²	114	105.8 Å²	105.8	69%	0.691	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-70.4	135.8	162.8	-176.1	0	0	0	0	106.6	A267 M271	A267-V269 VanDerWaalsContact C-N 3.27Å; A267-V269 PolarHBondContact O-N 3.01Å; V269-M271 PolarHBondContact O-N 3.25Å
270	P	31.7	Very low	35.6	Very low	123 Å²	123	110.2 Å²	110.2	80%	0.799	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-61.4	123.3	178.4	-15.2	28	0	0	0	110
271	M	31.7	Very low	33.6	Very low	190 Å²	190	111.8 Å²	111.8	94%	0.936	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-73	137.3	177	-79.1	-162.1	-163.7	0	0	111.9	V269	V269-M271 PolarHBondContact O-N 3.25Å
272	D	29.5	Very low	32.2	Very low	132 Å²	132	112.5 Å²	112.5	71%	0.706	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-79	136.4	166.3	-151.7	-3.5	0	0	0	109.3	S274	D272-S274 VanDerWaalsContact C-N 3.32Å; D272-S274 PolarHBondContact O-N 2.72Å
273	P	36.9	Very low	32.3	Very low	127 Å²	127	106.9 Å²	106.9	83%	0.825	75%	0.753	S	S	*	*	S	Bend	trans	-82.6	9.8	-164.6	1.7	14.4	0	0	0	116
274	S	31.9	Very low	33.4	Very low	96 Å²	96	105.7 Å²	105.7	67%	0.671	73%	0.734	S	S	*	*			trans	-109.4	20.3	-164.8	65.5	0	0	0	0	116.4	D272	D272-S274 VanDerWaalsContact C-N 3.32Å; D272-S274 PolarHBondContact O-N 2.72Å
275	V	34.2	Very low	35.6	Very low	120 Å²	120	107.2 Å²	107.2	73%	0.727	73%	0.73	S	S	*	*	S	Bend	trans	-123.8	127.1	176.5	-170.6	0	0	0	0	110.6	S277	V275-S277 PolarHBondContact O-N 3.32Å
276	P	30.7	Very low	37.9	Very low	116 Å²	116	105.5 Å²	105.5	75%	0.753	71%	0.705	S	S	*	*			trans	-65.4	131	179	26.1	-31.6	0	0	0	110.5	T278	P276-T278 PolarHBondContact O-N 3.03Å
277	S	26.3	Very low	40.6	Very low	120 Å²	120	103.2 Å²	103.2	84%	0.839	68%	0.679	S	S	*	*			trans	-59	108.4	-176.1	47	0	0	0	0	112.6	V275	V275-S277 PolarHBondContact O-N 3.32Å
278	T	26.9	Very low	43.4	Very low	124 Å²	124	104.4 Å²	104.4	76%	0.761	67%	0.668	S	S	*	*			trans	-84.1	136	153.2	31.7	0	0	0	0	108	P276 S280	P276-T278 PolarHBondContact O-N 3.03Å; T278-S280 PolarHBondContact O-N 2.97Å; T278-S280 VanDerWaalsContact O-N 3.15Å
279	P	33.6	Very low	46.2	Very low	122 Å²	122	106.2 Å²	106.2	79%	0.792	66%	0.659	S	S	*	*			trans	-63	121.6	-179.7	24.8	-30.9	0	0	0	108.9	A281	P279-A281 PolarHBondContact O-N 3.46Å
280	S	33.5	Very low	48.9	Very low	114 Å²	114	102.2 Å²	102.2	80%	0.797	63%	0.631	S	S	*	*			trans	-52.3	104.2	179.6	178.9	0	0	0	0	110.8	T278 C282	T278-S280 PolarHBondContact O-N 2.97Å; T278-S280 VanDerWaalsContact O-N 3.15Å; S280-C282 PolarHBondContact O-N 2.98Å
281	A	34	Very low	51.7	Low	87 Å²	87	100.7 Å²	100.7	72%	0.719	61%	0.609	S	S	*	*			trans	-79.2	53.1	177.9	0	0	0	0	0	111.8	P279	P279-A281 PolarHBondContact O-N 3.46Å
282	C	31.6	Very low	54.4	Low	114 Å²	114	95.1 Å²	95.1	77%	0.77	59%	0.588	S	S	*	*			trans	-132.1	57.9	177.7	-143.8	0	0	0	0	112.4	S280	S280-C282 PolarHBondContact O-N 2.98Å
283	G	49.9	Very low	57.3	Low	37 Å²	37	92.2 Å²	92.2	38%	0.381	57%	0.57	S	S	.	*			trans	-79.2	144.9	156.3	0	0	0	0	0	110
284	S	66.3	Low	59.8	Low	51 Å²	51	86.2 Å²	86.2	36%	0.357	53%	0.531	S	S	.	.			trans	-53.1	146.5	175.9	69.9	0	0	0	0	110.7	V286 L287 K288	S284-V286 PolarHBondContact O-N 2.96Å; S284-V286 VanDerWaalsContact O-N 3.11Å; S284-L287 PolarHBondContact O-N 2.68Å; S284-L287 WeakPolarHBondContact OG-CG 3.35Å; S284-L287 PolarHBondContact OG-N 3.22Å; S284-K288 PolarHBondContact O-N 3.2Å
285	P	77.7	Confident	62.6	Low	106 Å²	106	83.7 Å²	83.7	69%	0.688	51%	0.509	S	S	*	.	H	α-helix	trans	-55.9	-31.3	-179	22.6	-33.8	0	0	0	112.4	K288 Q289	P285-K288 PolarHBondContact O-N 3.29Å; P285-Q289 PolarHBondContact O-N 2.84Å
286	V	78.4	Confident	65.3	Low	38 Å²	38	84.3 Å²	84.3	23%	0.23	50%	0.504	C	S	.	.	H	α-helix	trans	-61.9	-45.2	175.2	179.7	0	0	0	0	111.5	S284 K288 Q289 W290	S284-V286 PolarHBondContact O-N 2.96Å; S284-V286 VanDerWaalsContact O-N 3.11Å; V286-K288 VanDerWaalsContact C-N 3.34Å; V286-K288 PolarHBondContact O-N 3.15Å; V286-Q289 WeakPolarHBondContact O-CB 3.31Å; V286-Q289 PolarHBondContact O-N 3.08Å; V286-W290 PolarHBondContact O-N 2.93Å
287	L	82	Confident	68.2	Low	46 Å²	46	79.4 Å²	79.4	24%	0.241	47%	0.471	C	S	.	.	H	α-helix	trans	-66.7	-35.2	178.2	-70.1	173.1	0	0	0	112.5	L255 S284 Q289 W290 R291	L255-L287 HydrophobicContact CB-CD2 4.31Å; S284-L287 PolarHBondContact O-N 2.68Å; S284-L287 WeakPolarHBondContact OG-CG 3.35Å; S284-L287 PolarHBondContact OG-N 3.22Å; L287-Q289 VanDerWaalsContact C-N 3.35Å; L287-W290 PolarHBondContact O-N 2.88Å; L287-R291 WeakPolarHBondContact O-CB 3.35Å; L287-R291 PolarHBondContact O-N 3.18Å
288	K	85.8	Confident	71.3	Confident	111 Å²	111	74 Å²	74	48%	0.483	43%	0.432	S	S	.	.	H	α-helix	trans	-64.3	-41	173	-66.9	-178.3	-178	177.6	0	111.3	S284 P285 V286 R291 C292	S284-K288 PolarHBondContact O-N 3.2Å; P285-K288 PolarHBondContact O-N 3.29Å; V286-K288 VanDerWaalsContact C-N 3.34Å; V286-K288 PolarHBondContact O-N 3.15Å; K288-R291 WeakPolarHBondContact O-CB 3.25Å; K288-R291 PolarHBondContact O-N 3.19Å; K288-C292 PolarHBondContact O-N 2.9Å; K288-C292 PolarHBondContact O-SG 3.33Å; K288-C292 VanDerWaalsContact O-SG 3.37Å
289	Q	86.9	Confident	74.4	Confident	143 Å²	143	68.3 Å²	68.3	67%	0.668	40%	0.397	S	S	*	.	H	α-helix	trans	-64.3	-44.5	176.3	-173.9	176.7	-4	0	0	111.8	P285 V286 L287 R291 C292 H293	P285-Q289 PolarHBondContact O-N 2.84Å; V286-Q289 WeakPolarHBondContact O-CB 3.31Å; V286-Q289 PolarHBondContact O-N 3.08Å; L287-Q289 VanDerWaalsContact C-N 3.35Å; Q289-R291 PolarHBondContact O-N 3.41Å; Q289-C292 PolarHBondContact O-N 3.35Å; Q289-H293 WeakPolarHBondContact O-CB 3.41Å; Q289-H293 PolarHBondContact O-N 3.35Å
290	W	87.8	Confident	77.2	Confident	30 Å²	30	68.6 Å²	68.6	11%	0.114	38%	0.383	C	S	.	.	H	α-helix	trans	-62.2	-41.4	175	-81.9	108.5	0	0	0	112.7	V216 T217 L220 L252 L255 F259 V286 L287 C292 H293 M294	V216-W290 HydrophobicContact CG1-CH2 3.95Å; V216-W290 HydrophobicContact CG1-CZ2 4.34Å; V216-W290 HydrophobicContact CG1-CZ3 4.26Å; T217-W290 WeakPolarHBondContact OG1-CH2 3.48Å; L220-W290 HydrophobicContact CD1-CE3 3.75Å; L220-W290 HydrophobicContact CD1-CH2 4.47Å; L220-W290 HydrophobicContact CD1-CZ3 3.53Å; L252-W290 HydrophobicContact CD2-CB 4.23Å; L255-W290 HydrophobicContact CD1-CB 4.12Å; L255-W290 HydrophobicContact CD1-CD2 4.41Å; L255-W290 HydrophobicContact CD1-CE3 4.41Å; L255-W290 HydrophobicContact CD1-CG 4.31Å; F259-W290 AromaticContact CE2-CE2 3.93Å; F259-W290 HydrophobicContact CE2-CZ2 4.16Å; F259-W290 AromaticContact CE2-NE1 3.58Å; F259-W290 HydrophobicContact CZ-CZ2 4.04Å; F259-W290 AromaticContact CZ-NE1 3.88Å; V286-W290 PolarHBondContact O-N 2.93Å; L287-W290 PolarHBondContact O-N 2.88Å; W290-C292 PolarHBondContact O-N 3.33Å; W290-H293 AromaticContact CZ3-ND1 3.98Å; W290-H293 PolarHBondContact O-N 3.48Å; W290-M294 WeakPolarHBondContact O-CB 3.49Å; W290-M294 VanDerWaalsContact O-CG 3.28Å; W290-M294 WeakPolarHBondContact O-CG 3.43Å; W290-M294 PolarHBondContact O-N 3.27Å
291	R	89.4	Confident	80	Confident	90 Å²	90	64.1 Å²	64.1	34%	0.34	35%	0.35	S	S	.	.	H	α-helix	trans	-55.2	-53.3	173.2	-179.6	-170.9	-166.6	88.6	3.6	110.8	E249 L252 L287 K288 Q289 H293 M294 H295	E249-R291 IonicContact OE1-CZ 3.91Å; E249-R291 IonicContact OE1-NH1 2.97Å; E249-R291 PolarHBondContact OE1-NH1 3.06Å; E249-R291 IonicContact OE1-NH2 2.74Å; E249-R291 PolarHBondContact OE1-NH2 3.34Å; E249-R291 IonicContact OE2-CZ 2.64Å; E249-R291 IonicContact OE2-NH1 3.69Å; E249-R291 PolarHBondContact OE2-NH1 3.19Å; L252-R291 HydrophobicContact CD1-CB 3.79Å; L252-R291 HydrophobicContact CD1-CG 3.78Å; L252-R291 HydrophobicContact CD2-CB 4.03Å; L287-R291 WeakPolarHBondContact O-CB 3.35Å; L287-R291 PolarHBondContact O-N 3.18Å; K288-R291 WeakPolarHBondContact O-CB 3.25Å; K288-R291 PolarHBondContact O-N 3.19Å; Q289-R291 PolarHBondContact O-N 3.41Å; R291-H293 VanDerWaalsContact C-N 3.34Å; R291-H293 PolarHBondContact O-N 2.86Å; R291-M294 PolarHBondContact O-N 3.33Å; R291-H295 PolarHBondContact O-N 3.21Å; R291-H295 PolarHBondContact O-ND1 2.67Å
292	C	89.8	Confident	82.7	Confident	73 Å²	73	60 Å²	60	49%	0.493	32%	0.316	S	S	.	.	H	α-helix	trans	-60.6	-44.2	179.8	-69.3	0	0	0	0	111.6	K288 Q289 W290 H295 Q296	K288-C292 PolarHBondContact O-N 2.9Å; K288-C292 PolarHBondContact O-SG 3.33Å; K288-C292 VanDerWaalsContact O-SG 3.37Å; Q289-C292 PolarHBondContact O-N 3.35Å; W290-C292 PolarHBondContact O-N 3.33Å; C292-H295 PolarHBondContact O-N 3.39Å; C292-Q296 WeakPolarHBondContact O-CB 3.25Å; C292-Q296 VanDerWaalsContact O-CG 3.31Å; C292-Q296 WeakPolarHBondContact O-CG 3.36Å; C292-Q296 PolarHBondContact O-N 3.48Å
293	H	89.9	Confident	85.7	Confident	71 Å²	71	54.6 Å²	54.6	33%	0.329	28%	0.279	S	S	.	.	H	α-helix	trans	-59.9	-47.7	178.5	179.6	-106.4	0	0	0	111.9	H221 Q289 W290 R291 Q296 F297	H221-H293 AromaticContact NE2-CE1 3.36Å; H221-H293 PolarHBondContact NE2-CE1 3.09Å; H221-H293 AromaticContact NE2-NE2 3.94Å; Q289-H293 WeakPolarHBondContact O-CB 3.41Å; Q289-H293 PolarHBondContact O-N 3.35Å; W290-H293 AromaticContact CZ3-ND1 3.98Å; W290-H293 PolarHBondContact O-N 3.48Å; R291-H293 VanDerWaalsContact C-N 3.34Å; R291-H293 PolarHBondContact O-N 2.86Å; H293-Q296 PolarHBondContact O-N 2.9Å; H293-F297 VanDerWaalsContact O-CB 3.27Å; H293-F297 WeakPolarHBondContact O-CB 3.37Å; H293-F297 PolarHBondContact O-N 2.91Å
294	M	90.3	Very high	87.8	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-64.1	-42.8	178.9	-71.7	169.2	57.7	0	0	112.3	L220 L248 V251 L252 L255 W290 R291 F297 F298	L220-M294 HydrophobicContact CD1-CG 4.22Å; L220-M294 HydrophobicContact CD1-SD 4.21Å; L220-M294 HydrophobicContact CD2-CE 4.22Å; L220-M294 HydrophobicContact CD2-SD 4.17Å; L248-M294 HydrophobicContact CB-CE 4.24Å; L248-M294 HydrophobicContact CD2-CB 4.32Å; L248-M294 HydrophobicContact CD2-CE 3.49Å; L248-M294 VanDerWaalsContact CD2-CE 3.49Å; L248-M294 HydrophobicContact CG-CE 4.45Å; V251-M294 HydrophobicContact CB-CE 3.72Å; V251-M294 HydrophobicContact CG1-CE 3.38Å; V251-M294 HydrophobicContact CG1-SD 4.3Å; L252-M294 HydrophobicContact CD2-SD 3.89Å; L252-M294 HydrophobicContact CG-CE 4.33Å; L252-M294 HydrophobicContact CG-SD 4.17Å; L255-M294 HydrophobicContact CD1-SD 3.47Å; L255-M294 WeakPolarHBondContact CD1-SD 3.41Å; W290-M294 WeakPolarHBondContact O-CB 3.49Å; W290-M294 VanDerWaalsContact O-CG 3.28Å; W290-M294 WeakPolarHBondContact O-CG 3.43Å; W290-M294 PolarHBondContact O-N 3.27Å; R291-M294 PolarHBondContact O-N 3.33Å; M294-F297 PolarHBondContact O-N 3.48Å; M294-F298 VanDerWaalsContact O-CB 3.28Å; M294-F298 WeakPolarHBondContact O-CB 3.46Å; M294-F298 PolarHBondContact O-N 3.44Å
295	H	89.6	Confident	89.1	Confident	43 Å²	43	53 Å²	53	20%	0.199	26%	0.258	C	S	.	.	H	α-helix	trans	-65.2	-42.3	177.4	-75.9	75	0	0	0	111.7	R291 C292 C299	R291-H295 PolarHBondContact O-N 3.21Å; R291-H295 PolarHBondContact O-ND1 2.67Å; C292-H295 PolarHBondContact O-N 3.39Å; H295-C299 WeakPolarHBondContact O-CB 3.47Å; H295-C299 PolarHBondContact O-N 3.36Å; H295-C299 PolarHBondContact O-SG 3.37Å
296	Q	90.7	Very high	89.9	Confident	134 Å²	134	48 Å²	48	63%	0.626	23%	0.225	S	C	*	.	H	α-helix	trans	-64.2	-42.5	175.8	-75	177.4	-12.2	0	0	111.8	C292 H293 C299 R300	C292-Q296 WeakPolarHBondContact O-CB 3.25Å; C292-Q296 VanDerWaalsContact O-CG 3.31Å; C292-Q296 WeakPolarHBondContact O-CG 3.36Å; C292-Q296 PolarHBondContact O-N 3.48Å; H293-Q296 PolarHBondContact O-N 2.9Å; Q296-C299 PolarHBondContact O-N 3.36Å; Q296-R300 WeakPolarHBondContact O-CB 3.49Å; Q296-R300 PolarHBondContact O-N 3.2Å
297	F	91.3	Very high	90.6	Very high	12 Å²	12	46.5 Å²	46.5	5%	0.053	22%	0.216	C	C	.	.	H	α-helix	trans	-64.8	-45	177.8	-175	-99.4	0	0	0	111.8	H221 I224 H293 M294 R300 I301	H221-F297 HydrophobicContact CB-CE1 3.67Å; H221-F297 HydrophobicContact CB-CE2 4.19Å; H221-F297 HydrophobicContact CB-CZ 3.37Å; H221-F297 AromaticContact CD2-CD1 3.52Å; H221-F297 AromaticContact CD2-CD2 3.56Å; H221-F297 AromaticContact CD2-CE1 3.32Å; H221-F297 WeakPolarHBondContact CD2-CE1 3.41Å; H221-F297 AromaticContact CD2-CE2 3.37Å; H221-F297 WeakPolarHBondContact CD2-CE2 3.3Å; H221-F297 AromaticContact CD2-CG 3.63Å; H221-F297 AromaticContact CD2-CZ 3.24Å; H221-F297 WeakPolarHBondContact CD2-CZ 3.29Å; H221-F297 AromaticContact CE1-CD2 3.85Å; H221-F297 AromaticContact CE1-CE2 3.54Å; H221-F297 AromaticContact CG-CE1 3.58Å; H221-F297 AromaticContact CG-CE2 3.48Å; H221-F297 VanDerWaalsContact CG-CE2 3.48Å; H221-F297 AromaticContact CG-CZ 3.14Å; H221-F297 AromaticContact ND1-CE2 3.58Å; H221-F297 AromaticContact ND1-CZ 3.69Å; H221-F297 AromaticContact NE2-CD2 3.35Å; H221-F297 WeakPolarHBondContact NE2-CD2 3.29Å; H221-F297 AromaticContact NE2-CE2 3.42Å; H221-F297 WeakPolarHBondContact NE2-CE2 3.41Å; H221-F297 AromaticContact NE2-CG 3.73Å; H221-F297 AromaticContact NE2-CZ 3.84Å; I224-F297 HydrophobicContact CB-CD1 4.33Å; I224-F297 HydrophobicContact CB-CE1 4.22Å; I224-F297 HydrophobicContact CD1-CD1 3.77Å; I224-F297 HydrophobicContact CD1-CE1 4.34Å; I224-F297 HydrophobicContact CG2-CD1 4.24Å; I224-F297 HydrophobicContact CG2-CE1 4.35Å; H293-F297 VanDerWaalsContact O-CB 3.27Å; H293-F297 WeakPolarHBondContact O-CB 3.37Å; H293-F297 PolarHBondContact O-N 2.91Å; M294-F297 PolarHBondContact O-N 3.48Å; F297-R300 VanDerWaalsContact CD2-NH2 3.27Å; F297-R300 VanDerWaalsContact CE2-NH2 3.27Å; F297-R300 PolarHBondContact O-N 3.48Å; F297-I301 HydrophobicContact CD1-CD1 3.58Å; F297-I301 HydrophobicContact CD2-CD1 4.35Å; F297-I301 HydrophobicContact CE1-CD1 2.97Å; F297-I301 HydrophobicContact CE1-CG1 4.26Å; F297-I301 HydrophobicContact CE2-CD1 3.86Å; F297-I301 HydrophobicContact CG-CD1 4.23Å; F297-I301 HydrophobicContact CZ-CD1 3.14Å; F297-I301 HydrophobicContact CZ-CG1 4.21Å; F297-I301 PolarHBondContact O-N 3.47Å; F297-I301 VanDerWaalsContact O-N 3.1Å
298	F	91.9	Very high	91.2	Very high	6 Å²	6	50.3 Å²	50.3	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-55.2	-55.6	172.1	163.9	-101	0	0	0	111.3	I224 L241 F244 L248 M294 R300 I301 Y302	I224-F298 HydrophobicContact CG2-CB 4.38Å; I224-F298 HydrophobicContact CG2-CD2 4.42Å; L241-F298 HydrophobicContact CD2-CE1 3.8Å; L241-F298 HydrophobicContact CD2-CZ 4.11Å; F244-F298 HydrophobicContact CB-CD2 4.44Å; F244-F298 HydrophobicContact CB-CE2 3.81Å; F244-F298 HydrophobicContact CB-CZ 3.9Å; F244-F298 AromaticContact CD1-CD2 3.7Å; F244-F298 HydrophobicContact CD1-CD2 3.7Å; F244-F298 AromaticContact CD1-CE2 3.38Å; F244-F298 HydrophobicContact CD1-CE2 3.38Å; F244-F298 HydrophobicContact CD1-CZ 4.3Å; F244-F298 HydrophobicContact CD2-CE2 4.2Å; F244-F298 HydrophobicContact CE1-CD2 4.27Å; F244-F298 AromaticContact CE1-CE2 3.94Å; F244-F298 HydrophobicContact CE1-CE2 3.94Å; F244-F298 HydrophobicContact CG-CD2 4.22Å; F244-F298 AromaticContact CG-CE2 3.51Å; F244-F298 HydrophobicContact CG-CE2 3.51Å; F244-F298 HydrophobicContact CG-CZ 4.01Å; L248-F298 HydrophobicContact CD1-CB 4.37Å; L248-F298 HydrophobicContact CD1-CG 4.46Å; M294-F298 VanDerWaalsContact O-CB 3.28Å; M294-F298 WeakPolarHBondContact O-CB 3.46Å; M294-F298 PolarHBondContact O-N 3.44Å; F298-R300 PolarHBondContact O-N 2.87Å; F298-I301 PolarHBondContact O-N 2.87Å; F298-I301 VanDerWaalsContact O-N 3.16Å; F298-Y302 HydrophobicContact CE2-CD2 4.25Å; F298-Y302 HydrophobicContact CE2-CG 4.45Å; F298-Y302 HydrophobicContact CZ-CD2 4.21Å; F298-Y302 HydrophobicContact CZ-CG 4.19Å; F298-Y302 VanDerWaalsContact O-CB 3.3Å; F298-Y302 WeakPolarHBondContact O-CB 3.39Å; F298-Y302 PolarHBondContact O-N 2.98Å
299	C	91.9	Very high	91.6	Very high	5 Å²	5	45.9 Å²	45.9	3%	0.034	21%	0.213	C	C	.	.	H	α-helix	trans	-56.4	-41.1	-179.6	-72.2	0	0	0	0	111.7	H295 Q296 V303 C330 T334	H295-C299 WeakPolarHBondContact O-CB 3.47Å; H295-C299 PolarHBondContact O-N 3.36Å; H295-C299 PolarHBondContact O-SG 3.37Å; Q296-C299 PolarHBondContact O-N 3.36Å; C299-V303 VanDerWaalsContact O-CB 3.3Å; C299-V303 WeakPolarHBondContact O-CB 3.21Å; C299-V303 WeakPolarHBondContact O-CG2 3.39Å; C299-V303 PolarHBondContact O-N 3.26Å; C299-C330 HydrophobicContact CB-CB 4.15Å; C299-T334 HydrophobicContact CB-CG2 3.86Å
300	R	92.7	Very high	92	Very high	129 Å²	129	39.3 Å²	39.3	49%	0.487	18%	0.183	S	C	.	.	H	α-helix	trans	-62.9	-43.9	179.7	-174.9	175.7	68.8	178.8	2.5	112.7	Q296 F297 F298 N304 Q336	Q296-R300 WeakPolarHBondContact O-CB 3.49Å; Q296-R300 PolarHBondContact O-N 3.2Å; F297-R300 VanDerWaalsContact CD2-NH2 3.27Å; F297-R300 VanDerWaalsContact CE2-NH2 3.27Å; F297-R300 PolarHBondContact O-N 3.48Å; F298-R300 PolarHBondContact O-N 2.87Å; R300-N304 PolarHBondContact O-N 3.24Å; R300-N304 VanDerWaalsContact O-N 3.15Å; R300-N304 PolarHBondContact O-ND2 3.18Å; R300-Q336 PolarHBondContact O-OE1 2.89Å
301	I	91.5	Very high	92.4	Very high	20 Å²	20	38.5 Å²	38.5	10%	0.103	18%	0.18	C	C	.	.	H	α-helix	trans	-75.6	-40.1	-179.3	-64.8	166.7	0	0	0	110.9	I224 E225 M228 F297 F298 V303 N304 M305	I224-I301 HydrophobicContact CG2-CD1 4.37Å; E225-I301 HydrophobicContact CG-CD1 3.61Å; E225-I301 HydrophobicContact CG-CG2 4.28Å; M228-I301 HydrophobicContact CE-CB 4.31Å; M228-I301 HydrophobicContact CE-CG2 3.14Å; M228-I301 HydrophobicContact SD-CB 4.32Å; M228-I301 HydrophobicContact SD-CG2 3.67Å; F297-I301 HydrophobicContact CD1-CD1 3.58Å; F297-I301 HydrophobicContact CD2-CD1 4.35Å; F297-I301 HydrophobicContact CE1-CD1 2.97Å; F297-I301 HydrophobicContact CE1-CG1 4.26Å; F297-I301 HydrophobicContact CE2-CD1 3.86Å; F297-I301 HydrophobicContact CG-CD1 4.23Å; F297-I301 HydrophobicContact CZ-CD1 3.14Å; F297-I301 HydrophobicContact CZ-CG1 4.21Å; F297-I301 PolarHBondContact O-N 3.47Å; F297-I301 VanDerWaalsContact O-N 3.1Å; F298-I301 PolarHBondContact O-N 2.87Å; F298-I301 VanDerWaalsContact O-N 3.16Å; I301-V303 VanDerWaalsContact C-N 3.33Å; I301-V303 PolarHBondContact O-N 2.91Å; I301-N304 WeakPolarHBondContact O-CB 3.34Å; I301-N304 PolarHBondContact O-N 3.44Å; I301-N304 VanDerWaalsContact O-N 3.15Å; I301-M305 PolarHBondContact O-N 3.03Å
302	Y	92.5	Very high	92.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.5	-46	175.7	-170.3	-101.4	0	0	0	111.6	M228 C232 F298 N304 M305 R306 D326 C330	M228-Y302 HydrophobicContact CG-CD2 4.34Å; M228-Y302 WeakPolarHBondContact SD-CA 3.17Å; M228-Y302 HydrophobicContact SD-CD2 4.02Å; C232-Y302 HydrophobicContact CB-CE2 4.41Å; F298-Y302 HydrophobicContact CE2-CD2 4.25Å; F298-Y302 HydrophobicContact CE2-CG 4.45Å; F298-Y302 HydrophobicContact CZ-CD2 4.21Å; F298-Y302 HydrophobicContact CZ-CG 4.19Å; F298-Y302 VanDerWaalsContact O-CB 3.3Å; F298-Y302 WeakPolarHBondContact O-CB 3.39Å; F298-Y302 PolarHBondContact O-N 2.98Å; Y302-N304 PolarHBondContact O-N 2.71Å; Y302-M305 HydrophobicContact CD2-CE 3.73Å; Y302-M305 HydrophobicContact CE2-CE 3.8Å; Y302-M305 PolarHBondContact O-N 3.46Å; Y302-R306 HydrophobicContact CD1-CG 4.11Å; Y302-R306 HydrophobicContact CE1-CG 3.79Å; Y302-R306 HydrophobicContact CE2-CG 4.37Å; Y302-R306 WeakPolarHBondContact O-CB 3.48Å; Y302-R306 VanDerWaalsContact O-CG 3.31Å; Y302-R306 WeakPolarHBondContact O-CG 3.42Å; Y302-R306 PolarHBondContact O-N 2.97Å; Y302-R306 PolarHBondContact OH-NE 2.96Å; Y302-R306 VanDerWaalsContact OH-NE 3.12Å; Y302-R306 PolarHBondContact OH-NH2 3.35Å; Y302-D326 HydrophobicContact CE1-CB 3.7Å; Y302-D326 PolarHBondContact OH-OD2 3.49Å; Y302-D326 VanDerWaalsContact OH-OD2 3.13Å; Y302-C330 HydrophobicContact CD1-CB 4.46Å
303	V	94.3	Very high	93	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-61.4	-44.6	174.7	169.4	0	0	0	0	111.2	C299 I301 M305 R306 I307 L327 C330 L331 T334 Q336	C299-V303 VanDerWaalsContact O-CB 3.3Å; C299-V303 WeakPolarHBondContact O-CB 3.21Å; C299-V303 WeakPolarHBondContact O-CG2 3.39Å; C299-V303 PolarHBondContact O-N 3.26Å; I301-V303 VanDerWaalsContact C-N 3.33Å; I301-V303 PolarHBondContact O-N 2.91Å; V303-M305 PolarHBondContact O-N 3.26Å; V303-R306 PolarHBondContact O-N 2.88Å; V303-I307 HydrophobicContact CG1-CD1 3.49Å; V303-I307 VanDerWaalsContact CG1-CD1 3.49Å; V303-I307 HydrophobicContact CG1-CG1 4.13Å; V303-I307 WeakPolarHBondContact O-CB 3.34Å; V303-I307 WeakPolarHBondContact O-CG1 3.43Å; V303-I307 PolarHBondContact O-N 3.49Å; V303-L327 HydrophobicContact CB-CD1 4.36Å; V303-L327 HydrophobicContact CG1-CD1 4.26Å; V303-L327 HydrophobicContact CG2-CD1 4.05Å; V303-C330 HydrophobicContact CG2-CB 3.41Å; V303-C330 VanDerWaalsContact CG2-CB 3.41Å; V303-L331 HydrophobicContact CG1-CD2 3.69Å; V303-L331 HydrophobicContact CG1-CG 4.43Å; V303-L331 HydrophobicContact CG2-CD2 4.39Å; V303-L331 HydrophobicContact CG2-CG 4.41Å; V303-T334 HydrophobicContact CG2-CG2 4.42Å; V303-Q336 HydrophobicContact CG1-CB 3.92Å
304	N	93.6	Very high	93.2	Very high	48 Å²	48	28.4 Å²	28.4	26%	0.257	13%	0.132	S	C	.	.	H	α-helix	trans	-58.6	-49.2	177.6	-79.4	-29.3	0	0	0	112.4	R300 I301 Y302 I307 E308 Q336 Q339	R300-N304 PolarHBondContact O-N 3.24Å; R300-N304 VanDerWaalsContact O-N 3.15Å; R300-N304 PolarHBondContact O-ND2 3.18Å; I301-N304 WeakPolarHBondContact O-CB 3.34Å; I301-N304 PolarHBondContact O-N 3.44Å; I301-N304 VanDerWaalsContact O-N 3.15Å; Y302-N304 PolarHBondContact O-N 2.71Å; N304-I307 PolarHBondContact O-N 3.12Å; N304-E308 PolarHBondContact O-N 2.9Å; N304-Q336 PolarHBondContact OD1-NE2 3.02Å; N304-Q339 PolarHBondContact OD1-NE2 3.18Å; N304-Q339 PolarHBondContact OD1-OE1 3.22Å
305	M	92.9	Very high	93.3	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.039	15%	0.154	C	C	.	.	H	α-helix	trans	-61.1	-48	177.8	176.4	-161.7	60.1	0	0	111.1	M228 C232 R233 I301 Y302 V303 I307 E308 E309	M228-M305 HydrophobicContact CE-CB 3.49Å; M228-M305 VanDerWaalsContact CE-CB 3.49Å; M228-M305 HydrophobicContact CE-CE 4.13Å; M228-M305 HydrophobicContact CE-CG 4.01Å; M228-M305 HydrophobicContact CE-SD 3.62Å; M228-M305 HydrophobicContact CG-CE 3.89Å; M228-M305 HydrophobicContact CG-SD 3.87Å; M228-M305 HydrophobicContact SD-CB 4.42Å; M228-M305 HydrophobicContact SD-CE 3.93Å; M228-M305 HydrophobicContact SD-SD 4.14Å; C232-M305 HydrophobicContact CB-CE 3.74Å; C232-M305 HydrophobicContact CB-SD 4.03Å; R233-M305 HydrophobicContact CB-SD 4.35Å; I301-M305 PolarHBondContact O-N 3.03Å; Y302-M305 HydrophobicContact CD2-CE 3.73Å; Y302-M305 HydrophobicContact CE2-CE 3.8Å; Y302-M305 PolarHBondContact O-N 3.46Å; V303-M305 PolarHBondContact O-N 3.26Å; M305-I307 VanDerWaalsContact C-N 3.28Å; M305-I307 PolarHBondContact O-N 3.2Å; M305-E308 WeakPolarHBondContact O-CB 3.42Å; M305-E308 PolarHBondContact O-N 3.29Å; M305-E308 VanDerWaalsContact O-N 3.11Å; M305-E309 PolarHBondContact O-N 3.28Å; M305-E309 VanDerWaalsContact O-N 3.14Å
306	R	94.1	Very high	93.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-65.6	-29.5	179	-69.1	-63.9	178.8	-121.3	5.1	112.9	C232 E235 Y302 V303 E309 L310 I313 L327	C232-R306 PolarHBondContact O-NH1 2.88Å; C232-R306 PolarHBondContact O-NH2 3.05Å; E235-R306 PolarHBondContact O-NH2 3.07Å; Y302-R306 HydrophobicContact CD1-CG 4.11Å; Y302-R306 HydrophobicContact CE1-CG 3.79Å; Y302-R306 HydrophobicContact CE2-CG 4.37Å; Y302-R306 WeakPolarHBondContact O-CB 3.48Å; Y302-R306 VanDerWaalsContact O-CG 3.31Å; Y302-R306 WeakPolarHBondContact O-CG 3.42Å; Y302-R306 PolarHBondContact O-N 2.97Å; Y302-R306 PolarHBondContact OH-NE 2.96Å; Y302-R306 VanDerWaalsContact OH-NE 3.12Å; Y302-R306 PolarHBondContact OH-NH2 3.35Å; V303-R306 PolarHBondContact O-N 2.88Å; R306-E309 IonicContact CZ-OE2 3.47Å; R306-E309 IonicContact NH1-OE2 3Å; R306-E309 PolarHBondContact NH1-OE2 2.73Å; R306-E309 CarbonylContact O-C 3.51Å; R306-E309 PolarHBondContact O-N 2.94Å; R306-L310 WeakPolarHBondContact O-CA 3.29Å; R306-L310 WeakPolarHBondContact O-CB 3.46Å; R306-L310 PolarHBondContact O-N 3.27Å; R306-I313 HydrophobicContact CB-CD1 4.42Å; R306-L327 HydrophobicContact CB-CD1 3.9Å; R306-L327 HydrophobicContact CB-CD2 4.43Å
307	I	94.8	Very high	93.5	Very high	6 Å²	6	30.3 Å²	30.3	3%	0.031	14%	0.137	C	C	.	.	H	α-helix	trans	-65.9	-39.1	172.5	-75.1	168.2	0	0	0	111.3	V303 N304 M305 E309 L340 S343	V303-I307 HydrophobicContact CG1-CD1 3.49Å; V303-I307 VanDerWaalsContact CG1-CD1 3.49Å; V303-I307 HydrophobicContact CG1-CG1 4.13Å; V303-I307 WeakPolarHBondContact O-CB 3.34Å; V303-I307 WeakPolarHBondContact O-CG1 3.43Å; V303-I307 PolarHBondContact O-N 3.49Å; N304-I307 PolarHBondContact O-N 3.12Å; M305-I307 VanDerWaalsContact C-N 3.28Å; M305-I307 PolarHBondContact O-N 3.2Å; I307-E309 VanDerWaalsContact C-N 3.32Å; I307-L340 HydrophobicContact CD1-CB 3.82Å; I307-L340 HydrophobicContact CG1-CB 3.89Å; I307-L340 HydrophobicContact CG1-CD1 4.15Å; I307-L340 HydrophobicContact CG1-CG 4.07Å; I307-S343 WeakPolarHBondContact CG2-OG 3.3Å
308	E	93.9	Very high	93.4	Very high	127 Å²	127	33.6 Å²	33.6	59%	0.593	16%	0.159	S	C	*	.	H	α-helix	trans	-65.9	-37.2	176	-68.7	179	-173.7	0	0	111.7	R233 N304 M305	R233-E308 IonicContact NH2-OE2 2.72Å; N304-E308 PolarHBondContact O-N 2.9Å; M305-E308 WeakPolarHBondContact O-CB 3.42Å; M305-E308 PolarHBondContact O-N 3.29Å; M305-E308 VanDerWaalsContact O-N 3.11Å
309	E	94.8	Very high	93.4	Very high	18 Å²	18	39.3 Å²	39.3	8%	0.084	19%	0.186	C	C	.	.	H	α-helix	trans	-88.9	-6.7	-178.5	-63.8	179.5	142	0	0	113.7	R233 G234 Y236 M305 R306 I307 F311 S312 I313	R233-E309 WeakPolarHBondContact CG-OE1 3.46Å; G234-E309 PolarHBondContact N-OE1 3.09Å; Y236-E309 HydrophobicContact CE1-CB 4.15Å; M305-E309 PolarHBondContact O-N 3.28Å; M305-E309 VanDerWaalsContact O-N 3.14Å; R306-E309 IonicContact CZ-OE2 3.47Å; R306-E309 IonicContact NH1-OE2 3Å; R306-E309 PolarHBondContact NH1-OE2 2.73Å; R306-E309 CarbonylContact O-C 3.51Å; R306-E309 PolarHBondContact O-N 2.94Å; I307-E309 VanDerWaalsContact C-N 3.32Å; E309-F311 PolarHBondContact O-N 3.13Å; E309-S312 WeakPolarHBondContact O-CA 3.45Å; E309-S312 WeakPolarHBondContact O-CB 3.23Å; E309-S312 PolarHBondContact O-N 2.86Å; E309-I313 HydrophobicContact CB-CD1 4.14Å; E309-I313 HydrophobicContact CB-CG1 4.34Å; E309-I313 PolarHBondContact O-N 3.45Å
310	L	95.6	Very high	93.6	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-55.9	-35.6	-167.5	-173.8	57.1	0	0	0	113.6	R306 S312 I313 I314 L327 L340 L344	R306-L310 WeakPolarHBondContact O-CA 3.29Å; R306-L310 WeakPolarHBondContact O-CB 3.46Å; R306-L310 PolarHBondContact O-N 3.27Å; L310-S312 VanDerWaalsContact C-N 3.35Å; L310-I313 PolarHBondContact O-N 2.87Å; L310-I314 HydrophobicContact CD1-CD1 4.29Å; L310-I314 HydrophobicContact CD1-CG1 4.31Å; L310-I314 HydrophobicContact CG-CD1 3.99Å; L310-I314 HydrophobicContact CG-CG1 4.47Å; L310-I314 WeakPolarHBondContact O-CB 3.29Å; L310-I314 VanDerWaalsContact O-CG1 3.23Å; L310-I314 WeakPolarHBondContact O-CG1 3.47Å; L310-I314 PolarHBondContact O-N 3.41Å; L310-L327 HydrophobicContact CD1-CD2 3.95Å; L310-L340 HydrophobicContact CD2-CD1 3.98Å; L310-L340 HydrophobicContact CD2-CD2 3.85Å; L310-L340 HydrophobicContact CD2-CG 3.73Å; L310-L344 HydrophobicContact CD2-CB 4.35Å; L310-L344 HydrophobicContact CD2-CD1 4.07Å; L310-L344 HydrophobicContact CD2-CD2 3.93Å; L310-L344 HydrophobicContact CD2-CG 4.34Å; L310-L344 HydrophobicContact CG-CD1 4.11Å
311	F	95.5	Very high	93.6	Very high	14 Å²	14	36.6 Å²	36.6	6%	0.061	18%	0.178	C	C	.	.	H	α-helix	trans	-62.5	-42.2	175.1	178.8	-82.5	0	0	0	112.2	E309 I314 R315 A347 F348 R351 L352 V365	E309-F311 PolarHBondContact O-N 3.13Å; F311-I314 PolarHBondContact O-N 3.48Å; F311-R315 PolarHBondContact O-N 2.96Å; F311-R315 VanDerWaalsContact O-N 3.08Å; F311-A347 HydrophobicContact CB-CB 4.13Å; F311-A347 HydrophobicContact CD2-CB 4.37Å; F311-F348 AromaticContact CD2-CD1 3.83Å; F311-F348 HydrophobicContact CD2-CD1 3.83Å; F311-F348 AromaticContact CD2-CE1 3.99Å; F311-F348 HydrophobicContact CD2-CE1 3.99Å; F311-F348 AromaticContact CE2-CD1 3.88Å; F311-F348 HydrophobicContact CE2-CD1 3.88Å; F311-F348 HydrophobicContact CE2-CE1 4.21Å; F311-R351 VanDerWaalsContact CD1-NH1 3.3Å; F311-R351 VanDerWaalsContact CD1-NH2 3.34Å; F311-R351 HydrophobicContact CE1-CB 4.32Å; F311-R351 HydrophobicContact CE2-CB 4.19Å; F311-R351 HydrophobicContact CZ-CB 3.99Å; F311-L352 HydrophobicContact CE2-CB 4.07Å; F311-L352 HydrophobicContact CZ-CB 4.38Å; F311-V365 HydrophobicContact CE2-CG1 4.45Å
312	S	94.9	Very high	93.8	Very high	20 Å²	20	37.2 Å²	37.2	14%	0.14	18%	0.183	C	C	.	.	H	α-helix	trans	-69.9	-41.9	177.6	-55.9	0	0	0	0	110.5	E309 L310 I314 R315 D316	E309-S312 WeakPolarHBondContact O-CA 3.45Å; E309-S312 WeakPolarHBondContact O-CB 3.23Å; E309-S312 PolarHBondContact O-N 2.86Å; L310-S312 VanDerWaalsContact C-N 3.35Å; S312-I314 VanDerWaalsContact C-N 3.31Å; S312-I314 PolarHBondContact O-N 3.23Å; S312-R315 WeakPolarHBondContact O-CB 3.22Å; S312-R315 PolarHBondContact O-N 3.27Å; S312-R315 VanDerWaalsContact O-N 3.12Å; S312-D316 VanDerWaalsContact O-CG 3.22Å; S312-D316 PolarHBondContact O-N 3.28Å
313	I	95.6	Very high	93.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-54.8	-47.7	173.2	-64.5	172.3	0	0	0	110.5	Y236 R306 E309 L310 R315 D316 F317 S320 A323 I324	Y236-I313 HydrophobicContact CD1-CD1 4.1Å; Y236-I313 HydrophobicContact CD1-CG1 3.56Å; Y236-I313 HydrophobicContact CD2-CG1 4.32Å; Y236-I313 HydrophobicContact CE1-CD1 4.08Å; Y236-I313 HydrophobicContact CE1-CG1 3.55Å; Y236-I313 HydrophobicContact CE2-CG1 4.32Å; Y236-I313 HydrophobicContact CG-CG1 3.97Å; R306-I313 HydrophobicContact CB-CD1 4.42Å; E309-I313 HydrophobicContact CB-CD1 4.14Å; E309-I313 HydrophobicContact CB-CG1 4.34Å; E309-I313 PolarHBondContact O-N 3.45Å; L310-I313 PolarHBondContact O-N 2.87Å; I313-R315 VanDerWaalsContact C-N 3.34Å; I313-R315 PolarHBondContact O-N 3.27Å; I313-D316 PolarHBondContact O-N 3.48Å; I313-F317 PolarHBondContact O-N 3.27Å; I313-S320 WeakPolarHBondContact O-CB 3.46Å; I313-S320 PolarHBondContact O-OG 3.35Å; I313-A323 HydrophobicContact CD1-CB 4.5Å; I313-A323 HydrophobicContact CG2-CB 4.44Å; I313-I324 HydrophobicContact CG2-CD1 4.24Å; I313-I324 HydrophobicContact CG2-CG1 3.72Å
314	I	95.5	Very high	93.9	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-63	-40.9	178.7	-73.7	167	0	0	0	111.6	L310 F311 S312 D316 F317 L344 F348 S368 A369 A372 L373	L310-I314 HydrophobicContact CD1-CD1 4.29Å; L310-I314 HydrophobicContact CD1-CG1 4.31Å; L310-I314 HydrophobicContact CG-CD1 3.99Å; L310-I314 HydrophobicContact CG-CG1 4.47Å; L310-I314 WeakPolarHBondContact O-CB 3.29Å; L310-I314 VanDerWaalsContact O-CG1 3.23Å; L310-I314 WeakPolarHBondContact O-CG1 3.47Å; L310-I314 PolarHBondContact O-N 3.41Å; F311-I314 PolarHBondContact O-N 3.48Å; S312-I314 VanDerWaalsContact C-N 3.31Å; S312-I314 PolarHBondContact O-N 3.23Å; I314-D316 VanDerWaalsContact C-N 3.3Å; I314-D316 PolarHBondContact O-N 3.41Å; I314-F317 WeakPolarHBondContact O-CB 3.43Å; I314-F317 PolarHBondContact O-N 3.01Å; I314-L344 HydrophobicContact CD1-CD1 3.83Å; I314-L344 HydrophobicContact CD1-CD2 4.23Å; I314-F348 HydrophobicContact CD1-CZ 4.28Å; I314-S368 WeakPolarHBondContact O-CB 3.45Å; I314-A369 VanDerWaalsContact CG2-CA 3.48Å; I314-A369 HydrophobicContact CG2-CB 3.72Å; I314-A372 HydrophobicContact CG1-CB 4.03Å; I314-L373 HydrophobicContact CD1-CD2 4.24Å; I314-L373 HydrophobicContact CD1-CG 4.47Å
315	R	92.4	Very high	93.9	Very high	127 Å²	127	39.6 Å²	39.6	48%	0.479	19%	0.192	S	C	.	.	H	α-helix	trans	-64.4	-37.3	179.6	-175.6	-167.8	64.1	-168.5	-6.1	111.9	F311 S312 I313 F317	F311-R315 PolarHBondContact O-N 2.96Å; F311-R315 VanDerWaalsContact O-N 3.08Å; S312-R315 WeakPolarHBondContact O-CB 3.22Å; S312-R315 PolarHBondContact O-N 3.27Å; S312-R315 VanDerWaalsContact O-N 3.12Å; I313-R315 VanDerWaalsContact C-N 3.34Å; I313-R315 PolarHBondContact O-N 3.27Å; R315-F317 VanDerWaalsContact C-N 3.3Å; R315-F317 PolarHBondContact O-N 3.32Å
316	D	92.1	Very high	94	Very high	61 Å²	61	39.4 Å²	39.4	33%	0.326	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	7.6	-174.6	-53.5	-16.6	0	0	0	112.3	S312 I313 I314 E319 S320	S312-D316 VanDerWaalsContact O-CG 3.22Å; S312-D316 PolarHBondContact O-N 3.28Å; I313-D316 PolarHBondContact O-N 3.48Å; I314-D316 VanDerWaalsContact C-N 3.3Å; I314-D316 PolarHBondContact O-N 3.41Å; D316-E319 PolarHBondContact O-N 3.16Å; D316-S320 PolarHBondContact O-N 3.09Å
317	F	91.8	Very high	94	Very high	30 Å²	30	39.5 Å²	39.5	13%	0.132	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	134.7	173.4	-173.3	-86.7	0	0	0	110.5	I313 I314 R315 S320 K321 I324 K371 A372	I313-F317 PolarHBondContact O-N 3.27Å; I314-F317 WeakPolarHBondContact O-CB 3.43Å; I314-F317 PolarHBondContact O-N 3.01Å; R315-F317 VanDerWaalsContact C-N 3.3Å; R315-F317 PolarHBondContact O-N 3.32Å; F317-S320 VanDerWaalsContact CA-OG 3.3Å; F317-S320 WeakPolarHBondContact CA-OG 3.28Å; F317-S320 PolarHBondContact N-OG 3.02Å; F317-K321 HydrophobicContact CE2-CB 4.17Å; F317-K321 HydrophobicContact CE2-CG 4.42Å; F317-I324 HydrophobicContact CD2-CD1 3.56Å; F317-I324 HydrophobicContact CE2-CD1 3.96Å; F317-K371 HydrophobicContact CD1-CB 3.78Å; F317-K371 HydrophobicContact CD1-CD 4.27Å; F317-K371 HydrophobicContact CE1-CB 3.31Å; F317-K371 HydrophobicContact CE1-CD 3.93Å; F317-K371 HydrophobicContact CE1-CG 4.21Å; F317-K371 HydrophobicContact CZ-CB 3.92Å; F317-A372 HydrophobicContact CB-CB 4.48Å; F317-A372 HydrophobicContact CD2-CB 3.98Å; F317-A372 HydrophobicContact CE2-CB 4.48Å; F317-A372 HydrophobicContact CG-CB 4.2Å
318	P	90.4	Very high	93.9	Very high	81 Å²	81	42 Å²	42	53%	0.526	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	cis	-92.7	-9.9	22.2	35.8	-37.3	0	0	0	117	S320 K321	P318-S320 PolarHBondContact O-N 3.05Å; P318-K321 VanDerWaalsContact O-CB 3.29Å; P318-K321 WeakPolarHBondContact O-CB 3.49Å; P318-K321 PolarHBondContact O-N 3.2Å; P318-K321 VanDerWaalsContact O-N 3.11Å
319	E	91.8	Very high	93.8	Very high	126 Å²	126	39.1 Å²	39.1	59%	0.589	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-30.8	-176.8	-57.5	-55.8	144.7	0	0	111.8	E237 D316 K321 P322	E237-E319 HydrophobicContact CG-CB 4.35Å; D316-E319 PolarHBondContact O-N 3.16Å; E319-K321 PolarHBondContact O-N 3.46Å; E319-P322 WeakPolarHBondContact O-CD 3.22Å
320	S	95.2	Very high	93.7	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.007	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	8.1	177.2	68.4	0	0	0	0	115.5	I313 D316 F317 P318 P322 A323 I324	I313-S320 WeakPolarHBondContact O-CB 3.46Å; I313-S320 PolarHBondContact O-OG 3.35Å; D316-S320 PolarHBondContact O-N 3.09Å; F317-S320 VanDerWaalsContact CA-OG 3.3Å; F317-S320 WeakPolarHBondContact CA-OG 3.28Å; F317-S320 PolarHBondContact N-OG 3.02Å; P318-S320 PolarHBondContact O-N 3.05Å; S320-P322 VanDerWaalsContact C-CD 3.49Å; S320-A323 PolarHBondContact O-N 2.97Å; S320-I324 PolarHBondContact O-N 3.41Å
321	K	93.9	Very high	93.4	Very high	77 Å²	77	39.1 Å²	39.1	34%	0.335	19%	0.189	S	C	.	.	H	α-helix	trans	-53.9	-44.3	-177.5	-176.2	179.5	-174.4	-169.4	0	113.8	F317 P318 E319 A323 I324 E325	F317-K321 HydrophobicContact CE2-CB 4.17Å; F317-K321 HydrophobicContact CE2-CG 4.42Å; P318-K321 VanDerWaalsContact O-CB 3.29Å; P318-K321 WeakPolarHBondContact O-CB 3.49Å; P318-K321 PolarHBondContact O-N 3.2Å; P318-K321 VanDerWaalsContact O-N 3.11Å; E319-K321 PolarHBondContact O-N 3.46Å; K321-A323 VanDerWaalsContact C-N 3.29Å; K321-A323 PolarHBondContact O-N 3.05Å; K321-I324 WeakPolarHBondContact O-CB 3.49Å; K321-I324 PolarHBondContact O-N 3.12Å; K321-E325 WeakPolarHBondContact CE-OE1 3.25Å; K321-E325 IonicContact NZ-OE1 3.21Å; K321-E325 PolarHBondContact O-N 2.72Å; K321-E325 VanDerWaalsContact O-N 3.11Å
322	P	94.3	Very high	93.1	Very high	32 Å²	32	45.1 Å²	45.1	21%	0.208	22%	0.217	C	C	.	.	H	α-helix	trans	-60.1	-36.8	-179.9	-27.4	39.7	0	0	0	113.2	E237 E319 S320 I324 E325 D326	E237-P322 WeakPolarHBondContact O-CG 3.41Å; E319-P322 WeakPolarHBondContact O-CD 3.22Å; S320-P322 VanDerWaalsContact C-CD 3.49Å; P322-I324 VanDerWaalsContact C-N 3.27Å; P322-I324 PolarHBondContact O-N 2.96Å; P322-E325 PolarHBondContact O-N 2.62Å; P322-D326 PolarHBondContact O-N 3.4Å
323	A	94.6	Very high	92.7	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-64	-32.2	175.9	0	0	0	0	0	113	Y236 I313 S320 K321 L327	Y236-A323 HydrophobicContact CD1-CB 4.49Å; Y236-A323 PolarHBondContact O-N 2.7Å; I313-A323 HydrophobicContact CD1-CB 4.5Å; I313-A323 HydrophobicContact CG2-CB 4.44Å; S320-A323 PolarHBondContact O-N 2.97Å; K321-A323 VanDerWaalsContact C-N 3.29Å; K321-A323 PolarHBondContact O-N 3.05Å; A323-L327 VanDerWaalsContact O-CB 3.28Å; A323-L327 WeakPolarHBondContact O-CB 3.22Å; A323-L327 PolarHBondContact O-N 3.48Å
324	I	95.1	Very high	92.3	Very high	4 Å²	4	51.7 Å²	51.7	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-73.3	-41.1	176.8	-61.8	167.9	0	0	0	110.7	I313 F317 S320 K321 P322 L327 K328 A372 E375 L376	I313-I324 HydrophobicContact CG2-CD1 4.24Å; I313-I324 HydrophobicContact CG2-CG1 3.72Å; F317-I324 HydrophobicContact CD2-CD1 3.56Å; F317-I324 HydrophobicContact CE2-CD1 3.96Å; S320-I324 PolarHBondContact O-N 3.41Å; K321-I324 WeakPolarHBondContact O-CB 3.49Å; K321-I324 PolarHBondContact O-N 3.12Å; P322-I324 VanDerWaalsContact C-N 3.27Å; P322-I324 PolarHBondContact O-N 2.96Å; I324-L327 PolarHBondContact O-N 3.17Å; I324-K328 WeakPolarHBondContact O-CB 3.44Å; I324-K328 PolarHBondContact O-N 3.06Å; I324-A372 HydrophobicContact CD1-CB 3.49Å; I324-A372 VanDerWaalsContact CD1-CB 3.49Å; I324-E375 HydrophobicContact CG2-CB 4.07Å; I324-L376 HydrophobicContact CG2-CB 3.87Å; I324-L376 HydrophobicContact CG2-CD1 4.19Å
325	E	93.9	Very high	91.8	Very high	93 Å²	93	60 Å²	60	44%	0.435	29%	0.286	S	S	.	.	H	α-helix	trans	-63.2	-42.3	175.6	-68.5	178.4	172.6	0	0	111.3	K321 P322 K328 F329	K321-E325 WeakPolarHBondContact CE-OE1 3.25Å; K321-E325 IonicContact NZ-OE1 3.21Å; K321-E325 PolarHBondContact O-N 2.72Å; K321-E325 VanDerWaalsContact O-N 3.11Å; P322-E325 PolarHBondContact O-N 2.62Å; E325-K328 WeakPolarHBondContact O-CB 3.36Å; E325-K328 PolarHBondContact O-N 3Å; E325-F329 PolarHBondContact O-N 3.33Å
326	D	93.9	Very high	91.6	Very high	5 Å²	5	55 Å²	55	3%	0.027	27%	0.267	C	S	.	.	H	α-helix	trans	-62.1	-45.5	173.6	-74.3	-1.5	0	0	0	111.4	S239 F240 L241 Y302 P322 K328 F329 C330	S239-D326 WeakPolarHBondContact CA-OD2 3.39Å; S239-D326 WeakPolarHBondContact CB-OD1 3.34Å; S239-D326 VanDerWaalsContact OG-CG 3.31Å; S239-D326 PolarHBondContact OG-OD1 3.46Å; S239-D326 PolarHBondContact OG-OD2 2.96Å; F240-D326 PolarHBondContact N-OD2 3.31Å; L241-D326 HydrophobicContact CD1-CB 4.14Å; L241-D326 WeakPolarHBondContact CD1-OD1 3.15Å; L241-D326 HydrophobicContact CG-CB 4.08Å; L241-D326 WeakPolarHBondContact CG-OD1 3.39Å; Y302-D326 HydrophobicContact CE1-CB 3.7Å; Y302-D326 PolarHBondContact OH-OD2 3.49Å; Y302-D326 VanDerWaalsContact OH-OD2 3.13Å; P322-D326 PolarHBondContact O-N 3.4Å; D326-K328 VanDerWaalsContact C-N 3.31Å; D326-K328 PolarHBondContact O-N 3.23Å; D326-F329 PolarHBondContact O-N 3.12Å; D326-C330 PolarHBondContact O-N 3.17Å; D326-C330 PolarHBondContact O-SG 2.97Å
327	L	94.3	Very high	91.5	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-60.8	-41.4	177.9	179.5	60.1	0	0	0	111.2	V303 R306 L310 A323 I324 C330 L331 L340 L376	V303-L327 HydrophobicContact CB-CD1 4.36Å; V303-L327 HydrophobicContact CG1-CD1 4.26Å; V303-L327 HydrophobicContact CG2-CD1 4.05Å; R306-L327 HydrophobicContact CB-CD1 3.9Å; R306-L327 HydrophobicContact CB-CD2 4.43Å; L310-L327 HydrophobicContact CD1-CD2 3.95Å; A323-L327 VanDerWaalsContact O-CB 3.28Å; A323-L327 WeakPolarHBondContact O-CB 3.22Å; A323-L327 PolarHBondContact O-N 3.48Å; I324-L327 PolarHBondContact O-N 3.17Å; L327-C330 PolarHBondContact O-N 3.47Å; L327-L331 HydrophobicContact CD1-CD1 4Å; L327-L331 HydrophobicContact CD1-CG 3.94Å; L327-L331 HydrophobicContact CD2-CD1 4.4Å; L327-L331 HydrophobicContact CG-CD1 3.77Å; L327-L331 HydrophobicContact CG-CG 4.19Å; L327-L331 VanDerWaalsContact O-CB 3.28Å; L327-L331 WeakPolarHBondContact O-CB 3.46Å; L327-L331 VanDerWaalsContact O-CG 3.23Å; L327-L331 WeakPolarHBondContact O-CG 2.94Å; L327-L331 PolarHBondContact O-N 3.37Å; L327-L340 HydrophobicContact CD2-CD1 4.19Å; L327-L376 HydrophobicContact CB-CD1 4.17Å; L327-L376 HydrophobicContact CD2-CD1 3.96Å; L327-L376 HydrophobicContact CD2-CD2 4.41Å; L327-L376 HydrophobicContact CG-CD1 3.86Å
328	K	93.4	Very high	91.4	Very high	60 Å²	60	59.9 Å²	59.9	26%	0.261	29%	0.286	S	S	.	.	H	α-helix	trans	-58.2	-51.2	174.5	177.8	-179.2	-174.7	168.7	0	111.5	I324 E325 D326 C330 L331 E332 E375 L376	I324-K328 WeakPolarHBondContact O-CB 3.44Å; I324-K328 PolarHBondContact O-N 3.06Å; E325-K328 WeakPolarHBondContact O-CB 3.36Å; E325-K328 PolarHBondContact O-N 3Å; D326-K328 VanDerWaalsContact C-N 3.31Å; D326-K328 PolarHBondContact O-N 3.23Å; K328-C330 VanDerWaalsContact C-N 3.29Å; K328-C330 PolarHBondContact O-N 3.12Å; K328-L331 PolarHBondContact O-N 3.48Å; K328-E332 PolarHBondContact O-N 3.21Å; K328-E332 VanDerWaalsContact O-N 3.09Å; K328-E375 WeakPolarHBondContact CD-O 3.48Å; K328-E375 PolarHBondContact NZ-O 3.48Å; K328-L376 HydrophobicContact CB-CD1 4.08Å
329	F	92	Very high	91.5	Very high	65 Å²	65	60.5 Å²	60.5	29%	0.285	28%	0.282	S	S	.	.	H	α-helix	trans	-58.5	-39.7	179.1	175.5	-88.7	0	0	0	112.7	L241 E325 D326 R333	L241-F329 HydrophobicContact CD1-CB 3.91Å; L241-F329 HydrophobicContact CD1-CD1 3.58Å; L241-F329 HydrophobicContact CD1-CE1 4.23Å; L241-F329 HydrophobicContact CD1-CG 3.79Å; L241-F329 HydrophobicContact CD2-CD1 4.08Å; L241-F329 HydrophobicContact CD2-CE1 4.42Å; L241-F329 HydrophobicContact CG-CD1 4.5Å; E325-F329 PolarHBondContact O-N 3.33Å; D326-F329 PolarHBondContact O-N 3.12Å; F329-R333 VanDerWaalsContact CZ-NH1 3.25Å; F329-R333 PolarHBondContact O-NH1 2.89Å; F329-R333 VanDerWaalsContact O-NH1 3.16Å
330	C	91.9	Very high	91.6	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-77.1	-33.4	177.9	-67.5	0	0	0	0	112.9	C299 Y302 V303 D326 L327 K328 R333 T334	C299-C330 HydrophobicContact CB-CB 4.15Å; Y302-C330 HydrophobicContact CD1-CB 4.46Å; V303-C330 HydrophobicContact CG2-CB 3.41Å; V303-C330 VanDerWaalsContact CG2-CB 3.41Å; D326-C330 PolarHBondContact O-N 3.17Å; D326-C330 PolarHBondContact O-SG 2.97Å; L327-C330 PolarHBondContact O-N 3.47Å; K328-C330 VanDerWaalsContact C-N 3.29Å; K328-C330 PolarHBondContact O-N 3.12Å; C330-R333 PolarHBondContact O-N 3.46Å; C330-T334 VanDerWaalsContact O-CG2 3.29Å; C330-T334 WeakPolarHBondContact O-CG2 3.34Å; C330-T334 PolarHBondContact O-N 3.08Å; C330-T334 PolarHBondContact O-OG1 3.42Å
331	L	89.9	Confident	91.5	Very high	23 Å²	23	54.7 Å²	54.7	12%	0.12	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-36.2	176.3	-80.6	172.1	0	0	0	112.4	V303 L327 K328 R333 T334 Q336 L340 L376	V303-L331 HydrophobicContact CG1-CD2 3.69Å; V303-L331 HydrophobicContact CG1-CG 4.43Å; V303-L331 HydrophobicContact CG2-CD2 4.39Å; V303-L331 HydrophobicContact CG2-CG 4.41Å; L327-L331 HydrophobicContact CD1-CD1 4Å; L327-L331 HydrophobicContact CD1-CG 3.94Å; L327-L331 HydrophobicContact CD2-CD1 4.4Å; L327-L331 HydrophobicContact CG-CD1 3.77Å; L327-L331 HydrophobicContact CG-CG 4.19Å; L327-L331 VanDerWaalsContact O-CB 3.28Å; L327-L331 WeakPolarHBondContact O-CB 3.46Å; L327-L331 VanDerWaalsContact O-CG 3.23Å; L327-L331 WeakPolarHBondContact O-CG 2.94Å; L327-L331 PolarHBondContact O-N 3.37Å; K328-L331 PolarHBondContact O-N 3.48Å; L331-R333 PolarHBondContact O-N 3.44Å; L331-T334 WeakPolarHBondContact CA-OG1 2.86Å; L331-T334 PolarHBondContact O-N 3.15Å; L331-T334 VanDerWaalsContact O-N 3.16Å; L331-Q336 HydrophobicContact CD2-CB 4.5Å; L331-L340 HydrophobicContact CD1-CD1 3.62Å; L331-L340 HydrophobicContact CD2-CD1 4.33Å; L331-L376 HydrophobicContact CD1-CD1 3.8Å; L331-L376 HydrophobicContact CD1-CD2 4.35Å; L331-L376 HydrophobicContact CD1-CG 4.31Å
332	E	87.6	Confident	91.5	Very high	140 Å²	140	55 Å²	55	65%	0.654	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-24.9	174.6	-71.6	173.4	-177.5	0	0	112.8	K328	K328-E332 PolarHBondContact O-N 3.21Å; K328-E332 VanDerWaalsContact O-N 3.09Å
333	R	87.4	Confident	91.5	Very high	139 Å²	139	55.5 Å²	55.5	53%	0.525	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-4.4	-179.7	-68	175.8	169.4	70.3	2.3	113.3	F329 C330 L331	F329-R333 VanDerWaalsContact CZ-NH1 3.25Å; F329-R333 PolarHBondContact O-NH1 2.89Å; F329-R333 VanDerWaalsContact O-NH1 3.16Å; C330-R333 PolarHBondContact O-N 3.46Å; L331-R333 PolarHBondContact O-N 3.44Å
334	T	86.3	Confident	91.6	Very high	19 Å²	19	55.5 Å²	55.5	12%	0.117	27%	0.267	C	S	.	.	S	Bend	trans	-128.2	145.2	-175.9	59.7	0	0	0	0	111	C299 V303 C330 L331 Q336	C299-T334 HydrophobicContact CB-CG2 3.86Å; V303-T334 HydrophobicContact CG2-CG2 4.42Å; C330-T334 VanDerWaalsContact O-CG2 3.29Å; C330-T334 WeakPolarHBondContact O-CG2 3.34Å; C330-T334 PolarHBondContact O-N 3.08Å; C330-T334 PolarHBondContact O-OG1 3.42Å; L331-T334 WeakPolarHBondContact CA-OG1 2.86Å; L331-T334 PolarHBondContact O-N 3.15Å; L331-T334 VanDerWaalsContact O-N 3.16Å; T334-Q336 PolarHBondContact O-N 3.32Å; T334-Q336 VanDerWaalsContact O-N 3.14Å
335	N	85.5	Confident	91.5	Very high	176 Å²	176	58 Å²	58	94%	0.941	28%	0.278	S	S	*	.	S	Bend	trans	-88.7	42.8	177.6	-71.5	-27.3	0	0	0	112.2
336	Q	88.3	Confident	91.5	Very high	20 Å²	20	56.9 Å²	56.9	9%	0.093	28%	0.28	C	S	.	.			trans	-107.1	8.6	-169.2	-66.1	-176.8	-84.1	0	0	115.2	R300 V303 N304 L331 T334 Q338 Q339 L340	R300-Q336 PolarHBondContact O-OE1 2.89Å; V303-Q336 HydrophobicContact CG1-CB 3.92Å; N304-Q336 PolarHBondContact OD1-NE2 3.02Å; L331-Q336 HydrophobicContact CD2-CB 4.5Å; T334-Q336 PolarHBondContact O-N 3.32Å; T334-Q336 VanDerWaalsContact O-N 3.14Å; Q336-Q338 VanDerWaalsContact C-N 3.31Å; Q336-Q338 PolarHBondContact O-N 2.77Å; Q336-Q339 WeakPolarHBondContact O-CB 3.37Å; Q336-Q339 PolarHBondContact O-N 2.97Å; Q336-L340 PolarHBondContact O-N 3.31Å; Q336-L340 VanDerWaalsContact O-N 3.1Å
337	R	90	Very high	91.6	Very high	70 Å²	70	57.5 Å²	57.5	26%	0.264	29%	0.286	S	S	.	.	H	α-helix	trans	-53	-41.6	179.5	-175.3	166.2	172.9	143.7	2.5	113.9	L340 L341 D377 I382 D451	R337-L340 WeakPolarHBondContact O-CB 3.34Å; R337-L340 PolarHBondContact O-N 3.36Å; R337-L341 PolarHBondContact O-N 3.01Å; R337-L341 VanDerWaalsContact O-N 3.11Å; R337-D377 IonicContact CZ-OD2 3.49Å; R337-D377 IonicContact NH1-OD1 2.69Å; R337-D377 IonicContact NH1-OD2 3.63Å; R337-D377 IonicContact NH2-OD1 3.9Å; R337-D377 IonicContact NH2-OD2 2.74Å; R337-D377 PolarHBondContact NH2-OD2 2.92Å; R337-I382 HydrophobicContact CG-CD1 4.06Å; R337-I382 HydrophobicContact CG-CG1 4.3Å; R337-D451 IonicContact CZ-OD1 2.89Å; R337-D451 IonicContact CZ-OD2 3.56Å; R337-D451 VanDerWaalsContact NE-CG 3.31Å; R337-D451 IonicContact NE-OD1 3.52Å; R337-D451 PolarHBondContact NE-OD1 3.49Å; R337-D451 IonicContact NE-OD2 3.99Å; R337-D451 PolarHBondContact NE-OD2 3.12Å; R337-D451 IonicContact NH2-OD1 2.73Å; R337-D451 PolarHBondContact NH2-OD1 2.95Å; R337-D451 IonicContact NH2-OD2 3.89Å; R337-D451 PolarHBondContact NH2-OD2 3.32Å
338	Q	90.1	Very high	91.6	Very high	125 Å²	125	57.5 Å²	57.5	58%	0.584	29%	0.286	S	S	*	.	H	α-helix	trans	-68.2	-35.7	178.7	-172.2	62.9	23	0	0	113.1	Q336 L341 T342	Q336-Q338 VanDerWaalsContact C-N 3.31Å; Q336-Q338 PolarHBondContact O-N 2.77Å; Q338-L341 PolarHBondContact O-N 3.5Å; Q338-T342 PolarHBondContact O-N 3.29Å; Q338-T342 PolarHBondContact O-OG1 2.84Å
339	Q	92.8	Very high	91.7	Very high	94 Å²	94	60.1 Å²	60.1	44%	0.439	30%	0.299	S	S	.	.	H	α-helix	trans	-66.3	-42.7	176.7	-174.7	-174.3	-10.1	0	0	110.2	N304 Q336 L341 T342 S343	N304-Q339 PolarHBondContact OD1-NE2 3.18Å; N304-Q339 PolarHBondContact OD1-OE1 3.22Å; Q336-Q339 WeakPolarHBondContact O-CB 3.37Å; Q336-Q339 PolarHBondContact O-N 2.97Å; Q339-L341 PolarHBondContact O-N 2.95Å; Q339-T342 PolarHBondContact O-N 3.29Å; Q339-S343 WeakPolarHBondContact O-CB 3.06Å; Q339-S343 PolarHBondContact O-N 2.92Å
340	L	94.3	Very high	91.8	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-56.3	-50.7	173.5	-175.9	155.1	0	0	0	111.2	I307 L310 L327 L331 Q336 R337 T342 S343 L344 L376 I382	I307-L340 HydrophobicContact CD1-CB 3.82Å; I307-L340 HydrophobicContact CG1-CB 3.89Å; I307-L340 HydrophobicContact CG1-CD1 4.15Å; I307-L340 HydrophobicContact CG1-CG 4.07Å; L310-L340 HydrophobicContact CD2-CD1 3.98Å; L310-L340 HydrophobicContact CD2-CD2 3.85Å; L310-L340 HydrophobicContact CD2-CG 3.73Å; L327-L340 HydrophobicContact CD2-CD1 4.19Å; L331-L340 HydrophobicContact CD1-CD1 3.62Å; L331-L340 HydrophobicContact CD2-CD1 4.33Å; Q336-L340 PolarHBondContact O-N 3.31Å; Q336-L340 VanDerWaalsContact O-N 3.1Å; R337-L340 WeakPolarHBondContact O-CB 3.34Å; R337-L340 PolarHBondContact O-N 3.36Å; L340-T342 VanDerWaalsContact C-N 3.33Å; L340-T342 PolarHBondContact O-N 3.36Å; L340-S343 PolarHBondContact O-N 2.83Å; L340-L344 HydrophobicContact CD2-CD2 4.42Å; L340-L344 VanDerWaalsContact O-CB 3.22Å; L340-L344 WeakPolarHBondContact O-CB 3.37Å; L340-L344 PolarHBondContact O-N 3.42Å; L340-L376 HydrophobicContact CD1-CD2 4.06Å; L340-I382 HydrophobicContact CD2-CG2 4.03Å
341	L	92.3	Very high	91.9	Very high	5 Å²	5	65.7 Å²	65.7	3%	0.026	33%	0.33	C	S	.	.	H	α-helix	trans	-58.8	-43.3	179.5	-74.3	173.4	0	0	0	112.7	R337 Q338 Q339 K345 I382 V385 A386	R337-L341 PolarHBondContact O-N 3.01Å; R337-L341 VanDerWaalsContact O-N 3.11Å; Q338-L341 PolarHBondContact O-N 3.5Å; Q339-L341 PolarHBondContact O-N 2.95Å; L341-K345 WeakPolarHBondContact O-CB 3.29Å; L341-K345 VanDerWaalsContact O-CG 3.25Å; L341-K345 WeakPolarHBondContact O-CG 3.33Å; L341-K345 PolarHBondContact O-N 3.14Å; L341-K345 VanDerWaalsContact O-N 3.09Å; L341-I382 HydrophobicContact CD2-CB 4.29Å; L341-I382 HydrophobicContact CD2-CG1 4.22Å; L341-I382 HydrophobicContact CD2-CG2 3.99Å; L341-V385 HydrophobicContact CD1-CG1 4.2Å; L341-V385 HydrophobicContact CD2-CB 4.07Å; L341-V385 HydrophobicContact CD2-CG1 4.07Å; L341-A386 HydrophobicContact CD2-CB 4.15Å
342	T	93.1	Very high	92.1	Very high	83 Å²	83	64.8 Å²	64.8	51%	0.509	33%	0.325	S	S	.	.	H	α-helix	trans	-69.2	-45.5	-178	-51.8	0	0	0	0	111.1	Q338 Q339 L340 S346	Q338-T342 PolarHBondContact O-N 3.29Å; Q338-T342 PolarHBondContact O-OG1 2.84Å; Q339-T342 PolarHBondContact O-N 3.29Å; L340-T342 VanDerWaalsContact C-N 3.33Å; L340-T342 PolarHBondContact O-N 3.36Å; T342-S346 PolarHBondContact O-N 2.89Å; T342-S346 VanDerWaalsContact O-N 3.16Å
343	S	95.4	Very high	92.4	Very high	42 Å²	42	59.3 Å²	59.3	29%	0.294	30%	0.3	S	S	.	.	H	α-helix	trans	-62.6	-48.2	177.3	-174.8	0	0	0	0	111.5	I307 Q339 L340 K345 S346 A347	I307-S343 WeakPolarHBondContact CG2-OG 3.3Å; Q339-S343 WeakPolarHBondContact O-CB 3.06Å; Q339-S343 PolarHBondContact O-N 2.92Å; L340-S343 PolarHBondContact O-N 2.83Å; S343-K345 PolarHBondContact O-N 3.07Å; S343-S346 PolarHBondContact O-N 2.8Å; S343-A347 WeakPolarHBondContact O-CB 3.2Å; S343-A347 PolarHBondContact O-N 3.4Å
344	L	95.4	Very high	92.6	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-65	-40.6	-177.4	-175.2	60.7	0	0	0	112.3	L310 I314 L340 A347 F348 L373 A386	L310-L344 HydrophobicContact CD2-CB 4.35Å; L310-L344 HydrophobicContact CD2-CD1 4.07Å; L310-L344 HydrophobicContact CD2-CD2 3.93Å; L310-L344 HydrophobicContact CD2-CG 4.34Å; L310-L344 HydrophobicContact CG-CD1 4.11Å; I314-L344 HydrophobicContact CD1-CD1 3.83Å; I314-L344 HydrophobicContact CD1-CD2 4.23Å; L340-L344 HydrophobicContact CD2-CD2 4.42Å; L340-L344 VanDerWaalsContact O-CB 3.22Å; L340-L344 WeakPolarHBondContact O-CB 3.37Å; L340-L344 PolarHBondContact O-N 3.42Å; L344-A347 PolarHBondContact O-N 3.32Å; L344-F348 HydrophobicContact CD1-CD2 4.39Å; L344-F348 HydrophobicContact CD1-CE1 4.25Å; L344-F348 HydrophobicContact CD1-CE2 3.84Å; L344-F348 HydrophobicContact CD1-CZ 3.75Å; L344-F348 HydrophobicContact CD2-CE2 3.97Å; L344-F348 HydrophobicContact CD2-CZ 4.31Å; L344-F348 HydrophobicContact CG-CD2 4.09Å; L344-F348 HydrophobicContact CG-CE2 3.58Å; L344-F348 HydrophobicContact CG-CZ 4.01Å; L344-F348 WeakPolarHBondContact O-CD2 3.19Å; L344-F348 PolarHBondContact O-N 3.13Å; L344-L373 HydrophobicContact CD2-CD1 4.19Å; L344-L373 HydrophobicContact CD2-CD2 4.13Å; L344-A386 HydrophobicContact CD2-CB 3.75Å; L344-A386 HydrophobicContact CG-CB 4.34Å
345	K	93.9	Very high	92.8	Very high	57 Å²	57	61.1 Å²	61.1	25%	0.248	32%	0.324	C	S	.	.	H	α-helix	trans	-58.5	-48.3	172.8	-78.8	178	175.3	-172.6	0	111.7	L341 S343 A347 F348 E349 V385	L341-K345 WeakPolarHBondContact O-CB 3.29Å; L341-K345 VanDerWaalsContact O-CG 3.25Å; L341-K345 WeakPolarHBondContact O-CG 3.33Å; L341-K345 PolarHBondContact O-N 3.14Å; L341-K345 VanDerWaalsContact O-N 3.09Å; S343-K345 PolarHBondContact O-N 3.07Å; K345-A347 VanDerWaalsContact C-N 3.29Å; K345-A347 PolarHBondContact O-N 3.03Å; K345-F348 PolarHBondContact O-N 2.91Å; K345-E349 WeakPolarHBondContact O-CG 3.25Å; K345-E349 PolarHBondContact O-N 3.35Å; K345-V385 WeakPolarHBondContact CE-O 3.34Å; K345-V385 VanDerWaalsContact NZ-CG1 3.3Å; K345-V385 PolarHBondContact NZ-O 3.49Å
346	S	94.9	Very high	93.1	Very high	70 Å²	70	56 Å²	56	49%	0.49	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-37.7	178	-174.9	0	0	0	0	111.9	T342 S343 E349 S350	T342-S346 PolarHBondContact O-N 2.89Å; T342-S346 VanDerWaalsContact O-N 3.16Å; S343-S346 PolarHBondContact O-N 2.8Å; S346-E349 PolarHBondContact O-N 3.49Å; S346-S350 WeakPolarHBondContact O-CB 3.32Å; S346-S350 PolarHBondContact O-N 3.13Å; S346-S350 PolarHBondContact O-OG 2.81Å
347	A	95.1	Very high	93.3	Very high	18 Å²	18	56 Å²	56	15%	0.149	31%	0.314	C	S	.	.	H	α-helix	trans	-65.1	-43.4	175.7	0	0	0	0	0	112.3	F311 S343 L344 K345 S350 R351	F311-A347 HydrophobicContact CB-CB 4.13Å; F311-A347 HydrophobicContact CD2-CB 4.37Å; S343-A347 WeakPolarHBondContact O-CB 3.2Å; S343-A347 PolarHBondContact O-N 3.4Å; L344-A347 PolarHBondContact O-N 3.32Å; K345-A347 VanDerWaalsContact C-N 3.29Å; K345-A347 PolarHBondContact O-N 3.03Å; A347-S350 PolarHBondContact O-OG 3.34Å; A347-R351 VanDerWaalsContact O-CB 3.3Å; A347-R351 WeakPolarHBondContact O-CB 3.15Å; A347-R351 PolarHBondContact O-N 3.49Å
348	F	95.2	Very high	93.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-62.9	-46.3	175	-71.1	-41.5	0	0	0	112	F311 I314 L344 K345 S350 L352 L353 V365 A369 A386 I390	F311-F348 AromaticContact CD2-CD1 3.83Å; F311-F348 HydrophobicContact CD2-CD1 3.83Å; F311-F348 AromaticContact CD2-CE1 3.99Å; F311-F348 HydrophobicContact CD2-CE1 3.99Å; F311-F348 AromaticContact CE2-CD1 3.88Å; F311-F348 HydrophobicContact CE2-CD1 3.88Å; F311-F348 HydrophobicContact CE2-CE1 4.21Å; I314-F348 HydrophobicContact CD1-CZ 4.28Å; L344-F348 HydrophobicContact CD1-CD2 4.39Å; L344-F348 HydrophobicContact CD1-CE1 4.25Å; L344-F348 HydrophobicContact CD1-CE2 3.84Å; L344-F348 HydrophobicContact CD1-CZ 3.75Å; L344-F348 HydrophobicContact CD2-CE2 3.97Å; L344-F348 HydrophobicContact CD2-CZ 4.31Å; L344-F348 HydrophobicContact CG-CD2 4.09Å; L344-F348 HydrophobicContact CG-CE2 3.58Å; L344-F348 HydrophobicContact CG-CZ 4.01Å; L344-F348 WeakPolarHBondContact O-CD2 3.19Å; L344-F348 PolarHBondContact O-N 3.13Å; K345-F348 PolarHBondContact O-N 2.91Å; F348-S350 PolarHBondContact O-N 3.42Å; F348-L352 HydrophobicContact CD1-CD2 4.14Å; F348-L352 WeakPolarHBondContact O-CB 3.2Å; F348-L352 PolarHBondContact O-N 3.03Å; F348-L353 HydrophobicContact CB-CD1 4.42Å; F348-L353 WeakPolarHBondContact O-CG 3.2Å; F348-L353 PolarHBondContact O-N 3.3Å; F348-V365 HydrophobicContact CE1-CG1 4.37Å; F348-A369 HydrophobicContact CZ-CB 4.25Å; F348-A386 HydrophobicContact CE2-CB 4.5Å; F348-I390 HydrophobicContact CB-CG1 4.43Å; F348-I390 HydrophobicContact CD1-CD1 3.99Å; F348-I390 HydrophobicContact CD2-CD1 3.8Å; F348-I390 HydrophobicContact CD2-CG1 4.28Å; F348-I390 HydrophobicContact CE1-CD1 4.03Å; F348-I390 HydrophobicContact CE2-CD1 3.81Å; F348-I390 HydrophobicContact CG-CD1 3.9Å; F348-I390 HydrophobicContact CG-CG1 4.24Å; F348-I390 HydrophobicContact CZ-CD1 3.94Å
349	E	94.1	Very high	93.4	Very high	116 Å²	116	53.1 Å²	53.1	54%	0.542	30%	0.303	S	S	.	.	H	α-helix	trans	-63.2	-40.4	179.9	-71.9	176	172.6	0	0	112.8	K345 S346 L353 P389	K345-E349 WeakPolarHBondContact O-CG 3.25Å; K345-E349 PolarHBondContact O-N 3.35Å; S346-E349 PolarHBondContact O-N 3.49Å; E349-L353 HydrophobicContact CG-CD1 4.24Å; E349-P389 HydrophobicContact CG-CB 4.42Å
350	S	93.7	Very high	93.3	Very high	76 Å²	76	50 Å²	50	53%	0.531	29%	0.292	S	S	.	.	H	α-helix	trans	-81	-35.9	-177.2	56.4	0	0	0	0	114.3	S346 A347 F348	S346-S350 WeakPolarHBondContact O-CB 3.32Å; S346-S350 PolarHBondContact O-N 3.13Å; S346-S350 PolarHBondContact O-OG 2.81Å; A347-S350 PolarHBondContact O-OG 3.34Å; F348-S350 PolarHBondContact O-N 3.42Å
351	R	94.4	Very high	93.1	Very high	105 Å²	105	53.1 Å²	53.1	40%	0.396	31%	0.309	S	S	.	.	H	α-helix	trans	-107.3	-19.3	-169.9	-59.7	174.8	64.7	-177.6	-2.8	115	F311 A347 H354	F311-R351 VanDerWaalsContact CD1-NH1 3.3Å; F311-R351 VanDerWaalsContact CD1-NH2 3.34Å; F311-R351 HydrophobicContact CE1-CB 4.32Å; F311-R351 HydrophobicContact CE2-CB 4.19Å; F311-R351 HydrophobicContact CZ-CB 3.99Å; A347-R351 VanDerWaalsContact O-CB 3.3Å; A347-R351 WeakPolarHBondContact O-CB 3.15Å; A347-R351 PolarHBondContact O-N 3.49Å; R351-H354 PolarHBondContact O-NE2 3.43Å
352	L	94.7	Very high	93.1	Very high	5 Å²	5	52.9 Å²	52.9	3%	0.026	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123	-42.9	-172.9	-170.4	70.6	0	0	0	113	F311 F348 H354 V357 I362 V365 I390	F311-L352 HydrophobicContact CE2-CB 4.07Å; F311-L352 HydrophobicContact CZ-CB 4.38Å; F348-L352 HydrophobicContact CD1-CD2 4.14Å; F348-L352 WeakPolarHBondContact O-CB 3.2Å; F348-L352 PolarHBondContact O-N 3.03Å; L352-H354 VanDerWaalsContact C-N 3.26Å; L352-H354 PolarHBondContact O-N 2.88Å; L352-V357 HydrophobicContact CD1-CG1 4.44Å; L352-V357 WeakPolarHBondContact O-CG2 2.99Å; L352-I362 HydrophobicContact CD1-CG1 4.18Å; L352-I362 HydrophobicContact CD2-CG2 4.23Å; L352-I362 HydrophobicContact CG-CG1 4.22Å; L352-I362 HydrophobicContact CG-CG2 4.34Å; L352-V365 HydrophobicContact CD1-CB 4.13Å; L352-V365 HydrophobicContact CD1-CG1 4.35Å; L352-V365 HydrophobicContact CD1-CG2 4.1Å; L352-V365 HydrophobicContact CD2-CB 4.11Å; L352-V365 HydrophobicContact CD2-CG1 3.83Å; L352-I390 HydrophobicContact CD2-CD1 4.45Å
353	L	93.8	Very high	93	Very high	24 Å²	24	49.1 Å²	49.1	13%	0.126	28%	0.284	C	S	.	.	S	Bend	trans	-89.3	52	-169.3	-55.4	-179.8	0	0	0	113	F348 E349 I362 P389 I390 Y393	F348-L353 HydrophobicContact CB-CD1 4.42Å; F348-L353 WeakPolarHBondContact O-CG 3.2Å; F348-L353 PolarHBondContact O-N 3.3Å; E349-L353 HydrophobicContact CG-CD1 4.24Å; L353-I362 HydrophobicContact CD2-CG2 4.45Å; L353-P389 HydrophobicContact CD1-CB 3.77Å; L353-P389 HydrophobicContact CD1-CG 4.43Å; L353-I390 HydrophobicContact CD1-CG1 4.42Å; L353-I390 HydrophobicContact CD2-CB 4.47Å; L353-I390 HydrophobicContact CD2-CG1 4.18Å; L353-Y393 HydrophobicContact CB-CD2 4.31Å; L353-Y393 HydrophobicContact CB-CG 4.27Å; L353-Y393 HydrophobicContact CD2-CD1 3.79Å; L353-Y393 HydrophobicContact CD2-CG 3.89Å
354	H	91.5	Very high	92.8	Very high	75 Å²	75	49.1 Å²	49.1	35%	0.347	28%	0.282	S	S	.	.	S	Bend	trans	-125.9	153.8	174.8	57.9	73.3	0	0	0	112.2	R351 L352 G356 V357 Y393	R351-H354 PolarHBondContact O-NE2 3.43Å; L352-H354 VanDerWaalsContact C-N 3.26Å; L352-H354 PolarHBondContact O-N 2.88Å; H354-G356 PolarHBondContact O-N 2.95Å; H354-V357 WeakPolarHBondContact CE1-CG2 3.07Å; H354-V357 WeakPolarHBondContact ND1-CG2 3.34Å; H354-V357 PolarHBondContact O-N 3.36Å; H354-V357 VanDerWaalsContact O-N 3.14Å; H354-Y393 PolarHBondContact O-OH 3.11Å
355	P	91.2	Very high	92.6	Very high	121 Å²	121	49.7 Å²	49.7	79%	0.786	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.6	-173.7	-27.4	36.1	0	0	0	115.4	V357	P355-V357 VanDerWaalsContact C-N 3.3Å; P355-V357 PolarHBondContact O-N 3.13Å
356	G	90.6	Very high	92.6	Very high	68 Å²	68	47 Å²	47	70%	0.701	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-10.5	178.2	0	0	0	0	0	115.8	H354	H354-G356 PolarHBondContact O-N 2.95Å
357	V	93.4	Very high	92.4	Very high	22 Å²	22	43.8 Å²	43.8	13%	0.133	25%	0.252	C	S	.	.	S	Bend	trans	-92.6	137.1	178.2	-169.7	0	0	0	0	110.6	L352 H354 P355 D361 I362 R397	L352-V357 HydrophobicContact CD1-CG1 4.44Å; L352-V357 WeakPolarHBondContact O-CG2 2.99Å; H354-V357 WeakPolarHBondContact CE1-CG2 3.07Å; H354-V357 WeakPolarHBondContact ND1-CG2 3.34Å; H354-V357 PolarHBondContact O-N 3.36Å; H354-V357 VanDerWaalsContact O-N 3.14Å; P355-V357 VanDerWaalsContact C-N 3.3Å; P355-V357 PolarHBondContact O-N 3.13Å; V357-D361 HydrophobicContact CG1-CB 3.84Å; V357-I362 HydrophobicContact CB-CD1 4.29Å; V357-I362 HydrophobicContact CB-CG1 4.14Å; V357-I362 HydrophobicContact CG1-CD1 4.43Å; V357-I362 HydrophobicContact CG1-CG1 3.76Å; V357-R397 PolarHBondContact O-NH1 3.27Å
358	H	91.1	Very high	92.2	Very high	129 Å²	129	43.7 Å²	43.7	60%	0.597	25%	0.25	S	C	*	.			trans	-67.4	149.2	174.1	-64	-74.3	0	0	0	111.8	S360 D361 I362	H358-S360 PolarHBondContact O-N 2.87Å; H358-D361 IonicContact CD2-OD2 2.8Å; H358-D361 PolarHBondContact O-N 3.38Å; H358-I362 WeakPolarHBondContact O-CG1 3.29Å; H358-I362 PolarHBondContact O-N 3.06Å
359	T	91.5	Very high	92.1	Very high	4 Å²	4	43.7 Å²	43.7	3%	0.025	25%	0.25	C	C	.	.	H	α-helix	trans	-60.3	-37.8	-179.9	-49	0	0	0	0	112.2	D361 I362 L363 R397 D399 T400 Q403	T359-D361 VanDerWaalsContact C-N 3.31Å; T359-D361 PolarHBondContact O-N 3.32Å; T359-I362 PolarHBondContact O-N 3.09Å; T359-L363 HydrophobicContact CG2-CD1 4.23Å; T359-L363 WeakPolarHBondContact O-CG 3.45Å; T359-L363 PolarHBondContact O-N 2.98Å; T359-R397 PolarHBondContact OG1-NE 3.01Å; T359-R397 PolarHBondContact OG1-NH2 3.35Å; T359-D399 WeakPolarHBondContact CB-OD2 3.39Å; T359-D399 PolarHBondContact OG1-OD1 3.27Å; T359-D399 PolarHBondContact OG1-OD2 3.18Å; T359-T400 HydrophobicContact CG2-CG2 3.43Å; T359-T400 VanDerWaalsContact CG2-CG2 3.43Å; T359-Q403 HydrophobicContact CG2-CB 4.37Å; T359-Q403 HydrophobicContact CG2-CG 4.24Å
360	S	89.1	Confident	91.9	Very high	29 Å²	29	38.1 Å²	38.1	20%	0.203	22%	0.224	C	C	.	.	H	α-helix	trans	-52.8	-49.4	174.8	50.9	0	0	0	0	111.3	H358 I362 L363 T364	H358-S360 PolarHBondContact O-N 2.87Å; S360-I362 VanDerWaalsContact C-N 3.34Å; S360-I362 PolarHBondContact O-N 3.44Å; S360-L363 WeakPolarHBondContact O-CB 3.08Å; S360-L363 PolarHBondContact O-N 3.41Å; S360-L363 VanDerWaalsContact O-N 3.14Å; S360-T364 WeakPolarHBondContact O-CG2 3.37Å; S360-T364 PolarHBondContact O-N 2.93Å
361	D	90.8	Very high	91.7	Very high	65 Å²	65	36 Å²	36	35%	0.348	21%	0.205	S	C	.	.	H	α-helix	trans	-72.4	-31.5	-173.2	-49.3	-22.1	0	0	0	111.7	V357 H358 T359 L363 T364 V365	V357-D361 HydrophobicContact CG1-CB 3.84Å; H358-D361 IonicContact CD2-OD2 2.8Å; H358-D361 PolarHBondContact O-N 3.38Å; T359-D361 VanDerWaalsContact C-N 3.31Å; T359-D361 PolarHBondContact O-N 3.32Å; D361-L363 VanDerWaalsContact C-N 3.35Å; D361-T364 WeakPolarHBondContact CA-OG1 3.31Å; D361-T364 PolarHBondContact O-OG1 2.7Å; D361-V365 WeakPolarHBondContact O-CG2 3.48Å; D361-V365 PolarHBondContact O-N 2.89Å; D361-V365 VanDerWaalsContact O-N 3.13Å
362	I	93.2	Very high	91.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-66.7	-41.5	172.5	-57.6	177.3	0	0	0	110.2	L352 L353 V357 H358 T359 S360 Y366 I390 Y393 L394	L352-I362 HydrophobicContact CD1-CG1 4.18Å; L352-I362 HydrophobicContact CD2-CG2 4.23Å; L352-I362 HydrophobicContact CG-CG1 4.22Å; L352-I362 HydrophobicContact CG-CG2 4.34Å; L353-I362 HydrophobicContact CD2-CG2 4.45Å; V357-I362 HydrophobicContact CB-CD1 4.29Å; V357-I362 HydrophobicContact CB-CG1 4.14Å; V357-I362 HydrophobicContact CG1-CD1 4.43Å; V357-I362 HydrophobicContact CG1-CG1 3.76Å; H358-I362 WeakPolarHBondContact O-CG1 3.29Å; H358-I362 PolarHBondContact O-N 3.06Å; T359-I362 PolarHBondContact O-N 3.09Å; S360-I362 VanDerWaalsContact C-N 3.34Å; S360-I362 PolarHBondContact O-N 3.44Å; I362-Y366 VanDerWaalsContact O-CB 3.25Å; I362-Y366 WeakPolarHBondContact O-CB 3.4Å; I362-Y366 PolarHBondContact O-N 3.35Å; I362-I390 HydrophobicContact CG2-CG2 4.28Å; I362-Y393 HydrophobicContact CD1-CD1 4Å; I362-Y393 HydrophobicContact CD1-CE1 3.56Å; I362-L394 HydrophobicContact CB-CD2 4.37Å; I362-L394 HydrophobicContact CG2-CD2 3.82Å; I362-L394 HydrophobicContact CG2-CG 4.29Å
363	L	91	Very high	91.6	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-67.4	-40.6	177.9	-70	172	0	0	0	111.8	T359 S360 D361 Y366 I367 L394 Q403 I404 L470	T359-L363 HydrophobicContact CG2-CD1 4.23Å; T359-L363 WeakPolarHBondContact O-CG 3.45Å; T359-L363 PolarHBondContact O-N 2.98Å; S360-L363 WeakPolarHBondContact O-CB 3.08Å; S360-L363 PolarHBondContact O-N 3.41Å; S360-L363 VanDerWaalsContact O-N 3.14Å; D361-L363 VanDerWaalsContact C-N 3.35Å; L363-Y366 PolarHBondContact O-N 3.31Å; L363-I367 VanDerWaalsContact O-CG1 3.25Å; L363-I367 WeakPolarHBondContact O-CG1 3.28Å; L363-I367 PolarHBondContact O-N 3.43Å; L363-L394 HydrophobicContact CD2-CD1 3.86Å; L363-L394 HydrophobicContact CD2-CD2 4.03Å; L363-L394 HydrophobicContact CG-CD2 4.39Å; L363-Q403 HydrophobicContact CD1-CB 3.91Å; L363-I404 HydrophobicContact CD1-CG1 3.72Å; L363-I404 HydrophobicContact CD2-CD1 4.16Å; L363-I404 HydrophobicContact CD2-CG1 3.94Å; L363-L470 HydrophobicContact CD2-CD2 4.12Å
364	T	90.2	Very high	91.4	Very high	42 Å²	42	33.2 Å²	33.2	26%	0.258	19%	0.193	S	C	.	.	H	α-helix	trans	-62.3	-50.1	176.8	56.1	0	0	0	0	111.5	S360 D361 Y366 I367 S368 A414	S360-T364 WeakPolarHBondContact O-CG2 3.37Å; S360-T364 PolarHBondContact O-N 2.93Å; D361-T364 WeakPolarHBondContact CA-OG1 3.31Å; D361-T364 PolarHBondContact O-OG1 2.7Å; T364-Y366 VanDerWaalsContact C-N 3.25Å; T364-Y366 PolarHBondContact O-N 2.96Å; T364-I367 PolarHBondContact O-N 2.85Å; T364-I367 VanDerWaalsContact O-N 3.15Å; T364-S368 PolarHBondContact O-N 3.38Å; T364-S368 PolarHBondContact O-OG 2.64Å; T364-A414 WeakPolarHBondContact CG2-O 3.25Å
365	V	92.4	Very high	91.3	Very high	13 Å²	13	33 Å²	33	8%	0.079	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-36	177	175.7	0	0	0	0	111	F311 F348 L352 D361 S368 A369	F311-V365 HydrophobicContact CE2-CG1 4.45Å; F348-V365 HydrophobicContact CE1-CG1 4.37Å; L352-V365 HydrophobicContact CD1-CB 4.13Å; L352-V365 HydrophobicContact CD1-CG1 4.35Å; L352-V365 HydrophobicContact CD1-CG2 4.1Å; L352-V365 HydrophobicContact CD2-CB 4.11Å; L352-V365 HydrophobicContact CD2-CG1 3.83Å; D361-V365 WeakPolarHBondContact O-CG2 3.48Å; D361-V365 PolarHBondContact O-N 2.89Å; D361-V365 VanDerWaalsContact O-N 3.13Å; V365-S368 PolarHBondContact O-N 2.77Å; V365-A369 VanDerWaalsContact O-CB 3.22Å; V365-A369 WeakPolarHBondContact O-CB 3.28Å; V365-A369 PolarHBondContact O-N 2.84Å
366	Y	92.4	Very high	91.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.5	-41	175.3	-177.9	-126.6	0	0	0	112.4	I362 L363 T364 A369 I370 C387 I390 R391 L394 L470 I473	I362-Y366 VanDerWaalsContact O-CB 3.25Å; I362-Y366 WeakPolarHBondContact O-CB 3.4Å; I362-Y366 PolarHBondContact O-N 3.35Å; L363-Y366 PolarHBondContact O-N 3.31Å; T364-Y366 VanDerWaalsContact C-N 3.25Å; T364-Y366 PolarHBondContact O-N 2.96Å; Y366-A369 WeakPolarHBondContact O-CB 3.45Å; Y366-A369 PolarHBondContact O-N 2.66Å; Y366-I370 HydrophobicContact CD1-CD1 4.04Å; Y366-I370 HydrophobicContact CD2-CD1 4.41Å; Y366-I370 HydrophobicContact CD2-CG1 4.39Å; Y366-I370 HydrophobicContact CE1-CD1 3.68Å; Y366-I370 HydrophobicContact CE2-CD1 4.06Å; Y366-I370 HydrophobicContact CE2-CG1 4.06Å; Y366-I370 HydrophobicContact CG-CD1 4.4Å; Y366-I370 VanDerWaalsContact O-CG1 3.28Å; Y366-I370 WeakPolarHBondContact O-CG1 3.46Å; Y366-I370 PolarHBondContact O-N 3.47Å; Y366-C387 HydrophobicContact CD2-CB 4.24Å; Y366-C387 HydrophobicContact CE2-CB 3.62Å; Y366-I390 HydrophobicContact CD2-CB 4.4Å; Y366-I390 HydrophobicContact CD2-CD1 4.08Å; Y366-I390 HydrophobicContact CD2-CG2 3.85Å; Y366-I390 HydrophobicContact CE2-CG2 4.49Å; Y366-I390 HydrophobicContact CG-CG2 3.96Å; Y366-R391 PolarHBondContact OH-NE 3.24Å; Y366-L394 HydrophobicContact CD1-CD1 4.32Å; Y366-L470 HydrophobicContact CD1-CD2 3.72Å; Y366-L470 HydrophobicContact CE1-CD2 3.69Å; Y366-L470 HydrophobicContact CE1-CG 4.43Å; Y366-I473 HydrophobicContact CE1-CD1 3.8Å
367	I	90.1	Very high	91.2	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.021	13%	0.127	C	C	.	.	H	α-helix	trans	-63.2	-47.6	174.6	-68.9	163.6	0	0	0	110.1	L363 T364 A369 I370 K371 L418 I466	L363-I367 VanDerWaalsContact O-CG1 3.25Å; L363-I367 WeakPolarHBondContact O-CG1 3.28Å; L363-I367 PolarHBondContact O-N 3.43Å; T364-I367 PolarHBondContact O-N 2.85Å; T364-I367 VanDerWaalsContact O-N 3.15Å; I367-A369 VanDerWaalsContact C-N 3.3Å; I367-A369 PolarHBondContact O-N 3.05Å; I367-I370 PolarHBondContact O-N 3.38Å; I367-I370 VanDerWaalsContact O-N 3.13Å; I367-K371 HydrophobicContact CG2-CD 4.35Å; I367-K371 WeakPolarHBondContact O-CG 3.4Å; I367-K371 PolarHBondContact O-N 3.24Å; I367-L418 HydrophobicContact CD1-CB 4.37Å; I367-L418 HydrophobicContact CD1-CD1 4.27Å; I367-I466 HydrophobicContact CG1-CG2 4.18Å; I367-I466 HydrophobicContact CG2-CG2 4.39Å
368	S	91.5	Very high	90.7	Very high	15 Å²	15	28.5 Å²	28.5	11%	0.105	15%	0.15	C	C	.	.	H	α-helix	trans	-61.7	-38.1	175.7	-56.5	0	0	0	0	111.8	I314 T364 V365 I370 K371 A372	I314-S368 WeakPolarHBondContact O-CB 3.45Å; T364-S368 PolarHBondContact O-N 3.38Å; T364-S368 PolarHBondContact O-OG 2.64Å; V365-S368 PolarHBondContact O-N 2.77Å; S368-I370 PolarHBondContact O-N 2.72Å; S368-K371 PolarHBondContact O-N 2.95Å; S368-A372 WeakPolarHBondContact O-CB 3.43Å; S368-A372 PolarHBondContact O-N 2.78Å
369	A	93.7	Very high	90.2	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.2	-39.7	173.8	0	0	0	0	0	112.1	I314 F348 V365 Y366 I367 L373	I314-A369 VanDerWaalsContact CG2-CA 3.48Å; I314-A369 HydrophobicContact CG2-CB 3.72Å; F348-A369 HydrophobicContact CZ-CB 4.25Å; V365-A369 VanDerWaalsContact O-CB 3.22Å; V365-A369 WeakPolarHBondContact O-CB 3.28Å; V365-A369 PolarHBondContact O-N 2.84Å; Y366-A369 WeakPolarHBondContact O-CB 3.45Å; Y366-A369 PolarHBondContact O-N 2.66Å; I367-A369 VanDerWaalsContact C-N 3.3Å; I367-A369 PolarHBondContact O-N 3.05Å; A369-L373 WeakPolarHBondContact O-CB 3.42Å; A369-L373 WeakPolarHBondContact O-CG 3.41Å; A369-L373 PolarHBondContact O-N 3.02Å
370	I	90.4	Very high	89.8	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.2	-44.5	175.9	-67.9	162.6	0	0	0	110.7	Y366 I367 S368 R374 L383 I466 L469	Y366-I370 HydrophobicContact CD1-CD1 4.04Å; Y366-I370 HydrophobicContact CD2-CD1 4.41Å; Y366-I370 HydrophobicContact CD2-CG1 4.39Å; Y366-I370 HydrophobicContact CE1-CD1 3.68Å; Y366-I370 HydrophobicContact CE2-CD1 4.06Å; Y366-I370 HydrophobicContact CE2-CG1 4.06Å; Y366-I370 HydrophobicContact CG-CD1 4.4Å; Y366-I370 VanDerWaalsContact O-CG1 3.28Å; Y366-I370 WeakPolarHBondContact O-CG1 3.46Å; Y366-I370 PolarHBondContact O-N 3.47Å; I367-I370 PolarHBondContact O-N 3.38Å; I367-I370 VanDerWaalsContact O-N 3.13Å; S368-I370 PolarHBondContact O-N 2.72Å; I370-R374 VanDerWaalsContact O-CB 3.25Å; I370-R374 WeakPolarHBondContact O-CB 3.33Å; I370-R374 PolarHBondContact O-N 2.8Å; I370-L383 HydrophobicContact CB-CD1 4.14Å; I370-L383 HydrophobicContact CG1-CD1 4.15Å; I370-L383 HydrophobicContact CG2-CD1 4Å; I370-I466 HydrophobicContact CB-CG1 4.44Å; I370-I466 HydrophobicContact CD1-CG2 4.15Å; I370-I466 HydrophobicContact CG2-CG1 3.67Å; I370-L469 HydrophobicContact CD1-CB 4.24Å; I370-L469 HydrophobicContact CD1-CD2 4.15Å; I370-L469 HydrophobicContact CG1-CD2 4.09Å; I370-L469 HydrophobicContact CG2-CD2 4.36Å
371	K	89.8	Confident	89.6	Confident	31 Å²	31	23.2 Å²	23.2	14%	0.135	13%	0.126	C	C	.	.	H	α-helix	trans	-66.3	-49.2	179.3	-64.4	175.1	178.6	-177.6	0	111.2	F317 I367 S368 E375 D417 E421 I466	F317-K371 HydrophobicContact CD1-CB 3.78Å; F317-K371 HydrophobicContact CD1-CD 4.27Å; F317-K371 HydrophobicContact CE1-CB 3.31Å; F317-K371 HydrophobicContact CE1-CD 3.93Å; F317-K371 HydrophobicContact CE1-CG 4.21Å; F317-K371 HydrophobicContact CZ-CB 3.92Å; I367-K371 HydrophobicContact CG2-CD 4.35Å; I367-K371 WeakPolarHBondContact O-CG 3.4Å; I367-K371 PolarHBondContact O-N 3.24Å; S368-K371 PolarHBondContact O-N 2.95Å; K371-E375 PolarHBondContact O-N 3.31Å; K371-D417 IonicContact NZ-OD2 2.85Å; K371-D417 PolarHBondContact NZ-OD2 3.35Å; K371-E421 WeakPolarHBondContact CE-OE1 3.47Å; K371-E421 IonicContact NZ-OE1 3.7Å; K371-I466 HydrophobicContact CD-CD1 4.45Å; K371-I466 HydrophobicContact CG-CD1 3.88Å
372	A	93.6	Very high	89.5	Confident	2 Å²	2	20.3 Å²	20.3	2%	0.017	11%	0.11	C	C	.	.	H	α-helix	trans	-64.7	-48.7	-179	0	0	0	0	0	113.3	I314 F317 I324 S368 R374 E375 L376	I314-A372 HydrophobicContact CG1-CB 4.03Å; F317-A372 HydrophobicContact CB-CB 4.48Å; F317-A372 HydrophobicContact CD2-CB 3.98Å; F317-A372 HydrophobicContact CE2-CB 4.48Å; F317-A372 HydrophobicContact CG-CB 4.2Å; I324-A372 HydrophobicContact CD1-CB 3.49Å; I324-A372 VanDerWaalsContact CD1-CB 3.49Å; S368-A372 WeakPolarHBondContact O-CB 3.43Å; S368-A372 PolarHBondContact O-N 2.78Å; A372-R374 VanDerWaalsContact C-N 3.26Å; A372-R374 PolarHBondContact O-N 3.44Å; A372-E375 PolarHBondContact O-N 3.48Å; A372-L376 PolarHBondContact O-N 3.16Å
373	L	92.7	Very high	89.4	Confident	1 Å²	1	20.4 Å²	20.4	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-72.6	-20.6	-176.4	-63.3	176.9	0	0	0	113	I314 L344 A369 L376 D377 I382 L383	I314-L373 HydrophobicContact CD1-CD2 4.24Å; I314-L373 HydrophobicContact CD1-CG 4.47Å; L344-L373 HydrophobicContact CD2-CD1 4.19Å; L344-L373 HydrophobicContact CD2-CD2 4.13Å; A369-L373 WeakPolarHBondContact O-CB 3.42Å; A369-L373 WeakPolarHBondContact O-CG 3.41Å; A369-L373 PolarHBondContact O-N 3.02Å; L373-L376 HydrophobicContact CD2-CD2 3.96Å; L373-D377 PolarHBondContact O-N 3.26Å; L373-I382 HydrophobicContact CD2-CG2 4.11Å; L373-L383 HydrophobicContact CB-CB 4.01Å; L373-L383 HydrophobicContact CB-CD1 4.4Å; L373-L383 HydrophobicContact CB-CG 4.4Å; L373-L383 HydrophobicContact CD1-CB 4.26Å; L373-L383 HydrophobicContact CD1-CG 4.46Å
374	R	89	Confident	89.1	Confident	72 Å²	72	23.7 Å²	23.7	27%	0.272	13%	0.126	S	C	.	.	H	α-helix	trans	-68.2	-41.8	171.4	-179	-172.3	-49.4	-172.7	0.8	112.1	I370 A372 L376 D377 M380 S464	I370-R374 VanDerWaalsContact O-CB 3.25Å; I370-R374 WeakPolarHBondContact O-CB 3.33Å; I370-R374 PolarHBondContact O-N 2.8Å; A372-R374 VanDerWaalsContact C-N 3.26Å; A372-R374 PolarHBondContact O-N 3.44Å; R374-L376 VanDerWaalsContact C-N 3.31Å; R374-D377 CarbonylContact O-C 3.58Å; R374-M380 HydrophobicContact CB-CE 4.39Å; R374-M380 HydrophobicContact CB-SD 3.7Å; R374-M380 HydrophobicContact CG-CE 4.4Å; R374-M380 HydrophobicContact CG-SD 3.74Å; R374-S464 PolarHBondContact NH1-O 2.63Å; R374-S464 PolarHBondContact NH2-O 3.25Å
375	E	90.8	Very high	89	Confident	72 Å²	72	22.4 Å²	22.4	34%	0.336	12%	0.118	S	C	.	.	H	α-helix	trans	-64.4	-40.8	175.1	-66.4	-65.6	162.7	0	0	110.6	I324 K328 K371 A372	I324-E375 HydrophobicContact CG2-CB 4.07Å; K328-E375 WeakPolarHBondContact CD-O 3.48Å; K328-E375 PolarHBondContact NZ-O 3.48Å; K371-E375 PolarHBondContact O-N 3.31Å; A372-E375 PolarHBondContact O-N 3.48Å
376	L	91.6	Very high	88.9	Confident	11 Å²	11	21.8 Å²	21.8	6%	0.058	11%	0.114	C	C	.	.	H	α-helix	trans	-64.4	-49	178.5	-171.4	65.5	0	0	0	113	I324 L327 K328 L331 L340 A372 L373 R374	I324-L376 HydrophobicContact CG2-CB 3.87Å; I324-L376 HydrophobicContact CG2-CD1 4.19Å; L327-L376 HydrophobicContact CB-CD1 4.17Å; L327-L376 HydrophobicContact CD2-CD1 3.96Å; L327-L376 HydrophobicContact CD2-CD2 4.41Å; L327-L376 HydrophobicContact CG-CD1 3.86Å; K328-L376 HydrophobicContact CB-CD1 4.08Å; L331-L376 HydrophobicContact CD1-CD1 3.8Å; L331-L376 HydrophobicContact CD1-CD2 4.35Å; L331-L376 HydrophobicContact CD1-CG 4.31Å; L340-L376 HydrophobicContact CD1-CD2 4.06Å; A372-L376 PolarHBondContact O-N 3.16Å; L373-L376 HydrophobicContact CD2-CD2 3.96Å; R374-L376 VanDerWaalsContact C-N 3.31Å
377	D	87.7	Confident	88.8	Confident	12 Å²	12	21.8 Å²	21.8	6%	0.064	11%	0.114	C	C	.	.			trans	-133.4	97.8	-174.9	-179.2	21.5	0	0	0	111	R337 L373 R374 S379 M380 V381 I382	R337-D377 IonicContact CZ-OD2 3.49Å; R337-D377 IonicContact NH1-OD1 2.69Å; R337-D377 IonicContact NH1-OD2 3.63Å; R337-D377 IonicContact NH2-OD1 3.9Å; R337-D377 IonicContact NH2-OD2 2.74Å; R337-D377 PolarHBondContact NH2-OD2 2.92Å; L373-D377 PolarHBondContact O-N 3.26Å; R374-D377 CarbonylContact O-C 3.58Å; D377-S379 PolarHBondContact O-N 3.41Å; D377-S379 WeakPolarHBondContact OD1-CB 3.46Å; D377-S379 PolarHBondContact OD1-N 3.11Å; D377-S379 PolarHBondContact OD1-OG 3.49Å; D377-S379 PolarHBondContact OD2-OG 3.37Å; D377-M380 PolarHBondContact O-N 3.01Å; D377-V381 PolarHBondContact OD2-N 3.11Å; D377-I382 HydrophobicContact CB-CB 4.15Å; D377-I382 HydrophobicContact CB-CD1 3.8Å; D377-I382 HydrophobicContact CB-CG1 4.33Å; D377-I382 PolarHBondContact OD2-N 2.9Å
378	P	82.1	Confident	88.8	Confident	93 Å²	93	27.2 Å²	27.2	60%	0.604	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.6	177.5	-25.9	34.9	0	0	0	113.8	M380	P378-M380 PolarHBondContact O-N 3.42Å
379	S	81.3	Confident	88.8	Confident	34 Å²	34	27.6 Å²	27.6	24%	0.238	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-12.1	177.3	76.4	0	0	0	0	113.8	D377 V381 R462	D377-S379 PolarHBondContact O-N 3.41Å; D377-S379 WeakPolarHBondContact OD1-CB 3.46Å; D377-S379 PolarHBondContact OD1-N 3.11Å; D377-S379 PolarHBondContact OD1-OG 3.49Å; D377-S379 PolarHBondContact OD2-OG 3.37Å; S379-V381 PolarHBondContact O-N 2.95Å; S379-V381 VanDerWaalsContact O-N 3.07Å; S379-R462 VanDerWaalsContact O-CD 3.3Å; S379-R462 WeakPolarHBondContact O-CD 3.44Å; S379-R462 PolarHBondContact O-NH1 3.34Å; S379-R462 VanDerWaalsContact O-NH1 3.15Å
380	M	82.6	Confident	88.8	Confident	14 Å²	14	27.6 Å²	27.6	7%	0.069	14%	0.142	C	C	.	.			trans	60.7	9.8	-178.7	-60	-75.3	-91.3	0	0	114.7	R374 D377 P378 L383 Q384	R374-M380 HydrophobicContact CB-CE 4.39Å; R374-M380 HydrophobicContact CB-SD 3.7Å; R374-M380 HydrophobicContact CG-CE 4.4Å; R374-M380 HydrophobicContact CG-SD 3.74Å; D377-M380 PolarHBondContact O-N 3.01Å; P378-M380 PolarHBondContact O-N 3.42Å; M380-L383 HydrophobicContact CE-CD1 3.63Å; M380-L383 PolarHBondContact O-N 3.29Å; M380-L383 HydrophobicContact SD-CD1 3.92Å; M380-Q384 WeakPolarHBondContact O-CG 3.2Å; M380-Q384 PolarHBondContact O-N 2.62Å
381	V	85.3	Confident	88.8	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.012	15%	0.149	C	C	.	.	H	α-helix	trans	-70	-43.6	-178.9	171.4	0	0	0	0	110.7	D377 S379 L383 Q384 V385 P449 D451 A452	D377-V381 PolarHBondContact OD2-N 3.11Å; S379-V381 PolarHBondContact O-N 2.95Å; S379-V381 VanDerWaalsContact O-N 3.07Å; V381-L383 VanDerWaalsContact C-N 3.27Å; V381-L383 PolarHBondContact O-N 3.3Å; V381-Q384 PolarHBondContact O-N 3.48Å; V381-V385 HydrophobicContact CG1-CG2 4.36Å; V381-V385 WeakPolarHBondContact O-CG2 3.29Å; V381-V385 PolarHBondContact O-N 2.88Å; V381-P449 HydrophobicContact CB-CG 4.05Å; V381-P449 HydrophobicContact CG1-CG 4.22Å; V381-P449 HydrophobicContact CG2-CG 3.7Å; V381-D451 WeakPolarHBondContact CG1-OD2 3.29Å; V381-A452 HydrophobicContact CG1-CB 4.17Å; V381-A452 HydrophobicContact CG2-CB 4.12Å
382	I	88.8	Confident	88.9	Confident	5 Å²	5	35.7 Å²	35.7	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-57	-44.8	176.5	-76.8	162.5	0	0	0	110.7	R337 L340 L341 L373 D377 V385 A386	R337-I382 HydrophobicContact CG-CD1 4.06Å; R337-I382 HydrophobicContact CG-CG1 4.3Å; L340-I382 HydrophobicContact CD2-CG2 4.03Å; L341-I382 HydrophobicContact CD2-CB 4.29Å; L341-I382 HydrophobicContact CD2-CG1 4.22Å; L341-I382 HydrophobicContact CD2-CG2 3.99Å; L373-I382 HydrophobicContact CD2-CG2 4.11Å; D377-I382 HydrophobicContact CB-CB 4.15Å; D377-I382 HydrophobicContact CB-CD1 3.8Å; D377-I382 HydrophobicContact CB-CG1 4.33Å; D377-I382 PolarHBondContact OD2-N 2.9Å; I382-V385 PolarHBondContact O-N 2.83Å; I382-A386 WeakPolarHBondContact O-CB 3.35Å; I382-A386 PolarHBondContact O-N 2.98Å
383	L	89.9	Confident	88.8	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-59.9	-49.4	177.6	-175.9	165.7	0	0	0	111.5	I370 L373 M380 V381 V385 C387 R391 L469	I370-L383 HydrophobicContact CB-CD1 4.14Å; I370-L383 HydrophobicContact CG1-CD1 4.15Å; I370-L383 HydrophobicContact CG2-CD1 4Å; L373-L383 HydrophobicContact CB-CB 4.01Å; L373-L383 HydrophobicContact CB-CD1 4.4Å; L373-L383 HydrophobicContact CB-CG 4.4Å; L373-L383 HydrophobicContact CD1-CB 4.26Å; L373-L383 HydrophobicContact CD1-CG 4.46Å; M380-L383 HydrophobicContact CE-CD1 3.63Å; M380-L383 PolarHBondContact O-N 3.29Å; M380-L383 HydrophobicContact SD-CD1 3.92Å; V381-L383 VanDerWaalsContact C-N 3.27Å; V381-L383 PolarHBondContact O-N 3.3Å; L383-V385 VanDerWaalsContact C-N 3.31Å; L383-V385 PolarHBondContact O-N 3.48Å; L383-C387 VanDerWaalsContact O-CB 3.22Å; L383-C387 WeakPolarHBondContact O-CB 3.23Å; L383-C387 PolarHBondContact O-N 2.74Å; L383-C387 PolarHBondContact O-SG 3Å; L383-R391 VanDerWaalsContact CD2-NH2 3.34Å; L383-L469 HydrophobicContact CD1-CD2 4.32Å; L383-L469 HydrophobicContact CD2-CD2 3.56Å
384	Q	85.3	Confident	88.7	Confident	73 Å²	73	37.8 Å²	37.8	34%	0.341	18%	0.183	S	C	.	.	H	α-helix	trans	-59.2	-43.6	-179.2	-76	-171	-23.7	0	0	112.2	M380 V381 Q388 R462	M380-Q384 WeakPolarHBondContact O-CG 3.2Å; M380-Q384 PolarHBondContact O-N 2.62Å; V381-Q384 PolarHBondContact O-N 3.48Å; Q384-Q388 PolarHBondContact O-N 3.27Å; Q384-R462 VanDerWaalsContact OE1-NE 3.11Å
385	V	88.1	Confident	88.8	Confident	16 Å²	16	41.4 Å²	41.4	10%	0.097	20%	0.197	C	C	.	.	H	α-helix	trans	-74.6	-46.6	-177.4	178.5	0	0	0	0	111	L341 K345 V381 I382 L383 V453	L341-V385 HydrophobicContact CD1-CG1 4.2Å; L341-V385 HydrophobicContact CD2-CB 4.07Å; L341-V385 HydrophobicContact CD2-CG1 4.07Å; K345-V385 WeakPolarHBondContact CE-O 3.34Å; K345-V385 VanDerWaalsContact NZ-CG1 3.3Å; K345-V385 PolarHBondContact NZ-O 3.49Å; V381-V385 HydrophobicContact CG1-CG2 4.36Å; V381-V385 WeakPolarHBondContact O-CG2 3.29Å; V381-V385 PolarHBondContact O-N 2.88Å; I382-V385 PolarHBondContact O-N 2.83Å; L383-V385 VanDerWaalsContact C-N 3.31Å; L383-V385 PolarHBondContact O-N 3.48Å; V385-V453 HydrophobicContact CG2-CG2 3.99Å
386	A	90.8	Very high	88.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-69.8	-36	-176.8	0	0	0	0	0	113.1	L341 L344 F348 I382 P389	L341-A386 HydrophobicContact CD2-CB 4.15Å; L344-A386 HydrophobicContact CD2-CB 3.75Å; L344-A386 HydrophobicContact CG-CB 4.34Å; F348-A386 HydrophobicContact CE2-CB 4.5Å; I382-A386 WeakPolarHBondContact O-CB 3.35Å; I382-A386 PolarHBondContact O-N 2.98Å; A386-P389 VanDerWaalsContact O-CD 3.29Å; A386-P389 WeakPolarHBondContact O-CD 3.28Å; A386-P389 WeakPolarHBondContact O-CG 3.21Å
387	C	90.7	Very high	88.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-2.3	-177.1	-61.7	0	0	0	0	114.3	Y366 L383 I390 R391	Y366-C387 HydrophobicContact CD2-CB 4.24Å; Y366-C387 HydrophobicContact CE2-CB 3.62Å; L383-C387 VanDerWaalsContact O-CB 3.22Å; L383-C387 WeakPolarHBondContact O-CB 3.23Å; L383-C387 PolarHBondContact O-N 2.74Å; L383-C387 PolarHBondContact O-SG 3Å; C387-I390 HydrophobicContact CB-CD1 4.33Å; C387-I390 WeakPolarHBondContact O-CB 3.45Å; C387-I390 PolarHBondContact O-N 3.29Å; C387-I390 VanDerWaalsContact O-N 3.09Å; C387-R391 WeakPolarHBondContact O-CG 3.35Å; C387-R391 PolarHBondContact O-N 2.83Å
388	Q	89.5	Confident	88.3	Confident	117 Å²	117	53.4 Å²	53.4	55%	0.547	26%	0.258	S	S	.	.	H	α-helix	trans	-48.2	-48.1	172.6	-171.7	-173.7	12.6	0	0	114	Q384 I390 R391 K392	Q384-Q388 PolarHBondContact O-N 3.27Å; Q388-I390 VanDerWaalsContact C-N 3.34Å; Q388-I390 PolarHBondContact O-N 2.83Å; Q388-R391 PolarHBondContact O-N 3.23Å; Q388-K392 PolarHBondContact O-N 3Å
389	P	92.3	Very high	88.4	Confident	23 Å²	23	52.1 Å²	52.1	15%	0.149	25%	0.246	C	C	.	.	H	α-helix	trans	-63.5	-37	177.1	25	-36.2	0	0	0	112.9	E349 L353 A386 K392 Y393	E349-P389 HydrophobicContact CG-CB 4.42Å; L353-P389 HydrophobicContact CD1-CB 3.77Å; L353-P389 HydrophobicContact CD1-CG 4.43Å; A386-P389 VanDerWaalsContact O-CD 3.29Å; A386-P389 WeakPolarHBondContact O-CD 3.28Å; A386-P389 WeakPolarHBondContact O-CG 3.21Å; P389-K392 PolarHBondContact O-N 3Å; P389-Y393 WeakPolarHBondContact O-CB 3.45Å; P389-Y393 PolarHBondContact O-N 3.17Å
390	I	93.6	Very high	88.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-48.8	175.9	-58.9	172.5	0	0	0	110.1	F348 L352 L353 I362 Y366 C387 Q388 K392 Y393 L394	F348-I390 HydrophobicContact CB-CG1 4.43Å; F348-I390 HydrophobicContact CD1-CD1 3.99Å; F348-I390 HydrophobicContact CD2-CD1 3.8Å; F348-I390 HydrophobicContact CD2-CG1 4.28Å; F348-I390 HydrophobicContact CE1-CD1 4.03Å; F348-I390 HydrophobicContact CE2-CD1 3.81Å; F348-I390 HydrophobicContact CG-CD1 3.9Å; F348-I390 HydrophobicContact CG-CG1 4.24Å; F348-I390 HydrophobicContact CZ-CD1 3.94Å; L352-I390 HydrophobicContact CD2-CD1 4.45Å; L353-I390 HydrophobicContact CD1-CG1 4.42Å; L353-I390 HydrophobicContact CD2-CB 4.47Å; L353-I390 HydrophobicContact CD2-CG1 4.18Å; I362-I390 HydrophobicContact CG2-CG2 4.28Å; Y366-I390 HydrophobicContact CD2-CB 4.4Å; Y366-I390 HydrophobicContact CD2-CD1 4.08Å; Y366-I390 HydrophobicContact CD2-CG2 3.85Å; Y366-I390 HydrophobicContact CE2-CG2 4.49Å; Y366-I390 HydrophobicContact CG-CG2 3.96Å; C387-I390 HydrophobicContact CB-CD1 4.33Å; C387-I390 WeakPolarHBondContact O-CB 3.45Å; C387-I390 PolarHBondContact O-N 3.29Å; C387-I390 VanDerWaalsContact O-N 3.09Å; Q388-I390 VanDerWaalsContact C-N 3.34Å; Q388-I390 PolarHBondContact O-N 2.83Å; I390-K392 VanDerWaalsContact C-N 3.33Å; I390-K392 PolarHBondContact O-N 2.74Å; I390-Y393 PolarHBondContact O-N 3.1Å; I390-L394 HydrophobicContact CG2-CD1 3.88Å; I390-L394 HydrophobicContact CG2-CG 4.3Å; I390-L394 WeakPolarHBondContact O-CG 3.45Å; I390-L394 PolarHBondContact O-N 3.43Å
391	R	90.4	Very high	89	Confident	42 Å²	42	50.3 Å²	50.3	16%	0.158	23%	0.234	C	C	.	.	H	α-helix	trans	-60.5	-43.3	178.8	-63.5	179	-174.4	151.4	-0.7	111.7	Y366 L383 C387 Q388 Y393 R395 I473	Y366-R391 PolarHBondContact OH-NE 3.24Å; L383-R391 VanDerWaalsContact CD2-NH2 3.34Å; C387-R391 WeakPolarHBondContact O-CG 3.35Å; C387-R391 PolarHBondContact O-N 2.83Å; Q388-R391 PolarHBondContact O-N 3.23Å; R391-Y393 VanDerWaalsContact C-N 3.32Å; R391-Y393 PolarHBondContact O-N 3.39Å; R391-R395 WeakPolarHBondContact O-CG 3.31Å; R391-R395 PolarHBondContact O-N 2.99Å; R391-I473 HydrophobicContact CB-CG1 4.37Å; R391-I473 HydrophobicContact CB-CG2 4.4Å; R391-I473 HydrophobicContact CG-CD1 4.15Å; R391-I473 HydrophobicContact CG-CG1 3.99Å
392	K	90.2	Very high	89	Confident	159 Å²	159	56.2 Å²	56.2	69%	0.691	26%	0.256	S	S	*	.	H	α-helix	trans	-61.9	-41.6	176.9	-173.2	-179.7	178.3	-176	0	111.4	Q388 P389 I390	Q388-K392 PolarHBondContact O-N 3Å; P389-K392 PolarHBondContact O-N 3Å; I390-K392 VanDerWaalsContact C-N 3.33Å; I390-K392 PolarHBondContact O-N 2.74Å
393	Y	92.8	Very high	89	Confident	46 Å²	46	59.2 Å²	59.2	18%	0.18	27%	0.27	C	S	.	.	H	α-helix	trans	-69.5	-44.4	179.5	-170.7	-101	0	0	0	112.5	L353 H354 I362 P389 I390 R391 R395 T396	L353-Y393 HydrophobicContact CB-CD2 4.31Å; L353-Y393 HydrophobicContact CB-CG 4.27Å; L353-Y393 HydrophobicContact CD2-CD1 3.79Å; L353-Y393 HydrophobicContact CD2-CG 3.89Å; H354-Y393 PolarHBondContact O-OH 3.11Å; I362-Y393 HydrophobicContact CD1-CD1 4Å; I362-Y393 HydrophobicContact CD1-CE1 3.56Å; P389-Y393 WeakPolarHBondContact O-CB 3.45Å; P389-Y393 PolarHBondContact O-N 3.17Å; I390-Y393 PolarHBondContact O-N 3.1Å; R391-Y393 VanDerWaalsContact C-N 3.32Å; R391-Y393 PolarHBondContact O-N 3.39Å; Y393-R395 VanDerWaalsContact C-N 3.3Å; Y393-R395 PolarHBondContact O-N 3.49Å; Y393-T396 PolarHBondContact O-N 3.33Å; Y393-T396 PolarHBondContact O-OG1 3.42Å
394	L	91.1	Very high	88.9	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-59.6	-39.7	177.6	-72.4	172.1	0	0	0	111.8	I362 L363 Y366 I390 T396 R397 T400 I473 Y474	I362-L394 HydrophobicContact CB-CD2 4.37Å; I362-L394 HydrophobicContact CG2-CD2 3.82Å; I362-L394 HydrophobicContact CG2-CG 4.29Å; L363-L394 HydrophobicContact CD2-CD1 3.86Å; L363-L394 HydrophobicContact CD2-CD2 4.03Å; L363-L394 HydrophobicContact CG-CD2 4.39Å; Y366-L394 HydrophobicContact CD1-CD1 4.32Å; I390-L394 HydrophobicContact CG2-CD1 3.88Å; I390-L394 HydrophobicContact CG2-CG 4.3Å; I390-L394 WeakPolarHBondContact O-CG 3.45Å; I390-L394 PolarHBondContact O-N 3.43Å; L394-T396 PolarHBondContact O-N 3.46Å; L394-T396 VanDerWaalsContact O-N 3.09Å; L394-R397 PolarHBondContact O-N 3.03Å; L394-T400 HydrophobicContact CB-CG2 4.26Å; L394-T400 HydrophobicContact CD2-CG2 3.74Å; L394-T400 WeakPolarHBondContact O-CG2 3.28Å; L394-I473 HydrophobicContact CD1-CD1 4.01Å; L394-Y474 PolarHBondContact O-OH 3.05Å
395	R	89.5	Confident	88.9	Confident	148 Å²	148	56.1 Å²	56.1	56%	0.558	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.2	174.1	-72.6	176.4	-176.1	-179.1	-4.9	114.4	R391 Y393 I473 Y474	R391-R395 WeakPolarHBondContact O-CG 3.31Å; R391-R395 PolarHBondContact O-N 2.99Å; Y393-R395 VanDerWaalsContact C-N 3.3Å; Y393-R395 PolarHBondContact O-N 3.49Å; R395-I473 HydrophobicContact CG-CG2 3.59Å; R395-I473 PolarHBondContact NE-O 3.2Å; R395-I473 PolarHBondContact NH2-O 3.45Å; R395-Y474 HydrophobicContact CG-CE1 4.36Å
396	T	88.9	Confident	88.7	Confident	103 Å²	103	56.3 Å²	56.3	63%	0.632	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-13.5	179.7	63.8	0	0	0	0	113.3	Y393 L394	Y393-T396 PolarHBondContact O-N 3.33Å; Y393-T396 PolarHBondContact O-OG1 3.42Å; L394-T396 PolarHBondContact O-N 3.46Å; L394-T396 VanDerWaalsContact O-N 3.09Å
397	R	88.6	Confident	88.3	Confident	50 Å²	50	56.3 Å²	56.3	19%	0.189	26%	0.259	C	S	.	.			trans	-99.7	120.5	-178.6	-71	-173.8	75.7	144.5	15.2	110.4	V357 T359 L394 D399 T400	V357-R397 PolarHBondContact O-NH1 3.27Å; T359-R397 PolarHBondContact OG1-NE 3.01Å; T359-R397 PolarHBondContact OG1-NH2 3.35Å; L394-R397 PolarHBondContact O-N 3.03Å; R397-D399 VanDerWaalsContact C-N 3.32Å; R397-D399 IonicContact NE-OD1 2.68Å; R397-D399 PolarHBondContact NE-OD1 3.07Å; R397-D399 IonicContact NH2-OD2 3.3Å; R397-D399 PolarHBondContact O-N 3.36Å; R397-T400 HydrophobicContact CB-CG2 3.52Å; R397-T400 WeakPolarHBondContact O-CG2 3.31Å; R397-T400 PolarHBondContact O-OG1 3.2Å
398	E	81.8	Confident	87.9	Confident	195 Å²	195	57 Å²	57	91%	0.911	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-26.7	-175.3	-59.8	-178.3	162.9	0	0	113.1	T400	E398-T400 VanDerWaalsContact C-N 3.33Å; E398-T400 PolarHBondContact O-N 3.27Å
399	D	85.1	Confident	87.2	Confident	66 Å²	66	51.5 Å²	51.5	35%	0.353	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-5.9	-176.1	65.2	-35.7	0	0	0	114.2	T359 R397 R402 Q403	T359-D399 WeakPolarHBondContact CB-OD2 3.39Å; T359-D399 PolarHBondContact OG1-OD1 3.27Å; T359-D399 PolarHBondContact OG1-OD2 3.18Å; R397-D399 VanDerWaalsContact C-N 3.32Å; R397-D399 IonicContact NE-OD1 2.68Å; R397-D399 PolarHBondContact NE-OD1 3.07Å; R397-D399 IonicContact NH2-OD2 3.3Å; R397-D399 PolarHBondContact O-N 3.36Å; D399-R402 PolarHBondContact O-N 2.74Å; D399-Q403 VanDerWaalsContact O-CG 3.26Å; D399-Q403 WeakPolarHBondContact O-CG 3.46Å; D399-Q403 PolarHBondContact O-N 3.46Å
400	T	88.9	Confident	86.2	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-64.7	-45.6	-172.7	48.5	0	0	0	0	114.2	T359 L394 R397 E398 R402 Q403 I404 Y474	T359-T400 HydrophobicContact CG2-CG2 3.43Å; T359-T400 VanDerWaalsContact CG2-CG2 3.43Å; L394-T400 HydrophobicContact CB-CG2 4.26Å; L394-T400 HydrophobicContact CD2-CG2 3.74Å; L394-T400 WeakPolarHBondContact O-CG2 3.28Å; R397-T400 HydrophobicContact CB-CG2 3.52Å; R397-T400 WeakPolarHBondContact O-CG2 3.31Å; R397-T400 PolarHBondContact O-OG1 3.2Å; E398-T400 VanDerWaalsContact C-N 3.33Å; E398-T400 PolarHBondContact O-N 3.27Å; T400-R402 VanDerWaalsContact C-N 3.33Å; T400-R402 PolarHBondContact O-N 3.16Å; T400-Q403 PolarHBondContact O-N 2.99Å; T400-I404 VanDerWaalsContact O-CG1 3.3Å; T400-I404 WeakPolarHBondContact O-CG1 3.47Å; T400-I404 PolarHBondContact O-N 2.83Å; T400-Y474 WeakPolarHBondContact CB-OH 3.2Å; T400-Y474 PolarHBondContact OG1-OH 2.86Å
401	V	87.8	Confident	84.8	Confident	8 Å²	8	55.6 Å²	55.6	5%	0.048	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-44.3	-178.5	-175.7	0	0	0	0	109.7	Q403 I404 V405 Y474 I479 F480 E483	V401-Q403 VanDerWaalsContact C-N 3.32Å; V401-Q403 PolarHBondContact O-N 2.71Å; V401-I404 PolarHBondContact O-N 2.77Å; V401-V405 HydrophobicContact CG1-CG2 4.42Å; V401-V405 WeakPolarHBondContact O-CG2 3.46Å; V401-V405 PolarHBondContact O-N 2.78Å; V401-Y474 HydrophobicContact CG2-CD1 4.33Å; V401-Y474 HydrophobicContact CG2-CD2 4.33Å; V401-Y474 HydrophobicContact CG2-CE1 4.07Å; V401-Y474 HydrophobicContact CG2-CE2 4.03Å; V401-Y474 HydrophobicContact CG2-CG 4.48Å; V401-I479 HydrophobicContact CG1-CG2 4.2Å; V401-I479 HydrophobicContact CG2-CG2 4.01Å; V401-F480 HydrophobicContact CG1-CD1 3.81Å; V401-F480 HydrophobicContact CG1-CE1 4.05Å; V401-F480 HydrophobicContact CG1-CG 4.18Å; V401-E483 HydrophobicContact CB-CG 4.03Å; V401-E483 HydrophobicContact CG1-CB 3.82Å; V401-E483 HydrophobicContact CG1-CG 3.54Å
402	R	85.7	Confident	83.4	Confident	126 Å²	126	54.7 Å²	54.7	48%	0.475	27%	0.268	S	S	.	.	H	α-helix	trans	-58.6	-42	175.6	-168.9	173.4	177.9	-173.4	-0.2	112.1	D399 T400 V405 A406 V487	D399-R402 PolarHBondContact O-N 2.74Å; T400-R402 VanDerWaalsContact C-N 3.33Å; T400-R402 PolarHBondContact O-N 3.16Å; R402-V405 PolarHBondContact O-N 3.36Å; R402-A406 WeakPolarHBondContact O-CB 3.4Å; R402-A406 PolarHBondContact O-N 3.4Å; R402-V487 HydrophobicContact CG-CG2 4.21Å
403	Q	87.1	Confident	81.8	Confident	67 Å²	67	56.3 Å²	56.3	31%	0.313	28%	0.278	S	S	.	.	H	α-helix	trans	-66.7	-39.3	176	-70.3	-69.3	-31.1	0	0	112.8	T359 L363 D399 T400 V401 A406 G407	T359-Q403 HydrophobicContact CG2-CB 4.37Å; T359-Q403 HydrophobicContact CG2-CG 4.24Å; L363-Q403 HydrophobicContact CD1-CB 3.91Å; D399-Q403 VanDerWaalsContact O-CG 3.26Å; D399-Q403 WeakPolarHBondContact O-CG 3.46Å; D399-Q403 PolarHBondContact O-N 3.46Å; T400-Q403 PolarHBondContact O-N 2.99Å; V401-Q403 VanDerWaalsContact C-N 3.32Å; V401-Q403 PolarHBondContact O-N 2.71Å; Q403-A406 PolarHBondContact O-N 3.07Å; Q403-G407 PolarHBondContact O-N 3.24Å
404	I	87.9	Confident	79.9	Confident	5 Å²	5	56.6 Å²	56.6	3%	0.026	29%	0.29	C	S	.	.	H	α-helix	trans	-63.6	-47	174.9	-65.4	163.7	0	0	0	110	L363 T400 V401 A406 G407 L408 L418 L470 Y474 F480	L363-I404 HydrophobicContact CD1-CG1 3.72Å; L363-I404 HydrophobicContact CD2-CD1 4.16Å; L363-I404 HydrophobicContact CD2-CG1 3.94Å; T400-I404 VanDerWaalsContact O-CG1 3.3Å; T400-I404 WeakPolarHBondContact O-CG1 3.47Å; T400-I404 PolarHBondContact O-N 2.83Å; V401-I404 PolarHBondContact O-N 2.77Å; I404-A406 PolarHBondContact O-N 2.9Å; I404-G407 WeakPolarHBondContact O-CA 3.3Å; I404-G407 PolarHBondContact O-N 3.48Å; I404-G407 VanDerWaalsContact O-N 3.13Å; I404-L408 HydrophobicContact CG2-CD1 4.14Å; I404-L408 HydrophobicContact CG2-CG 4.39Å; I404-L408 WeakPolarHBondContact O-CG 3.3Å; I404-L408 PolarHBondContact O-N 2.74Å; I404-L418 HydrophobicContact CG2-CD2 4.03Å; I404-L470 HydrophobicContact CD1-CD2 4.3Å; I404-Y474 HydrophobicContact CD1-CE2 4.41Å; I404-F480 HydrophobicContact CB-CE1 4.06Å; I404-F480 HydrophobicContact CD1-CE1 3.85Å; I404-F480 HydrophobicContact CD1-CZ 4.15Å; I404-F480 HydrophobicContact CG2-CD1 4.33Å; I404-F480 HydrophobicContact CG2-CE1 3.75Å
405	V	86.3	Confident	78.2	Confident	4 Å²	4	57 Å²	57	2%	0.024	29%	0.293	C	S	.	.	H	α-helix	trans	-62.1	-41	177.6	171.8	0	0	0	0	111.8	V401 R402 G407 L408 T409 F480 E483 Y484 V487	V401-V405 HydrophobicContact CG1-CG2 4.42Å; V401-V405 WeakPolarHBondContact O-CG2 3.46Å; V401-V405 PolarHBondContact O-N 2.78Å; R402-V405 PolarHBondContact O-N 3.36Å; V405-G407 VanDerWaalsContact C-N 3.3Å; V405-G407 PolarHBondContact O-N 3.11Å; V405-L408 PolarHBondContact O-N 2.98Å; V405-T409 WeakPolarHBondContact O-CG2 3.23Å; V405-T409 PolarHBondContact O-N 3.37Å; V405-T409 PolarHBondContact O-OG1 2.71Å; V405-F480 HydrophobicContact CG2-CD1 4.37Å; V405-E483 HydrophobicContact CG2-CB 4.18Å; V405-Y484 HydrophobicContact CG1-CD2 3.71Å; V405-Y484 HydrophobicContact CG1-CG 4.31Å; V405-V487 HydrophobicContact CG1-CB 4.44Å; V405-V487 HydrophobicContact CG1-CG2 4.46Å
406	A	83.4	Confident	77	Confident	20 Å²	20	53.4 Å²	53.4	17%	0.165	29%	0.29	C	S	.	.	H	α-helix	trans	-62.5	-37.2	173.5	0	0	0	0	0	112.3	R402 Q403 I404 T409 G410 D411	R402-A406 WeakPolarHBondContact O-CB 3.4Å; R402-A406 PolarHBondContact O-N 3.4Å; Q403-A406 PolarHBondContact O-N 3.07Å; I404-A406 PolarHBondContact O-N 2.9Å; A406-T409 WeakPolarHBondContact CA-OG1 3.12Å; A406-T409 PolarHBondContact O-OG1 3.29Å; A406-G410 PolarHBondContact O-N 2.74Å; A406-D411 PolarHBondContact O-N 3.45Å
407	G	83.8	Confident	76.1	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.4	-44.2	173.1	0	0	0	0	0	113.6	Q403 I404 V405 T409 G410	Q403-G407 PolarHBondContact O-N 3.24Å; I404-G407 WeakPolarHBondContact O-CA 3.3Å; I404-G407 PolarHBondContact O-N 3.48Å; I404-G407 VanDerWaalsContact O-N 3.13Å; V405-G407 VanDerWaalsContact C-N 3.3Å; V405-G407 PolarHBondContact O-N 3.11Å; G407-T409 VanDerWaalsContact C-N 3.27Å; G407-T409 PolarHBondContact O-N 3.11Å; G407-G410 PolarHBondContact O-N 2.86Å
408	L	81.2	Confident	75.6	Confident	14 Å²	14	49.7 Å²	49.7	7%	0.073	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-35.9	177	-71	171.3	0	0	0	112.3	I404 V405 G410 L418 L422 I467 L510	I404-L408 HydrophobicContact CG2-CD1 4.14Å; I404-L408 HydrophobicContact CG2-CG 4.39Å; I404-L408 WeakPolarHBondContact O-CG 3.3Å; I404-L408 PolarHBondContact O-N 2.74Å; V405-L408 PolarHBondContact O-N 2.98Å; L408-G410 VanDerWaalsContact C-N 3.33Å; L408-L418 HydrophobicContact CD2-CD1 4.41Å; L408-L418 HydrophobicContact CD2-CD2 3.53Å; L408-L418 HydrophobicContact CD2-CG 3.57Å; L408-L418 HydrophobicContact CG-CD2 3.7Å; L408-L418 HydrophobicContact CG-CG 4.25Å; L408-L422 HydrophobicContact CB-CD1 3.69Å; L408-L422 HydrophobicContact CD2-CD1 3.28Å; L408-L422 HydrophobicContact CD2-CD2 3.99Å; L408-L422 HydrophobicContact CD2-CG 3.54Å; L408-L422 HydrophobicContact CG-CD1 4.04Å; L408-L422 VanDerWaalsContact O-CD1 3.3Å; L408-L422 WeakPolarHBondContact O-CD1 3.48Å; L408-I467 HydrophobicContact CD2-CD1 4.48Å; L408-I467 HydrophobicContact CD2-CG1 4.24Å; L408-L510 HydrophobicContact CD1-CD2 4.43Å
409	T	75.9	Confident	75.2	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-85.2	-7.5	-179.2	50.2	0	0	0	0	113.5	V405 A406 G407 D411 Y484 R491 R502	V405-T409 WeakPolarHBondContact O-CG2 3.23Å; V405-T409 PolarHBondContact O-N 3.37Å; V405-T409 PolarHBondContact O-OG1 2.71Å; A406-T409 WeakPolarHBondContact CA-OG1 3.12Å; A406-T409 PolarHBondContact O-OG1 3.29Å; G407-T409 VanDerWaalsContact C-N 3.27Å; G407-T409 PolarHBondContact O-N 3.11Å; T409-D411 PolarHBondContact OG1-OD2 3.35Å; T409-Y484 HydrophobicContact CG2-CD2 4.02Å; T409-Y484 HydrophobicContact CG2-CE2 3.49Å; T409-Y484 VanDerWaalsContact CG2-CE2 3.49Å; T409-R491 PolarHBondContact OG1-NH2 3.29Å; T409-R502 PolarHBondContact O-NH2 3.4Å
410	G	70.4	Confident	74.8	Confident	36 Å²	36	40.7 Å²	40.7	37%	0.371	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	78	18.5	177.2	0	0	0	0	0	114.8	A406 G407 L408 R502	A406-G410 PolarHBondContact O-N 2.74Å; G407-G410 PolarHBondContact O-N 2.86Å; L408-G410 VanDerWaalsContact C-N 3.33Å; G410-R502 PolarHBondContact O-NH2 3.34Å; G410-R502 VanDerWaalsContact O-NH2 3.07Å
411	D	65.1	Low	74.2	Confident	73 Å²	73	42.2 Å²	42.2	39%	0.39	24%	0.243	S	C	.	.			trans	-82.6	-24.2	179.8	-70.2	-32.2	0	0	0	113.1	A406 T409 R491 R502	A406-D411 PolarHBondContact O-N 3.45Å; T409-D411 PolarHBondContact OG1-OD2 3.35Å; D411-R491 IonicContact OD1-NH1 3.49Å; D411-R491 IonicContact OD2-CZ 2.74Å; D411-R491 IonicContact OD2-NE 3.02Å; D411-R491 IonicContact OD2-NH1 3.48Å; D411-R491 PolarHBondContact OD2-NH1 2.89Å; D411-R491 IonicContact OD2-NH2 3.89Å; D411-R491 PolarHBondContact OD2-NH2 2.9Å; D411-R502 IonicContact OD1-CZ 3.85Å; D411-R502 IonicContact OD1-NH1 3.38Å; D411-R502 PolarHBondContact OD1-NH1 2.96Å; D411-R502 IonicContact OD1-NH2 3.94Å; D411-R502 PolarHBondContact OD1-NH2 3.42Å
412	A	60.5	Low	73.5	Confident	23 Å²	23	42.3 Å²	42.3	19%	0.19	24%	0.243	C	C	.	.			trans	-99.9	113.9	174.8	0	0	0	0	0	110.1	A414 C415	A412-A414 PolarHBondContact O-N 2.91Å; A412-A414 VanDerWaalsContact O-N 3.13Å; A412-C415 PolarHBondContact O-N 3.39Å
413	E	56.5	Low	72.8	Confident	192 Å²	192	40.1 Å²	40.1	90%	0.897	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-52.7	-33.6	172	-67.9	-175.2	164.4	0	0	111.4	C415	E413-C415 PolarHBondContact O-N 3.02Å
414	A	52	Low	71.9	Confident	52 Å²	52	46.2 Å²	46.2	43%	0.43	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-62.7	-20.5	179.1	0	0	0	0	0	114.3	T364 A412	T364-A414 WeakPolarHBondContact CG2-O 3.25Å; A412-A414 PolarHBondContact O-N 2.91Å; A412-A414 VanDerWaalsContact O-N 3.13Å
415	C	56.8	Low	70.3	Confident	10 Å²	10	47.7 Å²	47.7	7%	0.068	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-128.3	25.7	-175.6	-158.4	0	0	0	0	112.8	A412 E413 D417 L418	A412-C415 PolarHBondContact O-N 3.39Å; E413-C415 PolarHBondContact O-N 3.02Å; C415-D417 PolarHBondContact O-N 3.04Å; C415-L418 WeakPolarHBondContact O-CB 3.37Å; C415-L418 PolarHBondContact O-N 3.32Å; C415-L418 VanDerWaalsContact SG-CB 3.59Å
416	S	63.8	Low	68.7	Low	73 Å²	73	53.8 Å²	53.8	51%	0.51	32%	0.316	S	S	.	.	H	α-helix	trans	-54.5	-33.3	177.1	-174.8	0	0	0	0	112.8	L418 A419 S420	S416-L418 PolarHBondContact O-N 3.12Å; S416-L418 VanDerWaalsContact O-N 3.17Å; S416-A419 PolarHBondContact O-N 3.13Å; S416-A419 VanDerWaalsContact O-N 3.12Å; S416-S420 PolarHBondContact O-N 3.06Å
417	D	70.1	Confident	67.1	Low	74 Å²	74	57.3 Å²	57.3	40%	0.396	34%	0.337	S	S	.	.	H	α-helix	trans	-49.6	-40	172.4	-89.9	28.5	0	0	0	112.8	K371 C415 S420 E421	K371-D417 IonicContact NZ-OD2 2.85Å; K371-D417 PolarHBondContact NZ-OD2 3.35Å; C415-D417 PolarHBondContact O-N 3.04Å; D417-S420 WeakPolarHBondContact O-CB 3.44Å; D417-S420 PolarHBondContact O-N 3.49Å; D417-S420 PolarHBondContact O-OG 3.42Å; D417-E421 WeakPolarHBondContact O-CG 3.27Å; D417-E421 PolarHBondContact O-N 3.48Å
418	L	77.4	Confident	65.6	Low	1 Å²	1	61.2 Å²	61.2	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-73.1	-35.5	-176.8	-164.7	67.6	0	0	0	112.3	I367 I404 L408 C415 S416 S420 E421 L422 I466 I467 L470	I367-L418 HydrophobicContact CD1-CB 4.37Å; I367-L418 HydrophobicContact CD1-CD1 4.27Å; I404-L418 HydrophobicContact CG2-CD2 4.03Å; L408-L418 HydrophobicContact CD2-CD1 4.41Å; L408-L418 HydrophobicContact CD2-CD2 3.53Å; L408-L418 HydrophobicContact CD2-CG 3.57Å; L408-L418 HydrophobicContact CG-CD2 3.7Å; L408-L418 HydrophobicContact CG-CG 4.25Å; C415-L418 WeakPolarHBondContact O-CB 3.37Å; C415-L418 PolarHBondContact O-N 3.32Å; C415-L418 VanDerWaalsContact SG-CB 3.59Å; S416-L418 PolarHBondContact O-N 3.12Å; S416-L418 VanDerWaalsContact O-N 3.17Å; L418-S420 VanDerWaalsContact C-N 3.29Å; L418-E421 PolarHBondContact O-N 3.3Å; L418-L422 PolarHBondContact O-N 3.2Å; L418-I466 HydrophobicContact CD1-CG2 3.98Å; L418-I467 HydrophobicContact CD1-CG1 4.01Å; L418-L470 HydrophobicContact CD1-CD1 3.61Å; L418-L470 HydrophobicContact CD2-CD1 4.03Å
419	A	74.4	Confident	64.4	Low	27 Å²	27	62.1 Å²	62.1	22%	0.223	37%	0.367	C	S	.	.	H	α-helix	trans	-65.3	-35	170.9	0	0	0	0	0	111.4	S416 L422 S423	S416-A419 PolarHBondContact O-N 3.13Å; S416-A419 VanDerWaalsContact O-N 3.12Å; A419-L422 WeakPolarHBondContact O-CB 3.19Å; A419-L422 PolarHBondContact O-N 3.11Å; A419-S423 PolarHBondContact O-N 3.16Å; A419-S423 VanDerWaalsContact O-N 3.12Å
420	S	75.7	Confident	63.5	Low	45 Å²	45	62.3 Å²	62.3	32%	0.315	37%	0.368	S	S	.	.	H	α-helix	trans	-66.5	-41.6	173.2	85.6	0	0	0	0	111.9	S416 D417 L418 L422 S423 R424	S416-S420 PolarHBondContact O-N 3.06Å; D417-S420 WeakPolarHBondContact O-CB 3.44Å; D417-S420 PolarHBondContact O-N 3.49Å; D417-S420 PolarHBondContact O-OG 3.42Å; L418-S420 VanDerWaalsContact C-N 3.29Å; S420-L422 PolarHBondContact O-N 3.19Å; S420-S423 PolarHBondContact O-N 2.85Å; S420-S423 VanDerWaalsContact O-N 3.11Å; S420-S423 PolarHBondContact O-OG 3.27Å; S420-R424 VanDerWaalsContact O-CG 3.29Å; S420-R424 WeakPolarHBondContact O-CG 3.43Å; S420-R424 PolarHBondContact O-N 3.15Å
421	E	75.5	Confident	62.4	Low	34 Å²	34	64.6 Å²	64.6	16%	0.159	37%	0.369	C	S	.	.	H	α-helix	trans	-65.1	-37.9	176.1	-67.8	-65.4	165.4	0	0	112.1	K371 D417 L418 S423 R424 G425 I466	K371-E421 WeakPolarHBondContact CE-OE1 3.47Å; K371-E421 IonicContact NZ-OE1 3.7Å; D417-E421 WeakPolarHBondContact O-CG 3.27Å; D417-E421 PolarHBondContact O-N 3.48Å; L418-E421 PolarHBondContact O-N 3.3Å; E421-S423 VanDerWaalsContact C-N 3.28Å; E421-S423 PolarHBondContact O-N 2.87Å; E421-R424 PolarHBondContact O-N 3.3Å; E421-G425 PolarHBondContact O-N 3Å; E421-G425 VanDerWaalsContact O-N 3.16Å; E421-I466 HydrophobicContact CG-CD1 3.7Å
422	L	73.6	Confident	61.6	Low	9 Å²	9	66.9 Å²	66.9	5%	0.047	38%	0.378	C	S	.	.	H	α-helix	trans	-56.7	-43.6	170.1	-87	173.7	0	0	0	111.8	L408 L418 A419 S420 I467 L510 R513	L408-L422 HydrophobicContact CB-CD1 3.69Å; L408-L422 HydrophobicContact CD2-CD1 3.28Å; L408-L422 HydrophobicContact CD2-CD2 3.99Å; L408-L422 HydrophobicContact CD2-CG 3.54Å; L408-L422 HydrophobicContact CG-CD1 4.04Å; L408-L422 VanDerWaalsContact O-CD1 3.3Å; L408-L422 WeakPolarHBondContact O-CD1 3.48Å; L418-L422 PolarHBondContact O-N 3.2Å; A419-L422 WeakPolarHBondContact O-CB 3.19Å; A419-L422 PolarHBondContact O-N 3.11Å; S420-L422 PolarHBondContact O-N 3.19Å; L422-I467 HydrophobicContact CB-CD1 4.34Å; L422-I467 HydrophobicContact CD2-CD1 3.42Å; L422-I467 VanDerWaalsContact CD2-CD1 3.42Å; L422-I467 HydrophobicContact CG-CD1 3.64Å; L422-L510 HydrophobicContact CD2-CD2 4.31Å; L422-R513 HydrophobicContact CD2-CG 4.28Å; L422-R513 PolarHBondContact O-NH2 3.35Å
423	S	71	Confident	61.1	Low	81 Å²	81	69.3 Å²	69.3	57%	0.566	39%	0.386	S	S	*	.	H	α-helix	trans	-73.6	-24.3	-179.6	73.8	0	0	0	0	114.1	A419 S420 E421	A419-S423 PolarHBondContact O-N 3.16Å; A419-S423 VanDerWaalsContact O-N 3.12Å; S420-S423 PolarHBondContact O-N 2.85Å; S420-S423 VanDerWaalsContact O-N 3.11Å; S420-S423 PolarHBondContact O-OG 3.27Å; E421-S423 VanDerWaalsContact C-N 3.28Å; E421-S423 PolarHBondContact O-N 2.87Å
424	R	67.9	Low	60.6	Low	195 Å²	195	64.8 Å²	64.8	74%	0.736	37%	0.368	S	S	*	.	H	α-helix	trans	-88.9	-39.5	-173.8	-76.3	175.2	69.7	122.6	3.7	114.3	S420 E421	S420-R424 VanDerWaalsContact O-CG 3.29Å; S420-R424 WeakPolarHBondContact O-CG 3.43Å; S420-R424 PolarHBondContact O-N 3.15Å; E421-R424 PolarHBondContact O-N 3.3Å
425	G	54.2	Low	60.3	Low	35 Å²	35	65.2 Å²	65.2	36%	0.361	37%	0.367	S	S	.	.	S	Bend	trans	-73.9	140.2	-160.5	0	0	0	0	0	113.6	E421 R513	E421-G425 PolarHBondContact O-N 3Å; E421-G425 VanDerWaalsContact O-N 3.16Å; G425-R513 VanDerWaalsContact C-NH2 3.26Å; G425-R513 VanDerWaalsContact N-NH2 3.15Å; G425-R513 PolarHBondContact O-NH1 2.97Å; G425-R513 PolarHBondContact O-NH2 3.41Å
426	D	53.2	Low	59.8	Low	133 Å²	133	72.1 Å²	72.1	71%	0.711	40%	0.404	S	S	*	.			trans	-46.8	148.1	171.6	-81.1	-43.5	0	0	0	111.9	V428 R513	D426-V428 PolarHBondContact O-N 3.48Å; D426-R513 PolarHBondContact O-NH1 2.86Å
427	P	49.5	Very low	58.9	Low	93 Å²	93	74.5 Å²	74.5	60%	0.604	41%	0.411	S	S	*	.			trans	-73.5	48.1	-174.1	33.6	-37.5	0	0	0	112.6	T429	P427-T429 PolarHBondContact O-N 2.94Å; P427-T429 VanDerWaalsContact O-N 3.17Å
428	V	53.2	Low	58.1	Low	82 Å²	82	79.4 Å²	79.4	50%	0.497	43%	0.431	S	S	.	.			trans	-75.6	101.3	164.5	-176.3	0	0	0	0	106.2	D426	D426-V428 PolarHBondContact O-N 3.48Å
429	T	55.5	Low	56.8	Low	33 Å²	33	83.1 Å²	83.1	20%	0.202	47%	0.47	C	S	.	.			trans	-63	140.3	172.6	59.8	0	0	0	0	108.3	P427 E431 M432	P427-T429 PolarHBondContact O-N 2.94Å; P427-T429 VanDerWaalsContact O-N 3.17Å; T429-E431 PolarHBondContact O-N 2.73Å; T429-M432 PolarHBondContact O-N 3.24Å; T429-M432 WeakPolarHBondContact OG1-CB 3.47Å; T429-M432 VanDerWaalsContact OG1-CG 3.25Å; T429-M432 WeakPolarHBondContact OG1-CG 3.25Å; T429-M432 PolarHBondContact OG1-N 3.1Å
430	L	56.2	Low	55.8	Low	8 Å²	8	87.8 Å²	87.8	4%	0.042	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-14	172.9	-68.8	168.8	0	0	0	112	S468 K477 R513 F514	L430-S468 WeakPolarHBondContact CD2-OG 3.36Å; L430-K477 VanDerWaalsContact C-NZ 3.26Å; L430-K477 HydrophobicContact CB-CD 4.38Å; L430-K477 HydrophobicContact CD1-CD 4.49Å; L430-K477 PolarHBondContact O-NZ 2.74Å; L430-R513 VanDerWaalsContact CB-O 3.28Å; L430-R513 WeakPolarHBondContact CB-O 3.34Å; L430-R513 VanDerWaalsContact CG-O 3.29Å; L430-R513 WeakPolarHBondContact CG-O 2.83Å; L430-R513 PolarHBondContact N-O 3.46Å; L430-F514 HydrophobicContact CD1-CD1 3.56Å; L430-F514 HydrophobicContact CD1-CE1 3.57Å; L430-F514 HydrophobicContact CD1-CG 4.13Å; L430-F514 HydrophobicContact CD1-CZ 4.12Å
431	E	49	Very low	55.2	Low	84 Å²	84	90.9 Å²	90.9	39%	0.393	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-33.9	174.5	-61.4	-178.3	163.7	0	0	112.3	T429 Q433 D434 H518	T429-E431 PolarHBondContact O-N 2.73Å; E431-Q433 VanDerWaalsContact C-N 3.26Å; E431-Q433 PolarHBondContact O-N 2.76Å; E431-D434 PolarHBondContact O-N 3.34Å; E431-H518 IonicContact OE1-CD2 2.7Å
432	M	48.1	Very low	54.8	Low	120 Å²	120	94.8 Å²	94.8	59%	0.591	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-12.8	177.8	-80.3	178.5	70.1	0	0	113.9	T429 D434 S435	T429-M432 PolarHBondContact O-N 3.24Å; T429-M432 WeakPolarHBondContact OG1-CB 3.47Å; T429-M432 VanDerWaalsContact OG1-CG 3.25Å; T429-M432 WeakPolarHBondContact OG1-CG 3.25Å; T429-M432 PolarHBondContact OG1-N 3.1Å; M432-D434 PolarHBondContact O-N 2.9Å; M432-S435 PolarHBondContact O-N 3.15Å; M432-S435 PolarHBondContact O-OG 2.94Å
433	Q	50.1	Low	54.7	Low	75 Å²	75	102.9 Å²	102.9	35%	0.35	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.8	-18	172.8	-103.7	169.5	39.4	0	0	113.5	E431 S463	E431-Q433 VanDerWaalsContact C-N 3.26Å; E431-Q433 PolarHBondContact O-N 2.76Å; Q433-S463 VanDerWaalsContact NE2-CB 3.3Å
434	D	45.6	Very low	54.5	Low	96 Å²	96	104.1 Å²	104.1	51%	0.513	57%	0.57	S	S	.	*	S	Bend	trans	-94.9	-10.9	177.8	-73.9	-45.4	0	0	0	113.1	E431 M432 D436 R461	E431-D434 PolarHBondContact O-N 3.34Å; M432-D434 PolarHBondContact O-N 2.9Å; D434-D436 PolarHBondContact O-N 2.94Å; D434-R461 IonicContact OD1-CZ 3.16Å; D434-R461 IonicContact OD1-NH1 4Å; D434-R461 PolarHBondContact OD1-NH1 2.6Å; D434-R461 IonicContact OD1-NH2 2.86Å
435	S	44.5	Very low	54.8	Low	61 Å²	61	102.6 Å²	102.6	43%	0.427	57%	0.565	S	S	.	*			trans	-83.4	111.1	167.9	50.8	0	0	0	0	109.4	M432 D437	M432-S435 PolarHBondContact O-N 3.15Å; M432-S435 PolarHBondContact O-OG 2.94Å; S435-D437 PolarHBondContact O-N 3.39Å
436	D	46.2	Very low	55.5	Low	155 Å²	155	104.1 Å²	104.1	83%	0.829	57%	0.573	S	S	*	*			trans	-63.1	12.8	175.5	-77.8	-36.7	0	0	0	114.3	D434	D434-D436 PolarHBondContact O-N 2.94Å
437	D	46.9	Very low	56.6	Low	123 Å²	123	102.3 Å²	102.3	66%	0.658	57%	0.569	S	S	*	*			trans	-104.7	115.8	-163.6	-134.7	14.5	0	0	0	113.1	S435	S435-D437 PolarHBondContact O-N 3.39Å
438	E	51.7	Low	57.7	Low	178 Å²	178	100.9 Å²	100.9	83%	0.832	56%	0.557	S	S	*	*	S	Bend	trans	57.1	99.3	147.6	-66.8	-175.2	160.2	0	0	118.9
439	G	51.2	Low	58.8	Low	79 Å²	79	98.8 Å²	98.8	81%	0.814	55%	0.545	S	S	*	.			trans	-177.6	-10.9	163.3	0	0	0	0	0	118.5
440	N	52.3	Low	59.8	Low	124 Å²	124	104.7 Å²	104.7	66%	0.663	58%	0.581	S	S	*	*			trans	-101.4	122.1	176.7	-120.7	50.5	0	0	0	110.2	D444	N440-D444 WeakPolarHBondContact ND2-CB 3.38Å
441	D	63.5	Low	60.5	Low	110 Å²	110	105.9 Å²	105.9	59%	0.588	59%	0.587	S	S	*	*			trans	-54	137.1	169.1	-79.7	-42.2	0	0	0	108.6	E443 D444	D441-E443 PolarHBondContact O-N 3.07Å; D441-D444 PolarHBondContact O-N 2.95Å
442	P	67.7	Low	61.7	Low	116 Å²	116	102.8 Å²	102.8	75%	0.753	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-60.1	-15.2	179.9	22.6	-31.5	0	0	0	112.8
443	E	70.9	Confident	62.6	Low	180 Å²	180	101.4 Å²	101.4	84%	0.841	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-75.4	-24	175.3	-58.9	-172.1	173.8	0	0	113.3	D441 W445	D441-E443 PolarHBondContact O-N 3.07Å; E443-W445 VanDerWaalsContact C-N 3.31Å
444	D	68	Low	63.3	Low	106 Å²	106	104.2 Å²	104.2	57%	0.567	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-85.1	-3.9	179	-68.9	-33.2	0	0	0	113.1	N440 D441 A446	N440-D444 WeakPolarHBondContact ND2-CB 3.38Å; D441-D444 PolarHBondContact O-N 2.95Å; D444-A446 PolarHBondContact O-N 3.39Å
445	W	73.9	Confident	63.7	Low	164 Å²	164	105.1 Å²	105.1	62%	0.621	60%	0.604	S	S	*	*			trans	-81.7	113.9	179.6	-174.4	82.3	0	0	0	111.1	E443 P447	E443-W445 VanDerWaalsContact C-N 3.31Å; W445-P447 HydrophobicContact CH2-CB 4.16Å
446	A	69	Low	64	Low	66 Å²	66	112.1 Å²	112.1	55%	0.545	63%	0.626	S	S	.	*			trans	-109.7	142.6	169.2	0	0	0	0	0	110.7	D444	D444-A446 PolarHBondContact O-N 3.39Å
447	P	75.6	Confident	64.2	Low	95 Å²	95	109.5 Å²	109.5	62%	0.617	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-66.6	151.6	174	29	-34.5	0	0	0	111.1	W445	W445-P447 HydrophobicContact CH2-CB 4.16Å
448	D	72.3	Confident	64.4	Low	64 Å²	64	105.8 Å²	105.8	34%	0.342	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-65	143	176.7	-79.6	-22.7	0	0	0	111.8	A452 S459 R462	D448-A452 HydrophobicContact CB-CB 3.9Å; D448-S459 WeakPolarHBondContact OD1-CB 3.32Å; D448-S459 PolarHBondContact OD1-OG 3.17Å; D448-R462 IonicContact OD1-CZ 3.57Å; D448-R462 IonicContact OD1-NH1 3.65Å; D448-R462 PolarHBondContact OD1-NH1 3.41Å; D448-R462 IonicContact OD1-NH2 2.92Å; D448-R462 PolarHBondContact OD1-NH2 3.07Å; D448-R462 IonicContact OD2-CZ 2.77Å; D448-R462 IonicContact OD2-NH1 3.05Å; D448-R462 IonicContact OD2-NH2 3.62Å; D448-R462 PolarHBondContact OD2-NH2 3.33Å
449	P	76.8	Confident	64.4	Low	38 Å²	38	99.4 Å²	99.4	25%	0.247	58%	0.578	C	S	.	*	P	Polyproline II helix	trans	-68.5	160.7	176.7	32.2	-37.6	0	0	0	111.3	V381 D451 A452	V381-P449 HydrophobicContact CB-CG 4.05Å; V381-P449 HydrophobicContact CG1-CG 4.22Å; V381-P449 HydrophobicContact CG2-CG 3.7Å; P449-D451 VanDerWaalsContact CB-OD1 3.27Å; P449-D451 WeakPolarHBondContact CB-OD1 3.49Å; P449-D451 WeakPolarHBondContact CG-OD1 3.24Å; P449-D451 PolarHBondContact O-N 3.24Å; P449-D451 VanDerWaalsContact O-N 3.11Å; P449-A452 WeakPolarHBondContact O-CB 3.27Å; P449-A452 PolarHBondContact O-N 3.07Å
450	T	75.8	Confident	64.5	Low	156 Å²	156	104.6 Å²	104.6	96%	0.957	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-20.2	-171.1	51.4	0	0	0	0	115.1
451	D	72.4	Confident	64.5	Low	33 Å²	33	104.2 Å²	104.2	18%	0.176	57%	0.567	C	S	.	*	T	Hydrogen-bonded Turn	trans	-87.4	-4.6	177.5	63	-46	0	0	0	113.2	R337 V381 P449 V453	R337-D451 IonicContact CZ-OD1 2.89Å; R337-D451 IonicContact CZ-OD2 3.56Å; R337-D451 VanDerWaalsContact NE-CG 3.31Å; R337-D451 IonicContact NE-OD1 3.52Å; R337-D451 PolarHBondContact NE-OD1 3.49Å; R337-D451 IonicContact NE-OD2 3.99Å; R337-D451 PolarHBondContact NE-OD2 3.12Å; R337-D451 IonicContact NH2-OD1 2.73Å; R337-D451 PolarHBondContact NH2-OD1 2.95Å; R337-D451 IonicContact NH2-OD2 3.89Å; R337-D451 PolarHBondContact NH2-OD2 3.32Å; V381-D451 WeakPolarHBondContact CG1-OD2 3.29Å; P449-D451 VanDerWaalsContact CB-OD1 3.27Å; P449-D451 WeakPolarHBondContact CB-OD1 3.49Å; P449-D451 WeakPolarHBondContact CG-OD1 3.24Å; P449-D451 PolarHBondContact O-N 3.24Å; P449-D451 VanDerWaalsContact O-N 3.11Å; D451-V453 PolarHBondContact O-N 3.14Å
452	A	72.8	Confident	64.6	Low	20 Å²	20	100.8 Å²	100.8	17%	0.165	55%	0.546	C	S	.	.	S	Bend	trans	-60.5	125.3	173.1	0	0	0	0	0	109.8	V381 D448 P449	V381-A452 HydrophobicContact CG1-CB 4.17Å; V381-A452 HydrophobicContact CG2-CB 4.12Å; D448-A452 HydrophobicContact CB-CB 3.9Å; P449-A452 WeakPolarHBondContact O-CB 3.27Å; P449-A452 PolarHBondContact O-N 3.07Å
453	V	67.8	Low	64.3	Low	90 Å²	90	96.3 Å²	96.3	55%	0.545	52%	0.518	S	S	.	.			trans	-64.7	131.1	172.9	-178	0	0	0	0	107.1	V385 D451 D455	V385-V453 HydrophobicContact CG2-CG2 3.99Å; D451-V453 PolarHBondContact O-N 3.14Å; V453-D455 PolarHBondContact O-N 3.02Å
454	P	64	Low	64	Low	135 Å²	135	91.6 Å²	91.6	88%	0.877	50%	0.504	S	S	*	.			trans	-71.1	75.8	173.1	29.4	-33.7	0	0	0	108.7
455	D	54.8	Low	64.5	Low	115 Å²	115	87.9 Å²	87.9	62%	0.615	49%	0.485	S	S	*	.			trans	-92.2	155.7	173.3	-153.7	-4.6	0	0	0	109.8	V453 L457	V453-D455 PolarHBondContact O-N 3.02Å; D455-L457 PolarHBondContact O-N 2.91Å; D455-L457 VanDerWaalsContact O-N 3.16Å
456	K	50.2	Low	65	Low	207 Å²	207	80.1 Å²	80.1	90%	0.9	46%	0.455	S	S	*	.	S	Bend	trans	-67.4	-13.4	-177.7	-66.3	-178.6	-179.7	179.6	0	113.1
457	L	49.9	Very low	65.6	Low	100 Å²	100	77.1 Å²	77.1	52%	0.524	43%	0.43	S	S	.	.	S	Bend	trans	-90.9	98.4	170.7	-85.9	74.7	0	0	0	108.7	D455 R461	D455-L457 PolarHBondContact O-N 2.91Å; D455-L457 VanDerWaalsContact O-N 3.16Å; L457-R461 HydrophobicContact CB-CB 4.47Å; L457-R461 HydrophobicContact CD2-CB 4.18Å; L457-R461 HydrophobicContact CG-CB 4.43Å
458	G	51.7	Low	65.8	Low	45 Å²	45	73 Å²	73	46%	0.464	40%	0.403	S	S	.	.			trans	-61.1	166.9	175.1	0	0	0	0	0	113.4	K460 R461	G458-K460 PolarHBondContact O-N 3.27Å; G458-R461 PolarHBondContact O-N 2.94Å
459	S	52.6	Low	66.3	Low	45 Å²	45	70.4 Å²	70.4	32%	0.315	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-38.2	-35.9	178.2	-157.5	0	0	0	0	115.4	D448 R461 R462	D448-S459 WeakPolarHBondContact OD1-CB 3.32Å; D448-S459 PolarHBondContact OD1-OG 3.17Å; S459-R461 VanDerWaalsContact C-N 3.3Å; S459-R461 PolarHBondContact O-N 3.21Å; S459-R462 PolarHBondContact O-N 2.96Å
460	K	51.9	Low	66.7	Low	188 Å²	188	68.7 Å²	68.7	82%	0.817	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-64.7	-20.6	-178	-66.2	-174.3	174.7	-171.1	0	115.7	G458	G458-K460 PolarHBondContact O-N 3.27Å
461	R	53.5	Low	67	Low	115 Å²	115	61.8 Å²	61.8	43%	0.434	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-98.7	7.9	-179.4	-74.3	-176	180	-133.7	-3.2	113.9	D434 L457 G458 S459 S463	D434-R461 IonicContact OD1-CZ 3.16Å; D434-R461 IonicContact OD1-NH1 4Å; D434-R461 PolarHBondContact OD1-NH1 2.6Å; D434-R461 IonicContact OD1-NH2 2.86Å; L457-R461 HydrophobicContact CB-CB 4.47Å; L457-R461 HydrophobicContact CD2-CB 4.18Å; L457-R461 HydrophobicContact CG-CB 4.43Å; G458-R461 PolarHBondContact O-N 2.94Å; S459-R461 VanDerWaalsContact C-N 3.3Å; S459-R461 PolarHBondContact O-N 3.21Å; R461-S463 VanDerWaalsContact C-N 3.25Å; R461-S463 PolarHBondContact O-N 3.15Å
462	R	64	Low	67.4	Low	39 Å²	39	63.1 Å²	63.1	15%	0.147	35%	0.348	C	S	.	.			trans	-74.9	83.5	174	-59.3	-163.5	-174.8	113.6	18.9	108.8	S379 Q384 D448 S459 S464	S379-R462 VanDerWaalsContact O-CD 3.3Å; S379-R462 WeakPolarHBondContact O-CD 3.44Å; S379-R462 PolarHBondContact O-NH1 3.34Å; S379-R462 VanDerWaalsContact O-NH1 3.15Å; Q384-R462 VanDerWaalsContact OE1-NE 3.11Å; D448-R462 IonicContact OD1-CZ 3.57Å; D448-R462 IonicContact OD1-NH1 3.65Å; D448-R462 PolarHBondContact OD1-NH1 3.41Å; D448-R462 IonicContact OD1-NH2 2.92Å; D448-R462 PolarHBondContact OD1-NH2 3.07Å; D448-R462 IonicContact OD2-CZ 2.77Å; D448-R462 IonicContact OD2-NH1 3.05Å; D448-R462 IonicContact OD2-NH2 3.62Å; D448-R462 PolarHBondContact OD2-NH2 3.33Å; S459-R462 PolarHBondContact O-N 2.96Å; R462-S464 PolarHBondContact O-N 2.89Å
463	S	62.9	Low	67.8	Low	22 Å²	22	62.2 Å²	62.2	15%	0.154	34%	0.34	C	S	.	.			trans	-58.1	133.4	173.4	53.4	0	0	0	0	109.6	Q433 R461 S468 L469	Q433-S463 VanDerWaalsContact NE2-CB 3.3Å; R461-S463 VanDerWaalsContact C-N 3.25Å; R461-S463 PolarHBondContact O-N 3.15Å; S463-S468 VanDerWaalsContact OG-CB 3.31Å; S463-S468 WeakPolarHBondContact OG-CB 3.11Å; S463-L469 WeakPolarHBondContact O-CD1 3.49Å
464	S	64.4	Low	68.3	Low	80 Å²	80	60.1 Å²	60.1	56%	0.559	32%	0.323	S	S	*	.			trans	-81.2	-4.8	173.7	59	0	0	0	0	111.6	R374 R462	R374-S464 PolarHBondContact NH1-O 2.63Å; R374-S464 PolarHBondContact NH2-O 3.25Å; R462-S464 PolarHBondContact O-N 2.89Å
465	D	77.9	Confident	68.6	Low	29 Å²	29	56.9 Å²	56.9	16%	0.155	31%	0.313	C	S	.	.			trans	-88.6	129.6	-174.4	170.1	40.2	0	0	0	112.4	I467 S468 L469	D465-I467 VanDerWaalsContact C-N 3.29Å; D465-I467 PolarHBondContact O-N 2.88Å; D465-I467 PolarHBondContact OD1-N 3.47Å; D465-S468 WeakPolarHBondContact CB-OG 3.27Å; D465-S468 WeakPolarHBondContact O-CB 3.38Å; D465-S468 PolarHBondContact O-N 3.42Å; D465-S468 PolarHBondContact OD2-N 2.7Å; D465-S468 PolarHBondContact OD2-OG 3.4Å; D465-L469 WeakPolarHBondContact O-CD1 3.43Å; D465-L469 PolarHBondContact O-N 3.18Å
466	I	84.4	Confident	69.6	Low	1 Å²	1	52.8 Å²	52.8	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-60.3	-40.6	-177.7	-65.5	161.3	0	0	0	110.8	I367 I370 K371 L418 E421 L469 L470	I367-I466 HydrophobicContact CG1-CG2 4.18Å; I367-I466 HydrophobicContact CG2-CG2 4.39Å; I370-I466 HydrophobicContact CB-CG1 4.44Å; I370-I466 HydrophobicContact CD1-CG2 4.15Å; I370-I466 HydrophobicContact CG2-CG1 3.67Å; K371-I466 HydrophobicContact CD-CD1 4.45Å; K371-I466 HydrophobicContact CG-CD1 3.88Å; L418-I466 HydrophobicContact CD1-CG2 3.98Å; E421-I466 HydrophobicContact CG-CD1 3.7Å; I466-L469 PolarHBondContact O-N 2.88Å; I466-L470 HydrophobicContact CG2-CD1 4.09Å; I466-L470 WeakPolarHBondContact O-CG 3.33Å; I466-L470 PolarHBondContact O-N 3.33Å
467	I	82.6	Confident	70.9	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.015	26%	0.261	C	S	.	.	H	α-helix	trans	-67.9	-45.1	-178.6	-60.3	156	0	0	0	109.3	L408 L418 L422 D465 L469 L470 V471 F514	L408-I467 HydrophobicContact CD2-CD1 4.48Å; L408-I467 HydrophobicContact CD2-CG1 4.24Å; L418-I467 HydrophobicContact CD1-CG1 4.01Å; L422-I467 HydrophobicContact CB-CD1 4.34Å; L422-I467 HydrophobicContact CD2-CD1 3.42Å; L422-I467 VanDerWaalsContact CD2-CD1 3.42Å; L422-I467 HydrophobicContact CG-CD1 3.64Å; D465-I467 VanDerWaalsContact C-N 3.29Å; D465-I467 PolarHBondContact O-N 2.88Å; D465-I467 PolarHBondContact OD1-N 3.47Å; I467-L469 VanDerWaalsContact C-N 3.3Å; I467-L469 PolarHBondContact O-N 2.74Å; I467-L470 PolarHBondContact O-N 3.25Å; I467-L470 VanDerWaalsContact O-N 3.13Å; I467-V471 HydrophobicContact CG2-CG2 4.28Å; I467-V471 VanDerWaalsContact O-CG2 3.3Å; I467-V471 WeakPolarHBondContact O-CG2 3.12Å; I467-V471 PolarHBondContact O-N 2.89Å; I467-F514 HydrophobicContact CG2-CZ 4.31Å
468	S	80.1	Confident	72.2	Confident	7 Å²	7	42.9 Å²	42.9	5%	0.049	25%	0.247	C	C	.	.	H	α-helix	trans	-53.9	-45.4	172.2	-57.8	0	0	0	0	112	L430 S463 D465 V471 S472	L430-S468 WeakPolarHBondContact CD2-OG 3.36Å; S463-S468 VanDerWaalsContact OG-CB 3.31Å; S463-S468 WeakPolarHBondContact OG-CB 3.11Å; D465-S468 WeakPolarHBondContact CB-OG 3.27Å; D465-S468 WeakPolarHBondContact O-CB 3.38Å; D465-S468 PolarHBondContact O-N 3.42Å; D465-S468 PolarHBondContact OD2-N 2.7Å; D465-S468 PolarHBondContact OD2-OG 3.4Å; S468-V471 PolarHBondContact O-N 3.48Å; S468-S472 WeakPolarHBondContact O-CB 3.38Å; S468-S472 PolarHBondContact O-N 2.99Å
469	L	82.5	Confident	73.7	Confident	10 Å²	10	43.5 Å²	43.5	5%	0.052	24%	0.24	C	C	.	.	H	α-helix	trans	-63.4	-41.1	176	-88.5	90.7	0	0	0	113	I370 L383 S463 D465 I466 I467 S472 I473	I370-L469 HydrophobicContact CD1-CB 4.24Å; I370-L469 HydrophobicContact CD1-CD2 4.15Å; I370-L469 HydrophobicContact CG1-CD2 4.09Å; I370-L469 HydrophobicContact CG2-CD2 4.36Å; L383-L469 HydrophobicContact CD1-CD2 4.32Å; L383-L469 HydrophobicContact CD2-CD2 3.56Å; S463-L469 WeakPolarHBondContact O-CD1 3.49Å; D465-L469 WeakPolarHBondContact O-CD1 3.43Å; D465-L469 PolarHBondContact O-N 3.18Å; I466-L469 PolarHBondContact O-N 2.88Å; I467-L469 VanDerWaalsContact C-N 3.3Å; I467-L469 PolarHBondContact O-N 2.74Å; L469-S472 PolarHBondContact O-OG 3Å; L469-I473 WeakPolarHBondContact O-CG1 3.16Å
470	L	84.3	Confident	75.2	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-65.9	-42.2	177.3	-75.1	166.4	0	0	0	111.6	L363 Y366 I404 L418 I466 I467 I473	L363-L470 HydrophobicContact CD2-CD2 4.12Å; Y366-L470 HydrophobicContact CD1-CD2 3.72Å; Y366-L470 HydrophobicContact CE1-CD2 3.69Å; Y366-L470 HydrophobicContact CE1-CG 4.43Å; I404-L470 HydrophobicContact CD1-CD2 4.3Å; L418-L470 HydrophobicContact CD1-CD1 3.61Å; L418-L470 HydrophobicContact CD2-CD1 4.03Å; I466-L470 HydrophobicContact CG2-CD1 4.09Å; I466-L470 WeakPolarHBondContact O-CG 3.33Å; I466-L470 PolarHBondContact O-N 3.33Å; I467-L470 PolarHBondContact O-N 3.25Å; I467-L470 VanDerWaalsContact O-N 3.13Å; L470-I473 HydrophobicContact CD2-CD1 4.35Å; L470-I473 VanDerWaalsContact O-CB 3.29Å; L470-I473 WeakPolarHBondContact O-CB 3.38Å; L470-I473 WeakPolarHBondContact O-CG1 3.14Å; L470-I473 PolarHBondContact O-N 3.04Å
471	V	82.3	Confident	76.8	Confident	10 Å²	10	33.5 Å²	33.5	6%	0.061	19%	0.191	C	C	.	.	H	α-helix	trans	-67.9	-38.8	178.1	175.5	0	0	0	0	111.1	I467 S468 I473 Y474 G475 K477 F480 F514	I467-V471 HydrophobicContact CG2-CG2 4.28Å; I467-V471 VanDerWaalsContact O-CG2 3.3Å; I467-V471 WeakPolarHBondContact O-CG2 3.12Å; I467-V471 PolarHBondContact O-N 2.89Å; S468-V471 PolarHBondContact O-N 3.48Å; V471-I473 PolarHBondContact O-N 3.33Å; V471-Y474 PolarHBondContact O-N 2.79Å; V471-G475 PolarHBondContact O-N 2.86Å; V471-K477 HydrophobicContact CG1-CB 4.48Å; V471-K477 HydrophobicContact CG1-CG 3.9Å; V471-F480 HydrophobicContact CB-CD2 4.46Å; V471-F480 HydrophobicContact CB-CE2 4.11Å; V471-F480 HydrophobicContact CG1-CD2 4.14Å; V471-F480 HydrophobicContact CG1-CE2 4.1Å; V471-F480 HydrophobicContact CG2-CD2 4.11Å; V471-F480 HydrophobicContact CG2-CE2 4.01Å; V471-F480 HydrophobicContact CG2-CG 4.41Å; V471-F480 HydrophobicContact CG2-CZ 4.23Å; V471-F514 HydrophobicContact CG1-CE1 4.46Å; V471-F514 HydrophobicContact CG2-CE1 3.88Å; V471-F514 HydrophobicContact CG2-CZ 3.84Å
472	S	79.9	Confident	78.2	Confident	62 Å²	62	29.8 Å²	29.8	43%	0.434	18%	0.18	S	C	.	.	H	α-helix	trans	-59.5	-20.4	176.4	80.2	0	0	0	0	113.6	S468 L469 Y474 G475	S468-S472 WeakPolarHBondContact O-CB 3.38Å; S468-S472 PolarHBondContact O-N 2.99Å; L469-S472 PolarHBondContact O-OG 3Å; S472-Y474 VanDerWaalsContact C-N 3.26Å; S472-Y474 PolarHBondContact O-N 2.78Å; S472-G475 PolarHBondContact O-N 3.11Å
473	I	81.6	Confident	79.2	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.005	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-40.6	173.6	-58.1	179.1	0	0	0	109.5	Y366 R391 L394 R395 L469 L470 V471	Y366-I473 HydrophobicContact CE1-CD1 3.8Å; R391-I473 HydrophobicContact CB-CG1 4.37Å; R391-I473 HydrophobicContact CB-CG2 4.4Å; R391-I473 HydrophobicContact CG-CD1 4.15Å; R391-I473 HydrophobicContact CG-CG1 3.99Å; L394-I473 HydrophobicContact CD1-CD1 4.01Å; R395-I473 HydrophobicContact CG-CG2 3.59Å; R395-I473 PolarHBondContact NE-O 3.2Å; R395-I473 PolarHBondContact NH2-O 3.45Å; L469-I473 WeakPolarHBondContact O-CG1 3.16Å; L470-I473 HydrophobicContact CD2-CD1 4.35Å; L470-I473 VanDerWaalsContact O-CB 3.29Å; L470-I473 WeakPolarHBondContact O-CB 3.38Å; L470-I473 WeakPolarHBondContact O-CG1 3.14Å; L470-I473 PolarHBondContact O-N 3.04Å; V471-I473 PolarHBondContact O-N 3.33Å
474	Y	78.4	Confident	80.4	Confident	46 Å²	46	28.1 Å²	28.1	18%	0.18	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-9.1	-175.5	-63.5	-84	0	0	0	113.7	L394 R395 T400 V401 I404 V471 S472 S476 F480	L394-Y474 PolarHBondContact O-OH 3.05Å; R395-Y474 HydrophobicContact CG-CE1 4.36Å; T400-Y474 WeakPolarHBondContact CB-OH 3.2Å; T400-Y474 PolarHBondContact OG1-OH 2.86Å; V401-Y474 HydrophobicContact CG2-CD1 4.33Å; V401-Y474 HydrophobicContact CG2-CD2 4.33Å; V401-Y474 HydrophobicContact CG2-CE1 4.07Å; V401-Y474 HydrophobicContact CG2-CE2 4.03Å; V401-Y474 HydrophobicContact CG2-CG 4.48Å; I404-Y474 HydrophobicContact CD1-CE2 4.41Å; V471-Y474 PolarHBondContact O-N 2.79Å; S472-Y474 VanDerWaalsContact C-N 3.26Å; S472-Y474 PolarHBondContact O-N 2.78Å; Y474-S476 PolarHBondContact O-N 3.39Å; Y474-F480 AromaticContact CD2-CE2 3.63Å; Y474-F480 HydrophobicContact CD2-CE2 3.63Å; Y474-F480 AromaticContact CD2-CZ 3.51Å; Y474-F480 HydrophobicContact CD2-CZ 3.51Å; Y474-F480 HydrophobicContact CE2-CZ 4Å; Y474-F480 HydrophobicContact CG-CE2 4.22Å; Y474-F480 HydrophobicContact CG-CZ 4.48Å
475	G	69.9	Low	81.5	Confident	66 Å²	66	26.2 Å²	26.2	68%	0.68	15%	0.152	S	C	*	.	S	Bend	trans	78.2	-39	177.4	0	0	0	0	0	113.7	V471 S472	V471-G475 PolarHBondContact O-N 2.86Å; S472-G475 PolarHBondContact O-N 3.11Å
476	S	76.2	Confident	81.9	Confident	30 Å²	30	25.5 Å²	25.5	21%	0.21	15%	0.148	C	C	.	.			trans	-105.4	135.6	174.9	178.4	0	0	0	0	112.5	Y474 E478	Y474-S476 PolarHBondContact O-N 3.39Å; S476-E478 VanDerWaalsContact C-N 3.29Å; S476-E478 WeakPolarHBondContact OG-CB 3.49Å; S476-E478 PolarHBondContact OG-N 3.14Å; S476-E478 VanDerWaalsContact OG-N 3.12Å
477	K	78.5	Confident	81.9	Confident	45 Å²	45	26.3 Å²	26.3	20%	0.196	15%	0.153	C	C	.	.	S	Bend	trans	-71.1	-26.6	172.2	-60.9	170.5	-173.3	170.9	0	111.5	L430 V471 I479 F480 I481 F514	L430-K477 VanDerWaalsContact C-NZ 3.26Å; L430-K477 HydrophobicContact CB-CD 4.38Å; L430-K477 HydrophobicContact CD1-CD 4.49Å; L430-K477 PolarHBondContact O-NZ 2.74Å; V471-K477 HydrophobicContact CG1-CB 4.48Å; V471-K477 HydrophobicContact CG1-CG 3.9Å; K477-I479 VanDerWaalsContact C-N 3.3Å; K477-I479 PolarHBondContact O-N 3.02Å; K477-F480 PolarHBondContact O-N 3.19Å; K477-I481 HydrophobicContact CB-CD1 4.42Å; K477-I481 WeakPolarHBondContact O-CG1 3.48Å; K477-I481 PolarHBondContact O-N 3.06Å; K477-F514 HydrophobicContact CB-CD1 4.31Å; K477-F514 HydrophobicContact CB-CE1 4.49Å; K477-F514 HydrophobicContact CG-CD1 4.49Å
478	E	76.5	Confident	82.1	Confident	53 Å²	53	26.2 Å²	26.2	25%	0.248	15%	0.153	C	C	.	.	H	α-helix	trans	-62.8	-35.2	-173.7	-60.8	-176.7	161.6	0	0	112.7	S476 F480 I481 D482	S476-E478 VanDerWaalsContact C-N 3.29Å; S476-E478 WeakPolarHBondContact OG-CB 3.49Å; S476-E478 PolarHBondContact OG-N 3.14Å; S476-E478 VanDerWaalsContact OG-N 3.12Å; E478-F480 VanDerWaalsContact C-N 3.25Å; E478-F480 PolarHBondContact O-N 2.98Å; E478-I481 PolarHBondContact O-N 2.85Å; E478-I481 VanDerWaalsContact O-N 3.08Å; E478-D482 WeakPolarHBondContact O-CB 3.49Å; E478-D482 PolarHBondContact O-N 2.68Å
479	I	83.3	Confident	82.4	Confident	58 Å²	58	25.9 Å²	25.9	30%	0.297	15%	0.15	S	C	.	.	H	α-helix	trans	-59.7	-39.1	179.6	-59.6	166.7	0	0	0	110.8	V401 K477 E483	V401-I479 HydrophobicContact CG1-CG2 4.2Å; V401-I479 HydrophobicContact CG2-CG2 4.01Å; K477-I479 VanDerWaalsContact C-N 3.3Å; K477-I479 PolarHBondContact O-N 3.02Å; I479-E483 WeakPolarHBondContact O-CB 3.28Å; I479-E483 PolarHBondContact O-N 3.23Å; I479-E483 VanDerWaalsContact O-N 3.15Å
480	F	84.3	Confident	82.4	Confident	7 Å²	7	26.3 Å²	26.3	3%	0.031	15%	0.153	C	C	.	.	H	α-helix	trans	-71.4	-37.5	177.1	-72.4	-89.7	0	0	0	112.2	V401 I404 V405 V471 Y474 K477 E478 Y484	V401-F480 HydrophobicContact CG1-CD1 3.81Å; V401-F480 HydrophobicContact CG1-CE1 4.05Å; V401-F480 HydrophobicContact CG1-CG 4.18Å; I404-F480 HydrophobicContact CB-CE1 4.06Å; I404-F480 HydrophobicContact CD1-CE1 3.85Å; I404-F480 HydrophobicContact CD1-CZ 4.15Å; I404-F480 HydrophobicContact CG2-CD1 4.33Å; I404-F480 HydrophobicContact CG2-CE1 3.75Å; V405-F480 HydrophobicContact CG2-CD1 4.37Å; V471-F480 HydrophobicContact CB-CD2 4.46Å; V471-F480 HydrophobicContact CB-CE2 4.11Å; V471-F480 HydrophobicContact CG1-CD2 4.14Å; V471-F480 HydrophobicContact CG1-CE2 4.1Å; V471-F480 HydrophobicContact CG2-CD2 4.11Å; V471-F480 HydrophobicContact CG2-CE2 4.01Å; V471-F480 HydrophobicContact CG2-CG 4.41Å; V471-F480 HydrophobicContact CG2-CZ 4.23Å; Y474-F480 AromaticContact CD2-CE2 3.63Å; Y474-F480 HydrophobicContact CD2-CE2 3.63Å; Y474-F480 AromaticContact CD2-CZ 3.51Å; Y474-F480 HydrophobicContact CD2-CZ 3.51Å; Y474-F480 HydrophobicContact CE2-CZ 4Å; Y474-F480 HydrophobicContact CG-CE2 4.22Å; Y474-F480 HydrophobicContact CG-CZ 4.48Å; K477-F480 PolarHBondContact O-N 3.19Å; E478-F480 VanDerWaalsContact C-N 3.25Å; E478-F480 PolarHBondContact O-N 2.98Å; F480-Y484 VanDerWaalsContact O-CB 3.28Å; F480-Y484 WeakPolarHBondContact O-CB 3.3Å; F480-Y484 PolarHBondContact O-N 3.06Å
481	I	85.3	Confident	82.2	Confident	16 Å²	16	27.8 Å²	27.8	8%	0.082	16%	0.158	C	C	.	.	H	α-helix	trans	-69.7	-44	-178.9	-60.2	161.2	0	0	0	110.1	K477 E478 Y484 R485 H518 M519	K477-I481 HydrophobicContact CB-CD1 4.42Å; K477-I481 WeakPolarHBondContact O-CG1 3.48Å; K477-I481 PolarHBondContact O-N 3.06Å; E478-I481 PolarHBondContact O-N 2.85Å; E478-I481 VanDerWaalsContact O-N 3.08Å; I481-Y484 PolarHBondContact O-N 3.47Å; I481-R485 WeakPolarHBondContact O-CB 3.42Å; I481-R485 PolarHBondContact O-N 3.1Å; I481-H518 HydrophobicContact CD1-CB 3.59Å; I481-H518 WeakPolarHBondContact CG2-O 3.25Å; I481-M519 HydrophobicContact CB-CE 4.17Å; I481-M519 HydrophobicContact CD1-CE 4.29Å; I481-M519 HydrophobicContact CG1-CE 3.6Å; I481-M519 HydrophobicContact CG2-CE 3.74Å
482	D	83.3	Confident	82.3	Confident	38 Å²	38	27.4 Å²	27.4	20%	0.203	16%	0.156	C	C	.	.	H	α-helix	trans	-64	-42	176.8	-87.9	-13.8	0	0	0	111.6	E478 R485 T486 K718	E478-D482 WeakPolarHBondContact O-CB 3.49Å; E478-D482 PolarHBondContact O-N 2.68Å; D482-R485 PolarHBondContact O-N 3.35Å; D482-R485 IonicContact OD1-CZ 3.95Å; D482-R485 IonicContact OD1-NE 3.48Å; D482-R485 IonicContact OD1-NH2 2.6Å; D482-R485 PolarHBondContact OD1-NH2 2.67Å; D482-T486 WeakPolarHBondContact O-CB 3.42Å; D482-T486 PolarHBondContact O-N 3.49Å; D482-T486 PolarHBondContact O-OG1 2.97Å; D482-K718 IonicContact OD2-NZ 3.41Å
483	E	85.6	Confident	82.4	Confident	19 Å²	19	25.4 Å²	25.4	9%	0.089	14%	0.14	C	C	.	.	H	α-helix	trans	-63.8	-45.3	172.6	-85.1	-57.2	104.1	0	0	112	V401 V405 I479 R485 T486 V487 Q711	V401-E483 HydrophobicContact CB-CG 4.03Å; V401-E483 HydrophobicContact CG1-CB 3.82Å; V401-E483 HydrophobicContact CG1-CG 3.54Å; V405-E483 HydrophobicContact CG2-CB 4.18Å; I479-E483 WeakPolarHBondContact O-CB 3.28Å; I479-E483 PolarHBondContact O-N 3.23Å; I479-E483 VanDerWaalsContact O-N 3.15Å; E483-R485 VanDerWaalsContact C-N 3.33Å; E483-R485 PolarHBondContact O-N 3.11Å; E483-T486 WeakPolarHBondContact O-CB 3.33Å; E483-T486 PolarHBondContact O-N 3.02Å; E483-T486 VanDerWaalsContact O-N 3.15Å; E483-V487 WeakPolarHBondContact O-CB 3.42Å; E483-V487 VanDerWaalsContact O-CG2 3.32Å; E483-V487 WeakPolarHBondContact O-CG2 3.37Å; E483-V487 PolarHBondContact O-N 3.29Å; E483-Q711 VanDerWaalsContact CD-NE2 3.29Å; E483-Q711 VanDerWaalsContact CG-NE2 3.27Å; E483-Q711 WeakPolarHBondContact OE1-CG 3.2Å; E483-Q711 PolarHBondContact OE1-NE2 3.47Å
484	Y	87.9	Confident	82	Confident	6 Å²	6	30.3 Å²	30.3	2%	0.024	16%	0.163	C	C	.	.	H	α-helix	trans	-61.4	-42	177.6	178.8	-117.4	0	0	0	112.1	V405 T409 F480 I481 T486 V487 L488 V507 L510 M519 C522	V405-Y484 HydrophobicContact CG1-CD2 3.71Å; V405-Y484 HydrophobicContact CG1-CG 4.31Å; T409-Y484 HydrophobicContact CG2-CD2 4.02Å; T409-Y484 HydrophobicContact CG2-CE2 3.49Å; T409-Y484 VanDerWaalsContact CG2-CE2 3.49Å; F480-Y484 VanDerWaalsContact O-CB 3.28Å; F480-Y484 WeakPolarHBondContact O-CB 3.3Å; F480-Y484 PolarHBondContact O-N 3.06Å; I481-Y484 PolarHBondContact O-N 3.47Å; Y484-T486 VanDerWaalsContact C-N 3.3Å; Y484-T486 PolarHBondContact O-N 3.36Å; Y484-V487 PolarHBondContact O-N 2.59Å; Y484-L488 WeakPolarHBondContact O-CB 3.32Å; Y484-L488 PolarHBondContact O-N 2.95Å; Y484-V507 HydrophobicContact CE1-CG2 4.01Å; Y484-V507 VanDerWaalsContact OH-CG2 3.31Å; Y484-V507 WeakPolarHBondContact OH-CG2 3.43Å; Y484-L510 HydrophobicContact CD1-CD1 3.87Å; Y484-L510 HydrophobicContact CD2-CD1 4.28Å; Y484-L510 HydrophobicContact CE1-CD1 3.55Å; Y484-L510 HydrophobicContact CE2-CD1 4Å; Y484-L510 HydrophobicContact CG-CD1 4.21Å; Y484-M519 HydrophobicContact CD1-SD 4.41Å; Y484-M519 HydrophobicContact CE1-SD 4.44Å; Y484-C522 HydrophobicContact CD1-CB 4.47Å; Y484-C522 VanDerWaalsContact CD1-SG 3.6Å; Y484-C522 HydrophobicContact CE1-CB 4.09Å
485	R	87.8	Confident	81.5	Confident	41 Å²	41	33.4 Å²	33.4	16%	0.155	18%	0.179	C	C	.	.	H	α-helix	trans	-58.2	-44.1	173.4	-179	-179.3	62.2	-177	-9.5	111.5	I481 D482 E483 L488 A489 M525 P567	I481-R485 WeakPolarHBondContact O-CB 3.42Å; I481-R485 PolarHBondContact O-N 3.1Å; D482-R485 PolarHBondContact O-N 3.35Å; D482-R485 IonicContact OD1-CZ 3.95Å; D482-R485 IonicContact OD1-NE 3.48Å; D482-R485 IonicContact OD1-NH2 2.6Å; D482-R485 PolarHBondContact OD1-NH2 2.67Å; E483-R485 VanDerWaalsContact C-N 3.33Å; E483-R485 PolarHBondContact O-N 3.11Å; R485-L488 PolarHBondContact O-N 3.29Å; R485-A489 WeakPolarHBondContact O-CB 3.42Å; R485-A489 PolarHBondContact O-N 3.28Å; R485-M525 HydrophobicContact CG-CE 4.44Å; R485-M525 HydrophobicContact CG-SD 3.72Å; R485-P567 HydrophobicContact CG-CG 4.46Å
486	T	85.8	Confident	80.9	Confident	13 Å²	13	34.3 Å²	34.3	8%	0.08	17%	0.168	C	C	.	.	H	α-helix	trans	-65	-48.3	179.6	-59.3	0	0	0	0	111.6	D482 E483 Y484 L488 A489 D490 T708	D482-T486 WeakPolarHBondContact O-CB 3.42Å; D482-T486 PolarHBondContact O-N 3.49Å; D482-T486 PolarHBondContact O-OG1 2.97Å; E483-T486 WeakPolarHBondContact O-CB 3.33Å; E483-T486 PolarHBondContact O-N 3.02Å; E483-T486 VanDerWaalsContact O-N 3.15Å; Y484-T486 VanDerWaalsContact C-N 3.3Å; Y484-T486 PolarHBondContact O-N 3.36Å; T486-L488 VanDerWaalsContact C-N 3.34Å; T486-L488 PolarHBondContact O-N 3.14Å; T486-A489 WeakPolarHBondContact O-CB 3.24Å; T486-A489 PolarHBondContact O-N 2.99Å; T486-D490 PolarHBondContact O-N 2.88Å; T486-T708 HydrophobicContact CG2-CG2 4.19Å; T486-T708 WeakPolarHBondContact CG2-OG1 3.39Å
487	V	84.9	Confident	79.9	Confident	19 Å²	19	40.4 Å²	40.4	12%	0.115	20%	0.198	C	C	.	.	H	α-helix	trans	-64.4	-37.9	177.5	170.9	0	0	0	0	111.7	R402 V405 E483 Y484 R491	R402-V487 HydrophobicContact CG-CG2 4.21Å; V405-V487 HydrophobicContact CG1-CB 4.44Å; V405-V487 HydrophobicContact CG1-CG2 4.46Å; E483-V487 WeakPolarHBondContact O-CB 3.42Å; E483-V487 VanDerWaalsContact O-CG2 3.32Å; E483-V487 WeakPolarHBondContact O-CG2 3.37Å; E483-V487 PolarHBondContact O-N 3.29Å; Y484-V487 PolarHBondContact O-N 2.59Å; V487-R491 WeakPolarHBondContact O-CB 3.35Å; V487-R491 WeakPolarHBondContact O-CG 3.28Å; V487-R491 PolarHBondContact O-N 3.33Å
488	L	86.4	Confident	79.3	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.7	-43.3	174.6	-178.2	64.6	0	0	0	110.8	Y484 R485 T486 R491 L492 E503 C522 M525 L526	Y484-L488 WeakPolarHBondContact O-CB 3.32Å; Y484-L488 PolarHBondContact O-N 2.95Å; R485-L488 PolarHBondContact O-N 3.29Å; T486-L488 VanDerWaalsContact C-N 3.34Å; T486-L488 PolarHBondContact O-N 3.14Å; L488-R491 PolarHBondContact O-N 2.89Å; L488-L492 HydrophobicContact CD1-CD1 4.1Å; L488-L492 HydrophobicContact CD1-CG 4.12Å; L488-L492 HydrophobicContact CG-CD1 3.94Å; L488-L492 HydrophobicContact CG-CG 4.33Å; L488-L492 WeakPolarHBondContact O-CB 3.27Å; L488-L492 VanDerWaalsContact O-CG 3.25Å; L488-L492 WeakPolarHBondContact O-CG 3.48Å; L488-L492 PolarHBondContact O-N 3.44Å; L488-E503 HydrophobicContact CD1-CB 4.01Å; L488-E503 HydrophobicContact CD1-CG 3.87Å; L488-C522 HydrophobicContact CD2-CB 3.74Å; L488-M525 HydrophobicContact CB-CE 4.4Å; L488-M525 HydrophobicContact CD2-CE 4.31Å; L488-M525 HydrophobicContact CD2-SD 4.4Å; L488-M525 HydrophobicContact CG-CE 4.22Å; L488-L526 HydrophobicContact CD1-CD2 4.33Å
489	A	86.8	Confident	78.8	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.4	-49.4	177	0	0	0	0	0	111.1	R485 T486 R491 L492 L493 M525 W566 P567 T708	R485-A489 WeakPolarHBondContact O-CB 3.42Å; R485-A489 PolarHBondContact O-N 3.28Å; T486-A489 WeakPolarHBondContact O-CB 3.24Å; T486-A489 PolarHBondContact O-N 2.99Å; A489-R491 PolarHBondContact O-N 2.93Å; A489-L492 PolarHBondContact O-N 2.96Å; A489-L493 WeakPolarHBondContact O-CB 3.28Å; A489-L493 VanDerWaalsContact O-CG 3.23Å; A489-L493 WeakPolarHBondContact O-CG 3.4Å; A489-L493 PolarHBondContact O-N 3.39Å; A489-M525 HydrophobicContact CB-CE 3.62Å; A489-W566 HydrophobicContact CB-CE3 3.86Å; A489-W566 HydrophobicContact CB-CZ3 3.87Å; A489-P567 HydrophobicContact CB-CG 3.45Å; A489-P567 VanDerWaalsContact CB-CG 3.45Å; A489-T708 HydrophobicContact CB-CG2 4.24Å
490	D	81.9	Confident	78.6	Confident	19 Å²	19	40.8 Å²	40.8	10%	0.102	20%	0.203	C	C	.	.	H	α-helix	trans	-57	-49.7	176.6	-77.9	-20.6	0	0	0	110.2	T486 L492 L493 H494 S706 N707	T486-D490 PolarHBondContact O-N 2.88Å; D490-L492 PolarHBondContact O-N 2.95Å; D490-L493 PolarHBondContact O-N 3.32Å; D490-H494 PolarHBondContact O-N 3.37Å; D490-H494 VanDerWaalsContact O-N 3.13Å; D490-H494 PolarHBondContact O-ND1 3Å; D490-S706 PolarHBondContact OD1-OG 3.33Å; D490-S706 PolarHBondContact OD2-OG 3.05Å; D490-N707 PolarHBondContact OD1-N 3.06Å
491	R	80.3	Confident	78.6	Confident	35 Å²	35	43 Å²	43	13%	0.132	22%	0.223	C	C	.	.	H	α-helix	trans	-57.9	-44.6	178.8	-80.9	-173.1	-99.6	-162.6	-27.8	114	T409 D411 V487 L488 A489 L493 E503	T409-R491 PolarHBondContact OG1-NH2 3.29Å; D411-R491 IonicContact OD1-NH1 3.49Å; D411-R491 IonicContact OD2-CZ 2.74Å; D411-R491 IonicContact OD2-NE 3.02Å; D411-R491 IonicContact OD2-NH1 3.48Å; D411-R491 PolarHBondContact OD2-NH1 2.89Å; D411-R491 IonicContact OD2-NH2 3.89Å; D411-R491 PolarHBondContact OD2-NH2 2.9Å; V487-R491 WeakPolarHBondContact O-CB 3.35Å; V487-R491 WeakPolarHBondContact O-CG 3.28Å; V487-R491 PolarHBondContact O-N 3.33Å; L488-R491 PolarHBondContact O-N 2.89Å; A489-R491 PolarHBondContact O-N 2.93Å; R491-L493 VanDerWaalsContact C-N 3.33Å; R491-E503 WeakPolarHBondContact CD-OE1 3.41Å; R491-E503 IonicContact CZ-OE1 3.13Å; R491-E503 IonicContact NE-OE1 2.74Å; R491-E503 IonicContact NH1-OE1 3.95Å; R491-E503 PolarHBondContact NH1-OE1 3.39Å; R491-E503 IonicContact NH1-OE2 2.85Å
492	L	84.6	Confident	78.5	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-69.7	-31.1	-178	-67.9	178.8	0	0	0	112.4	L488 A489 D490 Y498 M525 L526 M529 W566	L488-L492 HydrophobicContact CD1-CD1 4.1Å; L488-L492 HydrophobicContact CD1-CG 4.12Å; L488-L492 HydrophobicContact CG-CD1 3.94Å; L488-L492 HydrophobicContact CG-CG 4.33Å; L488-L492 WeakPolarHBondContact O-CB 3.27Å; L488-L492 VanDerWaalsContact O-CG 3.25Å; L488-L492 WeakPolarHBondContact O-CG 3.48Å; L488-L492 PolarHBondContact O-N 3.44Å; A489-L492 PolarHBondContact O-N 2.96Å; D490-L492 PolarHBondContact O-N 2.95Å; L492-Y498 HydrophobicContact CD2-CD1 3.7Å; L492-Y498 HydrophobicContact CD2-CE1 3.98Å; L492-M525 HydrophobicContact CD1-CB 4.34Å; L492-L526 HydrophobicContact CD1-CD2 4.17Å; L492-L526 HydrophobicContact CD2-CD2 4.14Å; L492-M529 HydrophobicContact CB-CG 4.39Å; L492-M529 HydrophobicContact CB-SD 4.1Å; L492-M529 HydrophobicContact CD1-CG 3.86Å; L492-M529 HydrophobicContact CD2-CG 3.99Å; L492-M529 HydrophobicContact CG-CG 4.29Å; L492-W566 HydrophobicContact CB-CH2 3.78Å; L492-W566 HydrophobicContact CB-CZ3 4.4Å; L492-W566 HydrophobicContact CD1-CH2 3.81Å; L492-W566 HydrophobicContact CD1-CZ2 4.19Å; L492-W566 HydrophobicContact CG-CH2 4.46Å
493	L	80.6	Confident	78.6	Confident	21 Å²	21	45.3 Å²	45.3	11%	0.11	23%	0.228	C	C	.	.	H	α-helix	trans	-77.9	-33	179.4	-68.9	172	0	0	0	113.1	A489 D490 R491 Q495 L561 W566 L569 L606 N707	A489-L493 WeakPolarHBondContact O-CB 3.28Å; A489-L493 VanDerWaalsContact O-CG 3.23Å; A489-L493 WeakPolarHBondContact O-CG 3.4Å; A489-L493 PolarHBondContact O-N 3.39Å; D490-L493 PolarHBondContact O-N 3.32Å; R491-L493 VanDerWaalsContact C-N 3.33Å; L493-Q495 VanDerWaalsContact C-N 3.33Å; L493-Q495 PolarHBondContact O-N 3.16Å; L493-L561 HydrophobicContact CD2-CD1 3.93Å; L493-W566 HydrophobicContact CD1-CZ3 4.29Å; L493-W566 HydrophobicContact CD2-CZ3 4.13Å; L493-W566 HydrophobicContact CG-CZ3 3.94Å; L493-L569 HydrophobicContact CD1-CD2 3.97Å; L493-L606 HydrophobicContact CD1-CD1 4.39Å; L493-N707 HydrophobicContact CD1-CB 4.26Å
494	H	74.4	Confident	78.7	Confident	103 Å²	103	47.7 Å²	47.7	48%	0.477	24%	0.241	S	C	.	.	H	α-helix	trans	-73.6	-18.1	-176.1	-76	82.1	0	0	0	114.2	D490 N707	D490-H494 PolarHBondContact O-N 3.37Å; D490-H494 VanDerWaalsContact O-N 3.13Å; D490-H494 PolarHBondContact O-ND1 3Å; H494-N707 PolarHBondContact CE1-ND2 3.23Å
495	Q	66.8	Low	78.6	Confident	111 Å²	111	55.5 Å²	55.5	52%	0.519	27%	0.27	S	S	.	.			trans	-131.5	109.1	-175	-64.9	-171	6.7	0	0	113.9	L493 N497 Y498	L493-Q495 VanDerWaalsContact C-N 3.33Å; L493-Q495 PolarHBondContact O-N 3.16Å; Q495-N497 PolarHBondContact O-N 3.48Å; Q495-Y498 HydrophobicContact CB-CD2 4.09Å; Q495-Y498 PolarHBondContact O-N 3.01Å
496	L	57.7	Low	78.5	Confident	85 Å²	85	54.4 Å²	54.4	45%	0.445	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.4	176.2	-71.1	163.6	0	0	0	113.7	I559 S608	L496-I559 HydrophobicContact CD2-CD1 3.9Å; L496-I559 HydrophobicContact CD2-CG1 4.06Å; L496-S608 WeakPolarHBondContact CD1-OG 3.46Å
497	N	56.3	Low	78.6	Confident	159 Å²	159	54 Å²	54	85%	0.85	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	36.9	-178.5	-70.2	-27.9	0	0	0	113	Q495	Q495-N497 PolarHBondContact O-N 3.48Å
498	Y	64.8	Low	78.7	Confident	26 Å²	26	58.6 Å²	58.6	10%	0.102	29%	0.285	C	S	.	.			trans	-64.3	137.3	-175.1	-166.6	-112.3	0	0	0	113.8	L492 Q495 T500 E503 R533	L492-Y498 HydrophobicContact CD2-CD1 3.7Å; L492-Y498 HydrophobicContact CD2-CE1 3.98Å; Q495-Y498 HydrophobicContact CB-CD2 4.09Å; Q495-Y498 PolarHBondContact O-N 3.01Å; Y498-T500 HydrophobicContact CD1-CG2 4.14Å; Y498-T500 PolarHBondContact O-N 3.05Å; Y498-E503 HydrophobicContact CE1-CG 3.48Å; Y498-E503 VanDerWaalsContact CE1-CG 3.48Å; Y498-E503 WeakPolarHBondContact OH-CG 3.37Å; Y498-E503 PolarHBondContact OH-OE1 2.97Å; Y498-R533 VanDerWaalsContact O-CZ 3.27Å; Y498-R533 PolarHBondContact O-NH1 3.28Å; Y498-R533 PolarHBondContact O-NH2 3.13Å
499	N	67	Low	78.6	Confident	115 Å²	115	60.6 Å²	60.6	62%	0.615	30%	0.296	S	S	*	.			trans	-82.2	99.3	168.5	-174.6	0.9	0	0	0	109.8	A501	N499-A501 PolarHBondContact O-N 3.42Å; N499-A501 WeakPolarHBondContact OD1-CB 3.29Å; N499-A501 PolarHBondContact OD1-N 3.33Å; N499-A501 VanDerWaalsContact OD1-N 3.12Å
500	T	78.9	Confident	78.5	Confident	22 Å²	22	61 Å²	61	14%	0.135	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-12.2	-179.1	51.2	0	0	0	0	113.8	Y498 R502 E503 I504 L526 M529	Y498-T500 HydrophobicContact CD1-CG2 4.14Å; Y498-T500 PolarHBondContact O-N 3.05Å; T500-R502 VanDerWaalsContact C-N 3.27Å; T500-R502 PolarHBondContact O-N 2.97Å; T500-E503 PolarHBondContact O-N 3.03Å; T500-I504 VanDerWaalsContact O-CG1 3.27Å; T500-I504 WeakPolarHBondContact O-CG1 3.26Å; T500-I504 PolarHBondContact O-N 2.94Å; T500-L526 HydrophobicContact CG2-CD2 4.46Å; T500-M529 HydrophobicContact CG2-CB 4.28Å
501	A	83.4	Confident	78.7	Confident	54 Å²	54	61.9 Å²	61.9	45%	0.446	30%	0.3	S	S	.	.	H	α-helix	trans	-60.1	-35.7	-176.2	0	0	0	0	0	113.3	N499 R505	N499-A501 PolarHBondContact O-N 3.42Å; N499-A501 WeakPolarHBondContact OD1-CB 3.29Å; N499-A501 PolarHBondContact OD1-N 3.33Å; N499-A501 VanDerWaalsContact OD1-N 3.12Å; A501-R505 PolarHBondContact O-N 3.22Å
502	R	83.1	Confident	78.8	Confident	103 Å²	103	64.8 Å²	64.8	39%	0.389	32%	0.318	S	S	.	.	H	α-helix	trans	-66.3	-46.1	177.4	-176.8	179.4	176.6	-156.5	-4	111.4	T409 G410 D411 T500 R505 N506	T409-R502 PolarHBondContact O-NH2 3.4Å; G410-R502 PolarHBondContact O-NH2 3.34Å; G410-R502 VanDerWaalsContact O-NH2 3.07Å; D411-R502 IonicContact OD1-CZ 3.85Å; D411-R502 IonicContact OD1-NH1 3.38Å; D411-R502 PolarHBondContact OD1-NH1 2.96Å; D411-R502 IonicContact OD1-NH2 3.94Å; D411-R502 PolarHBondContact OD1-NH2 3.42Å; T500-R502 VanDerWaalsContact C-N 3.27Å; T500-R502 PolarHBondContact O-N 2.97Å; R502-R505 WeakPolarHBondContact O-CB 3.2Å; R502-R505 PolarHBondContact O-N 3.48Å; R502-N506 PolarHBondContact O-N 3.01Å
503	E	85.7	Confident	78.3	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-71.3	-33.1	-179	-58.5	-58.7	170.4	0	0	112.7	L488 R491 Y498 T500 R505 N506 V507 L526	L488-E503 HydrophobicContact CD1-CB 4.01Å; L488-E503 HydrophobicContact CD1-CG 3.87Å; R491-E503 WeakPolarHBondContact CD-OE1 3.41Å; R491-E503 IonicContact CZ-OE1 3.13Å; R491-E503 IonicContact NE-OE1 2.74Å; R491-E503 IonicContact NH1-OE1 3.95Å; R491-E503 PolarHBondContact NH1-OE1 3.39Å; R491-E503 IonicContact NH1-OE2 2.85Å; Y498-E503 HydrophobicContact CE1-CG 3.48Å; Y498-E503 VanDerWaalsContact CE1-CG 3.48Å; Y498-E503 WeakPolarHBondContact OH-CG 3.37Å; Y498-E503 PolarHBondContact OH-OE1 2.97Å; T500-E503 PolarHBondContact O-N 3.03Å; E503-R505 VanDerWaalsContact C-N 3.32Å; E503-R505 PolarHBondContact O-N 2.84Å; E503-N506 PolarHBondContact O-N 3.48Å; E503-N506 PolarHBondContact OE2-ND2 3.36Å; E503-N506 VanDerWaalsContact OE2-ND2 3.11Å; E503-V507 WeakPolarHBondContact O-CG2 3.31Å; E503-V507 PolarHBondContact O-N 3.09Å; E503-L526 HydrophobicContact CB-CD1 4.2Å; E503-L526 HydrophobicContact CB-CD2 3.74Å
504	I	87.6	Confident	78.2	Confident	69 Å²	69	64.3 Å²	64.3	35%	0.354	32%	0.315	S	S	.	.	H	α-helix	trans	-58.2	-47.6	172	-67.7	164.9	0	0	0	109.9	T500 N506 V507 E508 L526	T500-I504 VanDerWaalsContact O-CG1 3.27Å; T500-I504 WeakPolarHBondContact O-CG1 3.26Å; T500-I504 PolarHBondContact O-N 2.94Å; I504-N506 PolarHBondContact O-N 2.94Å; I504-V507 PolarHBondContact O-N 3.44Å; I504-E508 WeakPolarHBondContact O-CG 3.37Å; I504-E508 PolarHBondContact O-N 3.36Å; I504-L526 HydrophobicContact CG1-CD1 4.01Å
505	R	86.1	Confident	78.4	Confident	170 Å²	170	59.6 Å²	59.6	64%	0.642	29%	0.294	S	S	*	.	H	α-helix	trans	-61.1	-43.3	176.3	-173.3	-173.6	-61	176.8	0.7	112.2	A501 R502 E503 V507 E508 L509	A501-R505 PolarHBondContact O-N 3.22Å; R502-R505 WeakPolarHBondContact O-CB 3.2Å; R502-R505 PolarHBondContact O-N 3.48Å; E503-R505 VanDerWaalsContact C-N 3.32Å; E503-R505 PolarHBondContact O-N 2.84Å; R505-V507 PolarHBondContact O-N 2.81Å; R505-E508 PolarHBondContact O-N 3.32Å; R505-L509 HydrophobicContact CG-CD1 4.4Å; R505-L509 WeakPolarHBondContact O-CG 3.43Å; R505-L509 PolarHBondContact O-N 3.18Å
506	N	86.2	Confident	79	Confident	17 Å²	17	61.5 Å²	61.5	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-60.9	-44.7	178.1	-70.6	-13.4	0	0	0	111.3	R502 E503 I504 L509 L510	R502-N506 PolarHBondContact O-N 3.01Å; E503-N506 PolarHBondContact O-N 3.48Å; E503-N506 PolarHBondContact OE2-ND2 3.36Å; E503-N506 VanDerWaalsContact OE2-ND2 3.11Å; I504-N506 PolarHBondContact O-N 2.94Å; N506-L509 PolarHBondContact O-N 3.36Å; N506-L510 WeakPolarHBondContact O-CB 3.26Å; N506-L510 VanDerWaalsContact O-CG 3.29Å; N506-L510 WeakPolarHBondContact O-CG 3.45Å; N506-L510 PolarHBondContact O-N 3.37Å
507	V	88	Confident	80.1	Confident	5 Å²	5	61.1 Å²	61.1	3%	0.03	31%	0.308	C	S	.	.	H	α-helix	trans	-62.8	-41.7	176.1	172.4	0	0	0	0	111.3	Y484 E503 I504 R505 L509 L510 K511 M519 C522 L526	Y484-V507 HydrophobicContact CE1-CG2 4.01Å; Y484-V507 VanDerWaalsContact OH-CG2 3.31Å; Y484-V507 WeakPolarHBondContact OH-CG2 3.43Å; E503-V507 WeakPolarHBondContact O-CG2 3.31Å; E503-V507 PolarHBondContact O-N 3.09Å; I504-V507 PolarHBondContact O-N 3.44Å; R505-V507 PolarHBondContact O-N 2.81Å; V507-L509 PolarHBondContact O-N 3.32Å; V507-L510 PolarHBondContact O-N 3.16Å; V507-K511 HydrophobicContact CG1-CD 4.27Å; V507-K511 HydrophobicContact CG1-CG 4.35Å; V507-K511 WeakPolarHBondContact O-CB 3.42Å; V507-K511 VanDerWaalsContact O-CG 3.29Å; V507-K511 WeakPolarHBondContact O-CG 3.48Å; V507-K511 PolarHBondContact O-N 3.21Å; V507-M519 HydrophobicContact CG1-CB 4.43Å; V507-C522 HydrophobicContact CG2-CB 4.2Å; V507-L526 HydrophobicContact CB-CD1 4.34Å; V507-L526 HydrophobicContact CG2-CD1 3.7Å
508	E	86.5	Confident	81.2	Confident	115 Å²	115	56.4 Å²	56.4	54%	0.537	28%	0.28	S	S	.	.	H	α-helix	trans	-60.8	-44.1	176.3	-73	169.3	177.8	0	0	112.2	I504 R505 K511 L512	I504-E508 WeakPolarHBondContact O-CG 3.37Å; I504-E508 PolarHBondContact O-N 3.36Å; R505-E508 PolarHBondContact O-N 3.32Å; E508-K511 WeakPolarHBondContact O-CB 3.48Å; E508-K511 PolarHBondContact O-N 3.21Å; E508-L512 PolarHBondContact O-N 2.91Å
509	L	84.1	Confident	82.2	Confident	43 Å²	43	55.3 Å²	55.3	23%	0.225	28%	0.276	C	S	.	.	H	α-helix	trans	-65.2	-40.6	175.8	-68.8	173.5	0	0	0	112	R505 N506 V507 L512	R505-L509 HydrophobicContact CG-CD1 4.4Å; R505-L509 WeakPolarHBondContact O-CG 3.43Å; R505-L509 PolarHBondContact O-N 3.18Å; N506-L509 PolarHBondContact O-N 3.36Å; V507-L509 PolarHBondContact O-N 3.32Å; L509-L512 PolarHBondContact O-N 2.75Å
510	L	85	Confident	83.1	Confident	8 Å²	8	54.1 Å²	54.1	4%	0.042	27%	0.267	C	S	.	.	H	α-helix	trans	-68.3	-34.4	177.1	-70.8	169.7	0	0	0	112	L408 L422 Y484 N506 V507 L512 R513 F514 M519	L408-L510 HydrophobicContact CD1-CD2 4.43Å; L422-L510 HydrophobicContact CD2-CD2 4.31Å; Y484-L510 HydrophobicContact CD1-CD1 3.87Å; Y484-L510 HydrophobicContact CD2-CD1 4.28Å; Y484-L510 HydrophobicContact CE1-CD1 3.55Å; Y484-L510 HydrophobicContact CE2-CD1 4Å; Y484-L510 HydrophobicContact CG-CD1 4.21Å; N506-L510 WeakPolarHBondContact O-CB 3.26Å; N506-L510 VanDerWaalsContact O-CG 3.29Å; N506-L510 WeakPolarHBondContact O-CG 3.45Å; N506-L510 PolarHBondContact O-N 3.37Å; V507-L510 PolarHBondContact O-N 3.16Å; L510-L512 VanDerWaalsContact C-N 3.3Å; L510-L512 PolarHBondContact O-N 3.19Å; L510-R513 PolarHBondContact O-N 2.71Å; L510-R513 VanDerWaalsContact O-N 3.13Å; L510-F514 HydrophobicContact CB-CD2 4.31Å; L510-F514 HydrophobicContact CD2-CD2 3.8Å; L510-F514 HydrophobicContact CD2-CE2 3.56Å; L510-F514 PolarHBondContact O-N 3.24Å; L510-M519 HydrophobicContact CB-CG 4.3Å; L510-M519 HydrophobicContact CB-SD 3.73Å; L510-M519 HydrophobicContact CD1-SD 4.36Å
511	K	85.9	Confident	83.5	Confident	37 Å²	37	58 Å²	58	16%	0.161	28%	0.28	C	S	.	.	H	α-helix	trans	-59	-40.6	173.1	-80	175.7	171.7	-166.1	0	112	V507 E508 R513 G515 M519 E523	V507-K511 HydrophobicContact CG1-CD 4.27Å; V507-K511 HydrophobicContact CG1-CG 4.35Å; V507-K511 WeakPolarHBondContact O-CB 3.42Å; V507-K511 VanDerWaalsContact O-CG 3.29Å; V507-K511 WeakPolarHBondContact O-CG 3.48Å; V507-K511 PolarHBondContact O-N 3.21Å; E508-K511 WeakPolarHBondContact O-CB 3.48Å; E508-K511 PolarHBondContact O-N 3.21Å; K511-R513 PolarHBondContact O-N 3.33Å; K511-G515 CarbonylContact O-C 3.59Å; K511-G515 VanDerWaalsContact O-CA 3.32Å; K511-G515 WeakPolarHBondContact O-CA 3.29Å; K511-G515 PolarHBondContact O-N 3.49Å; K511-M519 HydrophobicContact CG-CB 3.6Å; K511-M519 HydrophobicContact CG-CG 3.85Å; K511-E523 WeakPolarHBondContact CE-OE2 3.34Å; K511-E523 IonicContact NZ-OE1 3.59Å; K511-E523 PolarHBondContact NZ-OE1 3.44Å; K511-E523 IonicContact NZ-OE2 3.18Å; K511-E523 PolarHBondContact NZ-OE2 3.2Å
512	L	81.7	Confident	83.8	Confident	97 Å²	97	55.5 Å²	55.5	51%	0.508	26%	0.258	S	S	.	.	H	α-helix	trans	-62.3	-27.7	177.5	-67.3	174.5	0	0	0	113.1	E508 L509 L510	E508-L512 PolarHBondContact O-N 2.91Å; L509-L512 PolarHBondContact O-N 2.75Å; L510-L512 VanDerWaalsContact C-N 3.3Å; L510-L512 PolarHBondContact O-N 3.19Å
513	R	75.1	Confident	84.2	Confident	7 Å²	7	54.6 Å²	54.6	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-97.4	-51.2	-178.2	-72.5	-74.2	-170.9	-88.9	-21.6	112.9	L422 G425 D426 L430 L510 K511	L422-R513 HydrophobicContact CD2-CG 4.28Å; L422-R513 PolarHBondContact O-NH2 3.35Å; G425-R513 VanDerWaalsContact C-NH2 3.26Å; G425-R513 VanDerWaalsContact N-NH2 3.15Å; G425-R513 PolarHBondContact O-NH1 2.97Å; G425-R513 PolarHBondContact O-NH2 3.41Å; D426-R513 PolarHBondContact O-NH1 2.86Å; L430-R513 VanDerWaalsContact CB-O 3.28Å; L430-R513 WeakPolarHBondContact CB-O 3.34Å; L430-R513 VanDerWaalsContact CG-O 3.29Å; L430-R513 WeakPolarHBondContact CG-O 2.83Å; L430-R513 PolarHBondContact N-O 3.46Å; L510-R513 PolarHBondContact O-N 2.71Å; L510-R513 VanDerWaalsContact O-N 3.13Å; K511-R513 PolarHBondContact O-N 3.33Å
514	F	77.1	Confident	84.4	Confident	5 Å²	5	55.6 Å²	55.6	2%	0.022	27%	0.265	C	S	.	.	H	α-helix	trans	-91.7	-10.9	-172.1	-67.9	-83.5	0	0	0	113.7	L430 I467 V471 K477 L510 H518 M519	L430-F514 HydrophobicContact CD1-CD1 3.56Å; L430-F514 HydrophobicContact CD1-CE1 3.57Å; L430-F514 HydrophobicContact CD1-CG 4.13Å; L430-F514 HydrophobicContact CD1-CZ 4.12Å; I467-F514 HydrophobicContact CG2-CZ 4.31Å; V471-F514 HydrophobicContact CG1-CE1 4.46Å; V471-F514 HydrophobicContact CG2-CE1 3.88Å; V471-F514 HydrophobicContact CG2-CZ 3.84Å; K477-F514 HydrophobicContact CB-CD1 4.31Å; K477-F514 HydrophobicContact CB-CE1 4.49Å; K477-F514 HydrophobicContact CG-CD1 4.49Å; L510-F514 HydrophobicContact CB-CD2 4.31Å; L510-F514 HydrophobicContact CD2-CD2 3.8Å; L510-F514 HydrophobicContact CD2-CE2 3.56Å; L510-F514 PolarHBondContact O-N 3.24Å; F514-H518 PolarHBondContact O-CD2 2.78Å; F514-M519 HydrophobicContact CB-CE 4.4Å
515	G	79.5	Confident	84.5	Confident	4 Å²	4	52.3 Å²	52.3	4%	0.041	25%	0.248	C	C	.	.			trans	92.8	157.5	-175.9	0	0	0	0	0	113.1	K511	K511-G515 CarbonylContact O-C 3.59Å; K511-G515 VanDerWaalsContact O-CA 3.32Å; K511-G515 WeakPolarHBondContact O-CA 3.29Å; K511-G515 PolarHBondContact O-N 3.49Å
516	E	80.2	Confident	84.7	Confident	151 Å²	151	44.9 Å²	44.9	71%	0.706	22%	0.221	S	C	*	.	H	α-helix	trans	-71	-37.4	-177	-66.6	-172.4	164.6	0	0	112.9	H518 M519 H520	E516-H518 VanDerWaalsContact C-N 3.33Å; E516-H518 PolarHBondContact O-N 3.3Å; E516-M519 PolarHBondContact O-N 3.38Å; E516-H520 PolarHBondContact O-N 3.18Å
517	S	80.2	Confident	84.9	Confident	77 Å²	77	50.3 Å²	50.3	54%	0.538	24%	0.244	S	C	.	.	H	α-helix	trans	-57.9	-46.1	-178	57.5	0	0	0	0	111.7	M519 H520	S517-M519 PolarHBondContact O-N 3.42Å; S517-H520 WeakPolarHBondContact O-CB 3.42Å; S517-H520 PolarHBondContact O-N 2.85Å
518	H	79	Confident	85	Confident	60 Å²	60	51.2 Å²	51.2	28%	0.278	25%	0.249	S	C	.	.	H	α-helix	trans	-69.3	-30.9	-177.7	-74.9	-63.2	0	0	0	113.1	E431 I481 F514 E516	E431-H518 IonicContact OE1-CD2 2.7Å; I481-H518 HydrophobicContact CD1-CB 3.59Å; I481-H518 WeakPolarHBondContact CG2-O 3.25Å; F514-H518 PolarHBondContact O-CD2 2.78Å; E516-H518 VanDerWaalsContact C-N 3.33Å; E516-H518 PolarHBondContact O-N 3.3Å
519	M	86.6	Confident	85.1	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.015	23%	0.226	C	C	.	.	H	α-helix	trans	-90.8	-4	-179	-68.8	-63.4	102.8	0	0	114.1	I481 Y484 V507 L510 K511 F514 E516 S517 Y521 C522 E523	I481-M519 HydrophobicContact CB-CE 4.17Å; I481-M519 HydrophobicContact CD1-CE 4.29Å; I481-M519 HydrophobicContact CG1-CE 3.6Å; I481-M519 HydrophobicContact CG2-CE 3.74Å; Y484-M519 HydrophobicContact CD1-SD 4.41Å; Y484-M519 HydrophobicContact CE1-SD 4.44Å; V507-M519 HydrophobicContact CG1-CB 4.43Å; L510-M519 HydrophobicContact CB-CG 4.3Å; L510-M519 HydrophobicContact CB-SD 3.73Å; L510-M519 HydrophobicContact CD1-SD 4.36Å; K511-M519 HydrophobicContact CG-CB 3.6Å; K511-M519 HydrophobicContact CG-CG 3.85Å; F514-M519 HydrophobicContact CB-CE 4.4Å; E516-M519 PolarHBondContact O-N 3.38Å; S517-M519 PolarHBondContact O-N 3.42Å; M519-Y521 VanDerWaalsContact C-N 3.3Å; M519-Y521 PolarHBondContact O-N 3.49Å; M519-C522 PolarHBondContact O-N 3.4Å; M519-C522 VanDerWaalsContact O-N 3.14Å; M519-E523 PolarHBondContact O-N 2.93Å; M519-E523 VanDerWaalsContact O-N 3.09Å
520	H	86.1	Confident	85.3	Confident	89 Å²	89	46 Å²	46	41%	0.412	23%	0.229	S	C	.	.	H	α-helix	trans	-55.3	-42.7	-175.2	-175.2	59.9	0	0	0	113.1	E516 S517 C522 E523 V524 F565	E516-H520 PolarHBondContact O-N 3.18Å; S517-H520 WeakPolarHBondContact O-CB 3.42Å; S517-H520 PolarHBondContact O-N 2.85Å; H520-C522 PolarHBondContact O-N 2.75Å; H520-E523 PolarHBondContact O-N 2.89Å; H520-V524 WeakPolarHBondContact O-CG2 3.23Å; H520-V524 PolarHBondContact O-N 2.99Å; H520-F565 AromaticContact NE2-CE1 3.97Å
521	Y	87.4	Confident	85.5	Confident	105 Å²	105	48.1 Å²	48.1	41%	0.412	24%	0.241	S	C	.	.	H	α-helix	trans	-57.9	-48.1	177.7	-71.5	-82.3	0	0	0	112.4	M519 E523 V524 M525 F565	M519-Y521 VanDerWaalsContact C-N 3.3Å; M519-Y521 PolarHBondContact O-N 3.49Å; Y521-E523 VanDerWaalsContact C-N 3.33Å; Y521-E523 PolarHBondContact O-N 2.74Å; Y521-V524 PolarHBondContact O-N 3.04Å; Y521-M525 VanDerWaalsContact O-CG 3.31Å; Y521-M525 WeakPolarHBondContact O-CG 3.47Å; Y521-M525 PolarHBondContact O-N 3.32Å; Y521-M525 VanDerWaalsContact O-N 3.08Å; Y521-F565 HydrophobicContact CD1-CB 4.17Å; Y521-F565 AromaticContact CD1-CD1 3.61Å; Y521-F565 HydrophobicContact CD1-CD1 3.61Å; Y521-F565 HydrophobicContact CD1-CE1 4.48Å; Y521-F565 HydrophobicContact CD1-CG 4.31Å; Y521-F565 AromaticContact CE1-CD1 3.91Å; Y521-F565 HydrophobicContact CE1-CD1 3.91Å; Y521-F565 HydrophobicContact CE1-CE1 4.44Å; Y521-F565 HydrophobicContact CG-CD1 4.45Å
522	C	89.6	Confident	85.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.6	-35	-179.8	-65.9	0	0	0	0	112.1	Y484 L488 V507 M519 H520 M525 L526	Y484-C522 HydrophobicContact CD1-CB 4.47Å; Y484-C522 VanDerWaalsContact CD1-SG 3.6Å; Y484-C522 HydrophobicContact CE1-CB 4.09Å; L488-C522 HydrophobicContact CD2-CB 3.74Å; V507-C522 HydrophobicContact CG2-CB 4.2Å; M519-C522 PolarHBondContact O-N 3.4Å; M519-C522 VanDerWaalsContact O-N 3.14Å; H520-C522 PolarHBondContact O-N 2.75Å; C522-M525 PolarHBondContact O-N 3.3Å; C522-L526 PolarHBondContact O-N 3.27Å
523	E	89.9	Confident	86	Confident	84 Å²	84	46.5 Å²	46.5	39%	0.393	23%	0.228	S	C	.	.	H	α-helix	trans	-65.4	-43.9	174.9	176.2	174	-147.8	0	0	112.2	K511 M519 H520 Y521 M525 L526 K527	K511-E523 WeakPolarHBondContact CE-OE2 3.34Å; K511-E523 IonicContact NZ-OE1 3.59Å; K511-E523 PolarHBondContact NZ-OE1 3.44Å; K511-E523 IonicContact NZ-OE2 3.18Å; K511-E523 PolarHBondContact NZ-OE2 3.2Å; M519-E523 PolarHBondContact O-N 2.93Å; M519-E523 VanDerWaalsContact O-N 3.09Å; H520-E523 PolarHBondContact O-N 2.89Å; Y521-E523 VanDerWaalsContact C-N 3.33Å; Y521-E523 PolarHBondContact O-N 2.74Å; E523-M525 VanDerWaalsContact C-N 3.31Å; E523-M525 PolarHBondContact O-N 3.02Å; E523-L526 PolarHBondContact O-N 3.38Å; E523-K527 PolarHBondContact O-N 3.05Å
524	V	90.6	Very high	86.6	Confident	22 Å²	22	54.4 Å²	54.4	13%	0.133	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-40	176.5	176.6	0	0	0	0	110.6	H520 Y521 L526 K527 D528 F565	H520-V524 WeakPolarHBondContact O-CG2 3.23Å; H520-V524 PolarHBondContact O-N 2.99Å; Y521-V524 PolarHBondContact O-N 3.04Å; V524-L526 VanDerWaalsContact C-N 3.34Å; V524-L526 PolarHBondContact O-N 3.45Å; V524-K527 WeakPolarHBondContact O-CB 3.35Å; V524-K527 PolarHBondContact O-N 3.28Å; V524-K527 VanDerWaalsContact O-N 3.15Å; V524-D528 PolarHBondContact O-N 2.87Å; V524-F565 HydrophobicContact CB-CB 4.24Å; V524-F565 HydrophobicContact CB-CD1 3.98Å; V524-F565 HydrophobicContact CB-CD2 4.49Å; V524-F565 HydrophobicContact CB-CE1 4.49Å; V524-F565 HydrophobicContact CB-CG 3.98Å; V524-F565 HydrophobicContact CG1-CB 3.98Å; V524-F565 HydrophobicContact CG1-CD1 4.03Å; V524-F565 HydrophobicContact CG1-CD2 3.66Å; V524-F565 HydrophobicContact CG1-CE1 4.46Å; V524-F565 HydrophobicContact CG1-CE2 4.12Å; V524-F565 HydrophobicContact CG1-CG 3.61Å; V524-F565 HydrophobicContact CG2-CD1 4.04Å; V524-F565 HydrophobicContact CG2-CE1 4.09Å; V524-F565 HydrophobicContact CG2-CG 4.46Å
525	M	90.2	Very high	87.2	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-58.5	-42.3	174.9	-66.7	168	65.9	0	0	112.7	R485 L488 A489 L492 Y521 C522 E523 D528 M529 W566	R485-M525 HydrophobicContact CG-CE 4.44Å; R485-M525 HydrophobicContact CG-SD 3.72Å; L488-M525 HydrophobicContact CB-CE 4.4Å; L488-M525 HydrophobicContact CD2-CE 4.31Å; L488-M525 HydrophobicContact CD2-SD 4.4Å; L488-M525 HydrophobicContact CG-CE 4.22Å; A489-M525 HydrophobicContact CB-CE 3.62Å; L492-M525 HydrophobicContact CD1-CB 4.34Å; Y521-M525 VanDerWaalsContact O-CG 3.31Å; Y521-M525 WeakPolarHBondContact O-CG 3.47Å; Y521-M525 PolarHBondContact O-N 3.32Å; Y521-M525 VanDerWaalsContact O-N 3.08Å; C522-M525 PolarHBondContact O-N 3.3Å; E523-M525 VanDerWaalsContact C-N 3.31Å; E523-M525 PolarHBondContact O-N 3.02Å; M525-D528 WeakPolarHBondContact O-CB 3.11Å; M525-D528 PolarHBondContact O-N 3.49Å; M525-M529 WeakPolarHBondContact O-CG 3.45Å; M525-M529 PolarHBondContact O-N 2.96Å; M525-W566 HydrophobicContact CB-CZ2 3.9Å; M525-W566 HydrophobicContact CE-CD2 3.95Å; M525-W566 HydrophobicContact CE-CE3 3.8Å; M525-W566 HydrophobicContact CE-CH2 4.13Å; M525-W566 HydrophobicContact CE-CZ2 4.24Å; M525-W566 HydrophobicContact CE-CZ3 3.9Å; M525-W566 HydrophobicContact CG-CD2 4.07Å; M525-W566 HydrophobicContact CG-CG 4.15Å; M525-W566 HydrophobicContact CG-CZ2 4.18Å
526	L	90.2	Very high	87.6	Confident	14 Å²	14	55.7 Å²	55.7	7%	0.073	26%	0.263	C	S	.	.	H	α-helix	trans	-68.5	-36.1	176.4	-70.5	173.3	0	0	0	112.3	L488 L492 T500 E503 I504 V507 C522 E523 V524 M529 A530	L488-L526 HydrophobicContact CD1-CD2 4.33Å; L492-L526 HydrophobicContact CD1-CD2 4.17Å; L492-L526 HydrophobicContact CD2-CD2 4.14Å; T500-L526 HydrophobicContact CG2-CD2 4.46Å; E503-L526 HydrophobicContact CB-CD1 4.2Å; E503-L526 HydrophobicContact CB-CD2 3.74Å; I504-L526 HydrophobicContact CG1-CD1 4.01Å; V507-L526 HydrophobicContact CB-CD1 4.34Å; V507-L526 HydrophobicContact CG2-CD1 3.7Å; C522-L526 PolarHBondContact O-N 3.27Å; E523-L526 PolarHBondContact O-N 3.38Å; V524-L526 VanDerWaalsContact C-N 3.34Å; V524-L526 PolarHBondContact O-N 3.45Å; L526-M529 WeakPolarHBondContact O-CB 3.2Å; L526-M529 PolarHBondContact O-N 3.4Å; L526-A530 PolarHBondContact O-N 2.97Å
527	K	90.1	Very high	88	Confident	130 Å²	130	52.2 Å²	52.2	57%	0.565	26%	0.256	S	S	*	.	H	α-helix	trans	-65.3	-41.4	174	-173.9	179.4	177.9	179.8	0	111.6	E523 V524 M529 A530 D531	E523-K527 PolarHBondContact O-N 3.05Å; V524-K527 WeakPolarHBondContact O-CB 3.35Å; V524-K527 PolarHBondContact O-N 3.28Å; V524-K527 VanDerWaalsContact O-N 3.15Å; K527-M529 VanDerWaalsContact C-N 3.27Å; K527-M529 PolarHBondContact O-N 2.99Å; K527-A530 PolarHBondContact O-N 3.02Å; K527-A530 VanDerWaalsContact O-N 3.12Å; K527-D531 PolarHBondContact O-N 3.35Å
528	D	90.5	Very high	88.4	Confident	25 Å²	25	52.4 Å²	52.4	13%	0.134	25%	0.248	C	C	.	.	H	α-helix	trans	-58	-40	175.5	-73.2	-12.9	0	0	0	111.2	V524 M525 D531 S532 S562 W566	V524-D528 PolarHBondContact O-N 2.87Å; M525-D528 WeakPolarHBondContact O-CB 3.11Å; M525-D528 PolarHBondContact O-N 3.49Å; D528-D531 PolarHBondContact O-N 3.34Å; D528-S532 WeakPolarHBondContact O-CB 3.37Å; D528-S532 PolarHBondContact O-N 3.39Å; D528-S562 VanDerWaalsContact OD2-CB 3.24Å; D528-S562 WeakPolarHBondContact OD2-CB 3.31Å; D528-S562 PolarHBondContact OD2-N 2.91Å; D528-S562 PolarHBondContact OD2-OG 3.39Å; D528-W566 PolarHBondContact OD2-NE1 3.18Å; D528-W566 VanDerWaalsContact OD2-NE1 3.16Å
529	M	88.6	Confident	88.8	Confident	11 Å²	11	49.7 Å²	49.7	5%	0.054	24%	0.236	C	C	.	.	H	α-helix	trans	-61.5	-45	173.8	-66.1	-64.7	91.4	0	0	113.1	L492 T500 M525 L526 K527 R533 I559 L561 W566	L492-M529 HydrophobicContact CB-CG 4.39Å; L492-M529 HydrophobicContact CB-SD 4.1Å; L492-M529 HydrophobicContact CD1-CG 3.86Å; L492-M529 HydrophobicContact CD2-CG 3.99Å; L492-M529 HydrophobicContact CG-CG 4.29Å; T500-M529 HydrophobicContact CG2-CB 4.28Å; M525-M529 WeakPolarHBondContact O-CG 3.45Å; M525-M529 PolarHBondContact O-N 2.96Å; L526-M529 WeakPolarHBondContact O-CB 3.2Å; L526-M529 PolarHBondContact O-N 3.4Å; K527-M529 VanDerWaalsContact C-N 3.27Å; K527-M529 PolarHBondContact O-N 2.99Å; M529-R533 WeakPolarHBondContact O-CG 3.24Å; M529-R533 PolarHBondContact O-N 3.32Å; M529-R533 VanDerWaalsContact O-N 3.1Å; M529-I559 HydrophobicContact CE-CG2 3.32Å; M529-I559 HydrophobicContact SD-CG2 4.18Å; M529-L561 HydrophobicContact CE-CD2 3.11Å; M529-W566 HydrophobicContact CE-CH2 4.08Å; M529-W566 HydrophobicContact CE-CZ2 3.83Å
530	A	88.5	Confident	88.7	Confident	37 Å²	37	56 Å²	56	31%	0.306	26%	0.259	S	S	.	.	H	α-helix	trans	-65.6	-42.7	178.3	0	0	0	0	0	111.5	L526 K527 R533 R534	L526-A530 PolarHBondContact O-N 2.97Å; K527-A530 PolarHBondContact O-N 3.02Å; K527-A530 VanDerWaalsContact O-N 3.12Å; A530-R533 PolarHBondContact O-N 3.42Å; A530-R534 WeakPolarHBondContact O-CG 3.27Å; A530-R534 PolarHBondContact O-N 3.14Å
531	D	88.8	Confident	88.7	Confident	53 Å²	53	56.7 Å²	56.7	28%	0.283	26%	0.263	S	S	.	.	H	α-helix	trans	-70.1	-37.3	178.7	-75.6	-16.9	0	0	0	111.7	K527 D528 R533 R534 I535	K527-D531 PolarHBondContact O-N 3.35Å; D528-D531 PolarHBondContact O-N 3.34Å; D531-R533 VanDerWaalsContact C-N 3.32Å; D531-R533 PolarHBondContact O-N 3.43Å; D531-R534 WeakPolarHBondContact O-CB 3.35Å; D531-R534 PolarHBondContact O-N 3.13Å; D531-R534 IonicContact OD1-CZ 3.92Å; D531-R534 IonicContact OD1-NH1 3.23Å; D531-R534 PolarHBondContact OD1-NH1 3Å; D531-I535 WeakPolarHBondContact O-CD1 3.28Å; D531-I535 VanDerWaalsContact O-CG1 3.26Å; D531-I535 WeakPolarHBondContact O-CG1 3.45Å; D531-I535 PolarHBondContact O-N 3.35Å
532	S	89.3	Confident	88.6	Confident	5 Å²	5	55 Å²	55	4%	0.035	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-39.5	172.5	-175.7	0	0	0	0	112	D528 I535 N536 A558 I559 V560	D528-S532 WeakPolarHBondContact O-CB 3.37Å; D528-S532 PolarHBondContact O-N 3.39Å; S532-I535 PolarHBondContact O-N 3.3Å; S532-N536 WeakPolarHBondContact O-CB 3.42Å; S532-N536 PolarHBondContact O-N 3.4Å; S532-N536 PolarHBondContact O-ND2 3.31Å; S532-A558 PolarHBondContact OG-O 3.4Å; S532-I559 WeakPolarHBondContact OG-CA 3.45Å; S532-V560 PolarHBondContact OG-N 2.69Å
533	R	87.8	Confident	88.2	Confident	94 Å²	94	56.1 Å²	56.1	36%	0.355	26%	0.264	S	S	.	.	H	α-helix	trans	-63.4	-44.1	174.7	-73.4	175.8	-164.7	-172.1	2.9	111.8	Y498 M529 A530 D531 I535 N536 S537	Y498-R533 VanDerWaalsContact O-CZ 3.27Å; Y498-R533 PolarHBondContact O-NH1 3.28Å; Y498-R533 PolarHBondContact O-NH2 3.13Å; M529-R533 WeakPolarHBondContact O-CG 3.24Å; M529-R533 PolarHBondContact O-N 3.32Å; M529-R533 VanDerWaalsContact O-N 3.1Å; A530-R533 PolarHBondContact O-N 3.42Å; D531-R533 VanDerWaalsContact C-N 3.32Å; D531-R533 PolarHBondContact O-N 3.43Å; R533-I535 VanDerWaalsContact C-N 3.32Å; R533-I535 PolarHBondContact O-N 3Å; R533-N536 PolarHBondContact O-N 2.9Å; R533-S537 PolarHBondContact O-N 2.89Å; R533-S537 PolarHBondContact O-OG 3.32Å; R533-S537 VanDerWaalsContact O-OG 3.08Å
534	R	88.7	Confident	87.7	Confident	173 Å²	173	56 Å²	56	65%	0.653	27%	0.272	S	S	*	.	H	α-helix	trans	-61	-43.2	177.3	-68.6	169	176.7	164.9	-4.9	111.5	A530 D531 S537 H538	A530-R534 WeakPolarHBondContact O-CG 3.27Å; A530-R534 PolarHBondContact O-N 3.14Å; D531-R534 WeakPolarHBondContact O-CB 3.35Å; D531-R534 PolarHBondContact O-N 3.13Å; D531-R534 IonicContact OD1-CZ 3.92Å; D531-R534 IonicContact OD1-NH1 3.23Å; D531-R534 PolarHBondContact OD1-NH1 3Å; R534-S537 PolarHBondContact O-N 3.46Å; R534-H538 PolarHBondContact O-N 2.81Å
535	I	89.2	Confident	87.2	Confident	20 Å²	20	60.9 Å²	60.9	10%	0.103	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-47.4	178.1	-68.1	163.8	0	0	0	110.6	D531 S532 R533 S537 H538 I539 Y591 L594	D531-I535 WeakPolarHBondContact O-CD1 3.28Å; D531-I535 VanDerWaalsContact O-CG1 3.26Å; D531-I535 WeakPolarHBondContact O-CG1 3.45Å; D531-I535 PolarHBondContact O-N 3.35Å; S532-I535 PolarHBondContact O-N 3.3Å; R533-I535 VanDerWaalsContact C-N 3.32Å; R533-I535 PolarHBondContact O-N 3Å; I535-S537 PolarHBondContact O-N 2.8Å; I535-H538 PolarHBondContact O-N 3.5Å; I535-I539 HydrophobicContact CG2-CD1 3.75Å; I535-I539 HydrophobicContact CG2-CG1 4.5Å; I535-I539 WeakPolarHBondContact O-CG1 3.21Å; I535-I539 PolarHBondContact O-N 3.01Å; I535-Y591 HydrophobicContact CD1-CE2 4.16Å; I535-Y591 HydrophobicContact CG2-CD2 3.95Å; I535-Y591 HydrophobicContact CG2-CE2 4.09Å; I535-L594 HydrophobicContact CB-CD2 4.48Å; I535-L594 HydrophobicContact CG1-CD2 4.26Å; I535-L594 HydrophobicContact CG2-CD2 4.05Å
536	N	88.9	Confident	86.6	Confident	16 Å²	16	63.4 Å²	63.4	9%	0.086	31%	0.305	C	S	.	.	H	α-helix	trans	-58.5	-45.6	175.8	-83	-34.5	0	0	0	112	S532 R533 H538 I539 R540 A558 Y587	S532-N536 WeakPolarHBondContact O-CB 3.42Å; S532-N536 PolarHBondContact O-N 3.4Å; S532-N536 PolarHBondContact O-ND2 3.31Å; R533-N536 PolarHBondContact O-N 2.9Å; N536-H538 VanDerWaalsContact C-N 3.33Å; N536-H538 PolarHBondContact O-N 3.28Å; N536-I539 PolarHBondContact O-N 2.98Å; N536-R540 WeakPolarHBondContact O-CB 3.37Å; N536-R540 VanDerWaalsContact O-CG 3.3Å; N536-R540 WeakPolarHBondContact O-CG 3.17Å; N536-R540 PolarHBondContact O-N 3.3Å; N536-A558 VanDerWaalsContact CG-O 3.31Å; N536-A558 PolarHBondContact ND2-O 2.89Å; N536-A558 PolarHBondContact OD1-N 3.33Å; N536-A558 PolarHBondContact OD1-O 2.92Å; N536-A558 VanDerWaalsContact OD1-O 3.12Å; N536-Y587 PolarHBondContact OD1-OH 3.36Å
537	S	88.3	Confident	85.6	Confident	78 Å²	78	66.7 Å²	66.7	55%	0.545	33%	0.329	S	S	.	.	H	α-helix	trans	-60.6	-42.8	178.1	-64.5	0	0	0	0	111.9	R533 R534 I535 R540 E541	R533-S537 PolarHBondContact O-N 2.89Å; R533-S537 PolarHBondContact O-OG 3.32Å; R533-S537 VanDerWaalsContact O-OG 3.08Å; R534-S537 PolarHBondContact O-N 3.46Å; I535-S537 PolarHBondContact O-N 2.8Å; S537-R540 PolarHBondContact O-N 3.29Å; S537-E541 WeakPolarHBondContact O-CB 3.48Å; S537-E541 PolarHBondContact O-N 2.96Å
538	H	89	Confident	84.4	Confident	81 Å²	81	69 Å²	69	38%	0.375	34%	0.342	S	S	.	.	H	α-helix	trans	-66.1	-41.6	177.8	-172.7	-64.9	0	0	0	112.1	R534 I535 N536 E541 E542	R534-H538 PolarHBondContact O-N 2.81Å; I535-H538 PolarHBondContact O-N 3.5Å; N536-H538 VanDerWaalsContact C-N 3.33Å; N536-H538 PolarHBondContact O-N 3.28Å; H538-E541 PolarHBondContact O-N 3.38Å; H538-E542 WeakPolarHBondContact O-CG 3.22Å; H538-E542 PolarHBondContact O-N 3.32Å
539	I	86.6	Confident	82.9	Confident	4 Å²	4	77 Å²	77	2%	0.021	38%	0.378	C	S	.	.	H	α-helix	trans	-67	-42.8	178.6	-68.9	170.6	0	0	0	110.4	I535 N536 E541 E542 E543 Y587 R590	I535-I539 HydrophobicContact CG2-CD1 3.75Å; I535-I539 HydrophobicContact CG2-CG1 4.5Å; I535-I539 WeakPolarHBondContact O-CG1 3.21Å; I535-I539 PolarHBondContact O-N 3.01Å; N536-I539 PolarHBondContact O-N 2.98Å; I539-E541 VanDerWaalsContact C-N 3.34Å; I539-E541 PolarHBondContact O-N 3.46Å; I539-E542 PolarHBondContact O-N 2.64Å; I539-E543 WeakPolarHBondContact O-CG 3.33Å; I539-E543 PolarHBondContact O-N 2.86Å; I539-Y587 HydrophobicContact CB-CE2 4.27Å; I539-Y587 HydrophobicContact CD1-CD2 4.29Å; I539-Y587 HydrophobicContact CD1-CE1 3.94Å; I539-Y587 HydrophobicContact CD1-CE2 3.63Å; I539-Y587 VanDerWaalsContact CD1-CZ 3.41Å; I539-Y587 WeakPolarHBondContact CD1-OH 3.25Å; I539-Y587 HydrophobicContact CG2-CD2 3.96Å; I539-Y587 HydrophobicContact CG2-CE2 3.84Å; I539-R590 HydrophobicContact CG1-CB 4.49Å; I539-R590 HydrophobicContact CG2-CB 4.36Å
540	R	85.1	Confident	81.7	Confident	134 Å²	134	82.7 Å²	82.7	51%	0.506	41%	0.405	S	S	.	.	H	α-helix	trans	-63.5	-38.2	175	-73.5	-178.6	-178.3	-161.6	5.2	112.5	N536 S537 E543 S544 S557	N536-R540 WeakPolarHBondContact O-CB 3.37Å; N536-R540 VanDerWaalsContact O-CG 3.3Å; N536-R540 WeakPolarHBondContact O-CG 3.17Å; N536-R540 PolarHBondContact O-N 3.3Å; S537-R540 PolarHBondContact O-N 3.29Å; R540-E543 PolarHBondContact O-N 3.31Å; R540-S544 PolarHBondContact O-N 2.93Å; R540-S557 VanDerWaalsContact NH2-CB 3.26Å; R540-S557 PolarHBondContact NH2-OG 3.34Å
541	E	86.3	Confident	80.6	Confident	104 Å²	104	85 Å²	85	49%	0.486	41%	0.409	S	S	.	.	H	α-helix	trans	-64	-43.5	175.8	-164	-164.6	143	0	0	111.1	S537 H538 I539 S544 K545	S537-E541 WeakPolarHBondContact O-CB 3.48Å; S537-E541 PolarHBondContact O-N 2.96Å; H538-E541 PolarHBondContact O-N 3.38Å; I539-E541 VanDerWaalsContact C-N 3.34Å; I539-E541 PolarHBondContact O-N 3.46Å; E541-S544 PolarHBondContact O-N 3.41Å; E541-S544 PolarHBondContact O-OG 3.01Å; E541-K545 WeakPolarHBondContact O-CG 3.29Å; E541-K545 PolarHBondContact O-N 3.39Å; E541-K545 VanDerWaalsContact OE1-CE 3.3Å; E541-K545 WeakPolarHBondContact OE1-CE 3.26Å; E541-K545 IonicContact OE1-NZ 2.88Å; E541-K545 PolarHBondContact OE1-NZ 2.86Å
542	E	83.6	Confident	79.5	Confident	71 Å²	71	83.9 Å²	83.9	33%	0.332	41%	0.405	S	S	.	.	H	α-helix	trans	-63.7	-39.4	173.6	-71.9	-74.1	112.7	0	0	112.2	H538 I539 K545	H538-E542 WeakPolarHBondContact O-CG 3.22Å; H538-E542 PolarHBondContact O-N 3.32Å; I539-E542 PolarHBondContact O-N 2.64Å; E542-K545 PolarHBondContact O-N 2.87Å; E542-K545 IonicContact OE1-NZ 3.75Å; E542-K545 PolarHBondContact OE1-NZ 3.29Å
543	E	82.2	Confident	78.6	Confident	23 Å²	23	89 Å²	89	11%	0.107	44%	0.438	C	S	.	.	H	α-helix	trans	-63.4	-40	175.2	-75.5	177.8	163.3	0	0	112.3	I539 R540 K545 L546 P552 R590	I539-E543 WeakPolarHBondContact O-CG 3.33Å; I539-E543 PolarHBondContact O-N 2.86Å; R540-E543 PolarHBondContact O-N 3.31Å; E543-K545 PolarHBondContact O-N 3.39Å; E543-L546 WeakPolarHBondContact O-CB 3.36Å; E543-L546 PolarHBondContact O-N 2.89Å; E543-L546 VanDerWaalsContact O-N 3.16Å; E543-P552 HydrophobicContact CG-CG 4.45Å; E543-R590 IonicContact OE1-CZ 3.38Å; E543-R590 VanDerWaalsContact OE1-CZ 3.3Å; E543-R590 IonicContact OE1-NE 3.18Å; E543-R590 IonicContact OE1-NH1 3.78Å; E543-R590 PolarHBondContact OE1-NH1 3.39Å; E543-R590 IonicContact OE1-NH2 3.75Å
544	S	79.5	Confident	78	Confident	81 Å²	81	88.1 Å²	88.1	57%	0.566	44%	0.44	S	S	*	.	H	α-helix	trans	-66.2	-20.7	177.3	73.7	0	0	0	0	113.9	R540 E541	R540-S544 PolarHBondContact O-N 2.93Å; E541-S544 PolarHBondContact O-N 3.41Å; E541-S544 PolarHBondContact O-OG 3.01Å
545	K	80.6	Confident	77.4	Confident	124 Å²	124	84.8 Å²	84.8	54%	0.539	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-12.1	177.3	-68.2	167.8	-169.9	163.7	0	112.9	E541 E542 E543	E541-K545 WeakPolarHBondContact O-CG 3.29Å; E541-K545 PolarHBondContact O-N 3.39Å; E541-K545 VanDerWaalsContact OE1-CE 3.3Å; E541-K545 WeakPolarHBondContact OE1-CE 3.26Å; E541-K545 IonicContact OE1-NZ 2.88Å; E541-K545 PolarHBondContact OE1-NZ 2.86Å; E542-K545 PolarHBondContact O-N 2.87Å; E542-K545 IonicContact OE1-NZ 3.75Å; E542-K545 PolarHBondContact OE1-NZ 3.29Å; E543-K545 PolarHBondContact O-N 3.39Å
546	L	76.8	Confident	77.2	Confident	53 Å²	53	85.6 Å²	85.6	28%	0.277	45%	0.454	S	S	.	.	S	Bend	trans	-78.8	147.4	177.3	-63.1	170.9	0	0	0	110.6	E543 E550 Q551	E543-L546 WeakPolarHBondContact O-CB 3.36Å; E543-L546 PolarHBondContact O-N 2.89Å; E543-L546 VanDerWaalsContact O-N 3.16Å; L546-E550 HydrophobicContact CB-CB 4.24Å; L546-Q551 HydrophobicContact CB-CG 4.43Å; L546-Q551 PolarHBondContact O-NE2 2.93Å; L546-Q551 VanDerWaalsContact O-NE2 3.15Å
547	S	69.9	Low	77	Confident	83 Å²	83	86.9 Å²	86.9	58%	0.58	46%	0.464	S	S	*	.			trans	-57.4	149.3	172.5	-59.9	0	0	0	0	110.9	E549 E550 Q551	S547-E549 PolarHBondContact O-N 3.01Å; S547-E550 PolarHBondContact O-N 3.16Å; S547-Q551 PolarHBondContact O-N 3.45Å
548	E	63.6	Low	76.9	Confident	178 Å²	178	83.5 Å²	83.5	83%	0.832	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-27.9	-176.9	-68.8	-174	163.5	0	0	113.9
549	E	60.2	Low	76.8	Confident	194 Å²	194	82.3 Å²	82.3	91%	0.907	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-21.3	176.6	-65.9	178.3	165.7	0	0	114.3	S547	S547-E549 PolarHBondContact O-N 3.01Å
550	E	63.7	Low	76.9	Confident	130 Å²	130	83.1 Å²	83.1	61%	0.607	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-3.6	179.3	-69.9	-175.2	159.9	0	0	112.9	L546 S547	L546-E550 HydrophobicContact CB-CB 4.24Å; S547-E550 PolarHBondContact O-N 3.16Å
551	Q	64.9	Low	77.1	Confident	85 Å²	85	79.3 Å²	79.3	40%	0.397	43%	0.431	S	S	.	.	S	Bend	trans	-68.8	137.5	176.3	-72.7	178.7	7.3	0	0	110.1	L546 S547	L546-Q551 HydrophobicContact CB-CG 4.43Å; L546-Q551 PolarHBondContact O-NE2 2.93Å; L546-Q551 VanDerWaalsContact O-NE2 3.15Å; S547-Q551 PolarHBondContact O-N 3.45Å
552	P	66.3	Low	77.1	Confident	31 Å²	31	75.7 Å²	75.7	20%	0.201	42%	0.417	C	S	.	.			trans	-62.4	138.6	178.3	26.3	-32.4	0	0	0	109.8	E543 L554	E543-P552 HydrophobicContact CG-CG 4.45Å; P552-L554 PolarHBondContact O-N 3.41Å; P552-L554 VanDerWaalsContact O-N 3.1Å
553	P	68.6	Low	76.9	Confident	112 Å²	112	77.7 Å²	77.7	73%	0.727	44%	0.439	S	S	*	.	S	Bend	trans	-65.7	-14.7	-179.8	26.2	-34.4	0	0	0	113.1
554	L	75.9	Confident	76.8	Confident	75 Å²	75	84 Å²	84	39%	0.393	47%	0.469	S	S	.	.	S	Bend	trans	-126.7	126.9	179.9	-64	170.9	0	0	0	109.5	P552 L556 A579 V580 A583	P552-L554 PolarHBondContact O-N 3.41Å; P552-L554 VanDerWaalsContact O-N 3.1Å; L554-L556 PolarHBondContact O-N 3.12Å; L554-L556 VanDerWaalsContact O-N 3.08Å; L554-A579 HydrophobicContact CD1-CB 4.03Å; L554-V580 HydrophobicContact CD1-CG2 4.28Å; L554-A583 HydrophobicContact CB-CB 4.35Å
555	A	76.8	Confident	76.9	Confident	104 Å²	104	82.6 Å²	82.6	86%	0.86	45%	0.453	S	S	*	.			trans	-75.6	93.8	172.5	0	0	0	0	0	109.9
556	L	83.8	Confident	77.1	Confident	36 Å²	36	77.3 Å²	77.3	19%	0.188	43%	0.429	C	S	.	.			trans	-87.5	133.2	179.1	-172.5	69.6	0	0	0	110.9	L554 A583 M584 Y587 W602	L554-L556 PolarHBondContact O-N 3.12Å; L554-L556 VanDerWaalsContact O-N 3.08Å; L556-A583 HydrophobicContact CD2-CB 4.5Å; L556-M584 HydrophobicContact CD2-CG 4.07Å; L556-Y587 HydrophobicContact CD2-CD2 4.39Å; L556-Y587 HydrophobicContact CD2-CG 4.19Å; L556-W602 HydrophobicContact CD2-CH2 3.7Å; L556-W602 HydrophobicContact CD2-CZ2 4.37Å; L556-W602 HydrophobicContact CD2-CZ3 4.34Å
557	S	84.8	Confident	77.4	Confident	43 Å²	43	75 Å²	75	30%	0.301	42%	0.417	S	S	.	.			trans	-121.5	125.8	169.8	-157.7	0	0	0	0	108.6	R540	R540-S557 VanDerWaalsContact NH2-CB 3.26Å; R540-S557 PolarHBondContact NH2-OG 3.34Å
558	A	86.9	Confident	77.9	Confident	7 Å²	7	74.4 Å²	74.4	6%	0.058	41%	0.411	C	S	.	.			trans	-113.5	137.9	-177.2	0	0	0	0	0	111.3	S532 N536 Y587 W602	S532-A558 PolarHBondContact OG-O 3.4Å; N536-A558 VanDerWaalsContact CG-O 3.31Å; N536-A558 PolarHBondContact ND2-O 2.89Å; N536-A558 PolarHBondContact OD1-N 3.33Å; N536-A558 PolarHBondContact OD1-O 2.92Å; N536-A558 VanDerWaalsContact OD1-O 3.12Å; A558-Y587 HydrophobicContact CB-CD1 4.23Å; A558-Y587 HydrophobicContact CB-CE1 3.61Å; A558-Y587 HydrophobicContact CB-CE2 4.17Å; A558-W602 HydrophobicContact CB-CH2 3.72Å; A558-W602 HydrophobicContact CB-CZ3 3.81Å
559	I	87.6	Confident	78.6	Confident	56 Å²	56	67.6 Å²	67.6	29%	0.287	38%	0.38	S	S	.	.			trans	-89.8	115.4	167.6	-61.8	176.6	0	0	0	107.5	L496 M529 S532 L561	L496-I559 HydrophobicContact CD2-CD1 3.9Å; L496-I559 HydrophobicContact CD2-CG1 4.06Å; M529-I559 HydrophobicContact CE-CG2 3.32Å; M529-I559 HydrophobicContact SD-CG2 4.18Å; S532-I559 WeakPolarHBondContact OG-CA 3.45Å; I559-L561 HydrophobicContact CG2-CD1 4.49Å; I559-L561 HydrophobicContact CG2-CD2 3.55Å; I559-L561 HydrophobicContact CG2-CG 3.98Å
560	V	88.9	Confident	79.2	Confident	21 Å²	21	60.5 Å²	60.5	13%	0.127	35%	0.346	C	S	.	.			trans	-97	119.3	-179.4	-176.1	0	0	0	0	109.2	S532 Y591 L600	S532-V560 PolarHBondContact OG-N 2.69Å; V560-Y591 HydrophobicContact CG1-CE2 4.04Å; V560-Y591 HydrophobicContact CG2-CE2 4.23Å; V560-L600 HydrophobicContact CG1-CD2 4.33Å
561	L	88.5	Confident	79.5	Confident	54 Å²	54	62 Å²	62	28%	0.283	35%	0.353	S	S	.	.			trans	-120.3	151.6	-173.1	-56.4	-179.1	0	0	0	111.7	L493 M529 I559 W566 L569	L493-L561 HydrophobicContact CD2-CD1 3.93Å; M529-L561 HydrophobicContact CE-CD2 3.11Å; I559-L561 HydrophobicContact CG2-CD1 4.49Å; I559-L561 HydrophobicContact CG2-CD2 3.55Å; I559-L561 HydrophobicContact CG2-CG 3.98Å; L561-W566 HydrophobicContact CD1-CD2 4.03Å; L561-W566 HydrophobicContact CD1-CE3 4.03Å; L561-W566 HydrophobicContact CD1-CH2 4.32Å; L561-W566 HydrophobicContact CD1-CZ2 4.34Å; L561-W566 HydrophobicContact CD1-CZ3 4.17Å; L561-W566 HydrophobicContact CD2-CD2 4.24Å; L561-W566 HydrophobicContact CD2-CH2 3.78Å; L561-W566 HydrophobicContact CD2-CZ2 3.27Å; L561-W566 HydrophobicContact CD2-CZ3 4.44Å; L561-W566 HydrophobicContact CG-CZ2 4.33Å; L561-L569 HydrophobicContact CD1-CD1 4.42Å
562	S	86.2	Confident	79.8	Confident	28 Å²	28	61.7 Å²	61.7	20%	0.196	35%	0.352	C	S	.	.			trans	-79.9	133.9	164	62.7	0	0	0	0	110.7	D528 F565	D528-S562 VanDerWaalsContact OD2-CB 3.24Å; D528-S562 WeakPolarHBondContact OD2-CB 3.31Å; D528-S562 PolarHBondContact OD2-N 2.91Å; D528-S562 PolarHBondContact OD2-OG 3.39Å; S562-F565 WeakPolarHBondContact OG-CD2 3.45Å
563	S	79.8	Confident	80.1	Confident	113 Å²	113	69.1 Å²	69.1	79%	0.79	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-29.1	-176.7	55.4	0	0	0	0	113.9
564	E	79	Confident	80.6	Confident	156 Å²	156	65 Å²	65	73%	0.729	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-29.1	-173	-67.5	179.5	169	0	0	113.2
565	F	81.7	Confident	80.9	Confident	52 Å²	52	67 Å²	67	23%	0.228	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-18.5	-173.4	-62.1	-87.3	0	0	0	113.6	H520 Y521 V524 S562	H520-F565 AromaticContact NE2-CE1 3.97Å; Y521-F565 HydrophobicContact CD1-CB 4.17Å; Y521-F565 AromaticContact CD1-CD1 3.61Å; Y521-F565 HydrophobicContact CD1-CD1 3.61Å; Y521-F565 HydrophobicContact CD1-CE1 4.48Å; Y521-F565 HydrophobicContact CD1-CG 4.31Å; Y521-F565 AromaticContact CE1-CD1 3.91Å; Y521-F565 HydrophobicContact CE1-CD1 3.91Å; Y521-F565 HydrophobicContact CE1-CE1 4.44Å; Y521-F565 HydrophobicContact CG-CD1 4.45Å; V524-F565 HydrophobicContact CB-CB 4.24Å; V524-F565 HydrophobicContact CB-CD1 3.98Å; V524-F565 HydrophobicContact CB-CD2 4.49Å; V524-F565 HydrophobicContact CB-CE1 4.49Å; V524-F565 HydrophobicContact CB-CG 3.98Å; V524-F565 HydrophobicContact CG1-CB 3.98Å; V524-F565 HydrophobicContact CG1-CD1 4.03Å; V524-F565 HydrophobicContact CG1-CD2 3.66Å; V524-F565 HydrophobicContact CG1-CE1 4.46Å; V524-F565 HydrophobicContact CG1-CE2 4.12Å; V524-F565 HydrophobicContact CG1-CG 3.61Å; V524-F565 HydrophobicContact CG2-CD1 4.04Å; V524-F565 HydrophobicContact CG2-CE1 4.09Å; V524-F565 HydrophobicContact CG2-CG 4.46Å; S562-F565 WeakPolarHBondContact OG-CD2 3.45Å
566	W	85.5	Confident	81.1	Confident	12 Å²	12	63.7 Å²	63.7	5%	0.045	33%	0.327	C	S	.	.	S	Bend	trans	-85.5	151.3	177.8	-74.5	67.9	0	0	0	110.8	A489 L492 L493 M525 D528 M529 L561	A489-W566 HydrophobicContact CB-CE3 3.86Å; A489-W566 HydrophobicContact CB-CZ3 3.87Å; L492-W566 HydrophobicContact CB-CH2 3.78Å; L492-W566 HydrophobicContact CB-CZ3 4.4Å; L492-W566 HydrophobicContact CD1-CH2 3.81Å; L492-W566 HydrophobicContact CD1-CZ2 4.19Å; L492-W566 HydrophobicContact CG-CH2 4.46Å; L493-W566 HydrophobicContact CD1-CZ3 4.29Å; L493-W566 HydrophobicContact CD2-CZ3 4.13Å; L493-W566 HydrophobicContact CG-CZ3 3.94Å; M525-W566 HydrophobicContact CB-CZ2 3.9Å; M525-W566 HydrophobicContact CE-CD2 3.95Å; M525-W566 HydrophobicContact CE-CE3 3.8Å; M525-W566 HydrophobicContact CE-CH2 4.13Å; M525-W566 HydrophobicContact CE-CZ2 4.24Å; M525-W566 HydrophobicContact CE-CZ3 3.9Å; M525-W566 HydrophobicContact CG-CD2 4.07Å; M525-W566 HydrophobicContact CG-CG 4.15Å; M525-W566 HydrophobicContact CG-CZ2 4.18Å; D528-W566 PolarHBondContact OD2-NE1 3.18Å; D528-W566 VanDerWaalsContact OD2-NE1 3.16Å; M529-W566 HydrophobicContact CE-CH2 4.08Å; M529-W566 HydrophobicContact CE-CZ2 3.83Å; L561-W566 HydrophobicContact CD1-CD2 4.03Å; L561-W566 HydrophobicContact CD1-CE3 4.03Å; L561-W566 HydrophobicContact CD1-CH2 4.32Å; L561-W566 HydrophobicContact CD1-CZ2 4.34Å; L561-W566 HydrophobicContact CD1-CZ3 4.17Å; L561-W566 HydrophobicContact CD2-CD2 4.24Å; L561-W566 HydrophobicContact CD2-CH2 3.78Å; L561-W566 HydrophobicContact CD2-CZ2 3.27Å; L561-W566 HydrophobicContact CD2-CZ3 4.44Å; L561-W566 HydrophobicContact CG-CZ2 4.33Å
567	P	83	Confident	81.1	Confident	4 Å²	4	63 Å²	63	3%	0.026	33%	0.325	C	S	.	.			trans	-60.8	158.9	171.4	27.1	-32.4	0	0	0	110.3	R485 A489 L569 T708	R485-P567 HydrophobicContact CG-CG 4.46Å; A489-P567 HydrophobicContact CB-CG 3.45Å; A489-P567 VanDerWaalsContact CB-CG 3.45Å; P567-L569 PolarHBondContact O-N 2.83Å; P567-T708 HydrophobicContact CB-CG2 4.03Å; P567-T708 HydrophobicContact CG-CG2 3.54Å
568	T	79.4	Confident	81	Confident	72 Å²	72	65 Å²	65	44%	0.442	34%	0.344	S	S	.	.			trans	-60.2	111.1	178.7	46.8	0	0	0	0	109.9	T708 T709 Q714	T568-T708 WeakPolarHBondContact O-CA 3.24Å; T568-T709 PolarHBondContact O-N 3Å; T568-T709 PolarHBondContact O-OG1 2.94Å; T568-T709 WeakPolarHBondContact OG1-CB 3.4Å; T568-T709 PolarHBondContact OG1-OG1 3.42Å; T568-Q714 PolarHBondContact OG1-NE2 3.46Å
569	L	79.3	Confident	80.8	Confident	35 Å²	35	67.4 Å²	67.4	18%	0.183	36%	0.364	C	S	.	.	B	Isolated β-bridge	trans	-80.6	141	176	-60.4	177.4	0	0	0	108.7	L493 L561 P567 L606 T708	L493-L569 HydrophobicContact CD1-CD2 3.97Å; L561-L569 HydrophobicContact CD1-CD1 4.42Å; P567-L569 PolarHBondContact O-N 2.83Å; L569-L606 HydrophobicContact CB-CD1 4.11Å; L569-L606 HydrophobicContact CD1-CD1 3.84Å; L569-L606 HydrophobicContact CD2-CD1 4.08Å; L569-L606 HydrophobicContact CG-CD1 4.22Å; L569-T708 HydrophobicContact CD2-CG2 4.31Å
570	K	72.9	Confident	80.6	Confident	45 Å²	45	66.6 Å²	66.6	20%	0.196	36%	0.361	C	S	.	.			trans	-57.5	151.7	176.8	-70.6	175.6	176.4	166.4	0	110.4	H605 D705 S706 N707 T708	K570-H605 PolarHBondContact O-CE1 2.88Å; K570-H605 PolarHBondContact O-NE2 3.25Å; K570-D705 IonicContact NZ-OD1 2.7Å; K570-S706 WeakPolarHBondContact CE-O 3.42Å; K570-S706 PolarHBondContact NZ-O 2.79Å; K570-N707 PolarHBondContact N-O 2.99Å; K570-T708 WeakPolarHBondContact CE-O 3.49Å
571	E	70.4	Confident	80.5	Confident	160 Å²	160	67.7 Å²	67.7	75%	0.748	37%	0.369	S	S	*	.			trans	-117.9	101.8	175.4	-53.7	-152.1	148.6	0	0	110	K603	E571-K603 IonicContact OE1-NZ 3.86Å; E571-K603 PolarHBondContact OE1-NZ 3.09Å
572	E	70.6	Confident	80.4	Confident	80 Å²	80	70.1 Å²	70.1	37%	0.374	38%	0.379	S	S	.	.			trans	-106	128.4	170.2	-63.5	-174.3	176.5	0	0	110.2	L574 H605 L657	E572-L574 PolarHBondContact O-N 3.35Å; E572-H605 HydrophobicContact CB-CB 4.11Å; E572-L657 WeakPolarHBondContact OE1-CD1 3.46Å
573	K	73.2	Confident	80.4	Confident	187 Å²	187	69 Å²	69	81%	0.813	37%	0.372	S	S	*	.			trans	-80.5	116.8	171.5	-65.8	-177.7	-177.7	178	0	107.7
574	L	78.5	Confident	80.8	Confident	24 Å²	24	64.9 Å²	64.9	13%	0.126	34%	0.341	C	S	.	.			trans	-129.9	125.1	177.2	-178.7	68.5	0	0	0	108.2	E572 L576 P604 I628 L651	E572-L574 PolarHBondContact O-N 3.35Å; L574-L576 HydrophobicContact CD2-CD2 3.69Å; L574-L576 HydrophobicContact CG-CD2 4.2Å; L574-L576 PolarHBondContact O-N 3.26Å; L574-P604 HydrophobicContact CB-CG 4.44Å; L574-I628 HydrophobicContact CD1-CB 4.4Å; L574-I628 HydrophobicContact CD1-CD1 4.07Å; L574-I628 HydrophobicContact CD1-CG1 3.8Å; L574-I628 HydrophobicContact CD2-CB 4.14Å; L574-I628 HydrophobicContact CD2-CG1 4.44Å; L574-L651 HydrophobicContact CD1-CB 4.36Å; L574-L651 HydrophobicContact CD1-CD2 4.15Å
575	E	82.4	Confident	81.2	Confident	119 Å²	119	62.5 Å²	62.5	56%	0.556	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-78.5	117.2	167.4	-70.4	-168.3	177	0	0	109	L651 A652	E575-L651 PolarHBondContact N-O 2.88Å; E575-A652 HydrophobicContact CG-CB 4Å
576	L	81.4	Confident	81.5	Confident	34 Å²	34	60.8 Å²	60.8	18%	0.178	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-90.5	154.5	-178.7	-67.6	171.7	0	0	0	111.7	L574 V580 M584 P604 P627	L574-L576 HydrophobicContact CD2-CD2 3.69Å; L574-L576 HydrophobicContact CG-CD2 4.2Å; L574-L576 PolarHBondContact O-N 3.26Å; L576-V580 HydrophobicContact CD1-CG1 4.24Å; L576-M584 HydrophobicContact CD1-CE 3.61Å; L576-M584 HydrophobicContact CD1-SD 3.66Å; L576-P604 HydrophobicContact CD1-CB 3.71Å; L576-P604 HydrophobicContact CD1-CG 4.26Å; L576-P604 HydrophobicContact CD2-CB 4.06Å; L576-P604 HydrophobicContact CG-CB 4.19Å; L576-P627 HydrophobicContact CD2-CB 4.45Å
577	P	83.6	Confident	81.7	Confident	21 Å²	21	60.3 Å²	60.3	14%	0.136	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-56.6	142.9	172.4	-23.7	33.1	0	0	0	112.6	A579 V580 C581 A631 L634	P577-A579 PolarHBondContact O-N 3.21Å; P577-A579 VanDerWaalsContact O-N 3.13Å; P577-V580 HydrophobicContact CB-CG2 4.44Å; P577-V580 PolarHBondContact O-N 2.87Å; P577-C581 PolarHBondContact O-N 3.36Å; P577-C581 VanDerWaalsContact O-N 3.09Å; P577-A631 HydrophobicContact CG-CB 4.2Å; P577-L634 HydrophobicContact CB-CD1 4.07Å; P577-L634 HydrophobicContact CG-CB 4.27Å; P577-L634 HydrophobicContact CG-CD1 3.56Å
578	A	82.4	Confident	82	Confident	85 Å²	85	61.1 Å²	61.1	70%	0.702	33%	0.328	S	S	*	.	H	α-helix	trans	-56.2	-35	-175.1	0	0	0	0	0	113.9	V580 C581 H582	A578-V580 VanDerWaalsContact C-N 3.34Å; A578-V580 PolarHBondContact O-N 2.97Å; A578-C581 PolarHBondContact O-N 3.09Å; A578-H582 PolarHBondContact O-N 2.64Å
579	A	82.2	Confident	82.4	Confident	58 Å²	58	64.6 Å²	64.6	48%	0.479	33%	0.333	S	S	.	.	H	α-helix	trans	-62.1	-40.9	176.8	0	0	0	0	0	112.4	L554 P577 A583	L554-A579 HydrophobicContact CD1-CB 4.03Å; P577-A579 PolarHBondContact O-N 3.21Å; P577-A579 VanDerWaalsContact O-N 3.13Å; A579-A583 PolarHBondContact O-N 3.09Å; A579-A583 VanDerWaalsContact O-N 3.17Å
580	V	84.8	Confident	82.8	Confident	38 Å²	38	65.5 Å²	65.5	23%	0.23	33%	0.334	C	S	.	.	H	α-helix	trans	-71.2	-42.1	177.9	-179	0	0	0	0	110.2	L554 L576 P577 A578 H582 A583 M584	L554-V580 HydrophobicContact CD1-CG2 4.28Å; L576-V580 HydrophobicContact CD1-CG1 4.24Å; P577-V580 HydrophobicContact CB-CG2 4.44Å; P577-V580 PolarHBondContact O-N 2.87Å; A578-V580 VanDerWaalsContact C-N 3.34Å; A578-V580 PolarHBondContact O-N 2.97Å; V580-H582 VanDerWaalsContact C-N 3.34Å; V580-H582 PolarHBondContact O-N 3.31Å; V580-A583 PolarHBondContact O-N 3.46Å; V580-M584 HydrophobicContact CG1-CE 3.75Å; V580-M584 HydrophobicContact CG1-CG 4.36Å; V580-M584 HydrophobicContact CG1-SD 4.19Å; V580-M584 WeakPolarHBondContact O-CG 3.4Å; V580-M584 PolarHBondContact O-N 2.93Å
581	C	86.1	Confident	83.5	Confident	44 Å²	44	64 Å²	64	30%	0.297	33%	0.327	S	S	.	.	H	α-helix	trans	-57.3	-45.9	175.4	-66.2	0	0	0	0	111.7	P577 A578 A583 M584 E585	P577-C581 PolarHBondContact O-N 3.36Å; P577-C581 VanDerWaalsContact O-N 3.09Å; A578-C581 PolarHBondContact O-N 3.09Å; C581-A583 VanDerWaalsContact C-N 3.35Å; C581-A583 PolarHBondContact O-N 2.88Å; C581-M584 PolarHBondContact O-N 3.44Å; C581-E585 WeakPolarHBondContact O-CG 3.07Å; C581-E585 PolarHBondContact O-N 3.02Å
582	H	86.4	Confident	84.4	Confident	105 Å²	105	60.2 Å²	60.2	49%	0.486	31%	0.31	S	S	.	.	H	α-helix	trans	-63.1	-40.3	177.6	-173	-90.6	0	0	0	112.3	A578 V580 E585 A586	A578-H582 PolarHBondContact O-N 2.64Å; V580-H582 VanDerWaalsContact C-N 3.34Å; V580-H582 PolarHBondContact O-N 3.31Å; H582-E585 PolarHBondContact O-N 3.24Å; H582-A586 WeakPolarHBondContact O-CB 3.49Å; H582-A586 PolarHBondContact O-N 3.33Å
583	A	85.9	Confident	85.3	Confident	6 Å²	6	64.6 Å²	64.6	5%	0.05	33%	0.327	C	S	.	.	H	α-helix	trans	-64.2	-41.8	175	0	0	0	0	0	112	L554 L556 A579 V580 C581 A586 Y587	L554-A583 HydrophobicContact CB-CB 4.35Å; L556-A583 HydrophobicContact CD2-CB 4.5Å; A579-A583 PolarHBondContact O-N 3.09Å; A579-A583 VanDerWaalsContact O-N 3.17Å; V580-A583 PolarHBondContact O-N 3.46Å; C581-A583 VanDerWaalsContact C-N 3.35Å; C581-A583 PolarHBondContact O-N 2.88Å; A583-A586 PolarHBondContact O-N 3.33Å; A583-Y587 WeakPolarHBondContact O-CB 3.48Å; A583-Y587 PolarHBondContact O-N 3.26Å
584	M	88.1	Confident	85.9	Confident	26 Å²	26	58.6 Å²	58.6	13%	0.128	30%	0.304	C	S	.	.	H	α-helix	trans	-63	-44.3	175.5	-74.2	-179.3	173.2	0	0	111.9	L556 L576 V580 C581 Y587 T588 W602	L556-M584 HydrophobicContact CD2-CG 4.07Å; L576-M584 HydrophobicContact CD1-CE 3.61Å; L576-M584 HydrophobicContact CD1-SD 3.66Å; V580-M584 HydrophobicContact CG1-CE 3.75Å; V580-M584 HydrophobicContact CG1-CG 4.36Å; V580-M584 HydrophobicContact CG1-SD 4.19Å; V580-M584 WeakPolarHBondContact O-CG 3.4Å; V580-M584 PolarHBondContact O-N 2.93Å; C581-M584 PolarHBondContact O-N 3.44Å; M584-Y587 PolarHBondContact O-N 2.95Å; M584-T588 PolarHBondContact O-N 3.48Å; M584-T588 PolarHBondContact O-OG1 3.32Å; M584-T588 VanDerWaalsContact O-OG1 3.1Å; M584-W602 HydrophobicContact CB-CD2 4.32Å; M584-W602 HydrophobicContact CB-CZ2 3.9Å; M584-W602 HydrophobicContact CE-CD2 4.37Å; M584-W602 HydrophobicContact CE-CE3 3.95Å; M584-W602 HydrophobicContact CE-CZ3 4.37Å; M584-W602 HydrophobicContact CG-CD2 4.03Å; M584-W602 HydrophobicContact CG-CE3 4.16Å; M584-W602 HydrophobicContact CG-CH2 4.15Å; M584-W602 HydrophobicContact CG-CZ2 4Å; M584-W602 HydrophobicContact CG-CZ3 4.22Å; M584-W602 HydrophobicContact SD-CB 4.48Å; M584-W602 HydrophobicContact SD-CD2 3.94Å; M584-W602 HydrophobicContact SD-CE3 4.12Å; M584-W602 HydrophobicContact SD-CG 4.11Å
585	E	88.4	Confident	86.3	Confident	105 Å²	105	61.8 Å²	61.8	49%	0.491	32%	0.317	S	S	.	.	H	α-helix	trans	-63.8	-40.8	176.1	-73.7	176.1	-167.1	0	0	112.7	C581 H582 Y587 T588 R589	C581-E585 WeakPolarHBondContact O-CG 3.07Å; C581-E585 PolarHBondContact O-N 3.02Å; H582-E585 PolarHBondContact O-N 3.24Å; E585-Y587 VanDerWaalsContact C-N 3.32Å; E585-T588 PolarHBondContact O-N 3.24Å; E585-R589 WeakPolarHBondContact O-CG 3.28Å; E585-R589 PolarHBondContact O-N 3.26Å; E585-R589 IonicContact OE2-NH2 2.75Å
586	A	87.4	Confident	86.3	Confident	16 Å²	16	60 Å²	60	13%	0.132	32%	0.322	C	S	.	.	H	α-helix	trans	-63.1	-41.5	175.6	0	0	0	0	0	111	H582 A583 R589 R590	H582-A586 WeakPolarHBondContact O-CB 3.49Å; H582-A586 PolarHBondContact O-N 3.33Å; A583-A586 PolarHBondContact O-N 3.33Å; A586-R589 PolarHBondContact O-N 3.41Å; A586-R590 WeakPolarHBondContact O-CG 3.41Å; A586-R590 PolarHBondContact O-N 3.04Å; A586-R590 VanDerWaalsContact O-N 3.15Å
587	Y	88.7	Confident	86.3	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.008	36%	0.361	C	S	.	.	H	α-helix	trans	-63.9	-45.2	174.2	-170.1	-82.5	0	0	0	111.8	N536 I539 L556 A558 A583 M584 E585 R589 R590 Y591 L600 W602	N536-Y587 PolarHBondContact OD1-OH 3.36Å; I539-Y587 HydrophobicContact CB-CE2 4.27Å; I539-Y587 HydrophobicContact CD1-CD2 4.29Å; I539-Y587 HydrophobicContact CD1-CE1 3.94Å; I539-Y587 HydrophobicContact CD1-CE2 3.63Å; I539-Y587 VanDerWaalsContact CD1-CZ 3.41Å; I539-Y587 WeakPolarHBondContact CD1-OH 3.25Å; I539-Y587 HydrophobicContact CG2-CD2 3.96Å; I539-Y587 HydrophobicContact CG2-CE2 3.84Å; L556-Y587 HydrophobicContact CD2-CD2 4.39Å; L556-Y587 HydrophobicContact CD2-CG 4.19Å; A558-Y587 HydrophobicContact CB-CD1 4.23Å; A558-Y587 HydrophobicContact CB-CE1 3.61Å; A558-Y587 HydrophobicContact CB-CE2 4.17Å; A583-Y587 WeakPolarHBondContact O-CB 3.48Å; A583-Y587 PolarHBondContact O-N 3.26Å; M584-Y587 PolarHBondContact O-N 2.95Å; E585-Y587 VanDerWaalsContact C-N 3.32Å; Y587-R589 PolarHBondContact O-N 3.15Å; Y587-R590 PolarHBondContact O-N 3.2Å; Y587-Y591 WeakPolarHBondContact O-CB 3.36Å; Y587-Y591 PolarHBondContact O-N 3.43Å; Y587-L600 HydrophobicContact CD1-CD1 3.72Å; Y587-L600 HydrophobicContact CE1-CD1 3.82Å; Y587-W602 AromaticContact CD1-CH2 3.83Å; Y587-W602 HydrophobicContact CD1-CH2 3.83Å; Y587-W602 AromaticContact CD1-CZ2 3.86Å; Y587-W602 HydrophobicContact CD1-CZ2 3.86Å; Y587-W602 HydrophobicContact CE1-CH2 4.42Å; Y587-W602 HydrophobicContact CG-CH2 4.22Å; Y587-W602 HydrophobicContact CG-CZ2 4.35Å
588	T	89.6	Confident	86.4	Confident	22 Å²	22	74 Å²	74	14%	0.135	38%	0.381	C	S	.	.	H	α-helix	trans	-58.7	-44.2	176.4	-63.6	0	0	0	0	111.9	M584 E585 R590 Y591 E592 L600 W602	M584-T588 PolarHBondContact O-N 3.48Å; M584-T588 PolarHBondContact O-OG1 3.32Å; M584-T588 VanDerWaalsContact O-OG1 3.1Å; E585-T588 PolarHBondContact O-N 3.24Å; T588-R590 PolarHBondContact O-N 3.41Å; T588-Y591 WeakPolarHBondContact O-CB 3.41Å; T588-Y591 PolarHBondContact O-N 3.39Å; T588-E592 HydrophobicContact CG2-CG 4.47Å; T588-E592 WeakPolarHBondContact O-CG 3.4Å; T588-E592 PolarHBondContact O-N 3.1Å; T588-L600 HydrophobicContact CG2-CB 4.45Å; T588-W602 PolarHBondContact OG1-NE1 3.01Å
589	R	87.7	Confident	86.5	Confident	144 Å²	144	75.3 Å²	75.3	54%	0.543	38%	0.38	S	S	.	.	H	α-helix	trans	-60.8	-41.5	176	-76.6	-177.7	-106.7	171	-7.8	112.6	E585 A586 Y587 K593	E585-R589 WeakPolarHBondContact O-CG 3.28Å; E585-R589 PolarHBondContact O-N 3.26Å; E585-R589 IonicContact OE2-NH2 2.75Å; A586-R589 PolarHBondContact O-N 3.41Å; Y587-R589 PolarHBondContact O-N 3.15Å; R589-K593 PolarHBondContact O-N 3.49Å
590	R	87.3	Confident	86.7	Confident	54 Å²	54	74.5 Å²	74.5	20%	0.204	37%	0.368	C	S	.	.	H	α-helix	trans	-67.5	-38	176	-68.9	-177.2	-171.1	113.4	-9	111.6	I539 E543 A586 Y587 T588 K593 L594	I539-R590 HydrophobicContact CG1-CB 4.49Å; I539-R590 HydrophobicContact CG2-CB 4.36Å; E543-R590 IonicContact OE1-CZ 3.38Å; E543-R590 VanDerWaalsContact OE1-CZ 3.3Å; E543-R590 IonicContact OE1-NE 3.18Å; E543-R590 IonicContact OE1-NH1 3.78Å; E543-R590 PolarHBondContact OE1-NH1 3.39Å; E543-R590 IonicContact OE1-NH2 3.75Å; A586-R590 WeakPolarHBondContact O-CG 3.41Å; A586-R590 PolarHBondContact O-N 3.04Å; A586-R590 VanDerWaalsContact O-N 3.15Å; Y587-R590 PolarHBondContact O-N 3.2Å; T588-R590 PolarHBondContact O-N 3.41Å; R590-K593 PolarHBondContact O-N 3.2Å; R590-L594 PolarHBondContact O-N 2.87Å; R590-L594 VanDerWaalsContact O-N 3.14Å
591	Y	88.5	Confident	86.8	Confident	14 Å²	14	77.8 Å²	77.8	6%	0.055	39%	0.392	C	S	.	.	H	α-helix	trans	-64.1	-45.4	176	-176.1	-90.5	0	0	0	112.3	I535 V560 Y587 T588 K593 L594 K595 R598 L600	I535-Y591 HydrophobicContact CD1-CE2 4.16Å; I535-Y591 HydrophobicContact CG2-CD2 3.95Å; I535-Y591 HydrophobicContact CG2-CE2 4.09Å; V560-Y591 HydrophobicContact CG1-CE2 4.04Å; V560-Y591 HydrophobicContact CG2-CE2 4.23Å; Y587-Y591 WeakPolarHBondContact O-CB 3.36Å; Y587-Y591 PolarHBondContact O-N 3.43Å; T588-Y591 WeakPolarHBondContact O-CB 3.41Å; T588-Y591 PolarHBondContact O-N 3.39Å; Y591-K593 VanDerWaalsContact C-N 3.27Å; Y591-K593 PolarHBondContact O-N 3.16Å; Y591-L594 PolarHBondContact O-N 2.87Å; Y591-K595 HydrophobicContact CE1-CB 4.09Å; Y591-K595 HydrophobicContact CE2-CG 4.49Å; Y591-K595 PolarHBondContact O-N 2.78Å; Y591-R598 HydrophobicContact CE1-CB 3.96Å; Y591-L600 HydrophobicContact CD1-CD1 4.18Å; Y591-L600 HydrophobicContact CD1-CD2 3.83Å; Y591-L600 HydrophobicContact CD1-CG 3.78Å; Y591-L600 HydrophobicContact CD2-CD1 4.28Å; Y591-L600 HydrophobicContact CD2-CD2 4.21Å; Y591-L600 HydrophobicContact CE1-CD2 3.76Å; Y591-L600 HydrophobicContact CE1-CG 4.19Å; Y591-L600 HydrophobicContact CE2-CD2 4.11Å; Y591-L600 HydrophobicContact CG-CD1 3.85Å; Y591-L600 HydrophobicContact CG-CD2 4.07Å; Y591-L600 HydrophobicContact CG-CG 3.97Å
592	E	90.3	Very high	86.9	Confident	81 Å²	81	79.3 Å²	79.3	38%	0.379	39%	0.392	S	S	.	.	H	α-helix	trans	-61	-35.6	177.4	-74.8	170.6	-178.7	0	0	112.4	T588 K595 R598 T599	T588-E592 HydrophobicContact CG2-CG 4.47Å; T588-E592 WeakPolarHBondContact O-CG 3.4Å; T588-E592 PolarHBondContact O-N 3.1Å; E592-K595 CarbonylContact O-C 3.56Å; E592-R598 WeakPolarHBondContact CG-O 3.4Å; E592-T599 WeakPolarHBondContact OE1-CG2 3.48Å
593	K	87.6	Confident	86.9	Confident	172 Å²	172	77.4 Å²	77.4	75%	0.748	38%	0.382	S	S	*	.	H	α-helix	trans	-65.9	-38.5	173.2	-171.7	-175.5	177.2	-167.5	0	111.9	R589 R590 Y591	R589-K593 PolarHBondContact O-N 3.49Å; R590-K593 PolarHBondContact O-N 3.2Å; Y591-K593 VanDerWaalsContact C-N 3.27Å; Y591-K593 PolarHBondContact O-N 3.16Å
594	L	87.3	Confident	86.7	Confident	61 Å²	61	78.1 Å²	78.1	32%	0.319	39%	0.386	S	S	.	.	H	α-helix	trans	-76.4	-39.2	179.6	-175.5	67.6	0	0	0	112.5	I535 R590 Y591	I535-L594 HydrophobicContact CB-CD2 4.48Å; I535-L594 HydrophobicContact CG1-CD2 4.26Å; I535-L594 HydrophobicContact CG2-CD2 4.05Å; R590-L594 PolarHBondContact O-N 2.87Å; R590-L594 VanDerWaalsContact O-N 3.14Å; Y591-L594 PolarHBondContact O-N 2.87Å
595	K	85.9	Confident	86.3	Confident	91 Å²	91	78.2 Å²	78.2	40%	0.396	39%	0.386	S	S	.	.	S	Bend	trans	-127	93	-177.2	-70.2	-67.5	-173.4	178.2	0	109.7	Y591 E592	Y591-K595 HydrophobicContact CE1-CB 4.09Å; Y591-K595 HydrophobicContact CE2-CG 4.49Å; Y591-K595 PolarHBondContact O-N 2.78Å; E592-K595 CarbonylContact O-C 3.56Å
596	A	82.4	Confident	85.9	Confident	81 Å²	81	74.7 Å²	74.7	67%	0.669	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	143.8	178.7	0	0	0	0	0	112.4	R598	A596-R598 VanDerWaalsContact C-N 3.29Å; A596-R598 PolarHBondContact O-N 2.84Å
597	M	81.6	Confident	85.6	Confident	200 Å²	200	75.5 Å²	75.5	99%	0.985	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	27.2	178.3	-50.6	-164.8	-173.5	0	0	115.3
598	R	85.1	Confident	85.4	Confident	149 Å²	149	78.8 Å²	78.8	56%	0.562	40%	0.404	S	S	*	.			trans	-131	134.1	172.9	-61.2	-174.9	-177.5	-168.2	-4.7	110	Y591 E592 A596	Y591-R598 HydrophobicContact CE1-CB 3.96Å; E592-R598 WeakPolarHBondContact CG-O 3.4Å; A596-R598 VanDerWaalsContact C-N 3.29Å; A596-R598 PolarHBondContact O-N 2.84Å
599	T	85.6	Confident	85.2	Confident	113 Å²	113	80.3 Å²	80.3	69%	0.693	41%	0.413	S	S	*	.			trans	-117.4	156.6	174.9	58.9	0	0	0	0	109.8	E592	E592-T599 WeakPolarHBondContact OE1-CG2 3.48Å
600	L	87.1	Confident	85.1	Confident	40 Å²	40	78.2 Å²	78.2	21%	0.209	42%	0.416	C	S	.	.			trans	-97.2	133.8	-178.2	-64.7	176	0	0	0	110.9	V560 Y587 T588 Y591 W602	V560-L600 HydrophobicContact CG1-CD2 4.33Å; Y587-L600 HydrophobicContact CD1-CD1 3.72Å; Y587-L600 HydrophobicContact CE1-CD1 3.82Å; T588-L600 HydrophobicContact CG2-CB 4.45Å; Y591-L600 HydrophobicContact CD1-CD1 4.18Å; Y591-L600 HydrophobicContact CD1-CD2 3.83Å; Y591-L600 HydrophobicContact CD1-CG 3.78Å; Y591-L600 HydrophobicContact CD2-CD1 4.28Å; Y591-L600 HydrophobicContact CD2-CD2 4.21Å; Y591-L600 HydrophobicContact CE1-CD2 3.76Å; Y591-L600 HydrophobicContact CE1-CG 4.19Å; Y591-L600 HydrophobicContact CE2-CD2 4.11Å; Y591-L600 HydrophobicContact CG-CD1 3.85Å; Y591-L600 HydrophobicContact CG-CD2 4.07Å; Y591-L600 HydrophobicContact CG-CG 3.97Å; L600-W602 HydrophobicContact CD1-CZ2 4.17Å
601	S	86.5	Confident	85.1	Confident	107 Å²	107	76.8 Å²	76.8	75%	0.748	41%	0.413	S	S	*	.			trans	-104.5	118.7	166.7	-177	0	0	0	0	108.6
602	W	86.6	Confident	85	Confident	77 Å²	77	80.8 Å²	80.8	29%	0.292	44%	0.435	S	S	.	.			trans	-87.4	137.1	-174.5	-68.3	93.8	0	0	0	111.6	L556 A558 M584 Y587 T588 L600 P604	L556-W602 HydrophobicContact CD2-CH2 3.7Å; L556-W602 HydrophobicContact CD2-CZ2 4.37Å; L556-W602 HydrophobicContact CD2-CZ3 4.34Å; A558-W602 HydrophobicContact CB-CH2 3.72Å; A558-W602 HydrophobicContact CB-CZ3 3.81Å; M584-W602 HydrophobicContact CB-CD2 4.32Å; M584-W602 HydrophobicContact CB-CZ2 3.9Å; M584-W602 HydrophobicContact CE-CD2 4.37Å; M584-W602 HydrophobicContact CE-CE3 3.95Å; M584-W602 HydrophobicContact CE-CZ3 4.37Å; M584-W602 HydrophobicContact CG-CD2 4.03Å; M584-W602 HydrophobicContact CG-CE3 4.16Å; M584-W602 HydrophobicContact CG-CH2 4.15Å; M584-W602 HydrophobicContact CG-CZ2 4Å; M584-W602 HydrophobicContact CG-CZ3 4.22Å; M584-W602 HydrophobicContact SD-CB 4.48Å; M584-W602 HydrophobicContact SD-CD2 3.94Å; M584-W602 HydrophobicContact SD-CE3 4.12Å; M584-W602 HydrophobicContact SD-CG 4.11Å; Y587-W602 AromaticContact CD1-CH2 3.83Å; Y587-W602 HydrophobicContact CD1-CH2 3.83Å; Y587-W602 AromaticContact CD1-CZ2 3.86Å; Y587-W602 HydrophobicContact CD1-CZ2 3.86Å; Y587-W602 HydrophobicContact CE1-CH2 4.42Å; Y587-W602 HydrophobicContact CG-CH2 4.22Å; Y587-W602 HydrophobicContact CG-CZ2 4.35Å; T588-W602 PolarHBondContact OG1-NE1 3.01Å; L600-W602 HydrophobicContact CD1-CZ2 4.17Å; W602-P604 WeakPolarHBondContact O-CD 3.44Å
603	K	86.3	Confident	84.8	Confident	65 Å²	65	78 Å²	78	28%	0.283	42%	0.423	S	S	.	.			trans	-115.6	80.5	173.5	-64.9	-67.5	-176.8	174.6	0	109.5	E571 H605 L606	E571-K603 IonicContact OE1-NZ 3.86Å; E571-K603 PolarHBondContact OE1-NZ 3.09Å; K603-H605 PolarHBondContact O-N 3.41Å; K603-L606 HydrophobicContact CB-CD1 4.35Å; K603-L606 PolarHBondContact O-N 2.91Å
604	P	82.1	Confident	84.8	Confident	20 Å²	20	77.8 Å²	77.8	13%	0.13	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-72.4	-26.2	-165.8	27.4	-34.9	0	0	0	114.3	L574 L576 W602 L606 G607 P627	L574-P604 HydrophobicContact CB-CG 4.44Å; L576-P604 HydrophobicContact CD1-CB 3.71Å; L576-P604 HydrophobicContact CD1-CG 4.26Å; L576-P604 HydrophobicContact CD2-CB 4.06Å; L576-P604 HydrophobicContact CG-CB 4.19Å; W602-P604 WeakPolarHBondContact O-CD 3.44Å; P604-L606 PolarHBondContact O-N 3.29Å; P604-G607 PolarHBondContact O-N 3.43Å; P604-P627 WeakPolarHBondContact O-CB 3.33Å; P604-P627 WeakPolarHBondContact O-CG 3.48Å
605	H	80.3	Confident	84.5	Confident	29 Å²	29	76.1 Å²	76.1	13%	0.134	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-65.9	-21.7	179.9	58	-83.2	0	0	0	113.4	K570 E572 K603	K570-H605 PolarHBondContact O-CE1 2.88Å; K570-H605 PolarHBondContact O-NE2 3.25Å; E572-H605 HydrophobicContact CB-CB 4.11Å; K603-H605 PolarHBondContact O-N 3.41Å
606	L	80.6	Confident	84.2	Confident	30 Å²	30	79.5 Å²	79.5	16%	0.157	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-89.4	-0.6	178.1	-57.8	179.7	0	0	0	114.1	L493 L569 K603 P604 N707	L493-L606 HydrophobicContact CD1-CD1 4.39Å; L569-L606 HydrophobicContact CB-CD1 4.11Å; L569-L606 HydrophobicContact CD1-CD1 3.84Å; L569-L606 HydrophobicContact CD2-CD1 4.08Å; L569-L606 HydrophobicContact CG-CD1 4.22Å; K603-L606 HydrophobicContact CB-CD1 4.35Å; K603-L606 PolarHBondContact O-N 2.91Å; P604-L606 PolarHBondContact O-N 3.29Å; L606-N707 HydrophobicContact CD2-CB 3.62Å
607	G	80.6	Confident	83.9	Confident	34 Å²	34	79.4 Å²	79.4	35%	0.351	42%	0.421	S	S	.	.			trans	-75.7	171.9	-178.9	0	0	0	0	0	113	P604 P627	P604-G607 PolarHBondContact O-N 3.43Å; G607-P627 WeakPolarHBondContact O-CD 3.39Å
608	S	83.7	Confident	83.7	Confident	71 Å²	71	72 Å²	72	50%	0.497	38%	0.382	S	S	.	.			trans	-128.2	141.2	163.8	50.8	0	0	0	0	109.4	L496	L496-S608 WeakPolarHBondContact CD1-OG 3.46Å
609	V	85.5	Confident	83.4	Confident	53 Å²	53	69.3 Å²	69.3	32%	0.321	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	130.6	-179.4	-172.6	0	0	0	0	108.5	T624 V625 P627 A630	V609-T624 WeakPolarHBondContact O-CA 3.36Å; V609-V625 PolarHBondContact N-O 2.92Å; V609-V625 PolarHBondContact O-N 3.33Å; V609-P627 HydrophobicContact CG2-CB 4.22Å; V609-P627 HydrophobicContact CG2-CG 3.75Å; V609-A630 HydrophobicContact CB-CB 4.17Å; V609-A630 HydrophobicContact CG1-CB 4.2Å; V609-A630 HydrophobicContact CG2-CB 4.3Å
610	T	87.1	Confident	83.1	Confident	100 Å²	100	64.7 Å²	64.7	61%	0.613	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	122.2	167.9	49.8	0	0	0	0	108.7	L623 T624	T610-L623 CarbonylContact C-O 3.58Å; T610-L623 WeakPolarHBondContact CA-O 3.42Å; T610-T624 HydrophobicContact CG2-CG2 3.7Å
611	L	86.6	Confident	82.7	Confident	25 Å²	25	66.9 Å²	66.9	13%	0.131	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	148.8	179.8	58.3	86.9	0	0	0	111.7	L613 L623 V625 A630 W665	L611-L613 HydrophobicContact CD1-CD1 3.81Å; L611-L613 HydrophobicContact CD1-CD2 3.66Å; L611-L613 HydrophobicContact CD1-CG 3.44Å; L611-L613 VanDerWaalsContact CD1-CG 3.44Å; L611-L623 HydrophobicContact CD1-CB 3.74Å; L611-L623 HydrophobicContact CD1-CD1 3.81Å; L611-L623 HydrophobicContact CD1-CG 4.36Å; L611-L623 HydrophobicContact CG-CB 4.17Å; L611-L623 PolarHBondContact N-O 3.5Å; L611-L623 PolarHBondContact O-N 3.43Å; L611-V625 HydrophobicContact CD2-CG2 3.34Å; L611-V625 HydrophobicContact CG-CG2 4.1Å; L611-A630 HydrophobicContact CD2-CB 3.74Å; L611-W665 HydrophobicContact CD1-CH2 4.18Å
612	D	87.2	Confident	82.1	Confident	98 Å²	98	67.7 Å²	67.7	52%	0.524	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124	172	-66	-29.2	0	0	0	107.8	L620 T621 N622	D612-L620 CarbonylContact C-O 3.59Å; D612-L620 WeakPolarHBondContact CA-O 3.46Å; D612-T621 WeakPolarHBondContact OD1-CA 3.31Å; D612-N622 PolarHBondContact OD1-N 3.25Å
613	L	85.4	Confident	81.8	Confident	23 Å²	23	65.7 Å²	65.7	12%	0.12	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	115.2	178.7	-59.7	175.6	0	0	0	110	L611 T619 L620 L623 I633 W665	L611-L613 HydrophobicContact CD1-CD1 3.81Å; L611-L613 HydrophobicContact CD1-CD2 3.66Å; L611-L613 HydrophobicContact CD1-CG 3.44Å; L611-L613 VanDerWaalsContact CD1-CG 3.44Å; L613-T619 CarbonylContact O-C 3.6Å; L613-T619 VanDerWaalsContact O-CA 3.3Å; L613-T619 WeakPolarHBondContact O-CA 3.49Å; L613-L620 HydrophobicContact CB-CB 4.24Å; L613-L620 HydrophobicContact CD1-CD1 4.39Å; L613-L620 PolarHBondContact N-O 2.79Å; L613-L620 PolarHBondContact O-N 2.77Å; L613-L623 HydrophobicContact CD1-CD1 3.64Å; L613-L623 HydrophobicContact CG-CD1 4.09Å; L613-I633 HydrophobicContact CD1-CD1 3.58Å; L613-I633 HydrophobicContact CD2-CD1 4.25Å; L613-I633 HydrophobicContact CD2-CG2 3.62Å; L613-W665 HydrophobicContact CD1-CH2 4.11Å; L613-W665 HydrophobicContact CD1-CZ3 3.85Å
614	E	86.6	Confident	81.6	Confident	166 Å²	166	65.9 Å²	65.9	78%	0.776	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	104.3	172.2	-58.9	-174	165.5	0	0	108.9	T619	E614-T619 HydrophobicContact CB-CG2 4.43Å; E614-T619 HydrophobicContact CG-CG2 4.07Å
615	L	82.5	Confident	81.8	Confident	26 Å²	26	65.8 Å²	65.8	14%	0.136	37%	0.365	C	S	.	.			trans	-98.7	166.6	170.8	-59.7	167.7	0	0	0	109.4	D617 R618 V681	L615-D617 PolarHBondContact O-N 2.96Å; L615-R618 HydrophobicContact CB-CG 4.37Å; L615-R618 WeakPolarHBondContact CB-O 3.46Å; L615-R618 HydrophobicContact CD1-CG 4.04Å; L615-R618 PolarHBondContact N-O 2.95Å; L615-V681 HydrophobicContact CD2-CG1 4.4Å
616	E	78.6	Confident	82	Confident	163 Å²	163	65.2 Å²	65.2	76%	0.762	36%	0.364	S	S	*	.	S	Bend	trans	-56.3	-33.7	-179.5	-69.6	-174.5	168.4	0	0	114	E683	E616-E683 HydrophobicContact CB-CB 4.16Å; E616-E683 HydrophobicContact CG-CB 3.96Å; E616-E683 HydrophobicContact CG-CG 4.23Å; E616-E683 PolarHBondContact N-OE2 2.77Å
617	D	76.2	Confident	82.3	Confident	79 Å²	79	64.5 Å²	64.5	42%	0.422	36%	0.361	S	S	.	.	S	Bend	trans	-105.7	-20.3	-175.6	73.4	-15.2	0	0	0	115.2	L615 T684 G685	L615-D617 PolarHBondContact O-N 2.96Å; D617-T684 WeakPolarHBondContact OD2-CA 3.49Å; D617-G685 PolarHBondContact OD2-N 3.44Å
618	R	78	Confident	82.6	Confident	45 Å²	45	63.3 Å²	63.3	17%	0.17	35%	0.347	C	S	.	.			trans	-152.9	146.6	-173.2	69	-163.2	158.2	151	0.3	113.1	L615 L620 G669	L615-R618 HydrophobicContact CB-CG 4.37Å; L615-R618 WeakPolarHBondContact CB-O 3.46Å; L615-R618 HydrophobicContact CD1-CG 4.04Å; L615-R618 PolarHBondContact N-O 2.95Å; R618-L620 HydrophobicContact CG-CD2 4.44Å; R618-L620 HydrophobicContact CG-CG 4.49Å; R618-G669 PolarHBondContact NH2-O 3.49Å
619	T	79.1	Confident	82.8	Confident	91 Å²	91	60.1 Å²	60.1	56%	0.558	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	112.8	168.5	55.9	0	0	0	0	109.2	L613 E614 T621	L613-T619 CarbonylContact O-C 3.6Å; L613-T619 VanDerWaalsContact O-CA 3.3Å; L613-T619 WeakPolarHBondContact O-CA 3.49Å; E614-T619 HydrophobicContact CB-CG2 4.43Å; E614-T619 HydrophobicContact CG-CG2 4.07Å; T619-T621 PolarHBondContact O-N 3.3Å
620	L	78.3	Confident	82.9	Confident	16 Å²	16	58 Å²	58	8%	0.084	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	102.5	171.5	-56.6	175.1	0	0	0	108.3	D612 L613 R618 L623 V670 L691	D612-L620 CarbonylContact C-O 3.59Å; D612-L620 WeakPolarHBondContact CA-O 3.46Å; L613-L620 HydrophobicContact CB-CB 4.24Å; L613-L620 HydrophobicContact CD1-CD1 4.39Å; L613-L620 PolarHBondContact N-O 2.79Å; L613-L620 PolarHBondContact O-N 2.77Å; R618-L620 HydrophobicContact CG-CD2 4.44Å; R618-L620 HydrophobicContact CG-CG 4.49Å; L620-L623 HydrophobicContact CB-CD1 3.72Å; L620-L623 HydrophobicContact CB-CG 4.19Å; L620-L623 HydrophobicContact CD1-CD1 4.1Å; L620-V670 HydrophobicContact CD1-CG2 4.08Å; L620-L691 HydrophobicContact CD2-CD2 3.54Å
621	T	78.3	Confident	82.9	Confident	86 Å²	86	53.2 Å²	53.2	53%	0.528	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	148.2	-178.1	56.2	0	0	0	0	112.2	D612 T619	D612-T621 WeakPolarHBondContact OD1-CA 3.31Å; T619-T621 PolarHBondContact O-N 3.3Å
622	N	75.4	Confident	83.1	Confident	124 Å²	124	52 Å²	52	66%	0.663	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	59	42	174.7	-64.6	-56.1	0	0	0	114.7	D612 T624	D612-N622 PolarHBondContact OD1-N 3.25Å; N622-T624 PolarHBondContact O-N 3.2Å
623	L	80.3	Confident	83.1	Confident	35 Å²	35	48.3 Å²	48.3	18%	0.183	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	109.7	172.5	-65.7	174.7	0	0	0	109.9	T610 L611 L613 L620 V625 W665	T610-L623 CarbonylContact C-O 3.58Å; T610-L623 WeakPolarHBondContact CA-O 3.42Å; L611-L623 HydrophobicContact CD1-CB 3.74Å; L611-L623 HydrophobicContact CD1-CD1 3.81Å; L611-L623 HydrophobicContact CD1-CG 4.36Å; L611-L623 HydrophobicContact CG-CB 4.17Å; L611-L623 PolarHBondContact N-O 3.5Å; L611-L623 PolarHBondContact O-N 3.43Å; L613-L623 HydrophobicContact CD1-CD1 3.64Å; L613-L623 HydrophobicContact CG-CD1 4.09Å; L620-L623 HydrophobicContact CB-CD1 3.72Å; L620-L623 HydrophobicContact CB-CG 4.19Å; L620-L623 HydrophobicContact CD1-CD1 4.1Å; L623-V625 HydrophobicContact CB-CG1 4.5Å; L623-W665 HydrophobicContact CD1-CH2 4.32Å; L623-W665 HydrophobicContact CD1-CZ3 4.14Å
624	T	82.1	Confident	83.2	Confident	69 Å²	69	50.6 Å²	50.6	42%	0.423	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	111.6	169.8	50.9	0	0	0	0	109.5	V609 T610 N622	V609-T624 WeakPolarHBondContact O-CA 3.36Å; T610-T624 HydrophobicContact CG2-CG2 3.7Å; N622-T624 PolarHBondContact O-N 3.2Å
625	V	84.7	Confident	83.2	Confident	18 Å²	18	43.8 Å²	43.8	11%	0.109	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	163.4	178.3	-58.6	0	0	0	0	111.1	V609 L611 L623 H629 A630 W665	V609-V625 PolarHBondContact N-O 2.92Å; V609-V625 PolarHBondContact O-N 3.33Å; L611-V625 HydrophobicContact CD2-CG2 3.34Å; L611-V625 HydrophobicContact CG-CG2 4.1Å; L623-V625 HydrophobicContact CB-CG1 4.5Å; V625-H629 HydrophobicContact CB-CB 3.84Å; V625-H629 HydrophobicContact CG2-CB 3.94Å; V625-A630 HydrophobicContact CG2-CB 4.15Å; V625-W665 HydrophobicContact CB-CZ2 4.49Å; V625-W665 HydrophobicContact CG1-CH2 3.85Å; V625-W665 HydrophobicContact CG1-CZ2 4.02Å; V625-W665 HydrophobicContact CG2-CZ2 4.26Å
626	S	85.6	Confident	83.5	Confident	17 Å²	17	43.1 Å²	43.1	12%	0.119	23%	0.233	C	C	.	.			trans	-72	154.5	173.3	69.6	0	0	0	0	112.1	I628 H629 A630	S626-I628 PolarHBondContact O-N 3.4Å; S626-I628 VanDerWaalsContact O-N 3.11Å; S626-H629 WeakPolarHBondContact O-CB 3.43Å; S626-H629 PolarHBondContact O-N 3.3Å; S626-H629 PolarHBondContact OG-CE1 3.45Å; S626-H629 PolarHBondContact OG-ND1 3.47Å; S626-A630 PolarHBondContact O-N 2.94Å; S626-A630 VanDerWaalsContact O-N 3.15Å
627	P	86.4	Confident	83.9	Confident	15 Å²	15	43.1 Å²	43.1	10%	0.097	23%	0.233	C	C	.	.	H	α-helix	trans	-54.2	-31.3	-177.3	-35.8	40.1	0	0	0	115.1	L576 P604 G607 V609 A630 A631	L576-P627 HydrophobicContact CD2-CB 4.45Å; P604-P627 WeakPolarHBondContact O-CB 3.33Å; P604-P627 WeakPolarHBondContact O-CG 3.48Å; G607-P627 WeakPolarHBondContact O-CD 3.39Å; V609-P627 HydrophobicContact CG2-CB 4.22Å; V609-P627 HydrophobicContact CG2-CG 3.75Å; P627-A630 PolarHBondContact O-N 2.88Å; P627-A631 VanDerWaalsContact O-CB 3.32Å; P627-A631 WeakPolarHBondContact O-CB 3.19Å; P627-A631 PolarHBondContact O-N 3.37Å
628	I	87	Confident	84.3	Confident	10 Å²	10	46.4 Å²	46.4	5%	0.051	25%	0.246	C	C	.	.	H	α-helix	trans	-67.8	-40	175.4	-163.5	169.5	0	0	0	111.9	L574 S626 A630 A631 I632 A653 L657 L658 K661	L574-I628 HydrophobicContact CD1-CB 4.4Å; L574-I628 HydrophobicContact CD1-CD1 4.07Å; L574-I628 HydrophobicContact CD1-CG1 3.8Å; L574-I628 HydrophobicContact CD2-CB 4.14Å; L574-I628 HydrophobicContact CD2-CG1 4.44Å; S626-I628 PolarHBondContact O-N 3.4Å; S626-I628 VanDerWaalsContact O-N 3.11Å; I628-A630 VanDerWaalsContact C-N 3.33Å; I628-A630 PolarHBondContact O-N 3.3Å; I628-A631 PolarHBondContact O-N 3.05Å; I628-I632 HydrophobicContact CG1-CD1 4.38Å; I628-I632 WeakPolarHBondContact O-CD1 3.45Å; I628-I632 VanDerWaalsContact O-CG1 3.22Å; I628-I632 WeakPolarHBondContact O-CG1 3.47Å; I628-I632 PolarHBondContact O-N 2.95Å; I628-A653 HydrophobicContact CD1-CB 4.42Å; I628-L657 HydrophobicContact CD1-CD2 3.2Å; I628-L658 HydrophobicContact CD1-CD2 4.43Å; I628-K661 HydrophobicContact CG2-CD 4.02Å; I628-K661 HydrophobicContact CG2-CG 4.05Å
629	H	87.4	Confident	84.8	Confident	3 Å²	3	48.3 Å²	48.3	1%	0.014	26%	0.255	C	S	.	.	H	α-helix	trans	-64.2	-40.7	175.6	-67.9	110.8	0	0	0	111.2	V625 S626 I633 K661 W665	V625-H629 HydrophobicContact CB-CB 3.84Å; V625-H629 HydrophobicContact CG2-CB 3.94Å; S626-H629 WeakPolarHBondContact O-CB 3.43Å; S626-H629 PolarHBondContact O-N 3.3Å; S626-H629 PolarHBondContact OG-CE1 3.45Å; S626-H629 PolarHBondContact OG-ND1 3.47Å; H629-I633 PolarHBondContact O-N 3.41Å; H629-K661 PolarHBondContact CD2-O 3.36Å; H629-K661 WeakPolarHBondContact CE1-CD 3.4Å; H629-K661 VanDerWaalsContact NE2-CD 3.33Å; H629-K661 WeakPolarHBondContact NE2-CD 3.29Å; H629-K661 PolarHBondContact NE2-O 2.83Å; H629-W665 HydrophobicContact CB-CZ2 3.92Å; H629-W665 AromaticContact CD2-NE1 3.87Å; H629-W665 PolarHBondContact O-NE1 3.12Å; H629-W665 VanDerWaalsContact O-NE1 3.14Å
630	A	87.7	Confident	85	Confident	8 Å²	8	47.8 Å²	47.8	7%	0.066	26%	0.255	C	S	.	.	H	α-helix	trans	-64.8	-44.8	175.6	0	0	0	0	0	111.8	V609 L611 V625 S626 P627 I628 I632 I633 L634	V609-A630 HydrophobicContact CB-CB 4.17Å; V609-A630 HydrophobicContact CG1-CB 4.2Å; V609-A630 HydrophobicContact CG2-CB 4.3Å; L611-A630 HydrophobicContact CD2-CB 3.74Å; V625-A630 HydrophobicContact CG2-CB 4.15Å; S626-A630 PolarHBondContact O-N 2.94Å; S626-A630 VanDerWaalsContact O-N 3.15Å; P627-A630 PolarHBondContact O-N 2.88Å; I628-A630 VanDerWaalsContact C-N 3.33Å; I628-A630 PolarHBondContact O-N 3.3Å; A630-I632 VanDerWaalsContact C-N 3.35Å; A630-I632 PolarHBondContact O-N 3.46Å; A630-I633 PolarHBondContact O-N 2.95Å; A630-L634 WeakPolarHBondContact O-CG 3.32Å; A630-L634 PolarHBondContact O-N 3.08Å
631	A	88.4	Confident	85.5	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.008	26%	0.262	C	S	.	.	H	α-helix	trans	-61.9	-41.4	178.3	0	0	0	0	0	112	P577 P627 I628 I633 L634 H635 L651	P577-A631 HydrophobicContact CG-CB 4.2Å; P627-A631 VanDerWaalsContact O-CB 3.32Å; P627-A631 WeakPolarHBondContact O-CB 3.19Å; P627-A631 PolarHBondContact O-N 3.37Å; I628-A631 PolarHBondContact O-N 3.05Å; A631-I633 PolarHBondContact O-N 3.18Å; A631-L634 PolarHBondContact O-N 2.95Å; A631-H635 PolarHBondContact O-CD2 3.03Å; A631-H635 PolarHBondContact O-N 2.94Å; A631-L651 HydrophobicContact CB-CD2 3.65Å
632	I	89.2	Confident	86	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-55.4	-53.5	174.6	-70.9	163.9	0	0	0	110.2	I628 A630 L634 H635 F636 L651 L658 K661 L662	I628-I632 HydrophobicContact CG1-CD1 4.38Å; I628-I632 WeakPolarHBondContact O-CD1 3.45Å; I628-I632 VanDerWaalsContact O-CG1 3.22Å; I628-I632 WeakPolarHBondContact O-CG1 3.47Å; I628-I632 PolarHBondContact O-N 2.95Å; A630-I632 VanDerWaalsContact C-N 3.35Å; A630-I632 PolarHBondContact O-N 3.46Å; I632-L634 PolarHBondContact O-N 3.12Å; I632-H635 PolarHBondContact O-N 3.37Å; I632-F636 HydrophobicContact CG2-CD2 3.96Å; I632-F636 HydrophobicContact CG2-CE2 3.77Å; I632-F636 VanDerWaalsContact O-CD2 3.25Å; I632-F636 WeakPolarHBondContact O-CD2 3.44Å; I632-F636 PolarHBondContact O-N 2.8Å; I632-L651 HydrophobicContact CG1-CD1 3.62Å; I632-L658 HydrophobicContact CD1-CD2 3.98Å; I632-L658 HydrophobicContact CG1-CD2 4.17Å; I632-K661 HydrophobicContact CD1-CB 4.21Å; I632-L662 HydrophobicContact CG2-CD2 3.71Å
633	I	88.4	Confident	86.7	Confident	20 Å²	20	40.7 Å²	40.7	10%	0.103	22%	0.217	C	C	.	.	H	α-helix	trans	-65.2	-38.8	-177.8	-71.6	-160.9	0	0	0	112.6	L613 H629 A630 A631 H635 F636 Q637 W665 V670	L613-I633 HydrophobicContact CD1-CD1 3.58Å; L613-I633 HydrophobicContact CD2-CD1 4.25Å; L613-I633 HydrophobicContact CD2-CG2 3.62Å; H629-I633 PolarHBondContact O-N 3.41Å; A630-I633 PolarHBondContact O-N 2.95Å; A631-I633 PolarHBondContact O-N 3.18Å; I633-H635 PolarHBondContact O-N 3.48Å; I633-F636 WeakPolarHBondContact O-CA 3.4Å; I633-F636 WeakPolarHBondContact O-CB 3.26Å; I633-F636 PolarHBondContact O-N 3.47Å; I633-Q637 PolarHBondContact O-N 2.97Å; I633-Q637 VanDerWaalsContact O-N 3.11Å; I633-W665 HydrophobicContact CD1-CD2 3.41Å; I633-W665 VanDerWaalsContact CD1-CD2 3.41Å; I633-W665 HydrophobicContact CD1-CE3 3.43Å; I633-W665 VanDerWaalsContact CD1-CE3 3.43Å; I633-W665 HydrophobicContact CD1-CG 4.2Å; I633-W665 HydrophobicContact CD1-CH2 3.29Å; I633-W665 HydrophobicContact CD1-CZ2 3.23Å; I633-W665 HydrophobicContact CD1-CZ3 3.37Å; I633-W665 HydrophobicContact CG1-CD2 3.92Å; I633-W665 HydrophobicContact CG1-CE3 4.43Å; I633-W665 HydrophobicContact CG1-CG 4.32Å; I633-W665 HydrophobicContact CG1-CH2 4.27Å; I633-W665 HydrophobicContact CG1-CZ2 3.72Å; I633-V670 HydrophobicContact CD1-CG1 4.14Å
634	L	86.8	Confident	87.1	Confident	71 Å²	71	40.5 Å²	40.5	37%	0.372	22%	0.216	S	C	.	.	H	α-helix	trans	-60.4	-33.3	178.2	-74.5	165.2	0	0	0	111.9	P577 A630 A631 I632 Q637	P577-L634 HydrophobicContact CB-CD1 4.07Å; P577-L634 HydrophobicContact CG-CB 4.27Å; P577-L634 HydrophobicContact CG-CD1 3.56Å; A630-L634 WeakPolarHBondContact O-CG 3.32Å; A630-L634 PolarHBondContact O-N 3.08Å; A631-L634 PolarHBondContact O-N 2.95Å; I632-L634 PolarHBondContact O-N 3.12Å; L634-Q637 VanDerWaalsContact O-CB 3.29Å; L634-Q637 WeakPolarHBondContact O-CB 3.3Å; L634-Q637 PolarHBondContact O-N 2.64Å
635	H	87.5	Confident	87.3	Confident	22 Å²	22	43.1 Å²	43.1	10%	0.102	22%	0.223	C	C	.	.	H	α-helix	trans	-71.1	-29.2	171.6	-69	-52.8	0	0	0	113.7	A631 I632 I633 Q637 E638 K639 W642	A631-H635 PolarHBondContact O-CD2 3.03Å; A631-H635 PolarHBondContact O-N 2.94Å; I632-H635 PolarHBondContact O-N 3.37Å; I633-H635 PolarHBondContact O-N 3.48Å; H635-Q637 PolarHBondContact O-N 3Å; H635-E638 PolarHBondContact O-N 2.83Å; H635-K639 PolarHBondContact O-N 3.09Å; H635-W642 HydrophobicContact CB-CZ2 4.3Å; H635-W642 PolarHBondContact O-NE1 3.01Å
636	F	88.2	Confident	87.5	Confident	12 Å²	12	45.6 Å²	45.6	5%	0.053	23%	0.233	C	C	.	.	H	α-helix	trans	-69.2	-22.6	172.6	-83.4	-76.9	0	0	0	113	I632 I633 E638 K639 W642 L647 L662 L671 Y679 V681	I632-F636 HydrophobicContact CG2-CD2 3.96Å; I632-F636 HydrophobicContact CG2-CE2 3.77Å; I632-F636 VanDerWaalsContact O-CD2 3.25Å; I632-F636 WeakPolarHBondContact O-CD2 3.44Å; I632-F636 PolarHBondContact O-N 2.8Å; I633-F636 WeakPolarHBondContact O-CA 3.4Å; I633-F636 WeakPolarHBondContact O-CB 3.26Å; I633-F636 PolarHBondContact O-N 3.47Å; F636-E638 VanDerWaalsContact C-N 3.34Å; F636-K639 CarbonylContact C-O 3.39Å; F636-K639 WeakPolarHBondContact CA-O 3.37Å; F636-K639 CarbonylContact O-C 3.35Å; F636-K639 VanDerWaalsContact O-O 3.1Å; F636-W642 AromaticContact CD1-CD1 3.6Å; F636-W642 HydrophobicContact CE1-CB 4.14Å; F636-W642 AromaticContact CE1-CD1 3.6Å; F636-W642 HydrophobicContact CE1-CG 4.27Å; F636-W642 HydrophobicContact CZ-CB 4.04Å; F636-W642 AromaticContact CZ-CD1 4Å; F636-W642 HydrophobicContact CZ-CG 4.38Å; F636-L647 HydrophobicContact CE2-CD1 4.19Å; F636-L647 HydrophobicContact CZ-CD1 4.17Å; F636-L662 HydrophobicContact CE2-CD2 4.36Å; F636-L671 HydrophobicContact CD1-CD2 3.92Å; F636-L671 HydrophobicContact CD2-CD1 4.21Å; F636-L671 HydrophobicContact CD2-CD2 3.99Å; F636-L671 HydrophobicContact CE1-CD2 3.81Å; F636-L671 HydrophobicContact CE2-CD1 3.69Å; F636-L671 HydrophobicContact CE2-CD2 3.93Å; F636-L671 HydrophobicContact CG-CD2 4Å; F636-L671 HydrophobicContact CZ-CD1 4.02Å; F636-L671 HydrophobicContact CZ-CD2 3.83Å; F636-Y679 WeakPolarHBondContact CE1-O 3.47Å; F636-V681 HydrophobicContact CB-CG2 3.68Å; F636-V681 HydrophobicContact CD1-CG2 3.4Å; F636-V681 VanDerWaalsContact CD1-CG2 3.4Å; F636-V681 HydrophobicContact CE1-CG2 4.32Å; F636-V681 HydrophobicContact CG-CG2 3.85Å
637	Q	86.3	Confident	87.5	Confident	163 Å²	163	44.8 Å²	44.8	76%	0.762	23%	0.228	S	C	*	.	H	α-helix	trans	-66.8	-33.8	171	-170.1	178.8	-6.4	0	0	112.4	I633 L634 H635	I633-Q637 PolarHBondContact O-N 2.97Å; I633-Q637 VanDerWaalsContact O-N 3.11Å; L634-Q637 VanDerWaalsContact O-CB 3.29Å; L634-Q637 WeakPolarHBondContact O-CB 3.3Å; L634-Q637 PolarHBondContact O-N 2.64Å; H635-Q637 PolarHBondContact O-N 3Å
638	E	85.8	Confident	87.6	Confident	149 Å²	149	45.2 Å²	45.2	70%	0.696	23%	0.231	S	C	*	.	H	α-helix	trans	-77.8	-36.8	177.3	-62.9	179.7	175.3	0	0	112.4	H635 F636	H635-E638 PolarHBondContact O-N 2.83Å; F636-E638 VanDerWaalsContact C-N 3.34Å
639	K	87	Confident	87.7	Confident	84 Å²	84	50.4 Å²	50.4	37%	0.365	26%	0.263	S	S	.	.			trans	-144.9	124.4	-176.3	-178.6	-169.5	-176.2	-169.9	0	110.1	H635 F636 S641 W642 E646	H635-K639 PolarHBondContact O-N 3.09Å; F636-K639 CarbonylContact C-O 3.39Å; F636-K639 WeakPolarHBondContact CA-O 3.37Å; F636-K639 CarbonylContact O-C 3.35Å; F636-K639 VanDerWaalsContact O-O 3.1Å; K639-S641 VanDerWaalsContact C-N 3.28Å; K639-S641 WeakPolarHBondContact CD-O 3.31Å; K639-S641 WeakPolarHBondContact CE-O 3.41Å; K639-S641 PolarHBondContact O-N 3.03Å; K639-W642 HydrophobicContact CB-CZ2 3.85Å; K639-W642 HydrophobicContact CD-CD2 4.07Å; K639-W642 HydrophobicContact CD-CE3 4.42Å; K639-W642 HydrophobicContact CD-CH2 4.33Å; K639-W642 HydrophobicContact CD-CZ2 3.97Å; K639-W642 VanDerWaalsContact O-CD1 3.24Å; K639-W642 PolarHBondContact O-NE1 2.88Å; K639-E646 IonicContact NZ-OE2 3.53Å; K639-E646 PolarHBondContact NZ-OE2 2.85Å
640	S	85.1	Confident	87.6	Confident	81 Å²	81	55.2 Å²	55.2	57%	0.566	28%	0.284	S	S	*	.	S	Bend	trans	-70.3	-14	-173.2	57.4	0	0	0	0	115.7	A680 V681	S640-A680 WeakPolarHBondContact O-CA 3.35Å; S640-V681 PolarHBondContact O-N 2.87Å
641	S	87.5	Confident	87.4	Confident	32 Å²	32	54.9 Å²	54.9	22%	0.224	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	131.4	178.5	70.5	0	0	0	0	112.4	K639 Y679	K639-S641 VanDerWaalsContact C-N 3.28Å; K639-S641 WeakPolarHBondContact CD-O 3.31Å; K639-S641 WeakPolarHBondContact CE-O 3.41Å; K639-S641 PolarHBondContact O-N 3.03Å; S641-Y679 CarbonylContact C-O 3.55Å; S641-Y679 VanDerWaalsContact CA-O 3.24Å; S641-Y679 WeakPolarHBondContact CA-O 3.37Å
642	W	90.1	Very high	87.2	Confident	18 Å²	18	57.1 Å²	57.1	7%	0.068	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	150	-178.9	-72.1	91.2	0	0	0	111.8	H635 F636 K639 E646 L647 K650 R678 Y679	H635-W642 HydrophobicContact CB-CZ2 4.3Å; H635-W642 PolarHBondContact O-NE1 3.01Å; F636-W642 AromaticContact CD1-CD1 3.6Å; F636-W642 HydrophobicContact CE1-CB 4.14Å; F636-W642 AromaticContact CE1-CD1 3.6Å; F636-W642 HydrophobicContact CE1-CG 4.27Å; F636-W642 HydrophobicContact CZ-CB 4.04Å; F636-W642 AromaticContact CZ-CD1 4Å; F636-W642 HydrophobicContact CZ-CG 4.38Å; K639-W642 HydrophobicContact CB-CZ2 3.85Å; K639-W642 HydrophobicContact CD-CD2 4.07Å; K639-W642 HydrophobicContact CD-CE3 4.42Å; K639-W642 HydrophobicContact CD-CH2 4.33Å; K639-W642 HydrophobicContact CD-CZ2 3.97Å; K639-W642 VanDerWaalsContact O-CD1 3.24Å; K639-W642 PolarHBondContact O-NE1 2.88Å; W642-E646 HydrophobicContact CE3-CB 3.7Å; W642-E646 HydrophobicContact CZ3-CB 4.05Å; W642-L647 HydrophobicContact CB-CD1 3.64Å; W642-L647 HydrophobicContact CB-CD2 4.21Å; W642-L647 HydrophobicContact CB-CG 3.68Å; W642-L647 HydrophobicContact CD2-CD2 4.21Å; W642-L647 HydrophobicContact CD2-CG 4.34Å; W642-L647 HydrophobicContact CE3-CD2 4.48Å; W642-L647 HydrophobicContact CE3-CG 4.39Å; W642-L647 HydrophobicContact CG-CD1 4.4Å; W642-L647 HydrophobicContact CG-CD2 4.1Å; W642-L647 HydrophobicContact CG-CG 4.08Å; W642-K650 HydrophobicContact CH2-CG 4.14Å; W642-K650 HydrophobicContact CZ3-CG 3.91Å; W642-R678 CarbonylContact O-C 3.6Å; W642-R678 WeakPolarHBondContact O-CA 3.28Å; W642-Y679 PolarHBondContact N-O 3.37Å; W642-Y679 PolarHBondContact O-N 2.95Å
643	T	90.1	Very high	87	Confident	27 Å²	27	57.3 Å²	57.3	17%	0.166	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	155.9	168.1	63.8	0	0	0	0	110.3	E645 E646 L647 R678	T643-E645 PolarHBondContact O-N 3.34Å; T643-E646 PolarHBondContact O-N 3.37Å; T643-E646 WeakPolarHBondContact OG1-CB 3.2Å; T643-E646 VanDerWaalsContact OG1-CD 3.3Å; T643-E646 WeakPolarHBondContact OG1-CG 2.95Å; T643-E646 PolarHBondContact OG1-N 3.44Å; T643-E646 PolarHBondContact OG1-OE1 2.99Å; T643-L647 PolarHBondContact O-N 3.12Å; T643-R678 HydrophobicContact CG2-CB 4.42Å
644	L	86.8	Confident	86.8	Confident	31 Å²	31	59.9 Å²	59.9	16%	0.162	32%	0.319	C	S	.	.	H	α-helix	trans	-56.9	-33.5	176.6	-71.8	169.3	0	0	0	112.9	S648 L662 G677 Y679	L644-S648 VanDerWaalsContact O-CB 3.22Å; L644-S648 WeakPolarHBondContact O-CB 3.26Å; L644-S648 PolarHBondContact O-N 3.19Å; L644-L662 HydrophobicContact CD2-CD1 3.48Å; L644-L662 VanDerWaalsContact CD2-CD1 3.48Å; L644-G677 PolarHBondContact N-O 3.15Å; L644-Y679 HydrophobicContact CD1-CE2 4.05Å; L644-Y679 HydrophobicContact CD2-CD2 4.27Å; L644-Y679 HydrophobicContact CD2-CE2 3.63Å; L644-Y679 HydrophobicContact CG-CD2 4.28Å; L644-Y679 HydrophobicContact CG-CE2 3.65Å
645	E	87.9	Confident	86.7	Confident	123 Å²	123	60.9 Å²	60.9	58%	0.575	32%	0.32	S	S	*	.	H	α-helix	trans	-71.7	-43.3	179.4	-48.9	-159.8	133.5	0	0	111.8	T643 S648 V649 K655	T643-E645 PolarHBondContact O-N 3.34Å; E645-S648 PolarHBondContact O-N 3.33Å; E645-V649 WeakPolarHBondContact O-CG2 3.44Å; E645-V649 PolarHBondContact O-N 3.27Å; E645-V649 VanDerWaalsContact O-N 3.08Å; E645-K655 IonicContact OE1-NZ 2.72Å; E645-K655 PolarHBondContact OE1-NZ 3.37Å
646	E	88.1	Confident	86.6	Confident	70 Å²	70	66.1 Å²	66.1	33%	0.327	35%	0.345	S	S	.	.	H	α-helix	trans	-64	-42.2	176.3	-71	168.7	-152.7	0	0	111.3	K639 W642 T643 K650	K639-E646 IonicContact NZ-OE2 3.53Å; K639-E646 PolarHBondContact NZ-OE2 2.85Å; W642-E646 HydrophobicContact CE3-CB 3.7Å; W642-E646 HydrophobicContact CZ3-CB 4.05Å; T643-E646 PolarHBondContact O-N 3.37Å; T643-E646 WeakPolarHBondContact OG1-CB 3.2Å; T643-E646 VanDerWaalsContact OG1-CD 3.3Å; T643-E646 WeakPolarHBondContact OG1-CG 2.95Å; T643-E646 PolarHBondContact OG1-N 3.44Å; T643-E646 PolarHBondContact OG1-OE1 2.99Å; E646-K650 WeakPolarHBondContact O-CB 3.33Å; E646-K650 WeakPolarHBondContact O-CG 3.49Å; E646-K650 PolarHBondContact O-N 3.39Å
647	L	86.4	Confident	86.3	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-66.2	-40	176.4	-80.3	163.6	0	0	0	112.4	F636 W642 T643 K650 L651 L658 L662	F636-L647 HydrophobicContact CE2-CD1 4.19Å; F636-L647 HydrophobicContact CZ-CD1 4.17Å; W642-L647 HydrophobicContact CB-CD1 3.64Å; W642-L647 HydrophobicContact CB-CD2 4.21Å; W642-L647 HydrophobicContact CB-CG 3.68Å; W642-L647 HydrophobicContact CD2-CD2 4.21Å; W642-L647 HydrophobicContact CD2-CG 4.34Å; W642-L647 HydrophobicContact CE3-CD2 4.48Å; W642-L647 HydrophobicContact CE3-CG 4.39Å; W642-L647 HydrophobicContact CG-CD1 4.4Å; W642-L647 HydrophobicContact CG-CD2 4.1Å; W642-L647 HydrophobicContact CG-CG 4.08Å; T643-L647 PolarHBondContact O-N 3.12Å; L647-K650 PolarHBondContact O-N 3.24Å; L647-L651 HydrophobicContact CD2-CD1 4.17Å; L647-L651 WeakPolarHBondContact O-CB 3.19Å; L647-L651 PolarHBondContact O-N 3.04Å; L647-L658 HydrophobicContact CB-CD1 4.37Å; L647-L662 HydrophobicContact CD1-CD1 4.46Å
648	S	88.6	Confident	86.2	Confident	23 Å²	23	59.6 Å²	59.6	16%	0.161	32%	0.315	C	S	.	.	H	α-helix	trans	-62.5	-43	177.2	178.5	0	0	0	0	112.3	L644 E645 A652 A653	L644-S648 VanDerWaalsContact O-CB 3.22Å; L644-S648 WeakPolarHBondContact O-CB 3.26Å; L644-S648 PolarHBondContact O-N 3.19Å; E645-S648 PolarHBondContact O-N 3.33Å; S648-A652 VanDerWaalsContact O-CA 3.32Å; S648-A652 WeakPolarHBondContact O-CA 3.34Å; S648-A652 PolarHBondContact O-N 3.26Å; S648-A653 WeakPolarHBondContact CB-O 3.24Å; S648-A653 PolarHBondContact O-N 2.99Å; S648-A653 PolarHBondContact OG-O 3.23Å
649	V	88.4	Confident	86.2	Confident	120 Å²	120	56.7 Å²	56.7	73%	0.727	30%	0.302	S	S	*	.	H	α-helix	trans	-66.7	-38.9	175.6	174.2	0	0	0	0	111.3	E645	E645-V649 WeakPolarHBondContact O-CG2 3.44Å; E645-V649 PolarHBondContact O-N 3.27Å; E645-V649 VanDerWaalsContact O-N 3.08Å
650	K	85.1	Confident	86	Confident	104 Å²	104	60.4 Å²	60.4	45%	0.452	31%	0.314	S	S	.	.	H	α-helix	trans	-74.4	-38.8	-177.4	-82.6	-73.3	-173	170	0	114.7	W642 E646 L647 A652	W642-K650 HydrophobicContact CH2-CG 4.14Å; W642-K650 HydrophobicContact CZ3-CG 3.91Å; E646-K650 WeakPolarHBondContact O-CB 3.33Å; E646-K650 WeakPolarHBondContact O-CG 3.49Å; E646-K650 PolarHBondContact O-N 3.39Å; L647-K650 PolarHBondContact O-N 3.24Å; K650-A652 VanDerWaalsContact C-N 3.35Å
651	L	84.1	Confident	86	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-90.1	-6.1	179.6	-72.4	160.2	0	0	0	112.4	L574 E575 A631 I632 L647 A653 L658	L574-L651 HydrophobicContact CD1-CB 4.36Å; L574-L651 HydrophobicContact CD1-CD2 4.15Å; E575-L651 PolarHBondContact N-O 2.88Å; A631-L651 HydrophobicContact CB-CD2 3.65Å; I632-L651 HydrophobicContact CG1-CD1 3.62Å; L647-L651 HydrophobicContact CD2-CD1 4.17Å; L647-L651 WeakPolarHBondContact O-CB 3.19Å; L647-L651 PolarHBondContact O-N 3.04Å; L651-A653 HydrophobicContact CB-CB 4.2Å; L651-A653 PolarHBondContact O-N 3.34Å; L651-L658 HydrophobicContact CD1-CD2 3.58Å
652	A	84.6	Confident	85.9	Confident	48 Å²	48	56.7 Å²	56.7	40%	0.397	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	29.6	-170.6	0	0	0	0	0	113.5	E575 S648 K650	E575-A652 HydrophobicContact CG-CB 4Å; S648-A652 VanDerWaalsContact O-CA 3.32Å; S648-A652 WeakPolarHBondContact O-CA 3.34Å; S648-A652 PolarHBondContact O-N 3.26Å; K650-A652 VanDerWaalsContact C-N 3.35Å
653	A	83.4	Confident	85.7	Confident	5 Å²	5	57.2 Å²	57.2	4%	0.041	29%	0.291	C	S	.	.			trans	-109.2	149.1	-174.9	0	0	0	0	0	112.3	I628 S648 L651 L658	I628-A653 HydrophobicContact CD1-CB 4.42Å; S648-A653 WeakPolarHBondContact CB-O 3.24Å; S648-A653 PolarHBondContact O-N 2.99Å; S648-A653 PolarHBondContact OG-O 3.23Å; L651-A653 HydrophobicContact CB-CB 4.2Å; L651-A653 PolarHBondContact O-N 3.34Å; A653-L658 HydrophobicContact CB-CD1 4.05Å; A653-L658 HydrophobicContact CB-CD2 4.15Å; A653-L658 HydrophobicContact CB-CG 3.91Å
654	P	86.1	Confident	85.4	Confident	74 Å²	74	57.1 Å²	57.1	48%	0.481	29%	0.29	S	S	.	.			trans	-59.8	144.8	176.6	-21.5	32.2	0	0	0	112.8	E656 L657 L658	P654-E656 VanDerWaalsContact C-N 3.27Å; P654-E656 PolarHBondContact O-N 2.85Å; P654-L657 HydrophobicContact CB-CB 4.31Å; P654-L657 PolarHBondContact O-N 2.82Å; P654-L658 PolarHBondContact O-N 2.63Å
655	K	84.5	Confident	85.4	Confident	91 Å²	91	55.7 Å²	55.7	40%	0.396	28%	0.282	S	S	.	.	H	α-helix	trans	-61.1	-37.7	-178.8	-67	-175.9	-177.6	-178.3	0	111.7	E645 H659	E645-K655 IonicContact OE1-NZ 2.72Å; E645-K655 PolarHBondContact OE1-NZ 3.37Å; K655-H659 WeakPolarHBondContact O-CB 3.44Å; K655-H659 PolarHBondContact O-N 3.38Å
656	E	84.2	Confident	85.3	Confident	133 Å²	133	52.7 Å²	52.7	62%	0.621	27%	0.268	S	S	*	.	H	α-helix	trans	-64.4	-43.6	-179.9	-62.2	75.3	-165	0	0	111.5	P654 R660	P654-E656 VanDerWaalsContact C-N 3.27Å; P654-E656 PolarHBondContact O-N 2.85Å; E656-R660 WeakPolarHBondContact O-CG 3.36Å; E656-R660 PolarHBondContact O-N 3.34Å
657	L	82.3	Confident	85	Confident	36 Å²	36	56.2 Å²	56.2	19%	0.188	29%	0.285	C	S	.	.	H	α-helix	trans	-68.7	-43.7	179.7	-173.2	147.1	0	0	0	110.8	E572 I628 P654 H659 R660 K661	E572-L657 WeakPolarHBondContact OE1-CD1 3.46Å; I628-L657 HydrophobicContact CD1-CD2 3.2Å; P654-L657 HydrophobicContact CB-CB 4.31Å; P654-L657 PolarHBondContact O-N 2.82Å; L657-H659 PolarHBondContact O-N 2.64Å; L657-R660 PolarHBondContact O-N 2.89Å; L657-K661 HydrophobicContact CD2-CG 4.17Å; L657-K661 WeakPolarHBondContact O-CG 3.28Å; L657-K661 PolarHBondContact O-N 3.01Å
658	L	84.6	Confident	84.6	Confident	1 Å²	1	59 Å²	59	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-62.5	-42.9	175.7	-75.4	170.9	0	0	0	112.6	I628 I632 L647 L651 A653 P654 R660 K661 L662	I628-L658 HydrophobicContact CD1-CD2 4.43Å; I632-L658 HydrophobicContact CD1-CD2 3.98Å; I632-L658 HydrophobicContact CG1-CD2 4.17Å; L647-L658 HydrophobicContact CB-CD1 4.37Å; L651-L658 HydrophobicContact CD1-CD2 3.58Å; A653-L658 HydrophobicContact CB-CD1 4.05Å; A653-L658 HydrophobicContact CB-CD2 4.15Å; A653-L658 HydrophobicContact CB-CG 3.91Å; P654-L658 PolarHBondContact O-N 2.63Å; L658-R660 VanDerWaalsContact C-N 3.31Å; L658-R660 PolarHBondContact O-N 3.45Å; L658-K661 PolarHBondContact O-N 3.48Å; L658-L662 WeakPolarHBondContact O-CB 3.41Å; L658-L662 WeakPolarHBondContact O-CD1 3.44Å; L658-L662 WeakPolarHBondContact O-CG 3.37Å; L658-L662 PolarHBondContact O-N 3.48Å
659	H	85.3	Confident	84.1	Confident	88 Å²	88	59.1 Å²	59.1	41%	0.407	30%	0.302	S	S	.	.	H	α-helix	trans	-59.7	-42.5	177.1	-175.2	-75.9	0	0	0	111.7	K655 L657 A663	K655-H659 WeakPolarHBondContact O-CB 3.44Å; K655-H659 PolarHBondContact O-N 3.38Å; L657-H659 PolarHBondContact O-N 2.64Å; H659-A663 PolarHBondContact O-N 3.17Å
660	R	83.5	Confident	83.9	Confident	163 Å²	163	53.7 Å²	53.7	62%	0.615	27%	0.269	S	S	*	.	H	α-helix	trans	-63.5	-48.6	175.3	-69.2	176.1	-172.1	-178.5	2.5	111.6	E656 L657 L658 L662 A663	E656-R660 WeakPolarHBondContact O-CG 3.36Å; E656-R660 PolarHBondContact O-N 3.34Å; L657-R660 PolarHBondContact O-N 2.89Å; L658-R660 VanDerWaalsContact C-N 3.31Å; L658-R660 PolarHBondContact O-N 3.45Å; R660-L662 VanDerWaalsContact C-N 3.31Å; R660-L662 PolarHBondContact O-N 2.88Å; R660-A663 WeakPolarHBondContact O-CB 3.37Å; R660-A663 PolarHBondContact O-N 3.14Å; R660-A663 VanDerWaalsContact O-N 3.09Å
661	K	84.4	Confident	84	Confident	35 Å²	35	49 Å²	49	15%	0.152	25%	0.249	C	C	.	.	H	α-helix	trans	-69.5	-25.6	-178	-63.5	-71.1	172.7	-169.3	0	112.9	I628 H629 I632 L657 L658 A663 D699 E702	I628-K661 HydrophobicContact CG2-CD 4.02Å; I628-K661 HydrophobicContact CG2-CG 4.05Å; H629-K661 PolarHBondContact CD2-O 3.36Å; H629-K661 WeakPolarHBondContact CE1-CD 3.4Å; H629-K661 VanDerWaalsContact NE2-CD 3.33Å; H629-K661 WeakPolarHBondContact NE2-CD 3.29Å; H629-K661 PolarHBondContact NE2-O 2.83Å; I632-K661 HydrophobicContact CD1-CB 4.21Å; L657-K661 HydrophobicContact CD2-CG 4.17Å; L657-K661 WeakPolarHBondContact O-CG 3.28Å; L657-K661 PolarHBondContact O-N 3.01Å; L658-K661 PolarHBondContact O-N 3.48Å; K661-A663 VanDerWaalsContact C-N 3.29Å; K661-A663 PolarHBondContact O-N 3.34Å; K661-D699 IonicContact NZ-OD2 2.96Å; K661-D699 PolarHBondContact NZ-OD2 3.11Å; K661-E702 IonicContact NZ-OE1 3.41Å; K661-E702 PolarHBondContact NZ-OE1 3.3Å
662	L	86.4	Confident	84.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68.4	-26.2	171.2	-76.8	165.1	0	0	0	113	I632 F636 L644 L647 L658 R660 L664 W665 Q666 L671 Y679	I632-L662 HydrophobicContact CG2-CD2 3.71Å; F636-L662 HydrophobicContact CE2-CD2 4.36Å; L644-L662 HydrophobicContact CD2-CD1 3.48Å; L644-L662 VanDerWaalsContact CD2-CD1 3.48Å; L647-L662 HydrophobicContact CD1-CD1 4.46Å; L658-L662 WeakPolarHBondContact O-CB 3.41Å; L658-L662 WeakPolarHBondContact O-CD1 3.44Å; L658-L662 WeakPolarHBondContact O-CG 3.37Å; L658-L662 PolarHBondContact O-N 3.48Å; R660-L662 VanDerWaalsContact C-N 3.31Å; R660-L662 PolarHBondContact O-N 2.88Å; L662-L664 VanDerWaalsContact C-N 3.25Å; L662-L664 PolarHBondContact O-N 3.46Å; L662-W665 PolarHBondContact O-N 2.87Å; L662-W665 VanDerWaalsContact O-N 3.14Å; L662-Q666 WeakPolarHBondContact O-CG 3.45Å; L662-Q666 PolarHBondContact O-N 2.97Å; L662-L671 HydrophobicContact CD2-CD1 3.48Å; L662-L671 VanDerWaalsContact CD2-CD1 3.48Å; L662-Y679 HydrophobicContact CB-CD1 4.4Å; L662-Y679 HydrophobicContact CB-CE1 3.88Å; L662-Y679 HydrophobicContact CD1-CD1 4.11Å; L662-Y679 HydrophobicContact CD1-CD2 4.23Å; L662-Y679 HydrophobicContact CD1-CE1 3.85Å; L662-Y679 HydrophobicContact CD1-CE2 4.09Å; L662-Y679 HydrophobicContact CD1-CG 4.29Å; L662-Y679 HydrophobicContact CD2-CD1 4.21Å; L662-Y679 HydrophobicContact CD2-CE1 4.49Å; L662-Y679 HydrophobicContact CG-CD1 4.49Å; L662-Y679 HydrophobicContact CG-CE1 4.3Å
663	A	86.1	Confident	84.2	Confident	29 Å²	29	57.7 Å²	57.7	24%	0.24	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-33.8	-179.6	0	0	0	0	0	112.3	H659 R660 K661 W665 Q666 Q667	H659-A663 PolarHBondContact O-N 3.17Å; R660-A663 WeakPolarHBondContact O-CB 3.37Å; R660-A663 PolarHBondContact O-N 3.14Å; R660-A663 VanDerWaalsContact O-N 3.09Å; K661-A663 VanDerWaalsContact C-N 3.29Å; K661-A663 PolarHBondContact O-N 3.34Å; A663-W665 PolarHBondContact O-N 3.43Å; A663-Q666 WeakPolarHBondContact O-CB 3.31Å; A663-Q666 PolarHBondContact O-N 3.08Å; A663-Q667 VanDerWaalsContact O-CG 3.27Å; A663-Q667 WeakPolarHBondContact O-CG 3.31Å; A663-Q667 PolarHBondContact O-N 3.34Å
664	L	83.9	Confident	84.2	Confident	25 Å²	25	62.1 Å²	62.1	13%	0.131	30%	0.295	C	S	.	.	H	α-helix	trans	-60.3	-46.8	175.3	-175.1	148.3	0	0	0	111	L662 Q666 Q667 Q668	L662-L664 VanDerWaalsContact C-N 3.25Å; L662-L664 PolarHBondContact O-N 3.46Å; L664-Q666 VanDerWaalsContact C-N 3.33Å; L664-Q666 PolarHBondContact O-N 3.45Å; L664-Q667 PolarHBondContact O-N 3.07Å; L664-Q668 HydrophobicContact CD2-CG 4.31Å; L664-Q668 WeakPolarHBondContact O-CG 3.23Å; L664-Q668 PolarHBondContact O-N 3.46Å
665	W	85.6	Confident	83.6	Confident	1 Å²	1	63.1 Å²	63.1	0%	0.004	31%	0.31	C	S	.	.	H	α-helix	trans	-70.8	-28.2	179	-65.7	126.2	0	0	0	113.6	L611 L613 L623 V625 H629 I633 L662 A663 Q668 G669 V670 L671	L611-W665 HydrophobicContact CD1-CH2 4.18Å; L613-W665 HydrophobicContact CD1-CH2 4.11Å; L613-W665 HydrophobicContact CD1-CZ3 3.85Å; L623-W665 HydrophobicContact CD1-CH2 4.32Å; L623-W665 HydrophobicContact CD1-CZ3 4.14Å; V625-W665 HydrophobicContact CB-CZ2 4.49Å; V625-W665 HydrophobicContact CG1-CH2 3.85Å; V625-W665 HydrophobicContact CG1-CZ2 4.02Å; V625-W665 HydrophobicContact CG2-CZ2 4.26Å; H629-W665 HydrophobicContact CB-CZ2 3.92Å; H629-W665 AromaticContact CD2-NE1 3.87Å; H629-W665 PolarHBondContact O-NE1 3.12Å; H629-W665 VanDerWaalsContact O-NE1 3.14Å; I633-W665 HydrophobicContact CD1-CD2 3.41Å; I633-W665 VanDerWaalsContact CD1-CD2 3.41Å; I633-W665 HydrophobicContact CD1-CE3 3.43Å; I633-W665 VanDerWaalsContact CD1-CE3 3.43Å; I633-W665 HydrophobicContact CD1-CG 4.2Å; I633-W665 HydrophobicContact CD1-CH2 3.29Å; I633-W665 HydrophobicContact CD1-CZ2 3.23Å; I633-W665 HydrophobicContact CD1-CZ3 3.37Å; I633-W665 HydrophobicContact CG1-CD2 3.92Å; I633-W665 HydrophobicContact CG1-CE3 4.43Å; I633-W665 HydrophobicContact CG1-CG 4.32Å; I633-W665 HydrophobicContact CG1-CH2 4.27Å; I633-W665 HydrophobicContact CG1-CZ2 3.72Å; L662-W665 PolarHBondContact O-N 2.87Å; L662-W665 VanDerWaalsContact O-N 3.14Å; A663-W665 PolarHBondContact O-N 3.43Å; W665-Q668 HydrophobicContact CE3-CB 4.42Å; W665-Q668 HydrophobicContact CE3-CG 4.41Å; W665-G669 PolarHBondContact O-N 3.19Å; W665-V670 HydrophobicContact CE3-CB 4.26Å; W665-V670 HydrophobicContact CE3-CG2 4.06Å; W665-V670 HydrophobicContact CZ3-CG2 4.44Å; W665-V670 PolarHBondContact O-N 3.21Å; W665-L671 HydrophobicContact CB-CB 4.31Å; W665-L671 HydrophobicContact CB-CD1 3.7Å; W665-L671 HydrophobicContact CB-CG 3.91Å; W665-L671 HydrophobicContact CG-CD1 4.32Å; W665-L671 PolarHBondContact O-N 3.45Å
666	Q	85.3	Confident	83	Confident	60 Å²	60	63.9 Å²	63.9	28%	0.28	33%	0.333	S	S	.	.	H	α-helix	trans	-67.5	-43.7	169	-69.2	178.8	-27.1	0	0	111.8	L662 A663 L664 Q668 G669 L671 Y679	L662-Q666 WeakPolarHBondContact O-CG 3.45Å; L662-Q666 PolarHBondContact O-N 2.97Å; A663-Q666 WeakPolarHBondContact O-CB 3.31Å; A663-Q666 PolarHBondContact O-N 3.08Å; L664-Q666 VanDerWaalsContact C-N 3.33Å; L664-Q666 PolarHBondContact O-N 3.45Å; Q666-Q668 VanDerWaalsContact C-N 3.3Å; Q666-Q668 PolarHBondContact O-N 3.22Å; Q666-G669 WeakPolarHBondContact O-CA 3.26Å; Q666-G669 PolarHBondContact O-N 2.96Å; Q666-L671 WeakPolarHBondContact CA-O 3.33Å; Q666-Y679 HydrophobicContact CG-CE1 4.35Å
667	Q	83.1	Confident	82.6	Confident	144 Å²	144	58.4 Å²	58.4	67%	0.673	31%	0.312	S	S	*	.	H	α-helix	trans	-63.7	-36.3	177.4	-72.3	175	21	0	0	112	A663 L664 G669	A663-Q667 VanDerWaalsContact O-CG 3.27Å; A663-Q667 WeakPolarHBondContact O-CG 3.31Å; A663-Q667 PolarHBondContact O-N 3.34Å; L664-Q667 PolarHBondContact O-N 3.07Å; Q667-G669 PolarHBondContact O-N 3.19Å
668	Q	76.6	Confident	82.8	Confident	60 Å²	60	61.9 Å²	61.9	28%	0.28	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-12.9	172.4	-67.1	-65.7	-5.6	0	0	113.6	L664 W665 Q666 V670	L664-Q668 HydrophobicContact CD2-CG 4.31Å; L664-Q668 WeakPolarHBondContact O-CG 3.23Å; L664-Q668 PolarHBondContact O-N 3.46Å; W665-Q668 HydrophobicContact CE3-CB 4.42Å; W665-Q668 HydrophobicContact CE3-CG 4.41Å; Q666-Q668 VanDerWaalsContact C-N 3.3Å; Q666-Q668 PolarHBondContact O-N 3.22Å; Q668-V670 VanDerWaalsContact C-N 3.28Å; Q668-V670 HydrophobicContact CB-CG2 4Å; Q668-V670 PolarHBondContact O-N 3.03Å
669	G	78.9	Confident	82.9	Confident	25 Å²	25	61.9 Å²	61.9	26%	0.258	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	28.6	-176.3	0	0	0	0	0	113.2	R618 W665 Q666 Q667	R618-G669 PolarHBondContact NH2-O 3.49Å; W665-G669 PolarHBondContact O-N 3.19Å; Q666-G669 WeakPolarHBondContact O-CA 3.26Å; Q666-G669 PolarHBondContact O-N 2.96Å; Q667-G669 PolarHBondContact O-N 3.19Å
670	V	84.1	Confident	83	Confident	5 Å²	5	58.5 Å²	58.5	3%	0.03	31%	0.31	C	S	.	.	S	Bend	trans	-86.9	-37.8	172.7	178.5	0	0	0	0	110.1	L620 I633 W665 Q668 M682	L620-V670 HydrophobicContact CD1-CG2 4.08Å; I633-V670 HydrophobicContact CD1-CG1 4.14Å; W665-V670 HydrophobicContact CE3-CB 4.26Å; W665-V670 HydrophobicContact CE3-CG2 4.06Å; W665-V670 HydrophobicContact CZ3-CG2 4.44Å; W665-V670 PolarHBondContact O-N 3.21Å; Q668-V670 VanDerWaalsContact C-N 3.28Å; Q668-V670 HydrophobicContact CB-CG2 4Å; Q668-V670 PolarHBondContact O-N 3.03Å; V670-M682 PolarHBondContact O-N 3.41Å
671	L	87	Confident	83.2	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.026	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	144.6	178.3	-62.2	179.4	0	0	0	111.1	F636 L662 W665 Q666 V681	F636-L671 HydrophobicContact CD1-CD2 3.92Å; F636-L671 HydrophobicContact CD2-CD1 4.21Å; F636-L671 HydrophobicContact CD2-CD2 3.99Å; F636-L671 HydrophobicContact CE1-CD2 3.81Å; F636-L671 HydrophobicContact CE2-CD1 3.69Å; F636-L671 HydrophobicContact CE2-CD2 3.93Å; F636-L671 HydrophobicContact CG-CD2 4Å; F636-L671 HydrophobicContact CZ-CD1 4.02Å; F636-L671 HydrophobicContact CZ-CD2 3.83Å; L662-L671 HydrophobicContact CD2-CD1 3.48Å; L662-L671 VanDerWaalsContact CD2-CD1 3.48Å; W665-L671 HydrophobicContact CB-CB 4.31Å; W665-L671 HydrophobicContact CB-CD1 3.7Å; W665-L671 HydrophobicContact CB-CG 3.91Å; W665-L671 HydrophobicContact CG-CD1 4.32Å; W665-L671 PolarHBondContact O-N 3.45Å; Q666-L671 WeakPolarHBondContact CA-O 3.33Å; L671-V681 HydrophobicContact CD2-CG2 4.1Å
672	R	85.9	Confident	83.2	Confident	136 Å²	136	52 Å²	52	51%	0.513	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	138.7	169.2	-178.6	-177.5	-67.8	166.2	-2.4	110.1	Y679 A680 M682	R672-Y679 WeakPolarHBondContact O-CA 3.23Å; R672-A680 PolarHBondContact N-O 2.85Å; R672-A680 PolarHBondContact O-N 2.88Å; R672-M682 HydrophobicContact CB-CG 3.87Å; R672-M682 HydrophobicContact CB-SD 3.75Å; R672-M682 HydrophobicContact CG-SD 4.48Å; R672-M682 PolarHBondContact NE-SD 3.27Å; R672-M682 PolarHBondContact NH2-SD 3.36Å
673	E	86.6	Confident	82.7	Confident	95 Å²	95	55.4 Å²	55.4	44%	0.444	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	121	169.2	-170.3	173	-171.4	0	0	110.4	Y679	E673-Y679 HydrophobicContact CB-CE1 4.44Å; E673-Y679 HydrophobicContact CG-CE2 4.47Å
674	E	84.6	Confident	82.1	Confident	98 Å²	98	58.2 Å²	58.2	46%	0.458	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	171.6	168.3	-65.2	-169.5	153	0	0	110.7	A676 R678 A680	E674-A676 PolarHBondContact O-N 3.44Å; E674-R678 HydrophobicContact CB-CB 4.44Å; E674-R678 PolarHBondContact N-O 2.99Å; E674-A680 HydrophobicContact CG-CB 4.34Å
675	A	73.3	Confident	81	Confident	95 Å²	95	58.5 Å²	58.5	79%	0.785	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	139.7	176	0	0	0	0	0	111.7
676	A	71.9	Confident	79.5	Confident	107 Å²	107	61.9 Å²	61.9	88%	0.884	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	27.7	-179.5	0	0	0	0	0	117.1	E674 R678	E674-A676 PolarHBondContact O-N 3.44Å; A676-R678 VanDerWaalsContact C-N 3.28Å; A676-R678 PolarHBondContact O-N 3.21Å
677	G	75.4	Confident	77.5	Confident	18 Å²	18	64.9 Å²	64.9	19%	0.186	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	28.4	174.3	0	0	0	0	0	113	L644	L644-G677 PolarHBondContact N-O 3.15Å
678	R	85.4	Confident	75.6	Confident	110 Å²	110	69.5 Å²	69.5	42%	0.415	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	134.2	173.4	178.6	176	-77.1	-178.1	-4.3	108.6	W642 T643 E674 A676	W642-R678 CarbonylContact O-C 3.6Å; W642-R678 WeakPolarHBondContact O-CA 3.28Å; T643-R678 HydrophobicContact CG2-CB 4.42Å; E674-R678 HydrophobicContact CB-CB 4.44Å; E674-R678 PolarHBondContact N-O 2.99Å; A676-R678 VanDerWaalsContact C-N 3.28Å; A676-R678 PolarHBondContact O-N 3.21Å
679	Y	88.2	Confident	74	Confident	0 Å²	0	74 Å²	74	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.4	179.3	-69.8	-106.8	0	0	0	108	F636 S641 W642 L644 L662 Q666 R672 E673	F636-Y679 WeakPolarHBondContact CE1-O 3.47Å; S641-Y679 CarbonylContact C-O 3.55Å; S641-Y679 VanDerWaalsContact CA-O 3.24Å; S641-Y679 WeakPolarHBondContact CA-O 3.37Å; W642-Y679 PolarHBondContact N-O 3.37Å; W642-Y679 PolarHBondContact O-N 2.95Å; L644-Y679 HydrophobicContact CD1-CE2 4.05Å; L644-Y679 HydrophobicContact CD2-CD2 4.27Å; L644-Y679 HydrophobicContact CD2-CE2 3.63Å; L644-Y679 HydrophobicContact CG-CD2 4.28Å; L644-Y679 HydrophobicContact CG-CE2 3.65Å; L662-Y679 HydrophobicContact CB-CD1 4.4Å; L662-Y679 HydrophobicContact CB-CE1 3.88Å; L662-Y679 HydrophobicContact CD1-CD1 4.11Å; L662-Y679 HydrophobicContact CD1-CD2 4.23Å; L662-Y679 HydrophobicContact CD1-CE1 3.85Å; L662-Y679 HydrophobicContact CD1-CE2 4.09Å; L662-Y679 HydrophobicContact CD1-CG 4.29Å; L662-Y679 HydrophobicContact CD2-CD1 4.21Å; L662-Y679 HydrophobicContact CD2-CE1 4.49Å; L662-Y679 HydrophobicContact CG-CD1 4.49Å; L662-Y679 HydrophobicContact CG-CE1 4.3Å; Q666-Y679 HydrophobicContact CG-CE1 4.35Å; R672-Y679 WeakPolarHBondContact O-CA 3.23Å; E673-Y679 HydrophobicContact CB-CE1 4.44Å; E673-Y679 HydrophobicContact CG-CE2 4.47Å
680	A	86.4	Confident	72.5	Confident	17 Å²	17	82.9 Å²	82.9	14%	0.14	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	144.5	178	0	0	0	0	0	110.8	S640 R672 E674	S640-A680 WeakPolarHBondContact O-CA 3.35Å; R672-A680 PolarHBondContact N-O 2.85Å; R672-A680 PolarHBondContact O-N 2.88Å; E674-A680 HydrophobicContact CG-CB 4.34Å
681	V	87.6	Confident	70.6	Confident	32 Å²	32	87.9 Å²	87.9	19%	0.194	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	135.4	174.9	-175.8	0	0	0	0	110	L615 F636 S640 L671	L615-V681 HydrophobicContact CD2-CG1 4.4Å; F636-V681 HydrophobicContact CB-CG2 3.68Å; F636-V681 HydrophobicContact CD1-CG2 3.4Å; F636-V681 VanDerWaalsContact CD1-CG2 3.4Å; F636-V681 HydrophobicContact CE1-CG2 4.32Å; F636-V681 HydrophobicContact CG-CG2 3.85Å; S640-V681 PolarHBondContact O-N 2.87Å; L671-V681 HydrophobicContact CD2-CG2 4.1Å
682	M	84.2	Confident	68.2	Low	29 Å²	29	95.5 Å²	95.5	14%	0.143	51%	0.509	C	S	.	.			trans	-102.2	100.6	171	-75.8	-166.9	54.1	0	0	110.8	V670 R672 T684	V670-M682 PolarHBondContact O-N 3.41Å; R672-M682 HydrophobicContact CB-CG 3.87Å; R672-M682 HydrophobicContact CB-SD 3.75Å; R672-M682 HydrophobicContact CG-SD 4.48Å; R672-M682 PolarHBondContact NE-SD 3.27Å; R672-M682 PolarHBondContact NH2-SD 3.36Å; M682-T684 VanDerWaalsContact C-N 3.32Å; M682-T684 VanDerWaalsContact CE-O 3.27Å; M682-T684 WeakPolarHBondContact CE-O 3.47Å
683	E	77.2	Confident	66.2	Low	72 Å²	72	98.8 Å²	98.8	34%	0.336	52%	0.522	S	S	.	.	S	Bend	trans	-69.5	-28.4	176.6	-64.4	-61.8	162.1	0	0	113.3	E616	E616-E683 HydrophobicContact CB-CB 4.16Å; E616-E683 HydrophobicContact CG-CB 3.96Å; E616-E683 HydrophobicContact CG-CG 4.23Å; E616-E683 PolarHBondContact N-OE2 2.77Å
684	T	72.8	Confident	63.8	Low	89 Å²	89	98.3 Å²	98.3	55%	0.546	54%	0.542	S	S	.	.	S	Bend	trans	-116	122.1	178.3	57.4	0	0	0	0	111.2	D617 M682 A686	D617-T684 WeakPolarHBondContact OD2-CA 3.49Å; M682-T684 VanDerWaalsContact C-N 3.32Å; M682-T684 VanDerWaalsContact CE-O 3.27Å; M682-T684 WeakPolarHBondContact CE-O 3.47Å; T684-A686 PolarHBondContact O-N 2.86Å
685	G	61.2	Low	61.5	Low	31 Å²	31	98.1 Å²	98.1	32%	0.32	55%	0.548	S	S	.	.			trans	-69.7	124.7	176	0	0	0	0	0	112.2	D617 T687	D617-G685 PolarHBondContact OD2-N 3.44Å; G685-T687 PolarHBondContact O-N 3.47Å
686	A	53.1	Low	59.7	Low	72 Å²	72	100.5 Å²	100.5	60%	0.595	54%	0.544	S	S	*	.	S	Bend	trans	-73.8	112.4	165	0	0	0	0	0	108.8	T684	T684-A686 PolarHBondContact O-N 2.86Å
687	T	44.5	Very low	58.3	Low	123 Å²	123	100 Å²	100	76%	0.755	53%	0.526	S	S	*	.			trans	76.8	122.2	174.4	65.6	0	0	0	0	117.4	G685 D689	G685-T687 PolarHBondContact O-N 3.47Å; T687-D689 PolarHBondContact O-N 3.5Å
688	R	43.5	Very low	56.6	Low	241 Å²	241	104.2 Å²	104.2	91%	0.909	54%	0.544	S	S	*	.	S	Bend	trans	-68.8	15.1	-177.6	-80.2	165.9	77	156.4	1.7	115.7
689	D	41.8	Very low	54.5	Low	153 Å²	153	100.6 Å²	100.6	82%	0.818	53%	0.533	S	S	*	.	S	Bend	trans	-110.5	19.2	-162.6	-98.8	6	0	0	0	116.6	T687	T687-D689 PolarHBondContact O-N 3.5Å
690	R	47.8	Very low	52	Low	213 Å²	213	105.1 Å²	105.1	80%	0.804	56%	0.564	S	S	*	*	S	Bend	trans	-130.9	0.8	-179.6	-73.4	-173.5	179.6	166	0.6	117.2	D692	R690-D692 VanDerWaalsContact C-N 3.33Å; R690-D692 PolarHBondContact O-N 2.99Å
691	L	43.6	Very low	49.9	Very low	109 Å²	109	108.2 Å²	108.2	57%	0.571	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-0.6	-170.7	-85	150.6	0	0	0	115.7	L620	L620-L691 HydrophobicContact CD2-CD2 3.54Å
692	D	36.8	Very low	47.9	Very low	165 Å²	165	110 Å²	110	88%	0.882	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	11.4	178.3	-147.1	24.7	0	0	0	114.1	R690 G694	R690-D692 VanDerWaalsContact C-N 3.33Å; R690-D692 PolarHBondContact O-N 2.99Å; D692-G694 VanDerWaalsContact C-N 3.3Å; D692-G694 PolarHBondContact O-N 3.33Å
693	R	44.3	Very low	45.8	Very low	205 Å²	205	115.3 Å²	115.3	77%	0.774	61%	0.609	S	S	*	*			trans	-89.9	71	167.2	-72.6	-172.7	-176.8	-172.1	0.2	110	V695	R693-V695 HydrophobicContact CB-CG2 4.44Å; R693-V695 PolarHBondContact O-N 3.48Å
694	G	36.7	Very low	44.1	Very low	85 Å²	85	122.2 Å²	122.2	88%	0.876	63%	0.632	S	S	*	*			trans	-67.6	58.2	154.4	0	0	0	0	0	110.6	D692	D692-G694 VanDerWaalsContact C-N 3.3Å; D692-G694 PolarHBondContact O-N 3.33Å
695	V	35.7	Very low	43	Very low	95 Å²	95	122.1 Å²	122.1	58%	0.576	63%	0.628	S	S	*	*			trans	-116.6	124.9	176.6	-179.9	0	0	0	0	105.8	R693 L697	R693-V695 HydrophobicContact CB-CG2 4.44Å; R693-V695 PolarHBondContact O-N 3.48Å; V695-L697 PolarHBondContact O-N 3.47Å
696	M	36.2	Very low	42.7	Very low	144 Å²	144	121.7 Å²	121.7	71%	0.709	62%	0.621	S	S	*	*			trans	-49.7	104.9	165.7	-72.8	-153.1	165.6	0	0	108.2	I698	M696-I698 PolarHBondContact O-N 2.92Å
697	L	41.2	Very low	43.1	Very low	96 Å²	96	119.9 Å²	119.9	50%	0.503	60%	0.601	S	S	.	*			trans	-77.5	89.5	173.9	-80.1	156.8	0	0	0	106.3	V695 D699	V695-L697 PolarHBondContact O-N 3.47Å; L697-D699 PolarHBondContact O-N 2.94Å
698	I	39.7	Very low	43.8	Very low	108 Å²	108	114.1 Å²	114.1	55%	0.554	57%	0.565	S	S	*	*			trans	-50	116.4	154.3	-61.8	166.2	0	0	0	105.1	M696 S700 E703	M696-I698 PolarHBondContact O-N 2.92Å; I698-S700 PolarHBondContact O-N 3.22Å; I698-E703 HydrophobicContact CG2-CG 4.02Å
699	D	41.2	Very low	44.6	Very low	34 Å²	34	103.6 Å²	103.6	18%	0.182	53%	0.528	C	S	.	.			trans	-52.6	110.5	163.8	-168.1	1.5	0	0	0	105	K661 L697 D701 E702	K661-D699 IonicContact NZ-OD2 2.96Å; K661-D699 PolarHBondContact NZ-OD2 3.11Å; L697-D699 PolarHBondContact O-N 2.94Å; D699-D701 PolarHBondContact O-N 3.01Å; D699-E702 HydrophobicContact CB-CB 4.02Å; D699-E702 HydrophobicContact CB-CG 3.76Å; D699-E702 PolarHBondContact O-N 2.76Å
700	S	37.5	Very low	45.5	Very low	95 Å²	95	98.6 Å²	98.6	66%	0.664	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-12.8	-172.2	53.4	0	0	0	0	112.8	I698	I698-S700 PolarHBondContact O-N 3.22Å
701	D	42.3	Very low	45.9	Very low	82 Å²	82	92.1 Å²	92.1	44%	0.439	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-16	173.3	-77.8	-21.3	0	0	0	114.3	D699 E703 R704 D705	D699-D701 PolarHBondContact O-N 3.01Å; D701-E703 PolarHBondContact O-N 3.4Å; D701-R704 PolarHBondContact O-N 2.87Å; D701-D705 PolarHBondContact O-N 2.66Å
702	E	44.1	Very low	46.6	Very low	69 Å²	69	90.8 Å²	90.8	32%	0.322	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-21.4	172.2	-82	-178.3	-174.1	0	0	112.1	K661 D699 R704	K661-E702 IonicContact NZ-OE1 3.41Å; K661-E702 PolarHBondContact NZ-OE1 3.3Å; D699-E702 HydrophobicContact CB-CB 4.02Å; D699-E702 HydrophobicContact CB-CG 3.76Å; D699-E702 PolarHBondContact O-N 2.76Å; E702-R704 PolarHBondContact O-N 3.45Å
703	E	41.4	Very low	47.7	Very low	141 Å²	141	87 Å²	87	66%	0.659	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-19.3	168.1	-69.4	-163.1	165.3	0	0	113.1	I698 D701	I698-E703 HydrophobicContact CG2-CG 4.02Å; D701-E703 PolarHBondContact O-N 3.4Å
704	R	40	Very low	48.5	Very low	216 Å²	216	78 Å²	78	82%	0.815	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-35.9	178.5	-92.6	-177.5	168.6	-171.3	-3.3	113.5	D701 E702 S706	D701-R704 PolarHBondContact O-N 2.87Å; E702-R704 PolarHBondContact O-N 3.45Å; R704-S706 PolarHBondContact O-N 3.27Å
705	D	49.9	Very low	49.9	Very low	88 Å²	88	80.7 Å²	80.7	47%	0.471	41%	0.409	S	S	.	.	S	Bend	trans	-92	89.6	175.8	-89.2	-32.2	0	0	0	110.3	K570 D701	K570-D705 IonicContact NZ-OD1 2.7Å; D701-D705 PolarHBondContact O-N 2.66Å
706	S	56.2	Low	51.4	Low	22 Å²	22	81.5 Å²	81.5	15%	0.154	41%	0.407	C	S	.	.			trans	-52.5	144.8	169.1	177.5	0	0	0	0	110.4	D490 K570 R704 T708	D490-S706 PolarHBondContact OD1-OG 3.33Å; D490-S706 PolarHBondContact OD2-OG 3.05Å; K570-S706 WeakPolarHBondContact CE-O 3.42Å; K570-S706 PolarHBondContact NZ-O 2.79Å; R704-S706 PolarHBondContact O-N 3.27Å; S706-T708 PolarHBondContact O-N 2.71Å; S706-T708 PolarHBondContact OG-N 3.04Å; S706-T708 PolarHBondContact OG-OG1 3.11Å
707	N	60.4	Low	53	Low	33 Å²	33	80.1 Å²	80.1	18%	0.176	40%	0.398	C	S	.	.	S	Bend	trans	-68.6	-11.1	175.4	-71.5	-31.2	0	0	0	112.3	D490 L493 H494 K570 L606	D490-N707 PolarHBondContact OD1-N 3.06Å; L493-N707 HydrophobicContact CD1-CB 4.26Å; H494-N707 PolarHBondContact CE1-ND2 3.23Å; K570-N707 PolarHBondContact N-O 2.99Å; L606-N707 HydrophobicContact CD2-CB 3.62Å
708	T	60.2	Low	54.4	Low	2 Å²	2	78.8 Å²	78.8	1%	0.012	39%	0.389	C	S	.	.	B	Isolated β-bridge	trans	-102.6	154.1	176.4	69.7	0	0	0	0	110.8	T486 A489 P567 T568 L569 K570 S706 T710	T486-T708 HydrophobicContact CG2-CG2 4.19Å; T486-T708 WeakPolarHBondContact CG2-OG1 3.39Å; A489-T708 HydrophobicContact CB-CG2 4.24Å; P567-T708 HydrophobicContact CB-CG2 4.03Å; P567-T708 HydrophobicContact CG-CG2 3.54Å; T568-T708 WeakPolarHBondContact O-CA 3.24Å; L569-T708 HydrophobicContact CD2-CG2 4.31Å; K570-T708 WeakPolarHBondContact CE-O 3.49Å; S706-T708 PolarHBondContact O-N 2.71Å; S706-T708 PolarHBondContact OG-N 3.04Å; S706-T708 PolarHBondContact OG-OG1 3.11Å; T708-T710 PolarHBondContact O-N 3.44Å
709	T	58.9	Low	56.2	Low	21 Å²	21	74.9 Å²	74.9	13%	0.129	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-58.3	133.2	170.3	-52.1	0	0	0	0	109.5	T568 E713 Q714	T568-T709 PolarHBondContact O-N 3Å; T568-T709 PolarHBondContact O-OG1 2.94Å; T568-T709 WeakPolarHBondContact OG1-CB 3.4Å; T568-T709 PolarHBondContact OG1-OG1 3.42Å; T709-E713 HydrophobicContact CG2-CB 3.46Å; T709-E713 VanDerWaalsContact CG2-CB 3.46Å; T709-E713 HydrophobicContact CG2-CG 4.42Å; T709-E713 WeakPolarHBondContact CG2-OE2 3.27Å; T709-Q714 HydrophobicContact CG2-CG 3.96Å; T709-Q714 PolarHBondContact O-NE2 2.88Å
710	T	61.1	Low	58	Low	47 Å²	47	78.7 Å²	78.7	29%	0.288	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-62.7	151.4	-176.2	62.9	0	0	0	0	110.9	T708 S712 E713 Q714	T708-T710 PolarHBondContact O-N 3.44Å; T710-S712 PolarHBondContact O-N 2.84Å; T710-S712 VanDerWaalsContact O-N 3.07Å; T710-S712 PolarHBondContact OG1-OG 2.75Å; T710-E713 PolarHBondContact N-OE2 3.19Å; T710-E713 PolarHBondContact O-N 3.09Å; T710-E713 VanDerWaalsContact OG1-CD 3.28Å; T710-E713 VanDerWaalsContact OG1-CG 3.28Å; T710-E713 WeakPolarHBondContact OG1-CG 3.48Å; T710-E713 PolarHBondContact OG1-N 3.45Å; T710-E713 PolarHBondContact OG1-OE2 2.88Å; T710-Q714 PolarHBondContact O-N 3.32Å
711	Q	56.1	Low	60.1	Low	77 Å²	77	77.8 Å²	77.8	36%	0.36	37%	0.373	S	S	.	.	H	α-helix	trans	-53.2	-32.3	173	-72.6	-153	-22.7	0	0	112.4	E483 R715	E483-Q711 VanDerWaalsContact CD-NE2 3.29Å; E483-Q711 VanDerWaalsContact CG-NE2 3.27Å; E483-Q711 WeakPolarHBondContact OE1-CG 3.2Å; E483-Q711 PolarHBondContact OE1-NE2 3.47Å; Q711-R715 WeakPolarHBondContact O-CB 3.44Å; Q711-R715 PolarHBondContact O-N 3.49Å
712	S	57.8	Low	62.1	Low	82 Å²	82	74.4 Å²	74.4	57%	0.573	35%	0.354	S	S	*	.	H	α-helix	trans	-65.8	-43.4	178.3	73.2	0	0	0	0	112.5	T710 R715 E716	T710-S712 PolarHBondContact O-N 2.84Å; T710-S712 VanDerWaalsContact O-N 3.07Å; T710-S712 PolarHBondContact OG1-OG 2.75Å; S712-R715 PolarHBondContact O-N 2.84Å; S712-E716 WeakPolarHBondContact O-CB 3.46Å; S712-E716 PolarHBondContact O-N 3.23Å
713	E	61.1	Low	64.1	Low	84 Å²	84	73 Å²	73	39%	0.393	35%	0.346	S	S	.	.	H	α-helix	trans	-70.7	-44.2	177.5	-72.8	163.2	151.4	0	0	110.7	T709 T710 R715 E716 E717	T709-E713 HydrophobicContact CG2-CB 3.46Å; T709-E713 VanDerWaalsContact CG2-CB 3.46Å; T709-E713 HydrophobicContact CG2-CG 4.42Å; T709-E713 WeakPolarHBondContact CG2-OE2 3.27Å; T710-E713 PolarHBondContact N-OE2 3.19Å; T710-E713 PolarHBondContact O-N 3.09Å; T710-E713 VanDerWaalsContact OG1-CD 3.28Å; T710-E713 VanDerWaalsContact OG1-CG 3.28Å; T710-E713 WeakPolarHBondContact OG1-CG 3.48Å; T710-E713 PolarHBondContact OG1-N 3.45Å; T710-E713 PolarHBondContact OG1-OE2 2.88Å; E713-R715 VanDerWaalsContact C-N 3.28Å; E713-R715 PolarHBondContact O-N 3.19Å; E713-E716 PolarHBondContact O-N 3.03Å; E713-E716 VanDerWaalsContact O-N 3.15Å; E713-E717 WeakPolarHBondContact O-CG 3.29Å; E713-E717 PolarHBondContact O-N 3.45Å
714	Q	61	Low	66.2	Low	18 Å²	18	68.8 Å²	68.8	8%	0.084	34%	0.335	C	S	.	.	H	α-helix	trans	-61.2	-38.5	173.4	-69	-179.1	-1.8	0	0	111.6	T568 T709 T710 E717 K718	T568-Q714 PolarHBondContact OG1-NE2 3.46Å; T709-Q714 HydrophobicContact CG2-CG 3.96Å; T709-Q714 PolarHBondContact O-NE2 2.88Å; T710-Q714 PolarHBondContact O-N 3.32Å; Q714-E717 PolarHBondContact O-N 2.74Å; Q714-K718 WeakPolarHBondContact O-CB 3.19Å; Q714-K718 WeakPolarHBondContact O-CG 3.47Å; Q714-K718 PolarHBondContact O-N 3.23Å
715	R	65.1	Low	68.4	Low	140 Å²	140	63.2 Å²	63.2	53%	0.528	32%	0.315	S	S	.	.	H	α-helix	trans	-67.4	-38.7	175.5	-173.8	178.7	-171.2	-173.1	6.1	111.1	Q711 S712 E713 K718 L719 E762	Q711-R715 WeakPolarHBondContact O-CB 3.44Å; Q711-R715 PolarHBondContact O-N 3.49Å; S712-R715 PolarHBondContact O-N 2.84Å; E713-R715 VanDerWaalsContact C-N 3.28Å; E713-R715 PolarHBondContact O-N 3.19Å; R715-K718 PolarHBondContact O-N 3.16Å; R715-L719 HydrophobicContact CG-CD1 4.2Å; R715-L719 HydrophobicContact CG-CG 4.47Å; R715-L719 WeakPolarHBondContact O-CB 3.33Å; R715-L719 WeakPolarHBondContact O-CG 3.41Å; R715-L719 PolarHBondContact O-N 3.46Å; R715-E762 IonicContact CZ-OE1 2.75Å; R715-E762 IonicContact NE-OE1 3.26Å; R715-E762 PolarHBondContact NE-OE1 3.15Å; R715-E762 IonicContact NH2-OE1 2.77Å; R715-E762 PolarHBondContact NH2-OE1 2.91Å
716	E	68.4	Low	70.2	Confident	113 Å²	113	59 Å²	59	53%	0.528	29%	0.293	S	S	.	.	H	α-helix	trans	-65.1	-44.4	175.7	-169.7	169.1	-177.5	0	0	111.4	S712 E713 K718 L719 Q720	S712-E716 WeakPolarHBondContact O-CB 3.46Å; S712-E716 PolarHBondContact O-N 3.23Å; E713-E716 PolarHBondContact O-N 3.03Å; E713-E716 VanDerWaalsContact O-N 3.15Å; E716-K718 PolarHBondContact O-N 2.97Å; E716-L719 PolarHBondContact O-N 2.92Å; E716-Q720 WeakPolarHBondContact O-CB 3.24Å; E716-Q720 VanDerWaalsContact O-CG 3.26Å; E716-Q720 WeakPolarHBondContact O-CG 3.29Å; E716-Q720 PolarHBondContact O-N 2.97Å
717	E	68.9	Low	71.7	Confident	114 Å²	114	62.1 Å²	62.1	53%	0.533	31%	0.305	S	S	.	.	H	α-helix	trans	-59.5	-44.2	172.8	-72.2	178.3	173.8	0	0	111.9	E713 Q714 Q720 L721	E713-E717 WeakPolarHBondContact O-CG 3.29Å; E713-E717 PolarHBondContact O-N 3.45Å; Q714-E717 PolarHBondContact O-N 2.74Å; E717-Q720 WeakPolarHBondContact O-CB 3.28Å; E717-Q720 PolarHBondContact O-N 3.41Å; E717-L721 PolarHBondContact O-N 3.33Å
718	K	71.3	Confident	72.9	Confident	69 Å²	69	62.8 Å²	62.8	30%	0.3	31%	0.314	S	S	.	.	H	α-helix	trans	-60.2	-45.6	174.3	-73.9	169.9	-175.8	-177.8	0	111.6	D482 Q714 R715 E716 Q720 L721 F722 T756	D482-K718 IonicContact OD2-NZ 3.41Å; Q714-K718 WeakPolarHBondContact O-CB 3.19Å; Q714-K718 WeakPolarHBondContact O-CG 3.47Å; Q714-K718 PolarHBondContact O-N 3.23Å; R715-K718 PolarHBondContact O-N 3.16Å; E716-K718 PolarHBondContact O-N 2.97Å; K718-Q720 VanDerWaalsContact C-N 3.31Å; K718-Q720 PolarHBondContact O-N 2.87Å; K718-L721 WeakPolarHBondContact O-CB 3.44Å; K718-L721 PolarHBondContact O-N 3.33Å; K718-F722 VanDerWaalsContact O-CD2 3.24Å; K718-F722 WeakPolarHBondContact O-CD2 3.49Å; K718-F722 PolarHBondContact O-N 3.07Å; K718-T756 HydrophobicContact CD-CG2 3.9Å; K718-T756 HydrophobicContact CG-CG2 4.29Å
719	L	77	Confident	74.2	Confident	26 Å²	26	63.5 Å²	63.5	14%	0.136	32%	0.318	C	S	.	.	H	α-helix	trans	-65.9	-33.9	177.5	-72.9	172.9	0	0	0	112.1	R715 E716 W723 F766	R715-L719 HydrophobicContact CG-CD1 4.2Å; R715-L719 HydrophobicContact CG-CG 4.47Å; R715-L719 WeakPolarHBondContact O-CB 3.33Å; R715-L719 WeakPolarHBondContact O-CG 3.41Å; R715-L719 PolarHBondContact O-N 3.46Å; E716-L719 PolarHBondContact O-N 2.92Å; L719-W723 WeakPolarHBondContact O-CB 3.45Å; L719-W723 PolarHBondContact O-N 3.3Å; L719-F766 HydrophobicContact CB-CE2 3.87Å; L719-F766 HydrophobicContact CB-CZ 4.21Å; L719-F766 HydrophobicContact CD1-CD2 4.36Å; L719-F766 HydrophobicContact CD1-CE2 4.37Å; L719-F766 HydrophobicContact CD2-CD2 3.67Å; L719-F766 HydrophobicContact CD2-CE2 3.86Å; L719-F766 HydrophobicContact CD2-CG 4.02Å; L719-F766 HydrophobicContact CD2-CZ 4.37Å; L719-F766 HydrophobicContact CG-CD2 4.4Å; L719-F766 HydrophobicContact CG-CE2 4.25Å; L719-F766 WeakPolarHBondContact O-CZ 3.26Å
720	Q	79.9	Confident	75.6	Confident	114 Å²	114	62.6 Å²	62.6	53%	0.533	31%	0.312	S	S	.	.	H	α-helix	trans	-68.2	-39.2	172.7	-72.8	177.7	16.9	0	0	111.8	E716 E717 K718 W723 A724	E716-Q720 WeakPolarHBondContact O-CB 3.24Å; E716-Q720 VanDerWaalsContact O-CG 3.26Å; E716-Q720 WeakPolarHBondContact O-CG 3.29Å; E716-Q720 PolarHBondContact O-N 2.97Å; E717-Q720 WeakPolarHBondContact O-CB 3.28Å; E717-Q720 PolarHBondContact O-N 3.41Å; K718-Q720 VanDerWaalsContact C-N 3.31Å; K718-Q720 PolarHBondContact O-N 2.87Å; Q720-W723 WeakPolarHBondContact O-CB 3.37Å; Q720-W723 PolarHBondContact O-N 3.32Å; Q720-A724 PolarHBondContact O-N 3.42Å
721	L	80.8	Confident	76.9	Confident	76 Å²	76	64.4 Å²	64.4	40%	0.398	32%	0.324	S	S	.	.	H	α-helix	trans	-61.7	-50.6	172.7	-175.7	69.7	0	0	0	110.8	E717 K718 W723 A724 Y725	E717-L721 PolarHBondContact O-N 3.33Å; K718-L721 WeakPolarHBondContact O-CB 3.44Å; K718-L721 PolarHBondContact O-N 3.33Å; L721-W723 VanDerWaalsContact C-N 3.25Å; L721-W723 PolarHBondContact O-N 3.33Å; L721-A724 WeakPolarHBondContact O-CB 3.16Å; L721-A724 PolarHBondContact O-N 2.95Å; L721-A724 VanDerWaalsContact O-N 3.09Å; L721-Y725 HydrophobicContact CD1-CD2 4.26Å; L721-Y725 HydrophobicContact CD1-CE2 3.85Å; L721-Y725 HydrophobicContact CG-CD2 4.13Å; L721-Y725 HydrophobicContact CG-CE2 4Å; L721-Y725 WeakPolarHBondContact O-CD2 3.36Å; L721-Y725 PolarHBondContact O-N 2.94Å; L721-Y725 VanDerWaalsContact O-N 3.09Å
722	F	83.7	Confident	78.3	Confident	11 Å²	11	67 Å²	67	5%	0.048	34%	0.34	C	S	.	.	H	α-helix	trans	-57.3	-40.9	175.4	-71.9	-48.2	0	0	0	111.7	K718 A724 Y725 I726 L745 V749 M758	K718-F722 VanDerWaalsContact O-CD2 3.24Å; K718-F722 WeakPolarHBondContact O-CD2 3.49Å; K718-F722 PolarHBondContact O-N 3.07Å; F722-A724 PolarHBondContact O-N 3.3Å; F722-Y725 PolarHBondContact O-N 3.44Å; F722-I726 HydrophobicContact CB-CD1 4.48Å; F722-I726 WeakPolarHBondContact O-CB 3.36Å; F722-I726 WeakPolarHBondContact O-CD1 3.27Å; F722-I726 WeakPolarHBondContact O-CG1 3.27Å; F722-I726 PolarHBondContact O-N 2.82Å; F722-L745 HydrophobicContact CD1-CD2 4.03Å; F722-V749 HydrophobicContact CD1-CG1 4.15Å; F722-V749 HydrophobicContact CD1-CG2 4.34Å; F722-V749 HydrophobicContact CE1-CB 4.01Å; F722-V749 HydrophobicContact CE1-CG1 3.52Å; F722-V749 HydrophobicContact CE1-CG2 4.3Å; F722-V749 HydrophobicContact CZ-CG1 4.37Å; F722-M758 HydrophobicContact CB-CE 4.47Å; F722-M758 HydrophobicContact CD1-CE 4.09Å; F722-M758 HydrophobicContact CD2-CE 4.01Å; F722-M758 HydrophobicContact CD2-SD 3.87Å; F722-M758 HydrophobicContact CE1-CE 4.27Å; F722-M758 HydrophobicContact CE2-CB 4.06Å; F722-M758 HydrophobicContact CE2-CE 4.21Å; F722-M758 HydrophobicContact CE2-CG 4.5Å; F722-M758 HydrophobicContact CE2-SD 4.01Å; F722-M758 HydrophobicContact CG-CE 3.96Å; F722-M758 HydrophobicContact CG-SD 4.39Å; F722-M758 HydrophobicContact CZ-CB 3.97Å; F722-M758 HydrophobicContact CZ-CE 4.34Å
723	W	87.7	Confident	79.6	Confident	39 Å²	39	66.6 Å²	66.6	15%	0.148	33%	0.331	C	S	.	.	H	α-helix	trans	-59.3	-44.6	174.8	177.8	-112.6	0	0	0	112.5	L719 Q720 L721 Y725 I726 Q727 F766 K770 Q775 L776 L785	L719-W723 WeakPolarHBondContact O-CB 3.45Å; L719-W723 PolarHBondContact O-N 3.3Å; Q720-W723 WeakPolarHBondContact O-CB 3.37Å; Q720-W723 PolarHBondContact O-N 3.32Å; L721-W723 VanDerWaalsContact C-N 3.25Å; L721-W723 PolarHBondContact O-N 3.33Å; W723-Y725 VanDerWaalsContact C-N 3.34Å; W723-Y725 PolarHBondContact O-N 3.06Å; W723-I726 HydrophobicContact CZ3-CG2 4.47Å; W723-I726 PolarHBondContact O-N 3.29Å; W723-Q727 VanDerWaalsContact O-CB 3.26Å; W723-Q727 WeakPolarHBondContact O-CB 3.36Å; W723-Q727 PolarHBondContact O-N 3.42Å; W723-F766 HydrophobicContact CB-CE1 4.43Å; W723-F766 HydrophobicContact CB-CZ 4.11Å; W723-F766 HydrophobicContact CE3-CE1 4.49Å; W723-K770 HydrophobicContact CD2-CD 4.13Å; W723-K770 HydrophobicContact CE3-CD 3.81Å; W723-K770 HydrophobicContact CE3-CG 3.92Å; W723-K770 HydrophobicContact CH2-CD 4.23Å; W723-K770 HydrophobicContact CZ3-CB 4.06Å; W723-K770 HydrophobicContact CZ3-CD 3.86Å; W723-K770 HydrophobicContact CZ3-CG 3.85Å; W723-Q775 HydrophobicContact CH2-CB 3.84Å; W723-Q775 HydrophobicContact CZ2-CB 3.95Å; W723-L776 HydrophobicContact CH2-CD1 4.42Å; W723-L776 HydrophobicContact CH2-CD2 4.06Å; W723-L776 HydrophobicContact CH2-CG 3.85Å; W723-L776 HydrophobicContact CZ3-CD1 3.85Å; W723-L776 HydrophobicContact CZ3-CD2 4.16Å; W723-L776 HydrophobicContact CZ3-CG 3.79Å; W723-L785 HydrophobicContact CH2-CD2 4.3Å
724	A	85.8	Confident	80.5	Confident	53 Å²	53	68.6 Å²	68.6	44%	0.438	34%	0.344	S	S	.	.	H	α-helix	trans	-60.3	-43.4	177.1	0	0	0	0	0	112	Q720 L721 F722 A728	Q720-A724 PolarHBondContact O-N 3.42Å; L721-A724 WeakPolarHBondContact O-CB 3.16Å; L721-A724 PolarHBondContact O-N 2.95Å; L721-A724 VanDerWaalsContact O-N 3.09Å; F722-A724 PolarHBondContact O-N 3.3Å; A724-A728 WeakPolarHBondContact O-CB 3.42Å; A724-A728 PolarHBondContact O-N 3.38Å
725	Y	85.8	Confident	81.7	Confident	99 Å²	99	69.6 Å²	69.6	39%	0.388	35%	0.353	S	S	.	.	H	α-helix	trans	-64.9	-45.4	174.8	-84.2	-82.9	0	0	0	112.4	L721 F722 W723 Q727 A728 M729 V749	L721-Y725 HydrophobicContact CD1-CD2 4.26Å; L721-Y725 HydrophobicContact CD1-CE2 3.85Å; L721-Y725 HydrophobicContact CG-CD2 4.13Å; L721-Y725 HydrophobicContact CG-CE2 4Å; L721-Y725 WeakPolarHBondContact O-CD2 3.36Å; L721-Y725 PolarHBondContact O-N 2.94Å; L721-Y725 VanDerWaalsContact O-N 3.09Å; F722-Y725 PolarHBondContact O-N 3.44Å; W723-Y725 VanDerWaalsContact C-N 3.34Å; W723-Y725 PolarHBondContact O-N 3.06Å; Y725-Q727 VanDerWaalsContact C-N 3.34Å; Y725-Q727 PolarHBondContact O-N 2.93Å; Y725-A728 PolarHBondContact O-N 3.35Å; Y725-M729 WeakPolarHBondContact O-CB 3.36Å; Y725-M729 WeakPolarHBondContact O-CE 3.13Å; Y725-M729 VanDerWaalsContact O-CG 3.29Å; Y725-M729 WeakPolarHBondContact O-CG 3.5Å; Y725-M729 PolarHBondContact O-N 3.45Å; Y725-V749 HydrophobicContact CD1-CG2 4.3Å; Y725-V749 HydrophobicContact CD2-CG2 4.01Å; Y725-V749 HydrophobicContact CE1-CG2 4.49Å; Y725-V749 HydrophobicContact CE2-CG2 4.23Å; Y725-V749 HydrophobicContact CG-CG2 4.06Å
726	I	87.6	Confident	82.8	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-61.5	-44	177.9	-68.6	161.8	0	0	0	110.4	F722 W723 M729 L730 I741 L745 L763 F766 L767	F722-I726 HydrophobicContact CB-CD1 4.48Å; F722-I726 WeakPolarHBondContact O-CB 3.36Å; F722-I726 WeakPolarHBondContact O-CD1 3.27Å; F722-I726 WeakPolarHBondContact O-CG1 3.27Å; F722-I726 PolarHBondContact O-N 2.82Å; W723-I726 HydrophobicContact CZ3-CG2 4.47Å; W723-I726 PolarHBondContact O-N 3.29Å; I726-M729 HydrophobicContact CG1-CE 4.42Å; I726-M729 PolarHBondContact O-N 3.12Å; I726-L730 HydrophobicContact CG2-CD1 3.73Å; I726-L730 HydrophobicContact CG2-CG 4.3Å; I726-L730 WeakPolarHBondContact O-CB 3.46Å; I726-L730 WeakPolarHBondContact O-CG 3.23Å; I726-L730 PolarHBondContact O-N 3.48Å; I726-I741 HydrophobicContact CD1-CG2 4.38Å; I726-I741 HydrophobicContact CG1-CG2 3.97Å; I726-L745 HydrophobicContact CD1-CD1 4.04Å; I726-L745 HydrophobicContact CG1-CD1 4Å; I726-L745 HydrophobicContact CG1-CD2 4.31Å; I726-L763 HydrophobicContact CD1-CD1 4.06Å; I726-F766 HydrophobicContact CD1-CD1 4.4Å; I726-F766 HydrophobicContact CD1-CE1 4.14Å; I726-L767 HydrophobicContact CD1-CD2 4.13Å; I726-L767 HydrophobicContact CG2-CD2 4.2Å
727	Q	87.6	Confident	83.8	Confident	87 Å²	87	60.5 Å²	60.5	41%	0.407	32%	0.321	S	S	.	.	H	α-helix	trans	-62.2	-45.4	176.6	-173.7	177.7	-26.1	0	0	110.8	W723 Y725 L730 T731 L785	W723-Q727 VanDerWaalsContact O-CB 3.26Å; W723-Q727 WeakPolarHBondContact O-CB 3.36Å; W723-Q727 PolarHBondContact O-N 3.42Å; Y725-Q727 VanDerWaalsContact C-N 3.34Å; Y725-Q727 PolarHBondContact O-N 2.93Å; Q727-L730 PolarHBondContact O-N 3.49Å; Q727-T731 VanDerWaalsContact O-CB 3.3Å; Q727-T731 WeakPolarHBondContact O-CB 3.38Å; Q727-T731 PolarHBondContact O-N 2.84Å; Q727-T731 PolarHBondContact O-OG1 3.19Å; Q727-L785 HydrophobicContact CG-CD1 4.22Å; Q727-L785 HydrophobicContact CG-CD2 4.29Å
728	A	85.8	Confident	84.7	Confident	46 Å²	46	56.5 Å²	56.5	38%	0.38	30%	0.303	S	S	.	.	H	α-helix	trans	-62	-43.6	175.9	0	0	0	0	0	112.2	A724 Y725 T731 N732	A724-A728 WeakPolarHBondContact O-CB 3.42Å; A724-A728 PolarHBondContact O-N 3.38Å; Y725-A728 PolarHBondContact O-N 3.35Å; A728-T731 PolarHBondContact O-N 3.41Å; A728-N732 WeakPolarHBondContact O-CB 3.44Å; A728-N732 PolarHBondContact O-N 3.18Å; A728-N732 VanDerWaalsContact O-N 3.09Å; A728-N732 PolarHBondContact O-ND2 3.21Å
729	M	87.8	Confident	85.4	Confident	18 Å²	18	60.4 Å²	60.4	9%	0.089	32%	0.322	C	S	.	.	H	α-helix	trans	-64.8	-44.2	177.8	-71.1	-176.2	-98.6	0	0	112.1	Y725 I726 T731 N732 L733 M736 M744 L745	Y725-M729 WeakPolarHBondContact O-CB 3.36Å; Y725-M729 WeakPolarHBondContact O-CE 3.13Å; Y725-M729 VanDerWaalsContact O-CG 3.29Å; Y725-M729 WeakPolarHBondContact O-CG 3.5Å; Y725-M729 PolarHBondContact O-N 3.45Å; I726-M729 HydrophobicContact CG1-CE 4.42Å; I726-M729 PolarHBondContact O-N 3.12Å; M729-T731 VanDerWaalsContact C-N 3.33Å; M729-N732 PolarHBondContact O-N 3.33Å; M729-L733 VanDerWaalsContact O-CB 3.29Å; M729-L733 WeakPolarHBondContact O-CB 3.48Å; M729-L733 PolarHBondContact O-N 3.08Å; M729-M736 HydrophobicContact CB-CE 3.3Å; M729-M736 HydrophobicContact CB-SD 4.2Å; M729-M736 HydrophobicContact CG-CE 4.34Å; M729-M736 HydrophobicContact SD-CE 4.22Å; M729-M744 HydrophobicContact SD-CB 3.52Å; M729-M744 VanDerWaalsContact SD-CB 3.52Å; M729-M744 HydrophobicContact SD-CG 4.38Å; M729-M744 HydrophobicContact SD-SD 4.09Å; M729-L745 HydrophobicContact CE-CD2 3.4Å; M729-L745 VanDerWaalsContact CE-CD2 3.4Å; M729-L745 HydrophobicContact CE-CG 3.84Å
730	L	87.9	Confident	85.9	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-72.5	-26.1	178.7	-69.6	174.2	0	0	0	112.9	I726 Q727 D734 M736 L776 Y783 L785	I726-L730 HydrophobicContact CG2-CD1 3.73Å; I726-L730 HydrophobicContact CG2-CG 4.3Å; I726-L730 WeakPolarHBondContact O-CB 3.46Å; I726-L730 WeakPolarHBondContact O-CG 3.23Å; I726-L730 PolarHBondContact O-N 3.48Å; Q727-L730 PolarHBondContact O-N 3.49Å; L730-D734 VanDerWaalsContact O-CA 3.23Å; L730-D734 WeakPolarHBondContact O-CA 3.47Å; L730-D734 PolarHBondContact O-N 3.23Å; L730-D734 VanDerWaalsContact O-N 3.09Å; L730-M736 HydrophobicContact CD2-CB 4.06Å; L730-M736 HydrophobicContact CD2-CE 3.59Å; L730-M736 HydrophobicContact CD2-CG 4.13Å; L730-M736 HydrophobicContact CG-CE 3.82Å; L730-L776 HydrophobicContact CD1-CD2 3.38Å; L730-Y783 WeakPolarHBondContact CD2-O 3.47Å; L730-L785 HydrophobicContact CB-CD1 3.83Å; L730-L785 HydrophobicContact CB-CG 3.81Å; L730-L785 HydrophobicContact CD1-CG 4.35Å
731	T	87.6	Confident	86.2	Confident	85 Å²	85	60.4 Å²	60.4	52%	0.521	32%	0.316	S	S	.	.	H	α-helix	trans	-69.9	-37.3	171.8	-55.7	0	0	0	0	111.1	Q727 A728 M729 L785	Q727-T731 VanDerWaalsContact O-CB 3.3Å; Q727-T731 WeakPolarHBondContact O-CB 3.38Å; Q727-T731 PolarHBondContact O-N 2.84Å; Q727-T731 PolarHBondContact O-OG1 3.19Å; A728-T731 PolarHBondContact O-N 3.41Å; M729-T731 VanDerWaalsContact C-N 3.33Å; T731-L785 WeakPolarHBondContact OG1-CD1 3.23Å
732	N	86.1	Confident	86.4	Confident	132 Å²	132	57.5 Å²	57.5	71%	0.706	30%	0.3	S	S	*	.	H	α-helix	trans	-85.4	-29.7	-178.2	-70.4	-41.1	0	0	0	113.9	A728 M729	A728-N732 WeakPolarHBondContact O-CB 3.44Å; A728-N732 PolarHBondContact O-N 3.18Å; A728-N732 VanDerWaalsContact O-N 3.09Å; A728-N732 PolarHBondContact O-ND2 3.21Å; M729-N732 PolarHBondContact O-N 3.33Å
733	L	84.3	Confident	86.5	Confident	72 Å²	72	60.5 Å²	60.5	38%	0.377	32%	0.319	S	S	.	.	H	α-helix	trans	-113.1	3	-172.6	-62.7	169	0	0	0	113.7	M729 S735 M736 M744	M729-L733 VanDerWaalsContact O-CB 3.29Å; M729-L733 WeakPolarHBondContact O-CB 3.48Å; M729-L733 PolarHBondContact O-N 3.08Å; L733-S735 PolarHBondContact O-N 3.48Å; L733-M736 HydrophobicContact CB-CG 4.33Å; L733-M736 HydrophobicContact CB-SD 4.49Å; L733-M736 HydrophobicContact CD1-CG 4.46Å; L733-M736 HydrophobicContact CD1-SD 3.71Å; L733-M744 HydrophobicContact CD1-CE 3.94Å; L733-M744 HydrophobicContact CD1-SD 4.04Å
734	D	81.5	Confident	86.2	Confident	127 Å²	127	60.3 Å²	60.3	68%	0.679	32%	0.32	S	S	*	.	S	Bend	trans	58.7	-40.8	-176.7	-69.7	-36.8	0	0	0	116.5	L730	L730-D734 VanDerWaalsContact O-CA 3.23Å; L730-D734 WeakPolarHBondContact O-CA 3.47Å; L730-D734 PolarHBondContact O-N 3.23Å; L730-D734 VanDerWaalsContact O-N 3.09Å
735	S	86.1	Confident	86	Confident	38 Å²	38	58.1 Å²	58.1	27%	0.266	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	140	-175.3	75.9	0	0	0	0	113.2	L733 Y783 R784	L733-S735 PolarHBondContact O-N 3.48Å; S735-Y783 VanDerWaalsContact CA-O 3.28Å; S735-Y783 WeakPolarHBondContact CA-O 3.41Å; S735-R784 VanDerWaalsContact CB-CG 3.44Å; S735-R784 VanDerWaalsContact CB-NE 3.27Å
736	M	87.8	Confident	85.5	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.02	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	153.3	-179.3	-64.6	-170.9	-70.4	0	0	113	M729 L730 L733 I741 M744 I782 Y783	M729-M736 HydrophobicContact CB-CE 3.3Å; M729-M736 HydrophobicContact CB-SD 4.2Å; M729-M736 HydrophobicContact CG-CE 4.34Å; M729-M736 HydrophobicContact SD-CE 4.22Å; L730-M736 HydrophobicContact CD2-CB 4.06Å; L730-M736 HydrophobicContact CD2-CE 3.59Å; L730-M736 HydrophobicContact CD2-CG 4.13Å; L730-M736 HydrophobicContact CG-CE 3.82Å; L733-M736 HydrophobicContact CB-CG 4.33Å; L733-M736 HydrophobicContact CB-SD 4.49Å; L733-M736 HydrophobicContact CD1-CG 4.46Å; L733-M736 HydrophobicContact CD1-SD 3.71Å; M736-I741 HydrophobicContact CB-CD1 4.15Å; M736-I741 HydrophobicContact CB-CG1 3.76Å; M736-I741 HydrophobicContact CE-CD1 4.41Å; M736-I741 HydrophobicContact CE-CG1 3.66Å; M736-I741 HydrophobicContact SD-CG1 4.28Å; M736-M744 HydrophobicContact SD-SD 3.91Å; M736-I782 WeakPolarHBondContact O-CG2 3.28Å; M736-Y783 PolarHBondContact N-O 3.38Å; M736-Y783 VanDerWaalsContact N-O 3.08Å; M736-Y783 PolarHBondContact O-N 3.4Å
737	T	89.8	Confident	84.8	Confident	58 Å²	58	64.6 Å²	64.6	36%	0.356	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	160	171.3	56.3	0	0	0	0	111.2	E739 R740 I741 I782	T737-E739 VanDerWaalsContact C-N 3.31Å; T737-E739 PolarHBondContact O-N 3.23Å; T737-R740 PolarHBondContact O-N 3.37Å; T737-R740 WeakPolarHBondContact OG1-CB 3.39Å; T737-R740 PolarHBondContact OG1-N 2.83Å; T737-I741 WeakPolarHBondContact O-CG1 3.42Å; T737-I741 PolarHBondContact O-N 2.91Å; T737-I782 HydrophobicContact CG2-CG1 4.24Å
738	L	87.6	Confident	84	Confident	30 Å²	30	65.8 Å²	65.8	16%	0.157	34%	0.335	C	S	.	.	H	α-helix	trans	-51.9	-49.1	176	-179.2	64.2	0	0	0	111.9	R740 I741 H742 V760 L763 E764 L767 Y783	L738-R740 VanDerWaalsContact C-N 3.31Å; L738-R740 PolarHBondContact O-N 2.98Å; L738-I741 PolarHBondContact O-N 3.35Å; L738-H742 WeakPolarHBondContact O-CB 3.48Å; L738-H742 PolarHBondContact O-N 2.96Å; L738-V760 HydrophobicContact CD2-CG1 4.12Å; L738-V760 HydrophobicContact CG-CG1 4.47Å; L738-L763 HydrophobicContact CD1-CD2 3.89Å; L738-L763 HydrophobicContact CD1-CG 3.86Å; L738-E764 HydrophobicContact CD1-CB 4.2Å; L738-E764 HydrophobicContact CD2-CB 3.96Å; L738-E764 HydrophobicContact CD2-CG 4.01Å; L738-L767 HydrophobicContact CD1-CD1 3.65Å; L738-Y783 HydrophobicContact CB-CE2 4Å; L738-Y783 HydrophobicContact CD1-CE2 4.41Å
739	E	86.3	Confident	83	Confident	152 Å²	152	64 Å²	64	71%	0.71	32%	0.319	S	S	*	.	H	α-helix	trans	-61.1	-39.1	-178.4	-63.8	175.4	178.8	0	0	112.3	T737 H742 T743	T737-E739 VanDerWaalsContact C-N 3.31Å; T737-E739 PolarHBondContact O-N 3.23Å; E739-H742 PolarHBondContact O-N 3.05Å; E739-T743 WeakPolarHBondContact O-CB 3.45Å; E739-T743 PolarHBondContact O-N 3.26Å; E739-T743 PolarHBondContact O-OG1 2.85Å
740	R	86	Confident	81.4	Confident	140 Å²	140	64.4 Å²	64.4	53%	0.528	33%	0.325	S	S	.	.	H	α-helix	trans	-72.2	-39.4	179.8	-169.9	167.2	179	170.5	-1.5	111.6	T737 L738 T743 M744	T737-R740 PolarHBondContact O-N 3.37Å; T737-R740 WeakPolarHBondContact OG1-CB 3.39Å; T737-R740 PolarHBondContact OG1-N 2.83Å; L738-R740 VanDerWaalsContact C-N 3.31Å; L738-R740 PolarHBondContact O-N 2.98Å; R740-T743 PolarHBondContact O-N 2.84Å; R740-M744 HydrophobicContact CG-SD 4.24Å; R740-M744 WeakPolarHBondContact O-CB 3.49Å; R740-M744 VanDerWaalsContact O-CG 3.29Å; R740-M744 WeakPolarHBondContact O-CG 3.39Å; R740-M744 PolarHBondContact O-N 3.38Å
741	I	86.7	Confident	79.5	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-60.7	-48.1	172.3	-65.1	167.5	0	0	0	109.5	I726 M736 T737 L738 T743 M744 L745 L763 L767 Y783	I726-I741 HydrophobicContact CD1-CG2 4.38Å; I726-I741 HydrophobicContact CG1-CG2 3.97Å; M736-I741 HydrophobicContact CB-CD1 4.15Å; M736-I741 HydrophobicContact CB-CG1 3.76Å; M736-I741 HydrophobicContact CE-CD1 4.41Å; M736-I741 HydrophobicContact CE-CG1 3.66Å; M736-I741 HydrophobicContact SD-CG1 4.28Å; T737-I741 WeakPolarHBondContact O-CG1 3.42Å; T737-I741 PolarHBondContact O-N 2.91Å; L738-I741 PolarHBondContact O-N 3.35Å; I741-T743 PolarHBondContact O-N 3.28Å; I741-M744 PolarHBondContact O-N 3.15Å; I741-L745 HydrophobicContact CG2-CD1 3.72Å; I741-L745 HydrophobicContact CG2-CG 4.25Å; I741-L745 WeakPolarHBondContact O-CB 3.33Å; I741-L745 VanDerWaalsContact O-CG 3.27Å; I741-L745 WeakPolarHBondContact O-CG 3.32Å; I741-L745 PolarHBondContact O-N 3.16Å; I741-L763 HydrophobicContact CB-CD2 4.42Å; I741-L763 HydrophobicContact CG2-CD1 4.14Å; I741-L763 HydrophobicContact CG2-CD2 4.01Å; I741-L767 HydrophobicContact CD1-CD1 4.05Å; I741-Y783 HydrophobicContact CD1-CD2 3.88Å; I741-Y783 HydrophobicContact CD1-CG 4.17Å
742	H	84.8	Confident	77.7	Confident	15 Å²	15	66.9 Å²	66.9	7%	0.069	35%	0.346	C	S	.	.	H	α-helix	trans	-58.6	-47.2	178.6	-171.8	-101.7	0	0	0	112.4	L738 E739 M744 L745 R746 M758 V760 L763	L738-H742 WeakPolarHBondContact O-CB 3.48Å; L738-H742 PolarHBondContact O-N 2.96Å; E739-H742 PolarHBondContact O-N 3.05Å; H742-M744 PolarHBondContact O-N 3.17Å; H742-L745 PolarHBondContact O-N 3.22Å; H742-R746 PolarHBondContact O-N 3.2Å; H742-M758 PolarHBondContact NE2-O 3.01Å; H742-V760 VanDerWaalsContact CE1-CG2 3.48Å; H742-V760 WeakPolarHBondContact CE1-CG2 3.17Å; H742-L763 HydrophobicContact CB-CD2 3.68Å
743	T	85.3	Confident	75.6	Confident	74 Å²	74	67.3 Å²	67.3	45%	0.454	36%	0.356	S	S	.	.	H	α-helix	trans	-64.5	-41.6	179.8	-50.6	0	0	0	0	111.6	E739 R740 I741 R746 M747	E739-T743 WeakPolarHBondContact O-CB 3.45Å; E739-T743 PolarHBondContact O-N 3.26Å; E739-T743 PolarHBondContact O-OG1 2.85Å; R740-T743 PolarHBondContact O-N 2.84Å; I741-T743 PolarHBondContact O-N 3.28Å; T743-R746 PolarHBondContact O-N 3.14Å; T743-M747 HydrophobicContact CG2-CE 4.15Å; T743-M747 WeakPolarHBondContact O-CG 3.25Å; T743-M747 PolarHBondContact O-N 2.64Å
744	M	81.9	Confident	73.7	Confident	35 Å²	35	67.9 Å²	67.9	17%	0.172	36%	0.362	C	S	.	.	H	α-helix	trans	-69.5	-39.8	177.7	-69.2	-177.1	100.3	0	0	111.6	M729 L733 M736 R740 I741 H742 R746 M747 F748	M729-M744 HydrophobicContact SD-CB 3.52Å; M729-M744 VanDerWaalsContact SD-CB 3.52Å; M729-M744 HydrophobicContact SD-CG 4.38Å; M729-M744 HydrophobicContact SD-SD 4.09Å; L733-M744 HydrophobicContact CD1-CE 3.94Å; L733-M744 HydrophobicContact CD1-SD 4.04Å; M736-M744 HydrophobicContact SD-SD 3.91Å; R740-M744 HydrophobicContact CG-SD 4.24Å; R740-M744 WeakPolarHBondContact O-CB 3.49Å; R740-M744 VanDerWaalsContact O-CG 3.29Å; R740-M744 WeakPolarHBondContact O-CG 3.39Å; R740-M744 PolarHBondContact O-N 3.38Å; I741-M744 PolarHBondContact O-N 3.15Å; H742-M744 PolarHBondContact O-N 3.17Å; M744-R746 VanDerWaalsContact C-N 3.34Å; M744-R746 PolarHBondContact O-N 2.91Å; M744-M747 HydrophobicContact CG-CE 4.33Å; M744-M747 PolarHBondContact O-N 3.01Å; M744-F748 HydrophobicContact CB-CD2 4.05Å; M744-F748 HydrophobicContact CB-CE2 4.14Å; M744-F748 HydrophobicContact CE-CE2 3.87Å; M744-F748 HydrophobicContact CG-CE2 4.28Å; M744-F748 WeakPolarHBondContact O-CB 3.28Å; M744-F748 WeakPolarHBondContact O-CD2 3.34Å; M744-F748 PolarHBondContact O-N 3.5Å
745	L	81.1	Confident	72.1	Confident	6 Å²	6	66.2 Å²	66.2	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-62.4	-41.4	173.6	-71.2	174.2	0	0	0	111.7	F722 I726 M729 I741 H742 V749 A750 M758 L763	F722-L745 HydrophobicContact CD1-CD2 4.03Å; I726-L745 HydrophobicContact CD1-CD1 4.04Å; I726-L745 HydrophobicContact CG1-CD1 4Å; I726-L745 HydrophobicContact CG1-CD2 4.31Å; M729-L745 HydrophobicContact CE-CD2 3.4Å; M729-L745 VanDerWaalsContact CE-CD2 3.4Å; M729-L745 HydrophobicContact CE-CG 3.84Å; I741-L745 HydrophobicContact CG2-CD1 3.72Å; I741-L745 HydrophobicContact CG2-CG 4.25Å; I741-L745 WeakPolarHBondContact O-CB 3.33Å; I741-L745 VanDerWaalsContact O-CG 3.27Å; I741-L745 WeakPolarHBondContact O-CG 3.32Å; I741-L745 PolarHBondContact O-N 3.16Å; H742-L745 PolarHBondContact O-N 3.22Å; L745-V749 HydrophobicContact CD2-CG2 3.85Å; L745-V749 WeakPolarHBondContact O-CA 3.46Å; L745-V749 WeakPolarHBondContact O-CB 3.35Å; L745-V749 PolarHBondContact O-N 3.4Å; L745-A750 PolarHBondContact O-N 3.06Å; L745-M758 HydrophobicContact CD1-CE 3.41Å; L745-M758 VanDerWaalsContact CD1-CE 3.41Å; L745-L763 HydrophobicContact CD1-CD1 3.95Å; L745-L763 HydrophobicContact CD1-CD2 4.34Å
746	R	76.1	Confident	70.6	Confident	131 Å²	131	65.1 Å²	65.1	49%	0.494	35%	0.348	S	S	.	.	H	α-helix	trans	-59.9	-46.8	170.6	-96.5	-171.7	171.1	163.6	-1.8	112.2	H742 T743 M744 F748 A750	H742-R746 PolarHBondContact O-N 3.2Å; T743-R746 PolarHBondContact O-N 3.14Å; M744-R746 VanDerWaalsContact C-N 3.34Å; M744-R746 PolarHBondContact O-N 2.91Å; R746-F748 PolarHBondContact O-N 3.37Å; R746-A750 WeakPolarHBondContact O-CB 3Å; R746-A750 PolarHBondContact O-N 3.38Å
747	M	73.6	Confident	69.2	Low	104 Å²	104	70.4 Å²	70.4	51%	0.512	37%	0.372	S	S	.	.	H	α-helix	trans	-68.2	-34.7	-177.6	-75.8	-169.1	-61.2	0	0	113.8	T743 M744 T751	T743-M747 HydrophobicContact CG2-CE 4.15Å; T743-M747 WeakPolarHBondContact O-CG 3.25Å; T743-M747 PolarHBondContact O-N 2.64Å; M744-M747 HydrophobicContact CG-CE 4.33Å; M744-M747 PolarHBondContact O-N 3.01Å; M747-T751 PolarHBondContact O-OG1 3.2Å
748	F	70.1	Confident	68.1	Low	113 Å²	113	68.2 Å²	68.2	50%	0.496	36%	0.358	S	S	.	.	H	α-helix	trans	-106.2	-23.2	-172	-63.7	-63.4	0	0	0	114.8	M744 R746	M744-F748 HydrophobicContact CB-CD2 4.05Å; M744-F748 HydrophobicContact CB-CE2 4.14Å; M744-F748 HydrophobicContact CE-CE2 3.87Å; M744-F748 HydrophobicContact CG-CE2 4.28Å; M744-F748 WeakPolarHBondContact O-CB 3.28Å; M744-F748 WeakPolarHBondContact O-CD2 3.34Å; M744-F748 PolarHBondContact O-N 3.5Å; R746-F748 PolarHBondContact O-N 3.37Å
749	V	64.4	Low	67.3	Low	8 Å²	8	71.8 Å²	71.8	5%	0.048	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-40	-179.5	-169.7	0	0	0	0	111	F722 Y725 L745 T751 G752	F722-V749 HydrophobicContact CD1-CG1 4.15Å; F722-V749 HydrophobicContact CD1-CG2 4.34Å; F722-V749 HydrophobicContact CE1-CB 4.01Å; F722-V749 HydrophobicContact CE1-CG1 3.52Å; F722-V749 HydrophobicContact CE1-CG2 4.3Å; F722-V749 HydrophobicContact CZ-CG1 4.37Å; Y725-V749 HydrophobicContact CD1-CG2 4.3Å; Y725-V749 HydrophobicContact CD2-CG2 4.01Å; Y725-V749 HydrophobicContact CE1-CG2 4.49Å; Y725-V749 HydrophobicContact CE2-CG2 4.23Å; Y725-V749 HydrophobicContact CG-CG2 4.06Å; L745-V749 HydrophobicContact CD2-CG2 3.85Å; L745-V749 WeakPolarHBondContact O-CA 3.46Å; L745-V749 WeakPolarHBondContact O-CB 3.35Å; L745-V749 PolarHBondContact O-N 3.4Å; V749-T751 VanDerWaalsContact C-N 3.32Å; V749-T751 PolarHBondContact O-N 3.26Å; V749-G752 PolarHBondContact O-N 3.17Å
750	A	53.7	Low	66.8	Low	27 Å²	27	67.3 Å²	67.3	22%	0.223	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-16.5	-180	0	0	0	0	0	114.3	L745 R746	L745-A750 PolarHBondContact O-N 3.06Å; R746-A750 WeakPolarHBondContact O-CB 3Å; R746-A750 PolarHBondContact O-N 3.38Å
751	T	48.4	Very low	66.2	Low	114 Å²	114	66.5 Å²	66.5	70%	0.699	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	1.3	171.1	57.3	0	0	0	0	113.4	M747 V749	M747-T751 PolarHBondContact O-OG1 3.2Å; V749-T751 VanDerWaalsContact C-N 3.32Å; V749-T751 PolarHBondContact O-N 3.26Å
752	G	50.4	Low	65.7	Low	25 Å²	25	69.7 Å²	69.7	26%	0.258	38%	0.381	S	S	.	.	S	Bend	trans	-77.7	175.4	176.3	0	0	0	0	0	113	V749 V754	V749-G752 PolarHBondContact O-N 3.17Å; G752-V754 PolarHBondContact O-N 3.41Å
753	P	41.2	Very low	65.6	Low	141 Å²	141	69 Å²	69	92%	0.916	38%	0.378	S	S	*	.	S	Bend	trans	-61	-15.9	179.7	-15.7	26.6	0	0	0	114.1
754	V	44.3	Very low	65.5	Low	84 Å²	84	68.8 Å²	68.8	51%	0.509	37%	0.372	S	S	.	.	S	Bend	trans	-112.9	89.8	179	-176	0	0	0	0	107.5	G752 T756	G752-V754 PolarHBondContact O-N 3.41Å; V754-T756 HydrophobicContact CG1-CG2 4Å; V754-T756 PolarHBondContact O-N 3.46Å; V754-T756 PolarHBondContact O-OG1 3.11Å
755	V	49.1	Very low	65.5	Low	91 Å²	91	69.3 Å²	69.3	55%	0.552	38%	0.382	S	S	*	.			trans	-62.8	104.7	175.1	-177	0	0	0	0	107.6
756	T	53.7	Low	65.7	Low	15 Å²	15	69.5 Å²	69.5	9%	0.092	38%	0.382	C	S	.	.			trans	-136.3	111.2	176	33.7	0	0	0	0	108.6	K718 V754	K718-T756 HydrophobicContact CD-CG2 3.9Å; K718-T756 HydrophobicContact CG-CG2 4.29Å; V754-T756 HydrophobicContact CG1-CG2 4Å; V754-T756 PolarHBondContact O-N 3.46Å; V754-T756 PolarHBondContact O-OG1 3.11Å
757	E	58.3	Low	66.2	Low	116 Å²	116	63.2 Å²	63.2	54%	0.542	36%	0.359	S	S	.	.			trans	-83.4	139.7	171.9	-60.2	-161.1	148.9	0	0	110.2
758	M	66.9	Low	66.8	Low	12 Å²	12	62.8 Å²	62.8	6%	0.059	36%	0.355	C	S	.	.			trans	-124.3	127.3	170.8	-177.2	171.3	47.7	0	0	109	F722 H742 L745 E762 L763	F722-M758 HydrophobicContact CB-CE 4.47Å; F722-M758 HydrophobicContact CD1-CE 4.09Å; F722-M758 HydrophobicContact CD2-CE 4.01Å; F722-M758 HydrophobicContact CD2-SD 3.87Å; F722-M758 HydrophobicContact CE1-CE 4.27Å; F722-M758 HydrophobicContact CE2-CB 4.06Å; F722-M758 HydrophobicContact CE2-CE 4.21Å; F722-M758 HydrophobicContact CE2-CG 4.5Å; F722-M758 HydrophobicContact CE2-SD 4.01Å; F722-M758 HydrophobicContact CG-CE 3.96Å; F722-M758 HydrophobicContact CG-SD 4.39Å; F722-M758 HydrophobicContact CZ-CB 3.97Å; F722-M758 HydrophobicContact CZ-CE 4.34Å; H742-M758 PolarHBondContact NE2-O 3.01Å; L745-M758 HydrophobicContact CD1-CE 3.41Å; L745-M758 VanDerWaalsContact CD1-CE 3.41Å; M758-E762 HydrophobicContact CG-CB 4.35Å; M758-E762 HydrophobicContact CG-CG 4.4Å; M758-L763 HydrophobicContact CE-CB 3.94Å; M758-L763 HydrophobicContact CE-CD1 3.52Å; M758-L763 HydrophobicContact CE-CD2 4.45Å; M758-L763 HydrophobicContact CE-CG 4.14Å; M758-L763 HydrophobicContact CG-CB 4.22Å; M758-L763 HydrophobicContact SD-CB 3.97Å; M758-L763 HydrophobicContact SD-CD1 4.2Å
759	D	70.2	Confident	67.6	Low	104 Å²	104	62.7 Å²	62.7	56%	0.556	35%	0.352	S	S	*	.			trans	-71.5	150.3	179.1	-107.1	-14	0	0	0	111.6	N761 E762 L763	D759-N761 VanDerWaalsContact C-N 3.28Å; D759-N761 PolarHBondContact O-N 2.91Å; D759-E762 HydrophobicContact CB-CB 4.17Å; D759-E762 PolarHBondContact O-N 3.31Å; D759-E762 VanDerWaalsContact O-N 3.13Å; D759-L763 PolarHBondContact O-N 2.99Å
760	V	76.9	Confident	68.7	Low	58 Å²	58	63.6 Å²	63.6	35%	0.352	36%	0.355	S	S	.	.	H	α-helix	trans	-59.7	-41.5	-179.2	-179.2	0	0	0	0	111.1	L738 H742 E762 L763 E764	L738-V760 HydrophobicContact CD2-CG1 4.12Å; L738-V760 HydrophobicContact CG-CG1 4.47Å; H742-V760 VanDerWaalsContact CE1-CG2 3.48Å; H742-V760 WeakPolarHBondContact CE1-CG2 3.17Å; V760-E762 VanDerWaalsContact C-N 3.33Å; V760-E762 PolarHBondContact O-N 3.35Å; V760-L763 PolarHBondContact O-N 3.42Å; V760-E764 WeakPolarHBondContact O-CB 3.32Å; V760-E764 PolarHBondContact O-N 3.05Å
761	N	74.2	Confident	70.3	Confident	123 Å²	123	64.2 Å²	64.2	66%	0.658	36%	0.356	S	S	*	.	H	α-helix	trans	-67.7	-34.9	179	-63.5	-26.9	0	0	0	111.9	D759 A765	D759-N761 VanDerWaalsContact C-N 3.28Å; D759-N761 PolarHBondContact O-N 2.91Å; N761-A765 WeakPolarHBondContact O-CB 3.35Å; N761-A765 PolarHBondContact O-N 3.38Å
762	E	75.4	Confident	72.1	Confident	67 Å²	67	67.3 Å²	67.3	31%	0.313	36%	0.355	S	S	.	.	H	α-helix	trans	-71.2	-44.2	177.4	-174.6	173	-159.6	0	0	111.1	R715 M758 D759 V760 E764 A765 F766	R715-E762 IonicContact CZ-OE1 2.75Å; R715-E762 IonicContact NE-OE1 3.26Å; R715-E762 PolarHBondContact NE-OE1 3.15Å; R715-E762 IonicContact NH2-OE1 2.77Å; R715-E762 PolarHBondContact NH2-OE1 2.91Å; M758-E762 HydrophobicContact CG-CB 4.35Å; M758-E762 HydrophobicContact CG-CG 4.4Å; D759-E762 HydrophobicContact CB-CB 4.17Å; D759-E762 PolarHBondContact O-N 3.31Å; D759-E762 VanDerWaalsContact O-N 3.13Å; V760-E762 VanDerWaalsContact C-N 3.33Å; V760-E762 PolarHBondContact O-N 3.35Å; E762-E764 VanDerWaalsContact C-N 3.3Å; E762-E764 PolarHBondContact O-N 3.1Å; E762-A765 PolarHBondContact O-N 3.03Å; E762-F766 WeakPolarHBondContact O-CB 3.43Å; E762-F766 PolarHBondContact O-N 3.3Å
763	L	82.6	Confident	73.9	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-59.2	-42.5	172.6	173.9	63.7	0	0	0	111.2	I726 L738 I741 H742 L745 M758 D759 V760 F766 L767	I726-L763 HydrophobicContact CD1-CD1 4.06Å; L738-L763 HydrophobicContact CD1-CD2 3.89Å; L738-L763 HydrophobicContact CD1-CG 3.86Å; I741-L763 HydrophobicContact CB-CD2 4.42Å; I741-L763 HydrophobicContact CG2-CD1 4.14Å; I741-L763 HydrophobicContact CG2-CD2 4.01Å; H742-L763 HydrophobicContact CB-CD2 3.68Å; L745-L763 HydrophobicContact CD1-CD1 3.95Å; L745-L763 HydrophobicContact CD1-CD2 4.34Å; M758-L763 HydrophobicContact CE-CB 3.94Å; M758-L763 HydrophobicContact CE-CD1 3.52Å; M758-L763 HydrophobicContact CE-CD2 4.45Å; M758-L763 HydrophobicContact CE-CG 4.14Å; M758-L763 HydrophobicContact CG-CB 4.22Å; M758-L763 HydrophobicContact SD-CB 3.97Å; M758-L763 HydrophobicContact SD-CD1 4.2Å; D759-L763 PolarHBondContact O-N 2.99Å; V760-L763 PolarHBondContact O-N 3.42Å; L763-F766 PolarHBondContact O-N 3.5Å; L763-L767 HydrophobicContact CD1-CD1 3.84Å; L763-L767 HydrophobicContact CD1-CD2 4.4Å; L763-L767 HydrophobicContact CD1-CG 3.86Å; L763-L767 HydrophobicContact CG-CD1 3.91Å; L763-L767 HydrophobicContact CG-CG 4.32Å; L763-L767 WeakPolarHBondContact O-CB 3.42Å; L763-L767 VanDerWaalsContact O-CG 3.28Å; L763-L767 WeakPolarHBondContact O-CG 3.21Å; L763-L767 PolarHBondContact O-N 3.44Å
764	E	83.8	Confident	75.9	Confident	70 Å²	70	71.2 Å²	71.2	33%	0.327	35%	0.354	S	S	.	.	H	α-helix	trans	-60.8	-50	177.2	-169.3	-176.1	179.6	0	0	111.2	L738 V760 E762 F766 L767 Q768	L738-E764 HydrophobicContact CD1-CB 4.2Å; L738-E764 HydrophobicContact CD2-CB 3.96Å; L738-E764 HydrophobicContact CD2-CG 4.01Å; V760-E764 WeakPolarHBondContact O-CB 3.32Å; V760-E764 PolarHBondContact O-N 3.05Å; E762-E764 VanDerWaalsContact C-N 3.3Å; E762-E764 PolarHBondContact O-N 3.1Å; E764-F766 VanDerWaalsContact C-N 3.27Å; E764-F766 PolarHBondContact O-N 3.49Å; E764-L767 PolarHBondContact O-N 3.42Å; E764-Q768 HydrophobicContact CG-CG 4.45Å; E764-Q768 WeakPolarHBondContact O-CB 3.38Å; E764-Q768 VanDerWaalsContact O-CG 3.23Å; E764-Q768 WeakPolarHBondContact O-CG 3.43Å; E764-Q768 PolarHBondContact O-N 3.45Å; E764-Q768 PolarHBondContact OE1-NE2 3.29Å; E764-Q768 VanDerWaalsContact OE1-NE2 3.11Å
765	A	82.1	Confident	77.8	Confident	46 Å²	46	70.6 Å²	70.6	38%	0.38	35%	0.345	S	S	.	.	H	α-helix	trans	-60.8	-37.2	177.8	0	0	0	0	0	112.3	N761 E762 R769	N761-A765 WeakPolarHBondContact O-CB 3.35Å; N761-A765 PolarHBondContact O-N 3.38Å; E762-A765 PolarHBondContact O-N 3.03Å; A765-R769 PolarHBondContact O-N 3Å
766	F	84.8	Confident	79.6	Confident	10 Å²	10	66.4 Å²	66.4	4%	0.044	32%	0.32	C	S	.	.	H	α-helix	trans	-66.4	-49.1	176.1	179.5	-112.6	0	0	0	112.3	L719 W723 I726 E762 L763 E764 Q768 R769 K770	L719-F766 HydrophobicContact CB-CE2 3.87Å; L719-F766 HydrophobicContact CB-CZ 4.21Å; L719-F766 HydrophobicContact CD1-CD2 4.36Å; L719-F766 HydrophobicContact CD1-CE2 4.37Å; L719-F766 HydrophobicContact CD2-CD2 3.67Å; L719-F766 HydrophobicContact CD2-CE2 3.86Å; L719-F766 HydrophobicContact CD2-CG 4.02Å; L719-F766 HydrophobicContact CD2-CZ 4.37Å; L719-F766 HydrophobicContact CG-CD2 4.4Å; L719-F766 HydrophobicContact CG-CE2 4.25Å; L719-F766 WeakPolarHBondContact O-CZ 3.26Å; W723-F766 HydrophobicContact CB-CE1 4.43Å; W723-F766 HydrophobicContact CB-CZ 4.11Å; W723-F766 HydrophobicContact CE3-CE1 4.49Å; I726-F766 HydrophobicContact CD1-CD1 4.4Å; I726-F766 HydrophobicContact CD1-CE1 4.14Å; E762-F766 WeakPolarHBondContact O-CB 3.43Å; E762-F766 PolarHBondContact O-N 3.3Å; L763-F766 PolarHBondContact O-N 3.5Å; E764-F766 VanDerWaalsContact C-N 3.27Å; E764-F766 PolarHBondContact O-N 3.49Å; F766-Q768 VanDerWaalsContact C-N 3.33Å; F766-Q768 PolarHBondContact O-N 3.02Å; F766-R769 VanDerWaalsContact O-CB 3.31Å; F766-R769 WeakPolarHBondContact O-CB 3.48Å; F766-R769 PolarHBondContact O-N 3.11Å; F766-R769 VanDerWaalsContact O-N 3.12Å; F766-K770 HydrophobicContact CE1-CG 4.37Å; F766-K770 HydrophobicContact CE2-CG 4.47Å; F766-K770 HydrophobicContact CZ-CG 4.25Å; F766-K770 PolarHBondContact O-N 2.9Å
767	L	86.6	Confident	81.2	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.1	-40	176.7	-68.4	172.9	0	0	0	111.2	I726 L738 I741 L763 E764 R769 K770 V771 L776 Y783	I726-L767 HydrophobicContact CD1-CD2 4.13Å; I726-L767 HydrophobicContact CG2-CD2 4.2Å; L738-L767 HydrophobicContact CD1-CD1 3.65Å; I741-L767 HydrophobicContact CD1-CD1 4.05Å; L763-L767 HydrophobicContact CD1-CD1 3.84Å; L763-L767 HydrophobicContact CD1-CD2 4.4Å; L763-L767 HydrophobicContact CD1-CG 3.86Å; L763-L767 HydrophobicContact CG-CD1 3.91Å; L763-L767 HydrophobicContact CG-CG 4.32Å; L763-L767 WeakPolarHBondContact O-CB 3.42Å; L763-L767 VanDerWaalsContact O-CG 3.28Å; L763-L767 WeakPolarHBondContact O-CG 3.21Å; L763-L767 PolarHBondContact O-N 3.44Å; E764-L767 PolarHBondContact O-N 3.42Å; L767-R769 VanDerWaalsContact C-N 3.29Å; L767-R769 PolarHBondContact O-N 3.4Å; L767-K770 PolarHBondContact O-N 3.27Å; L767-K770 VanDerWaalsContact O-N 3.14Å; L767-V771 VanDerWaalsContact O-CG2 3.26Å; L767-V771 WeakPolarHBondContact O-CG2 3.34Å; L767-V771 PolarHBondContact O-N 3.48Å; L767-L776 HydrophobicContact CB-CD1 4.49Å; L767-L776 HydrophobicContact CD2-CD1 3.48Å; L767-L776 VanDerWaalsContact CD2-CD1 3.48Å; L767-Y783 HydrophobicContact CB-CD1 4.08Å; L767-Y783 HydrophobicContact CB-CE1 3.49Å; L767-Y783 VanDerWaalsContact CB-CE1 3.49Å; L767-Y783 HydrophobicContact CD1-CD1 4.26Å; L767-Y783 HydrophobicContact CD1-CD2 4.13Å; L767-Y783 HydrophobicContact CD1-CE1 3.97Å; L767-Y783 HydrophobicContact CD1-CE2 3.83Å; L767-Y783 HydrophobicContact CD1-CG 4.34Å; L767-Y783 HydrophobicContact CD2-CD1 4.5Å; L767-Y783 HydrophobicContact CG-CE1 4.26Å
768	Q	86.2	Confident	82.6	Confident	94 Å²	94	66.9 Å²	66.9	44%	0.439	33%	0.327	S	S	.	.	H	α-helix	trans	-61.8	-35.5	173.6	-73.6	177.5	8.3	0	0	112.4	E764 F766 V771 R772	E764-Q768 HydrophobicContact CG-CG 4.45Å; E764-Q768 WeakPolarHBondContact O-CB 3.38Å; E764-Q768 VanDerWaalsContact O-CG 3.23Å; E764-Q768 WeakPolarHBondContact O-CG 3.43Å; E764-Q768 PolarHBondContact O-N 3.45Å; E764-Q768 PolarHBondContact OE1-NE2 3.29Å; E764-Q768 VanDerWaalsContact OE1-NE2 3.11Å; F766-Q768 VanDerWaalsContact C-N 3.33Å; F766-Q768 PolarHBondContact O-N 3.02Å; Q768-V771 PolarHBondContact O-N 2.91Å; Q768-R772 WeakPolarHBondContact O-CG 3.33Å; Q768-R772 PolarHBondContact O-N 3.45Å; Q768-R772 VanDerWaalsContact O-N 3.08Å
769	R	86.3	Confident	83.2	Confident	111 Å²	111	68.6 Å²	68.6	42%	0.419	34%	0.34	S	S	.	.	H	α-helix	trans	-63.5	-45.7	171.6	-167.3	-174.8	-57.4	163.1	3.3	111	A765 F766 L767 V771 R772 E773	A765-R769 PolarHBondContact O-N 3Å; F766-R769 VanDerWaalsContact O-CB 3.31Å; F766-R769 WeakPolarHBondContact O-CB 3.48Å; F766-R769 PolarHBondContact O-N 3.11Å; F766-R769 VanDerWaalsContact O-N 3.12Å; L767-R769 VanDerWaalsContact C-N 3.29Å; L767-R769 PolarHBondContact O-N 3.4Å; R769-V771 VanDerWaalsContact C-N 3.28Å; R769-V771 PolarHBondContact O-N 3.15Å; R769-R772 WeakPolarHBondContact O-CB 3.49Å; R769-R772 PolarHBondContact O-N 3.1Å; R769-R772 VanDerWaalsContact O-N 3.09Å; R769-E773 WeakPolarHBondContact O-CG 3.45Å; R769-E773 PolarHBondContact O-N 2.93Å
770	K	86.9	Confident	83.5	Confident	27 Å²	27	70.2 Å²	70.2	12%	0.117	35%	0.354	C	S	.	.	H	α-helix	trans	-65.3	-29.3	177.3	-68.9	-72.4	166.1	-158	0	113.7	W723 F766 L767 E773 H774 Q775 L776	W723-K770 HydrophobicContact CD2-CD 4.13Å; W723-K770 HydrophobicContact CE3-CD 3.81Å; W723-K770 HydrophobicContact CE3-CG 3.92Å; W723-K770 HydrophobicContact CH2-CD 4.23Å; W723-K770 HydrophobicContact CZ3-CB 4.06Å; W723-K770 HydrophobicContact CZ3-CD 3.86Å; W723-K770 HydrophobicContact CZ3-CG 3.85Å; F766-K770 HydrophobicContact CE1-CG 4.37Å; F766-K770 HydrophobicContact CE2-CG 4.47Å; F766-K770 HydrophobicContact CZ-CG 4.25Å; F766-K770 PolarHBondContact O-N 2.9Å; L767-K770 PolarHBondContact O-N 3.27Å; L767-K770 VanDerWaalsContact O-N 3.14Å; K770-E773 IonicContact NZ-OE2 3.4Å; K770-E773 PolarHBondContact NZ-OE2 3.34Å; K770-H774 PolarHBondContact O-N 3.43Å; K770-Q775 HydrophobicContact CD-CB 4.26Å; K770-Q775 PolarHBondContact O-N 2.97Å; K770-L776 HydrophobicContact CB-CB 4.49Å; K770-L776 HydrophobicContact CB-CD1 3.88Å; K770-L776 HydrophobicContact CB-CG 4.15Å; K770-L776 PolarHBondContact O-N 3.48Å
771	V	87.9	Confident	83.6	Confident	40 Å²	40	69.8 Å²	69.8	24%	0.242	36%	0.361	C	S	.	.	H	α-helix	trans	-68.9	-42.5	170.5	174	0	0	0	0	111.4	L767 Q768 R769 E773 H774 L776 V778 Y783	L767-V771 VanDerWaalsContact O-CG2 3.26Å; L767-V771 WeakPolarHBondContact O-CG2 3.34Å; L767-V771 PolarHBondContact O-N 3.48Å; Q768-V771 PolarHBondContact O-N 2.91Å; R769-V771 VanDerWaalsContact C-N 3.28Å; R769-V771 PolarHBondContact O-N 3.15Å; V771-E773 VanDerWaalsContact C-N 3.3Å; V771-E773 PolarHBondContact O-N 3.21Å; V771-H774 PolarHBondContact O-N 3.43Å; V771-H774 VanDerWaalsContact O-N 3.08Å; V771-L776 WeakPolarHBondContact CA-O 3.43Å; V771-L776 HydrophobicContact CG2-CB 3.75Å; V771-V778 HydrophobicContact CG2-CB 4.43Å; V771-V778 HydrophobicContact CG2-CG2 3.5Å; V771-Y783 HydrophobicContact CG2-CD1 4.38Å; V771-Y783 HydrophobicContact CG2-CE1 4.29Å
772	R	86.8	Confident	84.3	Confident	180 Å²	180	66 Å²	66	68%	0.679	34%	0.341	S	S	*	.	H	α-helix	trans	-63.5	-35	174.3	-73.8	-176.5	-72	160.1	-4.7	112.6	Q768 R769 H774	Q768-R772 WeakPolarHBondContact O-CG 3.33Å; Q768-R772 PolarHBondContact O-N 3.45Å; Q768-R772 VanDerWaalsContact O-N 3.08Å; R769-R772 WeakPolarHBondContact O-CB 3.49Å; R769-R772 PolarHBondContact O-N 3.1Å; R769-R772 VanDerWaalsContact O-N 3.09Å; R772-H774 PolarHBondContact O-N 2.97Å
773	E	87	Confident	85	Confident	85 Å²	85	63.5 Å²	63.5	40%	0.397	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	3.9	174.3	-69.4	169.7	-165	0	0	113.4	R769 K770 V771 Q775	R769-E773 WeakPolarHBondContact O-CG 3.45Å; R769-E773 PolarHBondContact O-N 2.93Å; K770-E773 IonicContact NZ-OE2 3.4Å; K770-E773 PolarHBondContact NZ-OE2 3.34Å; V771-E773 VanDerWaalsContact C-N 3.3Å; V771-E773 PolarHBondContact O-N 3.21Å; E773-Q775 HydrophobicContact CB-CG 4.14Å; E773-Q775 PolarHBondContact O-N 3.23Å; E773-Q775 VanDerWaalsContact O-N 3.15Å
774	H	83.9	Confident	85.2	Confident	162 Å²	162	68.6 Å²	68.6	75%	0.75	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	19.7	-175.5	-58.3	-52.9	0	0	0	115	K770 V771 R772	K770-H774 PolarHBondContact O-N 3.43Å; V771-H774 PolarHBondContact O-N 3.43Å; V771-H774 VanDerWaalsContact O-N 3.08Å; R772-H774 PolarHBondContact O-N 2.97Å
775	Q	83.9	Confident	85.4	Confident	71 Å²	71	67.4 Å²	67.4	33%	0.332	34%	0.343	S	S	.	.	S	Bend	trans	-87.2	-16.7	175.3	-61.6	-176.1	2.5	0	0	112.4	W723 K770 E773 P786	W723-Q775 HydrophobicContact CH2-CB 3.84Å; W723-Q775 HydrophobicContact CZ2-CB 3.95Å; K770-Q775 HydrophobicContact CD-CB 4.26Å; K770-Q775 PolarHBondContact O-N 2.97Å; E773-Q775 HydrophobicContact CB-CG 4.14Å; E773-Q775 PolarHBondContact O-N 3.23Å; E773-Q775 VanDerWaalsContact O-N 3.15Å; Q775-P786 WeakPolarHBondContact O-CD 3.48Å
776	L	87.8	Confident	85.5	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.016	34%	0.341	C	S	.	.			trans	-134.8	151.8	173.4	-73.6	178	0	0	0	111.4	W723 L730 L767 K770 V771 Y783 R784 L785	W723-L776 HydrophobicContact CH2-CD1 4.42Å; W723-L776 HydrophobicContact CH2-CD2 4.06Å; W723-L776 HydrophobicContact CH2-CG 3.85Å; W723-L776 HydrophobicContact CZ3-CD1 3.85Å; W723-L776 HydrophobicContact CZ3-CD2 4.16Å; W723-L776 HydrophobicContact CZ3-CG 3.79Å; L730-L776 HydrophobicContact CD1-CD2 3.38Å; L767-L776 HydrophobicContact CB-CD1 4.49Å; L767-L776 HydrophobicContact CD2-CD1 3.48Å; L767-L776 VanDerWaalsContact CD2-CD1 3.48Å; K770-L776 HydrophobicContact CB-CB 4.49Å; K770-L776 HydrophobicContact CB-CD1 3.88Å; K770-L776 HydrophobicContact CB-CG 4.15Å; K770-L776 PolarHBondContact O-N 3.48Å; V771-L776 WeakPolarHBondContact CA-O 3.43Å; V771-L776 HydrophobicContact CG2-CB 3.75Å; L776-Y783 HydrophobicContact CD1-CD1 4.2Å; L776-R784 WeakPolarHBondContact CA-O 3.25Å; L776-R784 WeakPolarHBondContact CD2-O 3.31Å; L776-L785 HydrophobicContact CD2-CD2 4.01Å
777	I	87	Confident	84.9	Confident	80 Å²	80	76.7 Å²	76.7	41%	0.41	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.1	172.3	-56.5	176.3	0	0	0	108.1	Y783 R784 P786	I777-Y783 CarbonylContact O-C 3.49Å; I777-Y783 WeakPolarHBondContact O-CA 3.46Å; I777-R784 PolarHBondContact N-O 3.3Å; I777-R784 PolarHBondContact O-N 3.41Å; I777-P786 HydrophobicContact CD1-CB 4.04Å; I777-P786 HydrophobicContact CG1-CB 4.32Å
778	V	86.8	Confident	83.4	Confident	61 Å²	61	83.4 Å²	83.4	37%	0.37	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	126.4	171.3	170.9	0	0	0	0	109.4	V771 I782 Y783	V771-V778 HydrophobicContact CG2-CB 4.43Å; V771-V778 HydrophobicContact CG2-CG2 3.5Å; V778-I782 WeakPolarHBondContact CA-O 3.47Å; V778-Y783 HydrophobicContact CG2-CD1 3.27Å; V778-Y783 HydrophobicContact CG2-CE1 3.18Å; V778-Y783 HydrophobicContact CG2-CG 4.11Å
779	S	80.5	Confident	80.9	Confident	49 Å²	49	88 Å²	88	34%	0.343	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	121.9	171.2	-59.3	0	0	0	0	108.2	G781 I782	S779-G781 VanDerWaalsContact C-N 3.29Å; S779-G781 PolarHBondContact O-N 2.91Å; S779-I782 PolarHBondContact N-O 3.1Å; S779-I782 PolarHBondContact O-N 3.49Å
780	T	77.1	Confident	80.7	Confident	138 Å²	138	86.9 Å²	86.9	85%	0.847	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	44.3	176.7	59.1	0	0	0	0	114	I782	T780-I782 VanDerWaalsContact C-N 3.31Å; T780-I782 PolarHBondContact O-N 3.2Å
781	G	78.8	Confident	80.3	Confident	49 Å²	49	90 Å²	90	51%	0.505	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	8.6	178.9	0	0	0	0	0	115.7	S779	S779-G781 VanDerWaalsContact C-N 3.29Å; S779-G781 PolarHBondContact O-N 2.91Å
782	I	87.8	Confident	79.9	Confident	43 Å²	43	92.8 Å²	92.8	22%	0.221	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	131.5	178.6	-51.3	174.8	0	0	0	109.2	M736 T737 V778 S779 T780	M736-I782 WeakPolarHBondContact O-CG2 3.28Å; T737-I782 HydrophobicContact CG2-CG1 4.24Å; V778-I782 WeakPolarHBondContact CA-O 3.47Å; S779-I782 PolarHBondContact N-O 3.1Å; S779-I782 PolarHBondContact O-N 3.49Å; T780-I782 VanDerWaalsContact C-N 3.31Å; T780-I782 PolarHBondContact O-N 3.2Å
783	Y	90.1	Very high	79.5	Confident	15 Å²	15	87.6 Å²	87.6	6%	0.059	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	137.4	176.6	-62.8	-89.5	0	0	0	110.6	L730 S735 M736 L738 I741 L767 V771 L776 I777 V778	L730-Y783 WeakPolarHBondContact CD2-O 3.47Å; S735-Y783 VanDerWaalsContact CA-O 3.28Å; S735-Y783 WeakPolarHBondContact CA-O 3.41Å; M736-Y783 PolarHBondContact N-O 3.38Å; M736-Y783 VanDerWaalsContact N-O 3.08Å; M736-Y783 PolarHBondContact O-N 3.4Å; L738-Y783 HydrophobicContact CB-CE2 4Å; L738-Y783 HydrophobicContact CD1-CE2 4.41Å; I741-Y783 HydrophobicContact CD1-CD2 3.88Å; I741-Y783 HydrophobicContact CD1-CG 4.17Å; L767-Y783 HydrophobicContact CB-CD1 4.08Å; L767-Y783 HydrophobicContact CB-CE1 3.49Å; L767-Y783 VanDerWaalsContact CB-CE1 3.49Å; L767-Y783 HydrophobicContact CD1-CD1 4.26Å; L767-Y783 HydrophobicContact CD1-CD2 4.13Å; L767-Y783 HydrophobicContact CD1-CE1 3.97Å; L767-Y783 HydrophobicContact CD1-CE2 3.83Å; L767-Y783 HydrophobicContact CD1-CG 4.34Å; L767-Y783 HydrophobicContact CD2-CD1 4.5Å; L767-Y783 HydrophobicContact CG-CE1 4.26Å; V771-Y783 HydrophobicContact CG2-CD1 4.38Å; V771-Y783 HydrophobicContact CG2-CE1 4.29Å; L776-Y783 HydrophobicContact CD1-CD1 4.2Å; I777-Y783 CarbonylContact O-C 3.49Å; I777-Y783 WeakPolarHBondContact O-CA 3.46Å; V778-Y783 HydrophobicContact CG2-CD1 3.27Å; V778-Y783 HydrophobicContact CG2-CE1 3.18Å; V778-Y783 HydrophobicContact CG2-CG 4.11Å
784	R	88.1	Confident	79	Confident	106 Å²	106	87.8 Å²	87.8	40%	0.4	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	152.6	176.1	-64.9	-168.1	179.3	128.8	1.7	111	S735 L776 I777	S735-R784 VanDerWaalsContact CB-CG 3.44Å; S735-R784 VanDerWaalsContact CB-NE 3.27Å; L776-R784 WeakPolarHBondContact CA-O 3.25Å; L776-R784 WeakPolarHBondContact CD2-O 3.31Å; I777-R784 PolarHBondContact N-O 3.3Å; I777-R784 PolarHBondContact O-N 3.41Å
785	L	87.8	Confident	78.7	Confident	46 Å²	46	82.9 Å²	82.9	24%	0.241	48%	0.476	C	S	.	.			trans	-74	142.6	166.9	-71.4	166.8	0	0	0	110.1	W723 Q727 L730 T731 L776 K787	W723-L785 HydrophobicContact CH2-CD2 4.3Å; Q727-L785 HydrophobicContact CG-CD1 4.22Å; Q727-L785 HydrophobicContact CG-CD2 4.29Å; L730-L785 HydrophobicContact CB-CD1 3.83Å; L730-L785 HydrophobicContact CB-CG 3.81Å; L730-L785 HydrophobicContact CD1-CG 4.35Å; T731-L785 WeakPolarHBondContact OG1-CD1 3.23Å; L776-L785 HydrophobicContact CD2-CD2 4.01Å; L785-K787 PolarHBondContact O-N 3.24Å
786	P	83.7	Confident	78.3	Confident	51 Å²	51	83.7 Å²	83.7	33%	0.331	49%	0.486	S	S	.	.			trans	-61.2	136.4	170.9	26	-32.8	0	0	0	109.5	Q775 I777 T788	Q775-P786 WeakPolarHBondContact O-CD 3.48Å; I777-P786 HydrophobicContact CD1-CB 4.04Å; I777-P786 HydrophobicContact CG1-CB 4.32Å; P786-T788 PolarHBondContact O-N 2.65Å; P786-T788 VanDerWaalsContact O-N 3.08Å
787	K	71.6	Confident	77.6	Confident	199 Å²	199	89.9 Å²	89.9	87%	0.865	52%	0.522	S	S	*	.			trans	-65.5	113.1	175	-69.9	-176.4	176.6	-176.7	0	108.1	L785 S789	L785-K787 PolarHBondContact O-N 3.24Å; K787-S789 PolarHBondContact O-N 3.21Å
788	T	55.4	Low	76.8	Confident	141 Å²	141	90.8 Å²	90.8	87%	0.865	53%	0.532	S	S	*	.			trans	-57.4	122.5	166.8	40.3	0	0	0	0	108.1	P786	P786-T788 PolarHBondContact O-N 2.65Å; P786-T788 VanDerWaalsContact O-N 3.08Å
789	S	34.3	Very low	75.9	Confident	191 Å²	191	93.5 Å²	93.5	100%	1.336	55%	0.547	S	S	*	.			trans	-70	0	173.7	-44.6	0	0	0	0	110.7	K787	K787-S789 PolarHBondContact O-N 3.21Å

Retrieved 789 of 789 residues in 350 ms (Link to these results)

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