A0A087XGX5_POEFO Loading...

Carbohydrate sulfotransferase

AlphaFold DB , UniProt , Accession A0A087XGX5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 370 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	V	54.2	Low	53.3	Low	172 Å²	172	144.5 Å²	144.5	100%	1.042	69%	0.691	S	S	*	*				0	-26.9	0	-172.6	0	0	0	0	113.6
2	H	51.4	Low	54.1	Low	157 Å²	157	135.5 Å²	135.5	73%	0.727	67%	0.666	S	S	*	*	H	α-helix	trans	-79.3	-23.7	-177.5	-111.6	-70	0	0	0	116.7
3	I	51.3	Low	54.9	Low	141 Å²	141	129.2 Å²	129.2	72%	0.723	65%	0.649	S	S	*	*	H	α-helix	trans	-81.5	-33.3	-176.7	-65.9	171.5	0	0	0	112.3	R5 H6	I3-R5 PolarHBondContact O-N 3.29Å; I3-H6 PolarHBondContact O-N 3.04Å
4	M	50.7	Low	55.6	Low	128 Å²	128	125.6 Å²	125.6	63%	0.631	64%	0.64	S	S	*	*	H	α-helix	trans	-69	-31	179.2	-80.6	176.4	46.5	0	0	113	H6 Q7 W8	M4-H6 VanDerWaalsContact C-N 3.3Å; M4-H6 PolarHBondContact O-N 3.23Å; M4-Q7 PolarHBondContact O-N 3.03Å; M4-W8 VanDerWaalsContact O-CD1 3.24Å
5	R	52.9	Low	56.5	Low	189 Å²	189	119.5 Å²	119.5	71%	0.713	62%	0.621	S	S	*	*	H	α-helix	trans	-68	-27.2	-178.8	-115.9	176.3	160	176.2	-6.5	113.6	I3	I3-R5 PolarHBondContact O-N 3.29Å
6	H	52.6	Low	57.2	Low	125 Å²	125	123.6 Å²	123.6	58%	0.579	63%	0.626	S	S	*	*	H	α-helix	trans	-76.8	-32.5	178.8	-92.4	-64.7	0	0	0	113.6	I3 M4 L9 L10	I3-H6 PolarHBondContact O-N 3.04Å; M4-H6 VanDerWaalsContact C-N 3.3Å; M4-H6 PolarHBondContact O-N 3.23Å; H6-L9 PolarHBondContact O-N 3.25Å; H6-L10 PolarHBondContact O-N 3.49Å
7	Q	51	Low	58.2	Low	123 Å²	123	121.5 Å²	121.5	58%	0.575	62%	0.621	S	S	*	*	H	α-helix	trans	-69.4	-34.5	177.9	-81.7	174.6	-39	0	0	112.7	M4 L11	M4-Q7 PolarHBondContact O-N 3.03Å; Q7-L11 PolarHBondContact O-N 3.17Å; Q7-L11 VanDerWaalsContact O-N 3.13Å
8	W	53.6	Low	58.8	Low	197 Å²	197	121 Å²	121	75%	0.746	62%	0.619	S	S	*	*	H	α-helix	trans	-72	-31.4	176.2	-74.3	93.9	0	0	0	113.2	M4 G12	M4-W8 VanDerWaalsContact O-CD1 3.24Å; W8-G12 PolarHBondContact O-N 2.68Å; W8-G12 VanDerWaalsContact O-N 3.09Å
9	L	55.2	Low	59.4	Low	123 Å²	123	119.5 Å²	119.5	64%	0.644	61%	0.612	S	S	*	*	H	α-helix	trans	-71.6	-36.6	174.6	-73.9	166.5	0	0	0	112.3	H6 G12 A13	H6-L9 PolarHBondContact O-N 3.25Å; L9-G12 PolarHBondContact O-N 3.19Å; L9-A13 WeakPolarHBondContact O-CB 3.12Å; L9-A13 PolarHBondContact O-N 3.13Å
10	L	55.7	Low	60.2	Low	115 Å²	115	117.7 Å²	117.7	60%	0.602	61%	0.606	S	S	*	*	H	α-helix	trans	-68.5	-39.3	175	-80.2	159.5	0	0	0	112.4	H6 A13 C14	H6-L10 PolarHBondContact O-N 3.49Å; L10-A13 PolarHBondContact O-N 3.23Å; L10-C14 PolarHBondContact O-N 2.85Å; L10-C14 PolarHBondContact O-SG 2.81Å
11	L	58	Low	60.5	Low	119 Å²	119	117.1 Å²	117.1	62%	0.623	60%	0.604	S	S	*	*	H	α-helix	trans	-66.1	-38.7	174.2	-79.1	161.9	0	0	0	112.3	Q7 G15	Q7-L11 PolarHBondContact O-N 3.17Å; Q7-L11 VanDerWaalsContact O-N 3.13Å; L11-G15 PolarHBondContact O-N 3.47Å; L11-G15 VanDerWaalsContact O-N 3.15Å
12	G	62.6	Low	61.2	Low	37 Å²	37	115.4 Å²	115.4	38%	0.381	59%	0.586	S	S	.	*	H	α-helix	trans	-63.2	-45.9	173.1	0	0	0	0	0	112.6	W8 L9 G15 W16	W8-G12 PolarHBondContact O-N 2.68Å; W8-G12 VanDerWaalsContact O-N 3.09Å; L9-G12 PolarHBondContact O-N 3.19Å; G12-G15 PolarHBondContact O-N 3.07Å; G12-W16 VanDerWaalsContact O-CD1 3.25Å; G12-W16 PolarHBondContact O-N 3.16Å
13	A	65.1	Low	61.7	Low	54 Å²	54	114.8 Å²	114.8	45%	0.446	58%	0.582	S	S	.	*	H	α-helix	trans	-64	-41.6	178.9	0	0	0	0	0	112.7	L9 L10 G15 W16 V17	L9-A13 WeakPolarHBondContact O-CB 3.12Å; L9-A13 PolarHBondContact O-N 3.13Å; L10-A13 PolarHBondContact O-N 3.23Å; A13-G15 VanDerWaalsContact C-N 3.34Å; A13-G15 PolarHBondContact O-N 3.29Å; A13-W16 PolarHBondContact O-N 3.1Å; A13-V17 WeakPolarHBondContact O-CG2 3.36Å; A13-V17 PolarHBondContact O-N 2.89Å; A13-V17 VanDerWaalsContact O-N 3.12Å
14	C	64	Low	62.4	Low	79 Å²	79	111.5 Å²	111.5	53%	0.534	57%	0.568	S	S	.	*	H	α-helix	trans	-63.8	-37.1	175.5	-75.9	0	0	0	0	112.8	L10 V17 L18	L10-C14 PolarHBondContact O-N 2.85Å; L10-C14 PolarHBondContact O-SG 2.81Å; C14-V17 PolarHBondContact O-N 3.33Å; C14-L18 WeakPolarHBondContact O-CG 3.49Å; C14-L18 PolarHBondContact O-N 3.33Å
15	G	69.6	Low	62.7	Low	34 Å²	34	109.2 Å²	109.2	35%	0.351	57%	0.565	S	S	.	*	H	α-helix	trans	-64.2	-40.3	175.8	0	0	0	0	0	113.1	L11 G12 A13 L19	L11-G15 PolarHBondContact O-N 3.47Å; L11-G15 VanDerWaalsContact O-N 3.15Å; G12-G15 PolarHBondContact O-N 3.07Å; A13-G15 VanDerWaalsContact C-N 3.34Å; A13-G15 PolarHBondContact O-N 3.29Å; G15-L19 PolarHBondContact O-N 3.28Å; G15-L19 VanDerWaalsContact O-N 3.12Å
16	W	67.3	Low	62.5	Low	185 Å²	185	108.3 Å²	108.3	70%	0.701	57%	0.566	S	S	*	*	H	α-helix	trans	-68.9	-38.4	177.1	-83.7	99.2	0	0	0	112.9	G12 A13 L19 V20	G12-W16 VanDerWaalsContact O-CD1 3.25Å; G12-W16 PolarHBondContact O-N 3.16Å; A13-W16 PolarHBondContact O-N 3.1Å; W16-L19 PolarHBondContact O-N 2.98Å; W16-V20 WeakPolarHBondContact O-CG2 3.4Å; W16-V20 PolarHBondContact O-N 3.4Å
17	V	73.8	Confident	62.2	Low	88 Å²	88	109.9 Å²	109.9	53%	0.533	57%	0.571	S	S	.	*	H	α-helix	trans	-64.4	-40.6	176.6	172.6	0	0	0	0	111.5	A13 C14 V20 L21	A13-V17 WeakPolarHBondContact O-CG2 3.36Å; A13-V17 PolarHBondContact O-N 2.89Å; A13-V17 VanDerWaalsContact O-N 3.12Å; C14-V17 PolarHBondContact O-N 3.33Å; V17-V20 PolarHBondContact O-N 2.92Å; V17-L21 HydrophobicContact CG1-CD1 3.97Å; V17-L21 WeakPolarHBondContact O-CB 3.3Å; V17-L21 WeakPolarHBondContact O-CG 3.46Å; V17-L21 PolarHBondContact O-N 3.21Å
18	L	69.9	Low	62.1	Low	112 Å²	112	108.9 Å²	108.9	59%	0.586	57%	0.569	S	S	*	*	H	α-helix	trans	-66.6	-39.3	176	-71	170.6	0	0	0	112.3	C14 L21 M22	C14-L18 WeakPolarHBondContact O-CG 3.49Å; C14-L18 PolarHBondContact O-N 3.33Å; L18-L21 PolarHBondContact O-N 2.96Å; L18-M22 WeakPolarHBondContact O-CG 3.28Å; L18-M22 PolarHBondContact O-N 3.02Å
19	L	69.6	Low	61.6	Low	92 Å²	92	103.1 Å²	103.1	48%	0.482	56%	0.559	S	S	.	*	H	α-helix	trans	-63.4	-43.1	175.3	-106.7	160.6	0	0	0	112.2	G15 W16 M22 F23	G15-L19 PolarHBondContact O-N 3.28Å; G15-L19 VanDerWaalsContact O-N 3.12Å; W16-L19 PolarHBondContact O-N 2.98Å; L19-M22 PolarHBondContact O-N 2.86Å; L19-F23 HydrophobicContact CD2-CD2 4.33Å; L19-F23 HydrophobicContact CD2-CE2 4.26Å; L19-F23 WeakPolarHBondContact O-CD2 3.38Å; L19-F23 PolarHBondContact O-N 2.81Å
20	V	75.3	Confident	60.8	Low	84 Å²	84	106.1 Å²	106.1	51%	0.509	57%	0.567	S	S	.	*	H	α-helix	trans	-66	-42.8	176.2	173.3	0	0	0	0	110.9	W16 V17 M22 F23 V24	W16-V20 WeakPolarHBondContact O-CG2 3.4Å; W16-V20 PolarHBondContact O-N 3.4Å; V17-V20 PolarHBondContact O-N 2.92Å; V20-M22 VanDerWaalsContact C-N 3.34Å; V20-M22 PolarHBondContact O-N 3.28Å; V20-F23 PolarHBondContact O-N 3.38Å; V20-V24 HydrophobicContact CG1-CG2 4.12Å; V20-V24 WeakPolarHBondContact O-CB 3.46Å; V20-V24 VanDerWaalsContact O-CG2 3.24Å; V20-V24 WeakPolarHBondContact O-CG2 3.12Å; V20-V24 PolarHBondContact O-N 3.44Å
21	L	67.6	Low	59.9	Low	106 Å²	106	109 Å²	109	56%	0.555	58%	0.575	S	S	*	*	H	α-helix	trans	-63.1	-37.8	176.2	-76.1	168.5	0	0	0	112.7	V17 L18 S25	V17-L21 HydrophobicContact CG1-CD1 3.97Å; V17-L21 WeakPolarHBondContact O-CB 3.3Å; V17-L21 WeakPolarHBondContact O-CG 3.46Å; V17-L21 PolarHBondContact O-N 3.21Å; L18-L21 PolarHBondContact O-N 2.96Å; L21-S25 WeakPolarHBondContact O-CB 3.35Å; L21-S25 PolarHBondContact O-N 3.48Å
22	M	68.5	Low	58.8	Low	136 Å²	136	108.4 Å²	108.4	67%	0.67	58%	0.576	S	S	*	*	H	α-helix	trans	-66.6	-39	174.3	-74.3	-174.1	73	0	0	112.5	L18 L19 V20 K26	L18-M22 WeakPolarHBondContact O-CG 3.28Å; L18-M22 PolarHBondContact O-N 3.02Å; L19-M22 PolarHBondContact O-N 2.86Å; V20-M22 VanDerWaalsContact C-N 3.34Å; V20-M22 PolarHBondContact O-N 3.28Å; M22-K26 PolarHBondContact O-N 2.83Å
23	F	61.3	Low	57.5	Low	144 Å²	144	114 Å²	114	63%	0.632	60%	0.596	S	S	*	*	H	α-helix	trans	-69.5	-42.5	176.1	-98.8	-90	0	0	0	112.2	L19 V20 K26 F27	L19-F23 HydrophobicContact CD2-CD2 4.33Å; L19-F23 HydrophobicContact CD2-CE2 4.26Å; L19-F23 WeakPolarHBondContact O-CD2 3.38Å; L19-F23 PolarHBondContact O-N 2.81Å; V20-F23 PolarHBondContact O-N 3.38Å; F23-K26 PolarHBondContact O-N 3.38Å; F23-F27 PolarHBondContact O-N 2.92Å
24	V	65.8	Low	56.1	Low	72 Å²	72	120.5 Å²	120.5	44%	0.436	62%	0.617	S	S	.	*	H	α-helix	trans	-68	-39.4	178	174	0	0	0	0	111.1	V20 K26 F27 I28	V20-V24 HydrophobicContact CG1-CG2 4.12Å; V20-V24 WeakPolarHBondContact O-CB 3.46Å; V20-V24 VanDerWaalsContact O-CG2 3.24Å; V20-V24 WeakPolarHBondContact O-CG2 3.12Å; V20-V24 PolarHBondContact O-N 3.44Å; V24-K26 PolarHBondContact O-N 2.99Å; V24-F27 PolarHBondContact O-N 3.04Å; V24-I28 HydrophobicContact CG1-CD1 3.64Å; V24-I28 HydrophobicContact CG1-CG1 4.25Å; V24-I28 VanDerWaalsContact O-CG1 3.28Å; V24-I28 WeakPolarHBondContact O-CG1 3.15Å; V24-I28 PolarHBondContact O-N 3.4Å
25	S	57.4	Low	54.8	Low	80 Å²	80	119.9 Å²	119.9	56%	0.559	62%	0.624	S	S	*	*	H	α-helix	trans	-62.5	-41.6	174.8	178	0	0	0	0	112.6	L21 F27 I28 S29	L21-S25 WeakPolarHBondContact O-CB 3.35Å; L21-S25 PolarHBondContact O-N 3.48Å; S25-F27 VanDerWaalsContact C-N 3.33Å; S25-F27 PolarHBondContact O-N 3.29Å; S25-I28 PolarHBondContact O-N 3.41Å; S25-S29 WeakPolarHBondContact O-CB 3.32Å; S25-S29 PolarHBondContact O-N 3.32Å
26	K	48.7	Very low	52.8	Low	170 Å²	170	129.6 Å²	129.6	74%	0.739	65%	0.651	S	S	*	*	H	α-helix	trans	-65.2	-34.4	172.8	-87.8	-166.8	171.9	-175.6	0	113.1	M22 F23 V24 F30	M22-K26 PolarHBondContact O-N 2.83Å; F23-K26 PolarHBondContact O-N 3.38Å; V24-K26 PolarHBondContact O-N 2.99Å; K26-F30 PolarHBondContact O-N 2.83Å
27	F	45.3	Very low	50.8	Low	157 Å²	157	130.2 Å²	130.2	69%	0.689	66%	0.659	S	S	*	*	H	α-helix	trans	-74.5	-35.1	178.5	-125.6	-92	0	0	0	112.8	F23 V24 S25 F30	F23-F27 PolarHBondContact O-N 2.92Å; V24-F27 PolarHBondContact O-N 3.04Å; S25-F27 VanDerWaalsContact C-N 3.33Å; S25-F27 PolarHBondContact O-N 3.29Å; F27-F30 PolarHBondContact O-N 3.43Å
28	I	49.2	Very low	48.8	Very low	102 Å²	102	135.6 Å²	135.6	52%	0.523	68%	0.675	S	S	.	*	H	α-helix	trans	-71.8	-39.3	175.9	-65.9	168.2	0	0	0	110.6	V24 S25 F30 K31 T32	V24-I28 HydrophobicContact CG1-CD1 3.64Å; V24-I28 HydrophobicContact CG1-CG1 4.25Å; V24-I28 VanDerWaalsContact O-CG1 3.28Å; V24-I28 WeakPolarHBondContact O-CG1 3.15Å; V24-I28 PolarHBondContact O-N 3.4Å; S25-I28 PolarHBondContact O-N 3.41Å; I28-F30 PolarHBondContact O-N 3.33Å; I28-K31 PolarHBondContact O-N 2.93Å; I28-T32 PolarHBondContact O-N 3.5Å; I28-T32 PolarHBondContact O-OG1 3.43Å
29	S	43	Very low	46.7	Very low	77 Å²	77	141.8 Å²	141.8	54%	0.538	69%	0.691	S	S	.	*	H	α-helix	trans	-63.7	-22.7	175.4	-149.5	0	0	0	0	113.1	S25	S25-S29 WeakPolarHBondContact O-CB 3.32Å; S25-S29 PolarHBondContact O-N 3.32Å
30	F	38.8	Very low	44.7	Very low	186 Å²	186	142.8 Å²	142.8	82%	0.816	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-16.7	174.2	-140.7	-93.1	0	0	0	113.5	K26 F27 I28	K26-F30 PolarHBondContact O-N 2.83Å; F27-F30 PolarHBondContact O-N 3.43Å; I28-F30 PolarHBondContact O-N 3.33Å
31	K	36.6	Very low	42.3	Very low	175 Å²	175	143.8 Å²	143.8	76%	0.761	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-12	-179.9	-90.1	-171.2	173.6	-176.1	0	114.6	I28	I28-K31 PolarHBondContact O-N 2.93Å
32	T	34.9	Very low	40.2	Very low	106 Å²	106	146.5 Å²	146.5	65%	0.65	73%	0.73	S	S	*	*	S	Bend	trans	-101.2	13.1	-175.9	32.9	0	0	0	0	115.6	I28 E34	I28-T32 PolarHBondContact O-N 3.5Å; I28-T32 PolarHBondContact O-OG1 3.43Å; T32-E34 VanDerWaalsContact C-N 3.35Å
33	I	36	Very low	38.1	Very low	156 Å²	156	144.8 Å²	144.8	80%	0.8	73%	0.731	S	S	*	*			trans	-102.8	46.8	169.5	-45.5	178.3	0	0	0	110
34	E	36.5	Very low	36.2	Very low	189 Å²	189	148.4 Å²	148.4	88%	0.883	74%	0.74	S	S	*	*			trans	-118.9	94.1	159.9	-100.3	-172.5	162.4	0	0	107.3	T32	T32-E34 VanDerWaalsContact C-N 3.35Å
35	G	36.6	Very low	34.4	Very low	66 Å²	66	151 Å²	151	68%	0.68	76%	0.757	S	S	*	*			trans	140.6	83.9	171.1	0	0	0	0	0	113.5
36	Y	26.9	Very low	32.9	Very low	238 Å²	238	153.5 Å²	153.5	93%	0.933	77%	0.768	S	S	*	*			trans	-147.6	137.7	143	-124.6	-88.7	0	0	0	112
37	K	26.1	Very low	31.8	Very low	199 Å²	199	148.6 Å²	148.6	87%	0.865	77%	0.766	S	S	*	*			trans	-62.5	147.9	-167.3	-98.1	164	165.5	169.4	0	114.9
38	K	31.1	Very low	30.8	Very low	201 Å²	201	148.5 Å²	148.5	87%	0.874	77%	0.773	S	S	*	*			trans	-36.4	135.8	154.5	-85.7	172.8	167.5	173.6	0	114.2
39	R	25.4	Very low	29.7	Very low	242 Å²	242	149.5 Å²	149.5	91%	0.913	78%	0.784	S	S	*	*			trans	-171.8	163.4	132.9	-103.9	175.2	-169	-159.2	3.7	111.2
40	P	27.1	Very low	28.8	Very low	113 Å²	113	156 Å²	156	73%	0.734	80%	0.802	S	S	*	*				-86.5	154.9	-118.5	35.5	-37.1	0	0	0	115.1	Q42	P40-Q42 PolarHBondContact O-N 2.92Å
41	A	25.2	Very low	28.1	Very low	104 Å²	104	153.4 Å²	153.4	86%	0.86	80%	0.801	S	S	*	*			trans	-65.8	116.6	170.4	0	0	0	0	0	110.6
42	Q	23.9	Very low	27.5	Very low	164 Å²	164	149.7 Å²	149.7	77%	0.766	80%	0.803	S	S	*	*			trans	-90.2	112.2	160.5	-83.2	176.8	-22.8	0	0	108.4	P40	P40-Q42 PolarHBondContact O-N 2.92Å
43	S	25.1	Very low	27	Very low	99 Å²	99	154.2 Å²	154.2	69%	0.692	81%	0.814	S	S	*	*			trans	-73.7	120.5	172	171.3	0	0	0	0	109.6
44	W	21.9	Very low	26.4	Very low	221 Å²	221	155.2 Å²	155.2	84%	0.837	82%	0.82	S	S	*	*			trans	-129.8	95.1	163.9	-66.2	101.7	0	0	0	108.8
45	T	27.5	Very low	25.8	Very low	127 Å²	127	150.9 Å²	150.9	78%	0.779	82%	0.817	S	S	*	*			trans	-108	110.7	162.8	49	0	0	0	0	107.2
46	V	26.6	Very low	25.1	Very low	132 Å²	132	152.8 Å²	152.8	80%	0.8	82%	0.82	S	S	*	*			trans	-86.9	108.1	162.7	176.8	0	0	0	0	106.3
47	G	25.3	Very low	24.9	Very low	67 Å²	67	147.6 Å²	147.6	69%	0.691	81%	0.812	S	S	*	*			trans	-100.7	109.8	167.4	0	0	0	0	0	108.4	T49	G47-T49 PolarHBondContact O-N 3.46Å
48	D	23.8	Very low	25	Very low	155 Å²	155	143.2 Å²	143.2	83%	0.829	80%	0.804	S	S	*	*			trans	-83.9	103.6	163.2	-95.4	-28.8	0	0	0	108.4
49	T	25.9	Very low	24.7	Very low	123 Å²	123	139.1 Å²	139.1	76%	0.755	80%	0.801	S	S	*	*			trans	-141	111.3	156.3	-43.3	0	0	0	0	107.7	G47 V51	G47-T49 PolarHBondContact O-N 3.46Å; T49-V51 PolarHBondContact O-N 3.37Å; T49-V51 VanDerWaalsContact O-N 3.15Å
50	K	24.6	Very low	24.7	Very low	212 Å²	212	134.3 Å²	134.3	92%	0.922	80%	0.798	S	S	*	*			trans	-59.5	113.7	173.2	-73.6	179.8	174.6	178.6	0	109.1
51	V	23.5	Very low	24.7	Very low	133 Å²	133	136.9 Å²	136.9	81%	0.806	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-88.7	119.9	170.8	173.3	0	0	0	0	108.5	T49	T49-V51 PolarHBondContact O-N 3.37Å; T49-V51 VanDerWaalsContact O-N 3.15Å
52	A	24.4	Very low	24.7	Very low	97 Å²	97	141.8 Å²	141.8	80%	0.802	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-80.1	124.5	164.4	0	0	0	0	0	109.1
53	K	23.1	Very low	24.7	Very low	201 Å²	201	142.6 Å²	142.6	87%	0.874	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-64.1	136.2	175.7	-83.5	171.2	168.6	174.6	0	111
54	L	23.6	Very low	24.7	Very low	176 Å²	176	145.7 Å²	145.7	92%	0.921	82%	0.82	S	S	*	*			trans	-115	126.8	150.6	-117.7	88.2	0	0	0	109.1
55	A	24.1	Very low	24.8	Very low	99 Å²	99	143.6 Å²	143.6	82%	0.818	82%	0.819	S	S	*	*			trans	-79.9	157.3	177.9	0	0	0	0	0	111.4
56	S	21.5	Very low	24.7	Very low	106 Å²	106	143.8 Å²	143.8	74%	0.741	82%	0.82	S	S	*	*			trans	-88.6	172.8	-176.9	46	0	0	0	0	113.4
57	V	24.5	Very low	24.8	Very low	128 Å²	128	143.1 Å²	143.1	78%	0.776	82%	0.819	S	S	*	*			trans	102.4	142.3	155.7	-169.2	0	0	0	0	115.1
58	P	27.3	Very low	24.9	Very low	108 Å²	108	144.6 Å²	144.6	70%	0.701	82%	0.819	S	S	*	*			cis	-130.3	176.8	-37.5	36.2	-17.9	0	0	0	114.1
59	S	25.8	Very low	25.1	Very low	114 Å²	114	146.1 Å²	146.1	80%	0.797	82%	0.821	S	S	*	*			trans	-62.9	137.3	172	44.5	0	0	0	0	115
60	T	23.8	Very low	25.1	Very low	141 Å²	141	149.2 Å²	149.2	87%	0.865	83%	0.826	S	S	*	*			trans	-146.8	125.4	151.8	13.5	0	0	0	0	110.4
61	L	27.1	Very low	25.3	Very low	168 Å²	168	144.7 Å²	144.7	88%	0.88	82%	0.816	S	S	*	*			trans	-62.2	139.4	168.2	-85.8	123.5	0	0	0	110.6
62	K	25.2	Very low	25.5	Very low	207 Å²	207	149.6 Å²	149.6	90%	0.9	82%	0.82	S	S	*	*			trans	-157.8	123.1	141.8	-105.7	170.6	-167.8	-172.7	0	110.2
63	Q	25.3	Very low	25.6	Very low	180 Å²	180	150.9 Å²	150.9	84%	0.841	81%	0.813	S	S	*	*			trans	-60.8	144.8	166.3	-74.6	165.6	-39.5	0	0	109.9
64	N	23.7	Very low	25.8	Very low	164 Å²	164	146.4 Å²	146.4	88%	0.877	81%	0.807	S	S	*	*			trans	-160.3	146.4	141.2	-98.3	-12.6	0	0	0	111.4
65	Q	25.7	Very low	26.1	Very low	177 Å²	177	146.9 Å²	146.9	83%	0.827	80%	0.802	S	S	*	*			trans	-82.1	145.1	-164.2	-65.6	161.3	-13.8	0	0	112.8
66	T	23.6	Very low	26.3	Very low	131 Å²	131	150.5 Å²	150.5	80%	0.804	80%	0.803	S	S	*	*			trans	23.5	154	146.6	35.5	0	0	0	0	122.2
67	P	29.3	Very low	27.1	Very low	118 Å²	118	151 Å²	151	77%	0.766	80%	0.803	S	S	*	*			cis	-141.1	165.7	36.1	32.9	-9.3	0	0	0	119.2
68	S	26.8	Very low	27.7	Very low	99 Å²	99	150.6 Å²	150.6	69%	0.692	81%	0.806	S	S	*	*			trans	-29.9	127.2	169.1	52.1	0	0	0	0	118.8
69	H	28.3	Very low	28.4	Very low	187 Å²	187	152 Å²	152	87%	0.866	81%	0.812	S	S	*	*			trans	-126.3	109.7	144.2	-98.6	-73.1	0	0	0	109.2	V71	H69-V71 PolarHBondContact O-N 3.33Å
70	Q	26.9	Very low	29.3	Very low	187 Å²	187	150.4 Å²	150.4	87%	0.874	81%	0.806	S	S	*	*			trans	-72.1	109	171.2	-71.1	-167.8	-14.6	0	0	109.2
71	V	28.2	Very low	30.6	Very low	117 Å²	117	145.6 Å²	145.6	71%	0.709	78%	0.781	S	S	*	*			trans	-95.6	103.6	161.5	179.3	0	0	0	0	107	H69 N73	H69-V71 PolarHBondContact O-N 3.33Å; V71-N73 PolarHBondContact O-N 3.4Å
72	R	26.6	Very low	32.3	Very low	237 Å²	237	141.1 Å²	141.1	89%	0.894	76%	0.761	S	S	*	*			trans	-75.5	85.6	177.2	-163.4	-178.9	-158.5	-156.8	5.2	108.8	S74	R72-S74 PolarHBondContact O-N 3.08Å
73	N	26.9	Very low	34.2	Very low	123 Å²	123	133.9 Å²	133.9	66%	0.658	74%	0.739	S	S	*	*			trans	-80.5	96.3	169.1	-86.7	-7.7	0	0	0	109.5	V71 F75	V71-N73 PolarHBondContact O-N 3.4Å; N73-F75 VanDerWaalsContact C-N 3.32Å; N73-F75 HydrophobicContact CB-CD2 4.27Å; N73-F75 PolarHBondContact O-N 3.23Å
74	S	28.5	Very low	36.1	Very low	107 Å²	107	129.1 Å²	129.1	75%	0.748	73%	0.726	S	S	*	*			trans	-69.7	87.7	163.8	51.4	0	0	0	0	109.5	R72 Q76	R72-S74 PolarHBondContact O-N 3.08Å; S74-Q76 PolarHBondContact O-N 3.41Å
75	F	30.1	Very low	39	Very low	186 Å²	186	124.7 Å²	124.7	82%	0.816	70%	0.702	S	S	*	*			trans	-74.6	100.6	160.6	-94.1	-95.7	0	0	0	108	N73	N73-F75 VanDerWaalsContact C-N 3.32Å; N73-F75 HydrophobicContact CB-CD2 4.27Å; N73-F75 PolarHBondContact O-N 3.23Å
76	Q	27.8	Very low	42.2	Very low	176 Å²	176	117.8 Å²	117.8	82%	0.822	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-71.5	125.2	162.5	-82.5	176.6	-50.9	0	0	108.5	S74 S78	S74-Q76 PolarHBondContact O-N 3.41Å; Q76-S78 PolarHBondContact O-N 3.01Å
77	P	37.5	Very low	45.7	Very low	117 Å²	117	115.4 Å²	115.4	76%	0.76	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-64.8	133.7	168	-12.4	27.2	0	0	0	108.7	V79	P77-V79 PolarHBondContact O-N 2.94Å
78	S	37.7	Very low	48.8	Very low	119 Å²	119	116 Å²	116	83%	0.832	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-52.4	122.1	170	54.6	0	0	0	0	109.3	Q76 A80	Q76-S78 PolarHBondContact O-N 3.01Å; S78-A80 PolarHBondContact O-N 3Å; S78-A80 VanDerWaalsContact O-N 3.13Å
79	V	40.9	Very low	52.2	Low	137 Å²	137	113.6 Å²	113.6	83%	0.83	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-52.5	118	179.2	-178.4	0	0	0	0	108.8	P77 A81	P77-V79 PolarHBondContact O-N 2.94Å; V79-A81 PolarHBondContact O-N 3.05Å
80	A	46.4	Very low	55.5	Low	81 Å²	81	104.9 Å²	104.9	67%	0.669	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-60.7	120.3	170.5	0	0	0	0	0	107.6	S78 T82	S78-A80 PolarHBondContact O-N 3Å; S78-A80 VanDerWaalsContact O-N 3.13Å; A80-T82 PolarHBondContact O-N 3.29Å
81	A	51.2	Low	58.9	Low	40 Å²	40	100.3 Å²	100.3	33%	0.331	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-52.9	130.1	176.4	0	0	0	0	0	109.1	V79 D85 W86	V79-A81 PolarHBondContact O-N 3.05Å; A81-D85 HydrophobicContact CB-CB 4.21Å; A81-W86 HydrophobicContact CB-CE3 4.21Å
82	T	62	Low	62.2	Low	74 Å²	74	98 Å²	98	45%	0.454	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-68.5	162.1	178.9	69.3	0	0	0	0	109.8	A80 S84 D85 W86	A80-T82 PolarHBondContact O-N 3.29Å; T82-S84 PolarHBondContact O-N 3.41Å; T82-S84 VanDerWaalsContact O-N 3.16Å; T82-D85 PolarHBondContact N-OD2 3.43Å; T82-D85 PolarHBondContact O-N 3.23Å; T82-D85 VanDerWaalsContact O-N 3.07Å; T82-D85 PolarHBondContact OG1-OD1 3Å; T82-D85 PolarHBondContact OG1-OD2 3.45Å; T82-W86 PolarHBondContact O-N 2.92Å
83	A	64	Low	65.7	Low	55 Å²	55	88.5 Å²	88.5	46%	0.455	51%	0.514	S	S	.	.	H	α-helix	trans	-59.4	-26	177.8	0	0	0	0	0	113.1
84	S	66.5	Low	69.1	Low	80 Å²	80	84.8 Å²	84.8	56%	0.559	49%	0.494	S	S	*	.	H	α-helix	trans	-67.5	-43	174.3	-166.2	0	0	0	0	111.5	T82 W86 Q87	T82-S84 PolarHBondContact O-N 3.41Å; T82-S84 VanDerWaalsContact O-N 3.16Å; S84-W86 VanDerWaalsContact C-N 3.26Å; S84-W86 PolarHBondContact O-N 2.93Å; S84-Q87 WeakPolarHBondContact O-CB 3.34Å; S84-Q87 PolarHBondContact O-N 3.36Å
85	D	83.2	Confident	72.4	Confident	71 Å²	71	86.2 Å²	86.2	38%	0.38	49%	0.489	S	S	.	.	H	α-helix	trans	-65.9	-30.6	-175.6	-52.3	-28.3	0	0	0	112	A81 T82	A81-D85 HydrophobicContact CB-CB 4.21Å; T82-D85 PolarHBondContact N-OD2 3.43Å; T82-D85 PolarHBondContact O-N 3.23Å; T82-D85 VanDerWaalsContact O-N 3.07Å; T82-D85 PolarHBondContact OG1-OD1 3Å; T82-D85 PolarHBondContact OG1-OD2 3.45Å
86	W	94.1	Very high	75.7	Confident	32 Å²	32	80.8 Å²	80.8	12%	0.121	47%	0.466	C	S	.	.	H	α-helix	trans	-82.7	-18.6	-179.7	-142.7	-98.9	0	0	0	114.1	A81 T82 S84 V89 S90 T299 H302 D303 F306	A81-W86 HydrophobicContact CB-CE3 4.21Å; T82-W86 PolarHBondContact O-N 2.92Å; S84-W86 VanDerWaalsContact C-N 3.26Å; S84-W86 PolarHBondContact O-N 2.93Å; W86-V89 HydrophobicContact CD2-CB 4.38Å; W86-V89 HydrophobicContact CD2-CG2 4.48Å; W86-V89 HydrophobicContact CE3-CG2 4.23Å; W86-V89 HydrophobicContact CZ2-CG1 4.16Å; W86-V89 HydrophobicContact CZ3-CG2 4.39Å; W86-V89 PolarHBondContact O-N 3.3Å; W86-S90 PolarHBondContact O-N 2.77Å; W86-T299 HydrophobicContact CH2-CG2 4Å; W86-T299 HydrophobicContact CZ2-CG2 4.16Å; W86-H302 HydrophobicContact CD2-CB 3.64Å; W86-H302 HydrophobicContact CE3-CB 3.92Å; W86-H302 HydrophobicContact CG-CB 4.36Å; W86-H302 HydrophobicContact CH2-CB 3.66Å; W86-H302 AromaticContact CH2-CG 3.89Å; W86-H302 HydrophobicContact CZ2-CB 3.38Å; W86-H302 HydrophobicContact CZ3-CB 3.92Å; W86-H302 AromaticContact CZ3-CG 3.93Å; W86-D303 PolarHBondContact NE1-OD1 2.89Å; W86-F306 HydrophobicContact CB-CB 4.47Å; W86-F306 HydrophobicContact CB-CD2 4.02Å; W86-F306 HydrophobicContact CB-CG 4.42Å; W86-F306 VanDerWaalsContact CD1-CB 3.47Å; W86-F306 AromaticContact CD1-CG 3.66Å; W86-F306 HydrophobicContact CG-CB 4.23Å; W86-F306 HydrophobicContact CG-CD2 4.49Å; W86-F306 HydrophobicContact CG-CG 4.41Å
87	Q	95.8	Very high	79.1	Confident	81 Å²	81	72.9 Å²	72.9	38%	0.379	43%	0.429	S	S	.	.	H	α-helix	trans	-61.9	-48.8	171.9	-178.2	67.3	30.4	0	0	109.9	S84 V89 S90 E91 F306	S84-Q87 WeakPolarHBondContact O-CB 3.34Å; S84-Q87 PolarHBondContact O-N 3.36Å; Q87-V89 VanDerWaalsContact C-N 3.31Å; Q87-V89 PolarHBondContact O-N 3.03Å; Q87-S90 PolarHBondContact O-N 3.43Å; Q87-S90 VanDerWaalsContact O-N 3.09Å; Q87-E91 HydrophobicContact CG-CG 4.5Å; Q87-E91 WeakPolarHBondContact CG-OE1 3.24Å; Q87-E91 PolarHBondContact NE2-OE1 3.36Å; Q87-E91 WeakPolarHBondContact O-CG 3.43Å; Q87-E91 PolarHBondContact O-N 3.48Å; Q87-F306 HydrophobicContact CB-CE2 4.14Å; Q87-F306 VanDerWaalsContact OE1-CE2 3.23Å
88	E	96.4	Very high	82	Confident	130 Å²	130	69.6 Å²	69.6	61%	0.607	41%	0.409	S	S	*	.	H	α-helix	trans	-59.3	-41.3	178.7	-63.7	-179.6	-176.5	0	0	111.9	S90 E91 S92	E88-S90 PolarHBondContact O-N 2.89Å; E88-E91 PolarHBondContact O-N 3.09Å; E88-S92 VanDerWaalsContact O-CB 3.26Å; E88-S92 WeakPolarHBondContact O-CB 3.33Å; E88-S92 PolarHBondContact O-N 3.36Å
89	V	97.3	Very high	84.9	Confident	48 Å²	48	66.8 Å²	66.8	29%	0.291	39%	0.393	S	S	.	.	H	α-helix	trans	-61.7	-43.9	175.5	175.2	0	0	0	0	111.2	W86 Q87 R93	W86-V89 HydrophobicContact CD2-CB 4.38Å; W86-V89 HydrophobicContact CD2-CG2 4.48Å; W86-V89 HydrophobicContact CE3-CG2 4.23Å; W86-V89 HydrophobicContact CZ2-CG1 4.16Å; W86-V89 HydrophobicContact CZ3-CG2 4.39Å; W86-V89 PolarHBondContact O-N 3.3Å; Q87-V89 VanDerWaalsContact C-N 3.31Å; Q87-V89 PolarHBondContact O-N 3.03Å; V89-R93 VanDerWaalsContact O-CG 3.3Å; V89-R93 WeakPolarHBondContact O-CG 3.26Å; V89-R93 PolarHBondContact O-N 3.39Å
90	S	97.8	Very high	87.6	Confident	4 Å²	4	60.8 Å²	60.8	3%	0.028	36%	0.357	C	S	.	.	H	α-helix	trans	-66.4	-44	178.7	-174.5	0	0	0	0	111.9	W86 Q87 E88 R93 L94 F306	W86-S90 PolarHBondContact O-N 2.77Å; Q87-S90 PolarHBondContact O-N 3.43Å; Q87-S90 VanDerWaalsContact O-N 3.09Å; E88-S90 PolarHBondContact O-N 2.89Å; S90-R93 PolarHBondContact O-N 2.74Å; S90-L94 WeakPolarHBondContact O-CG 3.38Å; S90-L94 PolarHBondContact O-N 2.74Å; S90-L94 VanDerWaalsContact O-N 3.15Å; S90-F306 VanDerWaalsContact CB-CE1 3.44Å; S90-F306 WeakPolarHBondContact OG-CE1 3.34Å
91	E	97.9	Very high	90.1	Very high	91 Å²	91	57.9 Å²	57.9	43%	0.425	33%	0.331	S	S	.	.	H	α-helix	trans	-62.2	-48.7	177.8	-73.6	174	178.5	0	0	111.2	Q87 E88 R93 L94 E95	Q87-E91 HydrophobicContact CG-CG 4.5Å; Q87-E91 WeakPolarHBondContact CG-OE1 3.24Å; Q87-E91 PolarHBondContact NE2-OE1 3.36Å; Q87-E91 WeakPolarHBondContact O-CG 3.43Å; Q87-E91 PolarHBondContact O-N 3.48Å; E88-E91 PolarHBondContact O-N 3.09Å; E91-R93 VanDerWaalsContact C-N 3.26Å; E91-R93 PolarHBondContact O-N 3.48Å; E91-L94 PolarHBondContact O-N 3.07Å; E91-E95 WeakPolarHBondContact O-CG 3.3Å; E91-E95 PolarHBondContact O-N 3.18Å
92	S	98.3	Very high	92.4	Very high	70 Å²	70	63.9 Å²	63.9	49%	0.49	35%	0.35	S	S	.	.	H	α-helix	trans	-56.3	-39	177	-179.9	0	0	0	0	112.6	E88 E95 H96	E88-S92 VanDerWaalsContact O-CB 3.26Å; E88-S92 WeakPolarHBondContact O-CB 3.33Å; E88-S92 PolarHBondContact O-N 3.36Å; S92-E95 PolarHBondContact O-N 3.48Å; S92-H96 WeakPolarHBondContact O-CB 3.43Å; S92-H96 PolarHBondContact O-N 2.9Å
93	R	98.4	Very high	94.1	Very high	36 Å²	36	63.6 Å²	63.6	14%	0.136	35%	0.346	C	S	.	.	H	α-helix	trans	-66.7	-40.3	175.9	-73.2	171.9	-177.2	174.4	2.4	112.7	V89 S90 E91 L97 V294 T299 D303	V89-R93 VanDerWaalsContact O-CG 3.3Å; V89-R93 WeakPolarHBondContact O-CG 3.26Å; V89-R93 PolarHBondContact O-N 3.39Å; S90-R93 PolarHBondContact O-N 2.74Å; E91-R93 VanDerWaalsContact C-N 3.26Å; E91-R93 PolarHBondContact O-N 3.48Å; R93-L97 WeakPolarHBondContact O-CB 3.48Å; R93-L97 PolarHBondContact O-N 3.07Å; R93-V294 WeakPolarHBondContact CD-O 3.41Å; R93-V294 PolarHBondContact NH1-O 2.55Å; R93-T299 PolarHBondContact NH2-OG1 3.1Å; R93-D303 IonicContact CZ-OD1 2.8Å; R93-D303 IonicContact CZ-OD2 3.84Å; R93-D303 VanDerWaalsContact NH1-CG 3.3Å; R93-D303 IonicContact NH1-OD1 3.37Å; R93-D303 PolarHBondContact NH1-OD1 3.35Å; R93-D303 IonicContact NH1-OD2 3.78Å; R93-D303 PolarHBondContact NH1-OD2 2.9Å; R93-D303 VanDerWaalsContact NH1-OD2 3.16Å; R93-D303 IonicContact NH2-OD2 2.74Å
94	L	98.7	Very high	95.6	Very high	46 Å²	46	65.8 Å²	65.8	24%	0.241	36%	0.357	C	S	.	.	H	α-helix	trans	-69.9	-37.6	177.3	-67.3	173.4	0	0	0	111.7	S90 E91 L97 S98 Y291 S292 V294	S90-L94 WeakPolarHBondContact O-CG 3.38Å; S90-L94 PolarHBondContact O-N 2.74Å; S90-L94 VanDerWaalsContact O-N 3.15Å; E91-L94 PolarHBondContact O-N 3.07Å; L94-L97 PolarHBondContact O-N 3.26Å; L94-S98 WeakPolarHBondContact O-CB 3.48Å; L94-S98 PolarHBondContact O-N 3.35Å; L94-Y291 WeakPolarHBondContact CD2-O 3.33Å; L94-S292 WeakPolarHBondContact CD1-O 3.39Å; L94-V294 HydrophobicContact CD2-CG2 3.98Å
95	E	98.6	Very high	97.1	Very high	136 Å²	136	67 Å²	67	64%	0.636	37%	0.366	S	S	*	.	H	α-helix	trans	-62.3	-46.9	172.9	-72.7	-179.6	171.5	0	0	111.4	E91 S92 S98 A99	E91-E95 WeakPolarHBondContact O-CG 3.3Å; E91-E95 PolarHBondContact O-N 3.18Å; S92-E95 PolarHBondContact O-N 3.48Å; E95-S98 WeakPolarHBondContact O-CB 3.36Å; E95-S98 PolarHBondContact O-N 2.9Å; E95-A99 WeakPolarHBondContact O-CB 3.5Å; E95-A99 PolarHBondContact O-N 3.43Å
96	H	98.8	Very high	97.7	Very high	73 Å²	73	64.8 Å²	64.8	34%	0.338	35%	0.354	S	S	.	.	H	α-helix	trans	-58.7	-48.9	174.9	178.9	78.9	0	0	0	111.6	S92 S98 A99 V100 Q358 L359 G361	S92-H96 WeakPolarHBondContact O-CB 3.43Å; S92-H96 PolarHBondContact O-N 2.9Å; H96-S98 VanDerWaalsContact C-N 3.32Å; H96-S98 PolarHBondContact O-N 2.81Å; H96-A99 PolarHBondContact O-N 3.16Å; H96-V100 WeakPolarHBondContact O-CG2 3.3Å; H96-V100 PolarHBondContact O-N 3.02Å; H96-Q358 PolarHBondContact NE2-O 2.98Å; H96-L359 PolarHBondContact CD2-O 3.28Å; H96-G361 PolarHBondContact NE2-N 3.32Å
97	L	98.8	Very high	97.8	Very high	10 Å²	10	70.3 Å²	70.3	5%	0.052	38%	0.375	C	S	.	.	H	α-helix	trans	-56	-47.8	175.3	173.9	61.2	0	0	0	111.1	R93 L94 A99 V100 C101 P286 V294 L359 F360	R93-L97 WeakPolarHBondContact O-CB 3.48Å; R93-L97 PolarHBondContact O-N 3.07Å; L94-L97 PolarHBondContact O-N 3.26Å; L97-A99 VanDerWaalsContact C-N 3.34Å; L97-A99 PolarHBondContact O-N 3.39Å; L97-V100 PolarHBondContact O-N 3.06Å; L97-C101 WeakPolarHBondContact O-CB 3.35Å; L97-C101 PolarHBondContact O-N 3.02Å; L97-C101 PolarHBondContact O-SG 2.89Å; L97-P286 HydrophobicContact CD1-CB 4.12Å; L97-P286 HydrophobicContact CD1-CG 4.49Å; L97-P286 HydrophobicContact CD2-CB 4.25Å; L97-V294 HydrophobicContact CD2-CG2 4.08Å; L97-L359 HydrophobicContact CD1-CB 4.3Å; L97-L359 HydrophobicContact CD1-CD2 3.45Å; L97-L359 VanDerWaalsContact CD1-CD2 3.45Å; L97-L359 HydrophobicContact CD1-CG 4.47Å; L97-F360 HydrophobicContact CD1-CE1 4.4Å
98	S	98.6	Very high	97.8	Very high	47 Å²	47	73.7 Å²	73.7	33%	0.329	40%	0.396	S	S	.	.	H	α-helix	trans	-59.7	-43.5	177.9	-169.7	0	0	0	0	112	L94 E95 H96 C101 K102	L94-S98 WeakPolarHBondContact O-CB 3.48Å; L94-S98 PolarHBondContact O-N 3.35Å; E95-S98 WeakPolarHBondContact O-CB 3.36Å; E95-S98 PolarHBondContact O-N 2.9Å; H96-S98 VanDerWaalsContact C-N 3.32Å; H96-S98 PolarHBondContact O-N 2.81Å; S98-C101 PolarHBondContact O-N 2.87Å; S98-K102 VanDerWaalsContact O-CG 3.31Å; S98-K102 WeakPolarHBondContact O-CG 3.42Å; S98-K102 PolarHBondContact O-N 3.26Å; S98-K102 WeakPolarHBondContact OG-CE 3.23Å; S98-K102 PolarHBondContact OG-NZ 3.14Å
99	A	98.6	Very high	97.8	Very high	61 Å²	61	70.4 Å²	70.4	50%	0.504	38%	0.382	S	S	.	.	H	α-helix	trans	-62.8	-43.7	178.2	0	0	0	0	0	111.7	E95 H96 L97 K102 N103	E95-A99 WeakPolarHBondContact O-CB 3.5Å; E95-A99 PolarHBondContact O-N 3.43Å; H96-A99 PolarHBondContact O-N 3.16Å; L97-A99 VanDerWaalsContact C-N 3.34Å; L97-A99 PolarHBondContact O-N 3.39Å; A99-K102 PolarHBondContact O-N 3.14Å; A99-N103 PolarHBondContact O-N 3.43Å
100	V	98.6	Very high	97.8	Very high	11 Å²	11	68.1 Å²	68.1	7%	0.067	37%	0.368	C	S	.	.	H	α-helix	trans	-66.4	-41	177.1	173.9	0	0	0	0	111.6	H96 L97 K102 N103 L106 T110 Q358 L359	H96-V100 WeakPolarHBondContact O-CG2 3.3Å; H96-V100 PolarHBondContact O-N 3.02Å; L97-V100 PolarHBondContact O-N 3.06Å; V100-K102 VanDerWaalsContact C-N 3.3Å; V100-K102 PolarHBondContact O-N 3.39Å; V100-N103 WeakPolarHBondContact O-CB 3.14Å; V100-N103 PolarHBondContact O-N 3.27Å; V100-N103 VanDerWaalsContact O-N 3.16Å; V100-L106 HydrophobicContact CG1-CD1 3.91Å; V100-T110 HydrophobicContact CG1-CG2 4.05Å; V100-Q358 HydrophobicContact CG1-CB 4.23Å; V100-Q358 WeakPolarHBondContact CG2-O 3.26Å; V100-L359 HydrophobicContact CB-CD2 4.49Å; V100-L359 HydrophobicContact CG1-CD2 3.87Å; V100-L359 HydrophobicContact CG1-CG 4.22Å
101	C	98.6	Very high	97.8	Very high	19 Å²	19	70.2 Å²	70.2	13%	0.128	38%	0.377	C	S	.	.	H	α-helix	trans	-65.2	-31.7	175.7	-68.2	0	0	0	0	112.7	L97 S98 N103 H111 C287	L97-C101 WeakPolarHBondContact O-CB 3.35Å; L97-C101 PolarHBondContact O-N 3.02Å; L97-C101 PolarHBondContact O-SG 2.89Å; S98-C101 PolarHBondContact O-N 2.87Å; C101-N103 VanDerWaalsContact C-N 3.28Å; C101-N103 PolarHBondContact O-N 3.46Å; C101-H111 PolarHBondContact O-CE1 3.33Å; C101-H111 PolarHBondContact O-NE2 3.39Å; C101-C287 VanDerWaalsContact CA-SG 3.54Å; C101-C287 HydrophobicContact CB-CB 3.69Å; C101-C287 WeakPolarHBondContact CB-SG 3.12Å; C101-C287 WeakPolarHBondContact SG-CA 3.44Å; C101-C287 WeakPolarHBondContact SG-CB 3.47Å; C101-C287 CovalentContact SG-SG 2.04Å; C101-C287 PolarHBondContact SG-SG 3.29Å
102	K	98.4	Very high	97.8	Very high	166 Å²	166	67.8 Å²	67.8	72%	0.722	37%	0.368	S	S	*	.	H	α-helix	trans	-75.2	-15.1	175	-71.7	166.5	-177.1	164	0	113.5	S98 A99 V100 S104	S98-K102 VanDerWaalsContact O-CG 3.31Å; S98-K102 WeakPolarHBondContact O-CG 3.42Å; S98-K102 PolarHBondContact O-N 3.26Å; S98-K102 WeakPolarHBondContact OG-CE 3.23Å; S98-K102 PolarHBondContact OG-NZ 3.14Å; A99-K102 PolarHBondContact O-N 3.14Å; V100-K102 VanDerWaalsContact C-N 3.3Å; V100-K102 PolarHBondContact O-N 3.39Å; K102-S104 PolarHBondContact O-N 3.23Å; K102-S104 VanDerWaalsContact O-N 3.17Å
103	N	97.9	Very high	97.7	Very high	69 Å²	69	69.1 Å²	69.1	37%	0.369	38%	0.378	S	S	.	.			trans	-76.4	103.8	179.7	-172.7	-18.2	0	0	0	111.4	A99 V100 C101 S105 L106	A99-N103 PolarHBondContact O-N 3.43Å; V100-N103 WeakPolarHBondContact O-CB 3.14Å; V100-N103 PolarHBondContact O-N 3.27Å; V100-N103 VanDerWaalsContact O-N 3.16Å; C101-N103 VanDerWaalsContact C-N 3.28Å; C101-N103 PolarHBondContact O-N 3.46Å; N103-S105 PolarHBondContact O-N 3.06Å; N103-S105 VanDerWaalsContact O-N 3.15Å; N103-S105 WeakPolarHBondContact OD1-CB 3.29Å; N103-S105 PolarHBondContact OD1-N 2.93Å; N103-L106 HydrophobicContact CB-CD1 4.31Å; N103-L106 HydrophobicContact CB-CG 4.45Å; N103-L106 PolarHBondContact O-N 3.14Å
104	S	96.2	Very high	97.7	Very high	100 Å²	100	70.7 Å²	70.7	70%	0.699	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-58.2	-28.7	-179.2	58.4	0	0	0	0	114	K102 L106 R107	K102-S104 PolarHBondContact O-N 3.23Å; K102-S104 VanDerWaalsContact O-N 3.17Å; S104-L106 PolarHBondContact O-N 3.35Å; S104-R107 WeakPolarHBondContact O-CB 3.3Å; S104-R107 PolarHBondContact O-N 2.9Å
105	S	97.1	Very high	97.6	Very high	107 Å²	107	70.7 Å²	70.7	75%	0.748	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-69.2	-23.5	179.1	-57	0	0	0	0	112.6	N103	N103-S105 PolarHBondContact O-N 3.06Å; N103-S105 VanDerWaalsContact O-N 3.15Å; N103-S105 WeakPolarHBondContact OD1-CB 3.29Å; N103-S105 PolarHBondContact OD1-N 2.93Å
106	L	96.1	Very high	97.5	Very high	23 Å²	23	70.7 Å²	70.7	12%	0.12	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-97.4	-2.4	180	-64.1	178.6	0	0	0	113.2	V100 N103 S104 N108 L109 T110 Q358	V100-L106 HydrophobicContact CG1-CD1 3.91Å; N103-L106 HydrophobicContact CB-CD1 4.31Å; N103-L106 HydrophobicContact CB-CG 4.45Å; N103-L106 PolarHBondContact O-N 3.14Å; S104-L106 PolarHBondContact O-N 3.35Å; L106-N108 VanDerWaalsContact C-N 3.27Å; L106-N108 PolarHBondContact O-N 3.13Å; L106-N108 VanDerWaalsContact O-N 3.1Å; L106-L109 HydrophobicContact CD2-CD1 4.26Å; L106-L109 WeakPolarHBondContact O-CB 3.44Å; L106-L109 PolarHBondContact O-N 2.95Å; L106-T110 HydrophobicContact CB-CG2 4.1Å; L106-T110 PolarHBondContact O-N 3.15Å; L106-T110 PolarHBondContact O-OG1 3.13Å; L106-T110 VanDerWaalsContact O-OG1 3.07Å; L106-Q358 HydrophobicContact CD1-CB 4.24Å; L106-Q358 HydrophobicContact CD1-CG 4.36Å
107	R	96.8	Very high	97.4	Very high	148 Å²	148	70 Å²	70	56%	0.558	39%	0.386	S	S	*	.	H	α-helix	trans	-52.4	-41.1	-170	-168.3	-179.1	-174.7	-80.6	-3	113.8	S104 L109 T110 H111	S104-R107 WeakPolarHBondContact O-CB 3.3Å; S104-R107 PolarHBondContact O-N 2.9Å; R107-L109 PolarHBondContact O-N 3.48Å; R107-T110 PolarHBondContact O-N 3.19Å; R107-H111 HydrophobicContact CG-CB 4.15Å; R107-H111 WeakPolarHBondContact O-CB 3.32Å; R107-H111 PolarHBondContact O-N 3.09Å
108	N	96.4	Very high	97.3	Very high	153 Å²	153	69.6 Å²	69.6	82%	0.818	38%	0.384	S	S	*	.	H	α-helix	trans	-68	-17.4	-179.8	-69.5	-18.4	0	0	0	114	L106	L106-N108 VanDerWaalsContact C-N 3.27Å; L106-N108 PolarHBondContact O-N 3.13Å; L106-N108 VanDerWaalsContact O-N 3.1Å
109	L	96.3	Very high	97.3	Very high	60 Å²	60	68.3 Å²	68.3	31%	0.314	37%	0.373	S	S	.	.	H	α-helix	trans	-100.7	-20.2	-179.9	-58.1	175.9	0	0	0	112.4	L106 R107 Q354	L106-L109 HydrophobicContact CD2-CD1 4.26Å; L106-L109 WeakPolarHBondContact O-CB 3.44Å; L106-L109 PolarHBondContact O-N 2.95Å; R107-L109 PolarHBondContact O-N 3.48Å; L109-Q354 HydrophobicContact CD1-CB 4.15Å; L109-Q354 HydrophobicContact CD1-CG 4.02Å
110	T	97.4	Very high	97.2	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-116.7	-26.6	-167.3	57.8	0	0	0	0	114.3	V100 L106 R107 L359	V100-T110 HydrophobicContact CG1-CG2 4.05Å; L106-T110 HydrophobicContact CB-CG2 4.1Å; L106-T110 PolarHBondContact O-N 3.15Å; L106-T110 PolarHBondContact O-OG1 3.13Å; L106-T110 VanDerWaalsContact O-OG1 3.07Å; R107-T110 PolarHBondContact O-N 3.19Å; T110-L359 HydrophobicContact CG2-CD1 4.07Å; T110-L359 HydrophobicContact CG2-CD2 3.86Å; T110-L359 HydrophobicContact CG2-CG 3.77Å
111	H	97.9	Very high	97.1	Very high	49 Å²	49	65.9 Å²	65.9	23%	0.227	35%	0.351	C	S	.	.			trans	-103.7	135.2	-176.6	-63.8	62.3	0	0	0	111.9	C101 R107 E288	C101-H111 PolarHBondContact O-CE1 3.33Å; C101-H111 PolarHBondContact O-NE2 3.39Å; R107-H111 HydrophobicContact CG-CB 4.15Å; R107-H111 WeakPolarHBondContact O-CB 3.32Å; R107-H111 PolarHBondContact O-N 3.09Å; H111-E288 WeakPolarHBondContact CA-OE1 3.44Å; H111-E288 WeakPolarHBondContact CB-OE1 3.46Å; H111-E288 IonicContact CD2-OE1 3.49Å; H111-E288 IonicContact CD2-OE2 4Å; H111-E288 PolarHBondContact CD2-OE2 2.81Å; H111-E288 IonicContact CG-OE1 2.86Å; H111-E288 IonicContact CG-OE2 3.34Å; H111-E288 IonicContact NE2-OE2 3.71Å
112	V	97.1	Very high	97.1	Very high	39 Å²	39	65.2 Å²	65.2	24%	0.236	35%	0.346	C	S	.	.			trans	-141.2	149.1	173.9	-59	0	0	0	0	109.9	A281 E282 A285 E288	V112-A281 HydrophobicContact CG1-CB 4.34Å; V112-A281 WeakPolarHBondContact CG2-O 3.37Å; V112-E282 HydrophobicContact CG1-CG 4.27Å; V112-A285 HydrophobicContact CG2-CB 3.69Å; V112-E288 PolarHBondContact N-OE1 2.94Å; V112-E288 WeakPolarHBondContact O-CG 3.5Å
113	S	97.1	Very high	97.1	Very high	98 Å²	98	57.3 Å²	57.3	69%	0.685	31%	0.312	S	S	*	.			trans	-66.4	142.2	174	57.1	0	0	0	0	111.4	S115	S113-S115 VanDerWaalsContact C-N 3.31Å; S113-S115 PolarHBondContact O-N 3.28Å
114	I	97.6	Very high	97.1	Very high	69 Å²	69	54 Å²	54	35%	0.354	29%	0.294	S	S	.	.			trans	-67.8	93.4	170.9	-57	177.3	0	0	0	108	L119 A285 E288 I289	I114-L119 HydrophobicContact CG2-CD1 4.25Å; I114-L119 HydrophobicContact CG2-CD2 3.58Å; I114-L119 HydrophobicContact CG2-CG 3.78Å; I114-A285 HydrophobicContact CG1-CB 4.39Å; I114-E288 HydrophobicContact CD1-CB 4.04Å; I114-E288 HydrophobicContact CG1-CB 3.88Å; I114-I289 HydrophobicContact CD1-CD1 4.28Å; I114-I289 HydrophobicContact CD1-CG1 3.72Å; I114-I289 HydrophobicContact CG1-CG1 4.27Å
115	S	96.8	Very high	97.2	Very high	46 Å²	46	49.3 Å²	49.3	32%	0.322	26%	0.261	S	S	.	.			trans	-96.2	168.8	179.9	66.9	0	0	0	0	111.4	S113 F117 V118 L119	S113-S115 VanDerWaalsContact C-N 3.31Å; S113-S115 PolarHBondContact O-N 3.28Å; S115-F117 PolarHBondContact O-N 3.29Å; S115-F117 VanDerWaalsContact O-N 3.16Å; S115-F117 PolarHBondContact OG-N 3.04Å; S115-V118 PolarHBondContact O-N 3.25Å; S115-V118 PolarHBondContact OG-N 3.27Å; S115-L119 WeakPolarHBondContact O-CG 3.39Å; S115-L119 PolarHBondContact O-N 3.36Å
116	K	96.6	Very high	97.1	Very high	136 Å²	136	47.2 Å²	47.2	59%	0.591	24%	0.241	S	C	*	.	H	α-helix	trans	-52.6	-36.8	170.4	-172.5	-175.1	179.6	-63.6	0	111.7	V118 L119 D120	K116-V118 PolarHBondContact O-N 3Å; K116-L119 PolarHBondContact O-N 2.93Å; K116-D120 IonicContact NZ-OD1 3.27Å; K116-D120 PolarHBondContact NZ-OD1 3.04Å; K116-D120 IonicContact NZ-OD2 3.86Å; K116-D120 PolarHBondContact NZ-OD2 3.24Å; K116-D120 WeakPolarHBondContact O-CB 3.19Å; K116-D120 PolarHBondContact O-N 2.87Å
117	F	95.7	Very high	97.1	Very high	60 Å²	60	52.3 Å²	52.3	26%	0.263	26%	0.263	S	S	.	.	H	α-helix	trans	-60.9	-44.7	177.8	-178.9	-94.1	0	0	0	112.2	S115 D120 R121 I275 V278 L283	S115-F117 PolarHBondContact O-N 3.29Å; S115-F117 VanDerWaalsContact O-N 3.16Å; S115-F117 PolarHBondContact OG-N 3.04Å; F117-D120 PolarHBondContact O-N 3.34Å; F117-R121 WeakPolarHBondContact O-CG 3.35Å; F117-I275 HydrophobicContact CE2-CG2 4.08Å; F117-I275 HydrophobicContact CZ-CG2 3.87Å; F117-V278 HydrophobicContact CE1-CG1 4.32Å; F117-V278 HydrophobicContact CZ-CG2 4.43Å; F117-L283 HydrophobicContact CE1-CD2 4.27Å; F117-L283 HydrophobicContact CZ-CD2 4.49Å
118	V	97.8	Very high	97.1	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-63.4	-49	175.3	174.4	0	0	0	0	110.1	S115 K116 D120 R121 A285 I289	S115-V118 PolarHBondContact O-N 3.25Å; S115-V118 PolarHBondContact OG-N 3.27Å; K116-V118 PolarHBondContact O-N 3Å; V118-D120 VanDerWaalsContact C-N 3.29Å; V118-D120 PolarHBondContact O-N 2.92Å; V118-R121 WeakPolarHBondContact O-CB 3.38Å; V118-R121 PolarHBondContact O-N 3.23Å; V118-A285 HydrophobicContact CG1-CB 3.99Å; V118-A285 HydrophobicContact CG2-CB 4.41Å; V118-I289 HydrophobicContact CG1-CD1 4.28Å
119	L	98.3	Very high	97.1	Very high	20 Å²	20	48.3 Å²	48.3	11%	0.105	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-34	-178.9	-64.2	172.9	0	0	0	112.7	I114 S115 K116 R121 I122 L176 S177 I184	I114-L119 HydrophobicContact CG2-CD1 4.25Å; I114-L119 HydrophobicContact CG2-CD2 3.58Å; I114-L119 HydrophobicContact CG2-CG 3.78Å; S115-L119 WeakPolarHBondContact O-CG 3.39Å; S115-L119 PolarHBondContact O-N 3.36Å; K116-L119 PolarHBondContact O-N 2.93Å; L119-R121 PolarHBondContact O-N 3.15Å; L119-I122 PolarHBondContact O-N 2.8Å; L119-L176 HydrophobicContact CD2-CD2 3.77Å; L119-L176 HydrophobicContact CD2-CG 4.15Å; L119-L176 PolarHBondContact O-N 3.49Å; L119-S177 PolarHBondContact O-N 3.49Å; L119-I184 HydrophobicContact CD1-CD1 4.18Å; L119-I184 HydrophobicContact CD2-CG2 4.05Å
120	D	96.6	Very high	97.2	Very high	16 Å²	16	45.5 Å²	45.5	9%	0.086	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.8	173.8	-73.4	-39.6	0	0	0	111.9	K116 F117 V118 R175 S177	K116-D120 IonicContact NZ-OD1 3.27Å; K116-D120 PolarHBondContact NZ-OD1 3.04Å; K116-D120 IonicContact NZ-OD2 3.86Å; K116-D120 PolarHBondContact NZ-OD2 3.24Å; K116-D120 WeakPolarHBondContact O-CB 3.19Å; K116-D120 PolarHBondContact O-N 2.87Å; F117-D120 PolarHBondContact O-N 3.34Å; V118-D120 VanDerWaalsContact C-N 3.29Å; V118-D120 PolarHBondContact O-N 2.92Å; D120-R175 WeakPolarHBondContact O-CD 3.32Å; D120-R175 PolarHBondContact O-NH1 2.85Å; D120-S177 WeakPolarHBondContact CA-OG 3.39Å; D120-S177 WeakPolarHBondContact OD1-CB 3.47Å; D120-S177 PolarHBondContact OD1-OG 3.31Å
121	R	96.9	Very high	97.3	Very high	5 Å²	5	45.6 Å²	45.6	2%	0.019	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-10.6	176.9	-59.7	-51.1	88.1	113.9	-8.1	112.7	F117 V118 L119 Q134 E272 L283	F117-R121 WeakPolarHBondContact O-CG 3.35Å; V118-R121 WeakPolarHBondContact O-CB 3.38Å; V118-R121 PolarHBondContact O-N 3.23Å; L119-R121 PolarHBondContact O-N 3.15Å; R121-Q134 HydrophobicContact CB-CB 4.26Å; R121-Q134 VanDerWaalsContact O-CB 3.22Å; R121-Q134 WeakPolarHBondContact O-CB 3.42Å; R121-Q134 PolarHBondContact O-N 2.98Å; R121-E272 IonicContact CZ-OE1 3.4Å; R121-E272 IonicContact NH1-OE1 3.12Å; R121-E272 PolarHBondContact NH1-OE1 2.9Å; R121-E272 IonicContact NH2-OE1 2.79Å; R121-E272 PolarHBondContact NH2-OE1 3.48Å; R121-L283 HydrophobicContact CG-CD2 4.24Å
122	I	98.5	Very high	97.3	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.021	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	115.6	-179	-59.3	169.8	0	0	0	108.9	L119 L131 F132 C133 R175 L176 I289	L119-I122 PolarHBondContact O-N 2.8Å; I122-L131 HydrophobicContact CG2-CB 3.84Å; I122-L131 HydrophobicContact CG2-CD1 4.4Å; I122-L131 HydrophobicContact CG2-CD2 3.96Å; I122-L131 HydrophobicContact CG2-CG 4.28Å; I122-F132 WeakPolarHBondContact CA-O 3.36Å; I122-C133 HydrophobicContact CG1-CB 4.07Å; I122-R175 CarbonylContact O-C 3.52Å; I122-R175 WeakPolarHBondContact O-CA 3.49Å; I122-L176 HydrophobicContact CB-CB 3.89Å; I122-L176 HydrophobicContact CB-CD2 4.16Å; I122-L176 HydrophobicContact CD1-CD2 3.98Å; I122-L176 HydrophobicContact CG2-CB 4.05Å; I122-L176 HydrophobicContact CG2-CD2 3.94Å; I122-L176 PolarHBondContact O-N 3.45Å; I122-I289 HydrophobicContact CD1-CD1 3.68Å
123	F	98.1	Very high	97.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	142.8	173.1	-66.2	-65.2	0	0	0	111.1	L131 F132 Q134 K144 L147 L173 P174 R175	F123-L131 WeakPolarHBondContact O-CA 3.49Å; F123-F132 AromaticContact CD2-CD1 3.95Å; F123-F132 HydrophobicContact CD2-CD1 3.95Å; F123-F132 HydrophobicContact CD2-CE1 4.36Å; F123-F132 PolarHBondContact N-O 3.08Å; F123-F132 PolarHBondContact O-N 2.74Å; F123-Q134 HydrophobicContact CD2-CB 4.34Å; F123-Q134 HydrophobicContact CE2-CB 3.75Å; F123-Q134 HydrophobicContact CE2-CG 4.34Å; F123-K144 HydrophobicContact CE2-CD 4.28Å; F123-K144 HydrophobicContact CE2-CG 4.18Å; F123-L147 HydrophobicContact CB-CD2 3.66Å; F123-L173 HydrophobicContact CD1-CB 3.68Å; F123-L173 HydrophobicContact CD1-CD1 4.41Å; F123-L173 HydrophobicContact CE1-CB 4.08Å; F123-L173 HydrophobicContact CG-CB 4.41Å; F123-P174 WeakPolarHBondContact CA-O 3.27Å; F123-R175 HydrophobicContact CD1-CG 4.29Å; F123-R175 HydrophobicContact CE1-CG 4.03Å
124	V	97.9	Very high	97.4	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.9	-174.9	-171.5	0	0	0	0	110.6	D126 L131 P174 L176 F179 Y191	V124-D126 WeakPolarHBondContact CG1-OD1 3.16Å; V124-L131 HydrophobicContact CB-CD2 4.17Å; V124-L131 HydrophobicContact CG1-CD2 4.05Å; V124-L131 HydrophobicContact CG2-CD2 3.74Å; V124-P174 HydrophobicContact CB-CB 4.36Å; V124-P174 PolarHBondContact N-O 3.3Å; V124-L176 HydrophobicContact CG2-CB 3.91Å; V124-L176 HydrophobicContact CG2-CD1 3.88Å; V124-F179 HydrophobicContact CB-CE2 4.03Å; V124-F179 HydrophobicContact CB-CZ 4.32Å; V124-F179 HydrophobicContact CG1-CE2 4.23Å; V124-F179 HydrophobicContact CG1-CZ 4.16Å; V124-F179 HydrophobicContact CG2-CD2 4.32Å; V124-F179 HydrophobicContact CG2-CE2 3.7Å; V124-F179 HydrophobicContact CG2-CZ 4.43Å; V124-Y191 HydrophobicContact CG1-CE2 4.17Å
125	C	97.1	Very high	97.4	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	85.5	169	179.4	0	0	0	0	108.7	K127 R128 Q129 I130 N151	C125-K127 VanDerWaalsContact C-N 3.28Å; C125-K127 PolarHBondContact O-N 2.68Å; C125-R128 CarbonylContact O-C 3.54Å; C125-R128 PolarHBondContact O-N 3.12Å; C125-Q129 WeakPolarHBondContact O-CA 3.25Å; C125-Q129 PolarHBondContact O-N 2.83Å; C125-I130 HydrophobicContact CB-CB 4.17Å; C125-I130 PolarHBondContact N-O 3.17Å; C125-I130 PolarHBondContact O-N 3.41Å; C125-N151 PolarHBondContact SG-OD1 2.86Å
126	D	96.6	Very high	97.4	Very high	63 Å²	63	32 Å²	32	34%	0.337	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-61	-36.1	-178.2	-74	-13.9	0	0	0	112	V124 R128 Q129 R187 Y191	V124-D126 WeakPolarHBondContact CG1-OD1 3.16Å; D126-R128 PolarHBondContact O-N 3.27Å; D126-Q129 PolarHBondContact O-N 2.97Å; D126-Q129 VanDerWaalsContact O-N 3.14Å; D126-R187 IonicContact OD1-CZ 2.92Å; D126-R187 IonicContact OD1-NE 3.05Å; D126-R187 PolarHBondContact OD1-NE 3.43Å; D126-R187 IonicContact OD1-NH2 3.87Å; D126-R187 PolarHBondContact OD1-NH2 2.92Å; D126-R187 IonicContact OD2-CZ 2.62Å; D126-R187 IonicContact OD2-NE 2.56Å; D126-R187 IonicContact OD2-NH2 2.84Å; D126-R187 PolarHBondContact OD2-NH2 2.79Å; D126-Y191 VanDerWaalsContact OD1-CE2 3.25Å; D126-Y191 WeakPolarHBondContact OD1-CE2 3.48Å; D126-Y191 PolarHBondContact OD1-OH 3.39Å
127	K	94.9	Very high	97.4	Very high	130 Å²	130	27.3 Å²	27.3	57%	0.565	12%	0.123	S	C	*	.	G	3₁₀ helix	trans	-56.8	-23.2	179	-72	-172.3	179.2	176.8	0	114.2	C125 N151	C125-K127 VanDerWaalsContact C-N 3.28Å; C125-K127 PolarHBondContact O-N 2.68Å; K127-N151 PolarHBondContact NZ-O 2.94Å
128	R	96.5	Very high	97.4	Very high	108 Å²	108	24.5 Å²	24.5	41%	0.408	11%	0.111	S	C	.	.	G	3₁₀ helix	trans	-126.9	4.9	-178.5	-54.3	-63	172.7	-130.6	11.3	112.6	C125 D126 I130 L150 I313	C125-R128 CarbonylContact O-C 3.54Å; C125-R128 PolarHBondContact O-N 3.12Å; D126-R128 PolarHBondContact O-N 3.27Å; R128-I130 VanDerWaalsContact C-N 3.34Å; R128-I130 HydrophobicContact CB-CD1 3.79Å; R128-I130 HydrophobicContact CB-CG1 4.14Å; R128-I130 PolarHBondContact O-N 2.73Å; R128-L150 HydrophobicContact CG-CB 4.28Å; R128-L150 HydrophobicContact CG-CD2 4.2Å; R128-I313 HydrophobicContact CB-CG2 4.13Å; R128-I313 HydrophobicContact CG-CG2 4.13Å
129	Q	97.6	Very high	97.2	Very high	109 Å²	109	25.5 Å²	25.5	51%	0.509	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	48.9	-176.1	-57.8	-178.9	-90.2	0	0	113	C125 D126 Y191 F192	C125-Q129 WeakPolarHBondContact O-CA 3.25Å; C125-Q129 PolarHBondContact O-N 2.83Å; D126-Q129 PolarHBondContact O-N 2.97Å; D126-Q129 VanDerWaalsContact O-N 3.14Å; Q129-Y191 VanDerWaalsContact C-CG 3.48Å; Q129-Y191 HydrophobicContact CB-CD1 3.69Å; Q129-Y191 HydrophobicContact CB-CD2 4.22Å; Q129-Y191 HydrophobicContact CB-CE1 3.82Å; Q129-Y191 HydrophobicContact CB-CE2 4.31Å; Q129-Y191 HydrophobicContact CB-CG 3.91Å; Q129-Y191 HydrophobicContact CG-CD1 4.14Å; Q129-Y191 HydrophobicContact CG-CE1 3.77Å; Q129-Y191 CarbonylContact O-C 3.35Å; Q129-Y191 WeakPolarHBondContact O-CA 3.5Å; Q129-Y191 WeakPolarHBondContact O-CB 3.24Å; Q129-F192 PolarHBondContact O-N 3.33Å
130	I	98.5	Very high	96.9	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	138.5	-178.5	-68.6	167.6	0	0	0	110.9	C125 R128 L150 F192 F194 A311 I313	C125-I130 HydrophobicContact CB-CB 4.17Å; C125-I130 PolarHBondContact N-O 3.17Å; C125-I130 PolarHBondContact O-N 3.41Å; R128-I130 VanDerWaalsContact C-N 3.34Å; R128-I130 HydrophobicContact CB-CD1 3.79Å; R128-I130 HydrophobicContact CB-CG1 4.14Å; R128-I130 PolarHBondContact O-N 2.73Å; I130-L150 HydrophobicContact CD1-CD1 4.16Å; I130-F192 CarbonylContact C-O 3.6Å; I130-F192 WeakPolarHBondContact CA-O 3.46Å; I130-F192 HydrophobicContact CG1-CB 4.47Å; I130-F194 HydrophobicContact CG2-CD1 4.29Å; I130-F194 HydrophobicContact CG2-CE1 3.75Å; I130-A311 HydrophobicContact CD1-CB 4.09Å; I130-A311 HydrophobicContact CG1-CB 4.45Å; I130-I313 HydrophobicContact CD1-CD1 3.62Å; I130-I313 HydrophobicContact CD1-CG1 4.38Å; I130-I313 HydrophobicContact CD1-CG2 4.03Å
131	L	98.8	Very high	96.8	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.01	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.1	166.1	-63.9	-179.2	0	0	0	109.8	I122 F123 V124 L176 R187 L188 Y191 F192 K193 F194	I122-L131 HydrophobicContact CG2-CB 3.84Å; I122-L131 HydrophobicContact CG2-CD1 4.4Å; I122-L131 HydrophobicContact CG2-CD2 3.96Å; I122-L131 HydrophobicContact CG2-CG 4.28Å; F123-L131 WeakPolarHBondContact O-CA 3.49Å; V124-L131 HydrophobicContact CB-CD2 4.17Å; V124-L131 HydrophobicContact CG1-CD2 4.05Å; V124-L131 HydrophobicContact CG2-CD2 3.74Å; L131-L176 HydrophobicContact CD1-CD2 4.38Å; L131-L176 HydrophobicContact CD2-CD1 4.25Å; L131-R187 HydrophobicContact CD1-CB 4.28Å; L131-R187 HydrophobicContact CD2-CB 4.46Å; L131-L188 HydrophobicContact CD1-CD2 4.05Å; L131-Y191 HydrophobicContact CD2-CD2 4Å; L131-Y191 HydrophobicContact CG-CD2 3.96Å; L131-Y191 HydrophobicContact CG-CG 4.3Å; L131-F192 PolarHBondContact N-O 3.46Å; L131-K193 HydrophobicContact CB-CG 3.74Å; L131-K193 HydrophobicContact CD1-CD 4.16Å; L131-K193 HydrophobicContact CD1-CG 3.77Å; L131-K193 HydrophobicContact CG-CG 4.21Å; L131-K193 WeakPolarHBondContact O-CA 3.39Å; L131-F194 PolarHBondContact O-N 3.05Å
132	F	98.7	Very high	96.7	Very high	1 Å²	1	28.4 Å²	28.4	0%	0.004	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	114.8	176.4	168.2	-123.4	0	0	0	110	I122 F123 W143 L147 F194	I122-F132 WeakPolarHBondContact CA-O 3.36Å; F123-F132 AromaticContact CD2-CD1 3.95Å; F123-F132 HydrophobicContact CD2-CD1 3.95Å; F123-F132 HydrophobicContact CD2-CE1 4.36Å; F123-F132 PolarHBondContact N-O 3.08Å; F123-F132 PolarHBondContact O-N 2.74Å; F132-W143 HydrophobicContact CD1-CB 4.13Å; F132-W143 HydrophobicContact CD2-CB 4.49Å; F132-W143 HydrophobicContact CE1-CB 3.54Å; F132-W143 HydrophobicContact CE1-CG 4.48Å; F132-W143 HydrophobicContact CE2-CB 3.94Å; F132-W143 HydrophobicContact CE2-CG 4.04Å; F132-W143 HydrophobicContact CZ-CB 3.43Å; F132-W143 VanDerWaalsContact CZ-CB 3.43Å; F132-W143 AromaticContact CZ-CG 3.97Å; F132-W143 HydrophobicContact CZ-CG 3.97Å; F132-L147 HydrophobicContact CB-CD1 4.07Å; F132-L147 HydrophobicContact CB-CD2 3.81Å; F132-L147 HydrophobicContact CD1-CD1 4.26Å; F132-L147 HydrophobicContact CD1-CD2 4.32Å; F132-L147 HydrophobicContact CG-CD1 4.33Å; F132-F194 WeakPolarHBondContact CA-O 3.44Å; F132-F194 HydrophobicContact CB-CE1 4.02Å; F132-F194 HydrophobicContact CB-CZ 3.98Å; F132-F194 AromaticContact CD2-CD2 3.96Å; F132-F194 HydrophobicContact CD2-CD2 3.96Å; F132-F194 HydrophobicContact CD2-CE1 4.3Å; F132-F194 AromaticContact CD2-CE2 3.41Å; F132-F194 HydrophobicContact CD2-CE2 3.41Å; F132-F194 VanDerWaalsContact CD2-CE2 3.41Å; F132-F194 AromaticContact CD2-CZ 3.61Å; F132-F194 HydrophobicContact CD2-CZ 3.61Å; F132-F194 HydrophobicContact CE2-CD2 4.48Å; F132-F194 AromaticContact CE2-CE2 3.91Å; F132-F194 HydrophobicContact CE2-CE2 3.91Å; F132-F194 HydrophobicContact CE2-CZ 4.43Å; F132-F194 HydrophobicContact CG-CE1 4.5Å; F132-F194 HydrophobicContact CG-CE2 4.24Å; F132-F194 AromaticContact CG-CZ 3.98Å; F132-F194 HydrophobicContact CG-CZ 3.98Å
133	C	98.7	Very high	96.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	123.7	173.9	-170.4	0	0	0	0	111.4	I122 T135 F194 F195 C284 Y291	I122-C133 HydrophobicContact CG1-CB 4.07Å; C133-T135 PolarHBondContact O-N 2.75Å; C133-F194 PolarHBondContact N-O 2.68Å; C133-F195 HydrophobicContact CB-CB 3.91Å; C133-F195 WeakPolarHBondContact O-CB 3.47Å; C133-C284 HydrophobicContact CB-CB 3.93Å; C133-C284 WeakPolarHBondContact CB-SG 3.41Å; C133-C284 WeakPolarHBondContact SG-CA 3.43Å; C133-C284 WeakPolarHBondContact SG-CB 3.11Å; C133-C284 CovalentContact SG-SG 2.04Å; C133-C284 PolarHBondContact SG-SG 3.35Å; C133-Y291 HydrophobicContact CB-CE1 4.07Å
134	Q	96.9	Very high	96.6	Very high	12 Å²	12	28.3 Å²	28.3	6%	0.056	14%	0.136	C	C	.	.			trans	-70	112.2	179.1	172.3	161.7	27.6	0	0	111.6	R121 F123 N140	R121-Q134 HydrophobicContact CB-CB 4.26Å; R121-Q134 VanDerWaalsContact O-CB 3.22Å; R121-Q134 WeakPolarHBondContact O-CB 3.42Å; R121-Q134 PolarHBondContact O-N 2.98Å; F123-Q134 HydrophobicContact CD2-CB 4.34Å; F123-Q134 HydrophobicContact CE2-CB 3.75Å; F123-Q134 HydrophobicContact CE2-CG 4.34Å; Q134-N140 VanDerWaalsContact CG-OD1 3.25Å; Q134-N140 WeakPolarHBondContact CG-OD1 3.44Å; Q134-N140 PolarHBondContact NE2-ND2 3.35Å
135	T	97.6	Very high	96.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.141	C	C	.	.			trans	-114.5	116.6	167.9	45.7	0	0	0	0	109.9	C133 V138 N140 F195 I196 Y280	C133-T135 PolarHBondContact O-N 2.75Å; T135-V138 WeakPolarHBondContact O-CG2 3.36Å; T135-V138 WeakPolarHBondContact OG1-CG2 3.37Å; T135-N140 VanDerWaalsContact O-CB 3.27Å; T135-N140 WeakPolarHBondContact O-CB 3.19Å; T135-F195 HydrophobicContact CG2-CD2 3.9Å; T135-I196 VanDerWaalsContact CB-O 3.3Å; T135-I196 WeakPolarHBondContact CB-O 3.5Å; T135-I196 WeakPolarHBondContact CG2-O 3.46Å; T135-I196 PolarHBondContact OG1-O 3.22Å; T135-Y280 HydrophobicContact CG2-CD1 3.56Å; T135-Y280 HydrophobicContact CG2-CE1 3.66Å
136	P	96.9	Very high	96.5	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.026	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	151.6	-179.9	-25.7	37.4	0	0	0	113.5	V138 I275 H276	P136-V138 VanDerWaalsContact C-N 3.34Å; P136-V138 PolarHBondContact O-N 3.36Å; P136-I275 HydrophobicContact CG-CB 4.45Å; P136-I275 HydrophobicContact CG-CD1 4.45Å; P136-I275 HydrophobicContact CG-CG1 4.39Å; P136-I275 WeakPolarHBondContact CG-O 3.32Å; P136-H276 HydrophobicContact CB-CB 4.41Å; P136-H276 WeakPolarHBondContact CB-ND1 3.16Å
137	K	95.9	Very high	96.5	Very high	37 Å²	37	26.6 Å²	26.6	16%	0.161	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	23.3	172.6	-45.1	-52.7	176	-161	0	116	R203 A207 D210	K137-R203 HydrophobicContact CB-CG 4.19Å; K137-A207 HydrophobicContact CG-CB 4.08Å; K137-D210 IonicContact NZ-OD1 2.72Å; K137-D210 IonicContact NZ-OD2 3.89Å; K137-D210 PolarHBondContact NZ-OD2 3.2Å
138	V	96.4	Very high	96.5	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.006	10%	0.099	C	C	.	.	S	Bend	trans	-132.9	34.5	179	-55.5	0	0	0	0	113.2	T135 P136 I196 R198 H297	T135-V138 WeakPolarHBondContact O-CG2 3.36Å; T135-V138 WeakPolarHBondContact OG1-CG2 3.37Å; P136-V138 VanDerWaalsContact C-N 3.34Å; P136-V138 PolarHBondContact O-N 3.36Å; V138-I196 HydrophobicContact CB-CB 4.24Å; V138-I196 HydrophobicContact CB-CG2 3.91Å; V138-I196 HydrophobicContact CG2-CB 3.83Å; V138-I196 HydrophobicContact CG2-CG2 4.08Å; V138-I196 WeakPolarHBondContact CG2-O 3.42Å; V138-R198 HydrophobicContact CB-CB 4.46Å; V138-R198 HydrophobicContact CG1-CB 3.35Å; V138-R198 HydrophobicContact CG1-CG 4.46Å; V138-H297 VanDerWaalsContact CA-CD2 3.47Å; V138-H297 WeakPolarHBondContact CA-CD2 3.48Å; V138-H297 HydrophobicContact CB-CB 4.25Å; V138-H297 HydrophobicContact CG1-CB 4.42Å
139	G	92.8	Very high	96.4	Very high	21 Å²	21	16.3 Å²	16.3	22%	0.216	9%	0.085	C	C	.	.	S	Bend	trans	86.1	13.3	-177.5	0	0	0	0	0	115	T141 Q142 W143 Y319	G139-T141 VanDerWaalsContact C-N 3.35Å; G139-T141 PolarHBondContact O-N 3.06Å; G139-Q142 PolarHBondContact O-N 2.92Å; G139-W143 PolarHBondContact O-N 3.49Å; G139-W143 VanDerWaalsContact O-N 3.14Å; G139-Y319 PolarHBondContact O-OH 2.87Å
140	N	93.6	Very high	96.3	Very high	12 Å²	12	11.5 Å²	11.5	6%	0.064	6%	0.063	C	C	.	.	H	α-helix	trans	-55.7	-38.6	-177.5	171.6	75.2	0	0	0	115.3	Q134 T135 Q142 W143 K144	Q134-N140 VanDerWaalsContact CG-OD1 3.25Å; Q134-N140 WeakPolarHBondContact CG-OD1 3.44Å; Q134-N140 PolarHBondContact NE2-ND2 3.35Å; T135-N140 VanDerWaalsContact O-CB 3.27Å; T135-N140 WeakPolarHBondContact O-CB 3.19Å; N140-Q142 VanDerWaalsContact C-N 3.26Å; N140-Q142 PolarHBondContact O-N 3.34Å; N140-W143 PolarHBondContact O-N 2.98Å; N140-K144 WeakPolarHBondContact O-CG 3.47Å; N140-K144 PolarHBondContact O-N 3.02Å
141	T	93.6	Very high	95.9	Very high	30 Å²	30	13 Å²	13	18%	0.184	7%	0.071	C	C	.	.	H	α-helix	trans	-60.7	-39.2	176.9	-57.9	0	0	0	0	111.2	G139 K144 K145 E162 V165 H166	G139-T141 VanDerWaalsContact C-N 3.35Å; G139-T141 PolarHBondContact O-N 3.06Å; T141-K144 PolarHBondContact O-N 3.34Å; T141-K145 WeakPolarHBondContact O-CG 3.1Å; T141-K145 PolarHBondContact O-N 3.12Å; T141-K145 VanDerWaalsContact O-N 3.13Å; T141-E162 HydrophobicContact CG2-CG 4.46Å; T141-V165 HydrophobicContact CG2-CB 4.34Å; T141-V165 HydrophobicContact CG2-CG1 3.92Å; T141-H166 PolarHBondContact OG1-CE1 3.26Å; T141-H166 PolarHBondContact OG1-NE2 3.26Å; T141-H166 VanDerWaalsContact OG1-NE2 3.13Å
142	Q	95.4	Very high	95.3	Very high	61 Å²	61	15.7 Å²	15.7	29%	0.285	10%	0.099	S	C	.	.	H	α-helix	trans	-73	-40.1	179.9	-53.2	-48.8	-33.6	0	0	111.7	G139 N140 K144 K145 V146 Y319 P320	G139-Q142 PolarHBondContact O-N 2.92Å; N140-Q142 VanDerWaalsContact C-N 3.26Å; N140-Q142 PolarHBondContact O-N 3.34Å; Q142-K144 VanDerWaalsContact C-N 3.32Å; Q142-K144 PolarHBondContact O-N 2.66Å; Q142-K145 WeakPolarHBondContact O-CB 3.38Å; Q142-K145 PolarHBondContact O-N 2.98Å; Q142-K145 VanDerWaalsContact O-N 3.14Å; Q142-V146 PolarHBondContact O-N 3.28Å; Q142-Y319 HydrophobicContact CB-CE1 4.17Å; Q142-Y319 HydrophobicContact CB-CE2 3.83Å; Q142-Y319 WeakPolarHBondContact CB-OH 3.4Å; Q142-P320 HydrophobicContact CB-CG 3.99Å; Q142-P320 HydrophobicContact CG-CG 4.36Å; Q142-P320 VanDerWaalsContact OE1-CG 3.3Å
143	W	97.1	Very high	94.6	Very high	1 Å²	1	18 Å²	18	0%	0.004	12%	0.123	C	C	.	.	H	α-helix	trans	-62.7	-38	173.2	-80.9	116.5	0	0	0	112.9	F132 G139 N140 K145 V146 L147 F194 I196 A304 I307 L308 Y319	F132-W143 HydrophobicContact CD1-CB 4.13Å; F132-W143 HydrophobicContact CD2-CB 4.49Å; F132-W143 HydrophobicContact CE1-CB 3.54Å; F132-W143 HydrophobicContact CE1-CG 4.48Å; F132-W143 HydrophobicContact CE2-CB 3.94Å; F132-W143 HydrophobicContact CE2-CG 4.04Å; F132-W143 HydrophobicContact CZ-CB 3.43Å; F132-W143 VanDerWaalsContact CZ-CB 3.43Å; F132-W143 AromaticContact CZ-CG 3.97Å; F132-W143 HydrophobicContact CZ-CG 3.97Å; G139-W143 PolarHBondContact O-N 3.49Å; G139-W143 VanDerWaalsContact O-N 3.14Å; N140-W143 PolarHBondContact O-N 2.98Å; W143-K145 VanDerWaalsContact C-N 3.33Å; W143-K145 PolarHBondContact O-N 3.24Å; W143-V146 HydrophobicContact CE3-CB 4.23Å; W143-V146 HydrophobicContact CE3-CG1 4.27Å; W143-V146 HydrophobicContact CE3-CG2 4.37Å; W143-V146 HydrophobicContact CZ3-CG1 4.28Å; W143-V146 WeakPolarHBondContact O-CB 3.34Å; W143-V146 PolarHBondContact O-N 2.83Å; W143-L147 WeakPolarHBondContact O-CD1 3.28Å; W143-L147 PolarHBondContact O-N 2.99Å; W143-F194 AromaticContact CD2-CE2 3.62Å; W143-F194 HydrophobicContact CD2-CE2 3.62Å; W143-F194 AromaticContact CD2-CZ 3.91Å; W143-F194 HydrophobicContact CD2-CZ 3.91Å; W143-F194 AromaticContact CE2-CE2 3.73Å; W143-F194 AromaticContact CE3-CE2 3.66Å; W143-F194 HydrophobicContact CE3-CE2 3.66Å; W143-F194 AromaticContact CE3-CZ 3.47Å; W143-F194 HydrophobicContact CE3-CZ 3.47Å; W143-F194 VanDerWaalsContact CE3-CZ 3.47Å; W143-F194 HydrophobicContact CG-CE2 4.26Å; W143-F194 AromaticContact CH2-CE2 3.94Å; W143-F194 HydrophobicContact CH2-CE2 3.94Å; W143-F194 HydrophobicContact CH2-CZ 4.16Å; W143-F194 AromaticContact CZ2-CE2 3.89Å; W143-F194 HydrophobicContact CZ2-CE2 3.89Å; W143-F194 AromaticContact CZ3-CE2 3.82Å; W143-F194 HydrophobicContact CZ3-CE2 3.82Å; W143-F194 AromaticContact CZ3-CZ 3.61Å; W143-F194 HydrophobicContact CZ3-CZ 3.61Å; W143-I196 HydrophobicContact CZ2-CD1 4.37Å; W143-I196 VanDerWaalsContact NE1-CG1 3.34Å; W143-A304 HydrophobicContact CH2-CB 4.22Å; W143-A304 HydrophobicContact CZ2-CB 3.82Å; W143-I307 HydrophobicContact CH2-CB 3.85Å; W143-I307 HydrophobicContact CH2-CD1 4.22Å; W143-I307 HydrophobicContact CH2-CG2 3.5Å; W143-I307 VanDerWaalsContact CH2-CG2 3.5Å; W143-I307 HydrophobicContact CZ2-CB 4.32Å; W143-I307 HydrophobicContact CZ2-CD1 3.83Å; W143-I307 HydrophobicContact CZ2-CG2 4.21Å; W143-I307 HydrophobicContact CZ3-CG2 4.05Å; W143-L308 HydrophobicContact CH2-CD2 4.44Å; W143-L308 HydrophobicContact CH2-CG 4.46Å; W143-L308 HydrophobicContact CZ3-CD2 4.1Å; W143-Y319 AromaticContact CD1-CE2 3.78Å; W143-Y319 HydrophobicContact CD2-CD2 4.04Å; W143-Y319 AromaticContact CD2-CE2 3.63Å; W143-Y319 HydrophobicContact CD2-CE2 3.63Å; W143-Y319 AromaticContact CE2-CD2 3.91Å; W143-Y319 AromaticContact CE2-CE2 3.5Å; W143-Y319 VanDerWaalsContact CE2-CE2 3.5Å; W143-Y319 HydrophobicContact CE3-CD2 4.22Å; W143-Y319 HydrophobicContact CE3-CE2 4.25Å; W143-Y319 AromaticContact CG-CE2 3.83Å; W143-Y319 HydrophobicContact CG-CE2 3.83Å; W143-Y319 HydrophobicContact CH2-CD2 4.2Å; W143-Y319 HydrophobicContact CZ2-CD2 4.02Å; W143-Y319 HydrophobicContact CZ2-CE2 4.03Å; W143-Y319 HydrophobicContact CZ3-CD2 4.3Å; W143-Y319 AromaticContact NE1-CE2 3.55Å
144	K	96.1	Very high	94.3	Very high	1 Å²	1	20.8 Å²	20.8	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-59.4	-43.9	171.4	-74.6	-179.5	170.7	-167	0	112	F123 N140 T141 Q142 V146 L147 I148 V165 L173	F123-K144 HydrophobicContact CE2-CD 4.28Å; F123-K144 HydrophobicContact CE2-CG 4.18Å; N140-K144 WeakPolarHBondContact O-CG 3.47Å; N140-K144 PolarHBondContact O-N 3.02Å; T141-K144 PolarHBondContact O-N 3.34Å; Q142-K144 VanDerWaalsContact C-N 3.32Å; Q142-K144 PolarHBondContact O-N 2.66Å; K144-V146 VanDerWaalsContact C-N 3.32Å; K144-V146 PolarHBondContact O-N 3Å; K144-L147 PolarHBondContact O-N 3.38Å; K144-I148 VanDerWaalsContact O-CG1 3.24Å; K144-I148 WeakPolarHBondContact O-CG1 3.5Å; K144-I148 PolarHBondContact O-N 2.81Å; K144-V165 HydrophobicContact CB-CG1 3.47Å; K144-V165 VanDerWaalsContact CB-CG1 3.47Å; K144-V165 HydrophobicContact CD-CG1 3.77Å; K144-V165 HydrophobicContact CG-CG1 4.29Å; K144-L173 HydrophobicContact CB-CD1 3.82Å; K144-L173 HydrophobicContact CD-CD1 4.31Å; K144-L173 HydrophobicContact CG-CD1 3.85Å
145	K	96.4	Very high	94	Very high	25 Å²	25	25 Å²	25	11%	0.109	16%	0.164	C	C	.	.	H	α-helix	trans	-57.4	-44.8	174.8	-73.5	179.9	160.5	-140.8	0	111.9	T141 Q142 W143 L147 I148 V149 V157 I160 V165	T141-K145 WeakPolarHBondContact O-CG 3.1Å; T141-K145 PolarHBondContact O-N 3.12Å; T141-K145 VanDerWaalsContact O-N 3.13Å; Q142-K145 WeakPolarHBondContact O-CB 3.38Å; Q142-K145 PolarHBondContact O-N 2.98Å; Q142-K145 VanDerWaalsContact O-N 3.14Å; W143-K145 VanDerWaalsContact C-N 3.33Å; W143-K145 PolarHBondContact O-N 3.24Å; K145-L147 PolarHBondContact O-N 3.43Å; K145-I148 PolarHBondContact O-N 3.36Å; K145-V149 WeakPolarHBondContact O-CG2 3.23Å; K145-V149 PolarHBondContact O-N 3.35Å; K145-V157 HydrophobicContact CB-CB 4.16Å; K145-V157 HydrophobicContact CB-CG1 4.15Å; K145-V157 WeakPolarHBondContact CD-O 3.35Å; K145-V157 PolarHBondContact NZ-O 3.18Å; K145-I160 HydrophobicContact CB-CD1 3.83Å; K145-I160 HydrophobicContact CD-CB 4.44Å; K145-I160 WeakPolarHBondContact CE-O 3.36Å; K145-I160 HydrophobicContact CG-CB 4.14Å; K145-I160 HydrophobicContact CG-CD1 4.03Å; K145-I160 HydrophobicContact CG-CG2 4.2Å; K145-I160 PolarHBondContact NZ-O 3.13Å; K145-I160 WeakPolarHBondContact O-CD1 3.45Å; K145-V165 HydrophobicContact CD-CG2 4.39Å; K145-V165 HydrophobicContact CG-CG2 3.66Å
146	V	96.8	Very high	93.7	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	17%	0.173	C	C	.	.	H	α-helix	trans	-56.2	-49.4	174.7	172.1	0	0	0	0	110.9	Q142 W143 K144 I148 V149 L150 V157 L308 V317 Y319	Q142-V146 PolarHBondContact O-N 3.28Å; W143-V146 HydrophobicContact CE3-CB 4.23Å; W143-V146 HydrophobicContact CE3-CG1 4.27Å; W143-V146 HydrophobicContact CE3-CG2 4.37Å; W143-V146 HydrophobicContact CZ3-CG1 4.28Å; W143-V146 WeakPolarHBondContact O-CB 3.34Å; W143-V146 PolarHBondContact O-N 2.83Å; K144-V146 VanDerWaalsContact C-N 3.32Å; K144-V146 PolarHBondContact O-N 3Å; V146-I148 VanDerWaalsContact C-N 3.34Å; V146-I148 PolarHBondContact O-N 3.07Å; V146-V149 PolarHBondContact O-N 3.38Å; V146-L150 HydrophobicContact CG1-CD1 4.07Å; V146-L150 HydrophobicContact CG1-CG 4.5Å; V146-L150 WeakPolarHBondContact O-CG 3.25Å; V146-L150 PolarHBondContact O-N 2.89Å; V146-V157 HydrophobicContact CG2-CG1 4.23Å; V146-L308 HydrophobicContact CG1-CD2 4.18Å; V146-V317 HydrophobicContact CB-CG2 4.49Å; V146-V317 HydrophobicContact CG1-CG1 3.77Å; V146-V317 HydrophobicContact CG1-CG2 4.08Å; V146-V317 HydrophobicContact CG2-CG2 4.4Å; V146-Y319 HydrophobicContact CG2-CD2 4.11Å
147	L	96.6	Very high	93.5	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-64.1	-36.6	179	-87	73.7	0	0	0	112.9	F123 F132 W143 K144 K145 L150 N151 L173	F123-L147 HydrophobicContact CB-CD2 3.66Å; F132-L147 HydrophobicContact CB-CD1 4.07Å; F132-L147 HydrophobicContact CB-CD2 3.81Å; F132-L147 HydrophobicContact CD1-CD1 4.26Å; F132-L147 HydrophobicContact CD1-CD2 4.32Å; F132-L147 HydrophobicContact CG-CD1 4.33Å; W143-L147 WeakPolarHBondContact O-CD1 3.28Å; W143-L147 PolarHBondContact O-N 2.99Å; K144-L147 PolarHBondContact O-N 3.38Å; K145-L147 PolarHBondContact O-N 3.43Å; L147-L150 PolarHBondContact O-N 3.27Å; L147-N151 WeakPolarHBondContact O-CB 3.41Å; L147-N151 PolarHBondContact O-N 2.8Å; L147-L173 HydrophobicContact CB-CD2 3.56Å; L147-L173 HydrophobicContact CD2-CD2 4.48Å
148	I	95.4	Very high	93.3	Very high	5 Å²	5	31.1 Å²	31.1	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-44.2	176.5	-69.8	169.4	0	0	0	110.8	K144 K145 V146 N151 G152 G153 F154 I160 V165 N171 L173	K144-I148 VanDerWaalsContact O-CG1 3.24Å; K144-I148 WeakPolarHBondContact O-CG1 3.5Å; K144-I148 PolarHBondContact O-N 2.81Å; K145-I148 PolarHBondContact O-N 3.36Å; V146-I148 VanDerWaalsContact C-N 3.34Å; V146-I148 PolarHBondContact O-N 3.07Å; I148-N151 PolarHBondContact O-N 3.44Å; I148-G152 PolarHBondContact O-N 3.21Å; I148-G153 PolarHBondContact O-N 3Å; I148-F154 HydrophobicContact CG2-CD2 3.52Å; I148-F154 HydrophobicContact CG2-CE2 4.15Å; I148-I160 HydrophobicContact CB-CD1 3.81Å; I148-I160 HydrophobicContact CD1-CG2 4.27Å; I148-I160 HydrophobicContact CG2-CD1 3.65Å; I148-I160 HydrophobicContact CG2-CG1 4.33Å; I148-V165 HydrophobicContact CD1-CG2 4.45Å; I148-N171 HydrophobicContact CD1-CB 4.22Å; I148-N171 WeakPolarHBondContact CG1-O 3.4Å; I148-L173 HydrophobicContact CD1-CD1 4.21Å; I148-L173 HydrophobicContact CD1-CG 4.43Å; I148-L173 HydrophobicContact CG1-CD1 3.94Å; I148-L173 HydrophobicContact CG1-CD2 3.78Å; I148-L173 HydrophobicContact CG1-CG 3.77Å
149	V	95.4	Very high	93.1	Very high	17 Å²	17	36.4 Å²	36.4	10%	0.103	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-46.1	174.5	173.3	0	0	0	0	110.7	K145 V146 N151 G152 F154 S156 V157 I160 V317	K145-V149 WeakPolarHBondContact O-CG2 3.23Å; K145-V149 PolarHBondContact O-N 3.35Å; V146-V149 PolarHBondContact O-N 3.38Å; V149-N151 VanDerWaalsContact C-N 3.25Å; V149-N151 PolarHBondContact O-N 3.17Å; V149-G152 WeakPolarHBondContact O-CA 3.35Å; V149-G152 PolarHBondContact O-N 3.38Å; V149-F154 HydrophobicContact CG2-CB 4.46Å; V149-S156 VanDerWaalsContact CG2-C 3.47Å; V149-V157 HydrophobicContact CG2-CG1 3.74Å; V149-I160 HydrophobicContact CG2-CD1 3.87Å; V149-V317 HydrophobicContact CB-CG2 4.16Å; V149-V317 HydrophobicContact CG1-CB 4.37Å; V149-V317 HydrophobicContact CG1-CG2 3.96Å
150	L	94.2	Very high	93.1	Very high	9 Å²	9	35.5 Å²	35.5	5%	0.047	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-31.6	179	-69	175	0	0	0	113.4	R128 I130 V146 L147 G152 I313 L316 V317	R128-L150 HydrophobicContact CG-CB 4.28Å; R128-L150 HydrophobicContact CG-CD2 4.2Å; I130-L150 HydrophobicContact CD1-CD1 4.16Å; V146-L150 HydrophobicContact CG1-CD1 4.07Å; V146-L150 HydrophobicContact CG1-CG 4.5Å; V146-L150 WeakPolarHBondContact O-CG 3.25Å; V146-L150 PolarHBondContact O-N 2.89Å; L147-L150 PolarHBondContact O-N 3.27Å; L150-G152 PolarHBondContact O-N 3.26Å; L150-I313 HydrophobicContact CD1-CD1 3.58Å; L150-I313 HydrophobicContact CD2-CB 4.32Å; L150-I313 HydrophobicContact CD2-CD1 4.47Å; L150-I313 HydrophobicContact CD2-CG2 4.37Å; L150-L316 HydrophobicContact CD2-CB 4.26Å; L150-V317 HydrophobicContact CD1-CG1 4.31Å; L150-V317 HydrophobicContact CD2-CB 4.17Å; L150-V317 HydrophobicContact CD2-CG1 3.59Å; L150-V317 HydrophobicContact CG-CG1 3.97Å
151	N	90.4	Very high	92.9	Very high	33 Å²	33	37.8 Å²	37.8	18%	0.176	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-7.2	173.3	-76.8	-7.9	0	0	0	112.9	C125 K127 L147 I148 V149 G172	C125-N151 PolarHBondContact SG-OD1 2.86Å; K127-N151 PolarHBondContact NZ-O 2.94Å; L147-N151 WeakPolarHBondContact O-CB 3.41Å; L147-N151 PolarHBondContact O-N 2.8Å; I148-N151 PolarHBondContact O-N 3.44Å; V149-N151 VanDerWaalsContact C-N 3.25Å; V149-N151 PolarHBondContact O-N 3.17Å; N151-G172 PolarHBondContact ND2-O 3.45Å; N151-G172 VanDerWaalsContact ND2-O 3.09Å
152	G	87.4	Confident	92.5	Very high	57 Å²	57	42.5 Å²	42.5	59%	0.588	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.7	19.3	-179.2	0	0	0	0	0	113.6	I148 V149 L150	I148-G152 PolarHBondContact O-N 3.21Å; V149-G152 WeakPolarHBondContact O-CA 3.35Å; V149-G152 PolarHBondContact O-N 3.38Å; L150-G152 PolarHBondContact O-N 3.26Å
153	G	83.8	Confident	92.1	Very high	50 Å²	50	45.1 Å²	45.1	52%	0.515	26%	0.262	S	S	.	.	S	Bend	trans	-73.2	-30.2	177.6	0	0	0	0	0	112.9	I148	I148-G153 PolarHBondContact O-N 3Å
154	F	91.3	Very high	91.7	Very high	59 Å²	59	46.7 Å²	46.7	26%	0.259	27%	0.27	S	S	.	.			trans	-147.2	152.9	-177.9	-73.6	-97.4	0	0	0	110.4	I148 V149 E159 I160 L164	I148-F154 HydrophobicContact CG2-CD2 3.52Å; I148-F154 HydrophobicContact CG2-CE2 4.15Å; V149-F154 HydrophobicContact CG2-CB 4.46Å; F154-E159 HydrophobicContact CD1-CB 4.27Å; F154-I160 HydrophobicContact CB-CD1 4.19Å; F154-I160 HydrophobicContact CB-CG1 3.73Å; F154-I160 HydrophobicContact CD1-CG1 4.01Å; F154-I160 HydrophobicContact CD2-CD1 4.32Å; F154-I160 HydrophobicContact CD2-CG1 3.75Å; F154-I160 HydrophobicContact CE2-CG1 4.39Å; F154-I160 HydrophobicContact CG-CD1 4.34Å; F154-I160 HydrophobicContact CG-CG1 3.55Å; F154-L164 HydrophobicContact CE2-CD2 3.43Å; F154-L164 VanDerWaalsContact CE2-CD2 3.43Å; F154-L164 HydrophobicContact CZ-CD2 3.41Å; F154-L164 VanDerWaalsContact CZ-CD2 3.41Å
155	P	90.4	Very high	91.5	Very high	100 Å²	100	46.7 Å²	46.7	65%	0.649	27%	0.27	S	S	*	.	S	Bend	trans	-76.7	-26.7	179	31.5	-36.1	0	0	0	113.2	E159	P155-E159 WeakPolarHBondContact CG-OE1 3.03Å; P155-E159 WeakPolarHBondContact CG-OE2 3.14Å
156	S	92.1	Very high	91.1	Very high	27 Å²	27	49.5 Å²	49.5	19%	0.189	28%	0.283	C	S	.	.			trans	-145.7	162.9	-179.5	73	0	0	0	0	112.1	V149 E159	V149-S156 VanDerWaalsContact CG2-C 3.47Å; S156-E159 VanDerWaalsContact OG-CD 3.3Å; S156-E159 VanDerWaalsContact OG-CG 3.3Å; S156-E159 WeakPolarHBondContact OG-CG 3.44Å; S156-E159 PolarHBondContact OG-OE1 3.19Å
157	V	93.1	Very high	90.7	Very high	6 Å²	6	51.8 Å²	51.8	4%	0.036	30%	0.296	C	S	.	.	S	Bend	trans	-77.2	-25.3	-178.4	-66.5	0	0	0	0	112.3	K145 V146 V149 E159 V317 P320	K145-V157 HydrophobicContact CB-CB 4.16Å; K145-V157 HydrophobicContact CB-CG1 4.15Å; K145-V157 WeakPolarHBondContact CD-O 3.35Å; K145-V157 PolarHBondContact NZ-O 3.18Å; V146-V157 HydrophobicContact CG2-CG1 4.23Å; V149-V157 HydrophobicContact CG2-CG1 3.74Å; V157-E159 VanDerWaalsContact C-N 3.34Å; V157-V317 HydrophobicContact CG1-CG2 4.08Å; V157-P320 HydrophobicContact CB-CG 4.01Å; V157-P320 HydrophobicContact CG2-CB 4.36Å; V157-P320 HydrophobicContact CG2-CG 3.67Å
158	E	91.6	Very high	90.1	Very high	137 Å²	137	55.8 Å²	55.8	64%	0.64	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-34.6	177.9	-68.2	68.5	-150.4	0	0	111.6	I160	E158-I160 VanDerWaalsContact C-N 3.29Å; E158-I160 PolarHBondContact O-N 3.25Å
159	E	92.1	Very high	89.7	Confident	111 Å²	111	62.9 Å²	62.9	52%	0.519	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-12.2	-177.6	-73.2	170.3	-116.6	0	0	113.9	F154 P155 S156 V157 P161	F154-E159 HydrophobicContact CD1-CB 4.27Å; P155-E159 WeakPolarHBondContact CG-OE1 3.03Å; P155-E159 WeakPolarHBondContact CG-OE2 3.14Å; S156-E159 VanDerWaalsContact OG-CD 3.3Å; S156-E159 VanDerWaalsContact OG-CG 3.3Å; S156-E159 WeakPolarHBondContact OG-CG 3.44Å; S156-E159 PolarHBondContact OG-OE1 3.19Å; V157-E159 VanDerWaalsContact C-N 3.34Å; E159-P161 VanDerWaalsContact O-CD 3.28Å; E159-P161 WeakPolarHBondContact O-CD 3.47Å
160	I	91.9	Very high	89.4	Confident	3 Å²	3	69.2 Å²	69.2	2%	0.015	38%	0.378	C	S	.	.	S	Bend	trans	-79.9	118.9	-176.7	-57.1	172.1	0	0	0	110.6	K145 I148 V149 F154 E158 V165	K145-I160 HydrophobicContact CB-CD1 3.83Å; K145-I160 HydrophobicContact CD-CB 4.44Å; K145-I160 WeakPolarHBondContact CE-O 3.36Å; K145-I160 HydrophobicContact CG-CB 4.14Å; K145-I160 HydrophobicContact CG-CD1 4.03Å; K145-I160 HydrophobicContact CG-CG2 4.2Å; K145-I160 PolarHBondContact NZ-O 3.13Å; K145-I160 WeakPolarHBondContact O-CD1 3.45Å; I148-I160 HydrophobicContact CB-CD1 3.81Å; I148-I160 HydrophobicContact CD1-CG2 4.27Å; I148-I160 HydrophobicContact CG2-CD1 3.65Å; I148-I160 HydrophobicContact CG2-CG1 4.33Å; V149-I160 HydrophobicContact CG2-CD1 3.87Å; F154-I160 HydrophobicContact CB-CD1 4.19Å; F154-I160 HydrophobicContact CB-CG1 3.73Å; F154-I160 HydrophobicContact CD1-CG1 4.01Å; F154-I160 HydrophobicContact CD2-CD1 4.32Å; F154-I160 HydrophobicContact CD2-CG1 3.75Å; F154-I160 HydrophobicContact CE2-CG1 4.39Å; F154-I160 HydrophobicContact CG-CD1 4.34Å; F154-I160 HydrophobicContact CG-CG1 3.55Å; E158-I160 VanDerWaalsContact C-N 3.29Å; E158-I160 PolarHBondContact O-N 3.25Å; I160-V165 HydrophobicContact CG2-CG2 3.57Å
161	P	90.6	Very high	89.2	Confident	59 Å²	59	69.1 Å²	69.1	38%	0.383	38%	0.378	S	S	.	.			trans	-63.6	134.8	174.8	-20.6	33.7	0	0	0	111.7	E159 N163 L164 V165	E159-P161 VanDerWaalsContact O-CD 3.28Å; E159-P161 WeakPolarHBondContact O-CD 3.47Å; P161-N163 VanDerWaalsContact C-N 3.29Å; P161-N163 VanDerWaalsContact CB-OD1 3.23Å; P161-N163 WeakPolarHBondContact CB-OD1 3.49Å; P161-N163 PolarHBondContact O-N 2.87Å; P161-L164 HydrophobicContact CB-CB 4.22Å; P161-L164 WeakPolarHBondContact O-CB 3.48Å; P161-L164 PolarHBondContact O-N 3.4Å; P161-V165 PolarHBondContact O-N 3.25Å
162	E	85.5	Confident	89.2	Confident	130 Å²	130	70 Å²	70	61%	0.607	39%	0.394	S	S	*	.	H	α-helix	trans	-61.5	-36.9	-176.1	-173.5	170.1	-164.4	0	0	112.8	T141 L164 V165 H166	T141-E162 HydrophobicContact CG2-CG 4.46Å; E162-L164 VanDerWaalsContact C-N 3.28Å; E162-L164 PolarHBondContact O-N 3.44Å; E162-V165 WeakPolarHBondContact O-CB 3.36Å; E162-V165 PolarHBondContact O-N 2.84Å; E162-H166 PolarHBondContact O-CD2 2.97Å
163	N	85.2	Confident	89.5	Confident	116 Å²	116	67.8 Å²	67.8	62%	0.62	37%	0.369	S	S	*	.	H	α-helix	trans	-64.2	-32.7	176.1	63.6	-55	0	0	0	112.5	P161 D167	P161-N163 VanDerWaalsContact C-N 3.29Å; P161-N163 VanDerWaalsContact CB-OD1 3.23Å; P161-N163 WeakPolarHBondContact CB-OD1 3.49Å; P161-N163 PolarHBondContact O-N 2.87Å; N163-D167 PolarHBondContact O-N 3.2Å
164	L	90.6	Very high	90.1	Very high	34 Å²	34	67.8 Å²	67.8	18%	0.178	36%	0.36	C	S	.	.	H	α-helix	trans	-67.4	-40.4	176.6	179.8	65.1	0	0	0	111.2	F154 P161 E162 H166 D167 K170 N171	F154-L164 HydrophobicContact CE2-CD2 3.43Å; F154-L164 VanDerWaalsContact CE2-CD2 3.43Å; F154-L164 HydrophobicContact CZ-CD2 3.41Å; F154-L164 VanDerWaalsContact CZ-CD2 3.41Å; P161-L164 HydrophobicContact CB-CB 4.22Å; P161-L164 WeakPolarHBondContact O-CB 3.48Å; P161-L164 PolarHBondContact O-N 3.4Å; E162-L164 VanDerWaalsContact C-N 3.28Å; E162-L164 PolarHBondContact O-N 3.44Å; L164-H166 PolarHBondContact O-N 3.26Å; L164-D167 PolarHBondContact O-N 3.29Å; L164-K170 HydrophobicContact CD1-CB 3.66Å; L164-N171 VanDerWaalsContact O-CB 3.32Å; L164-N171 WeakPolarHBondContact O-CB 2.78Å
165	V	90.9	Very high	90.4	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-55.4	-32.9	-178.2	-177.6	0	0	0	0	112.4	T141 K144 K145 I148 I160 P161 E162 N171	T141-V165 HydrophobicContact CG2-CB 4.34Å; T141-V165 HydrophobicContact CG2-CG1 3.92Å; K144-V165 HydrophobicContact CB-CG1 3.47Å; K144-V165 VanDerWaalsContact CB-CG1 3.47Å; K144-V165 HydrophobicContact CD-CG1 3.77Å; K144-V165 HydrophobicContact CG-CG1 4.29Å; K145-V165 HydrophobicContact CD-CG2 4.39Å; K145-V165 HydrophobicContact CG-CG2 3.66Å; I148-V165 HydrophobicContact CD1-CG2 4.45Å; I160-V165 HydrophobicContact CG2-CG2 3.57Å; P161-V165 PolarHBondContact O-N 3.25Å; E162-V165 WeakPolarHBondContact O-CB 3.36Å; E162-V165 PolarHBondContact O-N 2.84Å; V165-N171 PolarHBondContact O-ND2 2.99Å
166	H	87.4	Confident	90.7	Very high	84 Å²	84	62 Å²	62	39%	0.389	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-6.4	-177.5	-63.6	-64.7	0	0	0	113.9	T141 E162 L164 H168	T141-H166 PolarHBondContact OG1-CE1 3.26Å; T141-H166 PolarHBondContact OG1-NE2 3.26Å; T141-H166 VanDerWaalsContact OG1-NE2 3.13Å; E162-H166 PolarHBondContact O-CD2 2.97Å; L164-H166 PolarHBondContact O-N 3.26Å; H166-H168 PolarHBondContact O-N 3.35Å
167	D	88.5	Confident	91	Very high	49 Å²	49	62 Å²	62	26%	0.262	32%	0.324	S	S	.	.			trans	-83	102.6	175.2	-171.4	-28.5	0	0	0	109.7	N163 L164 D169 K170 N171	N163-D167 PolarHBondContact O-N 3.2Å; L164-D167 PolarHBondContact O-N 3.29Å; D167-D169 PolarHBondContact O-N 2.83Å; D167-D169 PolarHBondContact OD1-N 3.43Å; D167-K170 HydrophobicContact CB-CB 4.3Å; D167-K170 PolarHBondContact O-N 3.25Å; D167-K170 PolarHBondContact OD1-N 3.09Å; D167-K170 VanDerWaalsContact OD2-CD 3.29Å; D167-K170 WeakPolarHBondContact OD2-CD 3.27Å; D167-K170 IonicContact OD2-NZ 3.16Å; D167-N171 WeakPolarHBondContact O-CB 3.24Å; D167-N171 PolarHBondContact O-N 3.01Å; D167-N171 PolarHBondContact O-ND2 2.9Å
168	H	85.2	Confident	91.2	Very high	86 Å²	86	65.7 Å²	65.7	40%	0.398	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.7	-174.3	-70	-52.9	0	0	0	114.2	H166 R175	H166-H168 PolarHBondContact O-N 3.35Å; H168-R175 PolarHBondContact CD2-NH2 3.29Å; H168-R175 VanDerWaalsContact CD2-NH2 3.28Å; H168-R175 PolarHBondContact CE1-NH2 2.93Å; H168-R175 PolarHBondContact ND1-NH2 3.28Å; H168-R175 PolarHBondContact NE2-NH2 3.49Å
169	D	86	Confident	91.5	Very high	154 Å²	154	61.1 Å²	61.1	82%	0.824	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-21.5	-176.7	-59.8	-33	0	0	0	111.5	D167	D167-D169 PolarHBondContact O-N 2.83Å; D167-D169 PolarHBondContact OD1-N 3.43Å
170	K	88.8	Confident	91.8	Very high	149 Å²	149	58.1 Å²	58.1	65%	0.648	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116	-15.6	-172.3	-59.6	-175.3	-166.3	153.7	0	114.8	L164 D167 G172	L164-K170 HydrophobicContact CD1-CB 3.66Å; D167-K170 HydrophobicContact CB-CB 4.3Å; D167-K170 PolarHBondContact O-N 3.25Å; D167-K170 PolarHBondContact OD1-N 3.09Å; D167-K170 VanDerWaalsContact OD2-CD 3.29Å; D167-K170 WeakPolarHBondContact OD2-CD 3.27Å; D167-K170 IonicContact OD2-NZ 3.16Å; K170-G172 PolarHBondContact O-N 3.25Å
171	N	90.7	Very high	92.1	Very high	7 Å²	7	63 Å²	63	4%	0.037	35%	0.352	C	S	.	.	S	Bend	trans	-74	-8.4	-175	69.6	14.3	0	0	0	114.5	I148 L164 V165 D167 L173	I148-N171 HydrophobicContact CD1-CB 4.22Å; I148-N171 WeakPolarHBondContact CG1-O 3.4Å; L164-N171 VanDerWaalsContact O-CB 3.32Å; L164-N171 WeakPolarHBondContact O-CB 2.78Å; V165-N171 PolarHBondContact O-ND2 2.99Å; D167-N171 WeakPolarHBondContact O-CB 3.24Å; D167-N171 PolarHBondContact O-N 3.01Å; D167-N171 PolarHBondContact O-ND2 2.9Å; N171-L173 PolarHBondContact O-N 3.19Å; N171-L173 WeakPolarHBondContact OD1-CB 3.37Å; N171-L173 PolarHBondContact OD1-N 3.48Å
172	G	90.6	Very high	92.5	Very high	51 Å²	51	67.8 Å²	67.8	53%	0.526	37%	0.369	S	S	.	.			trans	63	28.7	178.1	0	0	0	0	0	113.8	N151 K170 P174	N151-G172 PolarHBondContact ND2-O 3.45Å; N151-G172 VanDerWaalsContact ND2-O 3.09Å; K170-G172 PolarHBondContact O-N 3.25Å; G172-P174 WeakPolarHBondContact O-CD 3.25Å
173	L	93.8	Very high	93.1	Very high	11 Å²	11	65.1 Å²	65.1	6%	0.058	36%	0.356	C	S	.	.			trans	-108.9	95.3	176.1	-65	178.4	0	0	0	110.5	F123 K144 L147 I148 N171	F123-L173 HydrophobicContact CD1-CB 3.68Å; F123-L173 HydrophobicContact CD1-CD1 4.41Å; F123-L173 HydrophobicContact CE1-CB 4.08Å; F123-L173 HydrophobicContact CG-CB 4.41Å; K144-L173 HydrophobicContact CB-CD1 3.82Å; K144-L173 HydrophobicContact CD-CD1 4.31Å; K144-L173 HydrophobicContact CG-CD1 3.85Å; L147-L173 HydrophobicContact CB-CD2 3.56Å; L147-L173 HydrophobicContact CD2-CD2 4.48Å; I148-L173 HydrophobicContact CD1-CD1 4.21Å; I148-L173 HydrophobicContact CD1-CG 4.43Å; I148-L173 HydrophobicContact CG1-CD1 3.94Å; I148-L173 HydrophobicContact CG1-CD2 3.78Å; I148-L173 HydrophobicContact CG1-CG 3.77Å; N171-L173 PolarHBondContact O-N 3.19Å; N171-L173 WeakPolarHBondContact OD1-CB 3.37Å; N171-L173 PolarHBondContact OD1-N 3.48Å
174	P	95.8	Very high	93.8	Very high	50 Å²	50	60.6 Å²	60.6	33%	0.325	33%	0.332	S	S	.	.			trans	-58.2	140.7	174.4	-20.5	31.5	0	0	0	111	F123 V124 G172 F179	F123-P174 WeakPolarHBondContact CA-O 3.27Å; V124-P174 HydrophobicContact CB-CB 4.36Å; V124-P174 PolarHBondContact N-O 3.3Å; G172-P174 WeakPolarHBondContact O-CD 3.25Å; P174-F179 HydrophobicContact CB-CE2 3.91Å; P174-F179 HydrophobicContact CB-CZ 3.99Å
175	R	96.8	Very high	94.1	Very high	37 Å²	37	62.6 Å²	62.6	14%	0.14	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-96.2	144.6	172.5	-63.5	176.2	-173	-120.1	24.4	108.7	D120 I122 F123 H168 S177 S178 F179	D120-R175 WeakPolarHBondContact O-CD 3.32Å; D120-R175 PolarHBondContact O-NH1 2.85Å; I122-R175 CarbonylContact O-C 3.52Å; I122-R175 WeakPolarHBondContact O-CA 3.49Å; F123-R175 HydrophobicContact CD1-CG 4.29Å; F123-R175 HydrophobicContact CE1-CG 4.03Å; H168-R175 PolarHBondContact CD2-NH2 3.29Å; H168-R175 VanDerWaalsContact CD2-NH2 3.28Å; H168-R175 PolarHBondContact CE1-NH2 2.93Å; H168-R175 PolarHBondContact ND1-NH2 3.28Å; H168-R175 PolarHBondContact NE2-NH2 3.49Å; R175-S177 PolarHBondContact O-N 2.86Å; R175-S177 VanDerWaalsContact O-N 3.12Å; R175-S178 PolarHBondContact O-N 2.85Å; R175-S178 PolarHBondContact O-OG 3.12Å; R175-F179 WeakPolarHBondContact O-CD2 3.47Å; R175-F179 WeakPolarHBondContact O-CE2 3.02Å
176	L	98.3	Very high	94.5	Very high	0 Å²	0	68 Å²	68	0%	0	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-60.2	-30.3	-177.6	-171.4	60.6	0	0	0	112.2	L119 I122 V124 L131 S178 F179 I184 R187 L188	L119-L176 HydrophobicContact CD2-CD2 3.77Å; L119-L176 HydrophobicContact CD2-CG 4.15Å; L119-L176 PolarHBondContact O-N 3.49Å; I122-L176 HydrophobicContact CB-CB 3.89Å; I122-L176 HydrophobicContact CB-CD2 4.16Å; I122-L176 HydrophobicContact CD1-CD2 3.98Å; I122-L176 HydrophobicContact CG2-CB 4.05Å; I122-L176 HydrophobicContact CG2-CD2 3.94Å; I122-L176 PolarHBondContact O-N 3.45Å; V124-L176 HydrophobicContact CG2-CB 3.91Å; V124-L176 HydrophobicContact CG2-CD1 3.88Å; L131-L176 HydrophobicContact CD1-CD2 4.38Å; L131-L176 HydrophobicContact CD2-CD1 4.25Å; L176-S178 PolarHBondContact O-N 3.48Å; L176-F179 PolarHBondContact O-N 3.33Å; L176-I184 HydrophobicContact CD1-CB 4.47Å; L176-I184 HydrophobicContact CD1-CG1 4.18Å; L176-I184 HydrophobicContact CD1-CG2 4.47Å; L176-I184 HydrophobicContact CD2-CG2 4.23Å; L176-I184 HydrophobicContact CG-CG1 4.15Å; L176-I184 HydrophobicContact CG-CG2 4.15Å; L176-I184 WeakPolarHBondContact O-CD1 3.26Å; L176-I184 VanDerWaalsContact O-CG1 3.27Å; L176-I184 WeakPolarHBondContact O-CG1 3.35Å; L176-R187 HydrophobicContact CD1-CB 4.13Å; L176-L188 HydrophobicContact CD2-CD1 4.42Å; L176-L188 HydrophobicContact CD2-CD2 3.73Å; L176-L188 HydrophobicContact CD2-CG 3.93Å
177	S	97.8	Very high	95.1	Very high	28 Å²	28	65 Å²	65	20%	0.196	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-63.4	-14.3	173.8	56.4	0	0	0	0	115.9	L119 D120 R175 F179	L119-S177 PolarHBondContact O-N 3.49Å; D120-S177 WeakPolarHBondContact CA-OG 3.39Å; D120-S177 WeakPolarHBondContact OD1-CB 3.47Å; D120-S177 PolarHBondContact OD1-OG 3.31Å; R175-S177 PolarHBondContact O-N 2.86Å; R175-S177 VanDerWaalsContact O-N 3.12Å; S177-F179 VanDerWaalsContact C-N 3.3Å
178	S	97.3	Very high	95.5	Very high	84 Å²	84	64.1 Å²	64.1	59%	0.587	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-84.5	-3.6	177.8	69.5	0	0	0	0	113.6	R175 L176	R175-S178 PolarHBondContact O-N 2.85Å; R175-S178 PolarHBondContact O-OG 3.12Å; L176-S178 PolarHBondContact O-N 3.48Å
179	F	98.4	Very high	96.2	Very high	40 Å²	40	66.1 Å²	66.1	18%	0.175	37%	0.365	C	S	.	.	S	Bend	trans	-99.4	163.4	-178.5	-64.6	-93.7	0	0	0	111.5	V124 P174 R175 L176 S177 E183 I184	V124-F179 HydrophobicContact CB-CE2 4.03Å; V124-F179 HydrophobicContact CB-CZ 4.32Å; V124-F179 HydrophobicContact CG1-CE2 4.23Å; V124-F179 HydrophobicContact CG1-CZ 4.16Å; V124-F179 HydrophobicContact CG2-CD2 4.32Å; V124-F179 HydrophobicContact CG2-CE2 3.7Å; V124-F179 HydrophobicContact CG2-CZ 4.43Å; P174-F179 HydrophobicContact CB-CE2 3.91Å; P174-F179 HydrophobicContact CB-CZ 3.99Å; R175-F179 WeakPolarHBondContact O-CD2 3.47Å; R175-F179 WeakPolarHBondContact O-CE2 3.02Å; L176-F179 PolarHBondContact O-N 3.33Å; S177-F179 VanDerWaalsContact C-N 3.3Å; F179-E183 HydrophobicContact CB-CB 3.89Å; F179-E183 HydrophobicContact CD1-CB 4.39Å; F179-I184 HydrophobicContact CB-CG1 3.97Å; F179-I184 WeakPolarHBondContact O-CD1 3.35Å
180	S	98.5	Very high	96.7	Very high	49 Å²	49	61.8 Å²	61.8	34%	0.343	35%	0.347	S	S	.	.			trans	-67.6	157.9	173.8	68	0	0	0	0	111.9	Q182 E183 I184	S180-Q182 PolarHBondContact O-N 2.63Å; S180-E183 VanDerWaalsContact CB-OE2 3.28Å; S180-E183 WeakPolarHBondContact CB-OE2 3.46Å; S180-E183 PolarHBondContact N-OE2 2.99Å; S180-E183 WeakPolarHBondContact O-CB 3.4Å; S180-E183 PolarHBondContact O-N 2.04Å; S180-E183 VanDerWaalsContact O-N 3.14Å; S180-E183 WeakPolarHBondContact OG-CB 3.29Å; S180-E183 VanDerWaalsContact OG-CD 3.31Å; S180-E183 VanDerWaalsContact OG-CG 3.28Å; S180-E183 WeakPolarHBondContact OG-CG 3.44Å; S180-E183 PolarHBondContact OG-N 2.66Å; S180-E183 PolarHBondContact OG-OE2 3.39Å; S180-I184 VanDerWaalsContact O-CG1 3.29Å; S180-I184 WeakPolarHBondContact O-CG1 3.43Å; S180-I184 PolarHBondContact O-N 2.89Å
181	P	98.4	Very high	97.2	Very high	106 Å²	106	55.9 Å²	55.9	69%	0.688	32%	0.32	S	S	*	.	H	α-helix	trans	-55.6	-34.9	179	-28.3	36.2	0	0	0	114.6	T185	P181-T185 WeakPolarHBondContact O-CB 3.43Å; P181-T185 PolarHBondContact O-N 2.92Å; P181-T185 VanDerWaalsContact O-N 3.07Å; P181-T185 PolarHBondContact O-OG1 3.45Å
182	Q	98.4	Very high	97.6	Very high	159 Å²	159	57.3 Å²	57.3	74%	0.743	33%	0.326	S	S	*	.	H	α-helix	trans	-67.1	-49.4	176.7	-177.9	177.7	-2.3	0	0	111	S180 I184 T185 E186	S180-Q182 PolarHBondContact O-N 2.63Å; Q182-I184 VanDerWaalsContact C-N 3.29Å; Q182-I184 PolarHBondContact O-N 3.45Å; Q182-T185 PolarHBondContact O-N 3.46Å; Q182-E186 PolarHBondContact O-N 3.23Å
183	E	98.6	Very high	98	Very high	74 Å²	74	55.5 Å²	55.5	35%	0.346	30%	0.304	S	S	.	.	H	α-helix	trans	-61.3	-36.5	177.3	-77.9	172.6	128	0	0	113	F179 S180 R187	F179-E183 HydrophobicContact CB-CB 3.89Å; F179-E183 HydrophobicContact CD1-CB 4.39Å; S180-E183 VanDerWaalsContact CB-OE2 3.28Å; S180-E183 WeakPolarHBondContact CB-OE2 3.46Å; S180-E183 PolarHBondContact N-OE2 2.99Å; S180-E183 WeakPolarHBondContact O-CB 3.4Å; S180-E183 PolarHBondContact O-N 2.04Å; S180-E183 VanDerWaalsContact O-N 3.14Å; S180-E183 WeakPolarHBondContact OG-CB 3.29Å; S180-E183 VanDerWaalsContact OG-CD 3.31Å; S180-E183 VanDerWaalsContact OG-CG 3.28Å; S180-E183 WeakPolarHBondContact OG-CG 3.44Å; S180-E183 PolarHBondContact OG-N 2.66Å; S180-E183 PolarHBondContact OG-OE2 3.39Å; E183-R187 VanDerWaalsContact CB-NH1 3.28Å; E183-R187 WeakPolarHBondContact O-CB 3.4Å; E183-R187 VanDerWaalsContact O-CG 3.26Å; E183-R187 WeakPolarHBondContact O-CG 3.37Å; E183-R187 PolarHBondContact O-N 3.18Å; E183-R187 VanDerWaalsContact O-N 3.12Å; E183-R187 PolarHBondContact O-NH1 3.3Å; E183-R187 VanDerWaalsContact O-NH1 3.17Å
184	I	98.7	Very high	98.2	Very high	21 Å²	21	55.2 Å²	55.2	11%	0.108	30%	0.302	C	S	.	.	H	α-helix	trans	-62.7	-49.7	174	-70.5	169.3	0	0	0	109.8	L119 L176 F179 S180 Q182 E186 R187 L188	L119-I184 HydrophobicContact CD1-CD1 4.18Å; L119-I184 HydrophobicContact CD2-CG2 4.05Å; L176-I184 HydrophobicContact CD1-CB 4.47Å; L176-I184 HydrophobicContact CD1-CG1 4.18Å; L176-I184 HydrophobicContact CD1-CG2 4.47Å; L176-I184 HydrophobicContact CD2-CG2 4.23Å; L176-I184 HydrophobicContact CG-CG1 4.15Å; L176-I184 HydrophobicContact CG-CG2 4.15Å; L176-I184 WeakPolarHBondContact O-CD1 3.26Å; L176-I184 VanDerWaalsContact O-CG1 3.27Å; L176-I184 WeakPolarHBondContact O-CG1 3.35Å; F179-I184 HydrophobicContact CB-CG1 3.97Å; F179-I184 WeakPolarHBondContact O-CD1 3.35Å; S180-I184 VanDerWaalsContact O-CG1 3.29Å; S180-I184 WeakPolarHBondContact O-CG1 3.43Å; S180-I184 PolarHBondContact O-N 2.89Å; Q182-I184 VanDerWaalsContact C-N 3.29Å; Q182-I184 PolarHBondContact O-N 3.45Å; I184-E186 PolarHBondContact O-N 3.09Å; I184-R187 PolarHBondContact O-N 3.49Å; I184-L188 HydrophobicContact CG2-CD1 3.75Å; I184-L188 HydrophobicContact CG2-CG 4.31Å; I184-L188 WeakPolarHBondContact O-CB 3.3Å; I184-L188 WeakPolarHBondContact O-CG 3.36Å; I184-L188 PolarHBondContact O-N 2.9Å
185	T	98.4	Very high	98.4	Very high	76 Å²	76	52.8 Å²	52.8	47%	0.466	29%	0.287	S	S	.	.	H	α-helix	trans	-62	-44.9	-178.7	-58.3	0	0	0	0	111.2	P181 Q182 R187 L188 N189	P181-T185 WeakPolarHBondContact O-CB 3.43Å; P181-T185 PolarHBondContact O-N 2.92Å; P181-T185 VanDerWaalsContact O-N 3.07Å; P181-T185 PolarHBondContact O-OG1 3.45Å; Q182-T185 PolarHBondContact O-N 3.46Å; T185-R187 PolarHBondContact O-N 3.35Å; T185-L188 PolarHBondContact O-N 3.39Å; T185-N189 WeakPolarHBondContact O-CB 3.43Å; T185-N189 VanDerWaalsContact O-CG 3.22Å; T185-N189 PolarHBondContact O-N 3.17Å; T185-N189 PolarHBondContact O-ND2 2.93Å
186	E	98.6	Very high	98.5	Very high	114 Å²	114	51.1 Å²	51.1	53%	0.533	28%	0.28	S	S	.	.	H	α-helix	trans	-57.4	-48.4	177	-176	-179.7	172.3	0	0	111.7	Q182 I184 N189 S190	Q182-E186 PolarHBondContact O-N 3.23Å; I184-E186 PolarHBondContact O-N 3.09Å; E186-N189 PolarHBondContact O-N 2.75Å; E186-S190 WeakPolarHBondContact O-CB 3.47Å; E186-S190 PolarHBondContact O-N 3.42Å; E186-S190 PolarHBondContact O-OG 2.88Å
187	R	98.7	Very high	98.5	Very high	21 Å²	21	51.1 Å²	51.1	8%	0.079	28%	0.28	C	S	.	.	H	α-helix	trans	-66.5	-44.4	179.2	-71	172.5	174.1	73.4	-5.9	112	D126 L131 L176 E183 I184 T185 N189 S190 Y191	D126-R187 IonicContact OD1-CZ 2.92Å; D126-R187 IonicContact OD1-NE 3.05Å; D126-R187 PolarHBondContact OD1-NE 3.43Å; D126-R187 IonicContact OD1-NH2 3.87Å; D126-R187 PolarHBondContact OD1-NH2 2.92Å; D126-R187 IonicContact OD2-CZ 2.62Å; D126-R187 IonicContact OD2-NE 2.56Å; D126-R187 IonicContact OD2-NH2 2.84Å; D126-R187 PolarHBondContact OD2-NH2 2.79Å; L131-R187 HydrophobicContact CD1-CB 4.28Å; L131-R187 HydrophobicContact CD2-CB 4.46Å; L176-R187 HydrophobicContact CD1-CB 4.13Å; E183-R187 VanDerWaalsContact CB-NH1 3.28Å; E183-R187 WeakPolarHBondContact O-CB 3.4Å; E183-R187 VanDerWaalsContact O-CG 3.26Å; E183-R187 WeakPolarHBondContact O-CG 3.37Å; E183-R187 PolarHBondContact O-N 3.18Å; E183-R187 VanDerWaalsContact O-N 3.12Å; E183-R187 PolarHBondContact O-NH1 3.3Å; E183-R187 VanDerWaalsContact O-NH1 3.17Å; I184-R187 PolarHBondContact O-N 3.49Å; T185-R187 PolarHBondContact O-N 3.35Å; R187-N189 PolarHBondContact O-N 2.92Å; R187-S190 PolarHBondContact O-N 3.07Å; R187-Y191 HydrophobicContact CB-CD1 4.37Å; R187-Y191 HydrophobicContact CB-CD2 4.2Å; R187-Y191 HydrophobicContact CB-CE2 4.35Å; R187-Y191 HydrophobicContact CB-CG 4.23Å; R187-Y191 HydrophobicContact CG-CD1 4.31Å; R187-Y191 HydrophobicContact CG-CD2 4.13Å; R187-Y191 HydrophobicContact CG-CE1 3.96Å; R187-Y191 HydrophobicContact CG-CE2 3.77Å; R187-Y191 HydrophobicContact CG-CG 4.41Å; R187-Y191 VanDerWaalsContact O-CB 3.24Å; R187-Y191 WeakPolarHBondContact O-CB 3.17Å; R187-Y191 PolarHBondContact O-N 3.17Å
188	L	98.5	Very high	98.5	Very high	29 Å²	29	50.5 Å²	50.5	15%	0.152	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-30	176.2	-74.4	174.4	0	0	0	112.3	L131 L176 I184 T185 K193 I289	L131-L188 HydrophobicContact CD1-CD2 4.05Å; L176-L188 HydrophobicContact CD2-CD1 4.42Å; L176-L188 HydrophobicContact CD2-CD2 3.73Å; L176-L188 HydrophobicContact CD2-CG 3.93Å; I184-L188 HydrophobicContact CG2-CD1 3.75Å; I184-L188 HydrophobicContact CG2-CG 4.31Å; I184-L188 WeakPolarHBondContact O-CB 3.3Å; I184-L188 WeakPolarHBondContact O-CG 3.36Å; I184-L188 PolarHBondContact O-N 2.9Å; T185-L188 PolarHBondContact O-N 3.39Å; L188-K193 WeakPolarHBondContact O-CE 3.15Å; L188-I289 HydrophobicContact CD2-CD1 4.19Å; L188-I289 HydrophobicContact CD2-CG1 4.38Å; L188-I289 HydrophobicContact CD2-CG2 4.08Å
189	N	98.3	Very high	98.6	Very high	128 Å²	128	46.7 Å²	46.7	68%	0.684	25%	0.247	S	C	*	.	H	α-helix	trans	-85.6	-32.2	179.4	-70.3	-18.8	0	0	0	113.5	T185 E186 R187	T185-N189 WeakPolarHBondContact O-CB 3.43Å; T185-N189 VanDerWaalsContact O-CG 3.22Å; T185-N189 PolarHBondContact O-N 3.17Å; T185-N189 PolarHBondContact O-ND2 2.93Å; E186-N189 PolarHBondContact O-N 2.75Å; R187-N189 PolarHBondContact O-N 2.92Å
190	S	98.3	Very high	98.6	Very high	64 Å²	64	44.8 Å²	44.8	45%	0.448	24%	0.239	S	C	.	.	H	α-helix	trans	-109.1	-23	-168.7	60.7	0	0	0	0	115.2	E186 R187	E186-S190 WeakPolarHBondContact O-CB 3.47Å; E186-S190 PolarHBondContact O-N 3.42Å; E186-S190 PolarHBondContact O-OG 2.88Å; R187-S190 PolarHBondContact O-N 3.07Å
191	Y	98.7	Very high	98.6	Very high	24 Å²	24	42.5 Å²	42.5	9%	0.094	22%	0.223	C	C	.	.	S	Bend	trans	-86.5	151	-171.6	-75.3	23.3	0	0	0	112.1	V124 D126 Q129 L131 R187 K193	V124-Y191 HydrophobicContact CG1-CE2 4.17Å; D126-Y191 VanDerWaalsContact OD1-CE2 3.25Å; D126-Y191 WeakPolarHBondContact OD1-CE2 3.48Å; D126-Y191 PolarHBondContact OD1-OH 3.39Å; Q129-Y191 VanDerWaalsContact C-CG 3.48Å; Q129-Y191 HydrophobicContact CB-CD1 3.69Å; Q129-Y191 HydrophobicContact CB-CD2 4.22Å; Q129-Y191 HydrophobicContact CB-CE1 3.82Å; Q129-Y191 HydrophobicContact CB-CE2 4.31Å; Q129-Y191 HydrophobicContact CB-CG 3.91Å; Q129-Y191 HydrophobicContact CG-CD1 4.14Å; Q129-Y191 HydrophobicContact CG-CE1 3.77Å; Q129-Y191 CarbonylContact O-C 3.35Å; Q129-Y191 WeakPolarHBondContact O-CA 3.5Å; Q129-Y191 WeakPolarHBondContact O-CB 3.24Å; L131-Y191 HydrophobicContact CD2-CD2 4Å; L131-Y191 HydrophobicContact CG-CD2 3.96Å; L131-Y191 HydrophobicContact CG-CG 4.3Å; R187-Y191 HydrophobicContact CB-CD1 4.37Å; R187-Y191 HydrophobicContact CB-CD2 4.2Å; R187-Y191 HydrophobicContact CB-CE2 4.35Å; R187-Y191 HydrophobicContact CB-CG 4.23Å; R187-Y191 HydrophobicContact CG-CD1 4.31Å; R187-Y191 HydrophobicContact CG-CD2 4.13Å; R187-Y191 HydrophobicContact CG-CE1 3.96Å; R187-Y191 HydrophobicContact CG-CE2 3.77Å; R187-Y191 HydrophobicContact CG-CG 4.41Å; R187-Y191 VanDerWaalsContact O-CB 3.24Å; R187-Y191 WeakPolarHBondContact O-CB 3.17Å; R187-Y191 PolarHBondContact O-N 3.17Å; Y191-K193 VanDerWaalsContact O-CE 3.27Å; Y191-K193 WeakPolarHBondContact O-CE 3.21Å; Y191-K193 PolarHBondContact O-N 2.62Å; Y191-K193 PolarHBondContact O-NZ 2.84Å
192	F	98.8	Very high	98.5	Very high	37 Å²	37	37.5 Å²	37.5	16%	0.162	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	122.9	168	-177.5	-86.8	0	0	0	109.1	Q129 I130 L131 F194 V293 I307 A310 A311	Q129-F192 PolarHBondContact O-N 3.33Å; I130-F192 CarbonylContact C-O 3.6Å; I130-F192 WeakPolarHBondContact CA-O 3.46Å; I130-F192 HydrophobicContact CG1-CB 4.47Å; L131-F192 PolarHBondContact N-O 3.46Å; F192-F194 HydrophobicContact CD1-CD1 4.04Å; F192-F194 HydrophobicContact CE1-CB 4.02Å; F192-F194 AromaticContact CE1-CD1 3.76Å; F192-F194 HydrophobicContact CE1-CD1 3.76Å; F192-F194 HydrophobicContact CE1-CG 4.2Å; F192-V293 HydrophobicContact CE2-CG2 4.14Å; F192-V293 HydrophobicContact CZ-CB 4.27Å; F192-V293 HydrophobicContact CZ-CG2 3.58Å; F192-I307 HydrophobicContact CE1-CG2 4.2Å; F192-A310 HydrophobicContact CE2-CB 3.87Å; F192-A310 HydrophobicContact CZ-CB 3.98Å; F192-A311 HydrophobicContact CD1-CB 3.71Å; F192-A311 HydrophobicContact CD2-CB 4.37Å; F192-A311 HydrophobicContact CE1-CB 3.81Å; F192-A311 HydrophobicContact CE2-CB 4.44Å; F192-A311 HydrophobicContact CG-CB 4Å; F192-A311 HydrophobicContact CZ-CB 4.16Å
193	K	98.8	Very high	98.5	Very high	14 Å²	14	30 Å²	30	6%	0.061	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.8	-172.1	-75.7	163.7	-94.3	58.8	0	110.3	L131 L188 Y191 I289 N290 Y291 S292 V293	L131-K193 HydrophobicContact CB-CG 3.74Å; L131-K193 HydrophobicContact CD1-CD 4.16Å; L131-K193 HydrophobicContact CD1-CG 3.77Å; L131-K193 HydrophobicContact CG-CG 4.21Å; L131-K193 WeakPolarHBondContact O-CA 3.39Å; L188-K193 WeakPolarHBondContact O-CE 3.15Å; Y191-K193 VanDerWaalsContact O-CE 3.27Å; Y191-K193 WeakPolarHBondContact O-CE 3.21Å; Y191-K193 PolarHBondContact O-N 2.62Å; Y191-K193 PolarHBondContact O-NZ 2.84Å; K193-I289 HydrophobicContact CD-CG2 3.84Å; K193-N290 WeakPolarHBondContact CD-O 3.47Å; K193-N290 WeakPolarHBondContact CE-O 3.49Å; K193-N290 PolarHBondContact NZ-O 2.56Å; K193-Y291 HydrophobicContact CB-CD1 3.83Å; K193-Y291 HydrophobicContact CB-CE1 4.39Å; K193-S292 PolarHBondContact N-OG 3.49Å; K193-S292 VanDerWaalsContact N-OG 3.08Å; K193-S292 WeakPolarHBondContact O-CA 3.41Å; K193-S292 VanDerWaalsContact O-CB 3.25Å; K193-S292 WeakPolarHBondContact O-CB 3.14Å; K193-S292 PolarHBondContact O-N 3.41Å; K193-V293 PolarHBondContact O-N 3.01Å
194	F	98.9	Very high	98.5	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.018	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	162.3	172.8	75.3	-80.8	0	0	0	113	I130 L131 F132 C133 W143 F192 V293 I307	I130-F194 HydrophobicContact CG2-CD1 4.29Å; I130-F194 HydrophobicContact CG2-CE1 3.75Å; L131-F194 PolarHBondContact O-N 3.05Å; F132-F194 WeakPolarHBondContact CA-O 3.44Å; F132-F194 HydrophobicContact CB-CE1 4.02Å; F132-F194 HydrophobicContact CB-CZ 3.98Å; F132-F194 AromaticContact CD2-CD2 3.96Å; F132-F194 HydrophobicContact CD2-CD2 3.96Å; F132-F194 HydrophobicContact CD2-CE1 4.3Å; F132-F194 AromaticContact CD2-CE2 3.41Å; F132-F194 HydrophobicContact CD2-CE2 3.41Å; F132-F194 VanDerWaalsContact CD2-CE2 3.41Å; F132-F194 AromaticContact CD2-CZ 3.61Å; F132-F194 HydrophobicContact CD2-CZ 3.61Å; F132-F194 HydrophobicContact CE2-CD2 4.48Å; F132-F194 AromaticContact CE2-CE2 3.91Å; F132-F194 HydrophobicContact CE2-CE2 3.91Å; F132-F194 HydrophobicContact CE2-CZ 4.43Å; F132-F194 HydrophobicContact CG-CE1 4.5Å; F132-F194 HydrophobicContact CG-CE2 4.24Å; F132-F194 AromaticContact CG-CZ 3.98Å; F132-F194 HydrophobicContact CG-CZ 3.98Å; C133-F194 PolarHBondContact N-O 2.68Å; W143-F194 AromaticContact CD2-CE2 3.62Å; W143-F194 HydrophobicContact CD2-CE2 3.62Å; W143-F194 AromaticContact CD2-CZ 3.91Å; W143-F194 HydrophobicContact CD2-CZ 3.91Å; W143-F194 AromaticContact CE2-CE2 3.73Å; W143-F194 AromaticContact CE3-CE2 3.66Å; W143-F194 HydrophobicContact CE3-CE2 3.66Å; W143-F194 AromaticContact CE3-CZ 3.47Å; W143-F194 HydrophobicContact CE3-CZ 3.47Å; W143-F194 VanDerWaalsContact CE3-CZ 3.47Å; W143-F194 HydrophobicContact CG-CE2 4.26Å; W143-F194 AromaticContact CH2-CE2 3.94Å; W143-F194 HydrophobicContact CH2-CE2 3.94Å; W143-F194 HydrophobicContact CH2-CZ 4.16Å; W143-F194 AromaticContact CZ2-CE2 3.89Å; W143-F194 HydrophobicContact CZ2-CE2 3.89Å; W143-F194 AromaticContact CZ3-CE2 3.82Å; W143-F194 HydrophobicContact CZ3-CE2 3.82Å; W143-F194 AromaticContact CZ3-CZ 3.61Å; W143-F194 HydrophobicContact CZ3-CZ 3.61Å; F192-F194 HydrophobicContact CD1-CD1 4.04Å; F192-F194 HydrophobicContact CE1-CB 4.02Å; F192-F194 AromaticContact CE1-CD1 3.76Å; F192-F194 HydrophobicContact CE1-CD1 3.76Å; F192-F194 HydrophobicContact CE1-CG 4.2Å; F194-V293 VanDerWaalsContact CA-O 3.23Å; F194-V293 WeakPolarHBondContact CA-O 3.46Å; F194-V293 HydrophobicContact CB-CB 4.12Å; F194-V293 WeakPolarHBondContact CB-O 3.4Å; F194-I307 HydrophobicContact CD1-CG2 3.99Å; F194-I307 HydrophobicContact CD2-CD1 3.8Å; F194-I307 HydrophobicContact CD2-CG1 4.43Å; F194-I307 HydrophobicContact CD2-CG2 3.87Å; F194-I307 HydrophobicContact CE1-CG2 4.08Å; F194-I307 HydrophobicContact CE2-CD1 4.34Å; F194-I307 HydrophobicContact CE2-CG2 3.97Å; F194-I307 HydrophobicContact CG-CD1 4.43Å; F194-I307 HydrophobicContact CG-CG2 3.88Å; F194-I307 HydrophobicContact CZ-CG2 4.07Å
195	F	98.8	Very high	98.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	166.9	167.8	69.9	-72	0	0	0	110.2	C133 T135 V197 C284 P286 Y291 V293 V294 G295 F360	C133-F195 HydrophobicContact CB-CB 3.91Å; C133-F195 WeakPolarHBondContact O-CB 3.47Å; T135-F195 HydrophobicContact CG2-CD2 3.9Å; F195-V197 HydrophobicContact CD2-CG1 3.82Å; F195-V197 HydrophobicContact CE2-CG1 3.38Å; F195-V197 HydrophobicContact CZ-CG1 4.34Å; F195-C284 HydrophobicContact CD2-CB 4.49Å; F195-P286 HydrophobicContact CE1-CB 4.36Å; F195-P286 HydrophobicContact CZ-CB 3.92Å; F195-Y291 AromaticContact CD1-CD1 3.42Å; F195-Y291 HydrophobicContact CD1-CD1 3.42Å; F195-Y291 VanDerWaalsContact CD1-CD1 3.42Å; F195-Y291 HydrophobicContact CD1-CD2 4.02Å; F195-Y291 AromaticContact CD1-CE1 3.51Å; F195-Y291 HydrophobicContact CD1-CE1 3.51Å; F195-Y291 HydrophobicContact CD1-CE2 4.1Å; F195-Y291 AromaticContact CD1-CG 3.68Å; F195-Y291 HydrophobicContact CD1-CG 3.68Å; F195-Y291 AromaticContact CD1-CZ 3.87Å; F195-Y291 AromaticContact CE1-CD1 3.84Å; F195-Y291 HydrophobicContact CE1-CD1 3.84Å; F195-Y291 AromaticContact CE1-CD2 3.56Å; F195-Y291 HydrophobicContact CE1-CD2 3.56Å; F195-Y291 HydrophobicContact CE1-CE1 4.06Å; F195-Y291 AromaticContact CE1-CE2 3.8Å; F195-Y291 HydrophobicContact CE1-CE2 3.8Å; F195-Y291 AromaticContact CE1-CG 3.58Å; F195-Y291 HydrophobicContact CE1-CG 3.58Å; F195-Y291 HydrophobicContact CG-CE1 4.35Å; F195-V293 PolarHBondContact N-O 3.21Å; F195-V294 HydrophobicContact CD1-CG2 4.17Å; F195-V294 HydrophobicContact CE1-CB 4.38Å; F195-V294 HydrophobicContact CE1-CG1 4.15Å; F195-V294 HydrophobicContact CE1-CG2 3.49Å; F195-V294 VanDerWaalsContact CE1-CG2 3.49Å; F195-V294 HydrophobicContact CE2-CG1 4.25Å; F195-V294 HydrophobicContact CZ-CG1 3.94Å; F195-V294 HydrophobicContact CZ-CG2 3.96Å; F195-G295 PolarHBondContact O-N 3.49Å; F195-F360 AromaticContact CE2-CE1 3.87Å; F195-F360 HydrophobicContact CE2-CE1 3.87Å; F195-F360 AromaticContact CE2-CZ 3.75Å; F195-F360 HydrophobicContact CE2-CZ 3.75Å; F195-F360 AromaticContact CZ-CE1 3.59Å; F195-F360 HydrophobicContact CZ-CE1 3.59Å; F195-F360 AromaticContact CZ-CZ 3.76Å; F195-F360 HydrophobicContact CZ-CZ 3.76Å
196	I	98.7	Very high	98.4	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	144.2	179.4	-49.1	-60.6	0	0	0	109.1	T135 V138 W143 G295 H297 L300 I307	T135-I196 VanDerWaalsContact CB-O 3.3Å; T135-I196 WeakPolarHBondContact CB-O 3.5Å; T135-I196 WeakPolarHBondContact CG2-O 3.46Å; T135-I196 PolarHBondContact OG1-O 3.22Å; V138-I196 HydrophobicContact CB-CB 4.24Å; V138-I196 HydrophobicContact CB-CG2 3.91Å; V138-I196 HydrophobicContact CG2-CB 3.83Å; V138-I196 HydrophobicContact CG2-CG2 4.08Å; V138-I196 WeakPolarHBondContact CG2-O 3.42Å; W143-I196 HydrophobicContact CZ2-CD1 4.37Å; W143-I196 VanDerWaalsContact NE1-CG1 3.34Å; I196-G295 CarbonylContact C-O 3.57Å; I196-G295 VanDerWaalsContact CA-O 3.28Å; I196-G295 WeakPolarHBondContact CA-O 3.47Å; I196-H297 HydrophobicContact CG2-CB 4.4Å; I196-L300 HydrophobicContact CD1-CD1 4.31Å; I196-L300 HydrophobicContact CG1-CD1 4.38Å; I196-L300 HydrophobicContact CG2-CD1 4.27Å; I196-I307 HydrophobicContact CD1-CD1 3.64Å
197	V	98.7	Very high	98.4	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	170.1	172.6	-63.5	0	0	0	0	110.6	F195 Y280 V294 G295 H296 H297 F360 Y362	F195-V197 HydrophobicContact CD2-CG1 3.82Å; F195-V197 HydrophobicContact CE2-CG1 3.38Å; F195-V197 HydrophobicContact CZ-CG1 4.34Å; V197-Y280 WeakPolarHBondContact CA-OH 3.16Å; V197-Y280 HydrophobicContact CB-CD2 4.41Å; V197-Y280 HydrophobicContact CB-CE1 4.29Å; V197-Y280 HydrophobicContact CB-CE2 3.93Å; V197-Y280 HydrophobicContact CG1-CD1 4.01Å; V197-Y280 HydrophobicContact CG1-CD2 4.05Å; V197-Y280 HydrophobicContact CG1-CE1 3.97Å; V197-Y280 HydrophobicContact CG1-CE2 4.02Å; V197-Y280 HydrophobicContact CG1-CG 4.04Å; V197-V294 HydrophobicContact CG1-CG1 4.23Å; V197-V294 HydrophobicContact CG2-CG1 4.06Å; V197-G295 WeakPolarHBondContact CG2-O 3.21Å; V197-G295 PolarHBondContact N-O 2.74Å; V197-H296 WeakPolarHBondContact CG2-CD2 3.34Å; V197-H296 CarbonylContact O-C 3.58Å; V197-H297 WeakPolarHBondContact O-CB 3.05Å; V197-H297 PolarHBondContact O-N 3.03Å; V197-F360 HydrophobicContact CB-CD1 4.44Å; V197-F360 HydrophobicContact CB-CD2 4.2Å; V197-F360 HydrophobicContact CB-CG 4.14Å; V197-F360 HydrophobicContact CG1-CD1 3.88Å; V197-F360 HydrophobicContact CG1-CD2 3.83Å; V197-F360 HydrophobicContact CG1-CE1 3.8Å; V197-F360 HydrophobicContact CG1-CE2 3.79Å; V197-F360 HydrophobicContact CG1-CG 3.9Å; V197-F360 HydrophobicContact CG1-CZ 3.76Å; V197-F360 HydrophobicContact CG2-CB 4.01Å; V197-F360 HydrophobicContact CG2-CD1 4.03Å; V197-F360 HydrophobicContact CG2-CD2 4.41Å; V197-F360 HydrophobicContact CG2-CG 3.86Å; V197-Y362 HydrophobicContact CG2-CE2 4.2Å; V197-Y362 WeakPolarHBondContact CG2-OH 3.2Å
198	R	98.3	Very high	98.3	Very high	15 Å²	15	17.6 Å²	17.6	6%	0.057	10%	0.096	C	C	.	.			trans	-150.6	156.6	177.4	179.9	178	-173.3	154.3	12.5	107.4	V138 P200 E202 R203 Y280 H297 E298 Y362	V138-R198 HydrophobicContact CB-CB 4.46Å; V138-R198 HydrophobicContact CG1-CB 3.35Å; V138-R198 HydrophobicContact CG1-CG 4.46Å; R198-P200 VanDerWaalsContact O-N 3.15Å; R198-E202 HydrophobicContact CG-CB 4.33Å; R198-E202 IonicContact CZ-OE2 3.05Å; R198-E202 IonicContact NE-OE2 2.77Å; R198-E202 PolarHBondContact NE-OE2 3.18Å; R198-E202 VanDerWaalsContact NE-OE2 3.12Å; R198-E202 IonicContact NH2-OE2 3.57Å; R198-E202 PolarHBondContact NH2-OE2 3.43Å; R198-R203 HydrophobicContact CB-CB 4.48Å; R198-Y280 PolarHBondContact N-OH 2.8Å; R198-Y280 PolarHBondContact O-OH 3.46Å; R198-H297 HydrophobicContact CB-CB 3.7Å; R198-H297 HydrophobicContact CG-CB 3.95Å; R198-H297 PolarHBondContact NH1-CE1 3.03Å; R198-E298 WeakPolarHBondContact CG-OE1 3.3Å; R198-Y362 VanDerWaalsContact C-OH 3.23Å; R198-Y362 WeakPolarHBondContact CA-OH 3.24Å; R198-Y362 PolarHBondContact N-OH 3.18Å
199	D	98.4	Very high	98.2	Very high	5 Å²	5	20.4 Å²	20.4	3%	0.027	11%	0.107	C	C	.	.			trans	-42.5	124.4	169.5	173.3	-89.6	0	0	0	110.4	F201 E202 R203 E298 Y329 Y362	D199-F201 VanDerWaalsContact C-N 3.25Å; D199-F201 PolarHBondContact O-N 3.42Å; D199-F201 PolarHBondContact OD1-N 3.3Å; D199-E202 HydrophobicContact CB-CB 4.12Å; D199-E202 HydrophobicContact CB-CG 4.15Å; D199-E202 PolarHBondContact O-N 2.83Å; D199-E202 PolarHBondContact OD1-N 2.95Å; D199-R203 WeakPolarHBondContact O-CB 3.49Å; D199-R203 PolarHBondContact O-N 3.12Å; D199-E298 PolarHBondContact N-OE1 3.15Å; D199-Y329 HydrophobicContact CB-CD2 3.91Å; D199-Y329 HydrophobicContact CB-CE2 3.97Å; D199-Y362 HydrophobicContact CB-CD1 4.03Å; D199-Y362 HydrophobicContact CB-CE1 4.06Å; D199-Y362 VanDerWaalsContact N-CE1 3.29Å; D199-Y362 VanDerWaalsContact N-CZ 3.27Å; D199-Y362 PolarHBondContact N-OH 3.46Å
200	P	98.4	Very high	98.1	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-57.3	-37.3	-171.2	-29.4	36.4	0	0	0	113.2	R198 R203 L204 Y353 D356 F357	R198-P200 VanDerWaalsContact O-N 3.15Å; P200-R203 PolarHBondContact O-N 3.08Å; P200-L204 VanDerWaalsContact O-CG 3.31Å; P200-L204 WeakPolarHBondContact O-CG 3.35Å; P200-L204 PolarHBondContact O-N 3.01Å; P200-L204 VanDerWaalsContact O-N 3.12Å; P200-Y353 HydrophobicContact CB-CD1 4.5Å; P200-Y353 HydrophobicContact CB-CG 4.45Å; P200-D356 HydrophobicContact CB-CB 4.34Å; P200-D356 HydrophobicContact CG-CB 3.71Å; P200-F357 HydrophobicContact CB-CD2 4.12Å; P200-F357 HydrophobicContact CB-CE2 3.62Å; P200-F357 HydrophobicContact CB-CZ 3.91Å; P200-F357 HydrophobicContact CG-CD1 4.22Å; P200-F357 HydrophobicContact CG-CD2 3.73Å; P200-F357 HydrophobicContact CG-CE1 4.16Å; P200-F357 HydrophobicContact CG-CE2 3.67Å; P200-F357 HydrophobicContact CG-CG 3.99Å; P200-F357 HydrophobicContact CG-CZ 3.89Å
201	F	98.4	Very high	98	Very high	1 Å²	1	13.4 Å²	13.4	0%	0.004	6%	0.064	C	C	.	.	H	α-helix	trans	-79.1	-37.3	-177.9	-76.1	5.6	0	0	0	112.4	D199 R203 L204 I205 V334 F338 I346 L349 F357 P365 L368	D199-F201 VanDerWaalsContact C-N 3.25Å; D199-F201 PolarHBondContact O-N 3.42Å; D199-F201 PolarHBondContact OD1-N 3.3Å; F201-R203 VanDerWaalsContact C-N 3.29Å; F201-R203 PolarHBondContact O-N 2.93Å; F201-L204 HydrophobicContact CD1-CD1 4.24Å; F201-L204 PolarHBondContact O-N 3.21Å; F201-I205 WeakPolarHBondContact O-CG1 3.43Å; F201-I205 PolarHBondContact O-N 3.12Å; F201-V334 HydrophobicContact CB-CG1 4.49Å; F201-F338 HydrophobicContact CB-CE2 4.02Å; F201-F338 HydrophobicContact CB-CZ 4.24Å; F201-F338 HydrophobicContact CD1-CZ 4.38Å; F201-F338 HydrophobicContact CD2-CE1 4.32Å; F201-F338 AromaticContact CD2-CE2 3.84Å; F201-F338 HydrophobicContact CD2-CE2 3.84Å; F201-F338 AromaticContact CD2-CZ 3.63Å; F201-F338 HydrophobicContact CD2-CZ 3.63Å; F201-F338 HydrophobicContact CE2-CE1 4.27Å; F201-F338 HydrophobicContact CE2-CZ 4Å; F201-F338 HydrophobicContact CG-CE2 4.06Å; F201-F338 AromaticContact CG-CZ 3.84Å; F201-F338 HydrophobicContact CG-CZ 3.84Å; F201-I346 HydrophobicContact CE2-CG2 4.38Å; F201-L349 HydrophobicContact CD1-CD2 4.11Å; F201-L349 HydrophobicContact CE1-CD2 3.6Å; F201-L349 HydrophobicContact CE1-CG 3.8Å; F201-L349 HydrophobicContact CZ-CD2 3.83Å; F201-L349 HydrophobicContact CZ-CG 4.13Å; F201-F357 HydrophobicContact CD1-CE2 4.04Å; F201-F357 AromaticContact CD1-CZ 3.99Å; F201-F357 HydrophobicContact CD1-CZ 3.99Å; F201-F357 HydrophobicContact CD2-CZ 4.43Å; F201-F357 AromaticContact CE1-CE2 3.92Å; F201-F357 HydrophobicContact CE1-CE2 3.92Å; F201-F357 HydrophobicContact CE1-CZ 4.21Å; F201-F357 HydrophobicContact CG-CZ 4.12Å; F201-F357 HydrophobicContact CZ-CE2 4.38Å; F201-P365 HydrophobicContact CD2-CB 4.45Å; F201-P365 HydrophobicContact CD2-CG 4.13Å; F201-P365 HydrophobicContact CE2-CB 4.41Å; F201-P365 HydrophobicContact CE2-CG 3.72Å; F201-P365 HydrophobicContact CZ-CG 4.36Å; F201-L368 HydrophobicContact CD2-CD1 3.62Å; F201-L368 HydrophobicContact CE2-CD1 3.79Å
202	E	97.5	Very high	97.8	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.005	6%	0.062	C	C	.	.	H	α-helix	trans	-61.5	-39	169.2	-72.7	-144.7	133.1	0	0	112.4	R198 D199 L204 I205 S206 Y329 N330 K333 V334	R198-E202 HydrophobicContact CG-CB 4.33Å; R198-E202 IonicContact CZ-OE2 3.05Å; R198-E202 IonicContact NE-OE2 2.77Å; R198-E202 PolarHBondContact NE-OE2 3.18Å; R198-E202 VanDerWaalsContact NE-OE2 3.12Å; R198-E202 IonicContact NH2-OE2 3.57Å; R198-E202 PolarHBondContact NH2-OE2 3.43Å; D199-E202 HydrophobicContact CB-CB 4.12Å; D199-E202 HydrophobicContact CB-CG 4.15Å; D199-E202 PolarHBondContact O-N 2.83Å; D199-E202 PolarHBondContact OD1-N 2.95Å; E202-L204 VanDerWaalsContact C-N 3.32Å; E202-L204 PolarHBondContact O-N 2.86Å; E202-I205 PolarHBondContact O-N 2.67Å; E202-S206 WeakPolarHBondContact O-CB 3.3Å; E202-S206 PolarHBondContact O-N 3.43Å; E202-Y329 VanDerWaalsContact CD-CD2 3.49Å; E202-Y329 HydrophobicContact CG-CD2 3.65Å; E202-Y329 HydrophobicContact CG-CE2 3.71Å; E202-N330 PolarHBondContact OE1-N 2.52Å; E202-K333 WeakPolarHBondContact OE1-CE 3.08Å; E202-K333 IonicContact OE1-NZ 3.02Å; E202-K333 PolarHBondContact OE1-NZ 3.14Å; E202-K333 IonicContact OE2-NZ 3.37Å; E202-V334 HydrophobicContact CG-CG2 3.73Å
203	R	98.1	Very high	97.6	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-59.1	-44.5	174.6	176.3	166.2	70.6	98.9	-6.5	111.1	K137 R198 D199 P200 F201 S206 A207 H276 V278 Y280 D356	K137-R203 HydrophobicContact CB-CG 4.19Å; R198-R203 HydrophobicContact CB-CB 4.48Å; D199-R203 WeakPolarHBondContact O-CB 3.49Å; D199-R203 PolarHBondContact O-N 3.12Å; P200-R203 PolarHBondContact O-N 3.08Å; F201-R203 VanDerWaalsContact C-N 3.29Å; F201-R203 PolarHBondContact O-N 2.93Å; R203-S206 WeakPolarHBondContact O-CB 3.04Å; R203-S206 PolarHBondContact O-N 3.28Å; R203-A207 WeakPolarHBondContact O-CB 3.42Å; R203-A207 PolarHBondContact O-N 2.99Å; R203-H276 PolarHBondContact NH1-O 3.32Å; R203-V278 VanDerWaalsContact CZ-O 3.24Å; R203-V278 PolarHBondContact NH1-O 3.47Å; R203-V278 PolarHBondContact NH2-O 3.45Å; R203-Y280 WeakPolarHBondContact CD-OH 3.09Å; R203-Y280 PolarHBondContact NE-OH 3.16Å; R203-D356 IonicContact NH2-OD2 3.76Å; R203-D356 PolarHBondContact NH2-OD2 3.41Å
204	L	98.6	Very high	97.3	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-64.7	-42.1	177.1	-68.1	178.7	0	0	0	112.7	P200 F201 E202 S206 A207 F208 L257 W277 L349 Y353	P200-L204 VanDerWaalsContact O-CG 3.31Å; P200-L204 WeakPolarHBondContact O-CG 3.35Å; P200-L204 PolarHBondContact O-N 3.01Å; P200-L204 VanDerWaalsContact O-N 3.12Å; F201-L204 HydrophobicContact CD1-CD1 4.24Å; F201-L204 PolarHBondContact O-N 3.21Å; E202-L204 VanDerWaalsContact C-N 3.32Å; E202-L204 PolarHBondContact O-N 2.86Å; L204-S206 VanDerWaalsContact C-N 3.31Å; L204-S206 PolarHBondContact O-N 3.12Å; L204-A207 PolarHBondContact O-N 2.77Å; L204-F208 WeakPolarHBondContact O-CB 3.21Å; L204-F208 PolarHBondContact O-N 3.32Å; L204-L257 HydrophobicContact CD1-CD1 3.89Å; L204-L257 HydrophobicContact CD2-CD1 3.7Å; L204-L257 HydrophobicContact CG-CD1 4.34Å; L204-W277 HydrophobicContact CD2-CB 3.59Å; L204-L349 HydrophobicContact CD1-CD1 3.93Å; L204-L349 HydrophobicContact CD1-CD2 4.02Å; L204-L349 HydrophobicContact CD1-CG 4.29Å; L204-Y353 HydrophobicContact CD1-CD2 4.06Å; L204-Y353 HydrophobicContact CD1-CE2 3.63Å; L204-Y353 HydrophobicContact CD2-CE1 4.32Å; L204-Y353 HydrophobicContact CD2-CE2 4.34Å; L204-Y353 HydrophobicContact CG-CE2 4.47Å
205	I	98.2	Very high	96.6	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.01	12%	0.122	C	C	.	.	H	α-helix	trans	-60.6	-44.7	174.1	-68.3	164.6	0	0	0	109.8	F201 E202 A207 F208 K209 F250 V334 Y337 F338	F201-I205 WeakPolarHBondContact O-CG1 3.43Å; F201-I205 PolarHBondContact O-N 3.12Å; E202-I205 PolarHBondContact O-N 2.67Å; I205-A207 VanDerWaalsContact C-N 3.33Å; I205-A207 PolarHBondContact O-N 3.31Å; I205-F208 PolarHBondContact O-N 3.02Å; I205-K209 HydrophobicContact CG2-CD 4.04Å; I205-K209 HydrophobicContact CG2-CG 4.37Å; I205-K209 WeakPolarHBondContact O-CB 3.3Å; I205-K209 VanDerWaalsContact O-CG 3.3Å; I205-K209 WeakPolarHBondContact O-CG 3.45Å; I205-K209 PolarHBondContact O-N 2.97Å; I205-F250 HydrophobicContact CG1-CE1 4.35Å; I205-F250 HydrophobicContact CG1-CE2 4Å; I205-F250 HydrophobicContact CG1-CZ 3.67Å; I205-V334 HydrophobicContact CD1-CB 4.35Å; I205-V334 HydrophobicContact CD1-CG2 4.04Å; I205-Y337 HydrophobicContact CD1-CD2 4.09Å; I205-Y337 HydrophobicContact CD1-CG 4.03Å; I205-Y337 HydrophobicContact CG1-CD1 4.38Å; I205-Y337 HydrophobicContact CG1-CD2 4.23Å; I205-Y337 HydrophobicContact CG1-CG 3.93Å; I205-Y337 HydrophobicContact CG2-CD1 4.27Å; I205-Y337 HydrophobicContact CG2-CD2 3.59Å; I205-Y337 HydrophobicContact CG2-CE1 4.22Å; I205-Y337 HydrophobicContact CG2-CE2 3.53Å; I205-Y337 HydrophobicContact CG2-CG 3.98Å; I205-F338 HydrophobicContact CD1-CE2 4.27Å
206	S	97	Very high	95.9	Very high	33 Å²	33	26 Å²	26	23%	0.231	13%	0.132	C	C	.	.	H	α-helix	trans	-62.4	-40.2	176.4	-174.5	0	0	0	0	112.1	E202 R203 L204 D210	E202-S206 WeakPolarHBondContact O-CB 3.3Å; E202-S206 PolarHBondContact O-N 3.43Å; R203-S206 WeakPolarHBondContact O-CB 3.04Å; R203-S206 PolarHBondContact O-N 3.28Å; L204-S206 VanDerWaalsContact C-N 3.31Å; L204-S206 PolarHBondContact O-N 3.12Å; S206-D210 VanDerWaalsContact O-CB 3.27Å; S206-D210 WeakPolarHBondContact O-CB 3.4Å; S206-D210 PolarHBondContact O-N 2.81Å; S206-D210 VanDerWaalsContact O-N 3.09Å
207	A	97.9	Very high	95.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.9	-46.8	176.1	0	0	0	0	0	111.2	K137 R203 L204 I205 D210 K211 H276	K137-A207 HydrophobicContact CG-CB 4.08Å; R203-A207 WeakPolarHBondContact O-CB 3.42Å; R203-A207 PolarHBondContact O-N 2.99Å; L204-A207 PolarHBondContact O-N 2.77Å; I205-A207 VanDerWaalsContact C-N 3.33Å; I205-A207 PolarHBondContact O-N 3.31Å; A207-D210 PolarHBondContact O-N 3.29Å; A207-K211 WeakPolarHBondContact O-CB 3.38Å; A207-K211 WeakPolarHBondContact O-CG 3.22Å; A207-K211 PolarHBondContact O-N 3.43Å; A207-H276 HydrophobicContact CB-CB 4.04Å
208	F	98.2	Very high	94.5	Very high	10 Å²	10	45 Å²	45	4%	0.044	21%	0.209	C	C	.	.	H	α-helix	trans	-62.1	-48.7	-180	177.8	-95.2	0	0	0	112.3	L204 I205 D210 K211 F212 V213 L248 H249 F250 F253 Y337	L204-F208 WeakPolarHBondContact O-CB 3.21Å; L204-F208 PolarHBondContact O-N 3.32Å; I205-F208 PolarHBondContact O-N 3.02Å; F208-D210 VanDerWaalsContact C-N 3.3Å; F208-D210 PolarHBondContact O-N 3.31Å; F208-K211 PolarHBondContact O-N 2.99Å; F208-F212 HydrophobicContact CD2-CB 4.25Å; F208-F212 AromaticContact CD2-CD2 3.66Å; F208-F212 HydrophobicContact CD2-CD2 3.66Å; F208-F212 HydrophobicContact CD2-CG 4.37Å; F208-F212 HydrophobicContact CE2-CB 4.13Å; F208-F212 HydrophobicContact CE2-CD2 4.18Å; F208-F212 HydrophobicContact CG-CD2 4.36Å; F208-F212 PolarHBondContact O-N 3.09Å; F208-V213 HydrophobicContact CD1-CG2 3.98Å; F208-V213 HydrophobicContact CE1-CG2 3.61Å; F208-V213 HydrophobicContact CZ-CG2 4.4Å; F208-V213 PolarHBondContact O-N 3.32Å; F208-L248 HydrophobicContact CE2-CD2 4.1Å; F208-L248 HydrophobicContact CE2-CG 4.05Å; F208-L248 VanDerWaalsContact CZ-O 3.23Å; F208-L248 WeakPolarHBondContact CZ-O 3.2Å; F208-H249 VanDerWaalsContact CZ-C 3.46Å; F208-F250 HydrophobicContact CB-CD2 3.84Å; F208-F250 HydrophobicContact CB-CE2 4.05Å; F208-F250 HydrophobicContact CD1-CB 4.27Å; F208-F250 AromaticContact CD1-CD2 3.78Å; F208-F250 HydrophobicContact CD1-CD2 3.78Å; F208-F250 HydrophobicContact CD1-CG 4.48Å; F208-F250 AromaticContact CD2-CD2 3.93Å; F208-F250 HydrophobicContact CD2-CD2 3.93Å; F208-F250 HydrophobicContact CE1-CB 3.95Å; F208-F250 HydrophobicContact CE1-CD2 4.32Å; F208-F250 HydrophobicContact CE2-CB 4.33Å; F208-F250 HydrophobicContact CE2-CD2 4.44Å; F208-F250 AromaticContact CG-CD2 3.57Å; F208-F250 HydrophobicContact CG-CD2 3.57Å; F208-F250 HydrophobicContact CG-CE2 4.29Å; F208-F250 HydrophobicContact CZ-CB 3.99Å; F208-F253 HydrophobicContact CB-CD1 4.02Å; F208-F253 HydrophobicContact CB-CE1 4.11Å; F208-F253 HydrophobicContact CD2-CB 3.86Å; F208-F253 AromaticContact CD2-CD1 3.78Å; F208-F253 HydrophobicContact CD2-CD1 3.78Å; F208-F253 AromaticContact CD2-CG 3.91Å; F208-F253 HydrophobicContact CD2-CG 3.91Å; F208-F253 HydrophobicContact CE2-CB 4.08Å; F208-F253 HydrophobicContact CG-CD1 4.31Å; F208-Y337 HydrophobicContact CD1-CE1 4.28Å; F208-Y337 HydrophobicContact CE1-CE1 4.5Å
209	K	96.4	Very high	94.1	Very high	89 Å²	89	46.5 Å²	46.5	39%	0.387	22%	0.216	S	C	.	.	I	π-helix	trans	-58.8	-44	176.8	-72.2	-179	75.5	171	0	111.6	I205 V213 K214 Y337	I205-K209 HydrophobicContact CG2-CD 4.04Å; I205-K209 HydrophobicContact CG2-CG 4.37Å; I205-K209 WeakPolarHBondContact O-CB 3.3Å; I205-K209 VanDerWaalsContact O-CG 3.3Å; I205-K209 WeakPolarHBondContact O-CG 3.45Å; I205-K209 PolarHBondContact O-N 2.97Å; K209-V213 WeakPolarHBondContact O-CB 3.46Å; K209-V213 PolarHBondContact O-N 3.29Å; K209-K214 PolarHBondContact O-N 2.91Å; K209-Y337 HydrophobicContact CD-CE2 4.3Å; K209-Y337 WeakPolarHBondContact CD-OH 3.38Å; K209-Y337 WeakPolarHBondContact CG-OH 3.37Å
210	D	94.9	Very high	93.9	Very high	38 Å²	38	49.2 Å²	49.2	20%	0.203	23%	0.234	C	C	.	.	I	π-helix	trans	-66.7	-48.5	-179.6	-170.8	69.5	0	0	0	112	K137 S206 A207 F208 P216	K137-D210 IonicContact NZ-OD1 2.72Å; K137-D210 IonicContact NZ-OD2 3.89Å; K137-D210 PolarHBondContact NZ-OD2 3.2Å; S206-D210 VanDerWaalsContact O-CB 3.27Å; S206-D210 WeakPolarHBondContact O-CB 3.4Å; S206-D210 PolarHBondContact O-N 2.81Å; S206-D210 VanDerWaalsContact O-N 3.09Å; A207-D210 PolarHBondContact O-N 3.29Å; F208-D210 VanDerWaalsContact C-N 3.3Å; F208-D210 PolarHBondContact O-N 3.31Å; D210-P216 WeakPolarHBondContact O-CD 3.27Å
211	K	95.9	Very high	93.7	Very high	7 Å²	7	52.5 Å²	52.5	3%	0.03	25%	0.247	C	C	.	.	I	π-helix	trans	-87.4	-34.4	-169.2	-62.5	-41.4	-171	-164.3	0	114.6	A207 F208 N215 P216 E219 Y222 H276	A207-K211 WeakPolarHBondContact O-CB 3.38Å; A207-K211 WeakPolarHBondContact O-CG 3.22Å; A207-K211 PolarHBondContact O-N 3.43Å; F208-K211 PolarHBondContact O-N 2.99Å; K211-N215 PolarHBondContact O-OD1 3.27Å; K211-P216 HydrophobicContact CD-CG 4.43Å; K211-E219 WeakPolarHBondContact CE-OE1 3.41Å; K211-E219 IonicContact NZ-OE1 3.96Å; K211-E219 PolarHBondContact NZ-OE1 3.39Å; K211-E219 IonicContact NZ-OE2 3.66Å; K211-E219 PolarHBondContact NZ-OE2 3.25Å; K211-Y222 HydrophobicContact CB-CD1 3.78Å; K211-Y222 HydrophobicContact CB-CD2 4.12Å; K211-Y222 HydrophobicContact CB-CE1 4.15Å; K211-Y222 HydrophobicContact CB-CE2 4.44Å; K211-Y222 HydrophobicContact CB-CG 3.8Å; K211-Y222 HydrophobicContact CD-CD2 3.75Å; K211-Y222 HydrophobicContact CD-CE1 4.32Å; K211-Y222 HydrophobicContact CD-CE2 3.46Å; K211-Y222 VanDerWaalsContact CD-CE2 3.46Å; K211-Y222 HydrophobicContact CD-CG 4.3Å; K211-Y222 HydrophobicContact CG-CD1 4.08Å; K211-Y222 HydrophobicContact CG-CD2 4.17Å; K211-Y222 HydrophobicContact CG-CE1 3.92Å; K211-Y222 HydrophobicContact CG-CE2 3.99Å; K211-Y222 HydrophobicContact CG-CG 4.23Å; K211-Y222 WeakPolarHBondContact O-CB 3.46Å; K211-H276 WeakPolarHBondContact CE-CD2 3.4Å; K211-H276 VanDerWaalsContact CE-CE1 3.43Å; K211-H276 WeakPolarHBondContact CE-CE1 3.17Å; K211-H276 WeakPolarHBondContact CE-NE2 3.39Å
212	F	95.7	Very high	93.6	Very high	10 Å²	10	52.6 Å²	52.6	4%	0.044	25%	0.247	C	C	.	.	I	π-helix	trans	-115.2	-21.4	-170.6	-55.4	-65.4	0	0	0	114.2	F208 N215 Y222 I226 A227 L248 F253 W277	F208-F212 HydrophobicContact CD2-CB 4.25Å; F208-F212 AromaticContact CD2-CD2 3.66Å; F208-F212 HydrophobicContact CD2-CD2 3.66Å; F208-F212 HydrophobicContact CD2-CG 4.37Å; F208-F212 HydrophobicContact CE2-CB 4.13Å; F208-F212 HydrophobicContact CE2-CD2 4.18Å; F208-F212 HydrophobicContact CG-CD2 4.36Å; F208-F212 PolarHBondContact O-N 3.09Å; F212-N215 PolarHBondContact O-ND2 3.14Å; F212-N215 PolarHBondContact O-OD1 2.82Å; F212-Y222 AromaticContact CE1-CD1 3.99Å; F212-Y222 HydrophobicContact CE1-CD1 3.99Å; F212-Y222 HydrophobicContact CE1-CG 4.45Å; F212-Y222 HydrophobicContact CZ-CD1 4.09Å; F212-I226 HydrophobicContact CE1-CB 4.3Å; F212-I226 HydrophobicContact CE1-CG2 3.88Å; F212-I226 HydrophobicContact CZ-CG2 3.84Å; F212-A227 HydrophobicContact CD1-CB 3.92Å; F212-A227 HydrophobicContact CE1-CB 4.15Å; F212-L248 HydrophobicContact CB-CB 4.38Å; F212-L248 HydrophobicContact CB-CD2 4.35Å; F212-L248 HydrophobicContact CD1-CD2 3.81Å; F212-L248 HydrophobicContact CD2-CD2 3.73Å; F212-L248 HydrophobicContact CE1-CD2 3.93Å; F212-L248 HydrophobicContact CE2-CD2 3.87Å; F212-L248 HydrophobicContact CG-CB 4.49Å; F212-L248 HydrophobicContact CG-CD2 3.69Å; F212-L248 HydrophobicContact CZ-CD2 3.97Å; F212-F253 HydrophobicContact CE2-CD2 4.05Å; F212-F253 AromaticContact CE2-CE2 3.84Å; F212-F253 HydrophobicContact CE2-CE2 3.84Å; F212-F253 HydrophobicContact CE2-CZ 4.27Å; F212-F253 HydrophobicContact CZ-CE2 4.48Å; F212-W277 HydrophobicContact CE2-CH2 4.45Å; F212-W277 HydrophobicContact CE2-CZ3 4.14Å; F212-W277 AromaticContact CZ-CH2 3.97Å; F212-W277 HydrophobicContact CZ-CH2 3.97Å; F212-W277 HydrophobicContact CZ-CZ3 4.07Å
213	V	93.9	Very high	93.4	Very high	85 Å²	85	58 Å²	58	52%	0.515	27%	0.271	S	S	.	.	I	π-helix	trans	-93.1	-56.6	175	-176.5	0	0	0	0	110.5	F208 K209 N215	F208-V213 HydrophobicContact CD1-CG2 3.98Å; F208-V213 HydrophobicContact CE1-CG2 3.61Å; F208-V213 HydrophobicContact CZ-CG2 4.4Å; F208-V213 PolarHBondContact O-N 3.32Å; K209-V213 WeakPolarHBondContact O-CB 3.46Å; K209-V213 PolarHBondContact O-N 3.29Å; V213-N215 VanDerWaalsContact C-N 3.3Å; V213-N215 PolarHBondContact O-N 2.99Å; V213-N215 PolarHBondContact O-ND2 2.04Å
214	K	92.1	Very high	93.2	Very high	156 Å²	156	63.8 Å²	63.8	68%	0.678	30%	0.297	S	S	*	.	S	Bend	trans	-67.1	-30.9	177.9	-69.8	-176.5	179.3	-177.4	0	112.8	K209	K209-K214 PolarHBondContact O-N 2.91Å
215	N	84.4	Confident	93	Very high	58 Å²	58	68.4 Å²	68.4	31%	0.31	32%	0.322	S	S	.	.			trans	48.3	69.7	-178.4	-68.1	-64.6	0	0	0	112.4	K211 F212 V213 R217	K211-N215 PolarHBondContact O-OD1 3.27Å; F212-N215 PolarHBondContact O-ND2 3.14Å; F212-N215 PolarHBondContact O-OD1 2.82Å; V213-N215 VanDerWaalsContact C-N 3.3Å; V213-N215 PolarHBondContact O-N 2.99Å; V213-N215 PolarHBondContact O-ND2 2.04Å; N215-R217 PolarHBondContact O-N 3.41Å
216	P	84.6	Confident	93	Very high	33 Å²	33	68.4 Å²	68.4	21%	0.214	32%	0.322	C	S	.	.			trans	-58.3	129.3	-175.1	20.6	-31	0	0	0	111.2	D210 K211 F218 E219	D210-P216 WeakPolarHBondContact O-CD 3.27Å; K211-P216 HydrophobicContact CD-CG 4.43Å; P216-F218 PolarHBondContact O-N 3.05Å; P216-F218 VanDerWaalsContact O-N 3.12Å; P216-E219 HydrophobicContact CG-CB 4.15Å; P216-E219 HydrophobicContact CG-CG 4.49Å; P216-E219 WeakPolarHBondContact CG-OE2 3.43Å; P216-E219 PolarHBondContact O-N 3.43Å
217	R	82.3	Confident	92.9	Very high	230 Å²	230	67.2 Å²	67.2	87%	0.868	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-32.2	-175.3	-75.2	-173.2	-83	171	-5.7	113.7	N215 E219	N215-R217 PolarHBondContact O-N 3.41Å; R217-E219 VanDerWaalsContact C-N 3.32Å
218	F	85.4	Confident	92.8	Very high	172 Å²	172	69.3 Å²	69.3	75%	0.754	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	0.6	-177.8	-57.2	-68.8	0	0	0	113.9	P216 P220	P216-F218 PolarHBondContact O-N 3.05Å; P216-F218 VanDerWaalsContact O-N 3.12Å; F218-P220 VanDerWaalsContact C-CD 3.41Å
219	E	90.7	Very high	92.7	Very high	45 Å²	45	70 Å²	70	21%	0.21	34%	0.335	C	S	.	.			trans	-131.3	59.5	176.5	-55.1	169.6	96.9	0	0	110.8	K211 P216 R217 W221 Y222	K211-E219 WeakPolarHBondContact CE-OE1 3.41Å; K211-E219 IonicContact NZ-OE1 3.96Å; K211-E219 PolarHBondContact NZ-OE1 3.39Å; K211-E219 IonicContact NZ-OE2 3.66Å; K211-E219 PolarHBondContact NZ-OE2 3.25Å; P216-E219 HydrophobicContact CG-CB 4.15Å; P216-E219 HydrophobicContact CG-CG 4.49Å; P216-E219 WeakPolarHBondContact CG-OE2 3.43Å; P216-E219 PolarHBondContact O-N 3.43Å; R217-E219 VanDerWaalsContact C-N 3.32Å; E219-W221 HydrophobicContact CB-CD2 4.34Å; E219-W221 HydrophobicContact CB-CH2 3.82Å; E219-W221 HydrophobicContact CB-CZ2 3.43Å; E219-W221 VanDerWaalsContact CB-CZ2 3.43Å; E219-W221 HydrophobicContact CB-CZ3 4.4Å; E219-W221 HydrophobicContact CG-CH2 3.78Å; E219-W221 HydrophobicContact CG-CZ2 3.51Å; E219-W221 PolarHBondContact O-N 2.95Å; E219-W221 VanDerWaalsContact O-N 3.16Å; E219-Y222 HydrophobicContact CB-CD2 3.64Å; E219-Y222 HydrophobicContact CB-CE2 3.68Å; E219-Y222 HydrophobicContact CG-CE2 4.27Å; E219-Y222 WeakPolarHBondContact O-CD2 3.37Å; E219-Y222 PolarHBondContact O-N 3.05Å; E219-Y222 WeakPolarHBondContact OE1-CE2 3.09Å
220	P	93.2	Very high	92.7	Very high	62 Å²	62	65.8 Å²	65.8	40%	0.403	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.1	-170.9	24.3	-34.8	0	0	0	114	F218 Y222 K223 H224	F218-P220 VanDerWaalsContact C-CD 3.41Å; P220-Y222 PolarHBondContact O-N 3.17Å; P220-K223 PolarHBondContact O-N 2.84Å; P220-H224 PolarHBondContact O-CD2 2.94Å; P220-H224 PolarHBondContact O-N 3.29Å
221	W	94.8	Very high	92.7	Very high	69 Å²	69	65.7 Å²	65.7	26%	0.261	32%	0.316	S	S	.	.	H	α-helix	trans	-58.6	-28	-179	53.7	83	0	0	0	113.5	E219 K223 D225 I226 H273	E219-W221 HydrophobicContact CB-CD2 4.34Å; E219-W221 HydrophobicContact CB-CH2 3.82Å; E219-W221 HydrophobicContact CB-CZ2 3.43Å; E219-W221 VanDerWaalsContact CB-CZ2 3.43Å; E219-W221 HydrophobicContact CB-CZ3 4.4Å; E219-W221 HydrophobicContact CG-CH2 3.78Å; E219-W221 HydrophobicContact CG-CZ2 3.51Å; E219-W221 PolarHBondContact O-N 2.95Å; E219-W221 VanDerWaalsContact O-N 3.16Å; W221-K223 VanDerWaalsContact C-N 3.31Å; W221-K223 PolarHBondContact O-N 2.97Å; W221-D225 WeakPolarHBondContact CA-OD2 3.43Å; W221-D225 WeakPolarHBondContact CB-OD2 3.27Å; W221-D225 WeakPolarHBondContact O-CB 3.33Å; W221-D225 PolarHBondContact O-N 3.2Å; W221-I226 PolarHBondContact O-N 3.19Å; W221-H273 AromaticContact CD1-CD2 3.76Å; W221-H273 AromaticContact CD1-CG 3.54Å; W221-H273 AromaticContact CD1-ND1 3.8Å; W221-H273 AromaticContact CD2-CE1 3.83Å; W221-H273 AromaticContact CE2-CE1 3.47Å; W221-H273 VanDerWaalsContact CE2-CE1 3.47Å; W221-H273 AromaticContact CE2-CG 3.97Å; W221-H273 AromaticContact CE2-ND1 3.39Å; W221-H273 AromaticContact CZ2-CE1 3.74Å; W221-H273 AromaticContact CZ2-ND1 3.71Å; W221-H273 AromaticContact NE1-CD2 3.95Å; W221-H273 AromaticContact NE1-CE1 3.68Å; W221-H273 AromaticContact NE1-CG 3.36Å; W221-H273 AromaticContact NE1-ND1 3.19Å; W221-H273 PolarHBondContact NE1-ND1 2.7Å; W221-H273 VanDerWaalsContact NE1-ND1 3.19Å
222	Y	96.2	Very high	92.6	Very high	3 Å²	3	75.4 Å²	75.4	1%	0.012	35%	0.353	C	S	.	.	I	π-helix	trans	-62.8	-40.9	174.8	-69.1	-67.7	0	0	0	112	K211 F212 E219 P220 I226 A227 H273 H276 W277	K211-Y222 HydrophobicContact CB-CD1 3.78Å; K211-Y222 HydrophobicContact CB-CD2 4.12Å; K211-Y222 HydrophobicContact CB-CE1 4.15Å; K211-Y222 HydrophobicContact CB-CE2 4.44Å; K211-Y222 HydrophobicContact CB-CG 3.8Å; K211-Y222 HydrophobicContact CD-CD2 3.75Å; K211-Y222 HydrophobicContact CD-CE1 4.32Å; K211-Y222 HydrophobicContact CD-CE2 3.46Å; K211-Y222 VanDerWaalsContact CD-CE2 3.46Å; K211-Y222 HydrophobicContact CD-CG 4.3Å; K211-Y222 HydrophobicContact CG-CD1 4.08Å; K211-Y222 HydrophobicContact CG-CD2 4.17Å; K211-Y222 HydrophobicContact CG-CE1 3.92Å; K211-Y222 HydrophobicContact CG-CE2 3.99Å; K211-Y222 HydrophobicContact CG-CG 4.23Å; K211-Y222 WeakPolarHBondContact O-CB 3.46Å; F212-Y222 AromaticContact CE1-CD1 3.99Å; F212-Y222 HydrophobicContact CE1-CD1 3.99Å; F212-Y222 HydrophobicContact CE1-CG 4.45Å; F212-Y222 HydrophobicContact CZ-CD1 4.09Å; E219-Y222 HydrophobicContact CB-CD2 3.64Å; E219-Y222 HydrophobicContact CB-CE2 3.68Å; E219-Y222 HydrophobicContact CG-CE2 4.27Å; E219-Y222 WeakPolarHBondContact O-CD2 3.37Å; E219-Y222 PolarHBondContact O-N 3.05Å; E219-Y222 WeakPolarHBondContact OE1-CE2 3.09Å; P220-Y222 PolarHBondContact O-N 3.17Å; Y222-I226 HydrophobicContact CD1-CD1 3.65Å; Y222-I226 HydrophobicContact CE1-CD1 3.8Å; Y222-A227 WeakPolarHBondContact O-CB 3.29Å; Y222-A227 PolarHBondContact O-N 2.97Å; Y222-H273 HydrophobicContact CE1-CB 4.34Å; Y222-H273 PolarHBondContact OH-O 2.8Å; Y222-H276 AromaticContact CZ-CD2 3.8Å; Y222-H276 PolarHBondContact OH-CD2 3.19Å; Y222-H276 PolarHBondContact OH-NE2 3.18Å; Y222-W277 HydrophobicContact CD1-CH2 4.2Å; Y222-W277 HydrophobicContact CD1-CZ3 4.39Å; Y222-W277 AromaticContact CE1-CH2 3.76Å; Y222-W277 HydrophobicContact CE1-CH2 3.76Å; Y222-W277 AromaticContact CE1-CZ3 3.86Å; Y222-W277 HydrophobicContact CE1-CZ3 3.86Å
223	K	93.9	Very high	92.6	Very high	116 Å²	116	79.9 Å²	79.9	50%	0.504	37%	0.372	S	S	.	.	I	π-helix	trans	-80.6	-41.3	-179.8	-178.3	179.3	176.6	-178.4	0	112.1	P220 W221 P228	P220-K223 PolarHBondContact O-N 2.84Å; W221-K223 VanDerWaalsContact C-N 3.31Å; W221-K223 PolarHBondContact O-N 2.97Å; K223-P228 VanDerWaalsContact O-CD 3.22Å; K223-P228 WeakPolarHBondContact O-CD 3.49Å; K223-P228 WeakPolarHBondContact O-CG 3.4Å
224	H	93.3	Very high	92.6	Very high	120 Å²	120	76.9 Å²	76.9	56%	0.556	35%	0.352	S	S	*	.	I	π-helix	trans	-91.6	-28	-168.3	-68	-66.7	0	0	0	113.9	P220	P220-H224 PolarHBondContact O-CD2 2.94Å; P220-H224 PolarHBondContact O-N 3.29Å
225	D	94.6	Very high	92.6	Very high	98 Å²	98	71.7 Å²	71.7	52%	0.524	33%	0.328	S	S	.	.	I	π-helix	trans	-118.7	-54.8	-174.2	-52.3	-53.2	0	0	0	111.9	W221 A229	W221-D225 WeakPolarHBondContact CA-OD2 3.43Å; W221-D225 WeakPolarHBondContact CB-OD2 3.27Å; W221-D225 WeakPolarHBondContact O-CB 3.33Å; W221-D225 PolarHBondContact O-N 3.2Å; D225-A229 VanDerWaalsContact O-CB 3.27Å; D225-A229 WeakPolarHBondContact O-CB 3.43Å; D225-A229 PolarHBondContact O-N 3.12Å
226	I	97.3	Very high	92.4	Very high	2 Å²	2	73.4 Å²	73.4	1%	0.01	33%	0.333	C	S	.	.	I	π-helix	trans	-71.8	-54	-170.6	-60.2	179.9	0	0	0	111.4	F212 W221 Y222 A229 I230 F270 H273 W277	F212-I226 HydrophobicContact CE1-CB 4.3Å; F212-I226 HydrophobicContact CE1-CG2 3.88Å; F212-I226 HydrophobicContact CZ-CG2 3.84Å; W221-I226 PolarHBondContact O-N 3.19Å; Y222-I226 HydrophobicContact CD1-CD1 3.65Å; Y222-I226 HydrophobicContact CE1-CD1 3.8Å; I226-A229 PolarHBondContact O-N 2.78Å; I226-I230 HydrophobicContact CG2-CD1 3.75Å; I226-I230 HydrophobicContact CG2-CG1 4.48Å; I226-I230 WeakPolarHBondContact O-CG1 3.15Å; I226-I230 PolarHBondContact O-N 3.48Å; I226-F270 HydrophobicContact CB-CD1 4.49Å; I226-F270 HydrophobicContact CB-CE1 4.22Å; I226-F270 HydrophobicContact CB-CE2 4.5Å; I226-F270 HydrophobicContact CB-CZ 4.22Å; I226-F270 HydrophobicContact CD1-CB 4.39Å; I226-F270 HydrophobicContact CD1-CD1 4.43Å; I226-F270 HydrophobicContact CD1-CG 4.25Å; I226-F270 HydrophobicContact CG1-CD1 3.73Å; I226-F270 HydrophobicContact CG1-CD2 4.39Å; I226-F270 HydrophobicContact CG1-CE1 3.91Å; I226-F270 HydrophobicContact CG1-CG 3.98Å; I226-F270 HydrophobicContact CG1-CZ 4.32Å; I226-F270 HydrophobicContact CG2-CD2 4.1Å; I226-F270 HydrophobicContact CG2-CE1 4.34Å; I226-F270 HydrophobicContact CG2-CE2 3.75Å; I226-F270 HydrophobicContact CG2-CZ 3.88Å; I226-H273 HydrophobicContact CD1-CB 3.8Å; I226-W277 HydrophobicContact CD1-CH2 4.48Å; I226-W277 HydrophobicContact CG2-CH2 4.3Å
227	A	96.3	Very high	91.6	Very high	8 Å²	8	77.2 Å²	77.2	7%	0.066	36%	0.355	C	S	.	.	H	α-helix	trans	-57.8	-50.9	180	0	0	0	0	0	112.2	F212 Y222 A229 I230 I231 L248	F212-A227 HydrophobicContact CD1-CB 3.92Å; F212-A227 HydrophobicContact CE1-CB 4.15Å; Y222-A227 WeakPolarHBondContact O-CB 3.29Å; Y222-A227 PolarHBondContact O-N 2.97Å; A227-A229 VanDerWaalsContact C-N 3.3Å; A227-A229 PolarHBondContact O-N 2.79Å; A227-I230 PolarHBondContact O-N 3.49Å; A227-I231 WeakPolarHBondContact O-CB 3.45Å; A227-I231 WeakPolarHBondContact O-CG1 3.39Å; A227-I231 PolarHBondContact O-N 2.92Å; A227-L248 HydrophobicContact CB-CB 3.8Å; A227-L248 HydrophobicContact CB-CD2 4.39Å
228	P	94.9	Very high	90.4	Very high	45 Å²	45	73.7 Å²	73.7	29%	0.292	35%	0.348	S	S	.	.	H	α-helix	trans	-60.7	-36.6	178.5	-27	37.8	0	0	0	113.4	K223 R232	K223-P228 VanDerWaalsContact O-CD 3.22Å; K223-P228 WeakPolarHBondContact O-CD 3.49Å; K223-P228 WeakPolarHBondContact O-CG 3.4Å; P228-R232 VanDerWaalsContact O-CB 3.24Å; P228-R232 WeakPolarHBondContact O-CB 3.28Å; P228-R232 PolarHBondContact O-N 3.25Å
229	A	95.9	Very high	88.9	Confident	24 Å²	24	75.5 Å²	75.5	20%	0.198	35%	0.35	C	S	.	.	H	α-helix	trans	-64.6	-44.5	176.2	0	0	0	0	0	112	D225 I226 A227 K233 F270	D225-A229 VanDerWaalsContact O-CB 3.27Å; D225-A229 WeakPolarHBondContact O-CB 3.43Å; D225-A229 PolarHBondContact O-N 3.12Å; I226-A229 PolarHBondContact O-N 2.78Å; A227-A229 VanDerWaalsContact C-N 3.3Å; A227-A229 PolarHBondContact O-N 2.79Å; A229-K233 PolarHBondContact O-N 2.84Å; A229-F270 HydrophobicContact CB-CE1 4.07Å; A229-F270 HydrophobicContact CB-CZ 3.89Å
230	I	97.1	Very high	87.2	Confident	0 Å²	0	82 Å²	82	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-64.5	-48.6	176.3	-66.6	170.6	0	0	0	110.5	I226 A227 R232 K233 Y234 L248 D252 F253 Y256 F270	I226-I230 HydrophobicContact CG2-CD1 3.75Å; I226-I230 HydrophobicContact CG2-CG1 4.48Å; I226-I230 WeakPolarHBondContact O-CG1 3.15Å; I226-I230 PolarHBondContact O-N 3.48Å; A227-I230 PolarHBondContact O-N 3.49Å; I230-R232 VanDerWaalsContact C-N 3.35Å; I230-R232 PolarHBondContact O-N 3.36Å; I230-K233 PolarHBondContact O-N 3Å; I230-Y234 HydrophobicContact CG2-CD2 4Å; I230-Y234 WeakPolarHBondContact O-CD2 3.28Å; I230-Y234 PolarHBondContact O-N 2.86Å; I230-L248 HydrophobicContact CB-CD1 3.84Å; I230-L248 HydrophobicContact CD1-CD2 4.16Å; I230-L248 HydrophobicContact CG2-CD1 3.41Å; I230-L248 VanDerWaalsContact CG2-CD1 3.41Å; I230-L248 HydrophobicContact CG2-CD2 4.43Å; I230-D252 HydrophobicContact CG2-CB 4.26Å; I230-F253 HydrophobicContact CD1-CD2 4.34Å; I230-Y256 HydrophobicContact CD1-CD1 3.64Å; I230-Y256 HydrophobicContact CD1-CD2 4.48Å; I230-Y256 HydrophobicContact CD1-CE1 3.84Å; I230-Y256 HydrophobicContact CD1-CG 3.98Å; I230-Y256 HydrophobicContact CG1-CD1 4.14Å; I230-Y256 HydrophobicContact CG1-CD2 4.15Å; I230-Y256 HydrophobicContact CG1-CE1 4.5Å; I230-Y256 HydrophobicContact CG1-CE2 4.5Å; I230-Y256 HydrophobicContact CG1-CG 3.95Å; I230-Y256 HydrophobicContact CG2-CG 4.27Å; I230-F270 HydrophobicContact CD1-CE2 4.44Å; I230-F270 HydrophobicContact CG1-CE2 4.31Å; I230-F270 HydrophobicContact CG1-CZ 4.39Å
231	I	94.8	Very high	85.2	Confident	37 Å²	37	83.8 Å²	83.8	19%	0.19	39%	0.394	C	S	.	.	H	α-helix	trans	-55	-51.5	179.4	-69.9	170.3	0	0	0	110.5	A227 K233 Y234 R235 L248	A227-I231 WeakPolarHBondContact O-CB 3.45Å; A227-I231 WeakPolarHBondContact O-CG1 3.39Å; A227-I231 PolarHBondContact O-N 2.92Å; I231-K233 PolarHBondContact O-N 3.32Å; I231-K233 VanDerWaalsContact O-N 3.13Å; I231-Y234 PolarHBondContact O-N 3.33Å; I231-R235 HydrophobicContact CG2-CB 4.2Å; I231-R235 WeakPolarHBondContact O-CB 3.49Å; I231-R235 PolarHBondContact O-N 3Å; I231-L248 HydrophobicContact CD1-CB 4.22Å; I231-L248 HydrophobicContact CD1-CD1 4.45Å; I231-L248 HydrophobicContact CG1-CB 4.28Å; I231-L248 HydrophobicContact CG1-CD1 3.6Å
232	R	93.3	Very high	83.1	Confident	210 Å²	210	87 Å²	87	79%	0.792	42%	0.417	S	S	*	.	H	α-helix	trans	-56.7	-32.6	-177.2	-169.7	-171	-47.9	-91.5	-2.4	112.7	P228 I230	P228-R232 VanDerWaalsContact O-CB 3.24Å; P228-R232 WeakPolarHBondContact O-CB 3.28Å; P228-R232 PolarHBondContact O-N 3.25Å; I230-R232 VanDerWaalsContact C-N 3.35Å; I230-R232 PolarHBondContact O-N 3.36Å
233	K	94.9	Very high	81.1	Confident	104 Å²	104	89.5 Å²	89.5	45%	0.452	43%	0.43	S	S	.	.	H	α-helix	trans	-93.7	-36.7	-176.2	-177.8	163.8	171.6	171	0	113.9	A229 I230 I231 G262 M266	A229-K233 PolarHBondContact O-N 2.84Å; I230-K233 PolarHBondContact O-N 3Å; I231-K233 PolarHBondContact O-N 3.32Å; I231-K233 VanDerWaalsContact O-N 3.13Å; K233-G262 VanDerWaalsContact NZ-CA 3.27Å; K233-G262 PolarHBondContact NZ-O 2.79Å; K233-M266 HydrophobicContact CD-CE 3.82Å; K233-M266 HydrophobicContact CD-SD 4.19Å
234	Y	94.8	Very high	79	Confident	22 Å²	22	88.7 Å²	88.7	9%	0.086	45%	0.445	C	S	.	.	H	α-helix	trans	-113	-12.9	-166.6	-64.5	-75.4	0	0	0	115.1	I230 I231 K236 R255 Y256 D259 R263 M266	I230-Y234 HydrophobicContact CG2-CD2 4Å; I230-Y234 WeakPolarHBondContact O-CD2 3.28Å; I230-Y234 PolarHBondContact O-N 2.86Å; I231-Y234 PolarHBondContact O-N 3.33Å; Y234-K236 PolarHBondContact O-N 3.33Å; Y234-R255 HydrophobicContact CD1-CB 3.95Å; Y234-R255 HydrophobicContact CG-CB 4.26Å; Y234-R255 PolarHBondContact O-NH1 2.96Å; Y234-Y256 AromaticContact CE2-CD2 3.77Å; Y234-Y256 HydrophobicContact CE2-CD2 3.77Å; Y234-Y256 HydrophobicContact CE2-CG 4.15Å; Y234-D259 HydrophobicContact CE1-CB 3.68Å; Y234-D259 WeakPolarHBondContact CE1-OD2 3.5Å; Y234-D259 VanDerWaalsContact CZ-OD2 3.3Å; Y234-D259 PolarHBondContact OH-OD2 3.44Å; Y234-R263 PolarHBondContact OH-N 3.31Å; Y234-M266 HydrophobicContact CE2-CE 3.56Å; Y234-M266 HydrophobicContact CE2-SD 4.37Å; Y234-M266 WeakPolarHBondContact OH-CE 3.31Å
235	R	91.6	Very high	77.4	Confident	47 Å²	47	87.8 Å²	87.8	18%	0.177	46%	0.458	C	S	.	.			trans	-73.3	119.6	176.9	-171.7	165.3	-68.3	174.7	-6.5	109.6	I231 V237 L243 S246 G247 D252	I231-R235 HydrophobicContact CG2-CB 4.2Å; I231-R235 WeakPolarHBondContact O-CB 3.49Å; I231-R235 PolarHBondContact O-N 3Å; R235-V237 PolarHBondContact O-N 2.91Å; R235-L243 PolarHBondContact NH1-O 3.01Å; R235-S246 PolarHBondContact NH1-O 3.32Å; R235-G247 PolarHBondContact NH2-O 2.85Å; R235-D252 VanDerWaalsContact CA-OD1 3.31Å; R235-D252 WeakPolarHBondContact CA-OD1 3.23Å; R235-D252 IonicContact CZ-OD2 3.28Å; R235-D252 VanDerWaalsContact CZ-OD2 3.28Å; R235-D252 IonicContact NE-OD1 3.85Å; R235-D252 IonicContact NE-OD2 2.97Å; R235-D252 PolarHBondContact NE-OD2 3.5Å; R235-D252 IonicContact NH2-OD2 2.73Å; R235-D252 PolarHBondContact NH2-OD2 2.47Å
236	K	80.6	Confident	76.2	Confident	95 Å²	95	85 Å²	85	41%	0.413	45%	0.446	S	S	.	.			trans	-68.8	126.7	171.6	-66.2	-176.5	-177.7	173.1	0	108.6	Y234 H238	Y234-K236 PolarHBondContact O-N 3.33Å; K236-H238 VanDerWaalsContact C-N 3.25Å; K236-H238 PolarHBondContact O-N 3.5Å
237	V	67.7	Low	75.6	Confident	112 Å²	112	87.4 Å²	87.4	68%	0.679	47%	0.471	S	S	*	.			trans	-69.7	83.7	174.2	-174.4	0	0	0	0	108	R235 E240	R235-V237 PolarHBondContact O-N 2.91Å; V237-E240 HydrophobicContact CG1-CG 4.29Å
238	H	57.6	Low	75.5	Confident	157 Å²	157	87.5 Å²	87.5	73%	0.727	47%	0.471	S	S	*	.			trans	-123.5	-5.8	176.8	-82.5	-44.9	0	0	0	115.3	K236	K236-H238 VanDerWaalsContact C-N 3.25Å; K236-H238 PolarHBondContact O-N 3.5Å
239	R	53.4	Low	75.5	Confident	210 Å²	210	88.8 Å²	88.8	79%	0.792	47%	0.473	S	S	*	.			trans	-150.2	116.8	166.7	-63.1	-170.6	172.6	118.6	0.8	110.6	L243	R239-L243 HydrophobicContact CB-CD1 3.83Å
240	E	54.5	Low	75.6	Confident	180 Å²	180	88.3 Å²	88.3	84%	0.841	47%	0.466	S	S	*	.			trans	-90.7	-4.2	-158.9	-113.2	178.4	-179.4	0	0	117.2	V237	V237-E240 HydrophobicContact CG1-CG 4.29Å
241	S	52.9	Low	75.6	Confident	100 Å²	100	91 Å²	91	70%	0.699	48%	0.478	S	S	*	.	S	Bend	trans	-123.6	-31.9	-172.7	57.3	0	0	0	0	116.6
242	D	50.4	Low	75.7	Confident	138 Å²	138	89.3 Å²	89.3	74%	0.738	47%	0.47	S	S	*	.	S	Bend	trans	-104.3	-10.4	-173.9	-63.7	-25.4	0	0	0	114.4
243	L	52.8	Low	75.9	Confident	54 Å²	54	79.4 Å²	79.4	28%	0.283	43%	0.433	S	S	.	.	S	Bend	trans	-89.4	-20.8	-172.4	-77.2	175.4	0	0	0	115.1	R235 R239 A245 S246	R235-L243 PolarHBondContact NH1-O 3.01Å; R239-L243 HydrophobicContact CB-CD1 3.83Å; L243-A245 PolarHBondContact O-N 3.06Å; L243-S246 PolarHBondContact O-N 3.48Å; L243-S246 VanDerWaalsContact O-O 3.14Å; L243-S246 PolarHBondContact O-OG 2.82Å
244	A	51.3	Low	76.1	Confident	100 Å²	100	74.5 Å²	74.5	83%	0.826	41%	0.411	S	S	*	.	S	Bend	trans	-65.6	-23.4	178.2	0	0	0	0	0	112.5
245	A	58.5	Low	76.2	Confident	100 Å²	100	74.7 Å²	74.7	83%	0.826	41%	0.412	S	S	*	.	S	Bend	trans	-84.2	-23.3	175.7	0	0	0	0	0	113.6	L243	L243-A245 PolarHBondContact O-N 3.06Å
246	S	69.5	Low	76.6	Confident	40 Å²	40	72.5 Å²	72.5	28%	0.28	40%	0.404	S	S	.	.	S	Bend	trans	-82	124.3	175.8	72.1	0	0	0	0	109.1	R235 L243 H249	R235-S246 PolarHBondContact NH1-O 3.32Å; L243-S246 PolarHBondContact O-N 3.48Å; L243-S246 VanDerWaalsContact O-O 3.14Å; L243-S246 PolarHBondContact O-OG 2.82Å; S246-H249 PolarHBondContact OG-NE2 3.33Å
247	G	86.2	Confident	77.4	Confident	52 Å²	52	68 Å²	68	54%	0.536	38%	0.384	S	S	.	.			trans	-57.5	-165.2	-178.6	0	0	0	0	0	114.2	R235 H249	R235-G247 PolarHBondContact NH2-O 2.85Å; G247-H249 PolarHBondContact O-CD2 3.35Å; G247-H249 PolarHBondContact O-N 3.33Å
248	L	93.8	Very high	78.8	Confident	11 Å²	11	63.2 Å²	63.2	6%	0.058	36%	0.358	C	S	.	.			trans	-57	131.1	178.8	-177.8	68.3	0	0	0	110.6	F208 F212 A227 I230 I231 D252 F253	F208-L248 HydrophobicContact CE2-CD2 4.1Å; F208-L248 HydrophobicContact CE2-CG 4.05Å; F208-L248 VanDerWaalsContact CZ-O 3.23Å; F208-L248 WeakPolarHBondContact CZ-O 3.2Å; F212-L248 HydrophobicContact CB-CB 4.38Å; F212-L248 HydrophobicContact CB-CD2 4.35Å; F212-L248 HydrophobicContact CD1-CD2 3.81Å; F212-L248 HydrophobicContact CD2-CD2 3.73Å; F212-L248 HydrophobicContact CE1-CD2 3.93Å; F212-L248 HydrophobicContact CE2-CD2 3.87Å; F212-L248 HydrophobicContact CG-CB 4.49Å; F212-L248 HydrophobicContact CG-CD2 3.69Å; F212-L248 HydrophobicContact CZ-CD2 3.97Å; A227-L248 HydrophobicContact CB-CB 3.8Å; A227-L248 HydrophobicContact CB-CD2 4.39Å; I230-L248 HydrophobicContact CB-CD1 3.84Å; I230-L248 HydrophobicContact CD1-CD2 4.16Å; I230-L248 HydrophobicContact CG2-CD1 3.41Å; I230-L248 VanDerWaalsContact CG2-CD1 3.41Å; I230-L248 HydrophobicContact CG2-CD2 4.43Å; I231-L248 HydrophobicContact CD1-CB 4.22Å; I231-L248 HydrophobicContact CD1-CD1 4.45Å; I231-L248 HydrophobicContact CG1-CB 4.28Å; I231-L248 HydrophobicContact CG1-CD1 3.6Å; L248-D252 HydrophobicContact CD1-CB 3.51Å; L248-D252 HydrophobicContact CG-CB 4.47Å; L248-F253 HydrophobicContact CD2-CB 4.28Å; L248-F253 HydrophobicContact CD2-CD2 4.38Å
249	H	94.4	Very high	80.7	Confident	71 Å²	71	58.1 Å²	58.1	33%	0.329	34%	0.336	S	S	.	.			trans	-90.3	155.4	174.6	-69.2	-173.2	0	0	0	110.5	F208 S246 G247 E251 D252 F253	F208-H249 VanDerWaalsContact CZ-C 3.46Å; S246-H249 PolarHBondContact OG-NE2 3.33Å; G247-H249 PolarHBondContact O-CD2 3.35Å; G247-H249 PolarHBondContact O-N 3.33Å; H249-E251 PolarHBondContact O-N 3.22Å; H249-D252 WeakPolarHBondContact CB-OD2 3.39Å; H249-D252 PolarHBondContact N-OD2 3.37Å; H249-D252 WeakPolarHBondContact O-CB 3.36Å; H249-D252 PolarHBondContact O-N 2.9Å; H249-F253 PolarHBondContact O-N 2.96Å
250	F	97.4	Very high	82.6	Confident	15 Å²	15	51.2 Å²	51.2	7%	0.066	32%	0.323	C	S	.	.	H	α-helix	trans	-63.3	-34.6	178.7	-172.2	-110.6	0	0	0	111.5	I205 F208 D252 F253 V254 Y337 F338 I341	I205-F250 HydrophobicContact CG1-CE1 4.35Å; I205-F250 HydrophobicContact CG1-CE2 4Å; I205-F250 HydrophobicContact CG1-CZ 3.67Å; F208-F250 HydrophobicContact CB-CD2 3.84Å; F208-F250 HydrophobicContact CB-CE2 4.05Å; F208-F250 HydrophobicContact CD1-CB 4.27Å; F208-F250 AromaticContact CD1-CD2 3.78Å; F208-F250 HydrophobicContact CD1-CD2 3.78Å; F208-F250 HydrophobicContact CD1-CG 4.48Å; F208-F250 AromaticContact CD2-CD2 3.93Å; F208-F250 HydrophobicContact CD2-CD2 3.93Å; F208-F250 HydrophobicContact CE1-CB 3.95Å; F208-F250 HydrophobicContact CE1-CD2 4.32Å; F208-F250 HydrophobicContact CE2-CB 4.33Å; F208-F250 HydrophobicContact CE2-CD2 4.44Å; F208-F250 AromaticContact CG-CD2 3.57Å; F208-F250 HydrophobicContact CG-CD2 3.57Å; F208-F250 HydrophobicContact CG-CE2 4.29Å; F208-F250 HydrophobicContact CZ-CB 3.99Å; F250-D252 PolarHBondContact O-N 3.04Å; F250-F253 HydrophobicContact CD2-CD1 4.25Å; F250-F253 HydrophobicContact CE2-CD1 4.14Å; F250-F253 WeakPolarHBondContact O-CB 3.46Å; F250-F253 PolarHBondContact O-N 2.72Å; F250-V254 HydrophobicContact CD1-CG2 3.91Å; F250-V254 HydrophobicContact CE1-CG2 3.59Å; F250-V254 HydrophobicContact CZ-CG2 3.93Å; F250-V254 WeakPolarHBondContact O-CG2 3.19Å; F250-V254 PolarHBondContact O-N 3.44Å; F250-Y337 HydrophobicContact CB-CD1 4.07Å; F250-Y337 AromaticContact CD1-CD1 3.97Å; F250-Y337 HydrophobicContact CD1-CD1 3.97Å; F250-Y337 HydrophobicContact CD1-CG 4.49Å; F250-Y337 VanDerWaalsContact CD1-O 3.26Å; F250-Y337 WeakPolarHBondContact CD1-O 3.36Å; F250-Y337 HydrophobicContact CD2-CD1 4.12Å; F250-Y337 HydrophobicContact CE1-CD1 4.44Å; F250-Y337 AromaticContact CG-CD1 3.78Å; F250-Y337 HydrophobicContact CG-CD1 3.78Å; F250-F338 HydrophobicContact CE1-CD1 4.32Å; F250-F338 AromaticContact CE1-CD2 3.99Å; F250-F338 HydrophobicContact CE1-CD2 3.99Å; F250-F338 HydrophobicContact CE1-CE1 4.08Å; F250-F338 AromaticContact CE1-CE2 3.73Å; F250-F338 HydrophobicContact CE1-CE2 3.73Å; F250-F338 HydrophobicContact CE1-CG 4.3Å; F250-F338 AromaticContact CE1-CZ 3.79Å; F250-F338 HydrophobicContact CE1-CZ 3.79Å; F250-F338 AromaticContact CZ-CE2 3.93Å; F250-F338 HydrophobicContact CZ-CE2 3.93Å; F250-F338 AromaticContact CZ-CZ 3.93Å; F250-F338 HydrophobicContact CZ-CZ 3.93Å; F250-I341 HydrophobicContact CD1-CD1 3.91Å; F250-I341 HydrophobicContact CE1-CD1 4.31Å
251	E	96.8	Very high	84.5	Confident	55 Å²	55	51 Å²	51	26%	0.257	32%	0.323	S	S	.	.	H	α-helix	trans	-62	-41.6	175.1	-170.8	-180	-152.7	0	0	112.8	H249 F253 V254 R255 I341	H249-E251 PolarHBondContact O-N 3.22Å; E251-F253 VanDerWaalsContact C-N 3.26Å; E251-F253 PolarHBondContact O-N 2.79Å; E251-V254 PolarHBondContact O-N 3.03Å; E251-R255 WeakPolarHBondContact O-CG 3.47Å; E251-R255 PolarHBondContact O-N 3.35Å; E251-R255 IonicContact OE1-CZ 3.38Å; E251-R255 IonicContact OE1-NE 3.9Å; E251-R255 IonicContact OE1-NH2 2.81Å; E251-R255 PolarHBondContact OE1-NH2 2.63Å; E251-R255 IonicContact OE2-CZ 2.61Å; E251-R255 IonicContact OE2-NH1 3.34Å; E251-R255 PolarHBondContact OE2-NH1 2.77Å; E251-R255 IonicContact OE2-NH2 3.92Å; E251-R255 PolarHBondContact OE2-NH2 3.37Å; E251-I341 HydrophobicContact CB-CD1 4.1Å; E251-I341 HydrophobicContact CB-CG1 4.01Å; E251-I341 HydrophobicContact CG-CB 4.44Å; E251-I341 HydrophobicContact CG-CD1 4.27Å; E251-I341 HydrophobicContact CG-CG1 3.88Å; E251-I341 HydrophobicContact CG-CG2 4.19Å
252	D	96.8	Very high	86.5	Confident	3 Å²	3	47 Å²	47	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-60.2	-41.5	175	-59.6	-36.7	0	0	0	110.6	I230 R235 L248 H249 F250 R255 Y256	I230-D252 HydrophobicContact CG2-CB 4.26Å; R235-D252 VanDerWaalsContact CA-OD1 3.31Å; R235-D252 WeakPolarHBondContact CA-OD1 3.23Å; R235-D252 IonicContact CZ-OD2 3.28Å; R235-D252 VanDerWaalsContact CZ-OD2 3.28Å; R235-D252 IonicContact NE-OD1 3.85Å; R235-D252 IonicContact NE-OD2 2.97Å; R235-D252 PolarHBondContact NE-OD2 3.5Å; R235-D252 IonicContact NH2-OD2 2.73Å; R235-D252 PolarHBondContact NH2-OD2 2.47Å; L248-D252 HydrophobicContact CD1-CB 3.51Å; L248-D252 HydrophobicContact CG-CB 4.47Å; H249-D252 WeakPolarHBondContact CB-OD2 3.39Å; H249-D252 PolarHBondContact N-OD2 3.37Å; H249-D252 WeakPolarHBondContact O-CB 3.36Å; H249-D252 PolarHBondContact O-N 2.9Å; F250-D252 PolarHBondContact O-N 3.04Å; D252-R255 PolarHBondContact O-N 3.19Å; D252-R255 IonicContact OD1-NH1 3.51Å; D252-Y256 WeakPolarHBondContact O-CB 3.28Å; D252-Y256 PolarHBondContact O-N 2.92Å
253	F	98.2	Very high	88.6	Confident	1 Å²	1	42.1 Å²	42.1	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-65.4	-43.6	177.3	-171.7	-126.5	0	0	0	112	F208 F212 I230 L248 H249 F250 E251 R255 Y256 L257 W277	F208-F253 HydrophobicContact CB-CD1 4.02Å; F208-F253 HydrophobicContact CB-CE1 4.11Å; F208-F253 HydrophobicContact CD2-CB 3.86Å; F208-F253 AromaticContact CD2-CD1 3.78Å; F208-F253 HydrophobicContact CD2-CD1 3.78Å; F208-F253 AromaticContact CD2-CG 3.91Å; F208-F253 HydrophobicContact CD2-CG 3.91Å; F208-F253 HydrophobicContact CE2-CB 4.08Å; F208-F253 HydrophobicContact CG-CD1 4.31Å; F212-F253 HydrophobicContact CE2-CD2 4.05Å; F212-F253 AromaticContact CE2-CE2 3.84Å; F212-F253 HydrophobicContact CE2-CE2 3.84Å; F212-F253 HydrophobicContact CE2-CZ 4.27Å; F212-F253 HydrophobicContact CZ-CE2 4.48Å; I230-F253 HydrophobicContact CD1-CD2 4.34Å; L248-F253 HydrophobicContact CD2-CB 4.28Å; L248-F253 HydrophobicContact CD2-CD2 4.38Å; H249-F253 PolarHBondContact O-N 2.96Å; F250-F253 HydrophobicContact CD2-CD1 4.25Å; F250-F253 HydrophobicContact CE2-CD1 4.14Å; F250-F253 WeakPolarHBondContact O-CB 3.46Å; F250-F253 PolarHBondContact O-N 2.72Å; E251-F253 VanDerWaalsContact C-N 3.26Å; E251-F253 PolarHBondContact O-N 2.79Å; F253-R255 PolarHBondContact O-N 2.92Å; F253-Y256 AromaticContact CD2-CD1 3.86Å; F253-Y256 HydrophobicContact CD2-CD1 3.86Å; F253-Y256 HydrophobicContact CD2-CE1 4.35Å; F253-Y256 HydrophobicContact CE2-CD1 4.02Å; F253-Y256 HydrophobicContact CE2-CE1 4.08Å; F253-Y256 PolarHBondContact O-N 3.19Å; F253-L257 HydrophobicContact CD1-CD1 3.99Å; F253-L257 HydrophobicContact CD2-CD1 4.45Å; F253-L257 HydrophobicContact CD2-CG 4.33Å; F253-L257 HydrophobicContact CE1-CD1 3.63Å; F253-L257 HydrophobicContact CE1-CG 4.47Å; F253-L257 HydrophobicContact CE2-CD1 4.1Å; F253-L257 HydrophobicContact CE2-CD2 4.13Å; F253-L257 HydrophobicContact CE2-CG 4.1Å; F253-L257 HydrophobicContact CG-CD1 4.4Å; F253-L257 HydrophobicContact CZ-CD1 3.69Å; F253-L257 HydrophobicContact CZ-CD2 4.27Å; F253-L257 HydrophobicContact CZ-CG 4.19Å; F253-L257 VanDerWaalsContact O-CG 3.3Å; F253-L257 WeakPolarHBondContact O-CG 3.34Å; F253-L257 PolarHBondContact O-N 3.17Å; F253-W277 AromaticContact CE2-CD2 3.95Å; F253-W277 HydrophobicContact CE2-CD2 3.95Å; F253-W277 HydrophobicContact CE2-CE3 4.06Å; F253-W277 HydrophobicContact CE2-CG 4.31Å; F253-W277 HydrophobicContact CE2-CZ3 4.46Å; F253-W277 HydrophobicContact CZ-CB 4.02Å; F253-W277 AromaticContact CZ-CD2 3.79Å; F253-W277 HydrophobicContact CZ-CD2 3.79Å; F253-W277 AromaticContact CZ-CE3 3.76Å; F253-W277 HydrophobicContact CZ-CE3 3.76Å; F253-W277 AromaticContact CZ-CG 3.93Å; F253-W277 HydrophobicContact CZ-CG 3.93Å; F253-W277 HydrophobicContact CZ-CZ3 4.47Å
254	V	98.5	Very high	90.7	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.006	29%	0.288	C	S	.	.	H	α-helix	trans	-60	-45.4	175.2	168.3	0	0	0	0	111.3	F250 E251 L257 G258 F338 I341 D345 L349	F250-V254 HydrophobicContact CD1-CG2 3.91Å; F250-V254 HydrophobicContact CE1-CG2 3.59Å; F250-V254 HydrophobicContact CZ-CG2 3.93Å; F250-V254 WeakPolarHBondContact O-CG2 3.19Å; F250-V254 PolarHBondContact O-N 3.44Å; E251-V254 PolarHBondContact O-N 3.03Å; V254-L257 PolarHBondContact O-N 3.41Å; V254-G258 PolarHBondContact O-N 3.17Å; V254-F338 HydrophobicContact CG2-CE1 3.92Å; V254-F338 HydrophobicContact CG2-CZ 4.41Å; V254-I341 HydrophobicContact CB-CD1 4.2Å; V254-I341 HydrophobicContact CG1-CG2 4.07Å; V254-I341 HydrophobicContact CG2-CD1 3.82Å; V254-D345 HydrophobicContact CG1-CB 4.41Å; V254-L349 HydrophobicContact CG1-CB 4.19Å; V254-L349 HydrophobicContact CG1-CD2 4.06Å; V254-L349 HydrophobicContact CG2-CD2 4.12Å
255	R	98.1	Very high	92.8	Very high	27 Å²	27	52.7 Å²	52.7	10%	0.102	28%	0.283	C	S	.	.	H	α-helix	trans	-62.1	-44.1	177	-71.8	-179.9	-172.6	132	-1.9	112.2	Y234 E251 D252 F253 G258 D259 D345	Y234-R255 HydrophobicContact CD1-CB 3.95Å; Y234-R255 HydrophobicContact CG-CB 4.26Å; Y234-R255 PolarHBondContact O-NH1 2.96Å; E251-R255 WeakPolarHBondContact O-CG 3.47Å; E251-R255 PolarHBondContact O-N 3.35Å; E251-R255 IonicContact OE1-CZ 3.38Å; E251-R255 IonicContact OE1-NE 3.9Å; E251-R255 IonicContact OE1-NH2 2.81Å; E251-R255 PolarHBondContact OE1-NH2 2.63Å; E251-R255 IonicContact OE2-CZ 2.61Å; E251-R255 IonicContact OE2-NH1 3.34Å; E251-R255 PolarHBondContact OE2-NH1 2.77Å; E251-R255 IonicContact OE2-NH2 3.92Å; E251-R255 PolarHBondContact OE2-NH2 3.37Å; D252-R255 PolarHBondContact O-N 3.19Å; D252-R255 IonicContact OD1-NH1 3.51Å; F253-R255 PolarHBondContact O-N 2.92Å; R255-G258 PolarHBondContact O-N 3.21Å; R255-D259 WeakPolarHBondContact O-CB 3.04Å; R255-D259 PolarHBondContact O-N 3.16Å; R255-D259 VanDerWaalsContact O-N 3.14Å; R255-D345 HydrophobicContact CG-CB 4.24Å; R255-D345 WeakPolarHBondContact CG-OD2 3.05Å; R255-D345 IonicContact NE-OD2 3.16Å; R255-D345 PolarHBondContact NE-OD2 3.49Å; R255-D345 VanDerWaalsContact NE-OD2 3.16Å
256	Y	98.3	Very high	94.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.4	-47	174.6	156.4	-111.7	0	0	0	112.2	I230 Y234 D252 F253 G258 D259 R263 M266 D267 F270 W277	I230-Y256 HydrophobicContact CD1-CD1 3.64Å; I230-Y256 HydrophobicContact CD1-CD2 4.48Å; I230-Y256 HydrophobicContact CD1-CE1 3.84Å; I230-Y256 HydrophobicContact CD1-CG 3.98Å; I230-Y256 HydrophobicContact CG1-CD1 4.14Å; I230-Y256 HydrophobicContact CG1-CD2 4.15Å; I230-Y256 HydrophobicContact CG1-CE1 4.5Å; I230-Y256 HydrophobicContact CG1-CE2 4.5Å; I230-Y256 HydrophobicContact CG1-CG 3.95Å; I230-Y256 HydrophobicContact CG2-CG 4.27Å; Y234-Y256 AromaticContact CE2-CD2 3.77Å; Y234-Y256 HydrophobicContact CE2-CD2 3.77Å; Y234-Y256 HydrophobicContact CE2-CG 4.15Å; D252-Y256 WeakPolarHBondContact O-CB 3.28Å; D252-Y256 PolarHBondContact O-N 2.92Å; F253-Y256 AromaticContact CD2-CD1 3.86Å; F253-Y256 HydrophobicContact CD2-CD1 3.86Å; F253-Y256 HydrophobicContact CD2-CE1 4.35Å; F253-Y256 HydrophobicContact CE2-CD1 4.02Å; F253-Y256 HydrophobicContact CE2-CE1 4.08Å; F253-Y256 PolarHBondContact O-N 3.19Å; Y256-G258 PolarHBondContact O-N 3.47Å; Y256-D259 PolarHBondContact O-N 3.13Å; Y256-R263 HydrophobicContact CD2-CB 3.83Å; Y256-R263 HydrophobicContact CE2-CB 3.59Å; Y256-M266 HydrophobicContact CD2-CE 3.91Å; Y256-M266 HydrophobicContact CE2-CE 4.09Å; Y256-D267 WeakPolarHBondContact CE2-OD1 3.31Å; Y256-D267 VanDerWaalsContact CZ-OD1 3.3Å; Y256-D267 PolarHBondContact OH-OD1 3.28Å; Y256-F270 HydrophobicContact CE2-CE2 4.19Å; Y256-W277 HydrophobicContact CE1-CZ2 4.33Å; Y256-W277 AromaticContact CE1-NE1 3.64Å; Y256-W277 AromaticContact CZ-NE1 3.93Å; Y256-W277 PolarHBondContact OH-NE1 3.18Å
257	L	98.3	Very high	95.8	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-68.3	-36.7	-177.7	-68.5	180	0	0	0	112.5	L204 F253 V254 D259 W277 L349 R352 Y353	L204-L257 HydrophobicContact CD1-CD1 3.89Å; L204-L257 HydrophobicContact CD2-CD1 3.7Å; L204-L257 HydrophobicContact CG-CD1 4.34Å; F253-L257 HydrophobicContact CD1-CD1 3.99Å; F253-L257 HydrophobicContact CD2-CD1 4.45Å; F253-L257 HydrophobicContact CD2-CG 4.33Å; F253-L257 HydrophobicContact CE1-CD1 3.63Å; F253-L257 HydrophobicContact CE1-CG 4.47Å; F253-L257 HydrophobicContact CE2-CD1 4.1Å; F253-L257 HydrophobicContact CE2-CD2 4.13Å; F253-L257 HydrophobicContact CE2-CG 4.1Å; F253-L257 HydrophobicContact CG-CD1 4.4Å; F253-L257 HydrophobicContact CZ-CD1 3.69Å; F253-L257 HydrophobicContact CZ-CD2 4.27Å; F253-L257 HydrophobicContact CZ-CG 4.19Å; F253-L257 VanDerWaalsContact O-CG 3.3Å; F253-L257 WeakPolarHBondContact O-CG 3.34Å; F253-L257 PolarHBondContact O-N 3.17Å; V254-L257 PolarHBondContact O-N 3.41Å; L257-D259 VanDerWaalsContact C-N 3.34Å; L257-W277 HydrophobicContact CD1-CB 4.43Å; L257-W277 HydrophobicContact CD2-CB 4.1Å; L257-W277 HydrophobicContact CD2-CG 3.75Å; L257-L349 HydrophobicContact CB-CD1 3.41Å; L257-L349 VanDerWaalsContact CB-CD1 3.41Å; L257-L349 HydrophobicContact CD1-CD1 3.94Å; L257-L349 HydrophobicContact CG-CD1 4.35Å; L257-R352 WeakPolarHBondContact O-CD 3.3Å; L257-R352 PolarHBondContact O-NH1 3.25Å; L257-Y353 HydrophobicContact CD1-CE2 4.48Å
258	G	97.8	Very high	96.2	Very high	12 Å²	12	53.6 Å²	53.6	12%	0.124	25%	0.245	C	C	.	.	H	α-helix	trans	-77.1	-11.6	178.1	0	0	0	0	0	115.2	V254 R255 Y256 A260	V254-G258 PolarHBondContact O-N 3.17Å; R255-G258 PolarHBondContact O-N 3.21Å; Y256-G258 PolarHBondContact O-N 3.47Å; G258-A260 PolarHBondContact O-N 3Å
259	D	97.3	Very high	96.3	Very high	50 Å²	50	60 Å²	60	27%	0.267	28%	0.275	S	S	.	.			trans	-94.7	77.4	179.3	176.8	22.4	0	0	0	111.5	Y234 R255 Y256 L257 E261 G262 R263	Y234-D259 HydrophobicContact CE1-CB 3.68Å; Y234-D259 WeakPolarHBondContact CE1-OD2 3.5Å; Y234-D259 VanDerWaalsContact CZ-OD2 3.3Å; Y234-D259 PolarHBondContact OH-OD2 3.44Å; R255-D259 WeakPolarHBondContact O-CB 3.04Å; R255-D259 PolarHBondContact O-N 3.16Å; R255-D259 VanDerWaalsContact O-N 3.14Å; Y256-D259 PolarHBondContact O-N 3.13Å; L257-D259 VanDerWaalsContact C-N 3.34Å; D259-E261 PolarHBondContact O-N 3.17Å; D259-G262 PolarHBondContact O-N 3.06Å; D259-G262 WeakPolarHBondContact OD1-CA 3.4Å; D259-G262 PolarHBondContact OD1-N 3.42Å; D259-G262 WeakPolarHBondContact OD2-CA 3.49Å; D259-R263 VanDerWaalsContact O-CB 3.31Å; D259-R263 WeakPolarHBondContact O-CB 3.43Å; D259-R263 WeakPolarHBondContact O-CG 3.32Å; D259-R263 PolarHBondContact O-N 3.16Å
260	A	93.4	Very high	96.3	Very high	64 Å²	64	57.1 Å²	57.1	53%	0.529	26%	0.261	S	S	.	.	H	α-helix	trans	-55.2	-44.1	-174.5	0	0	0	0	0	114	G258 R263	G258-A260 PolarHBondContact O-N 3Å; A260-R263 WeakPolarHBondContact O-CG 3.45Å
261	E	94.9	Very high	96.2	Very high	176 Å²	176	58 Å²	58	82%	0.822	27%	0.274	S	S	*	.	H	α-helix	trans	-75.1	-47.8	-179.5	-66.7	-176.4	172.8	0	0	111.4	D259 R263 R264	D259-E261 PolarHBondContact O-N 3.17Å; E261-R263 VanDerWaalsContact C-N 3.32Å; E261-R263 PolarHBondContact O-N 2.85Å; E261-R264 WeakPolarHBondContact O-CB 3.48Å; E261-R264 PolarHBondContact O-N 3.27Å
262	G	93.9	Very high	95.9	Very high	17 Å²	17	59.8 Å²	59.8	18%	0.175	28%	0.283	C	S	.	.	H	α-helix	trans	-71.7	-25.1	-175.6	0	0	0	0	0	113.5	K233 D259	K233-G262 VanDerWaalsContact NZ-CA 3.27Å; K233-G262 PolarHBondContact NZ-O 2.79Å; D259-G262 PolarHBondContact O-N 3.06Å; D259-G262 WeakPolarHBondContact OD1-CA 3.4Å; D259-G262 PolarHBondContact OD1-N 3.42Å; D259-G262 WeakPolarHBondContact OD2-CA 3.49Å
263	R	95.3	Very high	95.7	Very high	35 Å²	35	63 Å²	63	13%	0.132	30%	0.297	C	S	.	.	H	α-helix	trans	-75.5	-22.1	175	75.1	-178.2	170.8	96.4	-4.9	114.3	Y234 Y256 D259 A260 E261 R265 M266 D267 R352	Y234-R263 PolarHBondContact OH-N 3.31Å; Y256-R263 HydrophobicContact CD2-CB 3.83Å; Y256-R263 HydrophobicContact CE2-CB 3.59Å; D259-R263 VanDerWaalsContact O-CB 3.31Å; D259-R263 WeakPolarHBondContact O-CB 3.43Å; D259-R263 WeakPolarHBondContact O-CG 3.32Å; D259-R263 PolarHBondContact O-N 3.16Å; A260-R263 WeakPolarHBondContact O-CG 3.45Å; E261-R263 VanDerWaalsContact C-N 3.32Å; E261-R263 PolarHBondContact O-N 2.85Å; R263-R265 PolarHBondContact O-N 3.43Å; R263-M266 HydrophobicContact CB-CE 4.31Å; R263-M266 WeakPolarHBondContact O-CA 3.26Å; R263-M266 PolarHBondContact O-N 3.22Å; R263-D267 WeakPolarHBondContact CD-OD2 3.31Å; R263-D267 WeakPolarHBondContact CG-OD2 3.36Å; R263-D267 IonicContact CZ-OD2 3.56Å; R263-D267 IonicContact NE-OD2 3.81Å; R263-D267 IonicContact NH1-OD2 2.62Å; R263-D267 PolarHBondContact NH1-OD2 3.18Å; R263-D267 PolarHBondContact O-N 3.07Å; R263-R352 VanDerWaalsContact CZ-NH2 3.31Å; R263-R352 VanDerWaalsContact NH2-CZ 3.27Å
264	R	95.3	Very high	95.6	Very high	180 Å²	180	64 Å²	64	68%	0.679	30%	0.303	S	S	*	.	H	α-helix	trans	-54.7	-34.3	-169	-168.3	-179.3	-175.8	176.9	3.4	114.7	E261 R268	E261-R264 WeakPolarHBondContact O-CB 3.48Å; E261-R264 PolarHBondContact O-N 3.27Å; R264-R268 WeakPolarHBondContact O-CG 3.29Å; R264-R268 PolarHBondContact O-NE 3.42Å; R264-R268 VanDerWaalsContact O-NE 3.15Å
265	R	95.4	Very high	95.5	Very high	195 Å²	195	65 Å²	65	74%	0.736	31%	0.308	S	S	*	.	H	α-helix	trans	-73.8	-45	175.4	-176.1	-174.1	-73.7	-108.1	4.2	111.5	R263 R268 Q269	R263-R265 PolarHBondContact O-N 3.43Å; R265-R268 PolarHBondContact O-N 3.4Å; R265-Q269 PolarHBondContact O-N 3.13Å
266	M	95.7	Very high	95.5	Very high	17 Å²	17	64.6 Å²	64.6	8%	0.084	31%	0.307	C	S	.	.	H	α-helix	trans	-65.7	-41.3	179.5	-72.6	173.5	-59.6	0	0	111.3	K233 Y234 Y256 R263 R268 Q269 F270	K233-M266 HydrophobicContact CD-CE 3.82Å; K233-M266 HydrophobicContact CD-SD 4.19Å; Y234-M266 HydrophobicContact CE2-CE 3.56Å; Y234-M266 HydrophobicContact CE2-SD 4.37Å; Y234-M266 WeakPolarHBondContact OH-CE 3.31Å; Y256-M266 HydrophobicContact CD2-CE 3.91Å; Y256-M266 HydrophobicContact CE2-CE 4.09Å; R263-M266 HydrophobicContact CB-CE 4.31Å; R263-M266 WeakPolarHBondContact O-CA 3.26Å; R263-M266 PolarHBondContact O-N 3.22Å; M266-R268 VanDerWaalsContact C-N 3.28Å; M266-R268 PolarHBondContact O-N 3.3Å; M266-Q269 CarbonylContact O-C 3.53Å; M266-Q269 WeakPolarHBondContact O-CA 3.48Å; M266-Q269 WeakPolarHBondContact O-CB 3.43Å; M266-Q269 PolarHBondContact O-N 3.29Å; M266-F270 HydrophobicContact CB-CD2 4.29Å; M266-F270 HydrophobicContact CB-CE1 4.39Å; M266-F270 HydrophobicContact CB-CE2 3.77Å; M266-F270 HydrophobicContact CB-CZ 3.83Å; M266-F270 HydrophobicContact CG-CZ 4.24Å; M266-F270 WeakPolarHBondContact O-CB 3.3Å; M266-F270 WeakPolarHBondContact O-CD1 3.37Å; M266-F270 WeakPolarHBondContact O-CD2 3.45Å; M266-F270 WeakPolarHBondContact O-CG 3.23Å; M266-F270 PolarHBondContact O-N 2.76Å
267	D	95.9	Very high	95.4	Very high	15 Å²	15	64.6 Å²	64.6	8%	0.08	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-39.4	179.2	-69.2	1.4	0	0	0	112.2	Y256 R263 Q269 F270 G271 I274	Y256-D267 WeakPolarHBondContact CE2-OD1 3.31Å; Y256-D267 VanDerWaalsContact CZ-OD1 3.3Å; Y256-D267 PolarHBondContact OH-OD1 3.28Å; R263-D267 WeakPolarHBondContact CD-OD2 3.31Å; R263-D267 WeakPolarHBondContact CG-OD2 3.36Å; R263-D267 IonicContact CZ-OD2 3.56Å; R263-D267 IonicContact NE-OD2 3.81Å; R263-D267 IonicContact NH1-OD2 2.62Å; R263-D267 PolarHBondContact NH1-OD2 3.18Å; R263-D267 PolarHBondContact O-N 3.07Å; D267-Q269 VanDerWaalsContact C-N 3.31Å; D267-Q269 PolarHBondContact O-N 3.4Å; D267-F270 PolarHBondContact O-N 3.07Å; D267-G271 PolarHBondContact O-N 3.05Å; D267-I274 HydrophobicContact CB-CD1 4.08Å
268	R	95	Very high	95.4	Very high	180 Å²	180	64.7 Å²	64.7	68%	0.679	31%	0.308	S	S	*	.	H	α-helix	trans	-64.2	-36.3	172.7	-75.6	-175.9	-74.3	158.3	-7.4	112.6	R264 R265 M266	R264-R268 WeakPolarHBondContact O-CG 3.29Å; R264-R268 PolarHBondContact O-NE 3.42Å; R264-R268 VanDerWaalsContact O-NE 3.15Å; R265-R268 PolarHBondContact O-N 3.4Å; M266-R268 VanDerWaalsContact C-N 3.28Å; M266-R268 PolarHBondContact O-N 3.3Å
269	Q	95.3	Very high	95.4	Very high	146 Å²	146	64.8 Å²	64.8	68%	0.682	31%	0.306	S	S	*	.	H	α-helix	trans	-73	-40.7	177.3	-178.6	-177.9	-7.8	0	0	112	R265 M266 D267 G271	R265-Q269 PolarHBondContact O-N 3.13Å; M266-Q269 CarbonylContact O-C 3.53Å; M266-Q269 WeakPolarHBondContact O-CA 3.48Å; M266-Q269 WeakPolarHBondContact O-CB 3.43Å; M266-Q269 PolarHBondContact O-N 3.29Å; D267-Q269 VanDerWaalsContact C-N 3.31Å; D267-Q269 PolarHBondContact O-N 3.4Å; Q269-G271 VanDerWaalsContact C-N 3.27Å; Q269-G271 PolarHBondContact O-N 3.12Å
270	F	95.9	Very high	95.5	Very high	9 Å²	9	62.4 Å²	62.4	4%	0.039	29%	0.293	C	S	.	.	H	α-helix	trans	-71.3	-25.6	178.4	-60.6	-17.9	0	0	0	111.8	I226 A229 I230 Y256 M266 D267 E272 H273 I274	I226-F270 HydrophobicContact CB-CD1 4.49Å; I226-F270 HydrophobicContact CB-CE1 4.22Å; I226-F270 HydrophobicContact CB-CE2 4.5Å; I226-F270 HydrophobicContact CB-CZ 4.22Å; I226-F270 HydrophobicContact CD1-CB 4.39Å; I226-F270 HydrophobicContact CD1-CD1 4.43Å; I226-F270 HydrophobicContact CD1-CG 4.25Å; I226-F270 HydrophobicContact CG1-CD1 3.73Å; I226-F270 HydrophobicContact CG1-CD2 4.39Å; I226-F270 HydrophobicContact CG1-CE1 3.91Å; I226-F270 HydrophobicContact CG1-CG 3.98Å; I226-F270 HydrophobicContact CG1-CZ 4.32Å; I226-F270 HydrophobicContact CG2-CD2 4.1Å; I226-F270 HydrophobicContact CG2-CE1 4.34Å; I226-F270 HydrophobicContact CG2-CE2 3.75Å; I226-F270 HydrophobicContact CG2-CZ 3.88Å; A229-F270 HydrophobicContact CB-CE1 4.07Å; A229-F270 HydrophobicContact CB-CZ 3.89Å; I230-F270 HydrophobicContact CD1-CE2 4.44Å; I230-F270 HydrophobicContact CG1-CE2 4.31Å; I230-F270 HydrophobicContact CG1-CZ 4.39Å; Y256-F270 HydrophobicContact CE2-CE2 4.19Å; M266-F270 HydrophobicContact CB-CD2 4.29Å; M266-F270 HydrophobicContact CB-CE1 4.39Å; M266-F270 HydrophobicContact CB-CE2 3.77Å; M266-F270 HydrophobicContact CB-CZ 3.83Å; M266-F270 HydrophobicContact CG-CZ 4.24Å; M266-F270 WeakPolarHBondContact O-CB 3.3Å; M266-F270 WeakPolarHBondContact O-CD1 3.37Å; M266-F270 WeakPolarHBondContact O-CD2 3.45Å; M266-F270 WeakPolarHBondContact O-CG 3.23Å; M266-F270 PolarHBondContact O-N 2.76Å; D267-F270 PolarHBondContact O-N 3.07Å; F270-E272 PolarHBondContact O-N 2.93Å; F270-H273 WeakPolarHBondContact O-CB 3.42Å; F270-H273 PolarHBondContact O-CD2 2.56Å; F270-H273 PolarHBondContact O-N 2.94Å; F270-I274 HydrophobicContact CB-CG2 3.43Å; F270-I274 VanDerWaalsContact CB-CG2 3.43Å; F270-I274 HydrophobicContact CD2-CG2 3.95Å; F270-I274 HydrophobicContact CG-CG2 4.22Å
271	G	94.1	Very high	95.7	Very high	33 Å²	33	59.4 Å²	59.4	34%	0.34	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	58.1	-132.5	173	0	0	0	0	0	111.8	D267 Q269 H273 I274	D267-G271 PolarHBondContact O-N 3.05Å; Q269-G271 VanDerWaalsContact C-N 3.27Å; Q269-G271 PolarHBondContact O-N 3.12Å; G271-H273 PolarHBondContact O-N 3Å; G271-H273 VanDerWaalsContact O-N 3.1Å; G271-I274 WeakPolarHBondContact O-CG1 3.48Å; G271-I274 PolarHBondContact O-N 3.28Å
272	E	90.4	Very high	95.8	Very high	94 Å²	94	54.4 Å²	54.4	44%	0.439	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-65	-14.1	-177.2	-59.6	-156	112	0	0	114.3	R121 F270 I274 I275	R121-E272 IonicContact CZ-OE1 3.4Å; R121-E272 IonicContact NH1-OE1 3.12Å; R121-E272 PolarHBondContact NH1-OE1 2.9Å; R121-E272 IonicContact NH2-OE1 2.79Å; R121-E272 PolarHBondContact NH2-OE1 3.48Å; F270-E272 PolarHBondContact O-N 2.93Å; E272-I274 PolarHBondContact O-N 3.35Å; E272-I275 VanDerWaalsContact O-CG1 3.32Å; E272-I275 WeakPolarHBondContact O-CG1 3.44Å; E272-I275 WeakPolarHBondContact O-CG2 3.04Å; E272-I275 PolarHBondContact O-N 2.86Å
273	H	93.8	Very high	96	Very high	69 Å²	69	53.6 Å²	53.6	32%	0.319	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-70.1	-15.3	-179.8	-55	-49.1	0	0	0	113.1	W221 Y222 I226 F270 G271 I275	W221-H273 AromaticContact CD1-CD2 3.76Å; W221-H273 AromaticContact CD1-CG 3.54Å; W221-H273 AromaticContact CD1-ND1 3.8Å; W221-H273 AromaticContact CD2-CE1 3.83Å; W221-H273 AromaticContact CE2-CE1 3.47Å; W221-H273 VanDerWaalsContact CE2-CE1 3.47Å; W221-H273 AromaticContact CE2-CG 3.97Å; W221-H273 AromaticContact CE2-ND1 3.39Å; W221-H273 AromaticContact CZ2-CE1 3.74Å; W221-H273 AromaticContact CZ2-ND1 3.71Å; W221-H273 AromaticContact NE1-CD2 3.95Å; W221-H273 AromaticContact NE1-CE1 3.68Å; W221-H273 AromaticContact NE1-CG 3.36Å; W221-H273 AromaticContact NE1-ND1 3.19Å; W221-H273 PolarHBondContact NE1-ND1 2.7Å; W221-H273 VanDerWaalsContact NE1-ND1 3.19Å; Y222-H273 HydrophobicContact CE1-CB 4.34Å; Y222-H273 PolarHBondContact OH-O 2.8Å; I226-H273 HydrophobicContact CD1-CB 3.8Å; F270-H273 WeakPolarHBondContact O-CB 3.42Å; F270-H273 PolarHBondContact O-CD2 2.56Å; F270-H273 PolarHBondContact O-N 2.94Å; G271-H273 PolarHBondContact O-N 3Å; G271-H273 VanDerWaalsContact O-N 3.1Å; H273-I275 PolarHBondContact O-N 3.33Å
274	I	95.6	Very high	96.2	Very high	22 Å²	22	52 Å²	52	11%	0.113	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-75.8	-9.7	178	73.4	173.1	0	0	0	113.9	D267 F270 G271 E272 H276 W277 V278	D267-I274 HydrophobicContact CB-CD1 4.08Å; F270-I274 HydrophobicContact CB-CG2 3.43Å; F270-I274 VanDerWaalsContact CB-CG2 3.43Å; F270-I274 HydrophobicContact CD2-CG2 3.95Å; F270-I274 HydrophobicContact CG-CG2 4.22Å; G271-I274 WeakPolarHBondContact O-CG1 3.48Å; G271-I274 PolarHBondContact O-N 3.28Å; E272-I274 PolarHBondContact O-N 3.35Å; I274-H276 PolarHBondContact O-N 3.19Å; I274-W277 HydrophobicContact CB-CZ2 3.92Å; I274-W277 HydrophobicContact CG2-CZ2 3.85Å; I274-W277 PolarHBondContact O-N 2.87Å; I274-V278 HydrophobicContact CB-CG2 4.46Å; I274-V278 HydrophobicContact CD1-CG2 3.95Å; I274-V278 HydrophobicContact CG1-CG2 3.67Å; I274-V278 WeakPolarHBondContact O-CG2 3.49Å; I274-V278 PolarHBondContact O-N 3.4Å
275	I	96	Very high	96.3	Very high	24 Å²	24	43.4 Å²	43.4	12%	0.123	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-49.4	-27.3	-171.8	57.6	169.4	0	0	0	114.1	F117 P136 E272 H273 W277	F117-I275 HydrophobicContact CE2-CG2 4.08Å; F117-I275 HydrophobicContact CZ-CG2 3.87Å; P136-I275 HydrophobicContact CG-CB 4.45Å; P136-I275 HydrophobicContact CG-CD1 4.45Å; P136-I275 HydrophobicContact CG-CG1 4.39Å; P136-I275 WeakPolarHBondContact CG-O 3.32Å; E272-I275 VanDerWaalsContact O-CG1 3.32Å; E272-I275 WeakPolarHBondContact O-CG1 3.44Å; E272-I275 WeakPolarHBondContact O-CG2 3.04Å; E272-I275 PolarHBondContact O-N 2.86Å; H273-I275 PolarHBondContact O-N 3.33Å; I275-W277 PolarHBondContact O-N 3.29Å
276	H	97.2	Very high	96.5	Very high	17 Å²	17	34.4 Å²	34.4	8%	0.079	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-70.7	-17.7	-176.7	-59.2	-68.9	0	0	0	114.5	P136 R203 A207 K211 Y222 I274	P136-H276 HydrophobicContact CB-CB 4.41Å; P136-H276 WeakPolarHBondContact CB-ND1 3.16Å; R203-H276 PolarHBondContact NH1-O 3.32Å; A207-H276 HydrophobicContact CB-CB 4.04Å; K211-H276 WeakPolarHBondContact CE-CD2 3.4Å; K211-H276 VanDerWaalsContact CE-CE1 3.43Å; K211-H276 WeakPolarHBondContact CE-CE1 3.17Å; K211-H276 WeakPolarHBondContact CE-NE2 3.39Å; Y222-H276 AromaticContact CZ-CD2 3.8Å; Y222-H276 PolarHBondContact OH-CD2 3.19Å; Y222-H276 PolarHBondContact OH-NE2 3.18Å; I274-H276 PolarHBondContact O-N 3.19Å
277	W	97.8	Very high	96.6	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-130.9	17.3	179.6	55.7	82.4	0	0	0	112.7	L204 F212 Y222 I226 F253 Y256 L257 I274 I275 Y353	L204-W277 HydrophobicContact CD2-CB 3.59Å; F212-W277 HydrophobicContact CE2-CH2 4.45Å; F212-W277 HydrophobicContact CE2-CZ3 4.14Å; F212-W277 AromaticContact CZ-CH2 3.97Å; F212-W277 HydrophobicContact CZ-CH2 3.97Å; F212-W277 HydrophobicContact CZ-CZ3 4.07Å; Y222-W277 HydrophobicContact CD1-CH2 4.2Å; Y222-W277 HydrophobicContact CD1-CZ3 4.39Å; Y222-W277 AromaticContact CE1-CH2 3.76Å; Y222-W277 HydrophobicContact CE1-CH2 3.76Å; Y222-W277 AromaticContact CE1-CZ3 3.86Å; Y222-W277 HydrophobicContact CE1-CZ3 3.86Å; I226-W277 HydrophobicContact CD1-CH2 4.48Å; I226-W277 HydrophobicContact CG2-CH2 4.3Å; F253-W277 AromaticContact CE2-CD2 3.95Å; F253-W277 HydrophobicContact CE2-CD2 3.95Å; F253-W277 HydrophobicContact CE2-CE3 4.06Å; F253-W277 HydrophobicContact CE2-CG 4.31Å; F253-W277 HydrophobicContact CE2-CZ3 4.46Å; F253-W277 HydrophobicContact CZ-CB 4.02Å; F253-W277 AromaticContact CZ-CD2 3.79Å; F253-W277 HydrophobicContact CZ-CD2 3.79Å; F253-W277 AromaticContact CZ-CE3 3.76Å; F253-W277 HydrophobicContact CZ-CE3 3.76Å; F253-W277 AromaticContact CZ-CG 3.93Å; F253-W277 HydrophobicContact CZ-CG 3.93Å; F253-W277 HydrophobicContact CZ-CZ3 4.47Å; Y256-W277 HydrophobicContact CE1-CZ2 4.33Å; Y256-W277 AromaticContact CE1-NE1 3.64Å; Y256-W277 AromaticContact CZ-NE1 3.93Å; Y256-W277 PolarHBondContact OH-NE1 3.18Å; L257-W277 HydrophobicContact CD1-CB 4.43Å; L257-W277 HydrophobicContact CD2-CB 4.1Å; L257-W277 HydrophobicContact CD2-CG 3.75Å; I274-W277 HydrophobicContact CB-CZ2 3.92Å; I274-W277 HydrophobicContact CG2-CZ2 3.85Å; I274-W277 PolarHBondContact O-N 2.87Å; I275-W277 PolarHBondContact O-N 3.29Å; W277-Y353 PolarHBondContact O-OH 3.04Å
278	V	97.5	Very high	96.7	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.024	18%	0.182	C	C	.	.	S	Bend	trans	-73.1	149.7	168.6	177	0	0	0	0	109.6	F117 R203 I274 E282 L283	F117-V278 HydrophobicContact CE1-CG1 4.32Å; F117-V278 HydrophobicContact CZ-CG2 4.43Å; R203-V278 VanDerWaalsContact CZ-O 3.24Å; R203-V278 PolarHBondContact NH1-O 3.47Å; R203-V278 PolarHBondContact NH2-O 3.45Å; I274-V278 HydrophobicContact CB-CG2 4.46Å; I274-V278 HydrophobicContact CD1-CG2 3.95Å; I274-V278 HydrophobicContact CG1-CG2 3.67Å; I274-V278 WeakPolarHBondContact O-CG2 3.49Å; I274-V278 PolarHBondContact O-N 3.4Å; V278-E282 HydrophobicContact CG1-CB 3.29Å; V278-E282 HydrophobicContact CG1-CG 4.28Å; V278-L283 HydrophobicContact CB-CD1 4.43Å; V278-L283 HydrophobicContact CB-CD2 4.01Å; V278-L283 HydrophobicContact CB-CG 3.96Å; V278-L283 HydrophobicContact CG1-CD2 4.09Å; V278-L283 HydrophobicContact CG1-CG 3.86Å
279	T	98.2	Very high	96.9	Very high	13 Å²	13	29.4 Å²	29.4	8%	0.08	15%	0.152	C	C	.	.			trans	-66.2	158.3	177.3	64.1	0	0	0	0	111.1	A281 E282 L283 Y353 D356	T279-A281 VanDerWaalsContact C-N 3.28Å; T279-A281 PolarHBondContact O-N 2.85Å; T279-E282 WeakPolarHBondContact CB-OE2 3.43Å; T279-E282 WeakPolarHBondContact CG2-OE2 3.12Å; T279-E282 PolarHBondContact N-OE2 3.21Å; T279-E282 PolarHBondContact O-N 3.26Å; T279-E282 WeakPolarHBondContact OG1-CB 3.37Å; T279-E282 WeakPolarHBondContact OG1-CG 3.45Å; T279-E282 PolarHBondContact OG1-N 3.43Å; T279-E282 PolarHBondContact OG1-OE2 2.91Å; T279-L283 WeakPolarHBondContact O-CB 3.32Å; T279-L283 VanDerWaalsContact O-CG 3.29Å; T279-L283 WeakPolarHBondContact O-CG 3.47Å; T279-L283 PolarHBondContact O-N 2.84Å; T279-Y353 HydrophobicContact CG2-CD1 3.96Å; T279-Y353 HydrophobicContact CG2-CE1 4.03Å; T279-D356 WeakPolarHBondContact CA-OD2 3.4Å; T279-D356 WeakPolarHBondContact CB-OD1 3.31Å
280	Y	98.6	Very high	97.1	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-67.8	-32.3	176.7	-67.6	-61.2	0	0	0	112.3	T135 V197 R198 R203 L283 C284 D356 F360	T135-Y280 HydrophobicContact CG2-CD1 3.56Å; T135-Y280 HydrophobicContact CG2-CE1 3.66Å; V197-Y280 WeakPolarHBondContact CA-OH 3.16Å; V197-Y280 HydrophobicContact CB-CD2 4.41Å; V197-Y280 HydrophobicContact CB-CE1 4.29Å; V197-Y280 HydrophobicContact CB-CE2 3.93Å; V197-Y280 HydrophobicContact CG1-CD1 4.01Å; V197-Y280 HydrophobicContact CG1-CD2 4.05Å; V197-Y280 HydrophobicContact CG1-CE1 3.97Å; V197-Y280 HydrophobicContact CG1-CE2 4.02Å; V197-Y280 HydrophobicContact CG1-CG 4.04Å; R198-Y280 PolarHBondContact N-OH 2.8Å; R198-Y280 PolarHBondContact O-OH 3.46Å; R203-Y280 WeakPolarHBondContact CD-OH 3.09Å; R203-Y280 PolarHBondContact NE-OH 3.16Å; Y280-L283 PolarHBondContact O-N 3.28Å; Y280-C284 PolarHBondContact O-N 2.81Å; Y280-D356 WeakPolarHBondContact CB-OD1 3.42Å; Y280-D356 HydrophobicContact CD2-CB 3.86Å; Y280-D356 VanDerWaalsContact CD2-OD2 3.32Å; Y280-D356 WeakPolarHBondContact CD2-OD2 3.48Å; Y280-D356 HydrophobicContact CE2-CB 4.49Å; Y280-D356 PolarHBondContact N-OD1 3.43Å; Y280-D356 PolarHBondContact N-OD2 2.95Å; Y280-F360 VanDerWaalsContact CB-CE2 3.49Å; Y280-F360 AromaticContact CD2-CD2 3.85Å; Y280-F360 HydrophobicContact CD2-CD2 3.85Å; Y280-F360 AromaticContact CD2-CE2 3.51Å; Y280-F360 HydrophobicContact CD2-CE2 3.51Å; Y280-F360 HydrophobicContact CD2-CZ 4.5Å; Y280-F360 HydrophobicContact CE2-CD2 4.45Å; Y280-F360 HydrophobicContact CE2-CE2 4.47Å; Y280-F360 HydrophobicContact CG-CD2 4.49Å; Y280-F360 AromaticContact CG-CE2 3.74Å; Y280-F360 HydrophobicContact CG-CE2 3.74Å; Y280-F360 HydrophobicContact CG-CZ 4.36Å
281	A	98	Very high	97.2	Very high	2 Å²	2	29 Å²	29	2%	0.017	16%	0.155	C	C	.	.	H	α-helix	trans	-55.4	-54.6	170.6	0	0	0	0	0	110.5	V112 T279 L283 A285 L359	V112-A281 HydrophobicContact CG1-CB 4.34Å; V112-A281 WeakPolarHBondContact CG2-O 3.37Å; T279-A281 VanDerWaalsContact C-N 3.28Å; T279-A281 PolarHBondContact O-N 2.85Å; A281-L283 VanDerWaalsContact C-N 3.31Å; A281-L283 PolarHBondContact O-N 3.23Å; A281-A285 VanDerWaalsContact O-CA 3.3Å; A281-A285 WeakPolarHBondContact O-CA 3.48Å; A281-A285 PolarHBondContact O-N 3.1Å; A281-L359 HydrophobicContact CB-CD1 4.37Å
282	E	97.5	Very high	97.4	Very high	71 Å²	71	29.4 Å²	29.4	33%	0.332	15%	0.152	S	C	.	.	H	α-helix	trans	-67.5	-24.5	179.6	-70.4	170.1	114.3	0	0	114.3	V112 V278 T279	V112-E282 HydrophobicContact CG1-CG 4.27Å; V278-E282 HydrophobicContact CG1-CB 3.29Å; V278-E282 HydrophobicContact CG1-CG 4.28Å; T279-E282 WeakPolarHBondContact CB-OE2 3.43Å; T279-E282 WeakPolarHBondContact CG2-OE2 3.12Å; T279-E282 PolarHBondContact N-OE2 3.21Å; T279-E282 PolarHBondContact O-N 3.26Å; T279-E282 WeakPolarHBondContact OG1-CB 3.37Å; T279-E282 WeakPolarHBondContact OG1-CG 3.45Å; T279-E282 PolarHBondContact OG1-N 3.43Å; T279-E282 PolarHBondContact OG1-OE2 2.91Å
283	L	98.1	Very high	97.8	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-82.4	-42.7	178.2	-74.9	170.6	0	0	0	113	F117 R121 V278 T279 Y280 A281	F117-L283 HydrophobicContact CE1-CD2 4.27Å; F117-L283 HydrophobicContact CZ-CD2 4.49Å; R121-L283 HydrophobicContact CG-CD2 4.24Å; V278-L283 HydrophobicContact CB-CD1 4.43Å; V278-L283 HydrophobicContact CB-CD2 4.01Å; V278-L283 HydrophobicContact CB-CG 3.96Å; V278-L283 HydrophobicContact CG1-CD2 4.09Å; V278-L283 HydrophobicContact CG1-CG 3.86Å; T279-L283 WeakPolarHBondContact O-CB 3.32Å; T279-L283 VanDerWaalsContact O-CG 3.29Å; T279-L283 WeakPolarHBondContact O-CG 3.47Å; T279-L283 PolarHBondContact O-N 2.84Å; Y280-L283 PolarHBondContact O-N 3.28Å; A281-L283 VanDerWaalsContact C-N 3.31Å; A281-L283 PolarHBondContact O-N 3.23Å
284	C	98.6	Very high	98	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-132.1	-3.4	-162.7	-66.9	0	0	0	0	114.6	C133 F195 Y280 Y291	C133-C284 HydrophobicContact CB-CB 3.93Å; C133-C284 WeakPolarHBondContact CB-SG 3.41Å; C133-C284 WeakPolarHBondContact SG-CA 3.43Å; C133-C284 WeakPolarHBondContact SG-CB 3.11Å; C133-C284 CovalentContact SG-SG 2.04Å; C133-C284 PolarHBondContact SG-SG 3.35Å; F195-C284 HydrophobicContact CD2-CB 4.49Å; Y280-C284 PolarHBondContact O-N 2.81Å; C284-Y291 WeakPolarHBondContact CB-OH 3.27Å; C284-Y291 WeakPolarHBondContact O-CE2 3.37Å; C284-Y291 PolarHBondContact O-OH 3.18Å
285	A	98.6	Very high	98.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.112	C	C	.	.			trans	44.2	57.6	177.4	0	0	0	0	0	113.8	V112 I114 V118 A281 C287 E288 I289	V112-A285 HydrophobicContact CG2-CB 3.69Å; I114-A285 HydrophobicContact CG1-CB 4.39Å; V118-A285 HydrophobicContact CG1-CB 3.99Å; V118-A285 HydrophobicContact CG2-CB 4.41Å; A281-A285 VanDerWaalsContact O-CA 3.3Å; A281-A285 WeakPolarHBondContact O-CA 3.48Å; A281-A285 PolarHBondContact O-N 3.1Å; A285-C287 PolarHBondContact O-N 3.19Å; A285-E288 HydrophobicContact CB-CB 4.11Å; A285-E288 PolarHBondContact O-N 2.93Å; A285-I289 HydrophobicContact CB-CD1 4.49Å; A285-I289 PolarHBondContact O-N 2.96Å
286	P	98.4	Very high	98.3	Very high	7 Å²	7	20.9 Å²	20.9	5%	0.045	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-14.9	-168.5	33	-37.5	0	0	0	114.6	L97 F195 Y291 L359 F360	L97-P286 HydrophobicContact CD1-CB 4.12Å; L97-P286 HydrophobicContact CD1-CG 4.49Å; L97-P286 HydrophobicContact CD2-CB 4.25Å; F195-P286 HydrophobicContact CE1-CB 4.36Å; F195-P286 HydrophobicContact CZ-CB 3.92Å; P286-Y291 HydrophobicContact CB-CD2 4.42Å; P286-Y291 HydrophobicContact CB-CE2 4.31Å; P286-L359 HydrophobicContact CG-CD1 4.03Å; P286-L359 HydrophobicContact CG-CD2 4.43Å; P286-F360 HydrophobicContact CG-CZ 4.21Å
287	C	98.7	Very high	98.3	Very high	30 Å²	30	20.7 Å²	20.7	20%	0.203	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-19.7	170.2	-63.1	0	0	0	0	113	C101 A285	C101-C287 VanDerWaalsContact CA-SG 3.54Å; C101-C287 HydrophobicContact CB-CB 3.69Å; C101-C287 WeakPolarHBondContact CB-SG 3.12Å; C101-C287 WeakPolarHBondContact SG-CA 3.44Å; C101-C287 WeakPolarHBondContact SG-CB 3.47Å; C101-C287 CovalentContact SG-SG 2.04Å; C101-C287 PolarHBondContact SG-SG 3.29Å; A285-C287 PolarHBondContact O-N 3.19Å
288	E	98.5	Very high	98.2	Very high	67 Å²	67	22.5 Å²	22.5	31%	0.313	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-19.9	-174	-78.2	57.7	101.1	0	0	111.8	H111 V112 I114 A285	H111-E288 WeakPolarHBondContact CA-OE1 3.44Å; H111-E288 WeakPolarHBondContact CB-OE1 3.46Å; H111-E288 IonicContact CD2-OE1 3.49Å; H111-E288 IonicContact CD2-OE2 4Å; H111-E288 PolarHBondContact CD2-OE2 2.81Å; H111-E288 IonicContact CG-OE1 2.86Å; H111-E288 IonicContact CG-OE2 3.34Å; H111-E288 IonicContact NE2-OE2 3.71Å; V112-E288 PolarHBondContact N-OE1 2.94Å; V112-E288 WeakPolarHBondContact O-CG 3.5Å; I114-E288 HydrophobicContact CD1-CB 4.04Å; I114-E288 HydrophobicContact CG1-CB 3.88Å; A285-E288 HydrophobicContact CB-CB 4.11Å; A285-E288 PolarHBondContact O-N 2.93Å
289	I	98.6	Very high	98.1	Very high	9 Å²	9	24.2 Å²	24.2	5%	0.046	13%	0.13	C	C	.	.	S	Bend	trans	-116.5	124.4	178.4	-61.5	176.5	0	0	0	108.7	I114 V118 I122 L188 K193 A285 Y291	I114-I289 HydrophobicContact CD1-CD1 4.28Å; I114-I289 HydrophobicContact CD1-CG1 3.72Å; I114-I289 HydrophobicContact CG1-CG1 4.27Å; V118-I289 HydrophobicContact CG1-CD1 4.28Å; I122-I289 HydrophobicContact CD1-CD1 3.68Å; L188-I289 HydrophobicContact CD2-CD1 4.19Å; L188-I289 HydrophobicContact CD2-CG1 4.38Å; L188-I289 HydrophobicContact CD2-CG2 4.08Å; K193-I289 HydrophobicContact CD-CG2 3.84Å; A285-I289 HydrophobicContact CB-CD1 4.49Å; A285-I289 PolarHBondContact O-N 2.96Å; I289-Y291 HydrophobicContact CB-CD2 4.25Å; I289-Y291 HydrophobicContact CB-CE2 3.67Å; I289-Y291 HydrophobicContact CG2-CD2 4.1Å; I289-Y291 HydrophobicContact CG2-CE1 4.32Å; I289-Y291 HydrophobicContact CG2-CE2 3.69Å; I289-Y291 WeakPolarHBondContact O-CD2 3.41Å; I289-Y291 PolarHBondContact O-N 3.16Å; I289-Y291 VanDerWaalsContact O-N 3.12Å
290	N	98.1	Very high	98	Very high	139 Å²	139	23.8 Å²	23.8	74%	0.743	13%	0.127	S	C	*	.			trans	-77.9	97	177.8	-171.3	18	0	0	0	111	K193	K193-N290 WeakPolarHBondContact CD-O 3.47Å; K193-N290 WeakPolarHBondContact CE-O 3.49Å; K193-N290 PolarHBondContact NZ-O 2.56Å
291	Y	98.8	Very high	97.7	Very high	9 Å²	9	30.1 Å²	30.1	4%	0.035	16%	0.157	C	C	.	.			trans	-78.5	140.1	178.7	-72.9	-85.1	0	0	0	112.1	L94 C133 K193 F195 C284 P286 I289	L94-Y291 WeakPolarHBondContact CD2-O 3.33Å; C133-Y291 HydrophobicContact CB-CE1 4.07Å; K193-Y291 HydrophobicContact CB-CD1 3.83Å; K193-Y291 HydrophobicContact CB-CE1 4.39Å; F195-Y291 AromaticContact CD1-CD1 3.42Å; F195-Y291 HydrophobicContact CD1-CD1 3.42Å; F195-Y291 VanDerWaalsContact CD1-CD1 3.42Å; F195-Y291 HydrophobicContact CD1-CD2 4.02Å; F195-Y291 AromaticContact CD1-CE1 3.51Å; F195-Y291 HydrophobicContact CD1-CE1 3.51Å; F195-Y291 HydrophobicContact CD1-CE2 4.1Å; F195-Y291 AromaticContact CD1-CG 3.68Å; F195-Y291 HydrophobicContact CD1-CG 3.68Å; F195-Y291 AromaticContact CD1-CZ 3.87Å; F195-Y291 AromaticContact CE1-CD1 3.84Å; F195-Y291 HydrophobicContact CE1-CD1 3.84Å; F195-Y291 AromaticContact CE1-CD2 3.56Å; F195-Y291 HydrophobicContact CE1-CD2 3.56Å; F195-Y291 HydrophobicContact CE1-CE1 4.06Å; F195-Y291 AromaticContact CE1-CE2 3.8Å; F195-Y291 HydrophobicContact CE1-CE2 3.8Å; F195-Y291 AromaticContact CE1-CG 3.58Å; F195-Y291 HydrophobicContact CE1-CG 3.58Å; F195-Y291 HydrophobicContact CG-CE1 4.35Å; C284-Y291 WeakPolarHBondContact CB-OH 3.27Å; C284-Y291 WeakPolarHBondContact O-CE2 3.37Å; C284-Y291 PolarHBondContact O-OH 3.18Å; P286-Y291 HydrophobicContact CB-CD2 4.42Å; P286-Y291 HydrophobicContact CB-CE2 4.31Å; I289-Y291 HydrophobicContact CB-CD2 4.25Å; I289-Y291 HydrophobicContact CB-CE2 3.67Å; I289-Y291 HydrophobicContact CG2-CD2 4.1Å; I289-Y291 HydrophobicContact CG2-CE1 4.32Å; I289-Y291 HydrophobicContact CG2-CE2 3.69Å; I289-Y291 WeakPolarHBondContact O-CD2 3.41Å; I289-Y291 PolarHBondContact O-N 3.16Å; I289-Y291 VanDerWaalsContact O-N 3.12Å
292	S	98.7	Very high	97.6	Very high	40 Å²	40	33.5 Å²	33.5	28%	0.28	17%	0.172	S	C	.	.	S	Bend	trans	-78	-32.9	176.2	-51.8	0	0	0	0	112.1	L94 K193	L94-S292 WeakPolarHBondContact CD1-O 3.39Å; K193-S292 PolarHBondContact N-OG 3.49Å; K193-S292 VanDerWaalsContact N-OG 3.08Å; K193-S292 WeakPolarHBondContact O-CA 3.41Å; K193-S292 VanDerWaalsContact O-CB 3.25Å; K193-S292 WeakPolarHBondContact O-CB 3.14Å; K193-S292 PolarHBondContact O-N 3.41Å
293	V	98.6	Very high	97.6	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.012	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	140.7	175.7	179.1	0	0	0	0	110.9	F192 K193 F194 F195 F306 I307	F192-V293 HydrophobicContact CE2-CG2 4.14Å; F192-V293 HydrophobicContact CZ-CB 4.27Å; F192-V293 HydrophobicContact CZ-CG2 3.58Å; K193-V293 PolarHBondContact O-N 3.01Å; F194-V293 VanDerWaalsContact CA-O 3.23Å; F194-V293 WeakPolarHBondContact CA-O 3.46Å; F194-V293 HydrophobicContact CB-CB 4.12Å; F194-V293 WeakPolarHBondContact CB-O 3.4Å; F195-V293 PolarHBondContact N-O 3.21Å; V293-F306 HydrophobicContact CG1-CD1 4.34Å; V293-F306 HydrophobicContact CG1-CE1 4.34Å; V293-F306 HydrophobicContact CG2-CD1 4.36Å; V293-F306 HydrophobicContact CG2-CE1 3.81Å; V293-I307 HydrophobicContact CB-CG1 4.07Å; V293-I307 HydrophobicContact CG1-CD1 4.04Å; V293-I307 HydrophobicContact CG1-CG1 3.56Å; V293-I307 HydrophobicContact CG2-CG1 4.46Å
294	V	98.7	Very high	97.5	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.012	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	107.1	166.8	-174.5	0	0	0	0	109.1	R93 L94 L97 F195 V197 F360	R93-V294 WeakPolarHBondContact CD-O 3.41Å; R93-V294 PolarHBondContact NH1-O 2.55Å; L94-V294 HydrophobicContact CD2-CG2 3.98Å; L97-V294 HydrophobicContact CD2-CG2 4.08Å; F195-V294 HydrophobicContact CD1-CG2 4.17Å; F195-V294 HydrophobicContact CE1-CB 4.38Å; F195-V294 HydrophobicContact CE1-CG1 4.15Å; F195-V294 HydrophobicContact CE1-CG2 3.49Å; F195-V294 VanDerWaalsContact CE1-CG2 3.49Å; F195-V294 HydrophobicContact CE2-CG1 4.25Å; F195-V294 HydrophobicContact CZ-CG1 3.94Å; F195-V294 HydrophobicContact CZ-CG2 3.96Å; V197-V294 HydrophobicContact CG1-CG1 4.23Å; V197-V294 HydrophobicContact CG2-CG1 4.06Å; V294-F360 HydrophobicContact CG1-CD1 3.88Å; V294-F360 HydrophobicContact CG1-CE1 3.93Å
295	G	98.3	Very high	97.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	152.7	178.9	0	0	0	0	0	112.1	F195 I196 V197	F195-G295 PolarHBondContact O-N 3.49Å; I196-G295 CarbonylContact C-O 3.57Å; I196-G295 VanDerWaalsContact CA-O 3.28Å; I196-G295 WeakPolarHBondContact CA-O 3.47Å; V197-G295 WeakPolarHBondContact CG2-O 3.21Å; V197-G295 PolarHBondContact N-O 2.74Å
296	H	98.3	Very high	97.3	Very high	27 Å²	27	32.4 Å²	32.4	13%	0.125	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	137.5	174.5	-72.5	-167.6	0	0	0	109.8	V197 E298 T299 L300 D303 F360	V197-H296 WeakPolarHBondContact CG2-CD2 3.34Å; V197-H296 CarbonylContact O-C 3.58Å; H296-E298 PolarHBondContact O-N 3.4Å; H296-T299 CarbonylContact O-C 3.5Å; H296-T299 PolarHBondContact O-N 2.88Å; H296-T299 VanDerWaalsContact O-N 3.07Å; H296-T299 PolarHBondContact O-OG1 2.86Å; H296-L300 WeakPolarHBondContact O-CA 3.39Å; H296-L300 PolarHBondContact O-N 3.1Å; H296-D303 PolarHBondContact N-OD2 3.35Å; H296-F360 PolarHBondContact CE1-O 3.35Å; H296-F360 VanDerWaalsContact CE1-O 3.24Å
297	H	97.6	Very high	97.3	Very high	12 Å²	12	32 Å²	32	6%	0.056	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-62.6	-32.5	-179.6	-178.2	-96	0	0	0	111.6	V138 I196 V197 R198 T299 L300 I326 T327	V138-H297 VanDerWaalsContact CA-CD2 3.47Å; V138-H297 WeakPolarHBondContact CA-CD2 3.48Å; V138-H297 HydrophobicContact CB-CB 4.25Å; V138-H297 HydrophobicContact CG1-CB 4.42Å; I196-H297 HydrophobicContact CG2-CB 4.4Å; V197-H297 WeakPolarHBondContact O-CB 3.05Å; V197-H297 PolarHBondContact O-N 3.03Å; R198-H297 HydrophobicContact CB-CB 3.7Å; R198-H297 HydrophobicContact CG-CB 3.95Å; R198-H297 PolarHBondContact NH1-CE1 3.03Å; H297-T299 PolarHBondContact O-N 3.46Å; H297-L300 VanDerWaalsContact O-CB 3.29Å; H297-L300 WeakPolarHBondContact O-CB 3.22Å; H297-L300 PolarHBondContact O-N 2.93Å; H297-I326 PolarHBondContact CE1-O 3.21Å; H297-T327 PolarHBondContact ND1-O 3Å; H297-T327 WeakPolarHBondContact O-CB 3.42Å; H297-T327 WeakPolarHBondContact O-CG2 3.46Å
298	E	96.4	Very high	97.3	Very high	39 Å²	39	31 Å²	31	18%	0.182	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-61.7	-28.9	176.9	-64	75.1	-168.9	0	0	112.3	R198 D199 H296 T327 Y362	R198-E298 WeakPolarHBondContact CG-OE1 3.3Å; D199-E298 PolarHBondContact N-OE1 3.15Å; H296-E298 PolarHBondContact O-N 3.4Å; E298-T327 VanDerWaalsContact CA-O 3.3Å; E298-T327 WeakPolarHBondContact CA-O 3.4Å; E298-Y362 PolarHBondContact OE2-OH 3.32Å
299	T	95.8	Very high	97.2	Very high	39 Å²	39	32.8 Å²	32.8	24%	0.239	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-118.5	21.7	179	52.8	0	0	0	0	112.8	W86 R93 H296 H297 E301 H302 D303	W86-T299 HydrophobicContact CH2-CG2 4Å; W86-T299 HydrophobicContact CZ2-CG2 4.16Å; R93-T299 PolarHBondContact NH2-OG1 3.1Å; H296-T299 CarbonylContact O-C 3.5Å; H296-T299 PolarHBondContact O-N 2.88Å; H296-T299 VanDerWaalsContact O-N 3.07Å; H296-T299 PolarHBondContact O-OG1 2.86Å; H297-T299 PolarHBondContact O-N 3.46Å; T299-E301 PolarHBondContact O-N 3.46Å; T299-H302 PolarHBondContact O-N 2.83Å; T299-D303 WeakPolarHBondContact CB-OD2 3.47Å; T299-D303 PolarHBondContact O-N 3.44Å; T299-D303 PolarHBondContact OG1-OD2 3.2Å
300	L	95.6	Very high	97.1	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.026	18%	0.183	C	C	.	.	H	α-helix	trans	-53.9	-32.5	-170	-177.9	61.7	0	0	0	114.4	I196 H296 H297 A304 Y319 I322 T327	I196-L300 HydrophobicContact CD1-CD1 4.31Å; I196-L300 HydrophobicContact CG1-CD1 4.38Å; I196-L300 HydrophobicContact CG2-CD1 4.27Å; H296-L300 WeakPolarHBondContact O-CA 3.39Å; H296-L300 PolarHBondContact O-N 3.1Å; H297-L300 VanDerWaalsContact O-CB 3.29Å; H297-L300 WeakPolarHBondContact O-CB 3.22Å; H297-L300 PolarHBondContact O-N 2.93Å; L300-A304 HydrophobicContact CD1-CB 4.49Å; L300-A304 WeakPolarHBondContact O-CB 3.17Å; L300-A304 PolarHBondContact O-N 3.07Å; L300-Y319 HydrophobicContact CD2-CE1 4.2Å; L300-Y319 HydrophobicContact CG-CE1 4.34Å; L300-I322 HydrophobicContact CB-CD1 4.11Å; L300-I322 HydrophobicContact CD2-CD1 4.01Å; L300-I322 HydrophobicContact CG-CD1 3.77Å; L300-T327 HydrophobicContact CB-CG2 3.9Å; L300-T327 HydrophobicContact CD2-CG2 4.19Å
301	E	92.8	Very high	97.1	Very high	133 Å²	133	28.8 Å²	28.8	62%	0.621	16%	0.155	S	C	*	.	H	α-helix	trans	-60.4	-46.4	177	-175.2	174.9	-176.6	0	0	112.1	T299 A305 I322	T299-E301 PolarHBondContact O-N 3.46Å; E301-A305 PolarHBondContact O-N 3.26Å; E301-I322 HydrophobicContact CB-CD1 4.04Å
302	H	94.9	Very high	97	Very high	72 Å²	72	31.1 Å²	31.1	33%	0.333	18%	0.181	S	C	.	.	H	α-helix	trans	-75.6	-42.4	177.8	-61.1	83.2	0	0	0	110.7	W86 T299 A304 A305 F306	W86-H302 HydrophobicContact CD2-CB 3.64Å; W86-H302 HydrophobicContact CE3-CB 3.92Å; W86-H302 HydrophobicContact CG-CB 4.36Å; W86-H302 HydrophobicContact CH2-CB 3.66Å; W86-H302 AromaticContact CH2-CG 3.89Å; W86-H302 HydrophobicContact CZ2-CB 3.38Å; W86-H302 HydrophobicContact CZ3-CB 3.92Å; W86-H302 AromaticContact CZ3-CG 3.93Å; T299-H302 PolarHBondContact O-N 2.83Å; H302-A304 PolarHBondContact O-N 3.09Å; H302-A305 PolarHBondContact O-N 3.27Å; H302-F306 WeakPolarHBondContact O-CB 3.45Å; H302-F306 PolarHBondContact O-N 3.19Å
303	D	96.8	Very high	96.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.4	-42.6	-179.9	-72.4	-49.3	0	0	0	112.5	W86 R93 H296 T299 F306 I307	W86-D303 PolarHBondContact NE1-OD1 2.89Å; R93-D303 IonicContact CZ-OD1 2.8Å; R93-D303 IonicContact CZ-OD2 3.84Å; R93-D303 VanDerWaalsContact NH1-CG 3.3Å; R93-D303 IonicContact NH1-OD1 3.37Å; R93-D303 PolarHBondContact NH1-OD1 3.35Å; R93-D303 IonicContact NH1-OD2 3.78Å; R93-D303 PolarHBondContact NH1-OD2 2.9Å; R93-D303 VanDerWaalsContact NH1-OD2 3.16Å; R93-D303 IonicContact NH2-OD2 2.74Å; H296-D303 PolarHBondContact N-OD2 3.35Å; T299-D303 WeakPolarHBondContact CB-OD2 3.47Å; T299-D303 PolarHBondContact O-N 3.44Å; T299-D303 PolarHBondContact OG1-OD2 3.2Å; D303-F306 PolarHBondContact O-N 2.99Å; D303-I307 WeakPolarHBondContact O-CB 3.39Å; D303-I307 WeakPolarHBondContact O-CD1 3.48Å; D303-I307 WeakPolarHBondContact O-CG1 3.44Å; D303-I307 PolarHBondContact O-N 3.42Å
304	A	96.9	Very high	96.8	Very high	2 Å²	2	33.2 Å²	33.2	2%	0.017	19%	0.187	C	C	.	.	H	α-helix	trans	-64.5	-45.6	178.3	0	0	0	0	0	111.4	W143 L300 H302 F306 I307 L308 Y319	W143-A304 HydrophobicContact CH2-CB 4.22Å; W143-A304 HydrophobicContact CZ2-CB 3.82Å; L300-A304 HydrophobicContact CD1-CB 4.49Å; L300-A304 WeakPolarHBondContact O-CB 3.17Å; L300-A304 PolarHBondContact O-N 3.07Å; H302-A304 PolarHBondContact O-N 3.09Å; A304-F306 VanDerWaalsContact C-N 3.32Å; A304-F306 PolarHBondContact O-N 2.86Å; A304-I307 PolarHBondContact O-N 3.44Å; A304-L308 VanDerWaalsContact O-CG 3.26Å; A304-L308 WeakPolarHBondContact O-CG 3.28Å; A304-L308 PolarHBondContact O-N 3.48Å; A304-L308 VanDerWaalsContact O-N 3.08Å; A304-Y319 HydrophobicContact CB-CD1 3.97Å; A304-Y319 HydrophobicContact CB-CD2 3.89Å; A304-Y319 HydrophobicContact CB-CE2 4.44Å; A304-Y319 HydrophobicContact CB-CG 3.61Å
305	A	96	Very high	96.6	Very high	36 Å²	36	40.6 Å²	40.6	30%	0.298	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-40.8	176.9	0	0	0	0	0	112	E301 H302 R309	E301-A305 PolarHBondContact O-N 3.26Å; H302-A305 PolarHBondContact O-N 3.27Å; A305-R309 PolarHBondContact O-N 3.45Å
306	F	97.6	Very high	96.5	Very high	10 Å²	10	45.1 Å²	45.1	4%	0.044	24%	0.244	C	C	.	.	H	α-helix	trans	-66.8	-48.2	176.5	176.8	-97.8	0	0	0	112.3	W86 Q87 S90 V293 H302 D303 A304 L308 R309 A310	W86-F306 HydrophobicContact CB-CB 4.47Å; W86-F306 HydrophobicContact CB-CD2 4.02Å; W86-F306 HydrophobicContact CB-CG 4.42Å; W86-F306 VanDerWaalsContact CD1-CB 3.47Å; W86-F306 AromaticContact CD1-CG 3.66Å; W86-F306 HydrophobicContact CG-CB 4.23Å; W86-F306 HydrophobicContact CG-CD2 4.49Å; W86-F306 HydrophobicContact CG-CG 4.41Å; Q87-F306 HydrophobicContact CB-CE2 4.14Å; Q87-F306 VanDerWaalsContact OE1-CE2 3.23Å; S90-F306 VanDerWaalsContact CB-CE1 3.44Å; S90-F306 WeakPolarHBondContact OG-CE1 3.34Å; V293-F306 HydrophobicContact CG1-CD1 4.34Å; V293-F306 HydrophobicContact CG1-CE1 4.34Å; V293-F306 HydrophobicContact CG2-CD1 4.36Å; V293-F306 HydrophobicContact CG2-CE1 3.81Å; H302-F306 WeakPolarHBondContact O-CB 3.45Å; H302-F306 PolarHBondContact O-N 3.19Å; D303-F306 PolarHBondContact O-N 2.99Å; A304-F306 VanDerWaalsContact C-N 3.32Å; A304-F306 PolarHBondContact O-N 2.86Å; F306-L308 VanDerWaalsContact C-N 3.3Å; F306-L308 PolarHBondContact O-N 2.61Å; F306-R309 PolarHBondContact O-N 2.98Å; F306-A310 HydrophobicContact CE1-CB 4.22Å; F306-A310 HydrophobicContact CZ-CB 4.35Å; F306-A310 WeakPolarHBondContact O-CB 3.38Å; F306-A310 PolarHBondContact O-N 3.14Å
307	I	98.1	Very high	96.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-55.7	-45.2	178.4	-74.1	161.9	0	0	0	110.9	W143 F192 F194 I196 V293 D303 A304 R309 A310 A311	W143-I307 HydrophobicContact CH2-CB 3.85Å; W143-I307 HydrophobicContact CH2-CD1 4.22Å; W143-I307 HydrophobicContact CH2-CG2 3.5Å; W143-I307 VanDerWaalsContact CH2-CG2 3.5Å; W143-I307 HydrophobicContact CZ2-CB 4.32Å; W143-I307 HydrophobicContact CZ2-CD1 3.83Å; W143-I307 HydrophobicContact CZ2-CG2 4.21Å; W143-I307 HydrophobicContact CZ3-CG2 4.05Å; F192-I307 HydrophobicContact CE1-CG2 4.2Å; F194-I307 HydrophobicContact CD1-CG2 3.99Å; F194-I307 HydrophobicContact CD2-CD1 3.8Å; F194-I307 HydrophobicContact CD2-CG1 4.43Å; F194-I307 HydrophobicContact CD2-CG2 3.87Å; F194-I307 HydrophobicContact CE1-CG2 4.08Å; F194-I307 HydrophobicContact CE2-CD1 4.34Å; F194-I307 HydrophobicContact CE2-CG2 3.97Å; F194-I307 HydrophobicContact CG-CD1 4.43Å; F194-I307 HydrophobicContact CG-CG2 3.88Å; F194-I307 HydrophobicContact CZ-CG2 4.07Å; I196-I307 HydrophobicContact CD1-CD1 3.64Å; V293-I307 HydrophobicContact CB-CG1 4.07Å; V293-I307 HydrophobicContact CG1-CD1 4.04Å; V293-I307 HydrophobicContact CG1-CG1 3.56Å; V293-I307 HydrophobicContact CG2-CG1 4.46Å; D303-I307 WeakPolarHBondContact O-CB 3.39Å; D303-I307 WeakPolarHBondContact O-CD1 3.48Å; D303-I307 WeakPolarHBondContact O-CG1 3.44Å; D303-I307 PolarHBondContact O-N 3.42Å; A304-I307 PolarHBondContact O-N 3.44Å; I307-R309 VanDerWaalsContact C-N 3.31Å; I307-R309 PolarHBondContact O-N 3.31Å; I307-A310 PolarHBondContact O-N 3.49Å; I307-A311 VanDerWaalsContact O-CB 3.24Å; I307-A311 WeakPolarHBondContact O-CB 3.35Å; I307-A311 PolarHBondContact O-N 3.46Å
308	L	97.8	Very high	96.1	Very high	8 Å²	8	47.9 Å²	47.9	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-37.2	178.5	-66.9	175.2	0	0	0	112.3	W143 V146 A304 F306 G312 I313 H314 V317	W143-L308 HydrophobicContact CH2-CD2 4.44Å; W143-L308 HydrophobicContact CH2-CG 4.46Å; W143-L308 HydrophobicContact CZ3-CD2 4.1Å; V146-L308 HydrophobicContact CG1-CD2 4.18Å; A304-L308 VanDerWaalsContact O-CG 3.26Å; A304-L308 WeakPolarHBondContact O-CG 3.28Å; A304-L308 PolarHBondContact O-N 3.48Å; A304-L308 VanDerWaalsContact O-N 3.08Å; F306-L308 VanDerWaalsContact C-N 3.3Å; F306-L308 PolarHBondContact O-N 2.61Å; L308-G312 PolarHBondContact O-N 2.98Å; L308-I313 HydrophobicContact CB-CG1 4.36Å; L308-I313 HydrophobicContact CD2-CD1 3.47Å; L308-I313 VanDerWaalsContact CD2-CD1 3.47Å; L308-I313 HydrophobicContact CD2-CG1 3.84Å; L308-I313 WeakPolarHBondContact O-CG1 3.47Å; L308-I313 PolarHBondContact O-N 2.93Å; L308-H314 HydrophobicContact CB-CB 4.05Å; L308-H314 PolarHBondContact O-N 2.73Å; L308-V317 HydrophobicContact CD2-CG1 4.04Å
309	R	97.2	Very high	96	Very high	104 Å²	104	47.5 Å²	47.5	39%	0.392	27%	0.265	S	S	.	.	H	α-helix	trans	-70.6	-49.5	175.9	-76.7	-171.6	-68.3	-91.1	2.3	111.7	A305 F306 I307 A311 G312 H314	A305-R309 PolarHBondContact O-N 3.45Å; F306-R309 PolarHBondContact O-N 2.98Å; I307-R309 VanDerWaalsContact C-N 3.31Å; I307-R309 PolarHBondContact O-N 3.31Å; R309-A311 VanDerWaalsContact C-N 3.26Å; R309-A311 PolarHBondContact O-N 3.32Å; R309-G312 PolarHBondContact O-N 2.96Å; R309-H314 HydrophobicContact CG-CB 3.8Å
310	A	97.2	Very high	95.9	Very high	47 Å²	47	46.3 Å²	46.3	39%	0.388	26%	0.258	S	S	.	.	H	α-helix	trans	-61.4	-33.7	-179.8	0	0	0	0	0	112.5	F192 F306 I307 G312	F192-A310 HydrophobicContact CE2-CB 3.87Å; F192-A310 HydrophobicContact CZ-CB 3.98Å; F306-A310 HydrophobicContact CE1-CB 4.22Å; F306-A310 HydrophobicContact CZ-CB 4.35Å; F306-A310 WeakPolarHBondContact O-CB 3.38Å; F306-A310 PolarHBondContact O-N 3.14Å; I307-A310 PolarHBondContact O-N 3.49Å; A310-G312 VanDerWaalsContact C-N 3.29Å; A310-G312 PolarHBondContact O-N 2.94Å
311	A	97.6	Very high	95.6	Very high	18 Å²	18	50.8 Å²	50.8	15%	0.149	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-0.6	173.7	0	0	0	0	0	114	I130 F192 I307 R309 I313	I130-A311 HydrophobicContact CD1-CB 4.09Å; I130-A311 HydrophobicContact CG1-CB 4.45Å; F192-A311 HydrophobicContact CD1-CB 3.71Å; F192-A311 HydrophobicContact CD2-CB 4.37Å; F192-A311 HydrophobicContact CE1-CB 3.81Å; F192-A311 HydrophobicContact CE2-CB 4.44Å; F192-A311 HydrophobicContact CG-CB 4Å; F192-A311 HydrophobicContact CZ-CB 4.16Å; I307-A311 VanDerWaalsContact O-CB 3.24Å; I307-A311 WeakPolarHBondContact O-CB 3.35Å; I307-A311 PolarHBondContact O-N 3.46Å; R309-A311 VanDerWaalsContact C-N 3.26Å; R309-A311 PolarHBondContact O-N 3.32Å; A311-I313 VanDerWaalsContact C-N 3.28Å; A311-I313 HydrophobicContact CB-CD1 4.25Å; A311-I313 HydrophobicContact CB-CG1 3.92Å; A311-I313 PolarHBondContact O-N 2.62Å
312	G	97.1	Very high	95.5	Very high	57 Å²	57	46.4 Å²	46.4	59%	0.588	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	17.6	179.3	0	0	0	0	0	115.1	L308 R309 A310	L308-G312 PolarHBondContact O-N 2.98Å; R309-G312 PolarHBondContact O-N 2.96Å; A310-G312 VanDerWaalsContact C-N 3.29Å; A310-G312 PolarHBondContact O-N 2.94Å
313	I	96.7	Very high	95.2	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.031	28%	0.283	C	S	.	.			trans	-113.3	1.3	-173.1	57.3	165.9	0	0	0	114.5	R128 I130 L150 L308 A311 Q315 L316 V317	R128-I313 HydrophobicContact CB-CG2 4.13Å; R128-I313 HydrophobicContact CG-CG2 4.13Å; I130-I313 HydrophobicContact CD1-CD1 3.62Å; I130-I313 HydrophobicContact CD1-CG1 4.38Å; I130-I313 HydrophobicContact CD1-CG2 4.03Å; L150-I313 HydrophobicContact CD1-CD1 3.58Å; L150-I313 HydrophobicContact CD2-CB 4.32Å; L150-I313 HydrophobicContact CD2-CD1 4.47Å; L150-I313 HydrophobicContact CD2-CG2 4.37Å; L308-I313 HydrophobicContact CB-CG1 4.36Å; L308-I313 HydrophobicContact CD2-CD1 3.47Å; L308-I313 VanDerWaalsContact CD2-CD1 3.47Å; L308-I313 HydrophobicContact CD2-CG1 3.84Å; L308-I313 WeakPolarHBondContact O-CG1 3.47Å; L308-I313 PolarHBondContact O-N 2.93Å; A311-I313 VanDerWaalsContact C-N 3.28Å; A311-I313 HydrophobicContact CB-CD1 4.25Å; A311-I313 HydrophobicContact CB-CG1 3.92Å; A311-I313 PolarHBondContact O-N 2.62Å; I313-Q315 PolarHBondContact O-N 2.97Å; I313-Q315 VanDerWaalsContact O-N 3.1Å; I313-L316 HydrophobicContact CG2-CD1 4.32Å; I313-L316 WeakPolarHBondContact O-CB 3.39Å; I313-L316 PolarHBondContact O-N 3.37Å; I313-V317 HydrophobicContact CD1-CG1 4.31Å; I313-V317 PolarHBondContact O-N 3.34Å
314	H	95.6	Very high	94.6	Very high	81 Å²	81	52.8 Å²	52.8	38%	0.375	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-23.2	-177.3	66.2	-75.8	0	0	0	115.4	L308 R309	L308-H314 HydrophobicContact CB-CB 4.05Å; L308-H314 PolarHBondContact O-N 2.73Å; R309-H314 HydrophobicContact CG-CB 3.8Å
315	Q	95.1	Very high	93.9	Very high	157 Å²	157	55.6 Å²	55.6	73%	0.734	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-10.7	174.9	-59.9	-60.8	-23.6	0	0	113.4	I313	I313-Q315 PolarHBondContact O-N 2.97Å; I313-Q315 VanDerWaalsContact O-N 3.1Å
316	L	94.9	Very high	93.4	Very high	94 Å²	94	57.9 Å²	57.9	49%	0.492	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-28.9	-174.1	-56.8	-178.8	0	0	0	112.8	L150 I313	L150-L316 HydrophobicContact CD2-CB 4.26Å; I313-L316 HydrophobicContact CG2-CD1 4.32Å; I313-L316 WeakPolarHBondContact O-CB 3.39Å; I313-L316 PolarHBondContact O-N 3.37Å
317	V	95.1	Very high	92.9	Very high	12 Å²	12	58.1 Å²	58.1	7%	0.073	36%	0.362	C	S	.	.			trans	-155.9	147.9	-175.4	65.4	0	0	0	0	109.7	V146 V149 L150 V157 L308 I313	V146-V317 HydrophobicContact CB-CG2 4.49Å; V146-V317 HydrophobicContact CG1-CG1 3.77Å; V146-V317 HydrophobicContact CG1-CG2 4.08Å; V146-V317 HydrophobicContact CG2-CG2 4.4Å; V149-V317 HydrophobicContact CB-CG2 4.16Å; V149-V317 HydrophobicContact CG1-CB 4.37Å; V149-V317 HydrophobicContact CG1-CG2 3.96Å; L150-V317 HydrophobicContact CD1-CG1 4.31Å; L150-V317 HydrophobicContact CD2-CB 4.17Å; L150-V317 HydrophobicContact CD2-CG1 3.59Å; L150-V317 HydrophobicContact CG-CG1 3.97Å; V157-V317 HydrophobicContact CG1-CG2 4.08Å; L308-V317 HydrophobicContact CD2-CG1 4.04Å; I313-V317 HydrophobicContact CD1-CG1 4.31Å; I313-V317 PolarHBondContact O-N 3.34Å
318	S	93.3	Very high	92.5	Very high	86 Å²	86	67.3 Å²	67.3	60%	0.601	40%	0.397	S	S	*	.			trans	-110	149.8	171.4	-69.3	0	0	0	0	110.7
319	Y	94.9	Very high	92.3	Very high	30 Å²	30	71.1 Å²	71.1	12%	0.118	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-71.7	136.4	168.2	-165.7	-96.8	0	0	0	108.9	G139 Q142 W143 V146 L300 A304 I322	G139-Y319 PolarHBondContact O-OH 2.87Å; Q142-Y319 HydrophobicContact CB-CE1 4.17Å; Q142-Y319 HydrophobicContact CB-CE2 3.83Å; Q142-Y319 WeakPolarHBondContact CB-OH 3.4Å; W143-Y319 AromaticContact CD1-CE2 3.78Å; W143-Y319 HydrophobicContact CD2-CD2 4.04Å; W143-Y319 AromaticContact CD2-CE2 3.63Å; W143-Y319 HydrophobicContact CD2-CE2 3.63Å; W143-Y319 AromaticContact CE2-CD2 3.91Å; W143-Y319 AromaticContact CE2-CE2 3.5Å; W143-Y319 VanDerWaalsContact CE2-CE2 3.5Å; W143-Y319 HydrophobicContact CE3-CD2 4.22Å; W143-Y319 HydrophobicContact CE3-CE2 4.25Å; W143-Y319 AromaticContact CG-CE2 3.83Å; W143-Y319 HydrophobicContact CG-CE2 3.83Å; W143-Y319 HydrophobicContact CH2-CD2 4.2Å; W143-Y319 HydrophobicContact CZ2-CD2 4.02Å; W143-Y319 HydrophobicContact CZ2-CE2 4.03Å; W143-Y319 HydrophobicContact CZ3-CD2 4.3Å; W143-Y319 AromaticContact NE1-CE2 3.55Å; V146-Y319 HydrophobicContact CG2-CD2 4.11Å; L300-Y319 HydrophobicContact CD2-CE1 4.2Å; L300-Y319 HydrophobicContact CG-CE1 4.34Å; A304-Y319 HydrophobicContact CB-CD1 3.97Å; A304-Y319 HydrophobicContact CB-CD2 3.89Å; A304-Y319 HydrophobicContact CB-CE2 4.44Å; A304-Y319 HydrophobicContact CB-CG 3.61Å; Y319-I322 HydrophobicContact CD1-CD1 4.17Å; Y319-I322 HydrophobicContact CD1-CG1 4.1Å; Y319-I322 HydrophobicContact CE1-CD1 3.97Å; Y319-I322 HydrophobicContact CE1-CG1 3.86Å
320	P	91.9	Very high	92.1	Very high	15 Å²	15	69.6 Å²	69.6	10%	0.097	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-52.6	145.9	177.4	-26.3	32.8	0	0	0	112.4	Q142 V157 I322	Q142-P320 HydrophobicContact CB-CG 3.99Å; Q142-P320 HydrophobicContact CG-CG 4.36Å; Q142-P320 VanDerWaalsContact OE1-CG 3.3Å; V157-P320 HydrophobicContact CB-CG 4.01Å; V157-P320 HydrophobicContact CG2-CB 4.36Å; V157-P320 HydrophobicContact CG2-CG 3.67Å; P320-I322 PolarHBondContact O-N 2.91Å
321	A	90	Very high	92	Very high	99 Å²	99	73.4 Å²	73.4	82%	0.818	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-54	133.2	176.5	0	0	0	0	0	111	P323	A321-P323 VanDerWaalsContact O-CD 3.3Å; A321-P323 WeakPolarHBondContact O-CD 3.49Å
322	I	90.7	Very high	91.9	Very high	40 Å²	40	77.3 Å²	77.3	21%	0.205	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-93.3	116.3	-178.6	-62.8	172.8	0	0	0	108.3	L300 E301 Y319 P320 I326 T327	L300-I322 HydrophobicContact CB-CD1 4.11Å; L300-I322 HydrophobicContact CD2-CD1 4.01Å; L300-I322 HydrophobicContact CG-CD1 3.77Å; E301-I322 HydrophobicContact CB-CD1 4.04Å; Y319-I322 HydrophobicContact CD1-CD1 4.17Å; Y319-I322 HydrophobicContact CD1-CG1 4.1Å; Y319-I322 HydrophobicContact CE1-CD1 3.97Å; Y319-I322 HydrophobicContact CE1-CG1 3.86Å; P320-I322 PolarHBondContact O-N 2.91Å; I322-I326 HydrophobicContact CG2-CD1 3.87Å; I322-I326 HydrophobicContact CG2-CG1 3.85Å; I322-T327 HydrophobicContact CG2-CG2 3.55Å
323	P	88.1	Confident	91.8	Very high	73 Å²	73	77 Å²	77	47%	0.474	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-55.1	138	174.8	-27.2	30.3	0	0	0	112.7	A321 G325 I326	A321-P323 VanDerWaalsContact O-CD 3.3Å; A321-P323 WeakPolarHBondContact O-CD 3.49Å; P323-G325 PolarHBondContact O-N 3.39Å; P323-I326 HydrophobicContact CB-CD1 4.13Å; P323-I326 HydrophobicContact CB-CG2 3.97Å; P323-I326 HydrophobicContact CG-CD1 4.03Å; P323-I326 WeakPolarHBondContact O-CG1 3.46Å
324	P	85.6	Confident	91.8	Very high	133 Å²	133	76.8 Å²	76.8	86%	0.864	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	139	178.8	-26.7	34.3	0	0	0	112.9	I326	P324-I326 VanDerWaalsContact C-N 3.33Å; P324-I326 PolarHBondContact O-N 3.17Å
325	G	81.4	Confident	91.9	Very high	62 Å²	62	76.2 Å²	76.2	64%	0.639	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	1.4	171.9	0	0	0	0	0	116.4	P323	P323-G325 PolarHBondContact O-N 3.39Å
326	I	85.1	Confident	92	Very high	84 Å²	84	75.7 Å²	75.7	43%	0.431	41%	0.413	S	S	.	.	S	Bend	trans	-84.8	-26.9	179.5	74.6	179.6	0	0	0	113.6	H297 I322 P323 P324	H297-I326 PolarHBondContact CE1-O 3.21Å; I322-I326 HydrophobicContact CG2-CD1 3.87Å; I322-I326 HydrophobicContact CG2-CG1 3.85Å; P323-I326 HydrophobicContact CB-CD1 4.13Å; P323-I326 HydrophobicContact CB-CG2 3.97Å; P323-I326 HydrophobicContact CG-CD1 4.03Å; P323-I326 WeakPolarHBondContact O-CG1 3.46Å; P324-I326 VanDerWaalsContact C-N 3.33Å; P324-I326 PolarHBondContact O-N 3.17Å
327	T	87.9	Confident	92.1	Very high	14 Å²	14	73.8 Å²	73.8	9%	0.086	40%	0.4	C	S	.	.	S	Bend	trans	-87.7	-38.6	-172.8	44.3	0	0	0	0	113.1	H297 E298 L300 I322	H297-T327 PolarHBondContact ND1-O 3Å; H297-T327 WeakPolarHBondContact O-CB 3.42Å; H297-T327 WeakPolarHBondContact O-CG2 3.46Å; E298-T327 VanDerWaalsContact CA-O 3.3Å; E298-T327 WeakPolarHBondContact CA-O 3.4Å; L300-T327 HydrophobicContact CB-CG2 3.9Å; L300-T327 HydrophobicContact CD2-CG2 4.19Å; I322-T327 HydrophobicContact CG2-CG2 3.55Å
328	R	89.3	Confident	92.2	Very high	194 Å²	194	73.5 Å²	73.5	73%	0.732	40%	0.398	S	S	*	.	S	Bend	trans	-61.6	138.2	-173.2	-60.8	-173.1	-179.2	-154.2	-0.5	112.7	N330	R328-N330 PolarHBondContact O-N 2.86Å
329	Y	92.7	Very high	92.4	Very high	87 Å²	87	73.9 Å²	73.9	34%	0.341	40%	0.4	S	S	.	.			trans	-59.9	133.9	169.8	179.5	-102.4	0	0	0	110.5	D199 E202 R331 V334	D199-Y329 HydrophobicContact CB-CD2 3.91Å; D199-Y329 HydrophobicContact CB-CE2 3.97Å; E202-Y329 VanDerWaalsContact CD-CD2 3.49Å; E202-Y329 HydrophobicContact CG-CD2 3.65Å; E202-Y329 HydrophobicContact CG-CE2 3.71Å; Y329-R331 HydrophobicContact CD1-CB 4.49Å; Y329-R331 HydrophobicContact CE1-CB 3.75Å; Y329-R331 HydrophobicContact CE1-CG 4.49Å; Y329-V334 HydrophobicContact CE2-CG2 4.16Å
330	N	93.3	Very high	92.3	Very high	73 Å²	73	76 Å²	76	39%	0.39	43%	0.432	S	S	.	.			trans	-126.6	94.6	-179.4	-175.5	-28.5	0	0	0	110	E202 R328 T332 K333 V334	E202-N330 PolarHBondContact OE1-N 2.52Å; R328-N330 PolarHBondContact O-N 2.86Å; N330-T332 PolarHBondContact O-N 3.28Å; N330-T332 PolarHBondContact OD1-N 3.2Å; N330-K333 HydrophobicContact CB-CB 3.97Å; N330-K333 WeakPolarHBondContact O-CB 3.46Å; N330-K333 PolarHBondContact O-N 2.97Å; N330-K333 WeakPolarHBondContact OD1-CB 3.38Å; N330-K333 PolarHBondContact OD1-N 3.43Å; N330-V334 PolarHBondContact O-N 3.38Å
331	R	95	Very high	92.5	Very high	127 Å²	127	76 Å²	76	48%	0.479	43%	0.43	S	S	.	.	H	α-helix	trans	-57.1	-46.2	178.4	-175.9	173.8	163.5	168.7	-4.8	112.8	Y329 K333 V334 E335 F367	Y329-R331 HydrophobicContact CD1-CB 4.49Å; Y329-R331 HydrophobicContact CE1-CB 3.75Å; Y329-R331 HydrophobicContact CE1-CG 4.49Å; R331-K333 VanDerWaalsContact C-N 3.26Å; R331-K333 PolarHBondContact O-N 3.32Å; R331-V334 CarbonylContact O-C 3.56Å; R331-V334 WeakPolarHBondContact O-CA 3.05Å; R331-V334 WeakPolarHBondContact O-CB 3.31Å; R331-V334 PolarHBondContact O-N 2.94Å; R331-E335 HydrophobicContact CG-CG 4.25Å; R331-E335 IonicContact CZ-OE1 3.67Å; R331-E335 IonicContact NE-OE1 2.81Å; R331-E335 PolarHBondContact NE-OE1 3.48Å; R331-E335 IonicContact NH2-OE1 2.68Å; R331-E335 PolarHBondContact NH2-OE1 3.32Å; R331-E335 PolarHBondContact O-N 3.45Å; R331-F367 HydrophobicContact CG-CE2 4.13Å; R331-F367 HydrophobicContact CG-CZ 4.13Å; R331-F367 VanDerWaalsContact NH2-CB 3.28Å
332	T	95.6	Very high	92.8	Very high	100 Å²	100	73.1 Å²	73.1	61%	0.613	40%	0.404	S	S	*	.	H	α-helix	trans	-59.9	-38.4	-178.3	-51.4	0	0	0	0	111.8	N330 E335 H336	N330-T332 PolarHBondContact O-N 3.28Å; N330-T332 PolarHBondContact OD1-N 3.2Å; T332-E335 PolarHBondContact O-N 2.98Å; T332-H336 VanDerWaalsContact O-CB 3.3Å; T332-H336 WeakPolarHBondContact O-CB 3.19Å; T332-H336 PolarHBondContact O-N 2.76Å
333	K	95.1	Very high	93.1	Very high	50 Å²	50	74.8 Å²	74.8	22%	0.217	41%	0.41	C	S	.	.	H	α-helix	trans	-62.2	-44.7	172.7	175.2	-170.9	70.7	-163.3	0	110.9	E202 N330 R331 H336 Y337	E202-K333 WeakPolarHBondContact OE1-CE 3.08Å; E202-K333 IonicContact OE1-NZ 3.02Å; E202-K333 PolarHBondContact OE1-NZ 3.14Å; E202-K333 IonicContact OE2-NZ 3.37Å; N330-K333 HydrophobicContact CB-CB 3.97Å; N330-K333 WeakPolarHBondContact O-CB 3.46Å; N330-K333 PolarHBondContact O-N 2.97Å; N330-K333 WeakPolarHBondContact OD1-CB 3.38Å; N330-K333 PolarHBondContact OD1-N 3.43Å; R331-K333 VanDerWaalsContact C-N 3.26Å; R331-K333 PolarHBondContact O-N 3.32Å; K333-H336 PolarHBondContact O-N 3.19Å; K333-Y337 HydrophobicContact CG-CD2 4.11Å; K333-Y337 HydrophobicContact CG-CE2 4.24Å; K333-Y337 WeakPolarHBondContact O-CD2 3.36Å; K333-Y337 PolarHBondContact O-N 3.42Å; K333-Y337 VanDerWaalsContact O-N 3.09Å
334	V	97.4	Very high	93.5	Very high	1 Å²	1	77.7 Å²	77.7	1%	0.006	41%	0.412	C	S	.	.	H	α-helix	trans	-61.9	-51.1	177.1	178.6	0	0	0	0	110.5	F201 E202 I205 Y329 N330 R331 H336 Y337 F338 F367 L368	F201-V334 HydrophobicContact CB-CG1 4.49Å; E202-V334 HydrophobicContact CG-CG2 3.73Å; I205-V334 HydrophobicContact CD1-CB 4.35Å; I205-V334 HydrophobicContact CD1-CG2 4.04Å; Y329-V334 HydrophobicContact CE2-CG2 4.16Å; N330-V334 PolarHBondContact O-N 3.38Å; R331-V334 CarbonylContact O-C 3.56Å; R331-V334 WeakPolarHBondContact O-CA 3.05Å; R331-V334 WeakPolarHBondContact O-CB 3.31Å; R331-V334 PolarHBondContact O-N 2.94Å; V334-H336 VanDerWaalsContact C-N 3.28Å; V334-H336 PolarHBondContact O-N 3.05Å; V334-Y337 PolarHBondContact O-N 3.22Å; V334-F338 HydrophobicContact CG1-CD2 3.85Å; V334-F338 HydrophobicContact CG1-CE2 4.12Å; V334-F338 WeakPolarHBondContact O-CD2 3.33Å; V334-F338 PolarHBondContact O-N 3.17Å; V334-F367 HydrophobicContact CB-CZ 4.48Å; V334-F367 HydrophobicContact CG1-CE2 4.19Å; V334-F367 HydrophobicContact CG1-CZ 4.01Å; V334-L368 HydrophobicContact CG1-CD1 3.8Å
335	E	97.3	Very high	94.1	Very high	70 Å²	70	71.8 Å²	71.8	33%	0.327	37%	0.373	S	S	.	.	H	α-helix	trans	-54.7	-43.8	177.1	-71.9	173.7	160.1	0	0	111.9	R331 T332 F338 S339 F367	R331-E335 HydrophobicContact CG-CG 4.25Å; R331-E335 IonicContact CZ-OE1 3.67Å; R331-E335 IonicContact NE-OE1 2.81Å; R331-E335 PolarHBondContact NE-OE1 3.48Å; R331-E335 IonicContact NH2-OE1 2.68Å; R331-E335 PolarHBondContact NH2-OE1 3.32Å; R331-E335 PolarHBondContact O-N 3.45Å; T332-E335 PolarHBondContact O-N 2.98Å; E335-F338 PolarHBondContact O-N 3.03Å; E335-S339 PolarHBondContact O-N 3.46Å; E335-F367 HydrophobicContact CG-CD2 3.55Å; E335-F367 HydrophobicContact CG-CE2 3.47Å; E335-F367 VanDerWaalsContact CG-CE2 3.47Å; E335-F367 WeakPolarHBondContact OE1-CD2 3.33Å
336	H	97.1	Very high	94.9	Very high	145 Å²	145	69 Å²	69	67%	0.671	34%	0.343	S	S	*	.	H	α-helix	trans	-62.2	-47.4	178.2	-178.9	75.8	0	0	0	112.8	T332 K333 V334 F338 S339	T332-H336 VanDerWaalsContact O-CB 3.3Å; T332-H336 WeakPolarHBondContact O-CB 3.19Å; T332-H336 PolarHBondContact O-N 2.76Å; K333-H336 PolarHBondContact O-N 3.19Å; V334-H336 VanDerWaalsContact C-N 3.28Å; V334-H336 PolarHBondContact O-N 3.05Å; H336-F338 VanDerWaalsContact C-N 3.31Å; H336-F338 PolarHBondContact O-N 3.46Å; H336-S339 VanDerWaalsContact O-CB 3.3Å; H336-S339 WeakPolarHBondContact O-CB 3.49Å; H336-S339 PolarHBondContact O-N 2.89Å
337	Y	97.6	Very high	95.5	Very high	55 Å²	55	71.1 Å²	71.1	22%	0.216	35%	0.346	C	S	.	.	H	α-helix	trans	-65.9	-33.5	179.8	-93.1	-84.4	0	0	0	112.8	I205 F208 K209 F250 K333 V334	I205-Y337 HydrophobicContact CD1-CD2 4.09Å; I205-Y337 HydrophobicContact CD1-CG 4.03Å; I205-Y337 HydrophobicContact CG1-CD1 4.38Å; I205-Y337 HydrophobicContact CG1-CD2 4.23Å; I205-Y337 HydrophobicContact CG1-CG 3.93Å; I205-Y337 HydrophobicContact CG2-CD1 4.27Å; I205-Y337 HydrophobicContact CG2-CD2 3.59Å; I205-Y337 HydrophobicContact CG2-CE1 4.22Å; I205-Y337 HydrophobicContact CG2-CE2 3.53Å; I205-Y337 HydrophobicContact CG2-CG 3.98Å; F208-Y337 HydrophobicContact CD1-CE1 4.28Å; F208-Y337 HydrophobicContact CE1-CE1 4.5Å; K209-Y337 HydrophobicContact CD-CE2 4.3Å; K209-Y337 WeakPolarHBondContact CD-OH 3.38Å; K209-Y337 WeakPolarHBondContact CG-OH 3.37Å; F250-Y337 HydrophobicContact CB-CD1 4.07Å; F250-Y337 AromaticContact CD1-CD1 3.97Å; F250-Y337 HydrophobicContact CD1-CD1 3.97Å; F250-Y337 HydrophobicContact CD1-CG 4.49Å; F250-Y337 VanDerWaalsContact CD1-O 3.26Å; F250-Y337 WeakPolarHBondContact CD1-O 3.36Å; F250-Y337 HydrophobicContact CD2-CD1 4.12Å; F250-Y337 HydrophobicContact CE1-CD1 4.44Å; F250-Y337 AromaticContact CG-CD1 3.78Å; F250-Y337 HydrophobicContact CG-CD1 3.78Å; K333-Y337 HydrophobicContact CG-CD2 4.11Å; K333-Y337 HydrophobicContact CG-CE2 4.24Å; K333-Y337 WeakPolarHBondContact O-CD2 3.36Å; K333-Y337 PolarHBondContact O-N 3.42Å; K333-Y337 VanDerWaalsContact O-N 3.09Å; V334-Y337 PolarHBondContact O-N 3.22Å
338	F	98	Very high	96	Very high	6 Å²	6	76.5 Å²	76.5	3%	0.026	37%	0.365	C	S	.	.	H	α-helix	trans	-88.9	-4.1	179.3	-78.3	-88.2	0	0	0	113.9	F201 I205 F250 V254 V334 E335 H336 G340 I341 I346 L349 L368	F201-F338 HydrophobicContact CB-CE2 4.02Å; F201-F338 HydrophobicContact CB-CZ 4.24Å; F201-F338 HydrophobicContact CD1-CZ 4.38Å; F201-F338 HydrophobicContact CD2-CE1 4.32Å; F201-F338 AromaticContact CD2-CE2 3.84Å; F201-F338 HydrophobicContact CD2-CE2 3.84Å; F201-F338 AromaticContact CD2-CZ 3.63Å; F201-F338 HydrophobicContact CD2-CZ 3.63Å; F201-F338 HydrophobicContact CE2-CE1 4.27Å; F201-F338 HydrophobicContact CE2-CZ 4Å; F201-F338 HydrophobicContact CG-CE2 4.06Å; F201-F338 AromaticContact CG-CZ 3.84Å; F201-F338 HydrophobicContact CG-CZ 3.84Å; I205-F338 HydrophobicContact CD1-CE2 4.27Å; F250-F338 HydrophobicContact CE1-CD1 4.32Å; F250-F338 AromaticContact CE1-CD2 3.99Å; F250-F338 HydrophobicContact CE1-CD2 3.99Å; F250-F338 HydrophobicContact CE1-CE1 4.08Å; F250-F338 AromaticContact CE1-CE2 3.73Å; F250-F338 HydrophobicContact CE1-CE2 3.73Å; F250-F338 HydrophobicContact CE1-CG 4.3Å; F250-F338 AromaticContact CE1-CZ 3.79Å; F250-F338 HydrophobicContact CE1-CZ 3.79Å; F250-F338 AromaticContact CZ-CE2 3.93Å; F250-F338 HydrophobicContact CZ-CE2 3.93Å; F250-F338 AromaticContact CZ-CZ 3.93Å; F250-F338 HydrophobicContact CZ-CZ 3.93Å; V254-F338 HydrophobicContact CG2-CE1 3.92Å; V254-F338 HydrophobicContact CG2-CZ 4.41Å; V334-F338 HydrophobicContact CG1-CD2 3.85Å; V334-F338 HydrophobicContact CG1-CE2 4.12Å; V334-F338 WeakPolarHBondContact O-CD2 3.33Å; V334-F338 PolarHBondContact O-N 3.17Å; E335-F338 PolarHBondContact O-N 3.03Å; H336-F338 VanDerWaalsContact C-N 3.31Å; H336-F338 PolarHBondContact O-N 3.46Å; F338-G340 PolarHBondContact O-N 2.96Å; F338-I341 HydrophobicContact CD1-CD1 4.14Å; F338-I341 WeakPolarHBondContact O-CB 3.45Å; F338-I341 PolarHBondContact O-N 3.32Å; F338-I346 HydrophobicContact CB-CD1 4.41Å; F338-I346 HydrophobicContact CD1-CD1 4.05Å; F338-I346 HydrophobicContact CD1-CG1 3.94Å; F338-I346 HydrophobicContact CD1-CG2 4.45Å; F338-I346 HydrophobicContact CE1-CG1 4.47Å; F338-L349 HydrophobicContact CE1-CD2 3.62Å; F338-L349 HydrophobicContact CZ-CD2 3.67Å; F338-L368 HydrophobicContact CB-CD1 4.29Å; F338-L368 HydrophobicContact CB-CD2 3.74Å; F338-L368 HydrophobicContact CD1-CD1 4.36Å; F338-L368 HydrophobicContact CD2-CD1 3.93Å; F338-L368 HydrophobicContact CE2-CD1 4.34Å; F338-L368 HydrophobicContact CG-CD1 3.93Å; F338-L368 HydrophobicContact CG-CD2 4.31Å
339	S	95.9	Very high	96.5	Very high	93 Å²	93	67.3 Å²	67.3	65%	0.65	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	131.3	177.4	-176	0	0	0	0	111.4	E335 H336 I341	E335-S339 PolarHBondContact O-N 3.46Å; H336-S339 VanDerWaalsContact O-CB 3.3Å; H336-S339 WeakPolarHBondContact O-CB 3.49Å; H336-S339 PolarHBondContact O-N 2.89Å; S339-I341 PolarHBondContact O-N 3.16Å
340	G	93.2	Very high	96.7	Very high	76 Å²	76	64.5 Å²	64.5	78%	0.784	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	-8.1	-179.9	0	0	0	0	0	115.5	F338	F338-G340 PolarHBondContact O-N 2.96Å
341	I	96.4	Very high	97	Very high	13 Å²	13	63.4 Å²	63.4	7%	0.067	32%	0.32	C	S	.	.			trans	-76.2	134.8	174.2	-54.3	-173.3	0	0	0	109.5	F250 E251 V254 F338 S339 D345 I346	F250-I341 HydrophobicContact CD1-CD1 3.91Å; F250-I341 HydrophobicContact CE1-CD1 4.31Å; E251-I341 HydrophobicContact CB-CD1 4.1Å; E251-I341 HydrophobicContact CB-CG1 4.01Å; E251-I341 HydrophobicContact CG-CB 4.44Å; E251-I341 HydrophobicContact CG-CD1 4.27Å; E251-I341 HydrophobicContact CG-CG1 3.88Å; E251-I341 HydrophobicContact CG-CG2 4.19Å; V254-I341 HydrophobicContact CB-CD1 4.2Å; V254-I341 HydrophobicContact CG1-CG2 4.07Å; V254-I341 HydrophobicContact CG2-CD1 3.82Å; F338-I341 HydrophobicContact CD1-CD1 4.14Å; F338-I341 WeakPolarHBondContact O-CB 3.45Å; F338-I341 PolarHBondContact O-N 3.32Å; S339-I341 PolarHBondContact O-N 3.16Å; I341-D345 HydrophobicContact CG2-CB 4.09Å; I341-I346 HydrophobicContact CB-CD1 4.27Å; I341-I346 HydrophobicContact CB-CG1 4.2Å; I341-I346 HydrophobicContact CG2-CD1 4.43Å; I341-I346 HydrophobicContact CG2-CG1 3.82Å
342	S	96.1	Very high	97.1	Very high	39 Å²	39	59 Å²	59	27%	0.273	30%	0.304	S	S	.	.			trans	-62.6	139.2	-179.3	79.8	0	0	0	0	112.3	R344 D345 I346	S342-R344 PolarHBondContact O-N 3.38Å; S342-R344 VanDerWaalsContact O-N 3.1Å; S342-D345 PolarHBondContact O-N 3.37Å; S342-D345 PolarHBondContact OG-N 2.86Å; S342-D345 PolarHBondContact OG-OD2 3.32Å; S342-I346 WeakPolarHBondContact O-CG1 3.5Å; S342-I346 PolarHBondContact O-N 3.33Å; S342-I346 VanDerWaalsContact O-N 3.07Å
343	K	96.8	Very high	97.2	Very high	76 Å²	76	54.3 Å²	54.3	33%	0.33	27%	0.274	S	S	.	.	H	α-helix	trans	-54.3	-32.9	177	-63	-70.1	174.8	171	0	112.8	I346 R347 L368 N370	K343-I346 PolarHBondContact O-N 2.62Å; K343-R347 WeakPolarHBondContact O-CB 3.17Å; K343-R347 VanDerWaalsContact O-CG 3.28Å; K343-R347 WeakPolarHBondContact O-CG 3.38Å; K343-R347 PolarHBondContact O-N 2.97Å; K343-L368 WeakPolarHBondContact CD-O 3.34Å; K343-L368 WeakPolarHBondContact CE-O 3.42Å; K343-L368 VanDerWaalsContact NZ-C 3.34Å; K343-L368 PolarHBondContact NZ-O 3.03Å; K343-N370 WeakPolarHBondContact CE-O 3.45Å; K343-N370 PolarHBondContact NZ-O 3.36Å
344	R	96.7	Very high	97.4	Very high	134 Å²	134	54.8 Å²	54.8	51%	0.506	28%	0.278	S	S	.	.	H	α-helix	trans	-60.3	-47.2	174.2	-175.1	-170.3	69.4	-175.7	1.4	111.9	S342 R347 R348	S342-R344 PolarHBondContact O-N 3.38Å; S342-R344 VanDerWaalsContact O-N 3.1Å; R344-R347 PolarHBondContact O-N 3.03Å; R344-R348 WeakPolarHBondContact O-CG 3.24Å; R344-R348 PolarHBondContact O-N 3.43Å; R344-R348 VanDerWaalsContact O-N 3.09Å
345	D	97.8	Very high	97.4	Very high	8 Å²	8	54.9 Å²	54.9	4%	0.043	28%	0.279	C	S	.	.	H	α-helix	trans	-70.5	-37	-178.3	-60.3	-21.2	0	0	0	110.3	V254 R255 I341 S342 R348 L349	V254-D345 HydrophobicContact CG1-CB 4.41Å; R255-D345 HydrophobicContact CG-CB 4.24Å; R255-D345 WeakPolarHBondContact CG-OD2 3.05Å; R255-D345 IonicContact NE-OD2 3.16Å; R255-D345 PolarHBondContact NE-OD2 3.49Å; R255-D345 VanDerWaalsContact NE-OD2 3.16Å; I341-D345 HydrophobicContact CG2-CB 4.09Å; S342-D345 PolarHBondContact O-N 3.37Å; S342-D345 PolarHBondContact OG-N 2.86Å; S342-D345 PolarHBondContact OG-OD2 3.32Å; D345-R348 PolarHBondContact O-N 3.41Å; D345-L349 PolarHBondContact O-N 2.91Å
346	I	98.4	Very high	97.5	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-63.5	-45.3	173.5	-57.4	178	0	0	0	111.5	F201 F338 I341 S342 K343 R348 L349 Y350 L368 L369	F201-I346 HydrophobicContact CE2-CG2 4.38Å; F338-I346 HydrophobicContact CB-CD1 4.41Å; F338-I346 HydrophobicContact CD1-CD1 4.05Å; F338-I346 HydrophobicContact CD1-CG1 3.94Å; F338-I346 HydrophobicContact CD1-CG2 4.45Å; F338-I346 HydrophobicContact CE1-CG1 4.47Å; I341-I346 HydrophobicContact CB-CD1 4.27Å; I341-I346 HydrophobicContact CB-CG1 4.2Å; I341-I346 HydrophobicContact CG2-CD1 4.43Å; I341-I346 HydrophobicContact CG2-CG1 3.82Å; S342-I346 WeakPolarHBondContact O-CG1 3.5Å; S342-I346 PolarHBondContact O-N 3.33Å; S342-I346 VanDerWaalsContact O-N 3.07Å; K343-I346 PolarHBondContact O-N 2.62Å; I346-R348 VanDerWaalsContact C-N 3.33Å; I346-R348 PolarHBondContact O-N 3.29Å; I346-L349 WeakPolarHBondContact O-CB 3.27Å; I346-L349 PolarHBondContact O-N 3.38Å; I346-Y350 PolarHBondContact O-N 3.4Å; I346-L368 HydrophobicContact CG2-CB 4Å; I346-L369 HydrophobicContact CG2-CD2 3.78Å
347	R	98.4	Very high	97.6	Very high	128 Å²	128	44.7 Å²	44.7	48%	0.483	23%	0.231	S	C	.	.	H	α-helix	trans	-62.7	-39.1	177.8	-75.7	175.9	-168.7	137.2	3.7	112.2	K343 R344 Y350 A351 L369	K343-R347 WeakPolarHBondContact O-CB 3.17Å; K343-R347 VanDerWaalsContact O-CG 3.28Å; K343-R347 WeakPolarHBondContact O-CG 3.38Å; K343-R347 PolarHBondContact O-N 2.97Å; R344-R347 PolarHBondContact O-N 3.03Å; R347-Y350 PolarHBondContact O-N 3.04Å; R347-A351 WeakPolarHBondContact O-CB 3.47Å; R347-A351 PolarHBondContact O-N 3.18Å; R347-L369 HydrophobicContact CG-CD2 3.93Å; R347-L369 PolarHBondContact NE-O 3.13Å; R347-L369 PolarHBondContact NH2-O 3.19Å
348	R	98.2	Very high	97.6	Very high	128 Å²	128	45 Å²	45	48%	0.483	24%	0.235	S	C	.	.	H	α-helix	trans	-64.1	-40.8	173.8	-75.8	175.5	173.7	178	-6.4	112.1	R344 D345 I346 R352	R344-R348 WeakPolarHBondContact O-CG 3.24Å; R344-R348 PolarHBondContact O-N 3.43Å; R344-R348 VanDerWaalsContact O-N 3.09Å; D345-R348 PolarHBondContact O-N 3.41Å; I346-R348 VanDerWaalsContact C-N 3.33Å; I346-R348 PolarHBondContact O-N 3.29Å; R348-R352 PolarHBondContact O-N 3.13Å
349	L	98.6	Very high	97.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62	-48.6	172.8	-175.7	73	0	0	0	111.1	F201 L204 V254 L257 F338 D345 I346 A351 R352 Y353	F201-L349 HydrophobicContact CD1-CD2 4.11Å; F201-L349 HydrophobicContact CE1-CD2 3.6Å; F201-L349 HydrophobicContact CE1-CG 3.8Å; F201-L349 HydrophobicContact CZ-CD2 3.83Å; F201-L349 HydrophobicContact CZ-CG 4.13Å; L204-L349 HydrophobicContact CD1-CD1 3.93Å; L204-L349 HydrophobicContact CD1-CD2 4.02Å; L204-L349 HydrophobicContact CD1-CG 4.29Å; V254-L349 HydrophobicContact CG1-CB 4.19Å; V254-L349 HydrophobicContact CG1-CD2 4.06Å; V254-L349 HydrophobicContact CG2-CD2 4.12Å; L257-L349 HydrophobicContact CB-CD1 3.41Å; L257-L349 VanDerWaalsContact CB-CD1 3.41Å; L257-L349 HydrophobicContact CD1-CD1 3.94Å; L257-L349 HydrophobicContact CG-CD1 4.35Å; F338-L349 HydrophobicContact CE1-CD2 3.62Å; F338-L349 HydrophobicContact CZ-CD2 3.67Å; D345-L349 PolarHBondContact O-N 2.91Å; I346-L349 WeakPolarHBondContact O-CB 3.27Å; I346-L349 PolarHBondContact O-N 3.38Å; L349-A351 VanDerWaalsContact C-N 3.34Å; L349-A351 PolarHBondContact O-N 3.39Å; L349-R352 WeakPolarHBondContact O-CB 3.43Å; L349-R352 PolarHBondContact O-N 2.69Å; L349-R352 VanDerWaalsContact O-N 3.13Å; L349-Y353 HydrophobicContact CD1-CD2 4.03Å; L349-Y353 HydrophobicContact CD1-CE2 3.67Å; L349-Y353 HydrophobicContact CG-CD2 4.24Å; L349-Y353 HydrophobicContact CG-CE2 4.36Å; L349-Y353 WeakPolarHBondContact O-CD2 3.41Å; L349-Y353 PolarHBondContact O-N 2.91Å
350	Y	98.6	Very high	97.8	Very high	29 Å²	29	40.7 Å²	40.7	11%	0.114	20%	0.204	C	C	.	.	H	α-helix	trans	-57.1	-47.1	177.8	174.5	-99.3	0	0	0	111.4	I346 R347 R352 Y353 Q354 F357 T364 P365 L369	I346-Y350 PolarHBondContact O-N 3.4Å; R347-Y350 PolarHBondContact O-N 3.04Å; Y350-R352 PolarHBondContact O-N 3.15Å; Y350-R352 VanDerWaalsContact O-N 3.12Å; Y350-Y353 CarbonylContact O-C 3.41Å; Y350-Y353 PolarHBondContact O-N 3.49Å; Y350-Q354 HydrophobicContact CE1-CB 4.2Å; Y350-Q354 HydrophobicContact CE1-CG 3.98Å; Y350-Q354 WeakPolarHBondContact O-CA 3.28Å; Y350-Q354 PolarHBondContact O-N 3.23Å; Y350-F357 AromaticContact CD2-CD2 3.97Å; Y350-F357 HydrophobicContact CD2-CD2 3.97Å; Y350-F357 AromaticContact CD2-CE2 3.97Å; Y350-F357 HydrophobicContact CD2-CE2 3.97Å; Y350-F357 HydrophobicContact CE2-CB 4.49Å; Y350-F357 AromaticContact CE2-CD2 3.8Å; Y350-F357 HydrophobicContact CE2-CD2 3.8Å; Y350-F357 HydrophobicContact CE2-CE2 4.21Å; Y350-F357 HydrophobicContact CE2-CG 4.1Å; Y350-T364 HydrophobicContact CE2-CG2 3.82Å; Y350-T364 PolarHBondContact OH-OG1 3.3Å; Y350-T364 VanDerWaalsContact OH-OG1 3.06Å; Y350-P365 HydrophobicContact CD2-CG 4.17Å; Y350-L369 HydrophobicContact CD1-CD1 4.3Å; Y350-L369 HydrophobicContact CD2-CD1 4.33Å; Y350-L369 HydrophobicContact CG-CD1 4.16Å; Y350-L369 HydrophobicContact CG-CD2 4.48Å
351	A	97.9	Very high	98	Very high	50 Å²	50	39.4 Å²	39.4	41%	0.413	19%	0.191	S	C	.	.	H	α-helix	trans	-54.4	-35.1	178.5	0	0	0	0	0	112.8	R347 L349	R347-A351 WeakPolarHBondContact O-CB 3.47Å; R347-A351 PolarHBondContact O-N 3.18Å; L349-A351 VanDerWaalsContact C-N 3.34Å; L349-A351 PolarHBondContact O-N 3.39Å
352	R	97.7	Very high	98.1	Very high	35 Å²	35	40 Å²	40	13%	0.132	19%	0.193	C	C	.	.	H	α-helix	trans	-68.6	-39.8	174.7	174.3	175.1	178	167.9	2.2	113.5	L257 R263 R348 L349 Y350	L257-R352 WeakPolarHBondContact O-CD 3.3Å; L257-R352 PolarHBondContact O-NH1 3.25Å; R263-R352 VanDerWaalsContact CZ-NH2 3.31Å; R263-R352 VanDerWaalsContact NH2-CZ 3.27Å; R348-R352 PolarHBondContact O-N 3.13Å; L349-R352 WeakPolarHBondContact O-CB 3.43Å; L349-R352 PolarHBondContact O-N 2.69Å; L349-R352 VanDerWaalsContact O-N 3.13Å; Y350-R352 PolarHBondContact O-N 3.15Å; Y350-R352 VanDerWaalsContact O-N 3.12Å
353	Y	98.4	Very high	98.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-100.6	6.8	-176.5	-65.1	-83	0	0	0	113.2	P200 L204 L257 W277 T279 L349 Y350 G355 D356 F357	P200-Y353 HydrophobicContact CB-CD1 4.5Å; P200-Y353 HydrophobicContact CB-CG 4.45Å; L204-Y353 HydrophobicContact CD1-CD2 4.06Å; L204-Y353 HydrophobicContact CD1-CE2 3.63Å; L204-Y353 HydrophobicContact CD2-CE1 4.32Å; L204-Y353 HydrophobicContact CD2-CE2 4.34Å; L204-Y353 HydrophobicContact CG-CE2 4.47Å; L257-Y353 HydrophobicContact CD1-CE2 4.48Å; W277-Y353 PolarHBondContact O-OH 3.04Å; T279-Y353 HydrophobicContact CG2-CD1 3.96Å; T279-Y353 HydrophobicContact CG2-CE1 4.03Å; L349-Y353 HydrophobicContact CD1-CD2 4.03Å; L349-Y353 HydrophobicContact CD1-CE2 3.67Å; L349-Y353 HydrophobicContact CG-CD2 4.24Å; L349-Y353 HydrophobicContact CG-CE2 4.36Å; L349-Y353 WeakPolarHBondContact O-CD2 3.41Å; L349-Y353 PolarHBondContact O-N 2.91Å; Y350-Y353 CarbonylContact O-C 3.41Å; Y350-Y353 PolarHBondContact O-N 3.49Å; Y353-G355 PolarHBondContact O-N 2.85Å; Y353-D356 WeakPolarHBondContact O-CA 3.16Å; Y353-D356 WeakPolarHBondContact O-CB 3.5Å; Y353-D356 PolarHBondContact O-N 3.42Å; Y353-F357 WeakPolarHBondContact O-CD2 3.13Å; Y353-F357 PolarHBondContact O-N 3.4Å; Y353-F357 VanDerWaalsContact O-N 3.09Å
354	Q	98.3	Very high	98.1	Very high	61 Å²	61	41.2 Å²	41.2	29%	0.285	21%	0.207	S	C	.	.	H	α-helix	trans	-55.4	-41	-178	-178.3	-179.5	9	0	0	111.1	L109 Y350 D356 F357 Q358	L109-Q354 HydrophobicContact CD1-CB 4.15Å; L109-Q354 HydrophobicContact CD1-CG 4.02Å; Y350-Q354 HydrophobicContact CE1-CB 4.2Å; Y350-Q354 HydrophobicContact CE1-CG 3.98Å; Y350-Q354 WeakPolarHBondContact O-CA 3.28Å; Y350-Q354 PolarHBondContact O-N 3.23Å; Q354-D356 VanDerWaalsContact C-N 3.34Å; Q354-D356 PolarHBondContact O-N 2.9Å; Q354-F357 PolarHBondContact O-N 2.95Å; Q354-Q358 HydrophobicContact CG-CG 4.37Å; Q354-Q358 VanDerWaalsContact O-CG 3.27Å; Q354-Q358 WeakPolarHBondContact O-CG 3.5Å; Q354-Q358 PolarHBondContact O-N 3.44Å
355	G	98.3	Very high	98.1	Very high	3 Å²	3	35.1 Å²	35.1	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-56.3	-44.7	173.6	0	0	0	0	0	112.8	Y353 Q358 L359	Y353-G355 PolarHBondContact O-N 2.85Å; G355-Q358 PolarHBondContact O-N 2.99Å; G355-L359 VanDerWaalsContact O-CB 3.28Å; G355-L359 WeakPolarHBondContact O-CB 3.48Å; G355-L359 WeakPolarHBondContact O-CD1 3.14Å; G355-L359 WeakPolarHBondContact O-CG 3.39Å; G355-L359 PolarHBondContact O-N 3.34Å
356	D	98.5	Very high	98	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-40.4	177.8	-72.2	-1.7	0	0	0	111.8	P200 R203 T279 Y280 Y353 Q354 F360	P200-D356 HydrophobicContact CB-CB 4.34Å; P200-D356 HydrophobicContact CG-CB 3.71Å; R203-D356 IonicContact NH2-OD2 3.76Å; R203-D356 PolarHBondContact NH2-OD2 3.41Å; T279-D356 WeakPolarHBondContact CA-OD2 3.4Å; T279-D356 WeakPolarHBondContact CB-OD1 3.31Å; Y280-D356 WeakPolarHBondContact CB-OD1 3.42Å; Y280-D356 HydrophobicContact CD2-CB 3.86Å; Y280-D356 VanDerWaalsContact CD2-OD2 3.32Å; Y280-D356 WeakPolarHBondContact CD2-OD2 3.48Å; Y280-D356 HydrophobicContact CE2-CB 4.49Å; Y280-D356 PolarHBondContact N-OD1 3.43Å; Y280-D356 PolarHBondContact N-OD2 2.95Å; Y353-D356 WeakPolarHBondContact O-CA 3.16Å; Y353-D356 WeakPolarHBondContact O-CB 3.5Å; Y353-D356 PolarHBondContact O-N 3.42Å; Q354-D356 VanDerWaalsContact C-N 3.34Å; Q354-D356 PolarHBondContact O-N 2.9Å; D356-F360 VanDerWaalsContact O-CD2 3.23Å; D356-F360 WeakPolarHBondContact O-CD2 3.16Å
357	F	98.7	Very high	97.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-46.9	175.3	-80.4	-85	0	0	0	111.2	P200 F201 Y350 Y353 Q354 G361 Y362 P363 P365	P200-F357 HydrophobicContact CB-CD2 4.12Å; P200-F357 HydrophobicContact CB-CE2 3.62Å; P200-F357 HydrophobicContact CB-CZ 3.91Å; P200-F357 HydrophobicContact CG-CD1 4.22Å; P200-F357 HydrophobicContact CG-CD2 3.73Å; P200-F357 HydrophobicContact CG-CE1 4.16Å; P200-F357 HydrophobicContact CG-CE2 3.67Å; P200-F357 HydrophobicContact CG-CG 3.99Å; P200-F357 HydrophobicContact CG-CZ 3.89Å; F201-F357 HydrophobicContact CD1-CE2 4.04Å; F201-F357 AromaticContact CD1-CZ 3.99Å; F201-F357 HydrophobicContact CD1-CZ 3.99Å; F201-F357 HydrophobicContact CD2-CZ 4.43Å; F201-F357 AromaticContact CE1-CE2 3.92Å; F201-F357 HydrophobicContact CE1-CE2 3.92Å; F201-F357 HydrophobicContact CE1-CZ 4.21Å; F201-F357 HydrophobicContact CG-CZ 4.12Å; F201-F357 HydrophobicContact CZ-CE2 4.38Å; Y350-F357 AromaticContact CD2-CD2 3.97Å; Y350-F357 HydrophobicContact CD2-CD2 3.97Å; Y350-F357 AromaticContact CD2-CE2 3.97Å; Y350-F357 HydrophobicContact CD2-CE2 3.97Å; Y350-F357 HydrophobicContact CE2-CB 4.49Å; Y350-F357 AromaticContact CE2-CD2 3.8Å; Y350-F357 HydrophobicContact CE2-CD2 3.8Å; Y350-F357 HydrophobicContact CE2-CE2 4.21Å; Y350-F357 HydrophobicContact CE2-CG 4.1Å; Y353-F357 WeakPolarHBondContact O-CD2 3.13Å; Y353-F357 PolarHBondContact O-N 3.4Å; Y353-F357 VanDerWaalsContact O-N 3.09Å; Q354-F357 PolarHBondContact O-N 2.95Å; F357-G361 PolarHBondContact O-N 3.18Å; F357-Y362 PolarHBondContact O-N 3.12Å; F357-P363 WeakPolarHBondContact CD1-O 3.42Å; F357-P365 HydrophobicContact CE1-CG 4.26Å; F357-P365 HydrophobicContact CZ-CG 4.02Å
358	Q	98.6	Very high	97.7	Very high	61 Å²	61	35.9 Å²	35.9	29%	0.285	19%	0.193	S	C	.	.	H	α-helix	trans	-68.1	-49.7	-177.8	-65.7	-65.7	-44.4	0	0	111.8	H96 V100 L106 Q354 G355 F360 G361	H96-Q358 PolarHBondContact NE2-O 2.98Å; V100-Q358 HydrophobicContact CG1-CB 4.23Å; V100-Q358 WeakPolarHBondContact CG2-O 3.26Å; L106-Q358 HydrophobicContact CD1-CB 4.24Å; L106-Q358 HydrophobicContact CD1-CG 4.36Å; Q354-Q358 HydrophobicContact CG-CG 4.37Å; Q354-Q358 VanDerWaalsContact O-CG 3.27Å; Q354-Q358 WeakPolarHBondContact O-CG 3.5Å; Q354-Q358 PolarHBondContact O-N 3.44Å; G355-Q358 PolarHBondContact O-N 2.99Å; Q358-F360 PolarHBondContact O-N 3.12Å; Q358-F360 VanDerWaalsContact O-N 3.14Å; Q358-G361 PolarHBondContact O-N 3.47Å
359	L	98.7	Very high	97.4	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-55.8	-34.5	-175.8	-79.2	165.8	0	0	0	113.5	H96 L97 V100 T110 A281 P286 G355	H96-L359 PolarHBondContact CD2-O 3.28Å; L97-L359 HydrophobicContact CD1-CB 4.3Å; L97-L359 HydrophobicContact CD1-CD2 3.45Å; L97-L359 VanDerWaalsContact CD1-CD2 3.45Å; L97-L359 HydrophobicContact CD1-CG 4.47Å; V100-L359 HydrophobicContact CB-CD2 4.49Å; V100-L359 HydrophobicContact CG1-CD2 3.87Å; V100-L359 HydrophobicContact CG1-CG 4.22Å; T110-L359 HydrophobicContact CG2-CD1 4.07Å; T110-L359 HydrophobicContact CG2-CD2 3.86Å; T110-L359 HydrophobicContact CG2-CG 3.77Å; A281-L359 HydrophobicContact CB-CD1 4.37Å; P286-L359 HydrophobicContact CG-CD1 4.03Å; P286-L359 HydrophobicContact CG-CD2 4.43Å; G355-L359 VanDerWaalsContact O-CB 3.28Å; G355-L359 WeakPolarHBondContact O-CB 3.48Å; G355-L359 WeakPolarHBondContact O-CD1 3.14Å; G355-L359 WeakPolarHBondContact O-CG 3.39Å; G355-L359 PolarHBondContact O-N 3.34Å
360	F	98.6	Very high	96.6	Very high	8 Å²	8	37.6 Å²	37.6	4%	0.035	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	15.1	-171.3	-52.8	-61.4	0	0	0	113.6	L97 F195 V197 Y280 P286 V294 H296 D356 Q358 Y362	L97-F360 HydrophobicContact CD1-CE1 4.4Å; F195-F360 AromaticContact CE2-CE1 3.87Å; F195-F360 HydrophobicContact CE2-CE1 3.87Å; F195-F360 AromaticContact CE2-CZ 3.75Å; F195-F360 HydrophobicContact CE2-CZ 3.75Å; F195-F360 AromaticContact CZ-CE1 3.59Å; F195-F360 HydrophobicContact CZ-CE1 3.59Å; F195-F360 AromaticContact CZ-CZ 3.76Å; F195-F360 HydrophobicContact CZ-CZ 3.76Å; V197-F360 HydrophobicContact CB-CD1 4.44Å; V197-F360 HydrophobicContact CB-CD2 4.2Å; V197-F360 HydrophobicContact CB-CG 4.14Å; V197-F360 HydrophobicContact CG1-CD1 3.88Å; V197-F360 HydrophobicContact CG1-CD2 3.83Å; V197-F360 HydrophobicContact CG1-CE1 3.8Å; V197-F360 HydrophobicContact CG1-CE2 3.79Å; V197-F360 HydrophobicContact CG1-CG 3.9Å; V197-F360 HydrophobicContact CG1-CZ 3.76Å; V197-F360 HydrophobicContact CG2-CB 4.01Å; V197-F360 HydrophobicContact CG2-CD1 4.03Å; V197-F360 HydrophobicContact CG2-CD2 4.41Å; V197-F360 HydrophobicContact CG2-CG 3.86Å; Y280-F360 VanDerWaalsContact CB-CE2 3.49Å; Y280-F360 AromaticContact CD2-CD2 3.85Å; Y280-F360 HydrophobicContact CD2-CD2 3.85Å; Y280-F360 AromaticContact CD2-CE2 3.51Å; Y280-F360 HydrophobicContact CD2-CE2 3.51Å; Y280-F360 HydrophobicContact CD2-CZ 4.5Å; Y280-F360 HydrophobicContact CE2-CD2 4.45Å; Y280-F360 HydrophobicContact CE2-CE2 4.47Å; Y280-F360 HydrophobicContact CG-CD2 4.49Å; Y280-F360 AromaticContact CG-CE2 3.74Å; Y280-F360 HydrophobicContact CG-CE2 3.74Å; Y280-F360 HydrophobicContact CG-CZ 4.36Å; P286-F360 HydrophobicContact CG-CZ 4.21Å; V294-F360 HydrophobicContact CG1-CD1 3.88Å; V294-F360 HydrophobicContact CG1-CE1 3.93Å; H296-F360 PolarHBondContact CE1-O 3.35Å; H296-F360 VanDerWaalsContact CE1-O 3.24Å; D356-F360 VanDerWaalsContact O-CD2 3.23Å; D356-F360 WeakPolarHBondContact O-CD2 3.16Å; Q358-F360 PolarHBondContact O-N 3.12Å; Q358-F360 VanDerWaalsContact O-N 3.14Å; F360-Y362 VanDerWaalsContact C-N 3.26Å; F360-Y362 HydrophobicContact CB-CD2 3.75Å; F360-Y362 HydrophobicContact CB-CE2 3.5Å; F360-Y362 HydrophobicContact CG-CE2 4.41Å; F360-Y362 PolarHBondContact O-N 3.34Å
361	G	98.1	Very high	96.5	Very high	49 Å²	49	38.1 Å²	38.1	51%	0.505	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	26.3	172.6	0	0	0	0	0	114	H96 F357 Q358	H96-G361 PolarHBondContact NE2-N 3.32Å; F357-G361 PolarHBondContact O-N 3.18Å; Q358-G361 PolarHBondContact O-N 3.47Å
362	Y	98.3	Very high	96.4	Very high	24 Å²	24	37.4 Å²	37.4	9%	0.094	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-76.5	136.9	172.7	-68.1	-74.1	0	0	0	109.8	V197 R198 D199 E298 F357 F360	V197-Y362 HydrophobicContact CG2-CE2 4.2Å; V197-Y362 WeakPolarHBondContact CG2-OH 3.2Å; R198-Y362 VanDerWaalsContact C-OH 3.23Å; R198-Y362 WeakPolarHBondContact CA-OH 3.24Å; R198-Y362 PolarHBondContact N-OH 3.18Å; D199-Y362 HydrophobicContact CB-CD1 4.03Å; D199-Y362 HydrophobicContact CB-CE1 4.06Å; D199-Y362 VanDerWaalsContact N-CE1 3.29Å; D199-Y362 VanDerWaalsContact N-CZ 3.27Å; D199-Y362 PolarHBondContact N-OH 3.46Å; E298-Y362 PolarHBondContact OE2-OH 3.32Å; F357-Y362 PolarHBondContact O-N 3.12Å; F360-Y362 VanDerWaalsContact C-N 3.26Å; F360-Y362 HydrophobicContact CB-CD2 3.75Å; F360-Y362 HydrophobicContact CB-CE2 3.5Å; F360-Y362 HydrophobicContact CG-CE2 4.41Å; F360-Y362 PolarHBondContact O-N 3.34Å
363	P	96.8	Very high	96.4	Very high	101 Å²	101	37.6 Å²	37.6	66%	0.656	21%	0.21	S	C	*	.	P	Polyproline II helix	trans	-64.5	141.3	177.6	27.6	-34	0	0	0	110.5	F357	F357-P363 WeakPolarHBondContact CD1-O 3.42Å
364	T	96.8	Very high	96.2	Very high	41 Å²	41	39.8 Å²	39.8	25%	0.252	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-56.6	132.7	169.3	-62.7	0	0	0	0	109.3	Y350 E366 L369	Y350-T364 HydrophobicContact CE2-CG2 3.82Å; Y350-T364 PolarHBondContact OH-OG1 3.3Å; Y350-T364 VanDerWaalsContact OH-OG1 3.06Å; T364-E366 HydrophobicContact CG2-CG 4.29Å; T364-E366 WeakPolarHBondContact CG2-OE1 3.49Å; T364-E366 PolarHBondContact O-N 3.15Å; T364-L369 HydrophobicContact CG2-CD1 3.59Å
365	P	96.2	Very high	96.1	Very high	6 Å²	6	38.4 Å²	38.4	4%	0.039	22%	0.219	C	C	.	.			trans	-79.6	62.5	-175.7	33.2	-36.3	0	0	0	111.4	F201 Y350 F357 F367 L368 L369	F201-P365 HydrophobicContact CD2-CB 4.45Å; F201-P365 HydrophobicContact CD2-CG 4.13Å; F201-P365 HydrophobicContact CE2-CB 4.41Å; F201-P365 HydrophobicContact CE2-CG 3.72Å; F201-P365 HydrophobicContact CZ-CG 4.36Å; Y350-P365 HydrophobicContact CD2-CG 4.17Å; F357-P365 HydrophobicContact CE1-CG 4.26Å; F357-P365 HydrophobicContact CZ-CG 4.02Å; P365-F367 HydrophobicContact CB-CD1 4.38Å; P365-F367 HydrophobicContact CB-CE1 3.82Å; P365-F367 HydrophobicContact CB-CZ 4.26Å; P365-F367 PolarHBondContact O-N 3.42Å; P365-F367 VanDerWaalsContact O-N 3.12Å; P365-L368 HydrophobicContact CB-CD1 4.13Å; P365-L368 HydrophobicContact CB-CG 4.4Å; P365-L368 WeakPolarHBondContact O-CA 3.44Å; P365-L368 WeakPolarHBondContact O-CB 3.34Å; P365-L368 PolarHBondContact O-N 3.46Å; P365-L369 PolarHBondContact O-N 3.44Å
366	E	95.8	Very high	96	Very high	87 Å²	87	40.8 Å²	40.8	41%	0.407	23%	0.231	S	C	.	.	H	α-helix	trans	-53.5	-35.2	-176.1	-71.2	-57.9	150	0	0	113.1	T364 L368 L369 N370	T364-E366 HydrophobicContact CG2-CG 4.29Å; T364-E366 WeakPolarHBondContact CG2-OE1 3.49Å; T364-E366 PolarHBondContact O-N 3.15Å; E366-L368 PolarHBondContact O-N 3.09Å; E366-L368 VanDerWaalsContact O-N 3.13Å; E366-L369 PolarHBondContact O-N 3.47Å; E366-N370 WeakPolarHBondContact O-CB 3.38Å; E366-N370 PolarHBondContact O-N 3.45Å; E366-N370 PolarHBondContact O-ND2 3.49Å; E366-N370 PolarHBondContact OE2-ND2 3.43Å; E366-N370 PolarHBondContact OE2-OD1 2.99Å
367	F	95.3	Very high	95.8	Very high	59 Å²	59	43.6 Å²	43.6	26%	0.259	25%	0.247	S	C	.	.	H	α-helix	trans	-60.5	-21.4	175.5	68.3	-85.5	0	0	0	113.9	R331 V334 E335 P365	R331-F367 HydrophobicContact CG-CE2 4.13Å; R331-F367 HydrophobicContact CG-CZ 4.13Å; R331-F367 VanDerWaalsContact NH2-CB 3.28Å; V334-F367 HydrophobicContact CB-CZ 4.48Å; V334-F367 HydrophobicContact CG1-CE2 4.19Å; V334-F367 HydrophobicContact CG1-CZ 4.01Å; E335-F367 HydrophobicContact CG-CD2 3.55Å; E335-F367 HydrophobicContact CG-CE2 3.47Å; E335-F367 VanDerWaalsContact CG-CE2 3.47Å; E335-F367 WeakPolarHBondContact OE1-CD2 3.33Å; P365-F367 HydrophobicContact CB-CD1 4.38Å; P365-F367 HydrophobicContact CB-CE1 3.82Å; P365-F367 HydrophobicContact CB-CZ 4.26Å; P365-F367 PolarHBondContact O-N 3.42Å; P365-F367 VanDerWaalsContact O-N 3.12Å
368	L	95.8	Very high	95.6	Very high	10 Å²	10	47 Å²	47	5%	0.052	27%	0.266	C	S	.	.	H	α-helix	trans	-96.1	-24.8	172.1	-59.4	179	0	0	0	112.9	F201 V334 F338 K343 I346 P365 E366	F201-L368 HydrophobicContact CD2-CD1 3.62Å; F201-L368 HydrophobicContact CE2-CD1 3.79Å; V334-L368 HydrophobicContact CG1-CD1 3.8Å; F338-L368 HydrophobicContact CB-CD1 4.29Å; F338-L368 HydrophobicContact CB-CD2 3.74Å; F338-L368 HydrophobicContact CD1-CD1 4.36Å; F338-L368 HydrophobicContact CD2-CD1 3.93Å; F338-L368 HydrophobicContact CE2-CD1 4.34Å; F338-L368 HydrophobicContact CG-CD1 3.93Å; F338-L368 HydrophobicContact CG-CD2 4.31Å; K343-L368 WeakPolarHBondContact CD-O 3.34Å; K343-L368 WeakPolarHBondContact CE-O 3.42Å; K343-L368 VanDerWaalsContact NZ-C 3.34Å; K343-L368 PolarHBondContact NZ-O 3.03Å; I346-L368 HydrophobicContact CG2-CB 4Å; P365-L368 HydrophobicContact CB-CD1 4.13Å; P365-L368 HydrophobicContact CB-CG 4.4Å; P365-L368 WeakPolarHBondContact O-CA 3.44Å; P365-L368 WeakPolarHBondContact O-CB 3.34Å; P365-L368 PolarHBondContact O-N 3.46Å; E366-L368 PolarHBondContact O-N 3.09Å; E366-L368 VanDerWaalsContact O-N 3.13Å
369	L	91.9	Very high	95.3	Very high	15 Å²	15	45.8 Å²	45.8	8%	0.079	27%	0.265	C	S	.	.	H	α-helix	trans	-91.5	-27.6	-172.6	-60.1	-179.6	0	0	0	113.6	I346 R347 Y350 T364 P365 E366	I346-L369 HydrophobicContact CG2-CD2 3.78Å; R347-L369 HydrophobicContact CG-CD2 3.93Å; R347-L369 PolarHBondContact NE-O 3.13Å; R347-L369 PolarHBondContact NH2-O 3.19Å; Y350-L369 HydrophobicContact CD1-CD1 4.3Å; Y350-L369 HydrophobicContact CD2-CD1 4.33Å; Y350-L369 HydrophobicContact CG-CD1 4.16Å; Y350-L369 HydrophobicContact CG-CD2 4.48Å; T364-L369 HydrophobicContact CG2-CD1 3.59Å; P365-L369 PolarHBondContact O-N 3.44Å; E366-L369 PolarHBondContact O-N 3.47Å
370	N	81.8	Confident	95	Very high	149 Å²	149	49.9 Å²	49.9	80%	0.797	29%	0.289	S	S	*	.			trans	-78.6	0	179.9	-69.1	-35.3	0	0	0	113.1	K343 E366	K343-N370 WeakPolarHBondContact CE-O 3.45Å; K343-N370 PolarHBondContact NZ-O 3.36Å; E366-N370 WeakPolarHBondContact O-CB 3.38Å; E366-N370 PolarHBondContact O-N 3.45Å; E366-N370 PolarHBondContact O-ND2 3.49Å; E366-N370 PolarHBondContact OE2-ND2 3.43Å; E366-N370 PolarHBondContact OE2-OD1 2.99Å

Retrieved 370 of 370 residues in 268.5 ms (Link to these results)

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